data_3MW2 # _entry.id 3MW2 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3MW2 RCSB RCSB059065 WWPDB D_1000059065 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 3MW3 . unspecified PDB 3MW4 . unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3MW2 _pdbx_database_status.recvd_initial_deposition_date 2010-05-05 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Jin, X.' 1 'Shapiro, L.' 2 # _citation.id primary _citation.title 'Splice Form Dependence of beta-Neurexin/Neuroligin Binding Interactions.' _citation.journal_abbrev Neuron _citation.journal_volume 67 _citation.page_first 61 _citation.page_last 74 _citation.year 2010 _citation.journal_id_ASTM NERNET _citation.country US _citation.journal_id_ISSN 0896-6273 _citation.journal_id_CSD 2038 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 20624592 _citation.pdbx_database_id_DOI 10.1016/j.neuron.2010.06.001 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Koehnke, J.' 1 primary 'Katsamba, P.S.' 2 primary 'Ahlsen, G.' 3 primary 'Bahna, F.' 4 primary 'Vendome, J.' 5 primary 'Honig, B.' 6 primary 'Shapiro, L.' 7 primary 'Jin, X.' 8 # _cell.entry_id 3MW2 _cell.length_a 85.890 _cell.length_b 59.819 _cell.length_c 105.697 _cell.angle_alpha 90.00 _cell.angle_beta 103.86 _cell.angle_gamma 90.00 _cell.Z_PDB 8 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 3MW2 _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 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man Neurexin-1-alpha 22753.578 2 ? ? 'UNP residues 1132 to 1334' ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 4 ? ? ? ? 3 non-polymer man BETA-D-MANNOSE 180.156 2 ? ? ? ? 4 non-polymer syn 'PHOSPHATE ION' 94.971 1 ? ? ? ? 5 water nat water 18.015 148 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'Neurexin I-alpha' # _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 ;GPGSTYIFSKGGGQITYKWPPNDRPSTRADRLAIGFSTVQKEAVLVRVDSSSGLGDYLELHIHQGKIGVKFNVGTDDIAI EESNAIINDGKYHVVRFTRSGGNATLQVDSWPVIERYPAGNNDNERLAIARQRIPYRLGRVVDEWLLDKGRQLTIFNSQA TIIIGGKEQGQPFQGQLSGLYYNGLKVLNMAAENDANIAIVGNVRLV ; _entity_poly.pdbx_seq_one_letter_code_can ;GPGSTYIFSKGGGQITYKWPPNDRPSTRADRLAIGFSTVQKEAVLVRVDSSSGLGDYLELHIHQGKIGVKFNVGTDDIAI EESNAIINDGKYHVVRFTRSGGNATLQVDSWPVIERYPAGNNDNERLAIARQRIPYRLGRVVDEWLLDKGRQLTIFNSQA TIIIGGKEQGQPFQGQLSGLYYNGLKVLNMAAENDANIAIVGNVRLV ; _entity_poly.pdbx_strand_id A,B _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLY n 1 2 PRO n 1 3 GLY n 1 4 SER n 1 5 THR n 1 6 TYR n 1 7 ILE n 1 8 PHE n 1 9 SER n 1 10 LYS n 1 11 GLY n 1 12 GLY n 1 13 GLY n 1 14 GLN n 1 15 ILE n 1 16 THR n 1 17 TYR n 1 18 LYS n 1 19 TRP n 1 20 PRO n 1 21 PRO n 1 22 ASN n 1 23 ASP n 1 24 ARG n 1 25 PRO n 1 26 SER n 1 27 THR n 1 28 ARG n 1 29 ALA n 1 30 ASP n 1 31 ARG n 1 32 LEU n 1 33 ALA n 1 34 ILE n 1 35 GLY n 1 36 PHE n 1 37 SER n 1 38 THR n 1 39 VAL n 1 40 GLN n 1 41 LYS n 1 42 GLU n 1 43 ALA n 1 44 VAL n 1 45 LEU n 1 46 VAL n 1 47 ARG n 1 48 VAL n 1 49 ASP n 1 50 SER n 1 51 SER n 1 52 SER n 1 53 GLY n 1 54 LEU n 1 55 GLY n 1 56 ASP n 1 57 TYR n 1 58 LEU n 1 59 GLU n 1 60 LEU n 1 61 HIS n 1 62 ILE n 1 63 HIS n 1 64 GLN n 1 65 GLY n 1 66 LYS n 1 67 ILE n 1 68 GLY n 1 69 VAL n 1 70 LYS n 1 71 PHE n 1 72 ASN n 1 73 VAL n 1 74 GLY n 1 75 THR n 1 76 ASP n 1 77 ASP n 1 78 ILE n 1 79 ALA n 1 80 ILE n 1 81 GLU n 1 82 GLU n 1 83 SER n 1 84 ASN n 1 85 ALA n 1 86 ILE n 1 87 ILE n 1 88 ASN n 1 89 ASP n 1 90 GLY n 1 91 LYS n 1 92 TYR n 1 93 HIS n 1 94 VAL n 1 95 VAL n 1 96 ARG n 1 97 PHE n 1 98 THR n 1 99 ARG n 1 100 SER n 1 101 GLY n 1 102 GLY n 1 103 ASN n 1 104 ALA n 1 105 THR n 1 106 LEU n 1 107 GLN n 1 108 VAL n 1 109 ASP n 1 110 SER n 1 111 TRP n 1 112 PRO n 1 113 VAL n 1 114 ILE n 1 115 GLU n 1 116 ARG n 1 117 TYR n 1 118 PRO n 1 119 ALA n 1 120 GLY n 1 121 ASN n 1 122 ASN n 1 123 ASP n 1 124 ASN n 1 125 GLU n 1 126 ARG n 1 127 LEU n 1 128 ALA n 1 129 ILE n 1 130 ALA n 1 131 ARG n 1 132 GLN n 1 133 ARG n 1 134 ILE n 1 135 PRO n 1 136 TYR n 1 137 ARG n 1 138 LEU n 1 139 GLY n 1 140 ARG n 1 141 VAL n 1 142 VAL n 1 143 ASP n 1 144 GLU n 1 145 TRP n 1 146 LEU n 1 147 LEU n 1 148 ASP n 1 149 LYS n 1 150 GLY n 1 151 ARG n 1 152 GLN n 1 153 LEU n 1 154 THR n 1 155 ILE n 1 156 PHE n 1 157 ASN n 1 158 SER n 1 159 GLN n 1 160 ALA n 1 161 THR n 1 162 ILE n 1 163 ILE n 1 164 ILE n 1 165 GLY n 1 166 GLY n 1 167 LYS n 1 168 GLU n 1 169 GLN n 1 170 GLY n 1 171 GLN n 1 172 PRO n 1 173 PHE n 1 174 GLN n 1 175 GLY n 1 176 GLN n 1 177 LEU n 1 178 SER n 1 179 GLY n 1 180 LEU n 1 181 TYR n 1 182 TYR n 1 183 ASN n 1 184 GLY n 1 185 LEU n 1 186 LYS n 1 187 VAL n 1 188 LEU n 1 189 ASN n 1 190 MET n 1 191 ALA n 1 192 ALA n 1 193 GLU n 1 194 ASN n 1 195 ASP n 1 196 ALA n 1 197 ASN n 1 198 ILE n 1 199 ALA n 1 200 ILE n 1 201 VAL n 1 202 GLY n 1 203 ASN n 1 204 VAL n 1 205 ARG n 1 206 LEU n 1 207 VAL n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name mouse _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene 'Nrxn1, Kiaa0578' _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Mus musculus' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 10090 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name human _entity_src_gen.pdbx_host_org_scientific_name 'Homo sapiens' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line HEK293 _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code NRX1A_MOUSE _struct_ref.pdbx_db_accession Q9CS84 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;TYIFSKGGGQITYKWPPNDRPSTRADRLAIGFSTVQKEAVLVRVDSSSGLGDYLELHIHQGKIGVKFNVGTDDIAIEESN AIINDGKYHVVRFTRSGGNATLQVDSWPVIERYPAGNNDNERLAIARQRIPYRLGRVVDEWLLDKGRQLTIFNSQATIII GGKEQGQPFQGQLSGLYYNGLKVLNMAAENDANIAIVGNVRLV ; _struct_ref.pdbx_align_begin 1132 _struct_ref.pdbx_db_isoform ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 3MW2 A 5 ? 207 ? Q9CS84 1132 ? 1334 ? 86 288 2 1 3MW2 B 5 ? 207 ? Q9CS84 1132 ? 1334 ? 86 288 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 3MW2 GLY A 1 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 82 1 1 3MW2 PRO A 2 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 83 2 1 3MW2 GLY A 3 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 84 3 1 3MW2 SER A 4 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 85 4 2 3MW2 GLY B 1 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 82 5 2 3MW2 PRO B 2 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 83 6 2 3MW2 GLY B 3 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 84 7 2 3MW2 SER B 4 ? UNP Q9CS84 ? ? 'EXPRESSION TAG' 85 8 # 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 BMA D-saccharide . BETA-D-MANNOSE ? 'C6 H12 O6' 180.156 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PO4 non-polymer . 'PHOSPHATE ION' ? 'O4 P -3' 94.971 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 3MW2 _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.90 _exptl_crystal.density_percent_sol 57.53 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 4.9 _exptl_crystal_grow.pdbx_details '26% PEG1000, 0.2M lithium sulfate, 0.1M phosphate-citrate, pH 4.9, VAPOR DIFFUSION, HANGING DROP, temperature 293K' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp ? _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'MAR CCD 165 mm' _diffrn_detector.pdbx_collection_date 2009-06-12 _diffrn_detector.details 'Si (111) crystal monochromator with vertical focusing mirror' # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'Si 111' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.9795 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'NSLS BEAMLINE X4C' _diffrn_source.pdbx_synchrotron_site NSLS _diffrn_source.pdbx_synchrotron_beamline X4C _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 0.9795 # _reflns.entry_id 3MW2 _reflns.observed_criterion_sigma_I 1 _reflns.observed_criterion_sigma_F 1 _reflns.d_resolution_low 50 _reflns.d_resolution_high 2.7 _reflns.number_obs 14339 _reflns.number_all 18319 _reflns.percent_possible_obs 78.3 _reflns.pdbx_Rmerge_I_obs 0.09 _reflns.pdbx_Rsym_value 0.09 _reflns.pdbx_netI_over_sigmaI 19.7 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 3.6 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _refine.entry_id 3MW2 _refine.ls_number_reflns_obs 13752 _refine.ls_number_reflns_all 14286 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F . _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 20.00 _refine.ls_d_res_high 2.69 _refine.ls_percent_reflns_obs 99.02 _refine.ls_R_factor_obs 0.21016 _refine.ls_R_factor_all 0.21 _refine.ls_R_factor_R_work 0.20580 _refine.ls_R_factor_R_free 0.28724 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.1 _refine.ls_number_reflns_R_free 739 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.934 _refine.correlation_coeff_Fo_to_Fc_free 0.840 _refine.B_iso_mean 35.836 _refine.aniso_B[1][1] 0.64 _refine.aniso_B[2][2] 0.97 _refine.aniso_B[3][3] -2.05 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] -0.91 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_details MASK _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.40 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' _refine.pdbx_starting_model 'PDB ID 3BOD' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R_Free 0.386 _refine.overall_SU_ML 0.300 _refine.overall_SU_B 26.824 _refine.overall_SU_R_Cruickshank_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_overall_phase_error ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_overall_ESU_R ? _refine.pdbx_TLS_residual_ADP_flag 'LIKELY RESIDUAL' _refine.pdbx_diffrn_id 1 _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 3041 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 83 _refine_hist.number_atoms_solvent 148 _refine_hist.number_atoms_total 3272 _refine_hist.d_res_high 2.69 _refine_hist.d_res_low 20.00 # 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 r_bond_refined_d 0.008 0.022 ? 3209 'X-RAY DIFFRACTION' ? r_angle_refined_deg 1.234 1.975 ? 4357 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 6.661 5.000 ? 397 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg 41.204 23.867 ? 150 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg 17.007 15.000 ? 524 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg 15.592 15.000 ? 26 'X-RAY DIFFRACTION' ? r_chiral_restr 0.076 0.200 ? 495 'X-RAY DIFFRACTION' ? r_gen_planes_refined 0.003 0.020 ? 2414 'X-RAY DIFFRACTION' ? r_nbd_refined 0.200 0.200 ? 1235 'X-RAY DIFFRACTION' ? r_nbtor_refined 0.306 0.200 ? 2105 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_refined 0.154 0.200 ? 166 'X-RAY DIFFRACTION' ? r_symmetry_vdw_refined 0.202 0.200 ? 54 'X-RAY DIFFRACTION' ? r_symmetry_hbond_refined 0.196 0.200 ? 5 'X-RAY DIFFRACTION' ? r_mcbond_it 0.407 1.500 ? 1994 'X-RAY DIFFRACTION' ? r_mcangle_it 0.736 2.000 ? 3115 'X-RAY DIFFRACTION' ? r_scbond_it 1.031 3.000 ? 1365 'X-RAY DIFFRACTION' ? r_scangle_it 1.832 4.500 ? 1238 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 2.690 _refine_ls_shell.d_res_low 2.759 _refine_ls_shell.number_reflns_R_work 946 _refine_ls_shell.R_factor_R_work 0.348 _refine_ls_shell.percent_reflns_obs 90.79 _refine_ls_shell.R_factor_R_free 0.461 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 50 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' # _struct.entry_id 3MW2 _struct.title 'Crystal structure of beta-neurexin 1 with the splice insert 4' _struct.pdbx_descriptor Neurexin-1-alpha _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3MW2 _struct_keywords.pdbx_keywords 'CELL ADHESION' _struct_keywords.text 'NEUREXIN, LNS domain, CALCIUM-binding, CELL ADHESION, GLYCOPROTEIN' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 1 ? C N N 2 ? D N N 2 ? E N N 3 ? F N N 4 ? G N N 2 ? H N N 2 ? I N N 3 ? J N N 5 ? K N N 5 ? # _struct_biol.id 1 _struct_biol.details 'The biological unit is a monomer.' # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLY A 166 ? GLY A 170 ? GLY A 247 GLY A 251 5 ? 5 HELX_P HELX_P2 2 LYS A 186 ? GLU A 193 ? LYS A 267 GLU A 274 1 ? 8 HELX_P HELX_P3 3 PRO B 20 ? ARG B 24 ? PRO B 101 ARG B 105 5 ? 5 HELX_P HELX_P4 4 GLY B 166 ? GLY B 170 ? GLY B 247 GLY B 251 5 ? 5 HELX_P HELX_P5 5 VAL B 187 ? GLU B 193 ? VAL B 268 GLU B 274 1 ? 7 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order covale1 covale ? ? C NAG . C1 ? ? ? 1_555 A ASN 103 ND2 ? ? A NAG 291 A ASN 184 1_555 ? ? ? ? ? ? ? 1.442 ? covale2 covale ? ? G NAG . C1 ? ? ? 1_555 B ASN 103 ND2 ? ? B NAG 291 B ASN 184 1_555 ? ? ? ? ? ? ? 1.446 ? covale3 covale ? ? C NAG . O6 ? ? ? 1_555 E BMA . C1 ? ? A NAG 291 A BMA 293 1_555 ? ? ? ? ? ? ? 1.433 ? covale4 covale ? ? G NAG . O6 ? ? ? 1_555 I BMA . C1 ? ? B NAG 291 B BMA 293 1_555 ? ? ? ? ? ? ? 1.436 ? covale5 covale ? ? G NAG . O4 ? ? ? 1_555 H NAG . C1 ? ? B NAG 291 B NAG 292 1_555 ? ? ? ? ? ? ? 1.441 ? covale6 covale ? ? C NAG . O4 ? ? ? 1_555 D NAG . C1 ? ? A NAG 291 A NAG 292 1_555 ? ? ? ? ? ? ? 1.450 ? # _struct_conn_type.id covale _struct_conn_type.criteria ? _struct_conn_type.reference ? # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG A 291' AC2 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 292' AC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE BMA A 293' AC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE PO4 A 1' AC5 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG B 291' AC6 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG B 292' AC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE BMA B 293' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 7 SER A 100 ? SER A 181 . ? 1_555 ? 2 AC1 7 ASN A 103 ? ASN A 184 . ? 1_555 ? 3 AC1 7 TRP A 145 ? TRP A 226 . ? 1_555 ? 4 AC1 7 LEU A 147 ? LEU A 228 . ? 1_555 ? 5 AC1 7 NAG D . ? NAG A 292 . ? 1_555 ? 6 AC1 7 BMA E . ? BMA A 293 . ? 1_555 ? 7 AC1 7 HOH J . ? HOH A 319 . ? 1_555 ? 8 AC2 3 HOH J . ? HOH A 35 . ? 1_555 ? 9 AC2 3 NAG C . ? NAG A 291 . ? 1_555 ? 10 AC2 3 HOH J . ? HOH A 319 . ? 1_555 ? 11 AC3 2 TRP A 145 ? TRP A 226 . ? 1_555 ? 12 AC3 2 NAG C . ? NAG A 291 . ? 1_555 ? 13 AC4 4 LYS A 10 ? LYS A 91 . ? 4_545 ? 14 AC4 4 ARG A 24 ? ARG A 105 . ? 1_555 ? 15 AC4 4 SER A 51 ? SER A 132 . ? 1_555 ? 16 AC4 4 SER A 52 ? SER A 133 . ? 1_555 ? 17 AC5 7 ASN B 22 ? ASN B 103 . ? 2_656 ? 18 AC5 7 SER B 100 ? SER B 181 . ? 1_555 ? 19 AC5 7 GLY B 101 ? GLY B 182 . ? 1_555 ? 20 AC5 7 ASN B 103 ? ASN B 184 . ? 1_555 ? 21 AC5 7 TRP B 145 ? TRP B 226 . ? 1_555 ? 22 AC5 7 NAG H . ? NAG B 292 . ? 1_555 ? 23 AC5 7 BMA I . ? BMA B 293 . ? 1_555 ? 24 AC6 3 HOH K . ? HOH B 13 . ? 1_555 ? 25 AC6 3 ASN B 22 ? ASN B 103 . ? 2_656 ? 26 AC6 3 NAG G . ? NAG B 291 . ? 1_555 ? 27 AC7 3 VAL A 141 ? VAL A 222 . ? 1_555 ? 28 AC7 3 TRP B 145 ? TRP B 226 . ? 1_555 ? 29 AC7 3 NAG G . ? NAG B 291 . ? 1_555 ? # _database_PDB_matrix.entry_id 3MW2 _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 3MW2 _atom_sites.fract_transf_matrix[1][1] 0.011643 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.002873 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.016717 _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] 0.009745 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O P S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . GLY A 1 3 ? 40.027 2.413 10.790 1.00 41.53 ? 84 GLY A N 1 ATOM 2 C CA . GLY A 1 3 ? 41.201 3.010 10.073 1.00 41.04 ? 84 GLY A CA 1 ATOM 3 C C . GLY A 1 3 ? 40.758 4.124 9.139 1.00 40.63 ? 84 GLY A C 1 ATOM 4 O O . GLY A 1 3 ? 41.146 5.298 9.318 1.00 40.37 ? 84 GLY A O 1 ATOM 5 N N . SER A 1 4 ? 39.947 3.743 8.145 1.00 39.89 ? 85 SER A N 1 ATOM 6 C CA . SER A 1 4 ? 39.291 4.690 7.238 1.00 39.13 ? 85 SER A CA 1 ATOM 7 C C . SER A 1 4 ? 38.160 5.413 7.954 1.00 38.25 ? 85 SER A C 1 ATOM 8 O O . SER A 1 4 ? 37.166 4.792 8.344 1.00 38.10 ? 85 SER A O 1 ATOM 9 C CB . SER A 1 4 ? 38.742 3.969 6.013 1.00 39.27 ? 85 SER A CB 1 ATOM 10 O OG . SER A 1 4 ? 39.789 3.617 5.128 1.00 40.52 ? 85 SER A OG 1 ATOM 11 N N . THR A 1 5 ? 38.323 6.721 8.138 1.00 37.07 ? 86 THR A N 1 ATOM 12 C CA . THR A 1 5 ? 37.351 7.506 8.874 1.00 36.18 ? 86 THR A CA 1 ATOM 13 C C . THR A 1 5 ? 36.682 8.494 7.937 1.00 35.75 ? 86 THR A C 1 ATOM 14 O O . THR A 1 5 ? 37.340 9.197 7.168 1.00 35.40 ? 86 THR A O 1 ATOM 15 C CB . THR A 1 5 ? 37.989 8.255 10.069 1.00 36.29 ? 86 THR A CB 1 ATOM 16 O OG1 . THR A 1 5 ? 38.846 7.370 10.801 1.00 36.38 ? 86 THR A OG1 1 ATOM 17 C CG2 . THR A 1 5 ? 36.920 8.790 11.013 1.00 36.14 ? 86 THR A CG2 1 ATOM 18 N N . TYR A 1 6 ? 35.358 8.524 7.999 1.00 35.39 ? 87 TYR A N 1 ATOM 19 C CA . TYR A 1 6 ? 34.579 9.479 7.231 1.00 34.74 ? 87 TYR A CA 1 ATOM 20 C C . TYR A 1 6 ? 33.873 10.460 8.150 1.00 34.62 ? 87 TYR A C 1 ATOM 21 O O . TYR A 1 6 ? 33.268 10.058 9.147 1.00 34.68 ? 87 TYR A O 1 ATOM 22 C CB . TYR A 1 6 ? 33.567 8.744 6.365 1.00 34.22 ? 87 TYR A CB 1 ATOM 23 C CG . TYR A 1 6 ? 34.162 8.200 5.096 1.00 33.93 ? 87 TYR A CG 1 ATOM 24 C CD1 . TYR A 1 6 ? 34.647 6.890 5.029 1.00 33.59 ? 87 TYR A CD1 1 ATOM 25 C CD2 . TYR A 1 6 ? 34.256 8.997 3.956 1.00 33.74 ? 87 TYR A CD2 1 ATOM 26 C CE1 . TYR A 1 6 ? 35.190 6.382 3.848 1.00 32.41 ? 87 TYR A CE1 1 ATOM 27 C CE2 . TYR A 1 6 ? 34.803 8.502 2.779 1.00 33.26 ? 87 TYR A CE2 1 ATOM 28 C CZ . TYR A 1 6 ? 35.264 7.196 2.736 1.00 33.03 ? 87 TYR A CZ 1 ATOM 29 O OH . TYR A 1 6 ? 35.800 6.719 1.570 1.00 33.79 ? 87 TYR A OH 1 ATOM 30 N N . ILE A 1 7 ? 33.954 11.745 7.812 1.00 34.28 ? 88 ILE A N 1 ATOM 31 C CA . ILE A 1 7 ? 33.234 12.773 8.558 1.00 34.08 ? 88 ILE A CA 1 ATOM 32 C C . ILE A 1 7 ? 31.913 13.072 7.870 1.00 33.73 ? 88 ILE A C 1 ATOM 33 O O . ILE A 1 7 ? 31.886 13.438 6.689 1.00 33.79 ? 88 ILE A O 1 ATOM 34 C CB . ILE A 1 7 ? 34.053 14.091 8.691 1.00 34.33 ? 88 ILE A CB 1 ATOM 35 C CG1 . ILE A 1 7 ? 35.537 13.799 8.923 1.00 34.82 ? 88 ILE A CG1 1 ATOM 36 C CG2 . ILE A 1 7 ? 33.488 15.001 9.806 1.00 33.99 ? 88 ILE A CG2 1 ATOM 37 C CD1 . ILE A 1 7 ? 35.816 12.880 10.112 1.00 36.37 ? 88 ILE A CD1 1 ATOM 38 N N . PHE A 1 8 ? 30.816 12.916 8.604 1.00 33.19 ? 89 PHE A N 1 ATOM 39 C CA . PHE A 1 8 ? 29.506 13.325 8.095 1.00 32.79 ? 89 PHE A CA 1 ATOM 40 C C . PHE A 1 8 ? 29.207 14.729 8.602 1.00 32.60 ? 89 PHE A C 1 ATOM 41 O O . PHE A 1 8 ? 28.914 14.904 9.783 1.00 32.73 ? 89 PHE A O 1 ATOM 42 C CB . PHE A 1 8 ? 28.424 12.337 8.532 1.00 32.59 ? 89 PHE A CB 1 ATOM 43 C CG . PHE A 1 8 ? 28.501 11.002 7.840 1.00 32.17 ? 89 PHE A CG 1 ATOM 44 C CD1 . PHE A 1 8 ? 27.489 10.595 6.986 1.00 31.59 ? 89 PHE A CD1 1 ATOM 45 C CD2 . PHE A 1 8 ? 29.583 10.147 8.050 1.00 32.51 ? 89 PHE A CD2 1 ATOM 46 C CE1 . PHE A 1 8 ? 27.550 9.357 6.342 1.00 31.42 ? 89 PHE A CE1 1 ATOM 47 C CE2 . PHE A 1 8 ? 29.651 8.910 7.410 1.00 32.00 ? 89 PHE A CE2 1 ATOM 48 C CZ . PHE A 1 8 ? 28.626 8.514 6.557 1.00 31.54 ? 89 PHE A CZ 1 ATOM 49 N N . SER A 1 9 ? 29.318 15.722 7.716 1.00 32.29 ? 90 SER A N 1 ATOM 50 C CA . SER A 1 9 ? 29.156 17.137 8.085 1.00 32.30 ? 90 SER A CA 1 ATOM 51 C C . SER A 1 9 ? 27.699 17.618 8.044 1.00 32.33 ? 90 SER A C 1 ATOM 52 O O . SER A 1 9 ? 26.771 16.821 7.855 1.00 32.67 ? 90 SER A O 1 ATOM 53 C CB . SER A 1 9 ? 29.996 18.039 7.174 1.00 32.10 ? 90 SER A CB 1 ATOM 54 O OG . SER A 1 9 ? 31.356 17.664 7.151 1.00 32.92 ? 90 SER A OG 1 ATOM 55 N N . LYS A 1 10 ? 27.511 18.929 8.194 1.00 32.15 ? 91 LYS A N 1 ATOM 56 C CA . LYS A 1 10 ? 26.185 19.525 8.238 1.00 32.16 ? 91 LYS A CA 1 ATOM 57 C C . LYS A 1 10 ? 25.384 19.127 7.006 1.00 32.44 ? 91 LYS A C 1 ATOM 58 O O . LYS A 1 10 ? 25.848 19.265 5.871 1.00 32.49 ? 91 LYS A O 1 ATOM 59 C CB . LYS A 1 10 ? 26.272 21.053 8.356 1.00 31.97 ? 91 LYS A CB 1 ATOM 60 C CG . LYS A 1 10 ? 25.004 21.735 8.868 1.00 31.44 ? 91 LYS A CG 1 ATOM 61 C CD . LYS A 1 10 ? 25.247 23.224 9.088 1.00 32.22 ? 91 LYS A CD 1 ATOM 62 C CE . LYS A 1 10 ? 24.201 23.866 10.001 1.00 32.67 ? 91 LYS A CE 1 ATOM 63 N NZ . LYS A 1 10 ? 24.298 25.362 10.012 1.00 32.18 ? 91 LYS A NZ 1 ATOM 64 N N . GLY A 1 11 ? 24.186 18.610 7.252 1.00 32.59 ? 92 GLY A N 1 ATOM 65 C CA . GLY A 1 11 ? 23.260 18.265 6.195 1.00 32.87 ? 92 GLY A CA 1 ATOM 66 C C . GLY A 1 11 ? 23.201 16.774 6.003 1.00 33.19 ? 92 GLY A C 1 ATOM 67 O O . GLY A 1 11 ? 22.278 16.266 5.370 1.00 33.77 ? 92 GLY A O 1 ATOM 68 N N . GLY A 1 12 ? 24.194 16.070 6.538 1.00 33.11 ? 93 GLY A N 1 ATOM 69 C CA . GLY A 1 12 ? 24.253 14.626 6.414 1.00 33.04 ? 93 GLY A CA 1 ATOM 70 C C . GLY A 1 12 ? 24.719 14.133 5.058 1.00 33.32 ? 93 GLY A C 1 ATOM 71 O O . GLY A 1 12 ? 24.938 14.909 4.125 1.00 33.10 ? 93 GLY A O 1 ATOM 72 N N . GLY A 1 13 ? 24.874 12.820 4.952 1.00 33.65 ? 94 GLY A N 1 ATOM 73 C CA . GLY A 1 13 ? 25.352 12.206 3.730 1.00 34.04 ? 94 GLY A CA 1 ATOM 74 C C . GLY A 1 13 ? 25.081 10.728 3.756 1.00 34.31 ? 94 GLY A C 1 ATOM 75 O O . GLY A 1 13 ? 24.423 10.238 4.672 1.00 35.06 ? 94 GLY A O 1 ATOM 76 N N . GLN A 1 14 ? 25.594 10.006 2.769 1.00 34.32 ? 95 GLN A N 1 ATOM 77 C CA . GLN A 1 14 ? 25.284 8.594 2.655 1.00 34.61 ? 95 GLN A CA 1 ATOM 78 C C . GLN A 1 14 ? 26.350 7.815 1.893 1.00 34.42 ? 95 GLN A C 1 ATOM 79 O O . GLN A 1 14 ? 26.760 8.212 0.798 1.00 34.67 ? 95 GLN A O 1 ATOM 80 C CB . GLN A 1 14 ? 23.929 8.442 1.970 1.00 35.00 ? 95 GLN A CB 1 ATOM 81 C CG . GLN A 1 14 ? 23.462 7.004 1.777 1.00 36.96 ? 95 GLN A CG 1 ATOM 82 C CD . GLN A 1 14 ? 21.981 6.937 1.494 1.00 38.23 ? 95 GLN A CD 1 ATOM 83 O OE1 . GLN A 1 14 ? 21.194 7.643 2.121 1.00 38.84 ? 95 GLN A OE1 1 ATOM 84 N NE2 . GLN A 1 14 ? 21.590 6.086 0.547 1.00 38.63 ? 95 GLN A NE2 1 ATOM 85 N N . ILE A 1 15 ? 26.799 6.713 2.483 1.00 33.92 ? 96 ILE A N 1 ATOM 86 C CA . ILE A 1 15 ? 27.656 5.759 1.787 1.00 33.37 ? 96 ILE A CA 1 ATOM 87 C C . ILE A 1 15 ? 26.874 4.465 1.620 1.00 33.47 ? 96 ILE A C 1 ATOM 88 O O . ILE A 1 15 ? 26.439 3.856 2.608 1.00 33.49 ? 96 ILE A O 1 ATOM 89 C CB . ILE A 1 15 ? 28.970 5.484 2.541 1.00 33.25 ? 96 ILE A CB 1 ATOM 90 C CG1 . ILE A 1 15 ? 29.725 6.793 2.790 1.00 32.77 ? 96 ILE A CG1 1 ATOM 91 C CG2 . ILE A 1 15 ? 29.826 4.473 1.769 1.00 32.03 ? 96 ILE A CG2 1 ATOM 92 C CD1 . ILE A 1 15 ? 30.806 6.705 3.851 1.00 31.52 ? 96 ILE A CD1 1 ATOM 93 N N . THR A 1 16 ? 26.683 4.066 0.369 1.00 33.10 ? 97 THR A N 1 ATOM 94 C CA . THR A 1 16 ? 25.908 2.884 0.049 1.00 33.21 ? 97 THR A CA 1 ATOM 95 C C . THR A 1 16 ? 26.794 1.809 -0.579 1.00 33.44 ? 97 THR A C 1 ATOM 96 O O . THR A 1 16 ? 27.570 2.084 -1.500 1.00 33.34 ? 97 THR A O 1 ATOM 97 C CB . THR A 1 16 ? 24.755 3.230 -0.903 1.00 33.16 ? 97 THR A CB 1 ATOM 98 O OG1 . THR A 1 16 ? 23.841 4.109 -0.238 1.00 32.97 ? 97 THR A OG1 1 ATOM 99 C CG2 . THR A 1 16 ? 24.010 1.979 -1.338 1.00 33.44 ? 97 THR A CG2 1 ATOM 100 N N . TYR A 1 17 ? 26.687 0.594 -0.050 1.00 33.40 ? 98 TYR A N 1 ATOM 101 C CA . TYR A 1 17 ? 27.302 -0.570 -0.660 1.00 33.58 ? 98 TYR A CA 1 ATOM 102 C C . TYR A 1 17 ? 26.214 -1.452 -1.224 1.00 33.41 ? 98 TYR A C 1 ATOM 103 O O . TYR A 1 17 ? 25.275 -1.806 -0.520 1.00 33.63 ? 98 TYR A O 1 ATOM 104 C CB . TYR A 1 17 ? 28.121 -1.371 0.355 1.00 33.80 ? 98 TYR A CB 1 ATOM 105 C CG . TYR A 1 17 ? 28.715 -2.627 -0.235 1.00 34.17 ? 98 TYR A CG 1 ATOM 106 C CD1 . TYR A 1 17 ? 29.999 -2.620 -0.765 1.00 34.32 ? 98 TYR A CD1 1 ATOM 107 C CD2 . TYR A 1 17 ? 27.992 -3.822 -0.279 1.00 35.19 ? 98 TYR A CD2 1 ATOM 108 C CE1 . TYR A 1 17 ? 30.557 -3.754 -1.317 1.00 34.20 ? 98 TYR A CE1 1 ATOM 109 C CE2 . TYR A 1 17 ? 28.548 -4.978 -0.839 1.00 34.98 ? 98 TYR A CE2 1 ATOM 110 C CZ . TYR A 1 17 ? 29.835 -4.928 -1.355 1.00 34.69 ? 98 TYR A CZ 1 ATOM 111 O OH . TYR A 1 17 ? 30.423 -6.049 -1.916 1.00 35.31 ? 98 TYR A OH 1 ATOM 112 N N . LYS A 1 18 ? 26.343 -1.813 -2.490 1.00 33.49 ? 99 LYS A N 1 ATOM 113 C CA . LYS A 1 18 ? 25.385 -2.715 -3.118 1.00 33.68 ? 99 LYS A CA 1 ATOM 114 C C . LYS A 1 18 ? 26.077 -4.004 -3.484 1.00 33.49 ? 99 LYS A C 1 ATOM 115 O O . LYS A 1 18 ? 27.016 -4.014 -4.281 1.00 33.57 ? 99 LYS A O 1 ATOM 116 C CB . LYS A 1 18 ? 24.772 -2.092 -4.372 1.00 33.91 ? 99 LYS A CB 1 ATOM 117 C CG . LYS A 1 18 ? 23.698 -1.074 -4.109 1.00 34.64 ? 99 LYS A CG 1 ATOM 118 C CD . LYS A 1 18 ? 23.125 -0.594 -5.429 1.00 37.99 ? 99 LYS A CD 1 ATOM 119 C CE . LYS A 1 18 ? 21.885 0.291 -5.231 1.00 39.78 ? 99 LYS A CE 1 ATOM 120 N NZ . LYS A 1 18 ? 21.401 0.850 -6.535 1.00 40.96 ? 99 LYS A NZ 1 ATOM 121 N N . TRP A 1 19 ? 25.624 -5.095 -2.883 1.00 33.58 ? 100 TRP A N 1 ATOM 122 C CA . TRP A 1 19 ? 26.095 -6.415 -3.270 1.00 33.44 ? 100 TRP A CA 1 ATOM 123 C C . TRP A 1 19 ? 25.804 -6.626 -4.746 1.00 34.05 ? 100 TRP A C 1 ATOM 124 O O . TRP A 1 19 ? 24.734 -6.224 -5.228 1.00 34.19 ? 100 TRP A O 1 ATOM 125 C CB . TRP A 1 19 ? 25.385 -7.487 -2.468 1.00 32.36 ? 100 TRP A CB 1 ATOM 126 C CG . TRP A 1 19 ? 25.997 -7.746 -1.146 1.00 31.55 ? 100 TRP A CG 1 ATOM 127 C CD1 . TRP A 1 19 ? 27.083 -8.534 -0.883 1.00 30.21 ? 100 TRP A CD1 1 ATOM 128 C CD2 . TRP A 1 19 ? 25.554 -7.237 0.112 1.00 30.28 ? 100 TRP A CD2 1 ATOM 129 N NE1 . TRP A 1 19 ? 27.347 -8.538 0.462 1.00 29.78 ? 100 TRP A NE1 1 ATOM 130 C CE2 . TRP A 1 19 ? 26.423 -7.754 1.100 1.00 29.56 ? 100 TRP A CE2 1 ATOM 131 C CE3 . TRP A 1 19 ? 24.503 -6.399 0.502 1.00 29.19 ? 100 TRP A CE3 1 ATOM 132 C CZ2 . TRP A 1 19 ? 26.276 -7.461 2.450 1.00 29.31 ? 100 TRP A CZ2 1 ATOM 133 C CZ3 . TRP A 1 19 ? 24.352 -6.113 1.841 1.00 30.41 ? 100 TRP A CZ3 1 ATOM 134 C CH2 . TRP A 1 19 ? 25.236 -6.650 2.805 1.00 30.49 ? 100 TRP A CH2 1 ATOM 135 N N . PRO A 1 20 ? 26.757 -7.232 -5.476 1.00 34.59 ? 101 PRO A N 1 ATOM 136 C CA . PRO A 1 20 ? 26.460 -7.579 -6.863 1.00 34.94 ? 101 PRO A CA 1 ATOM 137 C C . PRO A 1 20 ? 25.141 -8.341 -6.871 1.00 35.27 ? 101 PRO A C 1 ATOM 138 O O . PRO A 1 20 ? 24.965 -9.251 -6.057 1.00 35.23 ? 101 PRO A O 1 ATOM 139 C CB . PRO A 1 20 ? 27.617 -8.501 -7.253 1.00 34.96 ? 101 PRO A CB 1 ATOM 140 C CG . PRO A 1 20 ? 28.745 -8.086 -6.364 1.00 35.00 ? 101 PRO A CG 1 ATOM 141 C CD . PRO A 1 20 ? 28.119 -7.632 -5.071 1.00 34.63 ? 101 PRO A CD 1 ATOM 142 N N . PRO A 1 21 ? 24.208 -7.957 -7.761 1.00 35.59 ? 102 PRO A N 1 ATOM 143 C CA . PRO A 1 21 ? 22.824 -8.428 -7.684 1.00 35.82 ? 102 PRO A CA 1 ATOM 144 C C . PRO A 1 21 ? 22.708 -9.933 -7.588 1.00 36.03 ? 102 PRO A C 1 ATOM 145 O O . PRO A 1 21 ? 21.607 -10.453 -7.456 1.00 36.67 ? 102 PRO A O 1 ATOM 146 C CB . PRO A 1 21 ? 22.127 -7.617 -8.777 1.00 35.99 ? 102 PRO A CB 1 ATOM 147 C CG . PRO A 1 21 ? 23.204 -7.334 -9.771 1.00 35.95 ? 102 PRO A CG 1 ATOM 148 C CD . PRO A 1 21 ? 24.421 -7.074 -8.922 1.00 35.63 ? 102 PRO A CD 1 ATOM 149 N N . ASN A 1 22 ? 23.849 -10.614 -7.623 1.00 36.08 ? 103 ASN A N 1 ATOM 150 C CA . ASN A 1 22 ? 23.931 -12.042 -7.888 1.00 36.14 ? 103 ASN A CA 1 ATOM 151 C C . ASN A 1 22 ? 24.665 -12.773 -6.763 1.00 35.92 ? 103 ASN A C 1 ATOM 152 O O . ASN A 1 22 ? 24.703 -14.000 -6.712 1.00 35.82 ? 103 ASN A O 1 ATOM 153 C CB . ASN A 1 22 ? 24.803 -11.961 -9.144 1.00 36.34 ? 103 ASN A CB 1 ATOM 154 C CG . ASN A 1 22 ? 24.832 -13.248 -9.929 1.00 37.48 ? 103 ASN A CG 1 ATOM 155 O OD1 . ASN A 1 22 ? 25.422 -14.237 -9.496 1.00 39.08 ? 103 ASN A OD1 1 ATOM 156 N ND2 . ASN A 1 22 ? 24.222 -13.235 -11.115 1.00 38.08 ? 103 ASN A ND2 1 ATOM 157 N N . ASP A 1 23 ? 25.248 -11.986 -5.864 1.00 35.66 ? 104 ASP A N 1 ATOM 158 C CA . ASP A 1 23 ? 25.904 -12.475 -4.663 1.00 35.42 ? 104 ASP A CA 1 ATOM 159 C C . ASP A 1 23 ? 25.148 -12.013 -3.417 1.00 34.49 ? 104 ASP A C 1 ATOM 160 O O . ASP A 1 23 ? 25.699 -12.081 -2.329 1.00 34.98 ? 104 ASP A O 1 ATOM 161 C CB . ASP A 1 23 ? 27.349 -11.946 -4.576 1.00 36.05 ? 104 ASP A CB 1 ATOM 162 C CG . ASP A 1 23 ? 28.391 -12.919 -5.150 1.00 38.26 ? 104 ASP A CG 1 ATOM 163 O OD1 . ASP A 1 23 ? 28.121 -14.148 -5.223 1.00 39.67 ? 104 ASP A OD1 1 ATOM 164 O OD2 . ASP A 1 23 ? 29.502 -12.440 -5.513 1.00 39.75 ? 104 ASP A OD2 1 ATOM 165 N N . ARG A 1 24 ? 23.907 -11.541 -3.569 1.00 33.00 ? 105 ARG A N 1 ATOM 166 C CA . ARG A 1 24 ? 23.089 -11.106 -2.422 1.00 31.49 ? 105 ARG A CA 1 ATOM 167 C C . ARG A 1 24 ? 22.952 -12.189 -1.347 1.00 30.94 ? 105 ARG A C 1 ATOM 168 O O . ARG A 1 24 ? 22.195 -13.143 -1.513 1.00 30.84 ? 105 ARG A O 1 ATOM 169 C CB . ARG A 1 24 ? 21.699 -10.629 -2.869 1.00 31.16 ? 105 ARG A CB 1 ATOM 170 C CG . ARG A 1 24 ? 21.677 -9.224 -3.406 1.00 29.27 ? 105 ARG A CG 1 ATOM 171 C CD . ARG A 1 24 ? 20.304 -8.779 -3.845 1.00 26.09 ? 105 ARG A CD 1 ATOM 172 N NE . ARG A 1 24 ? 20.422 -7.471 -4.483 1.00 25.56 ? 105 ARG A NE 1 ATOM 173 C CZ . ARG A 1 24 ? 19.440 -6.814 -5.091 1.00 25.33 ? 105 ARG A CZ 1 ATOM 174 N NH1 . ARG A 1 24 ? 18.214 -7.318 -5.180 1.00 25.36 ? 105 ARG A NH1 1 ATOM 175 N NH2 . ARG A 1 24 ? 19.697 -5.639 -5.630 1.00 26.72 ? 105 ARG A NH2 1 ATOM 176 N N . PRO A 1 25 ? 23.673 -12.028 -0.227 1.00 30.38 ? 106 PRO A N 1 ATOM 177 C CA . PRO A 1 25 ? 23.758 -13.113 0.740 1.00 30.16 ? 106 PRO A CA 1 ATOM 178 C C . PRO A 1 25 ? 22.548 -13.259 1.665 1.00 29.98 ? 106 PRO A C 1 ATOM 179 O O . PRO A 1 25 ? 21.786 -12.316 1.850 1.00 30.03 ? 106 PRO A O 1 ATOM 180 C CB . PRO A 1 25 ? 25.031 -12.784 1.523 1.00 29.88 ? 106 PRO A CB 1 ATOM 181 C CG . PRO A 1 25 ? 25.161 -11.302 1.427 1.00 30.40 ? 106 PRO A CG 1 ATOM 182 C CD . PRO A 1 25 ? 24.438 -10.841 0.192 1.00 30.29 ? 106 PRO A CD 1 ATOM 183 N N . SER A 1 26 ? 22.375 -14.463 2.199 1.00 29.99 ? 107 SER A N 1 ATOM 184 C CA . SER A 1 26 ? 21.399 -14.744 3.230 1.00 30.33 ? 107 SER A CA 1 ATOM 185 C C . SER A 1 26 ? 22.122 -15.457 4.365 1.00 31.01 ? 107 SER A C 1 ATOM 186 O O . SER A 1 26 ? 22.815 -16.451 4.136 1.00 31.44 ? 107 SER A O 1 ATOM 187 C CB . SER A 1 26 ? 20.294 -15.616 2.669 1.00 29.96 ? 107 SER A CB 1 ATOM 188 O OG . SER A 1 26 ? 19.667 -14.958 1.597 1.00 29.81 ? 107 SER A OG 1 ATOM 189 N N . THR A 1 27 ? 21.987 -14.948 5.585 1.00 31.66 ? 108 THR A N 1 ATOM 190 C CA . THR A 1 27 ? 22.817 -15.430 6.686 1.00 32.32 ? 108 THR A CA 1 ATOM 191 C C . THR A 1 27 ? 22.046 -15.844 7.934 1.00 33.20 ? 108 THR A C 1 ATOM 192 O O . THR A 1 27 ? 20.996 -15.269 8.263 1.00 33.20 ? 108 THR A O 1 ATOM 193 C CB . THR A 1 27 ? 23.860 -14.381 7.096 1.00 32.06 ? 108 THR A CB 1 ATOM 194 O OG1 . THR A 1 27 ? 23.204 -13.144 7.409 1.00 31.96 ? 108 THR A OG1 1 ATOM 195 C CG2 . THR A 1 27 ? 24.841 -14.155 5.977 1.00 32.17 ? 108 THR A CG2 1 ATOM 196 N N . ARG A 1 28 ? 22.586 -16.844 8.627 1.00 34.20 ? 109 ARG A N 1 ATOM 197 C CA . ARG A 1 28 ? 22.083 -17.217 9.938 1.00 35.62 ? 109 ARG A CA 1 ATOM 198 C C . ARG A 1 28 ? 22.730 -16.334 10.990 1.00 35.28 ? 109 ARG A C 1 ATOM 199 O O . ARG A 1 28 ? 22.069 -15.899 11.919 1.00 35.50 ? 109 ARG A O 1 ATOM 200 C CB . ARG A 1 28 ? 22.323 -18.702 10.233 1.00 35.66 ? 109 ARG A CB 1 ATOM 201 C CG . ARG A 1 28 ? 21.392 -19.264 11.322 1.00 37.50 ? 109 ARG A CG 1 ATOM 202 C CD . ARG A 1 28 ? 21.724 -20.720 11.695 1.00 37.87 ? 109 ARG A CD 1 ATOM 203 N NE . ARG A 1 28 ? 20.940 -21.715 10.949 1.00 42.08 ? 109 ARG A NE 1 ATOM 204 C CZ . ARG A 1 28 ? 21.272 -22.217 9.757 1.00 43.85 ? 109 ARG A CZ 1 ATOM 205 N NH1 . ARG A 1 28 ? 22.378 -21.815 9.132 1.00 44.75 ? 109 ARG A NH1 1 ATOM 206 N NH2 . ARG A 1 28 ? 20.487 -23.121 9.176 1.00 44.17 ? 109 ARG A NH2 1 ATOM 207 N N . ALA A 1 29 ? 24.014 -16.036 10.809 1.00 35.76 ? 110 ALA A N 1 ATOM 208 C CA . ALA A 1 29 ? 24.784 -15.237 11.767 1.00 35.98 ? 110 ALA A CA 1 ATOM 209 C C . ALA A 1 29 ? 25.355 -13.952 11.153 1.00 36.12 ? 110 ALA A C 1 ATOM 210 O O . ALA A 1 29 ? 25.727 -13.935 9.988 1.00 36.74 ? 110 ALA A O 1 ATOM 211 C CB . ALA A 1 29 ? 25.899 -16.081 12.363 1.00 35.82 ? 110 ALA A CB 1 ATOM 212 N N . ASP A 1 30 ? 25.423 -12.880 11.936 1.00 36.07 ? 111 ASP A N 1 ATOM 213 C CA . ASP A 1 30 ? 26.019 -11.621 11.473 1.00 35.97 ? 111 ASP A CA 1 ATOM 214 C C . ASP A 1 30 ? 27.059 -11.047 12.457 1.00 35.83 ? 111 ASP A C 1 ATOM 215 O O . ASP A 1 30 ? 26.945 -11.204 13.678 1.00 35.32 ? 111 ASP A O 1 ATOM 216 C CB . ASP A 1 30 ? 24.935 -10.580 11.194 1.00 36.16 ? 111 ASP A CB 1 ATOM 217 C CG . ASP A 1 30 ? 23.949 -11.017 10.096 1.00 38.07 ? 111 ASP A CG 1 ATOM 218 O OD1 . ASP A 1 30 ? 24.409 -11.506 9.030 1.00 39.94 ? 111 ASP A OD1 1 ATOM 219 O OD2 . ASP A 1 30 ? 22.711 -10.858 10.299 1.00 37.82 ? 111 ASP A OD2 1 ATOM 220 N N . ARG A 1 31 ? 28.091 -10.408 11.913 1.00 35.62 ? 112 ARG A N 1 ATOM 221 C CA . ARG A 1 31 ? 29.044 -9.657 12.725 1.00 35.50 ? 112 ARG A CA 1 ATOM 222 C C . ARG A 1 31 ? 29.146 -8.251 12.157 1.00 34.92 ? 112 ARG A C 1 ATOM 223 O O . ARG A 1 31 ? 29.425 -8.078 10.969 1.00 34.81 ? 112 ARG A O 1 ATOM 224 C CB . ARG A 1 31 ? 30.428 -10.320 12.749 1.00 35.31 ? 112 ARG A CB 1 ATOM 225 C CG . ARG A 1 31 ? 30.432 -11.803 13.139 1.00 36.35 ? 112 ARG A CG 1 ATOM 226 C CD . ARG A 1 31 ? 31.850 -12.351 13.287 1.00 36.41 ? 112 ARG A CD 1 ATOM 227 N NE . ARG A 1 31 ? 32.435 -12.022 14.589 1.00 39.31 ? 112 ARG A NE 1 ATOM 228 C CZ . ARG A 1 31 ? 32.312 -12.782 15.683 1.00 40.76 ? 112 ARG A CZ 1 ATOM 229 N NH1 . ARG A 1 31 ? 31.620 -13.920 15.639 1.00 40.49 ? 112 ARG A NH1 1 ATOM 230 N NH2 . ARG A 1 31 ? 32.875 -12.404 16.827 1.00 40.81 ? 112 ARG A NH2 1 ATOM 231 N N . LEU A 1 32 ? 28.899 -7.264 13.013 1.00 34.52 ? 113 LEU A N 1 ATOM 232 C CA . LEU A 1 32 ? 29.041 -5.857 12.672 1.00 34.46 ? 113 LEU A CA 1 ATOM 233 C C . LEU A 1 32 ? 29.928 -5.154 13.702 1.00 34.37 ? 113 LEU A C 1 ATOM 234 O O . LEU A 1 32 ? 29.735 -5.300 14.911 1.00 34.53 ? 113 LEU A O 1 ATOM 235 C CB . LEU A 1 32 ? 27.664 -5.177 12.612 1.00 34.41 ? 113 LEU A CB 1 ATOM 236 C CG . LEU A 1 32 ? 27.518 -3.732 12.098 1.00 34.79 ? 113 LEU A CG 1 ATOM 237 C CD1 . LEU A 1 32 ? 27.726 -3.678 10.608 1.00 35.89 ? 113 LEU A CD1 1 ATOM 238 C CD2 . LEU A 1 32 ? 26.146 -3.168 12.395 1.00 34.67 ? 113 LEU A CD2 1 ATOM 239 N N . ALA A 1 33 ? 30.904 -4.400 13.220 1.00 34.10 ? 114 ALA A N 1 ATOM 240 C CA . ALA A 1 33 ? 31.700 -3.526 14.079 1.00 33.87 ? 114 ALA A CA 1 ATOM 241 C C . ALA A 1 33 ? 31.796 -2.131 13.464 1.00 34.02 ? 114 ALA A C 1 ATOM 242 O O . ALA A 1 33 ? 31.900 -1.977 12.239 1.00 34.01 ? 114 ALA A O 1 ATOM 243 C CB . ALA A 1 33 ? 33.083 -4.102 14.299 1.00 33.37 ? 114 ALA A CB 1 ATOM 244 N N . ILE A 1 34 ? 31.758 -1.113 14.314 1.00 33.98 ? 115 ILE A N 1 ATOM 245 C CA . ILE A 1 34 ? 32.018 0.247 13.862 1.00 33.85 ? 115 ILE A CA 1 ATOM 246 C C . ILE A 1 34 ? 32.500 1.114 15.020 1.00 34.10 ? 115 ILE A C 1 ATOM 247 O O . ILE A 1 34 ? 32.069 0.940 16.157 1.00 34.87 ? 115 ILE A O 1 ATOM 248 C CB . ILE A 1 34 ? 30.766 0.859 13.187 1.00 33.86 ? 115 ILE A CB 1 ATOM 249 C CG1 . ILE A 1 34 ? 31.144 2.096 12.342 1.00 34.05 ? 115 ILE A CG1 1 ATOM 250 C CG2 . ILE A 1 34 ? 29.680 1.139 14.216 1.00 33.41 ? 115 ILE A CG2 1 ATOM 251 C CD1 . ILE A 1 34 ? 30.080 2.536 11.339 1.00 33.04 ? 115 ILE A CD1 1 ATOM 252 N N . GLY A 1 35 ? 33.423 2.018 14.738 1.00 34.03 ? 116 GLY A N 1 ATOM 253 C CA . GLY A 1 35 ? 33.772 3.072 15.683 1.00 33.87 ? 116 GLY A CA 1 ATOM 254 C C . GLY A 1 35 ? 32.996 4.319 15.293 1.00 33.92 ? 116 GLY A C 1 ATOM 255 O O . GLY A 1 35 ? 32.670 4.501 14.113 1.00 33.99 ? 116 GLY A O 1 ATOM 256 N N . PHE A 1 36 ? 32.689 5.175 16.269 1.00 33.66 ? 117 PHE A N 1 ATOM 257 C CA . PHE A 1 36 ? 31.910 6.384 15.994 1.00 33.52 ? 117 PHE A CA 1 ATOM 258 C C . PHE A 1 36 ? 32.140 7.486 17.022 1.00 33.50 ? 117 PHE A C 1 ATOM 259 O O . PHE A 1 36 ? 32.508 7.212 18.159 1.00 33.69 ? 117 PHE A O 1 ATOM 260 C CB . PHE A 1 36 ? 30.413 6.062 15.936 1.00 33.36 ? 117 PHE A CB 1 ATOM 261 C CG . PHE A 1 36 ? 29.796 5.829 17.281 1.00 33.42 ? 117 PHE A CG 1 ATOM 262 C CD1 . PHE A 1 36 ? 29.336 6.900 18.044 1.00 32.61 ? 117 PHE A CD1 1 ATOM 263 C CD2 . PHE A 1 36 ? 29.681 4.534 17.792 1.00 33.42 ? 117 PHE A CD2 1 ATOM 264 C CE1 . PHE A 1 36 ? 28.775 6.687 19.303 1.00 33.71 ? 117 PHE A CE1 1 ATOM 265 C CE2 . PHE A 1 36 ? 29.124 4.306 19.052 1.00 32.99 ? 117 PHE A CE2 1 ATOM 266 C CZ . PHE A 1 36 ? 28.671 5.378 19.810 1.00 34.12 ? 117 PHE A CZ 1 ATOM 267 N N . SER A 1 37 ? 31.923 8.729 16.605 1.00 33.19 ? 118 SER A N 1 ATOM 268 C CA . SER A 1 37 ? 31.738 9.828 17.540 1.00 33.24 ? 118 SER A CA 1 ATOM 269 C C . SER A 1 37 ? 30.651 10.777 17.042 1.00 32.79 ? 118 SER A C 1 ATOM 270 O O . SER A 1 37 ? 30.597 11.105 15.851 1.00 32.49 ? 118 SER A O 1 ATOM 271 C CB . SER A 1 37 ? 33.045 10.576 17.791 1.00 33.38 ? 118 SER A CB 1 ATOM 272 O OG . SER A 1 37 ? 33.754 10.747 16.584 1.00 35.65 ? 118 SER A OG 1 ATOM 273 N N . THR A 1 38 ? 29.789 11.199 17.967 1.00 32.42 ? 119 THR A N 1 ATOM 274 C CA . THR A 1 38 ? 28.663 12.092 17.673 1.00 31.93 ? 119 THR A CA 1 ATOM 275 C C . THR A 1 38 ? 28.162 12.784 18.939 1.00 31.80 ? 119 THR A C 1 ATOM 276 O O . THR A 1 38 ? 28.432 12.329 20.056 1.00 32.11 ? 119 THR A O 1 ATOM 277 C CB . THR A 1 38 ? 27.488 11.325 17.015 1.00 32.05 ? 119 THR A CB 1 ATOM 278 O OG1 . THR A 1 38 ? 26.433 12.244 16.692 1.00 32.72 ? 119 THR A OG1 1 ATOM 279 C CG2 . THR A 1 38 ? 26.960 10.215 17.933 1.00 30.56 ? 119 THR A CG2 1 ATOM 280 N N . VAL A 1 39 ? 27.438 13.884 18.768 1.00 31.32 ? 120 VAL A N 1 ATOM 281 C CA . VAL A 1 39 ? 26.776 14.539 19.897 1.00 31.16 ? 120 VAL A CA 1 ATOM 282 C C . VAL A 1 39 ? 25.254 14.412 19.786 1.00 31.50 ? 120 VAL A C 1 ATOM 283 O O . VAL A 1 39 ? 24.513 14.948 20.608 1.00 31.39 ? 120 VAL A O 1 ATOM 284 C CB . VAL A 1 39 ? 27.204 16.035 20.077 1.00 30.97 ? 120 VAL A CB 1 ATOM 285 C CG1 . VAL A 1 39 ? 28.688 16.134 20.289 1.00 30.22 ? 120 VAL A CG1 1 ATOM 286 C CG2 . VAL A 1 39 ? 26.766 16.905 18.897 1.00 30.22 ? 120 VAL A CG2 1 ATOM 287 N N . GLN A 1 40 ? 24.807 13.678 18.772 1.00 32.04 ? 121 GLN A N 1 ATOM 288 C CA . GLN A 1 40 ? 23.390 13.567 18.450 1.00 32.63 ? 121 GLN A CA 1 ATOM 289 C C . GLN A 1 40 ? 22.627 12.704 19.426 1.00 33.06 ? 121 GLN A C 1 ATOM 290 O O . GLN A 1 40 ? 23.071 11.615 19.782 1.00 33.09 ? 121 GLN A O 1 ATOM 291 C CB . GLN A 1 40 ? 23.206 12.980 17.056 1.00 32.60 ? 121 GLN A CB 1 ATOM 292 C CG . GLN A 1 40 ? 23.217 13.988 15.939 1.00 31.74 ? 121 GLN A CG 1 ATOM 293 C CD . GLN A 1 40 ? 23.466 13.324 14.619 1.00 31.42 ? 121 GLN A CD 1 ATOM 294 O OE1 . GLN A 1 40 ? 24.361 12.490 14.496 1.00 31.92 ? 121 GLN A OE1 1 ATOM 295 N NE2 . GLN A 1 40 ? 22.676 13.678 13.619 1.00 30.87 ? 