data_3H9Y # _entry.id 3H9Y # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.294 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3H9Y RCSB RCSB052877 WWPDB D_1000052877 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 1FP5 ;The 'wild-type carbohydrate' form of the same protein (has wild-type N371 and N383). ; unspecified PDB 1F6A ;The 'wild-type carbohydrate' form of the same protein in complex with the alpha chain of the IgE-FcRI. ; unspecified PDB 1O0V 'The structure of the IgE-Fc domains 2-4.' unspecified PDB 3H9Z 'Crystal structure of the IgE-Fc3-4 domains, crystal form 2' unspecified PDB 3HA0 'Crystal structure of the IgE-Fc3-4 domains, crystal form 3' unspecified # _pdbx_database_status.entry_id 3H9Y _pdbx_database_status.status_code REL _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.recvd_initial_deposition_date 2009-04-30 _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 ? # _audit_author.name 'Wurzburg, B.A.' _audit_author.pdbx_ordinal 1 # _citation.id primary _citation.title 'Conformational flexibility in immunoglobulin E-Fc 3-4 revealed in multiple crystal forms.' _citation.journal_abbrev J.Mol.Biol. _citation.journal_volume 393 _citation.page_first 176 _citation.page_last 190 _citation.year 2009 _citation.journal_id_ASTM JMOBAK _citation.country UK _citation.journal_id_ISSN 0022-2836 _citation.journal_id_CSD 0070 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 19682998 _citation.pdbx_database_id_DOI 10.1016/j.jmb.2009.08.012 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Wurzburg, B.A.' 1 primary 'Jardetzky, T.S.' 2 # _cell.entry_id 3H9Y _cell.length_a 153.676 _cell.length_b 104.994 _cell.length_c 49.222 _cell.angle_alpha 90.00 _cell.angle_beta 101.61 _cell.angle_gamma 90.00 _cell.Z_PDB 12 _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 3H9Y _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 'Ig epsilon chain C region' 24920.146 3 ? 'N252Q, N264Q' 'UNP residues 209-428' ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 6 ? ? ? ? 3 non-polymer man BETA-D-MANNOSE 180.156 3 ? ? ? ? 4 non-polymer man ALPHA-D-MANNOSE 180.156 7 ? ? ? ? 5 non-polymer syn 'AMMONIUM ION' 18.038 1 ? ? ? ? 6 water nat water 18.015 247 ? ? ? ? # _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 ;ADPCADSNPRGVSAYLSRPSPFDLFIRKSPTITCLVVDLAPSKGTVQLTWSRASGKPVQHSTRKEEKQRNGTLTVTSTLP VGTRDWIEGETYQCRVTHPHLPRALMRSTTKTSGPRAAPEVYAFATPEWPGSRDKRTLACLIQNFMPEDISVQWLHNEVQ LPDARHSTTQPRKTKGSGFFVFSRLEVTRAEWEQKDEFICRAVHEAASPSQTVQRAVSVNPGK ; _entity_poly.pdbx_seq_one_letter_code_can ;ADPCADSNPRGVSAYLSRPSPFDLFIRKSPTITCLVVDLAPSKGTVQLTWSRASGKPVQHSTRKEEKQRNGTLTVTSTLP VGTRDWIEGETYQCRVTHPHLPRALMRSTTKTSGPRAAPEVYAFATPEWPGSRDKRTLACLIQNFMPEDISVQWLHNEVQ LPDARHSTTQPRKTKGSGFFVFSRLEVTRAEWEQKDEFICRAVHEAASPSQTVQRAVSVNPGK ; _entity_poly.pdbx_strand_id A,B,E _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 ALA n 1 2 ASP n 1 3 PRO n 1 4 CYS n 1 5 ALA n 1 6 ASP n 1 7 SER n 1 8 ASN n 1 9 PRO n 1 10 ARG n 1 11 GLY n 1 12 VAL n 1 13 SER n 1 14 ALA n 1 15 TYR n 1 16 LEU n 1 17 SER n 1 18 ARG n 1 19 PRO n 1 20 SER n 1 21 PRO n 1 22 PHE n 1 23 ASP n 1 24 LEU n 1 25 PHE n 1 26 ILE n 1 27 ARG n 1 28 LYS n 1 29 SER n 1 30 PRO n 1 31 THR n 1 32 ILE n 1 33 THR n 1 34 CYS n 1 35 LEU n 1 36 VAL n 1 37 VAL n 1 38 ASP n 1 39 LEU n 1 40 ALA n 1 41 PRO n 1 42 SER n 1 43 LYS n 1 44 GLY n 1 45 THR n 1 46 VAL n 1 47 GLN n 1 48 LEU n 1 49 THR n 1 50 TRP n 1 51 SER n 1 52 ARG n 1 53 ALA n 1 54 SER n 1 55 GLY n 1 56 LYS n 1 57 PRO n 1 58 VAL n 1 59 GLN n 1 60 HIS n 1 61 SER n 1 62 THR n 1 63 ARG n 1 64 LYS n 1 65 GLU n 1 66 GLU n 1 67 LYS n 1 68 GLN n 1 69 ARG n 1 70 ASN n 1 71 GLY n 1 72 THR n 1 73 LEU n 1 74 THR n 1 75 VAL n 1 76 THR n 1 77 SER n 1 78 THR n 1 79 LEU n 1 80 PRO n 1 81 VAL n 1 82 GLY n 1 83 THR n 1 84 ARG n 1 85 ASP n 1 86 TRP n 1 87 ILE n 1 88 GLU n 1 89 GLY n 1 90 GLU n 1 91 THR n 1 92 TYR n 1 93 GLN n 1 94 CYS n 1 95 ARG n 1 96 VAL n 1 97 THR n 1 98 HIS n 1 99 PRO n 1 100 HIS n 1 101 LEU n 1 102 PRO n 1 103 ARG n 1 104 ALA n 1 105 LEU n 1 106 MET n 1 107 ARG n 1 108 SER n 1 109 THR n 1 110 THR n 1 111 LYS n 1 112 THR n 1 113 SER n 1 114 GLY n 1 115 PRO n 1 116 ARG n 1 117 ALA n 1 118 ALA n 1 119 PRO n 1 120 GLU n 1 121 VAL n 1 122 TYR n 1 123 ALA n 1 124 PHE n 1 125 ALA n 1 126 THR n 1 127 PRO n 1 128 GLU n 1 129 TRP n 1 130 PRO n 1 131 GLY n 1 132 SER n 1 133 ARG n 1 134 ASP n 1 135 LYS n 1 136 ARG n 1 137 THR n 1 138 LEU n 1 139 ALA n 1 140 CYS n 1 141 LEU n 1 142 ILE n 1 143 GLN n 1 144 ASN n 1 145 PHE n 1 146 MET n 1 147 PRO n 1 148 GLU n 1 149 ASP n 1 150 ILE n 1 151 SER n 1 152 VAL n 1 153 GLN n 1 154 TRP n 1 155 LEU n 1 156 HIS n 1 157 ASN n 1 158 GLU n 1 159 VAL n 1 160 GLN n 1 161 LEU n 1 162 PRO n 1 163 ASP n 1 164 ALA n 1 165 ARG n 1 166 HIS n 1 167 SER n 1 168 THR n 1 169 THR n 1 170 GLN n 1 171 PRO n 1 172 ARG n 1 173 LYS n 1 174 THR n 1 175 LYS n 1 176 GLY n 1 177 SER n 1 178 GLY n 1 179 PHE n 1 180 PHE n 1 181 VAL n 1 182 PHE n 1 183 SER n 1 184 ARG n 1 185 LEU n 1 186 GLU n 1 187 VAL n 1 188 THR n 1 189 ARG n 1 190 ALA n 1 191 GLU n 1 192 TRP n 1 193 GLU n 1 194 GLN n 1 195 LYS n 1 196 ASP n 1 197 GLU n 1 198 PHE n 1 199 ILE n 1 200 CYS n 1 201 ARG n 1 202 ALA n 1 203 VAL n 1 204 HIS n 1 205 GLU n 1 206 ALA n 1 207 ALA n 1 208 SER n 1 209 PRO n 1 210 SER n 1 211 GLN n 1 212 THR n 1 213 VAL n 1 214 GLN n 1 215 ARG n 1 216 ALA n 1 217 VAL n 1 218 SER n 1 219 VAL n 1 220 ASN n 1 221 PRO n 1 222 GLY n 1 223 LYS n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name human _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene IGHE _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Trichoplusia ni' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 7111 _entity_src_gen.host_org_genus ? _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 Hi5 _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type plasmid _entity_src_gen.pdbx_host_org_vector 'recombinant baculovirus' _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pAcGP67A _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code IGHE_HUMAN _struct_ref.pdbx_db_accession P01854 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;CADSNPRGVSAYLSRPSPFDLFIRKSPTITCLVVDLAPSKGTVNLTWSRASGKPVNHSTRKEEKQRNGTLTVTSTLPVGT RDWIEGETYQCRVTHPHLPRALMRSTTKTSGPRAAPEVYAFATPEWPGSRDKRTLACLIQNFMPEDISVQWLHNEVQLPD ARHSTTQPRKTKGSGFFVFSRLEVTRAEWEQKDEFICRAVHEAASPSQTVQRAVSVNPGK ; _struct_ref.pdbx_align_begin 209 _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 3H9Y A 4 ? 223 ? P01854 209 ? 428 ? 328 547 2 1 3H9Y B 4 ? 223 ? P01854 209 ? 428 ? 328 547 3 1 3H9Y E 4 ? 223 ? P01854 209 ? 428 ? 328 547 # 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 3H9Y ALA A 1 ? UNP P01854 ? ? 'EXPRESSION TAG' 325 1 1 3H9Y ASP A 2 ? UNP P01854 ? ? 'EXPRESSION TAG' 326 2 1 3H9Y PRO A 3 ? UNP P01854 ? ? 'EXPRESSION TAG' 327 3 1 3H9Y GLN A 47 ? UNP P01854 ASN 252 ENGINEERED 371 4 1 3H9Y GLN A 59 ? UNP P01854 ASN 264 ENGINEERED 383 5 2 3H9Y ALA B 1 ? UNP P01854 ? ? 'EXPRESSION TAG' 325 6 2 3H9Y ASP B 2 ? UNP P01854 ? ? 'EXPRESSION TAG' 326 7 2 3H9Y PRO B 3 ? UNP P01854 ? ? 'EXPRESSION TAG' 327 8 2 3H9Y GLN B 47 ? UNP P01854 ASN 252 ENGINEERED 371 9 2 3H9Y GLN B 59 ? UNP P01854 ASN 264 ENGINEERED 383 10 3 3H9Y ALA E 1 ? UNP P01854 ? ? 'EXPRESSION TAG' 325 11 3 3H9Y ASP E 2 ? UNP P01854 ? ? 'EXPRESSION TAG' 326 12 3 3H9Y PRO E 3 ? UNP P01854 ? ? 'EXPRESSION TAG' 327 13 3 3H9Y GLN E 47 ? UNP P01854 ASN 252 ENGINEERED 371 14 3 3H9Y GLN E 59 ? UNP P01854 ASN 264 ENGINEERED 383 15 # 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 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 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 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 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 NH4 non-polymer . 'AMMONIUM ION' ? 'H4 N 1' 18.038 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 3H9Y _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.60 _exptl_crystal.density_percent_sol 52.72 _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 5.3 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details ;1 microliter of protein at 10 mg/mL in 20 mM sodium chloride was added to 1 microliter well solution (100 mM ammonium acetate, 100 mM sodium acetate pH 4.6, 30% (w/v) PEG 4000) and mixed by pipetting., VAPOR DIFFUSION, HANGING DROP, temperature 293K ; # _diffrn.id 1 _diffrn.ambient_temp 113.0 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'MAR CCD 130 mm' _diffrn_detector.pdbx_collection_date 1998-08-30 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator '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 1.00796 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'APS BEAMLINE 5ID-B' _diffrn_source.pdbx_synchrotron_site APS _diffrn_source.pdbx_synchrotron_beamline 5ID-B _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.00796 # _reflns.entry_id 3H9Y _reflns.observed_criterion_sigma_I 0 _reflns.observed_criterion_sigma_F 0 _reflns.d_resolution_low 30.000 _reflns.d_resolution_high 2.230 _reflns.number_obs 36675 _reflns.number_all 36675 _reflns.percent_possible_obs 98.800 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.061 _reflns.pdbx_netI_over_sigmaI 20.943 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 3.8 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.23 _reflns_shell.d_res_low 2.38 _reflns_shell.percent_possible_all 89.80 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value 0.513 _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy 3.45 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 3H9Y _refine.ls_number_reflns_obs 36671 _refine.ls_number_reflns_all 36671 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.000 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 29.64 _refine.ls_d_res_high 2.23 _refine.ls_percent_reflns_obs 97.91 _refine.ls_R_factor_obs 0.23263 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.23101 _refine.ls_R_factor_R_free 0.26212 _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 1866 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min 1.00 _refine.occupancy_max 1.00 _refine.correlation_coeff_Fo_to_Fc 0.940 _refine.correlation_coeff_Fo_to_Fc_free 0.924 _refine.B_iso_mean 37.900 _refine.aniso_B[1][1] -0.18 _refine.aniso_B[2][2] 0.86 _refine.aniso_B[3][3] -0.71 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] -0.08 _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 'Partially-refined monomer (chain C) from the IgE-Fc3-4 carbohydrate mutant P21 crystal form.' _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 0.338 _refine.pdbx_overall_ESU_R_Free 0.236 _refine.overall_SU_ML 0.192 _refine.pdbx_overall_phase_error ? _refine.overall_SU_B 15.167 _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_Cruickshank_DPI ? _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_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 4968 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 195 _refine_hist.number_atoms_solvent 247 _refine_hist.number_atoms_total 5410 _refine_hist.d_res_high 2.23 _refine_hist.d_res_low 29.64 # 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 0.009 0.022 ? 5313 'X-RAY DIFFRACTION' ? r_bond_other_d 0.001 0.020 ? 3713 'X-RAY DIFFRACTION' ? r_angle_refined_deg 1.232 1.990 ? 7259 'X-RAY DIFFRACTION' ? r_angle_other_deg 0.752 3.003 ? 8929 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 5.570 5.000 ? 625 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg 26.499 22.267 ? 225 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg 12.737 15.000 ? 847 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg 13.432 15.000 ? 54 'X-RAY DIFFRACTION' ? r_chiral_restr 0.067 0.200 ? 852 'X-RAY DIFFRACTION' ? r_gen_planes_refined 0.006 0.021 ? 5717 'X-RAY DIFFRACTION' ? r_gen_planes_other 0.001 0.020 ? 1060 'X-RAY DIFFRACTION' ? r_nbd_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcbond_it 1.153 2.000 ? 3159 'X-RAY DIFFRACTION' ? r_mcbond_other 0.199 2.000 ? 1234 'X-RAY DIFFRACTION' ? r_mcangle_it 1.928 3.000 ? 5168 'X-RAY DIFFRACTION' ? r_scbond_it 1.049 2.000 ? 2154 'X-RAY DIFFRACTION' ? r_scangle_it 1.621 3.000 ? 2091 'X-RAY DIFFRACTION' ? r_rigid_bond_restr ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_free ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_bonded ? ? ? ? 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.pdbx_total_number_of_bins_used 10 _refine_ls_shell.d_res_high 2.23 _refine_ls_shell.d_res_low 2.35 _refine_ls_shell.number_reflns_R_work 4440 _refine_ls_shell.R_factor_R_work 0.360 _refine_ls_shell.percent_reflns_obs 86.48 _refine_ls_shell.R_factor_R_free 0.447 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 234 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.number_reflns_obs ? # _struct.entry_id 3H9Y _struct.title 'Crystal structure of the IgE-Fc3-4 domains' _struct.pdbx_descriptor 'Ig epsilon chain C region' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3H9Y _struct_keywords.text ;Immunoglobin, IgE, Fc, flexibility, hydrophobic pocket, Disulfide bond, Glycoprotein, Immunoglobulin C region, Immunoglobulin domain, IMMUNE SYSTEM ; _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' # 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 1 ? D N N 2 ? E N N 2 ? F N N 3 ? G N N 4 ? H N N 4 ? I N N 4 ? J N N 2 ? K N N 2 ? L N N 3 ? M N N 4 ? N N N 4 ? O N N 2 ? P N N 2 ? Q N N 3 ? R N N 4 ? S N N 4 ? T N N 5 ? U N N 6 ? V N N 6 ? W N N 6 ? # 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 SER A 20 ? ILE A 26 ? SER A 344 ILE A 350 1 ? 7 HELX_P HELX_P2 2 GLY A 82 ? GLY A 89 ? GLY A 406 GLY A 413 1 ? 8 HELX_P HELX_P3 3 PRO A 162 ? ALA A 164 ? PRO A 486 ALA A 488 5 ? 3 HELX_P HELX_P4 4 ARG A 189 ? LYS A 195 ? ARG A 513 LYS A 519 1 ? 7 HELX_P HELX_P5 5 SER B 20 ? ILE B 26 ? SER B 344 ILE B 350 1 ? 7 HELX_P HELX_P6 6 GLY B 82 ? GLU B 88 ? GLY B 406 GLU B 412 1 ? 7 HELX_P HELX_P7 7 PRO B 162 ? ALA B 164 ? PRO B 486 ALA B 488 5 ? 3 HELX_P HELX_P8 8 ARG B 189 ? LYS B 195 ? ARG B 513 LYS B 519 1 ? 7 HELX_P HELX_P9 9 SER C 20 ? ILE C 26 ? SER E 344 ILE E 350 1 ? 7 HELX_P HELX_P10 10 GLY C 82 ? GLU C 88 ? GLY E 406 GLU E 412 1 ? 7 HELX_P HELX_P11 11 PRO C 162 ? ALA C 164 ? PRO E 486 ALA E 488 5 ? 3 HELX_P HELX_P12 12 ARG C 189 ? LYS C 195 ? ARG E 513 LYS E 519 1 ? 7 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 34 SG ? ? ? 1_555 A CYS 94 SG ? ? A CYS 358 A CYS 418 1_555 ? ? ? ? ? ? ? 2.026 ? disulf2 disulf ? ? A CYS 140 SG ? ? ? 1_555 A CYS 200 SG ? ? A CYS 464 A CYS 524 1_555 ? ? ? ? ? ? ? 2.035 ? disulf3 disulf ? ? B CYS 34 SG ? ? ? 1_555 B CYS 94 SG ? ? B CYS 358 B CYS 418 1_555 ? ? ? ? ? ? ? 2.041 ? disulf4 disulf ? ? B CYS 140 SG ? ? ? 1_555 B CYS 200 SG ? ? B CYS 464 B CYS 524 1_555 ? ? ? ? ? ? ? 2.062 ? disulf5 disulf ? ? C CYS 34 SG ? ? ? 1_555 C CYS 94 SG ? ? E CYS 358 E CYS 418 1_555 ? ? ? ? ? ? ? 2.034 ? disulf6 disulf ? ? C CYS 140 SG ? ? ? 1_555 C CYS 200 SG ? ? E CYS 464 E CYS 524 1_555 ? ? ? ? ? ? ? 2.051 ? covale1 covale ? ? A ASN 70 ND2 ? ? ? 1_555 D NAG . C1 ? ? A ASN 394 A NAG 1 1_555 ? ? ? ? ? ? ? 1.443 ? covale2 covale ? ? B ASN 70 ND2 ? ? ? 1_555 J NAG . C1 ? ? B ASN 394 B NAG 1 1_555 ? ? ? ? ? ? ? 1.445 ? covale3 covale ? ? C ASN 70 ND2 ? ? ? 1_555 O NAG . C1 ? ? E ASN 394 E NAG 1 1_555 ? ? ? ? ? ? ? 1.443 ? covale4 covale ? ? D NAG . O4 ? ? ? 1_555 E NAG . C1 ? ? A NAG 1 A NAG 2 1_555 ? ? ? ? ? ? ? 1.444 ? covale5 covale ? ? E NAG . O4 ? ? ? 1_555 F BMA . C1 ? ? A NAG 2 A BMA 3 1_555 ? ? ? ? ? ? ? 1.441 ? covale6 covale ? ? F BMA . O3 ? ? ? 1_555 I MAN . C1 ? ? A BMA 3 A MAN 6 1_555 ? ? ? ? ? ? ? 1.442 ? covale7 covale ? ? F BMA . O6 ? ? ? 1_555 G MAN . C1 ? ? A BMA 3 A MAN 4 1_555 ? ? ? ? ? ? ? 1.446 ? covale8 covale ? ? G MAN . O6 ? ? ? 1_555 H MAN . C1 ? ? A MAN 4 A MAN 5 1_555 ? ? ? ? ? ? ? 1.443 ? covale9 covale ? ? J NAG . O4 ? ? ? 1_555 K NAG . C1 ? ? B NAG 1 B NAG 2 1_555 ? ? ? ? ? ? ? 1.437 ? covale10 covale ? ? K NAG . O4 ? ? ? 1_555 L BMA . C1 ? ? B NAG 2 B BMA 3 1_555 ? ? ? ? ? ? ? 1.441 ? covale11 covale ? ? L BMA . O3 ? ? ? 1_555 N MAN . C1 ? ? B BMA 3 B MAN 5 1_555 ? ? ? ? ? ? ? 1.436 ? covale12 covale ? ? L BMA . O6 ? ? ? 1_555 M MAN . C1 ? ? B BMA 3 B MAN 4 1_555 ? ? ? ? ? ? ? 1.437 ? covale13 covale ? ? O NAG . O4 ? ? ? 1_555 P NAG . C1 ? ? E NAG 1 E NAG 2 1_555 ? ? ? ? ? ? ? 1.443 ? covale14 covale ? ? P NAG . O4 ? ? ? 1_555 Q BMA . C1 ? ? E NAG 2 E BMA 3 1_555 ? ? ? ? ? ? ? 1.444 ? covale15 covale ? ? Q BMA . O3 ? ? ? 1_555 S MAN . C1 ? ? E BMA 3 E MAN 5 1_555 ? ? ? ? ? ? ? 1.440 ? covale16 covale ? ? Q BMA . O6 ? ? ? 1_555 R MAN . C1 ? ? E BMA 3 E MAN 4 1_555 ? ? ? ? ? ? ? 1.444 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 MET 146 A . ? MET 470 A PRO 147 A ? PRO 471 A 1 -1.62 2 SER 208 A . ? SER 532 A PRO 209 A ? PRO 533 A 1 -10.11 3 MET 146 B . ? MET 470 B PRO 147 B ? PRO 471 B 1 -3.63 4 SER 208 B . ? SER 532 B PRO 209 B ? PRO 533 B 1 1.29 5 MET 146 C . ? MET 470 E PRO 147 C ? PRO 471 E 1 -3.67 6 SER 208 C . ? SER 532 E PRO 209 C ? PRO 533 E 1 2.84 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 4 ? B ? 3 ? C ? 4 ? D ? 4 ? E ? 4 ? F ? 4 ? G ? 3 ? H ? 4 ? I ? 4 ? J ? 4 ? K ? 4 ? L ? 3 ? M ? 4 ? N ? 4 ? O ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel J 3 4 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel N 1 2 ? anti-parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel O 1 2 ? anti-parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 SER A 13 ? LEU A 16 ? SER A 337 LEU A 340 A 2 THR A 31 ? VAL A 37 ? THR A 355 VAL A 361 A 3 THR A 72 ? PRO A 80 ? THR A 396 PRO A 404 A 4 THR A 62 ? GLN A 68 ? THR A 386 GLN A 392 B 1 GLN A 47 ? ARG A 52 ? GLN A 371 ARG A 376 B 2 TYR A 92 ? THR A 97 ? TYR A 416 THR A 421 B 3 MET A 106 ? THR A 109 ? MET A 430 THR A 433 C 1 GLU A 120 ? ALA A 125 ? GLU A 444 ALA A 449 C 2 LYS A 135 ? PHE A 145 ? LYS A 459 PHE A 469 C 3 PHE A 179 ? THR A 188 ? PHE A 503 THR A 512 C 4 HIS A 166 ? THR A 168 ? HIS A 490 THR A 492 D 1 GLU A 120 ? ALA A 125 ? GLU A 444 ALA A 449 D 2 LYS A 135 ? PHE A 145 ? LYS A 459 PHE A 469 D 3 PHE A 179 ? THR A 188 ? PHE A 503 THR A 512 D 4 ARG A 172 ? LYS A 173 ? ARG A 496 LYS A 497 E 1 VAL A 159 ? GLN A 160 ? VAL A 483 GLN A 484 E 2 SER A 151 ? HIS A 156 ? SER A 475 HIS A 480 E 3 PHE A 198 ? VAL A 203 ? PHE A 522 VAL A 527 E 4 THR A 212 ? VAL A 217 ? THR A 536 VAL A 541 F 1 VAL B 12 ? SER B 17 ? VAL B 336 SER B 341 F 2 THR B 31 ? ASP B 38 ? THR B 355 ASP B 362 F 3 LEU B 73 ? PRO B 80 ? LEU B 397 PRO B 404 F 4 LYS B 64 ? LYS B 67 ? LYS B 388 LYS B 391 G 1 GLN B 47 ? ARG B 52 ? GLN B 371 ARG B 376 G 2 TYR B 92 ? THR B 97 ? TYR B 416 THR B 421 G 3 LEU B 105 ? THR B 109 ? LEU B 429 THR B 433 H 1 GLU B 120 ? ALA B 125 ? GLU B 444 ALA B 449 H 2 LYS B 135 ? PHE B 145 ? LYS B 459 PHE B 469 H 3 PHE B 179 ? THR B 188 ? PHE B 503 THR B 512 H 4 HIS B 166 ? THR B 168 ? HIS B 490 THR B 492 I 1 GLU B 120 ? ALA B 125 ? GLU B 444 ALA B 449 I 2 LYS B 135 ? PHE B 145 ? LYS B 459 PHE B 469 I 3 PHE B 179 ? THR B 188 ? PHE B 503 THR B 512 I 4 ARG B 172 ? LYS B 173 ? ARG B 496 LYS B 497 J 1 VAL B 159 ? GLN B 160 ? VAL B 483 GLN B 484 J 2 SER B 151 ? HIS B 156 ? SER B 475 HIS B 480 J 3 PHE B 198 ? VAL B 203 ? PHE B 522 VAL B 527 J 4 THR B 212 ? VAL B 217 ? THR B 536 VAL B 541 K 1 SER C 13 ? LEU C 16 ? SER E 337 LEU E 340 K 2 THR C 31 ? ASP C 38 ? THR E 355 ASP E 362 K 3 LEU C 73 ? PRO C 80 ? LEU E 397 PRO E 404 K 4 THR C 62 ? LYS C 67 ? THR E 386 LYS E 391 L 1 GLN C 47 ? ARG C 52 ? GLN E 371 ARG E 376 L 2 THR C 91 ? THR C 97 ? THR E 415 THR E 421 L 3 LEU C 105 ? THR C 110 ? LEU E 429 THR E 434 M 1 GLU C 120 ? ALA C 125 ? GLU E 444 ALA E 449 M 2 LYS C 135 ? PHE C 145 ? LYS E 459 PHE E 469 M 3 PHE C 179 ? THR C 188 ? PHE E 503 THR E 512 M 4 HIS C 166 ? THR C 168 ? HIS E 490 THR E 492 N 1 GLU C 120 ? ALA C 125 ? GLU E 444 ALA E 449 N 2 LYS C 135 ? PHE C 145 ? LYS E 459 PHE E 469 N 3 PHE C 179 ? THR C 188 ? PHE E 503 THR E 512 N 4 ARG C 172 ? LYS C 173 ? ARG E 496 LYS E 497 O 1 VAL C 159 ? GLN C 160 ? VAL E 483 GLN E 484 O 2 SER C 151 ? HIS C 156 ? SER E 475 HIS E 480 O 3 PHE C 198 ? VAL C 203 ? PHE E 522 VAL E 527 O 4 THR C 212 ? VAL C 217 ? THR E 536 VAL E 541 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N TYR A 15 ? N TYR A 339 O LEU A 35 ? O LEU A 359 A 2 3 N CYS A 34 ? N CYS A 358 O SER A 77 ? O SER A 401 A 3 4 O THR A 72 ? O THR A 396 N GLN A 68 ? N GLN A 392 B 1 2 N SER A 51 ? N SER A 375 O GLN A 93 ? O GLN A 417 B 2 3 N CYS A 94 ? N CYS A 418 O ARG A 107 ? O ARG A 431 C 1 2 N TYR A 122 ? N TYR A 446 O LEU A 141 ? O LEU A 465 C 2 3 N LEU A 138 ? N LEU A 462 O LEU A 185 ? O LEU A 509 C 3 4 O ARG A 184 ? O ARG A 508 N SER A 167 ? N SER A 491 D 1 2 N TYR A 122 ? N TYR A 446 O LEU A 141 ? O LEU A 465 D 2 3 N LEU A 138 ? N LEU A 462 O LEU A 185 ? O LEU A 509 D 3 4 O PHE A 180 ? O PHE A 504 N ARG A 172 ? N ARG A 496 E 1 2 O VAL A 159 ? O VAL A 483 N HIS A 156 ? N HIS A 480 E 2 3 N SER A 151 ? N SER A 475 O VAL A 203 ? O VAL A 527 E 3 4 N ALA A 202 ? N ALA A 526 O VAL A 213 ? O VAL A 537 F 1 2 N TYR B 15 ? N TYR B 339 O LEU B 35 ? O LEU B 359 F 2 3 N VAL B 36 ? N VAL B 360 O VAL B 75 ? O VAL B 399 F 3 4 O THR B 74 ? O THR B 398 N GLU B 66 ? N GLU B 390 G 1 2 N SER B 51 ? N SER B 375 O GLN B 93 ? O GLN B 417 G 2 3 N VAL B 96 ? N VAL B 420 O LEU B 105 ? O LEU B 429 H 1 2 N PHE B 124 ? N PHE B 448 O ALA B 139 ? O ALA B 463 H 2 3 N LEU B 138 ? N LEU B 462 O LEU B 185 ? O LEU B 509 H 3 4 O ARG B 184 ? O ARG B 508 N SER B 167 ? N SER B 491 I 1 2 N PHE B 124 ? N PHE B 448 O ALA B 139 ? O ALA B 463 I 2 3 N LEU B 138 ? N LEU B 462 O LEU B 185 ? O LEU B 509 I 3 4 O PHE B 180 ? O PHE B 504 N ARG B 172 ? N ARG B 496 J 1 2 O VAL B 159 ? O VAL B 483 N HIS B 156 ? N HIS B 480 J 2 3 N SER B 151 ? N SER B 475 O VAL B 203 ? O VAL B 527 J 3 4 N ALA B 202 ? N ALA B 526 O VAL B 213 ? O VAL B 537 K 1 2 N TYR C 15 ? N TYR E 339 O LEU C 35 ? O LEU E 359 K 2 3 N ILE C 32 ? N ILE E 356 O LEU C 79 ? O LEU E 403 K 3 4 O THR C 78 ? O THR E 402 N THR C 62 ? N THR E 386 L 1 2 N SER C 51 ? N SER E 375 O GLN C 93 ? O GLN E 417 L 2 3 N CYS C 94 ? N CYS E 418 O ARG C 107 ? O ARG E 431 M 1 2 N PHE C 124 ? N PHE E 448 O ALA C 139 ? O ALA E 463 M 2 3 N LEU C 138 ? N LEU E 462 O LEU C 185 ? O LEU E 509 M 3 4 O ARG C 184 ? O ARG E 508 N SER C 167 ? N SER E 491 N 1 2 N PHE C 124 ? N PHE E 448 O ALA C 139 ? O ALA E 463 N 2 3 N LEU C 138 ? N LEU E 462 O LEU C 185 ? O LEU E 509 N 3 4 O PHE C 180 ? O PHE E 504 N ARG C 172 ? N ARG E 496 O 1 2 O VAL C 159 ? O VAL E 483 N HIS C 156 ? N HIS E 480 O 2 3 N GLN C 153 ? N GLN E 477 O ARG C 201 ? O ARG E 525 O 3 4 N ALA C 202 ? N ALA E 526 O VAL C 213 ? O VAL E 537 # 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 ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 1' AC2 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG A 2' AC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE BMA A 3' AC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE MAN A 4' AC5 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE MAN A 5' AC6 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE MAN A 6' AC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG B 1' AC8 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG B 2' AC9 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE BMA B 3' BC1 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE MAN B 4' BC2 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE MAN B 5' BC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG E 1' BC4 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG E 2' BC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE BMA E 3' BC6 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE MAN E 4' BC7 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE MAN E 5' BC8 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NH4 E 548' # 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 4 NAG E . ? NAG A 2 . ? 1_555 ? 2 AC1 4 LEU A 39 ? LEU A 363 . ? 1_555 ? 3 AC1 4 GLN A 68 ? GLN A 392 . ? 1_555 ? 4 AC1 4 ASN A 70 ? ASN A 394 . ? 1_555 ? 5 AC2 5 NAG D . ? NAG A 1 . ? 1_555 ? 6 AC2 5 BMA F . ? BMA A 3 . ? 1_555 ? 7 AC2 5 TYR A 15 ? TYR A 339 . ? 1_555 ? 8 AC2 5 LEU A 35 ? LEU A 359 . ? 1_555 ? 9 AC2 5 THR A 74 ? THR A 398 . ? 1_555 ? 10 AC3 5 NAG E . ? NAG A 2 . ? 1_555 ? 11 AC3 5 MAN G . ? MAN A 4 . ? 1_555 ? 12 AC3 5 MAN I . ? MAN A 6 . ? 1_555 ? 13 AC3 5 HOH U . ? HOH A 275 . ? 1_555 ? 14 AC3 5 LEU A 35 ? LEU A 359 . ? 1_555 ? 15 AC4 3 BMA F . ? BMA A 3 . ? 1_555 ? 16 AC4 3 MAN H . ? MAN A 5 . ? 1_555 ? 17 AC4 3 HOH U . ? HOH A 249 . ? 1_555 ? 18 AC5 1 MAN G . ? MAN A 4 . ? 1_555 ? 19 AC6 1 BMA F . ? BMA A 3 . ? 1_555 ? 20 AC7 4 NAG K . ? NAG B 2 . ? 1_555 ? 21 AC7 4 GLN B 68 ? GLN B 392 . ? 1_555 ? 22 AC7 4 ASN B 70 ? ASN B 394 . ? 1_555 ? 23 AC7 4 THR B 72 ? THR B 396 . ? 1_555 ? 24 AC8 5 NAG J . ? NAG B 1 . ? 1_555 ? 25 AC8 5 BMA L . ? BMA B 3 . ? 1_555 ? 26 AC8 5 TYR B 15 ? TYR B 339 . ? 1_555 ? 27 AC8 5 LEU B 35 ? LEU B 359 . ? 1_555 ? 28 AC8 5 THR B 74 ? THR B 398 . ? 1_555 ? 29 AC9 3 NAG K . ? NAG B 2 . ? 1_555 ? 30 AC9 3 MAN M . ? MAN B 4 . ? 1_555 ? 31 AC9 3 MAN N . ? MAN B 5 . ? 1_555 ? 32 BC1 1 BMA L . ? BMA B 3 . ? 1_555 ? 33 BC2 1 BMA L . ? BMA B 3 . ? 1_555 ? 34 BC3 5 NAG P . ? NAG E 2 . ? 1_555 ? 35 BC3 5 VAL C 37 ? VAL E 361 . ? 1_555 ? 36 BC3 5 LEU C 39 ? LEU E 363 . ? 1_555 ? 37 BC3 5 ASN C 70 ? ASN E 394 . ? 1_555 ? 38 BC3 5 THR C 72 ? THR E 396 . ? 1_555 ? 39 BC4 6 NAG O . ? NAG E 1 . ? 1_555 ? 40 BC4 6 BMA Q . ? BMA E 3 . ? 1_555 ? 41 BC4 6 TYR C 15 ? TYR E 339 . ? 1_555 ? 42 BC4 6 LEU C 35 ? LEU E 359 . ? 1_555 ? 43 BC4 6 GLN C 68 ? GLN E 392 . ? 1_555 ? 44 BC4 6 THR C 74 ? THR E 398 . ? 1_555 ? 45 BC5 5 NAG P . ? NAG E 2 . ? 1_555 ? 46 BC5 5 MAN R . ? MAN E 4 . ? 1_555 ? 47 BC5 5 MAN S . ? MAN E 5 . ? 1_555 ? 48 BC5 5 HOH W . ? HOH E 200 . ? 1_555 ? 49 BC5 5 TYR C 15 ? TYR E 339 . ? 1_555 ? 50 BC6 2 BMA Q . ? BMA E 3 . ? 1_555 ? 51 BC6 2 GLN C 170 ? GLN E 494 . ? 1_555 ? 52 BC7 1 BMA Q . ? BMA E 3 . ? 1_555 ? 53 BC8 2 HOH W . ? HOH E 136 . ? 1_555 ? 54 BC8 2 ARG C 18 ? ARG E 342 . ? 1_555 ? # _atom_sites.entry_id 3H9Y _atom_sites.fract_transf_matrix[1][1] 0.006507 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.001337 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.009524 _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] 0.020740 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . VAL A 1 12 ? -0.518 49.238 69.245 1.00 55.25 ? 336 VAL A N 1 ATOM 2 C CA . VAL A 1 12 ? 0.356 49.573 68.078 1.00 55.28 ? 336 VAL A CA 1 ATOM 3 C C . VAL A 1 12 ? 1.810 49.827 68.487 1.00 54.77 ? 336 VAL A C 1 ATOM 4 O O . VAL A 1 12 ? 2.141 50.868 69.053 1.00 55.07 ? 336 VAL A O 1 ATOM 5 C CB . VAL A 1 12 ? -0.170 50.803 67.313 1.00 55.44 ? 336 VAL A CB 1 ATOM 6 C CG1 . VAL A 1 12 ? 0.736 51.107 66.121 1.00 55.23 ? 336 VAL A CG1 1 ATOM 7 C CG2 . VAL A 1 12 ? -1.619 50.575 66.871 1.00 55.45 ? 336 VAL A CG2 1 ATOM 8 N N . SER A 1 13 ? 2.680 48.868 68.189 1.00 54.31 ? 337 SER A N 1 ATOM 9 C CA . SER A 1 13 ? 4.098 48.983 68.527 1.00 53.74 ? 337 SER A CA 1 ATOM 10 C C . SER A 1 13 ? 4.979 49.045 67.275 1.00 52.71 ? 337 SER A C 1 ATOM 11 O O . SER A 1 13 ? 4.628 48.520 66.219 1.00 52.06 ? 337 SER A O 1 ATOM 12 C CB . SER A 1 13 ? 4.511 47.800 69.398 1.00 54.16 ? 337 SER A CB 1 ATOM 13 O OG . SER A 1 13 ? 4.079 46.586 68.807 1.00 54.61 ? 337 SER A OG 1 ATOM 14 N N . ALA A 1 14 ? 6.132 49.693 67.397 1.00 51.77 ? 338 ALA A N 1 ATOM 15 C CA . ALA A 1 14 ? 7.043 49.827 66.272 1.00 51.20 ? 338 ALA A CA 1 ATOM 16 C C . ALA A 1 14 ? 8.459 49.485 66.706 1.00 50.62 ? 338 ALA A C 1 ATOM 17 O O . ALA A 1 14 ? 8.879 49.827 67.813 1.00 50.58 ? 338 ALA A O 1 ATOM 18 C CB . ALA A 1 14 ? 6.979 51.240 65.678 1.00 51.50 ? 338 ALA A CB 1 ATOM 19 N N . TYR A 1 15 ? 9.173 48.792 65.821 1.00 50.43 ? 339 TYR A N 1 ATOM 20 C CA . TYR A 1 15 ? 10.554 48.365 66.058 1.00 50.34 ? 339 TYR A CA 1 ATOM 21 C C . TYR A 1 15 ? 11.426 48.659 64.841 1.00 49.51 ? 339 TYR A C 1 ATOM 22 O O . TYR A 1 15 ? 10.935 48.760 63.725 1.00 49.02 ? 339 TYR A O 1 ATOM 23 C CB . TYR A 1 15 ? 10.611 46.871 66.367 1.00 51.00 ? 339 TYR A CB 1 ATOM 24 C CG . TYR A 1 15 ? 9.529 46.409 67.306 1.00 51.10 ? 339 TYR A CG 1 ATOM 25 C CD1 . TYR A 1 15 ? 8.358 45.839 66.823 1.00 51.21 ? 339 TYR A CD1 1 ATOM 26 C CD2 . TYR A 1 15 ? 9.675 46.552 68.679 1.00 51.53 ? 339 TYR A CD2 1 ATOM 27 C CE1 . TYR A 1 15 ? 7.359 45.413 67.694 1.00 51.48 ? 339 TYR A CE1 1 ATOM 28 C CE2 . TYR A 1 15 ? 8.689 46.135 69.553 1.00 51.82 ? 339 TYR A CE2 1 ATOM 29 C CZ . TYR A 1 15 ? 7.537 45.564 69.055 1.00 51.63 ? 339 TYR A CZ 1 ATOM 30 O OH . TYR A 1 15 ? 6.567 45.163 69.937 1.00 51.92 ? 339 TYR A OH 1 ATOM 31 N N . LEU A 1 16 ? 12.726 48.802 65.069 1.00 49.58 ? 340 LEU A N 1 ATOM 32 C CA . LEU A 1 16 ? 13.663 49.126 63.999 1.00 49.20 ? 340 LEU A CA 1 ATOM 33 C C . LEU A 1 16 ? 15.015 48.499 64.297 1.00 48.89 ? 340 LEU A C 1 ATOM 34 O O . LEU A 1 16 ? 15.742 48.943 65.196 1.00 48.30 ? 340 LEU A O 1 ATOM 35 C CB . LEU A 1 16 ? 13.798 50.646 63.835 1.00 48.04 ? 340 LEU A CB 1 ATOM 36 C CG . LEU A 1 16 ? 14.785 51.148 62.777 1.00 47.32 ? 340 LEU A CG 1 ATOM 37 C CD1 . LEU A 1 16 ? 14.418 50.650 61.391 1.00 46.35 ? 340 LEU A CD1 1 ATOM 38 C CD2 . LEU A 1 16 ? 14.868 52.676 62.800 1.00 46.13 ? 340 LEU A CD2 1 ATOM 39 N N . SER A 1 17 ? 15.350 47.488 63.498 1.00 48.44 ? 341 SER A N 1 ATOM 40 C CA . SER A 1 17 ? 16.511 46.639 63.741 1.00 48.41 ? 341 SER A CA 1 ATOM 41 C C . SER A 1 17 ? 17.763 47.133 63.030 1.00 47.43 ? 341 SER A C 1 ATOM 42 O O . SER A 1 17 ? 17.701 48.009 62.177 1.00 49.24 ? 341 SER A O 1 ATOM 43 C CB . SER A 1 17 ? 16.200 45.207 63.292 1.00 48.82 ? 341 SER A CB 1 ATOM 44 O OG . SER A 1 17 ? 15.821 45.220 61.928 1.00 49.08 ? 341 SER A OG 1 ATOM 45 N N . ARG A 1 18 ? 18.908 46.570 63.404 1.00 46.41 ? 342 ARG A N 1 ATOM 46 C CA . ARG A 1 18 ? 20.179 46.863 62.738 1.00 44.82 ? 342 ARG A CA 1 ATOM 47 C C . ARG A 1 18 ? 20.481 45.779 61.690 1.00 44.30 ? 342 ARG A C 1 ATOM 48 O O . ARG A 1 18 ? 19.887 44.703 61.724 1.00 44.13 ? 342 ARG A O 1 ATOM 49 C CB . ARG A 1 18 ? 21.308 46.950 63.771 1.00 43.44 ? 342 ARG A CB 1 ATOM 50 C CG . ARG A 1 18 ? 21.110 48.058 64.810 1.00 43.54 ? 342 ARG A CG 1 ATOM 51 C CD . ARG A 1 18 ? 22.181 48.079 65.907 1.00 42.69 ? 342 ARG A CD 1 ATOM 52 N NE . ARG A 1 18 ? 21.991 46.934 66.792 1.00 44.96 ? 342 ARG A NE 1 ATOM 53 C CZ . ARG A 1 18 ? 21.266 46.925 67.908 1.00 45.75 ? 342 ARG A CZ 1 ATOM 54 N NH1 . ARG A 1 18 ? 20.656 48.021 68.338 1.00 46.58 ? 342 ARG A NH1 1 ATOM 55 N NH2 . ARG A 1 18 ? 21.161 45.805 68.608 1.00 45.72 ? 342 ARG A NH2 1 ATOM 56 N N . PRO A 1 19 ? 21.396 46.064 60.744 1.00 43.46 ? 343 PRO A N 1 ATOM 57 C CA . PRO A 1 19 ? 21.763 45.048 59.770 1.00 42.86 ? 343 PRO A CA 1 ATOM 58 C C . PRO A 1 19 ? 22.385 43.826 60.432 1.00 41.66 ? 343 PRO A C 1 ATOM 59 O O . PRO A 1 19 ? 23.025 43.939 61.474 1.00 40.77 ? 343 PRO A O 1 ATOM 60 C CB . PRO A 1 19 ? 22.796 45.747 58.882 1.00 42.71 ? 343 PRO A CB 1 ATOM 61 C CG . PRO A 1 19 ? 22.553 47.224 59.074 1.00 42.88 ? 343 PRO A CG 1 ATOM 62 C CD . PRO A 1 19 ? 22.036 47.363 60.470 1.00 43.48 ? 343 PRO A CD 1 ATOM 63 N N . SER A 1 20 ? 22.211 42.667 59.808 1.00 41.03 ? 344 SER A N 1 ATOM 64 C CA . SER A 1 20 ? 22.899 41.492 60.273 1.00 40.19 ? 344 SER A CA 1 ATOM 65 C C . SER A 1 20 ? 24.361 41.606 59.833 1.00 41.01 ? 344 SER A C 1 ATOM 66 O O . SER A 1 20 ? 24.633 42.150 58.762 1.00 42.13 ? 344 SER A O 1 ATOM 67 C CB . SER A 1 20 ? 22.230 40.236 59.723 1.00 39.71 ? 344 SER A CB 1 ATOM 68 O OG . SER A 1 20 ? 22.550 40.012 58.370 1.00 38.47 ? 344 SER A OG 1 ATOM 69 N N . PRO A 1 21 ? 25.304 41.147 60.685 1.00 40.83 ? 345 PRO A N 1 ATOM 70 C CA . PRO A 1 21 ? 26.719 41.035 60.328 1.00 40.59 ? 345 PRO A CA 1 ATOM 71 C C . PRO A 1 21 ? 26.996 40.244 59.046 1.00 41.53 ? 345 PRO A C 1 ATOM 72 O O . PRO A 1 21 ? 27.961 40.522 58.346 1.00 41.81 ? 345 PRO A O 1 ATOM 73 C CB . PRO A 1 21 ? 27.315 40.302 61.533 1.00 39.91 ? 345 PRO A CB 1 ATOM 74 C CG . PRO A 1 21 ? 26.488 40.738 62.658 1.00 39.62 ? 345 PRO A CG 1 ATOM 75 C CD . PRO A 1 21 ? 25.095 40.923 62.128 1.00 39.52 ? 345 PRO A CD 1 ATOM 76 N N . PHE A 1 22 ? 26.183 39.235 58.760 1.00 42.67 ? 346 PHE A N 1 ATOM 77 C CA . PHE A 1 22 ? 26.316 38.506 57.514 1.00 42.42 ? 346 PHE A CA 1 ATOM 78 C C . PHE A 1 22 ? 26.054 39.407 56.291 1.00 41.82 ? 346 PHE A C 1 ATOM 79 O O . PHE A 1 22 ? 26.856 39.481 55.354 1.00 39.42 ? 346 PHE A O 1 ATOM 80 C CB . PHE A 1 22 ? 25.367 37.304 57.502 1.00 42.81 ? 346 PHE A CB 1 ATOM 81 C CG . PHE A 1 22 ? 25.408 36.542 56.211 1.00 44.12 ? 346 PHE A CG 1 ATOM 82 C CD1 . PHE A 1 22 ? 26.581 35.935 55.794 1.00 45.04 ? 346 PHE A CD1 1 ATOM 83 C CD2 . PHE A 1 22 ? 24.296 36.479 55.391 1.00 44.53 ? 346 PHE A CD2 1 ATOM 84 C CE1 . PHE A 1 22 ? 26.632 35.248 54.587 1.00 45.49 ? 346 PHE A CE1 1 ATOM 85 C CE2 . PHE A 1 22 ? 24.340 35.802 54.201 1.00 44.44 ? 346 PHE A CE2 1 ATOM 86 C CZ . PHE A 1 22 ? 25.507 35.191 53.793 1.00 45.24 ? 346 PHE A CZ 1 ATOM 87 N N . ASP A 1 23 ? 24.920 40.088 56.311 1.00 42.85 ? 347 ASP A N 1 ATOM 88 C CA . ASP A 1 23 ? 24.570 41.029 55.244 1.00 43.82 ? 347 ASP A CA 1 ATOM 89 C C . ASP A 1 23 ? 25.574 42.165 55.135 1.00 43.15 ? 347 ASP A C 1 ATOM 90 O O . ASP A 1 23 ? 25.970 42.549 54.037 1.00 43.36 ? 347 ASP A O 1 ATOM 91 C CB . ASP A 1 23 ? 23.194 41.636 55.478 1.00 44.18 ? 347 ASP A CB 1 ATOM 92 C CG . ASP A 1 23 ? 22.070 40.668 55.224 1.00 45.02 ? 347 ASP A CG 1 ATOM 93 O OD1 . ASP A 1 23 ? 20.908 41.037 55.504 1.00 47.49 ? 347 ASP A OD1 1 ATOM 94 O OD2 . ASP A 1 23 ? 22.318 39.551 54.745 1.00 47.27 ? 347 ASP A OD2 1 ATOM 95 N N . LEU A 1 24 ? 25.986 42.699 56.276 1.00 42.86 ? 348 LEU A N 1 ATOM 96 C CA . LEU A 1 24 ? 26.834 43.880 56.289 1.00 42.96 ? 348 LEU A CA 1 ATOM 97 C C . LEU A 1 24 ? 28.254 43.572 55.787 1.00 43.25 ? 348 LEU A C 1 ATOM 98 O O . LEU A 1 24 ? 28.811 44.326 54.983 1.00 42.54 ? 348 LEU A O 1 ATOM 99 C CB . LEU A 1 24 ? 26.846 44.488 57.702 1.00 43.19 ? 348 LEU A CB 1 ATOM 100 C CG . LEU A 1 24 ? 27.716 45.721 58.019 1.00 44.01 ? 348 LEU A CG 1 ATOM 101 C CD1 . LEU A 1 24 ? 27.253 47.015 57.317 1.00 42.88 ? 348 LEU A CD1 1 ATOM 102 C CD2 . LEU A 1 24 ? 27.770 45.933 59.531 1.00 44.23 ? 348 LEU A CD2 1 ATOM 103 N N . PHE A 1 25 ? 28.822 42.456 56.236 1.00 43.64 ? 349 PHE A N 1 ATOM 104 C CA . PHE A 1 25 ? 30.242 42.149 56.012 1.00 44.54 ? 349 PHE A CA 1 ATOM 105 C C . PHE A 1 25 ? 30.492 41.151 54.896 1.00 45.71 ? 349 PHE A C 1 ATOM 106 O O . PHE A 1 25 ? 31.395 41.351 54.088 1.00 47.64 ? 349 PHE A O 1 ATOM 107 C CB . PHE A 1 25 ? 30.904 41.626 57.301 1.00 44.02 ? 349 PHE A CB 1 ATOM 108 C CG . PHE A 1 25 ? 30.905 42.630 58.429 1.00 43.31 ? 349 PHE A CG 1 ATOM 109 C CD1 . PHE A 1 25 ? 30.204 42.387 59.599 1.00 42.90 ? 349 PHE A CD1 1 ATOM 110 C CD2 . PHE A 1 25 ? 31.573 43.834 58.294 1.00 43.52 ? 349 PHE A CD2 1 ATOM 111 C CE1 . PHE A 1 25 ? 30.191 43.313 60.617 1.00 43.07 ? 349 PHE A CE1 1 ATOM 112 C CE2 . PHE A 1 25 ? 31.569 44.769 59.317 1.00 43.36 ? 349 PHE A CE2 1 ATOM 113 C CZ . PHE A 1 25 ? 30.879 44.504 60.482 1.00 43.24 ? 349 PHE A CZ 1 ATOM 114 N N . ILE A 1 26 ? 29.717 40.073 54.851 1.00 47.02 ? 350 ILE A N 1 ATOM 115 C CA . ILE A 1 26 ? 29.917 39.044 53.830 1.00 47.89 ? 350 ILE A CA 1 ATOM 116 C C . ILE A 1 26 ? 29.238 39.412 52.507 1.00 49.65 ? 350 ILE A C 1 ATOM 117 O O . ILE A 1 26 ? 29.887 39.467 51.462 1.00 49.64 ? 350 ILE A O 1 ATOM 118 C CB . ILE A 1 26 ? 29.435 37.647 54.307 1.00 47.02 ? 350 ILE A CB 1 ATOM 119 C CG1 . ILE A 1 26 ? 30.009 37.309 55.687 1.00 46.55 ? 350 ILE A CG1 1 ATOM 120 C CG2 . ILE A 1 26 ? 29.861 36.560 53.326 1.00 46.45 ? 350 ILE A CG2 1 ATOM 121 C CD1 . ILE A 1 26 ? 31.527 37.369 55.754 1.00 45.76 ? 350 ILE A CD1 1 ATOM 122 N N . ARG A 1 27 ? 27.928 39.630 52.549 1.00 51.51 ? 351 ARG A N 1 ATOM 123 C CA . ARG A 1 27 ? 27.188 40.073 51.375 1.00 53.51 ? 351 ARG A CA 1 ATOM 124 C C . ARG A 1 27 ? 27.552 41.502 50.943 1.00 53.45 ? 351 ARG A C 1 ATOM 125 O O . ARG A 1 27 ? 27.529 41.812 49.756 1.00 53.29 ? 351 ARG A O 1 ATOM 126 C CB . ARG A 1 27 ? 25.692 40.043 51.666 1.00 55.17 ? 351 ARG A CB 1 ATOM 127 C CG . ARG A 1 27 ? 25.057 38.682 51.644 1.00 56.75 ? 351 ARG A CG 1 ATOM 128 C CD . ARG A 1 27 ? 23.540 38.864 51.588 1.00 58.62 ? 351 ARG A CD 1 ATOM 129 N NE . ARG A 1 27 ? 22.836 37.586 51.480 1.00 60.52 ? 351 ARG A NE 1 ATOM 130 C CZ . ARG A 1 27 ? 21.520 37.465 51.299 1.00 61.39 ? 351 ARG A CZ 1 ATOM 131 N NH1 . ARG A 1 27 ? 20.752 38.552 51.209 1.00 61.55 ? 351 ARG A NH1 1 ATOM 132 N NH2 . ARG A 1 27 ? 20.974 36.255 51.209 1.00 61.20 ? 351 ARG A NH2 1 ATOM 133 N N . LYS A 1 28 ? 27.878 42.354 51.914 1.00 53.32 ? 352 LYS A N 1 ATOM 134 C CA . LYS A 1 28 ? 28.096 43.783 51.700 1.00 53.51 ? 352 LYS A CA 1 ATOM 135 C C . LYS A 1 28 ? 26.881 44.405 51.038 1.00 52.10 ? 352 LYS A C 1 ATOM 136 O O . LYS A 1 28 ? 27.001 45.196 50.113 1.00 53.70 ? 352 LYS A O 1 ATOM 137 C CB . LYS A 1 28 ? 29.364 44.056 50.889 1.00 55.06 ? 352 LYS A CB 1 ATOM 138 C CG . LYS A 1 28 ? 30.633 43.509 51.536 1.00 56.00 ? 352 LYS A CG 1 ATOM 139 C CD . LYS A 1 28 ? 31.870 43.951 50.774 1.00 56.63 ? 352 LYS A CD 1 ATOM 140 C CE . LYS A 1 28 ? 33.133 43.623 51.551 1.00 57.08 ? 352 LYS A CE 1 ATOM 141 N NZ . LYS A 1 28 ? 34.371 43.949 50.777 1.00 58.00 ? 352 LYS A NZ 1 ATOM 142 N N . SER A 1 29 ? 25.706 44.033 51.530 1.00 49.99 ? 353 SER A N 1 ATOM 143 C CA . SER A 1 29 ? 24.463 44.652 51.133 1.00 48.02 ? 353 SER A CA 1 ATOM 144 C C . SER A 1 29 ? 23.546 44.634 52.350 1.00 46.52 ? 353 SER A C 1 ATOM 145 O O . SER A 1 29 ? 22.559 43.893 52.408 1.00 46.94 ? 353 SER A O 1 ATOM 146 C CB . SER A 1 29 ? 23.846 43.974 49.899 1.00 48.45 ? 353 SER A CB 1 ATOM 147 O OG . SER A 1 29 ? 23.510 42.631 50.137 1.00 49.51 ? 353 SER A OG 1 ATOM 148 N N . PRO A 1 30 ? 23.870 45.480 53.335 1.00 44.96 ? 354 PRO A N 1 ATOM 149 C CA . PRO A 1 30 ? 23.067 45.617 54.535 1.00 44.12 ? 354 PRO A CA 1 ATOM 150 C C . PRO A 1 30 ? 21.738 46.349 54.343 1.00 43.24 ? 354 PRO A C 1 ATOM 151 O O . PRO A 1 30 ? 21.592 47.227 53.493 1.00 42.68 ? 354 PRO A O 1 ATOM 152 C CB . PRO A 1 30 ? 23.982 46.416 55.455 1.00 44.21 ? 354 PRO A CB 1 ATOM 153 C CG . PRO A 1 30 ? 24.770 47.242 54.548 1.00 44.16 ? 354 PRO A CG 1 ATOM 154 C CD . PRO A 1 30 ? 24.957 46.474 53.296 1.00 44.18 ? 354 PRO A CD 1 ATOM 155 N N . THR A 1 31 ? 20.767 45.964 55.155 1.00 43.44 ? 355 THR A N 1 ATOM 156 C CA . THR A 1 31 ? 19.445 46.556 55.135 1.00 43.43 ? 355 THR A CA 1 ATOM 157 C C . THR A 1 31 ? 18.991 46.740 56.578 1.00 44.05 ? 355 THR A C 1 ATOM 158 O O . THR A 1 31 ? 19.522 46.090 57.496 1.00 45.59 ? 355 THR A O 1 ATOM 159 C CB . THR A 1 31 ? 18.427 45.656 54.394 1.00 43.56 ? 355 THR A CB 1 ATOM 160 O OG1 . THR A 1 31 ? 18.377 44.376 55.023 1.00 43.51 ? 355 THR A OG1 1 ATOM 161 C CG2 . THR A 1 31 ? 18.797 45.460 52.920 1.00 43.14 ? 355 THR A CG2 1 ATOM 162 N N . ILE A 1 32 ? 18.009 47.618 56.774 1.00 42.44 ? 356 ILE A N 1 ATOM 163 C CA . ILE A 1 32 ? 17.316 47.723 58.049 1.00 41.27 ? 356 ILE A CA 1 ATOM 164 C C . ILE A 1 32 ? 15.820 47.578 57.809 1.00 41.62 ? 356 ILE A C 1 ATOM 165 O O . ILE A 1 32 ? 15.349 47.809 56.709 1.00 42.53 ? 356 ILE A O 1 ATOM 166 C CB . ILE A 1 32 ? 17.676 49.018 58.819 1.00 40.06 ? 356 ILE A CB 1 ATOM 167 C CG1 . ILE A 1 32 ? 17.382 50.270 57.977 1.00 39.59 ? 356 ILE A CG1 1 ATOM 168 C CG2 . ILE A 1 32 ? 