121 GLN A NE2 1 ATOM 296 N N . LYS A 1 41 ? 21.461 13.196 19.828 1.00 33.52 ? 122 LYS A N 1 ATOM 297 C CA . LYS A 1 41 ? 20.518 12.428 20.631 1.00 34.23 ? 122 LYS A CA 1 ATOM 298 C C . LYS A 1 41 ? 19.964 11.222 19.834 1.00 34.01 ? 122 LYS A C 1 ATOM 299 O O . LYS A 1 41 ? 19.800 10.123 20.377 1.00 34.00 ? 122 LYS A O 1 ATOM 300 C CB . LYS A 1 41 ? 19.379 13.344 21.106 1.00 34.15 ? 122 LYS A CB 1 ATOM 301 C CG . LYS A 1 41 ? 18.955 13.114 22.548 1.00 35.01 ? 122 LYS A CG 1 ATOM 302 C CD . LYS A 1 41 ? 17.544 13.640 22.842 1.00 35.30 ? 122 LYS A CD 1 ATOM 303 C CE . LYS A 1 41 ? 16.912 12.867 24.018 1.00 36.93 ? 122 LYS A CE 1 ATOM 304 N NZ . LYS A 1 41 ? 16.090 13.731 24.928 1.00 37.81 ? 122 LYS A NZ 1 ATOM 305 N N . GLU A 1 42 ? 19.712 11.447 18.544 1.00 33.88 ? 123 GLU A N 1 ATOM 306 C CA . GLU A 1 42 ? 19.039 10.494 17.668 1.00 33.82 ? 123 GLU A CA 1 ATOM 307 C C . GLU A 1 42 ? 19.735 10.460 16.311 1.00 33.48 ? 123 GLU A C 1 ATOM 308 O O . GLU A 1 42 ? 20.000 11.505 15.710 1.00 33.49 ? 123 GLU A O 1 ATOM 309 C CB . GLU A 1 42 ? 17.582 10.917 17.436 1.00 34.07 ? 123 GLU A CB 1 ATOM 310 C CG . GLU A 1 42 ? 16.753 11.219 18.691 1.00 36.35 ? 123 GLU A CG 1 ATOM 311 C CD . GLU A 1 42 ? 16.108 9.976 19.280 1.00 39.62 ? 123 GLU A CD 1 ATOM 312 O OE1 . GLU A 1 42 ? 15.940 8.989 18.522 1.00 41.01 ? 123 GLU A OE1 1 ATOM 313 O OE2 . GLU A 1 42 ? 15.766 9.984 20.493 1.00 39.43 ? 123 GLU A OE2 1 ATOM 314 N N . ALA A 1 43 ? 20.012 9.256 15.822 1.00 32.93 ? 124 ALA A N 1 ATOM 315 C CA . ALA A 1 43 ? 20.590 9.068 14.499 1.00 32.53 ? 124 ALA A CA 1 ATOM 316 C C . ALA A 1 43 ? 20.512 7.591 14.100 1.00 32.53 ? 124 ALA A C 1 ATOM 317 O O . ALA A 1 43 ? 20.366 6.717 14.957 1.00 32.33 ? 124 ALA A O 1 ATOM 318 C CB . ALA A 1 43 ? 22.037 9.547 14.477 1.00 32.48 ? 124 ALA A CB 1 ATOM 319 N N . VAL A 1 44 ? 20.575 7.333 12.797 1.00 32.12 ? 125 VAL A N 1 ATOM 320 C CA . VAL A 1 44 ? 20.789 5.995 12.280 1.00 31.66 ? 125 VAL A CA 1 ATOM 321 C C . VAL A 1 44 ? 22.190 5.994 11.685 1.00 31.71 ? 125 VAL A C 1 ATOM 322 O O . VAL A 1 44 ? 22.551 6.892 10.925 1.00 31.74 ? 125 VAL A O 1 ATOM 323 C CB . VAL A 1 44 ? 19.762 5.628 11.201 1.00 31.79 ? 125 VAL A CB 1 ATOM 324 C CG1 . VAL A 1 44 ? 20.137 4.300 10.542 1.00 31.24 ? 125 VAL A CG1 1 ATOM 325 C CG2 . VAL A 1 44 ? 18.356 5.580 11.788 1.00 31.22 ? 125 VAL A CG2 1 ATOM 326 N N . LEU A 1 45 ? 22.988 5.002 12.054 1.00 31.59 ? 126 LEU A N 1 ATOM 327 C CA . LEU A 1 45 ? 24.387 4.965 11.647 1.00 31.29 ? 126 LEU A CA 1 ATOM 328 C C . LEU A 1 45 ? 24.506 4.064 10.452 1.00 31.41 ? 126 LEU A C 1 ATOM 329 O O . LEU A 1 45 ? 24.944 4.503 9.389 1.00 31.68 ? 126 LEU A O 1 ATOM 330 C CB . LEU A 1 45 ? 25.280 4.440 12.777 1.00 30.83 ? 126 LEU A CB 1 ATOM 331 C CG . LEU A 1 45 ? 25.591 5.427 13.895 1.00 30.56 ? 126 LEU A CG 1 ATOM 332 C CD1 . LEU A 1 45 ? 24.360 5.745 14.726 1.00 29.80 ? 126 LEU A CD1 1 ATOM 333 C CD2 . LEU A 1 45 ? 26.713 4.889 14.769 1.00 30.81 ? 126 LEU A CD2 1 ATOM 334 N N . VAL A 1 46 ? 24.099 2.806 10.643 1.00 31.19 ? 127 VAL A N 1 ATOM 335 C CA . VAL A 1 46 ? 24.175 1.785 9.614 1.00 30.72 ? 127 VAL A CA 1 ATOM 336 C C . VAL A 1 46 ? 22.866 1.012 9.505 1.00 30.86 ? 127 VAL A C 1 ATOM 337 O O . VAL A 1 46 ? 22.200 0.724 10.497 1.00 30.61 ? 127 VAL A O 1 ATOM 338 C CB . VAL A 1 46 ? 25.308 0.784 9.891 1.00 30.34 ? 127 VAL A CB 1 ATOM 339 C CG1 . VAL A 1 46 ? 25.501 -0.115 8.691 1.00 30.22 ? 127 VAL A CG1 1 ATOM 340 C CG2 . VAL A 1 46 ? 26.609 1.507 10.201 1.00 30.22 ? 127 VAL A CG2 1 ATOM 341 N N . ARG A 1 47 ? 22.513 0.660 8.279 1.00 31.13 ? 128 ARG A N 1 ATOM 342 C CA . ARG A 1 47 ? 21.320 -0.109 8.028 1.00 30.96 ? 128 ARG A CA 1 ATOM 343 C C . ARG A 1 47 ? 21.587 -1.054 6.878 1.00 31.16 ? 128 ARG A C 1 ATOM 344 O O . ARG A 1 47 ? 21.961 -0.617 5.808 1.00 31.93 ? 128 ARG A O 1 ATOM 345 C CB . ARG A 1 47 ? 20.146 0.812 7.723 1.00 30.17 ? 128 ARG A CB 1 ATOM 346 C CG . ARG A 1 47 ? 18.925 0.058 7.338 1.00 30.64 ? 128 ARG A CG 1 ATOM 347 C CD . ARG A 1 47 ? 17.640 0.700 7.834 1.00 30.89 ? 128 ARG A CD 1 ATOM 348 N NE . ARG A 1 47 ? 16.500 -0.009 7.263 1.00 30.30 ? 128 ARG A NE 1 ATOM 349 C CZ . ARG A 1 47 ? 15.301 -0.106 7.822 1.00 30.91 ? 128 ARG A CZ 1 ATOM 350 N NH1 . ARG A 1 47 ? 15.046 0.458 8.993 1.00 31.09 ? 128 ARG A NH1 1 ATOM 351 N NH2 . ARG A 1 47 ? 14.346 -0.778 7.198 1.00 31.76 ? 128 ARG A NH2 1 ATOM 352 N N . VAL A 1 48 ? 21.422 -2.350 7.116 1.00 31.42 ? 129 VAL A N 1 ATOM 353 C CA . VAL A 1 48 ? 21.499 -3.343 6.061 1.00 31.55 ? 129 VAL A CA 1 ATOM 354 C C . VAL A 1 48 ? 20.084 -3.765 5.717 1.00 32.02 ? 129 VAL A C 1 ATOM 355 O O . VAL A 1 48 ? 19.397 -4.359 6.553 1.00 32.16 ? 129 VAL A O 1 ATOM 356 C CB . VAL A 1 48 ? 22.273 -4.579 6.499 1.00 31.33 ? 129 VAL A CB 1 ATOM 357 C CG1 . VAL A 1 48 ? 22.660 -5.390 5.288 1.00 32.06 ? 129 VAL A CG1 1 ATOM 358 C CG2 . VAL A 1 48 ? 23.510 -4.184 7.267 1.00 31.59 ? 129 VAL A CG2 1 ATOM 359 N N . ASP A 1 49 ? 19.646 -3.432 4.503 1.00 32.24 ? 130 ASP A N 1 ATOM 360 C CA . ASP A 1 49 ? 18.319 -3.794 4.019 1.00 32.62 ? 130 ASP A CA 1 ATOM 361 C C . ASP A 1 49 ? 18.370 -4.966 3.057 1.00 32.38 ? 130 ASP A C 1 ATOM 362 O O . ASP A 1 49 ? 19.344 -5.131 2.321 1.00 32.60 ? 130 ASP A O 1 ATOM 363 C CB . ASP A 1 49 ? 17.677 -2.622 3.286 1.00 33.02 ? 130 ASP A CB 1 ATOM 364 C CG . ASP A 1 49 ? 17.206 -1.547 4.216 1.00 34.99 ? 130 ASP A CG 1 ATOM 365 O OD1 . ASP A 1 49 ? 16.062 -1.640 4.725 1.00 36.20 ? 130 ASP A OD1 1 ATOM 366 O OD2 . ASP A 1 49 ? 17.982 -0.590 4.420 1.00 38.51 ? 130 ASP A OD2 1 ATOM 367 N N . SER A 1 50 ? 17.302 -5.757 3.048 1.00 32.05 ? 131 SER A N 1 ATOM 368 C CA . SER A 1 50 ? 17.143 -6.834 2.074 1.00 31.81 ? 131 SER A CA 1 ATOM 369 C C . SER A 1 50 ? 16.541 -6.327 0.752 1.00 31.72 ? 131 SER A C 1 ATOM 370 O O . SER A 1 50 ? 16.185 -5.147 0.627 1.00 31.52 ? 131 SER A O 1 ATOM 371 C CB . SER A 1 50 ? 16.262 -7.932 2.660 1.00 31.60 ? 131 SER A CB 1 ATOM 372 O OG . SER A 1 50 ? 14.996 -7.406 3.005 1.00 31.42 ? 131 SER A OG 1 ATOM 373 N N . SER A 1 51 ? 16.429 -7.229 -0.223 1.00 31.62 ? 132 SER A N 1 ATOM 374 C CA . SER A 1 51 ? 15.834 -6.937 -1.529 1.00 31.56 ? 132 SER A CA 1 ATOM 375 C C . SER A 1 51 ? 14.427 -6.362 -1.400 1.00 31.87 ? 132 SER A C 1 ATOM 376 O O . SER A 1 51 ? 13.718 -6.644 -0.432 1.00 31.88 ? 132 SER A O 1 ATOM 377 C CB . SER A 1 51 ? 15.772 -8.210 -2.375 1.00 31.17 ? 132 SER A CB 1 ATOM 378 O OG . SER A 1 51 ? 17.064 -8.652 -2.743 1.00 30.56 ? 132 SER A OG 1 ATOM 379 N N . SER A 1 52 ? 14.029 -5.559 -2.384 1.00 32.21 ? 133 SER A N 1 ATOM 380 C CA . SER A 1 52 ? 12.673 -5.015 -2.447 1.00 32.86 ? 133 SER A CA 1 ATOM 381 C C . SER A 1 52 ? 11.639 -6.127 -2.360 1.00 32.60 ? 133 SER A C 1 ATOM 382 O O . SER A 1 52 ? 11.786 -7.172 -2.991 1.00 32.70 ? 133 SER A O 1 ATOM 383 C CB . SER A 1 52 ? 12.476 -4.238 -3.745 1.00 33.17 ? 133 SER A CB 1 ATOM 384 O OG . SER A 1 52 ? 13.575 -3.358 -3.952 1.00 35.22 ? 133 SER A OG 1 ATOM 385 N N . GLY A 1 53 ? 10.603 -5.899 -1.563 1.00 32.49 ? 134 GLY A N 1 ATOM 386 C CA . GLY A 1 53 ? 9.550 -6.891 -1.369 1.00 32.43 ? 134 GLY A CA 1 ATOM 387 C C . GLY A 1 53 ? 9.771 -7.754 -0.140 1.00 32.29 ? 134 GLY A C 1 ATOM 388 O O . GLY A 1 53 ? 8.928 -8.586 0.194 1.00 32.27 ? 134 GLY A O 1 ATOM 389 N N . LEU A 1 54 ? 10.905 -7.560 0.527 1.00 32.08 ? 135 LEU A N 1 ATOM 390 C CA . LEU A 1 54 ? 11.202 -8.275 1.765 1.00 32.09 ? 135 LEU A CA 1 ATOM 391 C C . LEU A 1 54 ? 11.326 -7.324 2.965 1.00 32.26 ? 135 LEU A C 1 ATOM 392 O O . LEU A 1 54 ? 11.828 -6.199 2.848 1.00 31.95 ? 135 LEU A O 1 ATOM 393 C CB . LEU A 1 54 ? 12.479 -9.116 1.615 1.00 32.10 ? 135 LEU A CB 1 ATOM 394 C CG . LEU A 1 54 ? 12.621 -10.100 0.437 1.00 31.33 ? 135 LEU A CG 1 ATOM 395 C CD1 . LEU A 1 54 ? 14.001 -10.730 0.475 1.00 30.71 ? 135 LEU A CD1 1 ATOM 396 C CD2 . LEU A 1 54 ? 11.558 -11.176 0.444 1.00 29.37 ? 135 LEU A CD2 1 ATOM 397 N N . GLY A 1 55 ? 10.870 -7.784 4.125 1.00 32.35 ? 136 GLY A N 1 ATOM 398 C CA . GLY A 1 55 ? 10.933 -6.968 5.330 1.00 32.53 ? 136 GLY A CA 1 ATOM 399 C C . GLY A 1 55 ? 12.266 -6.940 6.061 1.00 32.61 ? 136 GLY A C 1 ATOM 400 O O . GLY A 1 55 ? 12.477 -6.069 6.902 1.00 32.46 ? 136 GLY A O 1 ATOM 401 N N . ASP A 1 56 ? 13.156 -7.884 5.749 1.00 32.95 ? 137 ASP A N 1 ATOM 402 C CA . ASP A 1 56 ? 14.379 -8.112 6.536 1.00 33.46 ? 137 ASP A CA 1 ATOM 403 C C . ASP A 1 56 ? 15.311 -6.914 6.549 1.00 33.51 ? 137 ASP A C 1 ATOM 404 O O . ASP A 1 56 ? 15.615 -6.336 5.498 1.00 34.08 ? 137 ASP A O 1 ATOM 405 C CB . ASP A 1 56 ? 15.157 -9.315 6.006 1.00 33.82 ? 137 ASP A CB 1 ATOM 406 C CG . ASP A 1 56 ? 14.414 -10.625 6.161 1.00 35.09 ? 137 ASP A CG 1 ATOM 407 O OD1 . ASP A 1 56 ? 13.175 -10.617 6.320 1.00 36.28 ? 137 ASP A OD1 1 ATOM 408 O OD2 . ASP A 1 56 ? 15.084 -11.679 6.104 1.00 37.38 ? 137 ASP A OD2 1 ATOM 409 N N . TYR A 1 57 ? 15.775 -6.554 7.738 1.00 33.18 ? 138 TYR A N 1 ATOM 410 C CA . TYR A 1 57 ? 16.680 -5.424 7.902 1.00 33.12 ? 138 TYR A CA 1 ATOM 411 C C . TYR A 1 57 ? 17.432 -5.538 9.215 1.00 32.98 ? 138 TYR A C 1 ATOM 412 O O . TYR A 1 57 ? 17.052 -6.293 10.100 1.00 32.61 ? 138 TYR A O 1 ATOM 413 C CB . TYR A 1 57 ? 15.924 -4.084 7.849 1.00 33.53 ? 138 TYR A CB 1 ATOM 414 C CG . TYR A 1 57 ? 15.129 -3.772 9.101 1.00 33.73 ? 138 TYR A CG 1 ATOM 415 C CD1 . TYR A 1 57 ? 15.678 -3.005 10.140 1.00 33.75 ? 138 TYR A CD1 1 ATOM 416 C CD2 . TYR A 1 57 ? 13.827 -4.252 9.251 1.00 33.35 ? 138 TYR A CD2 1 ATOM 417 C CE1 . TYR A 1 57 ? 14.938 -2.725 11.299 1.00 33.67 ? 138 TYR A CE1 1 ATOM 418 C CE2 . TYR A 1 57 ? 13.086 -3.982 10.388 1.00 33.71 ? 138 TYR A CE2 1 ATOM 419 C CZ . TYR A 1 57 ? 13.637 -3.222 11.406 1.00 34.41 ? 138 TYR A CZ 1 ATOM 420 O OH . TYR A 1 57 ? 12.866 -2.978 12.526 1.00 35.31 ? 138 TYR A OH 1 ATOM 421 N N . LEU A 1 58 ? 18.507 -4.773 9.315 1.00 33.08 ? 139 LEU A N 1 ATOM 422 C CA . LEU A 1 58 ? 19.328 -4.700 10.503 1.00 33.56 ? 139 LEU A CA 1 ATOM 423 C C . LEU A 1 58 ? 19.708 -3.232 10.623 1.00 33.49 ? 139 LEU A C 1 ATOM 424 O O . LEU A 1 58 ? 20.221 -2.644 9.672 1.00 33.61 ? 139 LEU A O 1 ATOM 425 C CB . LEU A 1 58 ? 20.572 -5.569 10.327 1.00 33.44 ? 139 LEU A CB 1 ATOM 426 C CG . LEU A 1 58 ? 21.682 -5.491 11.375 1.00 34.46 ? 139 LEU A CG 1 ATOM 427 C CD1 . LEU A 1 58 ? 21.233 -6.215 12.608 1.00 35.65 ? 139 LEU A CD1 1 ATOM 428 C CD2 . LEU A 1 58 ? 22.962 -6.132 10.859 1.00 34.43 ? 139 LEU A CD2 1 ATOM 429 N N . GLU A 1 59 ? 19.430 -2.628 11.769 1.00 33.45 ? 140 GLU A N 1 ATOM 430 C CA . GLU A 1 59 ? 19.662 -1.198 11.928 1.00 33.78 ? 140 GLU A CA 1 ATOM 431 C C . GLU A 1 59 ? 20.442 -0.865 13.195 1.00 33.66 ? 140 GLU A C 1 ATOM 432 O O . GLU A 1 59 ? 20.053 -1.259 14.298 1.00 33.72 ? 140 GLU A O 1 ATOM 433 C CB . GLU A 1 59 ? 18.336 -0.438 11.909 1.00 33.88 ? 140 GLU A CB 1 ATOM 434 C CG . GLU A 1 59 ? 18.491 1.045 12.086 1.00 35.11 ? 140 GLU A CG 1 ATOM 435 C CD . GLU A 1 59 ? 17.185 1.778 11.980 1.00 38.07 ? 140 GLU A CD 1 ATOM 436 O OE1 . GLU A 1 59 ? 16.566 1.767 10.890 1.00 39.05 ? 140 GLU A OE1 1 ATOM 437 O OE2 . GLU A 1 59 ? 16.779 2.386 12.993 1.00 40.70 ? 140 GLU A OE2 1 ATOM 438 N N . LEU A 1 60 ? 21.543 -0.147 13.011 1.00 33.40 ? 141 LEU A N 1 ATOM 439 C CA . LEU A 1 60 ? 22.346 0.375 14.103 1.00 33.54 ? 141 LEU A CA 1 ATOM 440 C C . LEU A 1 60 ? 22.022 1.851 14.205 1.00 34.27 ? 141 LEU A C 1 ATOM 441 O O . LEU A 1 60 ? 22.192 2.614 13.243 1.00 34.19 ? 141 LEU A O 1 ATOM 442 C CB . LEU A 1 60 ? 23.839 0.178 13.832 1.00 33.25 ? 141 LEU A CB 1 ATOM 443 C CG . LEU A 1 60 ? 24.858 0.736 14.835 1.00 33.07 ? 141 LEU A CG 1 ATOM 444 C CD1 . LEU A 1 60 ? 24.803 0.014 16.180 1.00 31.77 ? 141 LEU A CD1 1 ATOM 445 C CD2 . LEU A 1 60 ? 26.273 0.672 14.256 1.00 32.95 ? 141 LEU A CD2 1 ATOM 446 N N . HIS A 1 61 ? 21.532 2.246 15.372 1.00 34.99 ? 142 HIS A N 1 ATOM 447 C CA . HIS A 1 61 ? 21.072 3.603 15.572 1.00 35.63 ? 142 HIS A CA 1 ATOM 448 C C . HIS A 1 61 ? 21.387 4.077 16.981 1.00 35.37 ? 142 HIS A C 1 ATOM 449 O O . HIS A 1 61 ? 21.867 3.296 17.815 1.00 35.89 ? 142 HIS A O 1 ATOM 450 C CB . HIS A 1 61 ? 19.564 3.719 15.265 1.00 36.14 ? 142 HIS A CB 1 ATOM 451 C CG . HIS A 1 61 ? 18.699 2.771 16.040 1.00 38.59 ? 142 HIS A CG 1 ATOM 452 N ND1 . HIS A 1 61 ? 18.691 2.720 17.417 1.00 41.94 ? 142 HIS A ND1 1 ATOM 453 C CD2 . HIS A 1 61 ? 17.791 1.855 15.628 1.00 40.86 ? 142 HIS A CD2 1 ATOM 454 C CE1 . HIS A 1 61 ? 17.833 1.797 17.820 1.00 43.12 ? 142 HIS A CE1 1 ATOM 455 N NE2 . HIS A 1 61 ? 17.269 1.261 16.752 1.00 42.60 ? 142 HIS A NE2 1 ATOM 456 N N . ILE A 1 62 ? 21.122 5.355 17.231 1.00 34.80 ? 143 ILE A N 1 ATOM 457 C CA . ILE A 1 62 ? 21.228 5.937 18.552 1.00 34.61 ? 143 ILE A CA 1 ATOM 458 C C . ILE A 1 62 ? 19.866 6.530 18.902 1.00 34.73 ? 143 ILE A C 1 ATOM 459 O O . ILE A 1 62 ? 19.318 7.306 18.118 1.00 35.19 ? 143 ILE A O 1 ATOM 460 C CB . ILE A 1 62 ? 22.337 7.031 18.609 1.00 34.52 ? 143 ILE A CB 1 ATOM 461 C CG1 . ILE A 1 62 ? 23.718 6.406 18.373 1.00 34.55 ? 143 ILE A CG1 1 ATOM 462 C CG2 . ILE A 1 62 ? 22.303 7.783 19.951 1.00 34.17 ? 143 ILE A CG2 1 ATOM 463 C CD1 . ILE A 1 62 ? 24.805 7.387 17.979 1.00 34.43 ? 143 ILE A CD1 1 ATOM 464 N N . HIS A 1 63 ? 19.312 6.122 20.043 1.00 34.62 ? 144 HIS A N 1 ATOM 465 C CA A HIS A 1 63 ? 18.079 6.707 20.558 0.50 34.80 ? 144 HIS A CA 1 ATOM 466 C CA B HIS A 1 63 ? 18.062 6.677 20.567 0.50 34.70 ? 144 HIS A CA 1 ATOM 467 C C . HIS A 1 63 ? 18.305 7.146 21.998 1.00 34.89 ? 144 HIS A C 1 ATOM 468 O O . HIS A 1 63 ? 18.857 6.395 22.809 1.00 34.98 ? 144 HIS A O 1 ATOM 469 C CB A HIS A 1 63 ? 16.888 5.741 20.442 0.50 34.61 ? 144 HIS A CB 1 ATOM 470 C CB B HIS A 1 63 ? 16.938 5.632 20.515 0.50 34.44 ? 144 HIS A CB 1 ATOM 471 C CG A HIS A 1 63 ? 16.508 5.407 19.029 0.50 35.32 ? 144 HIS A CG 1 ATOM 472 C CG B HIS A 1 63 ? 15.594 6.155 20.928 0.50 34.68 ? 144 HIS A CG 1 ATOM 473 N ND1 A HIS A 1 63 ? 15.970 4.188 18.671 0.50 35.58 ? 144 HIS A ND1 1 ATOM 474 N ND1 B HIS A 1 63 ? 14.888 7.075 20.181 0.50 34.87 ? 144 HIS A ND1 1 ATOM 475 C CD2 A HIS A 1 63 ? 16.598 6.125 17.882 0.50 35.53 ? 144 HIS A CD2 1 ATOM 476 C CD2 B HIS A 1 63 ? 14.819 5.872 22.003 0.50 34.74 ? 144 HIS A CD2 1 ATOM 477 C CE1 A HIS A 1 63 ? 15.742 4.172 17.369 0.50 35.45 ? 144 HIS A CE1 1 ATOM 478 C CE1 B HIS A 1 63 ? 13.744 7.346 20.785 0.50 34.55 ? 144 HIS A CE1 1 ATOM 479 N NE2 A HIS A 1 63 ? 16.119 5.334 16.866 0.50 35.63 ? 144 HIS A NE2 1 ATOM 480 N NE2 B HIS A 1 63 ? 13.677 6.628 21.892 0.50 34.45 ? 144 HIS A NE2 1 ATOM 481 N N . GLN A 1 64 ? 17.903 8.383 22.293 1.00 35.08 ? 145 GLN A N 1 ATOM 482 C CA . GLN A 1 64 ? 18.097 9.020 23.610 1.00 35.53 ? 145 GLN A CA 1 ATOM 483 C C . GLN A 1 64 ? 19.539 8.954 24.157 1.00 35.10 ? 145 GLN A C 1 ATOM 484 O O . GLN A 1 64 ? 19.749 8.727 25.345 1.00 35.25 ? 145 GLN A O 1 ATOM 485 C CB . GLN A 1 64 ? 17.088 8.475 24.630 1.00 35.34 ? 145 GLN A CB 1 ATOM 486 C CG . GLN A 1 64 ? 15.640 8.864 24.342 1.00 36.35 ? 145 GLN A CG 1 ATOM 487 C CD . GLN A 1 64 ? 14.628 8.098 25.196 1.00 36.87 ? 145 GLN A CD 1 ATOM 488 O OE1 . GLN A 1 64 ? 13.784 8.702 25.869 1.00 38.73 ? 145 GLN A OE1 1 ATOM 489 N NE2 . GLN A 1 64 ? 14.706 6.763 25.170 1.00 37.83 ? 145 GLN A NE2 1 ATOM 490 N N . GLY A 1 65 ? 20.523 9.147 23.286 1.00 34.92 ? 146 GLY A N 1 ATOM 491 C CA . GLY A 1 65 ? 21.930 9.086 23.688 1.00 34.99 ? 146 GLY A CA 1 ATOM 492 C C . GLY A 1 65 ? 22.536 7.691 23.790 1.00 35.13 ? 146 GLY A C 1 ATOM 493 O O . GLY A 1 65 ? 23.723 7.544 24.095 1.00 34.59 ? 146 GLY A O 1 ATOM 494 N N . LYS A 1 66 ? 21.730 6.664 23.518 1.00 35.59 ? 147 LYS A N 1 ATOM 495 C CA . LYS A 1 66 ? 22.155 5.279 23.727 1.00 35.62 ? 147 LYS A CA 1 ATOM 496 C C . LYS A 1 66 ? 22.185 4.482 22.442 1.00 35.57 ? 147 LYS A C 1 ATOM 497 O O . LYS A 1 66 ? 21.265 4.571 21.628 1.00 35.68 ? 147 LYS A O 1 ATOM 498 C CB . LYS A 1 66 ? 21.272 4.608 24.770 1.00 35.71 ? 147 LYS A CB 1 ATOM 499 C CG . LYS A 1 66 ? 21.511 5.159 26.177 1.00 36.55 ? 147 LYS A CG 1 ATOM 500 C CD . LYS A 1 66 ? 20.219 5.379 26.926 1.00 38.11 ? 147 LYS A CD 1 ATOM 501 C CE . LYS A 1 66 ? 20.477 6.164 28.200 1.00 39.75 ? 147 LYS A CE 1 ATOM 502 N NZ . LYS A 1 66 ? 19.272 6.184 29.083 1.00 40.59 ? 147 LYS A NZ 1 ATOM 503 N N . ILE A 1 67 ? 23.262 3.718 22.267 1.00 35.45 ? 148 ILE A N 1 ATOM 504 C CA . ILE A 1 67 ? 23.477 2.916 21.068 1.00 35.31 ? 148 ILE A CA 1 ATOM 505 C C . ILE A 1 67 ? 22.705 1.605 21.160 1.00 35.25 ? 148 ILE A C 1 ATOM 506 O O . ILE A 1 67 ? 22.576 1.022 22.232 1.00 35.26 ? 148 ILE A O 1 ATOM 507 C CB . ILE A 1 67 ? 25.001 2.677 20.788 1.00 35.49 ? 148 ILE A CB 1 ATOM 508 C CG1 . ILE A 1 67 ? 25.236 2.063 19.399 1.00 35.42 ? 148 ILE A CG1 1 ATOM 509 C CG2 . ILE A 1 67 ? 25.633 1.819 21.853 1.00 35.00 ? 148 ILE A CG2 1 ATOM 510 C CD1 . ILE A 1 67 ? 25.267 3.070 18.275 1.00 34.48 ? 148 ILE A CD1 1 ATOM 511 N N . GLY A 1 68 ? 22.166 1.164 20.031 1.00 35.21 ? 149 GLY A N 1 ATOM 512 C CA . GLY A 1 68 ? 21.345 -0.035 19.987 1.00 34.83 ? 149 GLY A CA 1 ATOM 513 C C . GLY A 1 68 ? 21.206 -0.527 18.563 1.00 34.80 ? 149 GLY A C 1 ATOM 514 O O . GLY A 1 68 ? 21.580 0.167 17.611 1.00 35.32 ? 149 GLY A O 1 ATOM 515 N N . VAL A 1 69 ? 20.669 -1.730 18.420 1.00 34.18 ? 150 VAL A N 1 ATOM 516 C CA . VAL A 1 69 ? 20.465 -2.334 17.119 1.00 33.74 ? 150 VAL A CA 1 ATOM 517 C C . VAL A 1 69 ? 19.049 -2.880 17.066 1.00 33.65 ? 150 VAL A C 1 ATOM 518 O O . VAL A 1 69 ? 18.574 -3.490 18.023 1.00 33.60 ? 150 VAL A O 1 ATOM 519 C CB . VAL A 1 69 ? 21.461 -3.494 16.861 1.00 33.60 ? 150 VAL A CB 1 ATOM 520 C CG1 . VAL A 1 69 ? 21.163 -4.171 15.550 1.00 33.31 ? 150 VAL A CG1 1 ATOM 521 C CG2 . VAL A 1 69 ? 22.891 -2.989 16.861 1.00 33.95 ? 150 VAL A CG2 1 ATOM 522 N N . LYS A 1 70 ? 18.363 -2.645 15.955 1.00 33.52 ? 151 LYS A N 1 ATOM 523 C CA . LYS A 1 70 ? 17.067 -3.266 15.750 1.00 33.56 ? 151 LYS A CA 1 ATOM 524 C C . LYS A 1 70 ? 17.108 -4.080 14.469 1.00 33.05 ? 151 LYS A C 1 ATOM 525 O O . LYS A 1 70 ? 17.651 -3.633 13.464 1.00 33.33 ? 151 LYS A O 1 ATOM 526 C CB . LYS A 1 70 ? 15.970 -2.208 15.705 1.00 33.69 ? 151 LYS A CB 1 ATOM 527 C CG . LYS A 1 70 ? 14.587 -2.766 15.930 1.00 35.27 ? 151 LYS A CG 1 ATOM 528 C CD . LYS A 1 70 ? 13.600 -1.645 16.135 1.00 37.54 ? 151 LYS A CD 1 ATOM 529 C CE . LYS A 1 70 ? 12.401 -2.106 16.941 1.00 38.90 ? 151 LYS A CE 1 ATOM 530 N NZ . LYS A 1 70 ? 11.337 -1.053 16.941 1.00 40.44 ? 151 LYS A NZ 1 ATOM 531 N N . PHE A 1 71 ? 16.567 -5.288 14.508 1.00 32.64 ? 152 PHE A N 1 ATOM 532 C CA . PHE A 1 71 ? 16.531 -6.123 13.314 1.00 32.21 ? 152 PHE A CA 1 ATOM 533 C C . PHE A 1 71 ? 15.243 -6.899 13.174 1.00 32.26 ? 152 PHE A C 1 ATOM 534 O O . PHE A 1 71 ? 14.473 -7.031 14.113 1.00 31.85 ? 152 PHE A O 1 ATOM 535 C CB . PHE A 1 71 ? 17.768 -7.027 13.211 1.00 32.05 ? 152 PHE A CB 1 ATOM 536 C CG . PHE A 1 71 ? 17.936 -7.992 14.351 1.00 31.98 ? 152 PHE A CG 1 ATOM 537 C CD1 . PHE A 1 71 ? 17.528 -9.315 14.223 1.00 32.59 ? 152 PHE A CD1 1 ATOM 538 C CD2 . PHE A 1 71 ? 18.528 -7.590 15.545 1.00 31.45 ? 152 PHE A CD2 1 ATOM 539 C CE1 . PHE A 1 71 ? 17.695 -10.225 15.282 1.00 32.10 ? 152 PHE A CE1 1 ATOM 540 C CE2 . PHE A 1 71 ? 18.693 -8.483 16.601 1.00 31.16 ? 152 PHE A CE2 1 ATOM 541 C CZ . PHE A 1 71 ? 18.285 -9.804 16.466 1.00 31.36 ? 152 PHE A CZ 1 ATOM 542 N N . ASN A 1 72 ? 15.011 -7.389 11.968 1.00 33.18 ? 153 ASN A N 1 ATOM 543 C CA . ASN A 1 72 ? 13.865 -8.228 11.648 1.00 34.00 ? 153 ASN A CA 1 ATOM 544 C C . ASN A 1 72 ? 14.363 -9.314 10.717 1.00 34.75 ? 153 ASN A C 1 ATOM 545 O O . ASN A 1 72 ? 15.048 -9.029 9.744 1.00 35.12 ? 153 ASN A O 1 ATOM 546 C CB . ASN A 1 72 ? 12.775 -7.403 10.961 1.00 33.60 ? 153 ASN A CB 1 ATOM 547 C CG . ASN A 1 72 ? 11.465 -8.160 10.815 1.00 34.02 ? 153 ASN A CG 1 ATOM 548 O OD1 . ASN A 1 72 ? 11.390 -9.182 10.126 1.00 34.18 ? 153 ASN A OD1 1 ATOM 549 N ND2 . ASN A 1 72 ? 10.417 -7.649 11.451 1.00 33.82 ? 153 ASN A ND2 1 ATOM 550 N N . VAL A 1 73 ? 14.037 -10.564 11.008 1.00 35.92 ? 154 VAL A N 1 ATOM 551 C CA . VAL A 1 73 ? 14.469 -11.654 10.133 1.00 36.84 ? 154 VAL A CA 1 ATOM 552 C C . VAL A 1 73 ? 13.302 -12.572 9.775 1.00 37.46 ? 154 VAL A C 1 ATOM 553 O O . VAL A 1 73 ? 13.422 -13.795 9.825 1.00 37.84 ? 154 VAL A O 1 ATOM 554 C CB . VAL A 1 73 ? 15.699 -12.426 10.718 1.00 36.78 ? 154 VAL A CB 1 ATOM 555 C CG1 . VAL A 1 73 ? 16.935 -11.539 10.707 1.00 36.84 ? 154 VAL A CG1 1 ATOM 556 C CG2 . VAL A 1 73 ? 15.430 -12.942 12.130 1.00 36.68 ? 154 VAL A CG2 1 ATOM 557 N N . GLY A 1 74 ? 12.185 -11.966 9.372 1.00 38.41 ? 155 GLY A N 1 ATOM 558 C CA . GLY A 1 74 ? 10.885 -12.643 9.355 1.00 39.50 ? 155 GLY A CA 1 ATOM 559 C C . GLY A 1 74 ? 10.367 -12.595 10.779 1.00 40.51 ? 155 GLY A C 1 ATOM 560 O O . GLY A 1 74 ? 11.155 -12.393 11.706 1.00 41.44 ? 155 GLY A O 1 ATOM 561 N N . THR A 1 75 ? 9.062 -12.766 10.971 1.00 41.12 ? 156 THR A N 1 ATOM 562 C CA . THR A 1 75 ? 8.419 -12.634 12.306 1.00 41.79 ? 156 THR A CA 1 ATOM 563 C C . THR A 1 75 ? 8.610 -11.254 12.973 1.00 41.85 ? 156 THR A C 1 ATOM 564 O O . THR A 1 75 ? 8.434 -10.226 12.313 1.00 41.94 ? 156 THR A O 1 ATOM 565 C CB . THR A 1 75 ? 8.771 -13.815 13.296 1.00 41.94 ? 156 THR A CB 1 ATOM 566 O OG1 . THR A 1 75 ? 10.191 -13.938 13.447 1.00 42.19 ? 156 THR A OG1 1 ATOM 567 C CG2 . THR A 1 75 ? 8.196 -15.139 12.806 1.00 42.22 ? 156 THR A CG2 1 ATOM 568 N N . ASP A 1 76 ? 8.968 -11.238 14.262 1.00 42.02 ? 157 ASP A N 1 ATOM 569 C CA . ASP A 1 76 ? 8.976 -10.008 15.085 1.00 42.09 ? 157 ASP A CA 1 ATOM 570 C C . ASP A 1 76 ? 10.260 -9.176 14.955 1.00 41.71 ? 157 ASP A C 1 ATOM 571 O O . ASP A 1 76 ? 11.362 -9.714 14.823 1.00 41.67 ? 157 ASP A O 1 ATOM 572 C CB . ASP A 1 76 ? 8.757 -10.331 16.581 1.00 42.37 ? 157 ASP A CB 1 ATOM 573 C CG . ASP A 1 76 ? 7.547 -11.251 16.843 1.00 43.93 ? 157 ASP A CG 1 ATOM 574 O OD1 . ASP A 1 76 ? 6.384 -10.864 16.565 1.00 44.75 ? 157 ASP A OD1 1 ATOM 575 O OD2 . ASP A 1 76 ? 7.765 -12.364 17.370 1.00 45.33 ? 157 ASP A OD2 1 ATOM 576 N N . ASP A 1 77 ? 10.101 -7.856 15.008 1.00 41.35 ? 158 ASP A N 1 ATOM 577 C CA . ASP A 1 77 ? 11.220 -6.935 15.199 1.00 40.76 ? 158 ASP A CA 1 ATOM 578 C C . ASP A 1 77 ? 11.920 -7.183 16.538 1.00 39.89 ? 158 ASP A C 1 ATOM 579 O O . ASP A 1 77 ? 11.276 -7.293 17.581 1.00 39.70 ? 158 ASP A O 1 ATOM 580 C CB . ASP A 1 77 ? 10.725 -5.490 15.131 1.00 41.34 ? 158 ASP A CB 1 ATOM 581 C CG . ASP A 1 77 ? 10.731 -4.931 13.718 1.00 42.53 ? 158 ASP A CG 1 ATOM 582 O OD1 . ASP A 1 77 ? 11.268 -5.590 12.808 1.00 44.69 ? 158 ASP A OD1 1 ATOM 583 O OD2 . ASP A 1 77 ? 10.211 -3.815 13.513 1.00 44.43 ? 158 ASP A OD2 1 ATOM 584 N N . ILE A 1 78 ? 13.244 -7.280 16.496 1.00 39.19 ? 159 ILE A N 1 ATOM 585 C CA . ILE A 1 78 ? 14.045 -7.613 17.675 1.00 38.26 ? 159 ILE A CA 1 ATOM 586 C C . ILE A 1 78 ? 15.005 -6.480 17.997 1.00 37.72 ? 159 ILE A C 1 ATOM 587 O O . ILE A 1 78 ? 15.764 -6.029 17.136 1.00 37.86 ? 159 ILE A O 1 ATOM 588 C CB . ILE A 1 78 ? 14.810 -8.940 17.486 1.00 38.26 ? 159 ILE A CB 1 ATOM 589 C CG1 . ILE A 1 78 ? 13.816 -10.087 17.259 1.00 38.70 ? 159 ILE A CG1 1 ATOM 590 C CG2 . ILE A 1 78 ? 15.691 -9.245 18.704 1.00 38.18 ? 159 ILE A CG2 1 ATOM 591 C CD1 . ILE A 1 78 ? 14.405 -11.305 16.586 1.00 39.61 ? 159 ILE A CD1 1 ATOM 592 N N . ALA A 1 79 ? 14.950 -6.012 19.237 1.00 36.89 ? 160 ALA A N 1 ATOM 593 C CA . ALA A 1 79 ? 15.761 -4.891 19.673 1.00 36.44 ? 160 ALA A CA 1 ATOM 594 C C . ALA A 1 79 ? 16.777 -5.323 20.723 1.00 36.26 ? 160 ALA A C 1 ATOM 595 O O . ALA A 1 79 ? 16.479 -6.126 21.613 1.00 36.31 ? 160 ALA A O 1 ATOM 596 C CB . ALA A 1 79 ? 14.868 -3.773 20.217 1.00 36.28 ? 160 ALA A CB 1 ATOM 597 N N . ILE A 1 80 ? 17.986 -4.796 20.595 1.00 36.09 ? 161 ILE A N 1 ATOM 598 C CA . ILE A 1 80 ? 19.006 -4.910 21.626 1.00 35.76 ? 161 ILE A CA 1 ATOM 599 C C . ILE A 1 80 ? 19.644 -3.527 21.810 1.00 36.26 ? 161 ILE A C 1 ATOM 600 O O . ILE A 1 80 ? 20.059 -2.883 20.846 1.00 35.74 ? 161 ILE A O 1 ATOM 601 C CB . ILE A 1 80 ? 20.040 -6.035 21.313 1.00 35.66 ? 161 ILE A CB 1 ATOM 602 C CG1 . ILE A 1 80 ? 21.040 -6.193 22.469 1.00 35.34 ? 161 ILE A CG1 1 ATOM 603 C CG2 . ILE A 1 80 ? 20.727 -5.813 19.952 1.00 35.02 ? 161 ILE A CG2 1 ATOM 604 C CD1 . ILE A 1 80 ? 21.887 -7.459 22.416 1.00 34.99 ? 161 ILE A CD1 1 ATOM 605 N N . GLU A 1 81 ? 19.671 -3.057 23.051 1.00 37.12 ? 162 GLU A N 1 ATOM 606 C CA . GLU A 1 81 ? 20.155 -1.713 23.354 1.00 38.10 ? 162 GLU A CA 1 ATOM 607 C C . GLU A 1 81 ? 21.093 -1.730 24.545 1.00 37.91 ? 162 GLU A C 1 ATOM 608 O O . GLU A 1 81 ? 20.867 -2.475 25.510 1.00 38.03 ? 162 GLU A O 1 ATOM 609 C CB . GLU A 1 81 ? 18.989 -0.751 23.633 1.00 37.77 ? 162 GLU A CB 1 ATOM 610 C CG . GLU A 1 81 ? 19.435 0.721 23.716 1.00 39.68 ? 162 GLU A CG 1 ATOM 611 C CD . GLU A 1 81 ? 18.403 1.653 24.350 1.00 39.77 ? 162 GLU A CD 1 ATOM 612 O OE1 . GLU A 1 81 ? 17.947 1.368 25.486 1.00 41.07 ? 162 GLU A OE1 1 ATOM 613 O OE2 . GLU A 1 81 ? 18.065 2.684 23.710 1.00 41.81 ? 162 GLU A OE2 1 ATOM 614 N N . GLU A 1 82 ? 22.144 -0.912 24.462 1.00 37.88 ? 163 GLU A N 1 ATOM 615 C CA . GLU A 1 82 ? 23.007 -0.626 25.607 1.00 37.97 ? 163 GLU A CA 1 ATOM 616 C C . GLU A 1 82 ? 22.519 0.649 26.300 1.00 37.42 ? 163 GLU A C 1 ATOM 617 O O . GLU A 1 82 ? 22.857 1.761 25.894 1.00 37.45 ? 163 GLU A O 1 ATOM 618 C CB . GLU A 1 82 ? 24.478 -0.527 25.181 1.00 38.00 ? 163 GLU A CB 1 ATOM 619 C CG . GLU A 1 82 ? 25.450 -0.116 26.294 1.00 41.12 ? 163 GLU A CG 1 ATOM 620 C CD . GLU A 1 82 ? 25.217 -0.848 27.616 1.00 44.47 ? 163 GLU A CD 1 ATOM 621 O OE1 . GLU A 1 82 ? 25.560 -2.046 27.708 1.00 46.75 ? 163 GLU A OE1 1 ATOM 622 O OE2 . GLU A 1 82 ? 24.699 -0.222 28.568 1.00 44.90 ? 163 GLU A OE2 1 ATOM 623 N N . SER A 1 83 ? 21.731 0.473 27.358 1.00 36.98 ? 164 SER A N 1 ATOM 624 C CA . SER A 1 83 ? 21.021 1.588 27.990 1.00 36.67 ? 164 SER A CA 1 ATOM 625 C C . SER A 1 83 ? 21.725 2.239 29.192 1.00 36.36 ? 164 SER A C 1 ATOM 626 O O . SER A 1 83 ? 21.174 3.153 29.810 1.00 36.14 ? 164 SER A O 1 ATOM 627 C CB . SER A 1 83 ? 19.615 1.146 28.391 1.00 36.52 ? 164 SER A CB 1 ATOM 628 O OG . SER A 1 83 ? 19.669 -0.101 29.050 1.00 36.99 ? 164 SER A OG 1 ATOM 629 N N . ASN A 1 84 ? 22.932 1.778 29.516 1.00 36.00 ? 165 ASN A N 1 ATOM 630 C CA . ASN A 1 84 ? 23.686 2.327 30.643 1.00 35.62 ? 165 ASN A CA 1 ATOM 631 C C . ASN A 1 84 ? 24.694 3.393 30.236 1.00 35.88 ? 165 ASN A C 1 ATOM 632 O O . ASN A 1 84 ? 24.912 4.347 30.977 1.00 36.40 ? 165 ASN A O 1 ATOM 633 C CB . ASN A 1 84 ? 24.359 1.216 31.442 1.00 35.12 ? 165 ASN A CB 1 ATOM 634 C CG . ASN A 1 84 ? 23.359 0.358 32.193 1.00 34.05 ? 165 ASN A CG 1 ATOM 635 O OD1 . ASN A 1 84 ? 22.790 0.795 33.184 1.00 32.61 ? 165 ASN A OD1 1 ATOM 636 N ND2 . ASN A 1 84 ? 23.144 -0.868 31.725 1.00 32.62 ? 165 ASN A ND2 1 ATOM 637 N N . ALA A 1 85 ? 25.290 3.241 29.056 1.00 35.89 ? 166 ALA A N 1 ATOM 638 C CA . ALA A 1 85 ? 26.227 4.235 28.521 1.00 35.49 ? 166 ALA A CA 1 ATOM 639 C C . ALA A 1 85 ? 25.502 5.303 27.732 1.00 35.09 ? 166 ALA A C 1 ATOM 640 O O . ALA A 1 85 ? 24.740 4.995 26.813 1.00 34.60 ? 166 ALA A O 1 ATOM 641 C CB . ALA A 1 85 ? 27.276 3.559 27.618 1.00 35.84 ? 166 ALA A CB 1 ATOM 642 N N . ILE A 1 86 ? 25.737 6.558 28.100 1.00 34.97 ? 167 ILE A N 1 ATOM 643 C CA . ILE A 1 86 ? 25.443 7.680 27.212 1.00 34.90 ? 167 ILE A CA 1 ATOM 644 C C . ILE A 1 86 ? 26.672 7.856 26.323 1.00 34.41 ? 167 ILE A C 1 ATOM 645 O O . ILE A 1 86 ? 27.773 8.108 26.808 1.00 34.31 ? 167 ILE A O 1 ATOM 646 C CB . ILE A 1 86 ? 25.109 8.976 27.979 1.00 34.91 ? 167 ILE A CB 1 ATOM 647 C CG1 . ILE A 1 86 ? 23.748 8.856 28.679 1.00 35.52 ? 167 ILE A CG1 1 ATOM 648 C CG2 . ILE A 1 86 ? 25.075 10.165 27.035 1.00 35.16 ? 167 ILE A CG2 1 ATOM 649 C CD1 . ILE A 1 86 ? 23.501 9.946 29.758 1.00 35.53 ? 167 ILE A CD1 1 ATOM 650 N N . ILE A 1 87 ? 26.476 7.689 25.021 1.00 34.17 ? 168 ILE A N 1 ATOM 651 C CA . ILE A 1 87 ? 27.583 7.649 24.072 1.00 33.97 ? 168 ILE A CA 1 ATOM 652 C C . ILE A 1 87 ? 27.648 8.856 23.101 1.00 33.96 ? 168 ILE A C 1 ATOM 653 O O . ILE A 1 87 ? 28.508 8.890 22.201 1.00 33.83 ? 168 ILE A O 1 ATOM 654 C CB . ILE A 1 87 ? 27.605 6.307 23.283 1.00 33.84 ? 168 ILE A CB 1 ATOM 655 C CG1 . ILE A 1 87 ? 26.209 5.932 22.783 1.00 34.12 ? 168 ILE A CG1 1 ATOM 656 C CG2 . ILE A 1 87 ? 28.171 5.199 24.130 1.00 33.28 ? 168 ILE A CG2 1 ATOM 657 C CD1 . ILE A 1 87 ? 25.775 6.692 21.540 1.00 34.10 ? 168 ILE A CD1 1 ATOM 658 N N . ASN A 1 88 ? 26.754 9.830 23.293 1.00 33.61 ? 169 ASN A N 1 ATOM 659 C CA . ASN A 1 88 ? 26.692 11.007 22.423 1.00 33.58 ? 169 ASN A CA 1 ATOM 660 C C . ASN A 1 88 ? 27.433 12.207 23.025 1.00 33.63 ? 169 ASN A C 1 ATOM 661 O O . ASN A 1 88 ? 26.863 13.279 23.246 1.00 33.34 ? 169 ASN A O 1 ATOM 662 C CB . ASN A 1 88 ? 25.240 11.343 22.062 1.00 33.49 ? 169 ASN A CB 1 ATOM 663 C CG . ASN A 1 88 ? 24.525 12.158 23.143 1.00 33.63 ? 169 ASN A CG 1 ATOM 664 O OD1 . ASN A 1 88 ? 24.649 11.889 24.341 1.00 33.23 ? 169 ASN A OD1 1 ATOM 665 N ND2 . ASN A 1 88 ? 23.772 13.166 22.712 1.00 32.94 ? 169 ASN A ND2 1 ATOM 666 N N . ASP A 1 89 ? 28.723 12.009 23.274 1.00 33.71 ? 170 ASP A N 1 ATOM 667 C CA . ASP A 1 89 ? 29.538 12.971 24.014 1.00 33.67 ? 170 ASP A CA 1 ATOM 668 C C . ASP A 1 89 ? 30.652 13.506 23.129 1.00 33.47 ? 170 ASP A C 1 ATOM 669 O O . ASP A 1 89 ? 31.625 14.070 23.617 1.00 33.45 ? 170 ASP A O 1 ATOM 670 C CB . ASP A 1 89 ? 30.121 12.310 25.271 1.00 33.56 ? 170 ASP A CB 1 ATOM 671 C CG . ASP A 1 89 ? 30.824 10.971 24.970 1.00 34.84 ? 170 ASP A CG 1 ATOM 672 O OD1 . ASP A 1 89 ? 30.870 10.547 23.781 1.00 34.92 ? 170 ASP A OD1 1 ATOM 673 O OD2 . ASP A 1 89 ? 31.327 10.338 25.931 1.00 35.13 ? 170 ASP A OD2 1 ATOM 674 N N . GLY A 1 90 ? 30.506 13.308 21.824 1.00 33.39 ? 171 GLY A N 1 ATOM 675 C CA . GLY A 1 90 ? 31.516 13.727 20.862 1.00 33.43 ? 171 GLY A CA 1 ATOM 676 C C . GLY A 1 90 ? 32.846 12.998 20.969 1.00 33.44 ? 171 GLY A C 1 ATOM 677 O O . GLY A 1 90 ? 33.836 13.427 20.372 1.00 33.68 ? 171 GLY A O 1 ATOM 678 N N . LYS A 1 91 ? 32.863 11.897 21.718 1.00 33.29 ? 172 LYS A N 1 ATOM 679 C CA . LYS A 1 91 ? 34.063 11.091 21.907 1.00 33.21 ? 172 LYS A CA 1 ATOM 680 C C . LYS A 1 91 ? 33.958 9.766 21.146 1.00 33.33 ? 172 LYS A C 1 ATOM 681 O O . LYS A 1 91 ? 32.858 9.330 20.767 1.00 32.93 ? 172 LYS A O 1 ATOM 682 C CB . LYS A 1 91 ? 34.301 10.810 23.399 1.00 33.49 ? 172 LYS A CB 1 ATOM 683 C CG . LYS A 1 91 ? 34.301 12.029 24.319 1.00 33.72 ? 172 LYS A CG 1 ATOM 684 C CD . LYS A 1 91 ? 35.632 12.739 24.295 1.00 34.23 ? 172 LYS A CD 1 ATOM 685 C CE . LYS A 1 91 ? 35.524 14.121 24.908 1.00 35.25 ? 172 LYS A CE 1 ATOM 686 N NZ . LYS A 1 91 ? 36.710 14.961 24.560 1.00 36.30 ? 172 LYS A NZ 1 ATOM 687 N N . TYR A 1 92 ? 35.111 9.124 20.948 1.00 33.37 ? 173 TYR A N 1 ATOM 688 C CA . TYR A 1 92 ? 35.193 7.844 20.248 1.00 33.67 ? 173 TYR A CA 1 ATOM 689 C C . TYR A 1 92 ? 34.609 6.680 21.056 1.00 33.58 ? 173 TYR A C 1 ATOM 690 O O . TYR A 1 92 ? 34.818 6.575 22.261 1.00 33.86 ? 173 TYR A O 1 ATOM 691 C CB . TYR A 1 92 ? 36.649 7.542 19.884 1.00 33.71 ? 173 TYR A CB 1 ATOM 692 C CG . TYR A 1 92 ? 36.827 6.363 18.944 1.00 34.40 ? 173 TYR A CG 1 ATOM 693 C CD1 . TYR A 1 92 ? 36.310 6.389 17.638 1.00 34.25 ? 173 TYR A CD1 1 ATOM 694 C CD2 . TYR A 1 92 ? 37.526 5.228 19.349 1.00 34.56 ? 173 TYR A CD2 1 ATOM 695 C CE1 . TYR A 1 92 ? 36.481 5.312 16.769 1.00 33.66 ? 173 TYR A CE1 1 ATOM 696 C CE2 . TYR A 1 92 ? 37.699 4.144 18.488 1.00 35.00 ? 173 TYR A CE2 1 ATOM 697 C CZ . TYR A 1 92 ? 37.178 4.193 17.201 1.00 34.65 ? 173 TYR A CZ 1 ATOM 698 O OH . TYR A 1 92 ? 37.361 3.115 16.359 1.00 35.11 ? 173 TYR A OH 1 ATOM 699 N N . HIS A 1 93 ? 33.878 5.809 20.372 1.00 33.72 ? 174 HIS A N 1 ATOM 700 C CA . HIS A 1 93 ? 33.345 4.572 20.956 1.00 33.68 ? 174 HIS A CA 1 ATOM 701 C C . HIS A 1 93 ? 33.379 3.501 19.879 1.00 33.55 ? 174 HIS A C 1 ATOM 702 O O . HIS A 1 93 ? 33.270 3.804 18.684 1.00 33.52 ? 174 HIS A O 1 ATOM 703 C CB . HIS A 1 93 ? 31.896 4.737 21.430 1.00 33.64 ? 174 HIS A CB 1 ATOM 704 C CG . HIS A 1 93 ? 31.671 5.921 22.315 1.00 34.42 ? 174 HIS A CG 1 ATOM 705 N ND1 . HIS A 1 93 ? 32.007 5.927 23.651 1.00 34.78 ? 174 HIS A ND1 1 ATOM 706 C CD2 . HIS A 1 93 ? 31.134 7.139 22.057 1.00 35.10 ? 174 HIS A CD2 1 ATOM 707 C CE1 . HIS A 1 93 ? 31.703 7.103 24.174 1.00 35.15 ? 174 HIS A CE1 1 ATOM 708 N NE2 . HIS A 1 93 ? 31.169 7.855 23.229 1.00 35.16 ? 174 HIS A NE2 1 ATOM 709 N N . VAL A 1 94 ? 33.540 2.253 20.298 1.00 33.42 ? 175 VAL A N 1 ATOM 710 C CA . VAL A 1 94 ? 33.445 1.133 19.377 1.00 33.27 ? 175 VAL A CA 1 ATOM 711 C C . VAL A 1 94 ? 32.218 0.323 19.755 1.00 33.54 ? 175 VAL A C 1 ATOM 712 O O . VAL A 1 94 ? 31.964 0.098 20.948 1.00 33.87 ? 175 VAL A O 1 ATOM 713 C CB . VAL A 1 94 ? 34.700 0.243 19.415 1.00 32.93 ? 175 VAL A CB 1 ATOM 714 C CG1 . VAL A 1 94 ? 34.597 -0.860 18.374 1.00 32.37 ? 175 VAL A CG1 1 ATOM 715 C CG2 . VAL A 1 94 ? 35.941 1.076 19.170 1.00 32.84 ? 175 VAL A CG2 1 ATOM 716 N N . VAL A 1 95 ? 31.463 -0.093 18.739 1.00 33.51 ? 176 VAL A N 1 ATOM 717 C CA . VAL A 1 95 ? 30.290 -0.940 18.918 1.00 33.85 ? 176 VAL A CA 1 ATOM 718 C C . VAL A 1 95 ? 30.538 -2.237 18.181 1.00 33.86 ? 176 VAL A C 1 ATOM 719 O O . VAL A 1 95 ? 30.995 -2.225 17.036 1.00 33.97 ? 176 VAL A O 1 ATOM 720 C CB . VAL A 1 95 ? 29.003 -0.317 18.307 1.00 34.06 ? 176 VAL A CB 1 ATOM 721 C CG1 . VAL A 1 95 ? 27.776 -1.134 18.703 1.00 34.66 ? 176 VAL A CG1 1 ATOM 722 C CG2 . VAL A 1 95 ? 28.814 1.090 18.757 1.00 34.08 ? 176 VAL A CG2 1 ATOM 723 N N . ARG A 1 96 ? 30.227 -3.352 18.832 1.00 33.92 ? 177 ARG A N 1 ATOM 724 C CA . ARG A 1 96 ? 30.330 -4.664 18.208 1.00 34.06 ? 177 ARG A CA 1 ATOM 725 C C . ARG A 1 96 ? 29.032 -5.404 18.413 1.00 34.05 ? 177 ARG A C 1 ATOM 726 O O . ARG A 1 96 ? 28.518 -5.479 19.533 1.00 34.46 ? 177 ARG A O 1 ATOM 727 C CB . ARG A 1 96 ? 31.491 -5.459 18.782 1.00 34.05 ? 177 ARG A CB 1 ATOM 728 C CG . ARG A 1 96 ? 32.830 -4.943 18.324 1.00 35.16 ? 177 ARG A CG 1 ATOM 729 C CD . ARG A 1 96 ? 33.919 -5.349 19.293 1.00 38.18 ? 177 ARG A CD 1 ATOM 730 N NE . ARG A 1 96 ? 35.128 -4.568 19.052 1.00 41.24 ? 177 ARG A NE 1 ATOM 731 C CZ . ARG A 1 96 ? 36.108 -4.402 19.934 1.00 42.56 ? 177 ARG A CZ 1 ATOM 732 N NH1 . ARG A 1 96 ? 36.031 -4.966 21.139 1.00 44.18 ? 177 ARG A NH1 1 ATOM 733 N NH2 . ARG A 1 96 ? 37.164 -3.667 19.610 1.00 42.20 ? 177 ARG A NH2 1 ATOM 734 N N . PHE A 1 97 ? 28.496 -5.925 17.316 1.00 33.63 ? 178 PHE A N 1 ATOM 735 C CA . PHE A 1 97 ? 27.217 -6.592 17.326 1.00 33.26 ? 178 PHE A CA 1 ATOM 736 C C . PHE A 1 97 ? 27.358 -7.944 16.656 1.00 33.24 ? 178 PHE A C 1 ATOM 737 O O . PHE A 1 97 ? 27.959 -8.049 15.579 1.00 33.41 ? 178 PHE A O 1 ATOM 738 C CB . PHE A 1 97 ? 26.199 -5.734 16.593 1.00 33.11 ? 178 PHE A CB 1 ATOM 739 C CG . PHE A 1 97 ? 24.911 -6.435 16.291 1.00 33.25 ? 178 PHE A CG 1 ATOM 740 C CD1 . PHE A 1 97 ? 23.884 -6.469 17.232 1.00 33.61 ? 178 PHE A CD1 1 ATOM 741 C CD2 . PHE A 1 97 ? 24.705 -7.034 15.050 1.00 33.46 ? 178 PHE A CD2 1 ATOM 742 C CE1 . PHE A 1 97 ? 22.664 -7.110 16.955 1.00 33.32 ? 178 PHE A CE1 1 ATOM 743 C CE2 . PHE A 1 97 ? 23.496 -7.680 14.760 1.00 34.55 ? 178 PHE A CE2 1 ATOM 744 C CZ . PHE A 1 97 ? 22.468 -7.712 15.721 1.00 33.67 ? 178 PHE A CZ 1 ATOM 745 N N . THR A 1 98 ? 26.843 -8.987 17.297 1.00 32.87 ? 179 THR A N 1 ATOM 746 C CA . THR A 1 98 ? 26.719 -10.267 16.612 1.00 32.84 ? 179 THR A CA 1 ATOM 747 C C . THR A 1 98 ? 25.284 -10.756 16.695 1.00 32.70 ? 179 THR A C 1 ATOM 748 O O . THR A 1 98 ? 24.546 -10.397 17.617 1.00 33.21 ? 179 THR A O 1 ATOM 749 C CB . THR A 1 98 ? 27.712 -11.358 17.112 1.00 32.72 ? 179 THR A CB 1 ATOM 750 O OG1 . THR A 1 98 ? 27.309 -11.840 18.397 1.00 33.88 ? 179 THR A OG1 1 ATOM 751 C CG2 . THR A 1 98 ? 29.143 -10.838 17.170 1.00 32.57 ? 179 THR A CG2 1 ATOM 752 N N . ARG A 1 99 ? 24.887 -11.555 15.715 1.00 32.33 ? 180 ARG A N 1 ATOM 753 C CA . ARG A 1 99 ? 23.556 -12.133 15.691 1.00 32.13 ? 180 ARG A CA 1 ATOM 754 C C . ARG A 1 99 ? 23.674 -13.592 15.314 1.00 31.91 ? 180 ARG A C 1 ATOM 755 O O . ARG A 1 99 ? 24.434 -13.950 14.415 1.00 32.02 ? 180 ARG A O 1 ATOM 756 C CB . ARG A 1 99 ? 22.657 -11.390 14.698 1.00 32.14 ? 180 ARG A CB 1 ATOM 757 C CG . ARG A 1 99 ? 21.248 -11.963 14.569 1.00 32.14 ? 180 ARG A CG 1 ATOM 758 C CD . ARG A 1 99 ? 20.511 -11.397 13.338 1.00 32.36 ? 180 ARG A CD 1 ATOM 759 N NE . ARG A 1 99 ? 21.054 -11.874 12.059 1.00 32.49 ? 180 ARG A NE 1 ATOM 760 C CZ . ARG A 1 99 ? 20.734 -13.038 11.477 1.00 31.87 ? 180 ARG A CZ 1 ATOM 761 N NH1 . ARG A 1 99 ? 19.871 -13.885 12.047 1.00 29.23 ? 180 ARG A NH1 1 ATOM 762 N NH2 . ARG A 1 99 ? 21.295 -13.361 10.316 1.00 30.64 ? 180 ARG A NH2 1 ATOM 763 N N . SER A 1 100 ? 22.941 -14.431 16.033 1.00 31.65 ? 181 SER A N 1 ATOM 764 C CA . SER A 1 100 ? 22.781 -15.828 15.676 1.00 31.15 ? 181 SER A CA 1 ATOM 765 C C . SER A 1 100 ? 21.300 -16.158 15.761 1.00 30.97 ? 181 SER A C 1 ATOM 766 O O . SER A 1 100 ? 20.734 -16.232 16.844 1.00 30.99 ? 181 SER A O 1 ATOM 767 C CB . SER A 1 100 ? 23.584 -16.708 16.617 1.00 31.04 ? 181 SER A CB 1 ATOM 768 O OG . SER A 1 100 ? 23.490 -18.060 16.218 1.00 31.46 ? 181 SER A OG 1 ATOM 769 N N . GLY A 1 101 ? 20.668 -16.339 14.614 1.00 30.99 ? 182 GLY A N 1 ATOM 770 C CA . GLY A 1 101 ? 19.222 -16.479 14.571 1.00 31.77 ? 182 GLY A CA 1 ATOM 771 C C . GLY A 1 101 ? 18.564 -15.281 15.225 1.00 32.32 ? 182 GLY A C 1 ATOM 772 O O . GLY A 1 101 ? 18.774 -14.138 14.800 1.00 32.51 ? 182 GLY A O 1 ATOM 773 N N . GLY A 1 102 ? 17.787 -15.547 16.273 1.00 32.72 ? 183 GLY A N 1 ATOM 774 C CA . GLY A 1 102 ? 17.130 -14.496 17.049 1.00 33.23 ? 183 GLY A CA 1 ATOM 775 C C . GLY A 1 102 ? 17.930 -14.013 18.248 1.00 33.51 ? 183 GLY A C 1 ATOM 776 O O . GLY A 1 102 ? 17.580 -13.012 18.873 1.00 33.70 ? 183 GLY A O 1 ATOM 777 N N . ASN A 1 103 ? 19.002 -14.729 18.577 1.00 33.70 ? 184 ASN A N 1 ATOM 778 C CA . ASN A 1 103 ? 19.897 -14.317 19.651 1.00 33.91 ? 184 ASN A CA 1 ATOM 779 C C . ASN A 1 103 ? 20.797 -13.198 19.146 1.00 33.44 ? 184 ASN A C 1 ATOM 780 O O . ASN A 1 103 ? 20.983 -13.059 17.934 1.00 33.58 ? 184 ASN A O 1 ATOM 781 C CB . ASN A 1 103 ? 20.740 -15.492 20.148 1.00 34.13 ? 184 ASN A CB 1 ATOM 782 C CG . ASN A 1 103 ? 19.912 -16.710 20.474 1.00 36.08 ? 184 ASN A CG 1 ATOM 783 O OD1 . ASN A 1 103 ? 18.710 -16.612 20.733 1.00 37.08 ? 184 ASN A OD1 1 ATOM 784 N ND2 . ASN A 1 103 ? 20.560 -17.878 20.462 1.00 39.76 ? 184 ASN A ND2 1 ATOM 785 N N . ALA A 1 104 ? 21.340 -12.402 20.064 1.00 32.83 ? 185 ALA A N 1 ATOM 786 C CA . ALA A 1 104 ? 22.171 -11.253 19.691 1.00 32.69 ? 185 ALA A CA 1 ATOM 787 C C . ALA A 1 104 ? 23.070 -10.789 20.842 1.00 32.47 ? 185 ALA A C 1 ATOM 788 O O . ALA A 1 104 ? 22.712 -10.905 22.016 1.00 32.55 ? 185 ALA A O 1 ATOM 789 C CB . ALA A 1 104 ? 21.297 -10.095 19.193 1.00 32.51 ? 185 ALA A CB 1 ATOM 790 N N . THR A 1 105 ? 24.247 -10.290 20.499 1.00 32.05 ? 186 THR A N 1 ATOM 791 C CA . THR A 1 105 ? 25.137 -9.702 21.488 1.00 32.14 ? 186 THR A CA 1 ATOM 792 C C . THR A 1 105 ? 25.501 -8.302 21.031 1.00 32.46 ? 186 THR A C 1 ATOM 793 O O . THR A 1 105 ? 25.663 -8.060 19.826 1.00 32.47 ? 186 THR A O 1 ATOM 794 C CB . THR A 1 105 ? 26.447 -10.518 21.704 1.00 32.11 ? 186 THR A CB 1 ATOM 795 O OG1 . THR A 1 105 ? 27.407 -10.193 20.683 1.00 31.55 ? 186 THR A OG1 1 ATOM 796 C CG2 . THR A 1 105 ? 26.175 -12.036 21.734 1.00 31.32 ? 186 THR A CG2 1 ATOM 797 N N . LEU A 1 106 ? 25.629 -7.385 21.982 1.00 32.56 ? 187 LEU A N 1 ATOM 798 C CA . LEU A 1 106 ? 26.066 -6.033 21.661 1.00 33.09 ? 187 LEU A CA 1 ATOM 799 C C . LEU A 1 106 ? 27.129 -5.592 22.650 1.00 33.26 ? 187 LEU A C 1 ATOM 800 O O . LEU A 1 106 ? 26.952 -5.726 23.866 1.00 33.42 ? 187 LEU A O 1 ATOM 801 C CB . LEU A 1 106 ? 24.888 -5.061 21.674 1.00 33.09 ? 187 LEU A CB 1 ATOM 802 C CG . LEU A 1 106 ? 25.176 -3.609 21.286 1.00 33.09 ? 187 LEU A CG 1 ATOM 803 C CD1 . LEU A 1 106 ? 25.330 -3.465 19.792 1.00 31.94 ? 187 LEU A CD1 1 ATOM 804 C CD2 . LEU A 1 106 ? 24.038 -2.738 21.775 1.00 33.95 ? 187 LEU A CD2 1 ATOM 805 N N . GLN A 1 107 ? 28.239 -5.085 22.132 1.00 33.26 ? 188 GLN A N 1 ATOM 806 C CA . GLN A 1 107 ? 29.292 -4.606 22.996 1.00 33.70 ? 188 GLN A CA 1 ATOM 807 C C . GLN A 1 107 ? 29.626 -3.165 22.701 1.00 33.79 ? 188 GLN A C 1 ATOM 808 O O . GLN A 1 107 ? 29.794 -2.779 21.536 1.00 34.06 ? 188 GLN A O 1 ATOM 809 C CB . GLN A 1 107 ? 30.541 -5.475 22.894 1.00 33.77 ? 188 GLN A CB 1 ATOM 810 C CG . GLN A 1 107 ? 31.714 -4.920 23.697 1.00 35.48 ? 188 GLN A CG 1 ATOM 811 C CD . GLN A 1 107 ? 32.845 -5.913 23.871 1.00 38.43 ? 188 GLN A CD 1 ATOM 812 O OE1 . GLN A 1 107 ? 32.662 -7.123 23.704 1.00 40.28 ? 188 GLN A OE1 1 ATOM 813 N NE2 . GLN A 1 107 ? 34.021 -5.408 24.223 1.00 38.50 ? 188 GLN A NE2 1 ATOM 814 N N . VAL A 1 108 ? 29.739 -2.372 23.763 1.00 33.52 ? 189 VAL A N 1 ATOM 815 C CA . VAL A 1 108 ? 30.072 -0.965 23.626 1.00 33.50 ? 189 VAL A CA 1 ATOM 816 C C . VAL A 1 108 ? 31.293 -0.615 24.456 1.00 33.44 ? 189 VAL A C 1 ATOM 817 O O . VAL A 1 108 ? 31.234 -0.655 25.683 1.00 34.19 ? 189 VAL A O 1 ATOM 818 C CB . VAL A 1 108 ? 28.879 -0.070 24.041 1.00 33.30 ? 189 VAL A CB 1 ATOM 819 C CG1 . VAL A 1 108 ? 29.251 1.393 23.955 1.00 33.40 ? 189 VAL A CG1 1 ATOM 820 C CG2 . VAL A 1 108 ? 27.690 -0.352 23.153 1.00 32.94 ? 189 VAL A CG2 1 ATOM 821 N N . ASP A 1 109 ? 32.397 -0.267 23.803 1.00 33.09 ? 190 ASP A N 1 ATOM 822 C CA . ASP A 1 109 ? 33.582 0.199 24.550 1.00 32.88 ? 190 ASP A CA 1 ATOM 823 C C . ASP A 1 109 ? 33.695 1.715 24.553 1.00 32.10 ? 190 ASP A C 1 ATOM 824 O O . ASP A 1 109 ? 33.349 2.371 23.570 1.00 32.17 ? 190 ASP A O 1 ATOM 825 C CB . ASP A 1 109 ? 34.885 -0.430 24.038 1.00 32.91 ? 190 ASP A CB 1 ATOM 826 C CG . ASP A 1 109 ? 34.856 -1.933 24.083 1.00 33.79 ? 190 ASP A CG 1 ATOM 827 O OD1 . ASP A 1 109 ? 35.457 -2.533 24.997 1.00 36.05 ? 190 ASP A OD1 1 ATOM 828 O OD2 . ASP A 1 109 ? 34.209 -2.523 23.204 1.00 37.06 ? 190 ASP A OD2 1 ATOM 829 N N . SER A 1 110 ? 34.176 2.251 25.670 1.00 31.29 ? 191 SER A N 1 ATOM 830 C CA . SER A 1 110 ? 34.379 3.680 25.841 1.00 31.00 ? 191 SER A CA 1 ATOM 831 C C . SER A 1 110 ? 35.633 3.927 26.665 1.00 30.78 ? 191 SER A C 1 ATOM 832 O O . SER A 1 110 ? 36.115 3.040 27.375 1.00 30.97 ? 191 SER A O 1 ATOM 833 C CB . SER A 1 110 ? 33.187 4.318 26.549 1.00 31.02 ? 191 SER A CB 1 ATOM 834 O OG . SER A 1 110 ? 31.996 4.170 25.800 1.00 32.09 ? 191 SER A OG 1 ATOM 835 N N . TRP A 1 111 ? 36.157 5.143 26.580 1.00 30.22 ? 192 TRP A N 1 ATOM 836 C CA . TRP A 1 111 ? 37.335 5.501 27.342 1.00 29.46 ? 192 TRP A CA 1 ATOM 837 C C . TRP A 1 111 ? 37.080 6.731 28.215 1.00 29.43 ? 192 TRP A C 1 ATOM 838 O O . TRP A 1 111 ? 37.640 7.796 27.973 1.00 29.23 ? 192 TRP A O 1 ATOM 839 C CB . TRP A 1 111 ? 38.534 5.645 26.406 1.00 29.04 ? 192 TRP A CB 1 ATOM 840 C CG . TRP A 1 111 ? 38.896 4.323 25.822 1.00 28.83 ? 192 TRP A CG 1 ATOM 841 C CD1 . TRP A 1 111 ? 39.821 3.442 26.306 1.00 28.78 ? 192 TRP A CD1 1 ATOM 842 C CD2 . TRP A 1 111 ? 38.296 3.690 24.681 1.00 28.24 ? 192 TRP A CD2 1 ATOM 843 N NE1 . TRP A 1 111 ? 39.852 2.312 25.523 1.00 28.81 ? 192 TRP A NE1 1 ATOM 844 C CE2 . TRP A 1 111 ? 38.923 2.436 24.523 1.00 27.63 ? 192 TRP A CE2 1 ATOM 845 C CE3 . TRP A 1 111 ? 37.301 4.070 23.766 1.00 29.41 ? 192 TRP A CE3 1 ATOM 846 C CZ2 . TRP A 1 111 ? 38.588 1.552 23.494 1.00 28.07 ? 192 TRP A CZ2 1 ATOM 847 C CZ3 . TRP A 1 111 ? 36.960 3.182 22.734 1.00 29.53 ? 192 TRP A CZ3 1 ATOM 848 C CH2 . TRP A 1 111 ? 37.607 1.936 22.611 1.00 28.84 ? 192 TRP A CH2 1 ATOM 849 N N . PRO A 1 112 ? 36.218 6.582 29.240 1.00 29.53 ? 193 PRO A N 1 ATOM 850 C CA . PRO A 1 112 ? 35.922 7.715 30.104 1.00 29.97 ? 193 PRO A CA 1 ATOM 851 C C . PRO A 1 112 ? 37.156 8.218 30.852 1.00 30.69 ? 193 PRO A C 1 ATOM 852 O O . PRO A 1 112 ? 38.046 7.437 31.199 1.00 30.25 ? 193 PRO A O 1 ATOM 853 C CB . PRO A 1 112 ? 34.886 7.145 31.086 1.00 29.71 ? 193 PRO A CB 1 ATOM 854 C CG . PRO A 1 112 ? 35.098 5.690 31.065 1.00 29.26 ? 193 PRO A CG 1 ATOM 855 C CD . PRO A 1 112 ? 35.476 5.380 29.658 1.00 29.36 ? 193 PRO A CD 1 ATOM 856 N N . VAL A 1 113 ? 37.189 9.522 31.090 1.00 31.98 ? 194 VAL A N 1 ATOM 857 C CA . VAL A 1 113 ? 38.300 10.166 31.774 1.00 33.38 ? 194 VAL A CA 1 ATOM 858 C C . VAL A 1 113 ? 37.847 10.710 33.134 1.00 34.54 ? 194 VAL A C 1 ATOM 859 O O . VAL A 1 113 ? 38.469 11.613 33.702 1.00 34.40 ? 194 VAL A O 1 ATOM 860 C CB . VAL A 1 113 ? 38.895 11.315 30.939 1.00 20.00 ? 194 VAL A CB 1 ATOM 861 C CG1 . VAL A 1 113 ? 39.963 12.052 31.731 1.00 20.00 ? 194 VAL A CG1 1 ATOM 862 C CG2 . VAL A 1 113 ? 39.462 10.784 29.631 1.00 20.00 ? 194 VAL A CG2 1 ATOM 863 N N . ILE A 1 114 ? 36.767 10.128 33.653 1.00 36.09 ? 195 ILE A N 1 ATOM 864 C CA . ILE A 1 114 ? 36.098 10.616 34.858 1.00 37.63 ? 195 ILE A CA 1 ATOM 865 C C . ILE A 1 114 ? 35.636 9.457 35.741 1.00 38.47 ? 195 ILE A C 1 ATOM 866 O O . ILE A 1 114 ? 35.037 8.487 35.249 1.00 38.53 ? 195 ILE A O 1 ATOM 867 C CB . ILE A 1 114 ? 34.910 11.557 34.475 1.00 37.84 ? 195 ILE A CB 1 ATOM 868 C CG1 . ILE A 1 114 ? 35.341 13.021 34.581 1.00 37.98 ? 195 ILE A CG1 1 ATOM 869 C CG2 . ILE A 1 114 ? 33.644 11.294 35.319 1.00 38.32 ? 195 ILE A CG2 1 ATOM 870 C CD1 . ILE A 1 114 ? 34.490 13.974 33.749 1.00 38.76 ? 195 ILE A CD1 1 ATOM 871 N N . GLU A 1 115 ? 35.936 9.556 37.037 1.00 39.40 ? 196 GLU A N 1 ATOM 872 C CA . GLU A 1 115 ? 35.436 8.592 38.022 1.00 40.49 ? 196 GLU A CA 1 ATOM 873 C C . GLU A 1 115 ? 34.615 9.234 39.138 1.00 40.83 ? 196 GLU A C 1 ATOM 874 O O . GLU A 1 115 ? 35.145 9.994 39.953 1.00 40.87 ? 196 GLU A O 1 ATOM 875 C CB . GLU A 1 115 ? 36.556 7.708 38.596 1.00 40.56 ? 196 GLU A CB 1 ATOM 876 C CG . GLU A 1 115 ? 36.735 6.406 37.804 1.00 41.72 ? 196 GLU A CG 1 ATOM 877 C CD . GLU A 1 115 ? 36.626 5.151 38.667 1.00 42.71 ? 196 GLU A CD 1 ATOM 878 O OE1 . GLU A 1 115 ? 37.135 5.156 39.812 1.00 41.61 ? 196 GLU A OE1 1 ATOM 879 O OE2 . GLU A 1 115 ? 36.023 4.158 38.189 1.00 42.95 ? 196 GLU A OE2 1 ATOM 880 N N . ARG A 1 116 ? 33.319 8.908 39.154 1.00 41.28 ? 197 ARG A N 1 ATOM 881 C CA . ARG A 1 116 ? 32.347 9.476 40.096 1.00 41.45 ? 197 ARG A CA 1 ATOM 882 C C . ARG A 1 116 ? 32.267 8.680 41.394 1.00 41.19 ? 197 ARG A C 1 ATOM 883 O O . ARG A 1 116 ? 33.281 8.209 41.905 1.00 40.87 ? 197 ARG A O 1 ATOM 884 C CB . ARG A 1 116 ? 30.963 9.573 39.435 1.00 41.61 ? 197 ARG A CB 1 ATOM 885 C CG . ARG A 1 116 ? 30.820 10.737 38.443 1.00 42.08 ? 197 ARG A CG 1 ATOM 886 C CD . ARG A 1 116 ? 29.649 10.551 37.472 1.00 42.01 ? 197 ARG A CD 1 ATOM 887 N NE . ARG A 1 116 ? 30.077 10.000 36.186 1.00 43.14 ? 197 ARG A NE 1 ATOM 888 C CZ . ARG A 1 116 ? 29.701 8.819 35.696 1.00 43.37 ? 197 ARG A CZ 1 ATOM 889 N NH1 . ARG A 1 116 ? 28.866 8.038 36.372 1.00 43.52 ? 197 ARG A NH1 1 ATOM 890 N NH2 . ARG A 1 116 ? 30.158 8.419 34.514 1.00 42.86 ? 197 ARG A NH2 1 ATOM 891 N N . LEU A 1 127 ? 25.577 11.754 45.429 1.00 46.67 ? 208 LEU A N 1 ATOM 892 C CA . LEU A 1 127 ? 26.727 12.635 45.587 1.00 46.71 ? 208 LEU A CA 1 ATOM 893 C C . LEU A 1 127 ? 27.879 12.203 44.675 1.00 46.67 ? 208 LEU A C 1 ATOM 894 O O . LEU A 1 127 ? 28.955 11.820 45.149 1.00 46.77 ? 208 LEU A O 1 ATOM 895 C CB . LEU A 1 127 ? 27.168 12.695 47.066 1.00 46.75 ? 208 LEU A CB 1 ATOM 896 N N . ALA A 1 128 ? 27.635 12.272 43.364 1.00 46.55 ? 209 ALA A N 1 ATOM 897 C CA . ALA A 1 128 ? 28.621 11.924 42.330 1.00 46.26 ? 209 ALA A CA 1 ATOM 898 C C . ALA A 1 128 ? 29.898 12.768 42.429 1.00 46.04 ? 209 ALA A C 1 ATOM 899 O O . ALA A 1 128 ? 29.899 13.826 43.067 1.00 46.24 ? 209 ALA A O 1 ATOM 900 C CB . ALA A 1 128 ? 27.999 12.057 40.944 1.00 46.39 ? 209 ALA A CB 1 ATOM 901 N N . ILE A 1 129 ? 30.979 12.300 41.800 1.00 45.56 ? 210 ILE A N 1 ATOM 902 C CA . ILE A 1 129 ? 32.301 12.946 41.929 1.00 44.84 ? 210 ILE A CA 1 ATOM 903 C C . ILE A 1 129 ? 32.927 13.308 40.565 1.00 44.30 ? 210 ILE A C 1 ATOM 904 O O . ILE A 1 129 ? 33.266 12.434 39.759 1.00 44.40 ? 210 ILE A O 1 ATOM 905 C CB . ILE A 1 129 ? 33.288 12.070 42.781 1.00 44.77 ? 210 ILE A CB 1 ATOM 906 C CG1 . ILE A 1 129 ? 32.711 11.737 44.170 1.00 44.66 ? 210 ILE A CG1 1 ATOM 907 C CG2 . ILE A 1 129 ? 34.659 12.715 42.884 1.00 44.97 ? 210 ILE A CG2 1 ATOM 908 C CD1 . ILE A 1 129 ? 32.399 12.932 45.069 1.00 44.76 ? 210 ILE A CD1 1 ATOM 909 N N . ALA A 1 130 ? 33.080 14.603 40.309 1.00 43.45 ? 211 ALA A N 1 ATOM 910 C CA . ALA A 1 130 ? 33.711 15.057 39.071 1.00 42.51 ? 211 ALA A CA 1 ATOM 911 C C . ALA A 1 130 ? 35.245 14.962 39.167 1.00 41.55 ? 211 ALA A C 1 ATOM 912 O O . ALA A 1 130 ? 35.945 15.982 39.188 1.00 41.54 ? 211 ALA A O 1 ATOM 913 C CB . ALA A 1 130 ? 33.258 16.485 38.733 1.00 42.82 ? 211 ALA A CB 1 ATOM 914 N N . ARG A 1 131 ? 35.748 13.727 39.234 1.00 40.07 ? 212 ARG A N 1 ATOM 915 C CA . ARG A 1 131 ? 37.182 13.444 39.335 1.00 38.62 ? 212 ARG A CA 1 ATOM 916 C C . ARG A 1 131 ? 37.772 13.188 37.947 1.00 37.31 ? 212 ARG A C 1 ATOM 917 O O . ARG A 1 131 ? 37.539 12.132 37.359 1.00 37.31 ? 212 ARG A O 1 ATOM 918 C CB . ARG A 1 131 ? 37.415 12.228 40.247 1.00 38.68 ? 212 ARG A CB 1 ATOM 919 C CG . ARG A 1 131 ? 38.856 11.996 40.726 1.00 38.97 ? 212 ARG A CG 1 ATOM 920 C CD . ARG A 1 131 ? 38.933 10.792 41.681 1.00 39.08 ? 212 ARG A CD 1 ATOM 921 N NE . ARG A 1 131 ? 40.207 10.709 42.405 1.00 40.74 ? 212 ARG A NE 1 ATOM 922 C CZ . ARG A 1 131 ? 40.373 10.158 43.615 1.00 41.70 ? 212 ARG A CZ 1 ATOM 923 N NH1 . ARG A 1 131 ? 39.347 9.634 44.279 1.00 42.06 ? 212 ARG A NH1 1 ATOM 924 N NH2 . ARG A 1 131 ? 41.576 10.141 44.183 1.00 41.47 ? 212 ARG A NH2 1 ATOM 925 N N . GLN A 1 132 ? 38.515 14.163 37.421 1.00 35.76 ? 213 GLN A N 1 ATOM 926 C CA . GLN A 1 132 ? 39.280 13.978 36.186 1.00 34.02 ? 213 GLN A CA 1 ATOM 927 C C . GLN A 1 132 ? 40.365 12.935 36.420 1.00 32.93 ? 213 GLN A C 1 ATOM 928 O O . GLN A 1 132 ? 41.032 12.929 37.449 1.00 32.85 ? 213 GLN A O 1 ATOM 929 C CB . GLN A 1 132 ? 39.876 15.292 35.688 1.00 34.02 ? 213 GLN A CB 1 ATOM 930 C CG . GLN A 1 132 ? 38.857 16.299 35.177 1.00 34.07 ? 213 GLN A CG 1 ATOM 931 C CD . GLN A 1 132 ? 38.051 15.792 33.992 1.00 35.43 ? 213 GLN A CD 1 ATOM 932 O OE1 . GLN A 1 132 ? 38.584 15.177 33.059 1.00 35.41 ? 213 GLN A OE1 1 ATOM 933 N NE2 . GLN A 1 132 ? 36.754 16.061 34.018 1.00 36.18 ? 213 GLN A NE2 1 ATOM 934 N N . ARG A 1 133 ? 40.525 12.054 35.448 1.00 31.71 ? 214 ARG A N 1 ATOM 935 C CA . ARG A 1 133 ? 41.171 10.774 35.651 1.00 30.54 ? 214 ARG A CA 1 ATOM 936 C C . ARG A 1 133 ? 41.987 10.467 34.409 1.00 29.92 ? 214 ARG A C 1 ATOM 937 O O . ARG A 1 133 ? 41.786 11.091 33.358 1.00 29.79 ? 214 ARG A O 1 ATOM 938 C CB . ARG A 1 133 ? 40.066 9.715 35.780 1.00 30.69 ? 214 ARG A CB 1 ATOM 939 C CG . ARG A 1 133 ? 40.312 8.611 36.779 1.00 30.18 ? 214 ARG A CG 1 ATOM 940 C CD . ARG A 1 133 ? 39.818 7.296 36.229 1.00 27.87 ? 214 ARG A CD 1 ATOM 941 N NE . ARG A 1 133 ? 40.862 6.657 35.440 1.00 27.53 ? 214 ARG A NE 1 ATOM 942 C CZ . ARG A 1 133 ? 41.677 5.704 35.891 1.00 27.79 ? 214 ARG A CZ 1 ATOM 943 N NH1 . ARG A 1 133 ? 41.555 5.243 37.130 1.00 26.89 ? 214 ARG A NH1 1 ATOM 944 N NH2 . ARG A 1 133 ? 42.612 5.202 35.091 1.00 28.28 ? 214 ARG A NH2 1 ATOM 945 N N . ILE A 1 134 ? 42.896 9.501 34.508 1.00 29.14 ? 215 ILE A N 1 ATOM 946 C CA . ILE A 1 134 ? 43.494 8.929 33.302 1.00 28.56 ? 215 ILE A CA 1 ATOM 947 C C . ILE A 1 134 ? 42.404 8.114 32.588 1.00 28.54 ? 215 ILE A C 1 ATOM 948 O O . ILE A 1 134 ? 41.754 7.280 33.211 1.00 28.07 ? 215 ILE A O 1 ATOM 949 C CB . ILE A 1 134 ? 44.739 8.048 33.613 1.00 28.21 ? 215 ILE A CB 1 ATOM 950 C CG1 . ILE A 1 134 ? 45.844 8.883 34.259 1.00 27.34 ? 215 ILE A CG1 1 ATOM 951 C CG2 . ILE A 1 134 ? 45.270 7.376 32.340 1.00 28.01 ? 215 ILE A CG2 1 ATOM 952 C CD1 . ILE A 1 134 ? 46.953 8.063 34.871 1.00 26.42 ? 215 ILE A CD1 1 ATOM 953 N N . PRO A 1 135 ? 42.171 8.384 31.293 1.00 28.77 ? 216 PRO A N 1 ATOM 954 C CA . PRO A 1 135 ? 41.222 7.569 30.533 1.00 29.30 ? 216 PRO A CA 1 ATOM 955 C C . PRO A 1 135 ? 41.496 6.070 30.672 1.00 29.81 ? 216 PRO A C 1 ATOM 956 O O . PRO A 1 135 ? 42.650 5.646 30.711 1.00 29.78 ? 216 PRO A O 1 ATOM 957 C CB . PRO A 1 135 ? 41.439 8.029 29.090 1.00 29.04 ? 216 PRO A CB 1 ATOM 958 C CG . PRO A 1 135 ? 41.888 9.425 29.214 1.00 28.78 ? 216 PRO A CG 1 ATOM 959 C CD . PRO A 1 135 ? 42.735 9.467 30.471 1.00 28.91 ? 216 PRO A CD 1 ATOM 960 N N . TYR A 1 136 ? 40.426 5.292 30.775 1.00 30.58 ? 217 TYR A N 1 ATOM 961 C CA . TYR A 1 136 ? 40.514 3.850 30.952 1.00 31.44 ? 217 TYR A CA 1 ATOM 962 C C . TYR A 1 136 ? 39.388 3.210 30.160 1.00 31.96 ? 217 TYR A C 1 ATOM 963 O O . TYR A 1 136 ? 38.356 3.846 29.927 1.00 31.90 ? 217 TYR A O 1 ATOM 964 C CB . TYR A 1 136 ? 40.397 3.481 32.439 1.00 31.67 ? 217 TYR A CB 1 ATOM 965 C CG . TYR A 1 136 ? 39.053 3.812 33.058 1.00 32.13 ? 217 TYR A CG 1 ATOM 966 C CD1 . TYR A 1 136 ? 38.002 2.882 33.037 1.00 32.11 ? 217 TYR A CD1 1 ATOM 967 C CD2 . TYR A 1 136 ? 38.825 5.050 33.664 1.00 31.79 ? 217 TYR A CD2 1 ATOM 968 C CE1 . TYR A 1 136 ? 36.764 3.181 33.597 1.00 32.10 ? 217 TYR A CE1 1 ATOM 969 C CE2 . TYR A 1 136 ? 37.586 5.360 34.232 1.00 32.03 ? 217 TYR A CE2 1 ATOM 970 C CZ . TYR A 1 136 ? 36.563 4.420 34.191 1.00 32.43 ? 217 TYR A CZ 1 ATOM 971 O OH . TYR A 1 136 ? 35.339 4.711 34.744 1.00 33.01 ? 217 TYR A OH 1 ATOM 972 N N . ARG A 1 137 ? 39.584 1.956 29.758 1.00 32.56 ? 218 ARG A N 1 ATOM 973 C CA . ARG A 1 137 ? 38.578 1.220 28.990 1.00 33.04 ? 218 ARG A CA 1 ATOM 974 C C . ARG A 1 137 ? 37.394 0.833 29.863 1.00 32.61 ? 218 ARG A C 1 ATOM 975 O O . ARG A 1 137 ? 37.560 0.213 30.918 1.00 32.39 ? 218 ARG A O 1 ATOM 976 C CB . ARG A 1 137 ? 39.192 -0.032 28.361 1.00 33.56 ? 218 ARG A CB 1 ATOM 977 C CG . ARG A 1 137 ? 38.314 -0.717 27.318 1.00 36.43 ? 218 ARG A CG 1 ATOM 978 C CD . ARG A 1 137 ? 39.043 -1.912 26.726 1.00 42.39 ? 218 ARG A CD 1 ATOM 979 N NE . ARG A 1 137 ? 38.307 -2.537 25.623 1.00 46.73 ? 218 ARG A NE 1 ATOM 980 C CZ . ARG A 1 137 ? 38.802 -3.495 24.837 1.00 48.55 ? 218 ARG A CZ 1 ATOM 981 N NH1 . ARG A 1 137 ? 40.042 -3.946 25.027 1.00 49.19 ? 218 ARG A NH1 1 ATOM 982 N NH2 . ARG A 1 137 ? 38.060 -4.000 23.856 1.00 48.92 ? 218 ARG A NH2 1 ATOM 983 N N . LEU A 1 138 ? 36.205 1.228 29.421 1.00 32.56 ? 219 LEU A N 1 ATOM 984 C CA . LEU A 1 138 ? 34.961 0.802 30.048 1.00 32.56 ? 219 LEU A CA 1 ATOM 985 C C . LEU A 1 138 ? 34.140 0.048 29.020 1.00 32.29 ? 219 LEU A C 1 ATOM 986 O O . LEU A 1 138 ? 33.627 0.635 28.064 1.00 32.06 ? 219 LEU A O 1 ATOM 987 C CB . LEU A 1 138 ? 34.175 1.993 30.604 1.00 32.63 ? 219 LEU A CB 1 ATOM 988 C CG . LEU A 1 138 ? 32.856 1.745 31.354 1.00 32.71 ? 219 LEU A CG 1 ATOM 989 C CD1 . LEU A 1 138 ? 32.984 0.671 32.419 1.00 33.34 ? 219 LEU A CD1 1 ATOM 990 C CD2 . LEU A 1 138 ? 32.372 3.040 31.984 1.00 32.93 ? 219 LEU A CD2 1 ATOM 991 N N . GLY A 1 139 ? 34.036 -1.261 29.220 1.00 31.96 ? 220 GLY A N 1 ATOM 992 C CA . GLY A 1 139 ? 33.339 -2.125 28.277 1.00 31.86 ? 220 GLY A CA 1 ATOM 993 C C . GLY A 1 139 ? 31.996 -2.577 28.807 1.00 31.77 ? 220 GLY A C 1 ATOM 994 O O . GLY A 1 139 ? 31.841 -2.845 29.994 1.00 31.40 ? 220 GLY A O 1 ATOM 995 N N . ARG A 1 140 ? 31.017 -2.639 27.917 1.00 31.81 ? 221 ARG A N 1 ATOM 996 C CA . ARG A 1 140 ? 29.690 -3.109 28.273 1.00 32.18 ? 221 ARG A CA 1 ATOM 997 C C . ARG A 1 140 ? 29.258 -4.106 27.232 1.00 32.05 ? 221 ARG A C 1 ATOM 998 O O . ARG A 1 140 ? 29.417 -3.873 26.035 1.00 32.41 ? 221 ARG A O 1 ATOM 999 C CB . ARG A 1 140 ? 28.682 -1.955 28.368 1.00 32.01 ? 221 ARG A CB 1 ATOM 1000 C CG . ARG A 1 140 ? 28.888 -1.075 29.583 1.00 32.26 ? 221 ARG A CG 1 ATOM 1001 C CD . ARG A 1 140 ? 27.937 0.101 29.626 1.00 32.95 ? 221 ARG A CD 1 ATOM 1002 N NE . ARG A 1 140 ? 28.510 1.198 30.409 1.00 35.62 ? 221 ARG A NE 1 ATOM 1003 C CZ . ARG A 1 140 ? 28.334 1.391 31.719 1.00 36.42 ? 221 ARG A CZ 1 ATOM 1004 N NH1 . ARG A 1 140 ? 27.572 0.571 32.447 1.00 35.64 ? 221 ARG A NH1 1 ATOM 1005 N NH2 . ARG A 1 140 ? 28.933 2.425 32.304 1.00 36.31 ? 221 ARG A NH2 1 ATOM 1006 N N . VAL A 1 141 ? 28.731 -5.228 27.703 1.00 31.95 ? 222 VAL A N 1 ATOM 1007 C CA . VAL A 1 141 ? 28.236 -6.275 26.836 1.00 31.72 ? 222 VAL A CA 1 ATOM 1008 C C . VAL A 1 141 ? 26.806 -6.549 27.236 1.00 31.48 ? 222 VAL A C 1 ATOM 1009 O O . VAL A 1 141 ? 26.480 -6.597 28.420 1.00 31.43 ? 222 VAL A O 1 ATOM 1010 C CB . VAL A 1 141 ? 29.072 -7.576 26.962 1.00 31.82 ? 222 VAL A CB 1 ATOM 1011 C CG1 . VAL A 1 141 ? 28.615 -8.612 25.938 1.00 31.72 ? 222 VAL A CG1 1 ATOM 1012 C CG2 . VAL A 1 141 ? 30.556 -7.279 26.768 1.00 32.21 ? 222 VAL A CG2 1 ATOM 1013 N N . VAL A 1 142 ? 25.954 -6.699 26.234 1.00 31.37 ? 223 VAL A N 1 ATOM 1014 C CA . VAL A 1 142 ? 24.573 -7.093 26.427 1.00 31.07 ? 223 VAL A CA 1 ATOM 1015 C C . VAL A 1 142 ? 24.348 -8.305 25.541 1.00 31.07 ? 223 VAL A C 1 ATOM 1016 O O . VAL A 1 142 ? 24.692 -8.284 24.362 1.00 31.05 ? 223 VAL A O 1 ATOM 1017 C CB . VAL A 1 142 ? 23.591 -5.954 26.026 1.00 31.03 ? 223 VAL A CB 1 ATOM 1018 C CG1 . VAL A 1 142 ? 22.154 -6.358 26.284 1.00 30.77 ? 223 VAL A CG1 1 ATOM 1019 C CG2 . VAL A 1 142 ? 23.913 -4.679 26.776 1.00 30.71 ? 223 VAL A CG2 1 ATOM 1020 N N . ASP A 1 143 ? 23.800 -9.364 26.121 1.00 31.42 ? 224 ASP A N 1 ATOM 1021 C CA . ASP A 1 143 ? 23.375 -10.541 25.374 1.00 31.78 ? 224 ASP A CA 1 ATOM 1022 C C . ASP A 1 143 ? 21.871 -10.692 25.475 1.00 32.12 ? 224 ASP A C 1 ATOM 1023 O O . ASP A 1 143 ? 21.299 -10.556 26.554 1.00 32.01 ? 224 ASP A O 1 ATOM 1024 C CB . ASP A 1 143 ? 24.023 -11.803 25.935 1.00 32.00 ? 224 ASP A CB 1 ATOM 1025 C CG . ASP A 1 143 ? 25.485 -11.912 25.590 1.00 32.94 ? 224 ASP A CG 1 ATOM 1026 O OD1 . ASP A 1 143 ? 26.003 -11.028 24.890 1.00 33.71 ? 224 ASP A OD1 1 ATOM 1027 O OD2 . ASP A 1 143 ? 26.127 -12.893 26.019 1.00 35.48 ? 224 ASP A OD2 1 ATOM 1028 N N . GLU A 1 144 ? 21.249 -10.975 24.338 1.00 32.56 ? 225 GLU A N 1 ATOM 1029 C CA A GLU A 1 144 ? 19.815 -11.191 24.248 0.43 32.93 ? 225 GLU A CA 1 ATOM 1030 C CA B GLU A 1 144 ? 19.811 -11.203 24.257 0.57 32.82 ? 225 GLU A CA 1 ATOM 1031 C C . GLU A 1 144 ? 19.592 -12.600 23.695 1.00 33.06 ? 225 GLU A C 1 ATOM 1032 O O . GLU A 1 144 ? 20.091 -12.926 22.619 1.00 33.23 ? 225 GLU A O 1 ATOM 1033 C CB A GLU A 1 144 ? 19.202 -10.133 23.320 0.43 32.96 ? 225 GLU A CB 1 ATOM 1034 C CB B GLU A 1 144 ? 19.148 -10.130 23.375 0.57 32.76 ? 225 GLU A CB 1 ATOM 1035 C CG A GLU A 1 144 ? 17.717 -9.884 23.496 0.43 33.50 ? 225 GLU A CG 1 ATOM 1036 C CG B GLU A 1 144 ? 17.686 -10.389 22.991 0.57 32.92 ? 225 GLU A CG 1 ATOM 1037 C CD A GLU A 1 144 ? 17.401 -8.899 24.612 0.43 34.37 ? 225 GLU A CD 1 ATOM 1038 C CD B GLU A 1 144 ? 17.521 -11.232 21.726 0.57 32.74 ? 225 GLU A CD 1 ATOM 1039 O OE1 A GLU A 1 144 ? 17.727 -7.694 24.482 0.43 33.64 ? 225 GLU A OE1 1 ATOM 1040 O OE1 B GLU A 1 144 ? 18.317 -11.084 20.777 0.57 32.86 ? 225 GLU A OE1 1 ATOM 1041 O OE2 A GLU A 1 144 ? 16.800 -9.335 25.614 0.43 34.47 ? 225 GLU A OE2 1 ATOM 1042 O OE2 B GLU A 1 144 ? 16.579 -12.045 21.678 0.57 33.51 ? 225 GLU A OE2 1 ATOM 1043 N N . TRP A 1 145 ? 18.860 -13.428 24.434 1.00 33.45 ? 226 TRP A N 1 ATOM 1044 C CA . TRP A 1 145 ? 18.573 -14.803 24.019 1.00 34.27 ? 226 TRP A CA 1 ATOM 1045 C C . TRP A 1 145 ? 17.080 -15.067 23.914 1.00 34.15 ? 226 TRP A C 1 ATOM 1046 O O . TRP A 1 145 ? 16.295 -14.613 24.750 1.00 33.82 ? 226 TRP A O 1 ATOM 1047 C CB . TRP A 1 145 ? 19.145 -15.813 25.012 1.00 35.35 ? 226 TRP A CB 1 ATOM 1048 C CG . TRP A 1 145 ? 20.558 -15.569 25.446 1.00 36.71 ? 226 TRP A CG 1 ATOM 1049 C CD1 . TRP A 1 145 ? 20.984 -14.808 26.514 1.00 37.44 ? 226 TRP A CD1 1 ATOM 1050 C CD2 . TRP A 1 145 ? 21.731 -16.116 24.850 1.00 37.47 ? 226 TRP A CD2 1 ATOM 1051 N NE1 . TRP A 1 145 ? 22.357 -14.847 26.606 1.00 37.91 ? 226 TRP A NE1 1 ATOM 1052 C CE2 . TRP A 1 145 ? 22.842 -15.642 25.597 1.00 38.34 ? 226 TRP A CE2 1 ATOM 1053 C CE3 . TRP A 1 145 ? 21.958 -16.962 23.757 1.00 36.73 ? 226 TRP A CE3 1 ATOM 1054 C CZ2 . TRP A 1 145 ? 24.161 -15.988 25.278 1.00 38.06 ? 226 TRP A CZ2 1 ATOM 1055 C CZ3 . TRP A 1 145 ? 23.270 -17.306 23.440 1.00 37.48 ? 226 TRP A CZ3 1 ATOM 1056 C CH2 . TRP A 1 145 ? 24.355 -16.817 24.196 1.00 37.42 ? 226 TRP A CH2 1 ATOM 1057 N N . LEU A 1 146 ? 16.705 -15.828 22.893 1.00 34.40 ? 227 LEU A N 1 ATOM 1058 C CA . LEU A 1 146 ? 15.325 -16.270 22.712 1.00 35.06 ? 227 LEU A CA 1 ATOM 1059 C C . LEU A 1 146 ? 15.189 -17.759 23.013 1.00 35.55 ? 227 LEU A C 1 ATOM 1060 O O . LEU A 1 146 ? 15.988 -18.562 22.537 1.00 35.62 ? 227 LEU A O 1 ATOM 1061 C CB . LEU A 1 146 ? 14.872 -15.977 21.288 1.00 34.92 ? 227 LEU A CB 1 ATOM 1062 C CG . LEU A 1 146 ? 13.443 -16.241 20.835 1.00 34.00 ? 227 LEU A CG 1 ATOM 1063 C CD1 . LEU A 1 146 ? 12.429 -15.760 21.841 1.00 33.50 ? 227 LEU A CD1 1 ATOM 1064 C CD2 . LEU A 1 146 ? 13.263 -15.521 19.520 1.00 34.69 ? 227 LEU A CD2 1 ATOM 1065 N N . LEU A 1 147 ? 14.186 -18.119 23.809 1.00 36.34 ? 228 LEU A N 1 ATOM 1066 C CA . LEU A 1 147 ? 13.954 -19.526 24.170 1.00 37.29 ? 228 LEU A CA 1 ATOM 1067 C C . LEU A 1 147 ? 12.602 -20.056 23.684 1.00 38.06 ? 228 LEU A C 1 ATOM 1068 O O . LEU A 1 147 ? 11.634 -20.137 24.436 1.00 37.87 ? 228 LEU A O 1 ATOM 1069 C CB . LEU A 1 147 ? 14.149 -19.775 25.680 1.00 36.97 ? 228 LEU A CB 1 ATOM 1070 C CG . LEU A 1 147 ? 15.336 -19.134 26.423 1.00 36.65 ? 228 LEU A CG 1 ATOM 1071 C CD1 . LEU A 1 147 ? 15.323 -19.529 27.894 1.00 36.27 ? 228 LEU A CD1 1 ATOM 1072 C CD2 . LEU A 1 147 ? 16.688 -19.462 25.793 1.00 35.77 ? 228 LEU A CD2 1 ATOM 1073 N N . ASP A 1 148 ? 12.553 -20.358 22.392 1.00 39.50 ? 229 ASP A N 1 ATOM 1074 C CA . ASP A 1 148 ? 11.556 -21.256 21.803 1.00 41.04 ? 229 ASP A CA 1 ATOM 1075 C C . ASP A 1 148 ? 12.365 -22.435 21.274 1.00 41.55 ? 229 ASP A C 1 ATOM 1076 O O . ASP A 1 148 ? 13.552 -22.281 20.978 1.00 42.24 ? 229 ASP A O 1 ATOM 1077 C CB . ASP A 1 148 ? 10.771 -20.554 20.683 1.00 41.12 ? 229 ASP A CB 1 ATOM 1078 C CG . ASP A 1 148 ? 11.670 -19.729 19.742 1.00 42.74 ? 229 ASP A CG 1 ATOM 1079 O OD1 . ASP A 1 148 ? 12.902 -19.955 19.693 1.00 43.22 ? 229 ASP A OD1 1 ATOM 1080 O OD2 . ASP A 1 148 ? 11.139 -18.841 19.035 1.00 44.73 ? 229 ASP A OD2 1 ATOM 1081 N N . LYS A 1 149 ? 11.760 -23.608 21.156 1.00 42.10 ? 230 LYS A N 1 ATOM 1082 C CA . LYS A 1 149 ? 12.493 -24.780 20.663 1.00 42.64 ? 230 LYS A CA 1 ATOM 1083 C C . LYS A 1 149 ? 12.817 -24.656 19.157 1.00 42.77 ? 230 LYS A C 1 ATOM 1084 O O . LYS A 1 149 ? 12.487 -25.542 18.362 1.00 42.82 ? 230 LYS A O 1 ATOM 1085 C CB . LYS A 1 149 ? 11.721 -26.078 20.951 1.00 42.72 ? 230 LYS A CB 1 ATOM 1086 C CG . LYS A 1 149 ? 11.494 -26.400 22.432 1.00 43.41 ? 230 LYS A CG 1 ATOM 1087 C CD . LYS A 1 149 ? 11.208 -27.902 22.610 1.00 45.35 ? 230 LYS A CD 1 ATOM 1088 C CE . LYS A 1 149 ? 10.192 -28.195 23.717 1.00 46.11 ? 230 LYS A CE 1 ATOM 1089 N NZ . LYS A 1 149 ? 10.678 -27.817 25.075 1.00 46.75 ? 230 LYS A NZ 1 ATOM 1090 N N . GLY A 1 150 ? 13.481 -23.562 18.780 1.00 42.93 ? 231 GLY A N 1 ATOM 1091 C CA . GLY A 1 150 ? 13.754 -23.243 17.375 1.00 43.28 ? 231 GLY A CA 1 ATOM 1092 C C . GLY A 1 150 ? 12.456 -23.110 16.601 1.00 43.54 ? 231 GLY A C 1 ATOM 1093 O O . GLY A 1 150 ? 12.073 -24.008 15.841 1.00 43.74 ? 231 GLY A O 1 ATOM 1094 N N . ARG A 1 151 ? 11.771 -21.993 16.811 1.00 43.61 ? 232 ARG A N 1 ATOM 1095 C CA . ARG A 1 151 ? 10.398 -21.842 16.348 1.00 43.72 ? 232 ARG A CA 1 ATOM 1096 C C . ARG A 1 151 ? 10.243 -20.604 15.481 1.00 43.62 ? 232 ARG A C 1 ATOM 1097 O O . ARG A 1 151 ? 9.565 -20.642 14.458 1.00 43.90 ? 232 ARG A O 1 ATOM 1098 C CB . ARG A 1 151 ? 9.445 -21.784 17.543 1.00 43.85 ? 232 ARG A CB 1 ATOM 1099 C CG . ARG A 1 151 ? 8.045 -22.274 17.249 1.00 44.04 ? 232 ARG A CG 1 ATOM 1100 C CD . ARG A 1 151 ? 7.147 -22.132 18.466 1.00 44.03 ? 232 ARG A CD 1 ATOM 1101 N NE . ARG A 1 151 ? 6.871 -23.392 19.158 1.00 43.88 ? 232 ARG A NE 1 ATOM 1102 C CZ . ARG A 1 151 ? 7.472 -23.800 20.276 1.00 44.11 ? 232 ARG A CZ 1 ATOM 1103 N NH1 . ARG A 1 151 ? 8.419 -23.066 20.839 1.00 44.08 ? 232 ARG A NH1 1 ATOM 1104 N NH2 . ARG A 1 151 ? 7.127 -24.956 20.831 1.00 44.08 ? 232 ARG A NH2 1 ATOM 1105 N N . GLN A 1 152 ? 10.873 -19.509 15.892 1.00 43.31 ? 233 GLN A N 1 ATOM 1106 C CA . GLN A 1 152 ? 10.910 -18.306 15.068 1.00 43.01 ? 233 GLN A CA 1 ATOM 1107 C C . GLN A 1 152 ? 11.901 -18.498 13.896 1.00 42.47 ? 233 GLN A C 1 ATOM 1108 O O . GLN A 1 152 ? 12.541 -19.554 13.789 1.00 42.68 ? 233 GLN A O 1 ATOM 1109 C CB . GLN A 1 152 ? 11.198 -17.063 15.935 1.00 42.93 ? 233 GLN A CB 1 ATOM 1110 C CG . GLN A 1 152 ? 10.048 -16.752 16.927 1.00 43.09 ? 233 GLN A CG 1 ATOM 1111 C CD . GLN A 1 152 ? 10.167 -15.412 17.667 1.00 43.40 ? 233 GLN A CD 1 ATOM 1112 O OE1 . GLN A 1 152 ? 11.055 -14.596 17.391 1.00 45.15 ? 233 GLN A OE1 1 ATOM 1113 N NE2 . GLN A 1 152 ? 9.258 -15.184 18.614 1.00 43.00 ? 233 GLN A NE2 1 ATOM 1114 N N . LEU A 1 153 ? 11.989 -17.511 13.001 1.00 41.55 ? 234 LEU A N 1 ATOM 1115 C CA . LEU A 1 153 ? 12.874 -17.590 11.825 1.00 40.39 ? 234 LEU A CA 1 ATOM 1116 C C . LEU A 1 153 ? 14.273 -17.041 12.142 1.00 39.47 ? 234 LEU A C 1 ATOM 1117 O O . LEU A 1 153 ? 14.432 -16.168 12.999 1.00 39.32 ? 234 LEU A O 1 ATOM 1118 C CB . LEU A 1 153 ? 12.248 -16.872 10.616 1.00 40.51 ? 234 LEU A CB 1 ATOM 1119 C CG . LEU A 1 153 ? 10.861 -17.335 10.118 1.00 41.17 ? 234 LEU A CG 1 ATOM 1120 C CD1 . LEU A 1 153 ? 10.223 -16.308 9.169 1.00 41.36 ? 234 LEU A CD1 1 ATOM 1121 C CD2 . LEU A 1 153 ? 10.900 -18.723 9.462 1.00 40.91 ? 234 LEU A CD2 1 ATOM 1122 N N . THR A 1 154 ? 15.282 -17.553 11.445 1.00 38.27 ? 235 THR A N 1 ATOM 1123 C CA . THR A 1 154 ? 16.673 -17.300 11.823 1.00 36.99 ? 235 THR A CA 1 ATOM 1124 C C . THR A 1 154 ? 17.514 -16.606 10.754 1.00 35.79 ? 235 THR A C 1 ATOM 1125 O O . THR A 1 154 ? 18.641 -16.183 11.037 1.00 35.67 ? 235 THR A O 1 ATOM 1126 C CB . THR A 1 154 ? 17.381 -18.615 12.220 1.00 37.16 ? 235 THR A CB 1 ATOM 1127 O OG1 . THR A 1 154 ? 17.009 -19.650 11.303 1.00 37.76 ? 235 THR A OG1 1 ATOM 1128 C CG2 . THR A 1 154 ? 16.981 -19.046 13.625 1.00 37.45 ? 235 THR A CG2 1 ATOM 1129 N N . ILE A 1 155 ? 16.970 -16.476 9.544 1.00 34.23 ? 236 ILE A N 1 ATOM 1130 C CA . ILE A 1 155 ? 17.770 -16.044 8.392 1.00 32.61 ? 236 ILE A CA 1 ATOM 1131 C C . ILE A 1 155 ? 17.435 -14.638 7.922 1.00 31.90 ? 236 ILE A C 1 ATOM 1132 O O . ILE A 1 155 ? 16.292 -14.330 7.591 1.00 31.93 ? 236 ILE A O 1 ATOM 1133 C CB . ILE A 1 155 ? 17.659 -17.027 7.178 1.00 32.67 ? 236 ILE A CB 1 ATOM 1134 C CG1 . ILE A 1 155 ? 17.839 -18.492 7.612 1.00 31.35 ? 236 ILE A CG1 1 ATOM 1135 C CG2 . ILE A 1 155 ? 18.652 -16.641 6.069 1.00 31.92 ? 236 ILE A CG2 1 ATOM 1136 C CD1 . ILE A 1 155 ? 19.277 -18.889 7.900 1.00 30.62 ? 236 ILE A CD1 1 ATOM 1137 N N . PHE A 1 156 ? 18.460 -13.795 7.908 1.00 30.94 ? 237 PHE A N 1 ATOM 1138 C CA . PHE A 1 156 ? 18.420 -12.489 7.279 1.00 29.99 ? 237 PHE A CA 1 ATOM 1139 C C . PHE A 1 156 ? 18.585 -12.777 5.784 1.00 29.98 ? 237 PHE A C 1 ATOM 1140 O O . PHE A 1 156 ? 19.679 -13.127 5.327 1.00 30.20 ? 237 PHE A O 1 ATOM 1141 C CB . PHE A 1 156 ? 19.573 -11.643 7.846 1.00 29.48 ? 237 PHE A CB 1 ATOM 1142 C CG . PHE A 1 156 ? 19.601 -10.198 7.393 1.00 27.99 ? 237 PHE A CG 1 ATOM 1143 C CD1 . PHE A 1 156 ? 18.566 -9.637 6.639 1.00 27.05 ? 237 PHE A CD1 1 ATOM 1144 C CD2 . PHE A 1 156 ? 20.671 -9.384 7.764 1.00 26.16 ? 237 PHE A CD2 1 ATOM 1145 C CE1 . PHE A 1 156 ? 18.615 -8.290 6.238 1.00 26.17 ? 237 PHE A CE1 1 ATOM 1146 C CE2 . PHE A 1 156 ? 20.727 -8.033 7.370 1.00 25.69 ? 237 PHE A CE2 1 ATOM 1147 C CZ . PHE A 1 156 ? 19.703 -7.490 6.605 1.00 26.15 ? 237 PHE A CZ 1 ATOM 1148 N N . ASN A 1 157 ? 17.479 -12.671 5.042 1.00 29.34 ? 238 ASN A N 1 ATOM 1149 C CA . ASN A 1 157 ? 17.415 -13.094 3.643 1.00 28.50 ? 238 ASN A CA 1 ATOM 1150 C C . ASN A 1 157 ? 17.745 -11.985 2.667 1.00 28.07 ? 238 ASN A C 1 ATOM 1151 O O . ASN A 1 157 ? 17.267 -10.869 2.822 1.00 27.92 ? 238 ASN A O 1 ATOM 1152 C CB . ASN A 1 157 ? 16.009 -13.610 3.303 1.00 28.62 ? 238 ASN A CB 1 ATOM 1153 C CG . ASN A 1 157 ? 15.738 -15.006 3.841 1.00 27.99 ? 238 ASN A CG 1 ATOM 1154 O OD1 . ASN A 1 157 ? 15.019 -15.169 4.818 1.00 28.54 ? 238 ASN A OD1 1 ATOM 1155 N ND2 . ASN A 1 157 ? 16.305 -16.013 3.203 1.00 26.91 ? 238 ASN A ND2 1 ATOM 1156 N N . SER A 1 158 ? 18.561 -12.308 1.665 1.00 27.72 ? 239 SER A N 1 ATOM 1157 C CA . SER A 1 158 ? 18.746 -11.475 0.467 1.00 27.46 ? 239 SER A CA 1 ATOM 1158 C C . SER A 1 158 ? 19.201 -10.052 0.762 1.00 27.88 ? 239 SER A C 1 ATOM 1159 O O . SER A 1 158 ? 18.551 -9.088 0.359 1.00 28.17 ? 239 SER A O 1 ATOM 1160 C CB . SER A 1 158 ? 17.462 -11.461 -0.376 1.00 27.07 ? 239 SER A CB 1 ATOM 1161 O OG . SER A 1 158 ? 17.725 -11.066 -1.704 1.00 25.48 ? 239 SER A OG 1 ATOM 1162 N N . GLN A 1 159 ? 20.322 -9.928 1.463 1.00 28.38 ? 240 GLN A N 1 ATOM 1163 C CA . GLN A 1 159 ? 20.907 -8.625 1.793 1.00 28.82 ? 240 GLN A CA 1 ATOM 1164 C C . GLN A 1 159 ? 21.394 -7.880 0.542 1.00 29.13 ? 240 GLN A C 1 ATOM 1165 O O . GLN A 1 159 ? 22.197 -8.411 -0.232 1.00 28.80 ? 240 GLN A O 1 ATOM 1166 C CB . GLN A 1 159 ? 22.030 -8.816 2.800 1.00 28.79 ? 240 GLN A CB 1 ATOM 1167 C CG . GLN A 1 159 ? 21.539 -9.477 4.075 1.00 29.34 ? 240 GLN A CG 1 ATOM 1168 C CD . GLN A 1 159 ? 22.640 -10.146 4.861 1.00 29.68 ? 240 GLN A CD 1 ATOM 1169 O OE1 . GLN A 1 159 ? 23.653 -9.524 5.187 1.00 31.53 ? 240 GLN A OE1 1 ATOM 1170 N NE2 . GLN A 1 159 ? 22.443 -11.418 5.188 1.00 28.85 ? 240 GLN A NE2 1 ATOM 1171 N N . ALA A 1 160 ? 20.888 -6.661 0.350 1.00 29.55 ? 241 ALA A N 1 ATOM 1172 C CA . ALA A 1 160 ? 21.070 -5.935 -0.908 1.00 30.46 ? 241 ALA A CA 1 ATOM 1173 C C . ALA A 1 160 ? 21.885 -4.656 -0.777 1.00 31.13 ? 241 ALA A C 1 ATOM 1174 O O . ALA A 1 160 ? 22.672 -4.330 -1.668 1.00 31.17 ? 241 ALA A O 1 ATOM 1175 C CB . ALA A 1 160 ? 19.719 -5.632 -1.550 1.00 30.49 ? 241 ALA A CB 1 ATOM 1176 N N . THR A 1 161 ? 21.682 -3.926 0.319 1.00 32.01 ? 242 THR A N 1 ATOM 1177 C CA . THR A 1 161 ? 22.388 -2.671 0.560 1.00 32.80 ? 242 THR A CA 1 ATOM 1178 C C . THR A 1 161 ? 22.854 -2.555 2.004 1.00 33.45 ? 242 THR A C 1 ATOM 1179 O O . THR A 1 161 ? 22.156 -2.976 2.937 1.00 33.72 ? 242 THR A O 1 ATOM 1180 C CB . THR A 1 161 ? 21.505 -1.454 0.293 1.00 32.79 ? 242 THR A CB 1 ATOM 1181 O OG1 . THR A 1 161 ? 20.346 -1.524 1.131 1.00 34.13 ? 242 THR A OG1 1 ATOM 1182 C CG2 . THR A 1 161 ? 21.072 -1.378 -1.162 1.00 32.93 ? 242 THR A CG2 1 ATOM 1183 N N . ILE A 1 162 ? 24.053 -2.001 2.168 1.00 33.84 ? 243 ILE A N 1 ATOM 1184 C CA . ILE A 1 162 ? 24.533 -1.516 3.442 1.00 33.83 ? 243 ILE A CA 1 ATOM 1185 C C . ILE A 1 162 ? 24.572 -0.013 3.231 1.00 34.53 ? 243 ILE A C 1 ATOM 1186 O O . ILE A 1 162 ? 25.378 0.480 2.427 1.00 35.20 ? 243 ILE A O 1 ATOM 1187 C CB . ILE A 1 162 ? 25.951 -2.002 3.755 1.00 33.87 ? 243 ILE A CB 1 ATOM 1188 C CG1 . ILE A 1 162 ? 25.983 -3.535 3.893 1.00 34.16 ? 243 ILE A CG1 1 ATOM 1189 C CG2 . ILE A 1 162 ? 26.481 -1.313 5.019 1.00 33.03 ? 243 ILE A CG2 1 ATOM 1190 C CD1 . ILE A 1 162 ? 27.396 -4.146 3.919 1.00 33.38 ? 243 ILE A CD1 1 ATOM 1191 N N . ILE A 1 163 ? 23.685 0.700 3.923 1.00 34.31 ? 244 ILE A N 1 ATOM 1192 C CA . ILE A 1 163 ? 23.591 2.135 3.818 1.00 34.26 ? 244 ILE A CA 1 ATOM 1193 C C . ILE A 1 163 ? 24.066 2.760 5.126 1.00 34.72 ? 244 ILE A C 1 ATOM 1194 O O . ILE A 1 163 ? 23.496 2.495 6.188 1.00 35.22 ? 244 ILE A O 1 ATOM 1195 C CB . ILE A 1 163 ? 22.154 2.565 3.497 1.00 34.07 ? 244 ILE A CB 1 ATOM 1196 C CG1 . ILE A 1 163 ? 21.813 2.202 2.050 1.00 34.44 ? 244 ILE A CG1 1 ATOM 1197 C CG2 . ILE A 1 163 ? 21.992 4.050 3.676 1.00 34.24 ? 244 ILE A CG2 1 ATOM 1198 C CD1 . ILE A 1 163 ? 20.314 2.276 1.704 1.00 33.95 ? 244 ILE A CD1 1 ATOM 1199 N N . ILE A 1 164 ? 25.108 3.587 5.042 1.00 34.61 ? 245 ILE A N 1 ATOM 1200 C CA . ILE A 1 164 ? 25.683 4.248 6.211 1.00 34.63 ? 245 ILE A CA 1 ATOM 1201 C C . ILE A 1 164 ? 25.357 5.750 6.216 1.00 34.65 ? 245 ILE A C 1 ATOM 1202 O O . ILE A 1 164 ? 25.680 6.449 5.264 1.00 35.02 ? 245 ILE A O 1 ATOM 1203 C CB . ILE A 1 164 ? 27.224 4.070 6.242 1.00 34.78 ? 245 ILE A CB 1 ATOM 1204 C CG1 . ILE A 1 164 ? 27.611 2.588 6.183 1.00 34.62 ? 245 ILE A CG1 1 ATOM 1205 C CG2 . ILE A 1 164 ? 27.819 4.718 7.468 1.00 34.30 ? 245 ILE A CG2 1 ATOM 1206 C CD1 . ILE A 1 164 ? 27.884 2.074 4.787 1.00 34.61 ? 245 ILE A CD1 1 ATOM 1207 N N . GLY A 1 165 ? 24.722 6.247 7.272 1.00 34.65 ? 246 GLY A N 1 ATOM 1208 C CA . GLY A 1 165 ? 24.453 7.683 7.372 1.00 35.00 ? 246 GLY A CA 1 ATOM 1209 C C . GLY A 1 165 ? 23.058 8.127 7.781 1.00 35.36 ? 246 GLY A C 1 ATOM 1210 O O . GLY A 1 165 ? 22.878 9.267 8.199 1.00 35.25 ? 246 GLY A O 1 ATOM 1211 N N . GLY A 1 166 ? 22.069 7.248 7.636 1.00 35.48 ? 247 GLY A N 1 ATOM 1212 C CA . GLY A 1 166 ? 20.751 7.473 8.211 1.00 35.92 ? 247 GLY A CA 1 ATOM 1213 C C . GLY A 1 166 ? 19.772 8.373 7.486 1.00 36.75 ? 247 GLY A C 1 ATOM 1214 O O . GLY A 1 166 ? 18.656 8.580 7.965 1.00 36.69 ? 247 GLY A O 1 ATOM 1215 N N . LYS A 1 167 ? 20.156 8.904 6.328 1.00 37.81 ? 248 LYS A N 1 ATOM 1216 C CA . LYS A 1 167 ? 19.268 9.833 5.606 1.00 38.78 ? 248 LYS A CA 1 ATOM 1217 C C . LYS A 1 167 ? 17.920 9.220 5.224 1.00 39.66 ? 248 LYS A C 1 ATOM 1218 O O . LYS A 1 167 ? 16.883 9.846 5.415 1.00 40.05 ? 248 LYS A O 1 ATOM 1219 C CB . LYS A 1 167 ? 19.951 10.440 4.380 1.00 38.48 ? 248 LYS A CB 1 ATOM 1220 C CG . LYS A 1 167 ? 21.121 11.340 4.727 1.00 38.06 ? 248 LYS A CG 1 ATOM 1221 C CD . LYS A 1 167 ? 21.209 12.541 3.801 1.00 37.45 ? 248 LYS A CD 1 ATOM 1222 C CE . LYS A 1 167 ? 20.200 13.604 4.188 1.00 36.81 ? 248 LYS A CE 1 ATOM 1223 N NZ . LYS A 1 167 ? 20.590 14.929 3.671 1.00 35.92 ? 248 LYS A NZ 1 ATOM 1224 N N . GLU A 1 168 ? 17.933 7.991 4.718 1.00 40.78 ? 249 GLU A N 1 ATOM 1225 C CA . GLU A 1 168 ? 16.706 7.345 4.244 1.00 41.90 ? 249 GLU A CA 1 ATOM 1226 C C . GLU A 1 168 ? 15.678 7.088 5.348 1.00 41.99 ? 249 GLU A C 1 ATOM 1227 O O . GLU A 1 168 ? 14.476 6.977 5.068 1.00 42.26 ? 249 GLU A O 1 ATOM 1228 C CB . GLU A 1 168 ? 17.024 6.056 3.484 1.00 42.22 ? 249 GLU A CB 1 ATOM 1229 C CG . GLU A 1 168 ? 18.099 6.250 2.430 1.00 44.74 ? 249 GLU A CG 1 ATOM 1230 C CD . GLU A 1 168 ? 17.912 5.371 1.211 1.00 47.96 ? 249 GLU A CD 1 ATOM 1231 O OE1 . GLU A 1 168 ? 17.782 4.131 1.371 1.00 49.45 ? 249 GLU A OE1 1 ATOM 1232 O OE2 . GLU A 1 168 ? 17.905 5.933 0.091 1.00 48.48 ? 249 GLU A OE2 1 ATOM 1233 N N . GLN A 1 169 ? 16.147 7.001 6.593 1.00 41.89 ? 250 GLN A N 1 ATOM 1234 C CA . GLN A 1 169 ? 15.247 6.878 7.742 1.00 41.89 ? 250 GLN A CA 1 ATOM 1235 C C . GLN A 1 169 ? 14.765 8.224 8.275 1.00 41.43 ? 250 GLN A C 1 ATOM 1236 O O . GLN A 1 169 ? 13.980 8.274 9.221 1.00 41.58 ? 250 GLN A O 1 ATOM 1237 C CB . GLN A 1 169 ? 15.905 6.072 8.865 1.00 42.21 ? 250 GLN A CB 1 ATOM 1238 C CG . GLN A 1 169 ? 15.836 4.562 8.671 1.00 43.81 ? 250 GLN A CG 1 ATOM 1239 C CD . GLN A 1 169 ? 16.502 4.116 7.385 1.00 46.21 ? 250 GLN A CD 1 ATOM 1240 O OE1 . GLN A 1 169 ? 17.717 4.308 7.183 1.00 46.78 ? 250 GLN A OE1 1 ATOM 1241 N NE2 . GLN A 1 169 ? 15.704 3.531 6.492 1.00 46.79 ? 250 GLN A NE2 1 ATOM 1242 N N . GLY A 1 170 ? 15.229 9.312 7.663 1.00 41.02 ? 251 GLY A N 1 ATOM 1243 C CA . GLY A 1 170 ? 14.888 10.664 8.112 1.00 40.21 ? 251 GLY A CA 1 ATOM 1244 C C . GLY A 1 170 ? 15.601 10.984 9.409 1.00 39.74 ? 251 GLY A C 1 ATOM 1245 O O . GLY A 1 170 ? 15.148 11.820 10.190 1.00 39.44 ? 251 GLY A O 1 ATOM 1246 N N . GLN A 1 171 ? 16.725 10.306 9.634 1.00 39.20 ? 252 GLN A N 1 ATOM 1247 C CA . GLN A 1 171 ? 17.497 10.469 10.857 1.00 38.73 ? 252 GLN A CA 1 ATOM 1248 C C . GLN A 1 171 ? 19.020 10.521 10.612 1.00 37.78 ? 252 GLN A C 1 ATOM 1249 O O . GLN A 1 171 ? 19.766 9.681 11.129 1.00 37.66 ? 252 GLN A O 1 ATOM 1250 C CB . GLN A 1 171 ? 17.147 9.345 11.824 1.00 39.16 ? 252 GLN A CB 1 ATOM 1251 C CG . GLN A 1 171 ? 15.765 9.446 12.437 1.00 40.57 ? 252 GLN A CG 1 ATOM 1252 C CD . GLN A 1 171 ? 15.656 8.617 13.696 1.00 42.91 ? 252 GLN A CD 1 ATOM 1253 O OE1 . GLN A 1 171 ? 15.234 7.456 13.649 1.00 43.94 ? 252 GLN A OE1 1 ATOM 1254 N NE2 . GLN A 1 171 ? 16.075 9.192 14.830 1.00 42.27 ? 252 GLN A NE2 1 ATOM 1255 N N . PRO A 1 172 ? 