19.146 48.947 59.258 1.00 39.41 ? 356 ILE A CG2 1 ATOM 169 C CD1 . ILE A 1 32 ? 17.686 51.586 58.671 1.00 37.73 ? 356 ILE A CD1 1 ATOM 170 N N . THR A 1 33 ? 15.093 47.146 58.832 1.00 43.14 ? 357 THR A N 1 ATOM 171 C CA . THR A 1 33 ? 13.664 46.850 58.709 1.00 44.55 ? 357 THR A CA 1 ATOM 172 C C . THR A 1 33 ? 12.914 47.573 59.817 1.00 46.07 ? 357 THR A C 1 ATOM 173 O O . THR A 1 33 ? 13.194 47.378 60.991 1.00 44.38 ? 357 THR A O 1 ATOM 174 C CB . THR A 1 33 ? 13.360 45.321 58.842 1.00 44.33 ? 357 THR A CB 1 ATOM 175 O OG1 . THR A 1 33 ? 14.124 44.594 57.878 1.00 43.59 ? 357 THR A OG1 1 ATOM 176 C CG2 . THR A 1 33 ? 11.860 45.021 58.666 1.00 42.57 ? 357 THR A CG2 1 ATOM 177 N N . CYS A 1 34 ? 11.993 48.441 59.412 1.00 48.89 ? 358 CYS A N 1 ATOM 178 C CA . CYS A 1 34 ? 11.041 49.047 60.320 1.00 51.01 ? 358 CYS A CA 1 ATOM 179 C C . CYS A 1 34 ? 9.814 48.147 60.436 1.00 52.93 ? 358 CYS A C 1 ATOM 180 O O . CYS A 1 34 ? 9.055 47.993 59.475 1.00 52.76 ? 358 CYS A O 1 ATOM 181 C CB . CYS A 1 34 ? 10.630 50.428 59.807 1.00 51.74 ? 358 CYS A CB 1 ATOM 182 S SG . CYS A 1 34 ? 9.647 51.370 60.993 1.00 51.54 ? 358 CYS A SG 1 ATOM 183 N N . LEU A 1 35 ? 9.637 47.548 61.614 1.00 55.07 ? 359 LEU A N 1 ATOM 184 C CA . LEU A 1 35 ? 8.523 46.639 61.875 1.00 56.80 ? 359 LEU A CA 1 ATOM 185 C C . LEU A 1 35 ? 7.487 47.280 62.796 1.00 57.91 ? 359 LEU A C 1 ATOM 186 O O . LEU A 1 35 ? 7.798 47.662 63.923 1.00 58.08 ? 359 LEU A O 1 ATOM 187 C CB . LEU A 1 35 ? 9.038 45.339 62.515 1.00 57.07 ? 359 LEU A CB 1 ATOM 188 C CG . LEU A 1 35 ? 7.996 44.361 63.064 1.00 57.64 ? 359 LEU A CG 1 ATOM 189 C CD1 . LEU A 1 35 ? 7.126 43.763 61.941 1.00 57.26 ? 359 LEU A CD1 1 ATOM 190 C CD2 . LEU A 1 35 ? 8.686 43.257 63.893 1.00 58.05 ? 359 LEU A CD2 1 ATOM 191 N N . VAL A 1 36 ? 6.248 47.372 62.322 1.00 59.62 ? 360 VAL A N 1 ATOM 192 C CA . VAL A 1 36 ? 5.156 47.906 63.136 1.00 61.12 ? 360 VAL A CA 1 ATOM 193 C C . VAL A 1 36 ? 4.064 46.853 63.326 1.00 62.21 ? 360 VAL A C 1 ATOM 194 O O . VAL A 1 36 ? 3.410 46.448 62.367 1.00 60.98 ? 360 VAL A O 1 ATOM 195 C CB . VAL A 1 36 ? 4.563 49.225 62.549 1.00 61.24 ? 360 VAL A CB 1 ATOM 196 C CG1 . VAL A 1 36 ? 4.470 49.174 61.029 1.00 61.20 ? 360 VAL A CG1 1 ATOM 197 C CG2 . VAL A 1 36 ? 3.197 49.529 63.163 1.00 60.52 ? 360 VAL A CG2 1 ATOM 198 N N . VAL A 1 37 ? 3.907 46.395 64.567 1.00 64.66 ? 361 VAL A N 1 ATOM 199 C CA . VAL A 1 37 ? 2.886 45.407 64.918 1.00 66.91 ? 361 VAL A CA 1 ATOM 200 C C . VAL A 1 37 ? 1.641 46.115 65.448 1.00 68.83 ? 361 VAL A C 1 ATOM 201 O O . VAL A 1 37 ? 1.639 46.647 66.559 1.00 69.16 ? 361 VAL A O 1 ATOM 202 C CB . VAL A 1 37 ? 3.407 44.400 65.966 1.00 66.67 ? 361 VAL A CB 1 ATOM 203 C CG1 . VAL A 1 37 ? 2.386 43.303 66.199 1.00 66.68 ? 361 VAL A CG1 1 ATOM 204 C CG2 . VAL A 1 37 ? 4.736 43.814 65.503 1.00 66.74 ? 361 VAL A CG2 1 ATOM 205 N N . ASP A 1 38 ? 0.588 46.142 64.636 1.00 71.29 ? 362 ASP A N 1 ATOM 206 C CA . ASP A 1 38 ? -0.638 46.848 65.008 1.00 73.56 ? 362 ASP A CA 1 ATOM 207 C C . ASP A 1 38 ? -1.514 45.996 65.918 1.00 74.50 ? 362 ASP A C 1 ATOM 208 O O . ASP A 1 38 ? -1.369 44.773 65.980 1.00 74.86 ? 362 ASP A O 1 ATOM 209 C CB . ASP A 1 38 ? -1.435 47.260 63.764 1.00 74.34 ? 362 ASP A CB 1 ATOM 210 C CG . ASP A 1 38 ? -0.681 48.242 62.881 1.00 75.20 ? 362 ASP A CG 1 ATOM 211 O OD1 . ASP A 1 38 ? 0.081 49.079 63.420 1.00 75.86 ? 362 ASP A OD1 1 ATOM 212 O OD2 . ASP A 1 38 ? -0.857 48.178 61.643 1.00 75.84 ? 362 ASP A OD2 1 ATOM 213 N N . LEU A 1 39 ? -2.422 46.652 66.630 1.00 75.57 ? 363 LEU A N 1 ATOM 214 C CA . LEU A 1 39 ? -3.379 45.946 67.472 1.00 76.38 ? 363 LEU A CA 1 ATOM 215 C C . LEU A 1 39 ? -4.776 46.544 67.292 1.00 77.08 ? 363 LEU A C 1 ATOM 216 O O . LEU A 1 39 ? -5.573 46.590 68.232 1.00 77.40 ? 363 LEU A O 1 ATOM 217 C CB . LEU A 1 39 ? -2.940 45.992 68.941 1.00 76.41 ? 363 LEU A CB 1 ATOM 218 C CG . LEU A 1 39 ? -1.573 45.389 69.288 1.00 76.44 ? 363 LEU A CG 1 ATOM 219 C CD1 . LEU A 1 39 ? -1.304 45.541 70.781 1.00 76.49 ? 363 LEU A CD1 1 ATOM 220 C CD2 . LEU A 1 39 ? -1.480 43.921 68.880 1.00 76.30 ? 363 LEU A CD2 1 ATOM 221 N N . ALA A 1 40 ? -5.068 46.997 66.074 1.00 77.81 ? 364 ALA A N 1 ATOM 222 C CA . ALA A 1 40 ? -6.379 47.557 65.745 1.00 78.24 ? 364 ALA A CA 1 ATOM 223 C C . ALA A 1 40 ? -6.440 47.972 64.276 1.00 78.65 ? 364 ALA A C 1 ATOM 224 O O . ALA A 1 40 ? -6.454 49.165 63.966 1.00 78.80 ? 364 ALA A O 1 ATOM 225 C CB . ALA A 1 40 ? -6.691 48.753 66.643 1.00 78.21 ? 364 ALA A CB 1 ATOM 226 N N . PRO A 1 41 ? -6.481 46.985 63.364 1.00 79.05 ? 365 PRO A N 1 ATOM 227 C CA . PRO A 1 41 ? -6.475 47.270 61.930 1.00 79.24 ? 365 PRO A CA 1 ATOM 228 C C . PRO A 1 41 ? -7.802 47.847 61.420 1.00 79.39 ? 365 PRO A C 1 ATOM 229 O O . PRO A 1 41 ? -8.879 47.428 61.854 1.00 79.54 ? 365 PRO A O 1 ATOM 230 C CB . PRO A 1 41 ? -6.206 45.898 61.305 1.00 79.21 ? 365 PRO A CB 1 ATOM 231 C CG . PRO A 1 41 ? -6.775 44.929 62.279 1.00 79.19 ? 365 PRO A CG 1 ATOM 232 C CD . PRO A 1 41 ? -6.585 45.540 63.641 1.00 79.09 ? 365 PRO A CD 1 ATOM 233 N N . SER A 1 42 ? -7.704 48.805 60.501 1.00 79.38 ? 366 SER A N 1 ATOM 234 C CA . SER A 1 42 ? -8.867 49.419 59.862 1.00 79.24 ? 366 SER A CA 1 ATOM 235 C C . SER A 1 42 ? -8.444 49.850 58.455 1.00 79.03 ? 366 SER A C 1 ATOM 236 O O . SER A 1 42 ? -7.533 49.249 57.882 1.00 79.09 ? 366 SER A O 1 ATOM 237 C CB . SER A 1 42 ? -9.356 50.613 60.688 1.00 79.30 ? 366 SER A CB 1 ATOM 238 O OG . SER A 1 42 ? -8.339 51.595 60.826 1.00 79.19 ? 366 SER A OG 1 ATOM 239 N N . LYS A 1 43 ? -9.091 50.869 57.891 1.00 78.57 ? 367 LYS A N 1 ATOM 240 C CA . LYS A 1 43 ? -8.620 51.444 56.631 1.00 78.01 ? 367 LYS A CA 1 ATOM 241 C C . LYS A 1 43 ? -7.188 51.931 56.820 1.00 77.45 ? 367 LYS A C 1 ATOM 242 O O . LYS A 1 43 ? -6.954 53.101 57.129 1.00 77.45 ? 367 LYS A O 1 ATOM 243 C CB . LYS A 1 43 ? -9.521 52.593 56.167 1.00 77.97 ? 367 LYS A CB 1 ATOM 244 C CG . LYS A 1 43 ? -10.552 52.187 55.127 1.00 77.95 ? 367 LYS A CG 1 ATOM 245 C CD . LYS A 1 43 ? -9.895 51.923 53.780 1.00 77.86 ? 367 LYS A CD 1 ATOM 246 C CE . LYS A 1 43 ? -10.909 51.496 52.734 1.00 77.84 ? 367 LYS A CE 1 ATOM 247 N NZ . LYS A 1 43 ? -10.252 51.131 51.449 1.00 77.72 ? 367 LYS A NZ 1 ATOM 248 N N . GLY A 1 44 ? -6.239 51.015 56.634 1.00 76.80 ? 368 GLY A N 1 ATOM 249 C CA . GLY A 1 44 ? -4.838 51.257 56.973 1.00 76.13 ? 368 GLY A CA 1 ATOM 250 C C . GLY A 1 44 ? -3.980 51.869 55.880 1.00 75.35 ? 368 GLY A C 1 ATOM 251 O O . GLY A 1 44 ? -3.269 51.164 55.161 1.00 75.60 ? 368 GLY A O 1 ATOM 252 N N . THR A 1 45 ? -4.018 53.193 55.776 1.00 74.25 ? 369 THR A N 1 ATOM 253 C CA . THR A 1 45 ? -3.095 53.910 54.902 1.00 73.43 ? 369 THR A CA 1 ATOM 254 C C . THR A 1 45 ? -1.810 54.250 55.674 1.00 72.37 ? 369 THR A C 1 ATOM 255 O O . THR A 1 45 ? -1.189 55.293 55.451 1.00 72.62 ? 369 THR A O 1 ATOM 256 C CB . THR A 1 45 ? -3.736 55.196 54.326 1.00 73.46 ? 369 THR A CB 1 ATOM 257 O OG1 . THR A 1 45 ? -4.077 56.092 55.393 1.00 73.57 ? 369 THR A OG1 1 ATOM 258 C CG2 . THR A 1 45 ? -4.990 54.864 53.522 1.00 73.67 ? 369 THR A CG2 1 ATOM 259 N N . VAL A 1 46 ? -1.411 53.348 56.570 1.00 70.77 ? 370 VAL A N 1 ATOM 260 C CA . VAL A 1 46 ? -0.248 53.557 57.434 1.00 69.60 ? 370 VAL A CA 1 ATOM 261 C C . VAL A 1 46 ? 1.024 53.773 56.621 1.00 68.24 ? 370 VAL A C 1 ATOM 262 O O . VAL A 1 46 ? 1.337 52.989 55.719 1.00 68.44 ? 370 VAL A O 1 ATOM 263 C CB . VAL A 1 46 ? -0.029 52.355 58.374 1.00 69.65 ? 370 VAL A CB 1 ATOM 264 C CG1 . VAL A 1 46 ? 1.207 52.562 59.243 1.00 69.55 ? 370 VAL A CG1 1 ATOM 265 C CG2 . VAL A 1 46 ? -1.262 52.128 59.232 1.00 69.62 ? 370 VAL A CG2 1 ATOM 266 N N . GLN A 1 47 ? 1.762 54.828 56.955 1.00 66.19 ? 371 GLN A N 1 ATOM 267 C CA . GLN A 1 47 ? 2.939 55.199 56.182 1.00 64.58 ? 371 GLN A CA 1 ATOM 268 C C . GLN A 1 47 ? 4.188 55.064 57.038 1.00 62.49 ? 371 GLN A C 1 ATOM 269 O O . GLN A 1 47 ? 4.205 55.507 58.189 1.00 62.00 ? 371 GLN A O 1 ATOM 270 C CB . GLN A 1 47 ? 2.797 56.631 55.655 1.00 64.98 ? 371 GLN A CB 1 ATOM 271 C CG . GLN A 1 47 ? 3.854 57.021 54.636 1.00 65.26 ? 371 GLN A CG 1 ATOM 272 C CD . GLN A 1 47 ? 3.610 58.390 54.025 1.00 65.79 ? 371 GLN A CD 1 ATOM 273 O OE1 . GLN A 1 47 ? 2.741 59.145 54.474 1.00 66.00 ? 371 GLN A OE1 1 ATOM 274 N NE2 . GLN A 1 47 ? 4.385 58.720 52.992 1.00 65.95 ? 371 GLN A NE2 1 ATOM 275 N N . LEU A 1 48 ? 5.211 54.423 56.476 1.00 59.97 ? 372 LEU A N 1 ATOM 276 C CA . LEU A 1 48 ? 6.516 54.324 57.121 1.00 58.04 ? 372 LEU A CA 1 ATOM 277 C C . LEU A 1 48 ? 7.476 55.198 56.319 1.00 56.37 ? 372 LEU A C 1 ATOM 278 O O . LEU A 1 48 ? 7.836 54.868 55.192 1.00 56.23 ? 372 LEU A O 1 ATOM 279 C CB . LEU A 1 48 ? 7.016 52.867 57.188 1.00 57.79 ? 372 LEU A CB 1 ATOM 280 C CG . LEU A 1 48 ? 6.216 51.863 58.031 1.00 57.26 ? 372 LEU A CG 1 ATOM 281 C CD1 . LEU A 1 48 ? 6.892 50.502 58.087 1.00 57.01 ? 372 LEU A CD1 1 ATOM 282 C CD2 . LEU A 1 48 ? 6.014 52.367 59.435 1.00 57.47 ? 372 LEU A CD2 1 ATOM 283 N N . THR A 1 49 ? 7.855 56.333 56.898 1.00 54.08 ? 373 THR A N 1 ATOM 284 C CA . THR A 1 49 ? 8.737 57.282 56.242 1.00 52.30 ? 373 THR A CA 1 ATOM 285 C C . THR A 1 49 ? 10.181 57.068 56.726 1.00 50.80 ? 373 THR A C 1 ATOM 286 O O . THR A 1 49 ? 10.444 56.911 57.915 1.00 50.00 ? 373 THR A O 1 ATOM 287 C CB . THR A 1 49 ? 8.272 58.724 56.527 1.00 52.02 ? 373 THR A CB 1 ATOM 288 O OG1 . THR A 1 49 ? 6.897 58.861 56.151 1.00 52.35 ? 373 THR A OG1 1 ATOM 289 C CG2 . THR A 1 49 ? 9.109 59.737 55.768 1.00 52.41 ? 373 THR A CG2 1 ATOM 290 N N . TRP A 1 50 ? 11.110 57.047 55.780 1.00 49.44 ? 374 TRP A N 1 ATOM 291 C CA . TRP A 1 50 ? 12.525 56.890 56.088 1.00 47.71 ? 374 TRP A CA 1 ATOM 292 C C . TRP A 1 50 ? 13.246 58.231 55.969 1.00 46.59 ? 374 TRP A C 1 ATOM 293 O O . TRP A 1 50 ? 12.910 59.056 55.110 1.00 45.14 ? 374 TRP A O 1 ATOM 294 C CB . TRP A 1 50 ? 13.174 55.867 55.153 1.00 47.09 ? 374 TRP A CB 1 ATOM 295 C CG . TRP A 1 50 ? 12.838 54.450 55.468 1.00 47.10 ? 374 TRP A CG 1 ATOM 296 C CD1 . TRP A 1 50 ? 11.992 53.638 54.778 1.00 47.19 ? 374 TRP A CD1 1 ATOM 297 C CD2 . TRP A 1 50 ? 13.361 53.662 56.543 1.00 47.05 ? 374 TRP A CD2 1 ATOM 298 N NE1 . TRP A 1 50 ? 11.958 52.393 55.351 1.00 47.60 ? 374 TRP A NE1 1 ATOM 299 C CE2 . TRP A 1 50 ? 12.782 52.384 56.444 1.00 47.16 ? 374 TRP A CE2 1 ATOM 300 C CE3 . TRP A 1 50 ? 14.267 53.912 57.576 1.00 46.62 ? 374 TRP A CE3 1 ATOM 301 C CZ2 . TRP A 1 50 ? 13.073 51.366 57.339 1.00 46.87 ? 374 TRP A CZ2 1 ATOM 302 C CZ3 . TRP A 1 50 ? 14.553 52.911 58.457 1.00 46.26 ? 374 TRP A CZ3 1 ATOM 303 C CH2 . TRP A 1 50 ? 13.958 51.648 58.340 1.00 46.35 ? 374 TRP A CH2 1 ATOM 304 N N . SER A 1 51 ? 14.225 58.428 56.858 1.00 44.64 ? 375 SER A N 1 ATOM 305 C CA . SER A 1 51 ? 15.127 59.567 56.801 1.00 43.66 ? 375 SER A CA 1 ATOM 306 C C . SER A 1 51 ? 16.439 59.245 57.526 1.00 42.74 ? 375 SER A C 1 ATOM 307 O O . SER A 1 51 ? 16.562 58.250 58.242 1.00 42.94 ? 375 SER A O 1 ATOM 308 C CB . SER A 1 51 ? 14.468 60.861 57.315 1.00 43.31 ? 375 SER A CB 1 ATOM 309 O OG . SER A 1 51 ? 14.016 60.766 58.656 1.00 43.98 ? 375 SER A OG 1 ATOM 310 N N . ARG A 1 52 ? 17.438 60.079 57.263 1.00 41.73 ? 376 ARG A N 1 ATOM 311 C CA . ARG A 1 52 ? 18.722 60.013 57.919 1.00 38.57 ? 376 ARG A CA 1 ATOM 312 C C . ARG A 1 52 ? 18.902 61.246 58.777 1.00 37.17 ? 376 ARG A C 1 ATOM 313 O O . ARG A 1 52 ? 18.400 62.305 58.430 1.00 37.20 ? 376 ARG A O 1 ATOM 314 C CB . ARG A 1 52 ? 19.824 60.008 56.879 1.00 37.82 ? 376 ARG A CB 1 ATOM 315 C CG . ARG A 1 52 ? 19.856 58.810 55.951 1.00 38.91 ? 376 ARG A CG 1 ATOM 316 C CD . ARG A 1 52 ? 21.330 58.587 55.590 1.00 39.15 ? 376 ARG A CD 1 ATOM 317 N NE . ARG A 1 52 ? 21.563 58.390 54.183 1.00 38.60 ? 376 ARG A NE 1 ATOM 318 C CZ . ARG A 1 52 ? 22.750 58.448 53.588 1.00 39.09 ? 376 ARG A CZ 1 ATOM 319 N NH1 . ARG A 1 52 ? 23.874 58.700 54.256 1.00 38.02 ? 376 ARG A NH1 1 ATOM 320 N NH2 . ARG A 1 52 ? 22.795 58.248 52.278 1.00 40.02 ? 376 ARG A NH2 1 ATOM 321 N N . ALA A 1 53 ? 19.665 61.101 59.860 1.00 36.72 ? 377 ALA A N 1 ATOM 322 C CA . ALA A 1 53 ? 19.972 62.179 60.793 1.00 34.44 ? 377 ALA A CA 1 ATOM 323 C C . ALA A 1 53 ? 20.743 63.272 60.093 1.00 33.56 ? 377 ALA A C 1 ATOM 324 O O . ALA A 1 53 ? 20.589 64.440 60.388 1.00 32.06 ? 377 ALA A O 1 ATOM 325 C CB . ALA A 1 53 ? 20.790 61.629 61.991 1.00 34.91 ? 377 ALA A CB 1 ATOM 326 N N . SER A 1 54 ? 21.576 62.865 59.149 1.00 33.97 ? 378 SER A N 1 ATOM 327 C CA . SER A 1 54 ? 22.379 63.770 58.351 1.00 35.08 ? 378 SER A CA 1 ATOM 328 C C . SER A 1 54 ? 21.584 64.584 57.312 1.00 35.63 ? 378 SER A C 1 ATOM 329 O O . SER A 1 54 ? 22.023 65.654 56.894 1.00 37.51 ? 378 SER A O 1 ATOM 330 C CB . SER A 1 54 ? 23.493 62.954 57.666 1.00 34.92 ? 378 SER A CB 1 ATOM 331 O OG . SER A 1 54 ? 22.978 62.087 56.655 1.00 33.30 ? 378 SER A OG 1 ATOM 332 N N . GLY A 1 55 ? 20.424 64.070 56.909 1.00 37.27 ? 379 GLY A N 1 ATOM 333 C CA . GLY A 1 55 ? 19.585 64.660 55.891 1.00 37.56 ? 379 GLY A CA 1 ATOM 334 C C . GLY A 1 55 ? 19.930 64.158 54.492 1.00 39.78 ? 379 GLY A C 1 ATOM 335 O O . GLY A 1 55 ? 19.340 64.588 53.497 1.00 40.79 ? 379 GLY A O 1 ATOM 336 N N . LYS A 1 56 ? 20.867 63.222 54.397 1.00 41.34 ? 380 LYS A N 1 ATOM 337 C CA . LYS A 1 56 ? 21.289 62.707 53.107 1.00 41.29 ? 380 LYS A CA 1 ATOM 338 C C . LYS A 1 56 ? 20.239 61.767 52.575 1.00 41.75 ? 380 LYS A C 1 ATOM 339 O O . LYS A 1 56 ? 19.436 61.263 53.361 1.00 42.22 ? 380 LYS A O 1 ATOM 340 C CB . LYS A 1 56 ? 22.629 62.016 53.212 1.00 41.37 ? 380 LYS A CB 1 ATOM 341 C CG . LYS A 1 56 ? 23.736 62.964 53.532 1.00 42.63 ? 380 LYS A CG 1 ATOM 342 C CD . LYS A 1 56 ? 25.041 62.214 53.681 1.00 43.28 ? 380 LYS A CD 1 ATOM 343 C CE . LYS A 1 56 ? 26.194 63.168 53.778 1.00 44.33 ? 380 LYS A CE 1 ATOM 344 N NZ . LYS A 1 56 ? 27.362 62.411 54.304 1.00 45.51 ? 380 LYS A NZ 1 ATOM 345 N N . PRO A 1 57 ? 20.220 61.566 51.240 1.00 42.56 ? 381 PRO A N 1 ATOM 346 C CA . PRO A 1 57 ? 19.149 60.823 50.581 1.00 43.12 ? 381 PRO A CA 1 ATOM 347 C C . PRO A 1 57 ? 19.106 59.361 51.020 1.00 42.88 ? 381 PRO A C 1 ATOM 348 O O . PRO A 1 57 ? 20.140 58.737 51.246 1.00 43.53 ? 381 PRO A O 1 ATOM 349 C CB . PRO A 1 57 ? 19.490 60.925 49.080 1.00 43.42 ? 381 PRO A CB 1 ATOM 350 C CG . PRO A 1 57 ? 20.410 62.071 48.961 1.00 44.30 ? 381 PRO A CG 1 ATOM 351 C CD . PRO A 1 57 ? 21.185 62.111 50.268 1.00 43.72 ? 381 PRO A CD 1 ATOM 352 N N . VAL A 1 58 ? 17.900 58.839 51.180 1.00 42.53 ? 382 VAL A N 1 ATOM 353 C CA . VAL A 1 58 ? 17.718 57.434 51.453 1.00 42.98 ? 382 VAL A CA 1 ATOM 354 C C . VAL A 1 58 ? 17.407 56.729 50.144 1.00 43.98 ? 382 VAL A C 1 ATOM 355 O O . VAL A 1 58 ? 16.898 57.331 49.197 1.00 43.06 ? 382 VAL A O 1 ATOM 356 C CB . VAL A 1 58 ? 16.582 57.188 52.469 1.00 43.29 ? 382 VAL A CB 1 ATOM 357 C CG1 . VAL A 1 58 ? 16.968 57.724 53.858 1.00 42.53 ? 382 VAL A CG1 1 ATOM 358 C CG2 . VAL A 1 58 ? 15.278 57.794 51.972 1.00 41.80 ? 382 VAL A CG2 1 ATOM 359 N N . GLN A 1 59 ? 17.738 55.443 50.078 1.00 45.96 ? 383 GLN A N 1 ATOM 360 C CA . GLN A 1 59 ? 17.442 54.672 48.890 1.00 46.75 ? 383 GLN A CA 1 ATOM 361 C C . GLN A 1 59 ? 15.960 54.319 48.888 1.00 46.84 ? 383 GLN A C 1 ATOM 362 O O . GLN A 1 59 ? 15.261 54.487 49.892 1.00 42.97 ? 383 GLN A O 1 ATOM 363 C CB . GLN A 1 59 ? 18.321 53.430 48.830 1.00 48.99 ? 383 GLN A CB 1 ATOM 364 C CG . GLN A 1 59 ? 19.816 53.733 48.707 1.00 50.62 ? 383 GLN A CG 1 ATOM 365 C CD . GLN A 1 59 ? 20.655 52.472 48.634 1.00 52.95 ? 383 GLN A CD 1 ATOM 366 O OE1 . GLN A 1 59 ? 20.321 51.534 47.892 1.00 54.95 ? 383 GLN A OE1 1 ATOM 367 N NE2 . GLN A 1 59 ? 21.751 52.435 49.401 1.00 53.91 ? 383 GLN A NE2 1 ATOM 368 N N . HIS A 1 60 ? 15.488 53.833 47.744 1.00 49.25 ? 384 HIS A N 1 ATOM 369 C CA . HIS A 1 60 ? 14.128 53.325 47.623 1.00 50.02 ? 384 HIS A CA 1 ATOM 370 C C . HIS A 1 60 ? 13.944 52.121 48.542 1.00 50.58 ? 384 HIS A C 1 ATOM 371 O O . HIS A 1 60 ? 14.745 51.181 48.511 1.00 52.72 ? 384 HIS A O 1 ATOM 372 C CB . HIS A 1 60 ? 13.829 52.957 46.163 1.00 50.09 ? 384 HIS A CB 1 ATOM 373 C CG . HIS A 1 60 ? 12.436 52.457 45.943 1.00 50.29 ? 384 HIS A CG 1 ATOM 374 N ND1 . HIS A 1 60 ? 11.341 53.293 45.939 1.00 49.89 ? 384 HIS A ND1 1 ATOM 375 C CD2 . HIS A 1 60 ? 11.957 51.206 45.742 1.00 50.43 ? 384 HIS A CD2 1 ATOM 376 C CE1 . HIS A 1 60 ? 10.246 52.580 45.746 1.00 50.94 ? 384 HIS A CE1 1 ATOM 377 N NE2 . HIS A 1 60 ? 10.593 51.310 45.617 1.00 51.13 ? 384 HIS A NE2 1 ATOM 378 N N . SER A 1 61 ? 12.891 52.161 49.357 1.00 50.41 ? 385 SER A N 1 ATOM 379 C CA . SER A 1 61 ? 12.613 51.095 50.307 1.00 50.90 ? 385 SER A CA 1 ATOM 380 C C . SER A 1 61 ? 11.489 50.174 49.840 1.00 52.37 ? 385 SER A C 1 ATOM 381 O O . SER A 1 61 ? 10.761 50.469 48.886 1.00 51.28 ? 385 SER A O 1 ATOM 382 C CB . SER A 1 61 ? 12.278 51.660 51.691 1.00 50.48 ? 385 SER A CB 1 ATOM 383 O OG . SER A 1 61 ? 11.065 52.375 51.676 1.00 50.45 ? 385 SER A OG 1 ATOM 384 N N . THR A 1 62 ? 11.361 49.049 50.540 1.00 54.15 ? 386 THR A N 1 ATOM 385 C CA . THR A 1 62 ? 10.413 47.998 50.172 1.00 55.99 ? 386 THR A CA 1 ATOM 386 C C . THR A 1 62 ? 9.383 47.778 51.271 1.00 56.89 ? 386 THR A C 1 ATOM 387 O O . THR A 1 62 ? 9.708 47.280 52.347 1.00 55.77 ? 386 THR A O 1 ATOM 388 C CB . THR A 1 62 ? 11.134 46.658 49.895 1.00 56.24 ? 386 THR A CB 1 ATOM 389 O OG1 . THR A 1 62 ? 11.929 46.774 48.703 1.00 56.71 ? 386 THR A OG1 1 ATOM 390 C CG2 . THR A 1 62 ? 10.119 45.522 49.738 1.00 55.94 ? 386 THR A CG2 1 ATOM 391 N N . ARG A 1 63 ? 8.139 48.152 50.988 1.00 59.26 ? 387 ARG A N 1 ATOM 392 C CA . ARG A 1 63 ? 7.038 47.947 51.924 1.00 61.18 ? 387 ARG A CA 1 ATOM 393 C C . ARG A 1 63 ? 6.408 46.570 51.744 1.00 62.92 ? 387 ARG A C 1 ATOM 394 O O . ARG A 1 63 ? 6.249 46.075 50.624 1.00 62.31 ? 387 ARG A O 1 ATOM 395 C CB . ARG A 1 63 ? 5.970 49.030 51.751 1.00 61.80 ? 387 ARG A CB 1 ATOM 396 C CG . ARG A 1 63 ? 4.923 49.053 52.868 1.00 62.22 ? 387 ARG A CG 1 ATOM 397 C CD . ARG A 1 63 ? 4.101 50.340 52.830 1.00 63.04 ? 387 ARG A CD 1 ATOM 398 N NE . ARG A 1 63 ? 3.266 50.509 54.021 1.00 63.47 ? 387 ARG A NE 1 ATOM 399 C CZ . ARG A 1 63 ? 2.011 50.082 54.135 1.00 63.52 ? 387 ARG A CZ 1 ATOM 400 N NH1 . ARG A 1 63 ? 1.416 49.451 53.129 1.00 63.72 ? 387 ARG A NH1 1 ATOM 401 N NH2 . ARG A 1 63 ? 1.346 50.282 55.267 1.00 63.34 ? 387 ARG A NH2 1 ATOM 402 N N . LYS A 1 64 ? 6.036 45.964 52.865 1.00 64.96 ? 388 LYS A N 1 ATOM 403 C CA . LYS A 1 64 ? 5.489 44.615 52.867 1.00 66.70 ? 388 LYS A CA 1 ATOM 404 C C . LYS A 1 64 ? 4.479 44.505 54.003 1.00 67.51 ? 388 LYS A C 1 ATOM 405 O O . LYS A 1 64 ? 4.748 44.915 55.129 1.00 67.50 ? 388 LYS A O 1 ATOM 406 C CB . LYS A 1 64 ? 6.627 43.598 53.027 1.00 67.60 ? 388 LYS A CB 1 ATOM 407 C CG . LYS A 1 64 ? 6.202 42.134 53.086 1.00 68.38 ? 388 LYS A CG 1 ATOM 408 C CD . LYS A 1 64 ? 7.406 41.207 53.254 1.00 68.78 ? 388 LYS A CD 1 ATOM 409 C CE . LYS A 1 64 ? 6.972 39.799 53.643 1.00 69.18 ? 388 LYS A CE 1 ATOM 410 N NZ . LYS A 1 64 ? 8.058 39.016 54.316 1.00 69.46 ? 388 LYS A NZ 1 ATOM 411 N N . GLU A 1 65 ? 3.298 43.979 53.704 1.00 68.85 ? 389 GLU A N 1 ATOM 412 C CA . GLU A 1 65 ? 2.284 43.780 54.735 1.00 69.63 ? 389 GLU A CA 1 ATOM 413 C C . GLU A 1 65 ? 1.775 42.342 54.708 1.00 69.62 ? 389 GLU A C 1 ATOM 414 O O . GLU A 1 65 ? 1.543 41.784 53.639 1.00 69.38 ? 389 GLU A O 1 ATOM 415 C CB . GLU A 1 65 ? 1.131 44.771 54.563 1.00 70.11 ? 389 GLU A CB 1 ATOM 416 C CG . GLU A 1 65 ? 0.438 44.697 53.211 1.00 70.60 ? 389 GLU A CG 1 ATOM 417 C CD . GLU A 1 65 ? -0.497 45.866 52.979 1.00 70.83 ? 389 GLU A CD 1 ATOM 418 O OE1 . GLU A 1 65 ? -0.311 46.921 53.629 1.00 70.75 ? 389 GLU A OE1 1 ATOM 419 O OE2 . GLU A 1 65 ? -1.413 45.730 52.141 1.00 71.26 ? 389 GLU A OE2 1 ATOM 420 N N . GLU A 1 66 ? 1.628 41.751 55.891 1.00 69.83 ? 390 GLU A N 1 ATOM 421 C CA . GLU A 1 66 ? 1.160 40.374 56.037 1.00 69.98 ? 390 GLU A CA 1 ATOM 422 C C . GLU A 1 66 ? 0.098 40.293 57.123 1.00 68.96 ? 390 GLU A C 1 ATOM 423 O O . GLU A 1 66 ? 0.382 40.502 58.301 1.00 68.69 ? 390 GLU A O 1 ATOM 424 C CB . GLU A 1 66 ? 2.316 39.435 56.400 1.00 70.92 ? 390 GLU A CB 1 ATOM 425 C CG . GLU A 1 66 ? 3.252 39.089 55.243 1.00 71.85 ? 390 GLU A CG 1 ATOM 426 C CD . GLU A 1 66 ? 2.678 38.052 54.281 1.00 72.51 ? 390 GLU A CD 1 ATOM 427 O OE1 . GLU A 1 66 ? 1.723 37.332 54.648 1.00 72.85 ? 390 GLU A OE1 1 ATOM 428 O OE2 . GLU A 1 66 ? 3.193 37.946 53.147 1.00 73.25 ? 390 GLU A OE2 1 ATOM 429 N N . LYS A 1 67 ? -1.128 39.985 56.720 1.00 68.30 ? 391 LYS A N 1 ATOM 430 C CA . LYS A 1 67 ? -2.211 39.792 57.672 1.00 67.60 ? 391 LYS A CA 1 ATOM 431 C C . LYS A 1 67 ? -1.941 38.534 58.506 1.00 69.54 ? 391 LYS A C 1 ATOM 432 O O . LYS A 1 67 ? -1.701 37.453 57.962 1.00 69.20 ? 391 LYS A O 1 ATOM 433 C CB . LYS A 1 67 ? -3.544 39.691 56.929 1.00 65.59 ? 391 LYS A CB 1 ATOM 434 C CG . LYS A 1 67 ? -4.770 39.737 57.822 1.00 63.70 ? 391 LYS A CG 1 ATOM 435 C CD . LYS A 1 67 ? -6.043 39.877 56.999 1.00 62.49 ? 391 LYS A CD 1 ATOM 436 C CE . LYS A 1 67 ? -6.287 38.658 56.110 1.00 61.74 ? 391 LYS A CE 1 ATOM 437 N NZ . LYS A 1 67 ? -7.617 38.697 55.441 1.00 61.01 ? 391 LYS A NZ 1 ATOM 438 N N . GLN A 1 68 ? -1.962 38.692 59.829 1.00 72.09 ? 392 GLN A N 1 ATOM 439 C CA . GLN A 1 68 ? -1.640 37.606 60.759 1.00 74.05 ? 392 GLN A CA 1 ATOM 440 C C . GLN A 1 68 ? -2.892 36.825 61.148 1.00 75.76 ? 392 GLN A C 1 ATOM 441 O O . GLN A 1 68 ? -4.015 37.322 61.018 1.00 76.02 ? 392 GLN A O 1 ATOM 442 C CB . GLN A 1 68 ? -0.976 38.162 62.022 1.00 74.30 ? 392 GLN A CB 1 ATOM 443 C CG . GLN A 1 68 ? 0.238 39.052 61.763 1.00 74.60 ? 392 GLN A CG 1 ATOM 444 C CD . GLN A 1 68 ? 1.366 38.332 61.045 1.00 74.76 ? 392 GLN A CD 1 ATOM 445 O OE1 . GLN A 1 68 ? 2.002 38.891 60.149 1.00 74.72 ? 392 GLN A OE1 1 ATOM 446 N NE2 . GLN A 1 68 ? 1.623 37.089 61.438 1.00 75.08 ? 392 GLN A NE2 1 ATOM 447 N N . ARG A 1 69 ? -2.691 35.606 61.641 1.00 77.51 ? 393 ARG A N 1 ATOM 448 C CA . ARG A 1 69 ? -3.804 34.717 61.977 1.00 78.94 ? 393 ARG A CA 1 ATOM 449 C C . ARG A 1 69 ? -4.689 35.270 63.094 1.00 79.11 ? 393 ARG A C 1 ATOM 450 O O . ARG A 1 69 ? -5.889 34.993 63.132 1.00 79.17 ? 393 ARG A O 1 ATOM 451 C CB . ARG A 1 69 ? -3.290 33.326 62.368 1.00 79.79 ? 393 ARG A CB 1 ATOM 452 C CG . ARG A 1 69 ? -2.437 33.303 63.632 1.00 80.64 ? 393 ARG A CG 1 ATOM 453 C CD . ARG A 1 69 ? -2.218 31.881 64.138 1.00 81.27 ? 393 ARG A CD 1 ATOM 454 N NE . ARG A 1 69 ? -1.447 31.866 65.381 1.00 81.90 ? 393 ARG A NE 1 ATOM 455 C CZ . ARG A 1 69 ? -1.945 32.136 66.586 1.00 82.26 ? 393 ARG A CZ 1 ATOM 456 N NH1 . ARG A 1 69 ? -3.227 32.445 66.733 1.00 82.40 ? 393 ARG A NH1 1 ATOM 457 N NH2 . ARG A 1 69 ? -1.155 32.099 67.653 1.00 82.33 ? 393 ARG A NH2 1 ATOM 458 N N . ASN A 1 70 ? -4.101 36.055 63.994 1.00 79.25 ? 394 ASN A N 1 ATOM 459 C CA . ASN A 1 70 ? -4.833 36.587 65.143 1.00 79.38 ? 394 ASN A CA 1 ATOM 460 C C . ASN A 1 70 ? -5.635 37.859 64.840 1.00 78.61 ? 394 ASN A C 1 ATOM 461 O O . ASN A 1 70 ? -5.823 38.706 65.716 1.00 78.40 ? 394 ASN A O 1 ATOM 462 C CB . ASN A 1 70 ? -3.884 36.806 66.331 1.00 80.10 ? 394 ASN A CB 1 ATOM 463 C CG . ASN A 1 70 ? -2.678 37.674 65.984 1.00 80.89 ? 394 ASN A CG 1 ATOM 464 O OD1 . ASN A 1 70 ? -2.472 38.055 64.832 1.00 80.55 ? 394 ASN A OD1 1 ATOM 465 N ND2 . ASN A 1 70 ? -1.871 37.983 66.998 1.00 81.88 ? 394 ASN A ND2 1 ATOM 466 N N . GLY A 1 71 ? -6.135 37.967 63.609 1.00 77.79 ? 395 GLY A N 1 ATOM 467 C CA . GLY A 1 71 ? -6.935 39.115 63.185 1.00 77.10 ? 395 GLY A CA 1 ATOM 468 C C . GLY A 1 71 ? -6.222 40.445 63.347 1.00 76.48 ? 395 GLY A C 1 ATOM 469 O O . GLY A 1 71 ? -6.769 41.380 63.936 1.00 76.63 ? 395 GLY A O 1 ATOM 470 N N . THR A 1 72 ? -5.005 40.537 62.813 1.00 75.41 ? 396 THR A N 1 ATOM 471 C CA . THR A 1 72 ? -4.166 41.728 62.980 1.00 74.38 ? 396 THR A CA 1 ATOM 472 C C . THR A 1 72 ? -3.216 41.930 61.798 1.00 73.37 ? 396 THR A C 1 ATOM 473 O O . THR A 1 72 ? -2.771 40.968 61.167 1.00 73.16 ? 396 THR A O 1 ATOM 474 C CB . THR A 1 72 ? -3.321 41.659 64.276 1.00 74.32 ? 396 THR A CB 1 ATOM 475 O OG1 . THR A 1 72 ? -4.167 41.796 65.425 1.00 74.32 ? 396 THR A OG1 1 ATOM 476 C CG2 . THR A 1 72 ? -2.284 42.767 64.305 1.00 74.21 ? 396 THR A CG2 1 ATOM 477 N N . LEU A 1 73 ? -2.898 43.190 61.514 1.00 72.04 ? 397 LEU A N 1 ATOM 478 C CA . LEU A 1 73 ? -2.035 43.527 60.388 1.00 70.88 ? 397 LEU A CA 1 ATOM 479 C C . LEU A 1 73 ? -0.606 43.842 60.842 1.00 69.71 ? 397 LEU A C 1 ATOM 480 O O . LEU A 1 73 ? -0.387 44.625 61.771 1.00 69.76 ? 397 LEU A O 1 ATOM 481 C CB . LEU A 1 73 ? -2.617 44.717 59.615 1.00 71.04 ? 397 LEU A CB 1 ATOM 482 C CG . LEU A 1 73 ? -1.909 45.088 58.304 1.00 71.14 ? 397 LEU A CG 1 ATOM 483 C CD1 . LEU A 1 73 ? -2.065 43.975 57.270 1.00 71.17 ? 397 LEU A CD1 1 ATOM 484 C CD2 . LEU A 1 73 ? -2.423 46.410 57.750 1.00 71.14 ? 397 LEU A CD2 1 ATOM 485 N N . THR A 1 74 ? 0.366 43.223 60.177 1.00 68.02 ? 398 THR A N 1 ATOM 486 C CA . THR A 1 74 ? 1.777 43.519 60.409 1.00 66.26 ? 398 THR A CA 1 ATOM 487 C C . THR A 1 74 ? 2.365 44.150 59.152 1.00 64.89 ? 398 THR A C 1 ATOM 488 O O . THR A 1 74 ? 2.256 43.596 58.057 1.00 64.74 ? 398 THR A O 1 ATOM 489 C CB . THR A 1 74 ? 2.581 42.248 60.766 1.00 66.11 ? 398 THR A CB 1 ATOM 490 O OG1 . THR A 1 74 ? 2.193 41.779 62.062 1.00 66.27 ? 398 THR A OG1 1 ATOM 491 C CG2 . THR A 1 74 ? 4.072 42.534 60.777 1.00 65.97 ? 398 THR A CG2 1 ATOM 492 N N . VAL A 1 75 ? 2.992 45.312 59.316 1.00 63.11 ? 399 VAL A N 1 ATOM 493 C CA . VAL A 1 75 ? 3.590 46.028 58.190 1.00 61.56 ? 399 VAL A CA 1 ATOM 494 C C . VAL A 1 75 ? 5.079 46.313 58.420 1.00 59.42 ? 399 VAL A C 1 ATOM 495 O O . VAL A 1 75 ? 5.483 46.824 59.464 1.00 58.63 ? 399 VAL A O 1 ATOM 496 C CB . VAL A 1 75 ? 2.820 47.337 57.867 1.00 61.90 ? 399 VAL A CB 1 ATOM 497 C CG1 . VAL A 1 75 ? 2.273 47.973 59.139 1.00 62.34 ? 399 VAL A CG1 1 ATOM 498 C CG2 . VAL A 1 75 ? 3.707 48.311 57.091 1.00 61.43 ? 399 VAL A CG2 1 ATOM 499 N N . THR A 1 76 ? 5.890 45.957 57.429 1.00 57.33 ? 400 THR A N 1 ATOM 500 C CA . THR A 1 76 ? 7.333 46.139 57.495 1.00 55.78 ? 400 THR A CA 1 ATOM 501 C C . THR A 1 76 ? 7.794 46.956 56.293 1.00 54.17 ? 400 THR A C 1 ATOM 502 O O . THR A 1 76 ? 7.203 46.880 55.215 1.00 53.94 ? 400 THR A O 1 ATOM 503 C CB . THR A 1 76 ? 8.092 44.783 57.525 1.00 55.69 ? 400 THR A CB 1 ATOM 504 O OG1 . THR A 1 76 ? 8.055 44.171 56.227 1.00 55.38 ? 400 THR A OG1 1 ATOM 505 C CG2 . THR A 1 76 ? 7.475 43.832 58.550 1.00 55.14 ? 400 THR A CG2 1 ATOM 506 N N . SER A 1 77 ? 8.826 47.771 56.499 1.00 52.47 ? 401 SER A N 1 ATOM 507 C CA . SER A 1 77 ? 9.503 48.433 55.402 1.00 50.22 ? 401 SER A CA 1 ATOM 508 C C . SER A 1 77 ? 10.994 48.168 55.554 1.00 49.40 ? 401 SER A C 1 ATOM 509 O O . SER A 1 77 ? 11.547 48.333 56.636 1.00 50.18 ? 401 SER A O 1 ATOM 510 C CB . SER A 1 77 ? 9.198 49.936 55.382 1.00 50.04 ? 401 SER A CB 1 ATOM 511 O OG . SER A 1 77 ? 9.687 50.576 54.202 1.00 48.54 ? 401 SER A OG 1 ATOM 512 N N . THR A 1 78 ? 11.631 47.740 54.468 1.00 47.93 ? 402 THR A N 1 ATOM 513 C CA . THR A 1 78 ? 13.052 47.423 54.463 1.00 46.50 ? 402 THR A CA 1 ATOM 514 C C . THR A 1 78 ? 13.822 48.400 53.600 1.00 45.56 ? 402 THR A C 1 ATOM 515 O O . THR A 1 78 ? 13.509 48.608 52.423 1.00 45.49 ? 402 THR A O 1 ATOM 516 C CB . THR A 1 78 ? 13.307 45.991 53.950 1.00 46.73 ? 402 THR A CB 1 ATOM 517 O OG1 . THR A 1 78 ? 12.650 45.086 54.839 1.00 45.42 ? 402 THR A OG1 1 ATOM 518 C CG2 . THR A 1 78 ? 14.832 45.667 53.902 1.00 46.54 ? 402 THR A CG2 1 ATOM 519 N N . LEU A 1 79 ? 14.841 48.993 54.209 1.00 43.62 ? 403 LEU A N 1 ATOM 520 C CA . LEU A 1 79 ? 15.648 49.996 53.550 1.00 42.12 ? 403 LEU A CA 1 ATOM 521 C C . LEU A 1 79 ? 17.080 49.472 53.356 1.00 42.40 ? 403 LEU A C 1 ATOM 522 O O . LEU A 1 79 ? 17.778 49.155 54.326 1.00 41.66 ? 403 LEU A O 1 ATOM 523 C CB . LEU A 1 79 ? 15.651 51.295 54.382 1.00 40.38 ? 403 LEU A CB 1 ATOM 524 C CG . LEU A 1 79 ? 16.360 52.519 53.793 1.00 39.40 ? 403 LEU A CG 1 ATOM 525 C CD1 . LEU A 1 79 ? 15.591 53.020 52.564 1.00 38.05 ? 403 LEU A CD1 1 ATOM 526 C CD2 . LEU A 1 79 ? 16.563 53.658 54.817 1.00 38.56 ? 403 LEU A CD2 1 ATOM 527 N N . PRO A 1 80 ? 17.535 49.405 52.097 1.00 42.35 ? 404 PRO A N 1 ATOM 528 C CA . PRO A 1 80 ? 18.961 49.201 51.864 1.00 42.15 ? 404 PRO A CA 1 ATOM 529 C C . PRO A 1 80 ? 19.798 50.381 52.369 1.00 41.94 ? 404 PRO A C 1 ATOM 530 O O . PRO A 1 80 ? 19.473 51.548 52.111 1.00 42.11 ? 404 PRO A O 1 ATOM 531 C CB . PRO A 1 80 ? 19.059 49.075 50.337 1.00 42.27 ? 404 PRO A CB 1 ATOM 532 C CG . PRO A 1 80 ? 17.661 48.848 49.865 1.00 42.12 ? 404 PRO A CG 1 ATOM 533 C CD . PRO A 1 80 ? 16.787 49.549 50.838 1.00 42.04 ? 404 PRO A CD 1 ATOM 534 N N . VAL A 1 81 ? 20.860 50.071 53.104 1.00 41.12 ? 405 VAL A N 1 ATOM 535 C CA . VAL A 1 81 ? 21.756 51.087 53.617 1.00 41.34 ? 405 VAL A CA 1 ATOM 536 C C . VAL A 1 81 ? 23.160 50.894 53.029 1.00 42.07 ? 405 VAL A C 1 ATOM 537 O O . VAL A 1 81 ? 23.525 49.824 52.563 1.00 41.72 ? 405 VAL A O 1 ATOM 538 C CB . VAL A 1 81 ? 21.769 51.144 55.189 1.00 41.44 ? 405 VAL A CB 1 ATOM 539 C CG1 . VAL A 1 81 ? 20.360 51.329 55.726 1.00 41.10 ? 405 VAL A CG1 1 ATOM 540 C CG2 . VAL A 1 81 ? 22.404 49.912 55.819 1.00 41.84 ? 405 VAL A CG2 1 ATOM 541 N N . GLY A 1 82 ? 23.922 51.971 52.983 1.00 43.91 ? 406 GLY A N 1 ATOM 542 C CA . GLY A 1 82 ? 25.293 51.928 52.499 1.00 46.16 ? 406 GLY A CA 1 ATOM 543 C C . GLY A 1 82 ? 26.157 51.272 53.552 1.00 47.00 ? 406 GLY A C 1 ATOM 544 O O . GLY A 1 82 ? 25.971 51.514 54.744 1.00 48.89 ? 406 GLY A O 1 ATOM 545 N N . THR A 1 83 ? 27.073 50.419 53.113 1.00 47.64 ? 407 THR A N 1 ATOM 546 C CA . THR A 1 83 ? 27.899 49.636 54.033 1.00 47.79 ? 407 THR A CA 1 ATOM 547 C C . THR A 1 83 ? 28.825 50.596 54.777 1.00 47.89 ? 407 THR A C 1 ATOM 548 O O . THR A 1 83 ? 28.988 50.525 56.002 1.00 45.97 ? 407 THR A O 1 ATOM 549 C CB . THR A 1 83 ? 28.703 48.556 53.274 1.00 48.01 ? 407 THR A CB 1 ATOM 550 O OG1 . THR A 1 83 ? 27.793 47.626 52.672 1.00 48.61 ? 407 THR A OG1 1 ATOM 551 C CG2 . THR A 1 83 ? 29.631 47.785 54.214 1.00 48.52 ? 407 THR A CG2 1 ATOM 552 N N . ARG A 1 84 ? 29.392 51.523 54.014 1.00 48.05 ? 408 ARG A N 1 ATOM 553 C CA . ARG A 1 84 ? 30.304 52.510 54.555 1.00 48.48 ? 408 ARG A CA 1 ATOM 554 C C . ARG A 1 84 ? 29.550 53.546 55.391 1.00 46.41 ? 408 ARG A C 1 ATOM 555 O O . ARG A 1 84 ? 30.024 53.973 56.440 1.00 45.34 ? 408 ARG A O 1 ATOM 556 C CB . ARG A 1 84 ? 31.090 53.166 53.420 1.00 50.41 ? 408 ARG A CB 1 ATOM 557 C CG . ARG A 1 84 ? 32.445 53.688 53.853 1.00 52.59 ? 408 ARG A CG 1 ATOM 558 C CD . ARG A 1 84 ? 33.304 52.559 54.417 1.00 54.13 ? 408 ARG A CD 1 ATOM 559 N NE . ARG A 1 84 ? 34.173 53.056 55.481 1.00 55.82 ? 408 ARG A NE 1 ATOM 560 C CZ . ARG A 1 84 ? 34.718 52.300 56.428 1.00 56.51 ? 408 ARG A CZ 1 ATOM 561 N NH1 . ARG A 1 84 ? 34.486 50.994 56.461 1.00 56.48 ? 408 ARG A NH1 1 ATOM 562 N NH2 . ARG A 1 84 ? 35.494 52.861 57.352 1.00 57.44 ? 408 ARG A NH2 1 ATOM 563 N N . ASP A 1 85 ? 28.357 53.919 54.943 1.00 44.82 ? 409 ASP A N 1 ATOM 564 C CA . ASP A 1 85 ? 27.495 54.800 55.711 1.00 43.65 ? 409 ASP A CA 1 ATOM 565 C C . ASP A 1 85 ? 27.145 54.213 57.079 1.00 41.75 ? 409 ASP A C 1 ATOM 566 O O . ASP A 1 85 ? 27.193 54.899 58.080 1.00 40.19 ? 409 ASP A O 1 ATOM 567 C CB . ASP A 1 85 ? 26.209 55.093 54.930 1.00 44.85 ? 409 ASP A CB 1 ATOM 568 C CG . ASP A 1 85 ? 26.441 55.987 53.727 1.00 44.69 ? 409 ASP A CG 1 ATOM 569 O OD1 . ASP A 1 85 ? 27.460 56.701 53.700 1.00 45.78 ? 409 ASP A OD1 1 ATOM 570 O OD2 . ASP A 1 85 ? 25.612 55.958 52.794 1.00 45.68 ? 409 ASP A OD2 1 ATOM 571 N N . TRP A 1 86 ? 26.770 52.938 57.133 1.00 42.21 ? 410 TRP A N 1 ATOM 572 C CA . TRP A 1 86 ? 26.456 52.306 58.403 1.00 41.56 ? 410 TRP A CA 1 ATOM 573 C C . TRP A 1 86 ? 27.667 52.257 59.347 1.00 42.46 ? 410 TRP A C 1 ATOM 574 O O . TRP A 1 86 ? 27.572 52.653 60.521 1.00 42.69 ? 410 TRP A O 1 ATOM 575 C CB . TRP A 1 86 ? 25.890 50.889 58.186 1.00 42.64 ? 410 TRP A CB 1 ATOM 576 C CG . TRP A 1 86 ? 25.504 50.276 59.510 1.00 41.40 ? 410 TRP A CG 1 ATOM 577 C CD1 . TRP A 1 86 ? 26.298 49.518 60.319 1.00 40.49 ? 410 TRP A CD1 1 ATOM 578 C CD2 . TRP A 1 86 ? 24.290 50.507 60.242 1.00 40.97 ? 410 TRP A CD2 1 ATOM 579 N NE1 . TRP A 1 86 ? 25.641 49.226 61.484 1.00 40.55 ? 410 TRP A NE1 1 ATOM 580 C CE2 . TRP A 1 86 ? 24.410 49.828 61.470 1.00 40.86 ? 410 TRP A CE2 1 ATOM 581 C CE3 . TRP A 1 86 ? 23.110 51.208 59.974 1.00 41.14 ? 410 TRP A CE3 1 ATOM 582 C CZ2 . TRP A 1 86 ? 23.385 49.805 62.413 1.00 41.12 ? 410 TRP A CZ2 1 ATOM 583 C CZ3 . TRP A 1 86 ? 22.090 51.193 60.930 1.00 40.53 ? 410 TRP A CZ3 1 ATOM 584 C CH2 . TRP A 1 86 ? 22.241 50.504 62.128 1.00 40.67 ? 410 TRP A CH2 1 ATOM 585 N N . ILE A 1 87 ? 28.803 51.795 58.825 1.00 43.94 ? 411 ILE A N 1 ATOM 586 C CA . ILE A 1 87 ? 30.028 51.586 59.616 1.00 45.07 ? 411 ILE A CA 1 ATOM 587 C C . ILE A 1 87 ? 30.557 52.903 60.194 1.00 45.46 ? 411 ILE A C 1 ATOM 588 O O . ILE A 1 87 ? 31.035 52.959 61.326 1.00 45.08 ? 411 ILE A O 1 ATOM 589 C CB . ILE A 1 87 ? 31.118 50.891 58.747 1.00 46.08 ? 411 ILE A CB 1 ATOM 590 C CG1 . ILE A 1 87 ? 30.703 49.456 58.388 1.00 46.62 ? 411 ILE A CG1 1 ATOM 591 C CG2 . ILE A 1 87 ? 32.479 50.900 59.432 1.00 47.11 ? 411 ILE A CG2 1 ATOM 592 C CD1 . ILE A 1 87 ? 30.632 48.505 59.561 1.00 48.22 ? 411 ILE A CD1 1 ATOM 593 N N . GLU A 1 88 ? 30.445 53.975 59.417 1.00 47.15 ? 412 GLU A N 1 ATOM 594 C CA . GLU A 1 88 ? 30.922 55.286 59.838 1.00 48.07 ? 412 GLU A CA 1 ATOM 595 C C . GLU A 1 88 ? 30.034 55.982 60.861 1.00 47.71 ? 412 GLU A C 1 ATOM 596 O O . GLU A 1 88 ? 30.462 56.939 61.482 1.00 49.33 ? 412 GLU A O 1 ATOM 597 C CB . GLU A 1 88 ? 31.118 56.183 58.619 1.00 49.69 ? 412 GLU A CB 1 ATOM 598 C CG . GLU A 1 88 ? 32.337 55.782 57.804 1.00 50.54 ? 412 GLU A CG 1 ATOM 599 C CD . GLU A 1 88 ? 32.376 56.413 56.429 1.00 51.66 ? 412 GLU A CD 1 ATOM 600 O OE1 . GLU A 1 88 ? 31.376 57.061 56.018 1.00 52.26 ? 412 GLU A OE1 1 ATOM 601 O OE2 . GLU A 1 88 ? 33.424 56.237 55.760 1.00 52.37 ? 412 GLU A OE2 1 ATOM 602 N N . GLY A 1 89 ? 28.804 55.517 61.031 1.00 47.03 ? 413 GLY A N 1 ATOM 603 C CA . GLY A 1 89 ? 27.996 55.902 62.185 1.00 45.47 ? 413 GLY A CA 1 ATOM 604 C C . GLY A 1 89 ? 26.729 56.655 61.869 1.00 43.24 ? 413 GLY A C 1 ATOM 605 O O . GLY A 1 89 ? 26.282 57.453 62.669 1.00 45.10 ? 413 GLY A O 1 ATOM 606 N N . GLU A 1 90 ? 26.129 56.402 60.712 1.00 42.44 ? 414 GLU A N 1 ATOM 607 C CA . GLU A 1 90 ? 24.911 57.113 60.333 1.00 41.38 ? 414 GLU A CA 1 ATOM 608 C C . GLU A 1 90 ? 23.740 56.617 61.171 1.00 40.74 ? 414 GLU A C 1 ATOM 609 O O . GLU A 1 90 ? 23.677 55.446 61.524 1.00 42.03 ? 414 GLU A O 1 ATOM 610 C CB . GLU A 1 90 ? 24.632 56.973 58.825 1.00 40.49 ? 414 GLU A CB 1 ATOM 611 C CG . GLU A 1 90 ? 23.317 57.600 58.327 1.00 39.68 ? 414 GLU A CG 1 ATOM 612 C CD . GLU A 1 90 ? 23.250 59.142 58.393 1.00 40.89 ? 414 GLU A CD 1 ATOM 613 O OE1 . GLU A 1 90 ? 23.045 59.745 59.480 1.00 41.34 ? 414 GLU A OE1 1 ATOM 614 O OE2 . GLU A 1 90 ? 23.396 59.764 57.326 1.00 39.43 ? 414 GLU A OE2 1 ATOM 615 N N . THR A 1 91 ? 22.799 57.502 61.488 1.00 41.19 ? 415 THR A N 1 ATOM 616 C CA . THR A 1 91 ? 21.567 57.063 62.151 1.00 41.95 ? 415 THR A CA 1 ATOM 617 C C . THR A 1 91 ? 20.372 57.165 61.200 1.00 41.57 ? 415 THR A C 1 ATOM 618 O O . THR A 1 91 ? 20.141 58.190 60.555 1.00 42.17 ? 415 THR A O 1 ATOM 619 C CB . THR A 1 91 ? 21.277 57.761 63.530 1.00 42.01 ? 415 THR A CB 1 ATOM 620 O OG1 . THR A 1 91 ? 20.633 59.016 63.327 1.00 47.24 ? 415 THR A OG1 1 ATOM 621 C CG2 . THR A 1 91 ? 22.531 57.992 64.328 1.00 40.68 ? 415 THR A CG2 1 ATOM 622 N N . TYR A 1 92 ? 19.618 56.075 61.103 1.00 41.90 ? 416 TYR A N 1 ATOM 623 C CA . TYR A 1 92 ? 18.467 56.007 60.216 1.00 42.36 ? 416 TYR A CA 1 ATOM 624 C C . TYR A 1 92 ? 17.194 56.104 61.052 1.00 43.68 ? 416 TYR A C 1 ATOM 625 O O . TYR A 1 92 ? 17.165 55.704 62.206 1.00 44.25 ? 416 TYR A O 1 ATOM 626 C CB . TYR A 1 92 ? 18.508 54.734 59.350 1.00 42.01 ? 416 TYR A CB 1 ATOM 627 C CG . TYR A 1 92 ? 19.743 54.649 58.455 1.00 41.46 ? 416 TYR A CG 1 ATOM 628 C CD1 . TYR A 1 92 ? 20.979 54.296 58.984 1.00 40.76 ? 416 TYR A CD1 1 ATOM 629 C CD2 . TYR A 1 92 ? 19.679 54.960 57.104 1.00 40.82 ? 416 TYR A CD2 1 ATOM 630 C CE1 . TYR A 1 92 ? 22.099 54.222 58.194 1.00 41.35 ? 416 TYR A CE1 1 ATOM 631 C CE2 . TYR A 1 92 ? 20.819 54.903 56.299 1.00 41.47 ? 416 TYR A CE2 1 ATOM 632 C CZ . TYR A 1 92 ? 22.032 54.538 56.857 1.00 41.96 ? 416 TYR A CZ 1 ATOM 633 O OH . TYR A 1 92 ? 23.202 54.446 56.101 1.00 43.36 ? 416 TYR A OH 1 ATOM 634 N N . GLN A 1 93 ? 16.152 56.688 60.481 1.00 45.10 ? 417 GLN A N 1 ATOM 635 C CA . GLN A 1 93 ? 14.958 56.969 61.247 1.00 47.66 ? 417 GLN A CA 1 ATOM 636 C C . GLN A 1 93 ? 13.751 56.496 60.469 1.00 49.42 ? 417 GLN A C 1 ATOM 637 O O . GLN A 1 93 ? 13.615 56.775 59.273 1.00 49.66 ? 417 GLN A O 1 ATOM 638 C CB . GLN A 1 93 ? 14.841 58.472 61.544 1.00 48.79 ? 417 GLN A CB 1 ATOM 639 C CG . GLN A 1 93 ? 16.120 59.108 62.102 1.00 49.55 ? 417 GLN A CG 1 ATOM 640 C CD . GLN A 1 93 ? 16.188 60.623 61.935 1.00 51.27 ? 417 GLN A CD 1 ATOM 641 O OE1 . GLN A 1 93 ? 16.903 61.291 62.687 1.00 52.92 ? 417 GLN A OE1 1 ATOM 642 N NE2 . GLN A 1 93 ? 15.464 61.171 60.951 1.00 50.59 ? 417 GLN A NE2 1 ATOM 643 N N . CYS A 1 94 ? 12.893 55.755 61.163 1.00 51.82 ? 418 CYS A N 1 ATOM 644 C CA . CYS A 1 94 ? 11.588 55.364 60.660 1.00 53.11 ? 418 CYS A CA 1 ATOM 645 C C . CYS A 1 94 ? 10.482 56.111 61.391 1.00 54.47 ? 418 CYS A C 1 ATOM 646 O O . CYS A 1 94 ? 10.388 56.052 62.614 1.00 53.65 ? 418 CYS A O 1 ATOM 647 C CB . CYS A 1 94 ? 11.391 53.855 60.819 1.00 53.42 ? 418 CYS A CB 1 ATOM 648 S SG . CYS A 1 94 ? 9.738 53.282 60.328 1.00 53.74 ? 418 CYS A SG 1 ATOM 649 N N . ARG A 1 95 ? 9.651 56.819 60.632 1.00 57.47 ? 419 ARG A N 1 ATOM 650 C CA . ARG A 1 95 ? 8.490 57.505 61.188 1.00 59.52 ? 419 ARG A CA 1 ATOM 651 C C . ARG A 1 95 ? 7.208 56.792 60.791 1.00 60.93 ? 419 ARG A C 1 ATOM 652 O O . ARG A 1 95 ? 6.973 56.523 59.616 1.00 60.26 ? 419 ARG A O 1 ATOM 653 C CB . ARG A 1 95 ? 8.433 58.955 60.713 1.00 60.63 ? 419 ARG A CB 1 ATOM 654 C CG . ARG A 1 95 ? 7.412 59.782 61.468 1.00 61.63 ? 419 ARG A CG 1 ATOM 655 C CD . ARG A 1 95 ? 7.697 61.269 61.372 1.00 62.83 ? 419 ARG A CD 1 ATOM 656 N NE . ARG A 1 95 ? 6.976 62.029 62.392 1.00 63.50 ? 419 ARG A NE 1 ATOM 657 C CZ . ARG A 1 95 ? 7.205 63.307 62.674 1.00 64.36 ? 419 ARG A CZ 1 ATOM 658 N NH1 . ARG A 1 95 ? 8.137 63.976 62.008 1.00 65.12 ? 419 ARG A NH1 1 ATOM 659 N NH2 . ARG A 1 95 ? 6.503 63.921 63.621 1.00 64.39 ? 419 ARG A NH2 1 ATOM 660 N N . VAL A 1 96 ? 6.386 56.488 61.788 1.00 63.33 ? 420 VAL A N 1 ATOM 661 C CA . VAL A 1 96 ? 5.121 55.797 61.573 1.00 65.12 ? 420 VAL A CA 1 ATOM 662 C C . VAL A 1 96 ? 3.941 56.754 61.790 1.00 66.84 ? 420 VAL A C 1 ATOM 663 O O . VAL A 1 96 ? 3.758 57.308 62.880 1.00 66.63 ? 420 VAL A O 1 ATOM 664 C CB . VAL A 1 96 ? 5.001 54.577 62.509 1.00 64.82 ? 420 VAL A CB 1 ATOM 665 C CG1 . VAL A 1 96 ? 3.767 53.766 62.166 1.00 64.57 ? 420 VAL A CG1 1 ATOM 666 C CG2 . VAL A 1 96 ? 6.270 53.727 62.430 1.00 64.28 ? 420 VAL A CG2 1 ATOM 667 N N . THR A 1 97 ? 3.163 56.955 60.729 1.00 69.07 ? 421 THR A N 1 ATOM 668 C CA . THR A 1 97 ? 1.976 57.802 60.765 1.00 70.55 ? 421 THR A CA 1 ATOM 669 C C . THR A 1 97 ? 0.724 56.942 60.641 1.00 72.20 ? 421 THR A C 1 ATOM 670 O O . THR A 1 97 ? 0.573 56.189 59.679 1.00 72.19 ? 421 THR A O 1 ATOM 671 C CB . THR A 1 97 ? 1.974 58.811 59.606 1.00 70.53 ? 421 THR A CB 1 ATOM 672 O OG1 . THR A 1 97 ? 3.272 59.406 59.488 1.00 70.41 ? 421 THR A OG1 1 ATOM 673 C CG2 . THR A 1 97 ? 0.932 59.901 59.847 1.00 71.02 ? 421 THR A CG2 1 ATOM 674 N N . HIS A 1 98 ? -0.172 57.067 61.615 1.00 74.36 ? 422 HIS A N 1 ATOM 675 C CA . HIS A 1 98 ? -1.401 56.281 61.637 1.00 75.98 ? 422 HIS A CA 1 ATOM 676 C C . HIS A 1 98 ? -2.609 57.216 61.744 1.00 76.92 ? 422 HIS A C 1 ATOM 677 O O . HIS A 1 98 ? -2.549 58.226 62.453 1.00 76.89 ? 422 HIS A O 1 ATOM 678 C CB . HIS A 1 98 ? -1.372 55.295 62.811 1.00 76.54 ? 422 HIS A CB 1 ATOM 679 C CG . HIS A 1 98 ? -2.355 54.170 62.684 1.00 77.13 ? 422 HIS A CG 1 ATOM 680 N ND1 . HIS A 1 98 ? -3.697 54.317 62.968 1.00 77.30 ? 422 HIS A ND1 1 ATOM 681 C CD2 . HIS A 1 98 ? -2.190 52.879 62.309 1.00 77.32 ? 422 HIS A CD2 1 ATOM 682 C CE1 . HIS A 1 98 ? -4.317 53.167 62.767 1.00 77.40 ? 422 HIS A CE1 1 ATOM 683 N NE2 . HIS A 1 98 ? -3.424 52.278 62.369 1.00 77.57 ? 422 HIS A NE2 1 ATOM 684 N N . PRO A 1 99 ? -3.701 56.895 61.020 1.00 77.88 ? 423 PRO A N 1 ATOM 685 C CA . PRO A 1 99 ? -4.925 57.699 61.067 1.00 78.42 ? 423 PRO A CA 1 ATOM 686 C C . PRO A 1 99 ? -5.544 57.781 62.462 1.00 79.05 ? 423 PRO A C 1 ATOM 687 O O . PRO A 1 99 ? -5.802 58.879 62.956 1.00 78.71 ? 423 PRO A O 1 ATOM 688 C CB . PRO A 1 99 ? -5.867 56.964 60.106 1.00 78.38 ? 423 PRO A CB 1 ATOM 689 C CG . PRO A 1 99 ? -4.970 56.222 59.178 1.00 78.20 ? 423 PRO A CG 1 ATOM 690 C CD . PRO A 1 99 ? -3.780 55.833 59.998 1.00 78.04 ? 423 PRO A CD 1 ATOM 691 N N . HIS A 1 100 ? -5.774 56.625 63.082 1.00 80.00 ? 424 HIS A N 1 ATOM 692 C CA . HIS A 1 100 ? -6.374 56.559 64.413 1.00 80.85 ? 424 HIS A CA 1 ATOM 693 C C . HIS A 1 100 ? -5.512 57.251 65.469 1.00 81.14 ? 424 HIS A C 1 ATOM 694 O O . HIS A 1 100 ? -5.990 58.129 66.188 1.00 81.45 ? 424 HIS A O 1 ATOM 695 C CB . HIS A 1 100 ? -6.624 55.103 64.830 1.00 81.13 ? 424 HIS A CB 1 ATOM 696 C CG . HIS A 1 100 ? -7.806 54.470 64.160 1.00 81.37 ? 424 HIS A CG 1 ATOM 697 N ND1 . HIS A 1 100 ? -9.071 55.015 64.208 1.00 81.51 ? 424 HIS A ND1 1 ATOM 698 C CD2 . HIS A 1 100 ? -7.918 53.323 63.448 1.00 81.49 ? 424 HIS A CD2 1 ATOM 699 C CE1 . HIS A 1 100 ? -9.909 54.240 63.543 1.00 81.62 ? 424 HIS A CE1 1 ATOM 700 N NE2 . HIS A 1 100 ? -9.234 53.206 63.071 1.00 81.54 ? 424 HIS A NE2 1 ATOM 701 N N . LEU A 1 101 ? -4.246 56.854 65.560 1.00 81.48 ? 425 LEU A N 1 ATOM 702 C CA . LEU A 1 101 ? -3.335 57.397 66.568 1.00 81.71 ? 425 LEU A CA 1 ATOM 703 C C . LEU A 1 101 ? -3.057 58.884 66.336 1.00 81.69 ? 425 LEU A C 1 ATOM 704 O O . LEU A 1 101 ? -3.182 59.367 65.209 1.00 81.95 ? 425 LEU A O 1 ATOM 705 C CB . LEU A 1 101 ? -2.013 56.622 66.570 1.00 81.89 ? 425 LEU A CB 1 ATOM 706 C CG . LEU A 1 101 ? -2.080 55.125 66.897 1.00 81.94 ? 425 LEU A CG 1 ATOM 707 C CD1 . LEU A 1 101 ? -0.703 54.488 66.730 1.00 81.92 ? 425 LEU A CD1 1 ATOM 708 C CD2 . LEU A 1 101 ? -2.629 54.876 68.300 1.00 81.82 ? 425 LEU A CD2 1 ATOM 709 N N . PRO A 1 102 ? -2.671 59.615 67.399 1.00 81.46 ? 426 PRO A N 1 ATOM 710 C CA . PRO A 1 102 ? -2.414 61.058 67.306 1.00 81.10 ? 426 PRO A CA 1 ATOM 711 C C . PRO A 1 102 ? -1.231 61.448 66.412 1.00 80.63 ? 426 PRO A C 1 ATOM 712 O O . PRO A 1 102 ? -0.481 62.365 66.759 1.00 80.49 ? 426 PRO A O 1 ATOM 713 C CB . PRO A 1 102 ? -2.130 61.463 68.760 1.00 81.19 ? 426 PRO A CB 1 ATOM 714 C CG . PRO A 1 102 ? -2.734 60.390 69.591 1.00 81.28 ? 426 PRO A CG 1 ATOM 715 C CD . PRO A 1 102 ? -2.578 59.135 68.790 1.00 81.37 ? 426 PRO A CD 1 ATOM 716 N N . ARG A 1 103 ? -1.088 60.766 65.274 1.00 79.96 ? 427 ARG A N 1 ATOM 717 C CA . ARG A 1 103 ? -0.090 61.092 64.248 1.00 79.29 ? 427 ARG A CA 1 ATOM 718 C C . ARG A 1 103 ? 1.271 61.534 64.805 1.00 78.02 ? 427 ARG A C 1 ATOM 719 O O . ARG A 1 103 ? 1.604 62.722 64.786 1.00 78.17 ? 427 ARG A O 1 ATOM 720 C CB . ARG A 1 103 ? -0.657 62.149 63.284 1.00 79.67 ? 427 ARG A CB 1 ATOM 721 C CG . ARG A 1 103 ? -1.354 63.332 63.964 1.00 79.94 ? 427 ARG A CG 1 ATOM 722 C CD . ARG A 1 103 ? -2.204 64.144 62.996 1.00 80.14 ? 427 ARG A CD 1 ATOM 723 N NE . ARG A 1 103 ? -1.407 64.787 61.953 1.00 80.36 ? 427 ARG A NE 1 ATOM 724 C CZ . ARG A 1 103 ? -1.900 65.624 61.045 1.00 80.46 ? 427 ARG A CZ 1 ATOM 725 N NH1 . ARG A 1 103 ? -3.192 65.925 61.047 1.00 80.51 ? 427 ARG A NH1 1 ATOM 726 N NH2 . ARG A 1 103 ? -1.100 66.166 60.134 1.00 80.46 ? 427 ARG A NH2 1 ATOM 727 N N . ALA A 1 104 ? 2.058 60.574 65.289 1.00 76.13 ? 428 ALA A N 1 ATOM 728 C CA . ALA A 1 104 ? 3.396 60.860 65.810 1.00 74.44 ? 428 ALA A CA 1 ATOM 729 C C . ALA A 1 104 ? 4.025 59.622 66.447 1.00 72.85 ? 428 ALA A C 1 ATOM 730 O O . ALA A 1 104 ? 3.682 59.264 67.575 1.00 73.44 ? 428 ALA A O 1 ATOM 731 C CB . ALA A 1 104 ? 3.332 61.998 66.828 1.00 74.33 ? 428 ALA A CB 1 ATOM 732 N N . LEU A 1 105 ? 4.940 58.969 65.734 1.00 70.06 ? 429 LEU A N 1 ATOM 733 C CA . LEU A 1 105 ? 5.660 57.810 66.278 1.00 68.16 ? 429 LEU A CA 1 ATOM 734 C C . LEU A 1 105 ? 6.993 57.576 65.546 1.00 65.71 ? 429 LEU A C 1 ATOM 735 O O . LEU A 1 105 ? 7.021 57.400 64.330 1.00 65.40 ? 429 LEU A O 1 ATOM 736 C CB . LEU A 1 105 ? 4.781 56.557 66.211 1.00 68.32 ? 429 LEU A CB 1 ATOM 737 C CG . LEU A 1 105 ? 5.136 55.421 67.179 1.00 68.51 ? 429 LEU A CG 1 ATOM 738 C CD1 . LEU A 1 105 ? 4.145 54.261 67.065 1.00 68.35 ? 429 LEU A CD1 1 ATOM 739 C CD2 . LEU A 1 105 ? 6.560 54.924 66.947 1.00 68.63 ? 429 LEU A CD2 1 ATOM 740 N N . MET A 1 106 ? 8.097 57.566 66.286 1.00 63.21 ? 430 MET A N 1 ATOM 741 C CA . MET A 1 106 ? 9.425 57.539 65.669 1.00 61.44 ? 430 MET A CA 1 ATOM 742 C C . MET A 1 106 ? 10.379 56.486 66.234 1.00 58.01 ? 430 MET A C 1 ATOM 743 O O . MET A 1 106 ? 10.497 56.314 67.439 1.00 56.78 ? 430 MET A O 1 ATOM 744 C CB . MET A 1 106 ? 10.065 58.918 65.789 1.00 62.77 ? 430 MET A CB 1 ATOM 745 C CG . MET A 1 106 ? 9.225 60.011 65.145 1.00 64.41 ? 430 MET A CG 1 ATOM 746 S SD . MET A 1 106 ? 10.256 61.374 64.595 1.00 66.55 ? 430 MET A SD 1 ATOM 747 C CE . MET A 1 106 ? 11.461 60.475 63.581 1.00 66.73 ? 430 MET A CE 1 ATOM 748 N N . ARG A 1 107 ? 11.069 55.783 65.344 1.00 55.20 ? 431 ARG A N 1 ATOM 749 C CA . ARG A 1 107 ? 12.069 54.795 65.747 1.00 52.48 ? 431 ARG A CA 1 ATOM 750 C C . ARG A 1 107 ? 13.389 55.099 65.041 1.00 49.48 ? 431 ARG A C 1 ATOM 751 O O . ARG A 1 107 ? 13.410 55.495 63.881 1.00 47.83 ? 431 ARG A O 1 ATOM 752 C CB . ARG A 1 107 ? 11.604 53.372 65.405 1.00 53.22 ? 431 ARG A CB 1 ATOM 753 C CG . ARG A 1 107 ? 10.350 52.897 66.129 1.00 53.89 ? 431 ARG A CG 1 ATOM 754 C CD . ARG A 1 107 ? 10.615 52.542 67.587 1.00 54.31 ? 431 ARG A CD 1 ATOM 755 N NE . ARG A 1 107 ? 10.156 53.587 68.496 1.00 55.36 ? 431 ARG A NE 1 ATOM 756 C CZ . ARG A 1 107 ? 8.913 53.698 68.961 1.00 55.56 ? 431 ARG A CZ 1 ATOM 757 N NH1 . ARG A 1 107 ? 7.974 52.831 68.619 1.00 55.99 ? 431 ARG A NH1 1 ATOM 758 N NH2 . ARG A 1 107 ? 8.603 54.689 69.777 1.00 56.04 ? 431 ARG A NH2 1 ATOM 759 N N . SER A 1 108 ? 14.503 54.937 65.738 1.00 47.06 ? 432 SER A N 1 ATOM 760 C CA . SER A 1 108 ? 15.792 55.190 65.101 1.00 45.91 ? 432 SER A CA 1 ATOM 761 C C . SER A 1 108 ? 16.827 54.099 65.366 1.00 43.88 ? 432 SER A C 1 ATOM 762 O O . SER A 1 108 ? 16.777 53.394 66.373 1.00 42.70 ? 432 SER A O 1 ATOM 763 C CB . SER A 1 108 ? 16.346 56.559 65.501 1.00 46.83 ? 432 SER A CB 1 ATOM 764 O OG . SER A 1 108 ? 16.610 56.608 66.880 1.00 49.15 ? 432 SER A OG 1 ATOM 765 N N . THR A 1 109 ? 17.779 53.970 64.445 1.00 41.05 ? 433 THR A N 1 ATOM 766 C CA . THR A 1 109 ? 18.818 52.970 64.590 1.00 39.74 ? 433 THR A CA 1 ATOM 767 C C . THR A 1 109 ? 20.188 53.435 64.067 1.00 39.11 ? 433 THR A C 1 ATOM 768 O O . THR A 1 109 ? 20.298 54.271 63.147 1.00 39.58 ? 433 THR A O 1 ATOM 769 C CB . THR A 1 109 ? 18.395 51.647 63.904 1.00 40.25 ? 433 THR A CB 1 ATOM 770 O OG1 . THR A 1 109 ? 19.300 50.608 64.283 1.00 39.54 ? 433 THR A OG1 1 ATOM 771 C CG2 . THR A 1 109 ? 18.341 51.798 62.380 1.00 39.35 ? 433 THR A CG2 1 ATOM 772 N N . THR A 1 110 ? 21.231 52.914 64.698 1.00 36.14 ? 434 THR A N 1 ATOM 773 C CA . THR A 1 110 ? 22.599 53.216 64.335 1.00 34.62 ? 434 THR A CA 1 ATOM 774 C C . THR A 1 110 ? 23.449 52.116 64.936 1.00 35.01 ? 434 THR A C 1 ATOM 775 O O . THR A 1 110 ? 22.997 51.396 65.838 1.00 33.49 ? 434 THR A O 1 ATOM 776 C CB . THR A 1 110 ? 23.040 54.606 64.893 1.00 34.56 ? 434 THR A CB 1 ATOM 777 O OG1 . THR A 1 110 ? 24.396 54.892 64.522 1.00 32.71 ? 434 THR A OG1 1 ATOM 778 C CG2 . THR A 1 110 ? 22.912 54.635 66.399 1.00 33.43 ? 434 THR A CG2 1 ATOM 779 N N . LYS A 1 111 ? 24.678 52.002 64.441 1.00 36.81 ? 435 LYS A N 1 ATOM 780 C CA . LYS A 1 111 ? 25.605 50.992 64.905 1.00 38.85 ? 435 LYS A CA 1 ATOM 781 C C . LYS A 1 111 ? 25.904 51.194 66.387 1.00 40.53 ? 435 LYS A C 1 ATOM 782 O O . LYS A 1 111 ? 26.019 52.325 66.873 1.00 40.49 ? 435 LYS A O 1 ATOM 783 C CB . LYS A 1 111 ? 26.888 51.008 64.069 1.00 39.41 ? 435 LYS A CB 1 ATOM 784 C CG . LYS A 1 111 ? 27.789 52.180 64.355 1.00 41.18 ? 435 LYS A CG 1 ATOM 785 C CD . LYS A 1 111 ? 29.242 51.834 64.075 1.00 42.39 ? 435 LYS A CD 1 ATOM 786 C CE . LYS A 1 111 ? 30.134 53.018 64.342 1.00 43.14 ? 435 LYS A CE 1 ATOM 787 N NZ . LYS A 1 111 ? 31.508 52.705 63.836 1.00 45.16 ? 435 LYS A NZ 1 ATOM 788 N N . THR A 1 112 ? 26.019 50.088 67.114 1.00 42.04 ? 436 THR A N 1 ATOM 789 C CA . THR A 1 112 ? 26.264 50.171 68.548 1.00 42.11 ? 436 THR A CA 1 ATOM 790 C C . THR A 1 112 ? 27.666 50.686 68.765 1.00 42.72 ? 436 THR A C 1 ATOM 791 O O . THR A 1 112 ? 28.553 50.461 67.945 1.00 41.69 ? 436 THR A O 1 ATOM 792 C CB . THR A 1 112 ? 26.096 48.807 69.245 1.00 41.92 ? 436 THR A CB 1 ATOM 793 O OG1 . THR A 1 112 ? 24.757 48.347 69.032 1.00 42.71 ? 436 THR A OG1 1 ATOM 794 C CG2 . THR A 1 112 ? 26.359 48.920 70.750 1.00 41.24 ? 436 THR A CG2 1 ATOM 795 N N . SER A 1 113 ? 27.849 51.390 69.875 1.00 44.82 ? 437 SER A N 1 ATOM 796 C CA . SER A 1 113 ? 29.148 51.922 70.235 1.00 46.56 ? 437 SER A CA 1 ATOM 797 C C . SER A 1 113 ? 29.734 51.055 71.338 1.00 46.56 ? 437 SER A C 1 ATOM 798 O O . SER A 1 113 ? 29.051 50.189 71.883 1.00 48.63 ? 437 SER A O 1 ATOM 799 C CB . SER A 1 113 ? 29.017 53.382 70.690 1.00 47.68 ? 437 SER A CB 1 ATOM 800 O OG . SER A 1 113 ? 27.955 53.540 71.628 1.00 48.61 ? 437 SER A OG 1 ATOM 801 N N . GLY A 1 114 ? 31.009 51.265 71.643 1.00 46.05 ? 438 GLY A N 1 ATOM 802 C CA . GLY A 1 114 ? 31.630 50.611 72.786 1.00 44.31 ? 438 GLY A CA 1 ATOM 803 C C . GLY A 1 114 ? 32.827 49.788 72.376 1.00 43.09 ? 438 GLY A C 1 ATOM 804 O O . GLY A 1 114 ? 33.226 49.774 71.210 1.00 42.77 ? 438 GLY A O 1 ATOM 805 N N . PRO A 1 115 ? 33.436 49.109 73.351 1.00 41.45 ? 439 PRO A N 1 ATOM 806 C CA . PRO A 1 115 ? 34.558 48.230 73.021 1.00 40.82 ? 439 PRO A CA 1 ATOM 807 C C . PRO A 1 115 ? 34.143 47.139 72.028 1.00 40.25 ? 439 PRO A C 1 ATOM 808 O O . PRO A 1 115 ? 32.949 46.829 71.925 1.00 38.44 ? 439 PRO A O 1 ATOM 809 C CB . PRO A 1 115 ? 34.939 47.625 74.377 1.00 40.44 ? 439 PRO A CB 1 ATOM 810 C CG . PRO A 1 115 ? 34.413 48.568 75.378 1.00 40.53 ? 439 PRO A CG 1 ATOM 811 C CD . PRO A 1 115 ? 33.172 49.170 74.795 1.00 40.63 ? 439 PRO A CD 1 ATOM 812 N N . ARG A 1 116 ? 35.114 46.635 71.264 1.00 39.96 ? 440 ARG A N 1 ATOM 813 C CA . ARG A 1 116 ? 34.922 45.515 70.365 1.00 39.77 ? 440 ARG A CA 1 ATOM 814 C C . ARG A 1 116 ? 35.648 44.307 70.965 1.00 39.50 ? 440 ARG A C 1 ATOM 815 O O . ARG A 1 116 ? 36.718 44.450 71.578 1.00 40.71 ? 440 ARG A O 1 ATOM 816 C CB . ARG A 1 116 ? 35.496 45.789 68.969 1.00 41.21 ? 440 ARG A CB 1 ATOM 817 C CG . ARG A 1 116 ? 35.252 47.170 68.364 1.00 41.92 ? 440 ARG A CG 1 ATOM 818 C CD . ARG A 1 116 ? 33.889 47.327 67.701 1.00 41.87 ? 440 ARG A CD 1 ATOM 819 N NE . ARG A 1 116 ? 32.919 47.899 68.623 1.00 42.25 ? 440 ARG A NE 1 ATOM 820 C CZ . ARG A 1 116 ? 31.738 48.403 68.276 1.00 42.78 ? 440 ARG A CZ 1 ATOM 821 N NH1 . ARG A 1 116 ? 31.345 48.419 67.006 1.00 43.01 ? 440 ARG A NH1 1 ATOM 822 N NH2 . ARG A 1 116 ? 30.940 48.900 69.213 1.00 43.12 ? 440 ARG A NH2 1 ATOM 823 N N . ALA A 1 117 ? 35.087 43.114 70.790 1.00 38.02 ? 441 ALA A N 1 ATOM 824 C CA . ALA A 1 117 ? 35.766 41.877 71.214 1.00 36.99 ? 441 ALA A CA 1 ATOM 825 C C . ALA A 1 117 ? 35.342 40.724 70.316 1.00 36.13 ? 441 ALA A C 1 ATOM 826 O O . ALA A 1 117 ? 34.172 40.607 69.983 1.00 35.66 ? 441 ALA A O 1 ATOM 827 C CB . ALA A 1 117 ? 35.475 41.559 72.677 1.00 35.84 ? 441 ALA A CB 1 ATOM 828 N N . ALA A 1 118 ? 36.301 39.902 69.902 1.00 36.19 ? 442 ALA A N 1 ATOM 829 C CA . ALA A 1 118 ? 36.040 38.800 68.984 1.00 36.68 ? 442 ALA A CA 1 ATOM 830 C C . ALA A 1 118 ? 35.406 37.616 69.715 1.00 37.34 ? 442 ALA A C 1 ATOM 831 O O . ALA A 1 118 ? 35.749 37.326 70.873 1.00 37.98 ? 442 ALA A O 1 ATOM 832 C CB . ALA A 1 118 ? 37.332 38.363 68.293 1.00 37.05 ? 442 ALA A CB 1 ATOM 833 N N . PRO A 1 119 ? 34.481 36.922 69.034 1.00 37.07 ? 443 PRO A N 1 ATOM 834 C CA . PRO A 1 119 ? 33.826 35.764 69.621 1.00 36.94 ? 443 PRO A CA 1 ATOM 835 C C . PRO A 1 119 ? 34.721 34.529 69.740 1.00 36.02 ? 443 PRO A C 1 ATOM 836 O O . PRO A 1 119 ? 35.517 34.230 68.857 1.00 34.53 ? 443 PRO A O 1 ATOM 837 C CB . PRO A 1 119 ? 32.648 35.509 68.671 1.00 37.29 ? 443 PRO A CB 1 ATOM 838 C CG . PRO A 1 119 ? 33.032 36.105 67.379 1.00 37.45 ? 443 PRO A CG 1 ATOM 839 C CD . PRO A 1 119 ? 33.992 37.217 67.675 1.00 37.65 ? 443 PRO A CD 1 ATOM 840 N N . GLU A 1 120 ? 34.575 33.817 70.850 1.00 36.15 ? 444 GLU A N 1 ATOM 841 C CA . GLU A 1 120 ? 35.122 32.476 70.971 1.00 34.51 ? 444 GLU A CA 1 ATOM 842 C C . GLU A 1 120 ? 34.035 31.519 70.494 1.00 34.47 ? 444 GLU A C 1 ATOM 843 O O . GLU A 1 120 ? 32.855 31.672 70.820 1.00 33.60 ? 444 GLU A O 1 ATOM 844 C CB . GLU A 1 120 ? 35.492 32.199 72.412 1.00 34.41 ? 444 GLU A CB 1 ATOM 845 C CG . GLU A 1 120 ? 36.245 33.329 73.063 1.00 33.86 ? 444 GLU A CG 1 ATOM 846 C CD . GLU A 1 120 ? 36.420 33.130 74.547 1.00 34.01 ? 444 GLU A CD 1 ATOM 847 O OE1 . GLU A 1 120 ? 36.121 32.028 75.062 1.00 34.99 ? 444 GLU A OE1 1 ATOM 848 O OE2 . GLU A 1 120 ? 36.857 34.092 75.204 1.00 34.94 ? 444 GLU A OE2 1 ATOM 849 N N . VAL A 1 121 ? 34.435 30.548 69.684 1.00 34.74 ? 445 VAL A N 1 ATOM 850 C CA . VAL A 1 121 ? 33.498 29.587 69.134 1.00 34.13 ? 445 VAL A CA 1 ATOM 851 C C . VAL A 1 121 ? 33.886 28.183 69.601 1.00 33.73 ? 445 VAL A C 1 ATOM 852 O O . VAL A 1 121 ? 35.022 27.761 69.467 1.00 33.43 ? 445 VAL A O 1 ATOM 853 C CB . VAL A 1 121 ? 33.489 29.619 67.593 1.00 34.23 ? 445 VAL A CB 1 ATOM 854 C CG1 . VAL A 1 121 ? 32.434 28.653 67.069 1.00 33.53 ? 445 VAL A CG1 1 ATOM 855 C CG2 . VAL A 1 121 ? 33.300 31.053 67.067 1.00 33.68 ? 445 VAL A CG2 1 ATOM 856 N N . TYR A 1 122 ? 32.919 27.471 70.162 1.00 33.69 ? 446 TYR A N 1 ATOM 857 C CA . TYR A 1 122 ? 33.063 26.084 70.570 1.00 32.24 ? 446 TYR A CA 1 ATOM 858 C C . TYR A 1 122 ? 31.895 25.266 70.013 1.00 32.06 ? 446 TYR A C 1 ATOM 859 O O . TYR A 1 122 ? 30.738 25.677 70.093 1.00 33.16 ? 446 TYR A O 1 ATOM 860 C CB . TYR A 1 122 ? 33.094 25.952 72.104 1.00 31.58 ? 446 TYR A CB 1 ATOM 861 C CG . TYR A 1 122 ? 34.033 26.902 72.785 1.00 32.05 ? 446 TYR A CG 1 ATOM 862 C CD1 . TYR A 1 122 ? 33.602 28.139 73.235 1.00 32.47 ? 446 TYR A CD1 1 ATOM 863 C CD2 . TYR A 1 122 ? 35.382 26.580 72.937 1.00 32.89 ? 446 TYR A CD2 1 ATOM 864 C CE1 . TYR A 1 122 ? 34.484 29.016 73.849 1.00 33.35 ? 446 TYR A CE1 1 ATOM 865 C CE2 . TYR A 1 122 ? 36.261 27.442 73.534 1.00 32.13 ? 446 TYR A CE2 1 ATOM 866 C CZ . TYR A 1 122 ? 35.816 28.657 73.995 1.00 33.44 ? 446 TYR A CZ 1 ATOM 867 O OH . TYR A 1 122 ? 36.716 29.512 74.603 1.00 34.96 ? 446 TYR A OH 1 ATOM 868 N N . ALA A 1 123 ? 32.216 24.103 69.464 1.00 31.23 ? 447 ALA A N 1 ATOM 869 C CA . ALA A 1 123 ? 31.242 23.226 68.821 1.00 30.91 ? 447 ALA A CA 1 ATOM 870 C C . ALA A 1 123 ? 31.331 21.823 69.433 1.00 30.90 ? 447 ALA A C 1 ATOM 871 O O . ALA A 1 123 ? 32.422 21.295 69.647 1.00 31.03 ? 447 ALA A O 1 ATOM 872 C CB . ALA A 1 123 ? 31.477 23.150 67.293 1.00 31.53 ? 447 ALA A CB 1 ATOM 873 N N . PHE A 1 124 ? 30.163 21.248 69.711 1.00 30.06 ? 448 PHE A N 1 ATOM 874 C CA . PHE A 1 124 ? 30.021 19.960 70.365 1.00 30.27 ? 448 PHE A CA 1 ATOM 875 C C . PHE A 1 124 ? 29.001 19.052 69.637 1.00 29.82 ? 448 PHE A C 1 ATOM 876 O O . PHE A 1 124 ? 28.071 19.523 68.990 1.00 29.06 ? 448 PHE A O 1 ATOM 877 C CB . PHE A 1 124 ? 29.535 20.141 71.822 1.00 30.00 ? 448 PHE A CB 1 ATOM 878 C CG . PHE A 1 124 ? 30.337 21.126 72.633 1.00 31.01 ? 448 PHE A CG 1 ATOM 879 C CD1 . PHE A 1 124 ? 29.954 22.456 72.711 1.00 30.65 ? 448 PHE A CD1 1 ATOM 880 C CD2 . PHE A 1 124 ? 31.472 20.723 73.314 1.00 31.25 ? 448 PHE A CD2 1 ATOM 881 C CE1 . PHE A 1 124 ? 30.695 23.372 73.431 1.00 31.11 ? 448 PHE A CE1 1 ATOM 882 C CE2 . PHE A 1 124 ? 32.204 21.631 74.047 1.00 30.98 ? 448 PHE A CE2 1 ATOM 883 C CZ . PHE A 1 124 ? 31.811 22.955 74.107 1.00 31.56 ? 448 PHE A CZ 1 ATOM 884 N N . ALA A 1 125 ? 29.149 17.744 69.828 1.00 30.45 ? 449 ALA A N 1 ATOM 885 C CA . ALA A 1 125 ? 28.218 16.729 69.328 1.00 30.05 ? 449 ALA A CA 1 ATOM 886 C C . ALA A 1 125 ? 27.672 15.897 70.491 1.00 30.36 ? 449 ALA A C 1 ATOM 887 O O . ALA A 1 125 ? 28.432 15.456 71.364 1.00 29.11 ? 449 ALA A O 1 ATOM 888 C CB . ALA A 1 125 ? 28.909 15.805 68.348 1.00 31.17 ? 449 ALA A CB 1 ATOM 889 N N . THR A 1 126 ? 26.352 15.678 70.489 1.00 29.67 ? 450 THR A N 1 ATOM 890 C CA . THR A 1 126 ? 25.734 14.876 71.519 1.00 29.94 ? 450 THR A CA 1 ATOM 891 C C . THR A 1 126 ? 26.026 13.416 71.193 1.00 29.57 ? 450 THR A C 1 ATOM 892 O O . THR A 1 126 ? 26.208 13.039 70.025 1.00 30.16 ? 450 THR A O 1 ATOM 893 C CB . THR A 1 126 ? 24.183 15.089 71.671 1.00 31.18 ? 450 THR A CB 1 ATOM 894 O OG1 . THR A 1 126 ? 23.497 14.671 70.477 1.00 31.04 ? 450 THR A OG1 1 ATOM 895 C CG2 . THR A 1 126 ? 23.846 16.543 71.997 1.00 29.84 ? 450 THR A CG2 1 ATOM 896 N N . PRO A 1 127 ? 26.127 12.593 72.240 1.00 28.66 ? 451 PRO A N 1 ATOM 897 C CA . PRO A 1 127 ? 26.138 11.147 72.031 1.00 29.14 ? 451 PRO A CA 1 ATOM 898 C C . PRO A 1 127 ? 24.746 10.610 71.760 1.00 29.81 ? 451 PRO A C 1 ATOM 899 O O . PRO A 1 127 ? 23.760 11.319 71.940 1.00 29.30 ? 451 PRO A O 1 ATOM 900 C CB . PRO A 1 127 ? 26.659 10.603 73.363 1.00 28.36 ? 451 PRO A CB 1 ATOM 901 C CG . PRO A 1 127 ? 26.280 11.601 74.361 1.00 28.40 ? 451 PRO A CG 1 ATOM 902 C CD . PRO A 1 127 ? 26.310 12.955 73.662 1.00 28.00 ? 451 PRO A CD 1 ATOM 903 N N . GLU A 1 128 ? 24.680 9.344 71.364 1.00 31.84 ? 452 GLU A N 1 ATOM 904 C CA . GLU A 1 128 ? 23.426 8.688 71.053 1.00 33.00 ? 452 GLU A CA 1 ATOM 905 C C . GLU A 1 128 ? 22.533 8.616 72.291 1.00 34.08 ? 452 GLU A C 1 ATOM 906 O O . GLU A 1 128 ? 23.007 8.390 73.409 1.00 34.62 ? 452 GLU A O 1 ATOM 907 C CB . GLU A 1 128 ? 23.689 7.295 70.476 1.00 34.35 ? 452 GLU A CB 1 ATOM 908 C CG . GLU A 1 128 ? 22.423 6.613 70.055 1.00 35.33 ? 452 GLU A CG 1 ATOM 909 C CD . GLU A 1 128 ? 22.637 5.234 69.491 1.00 36.24 ? 452 GLU A CD 1 ATOM 910 O OE1 . GLU A 1 128 ? 22.045 4.296 70.066 1.00 36.92 ? 452 GLU A OE1 1 ATOM 911 O OE2 . GLU A 1 128 ? 23.373 5.097 68.486 1.00 38.33 ? 452 GLU A OE2 1 ATOM 912 N N . TRP A 1 129 ? 21.243 8.874 72.092 1.00 34.90 ? 453 TRP A N 1 ATOM 913 C CA . TRP A 1 129 ? 20.242 8.717 73.148 1.00 34.64 ? 453 TRP A CA 1 ATOM 914 C C . TRP A 1 129 ? 19.477 7.476 72.766 1.00 36.41 ? 453 TRP A C 1 ATOM 915 O O . TRP A 1 129 ? 19.196 7.278 71.582 1.00 36.15 ? 453 TRP A O 1 ATOM 916 C CB . TRP A 1 129 ? 19.302 9.935 73.228 1.00 34.19 ? 453 TRP A CB 1 ATOM 917 C CG . TRP A 1 129 ? 18.466 10.009 74.496 1.00 31.70 ? 453 TRP A CG 1 ATOM 918 C CD1 . TRP A 1 129 ? 17.186 9.604 74.638 1.00 31.90 ? 453 TRP A CD1 1 ATOM 919 C CD2 . TRP A 1 129 ? 18.868 10.515 75.779 1.00 31.59 ? 453 TRP A CD2 1 ATOM 920 N NE1 . TRP A 1 129 ? 16.755 9.802 75.928 1.00 31.77 ? 453 TRP A NE1 1 ATOM 921 C CE2 . TRP A 1 129 ? 17.765 10.388 76.641 1.00 31.67 ? 453 TRP A CE2 1 ATOM 922 C CE3 . TRP A 1 129 ? 20.042 11.102 76.269 1.00 31.87 ? 453 TRP A CE3 1 ATOM 923 C CZ2 . TRP A 1 129 ? 17.805 10.794 77.969 1.00 32.24 ? 453 TRP A CZ2 1 ATOM 924 C CZ3 . TRP A 1 129 ? 20.089 11.509 77.582 1.00 32.36 ? 453 TRP A CZ3 1 ATOM 925 C CH2 . TRP A 1 129 ? 18.981 11.351 78.426 1.00 32.96 ? 453 TRP A CH2 1 ATOM 926 N N . PRO A 1 130 ? 19.167 6.616 73.758 1.00 39.26 ? 454 PRO A N 1 ATOM 927 C CA . PRO A 1 130 ? 18.441 5.365 73.492 1.00 39.96 ? 454 PRO A CA 1 ATOM 928 C C . PRO A 1 130 ? 17.157 5.571 72.682 1.00 41.24 ? 454 PRO A C 1 ATOM 929 O O . PRO A 1 130 ? 16.266 6.307 73.118 1.00 42.16 ? 454 PRO A O 1 ATOM 930 C CB . PRO A 1 130 ? 18.109 4.845 74.897 1.00 39.76 ? 454 PRO A CB 1 ATOM 931 C CG . PRO A 1 130 ? 19.138 5.415 75.775 1.00 39.84 ? 454 PRO A CG 1 ATOM 932 C CD . PRO A 1 130 ? 19.526 6.754 75.184 1.00 38.99 ? 454 PRO A CD 1 ATOM 933 N N . GLY A 1 131 ? 17.081 4.932 71.512 1.00 42.03 ? 455 GLY A N 1 ATOM 934 C CA . GLY A 1 131 ? 15.925 5.046 70.616 1.00 41.50 ? 455 GLY A CA 1 ATOM 935 C C . GLY A 1 131 ? 16.103 6.043 69.479 1.00 41.76 ? 455 GLY A C 1 ATOM 936 O O . GLY A 1 131 ? 15.190 6.249 68.681 1.00 41.72 ? 455 GLY A O 1 ATOM 937 N N . SER A 1 132 ? 17.271 6.674 69.397 1.00 41.81 ? 456 SER A N 1 ATOM 938 C CA . SER A 1 132 ? 17.521 7.684 68.372 1.00 42.11 ? 456 SER A CA 1 ATOM 939 C C . SER A 1 132 ? 18.887 7.515 67.722 1.00 41.10 ? 456 SER A C 1 ATOM 940 O O . SER A 1 132 ? 19.742 8.409 67.778 1.00 39.53 ? 456 SER A O 1 ATOM 941 C CB . SER A 1 132 ? 17.418 9.092 68.957 1.00 42.77 ? 456 SER A CB 1 ATOM 942 O OG . SER A 1 132 ? 16.099 9.339 69.410 1.00 44.32 ? 456 SER A OG 1 ATOM 943 N N . ARG A 1 133 ? 19.048 6.368 67.073 1.00 40.01 ? 457 ARG A N 1 ATOM 944 C CA . ARG A 1 133 ? 20.297 5.985 66.438 1.00 39.29 ? 457 ARG A CA 1 ATOM 945 C C . ARG A 1 133 ? 20.649 6.859 65.249 1.00 36.46 ? 457 ARG A C 1 ATOM 946 O O . ARG A 1 133 ? 21.818 7.093 65.002 1.00 35.77 ? 457 ARG A O 1 ATOM 947 C CB . ARG A 1 133 ? 20.211 4.527 65.957 1.00 41.04 ? 457 ARG A CB 1 ATOM 948 C CG . ARG A 1 133 ? 20.492 3.472 67.012 1.00 42.68 ? 457 ARG A CG 1 ATOM 949 C CD . ARG A 1 133 ? 20.471 2.073 66.382 1.00 44.87 ? 457 ARG A CD 1 ATOM 950 N NE . ARG A 1 133 ? 20.730 1.011 67.356 1.00 46.30 ? 457 ARG A NE 1 ATOM 951 C CZ . ARG A 1 133 ? 20.777 -0.286 67.055 1.00 48.06 ? 457 ARG A CZ 1 ATOM 952 N NH1 . ARG A 1 133 ? 20.585 -0.704 65.807 1.00 48.27 ? 457 ARG A NH1 1 ATOM 953 N NH2 . ARG A 1 133 ? 21.028 -1.179 68.005 1.00 49.46 ? 457 ARG A NH2 1 ATOM 954 N N . ASP A 1 134 ? 19.665 7.308 64.480 1.00 35.44 ? 458 ASP A N 1 ATOM 955 C CA . ASP A 1 134 ? 19.981 7.924 63.184 1.00 36.26 ? 458 ASP A CA 1 ATOM 956 C C . ASP A 1 134 ? 19.909 9.455 63.213 1.00 37.16 ? 458 ASP A C 1 ATOM 957 O O . ASP A 1 134 ? 19.621 10.094 62.198 1.00 37.63 ? 458 ASP A O 1 ATOM 958 C CB . ASP A 1 134 ? 19.071 7.394 62.067 1.00 36.35 ? 458 ASP A CB 1 ATOM 959 C CG . ASP A 1 134 ? 19.028 5.869 61.989 1.00 36.69 ? 458 ASP A CG 1 ATOM 960 O OD1 . ASP A 1 134 ? 19.728 5.172 62.750 1.00 35.19 ? 458 ASP A OD1 1 ATOM 961 O OD2 . ASP A 1 134 ? 18.265 5.361 61.137 1.00 38.65 ? 458 ASP A OD2 1 ATOM 962 N N . LYS A 1 135 ? 20.186 10.037 64.376 1.00 38.07 ? 459 LYS A N 1 ATOM 963 C CA . LYS A 1 135 ? 20.291 11.486 64.506 1.00 38.71 ? 459 LYS A CA 1 ATOM 964 C C . LYS A 1 135 ? 21.102 11.905 65.727 1.00 36.78 ? 459 LYS A C 1 ATOM 965 O O . LYS A 1 135 ? 21.193 11.176 66.718 1.00 36.27 ? 459 LYS A O 1 ATOM 966 C CB . LYS A 1 135 ? 18.902 12.133 64.546 1.00 40.11 ? 459 LYS A CB 1 ATOM 967 C CG . LYS A 1 135 ? 18.019 11.647 65.657 1.00 41.13 ? 459 LYS A CG 1 ATOM 968 C CD . LYS A 1 135 ? 16.584 12.101 65.447 1.00 41.83 ? 459 LYS A CD 1 ATOM 969 C CE . LYS A 1 135 ? 15.781 11.864 66.716 1.00 42.95 ? 459 LYS A CE 1 ATOM 970 N NZ . LYS A 1 135 ? 14.318 12.073 66.502 1.00 44.87 ? 459 LYS A NZ 1 ATOM 971 N N . ARG A 1 136 ? 21.698 13.089 65.634 1.00 35.22 ? 460 ARG A N 1 ATOM 972 C CA . ARG A 1 136 ? 22.448 13.664 66.730 1.00 34.68 ? 460 ARG A CA 1 ATOM 973 C C . ARG A 1 136 ? 22.140 15.156 66.770 1.00 32.93 ? 460 ARG A C 1 ATOM 974 O O . ARG A 1 136 ? 21.556 15.717 65.839 1.00 32.94 ? 460 ARG A O 1 ATOM 975 C CB . ARG A 1 136 ? 23.969 13.437 66.540 1.00 35.76 ? 460 ARG A CB 1 ATOM 976 C CG . ARG A 1 136 ? 24.395 11.977 66.477 1.00 37.48 ? 460 ARG A CG 1 ATOM 977 C CD . ARG A 1 136 ? 24.427 11.283 67.818 1.00 38.30 ? 460 ARG A CD 1 ATOM 978 N NE . ARG A 1 136 ? 23.731 10.022 67.711 1.00 40.52 ? 460 ARG A NE 1 ATOM 979 C CZ . ARG A 1 136 ? 24.244 8.922 67.176 1.00 42.62 ? 460 ARG A CZ 1 ATOM 980 N NH1 . ARG A 1 136 ? 25.487 8.917 66.746 1.00 44.42 ? 460 ARG A NH1 1 ATOM 981 N NH2 . ARG A 1 136 ? 23.517 7.821 67.079 1.00 43.25 ? 460 ARG A NH2 1 ATOM 982 N N . THR A 1 137 ? 22.535 15.804 67.855 1.00 31.50 ? 461 THR A N 1 ATOM 983 C CA . THR A 1 137 ? 22.319 17.246 67.998 1.00 30.82 ? 461 THR A CA 1 ATOM 984 C C . THR A 1 137 ? 23.670 17.904 68.177 1.00 31.97 ? 461 THR A C 1 ATOM 985 O O . THR A 1 137 ? 24.503 17.475 68.982 1.00 32.18 ? 461 THR A O 1 ATOM 986 C CB . THR A 1 137 ? 21.395 17.595 69.145 1.00 28.97 ? 461 THR A CB 1 ATOM 987 O OG1 . THR A 1 137 ? 20.186 16.843 69.006 1.00 30.21 ? 461 THR A OG1 1 ATOM 988 C CG2 . THR A 1 137 ? 21.071 19.078 69.143 1.00 27.30 ? 461 THR A CG2 1 ATOM 989 N N . LEU A 1 138 ? 23.909 18.891 67.330 1.00 32.90 ? 462 LEU A N 1 ATOM 990 C CA . LEU A 1 138 ? 25.144 19.639 67.393 1.00 33.89 ? 462 LEU A CA 1 ATOM 991 C C . LEU A 1 138 ? 24.838 20.959 68.081 1.00 33.10 ? 462 LEU A C 1 ATOM 992 O O . LEU A 1 138 ? 23.831 21.620 67.806 1.00 33.48 ? 462 LEU A O 1 ATOM 993 C CB . LEU A 1 138 ? 25.757 19.827 65.998 1.00 34.01 ? 462 LEU A CB 1 ATOM 994 C CG . LEU A 1 138 ? 25.979 18.523 65.208 1.00 34.07 ? 462 LEU A CG 1 ATOM 995 C CD1 . LEU A 1 138 ? 26.448 18.822 63.775 1.00 33.70 ? 462 LEU A CD1 1 ATOM 996 C CD2 . LEU A 1 138 ? 26.941 17.592 65.887 1.00 31.68 ? 462 LEU A CD2 1 ATOM 997 N N . ALA A 1 139 ? 25.718 21.307 69.008 1.00 33.46 ? 463 ALA A N 1 ATOM 998 C CA . ALA A 1 139 ? 25.605 22.511 69.815 1.00 31.93 ? 463 ALA A CA 1 ATOM 999 C C . ALA A 1 139 ? 26.869 23.369 69.621 1.00 33.32 ? 463 ALA A C 1 ATOM 1000 O O . ALA A 1 139 ? 27.996 22.883 69.705 1.00 33.79 ? 463 ALA A O 1 ATOM 1001 C CB . ALA A 1 139 ? 25.431 22.117 71.269 1.00 31.40 ? 463 ALA A CB 1 ATOM 1002 N N . CYS A 1 140 ? 26.662 24.659 69.379 1.00 33.70 ? 464 CYS A N 1 ATOM 1003 C CA . CYS A 1 140 ? 27.721 25.631 69.247 1.00 33.80 ? 464 CYS A CA 1 ATOM 1004 C C . CYS A 1 140 ? 27.557 26.720 70.286 1.00 33.43 ? 464 CYS A C 1 ATOM 1005 O O . CYS A 1 140 ? 26.453 27.205 70.456 1.00 33.95 ? 464 CYS A O 1 ATOM 1006 C CB . CYS A 1 140 ? 27.644 26.284 67.878 1.00 35.60 ? 464 CYS A CB 1 ATOM 1007 S SG . CYS A 1 140 ? 29.131 27.151 67.443 1.00 37.13 ? 464 CYS A SG 1 ATOM 1008 N N . LEU A 1 141 ? 28.646 27.061 70.986 1.00 32.37 ? 465 LEU A N 1 ATOM 1009 C CA . LEU A 1 141 ? 28.685 28.121 71.993 1.00 31.17 ? 465 LEU A CA 1 ATOM 1010 C C . LEU A 1 141 ? 29.594 29.243 71.486 1.00 31.56 ? 465 LEU A C 1 ATOM 1011 O O . LEU A 1 141 ? 30.784 29.043 71.263 1.00 32.03 ? 465 LEU A O 1 ATOM 1012 C CB . LEU A 1 141 ? 29.214 27.596 73.336 1.00 31.11 ? 465 LEU A CB 1 ATOM 1013 C CG . LEU A 1 141 ? 29.564 28.652 74.410 1.00 29.98 ? 465 LEU A CG 1 ATOM 1014 C CD1 . LEU A 1 141 ? 28.399 29.610 74.688 1.00 28.58 ? 465 LEU A CD1 1 ATOM 1015 C CD2 . LEU A 1 141 ? 30.052 28.017 75.723 1.00 30.93 ? 465 LEU A CD2 1 ATOM 1016 N N . ILE A 1 142 ? 29.002 30.405 71.243 1.00 32.97 ? 466 ILE A N 1 ATOM 1017 C CA . ILE A 1 142 ? 29.729 31.592 70.827 1.00 32.63 ? 466 ILE A CA 1 ATOM 1018 C C . ILE A 1 142 ? 29.698 32.585 72.001 1.00 30.66 ? 466 ILE A C 1 ATOM 1019 O O . ILE A 1 142 ? 28.651 32.916 72.506 1.00 30.14 ? 466 ILE A O 1 ATOM 1020 C CB . ILE A 1 142 ? 29.140 32.210 69.533 1.00 33.98 ? 466 ILE A CB 1 ATOM 1021 C CG1 . ILE A 1 142 ? 28.725 31.131 68.528 1.00 35.12 ? 466 ILE A CG1 1 ATOM 1022 C CG2 . ILE A 1 142 ? 30.138 33.182 68.858 1.00 32.49 ? 466 ILE A CG2 1 ATOM 1023 C CD1 . ILE A 1 142 ? 29.872 30.424 67.940 1.00 38.23 ? 466 ILE A CD1 1 ATOM 1024 N N . GLN A 1 143 ? 30.857 33.031 72.462 1.00 30.62 ? 467 GLN A N 1 ATOM 1025 C CA . GLN A 1 143 ? 30.925 33.834 73.682 1.00 31.46 ? 467 GLN A CA 1 ATOM 1026 C C . GLN A 1 143 ? 32.051 34.884 73.736 1.00 31.78 ? 467 GLN A C 1 ATOM 1027 O O . GLN A 1 143 ? 33.021 34.855 72.968 1.00 31.88 ? 467 GLN A O 1 ATOM 1028 C CB . GLN A 1 143 ? 31.026 32.915 74.899 1.00 31.32 ? 467 GLN A CB 1 ATOM 1029 C CG . GLN A 1 143 ? 32.299 32.100 74.958 1.00 32.27 ? 467 GLN A CG 1 ATOM 1030 C CD . GLN A 1 143 ? 32.366 31.314 76.242 1.00 32.21 ? 467 GLN A CD 1 ATOM 1031 O OE1 . GLN A 1 143 ? 31.329 30.969 76.795 1.00 33.58 ? 467 GLN A OE1 1 ATOM 1032 N NE2 . GLN A 1 143 ? 33.566 31.088 76.759 1.00 31.57 ? 467 GLN A NE2 1 ATOM 1033 N N . ASN A 1 144 ? 31.892 35.822 74.662 1.00 31.90 ? 468 ASN A N 1 ATOM 1034 C CA . ASN A 1 144 ? 32.900 36.843 74.943 1.00 33.29 ? 468 ASN A CA 1 ATOM 1035 C C . ASN A 1 144 ? 33.096 37.831 73.796 1.00 33.36 ? 468 ASN A C 1 ATOM 1036 O O . ASN A 1 144 ? 34.206 38.331 73.560 1.00 33.74 ? 468 ASN A O 1 ATOM 1037 C CB . ASN A 1 144 ? 34.230 36.188 75.376 1.00 32.63 ? 468 ASN A CB 1 ATOM 1038 C CG . ASN A 1 144 ? 34.109 35.456 76.711 1.00 32.91 ? 468 ASN A CG 1 ATOM 1039 O OD1 . ASN A 1 144 ? 33.151 35.655 77.455 1.00 33.55 ? 468 ASN A OD1 1 ATOM 1040 N ND2 . ASN A 1 144 ? 35.064 34.595 77.008 1.00 32.37 ? 468 ASN A ND2 1 ATOM 1041 N N . PHE A 1 145 ? 32.012 38.098 73.072 1.00 32.26 ? 469 PHE A N 1 ATOM 1042 C CA . PHE A 1 145 ? 32.052 39.069 71.985 1.00 31.25 ? 469 PHE A CA 1 ATOM 1043 C C . PHE A 1 145 ? 31.282 40.334 72.326 1.00 30.86 ? 469 PHE A C 1 ATOM 1044 O O . PHE A 1 145 ? 30.384 40.334 73.149 1.00 30.95 ? 469 PHE A O 1 ATOM 1045 C CB . PHE A 1 145 ? 31.567 38.464 70.669 1.00 31.02 ? 469 PHE A CB 1 ATOM 1046 C CG . PHE A 1 145 ? 30.160 37.954 70.715 1.00 30.82 ? 469 PHE A CG 1 ATOM 1047 C CD1 . PHE A 1 145 ? 29.105 38.785 70.402 1.00 30.11 ? 469 PHE A CD1 1 ATOM 1048 C CD2 . PHE A 1 145 ? 29.893 36.630 71.071 1.00 31.62 ? 469 PHE A CD2 1 ATOM 1049 C CE1 . PHE A 1 145 ? 27.788 38.316 70.439 1.00 30.59 ? 469 PHE A CE1 1 ATOM 1050 C CE2 . PHE A 1 145 ? 28.564 36.148 71.128 1.00 31.35 ? 469 PHE A CE2 1 ATOM 1051 C CZ . PHE A 1 145 ? 27.522 36.984 70.815 1.00 31.45 ? 469 PHE A CZ 1 ATOM 1052 N N . MET A 1 146 ? 31.679 41.441 71.717 1.00 33.62 ? 470 MET A N 1 ATOM 1053 C CA . MET A 1 146 ? 30.912 42.681 71.854 1.00 34.56 ? 470 MET A CA 1 ATOM 1054 C C . MET A 1 146 ? 31.198 43.590 70.676 1.00 33.11 ? 470 MET A C 1 ATOM 1055 O O . MET A 1 146 ? 32.316 43.607 70.165 1.00 29.77 ? 470 MET A O 1 ATOM 1056 C CB . MET A 1 146 ? 31.173 43.378 73.197 1.00 36.67 ? 470 MET A CB 1 ATOM 1057 C CG . MET A 1 146 ? 32.619 43.584 73.542 1.00 38.22 ? 470 MET A CG 1 ATOM 1058 S SD . MET A 1 146 ? 32.864 44.097 75.264 1.00 40.17 ? 470 MET A SD 1 ATOM 1059 C CE . MET A 1 146 ? 31.906 45.609 75.383 1.00 39.06 ? 470 MET A CE 1 ATOM 1060 N N . PRO A 1 147 ? 30.161 44.304 70.197 1.00 32.94 ? 471 PRO A N 1 ATOM 1061 C CA . PRO A 1 147 ? 28.769 44.290 70.654 1.00 33.00 ? 471 PRO A CA 1 ATOM 1062 C C . PRO A 1 147 ? 28.036 42.975 70.382 1.00 32.92 ? 471 PRO A C 1 ATOM 1063 O O . PRO A 1 147 ? 28.627 42.011 69.884 1.00 31.83 ? 471 PRO A O 1 ATOM 1064 C CB . PRO A 1 147 ? 28.118 45.442 69.861 1.00 32.24 ? 471 PRO A CB 1 ATOM 1065 C CG . PRO A 1 147 ? 29.208 46.231 69.387 1.00 32.54 ? 471 PRO A CG 1 ATOM 1066 C CD . PRO A 1 147 ? 30.323 45.259 69.097 1.00 32.43 ? 471 PRO A CD 1 ATOM 1067 N N . GLU A 1 148 ? 26.749 42.963 70.708 1.00 34.04 ? 472 GLU A N 1 ATOM 1068 C CA . GLU A 1 148 ? 25.950 41.754 70.717 1.00 35.52 ? 472 GLU A CA 1 ATOM 1069 C C . GLU A 1 148 ? 25.507 41.272 69.335 1.00 35.57 ? 472 GLU A C 1 ATOM 1070 O O . GLU A 1 148 ? 24.998 40.156 69.204 1.00 34.87 ? 472 GLU A O 1 ATOM 1071 C CB . GLU A 1 148 ? 24.722 41.981 71.588 1.00 37.71 ? 472 GLU A CB 1 ATOM 1072 C CG . GLU A 1 148 ? 23.757 43.011 71.027 1.00 40.07 ? 472 GLU A CG 1 ATOM 1073 C CD . GLU A 1 148 ? 22.690 43.360 72.017 1.00 42.26 ? 472 GLU A CD 1 ATOM 1074 O OE1 . GLU A 1 148 ? 22.517 44.575 72.294 1.00 45.11 ? 472 GLU A OE1 1 ATOM 1075 O OE2 . GLU A 1 148 ? 22.066 42.418 72.567 1.00 44.89 ? 472 GLU A OE2 1 ATOM 1076 N N . ASP A 1 149 ? 25.666 42.117 68.321 1.00 36.36 ? 473 ASP A N 1 ATOM 1077 C CA . ASP A 1 149 ? 25.281 41.757 66.959 1.00 36.25 ? 473 ASP A CA 1 ATOM 1078 C C . ASP A 1 149 ? 26.159 40.638 66.421 1.00 35.09 ? 473 ASP A C 1 ATOM 1079 O O . ASP A 1 149 ? 27.382 40.751 66.374 1.00 37.03 ? 473 ASP A O 1 ATOM 1080 C CB . ASP A 1 149 ? 25.339 42.977 66.026 1.00 37.30 ? 473 ASP A CB 1 ATOM 1081 C CG . ASP A 1 149 ? 24.177 43.926 66.230 1.00 38.58 ? 473 ASP A CG 1 ATOM 1082 O OD1 . ASP A 1 149 ? 23.384 43.687 67.162 1.00 39.74 ? 473 ASP A OD1 1 ATOM 1083 O OD2 . ASP A 1 149 ? 24.051 44.912 65.463 1.00 40.11 ? 473 ASP A OD2 1 ATOM 1084 N N . ILE A 1 150 ? 25.531 39.553 65.996 1.00 33.50 ? 474 ILE A N 1 ATOM 1085 C CA . ILE A 1 150 ? 26.273 38.382 65.519 1.00 32.99 ? 474 ILE A CA 1 ATOM 1086 C C . ILE A 1 150 ? 25.385 37.532 64.625 1.00 31.64 ? 474 ILE A C 1 ATOM 1087 O O . ILE A 1 150 ? 24.179 37.385 64.853 1.00 29.64 ? 474 ILE A O 1 ATOM 1088 C CB . ILE A 1 150 ? 26.872 37.550 66.686 1.00 33.87 ? 474 ILE A CB 1 ATOM 1089 C CG1 . ILE A 1 150 ? 28.036 36.671 66.207 1.00 33.56 ? 474 ILE A CG1 1 ATOM 1090 C CG2 . ILE A 1 150 ? 25.815 36.726 67.387 1.00 32.50 ? 474 ILE A CG2 1 ATOM 1091 C CD1 . ILE A 1 150 ? 28.566 35.868 67.291 1.00 34.70 ? 474 ILE A CD1 1 ATOM 1092 N N . SER A 1 151 ? 25.979 37.038 63.555 1.00 31.37 ? 475 SER A N 1 ATOM 1093 C CA . SER A 1 151 ? 25.298 36.081 62.673 1.00 31.32 ? 475 SER A CA 1 ATOM 1094 C C . SER A 1 151 ? 25.885 34.689 62.865 1.00 31.02 ? 475 SER A C 1 ATOM 1095 O O . SER A 1 151 ? 27.095 34.532 62.898 1.00 31.02 ? 475 SER A O 1 ATOM 1096 C CB . SER A 1 151 ? 25.423 36.506 61.204 1.00 30.37 ? 475 SER A CB 1 ATOM 1097 O OG . SER A 1 151 ? 24.721 37.710 60.959 1.00 31.65 ? 475 SER A OG 1 ATOM 1098 N N . VAL A 1 152 ? 25.041 33.671 62.961 1.00 31.94 ? 476 VAL A N 1 ATOM 1099 C CA . VAL A 1 152 ? 25.544 32.297 63.141 1.00 32.00 ? 476 VAL A CA 1 ATOM 1100 C C . VAL A 1 152 ? 25.095 31.416 61.980 1.00 32.47 ? 476 VAL A C 1 ATOM 1101 O O . VAL A 1 152 ? 23.930 31.425 61.591 1.00 32.48 ? 476 VAL A O 1 ATOM 1102 C CB . VAL A 1 152 ? 25.109 31.688 64.505 1.00 30.78 ? 476 VAL A CB 1 ATOM 1103 C CG1 . VAL A 1 152 ? 25.578 30.211 64.648 1.00 28.78 ? 476 VAL A CG1 1 ATOM 1104 C CG2 . VAL A 1 152 ? 25.656 32.559 65.621 1.00 28.83 ? 476 VAL A CG2 1 ATOM 1105 N N . GLN A 1 153 ? 26.027 30.673 61.398 1.00 33.76 ? 477 GLN A N 1 ATOM 1106 C CA . GLN A 1 153 ? 25.637 29.733 60.361 1.00 35.25 ? 477 GLN A CA 1 ATOM 1107 C C . GLN A 1 153 ? 26.284 28.361 60.513 1.00 33.24 ? 477 GLN A C 1 ATOM 1108 O O . GLN A 1 153 ? 27.264 28.202 61.233 1.00 32.14 ? 477 GLN A O 1 ATOM 1109 C CB . GLN A 1 153 ? 25.861 30.358 58.983 1.00 38.70 ? 477 GLN A CB 1 ATOM 1110 C CG . GLN A 1 153 ? 27.297 30.742 58.696 1.00 42.07 ? 477 GLN A CG 1 ATOM 1111 C CD . GLN A 1 153 ? 27.394 31.906 57.731 1.00 44.38 ? 477 GLN A CD 1 ATOM 1112 O OE1 . GLN A 1 153 ? 28.409 32.095 57.043 1.00 46.73 ? 477 GLN A OE1 1 ATOM 1113 N NE2 . GLN A 1 153 ? 26.335 32.705 57.678 1.00 46.75 ? 477 GLN A NE2 1 ATOM 1114 N N . TRP A 1 154 ? 25.675 27.358 59.884 1.00 32.83 ? 478 TRP A N 1 ATOM 1115 C CA . TRP A 1 154 ? 26.218 26.011 59.862 1.00 32.79 ? 478 TRP A CA 1 ATOM 1116 C C . TRP A 1 154 ? 26.541 25.556 58.440 1.00 32.79 ? 478 TRP A C 1 ATOM 1117 O O . TRP A 1 154 ? 25.879 25.916 57.464 1.00 31.67 ? 478 TRP A O 1 ATOM 1118 C CB . TRP A 1 154 ? 25.295 24.999 60.539 1.00 32.58 ? 478 TRP A CB 1 ATOM 1119 C CG . TRP A 1 154 ? 25.119 25.167 62.046 1.00 32.05 ? 478 TRP A CG 1 ATOM 1120 C CD1 . TRP A 1 154 ? 24.224 25.972 62.674 1.00 30.55 ? 478 TRP A CD1 1 ATOM 1121 C CD2 . TRP A 1 154 ? 25.838 24.474 63.088 1.00 30.86 ? 478 TRP A CD2 1 ATOM 1122 N NE1 . TRP A 1 154 ? 24.335 25.838 64.036 1.00 30.51 ? 478 TRP A NE1 1 ATOM 1123 C CE2 . TRP A 1 154 ? 25.324 24.933 64.321 1.00 31.13 ? 478 TRP A CE2 1 ATOM 1124 C CE3 . TRP A 1 154 ? 26.857 23.515 63.094 1.00 29.28 ? 478 TRP A CE3 1 ATOM 1125 C CZ2 . TRP A 1 154 ? 25.793 24.460 65.555 1.00 30.60 ? 478 TRP A CZ2 1 ATOM 1126 C CZ3 . TRP A 1 154 ? 27.335 23.053 64.310 1.00 29.24 ? 478 TRP A CZ3 1 ATOM 1127 C CH2 . TRP A 1 154 ? 26.811 23.523 65.524 1.00 30.96 ? 478 TRP A CH2 1 ATOM 1128 N N . LEU A 1 155 ? 27.630 24.809 58.328 1.00 33.81 ? 479 LEU A N 1 ATOM 1129 C CA . LEU A 1 155 ? 28.058 24.307 57.038 1.00 34.28 ? 479 LEU A CA 1 ATOM 1130 C C . LEU A 1 155 ? 28.373 22.810 57.065 1.00 34.94 ? 479 LEU A C 1 ATOM 1131 O O . LEU A 1 155 ? 28.866 22.251 58.046 1.00 34.11 ? 479 LEU A O 1 ATOM 1132 C CB . LEU A 1 155 ? 29.246 25.114 56.526 1.00 34.96 ? 479 LEU A CB 1 ATOM 1133 C CG . LEU A 1 155 ? 29.059 26.622 56.342 1.00 35.06 ? 479 LEU A CG 1 ATOM 1134 C CD1 . LEU A 1 155 ? 29.639 27.389 57.522 1.00 34.07 ? 479 LEU A CD1 1 ATOM 1135 C CD2 . LEU A 1 155 ? 29.738 27.052 55.051 1.00 36.39 ? 479 LEU A CD2 1 ATOM 1136 N N . HIS A 1 156 ? 28.040 22.162 55.961 1.00 36.52 ? 480 HIS A N 1 ATOM 1137 C CA . HIS A 1 156 ? 28.370 20.774 55.732 1.00 37.15 ? 480 HIS A CA 1 ATOM 1138 C C . HIS A 1 156 ? 28.818 20.651 54.281 1.00 39.08 ? 480 HIS A C 1 ATOM 1139 O O . HIS A 1 156 ? 28.055 20.974 53.377 1.00 40.82 ? 480 HIS A O 1 ATOM 1140 C CB . HIS A 1 156 ? 27.144 19.925 56.017 1.00 36.32 ? 480 HIS A CB 1 ATOM 1141 C CG . HIS A 1 156 ? 27.405 18.454 55.998 1.00 35.39 ? 480 HIS A CG 1 ATOM 1142 N ND1 . HIS A 1 156 ? 26.577 17.567 55.344 1.00 35.04 ? 480 HIS A ND1 1 ATOM 1143 C CD2 . HIS A 1 156 ? 28.408 17.718 56.528 1.00 34.55 ? 480 HIS A CD2 1 ATOM 1144 C CE1 . HIS A 1 156 ? 27.057 16.345 55.479 1.00 34.88 ? 480 HIS A CE1 1 ATOM 1145 N NE2 . HIS A 1 156 ? 28.161 16.409 56.200 1.00 35.27 ? 480 HIS A NE2 1 ATOM 1146 N N . ASN A 1 157 ? 30.052 20.199 54.060 1.00 41.26 ? 481 ASN A N 1 ATOM 1147 C CA . ASN A 1 157 ? 30.674 20.185 52.722 1.00 42.96 ? 481 ASN A CA 1 ATOM 1148 C C . ASN A 1 157 ? 30.930 21.586 52.195 1.00 43.94 ? 481 ASN A C 1 ATOM 1149 O O . ASN A 1 157 ? 30.922 21.828 50.995 1.00 44.57 ? 481 ASN A O 1 ATOM 1150 C CB . ASN A 1 157 ? 29.836 19.400 51.714 1.00 43.46 ? 481 ASN A CB 1 ATOM 1151 C CG . ASN A 1 157 ? 29.687 17.949 52.103 1.00 43.88 ? 481 ASN A CG 1 ATOM 1152 O OD1 . ASN A 1 157 ? 30.686 17.254 52.283 1.00 44.28 ? 481 ASN A OD1 1 ATOM 1153 N ND2 . ASN A 1 157 ? 28.447 17.487 52.235 1.00 44.14 ? 481 ASN A ND2 1 ATOM 1154 N N . GLU A 1 158 ? 31.182 22.505 53.116 1.00 45.93 ? 482 GLU A N 1 ATOM 1155 C CA . GLU A 1 158 ? 31.345 23.918 52.803 1.00 47.57 ? 482 GLU A CA 1 ATOM 1156 C C . GLU A 1 158 ? 30.154 24.514 52.023 1.00 46.72 ? 482 GLU A C 1 ATOM 1157 O O . GLU A 1 158 ? 30.263 25.593 51.423 1.00 45.77 ? 482 GLU A O 1 ATOM 1158 C CB . GLU A 1 158 ? 32.692 24.173 52.108 1.00 50.02 ? 482 GLU A CB 1 ATOM 1159 C CG . GLU A 1 158 ? 33.877 24.253 53.089 1.00 51.98 ? 482 GLU A CG 1 ATOM 1160 C CD . GLU A 1 158 ? 35.184 24.642 52.416 1.00 53.57 ? 482 GLU A CD 1 ATOM 1161 O OE1 . GLU A 1 158 ? 35.176 24.897 51.192 1.00 55.33 ? 482 GLU A OE1 1 ATOM 1162 O OE2 . GLU A 1 158 ? 36.227 24.703 53.106 1.00 54.81 ? 482 GLU A OE2 1 ATOM 1163 N N . VAL A 1 159 ? 29.007 23.830 52.069 1.00 45.49 ? 483 VAL A N 1 ATOM 1164 C CA . VAL A 1 159 ? 27.753 24.455 51.663 1.00 44.22 ? 483 VAL A CA 1 ATOM 1165 C C . VAL A 1 159 ? 26.972 24.807 52.924 1.00 42.60 ? 483 VAL A C 1 ATOM 1166 O O . VAL A 1 159 ? 26.789 23.981 53.829 1.00 39.67 ? 483 VAL A O 1 ATOM 1167 C CB . VAL A 1 159 ? 26.914 23.611 50.662 1.00 44.61 ? 483 VAL A CB 1 ATOM 1168 C CG1 . VAL A 1 159 ? 27.736 23.322 49.398 1.00 43.94 ? 