19.491 11.539 9.865 1.00 36.85 ? 253 PRO A N 1 ATOM 1256 C CA . PRO A 1 172 ? 20.872 11.595 9.399 1.00 36.31 ? 253 PRO A CA 1 ATOM 1257 C C . PRO A 1 172 ? 21.890 11.591 10.533 1.00 36.01 ? 253 PRO A C 1 ATOM 1258 O O . PRO A 1 172 ? 21.660 12.183 11.590 1.00 35.64 ? 253 PRO A O 1 ATOM 1259 C CB . PRO A 1 172 ? 20.939 12.933 8.665 1.00 36.31 ? 253 PRO A CB 1 ATOM 1260 C CG . PRO A 1 172 ? 19.551 13.255 8.341 1.00 36.65 ? 253 PRO A CG 1 ATOM 1261 C CD . PRO A 1 172 ? 18.738 12.732 9.454 1.00 36.52 ? 253 PRO A CD 1 ATOM 1262 N N . PHE A 1 173 ? 23.006 10.913 10.301 1.00 35.88 ? 254 PHE A N 1 ATOM 1263 C CA . PHE A 1 173 ? 24.107 10.901 11.237 1.00 35.53 ? 254 PHE A CA 1 ATOM 1264 C C . PHE A 1 173 ? 24.993 12.108 10.948 1.00 35.59 ? 254 PHE A C 1 ATOM 1265 O O . PHE A 1 173 ? 25.245 12.428 9.780 1.00 35.61 ? 254 PHE A O 1 ATOM 1266 C CB . PHE A 1 173 ? 24.910 9.609 11.095 1.00 35.35 ? 254 PHE A CB 1 ATOM 1267 C CG . PHE A 1 173 ? 26.131 9.558 11.972 1.00 35.39 ? 254 PHE A CG 1 ATOM 1268 C CD1 . PHE A 1 173 ? 26.038 9.124 13.287 1.00 35.67 ? 254 PHE A CD1 1 ATOM 1269 C CD2 . PHE A 1 173 ? 27.371 9.963 11.486 1.00 35.49 ? 254 PHE A CD2 1 ATOM 1270 C CE1 . PHE A 1 173 ? 27.162 9.089 14.107 1.00 36.05 ? 254 PHE A CE1 1 ATOM 1271 C CE2 . PHE A 1 173 ? 28.496 9.934 12.293 1.00 35.78 ? 254 PHE A CE2 1 ATOM 1272 C CZ . PHE A 1 173 ? 28.395 9.493 13.607 1.00 35.74 ? 254 PHE A CZ 1 ATOM 1273 N N . GLN A 1 174 ? 25.445 12.778 12.008 1.00 35.33 ? 255 GLN A N 1 ATOM 1274 C CA . GLN A 1 174 ? 26.452 13.827 11.896 1.00 35.54 ? 255 GLN A CA 1 ATOM 1275 C C . GLN A 1 174 ? 27.554 13.525 12.896 1.00 35.53 ? 255 GLN A C 1 ATOM 1276 O O . GLN A 1 174 ? 27.276 13.212 14.052 1.00 36.06 ? 255 GLN A O 1 ATOM 1277 C CB . GLN A 1 174 ? 25.848 15.215 12.138 1.00 35.43 ? 255 GLN A CB 1 ATOM 1278 C CG . GLN A 1 174 ? 26.756 16.356 11.666 1.00 36.06 ? 255 GLN A CG 1 ATOM 1279 C CD . GLN A 1 174 ? 26.106 17.740 11.710 1.00 36.10 ? 255 GLN A CD 1 ATOM 1280 O OE1 . GLN A 1 174 ? 25.007 17.954 11.186 1.00 36.50 ? 255 GLN A OE1 1 ATOM 1281 N NE2 . GLN A 1 174 ? 26.807 18.693 12.309 1.00 36.07 ? 255 GLN A NE2 1 ATOM 1282 N N . GLY A 1 175 ? 28.802 13.598 12.452 1.00 35.25 ? 256 GLY A N 1 ATOM 1283 C CA . GLY A 1 175 ? 29.923 13.192 13.291 1.00 35.33 ? 256 GLY A CA 1 ATOM 1284 C C . GLY A 1 175 ? 30.839 12.233 12.567 1.00 35.42 ? 256 GLY A C 1 ATOM 1285 O O . GLY A 1 175 ? 30.844 12.194 11.345 1.00 36.01 ? 256 GLY A O 1 ATOM 1286 N N . GLN A 1 176 ? 31.604 11.443 13.304 1.00 35.63 ? 257 GLN A N 1 ATOM 1287 C CA . GLN A 1 176 ? 32.599 10.578 12.679 1.00 36.37 ? 257 GLN A CA 1 ATOM 1288 C C . GLN A 1 176 ? 32.250 9.102 12.743 1.00 36.46 ? 257 GLN A C 1 ATOM 1289 O O . GLN A 1 176 ? 31.855 8.601 13.797 1.00 37.01 ? 257 GLN A O 1 ATOM 1290 C CB . GLN A 1 176 ? 33.961 10.805 13.314 1.00 36.29 ? 257 GLN A CB 1 ATOM 1291 C CG . GLN A 1 176 ? 34.562 12.128 12.921 1.00 38.97 ? 257 GLN A CG 1 ATOM 1292 C CD . GLN A 1 176 ? 35.668 12.600 13.858 1.00 42.01 ? 257 GLN A CD 1 ATOM 1293 O OE1 . GLN A 1 176 ? 35.759 13.794 14.171 1.00 42.10 ? 257 GLN A OE1 1 ATOM 1294 N NE2 . GLN A 1 176 ? 36.514 11.666 14.310 1.00 42.56 ? 257 GLN A NE2 1 ATOM 1295 N N . LEU A 1 177 ? 32.395 8.418 11.611 1.00 36.20 ? 258 LEU A N 1 ATOM 1296 C CA . LEU A 1 177 ? 32.314 6.959 11.555 1.00 36.26 ? 258 LEU A CA 1 ATOM 1297 C C . LEU A 1 177 ? 33.638 6.407 11.032 1.00 36.35 ? 258 LEU A C 1 ATOM 1298 O O . LEU A 1 177 ? 34.236 6.987 10.114 1.00 36.30 ? 258 LEU A O 1 ATOM 1299 C CB . LEU A 1 177 ? 31.178 6.508 10.640 1.00 36.05 ? 258 LEU A CB 1 ATOM 1300 C CG . LEU A 1 177 ? 29.743 6.825 11.064 1.00 36.97 ? 258 LEU A CG 1 ATOM 1301 C CD1 . LEU A 1 177 ? 28.761 6.664 9.909 1.00 35.55 ? 258 LEU A CD1 1 ATOM 1302 C CD2 . LEU A 1 177 ? 29.304 5.978 12.257 1.00 38.02 ? 258 LEU A CD2 1 ATOM 1303 N N . SER A 1 178 ? 34.103 5.303 11.618 1.00 36.36 ? 259 SER A N 1 ATOM 1304 C CA . SER A 1 178 ? 35.299 4.603 11.108 1.00 36.49 ? 259 SER A CA 1 ATOM 1305 C C . SER A 1 178 ? 35.263 3.094 11.305 1.00 36.14 ? 259 SER A C 1 ATOM 1306 O O . SER A 1 178 ? 34.518 2.586 12.133 1.00 36.39 ? 259 SER A O 1 ATOM 1307 C CB . SER A 1 178 ? 36.601 5.181 11.688 1.00 36.38 ? 259 SER A CB 1 ATOM 1308 O OG . SER A 1 178 ? 36.482 5.475 13.064 1.00 37.15 ? 259 SER A OG 1 ATOM 1309 N N . GLY A 1 179 ? 36.058 2.389 10.509 1.00 35.89 ? 260 GLY A N 1 ATOM 1310 C CA . GLY A 1 179 ? 36.332 0.978 10.722 1.00 35.80 ? 260 GLY A CA 1 ATOM 1311 C C . GLY A 1 179 ? 35.118 0.086 10.702 1.00 35.75 ? 260 GLY A C 1 ATOM 1312 O O . GLY A 1 179 ? 34.984 -0.796 11.542 1.00 36.31 ? 260 GLY A O 1 ATOM 1313 N N . LEU A 1 180 ? 34.233 0.302 9.742 1.00 35.58 ? 261 LEU A N 1 ATOM 1314 C CA . LEU A 1 180 ? 33.032 -0.519 9.632 1.00 35.64 ? 261 LEU A CA 1 ATOM 1315 C C . LEU A 1 180 ? 33.420 -1.910 9.170 1.00 35.31 ? 261 LEU A C 1 ATOM 1316 O O . LEU A 1 180 ? 34.161 -2.069 8.196 1.00 35.86 ? 261 LEU A O 1 ATOM 1317 C CB . LEU A 1 180 ? 32.059 0.074 8.615 1.00 35.78 ? 261 LEU A CB 1 ATOM 1318 C CG . LEU A 1 180 ? 30.543 -0.135 8.688 1.00 36.34 ? 261 LEU A CG 1 ATOM 1319 C CD1 . LEU A 1 180 ? 29.989 -0.026 7.279 1.00 37.21 ? 261 LEU A CD1 1 ATOM 1320 C CD2 . LEU A 1 180 ? 30.090 -1.432 9.321 1.00 35.75 ? 261 LEU A CD2 1 ATOM 1321 N N . TYR A 1 181 ? 32.932 -2.916 9.873 1.00 34.49 ? 262 TYR A N 1 ATOM 1322 C CA . TYR A 1 181 ? 33.099 -4.277 9.431 1.00 34.04 ? 262 TYR A CA 1 ATOM 1323 C C . TYR A 1 181 ? 31.710 -4.908 9.371 1.00 34.08 ? 262 TYR A C 1 ATOM 1324 O O . TYR A 1 181 ? 30.934 -4.785 10.318 1.00 33.74 ? 262 TYR A O 1 ATOM 1325 C CB . TYR A 1 181 ? 34.033 -5.023 10.394 1.00 33.77 ? 262 TYR A CB 1 ATOM 1326 C CG . TYR A 1 181 ? 34.146 -6.509 10.151 1.00 33.45 ? 262 TYR A CG 1 ATOM 1327 C CD1 . TYR A 1 181 ? 35.321 -7.071 9.635 1.00 32.95 ? 262 TYR A CD1 1 ATOM 1328 C CD2 . TYR A 1 181 ? 33.081 -7.361 10.446 1.00 32.71 ? 262 TYR A CD2 1 ATOM 1329 C CE1 . TYR A 1 181 ? 35.423 -8.440 9.411 1.00 32.44 ? 262 TYR A CE1 1 ATOM 1330 C CE2 . TYR A 1 181 ? 33.169 -8.724 10.220 1.00 33.50 ? 262 TYR A CE2 1 ATOM 1331 C CZ . TYR A 1 181 ? 34.341 -9.261 9.711 1.00 33.44 ? 262 TYR A CZ 1 ATOM 1332 O OH . TYR A 1 181 ? 34.400 -10.622 9.509 1.00 33.24 ? 262 TYR A OH 1 ATOM 1333 N N . TYR A 1 182 ? 31.389 -5.553 8.250 1.00 34.22 ? 263 TYR A N 1 ATOM 1334 C CA . TYR A 1 182 ? 30.157 -6.335 8.147 1.00 34.63 ? 263 TYR A CA 1 ATOM 1335 C C . TYR A 1 182 ? 30.340 -7.635 7.360 1.00 34.97 ? 263 TYR A C 1 ATOM 1336 O O . TYR A 1 182 ? 30.559 -7.606 6.143 1.00 35.04 ? 263 TYR A O 1 ATOM 1337 C CB . TYR A 1 182 ? 29.017 -5.510 7.546 1.00 34.94 ? 263 TYR A CB 1 ATOM 1338 C CG . TYR A 1 182 ? 27.709 -6.267 7.527 1.00 34.90 ? 263 TYR A CG 1 ATOM 1339 C CD1 . TYR A 1 182 ? 26.950 -6.401 8.692 1.00 34.44 ? 263 TYR A CD1 1 ATOM 1340 C CD2 . TYR A 1 182 ? 27.249 -6.880 6.357 1.00 34.92 ? 263 TYR A CD2 1 ATOM 1341 C CE1 . TYR A 1 182 ? 25.764 -7.112 8.699 1.00 35.58 ? 263 TYR A CE1 1 ATOM 1342 C CE2 . TYR A 1 182 ? 26.048 -7.593 6.342 1.00 35.65 ? 263 TYR A CE2 1 ATOM 1343 C CZ . TYR A 1 182 ? 25.313 -7.703 7.522 1.00 36.29 ? 263 TYR A CZ 1 ATOM 1344 O OH . TYR A 1 182 ? 24.131 -8.402 7.539 1.00 36.29 ? 263 TYR A OH 1 ATOM 1345 N N . ASN A 1 183 ? 30.249 -8.769 8.061 1.00 35.10 ? 264 ASN A N 1 ATOM 1346 C CA . ASN A 1 183 ? 30.412 -10.101 7.449 1.00 35.42 ? 264 ASN A CA 1 ATOM 1347 C C . ASN A 1 183 ? 31.611 -10.236 6.496 1.00 35.60 ? 264 ASN A C 1 ATOM 1348 O O . ASN A 1 183 ? 31.494 -10.802 5.402 1.00 35.77 ? 264 ASN A O 1 ATOM 1349 C CB . ASN A 1 183 ? 29.119 -10.545 6.757 1.00 35.25 ? 264 ASN A CB 1 ATOM 1350 C CG . ASN A 1 183 ? 28.001 -10.823 7.738 1.00 36.26 ? 264 ASN A CG 1 ATOM 1351 O OD1 . ASN A 1 183 ? 28.207 -10.830 8.949 1.00 37.79 ? 264 ASN A OD1 1 ATOM 1352 N ND2 . ASN A 1 183 ? 26.807 -11.068 7.218 1.00 37.81 ? 264 ASN A ND2 1 ATOM 1353 N N . GLY A 1 184 ? 32.761 -9.728 6.928 1.00 35.88 ? 265 GLY A N 1 ATOM 1354 C CA . GLY A 1 184 ? 33.972 -9.736 6.107 1.00 36.48 ? 265 GLY A CA 1 ATOM 1355 C C . GLY A 1 184 ? 34.180 -8.485 5.256 1.00 36.79 ? 265 GLY A C 1 ATOM 1356 O O . GLY A 1 184 ? 35.241 -8.305 4.679 1.00 37.16 ? 265 GLY A O 1 ATOM 1357 N N . LEU A 1 185 ? 33.177 -7.620 5.168 1.00 36.73 ? 266 LEU A N 1 ATOM 1358 C CA . LEU A 1 185 ? 33.305 -6.414 4.362 1.00 36.88 ? 266 LEU A CA 1 ATOM 1359 C C . LEU A 1 185 ? 33.801 -5.223 5.183 1.00 36.93 ? 266 LEU A C 1 ATOM 1360 O O . LEU A 1 185 ? 33.125 -4.759 6.108 1.00 37.23 ? 266 LEU A O 1 ATOM 1361 C CB . LEU A 1 185 ? 31.975 -6.069 3.678 1.00 36.83 ? 266 LEU A CB 1 ATOM 1362 C CG . LEU A 1 185 ? 31.347 -7.116 2.758 1.00 37.19 ? 266 LEU A CG 1 ATOM 1363 C CD1 . LEU A 1 185 ? 30.042 -6.596 2.192 1.00 36.18 ? 266 LEU A CD1 1 ATOM 1364 C CD2 . LEU A 1 185 ? 32.320 -7.506 1.629 1.00 38.02 ? 266 LEU A CD2 1 ATOM 1365 N N . LYS A 1 186 ? 34.987 -4.735 4.840 1.00 36.56 ? 267 LYS A N 1 ATOM 1366 C CA . LYS A 1 186 ? 35.504 -3.506 5.423 1.00 36.18 ? 267 LYS A CA 1 ATOM 1367 C C . LYS A 1 186 ? 35.008 -2.319 4.589 1.00 35.95 ? 267 LYS A C 1 ATOM 1368 O O . LYS A 1 186 ? 35.737 -1.781 3.745 1.00 35.79 ? 267 LYS A O 1 ATOM 1369 C CB . LYS A 1 186 ? 37.034 -3.572 5.506 1.00 36.31 ? 267 LYS A CB 1 ATOM 1370 C CG . LYS A 1 186 ? 37.525 -4.486 6.622 1.00 36.59 ? 267 LYS A CG 1 ATOM 1371 C CD . LYS A 1 186 ? 38.958 -4.928 6.437 1.00 38.19 ? 267 LYS A CD 1 ATOM 1372 C CE . LYS A 1 186 ? 39.361 -5.893 7.560 1.00 40.06 ? 267 LYS A CE 1 ATOM 1373 N NZ . LYS A 1 186 ? 40.548 -6.743 7.225 1.00 40.38 ? 267 LYS A NZ 1 ATOM 1374 N N . VAL A 1 187 ? 33.760 -1.918 4.842 1.00 35.50 ? 268 VAL A N 1 ATOM 1375 C CA . VAL A 1 187 ? 33.012 -1.043 3.926 1.00 35.13 ? 268 VAL A CA 1 ATOM 1376 C C . VAL A 1 187 ? 33.573 0.367 3.768 1.00 35.01 ? 268 VAL A C 1 ATOM 1377 O O . VAL A 1 187 ? 33.617 0.899 2.660 1.00 35.13 ? 268 VAL A O 1 ATOM 1378 C CB . VAL A 1 187 ? 31.506 -1.002 4.271 1.00 35.39 ? 268 VAL A CB 1 ATOM 1379 C CG1 . VAL A 1 187 ? 30.711 -0.292 3.176 1.00 34.44 ? 268 VAL A CG1 1 ATOM 1380 C CG2 . VAL A 1 187 ? 30.973 -2.417 4.481 1.00 35.41 ? 268 VAL A CG2 1 ATOM 1381 N N . LEU A 1 188 ? 34.014 0.979 4.857 1.00 34.97 ? 269 LEU A N 1 ATOM 1382 C CA . LEU A 1 188 ? 34.632 2.297 4.747 1.00 34.69 ? 269 LEU A CA 1 ATOM 1383 C C . LEU A 1 188 ? 36.028 2.245 4.120 1.00 35.08 ? 269 LEU A C 1 ATOM 1384 O O . LEU A 1 188 ? 36.445 3.203 3.460 1.00 35.23 ? 269 LEU A O 1 ATOM 1385 C CB . LEU A 1 188 ? 34.642 3.018 6.092 1.00 34.46 ? 269 LEU A CB 1 ATOM 1386 C CG . LEU A 1 188 ? 33.266 3.275 6.721 1.00 33.18 ? 269 LEU A CG 1 ATOM 1387 C CD1 . LEU A 1 188 ? 33.412 3.804 8.137 1.00 31.50 ? 269 LEU A CD1 1 ATOM 1388 C CD2 . LEU A 1 188 ? 32.431 4.216 5.873 1.00 30.82 ? 269 LEU A CD2 1 ATOM 1389 N N . ASN A 1 189 ? 36.744 1.135 4.302 1.00 35.37 ? 270 ASN A N 1 ATOM 1390 C CA . ASN A 1 189 ? 38.022 0.950 3.597 1.00 35.77 ? 270 ASN A CA 1 ATOM 1391 C C . ASN A 1 189 ? 37.811 0.765 2.090 1.00 35.74 ? 270 ASN A C 1 ATOM 1392 O O . ASN A 1 189 ? 38.589 1.254 1.276 1.00 35.52 ? 270 ASN A O 1 ATOM 1393 C CB . ASN A 1 189 ? 38.821 -0.229 4.163 1.00 36.01 ? 270 ASN A CB 1 ATOM 1394 C CG . ASN A 1 189 ? 39.296 -0.001 5.595 1.00 36.90 ? 270 ASN A CG 1 ATOM 1395 O OD1 . ASN A 1 189 ? 38.607 0.613 6.417 1.00 39.17 ? 270 ASN A OD1 1 ATOM 1396 N ND2 . ASN A 1 189 ? 40.468 -0.533 5.908 1.00 37.29 ? 270 ASN A ND2 1 ATOM 1397 N N . MET A 1 190 ? 36.743 0.063 1.729 1.00 35.92 ? 271 MET A N 1 ATOM 1398 C CA . MET A 1 190 ? 36.401 -0.154 0.332 1.00 36.27 ? 271 MET A CA 1 ATOM 1399 C C . MET A 1 190 ? 35.933 1.138 -0.325 1.00 36.08 ? 271 MET A C 1 ATOM 1400 O O . MET A 1 190 ? 36.198 1.371 -1.508 1.00 36.09 ? 271 MET A O 1 ATOM 1401 C CB . MET A 1 190 ? 35.329 -1.224 0.210 1.00 36.28 ? 271 MET A CB 1 ATOM 1402 C CG . MET A 1 190 ? 35.823 -2.598 0.548 1.00 36.25 ? 271 MET A CG 1 ATOM 1403 S SD . MET A 1 190 ? 34.493 -3.800 0.505 1.00 37.57 ? 271 MET A SD 1 ATOM 1404 C CE . MET A 1 190 ? 35.346 -5.186 1.259 1.00 37.89 ? 271 MET A CE 1 ATOM 1405 N N . ALA A 1 191 ? 35.240 1.971 0.451 1.00 35.93 ? 272 ALA A N 1 ATOM 1406 C CA . ALA A 1 191 ? 34.854 3.312 0.010 1.00 35.60 ? 272 ALA A CA 1 ATOM 1407 C C . ALA A 1 191 ? 36.095 4.126 -0.317 1.00 35.38 ? 272 ALA A C 1 ATOM 1408 O O . ALA A 1 191 ? 36.193 4.705 -1.399 1.00 35.31 ? 272 ALA A O 1 ATOM 1409 C CB . ALA A 1 191 ? 34.029 4.007 1.082 1.00 35.52 ? 272 ALA A CB 1 ATOM 1410 N N . ALA A 1 192 ? 37.048 4.135 0.613 1.00 35.26 ? 273 ALA A N 1 ATOM 1411 C CA . ALA A 1 192 ? 38.313 4.855 0.444 1.00 35.42 ? 273 ALA A CA 1 ATOM 1412 C C . ALA A 1 192 ? 39.104 4.399 -0.780 1.00 35.48 ? 273 ALA A C 1 ATOM 1413 O O . ALA A 1 192 ? 39.745 5.215 -1.436 1.00 35.39 ? 273 ALA A O 1 ATOM 1414 C CB . ALA A 1 192 ? 39.166 4.748 1.708 1.00 35.24 ? 273 ALA A CB 1 ATOM 1415 N N . GLU A 1 193 ? 39.042 3.103 -1.084 1.00 35.87 ? 274 GLU A N 1 ATOM 1416 C CA . GLU A 1 193 ? 39.751 2.518 -2.226 1.00 36.44 ? 274 GLU A CA 1 ATOM 1417 C C . GLU A 1 193 ? 38.934 2.566 -3.511 1.00 36.71 ? 274 GLU A C 1 ATOM 1418 O O . GLU A 1 193 ? 39.241 1.859 -4.463 1.00 36.80 ? 274 GLU A O 1 ATOM 1419 C CB . GLU A 1 193 ? 40.139 1.069 -1.928 1.00 36.46 ? 274 GLU A CB 1 ATOM 1420 C CG . GLU A 1 193 ? 41.176 0.917 -0.826 1.00 37.52 ? 274 GLU A CG 1 ATOM 1421 C CD . GLU A 1 193 ? 40.987 -0.347 0.010 1.00 38.85 ? 274 GLU A CD 1 ATOM 1422 O OE1 . GLU A 1 193 ? 40.009 -1.101 -0.225 1.00 38.38 ? 274 GLU A OE1 1 ATOM 1423 O OE2 . GLU A 1 193 ? 41.820 -0.575 0.919 1.00 39.35 ? 274 GLU A OE2 1 ATOM 1424 N N . ASN A 1 194 ? 37.889 3.392 -3.521 1.00 37.27 ? 275 ASN A N 1 ATOM 1425 C CA . ASN A 1 194 ? 37.024 3.609 -4.697 1.00 37.84 ? 275 ASN A CA 1 ATOM 1426 C C . ASN A 1 194 ? 36.427 2.329 -5.310 1.00 37.87 ? 275 ASN A C 1 ATOM 1427 O O . ASN A 1 194 ? 36.509 2.104 -6.520 1.00 38.07 ? 275 ASN A O 1 ATOM 1428 C CB . ASN A 1 194 ? 37.736 4.459 -5.766 1.00 37.76 ? 275 ASN A CB 1 ATOM 1429 C CG . ASN A 1 194 ? 38.505 5.626 -5.170 1.00 38.52 ? 275 ASN A CG 1 ATOM 1430 O OD1 . ASN A 1 194 ? 37.925 6.511 -4.541 1.00 39.44 ? 275 ASN A OD1 1 ATOM 1431 N ND2 . ASN A 1 194 ? 39.823 5.633 -5.371 1.00 39.33 ? 275 ASN A ND2 1 ATOM 1432 N N . ASP A 1 195 ? 35.831 1.508 -4.450 1.00 38.02 ? 276 ASP A N 1 ATOM 1433 C CA . ASP A 1 195 ? 35.156 0.271 -4.833 1.00 38.23 ? 276 ASP A CA 1 ATOM 1434 C C . ASP A 1 195 ? 33.987 0.583 -5.761 1.00 38.18 ? 276 ASP A C 1 ATOM 1435 O O . ASP A 1 195 ? 33.209 1.505 -5.491 1.00 38.66 ? 276 ASP A O 1 ATOM 1436 C CB . ASP A 1 195 ? 34.649 -0.424 -3.566 1.00 38.45 ? 276 ASP A CB 1 ATOM 1437 C CG . ASP A 1 195 ? 34.095 -1.806 -3.827 1.00 39.63 ? 276 ASP A CG 1 ATOM 1438 O OD1 . ASP A 1 195 ? 34.784 -2.786 -3.469 1.00 40.98 ? 276 ASP A OD1 1 ATOM 1439 O OD2 . ASP A 1 195 ? 32.977 -1.920 -4.383 1.00 40.74 ? 276 ASP A OD2 1 ATOM 1440 N N . ALA A 1 196 ? 33.855 -0.192 -6.839 1.00 37.81 ? 277 ALA A N 1 ATOM 1441 C CA . ALA A 1 196 ? 32.815 0.035 -7.856 1.00 37.30 ? 277 ALA A CA 1 ATOM 1442 C C . ALA A 1 196 ? 31.380 -0.082 -7.322 1.00 36.90 ? 277 ALA A C 1 ATOM 1443 O O . ALA A 1 196 ? 30.445 0.440 -7.930 1.00 37.16 ? 277 ALA A O 1 ATOM 1444 C CB . ALA A 1 196 ? 33.013 -0.913 -9.036 1.00 37.21 ? 277 ALA A CB 1 ATOM 1445 N N . ASN A 1 197 ? 31.218 -0.766 -6.193 1.00 36.01 ? 278 ASN A N 1 ATOM 1446 C CA . ASN A 1 197 ? 29.899 -1.062 -5.630 1.00 35.25 ? 278 ASN A CA 1 ATOM 1447 C C . ASN A 1 197 ? 29.493 -0.102 -4.508 1.00 34.54 ? 278 ASN A C 1 ATOM 1448 O O . ASN A 1 197 ? 28.508 -0.335 -3.796 1.00 33.93 ? 278 ASN A O 1 ATOM 1449 C CB . ASN A 1 197 ? 29.869 -2.512 -5.124 1.00 35.47 ? 278 ASN A CB 1 ATOM 1450 C CG . ASN A 1 197 ? 30.072 -3.523 -6.241 1.00 35.56 ? 278 ASN A CG 1 ATOM 1451 O OD1 . ASN A 1 197 ? 29.225 -3.670 -7.118 1.00 35.98 ? 278 ASN A OD1 1 ATOM 1452 N ND2 . ASN A 1 197 ? 31.199 -4.220 -6.212 1.00 35.92 ? 278 ASN A ND2 1 ATOM 1453 N N . ILE A 1 198 ? 30.268 0.972 -4.368 1.00 33.62 ? 279 ILE A N 1 ATOM 1454 C CA . ILE A 1 198 ? 30.050 1.991 -3.349 1.00 32.60 ? 279 ILE A CA 1 ATOM 1455 C C . ILE A 1 198 ? 29.677 3.315 -4.037 1.00 32.04 ? 279 ILE A C 1 ATOM 1456 O O . ILE A 1 198 ? 30.264 3.683 -5.051 1.00 31.50 ? 279 ILE A O 1 ATOM 1457 C CB . ILE A 1 198 ? 31.333 2.182 -2.485 1.00 32.74 ? 279 ILE A CB 1 ATOM 1458 C CG1 . ILE A 1 198 ? 31.783 0.846 -1.851 1.00 32.92 ? 279 ILE A CG1 1 ATOM 1459 C CG2 . ILE A 1 198 ? 31.175 3.330 -1.486 1.00 31.58 ? 279 ILE A CG2 1 ATOM 1460 C CD1 . ILE A 1 198 ? 31.525 0.676 -0.369 1.00 32.07 ? 279 ILE A CD1 1 ATOM 1461 N N . ALA A 1 199 ? 28.675 3.997 -3.488 1.00 31.62 ? 280 ALA A N 1 ATOM 1462 C CA . ALA A 1 199 ? 28.317 5.355 -3.881 1.00 31.16 ? 280 ALA A CA 1 ATOM 1463 C C . ALA A 1 199 ? 28.374 6.260 -2.655 1.00 31.04 ? 280 ALA A C 1 ATOM 1464 O O . ALA A 1 199 ? 27.912 5.881 -1.585 1.00 30.93 ? 280 ALA A O 1 ATOM 1465 C CB . ALA A 1 199 ? 26.928 5.389 -4.491 1.00 31.03 ? 280 ALA A CB 1 ATOM 1466 N N . ILE A 1 200 ? 28.952 7.449 -2.808 1.00 30.98 ? 281 ILE A N 1 ATOM 1467 C CA . ILE A 1 200 ? 28.947 8.437 -1.733 1.00 31.03 ? 281 ILE A CA 1 ATOM 1468 C C . ILE A 1 200 ? 28.198 9.699 -2.161 1.00 30.79 ? 281 ILE A C 1 ATOM 1469 O O . ILE A 1 200 ? 28.499 10.287 -3.196 1.00 30.79 ? 281 ILE A O 1 ATOM 1470 C CB . ILE A 1 200 ? 30.376 8.766 -1.220 1.00 30.93 ? 281 ILE A CB 1 ATOM 1471 C CG1 . ILE A 1 200 ? 31.112 7.461 -0.841 1.00 32.11 ? 281 ILE A CG1 1 ATOM 1472 C CG2 . ILE A 1 200 ? 30.295 9.717 -0.027 1.00 30.18 ? 281 ILE A CG2 1 ATOM 1473 C CD1 . ILE A 1 200 ? 32.599 7.614 -0.436 1.00 31.44 ? 281 ILE A CD1 1 ATOM 1474 N N . VAL A 1 201 ? 27.207 10.089 -1.363 1.00 30.73 ? 282 VAL A N 1 ATOM 1475 C CA . VAL A 1 201 ? 26.429 11.308 -1.612 1.00 30.64 ? 282 VAL A CA 1 ATOM 1476 C C . VAL A 1 201 ? 26.315 12.151 -0.340 1.00 30.90 ? 282 VAL A C 1 ATOM 1477 O O . VAL A 1 201 ? 26.485 11.628 0.762 1.00 31.21 ? 282 VAL A O 1 ATOM 1478 C CB . VAL A 1 201 ? 25.001 11.012 -2.203 1.00 30.51 ? 282 VAL A CB 1 ATOM 1479 C CG1 . VAL A 1 201 ? 25.090 10.285 -3.547 1.00 29.77 ? 282 VAL A CG1 1 ATOM 1480 C CG2 . VAL A 1 201 ? 24.158 10.236 -1.233 1.00 29.87 ? 282 VAL A CG2 1 ATOM 1481 N N . GLY A 1 202 ? 26.042 13.447 -0.501 1.00 31.06 ? 283 GLY A N 1 ATOM 1482 C CA . GLY A 1 202 ? 25.901 14.371 0.619 1.00 31.06 ? 283 GLY A CA 1 ATOM 1483 C C . GLY A 1 202 ? 27.214 14.982 1.084 1.00 31.64 ? 283 GLY A C 1 ATOM 1484 O O . GLY A 1 202 ? 28.222 14.972 0.361 1.00 31.63 ? 283 GLY A O 1 ATOM 1485 N N . ASN A 1 203 ? 27.192 15.520 2.303 1.00 31.93 ? 284 ASN A N 1 ATOM 1486 C CA . ASN A 1 203 ? 28.339 16.194 2.894 1.00 32.08 ? 284 ASN A CA 1 ATOM 1487 C C . ASN A 1 203 ? 29.165 15.204 3.710 1.00 32.55 ? 284 ASN A C 1 ATOM 1488 O O . ASN A 1 203 ? 29.204 15.264 4.946 1.00 32.57 ? 284 ASN A O 1 ATOM 1489 C CB . ASN A 1 203 ? 27.863 17.356 3.766 1.00 31.97 ? 284 ASN A CB 1 ATOM 1490 C CG . ASN A 1 203 ? 28.962 18.371 4.050 1.00 32.36 ? 284 ASN A CG 1 ATOM 1491 O OD1 . ASN A 1 203 ? 30.142 18.130 3.785 1.00 32.94 ? 284 ASN A OD1 1 ATOM 1492 N ND2 . ASN A 1 203 ? 28.574 19.515 4.603 1.00 31.77 ? 284 ASN A ND2 1 ATOM 1493 N N . VAL A 1 204 ? 29.803 14.278 2.996 1.00 33.04 ? 285 VAL A N 1 ATOM 1494 C CA . VAL A 1 204 ? 30.629 13.229 3.582 1.00 33.48 ? 285 VAL A CA 1 ATOM 1495 C C . VAL A 1 204 ? 32.008 13.340 2.962 1.00 34.35 ? 285 VAL A C 1 ATOM 1496 O O . VAL A 1 204 ? 32.127 13.553 1.758 1.00 34.74 ? 285 VAL A O 1 ATOM 1497 C CB . VAL A 1 204 ? 30.060 11.833 3.255 1.00 33.33 ? 285 VAL A CB 1 ATOM 1498 C CG1 . VAL A 1 204 ? 30.867 10.723 3.933 1.00 32.57 ? 285 VAL A CG1 1 ATOM 1499 C CG2 . VAL A 1 204 ? 28.617 11.751 3.665 1.00 33.32 ? 285 VAL A CG2 1 ATOM 1500 N N . ARG A 1 205 ? 33.046 13.196 3.773 1.00 35.15 ? 286 ARG A N 1 ATOM 1501 C CA . ARG A 1 205 ? 34.409 13.188 3.263 1.00 36.59 ? 286 ARG A CA 1 ATOM 1502 C C . ARG A 1 205 ? 35.305 12.239 4.047 1.00 36.59 ? 286 ARG A C 1 ATOM 1503 O O . ARG A 1 205 ? 35.075 11.974 5.232 1.00 36.76 ? 286 ARG A O 1 ATOM 1504 C CB . ARG A 1 205 ? 35.005 14.596 3.251 1.00 36.55 ? 286 ARG A CB 1 ATOM 1505 C CG . ARG A 1 205 ? 34.756 15.414 4.519 1.00 38.20 ? 286 ARG A CG 1 ATOM 1506 C CD . ARG A 1 205 ? 35.505 16.744 4.472 1.00 39.11 ? 286 ARG A CD 1 ATOM 1507 N NE . ARG A 1 205 ? 34.912 17.736 5.376 1.00 45.42 ? 286 ARG A NE 1 ATOM 1508 C CZ . ARG A 1 205 ? 34.230 18.818 4.986 1.00 47.07 ? 286 ARG A CZ 1 ATOM 1509 N NH1 . ARG A 1 205 ? 34.048 19.087 3.689 1.00 47.34 ? 286 ARG A NH1 1 ATOM 1510 N NH2 . ARG A 1 205 ? 33.732 19.642 5.903 1.00 47.63 ? 286 ARG A NH2 1 ATOM 1511 N N . LEU A 1 206 ? 36.320 11.725 3.360 1.00 36.84 ? 287 LEU A N 1 ATOM 1512 C CA . LEU A 1 206 ? 37.327 10.860 3.948 1.00 36.82 ? 287 LEU A CA 1 ATOM 1513 C C . LEU A 1 206 ? 38.351 11.701 4.706 1.00 37.23 ? 287 LEU A C 1 ATOM 1514 O O . LEU A 1 206 ? 38.876 12.668 4.162 1.00 37.17 ? 287 LEU A O 1 ATOM 1515 C CB . LEU A 1 206 ? 38.008 10.072 2.825 1.00 36.82 ? 287 LEU A CB 1 ATOM 1516 C CG . LEU A 1 206 ? 39.207 9.153 3.063 1.00 36.24 ? 287 LEU A CG 1 ATOM 1517 C CD1 . LEU A 1 206 ? 38.831 7.953 3.915 1.00 35.61 ? 287 LEU A CD1 1 ATOM 1518 C CD2 . LEU A 1 206 ? 39.758 8.712 1.717 1.00 36.30 ? 287 LEU A CD2 1 ATOM 1519 N N . VAL A 1 207 ? 38.619 11.345 5.963 1.00 37.66 ? 288 VAL A N 1 ATOM 1520 C CA . VAL A 1 207 ? 39.731 11.942 6.712 1.00 38.15 ? 288 VAL A CA 1 ATOM 1521 C C . VAL A 1 207 ? 41.046 11.525 6.067 1.00 38.42 ? 288 VAL A C 1 ATOM 1522 O O . VAL A 1 207 ? 41.252 10.342 5.778 1.00 38.65 ? 288 VAL A O 1 ATOM 1523 C CB . VAL A 1 207 ? 39.757 11.507 8.198 1.00 38.28 ? 288 VAL A CB 1 ATOM 1524 C CG1 . VAL A 1 207 ? 41.119 11.843 8.846 1.00 38.62 ? 288 VAL A CG1 1 ATOM 1525 C CG2 . VAL A 1 207 ? 38.645 12.172 8.964 1.00 37.93 ? 288 VAL A CG2 1 ATOM 1526 O OXT . VAL A 1 207 ? 41.923 12.355 5.825 1.00 38.51 ? 288 VAL A OXT 1 ATOM 1527 N N . GLY B 1 3 ? 3.696 -19.577 43.851 1.00 41.46 ? 84 GLY B N 1 ATOM 1528 C CA . GLY B 1 3 ? 3.403 -19.989 45.262 1.00 41.51 ? 84 GLY B CA 1 ATOM 1529 C C . GLY B 1 3 ? 2.164 -19.323 45.843 1.00 41.35 ? 84 GLY B C 1 ATOM 1530 O O . GLY B 1 3 ? 1.035 -19.649 45.446 1.00 41.44 ? 84 GLY B O 1 ATOM 1531 N N . SER B 1 4 ? 2.377 -18.396 46.784 1.00 40.89 ? 85 SER B N 1 ATOM 1532 C CA . SER B 1 4 ? 1.288 -17.625 47.398 1.00 40.17 ? 85 SER B CA 1 ATOM 1533 C C . SER B 1 4 ? 1.038 -16.321 46.639 1.00 39.61 ? 85 SER B C 1 ATOM 1534 O O . SER B 1 4 ? 1.958 -15.539 46.411 1.00 39.48 ? 85 SER B O 1 ATOM 1535 C CB . SER B 1 4 ? 1.583 -17.338 48.871 1.00 40.31 ? 85 SER B CB 1 ATOM 1536 O OG . SER B 1 4 ? 1.299 -18.463 49.687 1.00 40.33 ? 85 SER B OG 1 ATOM 1537 N N . THR B 1 5 ? -0.223 -16.102 46.272 1.00 39.00 ? 86 THR B N 1 ATOM 1538 C CA . THR B 1 5 ? -0.618 -15.046 45.340 1.00 38.34 ? 86 THR B CA 1 ATOM 1539 C C . THR B 1 5 ? -1.420 -13.939 46.016 1.00 37.92 ? 86 THR B C 1 ATOM 1540 O O . THR B 1 5 ? -2.279 -14.202 46.848 1.00 37.85 ? 86 THR B O 1 ATOM 1541 C CB . THR B 1 5 ? -1.460 -15.628 44.178 1.00 38.32 ? 86 THR B CB 1 ATOM 1542 O OG1 . THR B 1 5 ? -0.804 -16.779 43.637 1.00 38.35 ? 86 THR B OG1 1 ATOM 1543 C CG2 . THR B 1 5 ? -1.662 -14.604 43.073 1.00 38.09 ? 86 THR B CG2 1 ATOM 1544 N N . TYR B 1 6 ? -1.133 -12.701 45.628 1.00 37.67 ? 87 TYR B N 1 ATOM 1545 C CA . TYR B 1 6 ? -1.817 -11.526 46.148 1.00 37.39 ? 87 TYR B CA 1 ATOM 1546 C C . TYR B 1 6 ? -2.332 -10.649 45.012 1.00 37.39 ? 87 TYR B C 1 ATOM 1547 O O . TYR B 1 6 ? -1.621 -10.409 44.034 1.00 37.37 ? 87 TYR B O 1 ATOM 1548 C CB . TYR B 1 6 ? -0.863 -10.702 47.021 1.00 37.19 ? 87 TYR B CB 1 ATOM 1549 C CG . TYR B 1 6 ? -0.720 -11.191 48.442 1.00 36.91 ? 87 TYR B CG 1 ATOM 1550 C CD1 . TYR B 1 6 ? 0.205 -12.184 48.773 1.00 36.73 ? 87 TYR B CD1 1 ATOM 1551 C CD2 . TYR B 1 6 ? -1.496 -10.644 49.465 1.00 36.63 ? 87 TYR B CD2 1 ATOM 1552 C CE1 . TYR B 1 6 ? 0.342 -12.631 50.092 1.00 36.84 ? 87 TYR B CE1 1 ATOM 1553 C CE2 . TYR B 1 6 ? -1.366 -11.082 50.781 1.00 36.63 ? 87 TYR B CE2 1 ATOM 1554 C CZ . TYR B 1 6 ? -0.448 -12.075 51.087 1.00 36.68 ? 87 TYR B CZ 1 ATOM 1555 O OH . TYR B 1 6 ? -0.324 -12.505 52.386 1.00 36.52 ? 87 TYR B OH 1 ATOM 1556 N N . ILE B 1 7 ? -3.560 -10.162 45.159 1.00 37.41 ? 88 ILE B N 1 ATOM 1557 C CA . ILE B 1 7 ? -4.148 -9.219 44.207 1.00 37.48 ? 88 ILE B CA 1 ATOM 1558 C C . ILE B 1 7 ? -4.067 -7.783 44.746 1.00 37.46 ? 88 ILE B C 1 ATOM 1559 O O . ILE B 1 7 ? -4.358 -7.526 45.922 1.00 37.18 ? 88 ILE B O 1 ATOM 1560 C CB . ILE B 1 7 ? -5.630 -9.579 43.867 1.00 37.52 ? 88 ILE B CB 1 ATOM 1561 C CG1 . ILE B 1 7 ? -5.767 -11.066 43.523 1.00 37.69 ? 88 ILE B CG1 1 ATOM 1562 C CG2 . ILE B 1 7 ? -6.162 -8.708 42.720 1.00 37.34 ? 88 ILE B CG2 1 ATOM 1563 C CD1 . ILE B 1 7 ? -7.197 -11.584 43.548 1.00 37.61 ? 88 ILE B CD1 1 ATOM 1564 N N . PHE B 1 8 ? -3.664 -6.860 43.873 1.00 37.57 ? 89 PHE B N 1 ATOM 1565 C CA . PHE B 1 8 ? -3.640 -5.429 44.185 1.00 37.74 ? 89 PHE B CA 1 ATOM 1566 C C . PHE B 1 8 ? -4.718 -4.729 43.373 1.00 37.92 ? 89 PHE B C 1 ATOM 1567 O O . PHE B 1 8 ? -4.607 -4.619 42.149 1.00 38.08 ? 89 PHE B O 1 ATOM 1568 C CB . PHE B 1 8 ? -2.271 -4.821 43.856 1.00 37.65 ? 89 PHE B CB 1 ATOM 1569 C CG . PHE B 1 8 ? -1.163 -5.253 44.780 1.00 37.31 ? 89 PHE B CG 1 ATOM 1570 C CD1 . PHE B 1 8 ? -0.652 -4.371 45.726 1.00 37.30 ? 89 PHE B CD1 1 ATOM 1571 C CD2 . PHE B 1 8 ? -0.617 -6.532 44.692 1.00 37.09 ? 89 PHE B CD2 1 ATOM 1572 C CE1 . PHE B 1 8 ? 0.383 -4.761 46.578 1.00 37.70 ? 89 PHE B CE1 1 ATOM 1573 C CE2 . PHE B 1 8 ? 0.412 -6.934 45.537 1.00 37.33 ? 89 PHE B CE2 1 ATOM 1574 C CZ . PHE B 1 8 ? 0.918 -6.045 46.480 1.00 37.73 ? 89 PHE B CZ 1 ATOM 1575 N N . SER B 1 9 ? -5.759 -4.258 44.054 1.00 38.08 ? 90 SER B N 1 ATOM 1576 C CA . SER B 1 9 ? -6.916 -3.665 43.386 1.00 38.23 ? 90 SER B CA 1 ATOM 1577 C C . SER B 1 9 ? -6.705 -2.180 43.077 1.00 38.35 ? 90 SER B C 1 ATOM 1578 O O . SER B 1 9 ? -5.567 -1.709 43.034 1.00 38.52 ? 90 SER B O 1 ATOM 1579 C CB . SER B 1 9 ? -8.182 -3.884 44.224 1.00 38.32 ? 90 SER B CB 1 ATOM 1580 O OG . SER B 1 9 ? -8.347 -5.252 44.562 1.00 38.31 ? 90 SER B OG 1 ATOM 1581 N N . LYS B 1 10 ? -7.805 -1.459 42.855 1.00 38.52 ? 91 LYS B N 1 ATOM 1582 C CA . LYS B 1 10 ? -7.779 -0.033 42.512 1.00 38.63 ? 91 LYS B CA 1 ATOM 1583 C C . LYS B 1 10 ? -7.459 0.859 43.716 1.00 38.61 ? 91 LYS B C 1 ATOM 1584 O O . LYS B 1 10 ? -8.142 0.802 44.744 1.00 38.62 ? 91 LYS B O 1 ATOM 1585 C CB . LYS B 1 10 ? -9.108 0.383 41.865 1.00 38.68 ? 91 LYS B CB 1 ATOM 1586 C CG . LYS B 1 10 ? -9.208 0.043 40.375 1.00 38.91 ? 91 LYS B CG 1 ATOM 1587 C CD . LYS B 1 10 ? -10.654 0.028 39.872 1.00 38.86 ? 91 LYS B CD 1 ATOM 1588 C CE . LYS B 1 10 ? -11.239 -1.385 39.862 1.00 39.03 ? 91 LYS B CE 1 ATOM 1589 N NZ . LYS B 1 10 ? -12.549 -1.451 39.147 1.00 38.37 ? 91 LYS B NZ 1 ATOM 1590 N N . GLY B 1 11 ? -6.420 1.683 43.568 1.00 38.56 ? 92 GLY B N 1 ATOM 1591 C CA . GLY B 1 11 ? -5.926 2.543 44.646 1.00 38.56 ? 92 GLY B CA 1 ATOM 1592 C C . GLY B 1 11 ? -4.468 2.271 44.986 1.00 38.71 ? 92 GLY B C 1 ATOM 1593 O O . GLY B 1 11 ? -3.671 3.200 45.154 1.00 38.76 ? 92 GLY B O 1 ATOM 1594 N N . GLY B 1 12 ? -4.121 0.988 45.081 1.00 38.65 ? 93 GLY B N 1 ATOM 1595 C CA . GLY B 1 12 ? -2.774 0.565 45.433 1.00 38.57 ? 93 GLY B CA 1 ATOM 1596 C C . GLY B 1 12 ? -2.675 0.042 46.854 1.00 38.66 ? 93 GLY B C 1 ATOM 1597 O O . GLY B 1 12 ? -3.420 0.476 47.741 1.00 38.75 ? 93 GLY B O 1 ATOM 1598 N N . GLY B 1 13 ? -1.749 -0.894 47.062 1.00 38.61 ? 94 GLY B N 1 ATOM 1599 C CA . GLY B 1 13 ? -1.474 -1.476 48.379 1.00 38.37 ? 94 GLY B CA 1 ATOM 1600 C C . GLY B 1 13 ? -0.005 -1.825 48.535 1.00 38.23 ? 94 GLY B C 1 ATOM 1601 O O . GLY B 1 13 ? 0.782 -1.663 47.598 1.00 38.33 ? 94 GLY B O 1 ATOM 1602 N N . GLN B 1 14 ? 0.373 -2.317 49.712 1.00 38.06 ? 95 GLN B N 1 ATOM 1603 C CA . GLN B 1 14 ? 1.788 -2.537 50.008 1.00 38.00 ? 95 GLN B CA 1 ATOM 1604 C C . GLN B 1 14 ? 2.054 -3.694 50.968 1.00 37.65 ? 95 GLN B C 1 ATOM 1605 O O . GLN B 1 14 ? 1.371 -3.845 51.977 1.00 37.72 ? 95 GLN B O 1 ATOM 1606 C CB . GLN B 1 14 ? 2.404 -1.248 50.564 1.00 38.07 ? 95 GLN B CB 1 ATOM 1607 C CG . GLN B 1 14 ? 3.923 -1.184 50.506 1.00 38.35 ? 95 GLN B CG 1 ATOM 1608 C CD . GLN B 1 14 ? 4.448 0.191 50.862 1.00 38.45 ? 95 GLN B CD 1 ATOM 1609 O OE1 . GLN B 1 14 ? 4.177 1.167 50.163 1.00 39.62 ? 95 GLN B OE1 1 ATOM 1610 N NE2 . GLN B 1 14 ? 5.202 0.276 51.954 1.00 38.50 ? 95 GLN B NE2 1 ATOM 1611 N N . ILE B 1 15 ? 3.056 -4.504 50.632 1.00 37.33 ? 96 ILE B N 1 ATOM 1612 C CA . ILE B 1 15 ? 3.605 -5.515 51.538 1.00 36.95 ? 96 ILE B CA 1 ATOM 1613 C C . ILE B 1 15 ? 5.057 -5.132 51.836 1.00 36.90 ? 96 ILE B C 1 ATOM 1614 O O . ILE B 1 15 ? 5.813 -4.798 50.918 1.00 36.96 ? 96 ILE B O 1 ATOM 1615 C CB . ILE B 1 15 ? 3.547 -6.930 50.924 1.00 36.90 ? 96 ILE B CB 1 ATOM 1616 C CG1 . ILE B 1 15 ? 2.107 -7.293 50.552 1.00 36.65 ? 96 ILE B CG1 1 ATOM 1617 C CG2 . ILE B 1 15 ? 4.128 -7.967 51.885 1.00 36.41 ? 96 ILE B CG2 1 ATOM 1618 C CD1 . ILE B 1 15 ? 1.998 -8.174 49.322 1.00 36.48 ? 96 ILE B CD1 1 ATOM 1619 N N . THR B 1 16 ? 5.437 -5.178 53.110 1.00 36.50 ? 97 THR B N 1 ATOM 1620 C CA . THR B 1 16 ? 6.764 -4.754 53.536 1.00 36.21 ? 97 THR B CA 1 ATOM 1621 C C . THR B 1 16 ? 7.426 -5.819 54.408 1.00 36.11 ? 97 THR B C 1 ATOM 1622 O O . THR B 1 16 ? 6.927 -6.133 55.490 1.00 36.20 ? 97 THR B O 1 ATOM 1623 C CB . THR B 1 16 ? 6.692 -3.418 54.330 1.00 36.27 ? 97 THR B CB 1 ATOM 1624 O OG1 . THR B 1 16 ? 5.777 -2.520 53.691 1.00 36.17 ? 97 THR B OG1 1 ATOM 1625 C CG2 . THR B 1 16 ? 8.070 -2.756 54.444 1.00 35.97 ? 97 THR B CG2 1 ATOM 1626 N N . TYR B 1 17 ? 8.536 -6.379 53.934 1.00 35.91 ? 98 TYR B N 1 ATOM 1627 C CA . TYR B 1 17 ? 9.398 -7.205 54.783 1.00 35.94 ? 98 TYR B CA 1 ATOM 1628 C C . TYR B 1 17 ? 10.553 -6.365 55.300 1.00 35.92 ? 98 TYR B C 1 ATOM 1629 O O . TYR B 1 17 ? 11.122 -5.559 54.563 1.00 36.15 ? 98 TYR B O 1 ATOM 1630 C CB . TYR B 1 17 ? 9.941 -8.429 54.045 1.00 36.10 ? 98 TYR B CB 1 ATOM 1631 C CG . TYR B 1 17 ? 10.881 -9.284 54.885 1.00 36.41 ? 98 TYR B CG 1 ATOM 1632 C CD1 . TYR B 1 17 ? 10.399 -10.356 55.637 1.00 36.88 ? 98 TYR B CD1 1 ATOM 1633 C CD2 . TYR B 1 17 ? 12.253 -9.018 54.928 1.00 36.87 ? 98 TYR B CD2 1 ATOM 1634 C CE1 . TYR B 1 17 ? 11.255 -11.143 56.413 1.00 36.87 ? 98 TYR B CE1 1 ATOM 1635 C CE2 . TYR B 1 17 ? 13.118 -9.796 55.702 1.00 36.83 ? 98 TYR B CE2 1 ATOM 1636 C CZ . TYR B 1 17 ? 12.612 -10.859 56.439 1.00 36.85 ? 98 TYR B CZ 1 ATOM 1637 O OH . TYR B 1 17 ? 13.461 -11.635 57.201 1.00 36.61 ? 98 TYR B OH 1 ATOM 1638 N N . LYS B 1 18 ? 10.906 -6.584 56.564 1.00 35.72 ? 99 LYS B N 1 ATOM 1639 C CA . LYS B 1 18 ? 11.902 -5.789 57.255 1.00 35.47 ? 99 LYS B CA 1 ATOM 1640 C C . LYS B 1 18 ? 12.813 -6.715 58.053 1.00 35.42 ? 99 LYS B C 1 ATOM 1641 O O . LYS B 1 18 ? 12.424 -7.208 59.114 1.00 35.34 ? 99 LYS B O 1 ATOM 1642 C CB . LYS B 1 18 ? 11.181 -4.816 58.182 1.00 35.52 ? 99 LYS B CB 1 ATOM 1643 C CG . LYS B 1 18 ? 12.014 -3.670 58.728 1.00 36.13 ? 99 LYS B CG 1 ATOM 1644 C CD . LYS B 1 18 ? 11.108 -2.512 59.141 1.00 36.65 ? 99 LYS B CD 1 ATOM 1645 C CE . LYS B 1 18 ? 10.275 -2.026 57.945 1.00 37.12 ? 99 LYS B CE 1 ATOM 1646 N NZ . LYS B 1 18 ? 9.453 -0.821 58.223 1.00 37.43 ? 99 LYS B NZ 1 ATOM 1647 N N . TRP B 1 19 ? 14.017 -6.962 57.538 1.00 35.45 ? 100 TRP B N 1 ATOM 1648 C CA . TRP B 1 19 ? 15.010 -7.785 58.245 1.00 35.50 ? 100 TRP B CA 1 ATOM 1649 C C . TRP B 1 19 ? 15.187 -7.315 59.682 1.00 35.69 ? 100 TRP B C 1 ATOM 1650 O O . TRP B 1 19 ? 15.364 -6.117 59.909 1.00 35.65 ? 100 TRP B O 1 ATOM 1651 C CB . TRP B 1 19 ? 16.373 -7.726 57.555 1.00 35.08 ? 100 TRP B CB 1 ATOM 1652 C CG . TRP B 1 19 ? 16.504 -8.596 56.356 1.00 34.70 ? 100 TRP B CG 1 ATOM 1653 C CD1 . TRP B 1 19 ? 16.820 -9.928 56.333 1.00 34.23 ? 100 TRP B CD1 1 ATOM 1654 C CD2 . TRP B 1 19 ? 16.344 -8.196 54.994 1.00 34.53 ? 100 TRP B CD2 1 ATOM 1655 N NE1 . TRP B 1 19 ? 16.855 -10.383 55.037 1.00 33.95 ? 100 TRP B NE1 1 ATOM 1656 C CE2 . TRP B 1 19 ? 16.566 -9.340 54.194 1.00 34.59 ? 100 TRP B CE2 1 ATOM 1657 C CE3 . TRP B 1 19 ? 16.020 -6.984 54.368 1.00 34.01 ? 100 TRP B CE3 1 ATOM 1658 C CZ2 . TRP B 1 19 ? 16.483 -9.302 52.798 1.00 34.63 ? 100 TRP B CZ2 1 ATOM 1659 C CZ3 . TRP B 1 19 ? 15.940 -6.948 52.989 1.00 33.99 ? 100 TRP B CZ3 1 ATOM 1660 C CH2 . TRP B 1 19 ? 16.173 -8.100 52.218 1.00 34.37 ? 100 TRP B CH2 1 ATOM 1661 N N . PRO B 1 20 ? 15.135 -8.253 60.655 1.00 36.03 ? 101 PRO B N 1 ATOM 1662 C CA . PRO B 1 20 ? 15.431 -7.929 62.048 1.00 36.22 ? 101 PRO B CA 1 ATOM 1663 C C . PRO B 1 20 ? 16.741 -7.147 62.148 1.00 36.57 ? 101 PRO B C 1 ATOM 1664 O O . PRO B 1 20 ? 17.672 -7.422 61.388 1.00 36.53 ? 101 PRO B O 1 ATOM 1665 C CB . PRO B 1 20 ? 15.570 -9.306 62.699 1.00 36.11 ? 101 PRO B CB 1 ATOM 1666 C CG . PRO B 1 20 ? 14.656 -10.162 61.931 1.00 35.87 ? 101 PRO B CG 1 ATOM 1667 C CD . PRO B 1 20 ? 14.775 -9.677 60.501 1.00 36.16 ? 101 PRO B CD 1 ATOM 1668 N N . PRO B 1 21 ? 16.817 -6.177 63.079 1.00 36.92 ? 102 PRO B N 1 ATOM 1669 C CA . PRO B 1 21 ? 17.938 -5.232 63.150 1.00 37.22 ? 102 PRO B CA 1 ATOM 1670 C C . PRO B 1 21 ? 19.302 -5.886 62.888 1.00 37.44 ? 102 PRO B C 1 ATOM 1671 O O . PRO B 1 21 ? 20.063 -5.420 62.030 1.00 37.39 ? 102 PRO B O 1 ATOM 1672 C CB . PRO B 1 21 ? 17.868 -4.704 64.598 1.00 37.25 ? 102 PRO B CB 1 ATOM 1673 C CG . PRO B 1 21 ? 16.726 -5.455 65.271 1.00 37.20 ? 102 PRO B CG 1 ATOM 1674 C CD . PRO B 1 21 ? 15.849 -5.941 64.163 1.00 36.98 ? 102 PRO B CD 1 ATOM 1675 N N . ASN B 1 22 ? 19.566 -6.978 63.609 1.00 37.62 ? 103 ASN B N 1 ATOM 1676 C CA . ASN B 1 22 ? 20.844 -7.688 63.596 1.00 37.65 ? 103 ASN B CA 1 ATOM 1677 C C . ASN B 1 22 ? 20.993 -8.720 62.466 1.00 37.57 ? 103 ASN B C 1 ATOM 1678 O O . ASN B 1 22 ? 21.877 -9.582 62.518 1.00 37.65 ? 103 ASN B O 1 ATOM 1679 C CB . ASN B 1 22 ? 21.030 -8.375 64.953 1.00 37.80 ? 103 ASN B CB 1 ATOM 1680 C CG . ASN B 1 22 ? 22.459 -8.819 65.203 1.00 38.25 ? 103 ASN B CG 1 ATOM 1681 O OD1 . ASN B 1 22 ? 23.407 -8.294 64.610 1.00 38.78 ? 103 ASN B OD1 1 ATOM 1682 N ND2 . ASN B 1 22 ? 22.620 -9.793 66.092 1.00 38.64 ? 103 ASN B ND2 1 ATOM 1683 N N . ASP B 1 23 ? 20.143 -8.623 61.445 1.00 37.27 ? 104 ASP B N 1 ATOM 1684 C CA . ASP B 1 23 ? 20.095 -9.621 60.381 1.00 37.01 ? 104 ASP B CA 1 ATOM 1685 C C . ASP B 1 23 ? 20.259 -9.071 58.972 1.00 36.76 ? 104 ASP B C 1 ATOM 1686 O O . ASP B 1 23 ? 20.286 -9.845 58.011 1.00 36.76 ? 104 ASP B O 1 ATOM 1687 C CB . ASP B 1 23 ? 18.780 -10.394 60.453 1.00 37.26 ? 104 ASP B CB 1 ATOM 1688 C CG . ASP B 1 23 ? 18.942 -11.763 61.063 1.00 37.72 ? 104 ASP B CG 1 ATOM 1689 O OD1 . ASP B 1 23 ? 19.738 -11.908 62.018 1.00 37.69 ? 104 ASP B OD1 1 ATOM 1690 O OD2 . ASP B 1 23 ? 18.265 -12.696 60.579 1.00 38.45 ? 104 ASP B OD2 1 ATOM 1691 N N . ARG B 1 24 ? 20.359 -7.749 58.848 1.00 36.42 ? 105 ARG B N 1 ATOM 1692 C CA . ARG B 1 24 ? 20.458 -7.094 57.537 1.00 36.14 ? 105 ARG B CA 1 ATOM 1693 C C . ARG B 1 24 ? 21.616 -7.641 56.697 1.00 35.92 ? 105 ARG B C 1 ATOM 1694 O O . ARG B 1 24 ? 22.775 -7.542 57.097 1.00 35.93 ? 105 ARG B O 1 ATOM 1695 C CB . ARG B 1 24 ? 20.572 -5.579 57.683 1.00 36.00 ? 105 ARG B CB 1 ATOM 1696 C CG . ARG B 1 24 ? 19.343 -4.922 58.274 1.00 36.10 ? 105 ARG B CG 1 ATOM 1697 C CD . ARG B 1 24 ? 19.293 -3.469 57.869 1.00 36.45 ? 105 ARG B CD 1 ATOM 1698 N NE . ARG B 1 24 ? 18.194 -2.748 58.504 1.00 36.28 ? 105 ARG B NE 1 ATOM 1699 C CZ . ARG B 1 24 ? 18.320 -2.001 59.595 1.00 35.72 ? 105 ARG B CZ 1 ATOM 1700 N NH1 . ARG B 1 24 ? 19.497 -1.873 60.192 1.00 35.23 ? 105 ARG B NH1 1 ATOM 1701 N NH2 . ARG B 1 24 ? 17.260 -1.383 60.087 1.00 35.90 ? 105 ARG B NH2 1 ATOM 1702 N N . PRO B 1 25 ? 21.296 -8.242 55.536 1.00 35.77 ? 106 PRO B N 1 ATOM 1703 C CA . PRO B 1 25 ? 22.314 -8.868 54.698 1.00 35.71 ? 106 PRO B CA 1 ATOM 1704 C C . PRO B 1 25 ? 23.124 -7.870 53.878 1.00 35.70 ? 106 PRO B C 1 ATOM 1705 O O . PRO B 1 25 ? 22.671 -6.760 53.600 1.00 35.74 ? 106 PRO B O 1 ATOM 1706 C CB . PRO B 1 25 ? 21.496 -9.770 53.759 1.00 35.69 ? 106 PRO B CB 1 ATOM 1707 C CG . PRO B 1 25 ? 20.071 -9.666 54.216 1.00 35.35 ? 106 PRO B CG 1 ATOM 1708 C CD . PRO B 1 25 ? 19.955 -8.388 54.949 1.00 35.45 ? 106 PRO B CD 1 ATOM 1709 N N . SER B 1 26 ? 24.327 -8.283 53.509 1.00 35.73 ? 107 SER B N 1 ATOM 1710 C CA . SER B 1 26 ? 25.176 -7.525 52.610 1.00 35.61 ? 107 SER B CA 1 ATOM 1711 C C . SER B 1 26 ? 25.715 -8.519 51.610 1.00 35.61 ? 107 SER B C 1 ATOM 1712 O O . SER B 1 26 ? 26.445 -9.444 51.970 1.00 35.65 ? 107 SER B O 1 ATOM 1713 C CB . SER B 1 26 ? 26.319 -6.866 53.369 1.00 35.53 ? 107 SER B CB 1 ATOM 1714 O OG . SER B 1 26 ? 25.861 -5.759 54.116 1.00 35.82 ? 107 SER B OG 1 ATOM 1715 N N . THR B 1 27 ? 25.341 -8.335 50.351 1.00 35.65 ? 108 THR B N 1 ATOM 1716 C CA . THR B 1 27 ? 25.593 -9.348 49.343 1.00 35.56 ? 108 THR B CA 1 ATOM 1717 C C . THR B 1 27 ? 26.409 -8.856 48.165 1.00 35.55 ? 108 THR B C 1 ATOM 1718 O O . THR B 1 27 ? 26.388 -7.679 47.810 1.00 35.47 ? 108 THR B O 1 ATOM 1719 C CB . THR B 1 27 ? 24.284 -9.923 48.812 1.00 35.58 ? 108 THR B CB 1 ATOM 1720 O OG1 . THR B 1 27 ? 23.444 -8.844 48.381 1.00 35.58 ? 108 THR B OG1 1 ATOM 1721 C CG2 . THR B 1 27 ? 23.580 -10.736 49.899 1.00 35.29 ? 108 THR B CG2 1 ATOM 1722 N N . ARG B 1 28 ? 27.122 -9.798 47.568 1.00 35.65 ? 109 ARG B N 1 ATOM 1723 C CA . ARG B 1 28 ? 27.914 -9.578 46.376 1.00 35.87 ? 109 ARG B CA 1 ATOM 1724 C C . ARG B 1 28 ? 27.155 -10.127 45.161 1.00 35.67 ? 109 ARG B C 1 ATOM 1725 O O . ARG B 1 28 ? 27.417 -9.744 44.025 1.00 35.60 ? 109 ARG B O 1 ATOM 1726 C CB . ARG B 1 28 ? 29.288 -10.229 46.592 1.00 36.03 ? 109 ARG B CB 1 ATOM 1727 C CG . ARG B 1 28 ? 29.795 -11.196 45.527 1.00 37.26 ? 109 ARG B CG 1 ATOM 1728 C CD . ARG B 1 28 ? 30.556 -12.364 46.175 1.00 38.65 ? 109 ARG B CD 1 ATOM 1729 N NE . ARG B 1 28 ? 31.154 -12.008 47.465 1.00 38.96 ? 109 ARG B NE 1 ATOM 1730 C CZ . ARG B 1 28 ? 32.383 -11.519 47.626 1.00 39.89 ? 109 ARG B CZ 1 ATOM 1731 N NH1 . ARG B 1 28 ? 33.174 -11.322 46.577 1.00 39.95 ? 109 ARG B NH1 1 ATOM 1732 N NH2 . ARG B 1 28 ? 32.824 -11.225 48.844 1.00 39.62 ? 109 ARG B NH2 1 ATOM 1733 N N . ALA B 1 29 ? 26.194 -11.006 45.432 1.00 35.68 ? 