483 VAL A CG1 1 ATOM 1169 C CG2 . VAL A 1 159 ? 26.391 22.334 51.306 1.00 44.84 ? 483 VAL A CG2 1 ATOM 1170 N N . GLN A 1 160 ? 26.566 26.072 52.971 1.00 41.21 ? 484 GLN A N 1 ATOM 1171 C CA . GLN A 1 160 ? 25.793 26.588 54.062 1.00 40.96 ? 484 GLN A CA 1 ATOM 1172 C C . GLN A 1 160 ? 24.425 25.913 54.096 1.00 39.06 ? 484 GLN A C 1 ATOM 1173 O O . GLN A 1 160 ? 23.720 25.832 53.097 1.00 37.11 ? 484 GLN A O 1 ATOM 1174 C CB . GLN A 1 160 ? 25.675 28.115 53.970 1.00 42.67 ? 484 GLN A CB 1 ATOM 1175 C CG . GLN A 1 160 ? 25.250 28.768 55.302 1.00 44.05 ? 484 GLN A CG 1 ATOM 1176 C CD . GLN A 1 160 ? 25.140 30.273 55.193 1.00 45.56 ? 484 GLN A CD 1 ATOM 1177 O OE1 . GLN A 1 160 ? 24.082 30.852 55.464 1.00 46.48 ? 484 GLN A OE1 1 ATOM 1178 N NE2 . GLN A 1 160 ? 26.232 30.913 54.768 1.00 46.63 ? 484 GLN A NE2 1 ATOM 1179 N N . LEU A 1 161 ? 24.073 25.400 55.272 1.00 37.58 ? 485 LEU A N 1 ATOM 1180 C CA . LEU A 1 161 ? 22.800 24.729 55.457 1.00 35.23 ? 485 LEU A CA 1 ATOM 1181 C C . LEU A 1 161 ? 21.672 25.741 55.576 1.00 34.46 ? 485 LEU A C 1 ATOM 1182 O O . LEU A 1 161 ? 21.851 26.843 56.085 1.00 33.69 ? 485 LEU A O 1 ATOM 1183 C CB . LEU A 1 161 ? 22.851 23.834 56.685 1.00 34.96 ? 485 LEU A CB 1 ATOM 1184 C CG . LEU A 1 161 ? 23.888 22.719 56.679 1.00 34.54 ? 485 LEU A CG 1 ATOM 1185 C CD1 . LEU A 1 161 ? 24.070 22.199 58.093 1.00 34.38 ? 485 LEU A CD1 1 ATOM 1186 C CD2 . LEU A 1 161 ? 23.454 21.615 55.708 1.00 34.14 ? 485 LEU A CD2 1 ATOM 1187 N N . PRO A 1 162 ? 20.473 25.365 55.119 1.00 35.05 ? 486 PRO A N 1 ATOM 1188 C CA . PRO A 1 162 ? 19.348 26.302 55.257 1.00 36.17 ? 486 PRO A CA 1 ATOM 1189 C C . PRO A 1 162 ? 19.243 26.809 56.699 1.00 37.77 ? 486 PRO A C 1 ATOM 1190 O O . PRO A 1 162 ? 19.538 26.051 57.614 1.00 37.75 ? 486 PRO A O 1 ATOM 1191 C CB . PRO A 1 162 ? 18.130 25.447 54.910 1.00 35.44 ? 486 PRO A CB 1 ATOM 1192 C CG . PRO A 1 162 ? 18.666 24.253 54.225 1.00 34.89 ? 486 PRO A CG 1 ATOM 1193 C CD . PRO A 1 162 ? 20.027 24.005 54.793 1.00 34.33 ? 486 PRO A CD 1 ATOM 1194 N N . ASP A 1 163 ? 18.860 28.069 56.895 1.00 40.39 ? 487 ASP A N 1 ATOM 1195 C CA . ASP A 1 163 ? 18.804 28.669 58.226 1.00 43.03 ? 487 ASP A CA 1 ATOM 1196 C C . ASP A 1 163 ? 17.741 27.990 59.088 1.00 42.76 ? 487 ASP A C 1 ATOM 1197 O O . ASP A 1 163 ? 17.883 27.930 60.312 1.00 43.38 ? 487 ASP A O 1 ATOM 1198 C CB . ASP A 1 163 ? 18.505 30.174 58.135 1.00 45.86 ? 487 ASP A CB 1 ATOM 1199 C CG . ASP A 1 163 ? 19.691 30.973 57.643 1.00 48.67 ? 487 ASP A CG 1 ATOM 1200 O OD1 . ASP A 1 163 ? 20.835 30.438 57.714 1.00 50.70 ? 487 ASP A OD1 1 ATOM 1201 O OD2 . ASP A 1 163 ? 19.475 32.127 57.187 1.00 50.69 ? 487 ASP A OD2 1 ATOM 1202 N N . ALA A 1 164 ? 16.688 27.486 58.441 1.00 40.96 ? 488 ALA A N 1 ATOM 1203 C CA . ALA A 1 164 ? 15.566 26.881 59.148 1.00 40.47 ? 488 ALA A CA 1 ATOM 1204 C C . ALA A 1 164 ? 15.966 25.598 59.879 1.00 39.65 ? 488 ALA A C 1 ATOM 1205 O O . ALA A 1 164 ? 15.237 25.119 60.750 1.00 38.05 ? 488 ALA A O 1 ATOM 1206 C CB . ALA A 1 164 ? 14.407 26.616 58.181 1.00 39.67 ? 488 ALA A CB 1 ATOM 1207 N N . ARG A 1 165 ? 17.131 25.058 59.525 1.00 38.65 ? 489 ARG A N 1 ATOM 1208 C CA . ARG A 1 165 ? 17.626 23.814 60.102 1.00 38.27 ? 489 ARG A CA 1 ATOM 1209 C C . ARG A 1 165 ? 18.175 23.945 61.521 1.00 37.56 ? 489 ARG A C 1 ATOM 1210 O O . ARG A 1 165 ? 18.315 22.952 62.227 1.00 34.38 ? 489 ARG A O 1 ATOM 1211 C CB . ARG A 1 165 ? 18.727 23.246 59.206 1.00 39.99 ? 489 ARG A CB 1 ATOM 1212 C CG . ARG A 1 165 ? 18.187 22.529 57.982 1.00 40.48 ? 489 ARG A CG 1 ATOM 1213 C CD . ARG A 1 165 ? 18.026 21.058 58.239 1.00 41.40 ? 489 ARG A CD 1 ATOM 1214 N NE . ARG A 1 165 ? 19.067 20.371 57.488 1.00 44.60 ? 489 ARG A NE 1 ATOM 1215 C CZ . ARG A 1 165 ? 20.130 19.766 57.996 1.00 43.66 ? 489 ARG A CZ 1 ATOM 1216 N NH1 . ARG A 1 165 ? 20.330 19.696 59.297 1.00 43.46 ? 489 ARG A NH1 1 ATOM 1217 N NH2 . ARG A 1 165 ? 20.989 19.225 57.160 1.00 44.22 ? 489 ARG A NH2 1 ATOM 1218 N N . HIS A 1 166 ? 18.483 25.176 61.921 1.00 36.82 ? 490 HIS A N 1 ATOM 1219 C CA . HIS A 1 166 ? 19.062 25.464 63.223 1.00 37.11 ? 490 HIS A CA 1 ATOM 1220 C C . HIS A 1 166 ? 18.265 26.591 63.913 1.00 36.70 ? 490 HIS A C 1 ATOM 1221 O O . HIS A 1 166 ? 17.453 27.294 63.305 1.00 34.64 ? 490 HIS A O 1 ATOM 1222 C CB . HIS A 1 166 ? 20.564 25.834 63.070 1.00 36.77 ? 490 HIS A CB 1 ATOM 1223 C CG . HIS A 1 166 ? 20.804 27.227 62.558 1.00 37.66 ? 490 HIS A CG 1 ATOM 1224 N ND1 . HIS A 1 166 ? 21.041 27.511 61.227 1.00 39.51 ? 490 HIS A ND1 1 ATOM 1225 C CD2 . HIS A 1 166 ? 20.847 28.415 63.206 1.00 37.26 ? 490 HIS A CD2 1 ATOM 1226 C CE1 . HIS A 1 166 ? 21.205 28.814 61.080 1.00 38.16 ? 490 HIS A CE1 1 ATOM 1227 N NE2 . HIS A 1 166 ? 21.076 29.385 62.265 1.00 38.08 ? 490 HIS A NE2 1 ATOM 1228 N N . SER A 1 167 ? 18.527 26.765 65.197 1.00 38.03 ? 491 SER A N 1 ATOM 1229 C CA . SER A 1 167 ? 17.957 27.859 65.967 1.00 39.54 ? 491 SER A CA 1 ATOM 1230 C C . SER A 1 167 ? 19.025 28.355 66.915 1.00 38.19 ? 491 SER A C 1 ATOM 1231 O O . SER A 1 167 ? 19.663 27.552 67.582 1.00 39.48 ? 491 SER A O 1 ATOM 1232 C CB . SER A 1 167 ? 16.706 27.417 66.745 1.00 41.11 ? 491 SER A CB 1 ATOM 1233 O OG . SER A 1 167 ? 17.015 26.400 67.657 1.00 43.98 ? 491 SER A OG 1 ATOM 1234 N N . THR A 1 168 ? 19.227 29.670 66.908 1.00 35.59 ? 492 THR A N 1 ATOM 1235 C CA . THR A 1 168 ? 20.210 30.356 67.720 1.00 34.20 ? 492 THR A CA 1 ATOM 1236 C C . THR A 1 168 ? 19.517 31.199 68.797 1.00 34.30 ? 492 THR A C 1 ATOM 1237 O O . THR A 1 168 ? 18.520 31.846 68.545 1.00 34.57 ? 492 THR A O 1 ATOM 1238 C CB . THR A 1 168 ? 21.110 31.286 66.854 1.00 33.33 ? 492 THR A CB 1 ATOM 1239 O OG1 . THR A 1 168 ? 21.646 30.539 65.760 1.00 31.71 ? 492 THR A OG1 1 ATOM 1240 C CG2 . THR A 1 168 ? 22.261 31.917 67.674 1.00 31.95 ? 492 THR A CG2 1 ATOM 1241 N N . THR A 1 169 ? 20.067 31.180 70.005 1.00 34.31 ? 493 THR A N 1 ATOM 1242 C CA . THR A 1 169 ? 19.481 31.893 71.132 1.00 34.49 ? 493 THR A CA 1 ATOM 1243 C C . THR A 1 169 ? 19.794 33.389 70.997 1.00 35.99 ? 493 THR A C 1 ATOM 1244 O O . THR A 1 169 ? 20.665 33.795 70.220 1.00 36.15 ? 493 THR A O 1 ATOM 1245 C CB . THR A 1 169 ? 19.943 31.307 72.492 1.00 32.72 ? 493 THR A CB 1 ATOM 1246 O OG1 . THR A 1 169 ? 21.374 31.388 72.617 1.00 30.56 ? 493 THR A OG1 1 ATOM 1247 C CG2 . THR A 1 169 ? 19.528 29.848 72.625 1.00 31.62 ? 493 THR A CG2 1 ATOM 1248 N N . GLN A 1 170 ? 19.032 34.215 71.703 1.00 37.55 ? 494 GLN A N 1 ATOM 1249 C CA . GLN A 1 170 ? 19.275 35.654 71.677 1.00 40.10 ? 494 GLN A CA 1 ATOM 1250 C C . GLN A 1 170 ? 20.458 35.992 72.570 1.00 38.80 ? 494 GLN A C 1 ATOM 1251 O O . GLN A 1 170 ? 20.706 35.296 73.551 1.00 39.06 ? 494 GLN A O 1 ATOM 1252 C CB . GLN A 1 170 ? 18.034 36.435 72.111 1.00 42.63 ? 494 GLN A CB 1 ATOM 1253 C CG . GLN A 1 170 ? 16.898 36.340 71.088 1.00 45.60 ? 494 GLN A CG 1 ATOM 1254 C CD . GLN A 1 170 ? 17.199 37.080 69.797 1.00 47.46 ? 494 GLN A CD 1 ATOM 1255 O OE1 . GLN A 1 170 ? 17.070 36.525 68.698 1.00 50.12 ? 494 GLN A OE1 1 ATOM 1256 N NE2 . GLN A 1 170 ? 17.593 38.352 69.925 1.00 49.88 ? 494 GLN A NE2 1 ATOM 1257 N N . PRO A 1 171 ? 21.195 37.056 72.228 1.00 38.31 ? 495 PRO A N 1 ATOM 1258 C CA . PRO A 1 171 ? 22.421 37.368 72.963 1.00 38.78 ? 495 PRO A CA 1 ATOM 1259 C C . PRO A 1 171 ? 22.136 37.635 74.434 1.00 39.06 ? 495 PRO A C 1 ATOM 1260 O O . PRO A 1 171 ? 21.145 38.278 74.785 1.00 39.39 ? 495 PRO A O 1 ATOM 1261 C CB . PRO A 1 171 ? 22.945 38.606 72.245 1.00 38.52 ? 495 PRO A CB 1 ATOM 1262 C CG . PRO A 1 171 ? 22.435 38.444 70.844 1.00 37.68 ? 495 PRO A CG 1 ATOM 1263 C CD . PRO A 1 171 ? 21.071 37.869 71.008 1.00 37.70 ? 495 PRO A CD 1 ATOM 1264 N N . ARG A 1 172 ? 22.975 37.070 75.290 1.00 39.38 ? 496 ARG A N 1 ATOM 1265 C CA . ARG A 1 172 ? 22.848 37.272 76.714 1.00 39.77 ? 496 ARG A CA 1 ATOM 1266 C C . ARG A 1 172 ? 24.219 37.694 77.188 1.00 38.82 ? 496 ARG A C 1 ATOM 1267 O O . ARG A 1 172 ? 25.239 37.276 76.617 1.00 35.30 ? 496 ARG A O 1 ATOM 1268 C CB . ARG A 1 172 ? 22.430 35.979 77.424 1.00 42.15 ? 496 ARG A CB 1 ATOM 1269 C CG . ARG A 1 172 ? 20.980 35.601 77.272 1.00 44.46 ? 496 ARG A CG 1 ATOM 1270 C CD . ARG A 1 172 ? 20.757 34.129 77.649 1.00 47.29 ? 496 ARG A CD 1 ATOM 1271 N NE . ARG A 1 172 ? 19.351 33.894 77.966 1.00 50.29 ? 496 ARG A NE 1 ATOM 1272 C CZ . ARG A 1 172 ? 18.814 33.994 79.181 1.00 51.57 ? 496 ARG A CZ 1 ATOM 1273 N NH1 . ARG A 1 172 ? 19.570 34.277 80.235 1.00 51.32 ? 496 ARG A NH1 1 ATOM 1274 N NH2 . ARG A 1 172 ? 17.510 33.791 79.342 1.00 52.08 ? 496 ARG A NH2 1 ATOM 1275 N N . LYS A 1 173 ? 24.239 38.509 78.241 1.00 39.10 ? 497 LYS A N 1 ATOM 1276 C CA . LYS A 1 173 ? 25.499 38.930 78.830 1.00 40.07 ? 497 LYS A CA 1 ATOM 1277 C C . LYS A 1 173 ? 26.125 37.790 79.621 1.00 39.15 ? 497 LYS A C 1 ATOM 1278 O O . LYS A 1 173 ? 25.435 37.036 80.313 1.00 37.95 ? 497 LYS A O 1 ATOM 1279 C CB . LYS A 1 173 ? 25.334 40.187 79.699 1.00 42.11 ? 497 LYS A CB 1 ATOM 1280 C CG . LYS A 1 173 ? 25.669 41.490 78.967 1.00 43.05 ? 497 LYS A CG 1 ATOM 1281 C CD . LYS A 1 173 ? 25.700 42.692 79.896 1.00 44.39 ? 497 LYS A CD 1 ATOM 1282 C CE . LYS A 1 173 ? 26.292 43.907 79.170 1.00 45.39 ? 497 LYS A CE 1 ATOM 1283 N NZ . LYS A 1 173 ? 26.015 45.225 79.828 1.00 46.55 ? 497 LYS A NZ 1 ATOM 1284 N N . THR A 1 174 ? 27.438 37.641 79.457 1.00 39.07 ? 498 THR A N 1 ATOM 1285 C CA . THR A 1 174 ? 28.234 36.736 80.271 1.00 38.96 ? 498 THR A CA 1 ATOM 1286 C C . THR A 1 174 ? 28.354 37.383 81.662 1.00 39.91 ? 498 THR A C 1 ATOM 1287 O O . THR A 1 174 ? 27.736 38.412 81.921 1.00 38.34 ? 498 THR A O 1 ATOM 1288 C CB . THR A 1 174 ? 29.647 36.512 79.644 1.00 38.19 ? 498 THR A CB 1 ATOM 1289 O OG1 . THR A 1 174 ? 30.383 37.746 79.657 1.00 39.77 ? 498 THR A OG1 1 ATOM 1290 C CG2 . THR A 1 174 ? 29.572 36.024 78.206 1.00 35.46 ? 498 THR A CG2 1 ATOM 1291 N N . LYS A 1 175 ? 29.138 36.781 82.554 1.00 41.70 ? 499 LYS A N 1 ATOM 1292 C CA . LYS A 1 175 ? 29.395 37.358 83.873 1.00 43.35 ? 499 LYS A CA 1 ATOM 1293 C C . LYS A 1 175 ? 30.384 38.515 83.747 1.00 43.65 ? 499 LYS A C 1 ATOM 1294 O O . LYS A 1 175 ? 30.695 39.184 84.731 1.00 43.71 ? 499 LYS A O 1 ATOM 1295 C CB . LYS A 1 175 ? 29.949 36.313 84.847 1.00 44.65 ? 499 LYS A CB 1 ATOM 1296 C CG . LYS A 1 175 ? 28.909 35.369 85.427 1.00 46.01 ? 499 LYS A CG 1 ATOM 1297 C CD . LYS A 1 175 ? 29.560 34.137 86.065 1.00 47.02 ? 499 LYS A CD 1 ATOM 1298 C CE . LYS A 1 175 ? 30.496 34.485 87.229 1.00 48.05 ? 499 LYS A CE 1 ATOM 1299 N NZ . LYS A 1 175 ? 31.146 33.284 87.866 1.00 47.18 ? 499 LYS A NZ 1 ATOM 1300 N N . GLY A 1 176 ? 30.889 38.719 82.532 1.00 43.89 ? 500 GLY A N 1 ATOM 1301 C CA . GLY A 1 176 ? 31.782 39.831 82.220 1.00 43.73 ? 500 GLY A CA 1 ATOM 1302 C C . GLY A 1 176 ? 31.080 40.842 81.337 1.00 43.09 ? 500 GLY A C 1 ATOM 1303 O O . GLY A 1 176 ? 29.887 41.103 81.498 1.00 42.69 ? 500 GLY A O 1 ATOM 1304 N N . SER A 1 177 ? 31.813 41.404 80.383 1.00 43.53 ? 501 SER A N 1 ATOM 1305 C CA . SER A 1 177 ? 31.281 42.487 79.538 1.00 42.90 ? 501 SER A CA 1 ATOM 1306 C C . SER A 1 177 ? 30.718 42.018 78.196 1.00 42.67 ? 501 SER A C 1 ATOM 1307 O O . SER A 1 177 ? 29.961 42.763 77.550 1.00 43.99 ? 501 SER A O 1 ATOM 1308 C CB . SER A 1 177 ? 32.366 43.520 79.263 1.00 42.81 ? 501 SER A CB 1 ATOM 1309 O OG . SER A 1 177 ? 32.604 44.328 80.405 1.00 43.67 ? 501 SER A OG 1 ATOM 1310 N N . GLY A 1 178 ? 31.118 40.816 77.771 1.00 40.84 ? 502 GLY A N 1 ATOM 1311 C CA . GLY A 1 178 ? 30.732 40.273 76.475 1.00 39.19 ? 502 GLY A CA 1 ATOM 1312 C C . GLY A 1 178 ? 29.404 39.526 76.488 1.00 37.33 ? 502 GLY A C 1 ATOM 1313 O O . GLY A 1 178 ? 28.723 39.419 77.500 1.00 37.45 ? 502 GLY A O 1 ATOM 1314 N N . PHE A 1 179 ? 29.021 39.017 75.329 1.00 34.44 ? 503 PHE A N 1 ATOM 1315 C CA . PHE A 1 179 ? 27.758 38.315 75.204 1.00 32.64 ? 503 PHE A CA 1 ATOM 1316 C C . PHE A 1 179 ? 28.029 36.869 74.813 1.00 30.40 ? 503 PHE A C 1 ATOM 1317 O O . PHE A 1 179 ? 29.156 36.476 74.487 1.00 27.53 ? 503 PHE A O 1 ATOM 1318 C CB . PHE A 1 179 ? 26.853 39.007 74.178 1.00 32.24 ? 503 PHE A CB 1 ATOM 1319 C CG . PHE A 1 179 ? 26.488 40.419 74.562 1.00 32.54 ? 503 PHE A CG 1 ATOM 1320 C CD1 . PHE A 1 179 ? 27.373 41.457 74.328 1.00 32.20 ? 503 PHE A CD1 1 ATOM 1321 C CD2 . PHE A 1 179 ? 25.282 40.702 75.192 1.00 31.44 ? 503 PHE A CD2 1 ATOM 1322 C CE1 . PHE A 1 179 ? 27.063 42.761 74.707 1.00 32.42 ? 503 PHE A CE1 1 ATOM 1323 C CE2 . PHE A 1 179 ? 24.972 41.993 75.565 1.00 31.50 ? 503 PHE A CE2 1 ATOM 1324 C CZ . PHE A 1 179 ? 25.853 43.024 75.318 1.00 31.47 ? 503 PHE A CZ 1 ATOM 1325 N N . PHE A 1 180 ? 26.978 36.072 74.859 1.00 30.94 ? 504 PHE A N 1 ATOM 1326 C CA . PHE A 1 180 ? 27.032 34.721 74.319 1.00 29.78 ? 504 PHE A CA 1 ATOM 1327 C C . PHE A 1 180 ? 25.726 34.350 73.634 1.00 30.59 ? 504 PHE A C 1 ATOM 1328 O O . PHE A 1 180 ? 24.660 34.833 73.997 1.00 29.74 ? 504 PHE A O 1 ATOM 1329 C CB . PHE A 1 180 ? 27.373 33.704 75.426 1.00 29.61 ? 504 PHE A CB 1 ATOM 1330 C CG . PHE A 1 180 ? 26.236 33.450 76.394 1.00 28.80 ? 504 PHE A CG 1 ATOM 1331 C CD1 . PHE A 1 180 ? 25.288 32.470 76.127 1.00 28.64 ? 504 PHE A CD1 1 ATOM 1332 C CD2 . PHE A 1 180 ? 26.119 34.180 77.568 1.00 27.56 ? 504 PHE A CD2 1 ATOM 1333 C CE1 . PHE A 1 180 ? 24.241 32.247 77.017 1.00 27.47 ? 504 PHE A CE1 1 ATOM 1334 C CE2 . PHE A 1 180 ? 25.091 33.949 78.446 1.00 27.44 ? 504 PHE A CE2 1 ATOM 1335 C CZ . PHE A 1 180 ? 24.153 32.985 78.167 1.00 27.19 ? 504 PHE A CZ 1 ATOM 1336 N N . VAL A 1 181 ? 25.844 33.475 72.636 1.00 31.89 ? 505 VAL A N 1 ATOM 1337 C CA . VAL A 1 181 ? 24.706 32.766 72.074 1.00 32.82 ? 505 VAL A CA 1 ATOM 1338 C C . VAL A 1 181 ? 24.981 31.233 71.986 1.00 31.03 ? 505 VAL A C 1 ATOM 1339 O O . VAL A 1 181 ? 26.109 30.759 71.898 1.00 32.40 ? 505 VAL A O 1 ATOM 1340 C CB . VAL A 1 181 ? 24.319 33.364 70.678 1.00 32.27 ? 505 VAL A CB 1 ATOM 1341 C CG1 . VAL A 1 181 ? 23.796 34.818 70.836 1.00 30.79 ? 505 VAL A CG1 1 ATOM 1342 C CG2 . VAL A 1 181 ? 25.525 33.340 69.772 1.00 31.71 ? 505 VAL A CG2 1 ATOM 1343 N N . PHE A 1 182 ? 23.908 30.470 71.988 1.00 30.87 ? 506 PHE A N 1 ATOM 1344 C CA . PHE A 1 182 ? 23.967 29.052 71.668 1.00 31.97 ? 506 PHE A CA 1 ATOM 1345 C C . PHE A 1 182 ? 23.253 28.781 70.375 1.00 31.02 ? 506 PHE A C 1 ATOM 1346 O O . PHE A 1 182 ? 22.229 29.358 70.106 1.00 31.33 ? 506 PHE A O 1 ATOM 1347 C CB . PHE A 1 182 ? 23.293 28.225 72.733 1.00 31.00 ? 506 PHE A CB 1 ATOM 1348 C CG . PHE A 1 182 ? 24.088 28.057 73.989 1.00 31.19 ? 506 PHE A CG 1 ATOM 1349 C CD1 . PHE A 1 182 ? 23.860 28.860 75.088 1.00 31.47 ? 506 PHE A CD1 1 ATOM 1350 C CD2 . PHE A 1 182 ? 25.022 27.049 74.097 1.00 31.66 ? 506 PHE A CD2 1 ATOM 1351 C CE1 . PHE A 1 182 ? 24.544 28.631 76.286 1.00 31.39 ? 506 PHE A CE1 1 ATOM 1352 C CE2 . PHE A 1 182 ? 25.706 26.858 75.272 1.00 31.03 ? 506 PHE A CE2 1 ATOM 1353 C CZ . PHE A 1 182 ? 25.472 27.651 76.356 1.00 28.99 ? 506 PHE A CZ 1 ATOM 1354 N N . SER A 1 183 ? 23.796 27.868 69.580 1.00 32.24 ? 507 SER A N 1 ATOM 1355 C CA . SER A 1 183 ? 23.131 27.454 68.350 1.00 31.06 ? 507 SER A CA 1 ATOM 1356 C C . SER A 1 183 ? 22.941 25.943 68.337 1.00 31.18 ? 507 SER A C 1 ATOM 1357 O O . SER A 1 183 ? 23.824 25.173 68.686 1.00 32.56 ? 507 SER A O 1 ATOM 1358 C CB . SER A 1 183 ? 23.907 27.931 67.130 1.00 29.84 ? 507 SER A CB 1 ATOM 1359 O OG . SER A 1 183 ? 23.091 27.914 65.974 1.00 28.72 ? 507 SER A OG 1 ATOM 1360 N N . ARG A 1 184 ? 21.761 25.526 67.913 1.00 31.74 ? 508 ARG A N 1 ATOM 1361 C CA . ARG A 1 184 ? 21.376 24.121 67.931 1.00 32.17 ? 508 ARG A CA 1 ATOM 1362 C C . ARG A 1 184 ? 21.095 23.643 66.503 1.00 31.76 ? 508 ARG A C 1 ATOM 1363 O O . ARG A 1 184 ? 20.423 24.326 65.744 1.00 32.26 ? 508 ARG A O 1 ATOM 1364 C CB . ARG A 1 184 ? 20.136 23.954 68.834 1.00 30.78 ? 508 ARG A CB 1 ATOM 1365 C CG . ARG A 1 184 ? 19.752 22.529 69.091 1.00 30.45 ? 508 ARG A CG 1 ATOM 1366 C CD . ARG A 1 184 ? 18.725 22.389 70.188 1.00 29.83 ? 508 ARG A CD 1 ATOM 1367 N NE . ARG A 1 184 ? 18.208 21.034 70.192 1.00 31.15 ? 508 ARG A NE 1 ATOM 1368 C CZ . ARG A 1 184 ? 17.292 20.592 69.340 1.00 33.66 ? 508 ARG A CZ 1 ATOM 1369 N NH1 . ARG A 1 184 ? 16.764 21.429 68.438 1.00 34.93 ? 508 ARG A NH1 1 ATOM 1370 N NH2 . ARG A 1 184 ? 16.912 19.320 69.371 1.00 32.67 ? 508 ARG A NH2 1 ATOM 1371 N N . LEU A 1 185 ? 21.658 22.494 66.143 1.00 32.45 ? 509 LEU A N 1 ATOM 1372 C CA . LEU A 1 185 ? 21.513 21.897 64.824 1.00 33.28 ? 509 LEU A CA 1 ATOM 1373 C C . LEU A 1 185 ? 21.329 20.377 64.914 1.00 33.82 ? 509 LEU A C 1 ATOM 1374 O O . LEU A 1 185 ? 22.250 19.663 65.266 1.00 33.62 ? 509 LEU A O 1 ATOM 1375 C CB . LEU A 1 185 ? 22.767 22.151 63.956 1.00 32.39 ? 509 LEU A CB 1 ATOM 1376 C CG . LEU A 1 185 ? 22.666 21.569 62.533 1.00 31.76 ? 509 LEU A CG 1 ATOM 1377 C CD1 . LEU A 1 185 ? 21.674 22.331 61.678 1.00 31.64 ? 509 LEU A CD1 1 ATOM 1378 C CD2 . LEU A 1 185 ? 23.973 21.356 61.762 1.00 31.72 ? 509 LEU A CD2 1 ATOM 1379 N N . GLU A 1 186 ? 20.157 19.885 64.533 1.00 34.99 ? 510 GLU A N 1 ATOM 1380 C CA . GLU A 1 186 ? 19.921 18.451 64.427 1.00 36.97 ? 510 GLU A CA 1 ATOM 1381 C C . GLU A 1 186 ? 20.440 17.959 63.082 1.00 35.76 ? 510 GLU A C 1 ATOM 1382 O O . GLU A 1 186 ? 20.172 18.560 62.040 1.00 36.84 ? 510 GLU A O 1 ATOM 1383 C CB . GLU A 1 186 ? 18.421 18.113 64.577 1.00 39.61 ? 510 GLU A CB 1 ATOM 1384 C CG . GLU A 1 186 ? 17.777 18.670 65.853 1.00 41.40 ? 510 GLU A CG 1 ATOM 1385 C CD . GLU A 1 186 ? 16.271 18.411 65.964 1.00 44.10 ? 510 GLU A CD 1 ATOM 1386 O OE1 . GLU A 1 186 ? 15.553 19.365 66.373 1.00 44.55 ? 510 GLU A OE1 1 ATOM 1387 O OE2 . GLU A 1 186 ? 15.804 17.273 65.653 1.00 46.05 ? 510 GLU A OE2 1 ATOM 1388 N N . VAL A 1 187 ? 21.219 16.886 63.126 1.00 34.89 ? 511 VAL A N 1 ATOM 1389 C CA . VAL A 1 187 ? 21.784 16.279 61.935 1.00 34.98 ? 511 VAL A CA 1 ATOM 1390 C C . VAL A 1 187 ? 21.354 14.818 61.836 1.00 34.78 ? 511 VAL A C 1 ATOM 1391 O O . VAL A 1 187 ? 20.890 14.234 62.803 1.00 34.30 ? 511 VAL A O 1 ATOM 1392 C CB . VAL A 1 187 ? 23.332 16.476 61.827 1.00 33.86 ? 511 VAL A CB 1 ATOM 1393 C CG1 . VAL A 1 187 ? 23.659 17.973 61.939 1.00 32.63 ? 511 VAL A CG1 1 ATOM 1394 C CG2 . VAL A 1 187 ? 24.094 15.631 62.852 1.00 34.10 ? 511 VAL A CG2 1 ATOM 1395 N N . THR A 1 188 ? 21.437 14.274 60.626 1.00 34.77 ? 512 THR A N 1 ATOM 1396 C CA . THR A 1 188 ? 20.980 12.927 60.332 1.00 34.20 ? 512 THR A CA 1 ATOM 1397 C C . THR A 1 188 ? 22.186 12.046 60.075 1.00 34.26 ? 512 THR A C 1 ATOM 1398 O O . THR A 1 188 ? 23.258 12.524 59.712 1.00 35.49 ? 512 THR A O 1 ATOM 1399 C CB . THR A 1 188 ? 20.072 12.909 59.086 1.00 34.71 ? 512 THR A CB 1 ATOM 1400 O OG1 . THR A 1 188 ? 20.812 13.376 57.943 1.00 32.43 ? 512 THR A OG1 1 ATOM 1401 C CG2 . THR A 1 188 ? 18.814 13.787 59.304 1.00 32.75 ? 512 THR A CG2 1 ATOM 1402 N N . ARG A 1 189 ? 21.995 10.750 60.251 1.00 34.58 ? 513 ARG A N 1 ATOM 1403 C CA . ARG A 1 189 ? 23.026 9.772 59.957 1.00 34.89 ? 513 ARG A CA 1 ATOM 1404 C C . ARG A 1 189 ? 23.562 9.855 58.530 1.00 34.22 ? 513 ARG A C 1 ATOM 1405 O O . ARG A 1 189 ? 24.776 9.780 58.314 1.00 34.49 ? 513 ARG A O 1 ATOM 1406 C CB . ARG A 1 189 ? 22.486 8.374 60.259 1.00 34.97 ? 513 ARG A CB 1 ATOM 1407 C CG . ARG A 1 189 ? 23.396 7.262 59.846 1.00 35.76 ? 513 ARG A CG 1 ATOM 1408 C CD . ARG A 1 189 ? 23.078 6.010 60.628 1.00 36.73 ? 513 ARG A CD 1 ATOM 1409 N NE . ARG A 1 189 ? 23.894 5.989 61.838 1.00 38.53 ? 513 ARG A NE 1 ATOM 1410 C CZ . ARG A 1 189 ? 23.577 5.328 62.937 1.00 39.76 ? 513 ARG A CZ 1 ATOM 1411 N NH1 . ARG A 1 189 ? 22.456 4.626 62.971 1.00 41.64 ? 513 ARG A NH1 1 ATOM 1412 N NH2 . ARG A 1 189 ? 24.370 5.364 63.995 1.00 40.70 ? 513 ARG A NH2 1 ATOM 1413 N N . ALA A 1 190 ? 22.674 10.002 57.553 1.00 33.83 ? 514 ALA A N 1 ATOM 1414 C CA . ALA A 1 190 ? 23.099 10.104 56.159 1.00 33.69 ? 514 ALA A CA 1 ATOM 1415 C C . ALA A 1 190 ? 24.121 11.218 55.965 1.00 33.52 ? 514 ALA A C 1 ATOM 1416 O O . ALA A 1 190 ? 25.072 11.076 55.198 1.00 33.03 ? 514 ALA A O 1 ATOM 1417 C CB . ALA A 1 190 ? 21.881 10.308 55.223 1.00 34.12 ? 514 ALA A CB 1 ATOM 1418 N N . GLU A 1 191 ? 23.939 12.331 56.676 1.00 34.40 ? 515 GLU A N 1 ATOM 1419 C CA . GLU A 1 191 ? 24.854 13.457 56.554 1.00 33.76 ? 515 GLU A CA 1 ATOM 1420 C C . GLU A 1 191 ? 26.223 13.167 57.148 1.00 32.68 ? 515 GLU A C 1 ATOM 1421 O O . GLU A 1 191 ? 27.234 13.414 56.502 1.00 32.10 ? 515 GLU A O 1 ATOM 1422 C CB . GLU A 1 191 ? 24.251 14.710 57.193 1.00 35.68 ? 515 GLU A CB 1 ATOM 1423 C CG . GLU A 1 191 ? 23.071 15.231 56.419 1.00 37.70 ? 515 GLU A CG 1 ATOM 1424 C CD . GLU A 1 191 ? 22.307 16.330 57.133 1.00 39.14 ? 515 GLU A CD 1 ATOM 1425 O OE1 . GLU A 1 191 ? 21.443 16.931 56.484 1.00 42.34 ? 515 GLU A OE1 1 ATOM 1426 O OE2 . GLU A 1 191 ? 22.511 16.596 58.328 1.00 41.12 ? 515 GLU A OE2 1 ATOM 1427 N N . TRP A 1 192 ? 26.274 12.644 58.369 1.00 32.72 ? 516 TRP A N 1 ATOM 1428 C CA . TRP A 1 192 ? 27.577 12.427 59.015 1.00 33.54 ? 516 TRP A CA 1 ATOM 1429 C C . TRP A 1 192 ? 28.313 11.213 58.446 1.00 34.37 ? 516 TRP A C 1 ATOM 1430 O O . TRP A 1 192 ? 29.543 11.136 58.502 1.00 36.44 ? 516 TRP A O 1 ATOM 1431 C CB . TRP A 1 192 ? 27.455 12.389 60.553 1.00 33.62 ? 516 TRP A CB 1 ATOM 1432 C CG . TRP A 1 192 ? 27.009 11.082 61.158 1.00 32.56 ? 516 TRP A CG 1 ATOM 1433 C CD1 . TRP A 1 192 ? 27.659 9.892 61.105 1.00 32.25 ? 516 TRP A CD1 1 ATOM 1434 C CD2 . TRP A 1 192 ? 25.820 10.850 61.931 1.00 32.47 ? 516 TRP A CD2 1 ATOM 1435 N NE1 . TRP A 1 192 ? 26.955 8.927 61.782 1.00 31.65 ? 516 TRP A NE1 1 ATOM 1436 C CE2 . TRP A 1 192 ? 25.818 9.486 62.297 1.00 31.50 ? 516 TRP A CE2 1 ATOM 1437 C CE3 . TRP A 1 192 ? 24.758 11.662 62.346 1.00 31.76 ? 516 TRP A CE3 1 ATOM 1438 C CZ2 . TRP A 1 192 ? 24.796 8.914 63.052 1.00 31.36 ? 516 TRP A CZ2 1 ATOM 1439 C CZ3 . TRP A 1 192 ? 23.756 11.105 63.109 1.00 31.68 ? 516 TRP A CZ3 1 ATOM 1440 C CH2 . TRP A 1 192 ? 23.775 9.741 63.453 1.00 32.02 ? 516 TRP A CH2 1 ATOM 1441 N N . GLU A 1 193 ? 27.573 10.268 57.879 1.00 35.02 ? 517 GLU A N 1 ATOM 1442 C CA . GLU A 1 193 ? 28.194 9.151 57.157 1.00 35.68 ? 517 GLU A CA 1 ATOM 1443 C C . GLU A 1 193 ? 28.777 9.572 55.806 1.00 35.77 ? 517 GLU A C 1 ATOM 1444 O O . GLU A 1 193 ? 29.780 9.016 55.353 1.00 36.07 ? 517 GLU A O 1 ATOM 1445 C CB . GLU A 1 193 ? 27.197 8.011 56.977 1.00 36.30 ? 517 GLU A CB 1 ATOM 1446 C CG . GLU A 1 193 ? 26.887 7.314 58.287 1.00 37.40 ? 517 GLU A CG 1 ATOM 1447 C CD . GLU A 1 193 ? 26.215 5.963 58.126 1.00 38.74 ? 517 GLU A CD 1 ATOM 1448 O OE1 . GLU A 1 193 ? 25.624 5.670 57.063 1.00 40.12 ? 517 GLU A OE1 1 ATOM 1449 O OE2 . GLU A 1 193 ? 26.272 5.180 59.097 1.00 39.71 ? 517 GLU A OE2 1 ATOM 1450 N N . GLN A 1 194 ? 28.161 10.565 55.173 1.00 36.23 ? 518 GLN A N 1 ATOM 1451 C CA . GLN A 1 194 ? 28.684 11.146 53.938 1.00 36.61 ? 518 GLN A CA 1 ATOM 1452 C C . GLN A 1 194 ? 29.947 11.976 54.196 1.00 36.71 ? 518 GLN A C 1 ATOM 1453 O O . GLN A 1 194 ? 30.944 11.869 53.482 1.00 36.98 ? 518 GLN A O 1 ATOM 1454 C CB . GLN A 1 194 ? 27.598 12.005 53.273 1.00 37.48 ? 518 GLN A CB 1 ATOM 1455 C CG . GLN A 1 194 ? 28.016 12.644 51.936 1.00 38.50 ? 518 GLN A CG 1 ATOM 1456 C CD . GLN A 1 194 ? 28.580 14.050 52.096 1.00 39.12 ? 518 GLN A CD 1 ATOM 1457 O OE1 . GLN A 1 194 ? 28.056 14.847 52.871 1.00 40.66 ? 518 GLN A OE1 1 ATOM 1458 N NE2 . GLN A 1 194 ? 29.654 14.359 51.378 1.00 39.03 ? 518 GLN A NE2 1 ATOM 1459 N N . LYS A 1 195 ? 29.899 12.800 55.235 1.00 36.81 ? 519 LYS A N 1 ATOM 1460 C CA . LYS A 1 195 ? 31.032 13.611 55.656 1.00 36.53 ? 519 LYS A CA 1 ATOM 1461 C C . LYS A 1 195 ? 30.832 13.983 57.129 1.00 35.52 ? 519 LYS A C 1 ATOM 1462 O O . LYS A 1 195 ? 29.980 14.803 57.461 1.00 34.67 ? 519 LYS A O 1 ATOM 1463 C CB . LYS A 1 195 ? 31.118 14.857 54.774 1.00 37.51 ? 519 LYS A CB 1 ATOM 1464 C CG . LYS A 1 195 ? 32.121 15.891 55.241 1.00 37.95 ? 519 LYS A CG 1 ATOM 1465 C CD . LYS A 1 195 ? 33.510 15.395 55.038 1.00 38.78 ? 519 LYS A CD 1 ATOM 1466 C CE . LYS A 1 195 ? 34.521 16.518 55.155 1.00 39.31 ? 519 LYS A CE 1 ATOM 1467 N NZ . LYS A 1 195 ? 35.895 15.951 55.115 1.00 40.02 ? 519 LYS A NZ 1 ATOM 1468 N N . ASP A 1 196 ? 31.607 13.349 58.005 1.00 35.36 ? 520 ASP A N 1 ATOM 1469 C CA . ASP A 1 196 ? 31.508 13.519 59.454 1.00 35.08 ? 520 ASP A CA 1 ATOM 1470 C C . ASP A 1 196 ? 32.264 14.765 59.917 1.00 35.53 ? 520 ASP A C 1 ATOM 1471 O O . ASP A 1 196 ? 33.243 14.679 60.665 1.00 35.45 ? 520 ASP A O 1 ATOM 1472 C CB . ASP A 1 196 ? 32.062 12.279 60.183 1.00 35.32 ? 520 ASP A CB 1 ATOM 1473 C CG . ASP A 1 196 ? 31.728 12.285 61.674 1.00 35.53 ? 520 ASP A CG 1 ATOM 1474 O OD1 . ASP A 1 196 ? 30.865 13.092 62.044 1.00 36.13 ? 520 ASP A OD1 1 ATOM 1475 O OD2 . ASP A 1 196 ? 32.314 11.534 62.484 1.00 35.73 ? 520 ASP A OD2 1 ATOM 1476 N N . GLU A 1 197 ? 31.805 15.925 59.458 1.00 35.69 ? 521 GLU A N 1 ATOM 1477 C CA . GLU A 1 197 ? 32.390 17.193 59.852 1.00 37.25 ? 521 GLU A CA 1 ATOM 1478 C C . GLU A 1 197 ? 31.411 18.315 59.546 1.00 36.00 ? 521 GLU A C 1 ATOM 1479 O O . GLU A 1 197 ? 30.948 18.477 58.412 1.00 35.53 ? 521 GLU A O 1 ATOM 1480 C CB . GLU A 1 197 ? 33.738 17.441 59.158 1.00 38.83 ? 521 GLU A CB 1 ATOM 1481 C CG . GLU A 1 197 ? 34.285 18.860 59.368 1.00 40.29 ? 521 GLU A CG 1 ATOM 1482 C CD . GLU A 1 197 ? 35.744 18.985 58.950 1.00 42.27 ? 521 GLU A CD 1 ATOM 1483 O OE1 . GLU A 1 197 ? 36.074 19.835 58.078 1.00 42.93 ? 521 GLU A OE1 1 ATOM 1484 O OE2 . GLU A 1 197 ? 36.568 18.211 59.502 1.00 44.58 ? 521 GLU A OE2 1 ATOM 1485 N N . PHE A 1 198 ? 31.092 19.072 60.589 1.00 35.32 ? 522 PHE A N 1 ATOM 1486 C CA . PHE A 1 198 ? 30.143 20.166 60.493 1.00 34.52 ? 522 PHE A CA 1 ATOM 1487 C C . PHE A 1 198 ? 30.766 21.404 61.084 1.00 34.02 ? 522 PHE A C 1 ATOM 1488 O O . PHE A 1 198 ? 31.436 21.357 62.099 1.00 35.33 ? 522 PHE A O 1 ATOM 1489 C CB . PHE A 1 198 ? 28.834 19.822 61.225 1.00 34.31 ? 522 PHE A CB 1 ATOM 1490 C CG . PHE A 1 198 ? 28.229 18.514 60.801 1.00 34.12 ? 522 PHE A CG 1 ATOM 1491 C CD1 . PHE A 1 198 ? 28.755 17.310 61.245 1.00 33.98 ? 522 PHE A CD1 1 ATOM 1492 C CD2 . PHE A 1 198 ? 27.126 18.488 59.969 1.00 34.40 ? 522 PHE A CD2 1 ATOM 1493 C CE1 . PHE A 1 198 ? 28.198 16.107 60.847 1.00 34.70 ? 522 PHE A CE1 1 ATOM 1494 C CE2 . PHE A 1 198 ? 26.564 17.294 59.577 1.00 34.10 ? 522 PHE A CE2 1 ATOM 1495 C CZ . PHE A 1 198 ? 27.094 16.103 60.015 1.00 34.54 ? 522 PHE A CZ 1 ATOM 1496 N N . ILE A 1 199 ? 30.514 22.534 60.453 1.00 34.66 ? 523 ILE A N 1 ATOM 1497 C CA . ILE A 1 199 ? 31.152 23.766 60.845 1.00 34.13 ? 523 ILE A CA 1 ATOM 1498 C C . ILE A 1 199 ? 30.121 24.754 61.376 1.00 34.68 ? 523 ILE A C 1 ATOM 1499 O O . ILE A 1 199 ? 29.126 25.088 60.727 1.00 36.87 ? 523 ILE A O 1 ATOM 1500 C CB . ILE A 1 199 ? 31.994 24.329 59.664 1.00 34.79 ? 523 ILE A CB 1 ATOM 1501 C CG1 . ILE A 1 199 ? 33.258 23.458 59.495 1.00 35.00 ? 523 ILE A CG1 1 ATOM 1502 C CG2 . ILE A 1 199 ? 32.325 25.805 59.907 1.00 33.76 ? 523 ILE A CG2 1 ATOM 1503 C CD1 . ILE A 1 199 ? 34.041 23.701 58.257 1.00 36.62 ? 523 ILE A CD1 1 ATOM 1504 N N . CYS A 1 200 ? 30.352 25.174 62.606 1.00 33.86 ? 524 CYS A N 1 ATOM 1505 C CA . CYS A 1 200 ? 29.717 26.329 63.160 1.00 33.88 ? 524 CYS A CA 1 ATOM 1506 C C . CYS A 1 200 ? 30.519 27.603 62.883 1.00 33.02 ? 524 CYS A C 1 ATOM 1507 O O . CYS A 1 200 ? 31.665 27.714 63.283 1.00 32.50 ? 524 CYS A O 1 ATOM 1508 C CB . CYS A 1 200 ? 29.553 26.138 64.667 1.00 35.17 ? 524 CYS A CB 1 ATOM 1509 S SG . CYS A 1 200 ? 28.871 27.575 65.470 1.00 36.68 ? 524 CYS A SG 1 ATOM 1510 N N . ARG A 1 201 ? 29.909 28.566 62.203 1.00 33.13 ? 525 ARG A N 1 ATOM 1511 C CA . ARG A 1 201 ? 30.593 29.795 61.856 1.00 34.71 ? 525 ARG A CA 1 ATOM 1512 C C . ARG A 1 201 ? 29.856 31.011 62.420 1.00 36.19 ? 525 ARG A C 1 ATOM 1513 O O . ARG A 1 201 ? 28.629 31.164 62.262 1.00 36.47 ? 525 ARG A O 1 ATOM 1514 C CB . ARG A 1 201 ? 30.781 29.890 60.349 1.00 35.27 ? 525 ARG A CB 1 ATOM 1515 C CG . ARG A 1 201 ? 31.384 31.204 59.865 1.00 37.36 ? 525 ARG A CG 1 ATOM 1516 C CD . ARG A 1 201 ? 32.277 30.985 58.656 1.00 38.22 ? 525 ARG A CD 1 ATOM 1517 N NE . ARG A 1 201 ? 31.540 30.599 57.462 1.00 39.49 ? 525 ARG A NE 1 ATOM 1518 C CZ . ARG A 1 201 ? 32.103 30.093 56.357 1.00 40.87 ? 525 ARG A CZ 1 ATOM 1519 N NH1 . ARG A 1 201 ? 33.406 29.838 56.301 1.00 41.06 ? 525 ARG A NH1 1 ATOM 1520 N NH2 . ARG A 1 201 ? 31.356 29.805 55.299 1.00 40.83 ? 525 ARG A NH2 1 ATOM 1521 N N . ALA A 1 202 ? 30.606 31.848 63.130 1.00 36.02 ? 526 ALA A N 1 ATOM 1522 C CA . ALA A 1 202 ? 30.067 33.118 63.619 1.00 37.11 ? 526 ALA A CA 1 ATOM 1523 C C . ALA A 1 202 ? 30.618 34.317 62.836 1.00 36.61 ? 526 ALA A C 1 ATOM 1524 O O . ALA A 1 202 ? 31.840 34.513 62.743 1.00 36.63 ? 526 ALA A O 1 ATOM 1525 C CB . ALA A 1 202 ? 30.361 33.278 65.109 1.00 37.46 ? 526 ALA A CB 1 ATOM 1526 N N . VAL A 1 203 ? 29.721 35.108 62.254 1.00 35.86 ? 527 VAL A N 1 ATOM 1527 C CA . VAL A 1 203 ? 30.127 36.361 61.617 1.00 35.21 ? 527 VAL A CA 1 ATOM 1528 C C . VAL A 1 203 ? 29.945 37.547 62.568 1.00 35.95 ? 527 VAL A C 1 ATOM 1529 O O . VAL A 1 203 ? 28.854 37.787 63.089 1.00 36.22 ? 527 VAL A O 1 ATOM 1530 C CB . VAL A 1 203 ? 29.385 36.634 60.289 1.00 34.50 ? 527 VAL A CB 1 ATOM 1531 C CG1 . VAL A 1 203 ? 29.886 37.950 59.678 1.00 34.14 ? 527 VAL A CG1 1 ATOM 1532 C CG2 . VAL A 1 203 ? 29.620 35.511 59.304 1.00 34.07 ? 527 VAL A CG2 1 ATOM 1533 N N . HIS A 1 204 ? 31.029 38.272 62.816 1.00 36.64 ? 528 HIS A N 1 ATOM 1534 C CA . HIS A 1 204 ? 31.040 39.325 63.829 1.00 36.96 ? 528 HIS A CA 1 ATOM 1535 C C . HIS A 1 204 ? 32.054 40.377 63.384 1.00 39.12 ? 528 HIS A C 1 ATOM 1536 O O . HIS A 1 204 ? 33.094 40.051 62.816 1.00 41.25 ? 528 HIS A O 1 ATOM 1537 C CB . HIS A 1 204 ? 31.400 38.755 65.226 1.00 35.21 ? 528 HIS A CB 1 ATOM 1538 C CG . HIS A 1 204 ? 31.183 39.718 66.361 1.00 33.49 ? 528 HIS A CG 1 ATOM 1539 N ND1 . HIS A 1 204 ? 32.142 40.621 66.779 1.00 33.37 ? 528 HIS A ND1 1 ATOM 1540 C CD2 . HIS A 1 204 ? 30.115 39.916 67.169 1.00 32.70 ? 528 HIS A CD2 1 ATOM 1541 C CE1 . HIS A 1 204 ? 31.672 41.335 67.785 1.00 32.12 ? 528 HIS A CE1 1 ATOM 1542 N NE2 . HIS A 1 204 ? 30.439 40.934 68.037 1.00 33.06 ? 528 HIS A NE2 1 ATOM 1543 N N . GLU A 1 205 ? 31.765 41.643 63.643 1.00 40.59 ? 529 GLU A N 1 ATOM 1544 C CA . GLU A 1 205 ? 32.657 42.707 63.213 1.00 41.68 ? 529 GLU A CA 1 ATOM 1545 C C . GLU A 1 205 ? 34.052 42.706 63.839 1.00 42.19 ? 529 GLU A C 1 ATOM 1546 O O . GLU A 1 205 ? 35.029 43.088 63.182 1.00 41.98 ? 529 GLU A O 1 ATOM 1547 C CB . GLU A 1 205 ? 32.007 44.041 63.508 1.00 42.82 ? 529 GLU A CB 1 ATOM 1548 C CG . GLU A 1 205 ? 31.848 44.352 64.973 1.00 43.54 ? 529 GLU A CG 1 ATOM 1549 C CD . GLU A 1 205 ? 31.364 45.770 65.165 1.00 44.28 ? 529 GLU A CD 1 ATOM 1550 O OE1 . GLU A 1 205 ? 30.674 46.047 66.163 1.00 46.19 ? 529 GLU A OE1 1 ATOM 1551 O OE2 . GLU A 1 205 ? 31.676 46.606 64.303 1.00 44.11 ? 529 GLU A OE2 1 ATOM 1552 N N . ALA A 1 206 ? 34.137 42.320 65.113 1.00 42.37 ? 530 ALA A N 1 ATOM 1553 C CA . ALA A 1 206 ? 35.404 42.292 65.832 1.00 42.02 ? 530 ALA A CA 1 ATOM 1554 C C . ALA A 1 206 ? 36.147 40.990 65.566 1.00 43.60 ? 530 ALA A C 1 ATOM 1555 O O . ALA A 1 206 ? 37.302 40.832 65.959 1.00 44.98 ? 530 ALA A O 1 ATOM 1556 C CB . ALA A 1 206 ? 35.170 42.487 67.305 1.00 40.98 ? 530 ALA A CB 1 ATOM 1557 N N . ALA A 1 207 ? 35.473 40.069 64.887 1.00 45.26 ? 531 ALA A N 1 ATOM 1558 C CA . ALA A 1 207 ? 36.040 38.789 64.508 1.00 47.09 ? 531 ALA A CA 1 ATOM 1559 C C . ALA A 1 207 ? 37.077 38.956 63.416 1.00 49.33 ? 531 ALA A C 1 ATOM 1560 O O . ALA A 1 207 ? 37.093 39.945 62.684 1.00 50.33 ? 531 ALA A O 1 ATOM 1561 C CB . ALA A 1 207 ? 34.938 37.831 64.031 1.00 45.89 ? 531 ALA A CB 1 ATOM 1562 N N . SER A 1 208 ? 37.945 37.963 63.300 1.00 51.81 ? 532 SER A N 1 ATOM 1563 C CA . SER A 1 208 ? 38.973 37.977 62.281 1.00 53.47 ? 532 SER A CA 1 ATOM 1564 C C . SER A 1 208 ? 39.497 36.563 62.067 1.00 54.53 ? 532 SER A C 1 ATOM 1565 O O . SER A 1 208 ? 39.299 35.674 62.913 1.00 55.77 ? 532 SER A O 1 ATOM 1566 C CB . SER A 1 208 ? 40.109 38.923 62.680 1.00 54.13 ? 532 SER A CB 1 ATOM 1567 O OG . SER A 1 208 ? 40.462 38.734 64.040 1.00 55.12 ? 532 SER A OG 1 ATOM 1568 N N . PRO A 1 209 ? 40.093 36.327 60.891 1.00 54.70 ? 533 PRO A N 1 ATOM 1569 C CA . PRO A 1 209 ? 40.056 37.274 59.782 1.00 54.02 ? 533 PRO A CA 1 ATOM 1570 C C . PRO A 1 209 ? 38.706 37.217 59.053 1.00 52.45 ? 533 PRO A C 1 ATOM 1571 O O . PRO A 1 209 ? 37.921 36.285 59.271 1.00 52.68 ? 533 PRO A O 1 ATOM 1572 C CB . PRO A 1 209 ? 41.198 36.804 58.870 1.00 54.40 ? 533 PRO A CB 1 ATOM 1573 C CG . PRO A 1 209 ? 41.910 35.704 59.608 1.00 54.69 ? 533 PRO A CG 1 ATOM 1574 C CD . PRO A 1 209 ? 40.916 35.149 60.573 1.00 55.02 ? 533 PRO A CD 1 ATOM 1575 N N . SER A 1 210 ? 38.446 38.225 58.223 1.00 50.20 ? 534 SER A N 1 ATOM 1576 C CA . SER A 1 210 ? 37.238 38.293 57.400 1.00 48.34 ? 534 SER A CA 1 ATOM 1577 C C . SER A 1 210 ? 35.951 38.341 58.233 1.00 46.14 ? 534 SER A C 1 ATOM 1578 O O . SER A 1 210 ? 34.902 37.864 57.796 1.00 45.79 ? 534 SER A O 1 ATOM 1579 C CB . SER A 1 210 ? 37.189 37.116 56.420 1.00 48.44 ? 534 SER A CB 1 ATOM 1580 O OG . SER A 1 210 ? 38.465 36.865 55.849 1.00 48.92 ? 534 SER A OG 1 ATOM 1581 N N . GLN A 1 211 ? 36.033 38.930 59.423 1.00 44.27 ? 535 GLN A N 1 ATOM 1582 C CA . GLN A 1 211 ? 34.887 39.024 60.335 1.00 43.89 ? 535 GLN A CA 1 ATOM 1583 C C . GLN A 1 211 ? 34.205 37.660 60.584 1.00 42.94 ? 535 GLN A C 1 ATOM 1584 O O . GLN A 1 211 ? 33.033 37.584 60.922 1.00 40.51 ? 535 GLN A O 1 ATOM 1585 C CB . GLN A 1 211 ? 33.876 40.074 59.829 1.00 44.26 ? 535 GLN A CB 1 ATOM 1586 C CG . GLN A 1 211 ? 34.329 41.542 59.999 1.00 44.56 ? 535 GLN A CG 1 ATOM 1587 C CD . GLN A 1 211 ? 35.202 42.016 58.869 1.00 45.44 ? 535 GLN A CD 1 ATOM 1588 O OE1 . GLN A 1 211 ? 35.047 41.574 57.730 1.00 46.20 ? 535 GLN A OE1 1 ATOM 1589 N NE2 . GLN A 1 211 ? 36.126 42.918 59.170 1.00 46.19 ? 535 GLN A NE2 1 ATOM 1590 N N . THR A 1 212 ? 34.937 36.567 60.414 1.00 43.24 ? 536 THR A N 1 ATOM 1591 C CA . THR A 1 212 ? 34.346 35.259 60.673 1.00 44.27 ? 536 THR A CA 1 ATOM 1592 C C . THR A 1 212 ? 35.267 34.427 61.566 1.00 43.44 ? 536 THR A C 1 ATOM 1593 O O . THR A 1 212 ? 36.486 34.487 61.456 1.00 42.73 ? 536 THR A O 1 ATOM 1594 C CB . THR A 1 212 ? 33.979 34.503 59.380 1.00 44.41 ? 536 THR A CB 1 ATOM 1595 O OG1 . THR A 1 212 ? 35.147 34.294 58.600 1.00 47.37 ? 536 THR A OG1 1 ATOM 1596 C CG2 . THR A 1 212 ? 33.000 35.287 58.544 1.00 44.99 ? 536 THR A CG2 1 ATOM 1597 N N . VAL A 1 213 ? 34.663 33.714 62.509 1.00 43.01 ? 537 VAL A N 1 ATOM 1598 C CA . VAL A 1 213 ? 35.372 32.720 63.301 1.00 41.44 ? 537 VAL A CA 1 ATOM 1599 C C . VAL A 1 213 ? 34.535 31.443 63.245 1.00 40.48 ? 537 VAL A C 1 ATOM 1600 O O . VAL A 1 213 ? 33.319 31.483 63.416 1.00 38.38 ? 537 VAL A O 1 ATOM 1601 C CB . VAL A 1 213 ? 35.599 33.171 64.769 1.00 41.65 ? 537 VAL A CB 1 ATOM 1602 C CG1 . VAL A 1 213 ? 36.479 32.155 65.521 1.00 42.22 ? 537 VAL A CG1 1 ATOM 1603 C CG2 . VAL A 1 213 ? 36.248 34.528 64.828 1.00 42.43 ? 537 VAL A CG2 1 ATOM 1604 N N . GLN A 1 214 ? 35.182 30.309 62.994 1.00 39.27 ? 538 GLN A N 1 ATOM 1605 C CA . GLN A 1 214 ? 34.455 29.058 62.890 1.00 39.01 ? 538 GLN A CA 1 ATOM 1606 C C . GLN A 1 214 ? 35.142 27.919 63.616 1.00 38.88 ? 538 GLN A C 1 ATOM 1607 O O . GLN A 1 214 ? 36.357 27.923 63.794 1.00 39.02 ? 538 GLN A O 1 ATOM 1608 C CB . GLN A 1 214 ? 34.267 28.679 61.428 1.00 39.50 ? 538 GLN A CB 1 ATOM 1609 C CG . GLN A 1 214 ? 35.555 28.425 60.687 1.00 39.43 ? 538 GLN A CG 1 ATOM 1610 C CD . GLN A 1 214 ? 35.284 28.041 59.274 1.00 40.06 ? 538 GLN A CD 1 ATOM 1611 O OE1 . GLN A 1 214 ? 34.293 28.489 58.705 1.00 40.97 ? 538 GLN A OE1 1 ATOM 1612 N NE2 . GLN A 1 214 ? 36.141 27.203 58.691 1.00 40.23 ? 538 GLN A NE2 1 ATOM 1613 N N . ARG A 1 215 ? 34.347 26.927 64.002 1.00 39.30 ? 539 ARG A N 1 ATOM 1614 C CA . ARG A 1 215 ? 34.855 25.725 64.656 1.00 40.05 ? 539 ARG A CA 1 ATOM 1615 C C . ARG A 1 215 ? 34.185 24.466 64.078 1.00 37.80 ? 539 ARG A C 1 ATOM 1616 O O . ARG A 1 215 ? 32.959 24.416 63.862 1.00 37.17 ? 539 ARG A O 1 ATOM 1617 C CB . ARG A 1 215 ? 34.642 25.832 66.171 1.00 42.64 ? 539 ARG A CB 1 ATOM 1618 C CG . ARG A 1 215 ? 35.671 25.109 67.008 1.00 45.44 ? 539 ARG A CG 1 ATOM 1619 C CD . ARG A 1 215 ? 36.938 25.934 67.186 1.00 47.77 ? 539 ARG A CD 1 ATOM 1620 N NE . ARG A 1 215 ? 37.874 25.229 68.058 1.00 50.23 ? 539 ARG A NE 1 ATOM 1621 C CZ . ARG A 1 215 ? 37.871 25.264 69.391 1.00 51.37 ? 539 ARG A CZ 1 ATOM 1622 N NH1 . ARG A 1 215 ? 36.996 26.006 70.053 1.00 50.77 ? 539 ARG A NH1 1 ATOM 1623 N NH2 . ARG A 1 215 ? 38.771 24.549 70.064 1.00 52.74 ? 539 ARG A NH2 1 ATOM 1624 N N . ALA A 1 216 ? 35.002 23.455 63.820 1.00 35.56 ? 540 ALA A N 1 ATOM 1625 C CA . ALA A 1 216 ? 34.549 22.192 63.233 1.00 34.68 ? 540 ALA A CA 1 ATOM 1626 C C . ALA A 1 216 ? 34.232 21.191 64.322 1.00 32.89 ? 540 ALA A C 1 ATOM 1627 O O . ALA A 1 216 ? 34.919 21.134 65.338 1.00 33.47 ? 540 ALA A O 1 ATOM 1628 C CB . ALA A 1 216 ? 35.617 21.617 62.307 1.00 33.41 ? 540 ALA A CB 1 ATOM 1629 N N . VAL A 1 217 ? 33.177 20.411 64.109 1.00 32.17 ? 541 VAL A N 1 ATOM 1630 C CA . VAL A 1 217 ? 32.836 19.323 64.997 1.00 30.74 ? 541 VAL A CA 1 ATOM 1631 C C . VAL A 1 217 ? 32.443 18.079 64.224 1.00 30.77 ? 541 VAL A C 1 ATOM 1632 O O . VAL A 1 217 ? 31.921 18.156 63.113 1.00 31.29 ? 541 VAL A O 1 ATOM 1633 C CB . VAL A 1 217 ? 31.742 19.707 66.021 1.00 31.45 ? 541 VAL A CB 1 ATOM 1634 C CG1 . VAL A 1 217 ? 30.386 19.995 65.357 1.00 31.00 ? 541 VAL A CG1 1 ATOM 1635 C CG2 . VAL A 1 217 ? 31.607 18.579 67.016 1.00 31.97 ? 541 VAL A CG2 1 ATOM 1636 N N . SER A 1 218 ? 32.727 16.928 64.818 1.00 31.65 ? 542 SER A N 1 ATOM 1637 C CA . SER A 1 218 ? 32.436 15.629 64.233 1.00 32.94 ? 542 SER A CA 1 ATOM 1638 C C . SER A 1 218 ? 31.577 14.794 65.197 1.00 34.87 ? 542 SER A C 1 ATOM 1639 O O . SER A 1 218 ? 31.733 14.863 66.418 1.00 33.47 ? 542 SER A O 1 ATOM 1640 C CB . SER A 1 218 ? 33.735 14.888 63.884 1.00 32.99 ? 542 SER A CB 1 ATOM 1641 O OG . SER A 1 218 ? 34.492 15.586 62.889 1.00 34.33 ? 542 SER A OG 1 ATOM 1642 N N . VAL A 1 219 ? 30.624 14.058 64.637 1.00 37.50 ? 543 VAL A N 1 ATOM 1643 C CA . VAL A 1 219 ? 29.924 12.998 65.353 1.00 40.97 ? 543 VAL A CA 1 ATOM 1644 C C . VAL A 1 219 ? 30.908 11.842 65.454 1.00 43.41 ? 543 VAL A C 1 ATOM 1645 O O . VAL A 1 219 ? 31.299 11.259 64.447 1.00 47.23 ? 543 VAL A O 1 ATOM 1646 C CB . VAL A 1 219 ? 28.682 12.534 64.562 1.00 40.80 ? 543 VAL A CB 1 ATOM 1647 C CG1 . VAL A 1 219 ? 28.022 11.319 65.222 1.00 41.35 ? 543 VAL A CG1 1 ATOM 1648 C CG2 . VAL A 1 219 ? 27.693 13.682 64.389 1.00 40.19 ? 543 VAL A CG2 1 ATOM 1649 N N . ASN A 1 220 ? 31.360 11.513 66.645 1.00 45.61 ? 544 ASN A N 1 ATOM 1650 C CA . ASN A 1 220 ? 32.469 10.563 66.743 1.00 47.03 ? 544 ASN A CA 1 ATOM 1651 C C . ASN A 1 220 ? 33.771 11.299 66.411 1.00 47.18 ? 544 ASN A C 1 ATOM 1652 O O . ASN A 1 220 ? 34.365 11.161 65.338 1.00 48.53 ? 544 ASN A O 1 ATOM 1653 C CB . ASN A 1 220 ? 32.276 9.363 65.790 1.00 47.28 ? 544 ASN A CB 1 ATOM 1654 C CG . ASN A 1 220 ? 30.907 8.711 65.910 1.00 47.50 ? 544 ASN A CG 1 ATOM 1655 O OD1 . ASN A 1 220 ? 30.343 8.570 67.012 1.00 47.93 ? 544 ASN A OD1 1 ATOM 1656 N ND2 . ASN A 1 220 ? 30.370 8.292 64.765 1.00 46.90 ? 544 ASN A ND2 1 ATOM 1657 N N . GLY B 1 11 ? 3.702 47.521 28.975 1.00 50.54 ? 335 GLY B N 1 ATOM 1658 C CA . GLY B 1 11 ? 4.858 48.020 29.786 1.00 50.62 ? 335 GLY B CA 1 ATOM 1659 C C . GLY B 1 11 ? 5.234 47.126 30.962 1.00 50.19 ? 335 GLY B C 1 ATOM 1660 O O . GLY B 1 11 ? 6.395 47.102 31.385 1.00 50.39 ? 335 GLY B O 1 ATOM 1661 N N . VAL B 1 12 ? 4.250 46.403 31.496 1.00 49.45 ? 336 VAL B N 1 ATOM 1662 C CA . VAL B 1 12 ? 4.458 45.502 32.635 1.00 48.73 ? 336 VAL B CA 1 ATOM 1663 C C . VAL B 1 12 ? 4.780 44.062 32.194 1.00 48.16 ? 336 VAL B C 1 ATOM 1664 O O . VAL B 1 12 ? 4.002 43.430 31.473 1.00 47.68 ? 336 VAL B O 1 ATOM 1665 C CB . VAL B 1 12 ? 3.204 45.455 33.551 1.00 48.61 ? 336 VAL B CB 1 ATOM 1666 C CG1 . VAL B 1 12 ? 3.459 44.582 34.764 1.00 48.44 ? 336 VAL B CG1 1 ATOM 1667 C CG2 . VAL B 1 12 ? 2.787 46.849 33.984 1.00 48.77 ? 336 VAL B CG2 1 ATOM 1668 N N . SER B 1 13 ? 5.927 43.554 32.649 1.00 47.33 ? 337 SER B N 1 ATOM 1669 C CA . SER B 1 13 ? 6.362 42.180 32.388 1.00 46.52 ? 337 SER B CA 1 ATOM 1670 C C . SER B 1 13 ? 6.565 41.453 33.712 1.00 45.86 ? 337 SER B C 1 ATOM 1671 O O . SER B 1 13 ? 6.918 42.073 34.714 1.00 44.72 ? 337 SER B O 1 ATOM 1672 C CB . SER B 1 13 ? 7.695 42.135 31.625 1.00 46.60 ? 337 SER B CB 1 ATOM 1673 O OG . SER B 1 13 ? 7.572 42.595 30.295 1.00 47.35 ? 337 SER B OG 1 ATOM 1674 N N . ALA B 1 14 ? 6.357 40.137 33.692 1.00 44.95 ? 338 ALA B N 1 ATOM 1675 C CA . ALA B 1 14 ? 6.549 39.283 34.865 1.00 44.64 ? 338 ALA B CA 1 ATOM 1676 C C . ALA B 1 14 ? 7.174 37.956 34.437 1.00 44.02 ? 338 ALA B C 1 ATOM 1677 O O . ALA B 1 14 ? 6.809 37.385 33.414 1.00 43.05 ? 338 ALA B O 1 ATOM 1678 C CB . ALA B 1 14 ? 5.219 39.046 35.596 1.00 43.68 ? 338 ALA B CB 1 ATOM 1679 N N . TYR B 1 15 ? 8.136 37.494 35.228 1.00 44.74 ? 339 TYR B N 1 ATOM 1680 C CA . TYR B 1 15 ? 8.889 36.275 34.957 1.00 43.94 ? 339 TYR B CA 1 ATOM 1681 C C . TYR B 1 15 ? 8.941 35.433 36.220 1.00 43.69 ? 339 TYR B C 1 ATOM 1682 O O . TYR B 1 15 ? 9.167 35.954 37.318 1.00 41.87 ? 339 TYR B O 1 ATOM 1683 C CB . TYR B 1 15 ? 10.311 36.619 34.522 1.00 44.90 ? 339 TYR B CB 1 ATOM 1684 C CG . TYR B 1 15 ? 10.354 37.575 33.358 1.00 45.86 ? 339 TYR B CG 1 ATOM 1685 C CD1 . TYR B 1 15 ? 10.437 38.953 33.566 1.00 45.71 ? 339 TYR B CD1 1 ATOM 1686 C CD2 . TYR B 1 15 ? 10.265 37.103 32.051 1.00 45.86 ? 339 TYR B CD2 1 ATOM 1687 C CE1 . TYR B 1 15 ? 10.459 39.830 32.507 1.00 45.96 ? 339 TYR B CE1 1 ATOM 1688 C CE2 . TYR B 1 15 ? 10.289 37.971 30.983 1.00 46.18 ? 339 TYR B CE2 1 ATOM 1689 C CZ . TYR B 1 15 ? 10.386 39.337 31.212 1.00 46.36 ? 339 TYR B CZ 1 ATOM 1690 O OH . TYR B 1 15 ? 10.410 40.202 30.139 1.00 44.56 ? 339 TYR B OH 1 ATOM 1691 N N . LEU B 1 16 ? 8.731 34.127 36.057 1.00 42.70 ? 340 LEU B N 1 ATOM 1692 C CA . LEU B 1 16 ? 8.775 33.211 37.183 1.00 42.45 ? 340 LEU B CA 1 ATOM 1693 C C . LEU B 1 16 ? 9.794 32.106 36.930 1.00 41.82 ? 340 LEU B C 1 ATOM 1694 O O . LEU B 1 16 ? 9.621 31.301 36.024 1.00 41.78 ? 340 LEU B O 1 ATOM 1695 C CB . LEU B 1 16 ? 7.383 32.632 37.454 1.00 42.30 ? 340 LEU B CB 1 ATOM 1696 C CG . LEU B 1 16 ? 7.232 31.753 38.697 1.00 41.75 ? 340 LEU B CG 1 ATOM 1697 C CD1 . LEU B 1 16 ? 7.681 32.452 39.976 1.00 41.34 ? 340 LEU B CD1 1 ATOM 1698 C CD2 . LEU B 1 16 ? 5.790 31.342 38.782 1.00 42.19 ? 340 LEU B CD2 1 ATOM 1699 N N . SER B 1 17 ? 10.843 32.068 37.749 1.00 41.43 ? 341 SER B N 1 ATOM 1700 C CA . SER B 1 17 ? 11.907 31.102 37.584 1.00 43.01 ? 341 SER B CA 1 ATOM 1701 C C . SER B 1 17 ? 11.759 29.843 38.452 1.00 42.50 ? 341 SER B C 1 ATOM 1702 O O . SER B 1 17 ? 11.098 29.837 39.482 1.00 46.08 ? 341 SER B O 1 ATOM 1703 C CB . SER B 1 17 ? 13.249 31.758 37.872 1.00 43.92 ? 341 SER B CB 1 ATOM 1704 O OG . SER B 1 17 ? 13.475 31.690 39.265 1.00 46.36 ? 341 SER B OG 1 ATOM 1705 N N . ARG B 1 18 ? 12.361 28.755 37.991 1.00 40.28 ? 342 ARG B N 1 ATOM 1706 C CA . ARG B 1 18 ? 12.402 27.516 38.749 1.00 38.54 ? 342 ARG B CA 1 ATOM 1707 C C . ARG B 1 18 ? 13.625 27.516 39.677 1.00 37.53 ? 342 ARG B C 1 ATOM 1708 O O . ARG B 1 18 ? 14.504 28.352 39.536 1.00 34.96 ? 342 ARG B O 1 ATOM 1709 C CB . ARG B 1 18 ? 12.442 26.340 37.779 1.00 38.03 ? 342 ARG B CB 1 ATOM 1710 C CG . ARG B 1 18 ? 11.160 26.208 36.976 1.00 38.58 ? 342 ARG B CG 1 ATOM 1711 C CD . ARG B 1 18 ? 11.143 24.987 36.082 1.00 39.15 ? 342 ARG B CD 1 ATOM 1712 N NE . ARG B 1 18 ? 12.102 25.172 35.005 1.00 42.10 ? 342 ARG B NE 1 ATOM 1713 C CZ . ARG B 1 18 ? 11.846 25.762 33.838 1.00 42.95 ? 342 ARG B CZ 1 ATOM 1714 N NH1 . ARG B 1 18 ? 10.636 26.239 33.561 1.00 43.68 ? 342 ARG B NH1 1 ATOM 1715 N NH2 . ARG B 1 18 ? 12.822 25.883 32.953 1.00 42.86 ? 342 ARG B NH2 1 ATOM 1716 N N . PRO B 1 19 ? 13.688 26.571 40.628 1.00 38.22 ? 343 PRO B N 1 ATOM 1717 C CA . PRO B 1 19 ? 14.813 26.581 41.558 1.00 37.68 ? 343 PRO B CA 1 ATOM 1718 C C . PRO B 1 19 ? 16.106 26.158 40.896 1.00 35.44 ? 343 PRO B C 1 ATOM 1719 O O . PRO B 1 19 ? 16.072 25.402 39.943 1.00 37.81 ? 343 PRO B O 1 ATOM 1720 C CB . PRO B 1 19 ? 14.395 25.568 42.632 1.00 38.07 ? 343 PRO B CB 1 ATOM 1721 C CG . PRO B 1 19 ? 12.925 25.405 42.475 1.00 38.23 ? 343 PRO B CG 1 ATOM 1722 C CD . PRO B 1 19 ? 12.663 25.592 41.023 1.00 38.14 ? 343 PRO B CD 1 ATOM 1723 N N . SER B 1 20 ? 17.254 26.597 41.397 1.00 34.64 ? 344 SER B N 1 ATOM 1724 C CA . SER B 1 20 ? 18.504 26.080 40.836 1.00 34.02 ? 344 SER B CA 1 ATOM 1725 C C . SER B 1 20 ? 18.667 24.617 41.257 1.00 34.13 ? 344 SER B C 1 ATOM 1726 O O . SER B 1 20 ? 18.276 24.236 42.358 1.00 33.95 ? 344 SER B O 1 ATOM 1727 C CB . SER B 1 20 ? 19.709 26.904 41.261 1.00 34.29 ? 344 SER B CB 1 ATOM 1728 O OG . SER B 1 20 ? 20.162 26.529 42.536 1.00 34.04 ? 344 SER B OG 1 ATOM 1729 N N . PRO B 1 21 ? 19.163 23.775 40.346 1.00 32.92 ? 345 PRO B N 1 ATOM 1730 C CA . PRO B 1 21 ? 19.316 22.369 40.709 1.00 33.72 ? 345 PRO B CA 1 ATOM 1731 C C . PRO B 1 21 ? 20.203 22.158 41.942 1.00 33.99 ? 345 PRO B C 1 ATOM 1732 O O . PRO B 1 21 ? 19.985 21.216 42.694 1.00 34.94 ? 345 PRO B O 1 ATOM 1733 C CB . PRO B 1 21 ? 19.955 21.752 39.465 1.00 32.93 ? 345 PRO B CB 1 ATOM 1734 C CG . PRO B 1 21 ? 19.547 22.645 38.348 1.00 32.98 ? 345 PRO B CG 1 ATOM 1735 C CD . PRO B 1 21 ? 19.363 24.013 38.909 1.00 32.43 ? 345 PRO B CD 1 ATOM 1736 N N . PHE B 1 22 ? 21.204 23.015 42.119 1.00 35.00 ? 346 PHE B N 1 ATOM 1737 C CA . PHE B 1 22 ? 22.072 22.985 43.290 1.00 35.30 ? 346 PHE B CA 1 ATOM 1738 C C . PHE B 1 22 ? 21.275 23.186 44.589 1.00 35.06 ? 346 PHE B C 1 ATOM 1739 O O . PHE B 1 22 ? 21.395 22.417 45.531 1.00 34.35 ? 346 PHE B O 1 ATOM 1740 C CB . PHE B 1 22 ? 23.148 24.059 43.145 1.00 35.35 ? 346 PHE B CB 1 ATOM 1741 C CG . PHE B 1 22 ? 24.005 24.224 44.366 1.00 36.77 ? 346 PHE B CG 1 ATOM 1742 C CD1 . PHE B 1 22 ? 24.917 23.256 44.726 1.00 37.59 ? 346 PHE B CD1 1 ATOM 1743 C CD2 . PHE B 1 22 ? 23.880 25.342 45.156 1.00 36.80 ? 346 PHE B CD2 1 ATOM 1744 C CE1 . PHE B 1 22 ? 25.691 23.411 45.848 1.00 38.35 ? 346 PHE B CE1 1 ATOM 1745 C CE2 . PHE B 1 22 ? 24.650 25.499 46.256 1.00 37.19 ? 346 PHE B CE2 1 ATOM 1746 C CZ . PHE B 1 22 ? 25.549 24.541 46.613 1.00 37.78 ? 346 PHE B CZ 1 ATOM 1747 N N . ASP B 1 23 ? 20.448 24.216 44.618 1.00 37.09 ? 347 ASP B N 1 ATOM 1748 C CA . ASP B 1 23 ? 19.569 24.477 45.760 1.00 39.07 ? 347 ASP B CA 1 ATOM 1749 C C . ASP B 1 23 ? 18.587 23.350 45.984 1.00 38.46 ? 347 ASP B C 1 ATOM 1750 O O . ASP B 1 23 ? 18.350 22.942 47.127 1.00 40.00 ? 347 ASP B O 1 ATOM 1751 C CB . ASP B 1 23 ? 18.796 25.785 45.580 1.00 39.99 ? 347 ASP B CB 1 ATOM 1752 C CG . ASP B 1 23 ? 19.652 27.008 45.812 1.00 40.48 ? 347 ASP B CG 1 ATOM 1753 O OD1 . ASP B 1 23 ? 19.239 28.107 45.366 1.00 40.37 ? 347 ASP B OD1 1 ATOM 1754 O OD2 . ASP B 1 23 ? 20.725 26.864 46.438 1.00 41.94 ? 347 ASP B OD2 1 ATOM 1755 N N . LEU B 1 24 ? 18.045 22.820 44.897 1.00 37.15 ? 348 LEU B N 1 ATOM 1756 C CA . LEU B 1 24 ? 17.040 21.782 44.982 1.00 36.33 ? 348 LEU B CA 1 ATOM 1757 C C . LEU B 1 24 ? 17.615 20.444 45.435 1.00 36.14 ? 348 LEU B C 1 ATOM 1758 O O . LEU B 1 24 ? 17.036 19.773 46.298 1.00 35.70 ? 348 LEU B O 1 ATOM 1759 C CB . LEU B 1 24 ? 16.345 21.632 43.627 1.00 35.60 ? 348 LEU B CB 1 ATOM 1760 C CG . LEU B 1 24 ? 15.159 20.675 43.469 1.00 36.37 ? 348 LEU B CG 1 ATOM 1761 C CD1 . LEU B 1 24 ? 14.026 20.944 44.472 1.00 35.17 ? 348 LEU B CD1 1 ATOM 1762 C CD2 . LEU B 1 24 ? 14.646 20.776 42.016 1.00 36.13 ? 348 LEU B CD2 1 ATOM 1763 N N . PHE B 1 25 ? 18.728 20.026 44.834 1.00 36.62 ? 349 PHE B N 1 ATOM 1764 C CA . PHE B 1 25 ? 19.239 18.674 45.091 1.00 36.45 ? 349 PHE B CA 1 ATOM 1765 C C . PHE B 1 25 ? 20.432 18.602 46.045 1.00 36.78 ? 349 PHE B C 1 ATOM 1766 O O . PHE B 1 25 ? 20.591 17.611 46.745 1.00 38.01 ? 349 PHE B O 1 ATOM 1767 C CB . PHE B 1 25 ? 19.593 17.966 43.779 1.00 36.51 ? 349 PHE B CB 1 ATOM 1768 C CG . PHE B 1 25 ? 18.444 17.872 42.824 1.00 36.45 ? 349 PHE B CG 1 ATOM 1769 C CD1 . PHE B 1 25 ? 18.468 18.567 41.615 1.00 36.04 ? 349 PHE B CD1 1 ATOM 1770 C CD2 . PHE B 1 25 ? 17.327 17.108 43.135 1.00 35.86 ? 349 PHE B CD2 1 ATOM 1771 C CE1 . PHE B 1 25 ? 17.414 18.493 40.738 1.00 35.77 ? 349 PHE B CE1 1 ATOM 1772 C CE2 . PHE B 1 25 ? 16.261 17.037 42.251 1.00 35.23 ? 349 PHE B CE2 1 ATOM 1773 C CZ . PHE B 1 25 ? 16.312 17.723 41.050 1.00 35.73 ? 349 PHE B CZ 1 ATOM 1774 N N . ILE B 1 26 ? 21.283 19.616 46.069 1.00 37.26 ? 350 ILE B N 1 ATOM 1775 C CA . ILE B 1 26 ? 22.459 19.550 46.941 1.00 37.91 ? 350 ILE B CA 1 ATOM 1776 C C . ILE B 1 26 ? 22.147 20.212 48.291 1.00 38.94 ? 350 ILE B C 1 ATOM 1777 O O . ILE B 1 26 ? 22.123 19.545 49.323 1.00 35.60 ? 350 ILE B O 1 ATOM 1778 C CB . ILE B 1 26 ? 23.728 20.163 46.291 1.00 37.88 ? 350 ILE B CB 1 ATOM 1779 C CG1 . ILE B 1 26 ? 24.338 19.230 45.234 1.00 37.32 ? 350 ILE B CG1 1 ATOM 1780 C CG2 . ILE B 1 26 ? 24.831 20.407 47.341 1.00 37.19 ? 350 ILE B CG2 1 ATOM 1781 C CD1 . ILE B 1 26 ? 23.404 18.732 44.214 1.00 37.67 ? 350 ILE B CD1 1 ATOM 1782 N N . ARG B 1 27 ? 21.891 21.521 48.266 1.00 41.58 ? 351 ARG B N 1 ATOM 1783 C CA . ARG B 1 27 ? 21.515 22.266 49.469 1.00 42.59 ? 351 ARG B CA 1 ATOM 1784 C C . ARG B 1 27 ? 20.164 21.899 50.049 1.00 42.90 ? 351 ARG B C 1 ATOM 1785 O O . ARG B 1 27 ? 19.952 22.051 51.245 1.00 43.77 ? 351 ARG B O 1 ATOM 1786 C CB . ARG B 1 27 ? 21.466 23.750 49.168 1.00 44.19 ? 351 ARG B CB 1 ATOM 1787 C CG . ARG B 1 27 ? 22.797 24.415 48.966 1.00 45.58 ? 351 ARG B CG 1 ATOM 1788 C CD . ARG B 1 27 ? 22.616 25.924 49.112 1.00 47.07 ? 351 ARG B CD 1 ATOM 1789 N NE . ARG B 1 27 ? 22.180 26.269 50.459 1.00 48.50 ? 351 ARG B NE 1 ATOM 1790 C CZ . ARG B 1 27 ? 21.405 27.304 50.773 1.00 49.84 ? 351 ARG B CZ 1 ATOM 1791 N NH1 . ARG B 1 27 ? 20.942 28.112 49.827 1.00 50.79 ? 351 ARG B NH1 1 ATOM 1792 N NH2 . ARG B 1 27 ? 21.088 27.531 52.046 1.00 49.49 ? 351 ARG B NH2 1 ATOM 1793 N N . LYS B 1 28 ? 19.233 21.486 49.194 1.00 44.23 ? 352 LYS B N 1 ATOM 1794 C CA . LYS B 1 28 ? 17.882 21.131 49.613 1.00 44.62 ? 352 LYS B CA 1 ATOM 1795 C C . LYS B 1 28 ? 17.144 22.297 50.284 1.00 44.60 ? 352 LYS B C 1 ATOM 1796 O O . LYS B 1 28 ? 16.334 22.116 51.191 1.00 44.08 ? 352 LYS B O 1 ATOM 1797 C CB . LYS B 1 28 ? 17.899 19.888 50.504 1.00 46.58 ? 352 LYS B CB 1 ATOM 1798 C CG . LYS B 1 28 ? 18.334 18.610 49.766 1.00 46.91 ? 352 LYS B CG 1 ATOM 1799 C CD . LYS B 1 28 ? 18.137 17.395 50.662 1.00 47.82 ? 352 LYS B CD 1 ATOM 1800 C CE . LYS B 1 28 ? 18.715 16.114 50.059 1.00 48.49 ? 352 LYS B CE 1 ATOM 1801 N NZ . LYS B 1 28 ? 18.724 14.972 51.034 1.00 48.57 ? 352 LYS B NZ 1 ATOM 1802 N N . SER B 1 29 ? 17.412 23.499 49.785 1.00 44.45 ? 353 SER B N 1 ATOM 1803 C CA . SER B 1 29 ? 16.621 24.668 50.109 1.00 44.43 ? 353 SER B CA 1 ATOM 1804 C C . SER B 1 29 ? 16.269 25.409 48.815 1.00 41.70 ? 353 SER B C 1 ATOM 1805 O O . SER B 1 29 ? 16.770 26.499 48.551 1.00 40.02 ? 353 SER B O 1 ATOM 1806 C CB . SER B 1 29 ? 17.372 25.589 51.065 1.00 44.41 ? 353 SER B CB 1 ATOM 1807 O OG . SER B 1 29 ? 18.562 25.982 50.422 1.00 47.40 ? 353 SER B OG 1 ATOM 1808 N N . PRO B 1 30 ? 15.384 24.818 48.010 1.00 41.58 ? 354 PRO B N 1 ATOM 1809 C CA . PRO B 1 30 ? 14.990 25.481 46.771 1.00 41.20 ? 354 PRO B CA 1 ATOM 1810 C C . PRO B 1 30 ? 14.173 26.770 46.971 1.00 40.52 ? 354 PRO B C 1 ATOM 1811 O O . PRO B 1 30 ? 13.406 26.922 47.928 1.00 41.10 ? 354 PRO B O 1 ATOM 1812 C CB . PRO B 1 30 ? 14.174 24.410 46.057 1.00 41.47 ? 354 PRO B CB 1 ATOM 1813 C CG . PRO B 1 30 ? 13.657 23.536 47.131 1.00 41.12 ? 354 PRO B CG 1 ATOM 1814 C CD . PRO B 1 30 ? 14.749 23.496 48.158 1.00 41.70 ? 354 PRO B CD 1 ATOM 1815 N N . THR B 1 31 ? 14.345 27.708 46.062 1.00 40.38 ? 355 THR B N 1 ATOM 1816 C CA . THR B 1 31 ? 13.500 28.892 46.047 1.00 41.48 ? 355 THR B CA 1 ATOM 1817 C C . THR B 1 31 ? 13.021 29.108 44.622 1.00 39.23 ? 355 THR B C 1 ATOM 1818 O O . THR B 1 31 ? 13.652 28.655 43.698 1.00 41.22 ? 355 THR B O 1 ATOM 1819 C CB . THR B 1 31 ? 14.262 30.140 46.556 1.00 41.42 ? 355 THR B CB 1 ATOM 1820 O OG1 . THR B 1 31 ? 15.395 30.374 45.714 1.00 42.87 ? 355 THR B OG1 1 ATOM 1821 C CG2 . THR B 1 31 ? 14.761 29.958 47.987 1.00 42.10 ? 355 THR B CG2 1 ATOM 1822 N N . ILE B 1 32 ? 11.898 29.793 44.457 1.00 39.84 ? 356 ILE B N 1 ATOM 1823 C CA . ILE B 1 32 ? 11.482 30.321 43.153 1.00 38.79 ? 356 ILE B CA 1 ATOM 1824 C C . ILE B 1 32 ? 11.385 31.856 43.254 1.00 38.53 ? 356 ILE B C 1 ATOM 1825 O O . ILE B 1 32 ? 11.224 32.397 44.329 1.00 37.37 ? 356 ILE B O 1 ATOM 1826 C CB . ILE B 1 32 ? 10.154 29.681 42.672 1.00 38.25 ? 356 ILE B CB 1 ATOM 1827 C CG1 . ILE B 1 32 ? 9.027 29.989 43.658 1.00 36.02 ? 356 ILE B CG1 1 ATOM 1828 C CG2 . ILE B 1 32 ? 10.321 28.144 42.494 1.00 37.78 ? 356 ILE B CG2 1 ATOM 1829 C CD1 . ILE B 1 32 ? 7.696 29.413 43.278 1.00 34.99 ? 356 ILE B CD1 1 ATOM 1830 N N . THR B 1 33 ? 11.556 32.552 42.135 1.00 39.10 ? 357 THR B N 1 ATOM 1831 C CA . THR B 1 33 ? 11.614 34.011 42.136 1.00 39.98 ? 357 THR B CA 1 ATOM 1832 C C . THR B 1 33 ? 10.673 34.583 41.091 1.00 41.08 ? 357 THR B C 1 ATOM 1833 O O . THR B 1 33 ? 10.743 34.220 39.910 1.00 40.15 ? 357 THR B O 1 ATOM 1834 C CB . THR B 1 33 ? 13.014 34.532 41.774 1.00 39.58 ? 357 THR B CB 1 ATOM 1835 O OG1 . THR B 1 33 ? 13.969 34.048 42.726 1.00 40.10 ? 357 THR B OG1 1 ATOM 1836 C CG2 . THR B 1 33 ? 13.024 36.052 41.726 1.00 38.33 ? 357 THR B CG2 1 ATOM 1837 N N . CYS B 1 34 ? 9.822 35.496 41.544 1.00 41.79 ? 358 CYS B N 1 ATOM 1838 C CA . CYS B 1 34 ? 8.898 36.210 40.677 1.00 43.27 ? 358 CYS B CA 1 ATOM 1839 C C . CYS B 1 34 ? 9.452 37.612 40.448 1.00 43.23 ? 358 CYS B C 1 ATOM 1840 O O . CYS B 1 34 ? 9.522 38.416 41.367 1.00 43.44 ? 358 CYS B O 1 ATOM 1841 C CB . CYS B 1 34 ? 7.508 36.251 41.329 1.00 43.60 ? 358 CYS B CB 1 ATOM 1842 S SG . CYS B 1 34 ? 6.216 36.868 40.267 1.00 43.98 ? 358 CYS B SG 1 ATOM 1843 N N . LEU B 1 35 ? 9.889 37.874 39.224 1.00 44.92 ? 359 LEU B N 1 ATOM 1844 C CA . LEU B 1 35 ? 10.422 39.167 38.822 1.00 45.39 ? 359 LEU B CA 1 ATOM 1845 C C . LEU B 1 35 ? 9.385 39.935 38.017 1.00 46.19 ? 359 LEU B C 1 ATOM 1846 O O . LEU B 1 35 ? 8.831 39.434 37.041 1.00 45.31 ? 359 LEU B O 1 ATOM 1847 C CB . LEU B 1 35 ? 11.699 38.988 37.993 1.00 46.70 ? 359 LEU B CB 1 ATOM 1848 C CG . LEU B 1 35 ? 12.274 40.231 37.302 1.00 47.38 ? 359 LEU B CG 1 ATOM 1849 C CD1 . LEU B 1 35 ? 12.668 41.253 38.352 1.00 47.68 ? 359 LEU B CD1 1 ATOM 1850 C CD2 . LEU B 1 35 ? 13.469 39.880 36.408 1.00 47.19 ? 359 LEU B CD2 1 ATOM 1851 N N . VAL B 1 36 ? 9.122 41.163 38.452 1.00 47.21 ? 360 VAL B N 1 ATOM 1852 C CA . VAL B 1 36 ? 8.186 42.045 37.772 1.00 47.88 ? 360 VAL B CA 1 ATOM 1853 C C . VAL B 1 36 ? 8.952 43.276 37.289 1.00 48.69 ? 360 VAL B C 1 ATOM 1854 O O . VAL B 1 36 ? 9.611 43.954 38.070 1.00 46.67 ? 360 VAL B O 1 ATOM 1855 C CB . VAL B 1 36 ? 6.993 42.443 38.682 1.00 47.69 ? 360 VAL B CB 1 ATOM 1856 C CG1 . VAL B 1 36 ? 6.040 43.383 37.946 1.00 47.79 ? 360 VAL B CG1 1 ATOM 1857 C CG2 . VAL B 1 36 ? 6.248 41.211 39.158 1.00 47.08 ? 360 VAL B CG2 1 ATOM 1858 N N . VAL B 1 37 ? 8.905 43.500 35.979 1.00 50.90 ? 361 VAL B N 1 ATOM 1859 C CA . VAL B 1 37 ? 9.520 44.658 35.352 1.00 53.10 ? 361 VAL B CA 1 ATOM 1860 C C . VAL B 1 37 ? 8.454 45.679 34.927 1.00 54.65 ? 361 VAL B C 1 ATOM 1861 O O . VAL B 1 37 ? 7.433 45.337 34.335 1.00 54.05 ? 361 VAL B O 1 ATOM 1862 C CB . VAL B 1 37 ? 10.369 44.243 34.124 1.00 53.41 ? 361 VAL B CB 1 ATOM 1863 C CG1 . VAL B 1 37 ? 11.026 45.463 33.489 1.00 53.53 ? 361 VAL B CG1 1 ATOM 1864 C CG2 . VAL B 1 37 ? 11.419 43.209 34.528 1.00 53.35 ? 361 VAL B CG2 1 ATOM 1865 N N . ASP B 1 38 ? 8.708 46.946 35.236 1.00 57.22 ? 362 ASP B N 1 ATOM 1866 C CA . ASP B 1 38 ? 7.752 48.015 34.968 1.00 58.75 ? 362 ASP B CA 1 ATOM 1867 C C . ASP B 1 38 ? 8.487 49.189 34.355 1.00 59.25 ? 362 ASP B C 1 ATOM 1868 O O . ASP B 1 38 ? 9.221 49.888 35.046 1.00 58.90 ? 362 ASP B O 1 ATOM 1869 C CB . ASP B 1 38 ? 7.064 48.448 36.268 1.00 59.63 ? 362 ASP B CB 1 ATOM 1870 C CG . ASP B 1 38 ? 5.848 49.323 36.030 1.00 60.26 ? 362 ASP B CG 1 ATOM 1871 O OD1 . ASP B 1 38 ? 5.540 49.623 34.855 1.00 60.92 ? 362 ASP B OD1 1 ATOM 1872 O OD2 . ASP B 1 38 ? 5.191 49.698 37.027 1.00 60.85 ? 362 ASP B OD2 1 ATOM 1873 N N . LEU B 1 39 ? 8.288 49.394 33.057 1.00 60.58 ? 363 LEU B N 1 ATOM 1874 C CA . LEU B 1 39 ? 8.954 50.471 32.320 1.00 61.70 ? 363 LEU B CA 1 ATOM 1875 C C . LEU B 1 39 ? 8.507 51.872 32.712 1.00 62.27 ? 363 LEU B C 1 ATOM 1876 O O . LEU B 1 39 ? 9.323 52.797 32.797 1.00 61.93 ? 363 LEU B O 1 ATOM 1877 N N . ALA B 1 40 ? 7.206 52.026 32.953 1.00 62.94 ? 364 ALA B N 1 ATOM 1878 C CA . ALA B 1 40 ? 6.652 53.292 33.410 1.00 63.43 ? 364 ALA B CA 1 ATOM 1879 C C . ALA B 1 40 ? 5.999 53.128 34.785 1.00 63.85 ? 364 ALA B C 1 ATOM 1880 O O . ALA B 1 40 ? 4.813 52.822 34.866 1.00 63.92 ? 364 ALA B O 1 ATOM 1881 C CB . ALA B 1 40 ? 5.643 53.820 32.395 1.00 63.82 ? 364 ALA B CB 1 ATOM 1882 N N . PRO B 1 41 ? 6.775 53.327 35.869 1.00 64.43 ? 365 PRO B N 1 ATOM 1883 C CA . PRO B 1 41 ? 6.269 53.298 37.242 1.00 64.76 ? 365 PRO B CA 1 ATOM 1884 C C . PRO B 1 41 ? 5.146 54.301 37.504 1.00 65.46 ? 365 PRO B C 1 ATOM 1885 O O . PRO B 1 41 ? 5.396 55.501 37.651 1.00 65.47 ? 365 PRO B O 1 ATOM 1886 C CB . PRO B 1 41 ? 7.497 53.663 38.082 1.00 64.56 ? 365 PRO B CB 1 ATOM 1887 C CG . PRO B 1 41 ? 8.649 53.274 37.257 1.00 64.50 ? 365 PRO B CG 1 ATOM 1888 C CD . PRO B 1 41 ? 8.237 53.507 35.836 1.00 64.53 ? 365 PRO B CD 1 ATOM 1889 N N . SER B 1 42 ? 3.917 53.796 37.561 1.00 66.12 ? 366 SER B N 1 ATOM 1890 C CA . SER B 1 42 ? 2.753 54.597 37.932 1.00 66.38 ? 366 SER B CA 1 ATOM 1891 C C . SER B 1 42 ? 2.680 54.695 39.454 1.00 66.60 ? 366 SER B C 1 ATOM 1892 O O . SER B 1 42 ? 1.749 54.175 40.075 1.00 66.48 ? 366 SER B O 1 ATOM 1893 C CB . SER B 1 42 ? 1.480 53.958 37.371 1.00 66.27 ? 366 SER B CB 1 ATOM 1894 O OG . SER B 1 42 ? 0.322 54.589 37.878 1.00 66.30 ? 366 SER B OG 1 ATOM 1895 N N . LYS B 1 43 ? 3.669 55.373 40.036 1.00 66.87 ? 367 LYS B N 1 ATOM 1896 C CA . LYS B 1 43 ? 3.873 55.410 41.485 1.00 66.84 ? 367 LYS B CA 1 ATOM 1897 C C . LYS B 1 43 ? 2.704 54.811 42.263 1.00 66.75 ? 367 LYS B C 1 ATOM 1898 O O . LYS B 1 43 ? 1.764 55.509 42.646 1.00 66.89 ? 367 LYS B O 1 ATOM 1899 C CB . LYS B 1 43 ? 4.154 56.839 41.958 1.00 66.99 ? 367 LYS B CB 1 ATOM 1900 C CG . LYS B 1 43 ? 5.515 57.401 41.530 1.00 67.13 ? 367 LYS B CG 1 ATOM 1901 C CD . LYS B 1 43 ? 6.688 56.530 41.987 1.00 67.07 ? 367 LYS B CD 1 ATOM 1902 C CE . LYS B 1 43 ? 7.152 55.571 40.888 1.00 67.07 ? 367 LYS B CE 1 ATOM 1903 N NZ . LYS B 1 43 ? 8.054 54.488 41.379 1.00 66.78 ? 367 LYS B NZ 1 ATOM 1904 N N . GLY B 1 44 ? 2.784 53.502 42.483 1.00 66.36 ? 368 GLY B N 1 ATOM 1905 C CA . GLY B 1 44 ? 1.773 52.759 43.229 1.00 65.89 ? 368 GLY B CA 1 ATOM 1906 C C . GLY B 1 44 ? 2.357 51.437 43.694 1.00 65.23 ? 368 GLY B C 1 ATOM 1907 O O . GLY B 1 44 ? 3.559 51.195 43.539 1.00 65.09 ? 368 GLY B O 1 ATOM 1908 N N . THR B 1 45 ? 1.510 50.578 44.259 1.00 64.23 ? 369 THR B N 1 ATOM 1909 C CA . THR B 1 45 ? 1.972 49.308 44.818 1.00 63.33 ? 369 THR B CA 1 ATOM 1910 C C . THR B 1 45 ? 1.666 48.166 43.864 1.00 62.37 ? 369 THR B C 1 ATOM 1911 O O . THR B 1 45 ? 0.506 47.795 43.694 1.00 61.90 ? 369 THR B O 1 ATOM 1912 C CB . THR B 1 45 ? 1.302 48.985 46.177 1.00 63.29 ? 369 THR B CB 1 ATOM 1913 O OG1 . THR B 1 45 ? 1.625 49.996 47.140 1.00 63.13 ? 369 THR B OG1 1 ATOM 1914 C CG2 . THR B 1 45 ? 1.766 47.623 46.698 1.00 63.11 ? 369 THR B CG2 1 ATOM 1915 N N . VAL B 1 46 ? 2.700 47.620 43.230 1.00 61.68 ? 370 VAL B N 1 ATOM 1916 C CA . VAL B 1 46 ? 2.537 46.360 42.510 1.00 60.76 ? 370 VAL B CA 1 ATOM 1917 C C . VAL B 1 46 ? 2.556 45.252 43.544 1.00 59.25 ? 370 VAL B C 1 ATOM 1918 O O . VAL B 1 46 ? 3.572 45.026 44.186 1.00 58.80 ? 370 VAL B O 1 ATOM 1919 C CB . VAL B 1 46 ? 3.634 46.111 41.457 1.00 61.10 ? 370 VAL B CB 1 ATOM 1920 C CG1 . VAL B 1 46 ? 3.569 47.175 40.370 1.00 61.05 ? 370 VAL B CG1 1 ATOM 1921 C CG2 . VAL B 1 46 ? 5.014 46.045 42.108 1.00 61.20 ? 370 VAL B CG2 1 ATOM 1922 N N . GLN B 1 47 ? 1.414 44.594 43.725 1.00 58.29 ? 371 GLN B N 1 ATOM 1923 C CA . GLN B 1 47 ? 1.281 43.519 44.707 1.00 57.34 ? 371 GLN B CA 1 ATOM 1924 C C . GLN B 1 47 ? 1.613 42.152 44.111 1.00 55.55 ? 371 GLN B C 1 ATOM 1925 O O . GLN B 1 47 ? 1.026 41.754 43.108 1.00 54.53 ? 371 GLN B O 1 ATOM 1926 C CB . GLN B 1 47 ? -0.143 43.483 45.259 1.00 57.98 ? 371 GLN B CB 1 ATOM 1927 C CG . GLN B 1 47 ? -0.612 44.795 45.828 1.00 58.54 ? 371 GLN B CG 1 ATOM 1928 C CD . GLN B 1 47 ? -2.089 44.780 46.152 1.00 59.24 ? 371 GLN B CD 1 ATOM 1929 O OE1 . GLN B 1 47 ? -2.681 43.716 46.360 1.00 59.90 ? 371 GLN B OE1 1 ATOM 1930 N NE2 . GLN B 1 47 ? -2.699 45.966 46.184 1.00 59.67 ? 371 GLN B NE2 1 ATOM 1931 N N . LEU B 1 48 ? 2.553 41.448 44.740 1.00 54.49 ? 372 LEU B N 1 ATOM 1932 C CA . LEU B 1 48 ? 2.897 40.072 44.374 1.00 53.48 ? 372 LEU B CA 1 ATOM 1933 C C . LEU B 1 48 ? 2.343 39.095 45.412 1.00 51.32 ? 372 LEU B C 1 ATOM 1934 O O . LEU B 1 48 ? 2.694 39.147 46.589 1.00 50.24 ? 372 LEU B O 1 ATOM 1935 C CB . LEU B 1 48 ? 4.417 39.882 44.271 1.00 54.29 ? 372 LEU B CB 1 ATOM 1936 C CG . LEU B 1 48 ? 5.170 40.533 43.114 1.00 55.25 ? 372 LEU B CG 1 ATOM 1937 C CD1 . LEU B 1 48 ? 6.646 40.133 43.147 1.00 55.44 ? 372 LEU B CD1 1 ATOM 1938 C CD2 . LEU B 1 48 ? 4.543 40.108 41.802 1.00 56.39 ? 372 LEU B CD2 1 ATOM 1939 N N . THR B 1 49 ? 1.487 38.192 44.959 1.00 49.35 ? 373 THR B N 1 ATOM 1940 C CA . THR B 1 49 ? 0.867 37.226 45.846 1.00 47.51 ? 373 THR B CA 1 ATOM 1941 C C . THR B 1 49 ? 1.309 35.838 45.406 1.00 45.48 ? 373 THR B C 1 ATOM 1942 O O . THR B 1 49 ? 1.280 35.521 44.226 1.00 43.71 ? 373 THR B O 1 ATOM 1943 C CB . THR B 1 49 ? -0.688 37.320 45.796 1.00 47.40 ? 373 THR B CB 1 ATOM 1944 O OG1 . THR B 1 49 ? -1.095 38.670 46.024 1.00 47.93 ? 373 THR B OG1 1 ATOM 1945 C CG2 . THR B 1 49 ? -1.334 36.422 46.832 1.00 47.12 ? 373 THR B CG2 1 ATOM 1946 N N . TRP B 1 50 ? 1.697 35.021 46.380 1.00 44.32 ? 374 TRP B N 1 ATOM 1947 C CA . TRP B 1 50 ? 2.082 33.644 46.142 1.00 42.80 ? 374 TRP B CA 1 ATOM 1948 C C . TRP B 1 50 ? 0.965 32.693 46.557 1.00 42.02 ? 374 TRP B C 1 ATOM 1949 O O . TRP B 1 50 ? 0.255 32.929 47.534 1.00 41.26 ? 374 TRP B O 1 ATOM 1950 C CB . TRP B 1 50 ? 3.341 33.303 46.938 1.00 42.79 ? 374 TRP B CB 1 ATOM 1951 C CG . TRP B 1 50 ? 4.582 33.940 46.440 1.00 42.23 ? 374 TRP B CG 1 ATOM 1952 C CD1 . TRP B 1 50 ? 5.247 34.990 46.995 1.00 41.65 ? 374 TRP B CD1 1 ATOM 1953 C CD2 . TRP B 1 50 ? 5.341 33.549 45.286 1.00 42.07 ? 374 TRP B CD2 1 ATOM 1954 N NE1 . TRP B 1 50 ? 6.371 35.284 46.252 1.00 41.18 ? 374 TRP B NE1 1 ATOM 1955 C CE2 . TRP B 1 50 ? 6.451 34.416 45.201 1.00 41.38 ? 374 TRP B CE2 1 ATOM 1956 C CE3 . TRP B 1 50 ? 5.181 32.562 44.312 1.00 41.18 ? 374 TRP B CE3 1 ATOM 1957 C CZ2 . TRP B 1 50 ? 7.395 34.321 44.183 1.00 41.76 ? 374 TRP B CZ2 1 ATOM 1958 C CZ3 . TRP B 1 50 ? 6.125 32.469 43.306 1.00 41.53 ? 374 TRP B CZ3 1 ATOM 1959 C CH2 . TRP B 1 50 ? 7.223 33.334 43.263 1.00 41.28 ? 374 TRP B CH2 1 ATOM 1960 N N . SER B 1 51 ? 0.827 31.610 45.799 1.00 40.37 ? 375 SER B N 1 ATOM 1961 C CA . SER B 1 51 ? -0.134 30.569 46.104 1.00 39.56 ? 375 SER B CA 1 ATOM 1962 C C . SER B 1 51 ? 0.304 29.242 45.478 1.00 39.26 ? 375 SER B C 1 ATOM 1963 O O . SER B 1 51 ? 1.104 29.202 44.538 1.00 38.53 ? 375 SER B O 1 ATOM 1964 C CB . SER B 1 51 ? -1.546 30.961 45.637 1.00 39.73 ? 375 SER B CB 1 ATOM 1965 O OG . SER B 1 51 ? -1.627 31.113 44.234 1.00 39.59 ? 375 SER B OG 1 ATOM 1966 N N . ARG B 1 52 ? -0.225 28.159 46.037 1.00 38.25 ? 376 ARG B N 1 ATOM 1967 C CA . ARG B 1 52 ? -0.001 26.811 45.559 1.00 36.48 ? 376 ARG B CA 1 ATOM 1968 C C . ARG B 1 52 ? -1.281 26.249 44.979 1.00 35.77 ? 376 ARG B C 1 ATOM 1969 O O . ARG B 1 52 ? -2.357 26.525 45.481 1.00 36.23 ? 376 ARG B O 1 ATOM 1970 C CB . ARG B 1 52 ? 0.425 25.926 46.724 1.00 36.56 ? 376 ARG B CB 1 ATOM 1971 C CG . ARG B 1 52 ? 1.820 26.180 47.217 1.00 36.93 ? 376 ARG B CG 1 ATOM 1972 C CD . ARG B 1 52 ? 2.404 24.885 47.754 1.00 37.16 ? 376 ARG B CD 1 ATOM 1973 N NE . ARG B 1 52 ? 2.491 24.852 49.192 1.00 35.84 ? 376 ARG B NE 1 ATOM 1974 C CZ . ARG B 1 52 ? 2.814 23.777 49.906 1.00 35.50 ? 376 ARG B CZ 1 ATOM 1975 N NH1 . ARG B 1 52 ? 2.977 22.589 49.346 1.00 34.73 ? 376 ARG B NH1 1 ATOM 1976 N NH2 . ARG B 1 52 ? 2.888 23.884 51.222 1.00 36.39 ? 376 ARG B NH2 1 ATOM 1977 N N . ALA B 1 53 ? -1.151 25.429 43.944 1.00 36.26 ? 377 ALA B N 1 ATOM 1978 C CA . ALA B 1 53 ? -2.297 24.831 43.271 1.00 36.90 ? 377 ALA B CA 1 ATOM 1979 C C . ALA B 1 53 ? -3.083 23.922 44.202 1.00 35.75 ? 377 ALA B C 1 ATOM 1980 O O . ALA B 1 53 ? -4.298 23.813 44.091 1.00 35.94 ? 377 ALA B O 1 ATOM 1981 C CB . ALA B 1 53 ? -1.833 24.054 42.037 1.00 36.86 ? 377 ALA B CB 1 ATOM 1982 N N . SER B 1 54 ? -2.361 23.272 45.109 1.00 35.21 ? 378 SER B N 1 ATOM 1983 C CA . SER B 1 54 ? -2.918 22.323 46.060 1.00 35.05 ? 378 SER B CA 1 ATOM 1984 C C . SER B 1 54 ? -3.782 22.993 47.137 1.00 34.85 ? 378 SER B C 1 ATOM 1985 O O . SER B 1 54 ? -4.556 22.335 47.814 1.00 35.17 ? 378 SER B O 1 ATOM 1986 C CB . SER B 1 54 ? -1.767 21.553 46.730 1.00 35.00 ? 378 SER B CB 1 ATOM 1987 O OG . SER B 1 54 ? -0.932 22.433 47.478 1.00 33.69 ? 378 SER B OG 1 ATOM 1988 N N . GLY B 1 55 ? -3.628 24.298 47.311 1.00 35.23 ? 379 GLY B N 1 ATOM 1989 C CA . GLY B 1 55 ? -4.299 25.003 48.375 1.00 34.82 ? 379 GLY B CA 1 ATOM 1990 C C . GLY B 1 55 ? -3.462 25.066 49.644 1.00 35.96 ? 379 GLY B C 1 ATOM 1991 O O . GLY B 1 55 ? -3.858 25.685 50.620 1.00 36.80 ? 379 GLY B O 1 ATOM 1992 N N . LYS B 1 56 ? -2.298 24.430 49.654 1.00 37.38 ? 380 LYS B N 1 ATOM 1993 C CA . LYS B 1 56 ? -1.445 24.457 50.841 1.00 37.88 ? 380 LYS B CA 1 ATOM 1994 C C . LYS B 1 56 ? -0.795 25.823 51.008 1.00 37.91 ? 380 LYS B C 1 ATOM 1995 O O . LYS B 1 56 ? -0.701 26.588 50.044 1.00 36.59 ? 380 LYS B O 1 ATOM 1996 C CB . LYS B 1 56 ? -0.380 23.373 50.765 1.00 37.56 ? 380 LYS B CB 1 ATOM 1997 C CG . LYS B 1 56 ? -0.943 21.979 50.799 1.00 37.77 ? 380 LYS B CG 1 ATOM 1998 C CD . LYS B 1 56 ? 0.141 20.986 50.526 1.00 37.92 ? 380 LYS B CD 1 ATOM 1999 C CE . LYS B 1 56 ? -0.435 19.614 50.333 1.00 38.94 ? 380 LYS B CE 1 ATOM 2000 N NZ . LYS B 1 56 ? 0.683 18.708 50.017 1.00 39.87 ? 380 LYS B NZ 1 ATOM 2001 N N . PRO B 1 57 ? -0.385 26.142 52.249 1.00 39.14 ? 381 PRO B N 1 ATOM 2002 C CA . PRO B 1 57 ? 0.156 27.464 52.527 1.00 39.98 ? 381 PRO B CA 1 ATOM 2003 C C . PRO B 1 57 ? 1.553 27.645 51.959 1.00 40.37 ? 381 PRO B C 1 ATOM 2004 O O . PRO B 1 57 ? 2.321 26.689 51.797 1.00 39.98 ? 381 PRO B O 1 ATOM 2005 C CB . PRO B 1 57 ? 0.164 27.535 54.059 1.00 40.44 ? 381 PRO B CB 1 ATOM 2006 C CG . PRO B 1 57 ? 0.282 26.115 54.497 1.00 40.23 ? 381 PRO B CG 1 ATOM 2007 C CD . PRO B 1 57 ? -0.410 25.287 53.451 1.00 39.58 ? 381 PRO B CD 1 ATOM 2008 N N . VAL B 1 58 ? 1.860 28.894 51.643 1.00 41.19 ? 382 VAL B N 1 ATOM 2009 C CA . VAL B 1 58 ? 3.173 29.248 51.166 1.00 41.93 ? 382 VAL B CA 1 ATOM 2010 C C . VAL B 1 58 ? 3.962 29.806 52.336 1.00 42.63 ? 382 VAL B C 1 ATOM 2011 O O . VAL B 1 58 ? 3.378 30.345 53.268 1.00 42.06 ? 382 VAL B O 1 ATOM 2012 C CB . VAL B 1 58 ? 3.084 30.259 50.011 1.00 41.80 ? 382 VAL B CB 1 ATOM 2013 C CG1 . VAL B 1 58 ? 2.698 29.539 48.738 1.00 41.11 ? 382 VAL B CG1 1 ATOM 2014 C CG2 . VAL B 1 58 ? 2.106 31.370 50.354 1.00 41.78 ? 382 VAL B CG2 1 ATOM 2015 N N . GLN B 1 59 ? 5.280 29.618 52.313 1.00 44.61 ? 383 GLN B N 1 ATOM 2016 C CA . GLN B 1 59 ? 6.157 30.164 53.344 1.00 45.99 ? 383 GLN B CA 1 ATOM 2017 C C . GLN B 1 59 ? 6.191 31.677 53.164 1.00 46.42 ? 383 GLN B C 1 ATOM 2018 O O . GLN B 1 59 ? 5.628 32.214 52.205 1.00 47.24 ? 383 GLN B O 1 ATOM 2019 C CB . GLN B 1 59 ? 7.567 29.546 53.271 1.00 46.93 ? 383 GLN B CB 1 ATOM 2020 C CG . GLN B 1 59 ? 7.598 28.051 53.668 1.00 48.35 ? 383 GLN B CG 1 ATOM 2021 C CD . GLN B 1 59 ? 8.918 27.322 53.337 1.00 49.98 ? 383 GLN B CD 1 ATOM 2022 O OE1 . GLN B 1 59 ? 10.023 27.762 53.715 1.00 50.88 ? 383 GLN B OE1 1 ATOM 2023 N NE2 . GLN B 1 59 ? 8.797 26.178 52.650 1.00 49.69 ? 383 GLN B NE2 1 ATOM 2024 N N . HIS B 1 60 ? 6.803 32.373 54.109 1.00 47.09 ? 384 HIS B N 1 ATOM 2025 C CA . HIS B 1 60 ? 7.024 33.804 53.962 1.00 48.30 ? 384 HIS B CA 1 ATOM 2026 C C . HIS B 1 60 ? 8.029 34.037 52.835 1.00 48.03 ? 384 HIS B C 1 ATOM 2027 O O . HIS B 1 60 ? 9.037 33.336 52.727 1.00 48.13 ? 384 HIS B O 1 ATOM 2028 C CB . HIS B 1 60 ? 7.526 34.420 55.273 1.00 49.30 ? 384 HIS B CB 1 ATOM 2029 C CG . HIS B 1 60 ? 6.498 34.434 56.364 1.00 50.80 ? 384 HIS B CG 1 ATOM 2030 N ND1 . HIS B 1 60 ? 6.690 33.823 57.587 1.00 52.07 ? 384 HIS B ND1 1 ATOM 2031 C CD2 . HIS B 1 60 ? 5.258 34.978 56.408 1.00 51.65 ? 384 HIS B CD2 1 ATOM 2032 C CE1 . HIS B 1 60 ? 5.616 33.999 58.340 1.00 52.00 ? 384 HIS B CE1 1 ATOM 2033 N NE2 . HIS B 1 60 ? 4.733 34.697 57.648 1.00 52.07 ? 384 HIS B NE2 1 ATOM 2034 N N . SER B 1 61 ? 7.731 35.018 51.987 1.00 47.79 ? 385 SER B N 1 ATOM 2035 C CA . SER B 1 61 ? 8.597 35.351 50.857 1.00 47.28 ? 385 SER B CA 1 ATOM 2036 C C . SER B 1 61 ? 9.277 36.708 51.043 1.00 47.62 ? 385 SER B C 1 ATOM 2037 O O . SER B 1 61 ? 8.783 37.580 51.756 1.00 46.37 ? 385 SER B O 1 ATOM 2038 C CB . SER B 1 61 ? 7.780 35.374 49.576 1.00 46.55 ? 385 SER B CB 1 ATOM 2039 O OG . SER B 1 61 ? 6.766 36.343 49.696 1.00 45.99 ? 385 SER B OG 1 ATOM 2040 N N . THR B 1 62 ? 10.429 36.866 50.398 1.00 48.33 ? 386 THR B N 1 ATOM 2041 C CA . THR B 1 62 ? 11.185 38.109 50.441 1.00 49.44 ? 386 THR B CA 1 ATOM 2042 C C . THR B 1 62 ? 10.620 39.039 49.374 1.00 49.93 ? 386 THR B C 1 ATOM 2043 O O . THR B 1 62 ? 9.840 38.633 48.515 1.00 50.16 ? 386 THR B O 1 ATOM 2044 C CB . THR B 1 62 ? 12.704 37.870 50.202 1.00 49.91 ? 386 THR B CB 1 ATOM 2045 O OG1 . THR B 1 62 ? 13.205 36.919 51.151 1.00 50.54 ? 386 THR B OG1 1 ATOM 2046 C CG2 . THR B 1 62 ? 13.496 39.160 50.366 1.00 50.20 ? 386 THR B CG2 1 ATOM 2047 N N . ARG B 1 63 ? 10.968 40.312 49.454 1.00 50.10 ? 387 ARG B N 1 ATOM 2048 C CA . ARG B 1 63 ? 10.589 41.246 48.412 1.00 49.54 ? 387 ARG B CA 1 ATOM 2049 C C . ARG B 1 63 ? 11.632 42.342 48.337 1.00 50.33 ? 387 ARG B C 1 ATOM 2050 O O . ARG B 1 63 ? 12.190 42.745 49.358 1.00 49.65 ? 387 ARG B O 1 ATOM 2051 C CB . ARG B 1 63 ? 9.219 41.845 48.681 1.00 48.76 ? 387 ARG B CB 1 ATOM 2052 C CG . ARG B 1 63 ? 8.871 42.963 47.728 1.00 48.74 ? 387 ARG B CG 1 ATOM 2053 C CD . ARG B 1 63 ? 7.390 43.259 47.780 1.00 49.35 ? 387 ARG B CD 1 ATOM 2054 N NE . ARG B 1 63 ? 7.015 44.461 47.039 1.00 49.36 ? 387 ARG B NE 1 ATOM 2055 C CZ . ARG B 1 63 ? 5.812 44.668 46.510 1.00 49.81 ? 387 ARG B CZ 1 ATOM 2056 N NH1 . ARG B 1 63 ? 4.856 43.748 46.621 1.00 49.75 ? 387 ARG B NH1 1 ATOM 2057 N NH2 . ARG B 1 63 ? 5.569 45.801 45.859 1.00 50.33 ? 387 ARG B NH2 1 ATOM 2058 N N . LYS B 1 64 ? 11.886 42.807 47.119 1.00 51.57 ? 388 LYS B N 1 ATOM 2059 C CA . LYS B 1 64 ? 12.883 43.831 46.868 1.00 53.11 ? 388 LYS B CA 1 ATOM 2060 C C . LYS B 1 64 ? 12.472 44.676 45.664 1.00 53.39 ? 388 LYS B C 1 ATOM 2061 O O . LYS B 1 64 ? 12.347 44.165 44.552 1.00 53.41 ? 388 LYS B O 1 ATOM 2062 C CB . LYS B 1 64 ? 14.257 43.192 46.645 1.00 54.08 ? 388 LYS B CB 1 ATOM 2063 C CG . LYS B 1 64 ? 15.423 44.176 46.737 1.00 55.66 ? 388 LYS B CG 1 ATOM 2064 C CD . LYS B 1 64 ? 16.764 43.486 46.456 1.00 56.56 ? 388 LYS B CD 1 ATOM 2065 C CE . LYS B 1 64 ? 17.950 44.451 46.566 1.00 57.10 ? 388 LYS B CE 1 ATOM 2066 N NZ . LYS B 1 64 ? 19.211 43.852 46.010 1.00 57.40 ? 388 LYS B NZ 1 ATOM 2067 N N . GLU B 1 65 ? 12.242 45.965 45.905 1.00 54.15 ? 389 GLU B N 1 ATOM 2068 C CA . GLU B 1 65 ? 12.004 46.952 44.846 1.00 54.70 ? 389 GLU B CA 1 ATOM 2069 C C . GLU B 1 65 ? 13.286 47.710 44.520 1.00 55.07 ? 389 GLU B C 1 ATOM 2070 O O . GLU B 1 65 ? 13.938 48.250 45.419 1.00 54.55 ? 389 GLU B O 1 ATOM 2071 C CB . GLU B 1 65 ? 10.935 47.952 45.281 1.00 54.83 ? 389 GLU B CB 1 ATOM 2072 C CG . GLU B 1 65 ? 9.618 47.292 45.640 1.00 55.43 ? 389 GLU B CG 1 ATOM 2073 C CD . GLU B 1 65 ? 8.633 48.229 46.311 1.00 56.06 ? 389 GLU B CD 1 ATOM 2074 O OE1 . GLU B 1 65 ? 8.597 49.437 45.973 1.00 55.77 ? 389 GLU B OE1 1 ATOM 2075 O OE2 . GLU B 1 65 ? 7.892 47.736 47.192 1.00 57.22 ? 389 GLU B OE2 1 ATOM 2076 N N . GLU B 1 66 ? 13.647 47.732 43.239 1.00 55.65 ? 390 GLU B N 1 ATOM 2077 C CA . GLU B 1 66 ? 14.809 48.480 42.771 1.00 56.46 ? 390 GLU B CA 1 ATOM 2078 C C . GLU B 1 66 ? 14.411 49.457 41.661 1.00 56.27 ? 390 GLU B C 1 ATOM 2079 O O . GLU B 1 66 ? 13.805 49.071 40.661 1.00 55.84 ? 390 GLU B O 1 ATOM 2080 C CB . GLU B 1 66 ? 15.908 47.539 42.268 1.00 57.66 ? 390 GLU B CB 1 ATOM 2081 C CG . GLU B 1 66 ? 16.693 46.827 43.369 1.00 58.90 ? 390 GLU B CG 1 ATOM 2082 C CD . GLU B 1 66 ? 17.987 46.180 42.863 1.00 59.66 ? 390 GLU B CD 1 ATOM 2083 O OE1 . GLU B 1 66 ? 18.115 45.927 41.647 1.00 60.71 ? 390 GLU B OE1 1 ATOM 2084 O OE2 . GLU B 1 66 ? 18.890 45.915 43.682 1.00 60.23 ? 390 GLU B OE2 1 ATOM 2085 N N . LYS B 1 67 ? 14.737 50.730 41.861 1.00 56.09 ? 391 LYS B N 1 ATOM 2086 C CA . LYS B 1 67 ? 14.613 51.726 40.812 1.00 56.02 ? 391 LYS B CA 1 ATOM 2087 C C . LYS B 1 67 ? 15.877 51.658 39.961 1.00 55.73 ? 391 LYS B C 1 ATOM 2088 O O . LYS B 1 67 ? 16.992 51.678 40.481 1.00 55.31 ? 391 LYS B O 1 ATOM 2089 C CB . LYS B 1 67 ? 14.411 53.123 41.408 1.00 56.48 ? 391 LYS B CB 1 ATOM 2090 C CG . LYS B 1 67 ? 13.003 53.363 41.952 1.00 56.76 ? 391 LYS B CG 1 ATOM 2091 C CD . LYS B 1 67 ? 12.803 54.807 42.407 1.00 57.08 ? 391 LYS B CD 1 ATOM 2092 C CE . LYS B 1 67 ? 11.350 55.076 42.799 1.00 57.25 ? 391 LYS B CE 1 ATOM 2093 N NZ . LYS B 1 67 ? 11.096 56.505 43.153 1.00 57.06 ? 391 LYS B NZ 1 ATOM 2094 N N . GLN B 1 68 ? 15.693 51.547 38.649 1.00 55.71 ? 392 GLN B N 1 ATOM 2095 C CA . GLN B 1 68 ? 16.807 51.346 37.729 1.00 55.58 ? 392 GLN B CA 1 ATOM 2096 C C . GLN B 1 68 ? 17.251 52.656 37.092 1.00 55.74 ? 392 GLN B C 1 ATOM 2097 O O . GLN B 1 68 ? 16.583 53.690 37.217 1.00 55.35 ? 392 GLN B O 1 ATOM 2098 C CB . GLN B 1 68 ? 16.408 50.366 36.626 1.00 55.62 ? 392 GLN B CB 1 ATOM 2099 C CG . GLN B 1 68 ? 15.830 49.051 37.134 1.00 55.56 ? 392 GLN B CG 1 ATOM 2100 C CD . GLN B 1 68 ? 16.842 48.234 37.918 1.00 55.39 ? 392 GLN B CD 1 ATOM 2101 O OE1 . GLN B 1 68 ? 17.977 48.060 37.473 1.00 55.74 ? 392 GLN B OE1 1 ATOM 2102 N NE2 . GLN B 1 68 ? 16.441 47.732 39.084 1.00 54.49 ? 392 GLN B NE2 1 ATOM 2103 N N . ARG B 1 69 ? 18.378 52.589 36.390 1.00 55.73 ? 393 ARG B N 1 ATOM 2104 C CA . ARG B 1 69 ? 18.946 53.755 35.720 1.00 55.51 ? 393 ARG B CA 1 ATOM 2105 C C . ARG B 1 69 ? 17.987 54.351 34.690 1.00 56.84 ? 393 ARG B C 1 ATOM 2106 O O . ARG B 1 69 ? 17.890 55.573 34.563 1.00 56.79 ? 393 ARG B O 1 ATOM 2107 C CB . ARG B 1 69 ? 20.285 53.396 35.064 1.00 54.27 ? 393 ARG B CB 1 ATOM 2108 C CG . ARG B 1 69 ? 21.504 53.707 35.925 1.00 53.24 ? 393 ARG B CG 1 ATOM 2109 C CD . ARG B 1 69 ? 21.352 53.218 37.367 1.00 52.41 ? 393 ARG B CD 1 ATOM 2110 N NE . ARG B 1 69 ? 22.556 53.493 38.148 1.00 52.21 ? 393 ARG B NE 1 ATOM 2111 C CZ . ARG B 1 69 ? 22.642 53.409 39.474 1.00 51.71 ? 393 ARG B CZ 1 ATOM 2112 N NH1 . ARG B 1 69 ? 21.593 53.046 40.206 1.00 51.84 ? 393 ARG B NH1 1 ATOM 2113 N NH2 . ARG B 1 69 ? 23.790 53.693 40.074 1.00 51.47 ? 393 ARG B NH2 1 ATOM 2114 N N . ASN B 1 70 ? 17.260 53.492 33.981 1.00 58.28 ? 394 ASN B N 1 ATOM 2115 C CA . ASN B 1 70 ? 16.357 53.946 32.927 1.00 59.80 ? 394 ASN B CA 1 ATOM 2116 C C . ASN B 1 70 ? 14.991 54.434 33.429 1.00 59.05 ? 394 ASN B C 1 ATOM 2117 O O . ASN B 1 70 ? 14.057 54.604 32.645 1.00 58.58 ? 394 ASN B O 1 ATOM 2118 C CB . ASN B 1 70 ? 16.205 52.867 31.838 1.00 61.79 ? 394 ASN B CB 1 ATOM 2119 C CG . ASN B 1 70 ? 15.848 51.487 32.395 1.00 63.79 ? 394 ASN B CG 1 ATOM 2120 O OD1 . ASN B 1 70 ? 15.817 51.271 33.609 1.00 64.18 ? 394 ASN B OD1 1 ATOM 2121 N ND2 . ASN B 1 70 ? 15.587 50.543 31.491 1.00 65.62 ? 394 ASN B ND2 1 ATOM 2122 N N . GLY B 1 71 ? 14.887 54.686 34.732 1.00 58.62 ? 395 GLY B N 1 ATOM 2123 C CA . GLY B 1 71 ? 13.651 55.199 35.323 1.00 58.47 ? 395 GLY B CA 1 ATOM 2124 C C . GLY B 1 71 ? 12.533 54.174 35.348 1.00 58.27 ? 395 GLY B C 1 ATOM 2125 O O . GLY B 1 71 ? 11.413 54.446 34.910 1.00 58.40 ? 395 GLY B O 1 ATOM 2126 N N . THR B 1 72 ? 12.834 52.995 35.881 1.00 57.69 ? 396 THR B N 1 ATOM 2127 C CA . THR B 1 72 ? 11.895 51.878 35.860 1.00 57.40 ? 396 THR B CA 1 ATOM 2128 C C . THR B 1 72 ? 11.900 51.139 37.199 1.00 56.50 ? 396 THR B C 1 ATOM 2129 O O . THR B 1 72 ? 12.917 51.088 37.890 1.00 56.42 ? 396 THR B O 1 ATOM 2130 C CB . THR B 1 72 ? 12.227 50.897 34.709 1.00 57.32 ? 396 THR B CB 1 ATOM 2131 O OG1 . THR B 1 72 ? 11.495 49.681 34.876 1.00 57.54 ? 396 THR B OG1 1 ATOM 2132 C CG2 . THR B 1 72 ? 13.697 50.562 34.696 1.00 57.64 ? 396 THR B CG2 1 ATOM 2133 N N . LEU B 1 73 ? 10.755 50.574 37.561 1.00 55.63 ? 397 LEU B N 1 ATOM 2134 C CA . LEU B 1 73 ? 10.624 49.861 38.827 1.00 55.18 ? 397 LEU B CA 1 ATOM 2135 C C . LEU B 1 73 ? 10.698 48.350 38.602 1.00 54.47 ? 397 LEU B C 1 ATOM 2136 O O . LEU B 1 73 ? 9.904 47.789 37.853 1.00 54.76 ? 397 LEU B O 1 ATOM 2137 C CB . LEU B 1 73 ? 9.309 50.237 39.517 1.00 55.01 ? 397 LEU B CB 1 ATOM 2138 C CG . LEU B 1 73 ? 9.054 49.635 40.904 1.00 55.03 ? 397 LEU B CG 1 ATOM 2139 C CD1 . LEU B 1 73 ? 10.171 49.970 41.892 1.00 54.90 ? 397 LEU B CD1 1 ATOM 2140 C CD2 . LEU B 1 73 ? 7.701 50.094 41.427 1.00 55.08 ? 397 LEU B CD2 1 ATOM 2141 N N . THR B 1 74 ? 11.662 47.707 39.253 1.00 53.73 ? 398 THR B N 1 ATOM 2142 C CA . THR B 1 74 ? 11.815 46.253 39.222 1.00 52.71 ? 398 THR B CA 1 ATOM 2143 C C . THR B 1 74 ? 11.453 45.671 40.585 1.00 51.38 ? 398 THR B C 1 ATOM 2144 O O . THR B 1 74 ? 12.083 46.003 41.592 1.00 51.86 ? 398 THR B O 1 ATOM 2145 C CB . THR B 1 74 ? 13.263 45.855 38.863 1.00 53.25 ? 398 THR B CB 1 ATOM 2146 O OG1 . THR B 1 74 ? 13.410 45.840 37.423 1.00 54.45 ? 398 THR B OG1 1 ATOM 2147 C CG2 . THR B 1 74 ? 13.603 44.474 39.413 1.00 53.76 ? 398 THR B CG2 1 ATOM 2148 N N . VAL B 1 75 ? 10.427 44.819 40.625 1.00 49.52 ? 399 VAL B N 1 ATOM 2149 C CA . VAL B 1 75 ? 10.034 44.152 41.871 1.00 47.37 ? 399 VAL B CA 1 ATOM 2150 C C . VAL B 1 75 ? 10.319 42.653 41.806 1.00 46.84 ? 399 VAL B C 1 ATOM 2151 O O . VAL B 1 75 ? 9.838 41.947 40.921 1.00 46.44 ? 399 VAL B O 1 ATOM 2152 C CB . VAL B 1 75 ? 8.550 44.380 42.200 1.00 47.07 ? 399 VAL B CB 1 ATOM 2153 C CG1 . VAL B 1 75 ? 8.121 43.513 43.377 1.00 46.58 ? 399 VAL B CG1 1 ATOM 2154 C CG2 . VAL B 1 75 ? 8.294 45.854 42.494 1.00 47.20 ? 399 VAL B CG2 1 ATOM 2155 N N . THR B 1 76 ? 11.122 42.167 42.742 1.00 46.30 ? 400 THR B N 1 ATOM 2156 C CA . THR B 1 76 ? 11.461 40.751 42.794 1.00 45.37 ? 400 THR B CA 1 ATOM 2157 C C . THR B 1 76 ? 10.995 40.187 44.129 1.00 44.11 ? 400 THR B C 1 ATOM 2158 O O . THR B 1 76 ? 11.107 40.834 45.176 1.00 44.49 ? 400 THR B O 1 ATOM 2159 C CB . THR B 1 76 ? 