110 ALA B N 1 ATOM 1734 C CA . ALA B 1 29 ? 25.340 -11.606 44.418 1.00 35.54 ? 110 ALA B CA 1 ATOM 1735 C C . ALA B 1 29 ? 23.903 -11.687 44.929 1.00 35.78 ? 110 ALA B C 1 ATOM 1736 O O . ALA B 1 29 ? 23.682 -11.920 46.119 1.00 35.97 ? 110 ALA B O 1 ATOM 1737 C CB . ALA B 1 29 ? 25.846 -12.988 44.052 1.00 35.30 ? 110 ALA B CB 1 ATOM 1738 N N . ASP B 1 30 ? 22.935 -11.497 44.028 1.00 35.83 ? 111 ASP B N 1 ATOM 1739 C CA . ASP B 1 30 ? 21.510 -11.494 44.382 1.00 35.89 ? 111 ASP B CA 1 ATOM 1740 C C . ASP B 1 30 ? 20.671 -12.342 43.433 1.00 35.97 ? 111 ASP B C 1 ATOM 1741 O O . ASP B 1 30 ? 21.014 -12.507 42.259 1.00 36.32 ? 111 ASP B O 1 ATOM 1742 C CB . ASP B 1 30 ? 20.953 -10.069 44.406 1.00 35.77 ? 111 ASP B CB 1 ATOM 1743 C CG . ASP B 1 30 ? 21.701 -9.169 45.362 1.00 36.42 ? 111 ASP B CG 1 ATOM 1744 O OD1 . ASP B 1 30 ? 21.965 -9.600 46.505 1.00 37.39 ? 111 ASP B OD1 1 ATOM 1745 O OD2 . ASP B 1 30 ? 22.022 -8.028 44.974 1.00 36.62 ? 111 ASP B OD2 1 ATOM 1746 N N . ARG B 1 31 ? 19.572 -12.878 43.959 1.00 35.45 ? 112 ARG B N 1 ATOM 1747 C CA . ARG B 1 31 ? 18.644 -13.673 43.185 1.00 35.12 ? 112 ARG B CA 1 ATOM 1748 C C . ARG B 1 31 ? 17.230 -13.272 43.566 1.00 34.31 ? 112 ARG B C 1 ATOM 1749 O O . ARG B 1 31 ? 16.858 -13.281 44.738 1.00 34.15 ? 112 ARG B O 1 ATOM 1750 C CB . ARG B 1 31 ? 18.887 -15.169 43.408 1.00 35.26 ? 112 ARG B CB 1 ATOM 1751 C CG . ARG B 1 31 ? 20.321 -15.621 43.065 1.00 36.32 ? 112 ARG B CG 1 ATOM 1752 C CD . ARG B 1 31 ? 20.566 -17.087 43.378 1.00 36.66 ? 112 ARG B CD 1 ATOM 1753 N NE . ARG B 1 31 ? 19.641 -17.954 42.650 1.00 40.81 ? 112 ARG B NE 1 ATOM 1754 C CZ . ARG B 1 31 ? 19.858 -18.433 41.425 1.00 42.95 ? 112 ARG B CZ 1 ATOM 1755 N NH1 . ARG B 1 31 ? 20.979 -18.135 40.766 1.00 42.88 ? 112 ARG B NH1 1 ATOM 1756 N NH2 . ARG B 1 31 ? 18.948 -19.216 40.856 1.00 43.89 ? 112 ARG B NH2 1 ATOM 1757 N N . LEU B 1 32 ? 16.459 -12.897 42.554 1.00 33.69 ? 113 LEU B N 1 ATOM 1758 C CA . LEU B 1 32 ? 15.092 -12.438 42.712 1.00 32.96 ? 113 LEU B CA 1 ATOM 1759 C C . LEU B 1 32 ? 14.229 -13.124 41.659 1.00 32.67 ? 113 LEU B C 1 ATOM 1760 O O . LEU B 1 32 ? 14.686 -13.400 40.545 1.00 32.85 ? 113 LEU B O 1 ATOM 1761 C CB . LEU B 1 32 ? 15.039 -10.918 42.554 1.00 33.06 ? 113 LEU B CB 1 ATOM 1762 C CG . LEU B 1 32 ? 13.724 -10.130 42.502 1.00 32.92 ? 113 LEU B CG 1 ATOM 1763 C CD1 . LEU B 1 32 ? 13.074 -10.053 43.860 1.00 33.01 ? 113 LEU B CD1 1 ATOM 1764 C CD2 . LEU B 1 32 ? 13.998 -8.732 41.990 1.00 32.68 ? 113 LEU B CD2 1 ATOM 1765 N N . ALA B 1 33 ? 12.989 -13.415 42.024 1.00 32.00 ? 114 ALA B N 1 ATOM 1766 C CA . ALA B 1 33 ? 12.054 -14.081 41.133 1.00 31.53 ? 114 ALA B CA 1 ATOM 1767 C C . ALA B 1 33 ? 10.646 -13.757 41.583 1.00 31.55 ? 114 ALA B C 1 ATOM 1768 O O . ALA B 1 33 ? 10.369 -13.643 42.788 1.00 31.63 ? 114 ALA B O 1 ATOM 1769 C CB . ALA B 1 33 ? 12.279 -15.576 41.142 1.00 31.38 ? 114 ALA B CB 1 ATOM 1770 N N . ILE B 1 34 ? 9.757 -13.588 40.614 1.00 31.25 ? 115 ILE B N 1 ATOM 1771 C CA . ILE B 1 34 ? 8.357 -13.305 40.906 1.00 30.87 ? 115 ILE B CA 1 ATOM 1772 C C . ILE B 1 34 ? 7.483 -13.612 39.686 1.00 30.72 ? 115 ILE B C 1 ATOM 1773 O O . ILE B 1 34 ? 7.926 -13.506 38.536 1.00 30.53 ? 115 ILE B O 1 ATOM 1774 C CB . ILE B 1 34 ? 8.167 -11.843 41.425 1.00 30.76 ? 115 ILE B CB 1 ATOM 1775 C CG1 . ILE B 1 34 ? 6.779 -11.645 42.057 1.00 31.12 ? 115 ILE B CG1 1 ATOM 1776 C CG2 . ILE B 1 34 ? 8.469 -10.827 40.327 1.00 30.89 ? 115 ILE B CG2 1 ATOM 1777 C CD1 . ILE B 1 34 ? 6.598 -10.315 42.809 1.00 30.31 ? 115 ILE B CD1 1 ATOM 1778 N N . GLY B 1 35 ? 6.260 -14.051 39.953 1.00 30.59 ? 116 GLY B N 1 ATOM 1779 C CA . GLY B 1 35 ? 5.243 -14.188 38.917 1.00 30.00 ? 116 GLY B CA 1 ATOM 1780 C C . GLY B 1 35 ? 4.353 -12.976 39.032 1.00 29.56 ? 116 GLY B C 1 ATOM 1781 O O . GLY B 1 35 ? 4.129 -12.478 40.140 1.00 29.61 ? 116 GLY B O 1 ATOM 1782 N N . PHE B 1 36 ? 3.865 -12.478 37.900 1.00 29.11 ? 117 PHE B N 1 ATOM 1783 C CA . PHE B 1 36 ? 2.953 -11.335 37.915 1.00 28.82 ? 117 PHE B CA 1 ATOM 1784 C C . PHE B 1 36 ? 1.982 -11.352 36.748 1.00 28.78 ? 117 PHE B C 1 ATOM 1785 O O . PHE B 1 36 ? 2.189 -12.072 35.771 1.00 28.97 ? 117 PHE B O 1 ATOM 1786 C CB . PHE B 1 36 ? 3.738 -10.019 37.915 1.00 28.79 ? 117 PHE B CB 1 ATOM 1787 C CG . PHE B 1 36 ? 4.433 -9.726 36.616 1.00 28.55 ? 117 PHE B CG 1 ATOM 1788 C CD1 . PHE B 1 36 ? 3.790 -8.995 35.617 1.00 27.91 ? 117 PHE B CD1 1 ATOM 1789 C CD2 . PHE B 1 36 ? 5.727 -10.182 36.387 1.00 28.24 ? 117 PHE B CD2 1 ATOM 1790 C CE1 . PHE B 1 36 ? 4.414 -8.730 34.414 1.00 27.81 ? 117 PHE B CE1 1 ATOM 1791 C CE2 . PHE B 1 36 ? 6.363 -9.914 35.180 1.00 28.48 ? 117 PHE B CE2 1 ATOM 1792 C CZ . PHE B 1 36 ? 5.706 -9.187 34.194 1.00 28.57 ? 117 PHE B CZ 1 ATOM 1793 N N . SER B 1 37 ? 0.923 -10.556 36.865 1.00 28.73 ? 118 SER B N 1 ATOM 1794 C CA . SER B 1 37 ? 0.033 -10.245 35.744 1.00 28.83 ? 118 SER B CA 1 ATOM 1795 C C . SER B 1 37 ? -0.597 -8.878 35.978 1.00 28.91 ? 118 SER B C 1 ATOM 1796 O O . SER B 1 37 ? -1.031 -8.566 37.091 1.00 28.77 ? 118 SER B O 1 ATOM 1797 C CB . SER B 1 37 ? -1.041 -11.320 35.549 1.00 28.66 ? 118 SER B CB 1 ATOM 1798 O OG . SER B 1 37 ? -1.807 -11.487 36.723 1.00 28.84 ? 118 SER B OG 1 ATOM 1799 N N . THR B 1 38 ? -0.631 -8.069 34.922 1.00 29.08 ? 119 THR B N 1 ATOM 1800 C CA . THR B 1 38 ? -1.004 -6.655 35.013 1.00 29.39 ? 119 THR B CA 1 ATOM 1801 C C . THR B 1 38 ? -1.374 -6.139 33.617 1.00 29.75 ? 119 THR B C 1 ATOM 1802 O O . THR B 1 38 ? -0.990 -6.745 32.619 1.00 30.03 ? 119 THR B O 1 ATOM 1803 C CB . THR B 1 38 ? 0.163 -5.815 35.648 1.00 29.34 ? 119 THR B CB 1 ATOM 1804 O OG1 . THR B 1 38 ? -0.248 -4.461 35.883 1.00 29.21 ? 119 THR B OG1 1 ATOM 1805 C CG2 . THR B 1 38 ? 1.403 -5.831 34.769 1.00 28.78 ? 119 THR B CG2 1 ATOM 1806 N N . VAL B 1 39 ? -2.132 -5.048 33.538 1.00 30.04 ? 120 VAL B N 1 ATOM 1807 C CA . VAL B 1 39 ? -2.419 -4.419 32.238 1.00 30.56 ? 120 VAL B CA 1 ATOM 1808 C C . VAL B 1 39 ? -1.823 -3.011 32.160 1.00 31.10 ? 120 VAL B C 1 ATOM 1809 O O . VAL B 1 39 ? -2.146 -2.231 31.255 1.00 31.32 ? 120 VAL B O 1 ATOM 1810 C CB . VAL B 1 39 ? -3.942 -4.383 31.902 1.00 30.45 ? 120 VAL B CB 1 ATOM 1811 C CG1 . VAL B 1 39 ? -4.487 -5.791 31.726 1.00 29.99 ? 120 VAL B CG1 1 ATOM 1812 C CG2 . VAL B 1 39 ? -4.730 -3.605 32.965 1.00 30.19 ? 120 VAL B CG2 1 ATOM 1813 N N . GLN B 1 40 ? -0.949 -2.710 33.116 1.00 31.57 ? 121 GLN B N 1 ATOM 1814 C CA . GLN B 1 40 ? -0.411 -1.374 33.319 1.00 32.13 ? 121 GLN B CA 1 ATOM 1815 C C . GLN B 1 40 ? 0.814 -1.113 32.458 1.00 32.67 ? 121 GLN B C 1 ATOM 1816 O O . GLN B 1 40 ? 1.617 -2.019 32.221 1.00 32.87 ? 121 GLN B O 1 ATOM 1817 C CB . GLN B 1 40 ? -0.017 -1.193 34.783 1.00 32.10 ? 121 GLN B CB 1 ATOM 1818 C CG . GLN B 1 40 ? -1.172 -1.116 35.756 1.00 32.18 ? 121 GLN B CG 1 ATOM 1819 C CD . GLN B 1 40 ? -0.695 -0.943 37.182 1.00 32.60 ? 121 GLN B CD 1 ATOM 1820 O OE1 . GLN B 1 40 ? -0.046 -1.825 37.739 1.00 33.81 ? 121 GLN B OE1 1 ATOM 1821 N NE2 . GLN B 1 40 ? -1.012 0.197 37.781 1.00 32.55 ? 121 GLN B NE2 1 ATOM 1822 N N . LYS B 1 41 ? 0.960 0.136 32.015 1.00 33.06 ? 122 LYS B N 1 ATOM 1823 C CA . LYS B 1 41 ? 2.142 0.570 31.283 1.00 33.41 ? 122 LYS B CA 1 ATOM 1824 C C . LYS B 1 41 ? 3.270 0.927 32.242 1.00 33.73 ? 122 LYS B C 1 ATOM 1825 O O . LYS B 1 41 ? 4.439 0.683 31.943 1.00 34.05 ? 122 LYS B O 1 ATOM 1826 C CB . LYS B 1 41 ? 1.815 1.758 30.375 1.00 33.28 ? 122 LYS B CB 1 ATOM 1827 C CG . LYS B 1 41 ? 0.986 1.380 29.156 1.00 33.69 ? 122 LYS B CG 1 ATOM 1828 C CD . LYS B 1 41 ? 0.418 2.598 28.426 1.00 33.75 ? 122 LYS B CD 1 ATOM 1829 C CE . LYS B 1 41 ? -0.394 2.154 27.212 1.00 34.45 ? 122 LYS B CE 1 ATOM 1830 N NZ . LYS B 1 41 ? -1.339 3.196 26.728 1.00 34.60 ? 122 LYS B NZ 1 ATOM 1831 N N . GLU B 1 42 ? 2.918 1.505 33.391 1.00 33.99 ? 123 GLU B N 1 ATOM 1832 C CA . GLU B 1 42 ? 3.903 1.935 34.393 1.00 34.19 ? 123 GLU B CA 1 ATOM 1833 C C . GLU B 1 42 ? 3.526 1.405 35.777 1.00 33.85 ? 123 GLU B C 1 ATOM 1834 O O . GLU B 1 42 ? 2.357 1.486 36.172 1.00 34.01 ? 123 GLU B O 1 ATOM 1835 C CB . GLU B 1 42 ? 3.993 3.465 34.448 1.00 34.56 ? 123 GLU B CB 1 ATOM 1836 C CG . GLU B 1 42 ? 4.217 4.160 33.109 1.00 36.47 ? 123 GLU B CG 1 ATOM 1837 C CD . GLU B 1 42 ? 5.668 4.126 32.655 1.00 38.76 ? 123 GLU B CD 1 ATOM 1838 O OE1 . GLU B 1 42 ? 6.561 4.426 33.486 1.00 40.03 ? 123 GLU B OE1 1 ATOM 1839 O OE2 . GLU B 1 42 ? 5.907 3.821 31.463 1.00 39.18 ? 123 GLU B OE2 1 ATOM 1840 N N . ALA B 1 43 ? 4.511 0.880 36.509 1.00 33.19 ? 124 ALA B N 1 ATOM 1841 C CA . ALA B 1 43 ? 4.286 0.336 37.852 1.00 32.81 ? 124 ALA B CA 1 ATOM 1842 C C . ALA B 1 43 ? 5.580 -0.148 38.495 1.00 32.64 ? 124 ALA B C 1 ATOM 1843 O O . ALA B 1 43 ? 6.485 -0.629 37.809 1.00 32.97 ? 124 ALA B O 1 ATOM 1844 C CB . ALA B 1 43 ? 3.272 -0.807 37.810 1.00 32.62 ? 124 ALA B CB 1 ATOM 1845 N N . VAL B 1 44 ? 5.665 -0.035 39.816 1.00 32.09 ? 125 VAL B N 1 ATOM 1846 C CA . VAL B 1 44 ? 6.787 -0.626 40.540 1.00 31.51 ? 125 VAL B CA 1 ATOM 1847 C C . VAL B 1 44 ? 6.303 -1.872 41.276 1.00 31.09 ? 125 VAL B C 1 ATOM 1848 O O . VAL B 1 44 ? 5.266 -1.843 41.936 1.00 30.95 ? 125 VAL B O 1 ATOM 1849 C CB . VAL B 1 44 ? 7.459 0.398 41.480 1.00 31.48 ? 125 VAL B CB 1 ATOM 1850 C CG1 . VAL B 1 44 ? 8.361 -0.293 42.494 1.00 31.52 ? 125 VAL B CG1 1 ATOM 1851 C CG2 . VAL B 1 44 ? 8.252 1.408 40.665 1.00 31.15 ? 125 VAL B CG2 1 ATOM 1852 N N . LEU B 1 45 ? 7.041 -2.970 41.138 1.00 30.66 ? 126 LEU B N 1 ATOM 1853 C CA . LEU B 1 45 ? 6.594 -4.262 41.678 1.00 30.28 ? 126 LEU B CA 1 ATOM 1854 C C . LEU B 1 45 ? 7.241 -4.611 43.021 1.00 30.08 ? 126 LEU B C 1 ATOM 1855 O O . LEU B 1 45 ? 6.547 -4.888 43.997 1.00 29.78 ? 126 LEU B O 1 ATOM 1856 C CB . LEU B 1 45 ? 6.801 -5.387 40.654 1.00 30.05 ? 126 LEU B CB 1 ATOM 1857 C CG . LEU B 1 45 ? 5.787 -5.518 39.500 1.00 30.46 ? 126 LEU B CG 1 ATOM 1858 C CD1 . LEU B 1 45 ? 5.836 -4.356 38.510 1.00 29.68 ? 126 LEU B CD1 1 ATOM 1859 C CD2 . LEU B 1 45 ? 5.983 -6.833 38.760 1.00 30.22 ? 126 LEU B CD2 1 ATOM 1860 N N . VAL B 1 46 ? 8.569 -4.575 43.057 1.00 30.17 ? 127 VAL B N 1 ATOM 1861 C CA . VAL B 1 46 ? 9.345 -4.942 44.232 1.00 30.15 ? 127 VAL B CA 1 ATOM 1862 C C . VAL B 1 46 ? 10.500 -3.960 44.331 1.00 30.54 ? 127 VAL B C 1 ATOM 1863 O O . VAL B 1 46 ? 11.081 -3.574 43.309 1.00 30.58 ? 127 VAL B O 1 ATOM 1864 C CB . VAL B 1 46 ? 9.930 -6.374 44.101 1.00 30.14 ? 127 VAL B CB 1 ATOM 1865 C CG1 . VAL B 1 46 ? 10.766 -6.733 45.323 1.00 29.87 ? 127 VAL B CG1 1 ATOM 1866 C CG2 . VAL B 1 46 ? 8.824 -7.421 43.873 1.00 29.77 ? 127 VAL B CG2 1 ATOM 1867 N N . ARG B 1 47 ? 10.833 -3.550 45.551 1.00 30.61 ? 128 ARG B N 1 ATOM 1868 C CA . ARG B 1 47 ? 12.047 -2.783 45.771 1.00 30.97 ? 128 ARG B CA 1 ATOM 1869 C C . ARG B 1 47 ? 12.774 -3.199 47.054 1.00 31.43 ? 128 ARG B C 1 ATOM 1870 O O . ARG B 1 47 ? 12.176 -3.233 48.139 1.00 31.92 ? 128 ARG B O 1 ATOM 1871 C CB . ARG B 1 47 ? 11.754 -1.287 45.777 1.00 30.79 ? 128 ARG B CB 1 ATOM 1872 C CG . ARG B 1 47 ? 13.015 -0.445 45.715 1.00 30.40 ? 128 ARG B CG 1 ATOM 1873 C CD . ARG B 1 47 ? 12.670 0.999 45.512 1.00 30.33 ? 128 ARG B CD 1 ATOM 1874 N NE . ARG B 1 47 ? 13.731 1.872 45.997 1.00 30.49 ? 128 ARG B NE 1 ATOM 1875 C CZ . ARG B 1 47 ? 14.402 2.720 45.231 1.00 30.13 ? 128 ARG B CZ 1 ATOM 1876 N NH1 . ARG B 1 47 ? 14.114 2.817 43.942 1.00 29.88 ? 128 ARG B NH1 1 ATOM 1877 N NH2 . ARG B 1 47 ? 15.357 3.475 45.757 1.00 29.92 ? 128 ARG B NH2 1 ATOM 1878 N N . VAL B 1 48 ? 14.058 -3.523 46.925 1.00 31.31 ? 129 VAL B N 1 ATOM 1879 C CA . VAL B 1 48 ? 14.856 -3.909 48.075 1.00 31.43 ? 129 VAL B CA 1 ATOM 1880 C C . VAL B 1 48 ? 15.766 -2.751 48.432 1.00 31.76 ? 129 VAL B C 1 ATOM 1881 O O . VAL B 1 48 ? 16.605 -2.351 47.632 1.00 32.08 ? 129 VAL B O 1 ATOM 1882 C CB . VAL B 1 48 ? 15.657 -5.201 47.810 1.00 31.53 ? 129 VAL B CB 1 ATOM 1883 C CG1 . VAL B 1 48 ? 16.449 -5.629 49.058 1.00 31.18 ? 129 VAL B CG1 1 ATOM 1884 C CG2 . VAL B 1 48 ? 14.720 -6.326 47.359 1.00 31.38 ? 129 VAL B CG2 1 ATOM 1885 N N . ASP B 1 49 ? 15.584 -2.205 49.630 1.00 32.17 ? 130 ASP B N 1 ATOM 1886 C CA . ASP B 1 49 ? 16.277 -0.986 50.036 1.00 32.63 ? 130 ASP B CA 1 ATOM 1887 C C . ASP B 1 49 ? 17.277 -1.214 51.157 1.00 32.79 ? 130 ASP B C 1 ATOM 1888 O O . ASP B 1 49 ? 17.064 -2.050 52.043 1.00 33.05 ? 130 ASP B O 1 ATOM 1889 C CB . ASP B 1 49 ? 15.268 0.091 50.450 1.00 32.75 ? 130 ASP B CB 1 ATOM 1890 C CG . ASP B 1 49 ? 14.750 0.889 49.270 1.00 33.83 ? 130 ASP B CG 1 ATOM 1891 O OD1 . ASP B 1 49 ? 15.519 1.706 48.719 1.00 35.40 ? 130 ASP B OD1 1 ATOM 1892 O OD2 . ASP B 1 49 ? 13.572 0.707 48.895 1.00 34.80 ? 130 ASP B OD2 1 ATOM 1893 N N . SER B 1 50 ? 18.367 -0.458 51.114 1.00 32.76 ? 131 SER B N 1 ATOM 1894 C CA . SER B 1 50 ? 19.366 -0.491 52.168 1.00 32.79 ? 131 SER B CA 1 ATOM 1895 C C . SER B 1 50 ? 18.998 0.504 53.261 1.00 32.97 ? 131 SER B C 1 ATOM 1896 O O . SER B 1 50 ? 18.105 1.333 53.080 1.00 32.97 ? 131 SER B O 1 ATOM 1897 C CB . SER B 1 50 ? 20.723 -0.131 51.593 1.00 32.63 ? 131 SER B CB 1 ATOM 1898 O OG . SER B 1 50 ? 20.699 1.200 51.113 1.00 32.71 ? 131 SER B OG 1 ATOM 1899 N N . SER B 1 51 ? 19.708 0.428 54.384 1.00 33.17 ? 132 SER B N 1 ATOM 1900 C CA . SER B 1 51 ? 19.478 1.311 55.524 1.00 33.57 ? 132 SER B CA 1 ATOM 1901 C C . SER B 1 51 ? 19.593 2.799 55.171 1.00 33.93 ? 132 SER B C 1 ATOM 1902 O O . SER B 1 51 ? 20.322 3.176 54.244 1.00 33.97 ? 132 SER B O 1 ATOM 1903 C CB . SER B 1 51 ? 20.451 0.963 56.648 1.00 33.56 ? 132 SER B CB 1 ATOM 1904 O OG . SER B 1 51 ? 20.524 -0.438 56.827 1.00 33.66 ? 132 SER B OG 1 ATOM 1905 N N . SER B 1 52 ? 18.857 3.628 55.913 1.00 34.32 ? 133 SER B N 1 ATOM 1906 C CA . SER B 1 52 ? 18.838 5.081 55.726 1.00 34.97 ? 133 SER B CA 1 ATOM 1907 C C . SER B 1 52 ? 20.245 5.676 55.646 1.00 35.30 ? 133 SER B C 1 ATOM 1908 O O . SER B 1 52 ? 21.100 5.399 56.499 1.00 35.30 ? 133 SER B O 1 ATOM 1909 C CB . SER B 1 52 ? 18.072 5.759 56.872 1.00 35.07 ? 133 SER B CB 1 ATOM 1910 O OG . SER B 1 52 ? 16.791 5.178 57.057 1.00 35.72 ? 133 SER B OG 1 ATOM 1911 N N . GLY B 1 53 ? 20.472 6.499 54.624 1.00 35.60 ? 134 GLY B N 1 ATOM 1912 C CA . GLY B 1 53 ? 21.756 7.180 54.450 1.00 35.91 ? 134 GLY B CA 1 ATOM 1913 C C . GLY B 1 53 ? 22.579 6.533 53.356 1.00 36.09 ? 134 GLY B C 1 ATOM 1914 O O . GLY B 1 53 ? 23.493 7.150 52.803 1.00 36.19 ? 134 GLY B O 1 ATOM 1915 N N . LEU B 1 54 ? 22.243 5.282 53.055 1.00 36.18 ? 135 LEU B N 1 ATOM 1916 C CA . LEU B 1 54 ? 22.871 4.525 51.984 1.00 36.18 ? 135 LEU B CA 1 ATOM 1917 C C . LEU B 1 54 ? 21.945 4.506 50.771 1.00 36.31 ? 135 LEU B C 1 ATOM 1918 O O . LEU B 1 54 ? 20.744 4.232 50.891 1.00 36.51 ? 135 LEU B O 1 ATOM 1919 C CB . LEU B 1 54 ? 23.178 3.099 52.458 1.00 36.08 ? 135 LEU B CB 1 ATOM 1920 C CG . LEU B 1 54 ? 24.527 2.751 53.107 1.00 36.05 ? 135 LEU B CG 1 ATOM 1921 C CD1 . LEU B 1 54 ? 25.090 3.851 54.002 1.00 36.14 ? 135 LEU B CD1 1 ATOM 1922 C CD2 . LEU B 1 54 ? 24.406 1.453 53.884 1.00 36.16 ? 135 LEU B CD2 1 ATOM 1923 N N . GLY B 1 55 ? 22.510 4.804 49.605 1.00 36.33 ? 136 GLY B N 1 ATOM 1924 C CA . GLY B 1 55 ? 21.738 4.901 48.368 1.00 36.29 ? 136 GLY B CA 1 ATOM 1925 C C . GLY B 1 55 ? 21.448 3.580 47.678 1.00 36.25 ? 136 GLY B C 1 ATOM 1926 O O . GLY B 1 55 ? 20.731 3.553 46.675 1.00 36.30 ? 136 GLY B O 1 ATOM 1927 N N . ASP B 1 56 ? 21.999 2.490 48.216 1.00 36.10 ? 137 ASP B N 1 ATOM 1928 C CA . ASP B 1 56 ? 21.821 1.155 47.640 1.00 36.02 ? 137 ASP B CA 1 ATOM 1929 C C . ASP B 1 56 ? 20.360 0.763 47.549 1.00 35.79 ? 137 ASP B C 1 ATOM 1930 O O . ASP B 1 56 ? 19.588 0.997 48.478 1.00 35.76 ? 137 ASP B O 1 ATOM 1931 C CB . ASP B 1 56 ? 22.556 0.095 48.464 1.00 36.16 ? 137 ASP B CB 1 ATOM 1932 C CG . ASP B 1 56 ? 24.055 0.128 48.267 1.00 36.53 ? 137 ASP B CG 1 ATOM 1933 O OD1 . ASP B 1 56 ? 24.687 1.164 48.559 1.00 36.38 ? 137 ASP B OD1 1 ATOM 1934 O OD2 . ASP B 1 56 ? 24.605 -0.905 47.838 1.00 37.59 ? 137 ASP B OD2 1 ATOM 1935 N N . TYR B 1 57 ? 19.995 0.173 46.414 1.00 35.75 ? 138 TYR B N 1 ATOM 1936 C CA . TYR B 1 57 ? 18.662 -0.377 46.194 1.00 35.58 ? 138 TYR B CA 1 ATOM 1937 C C . TYR B 1 57 ? 18.657 -1.325 44.998 1.00 35.58 ? 138 TYR B C 1 ATOM 1938 O O . TYR B 1 57 ? 19.644 -1.403 44.246 1.00 35.31 ? 138 TYR B O 1 ATOM 1939 C CB . TYR B 1 57 ? 17.628 0.738 45.990 1.00 35.69 ? 138 TYR B CB 1 ATOM 1940 C CG . TYR B 1 57 ? 17.683 1.398 44.634 1.00 35.45 ? 138 TYR B CG 1 ATOM 1941 C CD1 . TYR B 1 57 ? 16.927 0.903 43.571 1.00 34.90 ? 138 TYR B CD1 1 ATOM 1942 C CD2 . TYR B 1 57 ? 18.481 2.520 44.414 1.00 35.13 ? 138 TYR B CD2 1 ATOM 1943 C CE1 . TYR B 1 57 ? 16.967 1.499 42.320 1.00 35.47 ? 138 TYR B CE1 1 ATOM 1944 C CE2 . TYR B 1 57 ? 18.532 3.132 43.164 1.00 35.50 ? 138 TYR B CE2 1 ATOM 1945 C CZ . TYR B 1 57 ? 17.768 2.614 42.120 1.00 36.45 ? 138 TYR B CZ 1 ATOM 1946 O OH . TYR B 1 57 ? 17.797 3.208 40.874 1.00 36.93 ? 138 TYR B OH 1 ATOM 1947 N N . LEU B 1 58 ? 17.537 -2.036 44.839 1.00 35.39 ? 139 LEU B N 1 ATOM 1948 C CA . LEU B 1 58 ? 17.292 -2.914 43.698 1.00 35.41 ? 139 LEU B CA 1 ATOM 1949 C C . LEU B 1 58 ? 15.800 -2.865 43.367 1.00 35.11 ? 139 LEU B C 1 ATOM 1950 O O . LEU B 1 58 ? 14.972 -3.154 44.226 1.00 35.62 ? 139 LEU B O 1 ATOM 1951 C CB . LEU B 1 58 ? 17.720 -4.346 44.033 1.00 35.48 ? 139 LEU B CB 1 ATOM 1952 C CG . LEU B 1 58 ? 17.153 -5.464 43.148 1.00 36.90 ? 139 LEU B CG 1 ATOM 1953 C CD1 . LEU B 1 58 ? 17.933 -5.528 41.861 1.00 38.50 ? 139 LEU B CD1 1 ATOM 1954 C CD2 . LEU B 1 58 ? 17.201 -6.809 43.851 1.00 37.81 ? 139 LEU B CD2 1 ATOM 1955 N N . GLU B 1 59 ? 15.448 -2.497 42.140 1.00 34.37 ? 140 GLU B N 1 ATOM 1956 C CA . GLU B 1 59 ? 14.044 -2.267 41.820 1.00 33.88 ? 140 GLU B CA 1 ATOM 1957 C C . GLU B 1 59 ? 13.550 -2.978 40.568 1.00 33.78 ? 140 GLU B C 1 ATOM 1958 O O . GLU B 1 59 ? 14.034 -2.736 39.468 1.00 33.53 ? 140 GLU B O 1 ATOM 1959 C CB . GLU B 1 59 ? 13.766 -0.772 41.691 1.00 33.98 ? 140 GLU B CB 1 ATOM 1960 C CG . GLU B 1 59 ? 12.298 -0.416 41.464 1.00 33.53 ? 140 GLU B CG 1 ATOM 1961 C CD . GLU B 1 59 ? 12.098 1.067 41.206 1.00 33.88 ? 140 GLU B CD 1 ATOM 1962 O OE1 . GLU B 1 59 ? 12.502 1.893 42.053 1.00 34.12 ? 140 GLU B OE1 1 ATOM 1963 O OE2 . GLU B 1 59 ? 11.529 1.414 40.154 1.00 34.62 ? 140 GLU B OE2 1 ATOM 1964 N N . LEU B 1 60 ? 12.559 -3.837 40.753 1.00 33.75 ? 141 LEU B N 1 ATOM 1965 C CA . LEU B 1 60 ? 11.847 -4.428 39.642 1.00 33.88 ? 141 LEU B CA 1 ATOM 1966 C C . LEU B 1 60 ? 10.648 -3.556 39.306 1.00 33.90 ? 141 LEU B C 1 ATOM 1967 O O . LEU B 1 60 ? 9.807 -3.277 40.163 1.00 33.90 ? 141 LEU B O 1 ATOM 1968 C CB . LEU B 1 60 ? 11.406 -5.844 39.993 1.00 33.93 ? 141 LEU B CB 1 ATOM 1969 C CG . LEU B 1 60 ? 10.563 -6.605 38.972 1.00 33.82 ? 141 LEU B CG 1 ATOM 1970 C CD1 . LEU B 1 60 ? 11.433 -7.190 37.880 1.00 33.36 ? 141 LEU B CD1 1 ATOM 1971 C CD2 . LEU B 1 60 ? 9.832 -7.709 39.684 1.00 34.34 ? 141 LEU B CD2 1 ATOM 1972 N N . HIS B 1 61 ? 10.584 -3.107 38.059 1.00 34.10 ? 142 HIS B N 1 ATOM 1973 C CA . HIS B 1 61 ? 9.491 -2.246 37.624 1.00 34.46 ? 142 HIS B CA 1 ATOM 1974 C C . HIS B 1 61 ? 9.015 -2.561 36.206 1.00 34.31 ? 142 HIS B C 1 ATOM 1975 O O . HIS B 1 61 ? 9.667 -3.314 35.474 1.00 34.29 ? 142 HIS B O 1 ATOM 1976 C CB . HIS B 1 61 ? 9.870 -0.763 37.761 1.00 34.60 ? 142 HIS B CB 1 ATOM 1977 C CG . HIS B 1 61 ? 11.237 -0.427 37.248 1.00 35.90 ? 142 HIS B CG 1 ATOM 1978 N ND1 . HIS B 1 61 ? 11.587 -0.545 35.920 1.00 38.02 ? 142 HIS B ND1 1 ATOM 1979 C CD2 . HIS B 1 61 ? 12.336 0.043 37.883 1.00 37.20 ? 142 HIS B CD2 1 ATOM 1980 C CE1 . HIS B 1 61 ? 12.846 -0.172 35.761 1.00 38.64 ? 142 HIS B CE1 1 ATOM 1981 N NE2 . HIS B 1 61 ? 13.323 0.190 36.938 1.00 38.25 ? 142 HIS B NE2 1 ATOM 1982 N N . ILE B 1 62 ? 7.866 -1.988 35.848 1.00 34.00 ? 143 ILE B N 1 ATOM 1983 C CA . ILE B 1 62 ? 7.365 -1.989 34.481 1.00 34.05 ? 143 ILE B CA 1 ATOM 1984 C C . ILE B 1 62 ? 7.420 -0.563 33.939 1.00 34.30 ? 143 ILE B C 1 ATOM 1985 O O . ILE B 1 62 ? 6.931 0.372 34.588 1.00 34.43 ? 143 ILE B O 1 ATOM 1986 C CB . ILE B 1 62 ? 5.914 -2.552 34.396 1.00 34.18 ? 143 ILE B CB 1 ATOM 1987 C CG1 . ILE B 1 62 ? 5.907 -4.055 34.695 1.00 33.62 ? 143 ILE B CG1 1 ATOM 1988 C CG2 . ILE B 1 62 ? 5.277 -2.267 33.018 1.00 33.55 ? 143 ILE B CG2 1 ATOM 1989 C CD1 . ILE B 1 62 ? 4.533 -4.626 34.944 1.00 33.07 ? 143 ILE B CD1 1 ATOM 1990 N N . HIS B 1 63 ? 8.040 -0.415 32.764 1.00 34.43 ? 144 HIS B N 1 ATOM 1991 C CA A HIS B 1 63 ? 8.148 0.870 32.079 0.48 34.42 ? 144 HIS B CA 1 ATOM 1992 C CA B HIS B 1 63 ? 8.159 0.871 32.073 0.52 34.59 ? 144 HIS B CA 1 ATOM 1993 C C . HIS B 1 63 ? 7.784 0.666 30.617 1.00 34.46 ? 144 HIS B C 1 ATOM 1994 O O . HIS B 1 63 ? 8.429 -0.114 29.916 1.00 34.46 ? 144 HIS B O 1 ATOM 1995 C CB A HIS B 1 63 ? 9.571 1.429 32.208 0.48 34.35 ? 144 HIS B CB 1 ATOM 1996 C CB B HIS B 1 63 ? 9.592 1.422 32.144 0.52 34.63 ? 144 HIS B CB 1 ATOM 1997 C CG A HIS B 1 63 ? 9.704 2.862 31.790 0.48 34.50 ? 144 HIS B CG 1 ATOM 1998 C CG B HIS B 1 63 ? 9.976 1.994 33.476 0.52 35.56 ? 144 HIS B CG 1 ATOM 1999 N ND1 A HIS B 1 63 ? 9.972 3.237 30.492 0.48 34.82 ? 144 HIS B ND1 1 ATOM 2000 N ND1 B HIS B 1 63 ? 9.053 2.453 34.394 0.52 36.15 ? 144 HIS B ND1 1 ATOM 2001 C CD2 A HIS B 1 63 ? 9.617 4.011 32.503 0.48 34.83 ? 144 HIS B CD2 1 ATOM 2002 C CD2 B HIS B 1 63 ? 11.194 2.221 34.025 0.52 36.42 ? 144 HIS B CD2 1 ATOM 2003 C CE1 A HIS B 1 63 ? 10.040 4.556 30.421 0.48 34.84 ? 144 HIS B CE1 1 ATOM 2004 C CE1 B HIS B 1 63 ? 9.686 2.913 35.459 0.52 36.76 ? 144 HIS B CE1 1 ATOM 2005 N NE2 A HIS B 1 63 ? 9.829 5.049 31.628 0.48 34.80 ? 144 HIS B NE2 1 ATOM 2006 N NE2 B HIS B 1 63 ? 10.986 2.786 35.260 0.52 36.63 ? 144 HIS B NE2 1 ATOM 2007 N N . GLN B 1 64 ? 6.741 1.363 30.168 1.00 34.54 ? 145 GLN B N 1 ATOM 2008 C CA . GLN B 1 64 ? 6.231 1.240 28.794 1.00 34.79 ? 145 GLN B CA 1 ATOM 2009 C C . GLN B 1 64 ? 5.822 -0.189 28.416 1.00 34.73 ? 145 GLN B C 1 ATOM 2010 O O . GLN B 1 64 ? 5.986 -0.609 27.267 1.00 34.64 ? 145 GLN B O 1 ATOM 2011 C CB . GLN B 1 64 ? 7.241 1.783 27.784 1.00 34.87 ? 145 GLN B CB 1 ATOM 2012 C CG . GLN B 1 64 ? 7.227 3.275 27.637 1.00 36.17 ? 145 GLN B CG 1 ATOM 2013 C CD . GLN B 1 64 ? 8.378 3.768 26.789 1.00 38.10 ? 145 GLN B CD 1 ATOM 2014 O OE1 . GLN B 1 64 ? 9.519 3.849 27.256 1.00 39.10 ? 145 GLN B OE1 1 ATOM 2015 N NE2 . GLN B 1 64 ? 8.088 4.103 25.533 1.00 38.64 ? 145 GLN B NE2 1 ATOM 2016 N N . GLY B 1 65 ? 5.294 -0.923 29.394 1.00 34.93 ? 146 GLY B N 1 ATOM 2017 C CA . GLY B 1 65 ? 4.776 -2.273 29.189 1.00 35.34 ? 146 GLY B CA 1 ATOM 2018 C C . GLY B 1 65 ? 5.845 -3.346 29.153 1.00 35.81 ? 146 GLY B C 1 ATOM 2019 O O . GLY B 1 65 ? 5.581 -4.482 28.735 1.00 35.91 ? 146 GLY B O 1 ATOM 2020 N N . LYS B 1 66 ? 7.050 -2.986 29.594 1.00 35.92 ? 147 LYS B N 1 ATOM 2021 C CA . LYS B 1 66 ? 8.188 -3.888 29.572 1.00 36.06 ? 147 LYS B CA 1 ATOM 2022 C C . LYS B 1 66 ? 8.814 -4.014 30.953 1.00 36.00 ? 147 LYS B C 1 ATOM 2023 O O . LYS B 1 66 ? 9.049 -3.023 31.642 1.00 36.02 ? 147 LYS B O 1 ATOM 2024 C CB . LYS B 1 66 ? 9.222 -3.407 28.558 1.00 36.23 ? 147 LYS B CB 1 ATOM 2025 C CG . LYS B 1 66 ? 8.785 -3.562 27.103 1.00 38.17 ? 147 LYS B CG 1 ATOM 2026 C CD . LYS B 1 66 ? 9.558 -2.611 26.206 1.00 41.28 ? 147 LYS B CD 1 ATOM 2027 C CE . LYS B 1 66 ? 8.899 -2.463 24.839 1.00 43.10 ? 147 LYS B CE 1 ATOM 2028 N NZ . LYS B 1 66 ? 9.583 -1.408 24.030 1.00 44.22 ? 147 LYS B NZ 1 ATOM 2029 N N . ILE B 1 67 ? 9.082 -5.246 31.358 1.00 36.06 ? 148 ILE B N 1 ATOM 2030 C CA . ILE B 1 67 ? 9.637 -5.507 32.675 1.00 35.96 ? 148 ILE B CA 1 ATOM 2031 C C . ILE B 1 67 ? 11.153 -5.304 32.672 1.00 36.01 ? 148 ILE B C 1 ATOM 2032 O O . ILE B 1 67 ? 11.823 -5.498 31.645 1.00 36.05 ? 148 ILE B O 1 ATOM 2033 C CB . ILE B 1 67 ? 9.211 -6.913 33.207 1.00 35.92 ? 148 ILE B CB 1 ATOM 2034 C CG1 . ILE B 1 67 ? 9.580 -7.088 34.678 1.00 35.89 ? 148 ILE B CG1 1 ATOM 2035 C CG2 . ILE B 1 67 ? 9.785 -8.027 32.357 1.00 36.00 ? 148 ILE B CG2 1 ATOM 2036 C CD1 . ILE B 1 67 ? 8.615 -6.434 35.628 1.00 35.99 ? 148 ILE B CD1 1 ATOM 2037 N N . GLY B 1 68 ? 11.678 -4.886 33.818 1.00 35.85 ? 149 GLY B N 1 ATOM 2038 C CA . GLY B 1 68 ? 13.081 -4.551 33.938 1.00 35.93 ? 149 GLY B CA 1 ATOM 2039 C C . GLY B 1 68 ? 13.493 -4.261 35.367 1.00 36.24 ? 149 GLY B C 1 ATOM 2040 O O . GLY B 1 68 ? 12.652 -4.019 36.237 1.00 36.40 ? 149 GLY B O 1 ATOM 2041 N N . VAL B 1 69 ? 14.800 -4.283 35.599 1.00 36.13 ? 150 VAL B N 1 ATOM 2042 C CA . VAL B 1 69 ? 15.356 -4.102 36.914 1.00 36.18 ? 150 VAL B CA 1 ATOM 2043 C C . VAL B 1 69 ? 16.380 -2.991 36.833 1.00 36.38 ? 150 VAL B C 1 ATOM 2044 O O . VAL B 1 69 ? 17.136 -2.906 35.873 1.00 36.71 ? 150 VAL B O 1 ATOM 2045 C CB . VAL B 1 69 ? 16.013 -5.407 37.441 1.00 36.42 ? 150 VAL B CB 1 ATOM 2046 C CG1 . VAL B 1 69 ? 16.808 -5.143 38.708 1.00 36.13 ? 150 VAL B CG1 1 ATOM 2047 C CG2 . VAL B 1 69 ? 14.961 -6.492 37.695 1.00 36.10 ? 150 VAL B CG2 1 ATOM 2048 N N . LYS B 1 70 ? 16.378 -2.126 37.838 1.00 36.46 ? 151 LYS B N 1 ATOM 2049 C CA . LYS B 1 70 ? 17.360 -1.074 37.953 1.00 36.36 ? 151 LYS B CA 1 ATOM 2050 C C . LYS B 1 70 ? 17.922 -1.185 39.357 1.00 36.39 ? 151 LYS B C 1 ATOM 2051 O O . LYS B 1 70 ? 17.167 -1.422 40.305 1.00 36.23 ? 151 LYS B O 1 ATOM 2052 C CB . LYS B 1 70 ? 16.706 0.284 37.736 1.00 36.38 ? 151 LYS B CB 1 ATOM 2053 C CG . LYS B 1 70 ? 17.686 1.402 37.420 1.00 37.31 ? 151 LYS B CG 1 ATOM 2054 C CD . LYS B 1 70 ? 16.953 2.657 36.981 1.00 39.30 ? 151 LYS B CD 1 ATOM 2055 C CE . LYS B 1 70 ? 17.835 3.536 36.103 1.00 40.48 ? 151 LYS B CE 1 ATOM 2056 N NZ . LYS B 1 70 ? 17.039 4.526 35.308 1.00 41.47 ? 151 LYS B NZ 1 ATOM 2057 N N . PHE B 1 71 ? 19.242 -1.046 39.488 1.00 36.23 ? 152 PHE B N 1 ATOM 2058 C CA . PHE B 1 71 ? 19.885 -1.153 40.792 1.00 36.44 ? 152 PHE B CA 1 ATOM 2059 C C . PHE B 1 71 ? 21.127 -0.287 40.988 1.00 36.71 ? 152 PHE B C 1 ATOM 2060 O O . PHE B 1 71 ? 21.700 0.254 40.041 1.00 36.39 ? 152 PHE B O 1 ATOM 2061 C CB . PHE B 1 71 ? 20.197 -2.616 41.132 1.00 36.32 ? 152 PHE B CB 1 ATOM 2062 C CG . PHE B 1 71 ? 21.170 -3.273 40.193 1.00 36.37 ? 152 PHE B CG 1 ATOM 2063 C CD1 . PHE B 1 71 ? 22.544 -3.227 40.446 1.00 36.41 ? 152 PHE B CD1 1 ATOM 2064 C CD2 . PHE B 1 71 ? 20.717 -3.956 39.066 1.00 35.54 ? 152 PHE B CD2 1 ATOM 2065 C CE1 . PHE B 1 71 ? 23.447 -3.842 39.580 1.00 36.18 ? 152 PHE B CE1 1 ATOM 2066 C CE2 . PHE B 1 71 ? 21.611 -4.575 38.201 1.00 34.87 ? 152 PHE B CE2 1 ATOM 2067 C CZ . PHE B 1 71 ? 22.978 -4.522 38.458 1.00 35.58 ? 152 PHE B CZ 1 ATOM 2068 N N . ASN B 1 72 ? 21.529 -0.176 42.248 1.00 37.23 ? 153 ASN B N 1 ATOM 2069 C CA . ASN B 1 72 ? 22.649 0.644 42.651 1.00 37.82 ? 153 ASN B CA 1 ATOM 2070 C C . ASN B 1 72 ? 23.369 -0.042 43.797 1.00 38.34 ? 153 ASN B C 1 ATOM 2071 O O . ASN B 1 72 ? 22.778 -0.283 44.843 1.00 38.48 ? 153 ASN B O 1 ATOM 2072 C CB . ASN B 1 72 ? 22.141 2.015 43.092 1.00 37.71 ? 153 ASN B CB 1 ATOM 2073 C CG . ASN B 1 72 ? 23.238 3.047 43.165 1.00 37.22 ? 153 ASN B CG 1 ATOM 2074 O OD1 . ASN B 1 72 ? 24.109 2.984 44.026 1.00 37.55 ? 153 ASN B OD1 1 ATOM 2075 N ND2 . ASN B 1 72 ? 23.189 4.019 42.269 1.00 36.73 ? 153 ASN B ND2 1 ATOM 2076 N N . VAL B 1 73 ? 24.640 -0.368 43.595 1.00 39.08 ? 154 VAL B N 1 ATOM 2077 C CA . VAL B 1 73 ? 25.443 -0.985 44.650 1.00 39.92 ? 154 VAL B CA 1 ATOM 2078 C C . VAL B 1 73 ? 26.635 -0.112 45.040 1.00 40.42 ? 154 VAL B C 1 ATOM 2079 O O . VAL B 1 73 ? 27.763 -0.592 45.174 1.00 40.87 ? 154 VAL B O 1 ATOM 2080 C CB . VAL B 1 73 ? 25.890 -2.426 44.289 1.00 39.91 ? 154 VAL B CB 1 ATOM 2081 C CG1 . VAL B 1 73 ? 24.709 -3.384 44.383 1.00 40.07 ? 154 VAL B CG1 1 ATOM 2082 C CG2 . VAL B 1 73 ? 26.532 -2.478 42.897 1.00 40.57 ? 154 VAL B CG2 1 ATOM 2083 N N . GLY B 1 74 ? 26.369 1.178 45.226 1.00 40.97 ? 155 GLY B N 1 ATOM 2084 C CA . GLY B 1 74 ? 27.396 2.139 45.613 1.00 41.39 ? 155 GLY B CA 1 ATOM 2085 C C . GLY B 1 74 ? 27.887 3.044 44.493 1.00 41.65 ? 155 GLY B C 1 ATOM 2086 O O . GLY B 1 74 ? 27.932 4.265 44.657 1.00 41.95 ? 155 GLY B O 1 ATOM 2087 N N . THR B 1 75 ? 28.265 2.457 43.360 1.00 41.75 ? 156 THR B N 1 ATOM 2088 C CA . THR B 1 75 ? 28.862 3.239 42.266 1.00 41.86 ? 156 THR B CA 1 ATOM 2089 C C . THR B 1 75 ? 27.903 3.759 41.182 1.00 41.57 ? 156 THR B C 1 ATOM 2090 O O . THR B 1 75 ? 27.566 4.947 41.164 1.00 41.78 ? 156 THR B O 1 ATOM 2091 C CB . THR B 1 75 ? 30.081 2.526 41.607 1.00 41.87 ? 156 THR B CB 1 ATOM 2092 O OG1 . THR B 1 75 ? 29.950 1.105 41.745 1.00 42.56 ? 156 THR B OG1 1 ATOM 2093 C CG2 . THR B 1 75 ? 31.373 2.966 42.274 1.00 42.00 ? 156 THR B CG2 1 ATOM 2094 N N . ASP B 1 76 ? 27.464 2.871 40.293 1.00 41.05 ? 157 ASP B N 1 ATOM 2095 C CA . ASP B 1 76 ? 26.630 3.276 39.161 1.00 40.58 ? 157 ASP B CA 1 ATOM 2096 C C . ASP B 1 76 ? 25.222 2.677 39.202 1.00 39.90 ? 157 ASP B C 1 ATOM 2097 O O . ASP B 1 76 ? 25.017 1.543 39.667 1.00 39.54 ? 157 ASP B O 1 ATOM 2098 C CB . ASP B 1 76 ? 27.294 2.978 37.809 1.00 40.76 ? 157 ASP B CB 1 ATOM 2099 C CG . ASP B 1 76 ? 27.968 4.204 37.205 1.00 42.24 ? 157 ASP B CG 1 ATOM 2100 O OD1 . ASP B 1 76 ? 28.966 4.711 37.777 1.00 42.98 ? 157 ASP B OD1 1 ATOM 2101 O OD2 . ASP B 1 76 ? 27.496 4.664 36.141 1.00 44.05 ? 157 ASP B OD2 1 ATOM 2102 N N . ASP B 1 77 ? 24.264 3.479 38.736 1.00 39.01 ? 158 ASP B N 1 ATOM 2103 C CA . ASP B 1 77 ? 22.939 3.004 38.374 1.00 38.38 ? 158 ASP B CA 1 ATOM 2104 C C . ASP B 1 77 ? 23.090 2.067 37.190 1.00 37.62 ? 158 ASP B C 1 ATOM 2105 O O . ASP B 1 77 ? 23.673 2.441 36.161 1.00 37.59 ? 158 ASP B O 1 ATOM 2106 C CB . ASP B 1 77 ? 22.044 4.170 37.950 1.00 38.68 ? 158 ASP B CB 1 ATOM 2107 C CG . ASP B 1 77 ? 21.672 5.076 39.097 1.00 39.25 ? 158 ASP B CG 1 ATOM 2108 O OD1 . ASP B 1 77 ? 20.869 4.654 39.962 1.00 39.83 ? 158 ASP B OD1 1 ATOM 2109 O OD2 . ASP B 1 77 ? 22.164 6.225 39.111 1.00 40.58 ? 158 ASP B OD2 1 ATOM 2110 N N . ILE B 1 78 ? 22.578 0.850 37.334 1.00 36.43 ? 159 ILE B N 1 ATOM 2111 C CA . ILE B 1 78 ? 22.646 -0.125 36.259 1.00 35.49 ? 159 ILE B CA 1 ATOM 2112 C C . ILE B 1 78 ? 21.240 -0.561 35.919 1.00 34.90 ? 159 ILE B C 1 ATOM 2113 O O . ILE B 1 78 ? 20.503 -1.007 36.784 1.00 35.39 ? 159 ILE B O 1 ATOM 2114 C CB . ILE B 1 78 ? 23.546 -1.326 36.628 1.00 35.43 ? 159 ILE B CB 1 ATOM 2115 C CG1 . ILE B 1 78 ? 25.004 -0.867 36.729 1.00 35.55 ? 159 ILE B CG1 1 ATOM 2116 C CG2 . ILE B 1 78 ? 23.418 -2.444 35.591 1.00 34.95 ? 159 ILE B CG2 1 ATOM 2117 C CD1 . ILE B 1 78 ? 25.806 -1.546 37.835 1.00 36.18 ? 159 ILE B CD1 1 ATOM 2118 N N . ALA B 1 79 ? 20.859 -0.408 34.662 1.00 34.22 ? 160 ALA B N 1 ATOM 2119 C CA . ALA B 1 79 ? 19.522 -0.773 34.229 1.00 33.46 ? 160 ALA B CA 1 ATOM 2120 C C . ALA B 1 79 ? 19.603 -1.992 33.346 1.00 33.14 ? 160 ALA B C 1 ATOM 2121 O O . ALA B 1 79 ? 20.493 -2.095 32.515 1.00 33.07 ? 160 ALA B O 1 ATOM 2122 C CB . ALA B 1 79 ? 18.876 0.380 33.485 1.00 33.28 ? 160 ALA B CB 1 ATOM 2123 N N . ILE B 1 80 ? 18.679 -2.921 33.543 1.00 33.03 ? 161 ILE B N 1 ATOM 2124 C CA . ILE B 1 80 ? 18.524 -4.068 32.653 1.00 33.17 ? 161 ILE B CA 1 ATOM 2125 C C . ILE B 1 80 ? 17.052 -4.186 32.274 1.00 33.27 ? 161 ILE B C 1 ATOM 2126 O O . ILE B 1 80 ? 16.184 -4.063 33.113 1.00 33.07 ? 161 ILE B O 1 ATOM 2127 C CB . ILE B 1 80 ? 19.074 -5.396 33.278 1.00 33.24 ? 161 ILE B CB 1 ATOM 2128 C CG1 . ILE B 1 80 ? 19.077 -6.530 32.242 1.00 32.97 ? 161 ILE B CG1 1 ATOM 2129 C CG2 . ILE B 1 80 ? 18.309 -5.784 34.547 1.00 32.62 ? 161 ILE B CG2 1 ATOM 2130 C CD1 . ILE B 1 80 ? 19.858 -7.764 32.663 1.00 32.92 ? 161 ILE B CD1 1 ATOM 2131 N N . GLU B 1 81 ? 16.777 -4.391 30.999 1.00 33.96 ? 162 GLU B N 1 ATOM 2132 C CA . GLU B 1 81 ? 15.400 -4.447 30.537 1.00 35.21 ? 162 GLU B CA 1 ATOM 2133 C C . GLU B 1 81 ? 15.247 -5.497 29.465 1.00 34.83 ? 162 GLU B C 1 ATOM 2134 O O . GLU B 1 81 ? 16.108 -5.617 28.590 1.00 34.95 ? 162 GLU B O 1 ATOM 2135 C CB . GLU B 1 81 ? 14.945 -3.079 30.002 1.00 35.19 ? 162 GLU B CB 1 ATOM 2136 C CG . GLU B 1 81 ? 13.522 -3.061 29.415 1.00 36.48 ? 162 GLU B CG 1 ATOM 2137 C CD . GLU B 1 81 ? 12.977 -1.653 29.240 1.00 37.08 ? 162 GLU B CD 1 ATOM 2138 O OE1 . GLU B 1 81 ? 12.721 -0.986 30.272 1.00 39.38 ? 162 GLU B OE1 1 ATOM 2139 O OE2 . GLU B 1 81 ? 12.806 -1.211 28.074 1.00 39.56 ? 162 GLU B OE2 1 ATOM 2140 N N . GLU B 1 82 ? 14.158 -6.257 29.552 1.00 34.72 ? 163 GLU B N 1 ATOM 2141 C CA . GLU B 1 82 ? 13.723 -7.112 28.457 1.00 35.00 ? 163 GLU B CA 1 ATOM 2142 C C . GLU B 1 82 ? 12.829 -6.267 27.559 1.00 34.63 ? 163 GLU B C 1 ATOM 2143 O O . GLU B 1 82 ? 11.629 -6.128 27.797 1.00 34.54 ? 163 GLU B O 1 ATOM 2144 C CB . GLU B 1 82 ? 13.001 -8.362 28.988 1.00 35.36 ? 163 GLU B CB 1 ATOM 2145 C CG . GLU B 1 82 ? 12.385 -9.282 27.931 1.00 37.60 ? 163 GLU B CG 1 ATOM 2146 C CD . GLU B 1 82 ? 13.060 -9.168 26.573 1.00 40.86 ? 163 GLU B CD 1 ATOM 2147 O OE1 . GLU B 1 82 ? 14.240 -9.563 26.434 1.00 42.57 ? 163 GLU B OE1 1 ATOM 2148 O OE2 . GLU B 1 82 ? 12.402 -8.667 25.641 1.00 41.72 ? 163 GLU B OE2 1 ATOM 2149 N N . SER B 1 83 ? 13.427 -5.690 26.528 1.00 34.46 ? 164 SER B N 1 ATOM 2150 C CA . SER B 1 83 ? 12.731 -4.688 25.732 1.00 34.79 ? 164 SER B CA 1 ATOM 2151 C C . SER B 1 83 ? 11.836 -5.264 24.630 1.00 34.40 ? 164 SER B C 1 ATOM 2152 O O . SER B 1 83 ? 11.023 -4.547 24.055 1.00 34.19 ? 164 SER B O 1 ATOM 2153 C CB . SER B 1 83 ? 13.727 -3.685 25.155 1.00 34.86 ? 164 SER B CB 1 ATOM 2154 O OG . SER B 1 83 ? 14.714 -4.360 24.405 1.00 36.31 ? 164 SER B OG 1 ATOM 2155 N N . ASN B 1 84 ? 11.974 -6.558 24.362 1.00 34.26 ? 165 ASN B N 1 ATOM 2156 C CA . ASN B 1 84 ? 11.234 -7.212 23.287 1.00 34.12 ? 165 ASN B CA 1 ATOM 2157 C C . ASN B 1 84 ? 9.870 -7.773 23.679 1.00 34.35 ? 165 ASN B C 1 ATOM 2158 O O . ASN B 1 84 ? 9.020 -7.960 22.817 1.00 34.84 ? 165 ASN B O 1 ATOM 2159 C CB . ASN B 1 84 ? 12.093 -8.299 22.642 1.00 33.86 ? 165 ASN B CB 1 ATOM 2160 C CG . ASN B 1 84 ? 13.242 -7.725 21.854 1.00 32.73 ? 165 ASN B CG 1 ATOM 2161 O OD1 . ASN B 1 84 ? 13.034 -7.007 20.876 1.00 32.09 ? 165 ASN B OD1 1 ATOM 2162 N ND2 . ASN B 1 84 ? 14.464 -8.027 22.277 1.00 31.36 ? 165 ASN B ND2 1 ATOM 2163 N N . ALA B 1 85 ? 9.660 -8.035 24.965 1.00 34.45 ? 166 ALA B N 1 ATOM 2164 C CA . ALA B 1 85 ? 8.388 -8.583 25.444 1.00 34.54 ? 166 ALA B CA 1 ATOM 2165 C C . ALA B 1 85 ? 7.435 -7.526 26.000 1.00 34.52 ? 166 ALA B C 1 ATOM 2166 O O . ALA B 1 85 ? 7.717 -6.906 27.034 1.00 34.48 ? 166 ALA B O 1 ATOM 2167 C CB . ALA B 1 85 ? 8.647 -9.646 26.509 1.00 34.94 ? 166 ALA B CB 1 ATOM 2168 N N . ILE B 1 86 ? 6.308 -7.328 25.321 1.00 34.40 ? 167 ILE B N 1 ATOM 2169 C CA . ILE B 1 86 ? 5.196 -6.561 25.888 1.00 34.47 ? 167 ILE B CA 1 ATOM 2170 C C . ILE B 1 86 ? 4.462 -7.456 26.889 1.00 34.31 ? 167 ILE B C 1 ATOM 2171 O O . ILE B 1 86 ? 3.822 -8.438 26.504 1.00 34.47 ? 167 ILE B O 1 ATOM 2172 C CB . ILE B 1 86 ? 4.223 -6.061 24.803 1.00 34.55 ? 167 ILE B CB 1 ATOM 2173 C CG1 . ILE B 1 86 ? 4.945 -5.182 23.776 1.00 35.14 ? 167 ILE B CG1 1 ATOM 2174 C CG2 . ILE B 1 86 ? 3.059 -5.303 25.426 1.00 35.32 ? 167 ILE B CG2 1 ATOM 2175 C CD1 . ILE B 1 86 ? 5.595 -3.920 24.356 1.00 36.97 ? 167 ILE B CD1 1 ATOM 2176 N N . ILE B 1 87 ? 4.568 -7.115 28.170 1.00 34.10 ? 168 ILE B N 1 ATOM 2177 C CA . ILE B 1 87 ? 4.096 -7.989 29.243 1.00 33.94 ? 168 ILE B CA 1 ATOM 2178 C C . ILE B 1 87 ? 2.880 -7.490 30.035 1.00 34.00 ? 168 ILE B C 1 ATOM 2179 O O . ILE B 1 87 ? 2.531 -8.078 31.064 1.00 33.98 ? 168 ILE B O 1 ATOM 2180 C CB . ILE B 1 87 ? 5.238 -8.368 30.235 1.00 33.93 ? 168 ILE B CB 1 ATOM 2181 C CG1 . ILE B 1 87 ? 6.102 -7.153 30.603 1.00 34.40 ? 168 ILE B CG1 1 ATOM 2182 C CG2 . ILE B 1 87 ? 6.102 -9.459 29.658 1.00 33.89 ? 168 ILE B CG2 1 ATOM 2183 C CD1 . ILE B 1 87 ? 5.443 -6.171 31.571 1.00 35.05 ? 168 ILE B CD1 1 ATOM 2184 N N . ASN B 1 88 ? 2.239 -6.416 29.574 1.00 33.88 ? 169 ASN B N 1 ATOM 2185 C CA . ASN B 1 88 ? 1.040 -5.926 30.251 1.00 33.77 ? 169 ASN B CA 1 ATOM 2186 C C . ASN B 1 88 ? -0.256 -6.352 29.569 1.00 33.81 ? 169 ASN B C 1 ATOM 2187 O O . ASN B 1 88 ? -1.169 -5.554 29.366 1.00 33.84 ? 169 ASN B O 1 ATOM 2188 C CB . ASN B 1 88 ? 1.097 -4.414 30.469 1.00 34.01 ? 169 ASN B CB 1 ATOM 2189 C CG . ASN B 1 88 ? 1.074 -3.621 29.175 1.00 34.18 ? 169 ASN B CG 1 ATOM 2190 O OD1 . ASN B 1 88 ? 1.585 -4.057 28.145 1.00 34.59 ? 169 ASN B OD1 1 ATOM 2191 N ND2 . ASN B 1 88 ? 0.488 -2.434 29.232 1.00 33.96 ? 169 ASN B ND2 1 ATOM 2192 N N . ASP B 1 89 ? -0.322 -7.640 29.244 1.00 33.84 ? 170 ASP B N 1 ATOM 2193 C CA . ASP B 1 89 ? -1.461 -8.245 28.563 1.00 33.68 ? 170 ASP B CA 1 ATOM 2194 C C . ASP B 1 89 ? -2.440 -8.888 29.542 1.00 33.50 ? 170 ASP B C 1 ATOM 2195 O O . ASP B 1 89 ? -3.408 -9.537 29.125 1.00 33.70 ? 170 ASP B O 1 ATOM 2196 C CB . ASP B 1 89 ? -0.971 -9.294 27.555 1.00 33.82 ? 170 ASP B CB 1 ATOM 2197 C CG . ASP B 1 89 ? -0.004 -10.325 28.174 1.00 35.13 ? 170 ASP B CG 1 ATOM 2198 O OD1 . ASP B 1 89 ? 0.393 -10.195 29.367 1.00 35.97 ? 170 ASP B OD1 1 ATOM 2199 O OD2 . ASP B 1 89 ? 0.373 -11.273 27.446 1.00 35.52 ? 170 ASP B OD2 1 ATOM 2200 N N . GLY B 1 90 ? -2.186 -8.711 30.840 1.00 33.08 ? 171 GLY B N 1 ATOM 2201 C CA . GLY B 1 90 ? -3.023 -9.297 31.888 1.00 32.50 ? 171 GLY B CA 1 ATOM 2202 C C . GLY B 1 90 ? -2.915 -10.807 31.967 1.00 32.20 ? 171 GLY B C 1 ATOM 2203 O O . GLY B 1 90 ? -3.817 -11.481 32.463 1.00 32.16 ? 171 GLY B O 1 ATOM 2204 N N . LYS B 1 91 ? -1.807 -11.333 31.460 1.00 32.16 ? 172 LYS B N 1 ATOM 2205 C CA . LYS B 1 91 ? -1.509 -12.754 31.525 1.00 32.18 ? 172 LYS B CA 1 ATOM 2206 C C . LYS B 1 91 ? -0.296 -13.001 32.417 1.00 32.37 ? 172 LYS B C 1 ATOM 2207 O O . LYS B 1 91 ? 0.508 -12.094 32.675 1.00 32.64 ? 172 LYS B O 1 ATOM 2208 C CB . LYS B 1 91 ? -1.280 -13.325 30.119 1.00 32.11 ? 172 LYS B CB 1 ATOM 2209 C CG . LYS B 1 91 ? -2.554 -13.470 29.266 1.00 32.19 ? 172 LYS B CG 1 ATOM 2210 C CD . LYS B 1 91 ? -3.408 -14.651 29.725 1.00 32.39 ? 172 LYS B CD 1 ATOM 2211 C CE . LYS B 1 91 ? -4.714 -14.760 28.946 1.00 32.82 ? 172 LYS B CE 1 ATOM 2212 N NZ . LYS B 1 91 ? -5.617 -15.804 29.523 1.00 32.59 ? 172 LYS B NZ 1 ATOM 2213 N N . TYR B 1 92 ? -0.166 -14.235 32.883 1.00 32.41 ? 173 TYR B N 1 ATOM 2214 C CA . TYR B 1 92 ? 0.929 -14.625 33.759 1.00 32.58 ? 173 TYR B CA 1 ATOM 2215 C C . TYR B 1 92 ? 2.308 -14.624 33.081 1.00 32.72 ? 173 TYR B C 1 ATOM 2216 O O . TYR B 1 92 ? 2.488 -15.203 32.010 1.00 32.26 ? 173 TYR B O 1 ATOM 2217 C CB . TYR B 1 92 ? 0.633 -16.001 34.326 1.00 32.48 ? 173 TYR B CB 1 ATOM 2218 C CG . TYR B 1 92 ? 1.587 -16.455 35.384 1.00 32.56 ? 173 TYR B CG 1 ATOM 2219 C CD1 . TYR B 1 92 ? 1.556 -15.903 36.659 1.00 32.92 ? 173 TYR B CD1 1 ATOM 2220 C CD2 . TYR B 1 92 ? 2.507 -17.461 35.119 1.00 32.86 ? 173 TYR B CD2 1 ATOM 2221 C CE1 . TYR B 1 92 ? 2.432 -16.338 37.645 1.00 33.83 ? 173 TYR B CE1 1 ATOM 2222 C CE2 . TYR B 1 92 ? 3.387 -17.901 36.090 1.00 33.43 ? 173 TYR B CE2 1 ATOM 2223 C CZ . TYR B 1 92 ? 3.350 -17.338 37.353 1.00 33.67 ? 173 TYR B CZ 1 ATOM 2224 O OH . TYR B 1 92 ? 4.234 -17.780 38.320 1.00 33.38 ? 173 TYR B OH 1 ATOM 2225 N N . HIS B 1 93 ? 3.267 -13.964 33.733 1.00 33.26 ? 174 HIS B N 1 ATOM 2226 C CA . HIS B 1 93 ? 4.685 -13.980 33.340 1.00 33.72 ? 174 HIS B CA 1 ATOM 2227 C C . HIS B 1 93 ? 5.530 -14.240 34.569 1.00 34.18 ? 174 HIS B C 1 ATOM 2228 O O . HIS B 1 93 ? 5.072 -14.017 35.696 1.00 34.32 ? 174 HIS B O 1 ATOM 2229 C CB . HIS B 1 93 ? 5.104 -12.654 32.706 1.00 33.43 ? 174 HIS B CB 1 ATOM 2230 C CG . HIS B 1 93 ? 4.195 -12.207 31.609 1.00 33.70 ? 174 HIS B CG 1 ATOM 2231 N ND1 . HIS B 1 93 ? 4.333 -12.637 30.308 1.00 33.99 ? 174 HIS B ND1 1 ATOM 2232 C CD2 . HIS B 1 93 ? 3.110 -11.400 31.626 1.00 34.12 ? 174 HIS B CD2 1 ATOM 2233 C CE1 . HIS B 1 93 ? 3.380 -12.102 29.566 1.00 34.32 ? 174 HIS B CE1 1 ATOM 2234 N NE2 . HIS B 1 93 ? 2.622 -11.350 30.344 1.00 34.90 ? 174 HIS B NE2 1 ATOM 2235 N N . VAL B 1 94 ? 6.751 -14.723 34.356 1.00 34.60 ? 175 VAL B N 1 ATOM 2236 C CA . VAL B 1 94 ? 7.679 -14.956 35.451 1.00 35.30 ? 175 VAL B CA 1 ATOM 2237 C C . VAL B 1 94 ? 8.977 -14.241 35.139 1.00 36.08 ? 175 VAL B C 1 ATOM 2238 O O . VAL B 1 94 ? 9.593 -14.509 34.106 1.00 36.52 ? 175 VAL B O 1 ATOM 2239 C CB . VAL B 1 94 ? 7.955 -16.459 35.679 1.00 35.15 ? 175 VAL B CB 1 ATOM 2240 C CG1 . VAL B 1 94 ? 9.048 -16.665 36.721 1.00 35.12 ? 175 VAL B CG1 1 ATOM 2241 C CG2 . VAL B 1 94 ? 6.698 -17.168 36.112 1.00 35.12 ? 175 VAL B CG2 1 ATOM 2242 N N . VAL B 1 95 ? 9.375 -13.328 36.026 1.00 36.52 ? 176 VAL B N 1 ATOM 2243 C CA . VAL B 1 95 ? 10.662 -12.639 35.932 1.00 37.03 ? 176 VAL B CA 1 ATOM 2244 C C . VAL B 1 95 ? 11.684 -13.283 36.862 1.00 37.19 ? 176 VAL B C 1 ATOM 2245 O O . VAL B 1 95 ? 11.390 -13.539 38.027 1.00 37.56 ? 176 VAL B O 1 ATOM 2246 C CB . VAL B 1 95 ? 10.553 -11.153 36.315 1.00 36.88 ? 176 VAL B CB 1 ATOM 2247 C CG1 . VAL B 1 95 ? 11.859 -10.429 36.030 1.00 37.38 ? 176 VAL B CG1 1 ATOM 2248 C CG2 . VAL B 1 95 ? 9.455 -10.502 35.549 1.00 37.67 ? 176 VAL B CG2 1 ATOM 2249 N N . ARG B 1 96 ? 12.883 -13.526 36.341 1.00 37.29 ? 177 ARG B N 1 ATOM 2250 C CA . ARG B 1 96 ? 13.987 -14.039 37.140 1.00 37.47 ? 177 ARG B CA 1 ATOM 2251 C C . ARG B 1 96 ? 15.198 -13.124 37.024 1.00 37.12 ? 177 ARG B C 1 ATOM 2252 O O . ARG B 1 96 ? 15.707 -12.893 35.932 1.00 37.21 ? 177 ARG B O 1 ATOM 2253 C CB . ARG B 1 96 ? 14.367 -15.454 36.708 1.00 37.70 ? 177 ARG B CB 1 ATOM 2254 C CG . ARG B 1 96 ? 13.327 -16.499 37.003 1.00 38.68 ? 177 ARG B CG 1 ATOM 2255 C CD . ARG B 1 96 ? 13.983 -17.841 37.125 1.00 42.30 ? 177 ARG B CD 1 ATOM 2256 N NE . ARG B 1 96 ? 12.997 -18.909 37.189 1.00 46.35 ? 177 ARG B NE 1 ATOM 2257 C CZ . ARG B 1 96 ? 12.709 -19.717 36.174 1.00 48.60 ? 177 ARG B CZ 1 ATOM 2258 N NH1 . ARG B 1 96 ? 13.349 -19.584 35.013 1.00 49.56 ? 177 ARG B NH1 1 ATOM 2259 N NH2 . ARG B 1 96 ? 11.786 -20.665 36.321 1.00 48.83 ? 177 ARG B NH2 1 ATOM 2260 N N . PHE B 1 97 ? 15.656 -12.612 38.158 1.00 36.74 ? 178 PHE B N 1 ATOM 2261 C CA . PHE B 1 97 ? 16.793 -11.702 38.180 1.00 36.27 ? 178 PHE B CA 1 ATOM 2262 C C . PHE B 1 97 ? 17.927 -12.263 39.023 1.00 35.99 ? 178 PHE B C 1 ATOM 2263 O O . PHE B 1 97 ? 17.698 -12.805 40.105 1.00 36.06 ? 178 PHE B O 1 ATOM 2264 C CB . PHE B 1 97 ? 16.377 -10.334 38.723 1.00 36.06 ? 178 PHE B CB 1 ATOM 2265 C CG . PHE B 1 97 ? 17.503 -9.346 38.791 1.00 36.12 ? 178 PHE B CG 1 ATOM 2266 C CD1 . PHE B 1 97 ? 17.959 -8.711 37.641 1.00 36.29 ? 178 PHE B CD1 1 ATOM 2267 C CD2 . PHE B 1 97 ? 18.107 -9.045 40.004 1.00 35.64 ? 178 PHE B CD2 1 ATOM 2268 C CE1 . PHE B 1 97 ? 19.002 -7.794 37.700 1.00 35.38 ? 178 PHE B CE1 1 ATOM 2269 C CE2 . PHE B 1 97 ? 19.139 -8.134 40.070 1.00 34.94 ? 178 PHE B CE2 1 ATOM 2270 C CZ . PHE B 1 97 ? 19.590 -7.505 38.919 1.00 35.46 ? 178 PHE B CZ 1 ATOM 2271 N N . THR B 1 98 ? 19.147 -12.145 38.511 1.00 35.33 ? 179 THR B N 1 ATOM 2272 C CA . THR B 1 98 ? 20.337 -12.420 39.297 1.00 34.76 ? 179 THR B CA 1 ATOM 2273 C C . THR B 1 98 ? 21.270 -11.240 39.097 1.00 34.13 ? 179 THR B C 1 ATOM 2274 O O . THR B 1 98 ? 21.258 -10.611 38.043 1.00 34.34 ? 179 THR B O 1 ATOM 2275 C CB . THR B 1 98 ? 21.071 -13.741 38.893 1.00 34.93 ? 179 THR B CB 1 ATOM 2276 O OG1 . THR B 1 98 ? 21.843 -13.531 37.700 1.00 35.85 ? 179 THR B OG1 1 ATOM 2277 C CG2 . THR B 1 98 ? 20.099 -14.904 38.679 1.00 34.63 ? 179 THR B CG2 1 ATOM 2278 N N . ARG B 1 99 ? 22.068 -10.942 40.116 1.00 33.22 ? 180 ARG B N 1 ATOM 2279 C CA . ARG B 1 99 ? 23.070 -9.891 40.045 1.00 32.04 ? 180 ARG B CA 1 ATOM 2280 C C . ARG B 1 99 ? 24.333 -10.478 40.632 1.00 31.51 ? 180 ARG B C 1 ATOM 2281 O O . ARG B 1 99 ? 24.285 -11.077 41.696 1.00 31.39 ? 180 ARG B O 1 ATOM 2282 C CB . ARG B 1 99 ? 22.630 -8.670 40.862 1.00 31.68 ? 180 ARG B CB 1 ATOM 2283 C CG . ARG B 1 99 ? 23.682 -7.577 40.959 1.00 31.75 ? 180 ARG B CG 1 ATOM 2284 C CD . ARG B 1 99 ? 23.360 -6.527 42.030 1.00 31.92 ? 180 ARG B CD 1 ATOM 2285 N NE . ARG B 1 99 ? 23.629 -6.992 43.390 1.00 31.29 ? 180 ARG B NE 1 ATOM 2286 C CZ . ARG B 1 99 ? 24.819 -6.958 43.991 1.00 31.55 ? 180 ARG B CZ 1 ATOM 2287 N NH1 . ARG B 1 99 ? 25.893 -6.476 43.364 1.00 31.18 ? 180 ARG B NH1 1 ATOM 2288 N NH2 . ARG B 1 99 ? 24.935 -7.416 45.231 1.00 31.09 ? 180 ARG B NH2 1 ATOM 2289 N N . SER B 1 100 ? 25.446 -10.342 39.921 1.00 30.89 ? 181 SER B N 1 ATOM 2290 C CA . SER B 1 100 ? 26.761 -10.618 40.473 1.00 30.45 ? 181 SER B CA 1 ATOM 2291 C C . SER B 1 100 ? 27.583 -9.357 40.270 1.00 30.60 ? 181 SER B C 1 ATOM 2292 O O . SER B 1 100 ? 27.960 -9.030 39.138 1.00 30.87 ? 181 SER B O 1 ATOM 2293 C CB . SER B 1 100 ? 27.421 -11.807 39.770 1.00 30.53 ? 181 SER B CB 1 ATOM 2294 O OG . SER B 1 100 ? 28.724 -12.070 40.285 1.00 29.59 ? 181 SER B OG 1 ATOM 2295 N N . GLY B 1 101 ? 27.843 -8.641 41.361 1.00 30.21 ? 182 GLY B N 1 ATOM 2296 C CA . GLY B 1 101 ? 28.556 -7.377 41.295 1.00 29.92 ? 182 GLY B CA 1 ATOM 2297 C C . GLY B 1 101 ? 27.794 -6.377 40.454 1.00 29.86 ? 182 GLY B C 1 ATOM 2298 O O . GLY B 1 101 ? 26.653 -6.048 40.767 1.00 29.69 ? 182 GLY B O 1 ATOM 2299 N N . GLY B 1 102 ? 28.437 -5.907 39.383 1.00 29.93 ? 183 GLY B N 1 ATOM 2300 C CA . GLY B 1 102 ? 27.825 -4.986 38.425 1.00 29.89 ? 183 GLY B CA 1 ATOM 2301 C C . GLY B 1 102 ? 27.178 -5.688 37.239 1.00 29.97 ? 183 GLY B C 1 ATOM 2302 O O . GLY B 1 102 ? 26.518 -5.048 36.419 1.00 29.99 ? 183 GLY B O 1 ATOM 2303 N N . ASN B 1 103 ? 27.378 -7.002 37.152 1.00 29.91 ? 184 ASN B N 1 ATOM 2304 C CA . ASN B 1 103 ? 26.742 -7.838 36.148 1.00 29.91 ? 184 ASN B CA 1 ATOM 2305 C C . ASN B 1 103 ? 25.372 -8.298 36.590 1.00 29.47 ? 184 ASN B C 1 ATOM 2306 O O . ASN B 1 103 ? 25.142 -8.537 37.771 1.00 29.56 ? 184 ASN B O 1 ATOM 2307 C CB . ASN B 1 103 ? 27.594 -9.063 35.863 1.00 30.29 ? 184 ASN B CB 1 ATOM 2308 C CG . ASN B 1 103 ? 29.024 -8.718 35.620 1.00 32.22 ? 184 ASN B CG 1 ATOM 2309 O OD1 . ASN B 1 103 ? 29.327 -7.625 35.140 1.00 32.51 ? 184 ASN B OD1 1 ATOM 2310 N ND2 . ASN B 1 103 ? 29.926 -9.646 35.964 1.00 35.96 ? 184 ASN B ND2 1 ATOM 2311 N N . ALA B 1 104 ? 24.467 -8.434 35.631 1.00 29.12 ? 185 ALA B N 1 ATOM 2312 C CA . ALA B 1 104 ? 23.108 -8.874 35.913 1.00 28.93 ? 185 ALA B CA 1 ATOM 2313 C C . ALA B 1 104 ? 22.585 -9.727 34.763 1.00 28.65 ? 185 ALA B C 1 ATOM 2314 O O . ALA B 1 104 ? 23.058 -9.601 33.628 1.00 28.66 ? 185 ALA B O 1 ATOM 2315 C CB . ALA B 1 104 ? 22.202 -7.670 36.143 1.00 28.71 ? 185 ALA B CB 1 ATOM 2316 N N . THR B 1 105 ? 21.644 -10.613 35.067 1.00 28.33 ? 186 THR B N 1 ATOM 2317 C CA . THR B 1 105 ? 20.893 -11.321 34.038 1.00 28.73 ? 186 THR B CA 1 ATOM 2318 C C . THR B 1 105 ? 19.419 -11.161 34.352 1.00 28.59 ? 186 THR B C 1 ATOM 2319 O O . THR B 1 105 ? 19.042 -11.088 35.506 1.00 28.68 ? 186 THR B O 1 ATOM 2320 C CB . THR B 1 105 ? 21.210 -12.826 33.979 1.00 28.66 ? 186 THR B CB 1 ATOM 2321 O OG1 . THR B 1 105 ? 20.583 -13.471 35.085 1.00 30.09 ? 186 THR B OG1 1 ATOM 2322 C CG2 . THR B 1 105 ? 22.713 -13.102 34.024 1.00 28.48 ? 186 THR B CG2 1 ATOM 2323 N N . LEU B 1 106 ? 18.589 -11.092 33.325 1.00 29.09 ? 187 LEU B N 1 ATOM 2324 C CA . LEU B 1 106 ? 17.149 -10.968 33.505 1.00 29.38 ? 187 LEU B CA 1 ATOM 2325 C C . LEU B 1 106 ? 16.485 -11.997 32.613 1.00 30.13 ? 187 LEU B C 1 ATOM 2326 O O . LEU B 1 106 ? 16.794 -12.090 31.418 1.00 30.50 ? 187 LEU B O 1 ATOM 2327 C CB . LEU B 1 106 ? 16.674 -9.559 33.128 1.00 29.13 ? 187 LEU B CB 1 ATOM 2328 C CG . LEU B 1 106 ? 15.219 -9.149 33.390 1.00 28.90 ? 187 LEU B CG 1 ATOM 2329 C CD1 . LEU B 1 106 ? 15.019 -8.765 34.835 1.00 28.95 ? 187 LEU B CD1 1 ATOM 2330 C CD2 . LEU B 1 106 ? 14.790 -7.994 32.500 1.00 28.96 ? 187 LEU B CD2 1 ATOM 2331 N N . GLN B 1 107 ? 15.573 -12.765 33.191 1.00 30.77 ? 188 GLN B N 1 ATOM 2332 C CA . GLN B 1 107 ? 14.859 -13.794 32.454 1.00 31.75 ? 188 GLN B CA 1 ATOM 2333 C C . GLN B 1 107 ? 13.348 -13.582 32.564 1.00 32.02 ? 188 GLN B C 1 ATOM 2334 O O . GLN B 1 107 ? 12.834 -13.339 33.653 1.00 32.33 ? 188 GLN B O 1 ATOM 2335 C CB . GLN B 1 107 ? 15.253 -15.176 32.973 1.00 31.85 ? 188 GLN B CB 1 ATOM 2336 C CG . GLN B 1 107 ? 14.950 -16.284 31.998 1.00 33.64 ? 188 GLN B CG 1 ATOM 2337 C CD . GLN B 1 107 ? 15.319 -17.658 32.522 1.00 35.83 ? 188 GLN B CD 1 ATOM 2338 O OE1 . GLN B 1 107 ? 16.345 -17.834 33.190 1.00 36.13 ? 188 GLN B OE1 1 ATOM 2339 N NE2 . GLN B 1 107 ? 14.482 -18.648 32.208 1.00 36.00 ? 188 GLN B NE2 1 ATOM 2340 N N . VAL B 1 108 ? 12.650 -13.650 31.433 1.00 32.31 ? 189 VAL B N 1 ATOM 2341 C CA . VAL B 1 108 ? 11.200 -13.464 31.397 1.00 32.71 ? 189 VAL B CA 1 ATOM 2342 C C . VAL B 1 108 ? 10.572 -14.641 30.662 1.00 32.98 ? 189 VAL B C 1 ATOM 2343 O O . VAL B 1 108 ? 10.881 -14.885 29.491 1.00 33.58 ? 189 VAL B O 1 ATOM 2344 C CB . VAL B 1 108 ? 10.776 -12.133 30.678 1.00 32.70 ? 189 VAL B CB 1 ATOM 2345 C CG1 . VAL B 1 108 ? 9.268 -11.948 30.732 1.00 33.24 ? 189 VAL B CG1 1 ATOM 2346 C CG2 . VAL B 1 108 ? 11.442 -10.924 31.293 1.00 32.69 ? 189 VAL B CG2 1 ATOM 2347 N N . ASP B 1 109 ? 9.698 -15.371 31.345 1.00 33.04 ? 190 ASP B N 1 ATOM 2348 C CA . ASP B 1 109 ? 8.925 -16.431 30.710 1.00 32.88 ? 190 ASP B CA 1 ATOM 2349 C C . ASP B 1 109 ? 7.505 -15.955 30.442 1.00 32.45 ? 190 ASP B C 1 ATOM 2350 O O . ASP B 1 109 ? 6.879 -15.325 31.293 1.00 32.36 ? 190 ASP B O 1 ATOM 2351 C CB . ASP B 1 109 ? 8.897 -17.686 31.581 1.00 33.20 ? 190 ASP B CB 1 ATOM 2352 C CG . ASP B 1 109 ? 10.232 -18.401 31.621 1.00 34.57 ? 190 ASP B CG 1 ATOM 2353 O OD1 . ASP B 1 109 ? 10.654 -18.979 30.593 1.00 36.30 ? 190 ASP B OD1 1 ATOM 2354 O OD2 . ASP B 1 109 ? 10.858 -18.401 32.697 1.00 37.38 ? 190 ASP B OD2 1 ATOM 2355 N N . SER B 1 110 ? 7.015 -16.250 29.244 1.00 32.08 ? 191 SER B N 1 ATOM 2356 C CA . SER B 1 110 ? 5.638 -15.972 28.869 1.00 31.79 ? 191 SER B CA 1 ATOM 2357 C C . SER B 1 110 ? 5.084 -17.211 28.197 1.00 31.68 ? 191 SER B C 1 ATOM 2358 O O . SER B 1 110 ? 5.852 -18.044 27.711 1.00 31.75 ? 191 SER B O 1 ATOM 2359 C CB . SER B 1 110 ? 5.571 -14.800 27.895 1.00 31.50 ? 191 SER B CB 1 ATOM 2360 O OG . SER B 1 110 ? 6.120 -13.633 28.466 1.00 32.21 ? 191 SER B OG 1 ATOM 2361 N N . TRP B 1 111 ? 3.757 -17.326 28.155 1.00 31.44 ? 192 TRP B N 1 ATOM 2362 C CA . TRP B 1 111 ? 3.113 -18.432 27.460 1.00 31.12 ? 192 TRP B CA 1 ATOM 2363 C C . TRP B 1 111 ? 2.126 -17.975 26.373 1.00 31.16 ? 192 TRP B C 1 ATOM 2364 O O . TRP B 1 111 ? 0.912 -18.160 26.513 1.00 31.13 ? 192 TRP B O 1 ATOM 2365 C CB . TRP B 1 111 ? 2.470 -19.371 28.473 1.00 31.06 ? 192 TRP B CB 1 ATOM 2366 C CG . TRP B 1 111 ? 3.493 -20.093 29.287 1.00 31.07 ? 192 TRP B CG 1 ATOM 2367 C CD1 . TRP B 1 111 ? 4.000 -21.331 29.041 1.00 31.33 ? 192 TRP B CD1 1 ATOM 2368 C CD2 . TRP B 1 111 ? 4.156 -19.614 30.467 1.00 30.83 ? 192 TRP B CD2 1 ATOM 2369 N NE1 . TRP B 1 111 ? 4.930 -21.663 29.997 1.00 31.49 ? 192 TRP B NE1 1 ATOM 2370 C CE2 . TRP B 1 111 ? 5.052 -20.623 30.879 1.00 30.78 ? 192 TRP B CE2 1 ATOM 2371 C CE3 . TRP B 1 111 ? 4.086 -18.430 31.210 1.00 31.19 ? 192 TRP B CE3 1 ATOM 2372 C CZ2 . TRP B 1 111 ? 5.866 -20.489 32.002 1.00 30.44 ? 192 TRP B CZ2 1 ATOM 2373 C CZ3 . TRP B 1 111 ? 4.900 -18.295 32.327 1.00 31.30 ? 192 TRP B CZ3 1 ATOM 2374 C CH2 . TRP B 1 111 ? 5.773 -19.322 32.714 1.00 31.19 ? 192 TRP B CH2 1 ATOM 2375 N N . PRO B 1 112 ? 2.651 -17.394 25.270 1.00 31.23 ? 193 PRO B N 1 ATOM 2376 C CA . PRO B 1 112 ? 1.817 -16.809 24.214 1.00 31.48 ? 193 PRO B CA 1 ATOM 2377 C C . PRO B 1 112 ? 0.927 -17.817 23.484 1.00 31.97 ? 193 PRO B C 1 ATOM 2378 O O . PRO B 1 112 ? 1.349 -18.942 23.204 1.00 31.93 ? 193 PRO B O 1 ATOM 2379 C CB . PRO B 1 112 ? 2.847 -16.221 23.242 1.00 31.08 ? 193 PRO B CB 1 ATOM 2380 C CG . PRO B 1 112 ? 4.061 -17.017 23.468 1.00 30.90 ? 193 PRO B CG 1 ATOM 2381 C CD . PRO B 1 112 ? 4.082 -17.257 24.943 1.00 31.02 ? 193 PRO B CD 1 ATOM 2382 N N . VAL B 1 113 ? -0.289 -17.387 23.162 1.00 32.56 ? 194 VAL B N 1 ATOM 2383 C CA . VAL B 1 113 ? -1.266 -18.235 22.496 1.00 33.21 ? 194 VAL B CA 1 ATOM 2384 C C . VAL B 1 113 ? -1.463 -17.867 21.013 1.00 33.78 ? 194 VAL B C 1 ATOM 2385 O O . VAL B 1 113 ? -2.373 -18.370 20.357 1.00 33.55 ? 194 VAL B O 1 ATOM 2386 C CB . VAL B 1 113 ? -2.631 -18.169 23.205 1.00 20.00 ? 194 VAL B CB 1 ATOM 2387 C CG1 . VAL B 1 113 ? -3.669 -18.976 22.440 1.00 20.00 ? 194 VAL B CG1 1 ATOM 2388 C CG2 . VAL B 1 113 ? -2.512 -18.665 24.638 1.00 20.00 ? 194 VAL B CG2 1 ATOM 2389 N N . ILE B 1 114 ? -0.600 -16.993 20.493 1.00 34.93 ? 195 ILE B N 1 ATOM 2390 C CA . ILE B 1 114 ? -0.675 -16.555 19.085 1.00 35.94 ? 195 ILE B CA 1 ATOM 2391 C C . ILE B 1 114 ? 0.618 -16.817 18.298 1.00 36.79 ? 195 ILE B C 1 ATOM 2392 O O . ILE B 1 114 ? 1.690 -17.005 18.888 1.00 36.72 ? 195 ILE B O 1 ATOM 2393 C CB . ILE B 1 114 ? -1.084 -15.053 18.949 1.00 35.87 ? 195 ILE B CB 1 ATOM 2394 C CG1 . ILE B 1 114 ? -0.122 -14.148 19.730 1.00 35.43 ? 195 ILE B CG1 1 ATOM 2395 C CG2 . ILE B 1 114 ? -2.552 -14.846 19.363 1.00 35.68 ? 195 ILE B CG2 1 ATOM 2396 C CD1 . ILE B 1 114 ? -0.433 -12.660 19.641 1.00 35.77 ? 195 ILE B CD1 1 ATOM 2397 N N . GLU B 1 115 ? 0.499 -16.830 16.970 1.00 37.78 ? 196 GLU B N 1 ATOM 2398 C CA . GLU B 1 115 ? 1.650 -16.947 16.072 1.00 39.15 ? 196 GLU B CA 1 ATOM 2399 C C . GLU B 1 115 ? 1.480 -16.120 14.785 1.00 40.00 ? 196 GLU B C 1 ATOM 2400 O O . GLU B 1 115 ? 0.391 -16.063 14.204 1.00 39.95 ? 196 GLU B O 1 ATOM 2401 C CB . GLU B 1 115 ? 1.955 -18.421 15.751 1.00 39.07 ? 196 GLU B CB 1 ATOM 2402 C CG . GLU B 1 115 ? 2.766 -18.650 14.461 1.00 39.56 ? 196 GLU B CG 1 ATOM 2403 C CD . GLU B 1 115 ? 3.460 -20.005 14.400 1.00 39.58 ? 196 GLU B CD 1 ATOM 2404 O OE1 . GLU B 1 115 ? 4.198 -20.360 15.355 1.00 39.94 ? 196 GLU B OE1 1 ATOM 2405 O OE2 . GLU B 1 115 ? 3.276 -20.705 13.380 1.00 39.43 ? 196 GLU B OE2 1 ATOM 2406 N N . ARG B 1 116 ? 2.571 -15.481 14.355 1.00 41.24 ? 197 ARG B N 1 ATOM 2407 C CA . ARG B 1 116 ? 2.609 -14.707 13.106 1.00 42.19 ? 197 ARG B CA 1 ATOM 2408 C C . ARG B 1 116 ? 3.737 -15.210 12.203 1.00 42.44 ? 197 ARG B C 1 ATOM 2409 O O . ARG B 1 116 ? 4.893 -14.785 12.334 1.00 42.75 ? 197 ARG B O 1 ATOM 2410 C CB . ARG B 1 116 ? 2.785 -13.211 13.400 1.00 42.25 ? 197 ARG B CB 1 ATOM 2411 C CG . ARG B 1 116 ? 1.616 -12.562 14.139 1.00 42.92 ? 197 ARG B CG 1 ATOM 2412 C CD . ARG B 1 116 ? 1.983 -11.191 14.677 1.00 42.83 ? 197 ARG B CD 1 ATOM 2413 N NE . ARG B 1 116 ? 2.971 -11.280 15.749 1.00 44.65 ? 197 ARG B NE 1 ATOM 2414 C CZ . ARG B 1 116 ? 2.714 -11.055 17.036 1.00 45.26 ? 197 ARG B CZ 1 ATOM 2415 N NH1 . ARG B 1 116 ? 1.491 -10.712 17.428 1.00 45.47 ? 197 ARG B NH1 1 ATOM 2416 N NH2 . ARG B 1 116 ? 3.688 -11.166 17.932 1.00 45.09 ? 197 ARG B NH2 1 ATOM 2417 N N . TYR B 1 117 ? 3.389 -16.127 11.299 1.00 42.76 ? 198 TYR B N 1 ATOM 2418 C CA . TYR B 1 117 ? 4.347 -16.782 10.402 1.00 42.85 ? 198 TYR B CA 1 ATOM 2419 C C . TYR B 1 117 ? 3.650 -17.300 9.150 1.00 42.89 ? 198 TYR B C 1 ATOM 2420 O O . TYR B 1 117 ? 2.571 -17.894 9.227 1.00 42.94 ? 198 TYR B O 1 ATOM 2421 C CB . TYR B 1 117 ? 5.065 -17.932 11.123 1.00 42.97 ? 198 TYR B CB 1 ATOM 2422 N N . GLU B 1 125 ? -3.235 -3.027 10.389 1.00 44.51 ? 206 GLU B N 1 ATOM 2423 C CA . GLU B 1 125 ? -2.547 -3.202 9.112 1.00 44.47 ? 206 GLU B CA 1 ATOM 2424 C C . GLU B 1 125 ? -2.928 -4.521 8.427 1.00 44.37 ? 206 GLU B C 1 ATOM 2425 O O . GLU B 1 125 ? -3.528 -5.405 9.050 1.00 44.41 ? 206 GLU B O 1 ATOM 2426 C CB . GLU B 1 125 ? -1.033 -3.107 9.310 1.00 44.45 ? 206 GLU B CB 1 ATOM 2427 N N . ARG B 1 126 ? -2.578 -4.640 7.146 1.00 44.15 ? 207 ARG B N 1 ATOM 2428 C CA . ARG B 1 126 ? -2.833 -5.855 6.363 1.00 43.91 ? 207 ARG B CA 1 ATOM 2429 C C . ARG B 1 126 ? -1.644 -6.832 6.372 1.00 43.75 ? 207 ARG B C 1 ATOM 2430 O O . ARG B 1 126 ? -1.557 -7.723 5.517 1.00 43.67 ? 207 ARG B O 1 ATOM 2431 C CB . ARG B 1 126 ? -3.224 -5.489 4.926 1.00 43.89 ? 207 ARG B CB 1 ATOM 2432 N N . LEU B 1 127 ? -0.744 -6.663 7.346 1.00 43.46 ? 208 LEU B N 1 ATOM 2433 C CA . LEU B 1 127 ? 0.465 -7.488 7.464 1.00 43.20 ? 208 LEU B CA 1 ATOM 2434 C C . LEU B 1 127 ? 0.400 -8.946 7.943 1.00 42.90 ? 208 LEU B C 1 ATOM 2435 O O . LEU B 1 127 ? 0.582 -9.873 7.146 1.00 43.05 ? 208 LEU B O 1 ATOM 2436 C CB . LEU B 1 127 ? 1.503 -6.806 8.368 1.00 43.23 ? 208 LEU B CB 1 ATOM 2437 N N . ALA B 1 128 ? 0.143 -9.139 9.236 1.00 42.38 ? 209 ALA B N 1 ATOM 2438 C CA . ALA B 1 128 ? 0.097 -10.471 9.835 1.00 41.83 ? 209 ALA B CA 1 ATOM 2439 C C . ALA B 1 128 ? -0.976 -10.445 10.928 1.00 41.42 ? 209 ALA B C 1 ATOM 2440 O O . ALA B 1 128 ? -0.714 -9.995 12.056 1.00 41.51 ? 209 ALA B O 1 ATOM 2441 C CB . ALA B 1 128 ? 1.424 -11.021 10.388 1.00 41.94 ? 209 ALA B CB 1 ATOM 2442 N N . ILE B 1 129 ? -2.174 -10.924 10.584 1.00 40.58 ? 210 ILE B N 1 ATOM 2443 C CA . ILE B 1 129 ? -3.284 -11.069 11.541 1.00 39.81 ? 210 ILE B CA 1 ATOM 2444 C C . ILE B 1 129 ? -3.083 -12.344 12.380 1.00 39.03 ? 210 ILE B C 1 ATOM 2445 O O . ILE B 1 129 ? -2.974 -13.444 11.822 1.00 39.09 ? 210 ILE B O 1 ATOM 2446 C CB . ILE B 1 129 ? -4.674 -11.095 10.825 1.00 39.94 ? 210 ILE B CB 1 ATOM 2447 C CG1 . ILE B 1 129 ? -4.848 -9.857 9.931 1.00 39.86 ? 210 ILE B CG1 1 ATOM 2448 C CG2 . ILE B 1 129 ? -5.821 -11.213 11.848 1.00 40.06 ? 210 ILE B CG2 1 ATOM 2449 C CD1 . ILE B 1 129 ? -6.040 -9.915 8.989 1.00 39.86 ? 210 ILE B CD1 1 ATOM 2450 N N . ALA B 1 130 ? -3.042 -12.181 13.707 1.00 37.78 ? 211 ALA B N 1 ATOM 2451 C CA . ALA B 1 130 ? -2.701 -13.261 14.663 1.00 36.53 ? 211 ALA B CA 1 ATOM 2452 C C . ALA B 1 130 ? -3.424 -14.609 14.469 1.00 35.68 ? 211 ALA B C 1 ATOM 2453 O O . ALA B 1 130 ? -4.623 -14.657 14.177 1.00 35.58 ? 211 ALA B O 1 ATOM 2454 C CB . ALA B 1 130 ? -2.875 -12.775 16.100 1.00 36.43 ? 211 ALA B CB 1 ATOM 2455 N N . ARG B 1 131 ? -2.665 -15.690 14.643 1.00 34.40 ? 212 ARG B N 1 ATOM 2456 C CA . ARG B 1 131 ? -3.166 -17.052 14.554 1.00 33.13 ? 212 ARG B CA 1 ATOM 2457 C C . ARG B 1 131 ? -3.236 -17.676 15.950 1.00 32.14 ? 212 ARG B C 1 ATOM 2458 O O . ARG B 1 131 ? -2.206 -17.947 16.577 1.00 31.99 ? 212 ARG B O 1 ATOM 2459 C CB . ARG B 1 131 ? -2.259 -17.883 13.638 1.00 33.06 ? 212 ARG B CB 1 ATOM 2460 C CG . ARG B 1 131 ? -2.903 -19.142 13.043 1.00 33.53 ? 212 ARG B CG 1 ATOM 2461 C CD . ARG B 1 131 ? -1.937 -19.882 12.116 1.00 33.73 ? 212 ARG B CD 1 ATOM 2462 N NE . ARG B 1 131 ? -0.677 -20.180 12.797 1.00 35.92 ? 212 ARG B NE 1 ATOM 2463 C CZ . ARG B 1 131 ? -0.429 -21.305 13.461 1.00 36.28 ? 212 ARG B CZ 1 ATOM 2464 N NH1 . ARG B 1 131 ? -1.349 -22.259 13.522 1.00 36.13 ? 212 ARG B NH1 1 ATOM 2465 N NH2 . ARG B 1 131 ? 0.743 -21.475 14.064 1.00 35.98 ? 212 ARG B NH2 1 ATOM 2466 N N . GLN B 1 132 ? -4.458 -17.885 16.434 1.00 31.05 ? 213 GLN B N 1 ATOM 2467 C CA . GLN B 1 132 ? -4.691 -18.570 17.705 1.00 29.82 ? 213 GLN B CA 1 ATOM 2468 C C . GLN B 1 132 ? -4.165 -20.003 17.659 1.00 29.10 ? 213 GLN B C 1 ATOM 2469 O O . GLN B 1 132 ? -4.330 -20.719 16.664 1.00 28.93 ? 213 GLN B O 1 ATOM 2470 C CB . GLN B 1 132 ? -6.174 -18.540 18.084 1.00 29.79 ? 213 GLN B CB 1 ATOM 2471 C CG . GLN B 1 132 ? -6.698 -17.164 18.472 1.00 29.40 ? 213 GLN B CG 1 ATOM 2472 C CD . GLN B 1 132 ? -6.039 -16.585 19.720 1.00 29.62 ? 213 GLN B CD 1 ATOM 2473 O OE1 . GLN B 1 132 ? -5.604 -17.310 20.622 1.00 29.10 ? 213 GLN B OE1 1 ATOM 2474 N NE2 . GLN B 1 132 ? -5.975 -15.263 19.778 1.00 30.11 ? 213 GLN B NE2 1 ATOM 2475 N N . ARG B 1 133 ? -3.555 -20.411 18.765 1.00 28.20 ? 214 ARG B N 1 ATOM 2476 C CA . ARG B 1 133 ? -2.644 -21.540 18.794 1.00 27.43 ? 214 ARG B CA 1 ATOM 2477 C C . ARG B 1 133 ? -2.636 -22.164 20.185 1.00 26.89 ? 214 ARG B C 1 ATOM 2478 O O . ARG B 1 133 ? -3.035 -21.520 21.168 1.00 26.75 ? 214 ARG B O 1 ATOM 2479 C CB . ARG B 1 133 ? -1.244 -21.003 18.488 1.00 27.69 ? 214 ARG B CB 1 ATOM 2480 C CG . ARG B 1 133 ? -0.169 -22.045 18.329 1.00 28.09 ? 214 ARG B CG 1 ATOM 2481 C CD . ARG B 1 133 ? 1.171 -21.550 18.852 1.00 26.01 ? 214 ARG B CD 1 ATOM 2482 N NE . ARG B 1 133 ? 2.246 -22.419 18.377 1.00 27.17 ? 214 ARG B NE 1 ATOM 2483 C CZ . ARG B 1 133 ? 2.594 -23.586 18.924 1.00 27.67 ? 214 ARG B CZ 1 ATOM 2484 N NH1 . ARG B 1 133 ? 1.975 -24.055 20.001 1.00 27.03 ? 214 ARG B NH1 1 ATOM 2485 N NH2 . ARG B 1 133 ? 3.582 -24.291 18.390 1.00 28.61 ? 214 ARG B NH2 1 ATOM 2486 N N . ILE B 1 134 ? -2.165 -23.406 20.279 1.00 26.22 ? 215 ILE B N 1 ATOM 2487 C CA . ILE B 1 134 ? -1.862 -23.997 21.586 1.00 25.75 ? 215 ILE B CA 1 ATOM 2488 C C . ILE B 1 134 ? -0.734 -23.189 22.238 1.00 25.41 ? 215 ILE B C 1 ATOM 2489 O O . ILE B 1 134 ? 0.309 -22.984 21.626 1.00 25.05 ? 215 ILE B O 1 ATOM 2490 C CB . ILE B 1 134 ? -1.478 -25.497 21.483 1.00 25.61 ? 215 ILE B CB 1 ATOM 2491 C CG1 . ILE B 1 134 ? -2.678 -26.330 21.044 1.00 24.86 ? 215 ILE B CG1 1 ATOM 2492 C CG2 . ILE B 1 134 ? -0.960 -26.018 22.822 1.00 25.87 ? 215 ILE B CG2 1 ATOM 2493 C CD1 . ILE B 1 134 ? -2.317 -27.719 20.547 1.00 24.16 ? 215 ILE B CD1 1 ATOM 2494 N N . PRO B 1 135 ? -0.954 -22.698 23.468 1.00 25.50 ? 216 PRO B N 1 ATOM 2495 C CA . PRO B 1 135 ? 0.094 -21.913 24.149 1.00 25.76 ? 216 PRO B CA 1 ATOM 2496 C C . PRO B 1 135 ? 1.416 -22.662 24.289 1.00 26.00 ? 216 PRO B C 1 ATOM 2497 O O . PRO B 1 135 ? 1.432 -23.872 24.485 1.00 26.15 ? 216 PRO B O 1 ATOM 2498 C CB . PRO B 1 135 ? -0.510 -21.626 25.530 1.00 25.50 ? 216 PRO B CB 1 ATOM 2499 C CG . PRO B 1 135 ? -1.983 -21.728 25.331 1.00 25.37 ? 216 PRO B CG 1 ATOM 2500 C CD . PRO B 1 135 ? -2.177 -22.803 24.282 1.00 25.38 ? 216 PRO B CD 1 ATOM 2501 N N . TYR B 1 136 ? 2.513 -21.934 24.159 1.00 26.61 ? 217 TYR B N 1 ATOM 2502 C CA . TYR B 1 136 ? 3.841 -22.500 24.321 1.00 27.25 ? 217 TYR B CA 1 ATOM 2503 C C . TYR B 1 136 ? 4.695 -21.545 25.133 1.00 28.00 ? 217 TYR B C 1 ATOM 2504 O O . TYR B 1 136 ? 4.451 -20.340 25.146 1.00 27.74 ? 217 TYR B O 1 ATOM 2505 C CB . TYR B 1 136 ? 4.487 -22.770 22.963 1.00 26.91 ? 217 TYR B CB 1 ATOM 2506 C CG . TYR B 1 136 ? 4.686 -21.539 22.108 1.00 26.70 ? 217 TYR B CG 1 ATOM 2507 C CD1 . TYR B 1 136 ? 3.637 -21.014 21.341 1.00 26.13 ? 217 TYR B CD1 1 ATOM 2508 C CD2 . TYR B 1 136 ? 5.927 -20.905 22.049 1.00 26.39 ? 217 TYR B CD2 1 ATOM 2509 C CE1 . TYR B 1 136 ? 3.819 -19.879 20.541 1.00 26.12 ? 217 TYR B CE1 1 ATOM 2510 C CE2 . TYR B 1 136 ? 6.120 -19.762 21.261 1.00 26.79 ? 217 TYR B CE2 1 ATOM 2511 C CZ . TYR B 1 136 ? 5.063 -19.260 20.508 1.00 26.73 ? 217 TYR B CZ 1 ATOM 2512 O OH . TYR B 1 136 ? 5.256 -18.139 19.735 1.00 26.54 ? 217 TYR B OH 1 ATOM 2513 N N . ARG B 1 137 ? 5.696 -22.093 25.811 1.00 29.17 ? 218 ARG B N 1 ATOM 2514 C CA . ARG B 1 137 ? 6.606 -21.294 26.600 1.00 30.34 ? 218 ARG B CA 1 ATOM 2515 C C . ARG B 1 137 ? 7.524 -20.478 25.699 1.00 30.83 ? 218 ARG B C 1 ATOM 2516 O O . ARG B 1 137 ? 8.192 -21.021 24.824 1.00 30.83 ? 218 ARG B O 1 ATOM 2517 C CB . ARG B 1 137 ? 7.440 -22.182 27.522 1.00 30.43 ? 218 ARG B CB 1 ATOM 2518 C CG . ARG B 1 137 ? 7.897 -21.447 28.771 1.00 33.11 ? 218 ARG B CG 1 ATOM 2519 C CD . ARG B 1 137 ? 9.350 -21.713 29.116 1.00 36.64 ? 218 ARG B CD 1 ATOM 2520 N NE . ARG B 1 137 ? 9.520 -22.913 29.933 1.00 38.64 ? 218 ARG B NE 1 ATOM 2521 C CZ . ARG B 1 137 ? 10.452 -23.036 30.874 1.00 40.47 ? 218 ARG B CZ 1 ATOM 2522 N NH1 . ARG B 1 137 ? 11.284 -22.024 31.123 1.00 41.39 ? 218 ARG B NH1 1 ATOM 2523 N NH2 . ARG B 1 137 ? 10.548 -24.159 31.575 1.00 40.81 ? 218 ARG B NH2 1 ATOM 2524 N N . LEU B 1 138 ? 7.538 -19.166 25.904 1.00 31.78 ? 219 LEU B N 1 ATOM 2525 C CA . LEU B 1 138 ? 8.563 -18.328 25.310 1.00 32.78 ? 219 LEU B CA 1 ATOM 2526 C C . LEU B 1 138 ? 9.354 -17.632 26.416 1.00 33.23 ? 219 LEU B C 1 ATOM 2527 O O . LEU B 1 138 ? 8.826 -16.774 27.132 1.00 33.56 ? 219 LEU B O 1 ATOM 2528 C CB . LEU B 1 138 ? 7.967 -17.302 24.345 1.00 32.89 ? 219 LEU B CB 1 ATOM 2529 C CG . LEU B 1 138 ? 8.976 -16.696 23.362 1.00 33.44 ? 219 LEU B CG 1 ATOM 2530 C CD1 . LEU B 1 138 ? 9.014 -17.528 22.081 1.00 35.30 ? 219 LEU B CD1 1 ATOM 2531 C CD2 . LEU B 1 138 ? 8.612 -15.277 23.033 1.00 33.83 ? 219 LEU B CD2 1 ATOM 2532 N N . GLY B 1 139 ? 10.617 -18.021 26.556 1.00 33.52 ? 220 GLY B N 1 ATOM 2533 C CA . GLY B 1 139 ? 11.506 -17.406 27.528 1.00 33.60 ? 220 GLY B CA 1 ATOM 2534 C C . GLY B 1 139 ? 12.424 -16.415 26.849 1.00 34.05 ? 220 GLY B C 1 ATOM 2535 O O . GLY B 1 139 ? 12.850 -16.623 25.708 1.00 33.99 ? 220 GLY B O 1 ATOM 2536 N N . ARG B 1 140 ? 12.724 -15.321 27.536 1.00 34.38 ? 221 ARG B N 1 ATOM 2537 C CA . ARG B 1 140 ? 13.714 -14.378 27.036 1.00 34.67 ? 221 ARG B CA 1 ATOM 2538 C C . ARG B 1 140 ? 14.726 -14.100 28.126 1.00 34.55 ? 221 ARG B C 1 ATOM 2539 O O . ARG B 1 140 ? 14.358 -13.885 29.278 1.00 34.94 ? 221 ARG B O 1 ATOM 2540 C CB . ARG B 1 140 ? 13.055 -13.086 26.559 1.00 34.83 ? 221 ARG B CB 1 ATOM 2541 C CG . ARG B 1 140 ? 12.302 -13.235 25.254 1.00 35.71 ? 221 ARG B CG 1 ATOM 2542 C CD . ARG B 1 140 ? 11.589 -11.959 24.914 1.00 37.77 ? 221 ARG B CD 1 ATOM 2543 N NE . ARG B 1 140 ? 10.478 -12.171 23.987 1.00 41.05 ? 221 ARG B NE 1 ATOM 2544 C CZ . ARG B 1 140 ? 10.567 -12.058 22.659 1.00 42.52 ? 221 ARG B CZ 1 ATOM 2545 N NH1 . ARG B 1 140 ? 11.728 -11.746 22.080 1.00 42.39 ? 221 ARG B NH1 1 ATOM 2546 N NH2 . ARG B 1 140 ? 9.489 -12.259 21.904 1.00 41.71 ? 221 ARG B NH2 1 ATOM 2547 N N . VAL B 1 141 ? 16.002 -14.133 27.757 1.00 34.15 ? 222 VAL B N 1 ATOM 2548 C CA . VAL B 1 141 ? 17.077 -13.858 28.689 1.00 33.60 ? 222 VAL B CA 1 ATOM 2549 C C . VAL B 1 141 ? 17.851 -12.643 28.201 1.00 33.27 ? 222 VAL B C 1 ATOM 2550 O O . VAL B 1 141 ? 18.255 -12.585 27.048 1.00 32.59 ? 222 VAL B O 1 ATOM 2551 C CB . VAL B 1 141 ? 18.044 -15.068 28.830 1.00 33.76 ? 222 VAL B CB 1 ATOM 2552 C CG1 . VAL B 1 141 ? 19.161 -14.766 29.837 1.00 34.03 ? 222 VAL B CG1 1 ATOM 2553 C CG2 . VAL B 1 141 ? 17.297 -16.318 29.256 1.00 33.43 ? 222 VAL B CG2 1 ATOM 2554 N N . VAL B 1 142 ? 18.029 -11.667 29.086 1.00 33.49 ? 223 VAL B N 1 ATOM 2555 C CA . VAL B 1 142 ? 18.983 -10.575 28.860 1.00 33.66 ? 223 VAL B CA 1 ATOM 2556 C C . VAL B 1 142 ? 20.165 -10.759 29.815 1.00 33.63 ? 223 VAL B C 1 ATOM 2557 O O . VAL B 1 142 ? 19.969 -11.035 30.999 1.00 33.43 ? 223 VAL B O 1 ATOM 2558 C CB . VAL B 1 142 ? 18.362 -9.160 29.075 1.00 33.43 ? 223 VAL B CB 1 ATOM 2559 C CG1 . VAL B 1 142 ? 19.174 -8.122 28.354 1.00 33.96 ? 223 VAL B CG1 1 ATOM 2560 C CG2 . VAL B 1 142 ? 16.949 -9.092 28.564 1.00 34.01 ? 223 VAL B CG2 1 ATOM 2561 N N . ASP B 1 143 ? 21.378 -10.637 29.285 1.00 33.90 ? 224 ASP B N 1 ATOM 2562 C CA . ASP B 1 143 ? 22.596 -10.624 30.094 1.00 34.53 ? 224 ASP B CA 1 ATOM 2563 C C . ASP B 1 143 ? 23.305 -9.298 29.910 1.00 34.77 ? 224 ASP B C 1 ATOM 2564 O O . ASP B 1 143 ? 23.404 -8.785 28.796 1.00 34.67 ? 224 ASP B O 1 ATOM 2565 C CB . ASP B 1 143 ? 23.560 -11.744 29.684 1.00 34.89 ? 224 ASP B CB 1 ATOM 2566 C CG . ASP B 1 143 ? 23.205 -13.100 30.286 1.00 35.59 ? 224 ASP B CG 1 ATOM 2567 O OD1 . ASP B 1 143 ? 22.085 -13.284 30.796 1.00 37.57 ? 224 ASP B OD1 1 ATOM 2568 O OD2 . ASP B 1 143 ? 24.063 -14.003 30.235 1.00 36.88 ? 224 ASP B OD2 1 ATOM 2569 N N . GLU B 1 144 ? 23.814 -8.767 31.015 1.00 35.23 ? 225 GLU B N 1 ATOM 2570 C CA A GLU B 1 144 ? 24.558 -7.512 31.022 0.54 35.39 ? 225 GLU B CA 1 ATOM 2571 C CA B GLU B 1 144 ? 24.537 -7.505 31.016 0.46 35.34 ? 225 GLU B CA 1 ATOM 2572 C C . GLU B 1 144 ? 25.840 -7.664 31.803 1.00 35.50 ? 225 GLU B C 1 ATOM 2573 O O . GLU B 1 144 ? 25.825 -8.134 32.941 1.00 35.64 ? 225 GLU B O 1 ATOM 2574 C CB A GLU B 1 144 ? 23.742 -6.416 31.679 0.54 35.43 ? 225 GLU B CB 1 ATOM 2575 C CB B GLU B 1 144 ? 23.634 -6.408 31.598 0.46 35.33 ? 225 GLU B CB 1 ATOM 2576 C CG A GLU B 1 144 ? 23.107 -5.464 30.721 0.54 36.02 ? 225 GLU B CG 1 ATOM 2577 C CG B GLU B 1 144 ? 24.299 -5.080 31.904 0.46 35.62 ? 225 GLU B CG 1 ATOM 2578 C CD A GLU B 1 144 ? 22.149 -4.540 31.420 0.54 37.00 ? 225 GLU B CD 1 ATOM 2579 C CD B GLU B 1 144 ? 24.749 -4.970 33.349 0.46 36.02 ? 225 GLU B CD 1 ATOM 2580 O OE1 A GLU B 1 144 ? 22.245 -4.406 32.662 0.54 36.70 ? 225 GLU B OE1 1 ATOM 2581 O OE1 B GLU B 1 144 ? 24.028 -5.455 34.246 0.46 36.86 ? 225 GLU B OE1 1 ATOM 2582 O OE2 A GLU B 1 144 ? 21.293 -3.958 30.724 0.54 37.61 ? 225 GLU B OE2 1 ATOM 2583 O OE2 B GLU B 1 144 ? 25.823 -4.389 33.592 0.46 36.14 ? 225 GLU B OE2 1 ATOM 2584 N N . TRP B 1 145 ? 26.947 -7.264 31.189 1.00 35.66 ? 226 TRP B N 1 ATOM 2585 C CA . TRP B 1 145 ? 28.262 -7.384 31.800 1.00 36.12 ? 226 TRP B CA 1 ATOM 2586 C C . TRP B 1 145 ? 29.028 -6.064 31.739 1.00 36.06 ? 226 TRP B C 1 ATOM 2587 O O . TRP B 1 145 ? 29.000 -5.380 30.718 1.00 35.84 ? 226 TRP B O 1 ATOM 2588 C CB . TRP B 1 145 ? 29.084 -8.459 31.082 1.00 36.68 ? 226 TRP B CB 1 ATOM 2589 C CG . TRP B 1 145 ? 28.322 -9.710 30.691 1.00 37.51 ? 226 TRP B CG 1 ATOM 2590 C CD1 . TRP B 1 145 ? 27.540 -9.889 29.576 1.00 37.98 ? 226 TRP B CD1 1 ATOM 2591 C CD2 . TRP B 1 145 ? 28.305 -10.959 31.393 1.00 37.69 ? 226 TRP B CD2 1 ATOM 2592 N NE1 . TRP B 1 145 ? 27.030 -11.167 29.549 1.00 37.83 ? 226 TRP B NE1 1 ATOM 2593 C CE2 . TRP B 1 145 ? 27.481 -11.846 30.652 1.00 38.09 ? 226 TRP B CE2 1 ATOM 2594 C CE3 . TRP B 1 145 ? 28.902 -11.415 32.578 1.00 37.12 ? 226 TRP B CE3 1 ATOM 2595 C CZ2 . TRP B 1 145 ? 27.232 -13.161 31.064 1.00 37.98 ? 226 TRP B CZ2 1 ATOM 2596 C CZ3 . TRP B 1 145 ? 28.661 -12.722 32.984 1.00 37.78 ? 226 TRP B CZ3 1 ATOM 2597 C CH2 . TRP B 1 145 ? 27.830 -13.581 32.228 1.00 38.03 ? 226 TRP B CH2 1 ATOM 2598 N N . LEU B 1 146 ? 29.705 -5.716 32.834 1.00 36.15 ? 227 LEU B N 1 ATOM 2599 C CA . LEU B 1 146 ? 30.712 -4.648 32.832 1.00 36.49 ? 227 LEU B CA 1 ATOM 2600 C C . LEU B 1 146 ? 32.114 -5.194 32.597 1.00 36.64 ? 227 LEU B C 1 ATOM 2601 O O . LEU B 1 146 ? 32.600 -6.012 33.374 1.00 36.66 ? 227 LEU B O 1 ATOM 2602 C CB . LEU B 1 146 ? 30.708 -3.857 34.142 1.00 36.40 ? 227 LEU B CB 1 ATOM 2603 C CG . LEU B 1 146 ? 29.895 -2.568 34.170 1.00 36.68 ? 227 LEU B CG 1 ATOM 2604 C CD1 . LEU B 1 146 ? 28.497 -2.824 34.735 1.00 37.67 ? 227 LEU B CD1 1 ATOM 2605 C CD2 . LEU B 1 146 ? 30.616 -1.540 34.994 1.00 36.34 ? 227 LEU B CD2 1 ATOM 2606 N N . LEU B 1 147 ? 32.750 -4.742 31.519 1.00 37.05 ? 228 LEU B N 1 ATOM 2607 C CA . LEU B 1 147 ? 34.160 -5.023 31.277 1.00 37.52 ? 228 LEU B CA 1 ATOM 2608 C C . LEU B 1 147 ? 34.965 -3.859 31.818 1.00 37.97 ? 228 LEU B C 1 ATOM 2609 O O . LEU B 1 147 ? 35.739 -3.220 31.106 1.00 37.85 ? 228 LEU B O 1 ATOM 2610 C CB . LEU B 1 147 ? 34.455 -5.225 29.792 1.00 37.42 ? 228 LEU B CB 1 ATOM 2611 C CG . LEU B 1 147 ? 33.654 -6.201 28.931 1.00 37.50 ? 228 LEU B CG 1 ATOM 2612 C CD1 . LEU B 1 147 ? 34.417 -6.398 27.619 1.00 37.90 ? 228 LEU B CD1 1 ATOM 2613 C CD2 . LEU B 1 147 ? 33.392 -7.540 29.624 1.00 36.43 ? 228 LEU B CD2 1 ATOM 2614 N N . ASP B 1 148 ? 34.727 -3.568 33.088 1.00 38.75 ? 229 ASP B N 1 ATOM 2615 C CA . ASP B 1 148 ? 35.504 -2.602 33.822 1.00 39.66 ? 229 ASP B CA 1 ATOM 2616 C C . ASP B 1 148 ? 36.637 -3.388 34.468 1.00 40.26 ? 229 ASP B C 1 ATOM 2617 O O . ASP B 1 148 ? 36.438 -4.545 34.858 1.00 40.99 ? 229 ASP B O 1 ATOM 2618 C CB . ASP B 1 148 ? 34.630 -1.957 34.894 1.00 39.52 ? 229 ASP B CB 1 ATOM 2619 C CG . ASP B 1 148 ? 35.165 -0.619 35.353 1.00 39.98 ? 229 ASP B CG 1 ATOM 2620 O OD1 . ASP B 1 148 ? 36.372 -0.357 35.170 1.00 38.61 ? 229 ASP B OD1 1 ATOM 2621 O OD2 . ASP B 1 148 ? 34.369 0.172 35.899 1.00 41.12 ? 229 ASP B OD2 1 ATOM 2622 N N . LYS B 1 149 ? 37.814 -2.778 34.584 1.00 40.43 ? 230 LYS B N 1 ATOM 2623 C CA . LYS B 1 149 ? 38.956 -3.436 35.224 1.00 40.93 ? 230 LYS B CA 1 ATOM 2624 C C . LYS B 1 149 ? 38.656 -3.525 36.734 1.00 41.14 ? 230 LYS B C 1 ATOM 2625 O O . LYS B 1 149 ? 39.465 -3.102 37.571 1.00 41.25 ? 230 LYS B O 1 ATOM 2626 C CB . LYS B 1 149 ? 40.254 -2.636 35.000 1.00 40.97 ? 230 LYS B CB 1 ATOM 2627 C CG . LYS B 1 149 ? 40.585 -2.289 33.536 1.00 41.50 ? 230 LYS B CG 1 ATOM 2628 C CD . LYS B 1 149 ? 41.503 -3.312 32.874 1.00 41.69 ? 230 LYS B CD 1 ATOM 2629 C CE . LYS B 1 149 ? 42.085 -2.780 31.561 1.00 42.23 ? 230 LYS B CE 1 ATOM 2630 N NZ . LYS B 1 149 ? 43.207 -1.799 31.748 1.00 42.14 ? 230 LYS B NZ 1 ATOM 2631 N N . GLY B 1 150 ? 37.483 -4.068 37.062 1.00 41.21 ? 231 GLY B N 1 ATOM 2632 C CA . GLY B 1 150 ? 37.038 -4.281 38.444 1.00 41.41 ? 231 GLY B CA 1 ATOM 2633 C C . GLY B 1 150 ? 36.915 -3.098 39.393 1.00 41.49 ? 231 GLY B C 1 ATOM 2634 O O . GLY B 1 150 ? 36.716 -3.289 40.593 1.00 41.58 ? 231 GLY B O 1 ATOM 2635 N N . ARG B 1 151 ? 37.012 -1.879 38.858 1.00 41.54 ? 232 ARG B N 1 ATOM 2636 C CA . ARG B 1 151 ? 37.078 -0.662 39.678 1.00 41.41 ? 232 ARG B CA 1 ATOM 2637 C C . ARG B 1 151 ? 35.702 -0.057 40.066 1.00 41.31 ? 232 ARG B C 1 ATOM 2638 O O . ARG B 1 151 ? 35.528 1.164 40.119 1.00 41.46 ? 232 ARG B O 1 ATOM 2639 C CB . ARG B 1 151 ? 38.032 0.364 39.034 1.00 41.35 ? 232 ARG B CB 1 ATOM 2640 C CG . ARG B 1 151 ? 37.477 1.139 37.841 1.00 41.56 ? 232 ARG B CG 1 ATOM 2641 C CD . ARG B 1 151 ? 38.392 1.104 36.610 1.00 41.98 ? 232 ARG B CD 1 ATOM 2642 N NE . ARG B 1 151 ? 39.811 1.296 36.894 1.00 42.24 ? 232 ARG B NE 1 ATOM 2643 C CZ . ARG B 1 151 ? 40.782 1.134 35.997 1.00 42.94 ? 232 ARG B CZ 1 ATOM 2644 N NH1 . ARG B 1 151 ? 40.491 0.778 34.750 1.00 42.83 ? 232 ARG B NH1 1 ATOM 2645 N NH2 . ARG B 1 151 ? 42.051 1.330 36.343 1.00 42.89 ? 232 ARG B NH2 1 ATOM 2646 N N . GLN B 1 152 ? 34.737 -0.924 40.356 1.00 41.03 ? 233 GLN B N 1 ATOM 2647 C CA . GLN B 1 152 ? 33.447 -0.492 40.898 1.00 40.99 ? 233 GLN B CA 1 ATOM 2648 C C . GLN B 1 152 ? 32.975 -1.404 42.027 1.00 40.49 ? 233 GLN B C 1 ATOM 2649 O O . GLN B 1 152 ? 33.213 -2.616 41.994 1.00 40.57 ? 233 GLN B O 1 ATOM 2650 C CB . GLN B 1 152 ? 32.379 -0.398 39.802 1.00 40.95 ? 233 GLN B CB 1 ATOM 2651 C CG . GLN B 1 152 ? 32.409 0.916 39.018 1.00 41.34 ? 233 GLN B CG 1 ATOM 2652 C CD . GLN B 1 152 ? 31.358 0.979 37.922 1.00 41.56 ? 233 GLN B CD 1 ATOM 2653 O OE1 . GLN B 1 152 ? 30.237 0.482 38.085 1.00 43.21 ? 233 GLN B OE1 1 ATOM 2654 N NE2 . GLN B 1 152 ? 31.713 1.598 36.795 1.00 41.50 ? 233 GLN B NE2 1 ATOM 2655 N N . LEU B 1 153 ? 32.307 -0.806 43.015 1.00 39.80 ? 234 LEU B N 1 ATOM 2656 C CA . LEU B 1 153 ? 31.825 -1.511 44.204 1.00 39.07 ? 234 LEU B CA 1 ATOM 2657 C C . LEU B 1 153 ? 30.742 -2.531 43.850 1.00 38.69 ? 234 LEU B C 1 ATOM 2658 O O . LEU B 1 153 ? 29.786 -2.217 43.132 1.00 38.81 ? 234 LEU B O 1 ATOM 2659 C CB . LEU B 1 153 ? 31.318 -0.511 45.249 1.00 39.07 ? 234 LEU B CB 1 ATOM 2660 C CG . LEU B 1 153 ? 32.204 0.709 45.571 1.00 38.82 ? 234 LEU B CG 1 ATOM 2661 C CD1 . LEU B 1 153 ? 31.531 1.611 46.595 1.00 38.30 ? 234 LEU B CD1 1 ATOM 2662 C CD2 . LEU B 1 153 ? 33.612 0.331 46.041 1.00 38.65 ? 234 LEU B CD2 1 ATOM 2663 N N . THR B 1 154 ? 30.910 -3.756 44.348 1.00 37.98 ? 235 THR B N 1 ATOM 2664 C CA . THR B 1 154 ? 30.066 -4.885 43.947 1.00 37.22 ? 235 THR B CA 1 ATOM 2665 C C . THR B 1 154 ? 29.099 -5.364 45.044 1.00 36.57 ? 235 THR B C 1 ATOM 2666 O O . THR B 1 154 ? 28.486 -6.427 44.905 1.00 36.47 ? 235 THR B O 1 ATOM 2667 C CB . THR B 1 154 ? 30.923 -6.102 43.475 1.00 37.36 ? 235 THR B CB 1 ATOM 2668 O OG1 . THR B 1 154 ? 31.516 -6.756 44.605 1.00 37.50 ? 235 THR B OG1 1 ATOM 2669 C CG2 . THR B 1 154 ? 32.015 -5.681 42.497 1.00 37.39 ? 235 THR B CG2 1 ATOM 2670 N N . ILE B 1 155 ? 28.956 -4.588 46.119 1.00 35.64 ? 236 ILE B N 1 ATOM 2671 C CA . ILE B 1 155 ? 28.225 -5.057 47.300 1.00 34.91 ? 236 ILE B CA 1 ATOM 2672 C C . ILE B 1 155 ? 26.948 -4.285 47.631 1.00 34.53 ? 236 ILE B C 1 ATOM 2673 O O . ILE B 1 155 ? 26.978 -3.075 47.867 1.00 34.44 ? 236 ILE B O 1 ATOM 2674 C CB . ILE B 1 155 ? 29.150 -5.154 48.546 1.00 34.98 ? 236 ILE B CB 1 ATOM 2675 C CG1 . ILE B 1 155 ? 30.149 -6.293 48.357 1.00 34.84 ? 236 ILE B CG1 1 ATOM 2676 C CG2 . ILE B 1 155 ? 28.346 -5.385 49.830 1.00 34.44 ? 236 ILE B CG2 1 ATOM 2677 C CD1 . ILE B 1 155 ? 31.157 -6.385 49.448 1.00 35.88 ? 236 ILE B CD1 1 ATOM 2678 N N . PHE B 1 156 ? 25.836 -5.015 47.649 1.00 34.03 ? 237 PHE B N 1 ATOM 2679 C CA . PHE B 1 156 ? 24.552 -4.499 48.090 1.00 33.64 ? 237 PHE B CA 1 ATOM 2680 C C . PHE B 1 156 ? 24.545 -4.504 49.618 1.00 33.52 ? 237 PHE B C 1 ATOM 2681 O O . PHE B 1 156 ? 24.159 -5.486 50.254 1.00 33.75 ? 237 PHE B O 1 ATOM 2682 C CB . PHE B 1 156 ? 23.421 -5.375 47.545 1.00 33.52 ? 237 PHE B CB 1 ATOM 2683 C CG . PHE B 1 156 ? 