12.983 40.498 42.649 1.00 46.07 ? 400 THR B CB 1 ATOM 2160 O OG1 . THR B 1 76 ? 13.671 41.045 43.774 1.00 47.01 ? 400 THR B OG1 1 ATOM 2161 C CG2 . THR B 1 76 ? 13.540 41.143 41.399 1.00 47.40 ? 400 THR B CG2 1 ATOM 2162 N N . SER B 1 77 ? 10.462 38.975 44.093 1.00 41.12 ? 401 SER B N 1 ATOM 2163 C CA . SER B 1 77 ? 10.077 38.291 45.305 1.00 39.25 ? 401 SER B CA 1 ATOM 2164 C C . SER B 1 77 ? 10.531 36.846 45.259 1.00 39.89 ? 401 SER B C 1 ATOM 2165 O O . SER B 1 77 ? 10.267 36.144 44.291 1.00 39.72 ? 401 SER B O 1 ATOM 2166 C CB . SER B 1 77 ? 8.562 38.337 45.482 1.00 39.20 ? 401 SER B CB 1 ATOM 2167 O OG . SER B 1 77 ? 8.194 37.684 46.684 1.00 38.06 ? 401 SER B OG 1 ATOM 2168 N N . THR B 1 78 ? 11.189 36.389 46.320 1.00 40.45 ? 402 THR B N 1 ATOM 2169 C CA . THR B 1 78 ? 11.713 35.036 46.345 1.00 40.20 ? 402 THR B CA 1 ATOM 2170 C C . THR B 1 78 ? 10.974 34.213 47.383 1.00 40.92 ? 402 THR B C 1 ATOM 2171 O O . THR B 1 78 ? 10.840 34.593 48.554 1.00 38.43 ? 402 THR B O 1 ATOM 2172 C CB . THR B 1 78 ? 13.230 35.029 46.587 1.00 40.88 ? 402 THR B CB 1 ATOM 2173 O OG1 . THR B 1 78 ? 13.828 35.885 45.613 1.00 40.10 ? 402 THR B OG1 1 ATOM 2174 C CG2 . THR B 1 78 ? 13.813 33.624 46.428 1.00 41.00 ? 402 THR B CG2 1 ATOM 2175 N N . LEU B 1 79 ? 10.465 33.077 46.922 1.00 40.44 ? 403 LEU B N 1 ATOM 2176 C CA . LEU B 1 79 ? 9.660 32.243 47.764 1.00 39.71 ? 403 LEU B CA 1 ATOM 2177 C C . LEU B 1 79 ? 10.416 30.951 48.019 1.00 39.68 ? 403 LEU B C 1 ATOM 2178 O O . LEU B 1 79 ? 10.699 30.204 47.079 1.00 39.12 ? 403 LEU B O 1 ATOM 2179 C CB . LEU B 1 79 ? 8.310 31.958 47.097 1.00 39.70 ? 403 LEU B CB 1 ATOM 2180 C CG . LEU B 1 79 ? 7.361 31.043 47.887 1.00 38.96 ? 403 LEU B CG 1 ATOM 2181 C CD1 . LEU B 1 79 ? 6.932 31.701 49.221 1.00 36.97 ? 403 LEU B CD1 1 ATOM 2182 C CD2 . LEU B 1 79 ? 6.171 30.622 47.032 1.00 38.12 ? 403 LEU B CD2 1 ATOM 2183 N N . PRO B 1 80 ? 10.751 30.691 49.292 1.00 39.03 ? 404 PRO B N 1 ATOM 2184 C CA . PRO B 1 80 ? 11.237 29.383 49.690 1.00 38.22 ? 404 PRO B CA 1 ATOM 2185 C C . PRO B 1 80 ? 10.195 28.303 49.466 1.00 38.16 ? 404 PRO B C 1 ATOM 2186 O O . PRO B 1 80 ? 8.997 28.493 49.716 1.00 38.03 ? 404 PRO B O 1 ATOM 2187 C CB . PRO B 1 80 ? 11.537 29.541 51.188 1.00 38.22 ? 404 PRO B CB 1 ATOM 2188 C CG . PRO B 1 80 ? 11.704 30.951 51.402 1.00 38.82 ? 404 PRO B CG 1 ATOM 2189 C CD . PRO B 1 80 ? 10.833 31.658 50.400 1.00 39.30 ? 404 PRO B CD 1 ATOM 2190 N N . VAL B 1 81 ? 10.669 27.153 49.010 1.00 38.35 ? 405 VAL B N 1 ATOM 2191 C CA . VAL B 1 81 ? 9.799 26.080 48.589 1.00 38.53 ? 405 VAL B CA 1 ATOM 2192 C C . VAL B 1 81 ? 10.246 24.769 49.246 1.00 37.46 ? 405 VAL B C 1 ATOM 2193 O O . VAL B 1 81 ? 11.434 24.525 49.473 1.00 37.33 ? 405 VAL B O 1 ATOM 2194 C CB . VAL B 1 81 ? 9.774 26.053 47.008 1.00 39.76 ? 405 VAL B CB 1 ATOM 2195 C CG1 . VAL B 1 81 ? 9.420 24.717 46.443 1.00 41.40 ? 405 VAL B CG1 1 ATOM 2196 C CG2 . VAL B 1 81 ? 8.804 27.115 46.509 1.00 39.16 ? 405 VAL B CG2 1 ATOM 2197 N N . GLY B 1 82 ? 9.281 23.923 49.581 1.00 37.86 ? 406 GLY B N 1 ATOM 2198 C CA . GLY B 1 82 ? 9.583 22.564 50.040 1.00 37.16 ? 406 GLY B CA 1 ATOM 2199 C C . GLY B 1 82 ? 10.270 21.746 48.955 1.00 37.30 ? 406 GLY B C 1 ATOM 2200 O O . GLY B 1 82 ? 9.854 21.763 47.799 1.00 37.05 ? 406 GLY B O 1 ATOM 2201 N N . THR B 1 83 ? 11.326 21.031 49.327 1.00 38.78 ? 407 THR B N 1 ATOM 2202 C CA . THR B 1 83 ? 12.087 20.202 48.409 1.00 40.20 ? 407 THR B CA 1 ATOM 2203 C C . THR B 1 83 ? 11.255 19.014 47.916 1.00 41.39 ? 407 THR B C 1 ATOM 2204 O O . THR B 1 83 ? 11.260 18.681 46.720 1.00 41.32 ? 407 THR B O 1 ATOM 2205 C CB . THR B 1 83 ? 13.384 19.669 49.062 1.00 40.90 ? 407 THR B CB 1 ATOM 2206 O OG1 . THR B 1 83 ? 14.115 20.748 49.646 1.00 41.94 ? 407 THR B OG1 1 ATOM 2207 C CG2 . THR B 1 83 ? 14.266 19.013 48.015 1.00 41.76 ? 407 THR B CG2 1 ATOM 2208 N N . ARG B 1 84 ? 10.540 18.384 48.840 1.00 42.37 ? 408 ARG B N 1 ATOM 2209 C CA . ARG B 1 84 ? 9.679 17.256 48.509 1.00 43.27 ? 408 ARG B CA 1 ATOM 2210 C C . ARG B 1 84 ? 8.477 17.747 47.713 1.00 41.87 ? 408 ARG B C 1 ATOM 2211 O O . ARG B 1 84 ? 8.063 17.132 46.734 1.00 41.57 ? 408 ARG B O 1 ATOM 2212 C CB . ARG B 1 84 ? 9.229 16.536 49.779 1.00 45.46 ? 408 ARG B CB 1 ATOM 2213 C CG . ARG B 1 84 ? 8.807 15.100 49.509 1.00 47.98 ? 408 ARG B CG 1 ATOM 2214 C CD . ARG B 1 84 ? 7.931 14.556 50.613 1.00 49.89 ? 408 ARG B CD 1 ATOM 2215 N NE . ARG B 1 84 ? 7.892 13.099 50.591 1.00 51.86 ? 408 ARG B NE 1 ATOM 2216 C CZ . ARG B 1 84 ? 7.001 12.361 51.245 1.00 53.35 ? 408 ARG B CZ 1 ATOM 2217 N NH1 . ARG B 1 84 ? 6.050 12.941 51.974 1.00 53.79 ? 408 ARG B NH1 1 ATOM 2218 N NH2 . ARG B 1 84 ? 7.057 11.035 51.156 1.00 53.85 ? 408 ARG B NH2 1 ATOM 2219 N N . ASP B 1 85 ? 7.958 18.898 48.105 1.00 41.19 ? 409 ASP B N 1 ATOM 2220 C CA . ASP B 1 85 ? 6.836 19.531 47.415 1.00 40.37 ? 409 ASP B CA 1 ATOM 2221 C C . ASP B 1 85 ? 7.128 19.831 45.945 1.00 39.28 ? 409 ASP B C 1 ATOM 2222 O O . ASP B 1 85 ? 6.307 19.584 45.058 1.00 38.88 ? 409 ASP B O 1 ATOM 2223 C CB . ASP B 1 85 ? 6.459 20.807 48.160 1.00 41.24 ? 409 ASP B CB 1 ATOM 2224 C CG . ASP B 1 85 ? 6.064 20.537 49.626 1.00 41.61 ? 409 ASP B CG 1 ATOM 2225 O OD1 . ASP B 1 85 ? 5.745 19.382 49.967 1.00 42.55 ? 409 ASP B OD1 1 ATOM 2226 O OD2 . ASP B 1 85 ? 6.076 21.470 50.444 1.00 41.86 ? 409 ASP B OD2 1 ATOM 2227 N N . TRP B 1 86 ? 8.321 20.342 45.674 1.00 38.81 ? 410 TRP B N 1 ATOM 2228 C CA . TRP B 1 86 ? 8.725 20.634 44.303 1.00 37.06 ? 410 TRP B CA 1 ATOM 2229 C C . TRP B 1 86 ? 8.854 19.354 43.469 1.00 37.62 ? 410 TRP B C 1 ATOM 2230 O O . TRP B 1 86 ? 8.303 19.247 42.370 1.00 35.84 ? 410 TRP B O 1 ATOM 2231 C CB . TRP B 1 86 ? 10.027 21.445 44.288 1.00 37.02 ? 410 TRP B CB 1 ATOM 2232 C CG . TRP B 1 86 ? 10.396 21.806 42.909 1.00 36.04 ? 410 TRP B CG 1 ATOM 2233 C CD1 . TRP B 1 86 ? 11.227 21.110 42.086 1.00 35.36 ? 410 TRP B CD1 1 ATOM 2234 C CD2 . TRP B 1 86 ? 9.858 22.882 42.129 1.00 36.51 ? 410 TRP B CD2 1 ATOM 2235 N NE1 . TRP B 1 86 ? 11.278 21.714 40.856 1.00 35.80 ? 410 TRP B NE1 1 ATOM 2236 C CE2 . TRP B 1 86 ? 10.438 22.792 40.844 1.00 36.25 ? 410 TRP B CE2 1 ATOM 2237 C CE3 . TRP B 1 86 ? 8.973 23.933 42.397 1.00 37.42 ? 410 TRP B CE3 1 ATOM 2238 C CZ2 . TRP B 1 86 ? 10.165 23.711 39.829 1.00 36.93 ? 410 TRP B CZ2 1 ATOM 2239 C CZ3 . TRP B 1 86 ? 8.687 24.840 41.375 1.00 37.89 ? 410 TRP B CZ3 1 ATOM 2240 C CH2 . TRP B 1 86 ? 9.290 24.721 40.110 1.00 37.05 ? 410 TRP B CH2 1 ATOM 2241 N N . ILE B 1 87 ? 9.563 18.380 44.023 1.00 39.22 ? 411 ILE B N 1 ATOM 2242 C CA . ILE B 1 87 ? 9.881 17.150 43.316 1.00 41.14 ? 411 ILE B CA 1 ATOM 2243 C C . ILE B 1 87 ? 8.672 16.253 43.081 1.00 41.04 ? 411 ILE B C 1 ATOM 2244 O O . ILE B 1 87 ? 8.689 15.408 42.199 1.00 42.61 ? 411 ILE B O 1 ATOM 2245 C CB . ILE B 1 87 ? 10.940 16.346 44.089 1.00 42.33 ? 411 ILE B CB 1 ATOM 2246 C CG1 . ILE B 1 87 ? 12.223 17.176 44.275 1.00 42.79 ? 411 ILE B CG1 1 ATOM 2247 C CG2 . ILE B 1 87 ? 11.177 15.013 43.396 1.00 42.99 ? 411 ILE B CG2 1 ATOM 2248 C CD1 . ILE B 1 87 ? 12.789 17.706 43.002 1.00 44.61 ? 411 ILE B CD1 1 ATOM 2249 N N . GLU B 1 88 ? 7.643 16.395 43.907 1.00 42.10 ? 412 GLU B N 1 ATOM 2250 C CA . GLU B 1 88 ? 6.395 15.657 43.737 1.00 41.85 ? 412 GLU B CA 1 ATOM 2251 C C . GLU B 1 88 ? 5.348 16.379 42.896 1.00 41.47 ? 412 GLU B C 1 ATOM 2252 O O . GLU B 1 88 ? 4.232 15.898 42.782 1.00 43.73 ? 412 GLU B O 1 ATOM 2253 C CB . GLU B 1 88 ? 5.810 15.330 45.106 1.00 42.88 ? 412 GLU B CB 1 ATOM 2254 C CG . GLU B 1 88 ? 6.690 14.374 45.880 1.00 43.79 ? 412 GLU B CG 1 ATOM 2255 C CD . GLU B 1 88 ? 6.162 14.053 47.249 1.00 44.36 ? 412 GLU B CD 1 ATOM 2256 O OE1 . GLU B 1 88 ? 5.228 14.745 47.711 1.00 45.36 ? 412 GLU B OE1 1 ATOM 2257 O OE2 . GLU B 1 88 ? 6.705 13.105 47.853 1.00 44.92 ? 412 GLU B OE2 1 ATOM 2258 N N . GLY B 1 89 ? 5.676 17.546 42.353 1.00 40.69 ? 413 GLY B N 1 ATOM 2259 C CA . GLY B 1 89 ? 4.914 18.148 41.271 1.00 39.81 ? 413 GLY B CA 1 ATOM 2260 C C . GLY B 1 89 ? 4.021 19.303 41.677 1.00 39.70 ? 413 GLY B C 1 ATOM 2261 O O . GLY B 1 89 ? 3.023 19.599 41.023 1.00 40.41 ? 413 GLY B O 1 ATOM 2262 N N . GLU B 1 90 ? 4.380 19.993 42.752 1.00 38.97 ? 414 GLU B N 1 ATOM 2263 C CA . GLU B 1 90 ? 3.558 21.090 43.200 1.00 37.76 ? 414 GLU B CA 1 ATOM 2264 C C . GLU B 1 90 ? 3.696 22.243 42.222 1.00 36.31 ? 414 GLU B C 1 ATOM 2265 O O . GLU B 1 90 ? 4.773 22.488 41.673 1.00 37.69 ? 414 GLU B O 1 ATOM 2266 C CB . GLU B 1 90 ? 3.911 21.522 44.639 1.00 37.11 ? 414 GLU B CB 1 ATOM 2267 C CG . GLU B 1 90 ? 3.148 22.726 45.171 1.00 35.71 ? 414 GLU B CG 1 ATOM 2268 C CD . GLU B 1 90 ? 1.653 22.467 45.410 1.00 36.67 ? 414 GLU B CD 1 ATOM 2269 O OE1 . GLU B 1 90 ? 0.841 22.661 44.479 1.00 36.75 ? 414 GLU B OE1 1 ATOM 2270 O OE2 . GLU B 1 90 ? 1.271 22.057 46.534 1.00 36.93 ? 414 GLU B OE2 1 ATOM 2271 N N . THR B 1 91 ? 2.585 22.937 42.012 1.00 35.28 ? 415 THR B N 1 ATOM 2272 C CA . THR B 1 91 ? 2.552 24.113 41.160 1.00 36.04 ? 415 THR B CA 1 ATOM 2273 C C . THR B 1 91 ? 2.474 25.353 42.029 1.00 35.67 ? 415 THR B C 1 ATOM 2274 O O . THR B 1 91 ? 1.612 25.464 42.898 1.00 34.16 ? 415 THR B O 1 ATOM 2275 C CB . THR B 1 91 ? 1.364 24.083 40.172 1.00 35.93 ? 415 THR B CB 1 ATOM 2276 O OG1 . THR B 1 91 ? 1.293 22.800 39.532 1.00 37.53 ? 415 THR B OG1 1 ATOM 2277 C CG2 . THR B 1 91 ? 1.506 25.162 39.130 1.00 35.60 ? 415 THR B CG2 1 ATOM 2278 N N . TYR B 1 92 ? 3.395 26.280 41.788 1.00 37.25 ? 416 TYR B N 1 ATOM 2279 C CA . TYR B 1 92 ? 3.440 27.554 42.486 1.00 36.54 ? 416 TYR B CA 1 ATOM 2280 C C . TYR B 1 92 ? 3.066 28.716 41.559 1.00 37.31 ? 416 TYR B C 1 ATOM 2281 O O . TYR B 1 92 ? 3.460 28.767 40.383 1.00 38.61 ? 416 TYR B O 1 ATOM 2282 C CB . TYR B 1 92 ? 4.839 27.762 43.067 1.00 37.01 ? 416 TYR B CB 1 ATOM 2283 C CG . TYR B 1 92 ? 5.240 26.694 44.045 1.00 36.40 ? 416 TYR B CG 1 ATOM 2284 C CD1 . TYR B 1 92 ? 5.698 25.472 43.594 1.00 36.27 ? 416 TYR B CD1 1 ATOM 2285 C CD2 . TYR B 1 92 ? 5.190 26.912 45.423 1.00 36.82 ? 416 TYR B CD2 1 ATOM 2286 C CE1 . TYR B 1 92 ? 6.060 24.486 44.461 1.00 36.67 ? 416 TYR B CE1 1 ATOM 2287 C CE2 . TYR B 1 92 ? 5.570 25.912 46.306 1.00 36.04 ? 416 TYR B CE2 1 ATOM 2288 C CZ . TYR B 1 92 ? 5.978 24.701 45.811 1.00 35.08 ? 416 TYR B CZ 1 ATOM 2289 O OH . TYR B 1 92 ? 6.353 23.671 46.626 1.00 34.87 ? 416 TYR B OH 1 ATOM 2290 N N . GLN B 1 93 ? 2.296 29.656 42.090 1.00 38.94 ? 417 GLN B N 1 ATOM 2291 C CA . GLN B 1 93 ? 1.788 30.758 41.293 1.00 41.81 ? 417 GLN B CA 1 ATOM 2292 C C . GLN B 1 93 ? 2.136 32.116 41.892 1.00 42.48 ? 417 GLN B C 1 ATOM 2293 O O . GLN B 1 93 ? 2.165 32.309 43.109 1.00 41.60 ? 417 GLN B O 1 ATOM 2294 C CB . GLN B 1 93 ? 0.265 30.637 41.065 1.00 43.78 ? 417 GLN B CB 1 ATOM 2295 C CG . GLN B 1 93 ? -0.313 31.789 40.226 1.00 45.87 ? 417 GLN B CG 1 ATOM 2296 C CD . GLN B 1 93 ? -1.815 31.701 40.012 1.00 47.95 ? 417 GLN B CD 1 ATOM 2297 O OE1 . GLN B 1 93 ? -2.346 30.634 39.657 1.00 50.17 ? 417 GLN B OE1 1 ATOM 2298 N NE2 . GLN B 1 93 ? -2.509 32.826 40.224 1.00 48.39 ? 417 GLN B NE2 1 ATOM 2299 N N . CYS B 1 94 ? 2.412 33.057 41.002 1.00 44.05 ? 418 CYS B N 1 ATOM 2300 C CA . CYS B 1 94 ? 2.653 34.427 41.385 1.00 45.22 ? 418 CYS B CA 1 ATOM 2301 C C . CYS B 1 94 ? 1.589 35.285 40.693 1.00 45.46 ? 418 CYS B C 1 ATOM 2302 O O . CYS B 1 94 ? 1.468 35.296 39.468 1.00 44.53 ? 418 CYS B O 1 ATOM 2303 C CB . CYS B 1 94 ? 4.077 34.828 40.991 1.00 45.99 ? 418 CYS B CB 1 ATOM 2304 S SG . CYS B 1 94 ? 4.484 36.576 41.307 1.00 48.07 ? 418 CYS B SG 1 ATOM 2305 N N . ARG B 1 95 ? 0.783 35.972 41.493 1.00 46.59 ? 419 ARG B N 1 ATOM 2306 C CA . ARG B 1 95 ? -0.265 36.841 40.965 1.00 47.44 ? 419 ARG B CA 1 ATOM 2307 C C . ARG B 1 95 ? 0.172 38.287 41.140 1.00 47.15 ? 419 ARG B C 1 ATOM 2308 O O . ARG B 1 95 ? 0.377 38.732 42.255 1.00 46.97 ? 419 ARG B O 1 ATOM 2309 C CB . ARG B 1 95 ? -1.596 36.597 41.687 1.00 47.72 ? 419 ARG B CB 1 ATOM 2310 C CG . ARG B 1 95 ? -2.743 37.470 41.191 1.00 48.43 ? 419 ARG B CG 1 ATOM 2311 C CD . ARG B 1 95 ? -4.016 37.243 42.009 1.00 49.31 ? 419 ARG B CD 1 ATOM 2312 N NE . ARG B 1 95 ? -5.125 38.103 41.594 1.00 49.81 ? 419 ARG B NE 1 ATOM 2313 C CZ . ARG B 1 95 ? -5.941 37.840 40.575 1.00 50.64 ? 419 ARG B CZ 1 ATOM 2314 N NH1 . ARG B 1 95 ? -5.787 36.739 39.844 1.00 50.59 ? 419 ARG B NH1 1 ATOM 2315 N NH2 . ARG B 1 95 ? -6.916 38.691 40.274 1.00 50.50 ? 419 ARG B NH2 1 ATOM 2316 N N . VAL B 1 96 ? 0.346 38.999 40.034 1.00 48.10 ? 420 VAL B N 1 ATOM 2317 C CA . VAL B 1 96 ? 0.737 40.403 40.079 1.00 49.07 ? 420 VAL B CA 1 ATOM 2318 C C . VAL B 1 96 ? -0.471 41.302 39.827 1.00 50.62 ? 420 VAL B C 1 ATOM 2319 O O . VAL B 1 96 ? -1.310 41.011 38.978 1.00 50.73 ? 420 VAL B O 1 ATOM 2320 C CB . VAL B 1 96 ? 1.829 40.746 39.043 1.00 48.39 ? 420 VAL B CB 1 ATOM 2321 C CG1 . VAL B 1 96 ? 2.209 42.207 39.163 1.00 47.56 ? 420 VAL B CG1 1 ATOM 2322 C CG2 . VAL B 1 96 ? 3.041 39.853 39.233 1.00 47.47 ? 420 VAL B CG2 1 ATOM 2323 N N . THR B 1 97 ? -0.531 42.403 40.569 1.00 52.96 ? 421 THR B N 1 ATOM 2324 C CA . THR B 1 97 ? -1.663 43.309 40.538 1.00 55.03 ? 421 THR B CA 1 ATOM 2325 C C . THR B 1 97 ? -1.182 44.744 40.763 1.00 56.64 ? 421 THR B C 1 ATOM 2326 O O . THR B 1 97 ? -0.167 44.968 41.417 1.00 56.26 ? 421 THR B O 1 ATOM 2327 C CB . THR B 1 97 ? -2.701 42.916 41.620 1.00 55.32 ? 421 THR B CB 1 ATOM 2328 O OG1 . THR B 1 97 ? -3.387 41.721 41.223 1.00 55.52 ? 421 THR B OG1 1 ATOM 2329 C CG2 . THR B 1 97 ? -3.707 44.018 41.829 1.00 55.96 ? 421 THR B CG2 1 ATOM 2330 N N . HIS B 1 98 ? -1.916 45.697 40.194 1.00 58.96 ? 422 HIS B N 1 ATOM 2331 C CA . HIS B 1 98 ? -1.696 47.127 40.392 1.00 60.81 ? 422 HIS B CA 1 ATOM 2332 C C . HIS B 1 98 ? -3.054 47.828 40.248 1.00 62.49 ? 422 HIS B C 1 ATOM 2333 O O . HIS B 1 98 ? -3.857 47.435 39.396 1.00 62.60 ? 422 HIS B O 1 ATOM 2334 C CB . HIS B 1 98 ? -0.710 47.658 39.349 1.00 61.09 ? 422 HIS B CB 1 ATOM 2335 C CG . HIS B 1 98 ? -0.188 49.032 39.643 1.00 61.45 ? 422 HIS B CG 1 ATOM 2336 N ND1 . HIS B 1 98 ? -0.772 50.178 39.146 1.00 61.63 ? 422 HIS B ND1 1 ATOM 2337 C CD2 . HIS B 1 98 ? 0.873 49.444 40.379 1.00 61.80 ? 422 HIS B CD2 1 ATOM 2338 C CE1 . HIS B 1 98 ? -0.098 51.234 39.566 1.00 61.62 ? 422 HIS B CE1 1 ATOM 2339 N NE2 . HIS B 1 98 ? 0.908 50.816 40.313 1.00 61.64 ? 422 HIS B NE2 1 ATOM 2340 N N . PRO B 1 99 ? -3.326 48.855 41.080 1.00 64.13 ? 423 PRO B N 1 ATOM 2341 C CA . PRO B 1 99 ? -4.609 49.557 41.004 1.00 64.79 ? 423 PRO B CA 1 ATOM 2342 C C . PRO B 1 99 ? -5.000 49.927 39.571 1.00 65.67 ? 423 PRO B C 1 ATOM 2343 O O . PRO B 1 99 ? -6.130 49.671 39.150 1.00 65.61 ? 423 PRO B O 1 ATOM 2344 C CB . PRO B 1 99 ? -4.367 50.822 41.838 1.00 64.79 ? 423 PRO B CB 1 ATOM 2345 C CG . PRO B 1 99 ? -3.323 50.434 42.821 1.00 64.69 ? 423 PRO B CG 1 ATOM 2346 C CD . PRO B 1 99 ? -2.454 49.411 42.134 1.00 64.50 ? 423 PRO B CD 1 ATOM 2347 N N . HIS B 1 100 ? -4.061 50.516 38.832 1.00 66.62 ? 424 HIS B N 1 ATOM 2348 C CA . HIS B 1 100 ? -4.306 50.945 37.459 1.00 67.14 ? 424 HIS B CA 1 ATOM 2349 C C . HIS B 1 100 ? -3.548 50.071 36.457 1.00 67.21 ? 424 HIS B C 1 ATOM 2350 O O . HIS B 1 100 ? -2.393 50.343 36.122 1.00 66.89 ? 424 HIS B O 1 ATOM 2351 C CB . HIS B 1 100 ? -3.927 52.423 37.291 1.00 67.58 ? 424 HIS B CB 1 ATOM 2352 C CG . HIS B 1 100 ? -4.377 53.018 35.992 1.00 67.80 ? 424 HIS B CG 1 ATOM 2353 N ND1 . HIS B 1 100 ? -5.688 53.363 35.745 1.00 67.91 ? 424 HIS B ND1 1 ATOM 2354 C CD2 . HIS B 1 100 ? -3.689 53.322 34.866 1.00 67.99 ? 424 HIS B CD2 1 ATOM 2355 C CE1 . HIS B 1 100 ? -5.789 53.856 34.524 1.00 68.11 ? 424 HIS B CE1 1 ATOM 2356 N NE2 . HIS B 1 100 ? -4.590 53.840 33.968 1.00 68.13 ? 424 HIS B NE2 1 ATOM 2357 N N . LEU B 1 101 ? -4.214 49.012 36.002 1.00 67.46 ? 425 LEU B N 1 ATOM 2358 C CA . LEU B 1 101 ? -3.689 48.122 34.969 1.00 67.44 ? 425 LEU B CA 1 ATOM 2359 C C . LEU B 1 101 ? -4.839 47.356 34.303 1.00 66.92 ? 425 LEU B C 1 ATOM 2360 O O . LEU B 1 101 ? -5.960 47.345 34.813 1.00 67.49 ? 425 LEU B O 1 ATOM 2361 C CB . LEU B 1 101 ? -2.656 47.156 35.561 1.00 68.04 ? 425 LEU B CB 1 ATOM 2362 C CG . LEU B 1 101 ? -3.081 46.123 36.615 1.00 68.34 ? 425 LEU B CG 1 ATOM 2363 C CD1 . LEU B 1 101 ? -4.386 45.415 36.255 1.00 68.51 ? 425 LEU B CD1 1 ATOM 2364 C CD2 . LEU B 1 101 ? -1.961 45.098 36.819 1.00 68.19 ? 425 LEU B CD2 1 ATOM 2365 N N . PRO B 1 102 ? -4.580 46.726 33.148 1.00 65.93 ? 426 PRO B N 1 ATOM 2366 C CA . PRO B 1 102 ? -5.674 46.000 32.491 1.00 64.95 ? 426 PRO B CA 1 ATOM 2367 C C . PRO B 1 102 ? -6.251 44.885 33.366 1.00 63.23 ? 426 PRO B C 1 ATOM 2368 O O . PRO B 1 102 ? -7.397 44.988 33.808 1.00 63.58 ? 426 PRO B O 1 ATOM 2369 C CB . PRO B 1 102 ? -5.025 45.436 31.215 1.00 65.54 ? 426 PRO B CB 1 ATOM 2370 C CG . PRO B 1 102 ? -3.536 45.560 31.423 1.00 65.88 ? 426 PRO B CG 1 ATOM 2371 C CD . PRO B 1 102 ? -3.343 46.723 32.346 1.00 65.90 ? 426 PRO B CD 1 ATOM 2372 N N . ARG B 1 103 ? -5.465 43.836 33.607 1.00 60.93 ? 427 ARG B N 1 ATOM 2373 C CA . ARG B 1 103 ? -5.874 42.738 34.485 1.00 59.02 ? 427 ARG B CA 1 ATOM 2374 C C . ARG B 1 103 ? -4.670 42.110 35.195 1.00 58.90 ? 427 ARG B C 1 ATOM 2375 O O . ARG B 1 103 ? -3.514 42.393 34.855 1.00 58.86 ? 427 ARG B O 1 ATOM 2376 C CB . ARG B 1 103 ? -6.624 41.663 33.690 1.00 57.87 ? 427 ARG B CB 1 ATOM 2377 C CG . ARG B 1 103 ? -5.788 40.956 32.616 1.00 56.68 ? 427 ARG B CG 1 ATOM 2378 C CD . ARG B 1 103 ? -6.597 39.878 31.893 1.00 55.56 ? 427 ARG B CD 1 ATOM 2379 N NE . ARG B 1 103 ? -6.994 38.808 32.806 1.00 54.56 ? 427 ARG B NE 1 ATOM 2380 C CZ . ARG B 1 103 ? -6.167 37.878 33.279 1.00 54.23 ? 427 ARG B CZ 1 ATOM 2381 N NH1 . ARG B 1 103 ? -4.885 37.883 32.919 1.00 54.36 ? 427 ARG B NH1 1 ATOM 2382 N NH2 . ARG B 1 103 ? -6.613 36.943 34.121 1.00 53.66 ? 427 ARG B NH2 1 ATOM 2383 N N . ALA B 1 104 ? -4.960 41.249 36.174 1.00 58.45 ? 428 ALA B N 1 ATOM 2384 C CA . ALA B 1 104 ? -3.932 40.550 36.944 1.00 57.97 ? 428 ALA B CA 1 ATOM 2385 C C . ALA B 1 104 ? -3.110 39.611 36.069 1.00 57.47 ? 428 ALA B C 1 ATOM 2386 O O . ALA B 1 104 ? -3.664 38.791 35.338 1.00 57.08 ? 428 ALA B O 1 ATOM 2387 C CB . ALA B 1 104 ? -4.564 39.765 38.082 1.00 57.84 ? 428 ALA B CB 1 ATOM 2388 N N . LEU B 1 105 ? -1.788 39.754 36.144 1.00 57.12 ? 429 LEU B N 1 ATOM 2389 C CA . LEU B 1 105 ? -0.859 38.838 35.488 1.00 56.66 ? 429 LEU B CA 1 ATOM 2390 C C . LEU B 1 105 ? -0.595 37.640 36.398 1.00 55.74 ? 429 LEU B C 1 ATOM 2391 O O . LEU B 1 105 ? -0.251 37.794 37.567 1.00 55.04 ? 429 LEU B O 1 ATOM 2392 C CB . LEU B 1 105 ? 0.468 39.532 35.179 1.00 56.99 ? 429 LEU B CB 1 ATOM 2393 C CG . LEU B 1 105 ? 0.484 40.698 34.190 1.00 57.20 ? 429 LEU B CG 1 ATOM 2394 C CD1 . LEU B 1 105 ? 1.894 41.295 34.159 1.00 57.18 ? 429 LEU B CD1 1 ATOM 2395 C CD2 . LEU B 1 105 ? 0.037 40.256 32.795 1.00 57.02 ? 429 LEU B CD2 1 ATOM 2396 N N . MET B 1 106 ? -0.761 36.445 35.852 1.00 55.24 ? 430 MET B N 1 ATOM 2397 C CA . MET B 1 106 ? -0.594 35.224 36.621 1.00 54.63 ? 430 MET B CA 1 ATOM 2398 C C . MET B 1 106 ? 0.479 34.397 35.951 1.00 52.20 ? 430 MET B C 1 ATOM 2399 O O . MET B 1 106 ? 0.396 34.108 34.760 1.00 51.88 ? 430 MET B O 1 ATOM 2400 C CB . MET B 1 106 ? -1.904 34.444 36.670 1.00 56.68 ? 430 MET B CB 1 ATOM 2401 C CG . MET B 1 106 ? -2.998 35.159 37.443 1.00 58.30 ? 430 MET B CG 1 ATOM 2402 S SD . MET B 1 106 ? -4.475 34.143 37.591 1.00 61.36 ? 430 MET B SD 1 ATOM 2403 C CE . MET B 1 106 ? -5.155 34.250 35.921 1.00 60.42 ? 430 MET B CE 1 ATOM 2404 N N . ARG B 1 107 ? 1.503 34.059 36.725 1.00 49.61 ? 431 ARG B N 1 ATOM 2405 C CA . ARG B 1 107 ? 2.594 33.214 36.270 1.00 46.91 ? 431 ARG B CA 1 ATOM 2406 C C . ARG B 1 107 ? 2.604 31.980 37.172 1.00 44.97 ? 431 ARG B C 1 ATOM 2407 O O . ARG B 1 107 ? 2.466 32.095 38.382 1.00 43.78 ? 431 ARG B O 1 ATOM 2408 C CB . ARG B 1 107 ? 3.926 33.977 36.341 1.00 46.39 ? 431 ARG B CB 1 ATOM 2409 C CG . ARG B 1 107 ? 3.999 35.230 35.464 1.00 46.20 ? 431 ARG B CG 1 ATOM 2410 C CD . ARG B 1 107 ? 3.941 34.879 33.975 1.00 45.90 ? 431 ARG B CD 1 ATOM 2411 N NE . ARG B 1 107 ? 3.999 36.051 33.110 1.00 45.85 ? 431 ARG B NE 1 ATOM 2412 C CZ . ARG B 1 107 ? 2.948 36.776 32.730 1.00 45.51 ? 431 ARG B CZ 1 ATOM 2413 N NH1 . ARG B 1 107 ? 1.724 36.479 33.133 1.00 45.13 ? 431 ARG B NH1 1 ATOM 2414 N NH2 . ARG B 1 107 ? 3.132 37.818 31.937 1.00 46.06 ? 431 ARG B NH2 1 ATOM 2415 N N . SER B 1 108 ? 2.729 30.798 36.575 1.00 43.17 ? 432 SER B N 1 ATOM 2416 C CA . SER B 1 108 ? 2.853 29.569 37.344 1.00 41.78 ? 432 SER B CA 1 ATOM 2417 C C . SER B 1 108 ? 4.108 28.782 36.962 1.00 39.99 ? 432 SER B C 1 ATOM 2418 O O . SER B 1 108 ? 4.636 28.927 35.864 1.00 40.52 ? 432 SER B O 1 ATOM 2419 C CB . SER B 1 108 ? 1.594 28.703 37.236 1.00 41.84 ? 432 SER B CB 1 ATOM 2420 O OG . SER B 1 108 ? 1.355 28.272 35.917 1.00 42.82 ? 432 SER B OG 1 ATOM 2421 N N . THR B 1 109 ? 4.608 27.985 37.906 1.00 37.90 ? 433 THR B N 1 ATOM 2422 C CA . THR B 1 109 ? 5.805 27.176 37.689 1.00 35.94 ? 433 THR B CA 1 ATOM 2423 C C . THR B 1 109 ? 5.736 25.831 38.415 1.00 34.89 ? 433 THR B C 1 ATOM 2424 O O . THR B 1 109 ? 5.131 25.698 39.486 1.00 36.81 ? 433 THR B O 1 ATOM 2425 C CB . THR B 1 109 ? 7.078 27.939 38.092 1.00 35.90 ? 433 THR B CB 1 ATOM 2426 O OG1 . THR B 1 109 ? 8.219 27.193 37.672 1.00 36.46 ? 433 THR B OG1 1 ATOM 2427 C CG2 . THR B 1 109 ? 7.153 28.196 39.606 1.00 35.18 ? 433 THR B CG2 1 ATOM 2428 N N . THR B 1 110 ? 6.331 24.815 37.806 1.00 32.58 ? 434 THR B N 1 ATOM 2429 C CA . THR B 1 110 ? 6.276 23.453 38.318 1.00 29.81 ? 434 THR B CA 1 ATOM 2430 C C . THR B 1 110 ? 7.388 22.669 37.671 1.00 29.32 ? 434 THR B C 1 ATOM 2431 O O . THR B 1 110 ? 7.966 23.106 36.679 1.00 30.96 ? 434 THR B O 1 ATOM 2432 C CB . THR B 1 110 ? 4.910 22.760 38.046 1.00 30.66 ? 434 THR B CB 1 ATOM 2433 O OG1 . THR B 1 110 ? 4.865 21.476 38.680 1.00 28.95 ? 434 THR B OG1 1 ATOM 2434 C CG2 . THR B 1 110 ? 4.642 22.581 36.528 1.00 29.82 ? 434 THR B CG2 1 ATOM 2435 N N . LYS B 1 111 ? 7.679 21.508 38.235 1.00 28.97 ? 435 LYS B N 1 ATOM 2436 C CA . LYS B 1 111 ? 8.683 20.615 37.695 1.00 30.26 ? 435 LYS B CA 1 ATOM 2437 C C . LYS B 1 111 ? 8.208 20.083 36.358 1.00 30.62 ? 435 LYS B C 1 ATOM 2438 O O . LYS B 1 111 ? 7.009 19.814 36.217 1.00 30.51 ? 435 LYS B O 1 ATOM 2439 C CB . LYS B 1 111 ? 8.889 19.441 38.654 1.00 31.33 ? 435 LYS B CB 1 ATOM 2440 C CG . LYS B 1 111 ? 10.185 18.741 38.452 1.00 32.69 ? 435 LYS B CG 1 ATOM 2441 C CD . LYS B 1 111 ? 10.460 17.743 39.571 1.00 34.37 ? 435 LYS B CD 1 ATOM 2442 C CE . LYS B 1 111 ? 11.809 17.072 39.353 1.00 35.80 ? 435 LYS B CE 1 ATOM 2443 N NZ . LYS B 1 111 ? 12.914 18.019 39.711 1.00 37.78 ? 435 LYS B NZ 1 ATOM 2444 N N . THR B 1 112 ? 9.143 19.877 35.420 1.00 31.05 ? 436 THR B N 1 ATOM 2445 C CA . THR B 1 112 ? 8.815 19.558 34.040 1.00 32.50 ? 436 THR B CA 1 ATOM 2446 C C . THR B 1 112 ? 8.279 18.137 33.971 1.00 30.42 ? 436 THR B C 1 ATOM 2447 O O . THR B 1 112 ? 8.713 17.279 34.696 1.00 32.38 ? 436 THR B O 1 ATOM 2448 C CB . THR B 1 112 ? 10.039 19.746 33.027 1.00 35.20 ? 436 THR B CB 1 ATOM 2449 O OG1 . THR B 1 112 ? 11.097 18.805 33.302 1.00 37.57 ? 436 THR B OG1 1 ATOM 2450 C CG2 . THR B 1 112 ? 10.615 21.188 33.088 1.00 37.01 ? 436 THR B CG2 1 ATOM 2451 N N . SER B 1 113 ? 7.306 17.911 33.108 1.00 28.77 ? 437 SER B N 1 ATOM 2452 C CA . SER B 1 113 ? 6.818 16.586 32.790 1.00 27.93 ? 437 SER B CA 1 ATOM 2453 C C . SER B 1 113 ? 7.049 16.228 31.313 1.00 28.01 ? 437 SER B C 1 ATOM 2454 O O . SER B 1 113 ? 6.540 15.214 30.806 1.00 28.78 ? 437 SER B O 1 ATOM 2455 C CB . SER B 1 113 ? 5.324 16.483 33.111 1.00 27.27 ? 437 SER B CB 1 ATOM 2456 O OG . SER B 1 113 ? 4.597 17.517 32.496 1.00 26.67 ? 437 SER B OG 1 ATOM 2457 N N . GLY B 1 114 ? 7.830 17.046 30.636 1.00 28.50 ? 438 GLY B N 1 ATOM 2458 C CA . GLY B 1 114 ? 8.236 16.770 29.261 1.00 30.01 ? 438 GLY B CA 1 ATOM 2459 C C . GLY B 1 114 ? 9.531 15.988 29.135 1.00 29.78 ? 438 GLY B C 1 ATOM 2460 O O . GLY B 1 114 ? 9.962 15.335 30.088 1.00 31.21 ? 438 GLY B O 1 ATOM 2461 N N . PRO B 1 115 ? 10.153 16.028 27.939 1.00 29.61 ? 439 PRO B N 1 ATOM 2462 C CA . PRO B 1 115 ? 11.359 15.234 27.666 1.00 29.66 ? 439 PRO B CA 1 ATOM 2463 C C . PRO B 1 115 ? 12.523 15.586 28.592 1.00 29.80 ? 439 PRO B C 1 ATOM 2464 O O . PRO B 1 115 ? 12.739 16.767 28.890 1.00 28.77 ? 439 PRO B O 1 ATOM 2465 C CB . PRO B 1 115 ? 11.707 15.579 26.207 1.00 30.41 ? 439 PRO B CB 1 ATOM 2466 C CG . PRO B 1 115 ? 10.482 16.228 25.631 1.00 30.84 ? 439 PRO B CG 1 ATOM 2467 C CD . PRO B 1 115 ? 9.766 16.870 26.795 1.00 29.99 ? 439 PRO B CD 1 ATOM 2468 N N . ARG B 1 116 ? 13.253 14.565 29.051 1.00 29.70 ? 440 ARG B N 1 ATOM 2469 C CA . ARG B 1 116 ? 14.414 14.769 29.933 1.00 30.45 ? 440 ARG B CA 1 ATOM 2470 C C . ARG B 1 116 ? 15.643 14.096 29.337 1.00 28.42 ? 440 ARG B C 1 ATOM 2471 O O . ARG B 1 116 ? 15.515 13.139 28.587 1.00 27.16 ? 440 ARG B O 1 ATOM 2472 C CB . ARG B 1 116 ? 14.198 14.141 31.305 1.00 32.77 ? 440 ARG B CB 1 ATOM 2473 C CG . ARG B 1 116 ? 13.053 14.682 32.122 1.00 35.75 ? 440 ARG B CG 1 ATOM 2474 C CD . ARG B 1 116 ? 12.690 13.617 33.149 1.00 37.71 ? 440 ARG B CD 1 ATOM 2475 N NE . ARG B 1 116 ? 11.760 14.104 34.166 1.00 40.11 ? 440 ARG B NE 1 ATOM 2476 C CZ . ARG B 1 116 ? 10.440 14.200 34.034 1.00 40.63 ? 440 ARG B CZ 1 ATOM 2477 N NH1 . ARG B 1 116 ? 9.826 13.902 32.871 1.00 40.61 ? 440 ARG B NH1 1 ATOM 2478 N NH2 . ARG B 1 116 ? 9.746 14.664 35.078 1.00 40.06 ? 440 ARG B NH2 1 ATOM 2479 N N . ALA B 1 117 ? 16.827 14.582 29.702 1.00 27.52 ? 441 ALA B N 1 ATOM 2480 C CA . ALA B 1 117 ? 18.091 13.994 29.245 1.00 25.92 ? 441 ALA B CA 1 ATOM 2481 C C . ALA B 1 117 ? 19.226 14.454 30.150 1.00 25.58 ? 441 ALA B C 1 ATOM 2482 O O . ALA B 1 117 ? 19.387 15.655 30.425 1.00 26.84 ? 441 ALA B O 1 ATOM 2483 C CB . ALA B 1 117 ? 18.378 14.317 27.760 1.00 24.49 ? 441 ALA B CB 1 ATOM 2484 N N . ALA B 1 118 ? 19.961 13.477 30.669 1.00 26.00 ? 442 ALA B N 1 ATOM 2485 C CA . ALA B 1 118 ? 21.127 13.724 31.513 1.00 27.06 ? 442 ALA B CA 1 ATOM 2486 C C . ALA B 1 118 ? 22.261 14.372 30.725 1.00 27.92 ? 442 ALA B C 1 ATOM 2487 O O . ALA B 1 118 ? 22.412 14.176 29.518 1.00 26.63 ? 442 ALA B O 1 ATOM 2488 C CB . ALA B 1 118 ? 21.607 12.423 32.171 1.00 26.31 ? 442 ALA B CB 1 ATOM 2489 N N . PRO B 1 119 ? 23.042 15.207 31.412 1.00 30.25 ? 443 PRO B N 1 ATOM 2490 C CA . PRO B 1 119 ? 24.193 15.845 30.774 1.00 30.19 ? 443 PRO B CA 1 ATOM 2491 C C . PRO B 1 119 ? 25.377 14.916 30.548 1.00 29.72 ? 443 PRO B C 1 ATOM 2492 O O . PRO B 1 119 ? 25.654 14.027 31.353 1.00 29.37 ? 443 PRO B O 1 ATOM 2493 C CB . PRO B 1 119 ? 24.580 16.947 31.773 1.00 30.73 ? 443 PRO B CB 1 ATOM 2494 C CG . PRO B 1 119 ? 24.071 16.481 33.095 1.00 29.99 ? 443 PRO B CG 1 ATOM 2495 C CD . PRO B 1 119 ? 22.867 15.621 32.820 1.00 29.78 ? 443 PRO B CD 1 ATOM 2496 N N . GLU B 1 120 ? 26.065 15.153 29.440 1.00 30.79 ? 444 GLU B N 1 ATOM 2497 C CA . GLU B 1 120 ? 27.397 14.628 29.185 1.00 29.35 ? 444 GLU B CA 1 ATOM 2498 C C . GLU B 1 120 ? 28.393 15.660 29.699 1.00 28.85 ? 444 GLU B C 1 ATOM 2499 O O . GLU B 1 120 ? 28.246 16.860 29.469 1.00 30.65 ? 444 GLU B O 1 ATOM 2500 C CB . GLU B 1 120 ? 27.592 14.435 27.681 1.00 29.44 ? 444 GLU B CB 1 ATOM 2501 C CG . GLU B 1 120 ? 26.501 13.645 27.010 1.00 29.47 ? 444 GLU B CG 1 ATOM 2502 C CD . GLU B 1 120 ? 26.679 13.591 25.514 1.00 29.53 ? 444 GLU B CD 1 ATOM 2503 O OE1 . GLU B 1 120 ? 27.726 14.020 25.004 1.00 31.10 ? 444 GLU B OE1 1 ATOM 2504 O OE2 . GLU B 1 120 ? 25.802 13.066 24.820 1.00 32.02 ? 444 GLU B OE2 1 ATOM 2505 N N . VAL B 1 121 ? 29.410 15.192 30.402 1.00 28.72 ? 445 VAL B N 1 ATOM 2506 C CA . VAL B 1 121 ? 30.379 16.074 31.015 1.00 27.18 ? 445 VAL B CA 1 ATOM 2507 C C . VAL B 1 121 ? 31.780 15.679 30.525 1.00 25.87 ? 445 VAL B C 1 ATOM 2508 O O . VAL B 1 121 ? 32.148 14.516 30.568 1.00 27.74 ? 445 VAL B O 1 ATOM 2509 C CB . VAL B 1 121 ? 30.312 15.999 32.582 1.00 26.44 ? 445 VAL B CB 1 ATOM 2510 C CG1 . VAL B 1 121 ? 31.379 16.859 33.192 1.00 22.25 ? 445 VAL B CG1 1 ATOM 2511 C CG2 . VAL B 1 121 ? 28.873 16.362 33.117 1.00 24.39 ? 445 VAL B CG2 1 ATOM 2512 N N . TYR B 1 122 ? 32.531 16.674 30.075 1.00 26.15 ? 446 TYR B N 1 ATOM 2513 C CA . TYR B 1 122 ? 33.915 16.547 29.583 1.00 24.51 ? 446 TYR B CA 1 ATOM 2514 C C . TYR B 1 122 ? 34.756 17.684 30.167 1.00 25.24 ? 446 TYR B C 1 ATOM 2515 O O . TYR B 1 122 ? 34.387 18.846 30.086 1.00 25.60 ? 446 TYR B O 1 ATOM 2516 C CB . TYR B 1 122 ? 33.953 16.605 28.056 1.00 24.38 ? 446 TYR B CB 1 ATOM 2517 C CG . TYR B 1 122 ? 32.947 15.716 27.363 1.00 25.86 ? 446 TYR B CG 1 ATOM 2518 C CD1 . TYR B 1 122 ? 31.738 16.224 26.877 1.00 25.69 ? 446 TYR B CD1 1 ATOM 2519 C CD2 . TYR B 1 122 ? 33.192 14.338 27.216 1.00 26.76 ? 446 TYR B CD2 1 ATOM 2520 C CE1 . TYR B 1 122 ? 30.831 15.385 26.269 1.00 25.60 ? 446 TYR B CE1 1 ATOM 2521 C CE2 . TYR B 1 122 ? 32.296 13.518 26.568 1.00 24.89 ? 446 TYR B CE2 1 ATOM 2522 C CZ . TYR B 1 122 ? 31.118 14.034 26.137 1.00 25.36 ? 446 TYR B CZ 1 ATOM 2523 O OH . TYR B 1 122 ? 30.250 13.198 25.485 1.00 29.14 ? 446 TYR B OH 1 ATOM 2524 N N . ALA B 1 123 ? 35.877 17.339 30.780 1.00 26.34 ? 447 ALA B N 1 ATOM 2525 C CA . ALA B 1 123 ? 36.729 18.308 31.427 1.00 27.57 ? 447 ALA B CA 1 ATOM 2526 C C . ALA B 1 123 ? 38.074 18.285 30.692 1.00 27.53 ? 447 ALA B C 1 ATOM 2527 O O . ALA B 1 123 ? 38.580 17.230 30.351 1.00 26.22 ? 447 ALA B O 1 ATOM 2528 C CB . ALA B 1 123 ? 36.891 18.009 32.945 1.00 25.41 ? 447 ALA B CB 1 ATOM 2529 N N . PHE B 1 124 ? 38.584 19.477 30.407 1.00 27.21 ? 448 PHE B N 1 ATOM 2530 C CA . PHE B 1 124 ? 39.801 19.686 29.645 1.00 28.14 ? 448 PHE B CA 1 ATOM 2531 C C . PHE B 1 124 ? 40.720 20.669 30.395 1.00 29.10 ? 448 PHE B C 1 ATOM 2532 O O . PHE B 1 124 ? 40.275 21.458 31.226 1.00 27.60 ? 448 PHE B O 1 ATOM 2533 C CB . PHE B 1 124 ? 39.478 20.304 28.271 1.00 29.09 ? 448 PHE B CB 1 ATOM 2534 C CG . PHE B 1 124 ? 38.575 19.474 27.416 1.00 29.84 ? 448 PHE B CG 1 ATOM 2535 C CD1 . PHE B 1 124 ? 37.247 19.810 27.268 1.00 30.66 ? 448 PHE B CD1 1 ATOM 2536 C CD2 . PHE B 1 124 ? 39.053 18.346 26.765 1.00 31.62 ? 448 PHE B CD2 1 ATOM 2537 C CE1 . PHE B 1 124 ? 36.409 19.036 26.489 1.00 31.58 ? 448 PHE B CE1 1 ATOM 2538 C CE2 . PHE B 1 124 ? 38.205 17.567 26.000 1.00 31.99 ? 448 PHE B CE2 1 ATOM 2539 C CZ . PHE B 1 124 ? 36.887 17.937 25.847 1.00 31.69 ? 448 PHE B CZ 1 ATOM 2540 N N . ALA B 1 125 ? 42.012 20.584 30.092 1.00 30.94 ? 449 ALA B N 1 ATOM 2541 C CA . ALA B 1 125 ? 43.030 21.499 30.608 1.00 31.09 ? 449 ALA B CA 1 ATOM 2542 C C . ALA B 1 125 ? 43.828 22.049 29.440 1.00 29.77 ? 449 ALA B C 1 ATOM 2543 O O . ALA B 1 125 ? 44.259 21.314 28.552 1.00 28.93 ? 449 ALA B O 1 ATOM 2544 C CB . ALA B 1 125 ? 43.971 20.795 31.601 1.00 32.64 ? 449 ALA B CB 1 ATOM 2545 N N . THR B 1 126 ? 43.998 23.364 29.428 1.00 29.75 ? 450 THR B N 1 ATOM 2546 C CA . THR B 1 126 ? 44.765 23.987 28.385 1.00 30.65 ? 450 THR B CA 1 ATOM 2547 C C . THR B 1 126 ? 46.235 23.586 28.544 1.00 30.22 ? 450 THR B C 1 ATOM 2548 O O . THR B 1 126 ? 46.703 23.278 29.648 1.00 27.87 ? 450 THR B O 1 ATOM 2549 C CB . THR B 1 126 ? 44.639 25.547 28.345 1.00 30.86 ? 450 THR B CB 1 ATOM 2550 O OG1 . THR B 1 126 ? 45.184 26.120 29.546 1.00 31.94 ? 450 THR B OG1 1 ATOM 2551 C CG2 . THR B 1 126 ? 43.183 25.991 28.121 1.00 28.68 ? 450 THR B CG2 1 ATOM 2552 N N . PRO B 1 127 ? 46.952 23.550 27.415 1.00 30.77 ? 451 PRO B N 1 ATOM 2553 C CA . PRO B 1 127 ? 48.401 23.450 27.464 1.00 32.01 ? 451 PRO B CA 1 ATOM 2554 C C . PRO B 1 127 ? 49.032 24.782 27.824 1.00 34.34 ? 451 PRO B C 1 ATOM 2555 O O . PRO B 1 127 ? 48.355 25.829 27.879 1.00 36.71 ? 451 PRO B O 1 ATOM 2556 C CB . PRO B 1 127 ? 48.777 23.027 26.033 1.00 31.02 ? 451 PRO B CB 1 ATOM 2557 C CG . PRO B 1 127 ? 47.687 23.508 25.189 1.00 31.20 ? 451 PRO B CG 1 ATOM 2558 C CD . PRO B 1 127 ? 46.432 23.535 26.038 1.00 30.69 ? 451 PRO B CD 1 ATOM 2559 N N . GLU B 1 128 ? 50.337 24.746 28.049 1.00 35.23 ? 452 GLU B N 1 ATOM 2560 C CA . GLU B 1 128 ? 51.075 25.933 28.361 1.00 36.39 ? 452 GLU B CA 1 ATOM 2561 C C . GLU B 1 128 ? 51.030 26.902 27.178 1.00 36.91 ? 452 GLU B C 1 ATOM 2562 O O . GLU B 1 128 ? 51.127 26.495 26.016 1.00 36.90 ? 452 GLU B O 1 ATOM 2563 C CB . GLU B 1 128 ? 52.523 25.548 28.712 1.00 37.72 ? 452 GLU B CB 1 ATOM 2564 C CG . GLU B 1 128 ? 53.347 26.708 29.232 1.00 38.28 ? 452 GLU B CG 1 ATOM 2565 C CD . GLU B 1 128 ? 54.790 26.317 29.549 1.00 38.80 ? 452 GLU B CD 1 ATOM 2566 O OE1 . GLU B 1 128 ? 55.021 25.275 30.183 1.00 39.53 ? 452 GLU B OE1 1 ATOM 2567 O OE2 . GLU B 1 128 ? 55.695 27.068 29.157 1.00 39.67 ? 452 GLU B OE2 1 ATOM 2568 N N . TRP B 1 129 ? 50.859 28.185 27.482 1.00 37.28 ? 453 TRP B N 1 ATOM 2569 C CA . TRP B 1 129 ? 51.033 29.240 26.485 1.00 37.58 ? 453 TRP B CA 1 ATOM 2570 C C . TRP B 1 129 ? 52.363 29.948 26.735 1.00 39.16 ? 453 TRP B C 1 ATOM 2571 O O . TRP B 1 129 ? 52.729 30.175 27.896 1.00 40.63 ? 453 TRP B O 1 ATOM 2572 C CB . TRP B 1 129 ? 49.903 30.254 26.579 1.00 36.60 ? 453 TRP B CB 1 ATOM 2573 C CG . TRP B 1 129 ? 49.798 31.163 25.401 1.00 36.37 ? 453 TRP B CG 1 ATOM 2574 C CD1 . TRP B 1 129 ? 50.243 32.453 25.325 1.00 36.47 ? 453 TRP B CD1 1 ATOM 2575 C CD2 . TRP B 1 129 ? 49.154 30.885 24.141 1.00 36.35 ? 453 TRP B CD2 1 ATOM 2576 N NE1 . TRP B 1 129 ? 49.942 32.982 24.094 1.00 36.47 ? 453 TRP B NE1 1 ATOM 2577 C CE2 . TRP B 1 129 ? 49.274 32.041 23.349 1.00 36.54 ? 453 TRP B CE2 1 ATOM 2578 C CE3 . TRP B 1 129 ? 48.505 29.766 23.603 1.00 36.25 ? 453 TRP B CE3 1 ATOM 2579 C CZ2 . TRP B 1 129 ? 48.776 32.107 22.040 1.00 36.22 ? 453 TRP B CZ2 1 ATOM 2580 C CZ3 . TRP B 1 129 ? 48.009 29.836 22.310 1.00 35.68 ? 453 TRP B CZ3 1 ATOM 2581 C CH2 . TRP B 1 129 ? 48.141 30.997 21.547 1.00 35.80 ? 453 TRP B CH2 1 ATOM 2582 N N . PRO B 1 130 ? 53.101 30.277 25.658 1.00 40.13 ? 454 PRO B N 1 ATOM 2583 C CA . PRO B 1 130 ? 54.351 31.025 25.813 1.00 41.17 ? 454 PRO B CA 1 ATOM 2584 C C . PRO B 1 130 ? 54.169 32.261 26.696 1.00 41.14 ? 454 PRO B C 1 ATOM 2585 O O . PRO B 1 130 ? 53.276 33.070 26.453 1.00 41.48 ? 454 PRO B O 1 ATOM 2586 C CB . PRO B 1 130 ? 54.703 31.425 24.373 1.00 41.33 ? 454 PRO B CB 1 ATOM 2587 C CG . PRO B 1 130 ? 54.050 30.376 23.518 1.00 40.95 ? 454 PRO B CG 1 ATOM 2588 C CD . PRO B 1 130 ? 52.821 29.934 24.251 1.00 40.28 ? 454 PRO B CD 1 ATOM 2589 N N . GLY B 1 131 ? 54.980 32.376 27.739 1.00 41.28 ? 455 GLY B N 1 ATOM 2590 C CA . GLY B 1 131 ? 54.903 33.520 28.636 1.00 41.36 ? 455 GLY B CA 1 ATOM 2591 C C . GLY B 1 131 ? 54.027 33.298 29.855 1.00 42.06 ? 455 GLY B C 1 ATOM 2592 O O . GLY B 1 131 ? 54.070 34.081 30.807 1.00 42.45 ? 455 GLY B O 1 ATOM 2593 N N . SER B 1 132 ? 53.230 32.231 29.857 1.00 42.56 ? 456 SER B N 1 ATOM 2594 C CA . SER B 1 132 ? 52.397 31.951 31.033 1.00 42.58 ? 456 SER B CA 1 ATOM 2595 C C . SER B 1 132 ? 52.488 30.504 31.515 1.00 41.09 ? 456 SER B C 1 ATOM 2596 O O . SER B 1 132 ? 51.496 29.786 31.538 1.00 40.88 ? 456 SER B O 1 ATOM 2597 C CB . SER B 1 132 ? 50.945 32.357 30.763 1.00 43.28 ? 456 SER B CB 1 ATOM 2598 O OG . SER B 1 132 ? 50.457 31.728 29.592 1.00 45.03 ? 456 SER B OG 1 ATOM 2599 N N . ARG B 1 133 ? 53.679 30.092 31.946 1.00 39.92 ? 457 ARG B N 1 ATOM 2600 C CA . ARG B 1 133 ? 53.881 28.729 32.432 1.00 38.51 ? 457 ARG B CA 1 ATOM 2601 C C . ARG B 1 133 ? 53.279 28.482 33.818 1.00 36.30 ? 457 ARG B C 1 ATOM 2602 O O . ARG B 1 133 ? 53.084 27.339 34.195 1.00 34.27 ? 457 ARG B O 1 ATOM 2603 C CB . ARG B 1 133 ? 55.367 28.354 32.420 1.00 39.85 ? 457 ARG B CB 1 ATOM 2604 C CG . ARG B 1 133 ? 56.274 29.284 33.211 1.00 40.93 ? 457 ARG B CG 1 ATOM 2605 C CD . ARG B 1 133 ? 57.715 28.780 33.296 1.00 41.70 ? 457 ARG B CD 1 ATOM 2606 N NE . ARG B 1 133 ? 57.925 27.944 34.484 1.00 42.89 ? 457 ARG B NE 1 ATOM 2607 C CZ . ARG B 1 133 ? 58.108 26.625 34.466 1.00 42.59 ? 457 ARG B CZ 1 ATOM 2608 N NH1 . ARG B 1 133 ? 58.128 25.958 33.322 1.00 42.43 ? 457 ARG B NH1 1 ATOM 2609 N NH2 . ARG B 1 133 ? 58.279 25.973 35.606 1.00 43.24 ? 457 ARG B NH2 1 ATOM 2610 N N . ASP B 1 134 ? 52.961 29.538 34.561 1.00 35.37 ? 458 ASP B N 1 ATOM 2611 C CA . ASP B 1 134 ? 52.408 29.398 35.909 1.00 35.77 ? 458 ASP B CA 1 ATOM 2612 C C . ASP B 1 134 ? 50.877 29.520 35.961 1.00 36.22 ? 458 ASP B C 1 ATOM 2613 O O . ASP B 1 134 ? 50.293 29.642 37.041 1.00 34.91 ? 458 ASP B O 1 ATOM 2614 C CB . ASP B 1 134 ? 53.028 30.441 36.845 1.00 36.45 ? 458 ASP B CB 1 ATOM 2615 C CG . ASP B 1 134 ? 54.537 30.246 37.053 1.00 36.90 ? 458 ASP B CG 1 ATOM 2616 O OD1 . ASP B 1 134 ? 55.072 29.132 36.879 1.00 36.84 ? 458 ASP B OD1 1 ATOM 2617 O OD2 . ASP B 1 134 ? 55.200 31.231 37.413 1.00 37.91 ? 458 ASP B OD2 1 ATOM 2618 N N . LYS B 1 135 ? 50.231 29.471 34.798 1.00 37.99 ? 459 LYS B N 1 ATOM 2619 C CA . LYS B 1 135 ? 48.770 29.567 34.699 1.00 38.68 ? 459 LYS B CA 1 ATOM 2620 C C . LYS B 1 135 ? 48.244 28.559 33.700 1.00 37.35 ? 459 LYS B C 1 ATOM 2621 O O . LYS B 1 135 ? 48.858 28.341 32.652 1.00 36.59 ? 459 LYS B O 1 ATOM 2622 C CB . LYS B 1 135 ? 48.356 30.955 34.201 1.00 40.27 ? 459 LYS B CB 1 ATOM 2623 C CG . LYS B 1 135 ? 48.932 32.129 34.978 1.00 41.74 ? 459 LYS B CG 1 ATOM 2624 C CD . LYS B 1 135 ? 48.340 33.433 34.432 1.00 42.97 ? 459 LYS B CD 1 ATOM 2625 C CE . LYS B 1 135 ? 49.102 34.676 34.857 1.00 43.84 ? 459 LYS B CE 1 ATOM 2626 N NZ . LYS B 1 135 ? 48.315 35.852 34.385 1.00 44.31 ? 459 LYS B NZ 1 ATOM 2627 N N . ARG B 1 136 ? 47.082 27.986 34.018 1.00 37.12 ? 460 ARG B N 1 ATOM 2628 C CA . ARG B 1 136 ? 46.339 27.133 33.097 1.00 35.72 ? 460 ARG B CA 1 ATOM 2629 C C . ARG B 1 136 ? 44.857 27.495 33.160 1.00 34.55 ? 460 ARG B C 1 ATOM 2630 O O . ARG B 1 136 ? 44.385 28.084 34.130 1.00 35.59 ? 460 ARG B O 1 ATOM 2631 C CB . ARG B 1 136 ? 46.523 25.646 33.453 1.00 36.51 ? 460 ARG B CB 1 ATOM 2632 C CG . ARG B 1 136 ? 47.952 25.123 33.311 1.00 36.97 ? 460 ARG B CG 1 ATOM 2633 C CD . ARG B 1 136 ? 48.467 25.150 31.877 1.00 36.89 ? 460 ARG B CD 1 ATOM 2634 N NE . ARG B 1 136 ? 49.680 24.354 31.750 1.00 37.97 ? 460 ARG B NE 1 ATOM 2635 C CZ . ARG B 1 136 ? 50.906 24.758 32.089 1.00 39.43 ? 460 ARG B CZ 1 ATOM 2636 N NH1 . ARG B 1 136 ? 51.139 25.973 32.566 1.00 38.95 ? 460 ARG B NH1 1 ATOM 2637 N NH2 . ARG B 1 136 ? 51.930 23.929 31.955 1.00 40.53 ? 460 ARG B NH2 1 ATOM 2638 N N . THR B 1 137 ? 44.129 27.182 32.099 1.00 32.48 ? 461 THR B N 1 ATOM 2639 C CA . THR B 1 137 ? 42.684 27.353 32.091 1.00 31.47 ? 461 THR B CA 1 ATOM 2640 C C . THR B 1 137 ? 42.006 25.980 31.979 1.00 31.16 ? 461 THR B C 1 ATOM 2641 O O . THR B 1 137 ? 42.357 25.172 31.135 1.00 30.71 ? 461 THR B O 1 ATOM 2642 C CB . THR B 1 137 ? 42.244 28.278 30.966 1.00 30.23 ? 461 THR B CB 1 ATOM 2643 O OG1 . THR B 1 137 ? 43.063 29.453 30.982 1.00 30.43 ? 461 THR B OG1 1 ATOM 2644 C CG2 . THR B 1 137 ? 40.789 28.670 31.135 1.00 29.68 ? 461 THR B CG2 1 ATOM 2645 N N . LEU B 1 138 ? 41.098 25.714 32.908 1.00 31.68 ? 462 LEU B N 1 ATOM 2646 C CA . LEU B 1 138 ? 40.309 24.483 32.917 1.00 31.92 ? 462 LEU B CA 1 ATOM 2647 C C . LEU B 1 138 ? 38.988 24.812 32.262 1.00 31.39 ? 462 LEU B C 1 ATOM 2648 O O . LEU B 1 138 ? 38.425 25.879 32.507 1.00 30.00 ? 462 LEU B O 1 ATOM 2649 C CB . LEU B 1 138 ? 40.090 23.966 34.339 1.00 31.95 ? 462 LEU B CB 1 ATOM 2650 C CG . LEU B 1 138 ? 41.351 23.694 35.178 1.00 31.62 ? 462 LEU B CG 1 ATOM 2651 C CD1 . LEU B 1 138 ? 40.958 22.971 36.458 1.00 30.56 ? 462 LEU B CD1 1 ATOM 2652 C CD2 . LEU B 1 138 ? 42.398 22.924 34.433 1.00 31.20 ? 462 LEU B CD2 1 ATOM 2653 N N . ALA B 1 139 ? 38.589 23.934 31.341 1.00 30.96 ? 463 ALA B N 1 ATOM 2654 C CA . ALA B 1 139 ? 