22.053 -4.760 47.668 1.00 33.56 ? 237 PHE B CG 1 ATOM 2684 C CD1 . PHE B 1 156 ? 21.842 -3.610 48.431 1.00 33.92 ? 237 PHE B CD1 1 ATOM 2685 C CD2 . PHE B 1 156 ? 20.964 -5.348 47.040 1.00 33.42 ? 237 PHE B CD2 1 ATOM 2686 C CE1 . PHE B 1 156 ? 20.576 -3.052 48.549 1.00 34.01 ? 237 PHE B CE1 1 ATOM 2687 C CE2 . PHE B 1 156 ? 19.693 -4.799 47.156 1.00 33.41 ? 237 PHE B CE2 1 ATOM 2688 C CZ . PHE B 1 156 ? 19.501 -3.650 47.911 1.00 33.69 ? 237 PHE B CZ 1 ATOM 2689 N N . ASN B 1 157 ? 24.961 -3.389 50.199 1.00 33.26 ? 238 ASN B N 1 ATOM 2690 C CA . ASN B 1 157 ? 25.280 -3.329 51.618 1.00 32.90 ? 238 ASN B CA 1 ATOM 2691 C C . ASN B 1 157 ? 24.054 -3.110 52.489 1.00 32.44 ? 238 ASN B C 1 ATOM 2692 O O . ASN B 1 157 ? 23.212 -2.267 52.174 1.00 32.59 ? 238 ASN B O 1 ATOM 2693 C CB . ASN B 1 157 ? 26.302 -2.213 51.866 1.00 32.96 ? 238 ASN B CB 1 ATOM 2694 C CG . ASN B 1 157 ? 27.509 -2.687 52.657 1.00 33.87 ? 238 ASN B CG 1 ATOM 2695 O OD1 . ASN B 1 157 ? 27.418 -3.022 53.849 1.00 34.31 ? 238 ASN B OD1 1 ATOM 2696 N ND2 . ASN B 1 157 ? 28.662 -2.701 51.996 1.00 34.57 ? 238 ASN B ND2 1 ATOM 2697 N N . SER B 1 158 ? 23.963 -3.886 53.571 1.00 31.80 ? 239 SER B N 1 ATOM 2698 C CA . SER B 1 158 ? 23.007 -3.656 54.663 1.00 31.08 ? 239 SER B CA 1 ATOM 2699 C C . SER B 1 158 ? 21.560 -3.463 54.177 1.00 30.78 ? 239 SER B C 1 ATOM 2700 O O . SER B 1 158 ? 20.978 -2.381 54.294 1.00 30.65 ? 239 SER B O 1 ATOM 2701 C CB . SER B 1 158 ? 23.474 -2.476 55.528 1.00 30.98 ? 239 SER B CB 1 ATOM 2702 O OG . SER B 1 158 ? 23.071 -2.629 56.874 1.00 30.44 ? 239 SER B OG 1 ATOM 2703 N N . GLN B 1 159 ? 20.997 -4.534 53.630 1.00 30.45 ? 240 GLN B N 1 ATOM 2704 C CA . GLN B 1 159 ? 19.645 -4.534 53.089 1.00 30.37 ? 240 GLN B CA 1 ATOM 2705 C C . GLN B 1 159 ? 18.589 -4.490 54.195 1.00 30.42 ? 240 GLN B C 1 ATOM 2706 O O . GLN B 1 159 ? 18.564 -5.349 55.080 1.00 30.23 ? 240 GLN B O 1 ATOM 2707 C CB . GLN B 1 159 ? 19.462 -5.754 52.196 1.00 30.39 ? 240 GLN B CB 1 ATOM 2708 C CG . GLN B 1 159 ? 20.287 -5.682 50.921 1.00 30.99 ? 240 GLN B CG 1 ATOM 2709 C CD . GLN B 1 159 ? 20.606 -7.039 50.319 1.00 32.05 ? 240 GLN B CD 1 ATOM 2710 O OE1 . GLN B 1 159 ? 21.754 -7.308 49.970 1.00 33.02 ? 240 GLN B OE1 1 ATOM 2711 N NE2 . GLN B 1 159 ? 19.596 -7.897 50.190 1.00 32.14 ? 240 GLN B NE2 1 ATOM 2712 N N . ALA B 1 160 ? 17.724 -3.480 54.140 1.00 30.51 ? 241 ALA B N 1 ATOM 2713 C CA . ALA B 1 160 ? 16.826 -3.163 55.254 1.00 30.51 ? 241 ALA B CA 1 ATOM 2714 C C . ALA B 1 160 ? 15.399 -3.637 55.032 1.00 30.62 ? 241 ALA B C 1 ATOM 2715 O O . ALA B 1 160 ? 14.826 -4.320 55.878 1.00 30.69 ? 241 ALA B O 1 ATOM 2716 C CB . ALA B 1 160 ? 16.845 -1.663 55.540 1.00 30.43 ? 241 ALA B CB 1 ATOM 2717 N N . THR B 1 161 ? 14.827 -3.270 53.891 1.00 30.86 ? 242 THR B N 1 ATOM 2718 C CA . THR B 1 161 ? 13.415 -3.519 53.632 1.00 30.87 ? 242 THR B CA 1 ATOM 2719 C C . THR B 1 161 ? 13.192 -4.009 52.220 1.00 30.87 ? 242 THR B C 1 ATOM 2720 O O . THR B 1 161 ? 13.877 -3.588 51.286 1.00 30.59 ? 242 THR B O 1 ATOM 2721 C CB . THR B 1 161 ? 12.563 -2.245 53.833 1.00 30.85 ? 242 THR B CB 1 ATOM 2722 O OG1 . THR B 1 161 ? 13.038 -1.210 52.964 1.00 31.38 ? 242 THR B OG1 1 ATOM 2723 C CG2 . THR B 1 161 ? 12.636 -1.753 55.274 1.00 31.07 ? 242 THR B CG2 1 ATOM 2724 N N . ILE B 1 162 ? 12.231 -4.915 52.087 1.00 31.16 ? 243 ILE B N 1 ATOM 2725 C CA . ILE B 1 162 ? 11.683 -5.312 50.793 1.00 31.38 ? 243 ILE B CA 1 ATOM 2726 C C . ILE B 1 162 ? 10.273 -4.753 50.745 1.00 31.14 ? 243 ILE B C 1 ATOM 2727 O O . ILE B 1 162 ? 9.428 -5.128 51.548 1.00 30.86 ? 243 ILE B O 1 ATOM 2728 C CB . ILE B 1 162 ? 11.637 -6.850 50.621 1.00 31.48 ? 243 ILE B CB 1 ATOM 2729 C CG1 . ILE B 1 162 ? 13.006 -7.465 50.940 1.00 31.86 ? 243 ILE B CG1 1 ATOM 2730 C CG2 . ILE B 1 162 ? 11.185 -7.220 49.208 1.00 31.69 ? 243 ILE B CG2 1 ATOM 2731 C CD1 . ILE B 1 162 ? 12.969 -8.957 51.228 1.00 32.60 ? 243 ILE B CD1 1 ATOM 2732 N N . ILE B 1 163 ? 10.042 -3.828 49.823 1.00 31.18 ? 244 ILE B N 1 ATOM 2733 C CA . ILE B 1 163 ? 8.760 -3.162 49.709 1.00 31.45 ? 244 ILE B CA 1 ATOM 2734 C C . ILE B 1 163 ? 8.128 -3.593 48.408 1.00 31.83 ? 244 ILE B C 1 ATOM 2735 O O . ILE B 1 163 ? 8.706 -3.390 47.343 1.00 32.44 ? 244 ILE B O 1 ATOM 2736 C CB . ILE B 1 163 ? 8.909 -1.630 49.755 1.00 31.34 ? 244 ILE B CB 1 ATOM 2737 C CG1 . ILE B 1 163 ? 9.302 -1.177 51.166 1.00 31.21 ? 244 ILE B CG1 1 ATOM 2738 C CG2 . ILE B 1 163 ? 7.619 -0.949 49.325 1.00 31.55 ? 244 ILE B CG2 1 ATOM 2739 C CD1 . ILE B 1 163 ? 9.970 0.190 51.219 1.00 30.99 ? 244 ILE B CD1 1 ATOM 2740 N N . ILE B 1 164 ? 6.943 -4.190 48.511 1.00 32.26 ? 245 ILE B N 1 ATOM 2741 C CA . ILE B 1 164 ? 6.220 -4.752 47.375 1.00 32.58 ? 245 ILE B CA 1 ATOM 2742 C C . ILE B 1 164 ? 4.924 -3.986 47.125 1.00 32.83 ? 245 ILE B C 1 ATOM 2743 O O . ILE B 1 164 ? 4.167 -3.733 48.056 1.00 32.74 ? 245 ILE B O 1 ATOM 2744 C CB . ILE B 1 164 ? 5.898 -6.242 47.634 1.00 32.74 ? 245 ILE B CB 1 ATOM 2745 C CG1 . ILE B 1 164 ? 7.170 -7.001 48.026 1.00 32.84 ? 245 ILE B CG1 1 ATOM 2746 C CG2 . ILE B 1 164 ? 5.241 -6.895 46.415 1.00 32.38 ? 245 ILE B CG2 1 ATOM 2747 C CD1 . ILE B 1 164 ? 6.927 -8.079 49.054 1.00 33.79 ? 245 ILE B CD1 1 ATOM 2748 N N . GLY B 1 165 ? 4.680 -3.618 45.868 1.00 33.38 ? 246 GLY B N 1 ATOM 2749 C CA . GLY B 1 165 ? 3.435 -2.949 45.476 1.00 34.35 ? 246 GLY B CA 1 ATOM 2750 C C . GLY B 1 165 ? 3.579 -1.544 44.908 1.00 35.07 ? 246 GLY B C 1 ATOM 2751 O O . GLY B 1 165 ? 2.599 -0.953 44.432 1.00 34.93 ? 246 GLY B O 1 ATOM 2752 N N . GLY B 1 166 ? 4.794 -1.001 44.988 1.00 35.81 ? 247 GLY B N 1 ATOM 2753 C CA . GLY B 1 166 ? 5.147 0.285 44.378 1.00 36.66 ? 247 GLY B CA 1 ATOM 2754 C C . GLY B 1 166 ? 4.498 1.554 44.903 1.00 37.37 ? 247 GLY B C 1 ATOM 2755 O O . GLY B 1 166 ? 4.748 2.642 44.370 1.00 37.27 ? 247 GLY B O 1 ATOM 2756 N N . LYS B 1 167 ? 3.679 1.427 45.946 1.00 38.15 ? 248 LYS B N 1 ATOM 2757 C CA . LYS B 1 167 ? 2.923 2.565 46.477 1.00 38.88 ? 248 LYS B CA 1 ATOM 2758 C C . LYS B 1 167 ? 3.831 3.673 47.023 1.00 39.26 ? 248 LYS B C 1 ATOM 2759 O O . LYS B 1 167 ? 3.509 4.853 46.904 1.00 39.34 ? 248 LYS B O 1 ATOM 2760 C CB . LYS B 1 167 ? 1.919 2.108 47.539 1.00 38.83 ? 248 LYS B CB 1 ATOM 2761 C CG . LYS B 1 167 ? 0.864 3.149 47.885 1.00 39.37 ? 248 LYS B CG 1 ATOM 2762 C CD . LYS B 1 167 ? -0.233 2.565 48.762 1.00 40.31 ? 248 LYS B CD 1 ATOM 2763 C CE . LYS B 1 167 ? -1.075 3.663 49.400 1.00 40.58 ? 248 LYS B CE 1 ATOM 2764 N NZ . LYS B 1 167 ? -2.183 3.109 50.232 1.00 40.96 ? 248 LYS B NZ 1 ATOM 2765 N N . GLU B 1 168 ? 4.975 3.294 47.588 1.00 39.83 ? 249 GLU B N 1 ATOM 2766 C CA . GLU B 1 168 ? 5.888 4.266 48.195 1.00 40.44 ? 249 GLU B CA 1 ATOM 2767 C C . GLU B 1 168 ? 6.945 4.809 47.220 1.00 40.57 ? 249 GLU B C 1 ATOM 2768 O O . GLU B 1 168 ? 7.967 5.360 47.639 1.00 40.54 ? 249 GLU B O 1 ATOM 2769 C CB . GLU B 1 168 ? 6.546 3.678 49.444 1.00 40.55 ? 249 GLU B CB 1 ATOM 2770 C CG . GLU B 1 168 ? 6.644 4.666 50.593 1.00 41.72 ? 249 GLU B CG 1 ATOM 2771 C CD . GLU B 1 168 ? 7.211 4.045 51.854 1.00 43.22 ? 249 GLU B CD 1 ATOM 2772 O OE1 . GLU B 1 168 ? 8.380 3.596 51.822 1.00 43.79 ? 249 GLU B OE1 1 ATOM 2773 O OE2 . GLU B 1 168 ? 6.491 4.020 52.879 1.00 43.47 ? 249 GLU B OE2 1 ATOM 2774 N N . GLN B 1 169 ? 6.686 4.648 45.923 1.00 40.74 ? 250 GLN B N 1 ATOM 2775 C CA . GLN B 1 169 ? 7.504 5.245 44.866 1.00 40.83 ? 250 GLN B CA 1 ATOM 2776 C C . GLN B 1 169 ? 6.651 6.199 44.030 1.00 40.76 ? 250 GLN B C 1 ATOM 2777 O O . GLN B 1 169 ? 7.178 6.977 43.225 1.00 40.69 ? 250 GLN B O 1 ATOM 2778 C CB . GLN B 1 169 ? 8.110 4.161 43.968 1.00 40.87 ? 250 GLN B CB 1 ATOM 2779 C CG . GLN B 1 169 ? 9.397 3.528 44.495 1.00 42.03 ? 250 GLN B CG 1 ATOM 2780 C CD . GLN B 1 169 ? 9.182 2.648 45.725 1.00 43.49 ? 250 GLN B CD 1 ATOM 2781 O OE1 . GLN B 1 169 ? 8.418 1.678 45.693 1.00 44.31 ? 250 GLN B OE1 1 ATOM 2782 N NE2 . GLN B 1 169 ? 9.864 2.986 46.816 1.00 43.60 ? 250 GLN B NE2 1 ATOM 2783 N N . GLY B 1 170 ? 5.333 6.131 44.235 1.00 40.64 ? 251 GLY B N 1 ATOM 2784 C CA . GLY B 1 170 ? 4.368 6.917 43.466 1.00 40.29 ? 251 GLY B CA 1 ATOM 2785 C C . GLY B 1 170 ? 3.970 6.246 42.164 1.00 40.10 ? 251 GLY B C 1 ATOM 2786 O O . GLY B 1 170 ? 3.529 6.913 41.223 1.00 40.10 ? 251 GLY B O 1 ATOM 2787 N N . GLN B 1 171 ? 4.138 4.925 42.112 1.00 39.89 ? 252 GLN B N 1 ATOM 2788 C CA . GLN B 1 171 ? 3.774 4.119 40.948 1.00 39.78 ? 252 GLN B CA 1 ATOM 2789 C C . GLN B 1 171 ? 3.130 2.808 41.422 1.00 39.31 ? 252 GLN B C 1 ATOM 2790 O O . GLN B 1 171 ? 3.769 1.745 41.385 1.00 39.37 ? 252 GLN B O 1 ATOM 2791 C CB . GLN B 1 171 ? 5.007 3.808 40.090 1.00 39.80 ? 252 GLN B CB 1 ATOM 2792 C CG . GLN B 1 171 ? 5.570 4.963 39.280 1.00 40.22 ? 252 GLN B CG 1 ATOM 2793 C CD . GLN B 1 171 ? 7.017 4.719 38.865 1.00 40.59 ? 252 GLN B CD 1 ATOM 2794 O OE1 . GLN B 1 171 ? 7.298 3.942 37.945 1.00 42.05 ? 252 GLN B OE1 1 ATOM 2795 N NE2 . GLN B 1 171 ? 7.945 5.384 39.548 1.00 41.51 ? 252 GLN B NE2 1 ATOM 2796 N N . PRO B 1 172 ? 1.859 2.873 41.862 1.00 38.82 ? 253 PRO B N 1 ATOM 2797 C CA . PRO B 1 172 ? 1.219 1.696 42.445 1.00 38.41 ? 253 PRO B CA 1 ATOM 2798 C C . PRO B 1 172 ? 1.031 0.588 41.420 1.00 38.04 ? 253 PRO B C 1 ATOM 2799 O O . PRO B 1 172 ? 0.617 0.848 40.284 1.00 38.00 ? 253 PRO B O 1 ATOM 2800 C CB . PRO B 1 172 ? -0.147 2.221 42.901 1.00 38.36 ? 253 PRO B CB 1 ATOM 2801 C CG . PRO B 1 172 ? -0.020 3.700 42.906 1.00 38.57 ? 253 PRO B CG 1 ATOM 2802 C CD . PRO B 1 172 ? 0.942 4.024 41.826 1.00 38.68 ? 253 PRO B CD 1 ATOM 2803 N N . PHE B 1 173 ? 1.357 -0.635 41.822 1.00 37.53 ? 254 PHE B N 1 ATOM 2804 C CA . PHE B 1 173 ? 1.092 -1.806 41.003 1.00 37.06 ? 254 PHE B CA 1 ATOM 2805 C C . PHE B 1 173 ? -0.371 -2.245 41.159 1.00 36.88 ? 254 PHE B C 1 ATOM 2806 O O . PHE B 1 173 ? -0.944 -2.156 42.246 1.00 36.82 ? 254 PHE B O 1 ATOM 2807 C CB . PHE B 1 173 ? 2.061 -2.943 41.364 1.00 37.00 ? 254 PHE B CB 1 ATOM 2808 C CG . PHE B 1 173 ? 1.680 -4.268 40.779 1.00 36.74 ? 254 PHE B CG 1 ATOM 2809 C CD1 . PHE B 1 173 ? 1.909 -4.538 39.431 1.00 36.06 ? 254 PHE B CD1 1 ATOM 2810 C CD2 . PHE B 1 173 ? 1.072 -5.241 41.572 1.00 36.79 ? 254 PHE B CD2 1 ATOM 2811 C CE1 . PHE B 1 173 ? 1.542 -5.764 38.874 1.00 36.42 ? 254 PHE B CE1 1 ATOM 2812 C CE2 . PHE B 1 173 ? 0.694 -6.471 41.025 1.00 37.14 ? 254 PHE B CE2 1 ATOM 2813 C CZ . PHE B 1 173 ? 0.934 -6.734 39.669 1.00 36.91 ? 254 PHE B CZ 1 ATOM 2814 N N . GLN B 1 174 ? -0.967 -2.694 40.058 1.00 36.66 ? 255 GLN B N 1 ATOM 2815 C CA . GLN B 1 174 ? -2.317 -3.257 40.055 1.00 36.55 ? 255 GLN B CA 1 ATOM 2816 C C . GLN B 1 174 ? -2.298 -4.586 39.315 1.00 36.31 ? 255 GLN B C 1 ATOM 2817 O O . GLN B 1 174 ? -1.774 -4.688 38.205 1.00 36.35 ? 255 GLN B O 1 ATOM 2818 C CB . GLN B 1 174 ? -3.318 -2.306 39.390 1.00 36.45 ? 255 GLN B CB 1 ATOM 2819 C CG . GLN B 1 174 ? -3.656 -1.066 40.208 1.00 36.75 ? 255 GLN B CG 1 ATOM 2820 C CD . GLN B 1 174 ? -4.664 -0.147 39.515 1.00 36.82 ? 255 GLN B CD 1 ATOM 2821 O OE1 . GLN B 1 174 ? -5.608 -0.607 38.864 1.00 36.58 ? 255 GLN B OE1 1 ATOM 2822 N NE2 . GLN B 1 174 ? -4.471 1.161 39.671 1.00 36.58 ? 255 GLN B NE2 1 ATOM 2823 N N . GLY B 1 175 ? -2.870 -5.607 39.932 1.00 36.10 ? 256 GLY B N 1 ATOM 2824 C CA . GLY B 1 175 ? -2.877 -6.933 39.334 1.00 35.88 ? 256 GLY B CA 1 ATOM 2825 C C . GLY B 1 175 ? -2.489 -8.000 40.333 1.00 35.68 ? 256 GLY B C 1 ATOM 2826 O O . GLY B 1 175 ? -2.949 -7.988 41.474 1.00 35.85 ? 256 GLY B O 1 ATOM 2827 N N . GLN B 1 176 ? -1.624 -8.910 39.909 1.00 35.35 ? 257 GLN B N 1 ATOM 2828 C CA . GLN B 1 176 ? -1.354 -10.112 40.674 1.00 35.26 ? 257 GLN B CA 1 ATOM 2829 C C . GLN B 1 176 ? 0.140 -10.392 40.818 1.00 35.14 ? 257 GLN B C 1 ATOM 2830 O O . GLN B 1 176 ? 0.890 -10.354 39.840 1.00 35.45 ? 257 GLN B O 1 ATOM 2831 C CB . GLN B 1 176 ? -2.096 -11.285 40.030 1.00 35.22 ? 257 GLN B CB 1 ATOM 2832 C CG . GLN B 1 176 ? -1.412 -12.638 40.116 1.00 35.65 ? 257 GLN B CG 1 ATOM 2833 C CD . GLN B 1 176 ? -2.206 -13.742 39.428 1.00 35.68 ? 257 GLN B CD 1 ATOM 2834 O OE1 . GLN B 1 176 ? -3.417 -13.904 39.650 1.00 35.61 ? 257 GLN B OE1 1 ATOM 2835 N NE2 . GLN B 1 176 ? -1.521 -14.515 38.593 1.00 35.69 ? 257 GLN B NE2 1 ATOM 2836 N N . LEU B 1 177 ? 0.566 -10.654 42.050 1.00 34.73 ? 258 LEU B N 1 ATOM 2837 C CA . LEU B 1 177 ? 1.946 -11.045 42.318 1.00 34.31 ? 258 LEU B CA 1 ATOM 2838 C C . LEU B 1 177 ? 1.967 -12.365 43.070 1.00 33.90 ? 258 LEU B C 1 ATOM 2839 O O . LEU B 1 177 ? 1.137 -12.600 43.947 1.00 33.54 ? 258 LEU B O 1 ATOM 2840 C CB . LEU B 1 177 ? 2.682 -9.960 43.111 1.00 34.41 ? 258 LEU B CB 1 ATOM 2841 C CG . LEU B 1 177 ? 2.861 -8.587 42.452 1.00 34.65 ? 258 LEU B CG 1 ATOM 2842 C CD1 . LEU B 1 177 ? 3.517 -7.597 43.402 1.00 34.37 ? 258 LEU B CD1 1 ATOM 2843 C CD2 . LEU B 1 177 ? 3.664 -8.681 41.164 1.00 35.49 ? 258 LEU B CD2 1 ATOM 2844 N N . SER B 1 178 ? 2.916 -13.225 42.720 1.00 33.59 ? 259 SER B N 1 ATOM 2845 C CA . SER B 1 178 ? 3.003 -14.543 43.335 1.00 33.46 ? 259 SER B CA 1 ATOM 2846 C C . SER B 1 178 ? 4.424 -15.074 43.370 1.00 33.03 ? 259 SER B C 1 ATOM 2847 O O . SER B 1 178 ? 5.263 -14.695 42.556 1.00 32.87 ? 259 SER B O 1 ATOM 2848 C CB . SER B 1 178 ? 2.099 -15.545 42.600 1.00 33.64 ? 259 SER B CB 1 ATOM 2849 O OG . SER B 1 178 ? 2.733 -16.042 41.433 1.00 34.13 ? 259 SER B OG 1 ATOM 2850 N N . GLY B 1 179 ? 4.665 -15.972 44.317 1.00 32.87 ? 260 GLY B N 1 ATOM 2851 C CA . GLY B 1 179 ? 5.919 -16.706 44.418 1.00 32.82 ? 260 GLY B CA 1 ATOM 2852 C C . GLY B 1 179 ? 7.150 -15.834 44.361 1.00 32.71 ? 260 GLY B C 1 ATOM 2853 O O . GLY B 1 179 ? 8.034 -16.070 43.544 1.00 32.98 ? 260 GLY B O 1 ATOM 2854 N N . LEU B 1 180 ? 7.195 -14.821 45.223 1.00 32.69 ? 261 LEU B N 1 ATOM 2855 C CA . LEU B 1 180 ? 8.334 -13.909 45.307 1.00 32.72 ? 261 LEU B CA 1 ATOM 2856 C C . LEU B 1 180 ? 9.483 -14.610 45.994 1.00 32.75 ? 261 LEU B C 1 ATOM 2857 O O . LEU B 1 180 ? 9.395 -14.969 47.162 1.00 32.68 ? 261 LEU B O 1 ATOM 2858 C CB . LEU B 1 180 ? 7.965 -12.662 46.107 1.00 32.66 ? 261 LEU B CB 1 ATOM 2859 C CG . LEU B 1 180 ? 8.722 -11.335 45.986 1.00 33.18 ? 261 LEU B CG 1 ATOM 2860 C CD1 . LEU B 1 180 ? 8.261 -10.447 47.119 1.00 33.28 ? 261 LEU B CD1 1 ATOM 2861 C CD2 . LEU B 1 180 ? 10.255 -11.442 46.001 1.00 33.70 ? 261 LEU B CD2 1 ATOM 2862 N N . TYR B 1 181 ? 10.565 -14.803 45.261 1.00 33.11 ? 262 TYR B N 1 ATOM 2863 C CA . TYR B 1 181 ? 11.768 -15.368 45.830 1.00 33.44 ? 262 TYR B CA 1 ATOM 2864 C C . TYR B 1 181 ? 12.807 -14.272 45.908 1.00 33.37 ? 262 TYR B C 1 ATOM 2865 O O . TYR B 1 181 ? 13.001 -13.546 44.936 1.00 33.35 ? 262 TYR B O 1 ATOM 2866 C CB . TYR B 1 181 ? 12.278 -16.505 44.950 1.00 33.87 ? 262 TYR B CB 1 ATOM 2867 C CG . TYR B 1 181 ? 13.519 -17.168 45.488 1.00 34.44 ? 262 TYR B CG 1 ATOM 2868 C CD1 . TYR B 1 181 ? 13.427 -18.236 46.374 1.00 34.66 ? 262 TYR B CD1 1 ATOM 2869 C CD2 . TYR B 1 181 ? 14.787 -16.725 45.115 1.00 35.03 ? 262 TYR B CD2 1 ATOM 2870 C CE1 . TYR B 1 181 ? 14.565 -18.850 46.880 1.00 35.03 ? 262 TYR B CE1 1 ATOM 2871 C CE2 . TYR B 1 181 ? 15.930 -17.328 45.618 1.00 35.46 ? 262 TYR B CE2 1 ATOM 2872 C CZ . TYR B 1 181 ? 15.810 -18.393 46.497 1.00 34.99 ? 262 TYR B CZ 1 ATOM 2873 O OH . TYR B 1 181 ? 16.937 -19.003 46.997 1.00 35.21 ? 262 TYR B OH 1 ATOM 2874 N N . TYR B 1 182 ? 13.462 -14.140 47.062 1.00 33.55 ? 263 TYR B N 1 ATOM 2875 C CA . TYR B 1 182 ? 14.622 -13.232 47.200 1.00 33.61 ? 263 TYR B CA 1 ATOM 2876 C C . TYR B 1 182 ? 15.670 -13.722 48.196 1.00 33.46 ? 263 TYR B C 1 ATOM 2877 O O . TYR B 1 182 ? 15.418 -13.763 49.403 1.00 33.57 ? 263 TYR B O 1 ATOM 2878 C CB . TYR B 1 182 ? 14.203 -11.802 47.554 1.00 33.47 ? 263 TYR B CB 1 ATOM 2879 C CG . TYR B 1 182 ? 15.378 -10.854 47.622 1.00 33.61 ? 263 TYR B CG 1 ATOM 2880 C CD1 . TYR B 1 182 ? 15.991 -10.389 46.461 1.00 33.98 ? 263 TYR B CD1 1 ATOM 2881 C CD2 . TYR B 1 182 ? 15.887 -10.428 48.848 1.00 33.71 ? 263 TYR B CD2 1 ATOM 2882 C CE1 . TYR B 1 182 ? 17.081 -9.524 46.520 1.00 33.60 ? 263 TYR B CE1 1 ATOM 2883 C CE2 . TYR B 1 182 ? 16.969 -9.561 48.914 1.00 32.80 ? 263 TYR B CE2 1 ATOM 2884 C CZ . TYR B 1 182 ? 17.561 -9.118 47.750 1.00 33.05 ? 263 TYR B CZ 1 ATOM 2885 O OH . TYR B 1 182 ? 18.634 -8.257 47.811 1.00 33.53 ? 263 TYR B OH 1 ATOM 2886 N N . ASN B 1 183 ? 16.844 -14.076 47.671 1.00 33.30 ? 264 ASN B N 1 ATOM 2887 C CA . ASN B 1 183 ? 17.978 -14.574 48.466 1.00 33.08 ? 264 ASN B CA 1 ATOM 2888 C C . ASN B 1 183 ? 17.577 -15.523 49.595 1.00 32.95 ? 264 ASN B C 1 ATOM 2889 O O . ASN B 1 183 ? 17.952 -15.322 50.750 1.00 32.77 ? 264 ASN B O 1 ATOM 2890 C CB . ASN B 1 183 ? 18.814 -13.409 49.009 1.00 33.09 ? 264 ASN B CB 1 ATOM 2891 C CG . ASN B 1 183 ? 19.500 -12.624 47.914 1.00 33.03 ? 264 ASN B CG 1 ATOM 2892 O OD1 . ASN B 1 183 ? 19.638 -13.099 46.789 1.00 33.10 ? 264 ASN B OD1 1 ATOM 2893 N ND2 . ASN B 1 183 ? 19.949 -11.417 48.242 1.00 33.55 ? 264 ASN B ND2 1 ATOM 2894 N N . GLY B 1 184 ? 16.800 -16.544 49.242 1.00 32.91 ? 265 GLY B N 1 ATOM 2895 C CA . GLY B 1 184 ? 16.324 -17.541 50.196 1.00 33.01 ? 265 GLY B CA 1 ATOM 2896 C C . GLY B 1 184 ? 14.921 -17.292 50.718 1.00 33.07 ? 265 GLY B C 1 ATOM 2897 O O . GLY B 1 184 ? 14.253 -18.227 51.176 1.00 33.07 ? 265 GLY B O 1 ATOM 2898 N N . LEU B 1 185 ? 14.471 -16.038 50.649 1.00 33.04 ? 266 LEU B N 1 ATOM 2899 C CA . LEU B 1 185 ? 13.180 -15.647 51.222 1.00 33.08 ? 266 LEU B CA 1 ATOM 2900 C C . LEU B 1 185 ? 12.025 -15.826 50.256 1.00 33.19 ? 266 LEU B C 1 ATOM 2901 O O . LEU B 1 185 ? 12.009 -15.213 49.195 1.00 33.32 ? 266 LEU B O 1 ATOM 2902 C CB . LEU B 1 185 ? 13.207 -14.193 51.685 1.00 32.84 ? 266 LEU B CB 1 ATOM 2903 C CG . LEU B 1 185 ? 14.245 -13.757 52.713 1.00 32.69 ? 266 LEU B CG 1 ATOM 2904 C CD1 . LEU B 1 185 ? 14.267 -12.245 52.777 1.00 31.99 ? 266 LEU B CD1 1 ATOM 2905 C CD2 . LEU B 1 185 ? 13.968 -14.366 54.088 1.00 32.15 ? 266 LEU B CD2 1 ATOM 2906 N N . LYS B 1 186 ? 11.069 -16.676 50.629 1.00 33.48 ? 267 LYS B N 1 ATOM 2907 C CA . LYS B 1 186 ? 9.797 -16.787 49.913 1.00 33.57 ? 267 LYS B CA 1 ATOM 2908 C C . LYS B 1 186 ? 8.814 -15.826 50.570 1.00 33.59 ? 267 LYS B C 1 ATOM 2909 O O . LYS B 1 186 ? 7.960 -16.233 51.351 1.00 33.53 ? 267 LYS B O 1 ATOM 2910 C CB . LYS B 1 186 ? 9.272 -18.226 49.945 1.00 33.51 ? 267 LYS B CB 1 ATOM 2911 C CG . LYS B 1 186 ? 10.132 -19.213 49.174 1.00 34.02 ? 267 LYS B CG 1 ATOM 2912 C CD . LYS B 1 186 ? 9.800 -20.663 49.503 1.00 34.82 ? 267 LYS B CD 1 ATOM 2913 C CE . LYS B 1 186 ? 10.779 -21.634 48.826 1.00 35.79 ? 267 LYS B CE 1 ATOM 2914 N NZ . LYS B 1 186 ? 10.798 -21.516 47.325 1.00 35.82 ? 267 LYS B NZ 1 ATOM 2915 N N . VAL B 1 187 ? 8.948 -14.545 50.239 1.00 33.73 ? 268 VAL B N 1 ATOM 2916 C CA . VAL B 1 187 ? 8.311 -13.462 50.993 1.00 34.21 ? 268 VAL B CA 1 ATOM 2917 C C . VAL B 1 187 ? 6.775 -13.437 50.955 1.00 34.65 ? 268 VAL B C 1 ATOM 2918 O O . VAL B 1 187 ? 6.126 -13.242 51.985 1.00 34.76 ? 268 VAL B O 1 ATOM 2919 C CB . VAL B 1 187 ? 8.876 -12.094 50.570 1.00 34.23 ? 268 VAL B CB 1 ATOM 2920 C CG1 . VAL B 1 187 ? 8.286 -10.974 51.424 1.00 34.04 ? 268 VAL B CG1 1 ATOM 2921 C CG2 . VAL B 1 187 ? 10.393 -12.104 50.674 1.00 34.10 ? 268 VAL B CG2 1 ATOM 2922 N N . LEU B 1 188 ? 6.193 -13.627 49.777 1.00 35.15 ? 269 LEU B N 1 ATOM 2923 C CA . LEU B 1 188 ? 4.738 -13.648 49.661 1.00 35.48 ? 269 LEU B CA 1 ATOM 2924 C C . LEU B 1 188 ? 4.157 -14.862 50.382 1.00 35.94 ? 269 LEU B C 1 ATOM 2925 O O . LEU B 1 188 ? 3.057 -14.793 50.939 1.00 36.13 ? 269 LEU B O 1 ATOM 2926 C CB . LEU B 1 188 ? 4.311 -13.598 48.188 1.00 35.38 ? 269 LEU B CB 1 ATOM 2927 C CG . LEU B 1 188 ? 3.829 -12.261 47.600 1.00 35.03 ? 269 LEU B CG 1 ATOM 2928 C CD1 . LEU B 1 188 ? 4.389 -11.030 48.310 1.00 34.41 ? 269 LEU B CD1 1 ATOM 2929 C CD2 . LEU B 1 188 ? 4.151 -12.195 46.120 1.00 34.56 ? 269 LEU B CD2 1 ATOM 2930 N N . ASN B 1 189 ? 4.912 -15.963 50.384 1.00 36.42 ? 270 ASN B N 1 ATOM 2931 C CA . ASN B 1 189 ? 4.540 -17.160 51.141 1.00 36.79 ? 270 ASN B CA 1 ATOM 2932 C C . ASN B 1 189 ? 4.568 -16.859 52.631 1.00 37.00 ? 270 ASN B C 1 ATOM 2933 O O . ASN B 1 189 ? 3.615 -17.164 53.342 1.00 36.84 ? 270 ASN B O 1 ATOM 2934 C CB . ASN B 1 189 ? 5.460 -18.346 50.810 1.00 36.77 ? 270 ASN B CB 1 ATOM 2935 C CG . ASN B 1 189 ? 5.199 -18.928 49.425 1.00 37.42 ? 270 ASN B CG 1 ATOM 2936 O OD1 . ASN B 1 189 ? 4.448 -19.891 49.281 1.00 37.97 ? 270 ASN B OD1 1 ATOM 2937 N ND2 . ASN B 1 189 ? 5.815 -18.341 48.399 1.00 38.58 ? 270 ASN B ND2 1 ATOM 2938 N N . MET B 1 190 ? 5.659 -16.231 53.079 1.00 37.48 ? 271 MET B N 1 ATOM 2939 C CA . MET B 1 190 ? 5.856 -15.852 54.479 1.00 37.94 ? 271 MET B CA 1 ATOM 2940 C C . MET B 1 190 ? 4.767 -14.904 54.984 1.00 38.04 ? 271 MET B C 1 ATOM 2941 O O . MET B 1 190 ? 4.333 -15.015 56.130 1.00 38.27 ? 271 MET B O 1 ATOM 2942 C CB . MET B 1 190 ? 7.246 -15.239 54.690 1.00 37.92 ? 271 MET B CB 1 ATOM 2943 C CG . MET B 1 190 ? 8.396 -16.247 54.716 1.00 38.19 ? 271 MET B CG 1 ATOM 2944 S SD . MET B 1 190 ? 10.032 -15.478 54.879 1.00 38.65 ? 271 MET B SD 1 ATOM 2945 C CE . MET B 1 190 ? 11.097 -16.868 54.495 1.00 38.87 ? 271 MET B CE 1 ATOM 2946 N N . ALA B 1 191 ? 4.323 -13.990 54.122 1.00 38.30 ? 272 ALA B N 1 ATOM 2947 C CA . ALA B 1 191 ? 3.228 -13.071 54.440 1.00 38.65 ? 272 ALA B CA 1 ATOM 2948 C C . ALA B 1 191 ? 1.918 -13.814 54.733 1.00 39.03 ? 272 ALA B C 1 ATOM 2949 O O . ALA B 1 191 ? 1.275 -13.577 55.764 1.00 38.91 ? 272 ALA B O 1 ATOM 2950 C CB . ALA B 1 191 ? 3.033 -12.065 53.312 1.00 38.52 ? 272 ALA B CB 1 ATOM 2951 N N . ALA B 1 192 ? 1.545 -14.720 53.827 1.00 39.52 ? 273 ALA B N 1 ATOM 2952 C CA . ALA B 1 192 ? 0.319 -15.516 53.951 1.00 39.95 ? 273 ALA B CA 1 ATOM 2953 C C . ALA B 1 192 ? 0.309 -16.362 55.220 1.00 40.31 ? 273 ALA B C 1 ATOM 2954 O O . ALA B 1 192 ? -0.753 -16.788 55.686 1.00 40.57 ? 273 ALA B O 1 ATOM 2955 C CB . ALA B 1 192 ? 0.134 -16.404 52.720 1.00 39.80 ? 273 ALA B CB 1 ATOM 2956 N N . GLU B 1 193 ? 1.494 -16.594 55.777 1.00 40.68 ? 274 GLU B N 1 ATOM 2957 C CA . GLU B 1 193 ? 1.642 -17.425 56.965 1.00 41.17 ? 274 GLU B CA 1 ATOM 2958 C C . GLU B 1 193 ? 1.846 -16.578 58.221 1.00 41.18 ? 274 GLU B C 1 ATOM 2959 O O . GLU B 1 193 ? 2.144 -17.106 59.298 1.00 41.20 ? 274 GLU B O 1 ATOM 2960 C CB . GLU B 1 193 ? 2.778 -18.437 56.770 1.00 41.34 ? 274 GLU B CB 1 ATOM 2961 C CG . GLU B 1 193 ? 2.613 -19.291 55.510 1.00 42.47 ? 274 GLU B CG 1 ATOM 2962 C CD . GLU B 1 193 ? 3.428 -20.572 55.529 1.00 43.49 ? 274 GLU B CD 1 ATOM 2963 O OE1 . GLU B 1 193 ? 4.396 -20.664 54.736 1.00 43.34 ? 274 GLU B OE1 1 ATOM 2964 O OE2 . GLU B 1 193 ? 3.092 -21.484 56.326 1.00 43.19 ? 274 GLU B OE2 1 ATOM 2965 N N . ASN B 1 194 ? 1.661 -15.265 58.064 1.00 41.23 ? 275 ASN B N 1 ATOM 2966 C CA . ASN B 1 194 ? 1.740 -14.286 59.157 1.00 41.28 ? 275 ASN B CA 1 ATOM 2967 C C . ASN B 1 194 ? 3.099 -14.211 59.853 1.00 41.21 ? 275 ASN B C 1 ATOM 2968 O O . ASN B 1 194 ? 3.183 -14.304 61.083 1.00 41.32 ? 275 ASN B O 1 ATOM 2969 C CB . ASN B 1 194 ? 0.617 -14.498 60.191 1.00 41.24 ? 275 ASN B CB 1 ATOM 2970 C CG . ASN B 1 194 ? -0.753 -14.114 59.661 1.00 41.53 ? 275 ASN B CG 1 ATOM 2971 O OD1 . ASN B 1 194 ? -0.879 -13.279 58.762 1.00 41.45 ? 275 ASN B OD1 1 ATOM 2972 N ND2 . ASN B 1 194 ? -1.795 -14.721 60.228 1.00 41.86 ? 275 ASN B ND2 1 ATOM 2973 N N . ASP B 1 195 ? 4.157 -14.049 59.065 1.00 40.93 ? 276 ASP B N 1 ATOM 2974 C CA . ASP B 1 195 ? 5.484 -13.821 59.621 1.00 40.86 ? 276 ASP B CA 1 ATOM 2975 C C . ASP B 1 195 ? 5.501 -12.483 60.365 1.00 40.75 ? 276 ASP B C 1 ATOM 2976 O O . ASP B 1 195 ? 4.871 -11.513 59.929 1.00 40.71 ? 276 ASP B O 1 ATOM 2977 C CB . ASP B 1 195 ? 6.548 -13.850 58.518 1.00 40.91 ? 276 ASP B CB 1 ATOM 2978 C CG . ASP B 1 195 ? 7.966 -13.738 59.063 1.00 41.07 ? 276 ASP B CG 1 ATOM 2979 O OD1 . ASP B 1 195 ? 8.368 -14.575 59.901 1.00 41.76 ? 276 ASP B OD1 1 ATOM 2980 O OD2 . ASP B 1 195 ? 8.685 -12.809 58.646 1.00 41.33 ? 276 ASP B OD2 1 ATOM 2981 N N . ALA B 1 196 ? 6.215 -12.452 61.491 1.00 40.61 ? 277 ALA B N 1 ATOM 2982 C CA . ALA B 1 196 ? 6.285 -11.277 62.367 1.00 40.42 ? 277 ALA B CA 1 ATOM 2983 C C . ALA B 1 196 ? 6.923 -10.040 61.720 1.00 40.36 ? 277 ALA B C 1 ATOM 2984 O O . ALA B 1 196 ? 6.604 -8.911 62.095 1.00 40.51 ? 277 ALA B O 1 ATOM 2985 C CB . ALA B 1 196 ? 7.017 -11.630 63.651 1.00 40.33 ? 277 ALA B CB 1 ATOM 2986 N N . ASN B 1 197 ? 7.817 -10.257 60.758 1.00 40.09 ? 278 ASN B N 1 ATOM 2987 C CA . ASN B 1 197 ? 8.590 -9.174 60.143 1.00 39.89 ? 278 ASN B CA 1 ATOM 2988 C C . ASN B 1 197 ? 7.960 -8.597 58.871 1.00 39.78 ? 278 ASN B C 1 ATOM 2989 O O . ASN B 1 197 ? 8.600 -7.848 58.125 1.00 39.58 ? 278 ASN B O 1 ATOM 2990 C CB . ASN B 1 197 ? 10.017 -9.651 59.863 1.00 39.87 ? 278 ASN B CB 1 ATOM 2991 C CG . ASN B 1 197 ? 10.806 -9.895 61.133 1.00 39.82 ? 278 ASN B CG 1 ATOM 2992 O OD1 . ASN B 1 197 ? 11.054 -8.971 61.910 1.00 39.74 ? 278 ASN B OD1 1 ATOM 2993 N ND2 . ASN B 1 197 ? 11.208 -11.141 61.348 1.00 39.57 ? 278 ASN B ND2 1 ATOM 2994 N N . ILE B 1 198 ? 6.697 -8.943 58.643 1.00 39.62 ? 279 ILE B N 1 ATOM 2995 C CA . ILE B 1 198 ? 5.982 -8.539 57.442 1.00 39.35 ? 279 ILE B CA 1 ATOM 2996 C C . ILE B 1 198 ? 4.745 -7.713 57.789 1.00 39.24 ? 279 ILE B C 1 ATOM 2997 O O . ILE B 1 198 ? 3.993 -8.067 58.697 1.00 39.24 ? 279 ILE B O 1 ATOM 2998 C CB . ILE B 1 198 ? 5.606 -9.773 56.594 1.00 39.33 ? 279 ILE B CB 1 ATOM 2999 C CG1 . ILE B 1 198 ? 6.867 -10.344 55.933 1.00 39.44 ? 279 ILE B CG1 1 ATOM 3000 C CG2 . ILE B 1 198 ? 4.556 -9.413 55.550 1.00 39.28 ? 279 ILE B CG2 1 ATOM 3001 C CD1 . ILE B 1 198 ? 6.704 -11.713 55.301 1.00 39.58 ? 279 ILE B CD1 1 ATOM 3002 N N . ALA B 1 199 ? 4.555 -6.608 57.071 1.00 39.09 ? 280 ALA B N 1 ATOM 3003 C CA . ALA B 1 199 ? 3.363 -5.778 57.220 1.00 38.97 ? 280 ALA B CA 1 ATOM 3004 C C . ALA B 1 199 ? 2.649 -5.576 55.883 1.00 39.04 ? 280 ALA B C 1 ATOM 3005 O O . ALA B 1 199 ? 3.270 -5.229 54.877 1.00 39.03 ? 280 ALA B O 1 ATOM 3006 C CB . ALA B 1 199 ? 3.711 -4.445 57.848 1.00 38.84 ? 280 ALA B CB 1 ATOM 3007 N N . ILE B 1 200 ? 1.339 -5.808 55.894 1.00 39.13 ? 281 ILE B N 1 ATOM 3008 C CA . ILE B 1 200 ? 0.480 -5.625 54.730 1.00 39.12 ? 281 ILE B CA 1 ATOM 3009 C C . ILE B 1 200 ? -0.481 -4.471 55.005 1.00 39.21 ? 281 ILE B C 1 ATOM 3010 O O . ILE B 1 200 ? -1.260 -4.517 55.958 1.00 39.20 ? 281 ILE B O 1 ATOM 3011 C CB . ILE B 1 200 ? -0.328 -6.916 54.406 1.00 39.14 ? 281 ILE B CB 1 ATOM 3012 C CG1 . ILE B 1 200 ? 0.603 -8.095 54.102 1.00 39.37 ? 281 ILE B CG1 1 ATOM 3013 C CG2 . ILE B 1 200 ? -1.278 -6.694 53.244 1.00 38.78 ? 281 ILE B CG2 1 ATOM 3014 C CD1 . ILE B 1 200 ? 0.818 -9.039 55.274 1.00 40.14 ? 281 ILE B CD1 1 ATOM 3015 N N . VAL B 1 201 ? -0.410 -3.435 54.176 1.00 39.37 ? 282 VAL B N 1 ATOM 3016 C CA . VAL B 1 201 ? -1.289 -2.270 54.305 1.00 39.63 ? 282 VAL B CA 1 ATOM 3017 C C . VAL B 1 201 ? -1.958 -1.915 52.976 1.00 39.84 ? 282 VAL B C 1 ATOM 3018 O O . VAL B 1 201 ? -1.494 -2.321 51.908 1.00 39.82 ? 282 VAL B O 1 ATOM 3019 C CB . VAL B 1 201 ? -0.540 -1.019 54.858 1.00 39.62 ? 282 VAL B CB 1 ATOM 3020 C CG1 . VAL B 1 201 ? -0.172 -1.205 56.329 1.00 39.65 ? 282 VAL B CG1 1 ATOM 3021 C CG2 . VAL B 1 201 ? 0.690 -0.681 54.010 1.00 39.50 ? 282 VAL B CG2 1 ATOM 3022 N N . GLY B 1 202 ? -3.047 -1.155 53.056 1.00 40.08 ? 283 GLY B N 1 ATOM 3023 C CA . GLY B 1 202 ? -3.729 -0.655 51.868 1.00 40.48 ? 283 GLY B CA 1 ATOM 3024 C C . GLY B 1 202 ? -4.612 -1.675 51.175 1.00 40.78 ? 283 GLY B C 1 ATOM 3025 O O . GLY B 1 202 ? -5.040 -2.660 51.782 1.00 40.66 ? 283 GLY B O 1 ATOM 3026 N N . ASN B 1 203 ? -4.863 -1.433 49.889 1.00 41.25 ? 284 ASN B N 1 ATOM 3027 C CA . ASN B 1 203 ? -5.829 -2.196 49.093 1.00 41.67 ? 284 ASN B CA 1 ATOM 3028 C C . ASN B 1 203 ? -5.224 -3.414 48.386 1.00 41.87 ? 284 ASN B C 1 ATOM 3029 O O . ASN B 1 203 ? -5.188 -3.479 47.155 1.00 41.93 ? 284 ASN B O 1 ATOM 3030 C CB . ASN B 1 203 ? -6.505 -1.268 48.078 1.00 41.68 ? 284 ASN B CB 1 ATOM 3031 C CG . ASN B 1 203 ? -7.890 -1.736 47.685 1.00 42.09 ? 284 ASN B CG 1 ATOM 3032 O OD1 . ASN B 1 203 ? -8.098 -2.904 47.349 1.00 42.73 ? 284 ASN B OD1 1 ATOM 3033 N ND2 . ASN B 1 203 ? -8.850 -0.819 47.720 1.00 42.20 ? 284 ASN B ND2 1 ATOM 3034 N N . VAL B 1 204 ? -4.754 -4.374 49.181 1.00 42.21 ? 285 VAL B N 1 ATOM 3035 C CA . VAL B 1 204 ? -4.165 -5.616 48.670 1.00 42.45 ? 285 VAL B CA 1 ATOM 3036 C C . VAL B 1 204 ? -4.753 -6.837 49.385 1.00 42.65 ? 285 VAL B C 1 ATOM 3037 O O . VAL B 1 204 ? -4.915 -6.839 50.607 1.00 42.45 ? 285 VAL B O 1 ATOM 3038 C CB . VAL B 1 204 ? -2.607 -5.605 48.752 1.00 42.50 ? 285 VAL B CB 1 ATOM 3039 C CG1 . VAL B 1 204 ? -2.122 -5.171 50.136 1.00 42.59 ? 285 VAL B CG1 1 ATOM 3040 C CG2 . VAL B 1 204 ? -2.018 -6.964 48.368 1.00 42.64 ? 285 VAL B CG2 1 ATOM 3041 N N . ARG B 1 205 ? -5.065 -7.869 48.604 1.00 43.04 ? 286 ARG B N 1 ATOM 3042 C CA . ARG B 1 205 ? -5.750 -9.056 49.108 1.00 43.35 ? 286 ARG B CA 1 ATOM 3043 C C . ARG B 1 205 ? -4.946 -10.326 48.867 1.00 43.43 ? 286 ARG B C 1 ATOM 3044 O O . ARG B 1 205 ? -4.329 -10.485 47.813 1.00 43.38 ? 286 ARG B O 1 ATOM 3045 C CB . ARG B 1 205 ? -7.126 -9.191 48.445 1.00 43.32 ? 286 ARG B CB 1 ATOM 3046 C CG . ARG B 1 205 ? -8.135 -8.136 48.870 1.00 43.91 ? 286 ARG B CG 1 ATOM 3047 C CD . ARG B 1 205 ? -9.324 -8.073 47.918 1.00 44.78 ? 286 ARG B CD 1 ATOM 3048 N NE . ARG B 1 205 ? -10.407 -7.238 48.447 1.00 44.89 ? 286 ARG B NE 1 ATOM 3049 C CZ . ARG B 1 205 ? -11.465 -6.833 47.746 1.00 45.10 ? 286 ARG B CZ 1 ATOM 3050 N NH1 . ARG B 1 205 ? -11.601 -7.171 46.469 1.00 45.00 ? 286 ARG B NH1 1 ATOM 3051 N NH2 . ARG B 1 205 ? -12.393 -6.083 48.327 1.00 45.23 ? 286 ARG B NH2 1 ATOM 3052 N N . LEU B 1 206 ? -4.950 -11.216 49.859 1.00 43.63 ? 287 LEU B N 1 ATOM 3053 C CA . LEU B 1 206 ? -4.478 -12.585 49.682 1.00 43.69 ? 287 LEU B CA 1 ATOM 3054 C C . LEU B 1 206 ? -5.540 -13.298 48.882 1.00 43.80 ? 287 LEU B C 1 ATOM 3055 O O . LEU B 1 206 ? -6.735 -13.048 49.061 1.00 43.83 ? 287 LEU B O 1 ATOM 3056 C CB . LEU B 1 206 ? -4.311 -13.288 51.032 1.00 43.80 ? 287 LEU B CB 1 ATOM 3057 C CG . LEU B 1 206 ? -3.512 -14.596 51.213 1.00 43.84 ? 287 LEU B CG 1 ATOM 3058 C CD1 . LEU B 1 206 ? -3.487 -14.976 52.697 1.00 44.20 ? 287 LEU B CD1 1 ATOM 3059 C CD2 . LEU B 1 206 ? -4.020 -15.780 50.396 1.00 43.69 ? 287 LEU B CD2 1 ATOM 3060 N N . VAL B 1 207 ? -5.102 -14.179 47.994 1.00 44.04 ? 288 VAL B N 1 ATOM 3061 C CA . VAL B 1 207 ? -6.022 -15.020 47.252 1.00 44.31 ? 288 VAL B CA 1 ATOM 3062 C C . VAL B 1 207 ? -5.472 -16.445 47.152 1.00 44.44 ? 288 VAL B C 1 ATOM 3063 O O . VAL B 1 207 ? -4.298 -16.652 46.831 1.00 44.42 ? 288 VAL B O 1 ATOM 3064 C CB . VAL B 1 207 ? -6.390 -14.396 45.874 1.00 44.34 ? 288 VAL B CB 1 ATOM 3065 C CG1 . VAL B 1 207 ? -5.367 -14.741 44.787 1.00 44.28 ? 288 VAL B CG1 1 ATOM 3066 C CG2 . VAL B 1 207 ? -7.797 -14.809 45.468 1.00 44.50 ? 288 VAL B CG2 1 ATOM 3067 O OXT . VAL B 1 207 ? -6.187 -17.412 47.433 1.00 44.62 ? 288 VAL B OXT 1 HETATM 3068 C C1 . NAG C 2 . ? 19.713 -19.001 20.781 1.00 42.42 ? 291 NAG A C1 1 HETATM 3069 C C2 . NAG C 2 . ? 20.255 -20.111 19.877 1.00 44.28 ? 291 NAG A C2 1 HETATM 3070 C C3 . NAG C 2 . ? 19.662 -21.476 20.229 1.00 46.18 ? 291 NAG A C3 1 HETATM 3071 C C4 . NAG C 2 . ? 19.795 -21.775 21.719 1.00 47.55 ? 291 NAG A C4 1 HETATM 3072 C C5 . NAG C 2 . ? 19.276 -20.573 22.531 1.00 45.60 ? 291 NAG A C5 1 HETATM 3073 C C6 . NAG C 2 . ? 19.617 -20.685 23.999 1.00 44.77 ? 291 NAG A C6 1 HETATM 3074 C C7 . NAG C 2 . ? 20.930 -19.799 17.576 1.00 41.92 ? 291 NAG A C7 1 HETATM 3075 C C8 . NAG C 2 . ? 20.480 -19.758 16.150 1.00 41.51 ? 291 NAG A C8 1 HETATM 3076 N N2 . NAG C 2 . ? 19.972 -19.811 18.491 1.00 43.10 ? 291 NAG A N2 1 HETATM 3077 O O3 . NAG C 2 . ? 20.313 -22.489 19.497 1.00 47.40 ? 291 NAG A O3 1 HETATM 3078 O O4 . NAG C 2 . ? 19.095 -22.984 21.954 1.00 51.18 ? 291 NAG A O4 1 HETATM 3079 O O5 . NAG C 2 . ? 19.909 -19.371 22.128 1.00 43.67 ? 291 NAG A O5 1 HETATM 3080 O O6 . NAG C 2 . ? 21.022 -20.613 24.158 1.00 44.34 ? 291 NAG A O6 1 HETATM 3081 O O7 . NAG C 2 . ? 22.125 -19.821 17.860 1.00 42.21 ? 291 NAG A O7 1 HETATM 3082 C C1 . NAG D 2 . ? 19.675 -23.781 23.017 1.00 55.22 ? 292 NAG A C1 1 HETATM 3083 C C2 . NAG D 2 . ? 18.575 -24.667 23.613 1.00 56.38 ? 292 NAG A C2 1 HETATM 3084 C C3 . NAG D 2 . ? 19.069 -26.089 23.872 1.00 57.76 ? 292 NAG A C3 1 HETATM 3085 C C4 . NAG D 2 . ? 19.700 -26.592 22.586 1.00 58.92 ? 292 NAG A C4 1 HETATM 3086 C C5 . NAG D 2 . ? 20.992 -25.802 22.339 1.00 58.88 ? 292 NAG A C5 1 HETATM 3087 C C6 . NAG D 2 . ? 21.449 -25.894 20.886 1.00 59.64 ? 292 NAG A C6 1 HETATM 3088 C C7 . NAG D 2 . ? 16.843 -23.599 24.956 1.00 56.35 ? 292 NAG A C7 1 HETATM 3089 C C8 . NAG D 2 . ? 16.484 -23.148 26.343 1.00 56.57 ? 292 NAG A C8 1 HETATM 3090 N N2 . NAG D 2 . ? 18.089 -24.054 24.833 1.00 55.93 ? 292 NAG A N2 1 HETATM 3091 O O3 . NAG D 2 . ? 18.025 -26.954 24.258 1.00 57.30 ? 292 NAG A O3 1 HETATM 3092 O O4 . NAG D 2 . ? 19.941 -27.982 22.697 1.00 60.34 ? 292 NAG A O4 1 HETATM 3093 O O5 . NAG D 2 . ? 20.923 -24.419 22.712 1.00 57.36 ? 292 NAG A O5 1 HETATM 3094 O O6 . NAG D 2 . ? 22.737 -25.321 20.794 1.00 60.31 ? 292 NAG A O6 1 HETATM 3095 O O7 . NAG D 2 . ? 16.016 -23.537 24.034 1.00 55.48 ? 292 NAG A O7 1 HETATM 3096 C C1 . BMA E 3 . ? 21.326 -21.377 25.332 1.00 44.30 ? 293 BMA A C1 1 HETATM 3097 C C2 . BMA E 3 . ? 22.822 -21.696 25.508 1.00 44.89 ? 293 BMA A C2 1 HETATM 3098 C C3 . BMA E 3 . ? 23.569 -20.697 26.406 1.00 45.19 ? 293 BMA A C3 1 HETATM 3099 C C4 . BMA E 3 . ? 22.738 -19.473 26.751 1.00 45.42 ? 293 BMA A C4 1 HETATM 3100 C C5 . BMA E 3 . ? 21.339 -19.840 27.243 1.00 44.93 ? 293 BMA A C5 1 HETATM 3101 C C6 . BMA E 3 . ? 20.426 -18.628 27.311 1.00 44.51 ? 293 BMA A C6 1 HETATM 3102 O O2 . BMA E 3 . ? 23.475 -21.829 24.260 1.00 45.25 ? 293 BMA A O2 1 HETATM 3103 O O3 . BMA E 3 . ? 24.789 -20.279 25.835 1.00 44.51 ? 293 BMA A O3 1 HETATM 3104 O O4 . BMA E 3 . ? 23.387 -18.837 27.820 1.00 46.64 ? 293 BMA A O4 1 HETATM 3105 O O5 . BMA E 3 . ? 20.686 -20.819 26.466 1.00 44.11 ? 293 BMA A O5 1 HETATM 3106 O O6 . BMA E 3 . ? 20.944 -17.747 28.277 1.00 44.77 ? 293 BMA A O6 1 HETATM 3107 P P . PO4 F 4 . ? 15.686 -4.720 -5.774 1.00 45.92 ? 1 PO4 A P 1 HETATM 3108 O O1 . PO4 F 4 . ? 17.001 -4.384 -6.450 1.00 44.43 ? 1 PO4 A O1 1 HETATM 3109 O O2 . PO4 F 4 . ? 14.568 -3.842 -6.301 1.00 44.45 ? 1 PO4 A O2 1 HETATM 3110 O O3 . PO4 F 4 . ? 15.326 -6.167 -6.026 1.00 45.63 ? 1 PO4 A O3 1 HETATM 3111 O O4 . PO4 F 4 . ? 15.831 -4.507 -4.284 1.00 45.62 ? 1 PO4 A O4 1 HETATM 3112 C C1 . NAG G 2 . ? 31.269 -9.354 35.515 1.00 40.11 ? 291 NAG B C1 1 HETATM 3113 C C2 . NAG G 2 . ? 32.183 -10.009 36.564 1.00 43.13 ? 291 NAG B C2 1 HETATM 3114 C C3 . NAG G 2 . ? 33.653 -9.920 36.147 1.00 44.11 ? 291 NAG B C3 1 HETATM 3115 C C4 . NAG G 2 . ? 33.847 -10.516 34.762 1.00 45.04 ? 291 NAG B C4 1 HETATM 3116 C C5 . NAG G 2 . ? 32.860 -9.822 33.820 1.00 44.18 ? 291 NAG B C5 1 HETATM 3117 C C6 . NAG G 2 . ? 32.957 -10.329 32.386 1.00 46.40 ? 291 NAG B C6 1 HETATM 3118 C C7 . NAG G 2 . ? 31.477 -10.198 38.867 1.00 41.52 ? 291 NAG B C7 1 HETATM 3119 C C8 . NAG G 2 . ? 31.275 -9.533 40.193 1.00 41.49 ? 291 NAG B C8 1 HETATM 3120 N N2 . NAG G 2 . ? 32.000 -9.451 37.898 1.00 42.30 ? 291 NAG B N2 1 HETATM 3121 O O3 . NAG G 2 . ? 34.480 -10.583 37.072 1.00 44.02 ? 291 NAG B O3 1 HETATM 3122 O O4 . NAG G 2 . ? 35.166 -10.219 34.372 1.00 48.31 ? 291 NAG B O4 1 HETATM 3123 O O5 . NAG G 2 . ? 31.522 -9.956 34.263 1.00 40.85 ? 291 NAG B O5 1 HETATM 3124 O O6 . NAG G 2 . ? 32.613 -11.692 32.285 1.00 48.28 ? 291 NAG B O6 1 HETATM 3125 O O7 . NAG G 2 . ? 31.160 -11.378 38.712 1.00 40.84 ? 291 NAG B O7 1 HETATM 3126 C C1 . NAG H 2 . ? 35.960 -11.385 34.076 1.00 52.02 ? 292 NAG B C1 1 HETATM 3127 C C2 . NAG H 2 . ? 37.231 -10.929 33.349 1.00 53.83 ? 292 NAG B C2 1 HETATM 3128 C C3 . NAG H 2 . ? 38.194 -12.094 33.087 1.00 54.71 ? 292 NAG B C3 1 HETATM 3129 C C4 . NAG H 2 . ? 38.318 -13.037 34.279 1.00 54.79 ? 292 NAG B C4 1 HETATM 3130 C C5 . NAG H 2 . ? 36.939 -13.372 34.852 1.00 54.29 ? 292 NAG B C5 1 HETATM 3131 C C6 . NAG H 2 . ? 37.021 -14.290 36.065 1.00 54.66 ? 292 NAG B C6 1 HETATM 3132 C C7 . NAG H 2 . ? 37.200 -9.021 31.798 1.00 55.52 ? 292 NAG B C7 1 HETATM 3133 C C8 . NAG H 2 . ? 37.396 -8.717 30.341 1.00 55.90 ? 292 NAG B C8 1 HETATM 3134 N N2 . NAG H 2 . ? 36.883 -10.283 32.091 1.00 54.64 ? 292 NAG B N2 1 HETATM 3135 O O3 . NAG H 2 . ? 39.478 -11.592 32.792 1.00 55.44 ? 292 NAG B O3 1 HETATM 3136 O O4 . NAG H 2 . ? 38.991 -14.202 33.852 1.00 55.90 ? 292 NAG B O4 1 HETATM 3137 O O5 . NAG H 2 . ? 36.294 -12.164 35.212 1.00 53.02 ? 292 NAG B O5 1 HETATM 3138 O O6 . NAG H 2 . ? 37.421 -13.520 37.172 1.00 55.31 ? 292 NAG B O6 1 HETATM 3139 O O7 . NAG H 2 . ? 37.323 -8.124 32.641 1.00 56.28 ? 292 NAG B O7 1 HETATM 3140 C C1 . BMA I 3 . ? 33.497 -12.264 31.309 1.00 50.45 ? 293 BMA B C1 1 HETATM 3141 C C2 . BMA I 3 . ? 33.460 -13.789 31.349 1.00 51.95 ? 293 BMA B C2 1 HETATM 3142 C C3 . BMA I 3 . ? 32.129 -14.339 30.827 1.00 52.58 ? 293 BMA B C3 1 HETATM 3143 C C4 . BMA I 3 . ? 31.619 -13.644 29.557 1.00 53.03 ? 293 BMA B C4 1 HETATM 3144 C C5 . BMA I 3 . ? 32.157 -12.236 29.244 1.00 52.67 ? 293 BMA B C5 1 HETATM 3145 C C6 . BMA I 3 . ? 31.035 -11.214 29.331 1.00 53.15 ? 293 BMA B C6 1 HETATM 3146 O O2 . BMA I 3 . ? 33.719 -14.244 32.663 1.00 52.37 ? 293 BMA B O2 1 HETATM 3147 O O3 . BMA I 3 . ? 31.127 -14.263 31.819 1.00 53.71 ? 293 BMA B O3 1 HETATM 3148 O O4 . BMA I 3 . ? 31.895 -14.470 28.447 1.00 54.00 ? 293 BMA B O4 1 HETATM 3149 O O5 . BMA I 3 . ? 33.271 -11.770 30.000 1.00 51.54 ? 293 BMA B O5 1 HETATM 3150 O O6 . BMA I 3 . ? 30.787 -10.700 28.043 1.00 54.48 ? 293 BMA B O6 1 HETATM 3151 O O . HOH J 5 . ? 36.198 -0.963 14.445 1.00 32.63 ? 2 HOH A O 1 HETATM 3152 O O . HOH J 5 . ? 24.555 3.168 24.623 1.00 21.32 ? 4 HOH A O 1 HETATM 3153 O O . HOH J 5 . ? 12.423 2.780 20.180 1.00 31.38 ? 6 HOH A O 1 HETATM 3154 O O . HOH J 5 . ? 32.192 -8.748 17.333 1.00 35.20 ? 7 HOH A O 1 HETATM 3155 O O . HOH J 5 . ? 13.780 -5.167 1.806 1.00 16.92 ? 8 HOH A O 1 HETATM 3156 O O . HOH J 5 . ? 13.972 -16.191 7.910 1.00 33.84 ? 10 HOH A O 1 HETATM 3157 O O . HOH J 5 . ? 23.553 -16.713 0.666 1.00 26.66 ? 11 HOH A O 1 HETATM 3158 O O . HOH J 5 . ? 35.813 -0.207 6.824 1.00 20.39 ? 14 HOH A O 1 HETATM 3159 O O . HOH J 5 . ? 25.042 6.631 -1.197 1.00 22.54 ? 16 HOH A O 1 HETATM 3160 O O . HOH J 5 . ? 33.426 8.698 26.597 1.00 24.04 ? 17 HOH A O 1 HETATM 3161 O O . HOH J 5 . ? 23.928 2.931 -4.971 1.00 40.18 ? 18 HOH A O 1 HETATM 3162 O O . HOH J 5 . ? 12.635 -11.419 13.500 1.00 33.25 ? 19 HOH A O 1 HETATM 3163 O O . HOH J 5 . ? 37.783 10.084 21.874 1.00 26.56 ? 20 HOH A O 1 HETATM 3164 O O . HOH J 5 . ? 30.399 10.168 20.481 1.00 25.92 ? 21 HOH A O 1 HETATM 3165 O O . HOH J 5 . ? 37.626 -6.855 22.717 1.00 42.60 ? 24 HOH A O 1 HETATM 3166 O O . HOH J 5 . ? 34.557 -10.705 13.433 1.00 56.03 ? 25 HOH A O 1 HETATM 3167 O O . HOH J 5 . ? 31.904 22.226 22.521 1.00 58.05 ? 28 HOH A O 1 HETATM 3168 O O . HOH J 5 . ? 22.132 4.438 7.495 1.00 36.45 ? 30 HOH A O 1 HETATM 3169 O O . HOH J 5 . ? 19.240 2.645 21.175 1.00 23.12 ? 31 HOH A O 1 HETATM 3170 O O . HOH J 5 . ? 30.162 13.889 -1.549 1.00 28.04 ? 32 HOH A O 1 HETATM 3171 O O . HOH J 5 . ? 21.134 16.074 19.157 1.00 25.68 ? 33 HOH A O 1 HETATM 3172 O O . HOH J 5 . ? 21.463 -30.249 22.350 1.00 45.02 ? 35 HOH A O 1 HETATM 3173 O O . HOH J 5 . ? 25.417 -10.579 -12.823 1.00 35.70 ? 36 HOH A O 1 HETATM 3174 O O . HOH J 5 . ? 14.504 -4.223 4.159 1.00 26.43 ? 37 HOH A O 1 HETATM 3175 O O . HOH J 5 . ? 16.897 5.040 25.317 1.00 43.18 ? 38 HOH A O 1 HETATM 3176 O O . HOH J 5 . ? 35.258 7.307 24.605 1.00 32.76 ? 39 HOH A O 1 HETATM 3177 O O . HOH J 5 . ? 38.871 -1.877 20.787 1.00 39.65 ? 40 HOH A O 1 HETATM 3178 O O . HOH J 5 . ? 30.976 1.706 27.368 1.00 30.96 ? 41 HOH A O 1 HETATM 3179 O O . HOH J 5 . ? 18.318 -4.708 25.442 1.00 37.37 ? 45 HOH A O 1 HETATM 3180 O O . HOH J 5 . ? 36.072 -5.678 14.239 1.00 43.66 ? 46 HOH A O 1 HETATM 3181 O O . HOH J 5 . ? 35.157 11.306 30.020 1.00 27.17 ? 47 HOH A O 1 HETATM 3182 O O . HOH J 5 . ? 29.857 -13.689 9.795 1.00 35.71 ? 48 HOH A O 1 HETATM 3183 O O . HOH J 5 . ? 33.393 -11.395 2.441 1.00 45.85 ? 49 HOH A O 1 HETATM 3184 O O . HOH J 5 . ? 30.799 16.700 11.804 1.00 34.79 ? 53 HOH A O 1 HETATM 3185 O O . HOH J 5 . ? 25.769 -17.841 7.827 1.00 25.88 ? 54 HOH A O 1 HETATM 3186 O O . HOH J 5 . ? 14.701 -0.162 19.299 1.00 38.51 ? 55 HOH A O 1 HETATM 3187 O O . HOH J 5 . ? 32.714 -8.340 14.857 1.00 31.86 ? 59 HOH A O 1 HETATM 3188 O O . HOH J 5 . ? 31.382 14.608 17.322 1.00 36.73 ? 60 HOH A O 1 HETATM 3189 O O . HOH J 5 . ? 21.286 12.394 25.937 1.00 43.16 ? 61 HOH A O 1 HETATM 3190 O O . HOH J 5 . ? 13.754 2.731 2.454 1.00 38.08 ? 62 HOH A O 1 HETATM 3191 O O . HOH J 5 . ? 6.771 -6.837 11.516 1.00 49.54 ? 63 HOH A O 1 HETATM 3192 O O . HOH J 5 . ? 37.622 9.054 24.355 1.00 21.09 ? 64 HOH A O 1 HETATM 3193 O O . HOH J 5 . ? 34.863 -9.793 0.570 1.00 60.90 ? 66 HOH A O 1 HETATM 3194 O O . HOH J 5 . ? 36.091 -2.753 -7.337 1.00 40.63 ? 67 HOH A O 1 HETATM 3195 O O . HOH J 5 . ? 29.429 -1.605 -10.703 1.00 33.11 ? 68 HOH A O 1 HETATM 3196 O O . HOH J 5 . ? 32.218 18.819 10.358 1.00 31.84 ? 71 HOH A O 1 HETATM 3197 O O . HOH J 5 . ? 22.742 -10.250 -12.698 1.00 31.55 ? 72 HOH A O 1 HETATM 3198 O O . HOH J 5 . ? 28.009 -10.408 -9.955 1.00 46.18 ? 73 HOH A O 1 HETATM 3199 O O . HOH J 5 . ? 22.212 -20.640 6.175 1.00 37.28 ? 74 HOH A O 1 HETATM 3200 O O . HOH J 5 . ? 33.642 -10.321 19.230 1.00 33.37 ? 75 HOH A O 1 HETATM 3201 O O . HOH J 5 . ? 37.672 9.810 26.534 1.00 28.21 ? 77 HOH A O 1 HETATM 3202 O O . HOH J 5 . ? 11.506 12.022 10.205 1.00 44.16 ? 78 HOH A O 1 HETATM 3203 O O . HOH J 5 . ? 30.094 8.172 -5.344 1.00 29.19 ? 79 HOH A O 1 HETATM 3204 O O . HOH J 5 . ? 23.600 6.944 -3.438 1.00 23.19 ? 80 HOH A O 1 HETATM 3205 O O . HOH J 5 . ? 22.919 17.001 10.007 1.00 32.13 ? 289 HOH A O 1 HETATM 3206 O O . HOH J 5 . ? 17.925 -0.647 -6.889 1.00 37.40 ? 290 HOH A O 1 HETATM 3207 O O . HOH J 5 . ? 24.242 11.587 7.743 1.00 25.88 ? 294 HOH A O 1 HETATM 3208 O O . HOH J 5 . ? 37.579 -1.791 -3.492 1.00 41.06 ? 295 HOH A O 1 HETATM 3209 O O . HOH J 5 . ? 33.720 5.789 -3.496 1.00 46.11 ? 296 HOH A O 1 HETATM 3210 O O . HOH J 5 . ? 27.978 -15.222 8.506 1.00 39.36 ? 297 HOH A O 1 HETATM 3211 O O . HOH J 5 . ? 17.121 -0.222 20.537 1.00 41.64 ? 298 HOH A O 1 HETATM 3212 O O . HOH J 5 . ? 30.064 18.406 29.149 1.00 43.20 ? 299 HOH A O 1 HETATM 3213 O O . HOH J 5 . ? 38.895 -8.579 10.336 1.00 41.56 ? 300 HOH A O 1 HETATM 3214 O O . HOH J 5 . ? 24.964 -14.488 19.749 1.00 40.48 ? 301 HOH A O 1 HETATM 3215 O O . HOH J 5 . ? 41.294 7.529 7.128 1.00 44.37 ? 302 HOH A O 1 HETATM 3216 O O . HOH J 5 . ? 28.291 -14.687 14.716 1.00 46.44 ? 303 HOH A O 1 HETATM 3217 O O . HOH J 5 . ? 30.290 -12.445 21.218 1.00 42.54 ? 304 HOH A O 1 HETATM 3218 O O . HOH J 5 . ? 29.818 3.205 29.630 1.00 40.40 ? 305 HOH A O 1 HETATM 3219 O O . HOH J 5 . ? 25.350 17.154 15.727 1.00 36.95 ? 306 HOH A O 1 HETATM 3220 O O . HOH J 5 . ? 28.225 -15.406 -9.188 1.00 34.96 ? 307 HOH A O 1 HETATM 3221 O O . HOH J 5 . ? 12.835 -13.899 14.550 1.00 37.93 ? 308 HOH A O 1 HETATM 3222 O O . HOH J 5 . ? 14.654 4.792 0.859 1.00 36.02 ? 309 HOH A O 1 HETATM 3223 O O . HOH J 5 . ? 28.942 -8.283 20.003 1.00 35.19 ? 310 HOH A O 1 HETATM 3224 O O . HOH J 5 . ? 36.359 9.139 14.774 1.00 38.52 ? 311 HOH A O 1 HETATM 3225 O O . HOH J 5 . ? 42.763 1.485 4.139 1.00 50.55 ? 312 HOH A O 1 HETATM 3226 O O . HOH J 5 . ? 26.371 -10.754 4.783 1.00 31.10 ? 313 HOH A O 1 HETATM 3227 O O . HOH J 5 . ? 31.476 -17.365 19.706 1.00 38.51 ? 314 HOH A O 1 HETATM 3228 O O . HOH J 5 . ? 5.898 -7.401 -0.482 1.00 41.84 ? 315 HOH A O 1 HETATM 3229 O O . HOH J 5 . ? 11.410 8.058 24.973 1.00 40.62 ? 316 HOH A O 1 HETATM 3230 O O . HOH J 5 . ? 10.307 -9.313 19.938 1.00 41.44 ? 317 HOH A O 1 HETATM 3231 O O . HOH J 5 . ? 29.554 5.284 31.218 1.00 35.62 ? 318 HOH A O 1 HETATM 3232 O O . HOH J 5 . ? 16.139 -22.480 21.705 1.00 42.01 ? 319 HOH A O 1 HETATM 3233 O O . HOH J 5 . ? 25.903 25.013 12.862 1.00 52.32 ? 320 HOH A O 1 HETATM 3234 O O . HOH J 5 . ? 22.395 -5.180 -4.234 1.00 37.52 ? 321 HOH A O 1 HETATM 3235 O O . HOH J 5 . ? 7.602 -5.175 13.659 1.00 52.50 ? 322 HOH A O 1 HETATM 3236 O O . HOH J 5 . ? 38.562 -7.793 18.044 1.00 38.48 ? 323 HOH A O 1 HETATM 3237 O O . HOH J 5 . ? 28.876 -12.851 24.946 1.00 34.61 ? 324 HOH A O 1 HETATM 3238 O O . HOH J 5 . ? 15.368 -20.675 9.485 1.00 43.58 ? 325 HOH A O 1 HETATM 3239 O O . HOH J 5 . ? 34.611 11.923 -0.204 1.00 30.19 ? 326 HOH A O 1 HETATM 3240 O O . HOH J 5 . ? 14.094 -1.187 -8.704 1.00 37.63 ? 327 HOH A O 1 HETATM 3241 O O . HOH J 5 . ? 17.083 -2.860 -1.294 1.00 35.27 ? 328 HOH A O 1 HETATM 3242 O O . HOH J 5 . ? 32.808 8.593 45.073 1.00 31.16 ? 329 HOH A O 1 HETATM 3243 O O . HOH J 5 . ? 42.489 0.832 25.760 1.00 47.29 ? 330 HOH A O 1 HETATM 3244 O O . HOH K 5 . ? 6.577 -25.859 24.732 1.00 31.85 ? 1 HOH B O 1 HETATM 3245 O O . HOH K 5 . ? 4.926 -26.350 18.056 1.00 20.70 ? 3 HOH B O 1 HETATM 3246 O O . HOH K 5 . ? 9.457 -6.780 29.127 1.00 29.98 ? 5 HOH B O 1 HETATM 3247 O O . HOH K 5 . ? -1.781 -16.364 31.968 1.00 31.06 ? 9 HOH B O 1 HETATM 3248 O O . HOH K 5 . ? 7.821 -17.767 40.845 1.00 35.37 ? 12 HOH B O 1 HETATM 3249 O O . HOH K 5 . ? 41.356 -14.582 34.334 1.00 36.65 ? 13 HOH B O 1 HETATM 3250 O O . HOH K 5 . ? 5.998 -24.721 16.422 1.00 38.00 ? 15 HOH B O 1 HETATM 3251 O O . HOH K 5 . ? -2.962 -23.749 14.615 1.00 28.38 ? 22 HOH B O 1 HETATM 3252 O O . HOH K 5 . ? 21.156 -2.874 28.907 1.00 23.90 ? 23 HOH B O 1 HETATM 3253 O O . HOH K 5 . ? 43.077 2.490 38.412 1.00 37.14 ? 26 HOH B O 1 HETATM 3254 O O . HOH K 5 . ? -1.258 -25.241 17.846 1.00 46.84 ? 27 HOH B O 1 HETATM 3255 O O . HOH K 5 . ? 14.235 -0.285 32.417 1.00 39.60 ? 29 HOH B O 1 HETATM 3256 O O . HOH K 5 . ? 9.028 -20.870 34.984 1.00 48.48 ? 34 HOH B O 1 HETATM 3257 O O . HOH K 5 . ? -3.940 -9.457 36.405 1.00 28.77 ? 42 HOH B O 1 HETATM 3258 O O . HOH K 5 . ? 0.407 -9.332 32.610 1.00 29.77 ? 43 HOH B O 1 HETATM 3259 O O . HOH K 5 . ? 8.833 -13.934 27.295 1.00 45.59 ? 44 HOH B O 1 HETATM 3260 O O . HOH K 5 . ? 18.190 -14.379 36.008 1.00 30.80 ? 50 HOH B O 1 HETATM 3261 O O . HOH K 5 . ? 11.687 -16.250 34.083 1.00 37.27 ? 51 HOH B O 1 HETATM 3262 O O . HOH K 5 . ? 2.613 -25.760 23.072 1.00 38.17 ? 52 HOH B O 1 HETATM 3263 O O . HOH K 5 . ? 11.480 -4.019 19.660 1.00 35.24 ? 56 HOH B O 1 HETATM 3264 O O . HOH K 5 . ? 17.041 -16.888 40.139 1.00 31.54 ? 57 HOH B O 1 HETATM 3265 O O . HOH K 5 . ? 25.737 -11.249 33.242 1.00 31.29 ? 58 HOH B O 1 HETATM 3266 O O . HOH K 5 . ? 42.418 0.800 31.488 1.00 34.74 ? 65 HOH B O 1 HETATM 3267 O O . HOH K 5 . ? 24.290 -12.212 37.074 1.00 37.41 ? 69 HOH B O 1 HETATM 3268 O O . HOH K 5 . ? 33.095 -3.355 38.530 1.00 45.12 ? 70 HOH B O 1 HETATM 3269 O O . HOH K 5 . ? -7.579 -3.581 18.737 1.00 44.43 ? 76 HOH B O 1 HETATM 3270 O O . HOH K 5 . ? 0.579 -18.910 40.260 1.00 31.90 ? 81 HOH B O 1 HETATM 3271 O O . HOH K 5 . ? 23.232 -12.343 57.842 1.00 37.50 ? 289 HOH B O 1 HETATM 3272 O O . HOH K 5 . ? 27.080 -12.660 49.221 1.00 41.06 ? 290 HOH B O 1 HETATM 3273 O O . HOH K 5 . ? 19.839 -21.946 37.259 1.00 30.32 ? 294 HOH B O 1 HETATM 3274 O O . HOH K 5 . ? 0.294 -5.640 59.202 1.00 45.25 ? 295 HOH B O 1 HETATM 3275 O O . HOH K 5 . ? 15.571 -14.706 64.229 1.00 44.41 ? 296 HOH B O 1 HETATM 3276 O O . HOH K 5 . ? 14.740 5.222 32.702 1.00 29.52 ? 297 HOH B O 1 HETATM 3277 O O . HOH K 5 . ? 1.256 -27.875 21.267 1.00 34.97 ? 298 HOH B O 1 HETATM 3278 O O . HOH K 5 . ? 18.845 -3.961 28.710 1.00 36.24 ? 299 HOH B O 1 HETATM 3279 O O . HOH K 5 . ? 47.700 -5.306 30.567 1.00 32.97 ? 300 HOH B O 1 HETATM 3280 O O . HOH K 5 . ? -1.884 -18.517 46.425 1.00 48.16 ? 301 HOH B O 1 HETATM 3281 O O . HOH K 5 . ? 2.956 7.663 30.894 1.00 45.67 ? 302 HOH B O 1 HETATM 3282 O O . HOH K 5 . ? 19.234 6.405 51.074 1.00 51.06 ? 303 HOH B O 1 HETATM 3283 O O . HOH K 5 . ? 28.434 -0.984 39.729 1.00 43.21 ? 304 HOH B O 1 HETATM 3284 O O . HOH K 5 . ? 1.736 -32.942 18.961 1.00 45.50 ? 305 HOH B O 1 HETATM 3285 O O . HOH K 5 . ? -0.398 -11.130 24.840 1.00 28.43 ? 306 HOH B O 1 HETATM 3286 O O . HOH K 5 . ? 11.242 -1.589 32.256 1.00 33.33 ? 307 HOH B O 1 HETATM 3287 O O . HOH K 5 . ? 26.805 -3.196 31.632 1.00 47.70 ? 308 HOH B O 1 HETATM 3288 O O . HOH K 5 . ? 2.035 -15.464 29.386 1.00 35.20 ? 309 HOH B O 1 HETATM 3289 O O . HOH K 5 . ? 1.380 -13.813 27.296 1.00 31.98 ? 310 HOH B O 1 HETATM 3290 O O . HOH K 5 . ? -1.031 5.272 45.963 1.00 46.39 ? 311 HOH B O 1 HETATM 3291 O O . HOH K 5 . ? 5.704 13.366 42.170 1.00 35.57 ? 312 HOH B O 1 HETATM 3292 O O . HOH K 5 . ? 13.151 -22.732 35.661 1.00 36.42 ? 313 HOH B O 1 HETATM 3293 O O . HOH K 5 . ? 11.608 -19.591 59.206 1.00 46.15 ? 315 HOH B O 1 HETATM 3294 O O . HOH K 5 . ? 34.071 -11.379 40.989 1.00 35.18 ? 316 HOH B O 1 HETATM 3295 O O . HOH K 5 . ? 24.470 9.264 54.595 1.00 44.91 ? 317 HOH B O 1 HETATM 3296 O O . HOH K 5 . ? -5.741 -7.062 27.057 1.00 52.15 ? 318 HOH B O 1 HETATM 3297 O O . HOH K 5 . ? 22.512 -16.625 31.495 1.00 41.48 ? 319 HOH B O 1 HETATM 3298 O O . HOH K 5 . ? 6.666 -15.879 47.711 1.00 33.58 ? 320 HOH B O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 GLY 1 82 ? ? ? A . n A 1 2 PRO 2 83 ? ? ? A . n A 1 3 GLY 3 84 84 GLY GLY A . n A 1 4 SER 4 85 85 SER SER A . n A 1 5 THR 5 86 86 THR THR A . n A 1 6 TYR 6 87 87 TYR TYR A . n A 1 7 ILE 7 88 88 ILE ILE A . n A 1 8 PHE 8 89 89 PHE PHE A . n A 1 9 SER 9 90 90 SER SER A . n A 1 10 LYS 10 91 91 LYS LYS A . n A 1 11 GLY 11 92 92 GLY GLY A . n A 1 12 GLY 12 93 93 GLY GLY A . n A 1 13 GLY 13 94 94 GLY GLY A . n A 1 14 GLN 14 95 95 GLN GLN A . n A 1 15 ILE 15 96 96 ILE ILE A . n A 1 16 THR 16 97 97 THR THR A . n A 1 17 TYR 17 98 98 TYR TYR A . n A 1 18 LYS 18 99 99 LYS LYS A . n A 1 19 TRP 19 100 100 TRP TRP A . n A 1 20 PRO 20 101 101 PRO PRO A . n A 1 21 PRO 21 102 102 PRO PRO A . n A 1 22 ASN 22 103 103 ASN ASN A . n A 1 23 ASP 23 104 104 ASP ASP A . n A 1 24 ARG 24 105 105 ARG ARG A . n A 1 25 PRO 25 106 106 PRO PRO A . n A 1 26 SER 26 107 107 SER SER A . n A 1 27 THR 27 108 108 THR THR A . n A 1 28 ARG 28 109 109 ARG ARG A . n A 1 29 ALA 29 110 110 ALA ALA A . n A 1 30 ASP 30 111 111 ASP ASP A . n A 1 31 ARG 31 112 112 ARG ARG A . n A 1 32 LEU 32 113 113 LEU LEU A . n A 1 33 ALA 33 114 114 ALA ALA A . n A 1 34 ILE 34 115 115 ILE ILE A . n A 1 35 GLY 35 116 116 GLY GLY A . n A 1 36 PHE 36 117 117 PHE PHE A . n A 1 37 SER 37 118 118 SER SER A . n A 1 38 THR 38 119 119 THR THR A . n A 1 39 VAL 39 120 120 VAL VAL A . n A 1 40 GLN 40 121 121 GLN GLN A . n A 1 41 LYS 41 122 122 LYS LYS A . n A 1 42 GLU 42 123 123 GLU GLU A . n A 1 43 ALA 43 124 124 ALA ALA A . n A 1 44 VAL 44 125 125 VAL VAL A . n A 1 45 LEU 45 126 126 LEU LEU A . n A 1 46 VAL 46 127 127 VAL VAL A . n A 1 47 ARG 47 128 128 ARG ARG A . n A 1 48 VAL 48 129 129 VAL VAL A . n A 1 49 ASP 49 130 130 ASP ASP A . n A 1 50 SER 50 131 131 SER SER A . n A 1 51 SER 51 132 132 SER SER A . n A 1 52 SER 52 133 133 SER SER A . n A 1 53 GLY 53 134 134 GLY GLY A . n A 1 54 LEU 54 135 135 LEU LEU A . n A 1 55 GLY 55 136 136 GLY GLY A . n A 1 56 ASP 56 137 137 ASP ASP A . n A 1 57 TYR 57 138 138 TYR TYR A . n A 1 58 LEU 58 139 139 LEU LEU A . n A 1 59 GLU 59 140 140 GLU GLU A . n A 1 60 LEU 60 141 141 LEU LEU A . n A 1 61 HIS 61 142 142 HIS HIS A . n A 1 62 ILE 62 143 143 ILE ILE A . n A 1 63 HIS 63 144 144 HIS HIS A . n A 1 64 GLN 64 145 145 GLN GLN A . n A 1 65 GLY 65 146 146 GLY GLY A . n A 1 66 LYS 66 147 147 LYS LYS A . n A 1 67 ILE 67 148 148 ILE ILE A . n A 1 68 GLY 68 149 149 GLY GLY A . n A 1 69 VAL 69 150 150 VAL VAL A . n A 1 70 LYS 70 151 151 LYS LYS A . n A 1 71 PHE 71 152 152 PHE PHE A . n A 1 72 ASN 72 153 153 ASN ASN A . n A 1 73 VAL 73 154 154 VAL VAL A . n A 1 74 GLY 74 155 155 GLY GLY A . n A 1 75 THR 75 156 156 THR THR A . n A 1 76 ASP 76 157 157 ASP ASP A . n A 1 77 ASP 77 158 158 ASP ASP A . n A 1 78 ILE 78 159 159 ILE ILE A . n A 1 79 ALA 79 160 160 ALA ALA A . n A 1 80 ILE 80 161 161 ILE ILE A . n A 1 81 GLU 81 162 162 GLU GLU A . n A 1 82 GLU 82 163 163 GLU GLU A . n A 1 83 SER 83 164 164 SER SER A . n A 1 84 ASN 84 165 165 ASN ASN A . n A 1 85 ALA 85 166 166 ALA ALA A . n A 1 86 ILE 86 167 167 ILE ILE A . n A 1 87 ILE 87 168 168 ILE ILE A . n A 1 88 ASN 88 169 169 ASN ASN A . n A 1 89 ASP 89 170 170 ASP ASP A . n A 1 90 GLY 90 171 171 GLY GLY A . n A 1 91 LYS 91 172 172 LYS LYS A . n A 1 92 TYR 92 173 173 TYR TYR A . n A 1 93 HIS 93 174 174 HIS HIS A . n A 1 94 VAL 94 175 175 VAL VAL A . n A 1 95 VAL 95 176 176 VAL VAL A . n A 1 96 ARG 96 177 177 ARG ARG A . n A 1 97 PHE 97 178 178 PHE PHE A . n A 1 98 THR 98 179 179 THR THR A . n A 1 99 ARG 99 180 180 ARG ARG A . n A 1 100 SER 100 181 181 SER SER A . n A 1 101 GLY 101 182 182 GLY GLY A . n A 1 102 GLY 102 183 183 GLY GLY A . n A 1 103 ASN 103 184 184 ASN ASN A . n A 1 104 ALA 104 185 185 ALA ALA A . n A 1 105 THR 105 186 186 THR THR A . n A 1 106 LEU 106 187 187 LEU LEU A . n A 1 107 GLN 107 188 188 GLN GLN A . n A 1 108 VAL 108 189 189 VAL VAL A . n A 1 109 ASP 109 190 190 ASP ASP A . n A 1 110 SER 110 191 191 SER SER A . n A 1 111 TRP 111 192 192 TRP TRP A . n A 1 112 PRO 112 193 193 PRO PRO A . n A 1 113 VAL 113 194 194 VAL VAL A . n A 1 114 ILE 114 195 195 ILE ILE A . n A 1 115 GLU 115 196 196 GLU GLU A . n A 1 116 ARG 116 197 197 ARG ARG A . n A 1 117 TYR 117 198 ? ? ? A . n A 1 118 PRO 118 199 ? ? ? A . n A 1 119 ALA 119 200 ? ? ? A . n A 1 120 GLY 120 201 ? ? ? A . n A 1 121 ASN 121 202 ? ? ? A . n A 1 122 ASN 122 203 ? ? ? A . n A 1 123 ASP 123 204 ? ? ? A . n A 1 124 ASN 124 205 ? ? ? A . n A 1 125 GLU 125 206 ? ? ? A . n A 1 126 ARG 126 207 ? ? ? A . n A 1 127 LEU 127 208 208 LEU LEU A . n A 1 128 ALA 128 209 209 ALA ALA A . n A 1 129 ILE 129 210 210 ILE ILE A . n A 1 130 ALA 130 211 211 ALA ALA A . n A 1 131 ARG 131 212 212 ARG ARG A . n A 1 132 GLN 132 213 213 GLN GLN A . n A 1 133 ARG 133 214 214 ARG ARG A . n A 1 134 ILE 134 215 215 ILE ILE A . n A 1 135 PRO 135 216 216 PRO PRO A . n A 1 136 TYR 136 217 217 TYR TYR A . n A 1 137 ARG 137 218 218 ARG ARG A . n A 1 138 LEU 138 219 219 LEU LEU A . n A 1 139 GLY 139 220 220 GLY GLY A . n A 1 140 ARG 140 221 221 ARG ARG A . n A 1 141 VAL 141 222 222 VAL VAL A . n A 1 142 VAL 142 223 223 VAL VAL A . n A 1 143 ASP 143 224 224 ASP ASP A . n A 1 144 GLU 144 225 225 GLU GLU A . n A 1 145 TRP 145 226 226 TRP TRP A . n A 1 146 LEU 146 227 227 LEU LEU A . n A 1 147 LEU 147 228 228 LEU LEU A . n A 1 148 ASP 148 229 229 ASP ASP A . n A 1 149 LYS 149 230 230 LYS LYS A . n A 1 150 GLY 150 231 231 GLY GLY A . n A 1 151 ARG 151 232 232 ARG ARG A . n A 1 152 GLN 152 233 233 GLN GLN A . n A 1 153 LEU 153 234 234 LEU LEU A . n A 1 154 THR 154 235 235 THR THR A . n A 1 155 ILE 155 236 236 ILE ILE A . n A 1 156 PHE 156 237 237 PHE PHE A . n A 1 157 ASN 157 238 238 ASN ASN A . n A 1 158 SER 158 239 239 SER SER A . n A 1 159 GLN 159 240 240 GLN GLN A . n A 1 160 ALA 160 241 241 ALA ALA A . n A 1 161 THR 161 242 242 THR THR A . n A 1 162 ILE 162 243 243 ILE ILE A . n A 1 163 ILE 163 244 244 ILE ILE A . n A 1 164 ILE 164 245 245 ILE ILE A . n A 1 165 GLY 165 246 246 GLY GLY A . n A 1 166 GLY 166 247 247 GLY GLY A . n A 1 167 LYS 167 248 248 LYS LYS A . n A 1 168 GLU 168 249 249 GLU GLU A . n A 1 169 GLN 169 250 250 GLN GLN A . n A 1 170 GLY 170 251 251 GLY GLY A . n A 1 171 GLN 171 252 252 GLN GLN A . n A 1 172 PRO 172 253 253 PRO PRO A . n A 1 173 PHE 173 254 254 PHE PHE A . n A 1 174 GLN 174 255 255 GLN GLN A . n A 1 175 GLY 175 256 256 GLY GLY A . n A 1 176 GLN 176 257 257 GLN GLN A . n A 1 177 LEU 177 258 258 LEU LEU A . n A 1 178 SER 178 259 259 SER SER A . n A 1 179 GLY 179 260 260 GLY GLY A . n A 1 180 LEU 180 261 261 LEU LEU A . n A 1 181 TYR 181 262 262 TYR TYR A . n A 1 182 TYR 182 263 263 TYR TYR A . n A 1 183 ASN 183 264 264 ASN ASN A . n A 1 184 GLY 184 265 265 GLY GLY A . n A 1 185 LEU 185 266 266 LEU LEU A . n A 1 186 LYS 186 267 267 LYS LYS A . n A 1 187 VAL 187 268 268 VAL VAL A . n A 1 188 LEU 188 269 269 LEU LEU A . n A 1 189 ASN 189 270 270 ASN ASN A . n A 1 190 MET 190 271 271 MET MET A . n A 1 191 ALA 191 272 272 ALA ALA A . n A 1 192 ALA 192 273 273 ALA ALA A . n A 1 193 GLU 193 274 274 GLU GLU A . n A 1 194 ASN 194 275 275 ASN ASN A . n A 1 195 ASP 195 276 276 ASP ASP A . n A 1 196 ALA 196 277 277 ALA ALA A . n A 1 197 ASN 197 278 278 ASN ASN A . n A 1 198 ILE 198 279 279 ILE ILE A . n A 1 199 ALA 199 280 280 ALA ALA A . n A 1 200 ILE 200 281 281 ILE ILE A . n A 1 201 VAL 201 282 282 VAL VAL A . n A 1 202 GLY 202 283 283 GLY GLY A . n A 1 203 ASN 203 284 284 ASN ASN A . n A 1 204 VAL 204 285 285 VAL VAL A . n A 1 205 ARG 205 286 286 ARG ARG A . n A 1 206 LEU 206 287 287 LEU LEU A . n A 1 207 VAL 207 288 288 VAL VAL A . n B 1 1 GLY 1 82 ? ? ? B . n B 1 2 PRO 2 83 ? ? ? B . n B 1 3 GLY 3 84 84 GLY GLY B . n B 1 4 SER 4 85 85 SER SER B . n B 1 5 THR 5 86 86 THR THR B . n B 1 6 TYR 6 87 87 TYR TYR B . n B 1 7 ILE 7 88 88 ILE ILE B . n B 1 8 PHE 8 89 89 PHE PHE B . n B 1 9 SER 9 90 90 SER SER B . n B 1 10 LYS 10 91 91 LYS LYS B . n B 1 11 GLY 11 92 92 GLY GLY B . n B 1 12 GLY 12 93 93 GLY GLY B . n B 1 13 GLY 13 94 94 GLY GLY B . n B 1 14 GLN 14 95 95 GLN GLN B . n B 1 15 ILE 15 96 96 ILE ILE B . n B 1 16 THR 16 97 97 THR THR B . n B 1 17 TYR 17 98 98 TYR TYR B . n B 1 18 LYS 18 99 99 LYS LYS B . n B 1 19 TRP 19 100 100 TRP TRP B . n B 1 20 PRO 20 101 101 PRO PRO B . n B 1 21 PRO 21 102 102 PRO PRO B . n B 1 22 ASN 22 103 103 ASN ASN B . n B 1 23 ASP 23 104 104 ASP ASP B . n B 1 24 ARG 24 105 105 ARG ARG B . n B 1 25 PRO 25 106 106 PRO PRO B . n B 1 26 SER 26 107 107 SER SER B . n B 1 27 THR 27 108 108 THR THR B . n B 1 28 ARG 28 109 109 ARG ARG B . n B 1 29 ALA 29 110 110 ALA ALA B . n B 1 30 ASP 30 111 111 ASP ASP B . n B 1 31 ARG 31 112 112 ARG ARG B . n B 1 32 LEU 32 113 113 LEU LEU B . n B 1 33 ALA 33 114 114 ALA ALA B . n B 1 34 ILE 34 115 115 ILE ILE B . n B 1 35 GLY 35 116 116 GLY GLY B . n B 1 36 PHE 36 117 117 PHE PHE B . n B 1 37 SER 37 118 118 SER SER B . n B 1 38 THR 38 119 119 THR THR B . n B 1 39 VAL 39 120 120 VAL VAL B . n B 1 40 GLN 40 121 121 GLN GLN B . n B 1 41 LYS 41 122 122 LYS LYS B . n B 1 42 GLU 42 123 123 GLU GLU B . n B 1 43 ALA 43 124 124 ALA ALA B . n B 1 44 VAL 44 125 125 VAL VAL B . n B 1 45 LEU 45 126 126 LEU LEU B . n B 1 46 VAL 46 127 127 VAL VAL B . n B 1 47 ARG 47 128 128 ARG ARG B . n B 1 48 VAL 48 129 129 VAL VAL B . n B 1 49 ASP 49 130 130 ASP ASP B . n B 1 50 SER 50 131 131 SER SER B . n B 1 51 SER 51 132 132 SER SER B . n B 1 52 SER 52 133 133 SER SER B . n B 1 53 GLY 53 134 134 GLY GLY B . n B 1 54 LEU 54 135 135 LEU LEU B . n B 1 55 GLY 55 136 136 GLY GLY B . n B 1 56 ASP 56 137 137 ASP ASP B . n B 1 57 TYR 57 138 138 TYR TYR B . n B 1 58 LEU 58 139 139 LEU LEU B . n B 1 59 GLU 59 140 140 GLU GLU B . n B 1 60 LEU 60 141 141 LEU LEU B . n B 1 61 HIS 61 142 142 HIS HIS B . n B 1 62 ILE 62 143 143 ILE ILE B . n B 1 63 HIS 63 144 144 HIS HIS B . n B 1 64 GLN 64 145 145 GLN GLN B . n B 1 65 GLY 65 146 146 GLY GLY B . n B 1 66 LYS 66 147 147 LYS LYS B . n B 1 67 ILE 67 148 148 ILE ILE B . n B 1 68 GLY 68 149 149 GLY GLY B . n B 1 69 VAL 69 150 150 VAL VAL B . n B 1 70 LYS 70 151 151 LYS LYS B . n B 1 71 PHE 71 152 152 PHE PHE B . n B 1 72 ASN 72 153 153 ASN ASN B . n B 1 73 VAL 73 154 154 VAL VAL B . n B 1 74 GLY 74 155 155 GLY GLY B . n B 1 75 THR 75 156 156 THR THR B . n B 1 76 ASP 76 157 157 ASP ASP B . n B 1 77 ASP 77 158 158 ASP ASP B . n B 1 78 ILE 78 159 159 ILE ILE B . n B 1 79 ALA 79 160 160 ALA ALA B . n B 1 80 ILE 80 161 161 ILE ILE B . n B 1 81 GLU 81 162 162 GLU GLU B . n B 1 82 GLU 82 163 163 GLU GLU B . n B 1 83 SER 83 164 164 SER SER B . n B 1 84 ASN 84 165 165 ASN ASN B . n B 1 85 ALA 85 166 166 ALA ALA B . n B 1 86 ILE 86 167 167 ILE ILE B . n B 1 87 ILE 87 168 168 ILE ILE B . n B 1 88 ASN 88 169 169 ASN ASN B . n B 1 89 ASP 89 170 170 ASP ASP B . n B 1 90 GLY 90 171 171 GLY GLY B . n B 1 91 LYS 91 172 172 LYS LYS B . n B 1 92 TYR 92 173 173 TYR TYR B . n B 1 93 HIS 93 174 174 HIS HIS B . n B 1 94 VAL 94 175 175 VAL VAL B . n B 1 95 VAL 95 176 176 VAL VAL B . n B 1 96 ARG 96 177 177 ARG ARG B . n B 1 97 PHE 97 178 178 PHE PHE B . n B 1 98 THR 98 179 179 THR THR B . n B 1 99 ARG 99 180 180 ARG ARG B . n B 1 100 SER 100 181 181 SER SER B . n B 1 101 GLY 101 182 182 GLY GLY B . n B 1 102 GLY 102 183 183 GLY GLY B . n B 1 103 ASN 103 184 184 ASN ASN B . n B 1 104 ALA 104 185 185 ALA ALA B . n B 1 105 THR 105 186 186 THR THR B . n B 1 106 LEU 106 187 187 LEU LEU B . n B 1 107 GLN 107 188 188 GLN GLN B . n B 1 108 VAL 108 189 189 VAL VAL B . n B 1 109 ASP 109 190 190 ASP ASP B . n B 1 110 SER 110 191 191 SER SER B . n B 1 111 TRP 111 192 192 TRP TRP B . n B 1 112 PRO 112 193 193 PRO PRO B . n B 1 113 VAL 113 194 194 VAL VAL B . n B 1 114 ILE 114 195 195 ILE ILE B . n B 1 115 GLU 115 196 196 GLU GLU B . n B 1 116 ARG 116 197 197 ARG ARG B . n B 1 117 TYR 117 198 198 TYR TYR B . n B 1 118 PRO 118 199 ? ? ? B . n B 1 119 ALA 119 200 ? ? ? B . n B 1 120 GLY 120 201 ? ? ? B . n B 1 121 ASN 121 202 ? ? ? B . n B 1 122 ASN 122 203 ? ? ? B . n B 1 123 ASP 123 204 ? ? ? B . n B 1 124 ASN 124 205 ? ? ? B . n B 1 125 GLU 125 206 206 GLU GLU B . n B 1 126 ARG 126 207 207 ARG ALA B . n B 1 127 LEU 127 208 208 LEU ALA B . n B 1 128 ALA 128 209 209 ALA ALA B . n B 1 129 ILE 129 210 210 ILE ILE B . n B 1 130 ALA 130 211 211 ALA ALA B . n B 1 131 ARG 131 212 212 ARG ARG B . n B 1 132 GLN 132 213 213 GLN GLN B . n B 1 133 ARG 133 214 214 ARG ARG B . n B 1 134 ILE 134 215 215 ILE ILE B . n B 1 135 PRO 135 216 216 PRO PRO B . n B 1 136 TYR 136 217 217 TYR TYR B . n B 1 137 ARG 137 218 218 ARG ARG B . n B 1 138 LEU 138 219 219 LEU LEU B . n B 1 139 GLY 139 220 220 GLY GLY B . n B 1 140 ARG 140 221 221 ARG ARG B . n B 1 141 VAL 141 222 222 VAL VAL B . n B 1 142 VAL 142 223 223 VAL VAL B . n B 1 143 ASP 143 224 224 ASP ASP B . n B 1 144 GLU 144 225 225 GLU GLU B . n B 1 145 TRP 145 226 226 TRP TRP B . n B 1 146 LEU 146 227 227 LEU LEU B . n B 1 147 LEU 147 228 228 LEU LEU B . n B 1 148 ASP 148 229 229 ASP ASP B . n B 1 149 LYS 149 230 230 LYS LYS B . n B 1 150 GLY 150 231 231 GLY GLY B . n B 1 151 ARG 151 232 232 ARG ARG B . n B 1 152 GLN 152 233 233 GLN GLN B . n B 1 153 LEU 153 234 234 LEU LEU B . n B 1 154 THR 154 235 235 THR THR B . n B 1 155 ILE 155 236 236 ILE ILE B . n B 1 156 PHE 156 237 237 PHE PHE B . n B 1 157 ASN 157 238 238 ASN ASN B . n B 1 158 SER 158 239 239 SER SER B . n B 1 159 GLN 159 240 240 GLN GLN B . n B 1 160 ALA 160 241 241 ALA ALA B . n B 1 161 THR 161 242 242 THR THR B . n B 1 162 ILE 162 243 243 ILE ILE B . n B 1 163 ILE 163 244 244 ILE ILE B . n B 1 164 ILE 164 245 245 ILE ILE B . n B 1 165 GLY 165 246 246 GLY GLY B . n B 1 166 GLY 166 247 247 GLY GLY B . n B 1 167 LYS 167 248 248 LYS LYS B . n B 1 168 GLU 168 249 249 GLU GLU B . n B 1 169 GLN 169 250 250 GLN GLN B . n B 1 170 GLY 170 251 251 GLY GLY B . n B 1 171 GLN 171 252 252 GLN GLN B . n B 1 172 PRO 172 253 253 PRO PRO B . n B 1 173 PHE 173 254 254 PHE PHE B . n B 1 174 GLN 174 255 255 GLN GLN B . n B 1 175 GLY 175 256 256 GLY GLY B . n B 1 176 GLN 176 257 257 GLN GLN B . n B 1 177 LEU 177 258 258 LEU LEU B . n B 1 178 SER 178 259 259 SER SER B . n B 1 179 GLY 179 260 260 GLY GLY B . n B 1 180 LEU 180 261 261 LEU LEU B . n B 1 181 TYR 181 262 262 TYR TYR B . n B 1 182 TYR 182 263 263 TYR TYR B . n B 1 183 ASN 183 264 264 ASN ASN B . n B 1 184 GLY 184 265 265 GLY GLY B . n B 1 185 LEU 185 266 266 LEU LEU B . n B 1 186 LYS 186 267 267 LYS LYS B . n B 1 187 VAL 187 268 268 VAL VAL B . n B 1 188 LEU 188 269 269 LEU LEU B . n B 1 189 ASN 189 270 270 ASN ASN B . n B 1 190 MET 190 271 271 MET MET B . n B 1 191 ALA 191 272 272 ALA ALA B . n B 1 192 ALA 192 273 273 ALA ALA B . n B 1 193 GLU 193 274 274 GLU GLU B . n B 1 194 ASN 194 275 275 ASN ASN B . n B 1 195 ASP 195 276 276 ASP ASP B . n B 1 196 ALA 196 277 277 ALA ALA B . n B 1 197 ASN 197 278 278 ASN ASN B . n B 1 198 ILE 198 279 279 ILE ILE B . n B 1 199 ALA 199 280 280 ALA ALA B . n B 1 200 ILE 200 281 281 ILE ILE B . n B 1 201 VAL 201 282 282 VAL VAL B . n B 1 202 GLY 202 283 283 GLY GLY B . n B 1 203 ASN 203 284 284 ASN ASN B . n B 1 204 VAL 204 285 285 VAL VAL B . n B 1 205 ARG 205 286 286 ARG ARG B . n B 1 206 LEU 206 287 287 LEU LEU B . n B 1 207 VAL 207 288 288 VAL VAL B . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code C 2 NAG 1 291 291 NAG NAG A . D 2 NAG 2 292 292 NAG NAG A . E 3 BMA 3 293 293 BMA BMA A . F 4 PO4 1 1 1 PO4 PO4 A . G 2 NAG 1 291 291 NAG NAG B . H 2 NAG 2 292 292 NAG NAG B . I 3 BMA 3 293 293 BMA BMA B . J 5 HOH 1 2 2 HOH HOH A . J 5 HOH 2 4 4 HOH HOH A . J 5 HOH 3 6 6 HOH HOH A . J 5 HOH 4 7 7 HOH HOH A . J 5 HOH 5 8 8 HOH HOH A . J 5 HOH 6 10 10 HOH HOH A . J 5 HOH 7 11 11 HOH HOH A . J 5 HOH 8 14 14 HOH HOH A . J 5 HOH 9 16 16 HOH HOH A . J 5 HOH 10 17 17 HOH HOH A . J 5 HOH 11 18 18 HOH HOH A . J 5 HOH 12 19 19 HOH HOH A . J 5 HOH 13 20 20 HOH HOH A . J 5 HOH 14 21 21 HOH HOH A . J 5 HOH 15 24 24 HOH HOH A . J 5 HOH 16 25 25 HOH HOH A . J 5 HOH 17 28 28 HOH HOH A . J 5 HOH 18 30 30 HOH HOH A . J 5 HOH 19 31 31 HOH HOH A . J 5 HOH 20 32 32 HOH HOH A . J 5 HOH 21 33 33 HOH HOH A . J 5 HOH 22 35 35 HOH HOH A . J 5 HOH 23 36 36 HOH HOH A . J 5 HOH 24 37 37 HOH HOH A . J 5 HOH 25 38 38 HOH HOH A . J 5 HOH 26 39 39 HOH HOH A . J 5 HOH 27 40 40 HOH HOH A . J 5 HOH 28 41 41 HOH HOH A . J 5 HOH 29 45 45 HOH HOH A . J 5 HOH 30 46 46 HOH HOH A . J 5 HOH 31 47 47 HOH HOH A . J 5 HOH 32 48 48 HOH HOH A . J 5 HOH 33 49 49 HOH HOH A . J 5 HOH 34 53 53 HOH HOH A . J 5 HOH 35 54 54 HOH HOH A . J 5 HOH 36 55 55 HOH HOH A . J 5 HOH 37 59 59 HOH HOH A . J 5 HOH 38 60 60 HOH HOH A . J 5 HOH 39 61 61 HOH HOH A . J 5 HOH 40 62 62 HOH HOH A . J 5 HOH 41 63 63 HOH HOH A . J 5 HOH 42 64 64 HOH HOH A . J 5 HOH 43 66 66 HOH HOH A . J 5 HOH 44 67 67 HOH HOH A . J 5 HOH 45 68 68 HOH HOH A . J 5 HOH 46 71 71 HOH HOH A . J 5 HOH 47 72 72 HOH HOH A . J 5 HOH 48 73 73 HOH HOH A . J 5 HOH 49 74 74 HOH HOH A . J 5 HOH 50 75 75 HOH HOH A . J 5 HOH 51 77 77 HOH HOH A . J 5 HOH 52 78 78 HOH HOH A . J 5 HOH 53 79 79 HOH HOH A . J 5 HOH 54 80 80 HOH HOH A . J 5 HOH 55 289 86 HOH HOH A . J 5 HOH 56 290 87 HOH HOH A . J 5 HOH 57 294 90 HOH HOH A . J 5 HOH 58 295 92 HOH HOH A . J 5 HOH 59 296 93 HOH HOH A . J 5 HOH 60 297 94 HOH HOH A . J 5 HOH 61 298 95 HOH HOH A . J 5 HOH 62 299 97 HOH HOH A . J 5 HOH 63 300 99 HOH HOH A . J 5 HOH 64 301 102 HOH HOH A . J 5 HOH 65 302 103 HOH HOH A . J 5 HOH 66 303 105 HOH HOH A . J 5 HOH 67 304 106 HOH HOH A . J 5 HOH 68 305 109 HOH HOH A . J 5 HOH 69 306 111 HOH HOH A . J 5 HOH 70 307 112 HOH HOH A . J 5 HOH 71 308 113 HOH HOH A . J 5 HOH 72 309 114 HOH HOH A . J 5 HOH 73 310 117 HOH HOH A . J 5 HOH 74 311 118 HOH HOH A . J 5 HOH 75 312 119 HOH HOH A . J 5 HOH 76 313 122 HOH HOH A . J 5 HOH 77 314 125 HOH HOH A . J 5 HOH 78 315 126 HOH HOH A . J 5 HOH 79 316 127 HOH HOH A . J 5 HOH 80 317 128 HOH HOH A . J 5 HOH 81 318 129 HOH HOH A . J 5 HOH 82 319 130 HOH HOH A . J 5 HOH 83 320 134 HOH HOH A . J 5 HOH 84 321 135 HOH HOH A . J 5 HOH 85 322 136 HOH HOH A . J 5 HOH 86 323 137 HOH HOH A . J 5 HOH 87 324 138 HOH HOH A . J 5 HOH 88 325 139 HOH HOH A . J 5 HOH 89 326 140 HOH HOH A . J 5 HOH 90 327 146 HOH HOH A . J 5 HOH 91 328 147 HOH HOH A . J 5 HOH 92 329 148 HOH HOH A . J 5 HOH 93 330 132 HOH HOH A . K 5 HOH 1 1 1 HOH HOH B . K 5 HOH 2 3 3 HOH HOH B . K 5 HOH 3 5 5 HOH HOH B . K 5 HOH 4 9 9 HOH HOH B . K 5 HOH 5 12 12 HOH HOH B . K 5 HOH 6 13 13 HOH HOH B . K 5 HOH 7 15 15 HOH HOH B . K 5 HOH 8 22 22 HOH HOH B . K 5 HOH 9 23 23 HOH HOH B . K 5 HOH 10 26 26 HOH HOH B . K 5 HOH 11 27 27 HOH HOH B . K 5 HOH 12 29 29 HOH HOH B . K 5 HOH 13 34 34 HOH HOH B . K 5 HOH 14 42 42 HOH HOH B . K 5 HOH 15 43 43 HOH HOH B . K 5 HOH 16 44 44 HOH HOH B . K 5 HOH 17 50 50 HOH HOH B . K 5 HOH 18 51 51 HOH HOH B . K 5 HOH 19 52 52 HOH HOH B . K 5 HOH 20 56 56 HOH HOH B . K 5 HOH 21 57 57 HOH HOH B . K 5 HOH 22 58 58 HOH HOH B . K 5 HOH 23 65 65 HOH HOH B . K 5 HOH 24 69 69 HOH HOH B . K 5 HOH 25 70 70 HOH HOH B . K 5 HOH 26 76 76 HOH HOH B . K 5 HOH 27 81 81 HOH HOH B . K 5 HOH 28 289 82 HOH HOH B . K 5 HOH 29 290 83 HOH HOH B . K 5 HOH 30 294 84 HOH HOH B . K 5 HOH 31 295 85 HOH HOH B . K 5 HOH 32 296 88 HOH HOH B . K 5 HOH 33 297 89 HOH HOH B . K 5 HOH 34 298 91 HOH HOH B . K 5 HOH 35 299 96 HOH HOH B . K 5 HOH 36 300 98 HOH HOH B . K 5 HOH 37 301 100 HOH HOH B . K 5 HOH 38 302 101 HOH HOH B . K 5 HOH 39 303 104 HOH HOH B . K 5 HOH 40 304 107 HOH HOH B . K 5 HOH 41 305 108 HOH HOH B . K 5 HOH 42 306 110 HOH HOH B . K 5 HOH 43 307 115 HOH HOH B . K 5 HOH 44 308 116 HOH HOH B . K 5 HOH 45 309 120 HOH HOH B . K 5 HOH 46 310 121 HOH HOH B . K 5 HOH 47 311 123 HOH HOH B . K 5 HOH 48 312 124 HOH HOH B . K 5 HOH 49 313 131 HOH HOH B . K 5 HOH 50 315 133 HOH HOH B . K 5 HOH 51 316 141 HOH HOH B . K 5 HOH 52 317 142 HOH HOH B . K 5 HOH 53 318 143 HOH HOH B . K 5 HOH 54 319 144 HOH HOH B . K 5 HOH 55 320 145 HOH HOH B . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 103 A ASN 184 ? ASN 'GLYCOSYLATION SITE' 2 B ASN 103 B ASN 184 ? ASN 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_defined_assembly ? monomeric 1 2 author_defined_assembly ? monomeric 1 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,C,D,E,F,J 2 1 B,G,H,I,K # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2010-07-28 2 'Structure model' 1 1 2011-07-13 3 'Structure model' 1 2 2017-11-08 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' Advisory 2 2 'Structure model' 'Version format compliance' 3 3 'Structure model' 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 3 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # _pdbx_audit_revision_item.ordinal 1 _pdbx_audit_revision_item.revision_ordinal 3 _pdbx_audit_revision_item.data_content_type 'Structure model' _pdbx_audit_revision_item.item '_software.name' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 'X-RAY DIFFRACTION' 1 ? refined 25.8861 -0.2447 13.8177 -0.2254 -0.2546 -0.0914 -0.0022 -0.0412 0.0424 2.7608 3.0247 4.9124 1.2406 0.2850 0.0432 0.1038 -0.1793 -0.0361 0.0586 -0.2336 0.0515 -0.1204 0.1480 0.1299 'X-RAY DIFFRACTION' 2 ? refined 10.9478 -7.8196 40.0964 -0.0725 0.0030 -0.0784 -0.1857 0.0081 -0.0083 5.7740 3.4622 6.0680 1.5389 1.2641 0.7916 0.0785 -0.6569 0.2714 0.2340 -0.2759 0.1607 -0.1429 -0.3377 0.1973 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 'X-RAY DIFFRACTION' 1 1 A 84 ? ? A 288 ? ? ? ? 'X-RAY DIFFRACTION' 2 2 B 84 ? ? B 288 ? ? ? ? # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal MAR345 'data collection' . ? 1 PHASER phasing . ? 2 REFMAC refinement 5.2.0019 ? 3 HKL-2000 'data reduction' . ? 4 SCALEPACK 'data scaling' . ? 5 # _pdbx_validate_close_contact.id 1 _pdbx_validate_close_contact.PDB_model_num 1 _pdbx_validate_close_contact.auth_atom_id_1 OE2 _pdbx_validate_close_contact.auth_asym_id_1 B _pdbx_validate_close_contact.auth_comp_id_1 GLU _pdbx_validate_close_contact.auth_seq_id_1 225 _pdbx_validate_close_contact.PDB_ins_code_1 ? _pdbx_validate_close_contact.label_alt_id_1 A _pdbx_validate_close_contact.auth_atom_id_2 O _pdbx_validate_close_contact.auth_asym_id_2 B _pdbx_validate_close_contact.auth_comp_id_2 HOH _pdbx_validate_close_contact.auth_seq_id_2 23 _pdbx_validate_close_contact.PDB_ins_code_2 ? _pdbx_validate_close_contact.label_alt_id_2 ? _pdbx_validate_close_contact.dist 2.12 # loop_ _pdbx_validate_symm_contact.id _pdbx_validate_symm_contact.PDB_model_num _pdbx_validate_symm_contact.auth_atom_id_1 _pdbx_validate_symm_contact.auth_asym_id_1 _pdbx_validate_symm_contact.auth_comp_id_1 _pdbx_validate_symm_contact.auth_seq_id_1 _pdbx_validate_symm_contact.PDB_ins_code_1 _pdbx_validate_symm_contact.label_alt_id_1 _pdbx_validate_symm_contact.site_symmetry_1 _pdbx_validate_symm_contact.auth_atom_id_2 _pdbx_validate_symm_contact.auth_asym_id_2 _pdbx_validate_symm_contact.auth_comp_id_2 _pdbx_validate_symm_contact.auth_seq_id_2 _pdbx_validate_symm_contact.PDB_ins_code_2 _pdbx_validate_symm_contact.label_alt_id_2 _pdbx_validate_symm_contact.site_symmetry_2 _pdbx_validate_symm_contact.dist 1 1 CG1 B VAL 194 ? ? 1_555 O A HOH 20 ? ? 3_445 1.81 2 1 CG1 A VAL 194 ? ? 1_555 O B HOH 9 ? ? 3_555 1.93 # _pdbx_validate_rmsd_angle.id 1 _pdbx_validate_rmsd_angle.PDB_model_num 1 _pdbx_validate_rmsd_angle.auth_atom_id_1 N _pdbx_validate_rmsd_angle.auth_asym_id_1 A _pdbx_validate_rmsd_angle.auth_comp_id_1 ASN _pdbx_validate_rmsd_angle.auth_seq_id_1 103 _pdbx_validate_rmsd_angle.PDB_ins_code_1 ? _pdbx_validate_rmsd_angle.label_alt_id_1 ? _pdbx_validate_rmsd_angle.auth_atom_id_2 CA _pdbx_validate_rmsd_angle.auth_asym_id_2 A _pdbx_validate_rmsd_angle.auth_comp_id_2 ASN _pdbx_validate_rmsd_angle.auth_seq_id_2 103 _pdbx_validate_rmsd_angle.PDB_ins_code_2 ? _pdbx_validate_rmsd_angle.label_alt_id_2 ? _pdbx_validate_rmsd_angle.auth_atom_id_3 CB _pdbx_validate_rmsd_angle.auth_asym_id_3 A _pdbx_validate_rmsd_angle.auth_comp_id_3 ASN _pdbx_validate_rmsd_angle.auth_seq_id_3 103 _pdbx_validate_rmsd_angle.PDB_ins_code_3 ? _pdbx_validate_rmsd_angle.label_alt_id_3 ? _pdbx_validate_rmsd_angle.angle_value 97.45 _pdbx_validate_rmsd_angle.angle_target_value 110.60 _pdbx_validate_rmsd_angle.angle_deviation -13.15 _pdbx_validate_rmsd_angle.angle_standard_deviation 1.80 _pdbx_validate_rmsd_angle.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 102 ? ? -51.77 -1.77 2 1 ARG A 105 ? ? -54.68 104.90 3 1 THR A 156 ? ? 58.66 -133.83 4 1 ASN A 169 ? ? -97.69 58.99 5 1 LEU A 228 ? ? -117.67 77.53 6 1 ALA B 124 ? ? -177.61 147.81 7 1 THR B 156 ? ? -93.16 -75.83 8 1 ASN B 169 ? ? -100.05 47.31 9 1 LEU B 208 ? ? -73.37 -72.10 10 1 LEU B 228 ? ? -94.47 54.50 11 1 ARG B 232 ? ? -87.36 38.15 12 1 ASN B 264 ? ? 39.89 51.71 # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 1 A LEU 208 ? CG ? A LEU 127 CG 2 1 Y 1 A LEU 208 ? CD1 ? A LEU 127 CD1 3 1 Y 1 A LEU 208 ? CD2 ? A LEU 127 CD2 4 1 Y 1 B TYR 198 ? CG ? B TYR 117 CG 5 1 Y 1 B TYR 198 ? CD1 ? B TYR 117 CD1 6 1 Y 1 B TYR 198 ? CD2 ? B TYR 117 CD2 7 1 Y 1 B TYR 198 ? CE1 ? B TYR 117 CE1 8 1 Y 1 B TYR 198 ? CE2 ? B TYR 117 CE2 9 1 Y 1 B TYR 198 ? CZ ? B TYR 117 CZ 10 1 Y 1 B TYR 198 ? OH ? B TYR 117 OH 11 1 Y 1 B GLU 206 ? CG ? B GLU 125 CG 12 1 Y 1 B GLU 206 ? CD ? B GLU 125 CD 13 1 Y 1 B GLU 206 ? OE1 ? B GLU 125 OE1 14 1 Y 1 B GLU 206 ? OE2 ? B GLU 125 OE2 15 1 Y 1 B ARG 207 ? CG ? B ARG 126 CG 16 1 Y 1 B ARG 207 ? CD ? B ARG 126 CD 17 1 Y 1 B ARG 207 ? NE ? B ARG 126 NE 18 1 Y 1 B ARG 207 ? CZ ? B ARG 126 CZ 19 1 Y 1 B ARG 207 ? NH1 ? B ARG 126 NH1 20 1 Y 1 B ARG 207 ? NH2 ? B ARG 126 NH2 21 1 Y 1 B LEU 208 ? CG ? B LEU 127 CG 22 1 Y 1 B LEU 208 ? CD1 ? B LEU 127 CD1 23 1 Y 1 B LEU 208 ? CD2 ? B LEU 127 CD2 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A GLY 82 ? A GLY 1 2 1 Y 1 A PRO 83 ? A PRO 2 3 1 Y 1 A TYR 198 ? A TYR 117 4 1 Y 1 A PRO 199 ? A PRO 118 5 1 Y 1 A ALA 200 ? A ALA 119 6 1 Y 1 A GLY 201 ? A GLY 120 7 1 Y 1 A ASN 202 ? A ASN 121 8 1 Y 1 A ASN 203 ? A ASN 122 9 1 Y 1 A ASP 204 ? A ASP 123 10 1 Y 1 A ASN 205 ? A ASN 124 11 1 Y 1 A GLU 206 ? A GLU 125 12 1 Y 1 A ARG 207 ? A ARG 126 13 1 Y 1 B GLY 82 ? B GLY 1 14 1 Y 1 B PRO 83 ? B PRO 2 15 1 Y 1 B PRO 199 ? B PRO 118 16 1 Y 1 B ALA 200 ? B ALA 119 17 1 Y 1 B GLY 201 ? B GLY 120 18 1 Y 1 B ASN 202 ? B ASN 121 19 1 Y 1 B ASN 203 ? B ASN 122 20 1 Y 1 B ASP 204 ? B ASP 123 21 1 Y 1 B ASN 205 ? B ASN 124 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 BETA-D-MANNOSE BMA 4 'PHOSPHATE ION' PO4 5 water HOH #