37.389 24.058 30.537 1.00 30.02 ? 463 ALA B CA 1 ATOM 2655 C C . ALA B 1 139 ? 36.530 22.813 30.739 1.00 30.76 ? 463 ALA B C 1 ATOM 2656 O O . ALA B 1 139 ? 37.009 21.690 30.733 1.00 31.46 ? 463 ALA B O 1 ATOM 2657 C CB . ALA B 1 139 ? 37.775 24.225 29.055 1.00 30.15 ? 463 ALA B CB 1 ATOM 2658 N N . CYS B 1 140 ? 35.244 23.016 30.970 1.00 31.74 ? 464 CYS B N 1 ATOM 2659 C CA . CYS B 1 140 ? 34.326 21.910 31.093 1.00 31.03 ? 464 CYS B CA 1 ATOM 2660 C C . CYS B 1 140 ? 33.184 22.057 30.080 1.00 29.38 ? 464 CYS B C 1 ATOM 2661 O O . CYS B 1 140 ? 32.497 23.056 30.093 1.00 29.32 ? 464 CYS B O 1 ATOM 2662 C CB . CYS B 1 140 ? 33.759 21.910 32.502 1.00 32.60 ? 464 CYS B CB 1 ATOM 2663 S SG . CYS B 1 140 ? 32.755 20.530 32.912 1.00 33.44 ? 464 CYS B SG 1 ATOM 2664 N N . LEU B 1 141 ? 32.958 21.036 29.251 1.00 27.63 ? 465 LEU B N 1 ATOM 2665 C CA . LEU B 1 141 ? 31.807 20.989 28.340 1.00 26.66 ? 465 LEU B CA 1 ATOM 2666 C C . LEU B 1 141 ? 30.686 20.103 28.904 1.00 26.18 ? 465 LEU B C 1 ATOM 2667 O O . LEU B 1 141 ? 30.887 18.922 29.218 1.00 27.81 ? 465 LEU B O 1 ATOM 2668 C CB . LEU B 1 141 ? 32.227 20.528 26.934 1.00 25.90 ? 465 LEU B CB 1 ATOM 2669 C CG . LEU B 1 141 ? 31.127 20.222 25.898 1.00 25.62 ? 465 LEU B CG 1 ATOM 2670 C CD1 . LEU B 1 141 ? 30.163 21.438 25.660 1.00 23.53 ? 465 LEU B CD1 1 ATOM 2671 C CD2 . LEU B 1 141 ? 31.770 19.673 24.595 1.00 25.37 ? 465 LEU B CD2 1 ATOM 2672 N N . ILE B 1 142 ? 29.513 20.703 29.075 1.00 26.93 ? 466 ILE B N 1 ATOM 2673 C CA . ILE B 1 142 ? 28.329 20.004 29.588 1.00 27.10 ? 466 ILE B CA 1 ATOM 2674 C C . ILE B 1 142 ? 27.216 20.132 28.534 1.00 25.80 ? 466 ILE B C 1 ATOM 2675 O O . ILE B 1 142 ? 26.858 21.244 28.138 1.00 24.98 ? 466 ILE B O 1 ATOM 2676 C CB . ILE B 1 142 ? 27.858 20.575 30.950 1.00 27.30 ? 466 ILE B CB 1 ATOM 2677 C CG1 . ILE B 1 142 ? 29.072 20.702 31.895 1.00 27.65 ? 466 ILE B CG1 1 ATOM 2678 C CG2 . ILE B 1 142 ? 26.694 19.715 31.520 1.00 27.00 ? 466 ILE B CG2 1 ATOM 2679 C CD1 . ILE B 1 142 ? 28.880 21.545 33.124 1.00 27.74 ? 466 ILE B CD1 1 ATOM 2680 N N . GLN B 1 143 ? 26.709 18.993 28.058 1.00 25.18 ? 467 GLN B N 1 ATOM 2681 C CA . GLN B 1 143 ? 25.940 18.967 26.800 1.00 25.85 ? 467 GLN B CA 1 ATOM 2682 C C . GLN B 1 143 ? 24.858 17.888 26.702 1.00 25.99 ? 467 GLN B C 1 ATOM 2683 O O . GLN B 1 143 ? 24.878 16.854 27.400 1.00 24.94 ? 467 GLN B O 1 ATOM 2684 C CB . GLN B 1 143 ? 26.888 18.890 25.573 1.00 24.77 ? 467 GLN B CB 1 ATOM 2685 C CG . GLN B 1 143 ? 27.608 17.554 25.362 1.00 24.93 ? 467 GLN B CG 1 ATOM 2686 C CD . GLN B 1 143 ? 28.386 17.560 24.060 1.00 25.51 ? 467 GLN B CD 1 ATOM 2687 O OE1 . GLN B 1 143 ? 28.789 18.620 23.594 1.00 27.53 ? 467 GLN B OE1 1 ATOM 2688 N NE2 . GLN B 1 143 ? 28.591 16.399 23.465 1.00 24.33 ? 467 GLN B NE2 1 ATOM 2689 N N . ASN B 1 144 ? 23.899 18.148 25.815 1.00 25.48 ? 468 ASN B N 1 ATOM 2690 C CA . ASN B 1 144 ? 22.830 17.198 25.518 1.00 26.49 ? 468 ASN B CA 1 ATOM 2691 C C . ASN B 1 144 ? 21.905 16.943 26.705 1.00 26.61 ? 468 ASN B C 1 ATOM 2692 O O . ASN B 1 144 ? 21.418 15.828 26.878 1.00 27.48 ? 468 ASN B O 1 ATOM 2693 C CB . ASN B 1 144 ? 23.400 15.875 24.967 1.00 25.18 ? 468 ASN B CB 1 ATOM 2694 C CG . ASN B 1 144 ? 24.166 16.071 23.667 1.00 26.57 ? 468 ASN B CG 1 ATOM 2695 O OD1 . ASN B 1 144 ? 23.920 17.050 22.959 1.00 29.34 ? 468 ASN B OD1 1 ATOM 2696 N ND2 . ASN B 1 144 ? 25.113 15.179 23.362 1.00 23.37 ? 468 ASN B ND2 1 ATOM 2697 N N . PHE B 1 145 ? 21.747 17.959 27.550 1.00 26.10 ? 469 PHE B N 1 ATOM 2698 C CA . PHE B 1 145 ? 20.829 17.892 28.680 1.00 25.79 ? 469 PHE B CA 1 ATOM 2699 C C . PHE B 1 145 ? 19.540 18.640 28.389 1.00 24.67 ? 469 PHE B C 1 ATOM 2700 O O . PHE B 1 145 ? 19.516 19.600 27.636 1.00 27.04 ? 469 PHE B O 1 ATOM 2701 C CB . PHE B 1 145 ? 21.473 18.382 29.998 1.00 25.42 ? 469 PHE B CB 1 ATOM 2702 C CG . PHE B 1 145 ? 21.987 19.802 29.950 1.00 25.39 ? 469 PHE B CG 1 ATOM 2703 C CD1 . PHE B 1 145 ? 21.157 20.865 30.282 1.00 24.88 ? 469 PHE B CD1 1 ATOM 2704 C CD2 . PHE B 1 145 ? 23.294 20.081 29.567 1.00 24.69 ? 469 PHE B CD2 1 ATOM 2705 C CE1 . PHE B 1 145 ? 21.603 22.151 30.221 1.00 23.16 ? 469 PHE B CE1 1 ATOM 2706 C CE2 . PHE B 1 145 ? 23.751 21.377 29.520 1.00 24.11 ? 469 PHE B CE2 1 ATOM 2707 C CZ . PHE B 1 145 ? 22.910 22.411 29.859 1.00 24.39 ? 469 PHE B CZ 1 ATOM 2708 N N . MET B 1 146 ? 18.456 18.157 28.980 1.00 27.32 ? 470 MET B N 1 ATOM 2709 C CA . MET B 1 146 ? 17.201 18.883 29.032 1.00 28.14 ? 470 MET B CA 1 ATOM 2710 C C . MET B 1 146 ? 16.338 18.436 30.204 1.00 26.63 ? 470 MET B C 1 ATOM 2711 O O . MET B 1 146 ? 16.392 17.278 30.599 1.00 23.47 ? 470 MET B O 1 ATOM 2712 C CB . MET B 1 146 ? 16.430 18.761 27.727 1.00 30.98 ? 470 MET B CB 1 ATOM 2713 C CG . MET B 1 146 ? 16.083 17.375 27.335 1.00 33.08 ? 470 MET B CG 1 ATOM 2714 S SD . MET B 1 146 ? 15.157 17.405 25.762 1.00 35.85 ? 470 MET B SD 1 ATOM 2715 C CE . MET B 1 146 ? 13.914 18.615 26.119 1.00 33.77 ? 470 MET B CE 1 ATOM 2716 N N . PRO B 1 147 ? 15.592 19.384 30.808 1.00 26.83 ? 471 PRO B N 1 ATOM 2717 C CA . PRO B 1 147 ? 15.554 20.838 30.525 1.00 26.70 ? 471 PRO B CA 1 ATOM 2718 C C . PRO B 1 147 ? 16.892 21.574 30.698 1.00 27.36 ? 471 PRO B C 1 ATOM 2719 O O . PRO B 1 147 ? 17.927 20.978 31.043 1.00 26.11 ? 471 PRO B O 1 ATOM 2720 C CB . PRO B 1 147 ? 14.557 21.384 31.561 1.00 26.49 ? 471 PRO B CB 1 ATOM 2721 C CG . PRO B 1 147 ? 13.897 20.201 32.119 1.00 27.63 ? 471 PRO B CG 1 ATOM 2722 C CD . PRO B 1 147 ? 14.848 19.063 32.030 1.00 26.84 ? 471 PRO B CD 1 ATOM 2723 N N . GLU B 1 148 ? 16.841 22.876 30.454 1.00 28.08 ? 472 GLU B N 1 ATOM 2724 C CA . GLU B 1 148 ? 18.011 23.729 30.436 1.00 29.68 ? 472 GLU B CA 1 ATOM 2725 C C . GLU B 1 148 ? 18.566 24.035 31.825 1.00 28.32 ? 472 GLU B C 1 ATOM 2726 O O . GLU B 1 148 ? 19.710 24.412 31.921 1.00 27.92 ? 472 GLU B O 1 ATOM 2727 C CB . GLU B 1 148 ? 17.695 25.044 29.710 1.00 31.68 ? 472 GLU B CB 1 ATOM 2728 C CG . GLU B 1 148 ? 16.544 25.848 30.324 1.00 35.05 ? 472 GLU B CG 1 ATOM 2729 C CD . GLU B 1 148 ? 15.165 25.575 29.705 1.00 38.21 ? 472 GLU B CD 1 ATOM 2730 O OE1 . GLU B 1 148 ? 14.409 26.570 29.545 1.00 40.78 ? 472 GLU B OE1 1 ATOM 2731 O OE2 . GLU B 1 148 ? 14.815 24.405 29.377 1.00 39.02 ? 472 GLU B OE2 1 ATOM 2732 N N . ASP B 1 149 ? 17.771 23.865 32.881 1.00 27.72 ? 473 ASP B N 1 ATOM 2733 C CA . ASP B 1 149 ? 18.192 24.205 34.250 1.00 27.76 ? 473 ASP B CA 1 ATOM 2734 C C . ASP B 1 149 ? 19.388 23.353 34.664 1.00 26.44 ? 473 ASP B C 1 ATOM 2735 O O . ASP B 1 149 ? 19.314 22.126 34.682 1.00 27.71 ? 473 ASP B O 1 ATOM 2736 C CB . ASP B 1 149 ? 17.058 23.956 35.272 1.00 29.48 ? 473 ASP B CB 1 ATOM 2737 C CG . ASP B 1 149 ? 15.746 24.663 34.924 1.00 30.84 ? 473 ASP B CG 1 ATOM 2738 O OD1 . ASP B 1 149 ? 15.529 25.052 33.772 1.00 33.82 ? 473 ASP B OD1 1 ATOM 2739 O OD2 . ASP B 1 149 ? 14.895 24.825 35.815 1.00 32.49 ? 473 ASP B OD2 1 ATOM 2740 N N . ILE B 1 150 ? 20.482 23.996 35.040 1.00 26.76 ? 474 ILE B N 1 ATOM 2741 C CA . ILE B 1 150 ? 21.718 23.294 35.389 1.00 25.58 ? 474 ILE B CA 1 ATOM 2742 C C . ILE B 1 150 ? 22.552 24.180 36.315 1.00 25.07 ? 474 ILE B C 1 ATOM 2743 O O . ILE B 1 150 ? 22.471 25.414 36.274 1.00 22.94 ? 474 ILE B O 1 ATOM 2744 C CB . ILE B 1 150 ? 22.503 22.885 34.111 1.00 28.11 ? 474 ILE B CB 1 ATOM 2745 C CG1 . ILE B 1 150 ? 23.594 21.834 34.433 1.00 28.40 ? 474 ILE B CG1 1 ATOM 2746 C CG2 . ILE B 1 150 ? 23.011 24.110 33.390 1.00 25.83 ? 474 ILE B CG2 1 ATOM 2747 C CD1 . ILE B 1 150 ? 23.985 21.005 33.314 1.00 28.05 ? 474 ILE B CD1 1 ATOM 2748 N N . SER B 1 151 ? 23.274 23.537 37.227 1.00 25.54 ? 475 SER B N 1 ATOM 2749 C CA . SER B 1 151 ? 24.210 24.213 38.134 1.00 24.64 ? 475 SER B CA 1 ATOM 2750 C C . SER B 1 151 ? 25.576 23.573 37.952 1.00 25.52 ? 475 SER B C 1 ATOM 2751 O O . SER B 1 151 ? 25.688 22.337 37.794 1.00 24.09 ? 475 SER B O 1 ATOM 2752 C CB . SER B 1 151 ? 23.771 24.062 39.593 1.00 24.37 ? 475 SER B CB 1 ATOM 2753 O OG . SER B 1 151 ? 22.500 24.640 39.790 1.00 24.43 ? 475 SER B OG 1 ATOM 2754 N N . VAL B 1 152 ? 26.611 24.405 37.974 1.00 25.96 ? 476 VAL B N 1 ATOM 2755 C CA . VAL B 1 152 ? 27.988 23.921 37.762 1.00 26.27 ? 476 VAL B CA 1 ATOM 2756 C C . VAL B 1 152 ? 28.840 24.295 38.969 1.00 28.12 ? 476 VAL B C 1 ATOM 2757 O O . VAL B 1 152 ? 28.840 25.456 39.417 1.00 26.43 ? 476 VAL B O 1 ATOM 2758 C CB . VAL B 1 152 ? 28.618 24.451 36.452 1.00 25.66 ? 476 VAL B CB 1 ATOM 2759 C CG1 . VAL B 1 152 ? 30.033 23.903 36.292 1.00 26.12 ? 476 VAL B CG1 1 ATOM 2760 C CG2 . VAL B 1 152 ? 27.790 24.026 35.253 1.00 24.98 ? 476 VAL B CG2 1 ATOM 2761 N N . GLN B 1 153 ? 29.504 23.296 39.544 1.00 29.86 ? 477 GLN B N 1 ATOM 2762 C CA . GLN B 1 153 ? 30.509 23.530 40.592 1.00 30.71 ? 477 GLN B CA 1 ATOM 2763 C C . GLN B 1 153 ? 31.881 22.987 40.166 1.00 29.70 ? 477 GLN B C 1 ATOM 2764 O O . GLN B 1 153 ? 31.977 22.031 39.370 1.00 29.09 ? 477 GLN B O 1 ATOM 2765 C CB . GLN B 1 153 ? 30.070 22.888 41.916 1.00 32.94 ? 477 GLN B CB 1 ATOM 2766 C CG . GLN B 1 153 ? 28.711 23.362 42.441 1.00 35.04 ? 477 GLN B CG 1 ATOM 2767 C CD . GLN B 1 153 ? 27.578 22.561 41.890 1.00 37.97 ? 477 GLN B CD 1 ATOM 2768 O OE1 . GLN B 1 153 ? 27.730 21.363 41.644 1.00 41.97 ? 477 GLN B OE1 1 ATOM 2769 N NE2 . GLN B 1 153 ? 26.427 23.200 41.680 1.00 40.91 ? 477 GLN B NE2 1 ATOM 2770 N N . TRP B 1 154 ? 32.936 23.625 40.664 1.00 29.43 ? 478 TRP B N 1 ATOM 2771 C CA . TRP B 1 154 ? 34.303 23.084 40.573 1.00 29.33 ? 478 TRP B CA 1 ATOM 2772 C C . TRP B 1 154 ? 34.801 22.660 41.946 1.00 28.53 ? 478 TRP B C 1 ATOM 2773 O O . TRP B 1 154 ? 34.648 23.378 42.923 1.00 29.10 ? 478 TRP B O 1 ATOM 2774 C CB . TRP B 1 154 ? 35.265 24.083 39.935 1.00 28.66 ? 478 TRP B CB 1 ATOM 2775 C CG . TRP B 1 154 ? 35.044 24.283 38.461 1.00 28.14 ? 478 TRP B CG 1 ATOM 2776 C CD1 . TRP B 1 154 ? 34.186 25.173 37.869 1.00 28.25 ? 478 TRP B CD1 1 ATOM 2777 C CD2 . TRP B 1 154 ? 35.704 23.586 37.389 1.00 27.64 ? 478 TRP B CD2 1 ATOM 2778 N NE1 . TRP B 1 154 ? 34.284 25.081 36.495 1.00 28.97 ? 478 TRP B NE1 1 ATOM 2779 C CE2 . TRP B 1 154 ? 35.202 24.108 36.179 1.00 28.91 ? 478 TRP B CE2 1 ATOM 2780 C CE3 . TRP B 1 154 ? 36.660 22.562 37.340 1.00 26.81 ? 478 TRP B CE3 1 ATOM 2781 C CZ2 . TRP B 1 154 ? 35.632 23.641 34.932 1.00 28.14 ? 478 TRP B CZ2 1 ATOM 2782 C CZ3 . TRP B 1 154 ? 37.082 22.108 36.117 1.00 27.52 ? 478 TRP B CZ3 1 ATOM 2783 C CH2 . TRP B 1 154 ? 36.564 22.637 34.919 1.00 27.15 ? 478 TRP B CH2 1 ATOM 2784 N N . LEU B 1 155 ? 35.364 21.458 42.034 1.00 29.24 ? 479 LEU B N 1 ATOM 2785 C CA . LEU B 1 155 ? 35.890 20.981 43.302 1.00 29.65 ? 479 LEU B CA 1 ATOM 2786 C C . LEU B 1 155 ? 37.410 20.774 43.196 1.00 30.00 ? 479 LEU B C 1 ATOM 2787 O O . LEU B 1 155 ? 37.944 20.423 42.155 1.00 27.74 ? 479 LEU B O 1 ATOM 2788 C CB . LEU B 1 155 ? 35.151 19.726 43.743 1.00 31.75 ? 479 LEU B CB 1 ATOM 2789 C CG . LEU B 1 155 ? 33.620 19.779 43.632 1.00 32.56 ? 479 LEU B CG 1 ATOM 2790 C CD1 . LEU B 1 155 ? 33.130 18.383 43.337 1.00 35.50 ? 479 LEU B CD1 1 ATOM 2791 C CD2 . LEU B 1 155 ? 33.044 20.289 44.907 1.00 34.26 ? 479 LEU B CD2 1 ATOM 2792 N N . HIS B 1 156 ? 38.101 21.082 44.284 1.00 32.29 ? 480 HIS B N 1 ATOM 2793 C CA . HIS B 1 156 ? 39.528 20.829 44.431 1.00 32.91 ? 480 HIS B CA 1 ATOM 2794 C C . HIS B 1 156 ? 39.760 20.431 45.894 1.00 35.35 ? 480 HIS B C 1 ATOM 2795 O O . HIS B 1 156 ? 39.242 21.079 46.797 1.00 34.53 ? 480 HIS B O 1 ATOM 2796 C CB . HIS B 1 156 ? 40.333 22.069 44.050 1.00 32.16 ? 480 HIS B CB 1 ATOM 2797 C CG . HIS B 1 156 ? 41.811 21.839 43.966 1.00 29.99 ? 480 HIS B CG 1 ATOM 2798 N ND1 . HIS B 1 156 ? 42.722 22.626 44.630 1.00 30.16 ? 480 HIS B ND1 1 ATOM 2799 C CD2 . HIS B 1 156 ? 42.534 20.923 43.285 1.00 29.93 ? 480 HIS B CD2 1 ATOM 2800 C CE1 . HIS B 1 156 ? 43.946 22.224 44.342 1.00 30.03 ? 480 HIS B CE1 1 ATOM 2801 N NE2 . HIS B 1 156 ? 43.859 21.187 43.530 1.00 30.90 ? 480 HIS B NE2 1 ATOM 2802 N N . ASN B 1 157 ? 40.498 19.339 46.119 1.00 38.82 ? 481 ASN B N 1 ATOM 2803 C CA . ASN B 1 157 ? 40.656 18.768 47.456 1.00 41.49 ? 481 ASN B CA 1 ATOM 2804 C C . ASN B 1 157 ? 39.331 18.367 48.091 1.00 43.91 ? 481 ASN B C 1 ATOM 2805 O O . ASN B 1 157 ? 39.149 18.475 49.299 1.00 44.45 ? 481 ASN B O 1 ATOM 2806 C CB . ASN B 1 157 ? 41.400 19.737 48.370 1.00 42.28 ? 481 ASN B CB 1 ATOM 2807 C CG . ASN B 1 157 ? 42.729 20.157 47.788 1.00 42.79 ? 481 ASN B CG 1 ATOM 2808 O OD1 . ASN B 1 157 ? 43.418 19.351 47.169 1.00 44.43 ? 481 ASN B OD1 1 ATOM 2809 N ND2 . ASN B 1 157 ? 43.093 21.419 47.976 1.00 43.58 ? 481 ASN B ND2 1 ATOM 2810 N N . GLU B 1 158 ? 38.408 17.886 47.263 1.00 46.70 ? 482 GLU B N 1 ATOM 2811 C CA . GLU B 1 158 ? 37.094 17.444 47.730 1.00 48.51 ? 482 GLU B CA 1 ATOM 2812 C C . GLU B 1 158 ? 36.321 18.607 48.349 1.00 48.98 ? 482 GLU B C 1 ATOM 2813 O O . GLU B 1 158 ? 35.445 18.409 49.184 1.00 50.85 ? 482 GLU B O 1 ATOM 2814 C CB . GLU B 1 158 ? 37.217 16.263 48.718 1.00 49.24 ? 482 GLU B CB 1 ATOM 2815 C CG . GLU B 1 158 ? 37.896 15.012 48.142 1.00 49.96 ? 482 GLU B CG 1 ATOM 2816 C CD . GLU B 1 158 ? 39.426 15.112 48.124 1.00 50.93 ? 482 GLU B CD 1 ATOM 2817 O OE1 . GLU B 1 158 ? 40.005 15.457 49.176 1.00 51.61 ? 482 GLU B OE1 1 ATOM 2818 O OE2 . GLU B 1 158 ? 40.065 14.839 47.077 1.00 51.16 ? 482 GLU B OE2 1 ATOM 2819 N N . VAL B 1 159 ? 36.644 19.818 47.902 1.00 48.17 ? 483 VAL B N 1 ATOM 2820 C CA . VAL B 1 159 ? 36.081 21.043 48.439 1.00 45.79 ? 483 VAL B CA 1 ATOM 2821 C C . VAL B 1 159 ? 35.643 21.942 47.272 1.00 43.22 ? 483 VAL B C 1 ATOM 2822 O O . VAL B 1 159 ? 36.412 22.231 46.365 1.00 40.19 ? 483 VAL B O 1 ATOM 2823 C CB . VAL B 1 159 ? 37.107 21.780 49.315 1.00 46.37 ? 483 VAL B CB 1 ATOM 2824 C CG1 . VAL B 1 159 ? 36.903 23.284 49.257 1.00 47.05 ? 483 VAL B CG1 1 ATOM 2825 C CG2 . VAL B 1 159 ? 37.027 21.290 50.742 1.00 47.35 ? 483 VAL B CG2 1 ATOM 2826 N N . GLN B 1 160 ? 34.385 22.352 47.313 1.00 41.04 ? 484 GLN B N 1 ATOM 2827 C CA . GLN B 1 160 ? 33.815 23.230 46.324 1.00 41.30 ? 484 GLN B CA 1 ATOM 2828 C C . GLN B 1 160 ? 34.463 24.620 46.368 1.00 40.02 ? 484 GLN B C 1 ATOM 2829 O O . GLN B 1 160 ? 34.473 25.280 47.392 1.00 39.90 ? 484 GLN B O 1 ATOM 2830 C CB . GLN B 1 160 ? 32.305 23.336 46.557 1.00 41.59 ? 484 GLN B CB 1 ATOM 2831 C CG . GLN B 1 160 ? 31.574 24.153 45.518 1.00 42.92 ? 484 GLN B CG 1 ATOM 2832 C CD . GLN B 1 160 ? 30.085 24.230 45.776 1.00 43.65 ? 484 GLN B CD 1 ATOM 2833 O OE1 . GLN B 1 160 ? 29.417 25.151 45.320 1.00 45.05 ? 484 GLN B OE1 1 ATOM 2834 N NE2 . GLN B 1 160 ? 29.554 23.256 46.500 1.00 45.61 ? 484 GLN B NE2 1 ATOM 2835 N N . LEU B 1 161 ? 34.990 25.063 45.233 1.00 38.72 ? 485 LEU B N 1 ATOM 2836 C CA . LEU B 1 161 ? 35.580 26.379 45.118 1.00 37.23 ? 485 LEU B CA 1 ATOM 2837 C C . LEU B 1 161 ? 34.493 27.441 45.082 1.00 37.13 ? 485 LEU B C 1 ATOM 2838 O O . LEU B 1 161 ? 33.348 27.142 44.744 1.00 36.59 ? 485 LEU B O 1 ATOM 2839 C CB . LEU B 1 161 ? 36.403 26.456 43.832 1.00 37.48 ? 485 LEU B CB 1 ATOM 2840 C CG . LEU B 1 161 ? 37.625 25.543 43.749 1.00 37.07 ? 485 LEU B CG 1 ATOM 2841 C CD1 . LEU B 1 161 ? 38.341 25.793 42.434 1.00 36.81 ? 485 LEU B CD1 1 ATOM 2842 C CD2 . LEU B 1 161 ? 38.552 25.795 44.940 1.00 36.97 ? 485 LEU B CD2 1 ATOM 2843 N N . PRO B 1 162 ? 34.843 28.692 45.435 1.00 36.91 ? 486 PRO B N 1 ATOM 2844 C CA . PRO B 1 162 ? 33.885 29.780 45.415 1.00 36.30 ? 486 PRO B CA 1 ATOM 2845 C C . PRO B 1 162 ? 33.284 29.969 44.033 1.00 36.49 ? 486 PRO B C 1 ATOM 2846 O O . PRO B 1 162 ? 34.005 29.835 43.051 1.00 36.39 ? 486 PRO B O 1 ATOM 2847 C CB . PRO B 1 162 ? 34.738 31.000 45.777 1.00 36.81 ? 486 PRO B CB 1 ATOM 2848 C CG . PRO B 1 162 ? 35.861 30.468 46.543 1.00 36.21 ? 486 PRO B CG 1 ATOM 2849 C CD . PRO B 1 162 ? 36.125 29.097 46.042 1.00 36.57 ? 486 PRO B CD 1 ATOM 2850 N N . ASP B 1 163 ? 31.990 30.284 43.969 1.00 36.97 ? 487 ASP B N 1 ATOM 2851 C CA . ASP B 1 163 ? 31.296 30.523 42.702 1.00 39.22 ? 487 ASP B CA 1 ATOM 2852 C C . ASP B 1 163 ? 31.964 31.532 41.772 1.00 37.83 ? 487 ASP B C 1 ATOM 2853 O O . ASP B 1 163 ? 32.030 31.289 40.568 1.00 39.14 ? 487 ASP B O 1 ATOM 2854 C CB . ASP B 1 163 ? 29.863 30.990 42.950 1.00 42.10 ? 487 ASP B CB 1 ATOM 2855 C CG . ASP B 1 163 ? 29.033 29.961 43.673 1.00 44.27 ? 487 ASP B CG 1 ATOM 2856 O OD1 . ASP B 1 163 ? 29.568 28.867 43.981 1.00 47.52 ? 487 ASP B OD1 1 ATOM 2857 O OD2 . ASP B 1 163 ? 27.848 30.254 43.933 1.00 45.40 ? 487 ASP B OD2 1 ATOM 2858 N N . ALA B 1 164 ? 32.457 32.637 42.330 1.00 35.45 ? 488 ALA B N 1 ATOM 2859 C CA . ALA B 1 164 ? 33.059 33.744 41.580 1.00 34.17 ? 488 ALA B CA 1 ATOM 2860 C C . ALA B 1 164 ? 34.366 33.354 40.883 1.00 32.06 ? 488 ALA B C 1 ATOM 2861 O O . ALA B 1 164 ? 34.869 34.036 39.998 1.00 30.37 ? 488 ALA B O 1 ATOM 2862 C CB . ALA B 1 164 ? 33.289 34.936 42.532 1.00 33.36 ? 488 ALA B CB 1 ATOM 2863 N N . ARG B 1 165 ? 34.903 32.218 41.286 1.00 32.87 ? 489 ARG B N 1 ATOM 2864 C CA . ARG B 1 165 ? 36.077 31.611 40.648 1.00 32.71 ? 489 ARG B CA 1 ATOM 2865 C C . ARG B 1 165 ? 35.940 31.142 39.187 1.00 32.50 ? 489 ARG B C 1 ATOM 2866 O O . ARG B 1 165 ? 36.924 31.134 38.412 1.00 30.38 ? 489 ARG B O 1 ATOM 2867 C CB . ARG B 1 165 ? 36.456 30.383 41.461 1.00 32.50 ? 489 ARG B CB 1 ATOM 2868 C CG . ARG B 1 165 ? 37.431 30.670 42.568 1.00 32.11 ? 489 ARG B CG 1 ATOM 2869 C CD . ARG B 1 165 ? 38.835 30.690 42.004 1.00 31.96 ? 489 ARG B CD 1 ATOM 2870 N NE . ARG B 1 165 ? 39.651 29.867 42.866 1.00 33.31 ? 489 ARG B NE 1 ATOM 2871 C CZ . ARG B 1 165 ? 40.638 29.071 42.492 1.00 31.61 ? 489 ARG B CZ 1 ATOM 2872 N NH1 . ARG B 1 165 ? 40.986 28.926 41.229 1.00 29.43 ? 489 ARG B NH1 1 ATOM 2873 N NH2 . ARG B 1 165 ? 41.275 28.409 43.438 1.00 33.76 ? 489 ARG B NH2 1 ATOM 2874 N N . HIS B 1 166 ? 34.733 30.703 38.831 1.00 31.34 ? 490 HIS B N 1 ATOM 2875 C CA . HIS B 1 166 ? 34.536 30.130 37.508 1.00 31.33 ? 490 HIS B CA 1 ATOM 2876 C C . HIS B 1 166 ? 33.453 30.942 36.848 1.00 32.63 ? 490 HIS B C 1 ATOM 2877 O O . HIS B 1 166 ? 32.772 31.704 37.505 1.00 32.43 ? 490 HIS B O 1 ATOM 2878 C CB . HIS B 1 166 ? 34.147 28.647 37.563 1.00 29.66 ? 490 HIS B CB 1 ATOM 2879 C CG . HIS B 1 166 ? 32.741 28.410 38.027 1.00 30.10 ? 490 HIS B CG 1 ATOM 2880 N ND1 . HIS B 1 166 ? 32.434 28.080 39.327 1.00 29.53 ? 490 HIS B ND1 1 ATOM 2881 C CD2 . HIS B 1 166 ? 31.560 28.471 37.367 1.00 30.00 ? 490 HIS B CD2 1 ATOM 2882 C CE1 . HIS B 1 166 ? 31.123 27.985 39.455 1.00 29.75 ? 490 HIS B CE1 1 ATOM 2883 N NE2 . HIS B 1 166 ? 30.572 28.202 38.276 1.00 30.42 ? 490 HIS B NE2 1 ATOM 2884 N N . SER B 1 167 ? 33.321 30.763 35.540 1.00 34.51 ? 491 SER B N 1 ATOM 2885 C CA . SER B 1 167 ? 32.294 31.407 34.747 1.00 35.27 ? 491 SER B CA 1 ATOM 2886 C C . SER B 1 167 ? 31.645 30.375 33.840 1.00 34.82 ? 491 SER B C 1 ATOM 2887 O O . SER B 1 167 ? 32.340 29.709 33.097 1.00 38.16 ? 491 SER B O 1 ATOM 2888 C CB . SER B 1 167 ? 32.927 32.478 33.876 1.00 36.48 ? 491 SER B CB 1 ATOM 2889 O OG . SER B 1 167 ? 31.926 33.171 33.153 1.00 37.21 ? 491 SER B OG 1 ATOM 2890 N N . THR B 1 168 ? 30.324 30.262 33.881 1.00 33.88 ? 492 THR B N 1 ATOM 2891 C CA . THR B 1 168 ? 29.583 29.349 33.024 1.00 33.48 ? 492 THR B CA 1 ATOM 2892 C C . THR B 1 168 ? 28.805 30.116 31.953 1.00 33.48 ? 492 THR B C 1 ATOM 2893 O O . THR B 1 168 ? 28.157 31.124 32.254 1.00 31.99 ? 492 THR B O 1 ATOM 2894 C CB . THR B 1 168 ? 28.593 28.459 33.828 1.00 33.12 ? 492 THR B CB 1 ATOM 2895 O OG1 . THR B 1 168 ? 29.268 27.870 34.942 1.00 32.46 ? 492 THR B OG1 1 ATOM 2896 C CG2 . THR B 1 168 ? 28.039 27.328 32.960 1.00 33.01 ? 492 THR B CG2 1 ATOM 2897 N N . THR B 1 169 ? 28.846 29.610 30.716 1.00 32.87 ? 493 THR B N 1 ATOM 2898 C CA . THR B 1 169 ? 28.092 30.219 29.604 1.00 33.19 ? 493 THR B CA 1 ATOM 2899 C C . THR B 1 169 ? 26.595 29.991 29.774 1.00 33.88 ? 493 THR B C 1 ATOM 2900 O O . THR B 1 169 ? 26.153 29.155 30.571 1.00 34.10 ? 493 THR B O 1 ATOM 2901 C CB . THR B 1 169 ? 28.529 29.708 28.204 1.00 32.66 ? 493 THR B CB 1 ATOM 2902 O OG1 . THR B 1 169 ? 28.250 28.300 28.082 1.00 31.61 ? 493 THR B OG1 1 ATOM 2903 C CG2 . THR B 1 169 ? 30.031 29.972 27.960 1.00 32.38 ? 493 THR B CG2 1 ATOM 2904 N N . GLN B 1 170 ? 25.820 30.766 29.033 1.00 34.34 ? 494 GLN B N 1 ATOM 2905 C CA . GLN B 1 170 ? 24.368 30.603 28.986 1.00 36.10 ? 494 GLN B CA 1 ATOM 2906 C C . GLN B 1 170 ? 23.968 29.349 28.184 1.00 34.71 ? 494 GLN B C 1 ATOM 2907 O O . GLN B 1 170 ? 24.591 29.031 27.176 1.00 32.60 ? 494 GLN B O 1 ATOM 2908 C CB . GLN B 1 170 ? 23.745 31.838 28.333 1.00 39.07 ? 494 GLN B CB 1 ATOM 2909 C CG . GLN B 1 170 ? 24.266 33.170 28.856 1.00 41.52 ? 494 GLN B CG 1 ATOM 2910 C CD . GLN B 1 170 ? 23.565 34.316 28.198 1.00 43.23 ? 494 GLN B CD 1 ATOM 2911 O OE1 . GLN B 1 170 ? 22.393 34.202 27.843 1.00 46.21 ? 494 GLN B OE1 1 ATOM 2912 N NE2 . GLN B 1 170 ? 24.271 35.418 28.005 1.00 44.95 ? 494 GLN B NE2 1 ATOM 2913 N N . PRO B 1 171 ? 22.921 28.634 28.634 1.00 33.75 ? 495 PRO B N 1 ATOM 2914 C CA . PRO B 1 171 ? 22.493 27.412 27.951 1.00 33.51 ? 495 PRO B CA 1 ATOM 2915 C C . PRO B 1 171 ? 22.078 27.652 26.512 1.00 32.54 ? 495 PRO B C 1 ATOM 2916 O O . PRO B 1 171 ? 21.196 28.403 26.253 1.00 34.28 ? 495 PRO B O 1 ATOM 2917 C CB . PRO B 1 171 ? 21.331 26.923 28.809 1.00 33.56 ? 495 PRO B CB 1 ATOM 2918 C CG . PRO B 1 171 ? 21.633 27.433 30.174 1.00 32.89 ? 495 PRO B CG 1 ATOM 2919 C CD . PRO B 1 171 ? 22.284 28.770 29.956 1.00 33.05 ? 495 PRO B CD 1 ATOM 2920 N N . ARG B 1 172 ? 22.763 27.035 25.573 1.00 34.36 ? 496 ARG B N 1 ATOM 2921 C CA . ARG B 1 172 ? 22.497 27.214 24.170 1.00 34.41 ? 496 ARG B CA 1 ATOM 2922 C C . ARG B 1 172 ? 22.016 25.891 23.596 1.00 34.11 ? 496 ARG B C 1 ATOM 2923 O O . ARG B 1 172 ? 22.360 24.803 24.082 1.00 32.19 ? 496 ARG B O 1 ATOM 2924 C CB . ARG B 1 172 ? 23.784 27.628 23.456 1.00 36.74 ? 496 ARG B CB 1 ATOM 2925 C CG . ARG B 1 172 ? 24.137 29.108 23.569 1.00 39.14 ? 496 ARG B CG 1 ATOM 2926 C CD . ARG B 1 172 ? 25.492 29.397 22.879 1.00 41.42 ? 496 ARG B CD 1 ATOM 2927 N NE . ARG B 1 172 ? 25.570 30.773 22.404 1.00 43.86 ? 496 ARG B NE 1 ATOM 2928 C CZ . ARG B 1 172 ? 25.339 31.168 21.157 1.00 44.78 ? 496 ARG B CZ 1 ATOM 2929 N NH1 . ARG B 1 172 ? 25.016 30.294 20.217 1.00 45.02 ? 496 ARG B NH1 1 ATOM 2930 N NH2 . ARG B 1 172 ? 25.437 32.458 20.854 1.00 46.00 ? 496 ARG B NH2 1 ATOM 2931 N N . LYS B 1 173 ? 21.245 25.983 22.523 1.00 34.29 ? 497 LYS B N 1 ATOM 2932 C CA . LYS B 1 173 ? 20.704 24.782 21.917 1.00 35.89 ? 497 LYS B CA 1 ATOM 2933 C C . LYS B 1 173 ? 21.822 24.098 21.154 1.00 35.66 ? 497 LYS B C 1 ATOM 2934 O O . LYS B 1 173 ? 22.585 24.750 20.451 1.00 36.27 ? 497 LYS B O 1 ATOM 2935 C CB . LYS B 1 173 ? 19.467 25.089 21.043 1.00 36.27 ? 497 LYS B CB 1 ATOM 2936 C CG . LYS B 1 173 ? 18.199 25.246 21.893 1.00 37.94 ? 497 LYS B CG 1 ATOM 2937 C CD . LYS B 1 173 ? 17.028 25.962 21.197 1.00 39.28 ? 497 LYS B CD 1 ATOM 2938 C CE . LYS B 1 173 ? 15.827 26.120 22.155 1.00 39.91 ? 497 LYS B CE 1 ATOM 2939 N NZ . LYS B 1 173 ? 14.710 26.924 21.547 1.00 41.03 ? 497 LYS B NZ 1 ATOM 2940 N N . THR B 1 174 ? 21.948 22.790 21.359 1.00 36.01 ? 498 THR B N 1 ATOM 2941 C CA . THR B 1 174 ? 22.773 21.953 20.503 1.00 37.50 ? 498 THR B CA 1 ATOM 2942 C C . THR B 1 174 ? 22.049 21.663 19.183 1.00 39.78 ? 498 THR B C 1 ATOM 2943 O O . THR B 1 174 ? 20.882 22.031 18.993 1.00 37.38 ? 498 THR B O 1 ATOM 2944 C CB . THR B 1 174 ? 23.061 20.564 21.129 1.00 36.33 ? 498 THR B CB 1 ATOM 2945 O OG1 . THR B 1 174 ? 21.865 19.786 21.063 1.00 34.49 ? 498 THR B OG1 1 ATOM 2946 C CG2 . THR B 1 174 ? 23.525 20.640 22.561 1.00 34.00 ? 498 THR B CG2 1 ATOM 2947 N N . LYS B 1 175 ? 22.764 21.005 18.273 1.00 43.44 ? 499 LYS B N 1 ATOM 2948 C CA . LYS B 1 175 ? 22.144 20.376 17.103 1.00 46.19 ? 499 LYS B CA 1 ATOM 2949 C C . LYS B 1 175 ? 21.582 19.038 17.588 1.00 46.72 ? 499 LYS B C 1 ATOM 2950 O O . LYS B 1 175 ? 22.242 18.243 18.263 1.00 48.22 ? 499 LYS B O 1 ATOM 2951 C CB . LYS B 1 175 ? 23.137 20.162 15.950 1.00 47.28 ? 499 LYS B CB 1 ATOM 2952 C CG . LYS B 1 175 ? 24.066 21.349 15.643 1.00 48.69 ? 499 LYS B CG 1 ATOM 2953 C CD . LYS B 1 175 ? 23.298 22.582 15.194 1.00 49.63 ? 499 LYS B CD 1 ATOM 2954 C CE . LYS B 1 175 ? 24.164 23.834 15.328 1.00 50.56 ? 499 LYS B CE 1 ATOM 2955 N NZ . LYS B 1 175 ? 23.596 25.011 14.594 1.00 52.03 ? 499 LYS B NZ 1 ATOM 2956 N N . GLY B 1 176 ? 20.327 18.802 17.279 1.00 47.14 ? 500 GLY B N 1 ATOM 2957 C CA . GLY B 1 176 ? 19.710 17.571 17.730 1.00 47.16 ? 500 GLY B CA 1 ATOM 2958 C C . GLY B 1 176 ? 18.744 17.904 18.834 1.00 45.25 ? 500 GLY B C 1 ATOM 2959 O O . GLY B 1 176 ? 17.637 18.375 18.579 1.00 49.09 ? 500 GLY B O 1 ATOM 2960 N N . SER B 1 177 ? 19.143 17.620 20.057 1.00 42.49 ? 501 SER B N 1 ATOM 2961 C CA . SER B 1 177 ? 18.299 17.949 21.188 1.00 42.46 ? 501 SER B CA 1 ATOM 2962 C C . SER B 1 177 ? 19.141 18.397 22.384 1.00 39.61 ? 501 SER B C 1 ATOM 2963 O O . SER B 1 177 ? 20.368 18.222 22.426 1.00 39.20 ? 501 SER B O 1 ATOM 2964 C CB . SER B 1 177 ? 17.333 16.797 21.525 1.00 43.82 ? 501 SER B CB 1 ATOM 2965 O OG . SER B 1 177 ? 18.021 15.578 21.761 1.00 46.65 ? 501 SER B OG 1 ATOM 2966 N N . GLY B 1 178 ? 18.482 19.055 23.325 1.00 35.74 ? 502 GLY B N 1 ATOM 2967 C CA . GLY B 1 178 ? 19.152 19.457 24.548 1.00 33.37 ? 502 GLY B CA 1 ATOM 2968 C C . GLY B 1 178 ? 19.972 20.726 24.401 1.00 29.76 ? 502 GLY B C 1 ATOM 2969 O O . GLY B 1 178 ? 19.847 21.445 23.417 1.00 25.41 ? 502 GLY B O 1 ATOM 2970 N N . PHE B 1 179 ? 20.771 21.010 25.428 1.00 27.00 ? 503 PHE B N 1 ATOM 2971 C CA . PHE B 1 179 ? 21.461 22.296 25.561 1.00 25.34 ? 503 PHE B CA 1 ATOM 2972 C C . PHE B 1 179 ? 22.907 21.981 25.886 1.00 23.66 ? 503 PHE B C 1 ATOM 2973 O O . PHE B 1 179 ? 23.244 20.864 26.224 1.00 21.25 ? 503 PHE B O 1 ATOM 2974 C CB . PHE B 1 179 ? 20.863 23.185 26.668 1.00 25.26 ? 503 PHE B CB 1 ATOM 2975 C CG . PHE B 1 179 ? 19.439 23.641 26.399 1.00 26.95 ? 503 PHE B CG 1 ATOM 2976 C CD1 . PHE B 1 179 ? 18.364 22.828 26.735 1.00 26.48 ? 503 PHE B CD1 1 ATOM 2977 C CD2 . PHE B 1 179 ? 19.182 24.879 25.832 1.00 27.06 ? 503 PHE B CD2 1 ATOM 2978 C CE1 . PHE B 1 179 ? 17.066 23.224 26.478 1.00 27.49 ? 503 PHE B CE1 1 ATOM 2979 C CE2 . PHE B 1 179 ? 17.877 25.276 25.565 1.00 28.38 ? 503 PHE B CE2 1 ATOM 2980 C CZ . PHE B 1 179 ? 16.818 24.461 25.889 1.00 27.62 ? 503 PHE B CZ 1 ATOM 2981 N N . PHE B 1 180 ? 23.753 22.991 25.777 1.00 24.20 ? 504 PHE B N 1 ATOM 2982 C CA . PHE B 1 180 ? 25.096 22.903 26.274 1.00 23.51 ? 504 PHE B CA 1 ATOM 2983 C C . PHE B 1 180 ? 25.460 24.189 27.000 1.00 24.18 ? 504 PHE B C 1 ATOM 2984 O O . PHE B 1 180 ? 24.950 25.260 26.683 1.00 23.32 ? 504 PHE B O 1 ATOM 2985 C CB . PHE B 1 180 ? 26.071 22.590 25.115 1.00 23.92 ? 504 PHE B CB 1 ATOM 2986 C CG . PHE B 1 180 ? 26.309 23.735 24.192 1.00 23.80 ? 504 PHE B CG 1 ATOM 2987 C CD1 . PHE B 1 180 ? 27.347 24.627 24.456 1.00 25.16 ? 504 PHE B CD1 1 ATOM 2988 C CD2 . PHE B 1 180 ? 25.525 23.930 23.046 1.00 22.55 ? 504 PHE B CD2 1 ATOM 2989 C CE1 . PHE B 1 180 ? 27.586 25.667 23.599 1.00 24.24 ? 504 PHE B CE1 1 ATOM 2990 C CE2 . PHE B 1 180 ? 25.776 24.938 22.201 1.00 22.04 ? 504 PHE B CE2 1 ATOM 2991 C CZ . PHE B 1 180 ? 26.786 25.834 22.483 1.00 23.02 ? 504 PHE B CZ 1 ATOM 2992 N N . VAL B 1 181 ? 26.384 24.049 27.950 1.00 24.71 ? 505 VAL B N 1 ATOM 2993 C CA . VAL B 1 181 ? 27.086 25.153 28.557 1.00 24.85 ? 505 VAL B CA 1 ATOM 2994 C C . VAL B 1 181 ? 28.591 24.797 28.598 1.00 25.18 ? 505 VAL B C 1 ATOM 2995 O O . VAL B 1 181 ? 29.001 23.621 28.569 1.00 27.16 ? 505 VAL B O 1 ATOM 2996 C CB . VAL B 1 181 ? 26.546 25.447 29.981 1.00 24.24 ? 505 VAL B CB 1 ATOM 2997 C CG1 . VAL B 1 181 ? 25.112 25.961 29.920 1.00 23.33 ? 505 VAL B CG1 1 ATOM 2998 C CG2 . VAL B 1 181 ? 26.614 24.191 30.828 1.00 22.82 ? 505 VAL B CG2 1 ATOM 2999 N N . PHE B 1 182 ? 29.400 25.839 28.675 1.00 25.28 ? 506 PHE B N 1 ATOM 3000 C CA . PHE B 1 182 ? 30.809 25.708 28.980 1.00 27.09 ? 506 PHE B CA 1 ATOM 3001 C C . PHE B 1 182 ? 31.060 26.423 30.294 1.00 27.03 ? 506 PHE B C 1 ATOM 3002 O O . PHE B 1 182 ? 30.589 27.521 30.510 1.00 27.45 ? 506 PHE B O 1 ATOM 3003 C CB . PHE B 1 182 ? 31.675 26.348 27.906 1.00 26.19 ? 506 PHE B CB 1 ATOM 3004 C CG . PHE B 1 182 ? 31.843 25.558 26.650 1.00 25.81 ? 506 PHE B CG 1 ATOM 3005 C CD1 . PHE B 1 182 ? 31.120 25.874 25.514 1.00 26.51 ? 506 PHE B CD1 1 ATOM 3006 C CD2 . PHE B 1 182 ? 32.822 24.589 26.559 1.00 26.46 ? 506 PHE B CD2 1 ATOM 3007 C CE1 . PHE B 1 182 ? 31.356 25.216 24.318 1.00 27.07 ? 506 PHE B CE1 1 ATOM 3008 C CE2 . PHE B 1 182 ? 33.048 23.909 25.380 1.00 26.66 ? 506 PHE B CE2 1 ATOM 3009 C CZ . PHE B 1 182 ? 32.327 24.233 24.247 1.00 26.33 ? 506 PHE B CZ 1 ATOM 3010 N N . SER B 1 183 ? 31.841 25.786 31.149 1.00 28.55 ? 507 SER B N 1 ATOM 3011 C CA . SER B 1 183 ? 32.378 26.397 32.359 1.00 28.98 ? 507 SER B CA 1 ATOM 3012 C C . SER B 1 183 ? 33.900 26.586 32.230 1.00 30.05 ? 507 SER B C 1 ATOM 3013 O O . SER B 1 183 ? 34.631 25.681 31.811 1.00 31.06 ? 507 SER B O 1 ATOM 3014 C CB . SER B 1 183 ? 32.029 25.534 33.572 1.00 28.37 ? 507 SER B CB 1 ATOM 3015 O OG . SER B 1 183 ? 32.283 26.229 34.776 1.00 28.51 ? 507 SER B OG 1 ATOM 3016 N N . ARG B 1 184 ? 34.357 27.775 32.620 1.00 31.03 ? 508 ARG B N 1 ATOM 3017 C CA . ARG B 1 184 ? 35.760 28.172 32.559 1.00 32.14 ? 508 ARG B CA 1 ATOM 3018 C C . ARG B 1 184 ? 36.339 28.490 33.948 1.00 31.89 ? 508 ARG B C 1 ATOM 3019 O O . ARG B 1 184 ? 35.788 29.296 34.680 1.00 33.33 ? 508 ARG B O 1 ATOM 3020 C CB . ARG B 1 184 ? 35.901 29.397 31.653 1.00 31.48 ? 508 ARG B CB 1 ATOM 3021 C CG . ARG B 1 184 ? 37.323 29.716 31.250 1.00 31.06 ? 508 ARG B CG 1 ATOM 3022 C CD . ARG B 1 184 ? 37.391 30.945 30.340 1.00 30.16 ? 508 ARG B CD 1 ATOM 3023 N NE . ARG B 1 184 ? 38.751 31.463 30.270 1.00 29.96 ? 508 ARG B NE 1 ATOM 3024 C CZ . ARG B 1 184 ? 39.263 32.337 31.135 1.00 29.80 ? 508 ARG B CZ 1 ATOM 3025 N NH1 . ARG B 1 184 ? 38.521 32.803 32.120 1.00 30.95 ? 508 ARG B NH1 1 ATOM 3026 N NH2 . ARG B 1 184 ? 40.525 32.726 31.037 1.00 28.52 ? 508 ARG B NH2 1 ATOM 3027 N N . LEU B 1 185 ? 37.462 27.859 34.283 1.00 31.70 ? 509 LEU B N 1 ATOM 3028 C CA . LEU B 1 185 ? 38.121 28.006 35.572 1.00 30.42 ? 509 LEU B CA 1 ATOM 3029 C C . LEU B 1 185 ? 39.610 28.250 35.388 1.00 31.50 ? 509 LEU B C 1 ATOM 3030 O O . LEU B 1 185 ? 40.328 27.345 34.983 1.00 32.01 ? 509 LEU B O 1 ATOM 3031 C CB . LEU B 1 185 ? 37.961 26.732 36.410 1.00 28.18 ? 509 LEU B CB 1 ATOM 3032 C CG . LEU B 1 185 ? 38.603 26.763 37.791 1.00 26.74 ? 509 LEU B CG 1 ATOM 3033 C CD1 . LEU B 1 185 ? 37.938 27.774 38.732 1.00 24.49 ? 509 LEU B CD1 1 ATOM 3034 C CD2 . LEU B 1 185 ? 38.675 25.390 38.438 1.00 25.76 ? 509 LEU B CD2 1 ATOM 3035 N N . GLU B 1 186 ? 40.076 29.454 35.717 1.00 32.16 ? 510 GLU B N 1 ATOM 3036 C CA . GLU B 1 186 ? 41.505 29.760 35.779 1.00 32.42 ? 510 GLU B CA 1 ATOM 3037 C C . GLU B 1 186 ? 42.136 29.177 37.033 1.00 31.58 ? 510 GLU B C 1 ATOM 3038 O O . GLU B 1 186 ? 41.611 29.331 38.136 1.00 30.34 ? 510 GLU B O 1 ATOM 3039 C CB . GLU B 1 186 ? 41.730 31.291 35.808 1.00 34.64 ? 510 GLU B CB 1 ATOM 3040 C CG . GLU B 1 186 ? 41.311 31.974 34.516 1.00 35.39 ? 510 GLU B CG 1 ATOM 3041 C CD . GLU B 1 186 ? 41.335 33.489 34.564 1.00 35.68 ? 510 GLU B CD 1 ATOM 3042 O OE1 . GLU B 1 186 ? 42.301 34.101 35.075 1.00 36.43 ? 510 GLU B OE1 1 ATOM 3043 O OE2 . GLU B 1 186 ? 40.357 34.069 34.054 1.00 35.28 ? 510 GLU B OE2 1 ATOM 3044 N N . VAL B 1 187 ? 43.279 28.525 36.857 1.00 31.95 ? 511 VAL B N 1 ATOM 3045 C CA . VAL B 1 187 ? 43.996 27.926 37.970 1.00 31.92 ? 511 VAL B CA 1 ATOM 3046 C C . VAL B 1 187 ? 45.473 28.317 37.949 1.00 32.94 ? 511 VAL B C 1 ATOM 3047 O O . VAL B 1 187 ? 46.032 28.588 36.889 1.00 32.67 ? 511 VAL B O 1 ATOM 3048 C CB . VAL B 1 187 ? 43.808 26.368 38.008 1.00 32.05 ? 511 VAL B CB 1 ATOM 3049 C CG1 . VAL B 1 187 ? 42.351 26.040 38.296 1.00 30.36 ? 511 VAL B CG1 1 ATOM 3050 C CG2 . VAL B 1 187 ? 44.301 25.680 36.720 1.00 30.58 ? 511 VAL B CG2 1 ATOM 3051 N N . THR B 1 188 ? 46.090 28.330 39.132 1.00 34.83 ? 512 THR B N 1 ATOM 3052 C CA . THR B 1 188 ? 47.511 28.654 39.290 1.00 34.93 ? 512 THR B CA 1 ATOM 3053 C C . THR B 1 188 ? 48.376 27.444 39.568 1.00 33.37 ? 512 THR B C 1 ATOM 3054 O O . THR B 1 188 ? 47.889 26.403 39.970 1.00 33.99 ? 512 THR B O 1 ATOM 3055 C CB . THR B 1 188 ? 47.736 29.630 40.444 1.00 35.68 ? 512 THR B CB 1 ATOM 3056 O OG1 . THR B 1 188 ? 47.216 29.051 41.644 1.00 36.94 ? 512 THR B OG1 1 ATOM 3057 C CG2 . THR B 1 188 ? 47.044 30.938 40.164 1.00 36.01 ? 512 THR B CG2 1 ATOM 3058 N N . ARG B 1 189 ? 49.677 27.612 39.367 1.00 33.36 ? 513 ARG B N 1 ATOM 3059 C CA . ARG B 1 189 ? 50.652 26.550 39.551 1.00 33.50 ? 513 ARG B CA 1 ATOM 3060 C C . ARG B 1 189 ? 50.641 26.005 40.988 1.00 31.95 ? 513 ARG B C 1 ATOM 3061 O O . ARG B 1 189 ? 50.740 24.803 41.218 1.00 30.47 ? 513 ARG B O 1 ATOM 3062 C CB . ARG B 1 189 ? 52.039 27.088 39.162 1.00 34.94 ? 513 ARG B CB 1 ATOM 3063 C CG . ARG B 1 189 ? 53.114 26.036 39.125 1.00 36.17 ? 513 ARG B CG 1 ATOM 3064 C CD . ARG B 1 189 ? 54.389 26.479 38.401 1.00 36.50 ? 513 ARG B CD 1 ATOM 3065 N NE . ARG B 1 189 ? 55.042 25.258 37.944 1.00 38.45 ? 513 ARG B NE 1 ATOM 3066 C CZ . ARG B 1 189 ? 55.100 24.820 36.689 1.00 38.90 ? 513 ARG B CZ 1 ATOM 3067 N NH1 . ARG B 1 189 ? 54.618 25.529 35.680 1.00 38.99 ? 513 ARG B NH1 1 ATOM 3068 N NH2 . ARG B 1 189 ? 55.700 23.666 36.437 1.00 39.63 ? 513 ARG B NH2 1 ATOM 3069 N N . ALA B 1 190 ? 50.503 26.898 41.958 1.00 31.15 ? 514 ALA B N 1 ATOM 3070 C CA . ALA B 1 190 ? 50.414 26.491 43.356 1.00 31.94 ? 514 ALA B CA 1 ATOM 3071 C C . ALA B 1 190 ? 49.328 25.439 43.562 1.00 32.29 ? 514 ALA B C 1 ATOM 3072 O O . ALA B 1 190 ? 49.490 24.480 44.321 1.00 30.99 ? 514 ALA B O 1 ATOM 3073 C CB . ALA B 1 190 ? 50.139 27.706 44.253 1.00 30.65 ? 514 ALA B CB 1 ATOM 3074 N N . GLU B 1 191 ? 48.199 25.639 42.891 1.00 33.54 ? 515 GLU B N 1 ATOM 3075 C CA . GLU B 1 191 ? 47.053 24.760 43.073 1.00 34.39 ? 515 GLU B CA 1 ATOM 3076 C C . GLU B 1 191 ? 47.231 23.357 42.516 1.00 33.04 ? 515 GLU B C 1 ATOM 3077 O O . GLU B 1 191 ? 46.941 22.392 43.216 1.00 34.56 ? 515 GLU B O 1 ATOM 3078 C CB . GLU B 1 191 ? 45.818 25.372 42.434 1.00 36.28 ? 515 GLU B CB 1 ATOM 3079 C CG . GLU B 1 191 ? 45.295 26.601 43.143 1.00 37.97 ? 515 GLU B CG 1 ATOM 3080 C CD . GLU B 1 191 ? 43.988 27.073 42.517 1.00 39.76 ? 515 GLU B CD 1 ATOM 3081 O OE1 . GLU B 1 191 ? 42.916 26.522 42.878 1.00 43.12 ? 515 GLU B OE1 1 ATOM 3082 O OE2 . GLU B 1 191 ? 44.016 27.960 41.640 1.00 40.23 ? 515 GLU B OE2 1 ATOM 3083 N N . TRP B 1 192 ? 47.684 23.236 41.273 1.00 32.52 ? 516 TRP B N 1 ATOM 3084 C CA . TRP B 1 192 ? 47.849 21.912 40.674 1.00 33.27 ? 516 TRP B CA 1 ATOM 3085 C C . TRP B 1 192 ? 49.101 21.191 41.175 1.00 33.97 ? 516 TRP B C 1 ATOM 3086 O O . TRP B 1 192 ? 49.187 19.966 41.098 1.00 35.07 ? 516 TRP B O 1 ATOM 3087 C CB . TRP B 1 192 ? 47.815 21.969 39.139 1.00 32.63 ? 516 TRP B CB 1 ATOM 3088 C CG . TRP B 1 192 ? 49.081 22.388 38.437 1.00 31.31 ? 516 TRP B CG 1 ATOM 3089 C CD1 . TRP B 1 192 ? 50.263 21.698 38.370 1.00 30.85 ? 516 TRP B CD1 1 ATOM 3090 C CD2 . TRP B 1 192 ? 49.263 23.566 37.649 1.00 31.55 ? 516 TRP B CD2 1 ATOM 3091 N NE1 . TRP B 1 192 ? 51.178 22.392 37.616 1.00 30.64 ? 516 TRP B NE1 1 ATOM 3092 C CE2 . TRP B 1 192 ? 50.590 23.543 37.160 1.00 30.76 ? 516 TRP B CE2 1 ATOM 3093 C CE3 . TRP B 1 192 ? 48.435 24.644 37.311 1.00 31.53 ? 516 TRP B CE3 1 ATOM 3094 C CZ2 . TRP B 1 192 ? 51.106 24.556 36.362 1.00 30.45 ? 516 TRP B CZ2 1 ATOM 3095 C CZ3 . TRP B 1 192 ? 48.960 25.660 36.512 1.00 31.17 ? 516 TRP B CZ3 1 ATOM 3096 C CH2 . TRP B 1 192 ? 50.280 25.602 36.051 1.00 31.06 ? 516 TRP B CH2 1 ATOM 3097 N N . GLU B 1 193 ? 50.078 21.932 41.684 1.00 34.56 ? 517 GLU B N 1 ATOM 3098 C CA . GLU B 1 193 ? 51.236 21.281 42.298 1.00 36.00 ? 517 GLU B CA 1 ATOM 3099 C C . GLU B 1 193 ? 50.900 20.730 43.684 1.00 36.24 ? 517 GLU B C 1 ATOM 3100 O O . GLU B 1 193 ? 51.434 19.707 44.115 1.00 36.56 ? 517 GLU B O 1 ATOM 3101 C CB . GLU B 1 193 ? 52.415 22.246 42.361 1.00 37.34 ? 517 GLU B CB 1 ATOM 3102 C CG . GLU B 1 193 ? 53.017 22.441 40.980 1.00 38.27 ? 517 GLU B CG 1 ATOM 3103 C CD . GLU B 1 193 ? 54.387 23.066 40.998 1.00 38.04 ? 517 GLU B CD 1 ATOM 3104 O OE1 . GLU B 1 193 ? 54.725 23.780 41.971 1.00 39.31 ? 517 GLU B OE1 1 ATOM 3105 O OE2 . GLU B 1 193 ? 55.107 22.839 40.009 1.00 37.75 ? 517 GLU B OE2 1 ATOM 3106 N N . GLN B 1 194 ? 49.975 21.388 44.368 1.00 37.19 ? 518 GLN B N 1 ATOM 3107 C CA . GLN B 1 194 ? 49.499 20.902 45.646 1.00 37.43 ? 518 GLN B CA 1 ATOM 3108 C C . GLN B 1 194 ? 48.709 19.623 45.410 1.00 38.06 ? 518 GLN B C 1 ATOM 3109 O O . GLN B 1 194 ? 48.967 18.606 46.068 1.00 37.72 ? 518 GLN B O 1 ATOM 3110 C CB . GLN B 1 194 ? 48.650 21.979 46.325 1.00 38.58 ? 518 GLN B CB 1 ATOM 3111 C CG . GLN B 1 194 ? 48.074 21.595 47.673 1.00 39.73 ? 518 GLN B CG 1 ATOM 3112 C CD . GLN B 1 194 ? 46.694 20.988 47.542 1.00 41.80 ? 518 GLN B CD 1 ATOM 3113 O OE1 . GLN B 1 194 ? 45.806 21.568 46.911 1.00 42.30 ? 518 GLN B OE1 1 ATOM 3114 N NE2 . GLN B 1 194 ? 46.506 19.802 48.123 1.00 43.16 ? 518 GLN B NE2 1 ATOM 3115 N N . LYS B 1 195 ? 47.755 19.686 44.470 1.00 37.50 ? 519 LYS B N 1 ATOM 3116 C CA . LYS B 1 195 ? 46.961 18.533 44.048 1.00 37.66 ? 519 LYS B CA 1 ATOM 3117 C C . LYS B 1 195 ? 46.433 18.682 42.623 1.00 37.77 ? 519 LYS B C 1 ATOM 3118 O O . LYS B 1 195 ? 45.561 19.513 42.350 1.00 36.20 ? 519 LYS B O 1 ATOM 3119 C CB . LYS B 1 195 ? 45.769 18.301 44.974 1.00 39.50 ? 519 LYS B CB 1 ATOM 3120 C CG . LYS B 1 195 ? 44.974 17.033 44.607 1.00 41.20 ? 519 LYS B CG 1 ATOM 3121 C CD . LYS B 1 195 ? 44.351 16.378 45.832 1.00 42.31 ? 519 LYS B CD 1 ATOM 3122 C CE . LYS B 1 195 ? 43.711 15.036 45.486 1.00 42.89 ? 519 LYS B CE 1 ATOM 3123 N NZ . LYS B 1 195 ? 43.087 14.387 46.686 1.00 43.73 ? 519 LYS B NZ 1 ATOM 3124 N N . ASP B 1 196 ? 46.962 17.864 41.719 1.00 37.55 ? 520 ASP B N 1 ATOM 3125 C CA . ASP B 1 196 ? 46.651 17.993 40.302 1.00 37.74 ? 520 ASP B CA 1 ATOM 3126 C C . ASP B 1 196 ? 45.416 17.176 39.934 1.00 37.31 ? 520 ASP B C 1 ATOM 3127 O O . ASP B 1 196 ? 45.498 16.156 39.252 1.00 37.45 ? 520 ASP B O 1 ATOM 3128 C CB . ASP B 1 196 ? 47.849 17.571 39.460 1.00 37.84 ? 520 ASP B CB 1 ATOM 3129 C CG . ASP B 1 196 ? 47.772 18.097 38.055 1.00 38.31 ? 520 ASP B CG 1 ATOM 3130 O OD1 . ASP B 1 196 ? 46.875 18.931 37.798 1.00 38.23 ? 520 ASP B OD1 1 ATOM 3131 O OD2 . ASP B 1 196 ? 48.596 17.671 37.213 1.00 38.42 ? 520 ASP B OD2 1 ATOM 3132 N N . GLU B 1 197 ? 44.272 17.629 40.423 1.00 37.32 ? 521 GLU B N 1 ATOM 3133 C CA . GLU B 1 197 ? 43.009 16.985 40.147 1.00 38.03 ? 521 GLU B CA 1 ATOM 3134 C C . GLU B 1 197 ? 41.908 17.960 40.486 1.00 35.96 ? 521 GLU B C 1 ATOM 3135 O O . GLU B 1 197 ? 41.699 18.292 41.653 1.00 35.92 ? 521 GLU B O 1 ATOM 3136 C CB . GLU B 1 197 ? 42.853 15.698 40.957 1.00 41.08 ? 521 GLU B CB 1 ATOM 3137 C CG . GLU B 1 197 ? 41.655 14.842 40.528 1.00 42.97 ? 521 GLU B CG 1 ATOM 3138 C CD . GLU B 1 197 ? 41.621 13.523 41.267 1.00 44.86 ? 521 GLU B CD 1 ATOM 3139 O OE1 . GLU B 1 197 ? 42.253 13.443 42.342 1.00 46.34 ? 521 GLU B OE1 1 ATOM 3140 O OE2 . GLU B 1 197 ? 40.971 12.566 40.780 1.00 47.74 ? 521 GLU B OE2 1 ATOM 3141 N N . PHE B 1 198 ? 41.235 18.435 39.442 1.00 33.29 ? 522 PHE B N 1 ATOM 3142 C CA . PHE B 1 198 ? 40.103 19.331 39.588 1.00 31.58 ? 522 PHE B CA 1 ATOM 3143 C C . PHE B 1 198 ? 38.857 18.691 39.009 1.00 30.28 ? 522 PHE B C 1 ATOM 3144 O O . PHE B 1 198 ? 38.905 18.042 37.967 1.00 31.09 ? 522 PHE B O 1 ATOM 3145 C CB . PHE B 1 198 ? 40.384 20.663 38.883 1.00 31.26 ? 522 PHE B CB 1 ATOM 3146 C CG . PHE B 1 198 ? 41.667 21.318 39.311 1.00 30.97 ? 522 PHE B CG 1 ATOM 3147 C CD1 . PHE B 1 198 ? 42.885 20.924 38.780 1.00 31.61 ? 522 PHE B CD1 1 ATOM 3148 C CD2 . PHE B 1 198 ? 41.655 22.370 40.206 1.00 30.50 ? 522 PHE B CD2 1 ATOM 3149 C CE1 . PHE B 1 198 ? 44.061 21.549 39.179 1.00 31.29 ? 522 PHE B CE1 1 ATOM 3150 C CE2 . PHE B 1 198 ? 42.800 22.973 40.583 1.00 30.00 ? 522 PHE B CE2 1 ATOM 3151 C CZ . PHE B 1 198 ? 44.006 22.580 40.069 1.00 30.46 ? 522 PHE B CZ 1 ATOM 3152 N N . ILE B 1 199 ? 37.726 18.901 39.673 1.00 30.32 ? 523 ILE B N 1 ATOM 3153 C CA . ILE B 1 199 ? 36.475 18.273 39.267 1.00 28.81 ? 523 ILE B CA 1 ATOM 3154 C C . ILE B 1 199 ? 35.412 19.263 38.836 1.00 28.98 ? 523 ILE B C 1 ATOM 3155 O O . ILE B 1 199 ? 35.025 20.128 39.579 1.00 28.52 ? 523 ILE B O 1 ATOM 3156 C CB . ILE B 1 199 ? 35.887 17.451 40.408 1.00 29.85 ? 523 ILE B CB 1 ATOM 3157 C CG1 . ILE B 1 199 ? 36.821 16.288 40.787 1.00 28.85 ? 523 ILE B CG1 1 ATOM 3158 C CG2 . ILE B 1 199 ? 34.449 16.983 40.060 1.00 27.52 ? 523 ILE B CG2 1 ATOM 3159 C CD1 . ILE B 1 199 ? 36.312 15.598 42.009 1.00 28.73 ? 523 ILE B CD1 1 ATOM 3160 N N . CYS B 1 200 ? 34.944 19.124 37.602 1.00 29.35 ? 524 CYS B N 1 ATOM 3161 C CA . CYS B 1 200 ? 33.745 19.784 37.159 1.00 28.80 ? 524 CYS B CA 1 ATOM 3162 C C . CYS B 1 200 ? 32.504 18.908 37.413 1.00 28.41 ? 524 CYS B C 1 ATOM 3163 O O . CYS B 1 200 ? 32.373 17.828 36.858 1.00 27.78 ? 524 CYS B O 1 ATOM 3164 C CB . CYS B 1 200 ? 33.882 20.103 35.679 1.00 30.84 ? 524 CYS B CB 1 ATOM 3165 S SG . CYS B 1 200 ? 32.415 20.784 34.930 1.00 33.60 ? 524 CYS B SG 1 ATOM 3166 N N . ARG B 1 201 ? 31.610 19.388 38.268 1.00 29.07 ? 525 ARG B N 1 ATOM 3167 C CA . ARG B 1 201 ? 30.353 18.722 38.585 1.00 29.08 ? 525 ARG B CA 1 ATOM 3168 C C . ARG B 1 201 ? 29.170 19.492 38.056 1.00 28.42 ? 525 ARG B C 1 ATOM 3169 O O . ARG B 1 201 ? 29.010 20.691 38.333 1.00 27.13 ? 525 ARG B O 1 ATOM 3170 C CB . ARG B 1 201 ? 30.197 18.579 40.092 1.00 29.76 ? 525 ARG B CB 1 ATOM 3171 C CG . ARG B 1 201 ? 28.925 17.845 40.488 1.00 31.50 ? 525 ARG B CG 1 ATOM 3172 C CD . ARG B 1 201 ? 28.978 17.430 41.917 1.00 32.15 ? 525 ARG B CD 1 ATOM 3173 N NE . ARG B 1 201 ? 28.857 18.614 42.737 1.00 34.61 ? 525 ARG B NE 1 ATOM 3174 C CZ . ARG B 1 201 ? 29.109 18.681 44.044 1.00 34.38 ? 525 ARG B CZ 1 ATOM 3175 N NH1 . ARG B 1 201 ? 29.509 17.612 44.710 1.00 34.80 ? 525 ARG B NH1 1 ATOM 3176 N NH2 . ARG B 1 201 ? 28.948 19.841 44.663 1.00 34.62 ? 525 ARG B NH2 1 ATOM 3177 N N . ALA B 1 202 ? 28.323 18.788 37.314 1.00 28.57 ? 526 ALA B N 1 ATOM 3178 C CA . ALA B 1 202 ? 27.042 19.332 36.874 1.00 28.04 ? 526 ALA B CA 1 ATOM 3179 C C . ALA B 1 202 ? 25.898 18.766 37.719 1.00 27.75 ? 526 ALA B C 1 ATOM 3180 O O . ALA B 1 202 ? 25.792 17.549 37.931 1.00 29.94 ? 526 ALA B O 1 ATOM 3181 C CB . ALA B 1 202 ? 26.824 19.040 35.383 1.00 25.83 ? 526 ALA B CB 1 ATOM 3182 N N . VAL B 1 203 ? 25.043 19.656 38.209 1.00 28.32 ? 527 VAL B N 1 ATOM 3183 C CA . VAL B 1 203 ? 23.823 19.256 38.901 1.00 26.27 ? 527 VAL B CA 1 ATOM 3184 C C . VAL B 1 203 ? 22.598 19.432 37.982 1.00 26.09 ? 527 VAL B C 1 ATOM 3185 O O . VAL B 1 203 ? 22.267 20.527 37.541 1.00 25.49 ? 527 VAL B O 1 ATOM 3186 C CB . VAL B 1 203 ? 23.611 20.042 40.208 1.00 26.03 ? 527 VAL B CB 1 ATOM 3187 C CG1 . VAL B 1 203 ? 22.468 19.432 40.992 1.00 24.57 ? 527 VAL B CG1 1 ATOM 3188 C CG2 . VAL B 1 203 ? 24.899 20.043 41.062 1.00 26.12 ? 527 VAL B CG2 1 ATOM 3189 N N . HIS B 1 204 ? 21.923 18.330 37.701 1.00 26.27 ? 528 HIS B N 1 ATOM 3190 C CA . HIS B 1 204 ? 20.826 18.341 36.755 1.00 25.98 ? 528 HIS B CA 1 ATOM 3191 C C . HIS B 1 204 ? 19.780 17.292 37.169 1.00 24.44 ? 528 HIS B C 1 ATOM 3192 O O . HIS B 1 204 ? 20.115 16.165 37.466 1.00 24.21 ? 528 HIS B O 1 ATOM 3193 C CB . HIS B 1 204 ? 21.362 18.104 35.319 1.00 24.91 ? 528 HIS B CB 1 ATOM 3194 C CG . HIS B 1 204 ? 20.324 18.286 34.248 1.00 24.32 ? 528 HIS B CG 1 ATOM 3195 N ND1 . HIS B 1 204 ? 19.502 17.270 33.817 1.00 23.73 ? 528 HIS B ND1 1 ATOM 3196 C CD2 . HIS B 1 204 ? 19.938 19.392 33.568 1.00 24.56 ? 528 HIS B CD2 1 ATOM 3197 C CE1 . HIS B 1 204 ? 18.653 17.746 32.921 1.00 24.20 ? 528 HIS B CE1 1 ATOM 3198 N NE2 . HIS B 1 204 ? 18.895 19.032 32.752 1.00 23.06 ? 528 HIS B NE2 1 ATOM 3199 N N . GLU B 1 205 ? 18.502 17.657 37.116 1.00 26.65 ? 529 GLU B N 1 ATOM 3200 C CA . GLU B 1 205 ? 17.414 16.778 37.534 1.00 27.54 ? 529 GLU B CA 1 ATOM 3201 C C . GLU B 1 205 ? 17.322 15.419 36.820 1.00 28.46 ? 529 GLU B C 1 ATOM 3202 O O . GLU B 1 205 ? 16.798 14.462 37.400 1.00 28.40 ? 529 GLU B O 1 ATOM 3203 C CB . GLU B 1 205 ? 16.073 17.495 37.396 1.00 29.37 ? 529 GLU B CB 1 ATOM 3204 C CG . GLU B 1 205 ? 15.673 17.825 35.950 1.00 32.19 ? 529 GLU B CG 1 ATOM 3205 C CD . GLU B 1 205 ? 14.524 18.805 35.868 1.00 33.83 ? 529 GLU B CD 1 ATOM 3206 O OE1 . GLU B 1 205 ? 14.788 19.983 35.558 1.00 35.45 ? 529 GLU B OE1 1 ATOM 3207 O OE2 . GLU B 1 205 ? 13.357 18.429 36.134 1.00 36.46 ? 529 GLU B OE2 1 ATOM 3208 N N . ALA B 1 206 ? 17.800 15.336 35.578 1.00 28.30 ? 530 ALA B N 1 ATOM 3209 C CA . ALA B 1 206 ? 17.674 14.109 34.772 1.00 28.34 ? 530 ALA B CA 1 ATOM 3210 C C . ALA B 1 206 ? 18.866 13.182 34.992 1.00 28.60 ? 530 ALA B C 1 ATOM 3211 O O . ALA B 1 206 ? 18.850 12.033 34.581 1.00 26.45 ? 530 ALA B O 1 ATOM 3212 C CB . ALA B 1 206 ? 17.514 14.435 33.279 1.00 26.53 ? 530 ALA B CB 1 ATOM 3213 N N . ALA B 1 207 ? 19.902 13.674 35.655 1.00 30.57 ? 531 ALA B N 1 ATOM 3214 C CA . ALA B 1 207 ? 21.042 12.832 35.982 1.00 32.05 ? 531 ALA B CA 1 ATOM 3215 C C . ALA B 1 207 ? 20.761 11.752 37.075 1.00 34.34 ? 531 ALA B C 1 ATOM 3216 O O . ALA B 1 207 ? 20.046 11.954 38.074 1.00 33.64 ? 531 ALA B O 1 ATOM 3217 C CB . ALA B 1 207 ? 22.252 13.700 36.311 1.00 31.85 ? 531 ALA B CB 1 ATOM 3218 N N . SER B 1 208 ? 21.321 10.567 36.855 1.00 36.65 ? 532 SER B N 1 ATOM 3219 C CA . SER B 1 208 ? 21.078 9.419 37.725 1.00 37.69 ? 532 SER B CA 1 ATOM 3220 C C . SER B 1 208 ? 22.352 8.830 38.328 1.00 38.29 ? 532 SER B C 1 ATOM 3221 O O . SER B 1 208 ? 23.413 8.818 37.705 1.00 38.50 ? 532 SER B O 1 ATOM 3222 C CB . SER B 1 208 ? 20.373 8.316 36.950 1.00 40.00 ? 532 SER B CB 1 ATOM 3223 O OG . SER B 1 208 ? 21.211 7.866 35.894 1.00 40.87 ? 532 SER B OG 1 ATOM 3224 N N . PRO B 1 209 ? 22.244 8.306 39.554 1.00 37.99 ? 533 PRO B N 1 ATOM 3225 C CA . PRO B 1 209 ? 21.037 8.217 40.357 1.00 37.61 ? 533 PRO B CA 1 ATOM 3226 C C . PRO B 1 209 ? 20.764 9.429 41.262 1.00 36.87 ? 533 PRO B C 1 ATOM 3227 O O . PRO B 1 209 ? 19.685 9.501 41.866 1.00 37.20 ? 533 PRO B O 1 ATOM 3228 C CB . PRO B 1 209 ? 21.312 6.986 41.215 1.00 38.31 ? 533 PRO B CB 1 ATOM 3229 C CG . PRO B 1 209 ? 22.806 7.029 41.440 1.00 38.12 ? 533 PRO B CG 1 ATOM 3230 C CD . PRO B 1 209 ? 23.403 7.693 40.224 1.00 38.71 ? 533 PRO B CD 1 ATOM 3231 N N . SER B 1 210 ? 21.720 10.358 41.343 1.00 35.61 ? 534 SER B N 1 ATOM 3232 C CA . SER B 1 210 ? 21.724 11.386 42.383 1.00 35.15 ? 534 SER B CA 1 ATOM 3233 C C . SER B 1 210 ? 21.702 12.817 41.865 1.00 32.31 ? 534 SER B C 1 ATOM 3234 O O . SER B 1 210 ? 22.088 13.728 42.572 1.00 32.28 ? 534 SER B O 1 ATOM 3235 C CB . SER B 1 210 ? 22.939 11.195 43.299 1.00 36.48 ? 534 SER B CB 1 ATOM 3236 O OG . SER B 1 210 ? 22.835 9.967 44.014 1.00 37.91 ? 534 SER B OG 1 ATOM 3237 N N . GLN B 1 211 ? 21.206 12.992 40.650 1.00 30.60 ? 535 GLN B N 1 ATOM 3238 C CA . GLN B 1 211 ? 21.121 14.280 39.972 1.00 29.84 ? 535 GLN B CA 1 ATOM 3239 C C . GLN B 1 211 ? 22.460 15.010 39.831 1.00 30.32 ? 535 GLN B C 1 ATOM 3240 O O . GLN B 1 211 ? 22.502 16.247 39.753 1.00 28.33 ? 535 GLN B O 1 ATOM 3241 C CB . GLN B 1 211 ? 20.065 15.184 40.608 1.00 29.29 ? 535 GLN B CB 1 ATOM 3242 C CG . GLN B 1 211 ? 18.641 14.577 40.623 1.00 29.10 ? 535 GLN B CG 1 ATOM 3243 C CD . GLN B 1 211 ? 18.452 13.473 41.637 1.00 28.07 ? 535 GLN B CD 1 ATOM 3244 O OE1 . GLN B 1 211 ? 18.773 13.619 42.813 1.00 29.42 ? 535 GLN B OE1 1 ATOM 3245 N NE2 . GLN B 1 211 ? 17.906 12.365 41.188 1.00 27.14 ? 535 GLN B NE2 1 ATOM 3246 N N . THR B 1 212 ? 23.546 14.248 39.739 1.00 30.04 ? 536 THR B N 1 ATOM 3247 C CA . THR B 1 212 ? 24.864 14.851 39.478 1.00 30.44 ? 536 THR B CA 1 ATOM 3248 C C . THR B 1 212 ? 25.647 14.029 38.450 1.00 29.86 ? 536 THR B C 1 ATOM 3249 O O . THR B 1 212 ? 25.530 12.795 38.375 1.00 31.82 ? 536 THR B O 1 ATOM 3250 C CB . THR B 1 212 ? 25.748 14.989 40.742 1.00 30.36 ? 536 THR B CB 1 ATOM 3251 O OG1 . THR B 1 212 ? 25.967 13.691 41.321 1.00 32.17 ? 536 THR B OG1 1 ATOM 3252 C CG2 . THR B 1 212 ? 25.116 15.927 41.771 1.00 30.31 ? 536 THR B CG2 1 ATOM 3253 N N . VAL B 1 213 ? 26.433 14.737 37.656 1.00 28.88 ? 537 VAL B N 1 ATOM 3254 C CA . VAL B 1 213 ? 27.401 14.127 36.764 1.00 28.44 ? 537 VAL B CA 1 ATOM 3255 C C . VAL B 1 213 ? 28.673 14.972 36.899 1.00 29.91 ? 537 VAL B C 1 ATOM 3256 O O . VAL B 1 213 ? 28.635 16.211 36.794 1.00 30.27 ? 537 VAL B O 1 ATOM 3257 C CB . VAL B 1 213 ? 26.892 14.081 35.285 1.00 27.39 ? 537 VAL B CB 1 ATOM 3258 C CG1 . VAL B 1 213 ? 27.808 13.199 34.428 1.00 26.42 ? 537 VAL B CG1 1 ATOM 3259 C CG2 . VAL B 1 213 ? 25.453 13.542 35.180 1.00 27.99 ? 537 VAL B CG2 1 ATOM 3260 N N . GLN B 1 214 ? 29.801 14.316 37.138 1.00 29.71 ? 538 GLN B N 1 ATOM 3261 C CA . GLN B 1 214 ? 31.055 15.040 37.305 1.00 29.05 ? 538 GLN B CA 1 ATOM 3262 C C . GLN B 1 214 ? 32.217 14.341 36.613 1.00 29.79 ? 538 GLN B C 1 ATOM 3263 O O . GLN B 1 214 ? 32.213 13.121 36.411 1.00 30.84 ? 538 GLN B O 1 ATOM 3264 C CB . GLN B 1 214 ? 31.368 15.216 38.792 1.00 28.37 ? 538 GLN B CB 1 ATOM 3265 C CG . GLN B 1 214 ? 31.807 13.929 39.500 1.00 27.52 ? 538 GLN B CG 1 ATOM 3266 C CD . GLN B 1 214 ? 31.910 14.116 41.006 1.00 26.74 ? 538 GLN B CD 1 ATOM 3267 O OE1 . GLN B 1 214 ? 30.922 14.439 41.645 1.00 26.15 ? 538 GLN B OE1 1 ATOM 3268 N NE2 . GLN B 1 214 ? 33.092 13.905 41.567 1.00 26.26 ? 538 GLN B NE2 1 ATOM 3269 N N . ARG B 1 215 ? 33.243 15.118 36.295 1.00 31.84 ? 539 ARG B N 1 ATOM 3270 C CA . ARG B 1 215 ? 34.437 14.613 35.595 1.00 32.18 ? 539 ARG B CA 1 ATOM 3271 C C . ARG B 1 215 ? 35.672 15.327 36.144 1.00 30.77 ? 539 ARG B C 1 ATOM 3272 O O . ARG B 1 215 ? 35.698 16.563 36.282 1.00 29.60 ? 539 ARG B O 1 ATOM 3273 C CB . ARG B 1 215 ? 34.288 14.794 34.062 1.00 34.54 ? 539 ARG B CB 1 ATOM 3274 C CG . ARG B 1 215 ? 35.024 13.736 33.210 1.00 37.96 ? 539 ARG B CG 1 ATOM 3275 C CD . ARG B 1 215 ? 34.218 12.496 32.764 1.00 38.85 ? 539 ARG B CD 1 ATOM 3276 N NE . ARG B 1 215 ? 33.281 12.034 33.772 1.00 39.17 ? 539 ARG B NE 1 ATOM 3277 C CZ . ARG B 1 215 ? 32.172 11.340 33.546 1.00 38.03 ? 539 ARG B CZ 1 ATOM 3278 N NH1 . ARG B 1 215 ? 31.834 10.915 32.353 1.00 39.23 ? 539 ARG B NH1 1 ATOM 3279 N NH2 . ARG B 1 215 ? 31.379 11.064 34.556 1.00 37.98 ? 539 ARG B NH2 1 ATOM 3280 N N . ALA B 1 216 ? 36.683 14.555 36.512 1.00 29.30 ? 540 ALA B N 1 ATOM 3281 C CA . ALA B 1 216 ? 37.970 15.147 36.866 1.00 29.97 ? 540 ALA B CA 1 ATOM 3282 C C . ALA B 1 216 ? 38.877 15.481 35.661 1.00 28.44 ? 540 ALA B C 1 ATOM 3283 O O . ALA B 1 216 ? 38.775 14.921 34.593 1.00 29.65 ? 540 ALA B O 1 ATOM 3284 C CB . ALA B 1 216 ? 38.721 14.258 37.850 1.00 27.82 ? 540 ALA B CB 1 ATOM 3285 N N . VAL B 1 217 ? 39.783 16.415 35.861 1.00 29.52 ? 541 VAL B N 1 ATOM 3286 C CA . VAL B 1 217 ? 40.850 16.683 34.909 1.00 28.34 ? 541 VAL B CA 1 ATOM 3287 C C . VAL B 1 217 ? 42.116 17.080 35.678 1.00 30.43 ? 541 VAL B C 1 ATOM 3288 O O . VAL B 1 217 ? 42.046 17.613 36.779 1.00 28.96 ? 541 VAL B O 1 ATOM 3289 C CB . VAL B 1 217 ? 40.475 17.817 33.863 1.00 27.09 ? 541 VAL B CB 1 ATOM 3290 C CG1 . VAL B 1 217 ? 40.279 19.183 34.493 1.00 24.30 ? 541 VAL B CG1 1 ATOM 3291 C CG2 . VAL B 1 217 ? 41.532 17.893 32.744 1.00 24.75 ? 541 VAL B CG2 1 ATOM 3292 N N . SER B 1 218 ? 43.266 16.831 35.062 1.00 33.93 ? 542 SER B N 1 ATOM 3293 C CA . SER B 1 218 ? 44.572 17.202 35.598 1.00 35.98 ? 542 SER B CA 1 ATOM 3294 C C . SER B 1 218 ? 45.341 18.028 34.575 1.00 38.11 ? 542 SER B C 1 ATOM 3295 O O . SER B 1 218 ? 45.135 17.896 33.371 1.00 39.24 ? 542 SER B O 1 ATOM 3296 C CB . SER B 1 218 ? 45.376 15.950 35.953 1.00 35.53 ? 542 SER B CB 1 ATOM 3297 O OG . SER B 1 218 ? 44.707 15.201 36.952 1.00 35.52 ? 542 SER B OG 1 ATOM 3298 N N . VAL B 1 219 ? 46.201 18.906 35.074 1.00 40.89 ? 543 VAL B N 1 ATOM 3299 C CA . VAL B 1 219 ? 47.082 19.724 34.243 1.00 43.10 ? 543 VAL B CA 1 ATOM 3300 C C . VAL B 1 219 ? 48.182 18.881 33.605 1.00 45.75 ? 543 VAL B C 1 ATOM 3301 O O . VAL B 1 219 ? 48.492 19.068 32.427 1.00 45.21 ? 543 VAL B O 1 ATOM 3302 C CB . VAL B 1 219 ? 47.715 20.877 35.077 1.00 42.63 ? 543 VAL B CB 1 ATOM 3303 C CG1 . VAL B 1 219 ? 48.855 21.540 34.327 1.00 41.81 ? 543 VAL B CG1 1 ATOM 3304 C CG2 . VAL B 1 219 ? 46.641 21.881 35.464 1.00 39.98 ? 543 VAL B CG2 1 ATOM 3305 N N . ASN B 1 220 ? 48.738 17.950 34.384 1.00 49.20 ? 544 ASN B N 1 ATOM 3306 C CA . ASN B 1 220 ? 49.752 17.007 33.922 1.00 52.34 ? 544 ASN B CA 1 ATOM 3307 C C . ASN B 1 220 ? 51.015 17.694 33.396 1.00 54.83 ? 544 ASN B C 1 ATOM 3308 O O . ASN B 1 220 ? 51.941 18.075 34.140 1.00 55.34 ? 544 ASN B O 1 ATOM 3309 C CB . ASN B 1 220 ? 49.183 16.083 32.839 1.00 53.21 ? 544 ASN B CB 1 ATOM 3310 C CG . ASN B 1 220 ? 48.322 14.964 33.403 1.00 54.01 ? 544 ASN B CG 1 ATOM 3311 O OD1 . ASN B 1 220 ? 48.591 14.440 34.495 1.00 55.18 ? 544 ASN B OD1 1 ATOM 3312 N ND2 . ASN B 1 220 ? 47.302 14.561 32.639 1.00 53.95 ? 544 ASN B ND2 1 ATOM 3313 N N . VAL C 1 12 ? 64.698 28.309 65.459 1.00 54.97 ? 336 VAL E N 1 ATOM 3314 C CA . VAL C 1 12 ? 63.904 28.877 64.326 1.00 55.38 ? 336 VAL E CA 1 ATOM 3315 C C . VAL C 1 12 ? 62.681 29.661 64.806 1.00 55.32 ? 336 VAL E C 1 ATOM 3316 O O . VAL C 1 12 ? 61.868 29.156 65.579 1.00 55.12 ? 336 VAL E O 1 ATOM 3317 C CB . VAL C 1 12 ? 63.422 27.783 63.343 1.00 55.42 ? 336 VAL E CB 1 ATOM 3318 C CG1 . VAL C 1 12 ? 62.836 28.424 62.090 1.00 55.59 ? 336 VAL E CG1 1 ATOM 3319 C CG2 . VAL C 1 12 ? 64.560 26.835 62.978 1.00 55.79 ? 336 VAL E CG2 1 ATOM 3320 N N . SER C 1 13 ? 62.563 30.900 64.332 1.00 55.58 ? 337 SER E N 1 ATOM 3321 C CA . SER C 1 13 ? 61.415 31.750 64.627 1.00 55.18 ? 337 SER E CA 1 ATOM 3322 C C . SER C 1 13 ? 60.916 32.468 63.361 1.00 55.36 ? 337 SER E C 1 ATOM 3323 O O . SER C 1 13 ? 61.689 32.751 62.432 1.00 54.24 ? 337 SER E O 1 ATOM 3324 C CB . SER C 1 13 ? 61.777 32.759 65.712 1.00 55.08 ? 337 SER E CB 1 ATOM 3325 O OG . SER C 1 13 ? 62.823 33.598 65.270 1.00 55.40 ? 337 SER E OG 1 ATOM 3326 N N . ALA C 1 14 ? 59.613 32.754 63.342 1.00 55.50 ? 338 ALA E N 1 ATOM 3327 C CA . ALA C 1 14 ? 58.941 33.314 62.171 1.00 55.52 ? 338 ALA E CA 1 ATOM 3328 C C . ALA C 1 14 ? 58.093 34.528 62.541 1.00 55.62 ? 338 ALA E C 1 ATOM 3329 O O . ALA C 1 14 ? 57.284 34.474 63.463 1.00 55.81 ? 338 ALA E O 1 ATOM 3330 C CB . ALA C 1 14 ? 58.071 32.254 61.503 1.00 55.32 ? 338 ALA E CB 1 ATOM 3331 N N . TYR C 1 15 ? 58.291 35.621 61.807 1.00 55.89 ? 339 TYR E N 1 ATOM 3332 C CA . TYR C 1 15 ? 57.498 36.837 61.966 1.00 55.98 ? 339 TYR E CA 1 ATOM 3333 C C . TYR C 1 15 ? 56.884 37.249 60.618 1.00 55.57 ? 339 TYR E C 1 ATOM 3334 O O . TYR C 1 15 ? 57.522 37.129 59.565 1.00 54.49 ? 339 TYR E O 1 ATOM 3335 C CB . TYR C 1 15 ? 58.382 37.968 62.506 1.00 56.10 ? 339 TYR E CB 1 ATOM 3336 C CG . TYR C 1 15 ? 59.314 37.544 63.621 1.00 56.35 ? 339 TYR E CG 1 ATOM 3337 C CD1 . TYR C 1 15 ? 60.640 37.229 63.358 1.00 56.34 ? 339 TYR E CD1 1 ATOM 3338 C CD2 . TYR C 1 15 ? 58.867 37.459 64.937 1.00 56.45 ? 339 TYR E CD2 1 ATOM 3339 C CE1 . TYR C 1 15 ? 61.498 36.847 64.371 1.00 56.53 ? 339 TYR E CE1 1 ATOM 3340 C CE2 . TYR C 1 15 ? 59.717 37.077 65.960 1.00 56.55 ? 339 TYR E CE2 1 ATOM 3341 C CZ . TYR C 1 15 ? 61.036 36.770 65.669 1.00 56.71 ? 339 TYR E CZ 1 ATOM 3342 O OH . TYR C 1 15 ? 61.909 36.390 66.664 1.00 56.72 ? 339 TYR E OH 1 ATOM 3343 N N . LEU C 1 16 ? 55.641 37.718 60.653 1.00 55.18 ? 340 LEU E N 1 ATOM 3344 C CA . LEU C 1 16 ? 54.977 38.239 59.457 1.00 55.05 ? 340 LEU E CA 1 ATOM 3345 C C . LEU C 1 16 ? 54.525 39.678 59.721 1.00 55.19 ? 340 LEU E C 1 ATOM 3346 O O . LEU C 1 16 ? 53.801 39.938 60.686 1.00 56.26 ? 340 LEU E O 1 ATOM 3347 C CB . LEU C 1 16 ? 53.793 37.347 59.057 1.00 54.44 ? 340 LEU E CB 1 ATOM 3348 C CG . LEU C 1 16 ? 53.031 37.716 57.774 1.00 54.07 ? 340 LEU E CG 1 ATOM 3349 C CD1 . LEU C 1 16 ? 53.975 37.952 56.608 1.00 53.94 ? 340 LEU E CD1 1 ATOM 3350 C CD2 . LEU C 1 16 ? 52.011 36.667 57.403 1.00 53.16 ? 340 LEU E CD2 1 ATOM 3351 N N . SER C 1 17 ? 54.962 40.602 58.869 1.00 54.67 ? 341 SER E N 1 ATOM 3352 C CA . SER C 1 17 ? 54.698 42.042 59.043 1.00 54.72 ? 341 SER E CA 1 ATOM 3353 C C . SER C 1 17 ? 53.493 42.536 58.242 1.00 54.37 ? 341 SER E C 1 ATOM 3354 O O . SER C 1 17 ? 52.912 41.794 57.434 1.00 54.78 ? 341 SER E O 1 ATOM 3355 C CB . SER C 1 17 ? 55.906 42.858 58.583 1.00 54.83 ? 341 SER E CB 1 ATOM 3356 O OG . SER C 1 17 ? 56.034 42.773 57.164 1.00 55.54 ? 341 SER E OG 1 ATOM 3357 N N . ARG C 1 18 ? 53.134 43.795 58.489 1.00 53.05 ? 342 ARG E N 1 ATOM 3358 C CA . ARG C 1 18 ? 52.105 44.503 57.736 1.00 51.73 ? 342 ARG E CA 1 ATOM 3359 C C . ARG C 1 18 ? 52.769 45.568 56.839 1.00 50.83 ? 342 ARG E C 1 ATOM 3360 O O . ARG C 1 18 ? 53.971 45.858 56.975 1.00 49.81 ? 342 ARG E O 1 ATOM 3361 C CB . ARG C 1 18 ? 51.110 45.169 58.692 1.00 52.62 ? 342 ARG E CB 1 ATOM 3362 C CG . ARG C 1 18 ? 50.165 44.223 59.445 1.00 53.13 ? 342 ARG E CG 1 ATOM 3363 C CD . ARG C 1 18 ? 49.220 44.971 60.386 1.00 53.44 ? 342 ARG E CD 1 ATOM 3364 N NE . ARG C 1 18 ? 49.979 45.570 61.484 1.00 54.55 ? 342 ARG E NE 1 ATOM 3365 C CZ . ARG C 1 18 ? 50.180 45.007 62.674 1.00 55.03 ? 342 ARG E CZ 1 ATOM 3366 N NH1 . ARG C 1 18 ? 49.638 43.831 62.965 1.00 55.91 ? 342 ARG E NH1 1 ATOM 3367 N NH2 . ARG C 1 18 ? 50.912 45.630 63.588 1.00 54.74 ? 342 ARG E NH2 1 ATOM 3368 N N . PRO C 1 19 ? 51.998 46.135 55.899 1.00 49.54 ? 343 PRO E N 1 ATOM 3369 C CA . PRO C 1 19 ? 52.545 47.167 55.035 1.00 50.03 ? 343 PRO E CA 1 ATOM 3370 C C . PRO C 1 19 ? 52.865 48.443 55.812 1.00 49.27 ? 343 PRO E C 1 ATOM 3371 O O . PRO C 1 19 ? 52.152 48.818 56.761 1.00 47.70 ? 343 PRO E O 1 ATOM 3372 C CB . PRO C 1 19 ? 51.421 47.411 54.002 1.00 50.00 ? 343 PRO E CB 1 ATOM 3373 C CG . PRO C 1 19 ? 50.562 46.207 54.059 1.00 49.70 ? 343 PRO E CG 1 ATOM 3374 C CD . PRO C 1 19 ? 50.618 45.794 55.512 1.00 50.23 ? 343 PRO E CD 1 ATOM 3375 N N . SER C 1 20 ? 53.947 49.101 55.417 1.00 48.19 ? 344 SER E N 1 ATOM 3376 C CA . SER C 1 20 ? 54.234 50.396 55.983 1.00 46.94 ? 344 SER E CA 1 ATOM 3377 C C . SER C 1 20 ? 53.220 51.362 55.382 1.00 44.90 ? 344 SER E C 1 ATOM 3378 O O . SER C 1 20 ? 52.820 51.188 54.225 1.00 44.14 ? 344 SER E O 1 ATOM 3379 C CB . SER C 1 20 ? 55.677 50.811 55.712 1.00 47.75 ? 344 SER E CB 1 ATOM 3380 O OG . SER C 1 20 ? 55.829 51.382 54.429 1.00 48.91 ? 344 SER E OG 1 ATOM 3381 N N . PRO C 1 21 ? 52.719 52.310 56.202 1.00 43.27 ? 345 PRO E N 1 ATOM 3382 C CA . PRO C 1 21 ? 51.791 53.356 55.760 1.00 41.50 ? 345 PRO E CA 1 ATOM 3383 C C . PRO C 1 21 ? 52.309 54.169 54.587 1.00 40.05 ? 345 PRO E C 1 ATOM 3384 O O . PRO C 1 21 ? 51.543 54.516 53.692 1.00 39.00 ? 345 PRO E O 1 ATOM 3385 C CB . PRO C 1 21 ? 51.658 54.240 56.998 1.00 41.41 ? 345 PRO E CB 1 ATOM 3386 C CG . PRO C 1 21 ? 51.830 53.292 58.130 1.00 41.64 ? 345 PRO E CG 1 ATOM 3387 C CD . PRO C 1 21 ? 52.775 52.223 57.677 1.00 42.23 ? 345 PRO E CD 1 ATOM 3388 N N . PHE C 1 22 ? 53.600 54.480 54.601 1.00 40.35 ? 346 PHE E N 1 ATOM 3389 C CA . PHE C 1 22 ? 54.256 55.101 53.440 1.00 40.48 ? 346 PHE E CA 1 ATOM 3390 C C . PHE C 1 22 ? 54.043 54.318 52.147 1.00 39.64 ? 346 PHE E C 1 ATOM 3391 O O . PHE C 1 22 ? 53.650 54.892 51.144 1.00 39.46 ? 346 PHE E O 1 ATOM 3392 C CB . PHE C 1 22 ? 55.747 55.292 53.688 1.00 40.45 ? 346 PHE E CB 1 ATOM 3393 C CG . PHE C 1 22 ? 56.462 55.998 52.563 1.00 41.03 ? 346 PHE E CG 1 ATOM 3394 C CD1 . PHE C 1 22 ? 56.114 57.290 52.198 1.00 41.89 ? 346 PHE E CD1 1 ATOM 3395 C CD2 . PHE C 1 22 ? 57.474 55.369 51.872 1.00 41.27 ? 346 PHE E CD2 1 ATOM 3396 C CE1 . PHE C 1 22 ? 56.765 57.937 51.161 1.00 42.22 ? 346 PHE E CE1 1 ATOM 3397 C CE2 . PHE C 1 22 ? 58.138 56.012 50.845 1.00 42.02 ? 346 PHE E CE2 1 ATOM 3398 C CZ . PHE C 1 22 ? 57.785 57.302 50.490 1.00 41.86 ? 346 PHE E CZ 1 ATOM 3399 N N . ASP C 1 23 ? 54.277 53.012 52.174 1.00 40.12 ? 347 ASP E N 1 ATOM 3400 C CA . ASP C 1 23 ? 54.101 52.197 50.982 1.00 40.47 ? 347 ASP E CA 1 ATOM 3401 C C . ASP C 1 23 ? 52.651 52.094 50.558 1.00 41.03 ? 347 ASP E C 1 ATOM 3402 O O . ASP C 1 23 ? 52.356 52.211 49.378 1.00 40.38 ? 347 ASP E O 1 ATOM 3403 C CB . ASP C 1 23 ? 54.668 50.796 51.197 1.00 42.30 ? 347 ASP E CB 1 ATOM 3404 C CG . ASP C 1 23 ? 56.179 50.776 51.216 1.00 41.43 ? 347 ASP E CG 1 ATOM 3405 O OD1 . ASP C 1 23 ? 56.738 49.746 51.620 1.00 43.75 ? 347 ASP E OD1 1 ATOM 3406 O OD2 . ASP C 1 23 ? 56.806 51.788 50.885 1.00 42.01 ? 347 ASP E OD2 1 ATOM 3407 N N . LEU C 1 24 ? 51.758 51.913 51.532 1.00 41.22 ? 348 LEU E N 1 ATOM 3408 C CA . LEU C 1 24 ? 50.326 51.777 51.297 1.00 41.62 ? 348 LEU E CA 1 ATOM 3409 C C . LEU C 1 24 ? 49.641 53.029 50.745 1.00 43.28 ? 348 LEU E C 1 ATOM 3410 O O . LEU C 1 24 ? 48.896 52.953 49.763 1.00 43.87 ? 348 LEU E O 1 ATOM 3411 C CB . LEU C 1 24 ? 49.645 51.362 52.612 1.00 40.99 ? 348 LEU E CB 1 ATOM 3412 C CG . LEU C 1 24 ? 48.175 50.940 52.572 1.00 39.64 ? 348 LEU E CG 1 ATOM 3413 C CD1 . LEU C 1 24 ? 47.919 49.759 51.635 1.00 39.03 ? 348 LEU E CD1 1 ATOM 3414 C CD2 . LEU C 1 24 ? 47.757 50.587 53.977 1.00 39.38 ? 348 LEU E CD2 1 ATOM 3415 N N . PHE C 1 25 ? 49.895 54.182 51.370 1.00 45.10 ? 349 PHE E N 1 ATOM 3416 C CA . PHE C 1 25 ? 49.148 55.402 51.081 1.00 45.88 ? 349 PHE E CA 1 ATOM 3417 C C . PHE C 1 25 ? 49.891 56.394 50.200 1.00 46.54 ? 349 PHE E C 1 ATOM 3418 O O . PHE C 1 25 ? 49.266 57.146 49.470 1.00 45.47 ? 349 PHE E O 1 ATOM 3419 C CB . PHE C 1 25 ? 48.760 56.136 52.379 1.00 45.74 ? 349 PHE E CB 1 ATOM 3420 C CG . PHE C 1 25 ? 47.945 55.317 53.328 1.00 45.30 ? 349 PHE E CG 1 ATOM 3421 C CD1 . PHE C 1 25 ? 48.464 54.935 54.558 1.00 45.38 ? 349 PHE E CD1 1 ATOM 3422 C CD2 . PHE C 1 25 ? 46.654 54.937 53.005 1.00 45.65 ? 349 PHE E CD2 1 ATOM 3423 C CE1 . PHE C 1 25 ? 47.713 54.180 55.442 1.00 45.46 ? 349 PHE E CE1 1 ATOM 3424 C CE2 . PHE C 1 25 ? 45.891 54.169 53.881 1.00 45.34 ? 349 PHE E CE2 1 ATOM 3425 C CZ . PHE C 1 25 ? 46.417 53.796 55.103 1.00 45.53 ? 349 PHE E CZ 1 ATOM 3426 N N . ILE C 1 26 ? 51.212 56.465 50.317 1.00 48.28 ? 350 ILE E N 1 ATOM 3427 C CA . ILE C 1 26 ? 51.951 57.450 49.543 1.00 49.07 ? 350 ILE E CA 1 ATOM 3428 C C . ILE C 1 26 ? 52.461 56.808 48.252 1.00 50.81 ? 350 ILE E C 1 ATOM 3429 O O . ILE C 1 26 ? 52.065 57.224 47.164 1.00 50.44 ? 350 ILE E O 1 ATOM 3430 C CB . ILE C 1 26 ? 53.106 58.118 50.334 1.00 49.41 ? 350 ILE E CB 1 ATOM 3431 C CG1 . ILE C 1 26 ? 52.640 58.607 51.713 1.00 48.56 ? 350 ILE E CG1 1 ATOM 3432 C CG2 . ILE C 1 26 ? 53.669 59.315 49.547 1.00 48.25 ? 350 ILE E CG2 1 ATOM 3433 C CD1 . ILE C 1 26 ? 51.578 59.697 51.671 1.00 48.00 ? 350 ILE E CD1 1 ATOM 3434 N N . ARG C 1 27 ? 53.311 55.788 48.363 1.00 52.38 ? 351 ARG E N 1 ATOM 3435 C CA . ARG C 1 27 ? 53.818 55.101 47.172 1.00 53.02 ? 351 ARG E CA 1 ATOM 3436 C C . ARG C 1 27 ? 52.758 54.251 46.479 1.00 53.02 ? 351 ARG E C 1 ATOM 3437 O O . ARG C 1 27 ? 52.831 54.023 45.269 1.00 53.49 ? 351 ARG E O 1 ATOM 3438 C CB . ARG C 1 27 ? 55.032 54.245 47.519 1.00 53.67 ? 351 ARG E CB 1 ATOM 3439 C CG . ARG C 1 27 ? 56.262 55.077 47.785 1.00 54.70 ? 351 ARG E CG 1 ATOM 3440 C CD . ARG C 1 27 ? 57.488 54.225 48.069 1.00 55.44 ? 351 ARG E CD 1 ATOM 3441 N NE . ARG C 1 27 ? 57.920 53.502 46.882 1.00 56.32 ? 351 ARG E NE 1 ATOM 3442 C CZ . ARG C 1 27 ? 57.806 52.189 46.717 1.00 57.12 ? 351 ARG E CZ 1 ATOM 3443 N NH1 . ARG C 1 27 ? 57.271 51.441 47.668 1.00 57.63 ? 351 ARG E NH1 1 ATOM 3444 N NH2 . ARG C 1 27 ? 58.213 51.626 45.586 1.00 57.13 ? 351 ARG E NH2 1 ATOM 3445 N N . LYS C 1 28 ? 51.770 53.798 47.245 1.00 52.65 ? 352 LYS E N 1 ATOM 3446 C CA . LYS C 1 28 ? 50.681 52.982 46.718 1.00 51.94 ? 352 LYS E CA 1 ATOM 3447 C C . LYS C 1 28 ? 51.197 51.687 46.073 1.00 50.71 ? 352 LYS E C 1 ATOM 3448 O O . LYS C 1 28 ? 50.707 51.254 45.030 1.00 49.17 ? 352 LYS E O 1 ATOM 3449 C CB . LYS C 1 28 ? 49.844 53.792 45.725 1.00 52.92 ? 352 LYS E CB 1 ATOM 3450 C CG . LYS C 1 28 ? 48.811 54.679 46.376 1.00 53.49 ? 352 LYS E CG 1 ATOM 3451 C CD . LYS C 1 28 ? 48.399 55.796 45.439 1.00 54.18 ? 352 LYS E CD 1 ATOM 3452 C CE . LYS C 1 28 ? 47.179 56.551 45.961 1.00 54.12 ? 352 LYS E CE 1 ATOM 3453 N NZ . LYS C 1 28 ? 47.310 56.943 47.387 1.00 53.59 ? 352 LYS E NZ 1 ATOM 3454 N N . SER C 1 29 ? 52.212 51.105 46.708 1.00 49.19 ? 353 SER E N 1 ATOM 3455 C CA . SER C 1 29 ? 52.730 49.794 46.372 1.00 48.05 ? 353 SER E CA 1 ATOM 3456 C C . SER C 1 29 ? 53.054 49.084 47.674 1.00 44.67 ? 353 SER E C 1 ATOM 3457 O O . SER C 1 29 ? 54.228 48.969 48.066 1.00 43.65 ? 353 SER E O 1 ATOM 3458 C CB . SER C 1 29 ? 53.949 49.874 45.436 1.00 49.65 ? 353 SER E CB 1 ATOM 3459 O OG . SER C 1 29 ? 54.988 50.641 45.988 1.00 53.39 ? 353 SER E OG 1 ATOM 3460 N N . PRO C 1 30 ? 51.996 48.624 48.368 1.00 41.62 ? 354 PRO E N 1 ATOM 3461 C CA . PRO C 1 30 ? 52.178 47.940 49.630 1.00 41.23 ? 354 PRO E CA 1 ATOM 3462 C C . PRO C 1 30 ? 52.715 46.533 49.470 1.00 42.02 ? 354 PRO E C 1 ATOM 3463 O O . PRO C 1 30 ? 52.368 45.818 48.514 1.00 39.63 ? 354 PRO E O 1 ATOM 3464 C CB . PRO C 1 30 ? 50.768 47.941 50.250 1.00 41.22 ? 354 PRO E CB 1 ATOM 3465 C CG . PRO C 1 30 ? 49.850 48.135 49.143 1.00 40.89 ? 354 PRO E CG 1 ATOM 3466 C CD . PRO C 1 30 ? 50.579 48.936 48.114 1.00 41.22 ? 354 PRO E CD 1 ATOM 3467 N N . THR C 1 31 ? 53.569 46.157 50.415 1.00 43.61 ? 355 THR E N 1 ATOM 3468 C CA . THR C 1 31 ? 54.117 44.810 50.484 1.00 45.10 ? 355 THR E CA 1 ATOM 3469 C C . THR C 1 31 ? 54.090 44.291 51.934 1.00 46.85 ? 355 THR E C 1 ATOM 3470 O O . THR C 1 31 ? 54.098 45.074 52.894 1.00 45.93 ? 355 THR E O 1 ATOM 3471 C CB . THR C 1 31 ? 55.574 44.796 49.945 1.00 45.18 ? 355 THR E CB 1 ATOM 3472 O OG1 . THR C 1 31 ? 56.446 45.441 50.885 1.00 44.45 ? 355 THR E OG1 1 ATOM 3473 C CG2 . THR C 1 31 ? 55.660 45.501 48.573 1.00 44.26 ? 355 THR E CG2 1 ATOM 3474 N N . ILE C 1 32 ? 54.064 42.971 52.086 1.00 47.20 ? 356 ILE E N 1 ATOM 3475 C CA . ILE C 1 32 ? 54.173 42.352 53.399 1.00 48.27 ? 356 ILE E CA 1 ATOM 3476 C C . ILE C 1 32 ? 55.340 41.379 53.363 1.00 49.29 ? 356 ILE E C 1 ATOM 3477 O O . ILE C 1 32 ? 55.644 40.838 52.307 1.00 48.32 ? 356 ILE E O 1 ATOM 3478 C CB . ILE C 1 32 ? 52.868 41.641 53.825 1.00 48.60 ? 356 ILE E CB 1 ATOM 3479 C CG1 . ILE C 1 32 ? 52.545 40.450 52.908 1.00 48.61 ? 356 ILE E CG1 1 ATOM 3480 C CG2 . ILE C 1 32 ? 51.722 42.641 53.818 1.00 47.91 ? 356 ILE E CG2 1 ATOM 3481 C CD1 . ILE C 1 32 ? 51.236 39.775 53.256 1.00 49.54 ? 356 ILE E CD1 1 ATOM 3482 N N . THR C 1 33 ? 55.994 41.182 54.509 1.00 50.82 ? 357 THR E N 1 ATOM 3483 C CA . THR C 1 33 ? 57.236 40.421 54.571 1.00 51.58 ? 357 THR E CA 1 ATOM 3484 C C . THR C 1 33 ? 57.191 39.335 55.633 1.00 51.18 ? 357 THR E C 1 ATOM 3485 O O . THR C 1 33 ? 56.928 39.598 56.799 1.00 52.12 ? 357 THR E O 1 ATOM 3486 C CB . THR C 1 33 ? 58.450 41.336 54.866 1.00 52.51 ? 357 THR E CB 1 ATOM 3487 O OG1 . THR C 1 33 ? 58.576 42.329 53.833 1.00 53.88 ? 357 THR E OG1 1 ATOM 3488 C CG2 . THR C 1 33 ? 59.729 40.525 54.939 1.00 52.50 ? 357 THR E CG2 1 ATOM 3489 N N . CYS C 1 34 ? 57.481 38.111 55.214 1.00 51.62 ? 358 CYS E N 1 ATOM 3490 C CA . CYS C 1 34 ? 57.680 36.996 56.115 1.00 51.73 ? 358 CYS E CA 1 ATOM 3491 C C . CYS C 1 34 ? 59.172 36.847 56.459 1.00 50.61 ? 358 CYS E C 1 ATOM 3492 O O . CYS C 1 34 ? 59.997 36.654 55.568 1.00 49.80 ? 358 CYS E O 1 ATOM 3493 C CB . CYS C 1 34 ? 57.172 35.727 55.433 1.00 53.74 ? 358 CYS E CB 1 ATOM 3494 S SG . CYS C 1 34 ? 56.819 34.303 56.522 1.00 55.55 ? 358 CYS E SG 1 ATOM 3495 N N . LEU C 1 35 ? 59.503 36.928 57.748 1.00 48.97 ? 359 LEU E N 1 ATOM 3496 C CA . LEU C 1 35 ? 60.880 36.833 58.208 1.00 49.23 ? 359 LEU E CA 1 ATOM 3497 C C . LEU C 1 35 ? 61.139 35.529 58.965 1.00 49.58 ? 359 LEU E C 1 ATOM 3498 O O . LEU C 1 35 ? 60.438 35.216 59.925 1.00 50.28 ? 359 LEU E O 1 ATOM 3499 C CB . LEU C 1 35 ? 61.227 38.032 59.101 1.00 48.79 ? 359 LEU E CB 1 ATOM 3500 C CG . LEU C 1 35 ? 62.571 37.965 59.835 1.00 49.18 ? 359 LEU E CG 1 ATOM 3501 C CD1 . LEU C 1 35 ? 63.737 37.721 58.853 1.00 48.63 ? 359 LEU E CD1 1 ATOM 3502 C CD2 . LEU C 1 35 ? 62.785 39.226 60.665 1.00 48.73 ? 359 LEU E CD2 1 ATOM 3503 N N . VAL C 1 36 ? 62.163 34.784 58.543 1.00 49.86 ? 360 VAL E N 1 ATOM 3504 C CA . VAL C 1 36 ? 62.549 33.533 59.198 1.00 50.15 ? 360 VAL E CA 1 ATOM 3505 C C . VAL C 1 36 ? 63.990 33.630 59.723 1.00 50.91 ? 360 VAL E C 1 ATOM 3506 O O . VAL C 1 36 ? 64.940 33.786 58.947 1.00 50.07 ? 360 VAL E O 1 ATOM 3507 C CB . VAL C 1 36 ? 62.401 32.323 58.239 1.00 50.17 ? 360 VAL E CB 1 ATOM 3508 C CG1 . VAL C 1 36 ? 63.075 31.079 58.822 1.00 50.16 ? 360 VAL E CG1 1 ATOM 3509 C CG2 . VAL C 1 36 ? 60.919 32.049 57.911 1.00 49.16 ? 360 VAL E CG2 1 ATOM 3510 N N . VAL C 1 37 ? 64.146 33.564 61.045 1.00 51.70 ? 361 VAL E N 1 ATOM 3511 C CA . VAL C 1 37 ? 65.470 33.648 61.678 1.00 52.34 ? 361 VAL E CA 1 ATOM 3512 C C . VAL C 1 37 ? 65.978 32.287 62.183 1.00 52.66 ? 361 VAL E C 1 ATOM 3513 O O . VAL C 1 37 ? 65.496 31.791 63.207 1.00 52.78 ? 361 VAL E O 1 ATOM 3514 C CB . VAL C 1 37 ? 65.455 34.629 62.867 1.00 52.44 ? 361 VAL E CB 1 ATOM 3515 C CG1 . VAL C 1 37 ? 66.853 34.709 63.513 1.00 51.99 ? 361 VAL E CG1 1 ATOM 3516 C CG2 . VAL C 1 37 ? 64.965 36.014 62.417 1.00 51.60 ? 361 VAL E CG2 1 ATOM 3517 N N . ASP C 1 38 ? 66.959 31.708 61.481 1.00 52.47 ? 362 ASP E N 1 ATOM 3518 C CA . ASP C 1 38 ? 67.506 30.375 61.800 1.00 52.43 ? 362 ASP E CA 1 ATOM 3519 C C . ASP C 1 38 ? 68.887 30.459 62.479 1.00 52.86 ? 362 ASP E C 1 ATOM 3520 O O . ASP C 1 38 ? 69.903 30.711 61.828 1.00 52.20 ? 362 ASP E O 1 ATOM 3521 C CB . ASP C 1 38 ? 67.598 29.538 60.515 1.00 51.93 ? 362 ASP E CB 1 ATOM 3522 C CG . ASP C 1 38 ? 67.912 28.066 60.771 1.00 51.63 ? 362 ASP E CG 1 ATOM 3523 O OD1 . ASP C 1 38 ? 67.788 27.592 61.920 1.00 51.79 ? 362 ASP E OD1 1 ATOM 3524 O OD2 . ASP C 1 38 ? 68.276 27.370 59.798 1.00 50.98 ? 362 ASP E OD2 1 ATOM 3525 N N . LEU C 1 39 ? 68.925 30.215 63.787 1.00 54.07 ? 363 LEU E N 1 ATOM 3526 C CA . LEU C 1 39 ? 70.154 30.393 64.578 1.00 54.69 ? 363 LEU E CA 1 ATOM 3527 C C . LEU C 1 39 ? 71.269 29.373 64.288 1.00 55.13 ? 363 LEU E C 1 ATOM 3528 O O . LEU C 1 39 ? 72.449 29.654 64.523 1.00 54.60 ? 363 LEU E O 1 ATOM 3529 C CB . LEU C 1 39 ? 69.833 30.384 66.079 1.00 54.75 ? 363 LEU E CB 1 ATOM 3530 C CG . LEU C 1 39 ? 68.871 31.449 66.619 1.00 54.81 ? 363 LEU E CG 1 ATOM 3531 C CD1 . LEU C 1 39 ? 68.981 31.541 68.142 1.00 54.88 ? 363 LEU E CD1 1 ATOM 3532 C CD2 . LEU C 1 39 ? 69.124 32.818 65.998 1.00 54.69 ? 363 LEU E CD2 1 ATOM 3533 N N . ALA C 1 40 ? 70.900 28.197 63.786 1.00 55.78 ? 364 ALA E N 1 ATOM 3534 C CA . ALA C 1 40 ? 71.874 27.145 63.495 1.00 56.23 ? 364 ALA E CA 1 ATOM 3535 C C . ALA C 1 40 ? 71.557 26.426 62.184 1.00 56.76 ? 364 ALA E C 1 ATOM 3536 O O . ALA C 1 40 ? 71.100 25.280 62.199 1.00 56.42 ? 364 ALA E O 1 ATOM 3537 C CB . ALA C 1 40 ? 71.923 26.152 64.638 1.00 55.98 ? 364 ALA E CB 1 ATOM 3538 N N . PRO C 1 41 ? 71.824 27.092 61.047 1.00 57.41 ? 365 PRO E N 1 ATOM 3539 C CA . PRO C 1 41 ? 71.474 26.613 59.702 1.00 58.35 ? 365 PRO E CA 1 ATOM 3540 C C . PRO C 1 41 ? 71.982 25.200 59.376 1.00 59.47 ? 365 PRO E C 1 ATOM 3541 O O . PRO C 1 41 ? 73.149 24.888 59.627 1.00 59.86 ? 365 PRO E O 1 ATOM 3542 C CB . PRO C 1 41 ? 72.140 27.638 58.778 1.00 58.06 ? 365 PRO E CB 1 ATOM 3543 C CG . PRO C 1 41 ? 72.367 28.849 59.622 1.00 57.63 ? 365 PRO E CG 1 ATOM 3544 C CD . PRO C 1 41 ? 72.562 28.367 61.014 1.00 57.43 ? 365 PRO E CD 1 ATOM 3545 N N . SER C 1 42 ? 71.115 24.361 58.811 1.00 60.49 ? 366 SER E N 1 ATOM 3546 C CA . SER C 1 42 ? 71.498 23.007 58.406 1.00 61.34 ? 366 SER E CA 1 ATOM 3547 C C . SER C 1 42 ? 71.239 22.800 56.918 1.00 62.19 ? 366 SER E C 1 ATOM 3548 O O . SER C 1 42 ? 70.469 23.543 56.308 1.00 62.39 ? 366 SER E O 1 ATOM 3549 C CB . SER C 1 42 ? 70.751 21.945 59.226 1.00 61.17 ? 366 SER E CB 1 ATOM 3550 O OG . SER C 1 42 ? 69.364 21.925 58.935 1.00 61.02 ? 366 SER E OG 1 ATOM 3551 N N . LYS C 1 43 ? 71.895 21.795 56.339 1.00 63.07 ? 367 LYS E N 1 ATOM 3552 C CA . LYS C 1 43 ? 71.726 21.476 54.920 1.00 63.76 ? 367 LYS E CA 1 ATOM 3553 C C . LYS C 1 43 ? 70.251 21.278 54.569 1.00 64.18 ? 367 LYS E C 1 ATOM 3554 O O . LYS C 1 43 ? 69.528 20.563 55.267 1.00 64.40 ? 367 LYS E O 1 ATOM 3555 C CB . LYS C 1 43 ? 72.529 20.228 54.539 1.00 64.02 ? 367 LYS E CB 1 ATOM 3556 C CG . LYS C 1 43 ? 72.182 18.960 55.313 1.00 64.04 ? 367 LYS E CG 1 ATOM 3557 C CD . LYS C 1 43 ? 73.089 17.817 54.893 1.00 64.11 ? 367 LYS E CD 1 ATOM 3558 C CE . LYS C 1 43 ? 72.875 16.574 55.741 1.00 64.11 ? 367 LYS E CE 1 ATOM 3559 N NZ . LYS C 1 43 ? 73.748 15.446 55.297 1.00 64.00 ? 367 LYS E NZ 1 ATOM 3560 N N . GLY C 1 44 ? 69.812 21.923 53.491 1.00 64.19 ? 368 GLY E N 1 ATOM 3561 C CA . GLY C 1 44 ? 68.407 21.903 53.104 1.00 64.25 ? 368 GLY E CA 1 ATOM 3562 C C . GLY C 1 44 ? 67.836 23.308 53.061 1.00 64.67 ? 368 GLY E C 1 ATOM 3563 O O . GLY C 1 44 ? 68.324 24.208 53.753 1.00 64.24 ? 368 GLY E O 1 ATOM 3564 N N . THR C 1 45 ? 66.785 23.480 52.258 1.00 64.85 ? 369 THR E N 1 ATOM 3565 C CA . THR C 1 45 ? 66.227 24.795 51.958 1.00 64.88 ? 369 THR E CA 1 ATOM 3566 C C . THR C 1 45 ? 64.963 25.083 52.759 1.00 64.81 ? 369 THR E C 1 ATOM 3567 O O . THR C 1 45 ? 64.096 24.223 52.909 1.00 64.54 ? 369 THR E O 1 ATOM 3568 C CB . THR C 1 45 ? 65.876 24.922 50.460 1.00 64.99 ? 369 THR E CB 1 ATOM 3569 O OG1 . THR C 1 45 ? 67.035 24.646 49.665 1.00 65.35 ? 369 THR E OG1 1 ATOM 3570 C CG2 . THR C 1 45 ? 65.361 26.317 50.142 1.00 65.27 ? 369 THR E CG2 1 ATOM 3571 N N . VAL C 1 46 ? 64.875 26.305 53.274 1.00 64.96 ? 370 VAL E N 1 ATOM 3572 C CA . VAL C 1 46 ? 63.654 26.809 53.894 1.00 64.90 ? 370 VAL E CA 1 ATOM 3573 C C . VAL C 1 46 ? 62.685 27.285 52.807 1.00 64.38 ? 370 VAL E C 1 ATOM 3574 O O . VAL C 1 46 ? 63.102 27.885 51.813 1.00 64.52 ? 370 VAL E O 1 ATOM 3575 C CB . VAL C 1 46 ? 63.944 27.992 54.838 1.00 65.02 ? 370 VAL E CB 1 ATOM 3576 C CG1 . VAL C 1 46 ? 62.676 28.402 55.573 1.00 65.04 ? 370 VAL E CG1 1 ATOM 3577 C CG2 . VAL C 1 46 ? 65.069 27.647 55.816 1.00 65.30 ? 370 VAL E CG2 1 ATOM 3578 N N . GLN C 1 47 ? 61.397 27.018 52.999 1.00 63.50 ? 371 GLN E N 1 ATOM 3579 C CA . GLN C 1 47 ? 60.390 27.342 51.995 1.00 62.78 ? 371 GLN E CA 1 ATOM 3580 C C . GLN C 1 47 ? 59.378 28.313 52.579 1.00 61.66 ? 371 GLN E C 1 ATOM 3581 O O . GLN C 1 47 ? 58.871 28.094 53.673 1.00 61.85 ? 371 GLN E O 1 ATOM 3582 C CB . GLN C 1 47 ? 59.682 26.074 51.509 1.00 63.31 ? 371 GLN E CB 1 ATOM 3583 C CG . GLN C 1 47 ? 60.630 25.001 50.956 1.00 63.67 ? 371 GLN E CG 1 ATOM 3584 C CD . GLN C 1 47 ? 61.326 25.420 49.668 1.00 63.79 ? 371 GLN E CD 1 ATOM 3585 O OE1 . GLN C 1 47 ? 60.935 26.394 49.022 1.00 63.35 ? 371 GLN E OE1 1 ATOM 3586 N NE2 . GLN C 1 47 ? 62.370 24.679 49.294 1.00 63.95 ? 371 GLN E NE2 1 ATOM 3587 N N . LEU C 1 48 ? 59.117 29.398 51.856 1.00 60.44 ? 372 LEU E N 1 ATOM 3588 C CA . LEU C 1 48 ? 58.115 30.383 52.250 1.00 59.14 ? 372 LEU E CA 1 ATOM 3589 C C . LEU C 1 48 ? 57.020 30.425 51.182 1.00 58.02 ? 372 LEU E C 1 ATOM 3590 O O . LEU C 1 48 ? 57.277 30.804 50.041 1.00 58.00 ? 372 LEU E O 1 ATOM 3591 C CB . LEU C 1 48 ? 58.753 31.763 52.466 1.00 59.09 ? 372 LEU E CB 1 ATOM 3592 C CG . LEU C 1 48 ? 59.705 31.895 53.667 1.00 59.39 ? 372 LEU E CG 1 ATOM 3593 C CD1 . LEU C 1 48 ? 60.561 33.144 53.601 1.00 59.21 ? 372 LEU E CD1 1 ATOM 3594 C CD2 . LEU C 1 48 ? 58.949 31.876 54.980 1.00 59.27 ? 372 LEU E CD2 1 ATOM 3595 N N . THR C 1 49 ? 55.810 30.012 51.559 1.00 56.71 ? 373 THR E N 1 ATOM 3596 C CA . THR C 1 49 ? 54.680 29.909 50.625 1.00 56.08 ? 373 THR E CA 1 ATOM 3597 C C . THR C 1 49 ? 53.553 30.863 51.010 1.00 54.85 ? 373 THR E C 1 ATOM 3598 O O . THR C 1 49 ? 53.090 30.866 52.148 1.00 54.25 ? 373 THR E O 1 ATOM 3599 C CB . THR C 1 49 ? 54.056 28.477 50.575 1.00 56.18 ? 373 THR E CB 1 ATOM 3600 O OG1 . THR C 1 49 ? 55.082 27.472 50.584 1.00 55.73 ? 373 THR E OG1 1 ATOM 3601 C CG2 . THR C 1 49 ? 53.182 28.321 49.320 1.00 56.09 ? 373 THR E CG2 1 ATOM 3602 N N . TRP C 1 50 ? 53.091 31.640 50.037 1.00 53.92 ? 374 TRP E N 1 ATOM 3603 C CA . TRP C 1 50 ? 52.098 32.675 50.281 1.00 52.84 ? 374 TRP E CA 1 ATOM 3604 C C . TRP C 1 50 ? 50.717 32.286 49.795 1.00 52.81 ? 374 TRP E C 1 ATOM 3605 O O . TRP C 1 50 ? 50.559 31.682 48.738 1.00 52.35 ? 374 TRP E O 1 ATOM 3606 C CB . TRP C 1 50 ? 52.487 33.966 49.566 1.00 52.48 ? 374 TRP E CB 1 ATOM 3607 C CG . TRP C 1 50 ? 53.638 34.694 50.160 1.00 51.62 ? 374 TRP E CG 1 ATOM 3608 C CD1 . TRP C 1 50 ? 54.922 34.707 49.707 1.00 51.30 ? 374 TRP E CD1 1 ATOM 3609 C CD2 . TRP C 1 50 ? 53.606 35.541 51.308 1.00 51.52 ? 374 TRP E CD2 1 ATOM 3610 N NE1 . TRP C 1 50 ? 55.695 35.509 50.501 1.00 51.22 ? 374 TRP E NE1 1 ATOM 3611 C CE2 . TRP C 1 50 ? 54.910 36.039 51.492 1.00 51.71 ? 374 TRP E CE2 1 ATOM 3612 C CE3 . TRP C 1 50 ? 52.599 35.927 52.203 1.00 51.26 ? 374 TRP E CE3 1 ATOM 3613 C CZ2 . TRP C 1 50 ? 55.234 36.917 52.531 1.00 51.67 ? 374 TRP E CZ2 1 ATOM 3614 C CZ3 . TRP C 1 50 ? 52.924 36.784 53.238 1.00 51.51 ? 374 TRP E CZ3 1 ATOM 3615 C CH2 . TRP C 1 50 ? 54.229 37.275 53.390 1.00 51.22 ? 374 TRP E CH2 1 ATOM 3616 N N . SER C 1 51 ? 49.707 32.700 50.553 1.00 52.51 ? 375 SER E N 1 ATOM 3617 C CA . SER C 1 51 ? 48.320 32.440 50.189 1.00 51.15 ? 375 SER E CA 1 ATOM 3618 C C . SER C 1 51 ? 47.429 33.481 50.859 1.00 50.15 ? 375 SER E C 1 ATOM 3619 O O . SER C 1 51 ? 47.812 34.125 51.843 1.00 49.38 ? 375 SER E O 1 ATOM 3620 C CB . SER C 1 51 ? 47.879 31.009 50.570 1.00 51.19 ? 375 SER E CB 1 ATOM 3621 O OG . SER C 1 51 ? 47.590 30.851 51.959 1.00 50.44 ? 375 SER E OG 1 ATOM 3622 N N . ARG C 1 52 ? 46.253 33.662 50.273 1.00 49.01 ? 376 ARG E N 1 ATOM 3623 C CA . ARG C 1 52 ? 45.205 34.484 50.850 1.00 48.17 ? 376 ARG E CA 1 ATOM 3624 C C . ARG C 1 52 ? 44.169 33.599 51.565 1.00 47.72 ? 376 ARG E C 1 ATOM 3625 O O . ARG C 1 52 ? 44.084 32.392 51.305 1.00 46.36 ? 376 ARG E O 1 ATOM 3626 C CB . ARG C 1 52 ? 44.501 35.245 49.744 1.00 47.51 ? 376 ARG E CB 1 ATOM 3627 C CG . ARG C 1 52 ? 45.347 36.245 49.009 1.00 47.34 ? 376 ARG E CG 1 ATOM 3628 C CD . ARG C 1 52 ? 44.417 37.299 48.471 1.00 46.99 ? 376 ARG E CD 1 ATOM 3629 N NE . ARG C 1 52 ? 44.766 37.769 47.151 1.00 46.48 ? 376 ARG E NE 1 ATOM 3630 C CZ . ARG C 1 52 ? 43.963 38.498 46.391 1.00 46.19 ? 376 ARG E CZ 1 ATOM 3631 N NH1 . ARG C 1 52 ? 42.755 38.847 46.824 1.00 45.92 ? 376 ARG E NH1 1 ATOM 3632 N NH2 . ARG C 1 52 ? 44.382 38.880 45.192 1.00 46.84 ? 376 ARG E NH2 1 ATOM 3633 N N . ALA C 1 53 ? 43.393 34.209 52.461 1.00 47.60 ? 377 ALA E N 1 ATOM 3634 C CA . ALA C 1 53 ? 42.276 33.520 53.129 1.00 47.74 ? 377 ALA E CA 1 ATOM 3635 C C . ALA C 1 53 ? 41.082 33.377 52.180 1.00 47.94 ? 377 ALA E C 1 ATOM 3636 O O . ALA C 1 53 ? 40.326 32.412 52.264 1.00 49.68 ? 377 ALA E O 1 ATOM 3637 C CB . ALA C 1 53 ? 41.867 34.256 54.400 1.00 46.93 ? 377 ALA E CB 1 ATOM 3638 N N . SER C 1 54 ? 40.933 34.329 51.261 1.00 48.21 ? 378 SER E N 1 ATOM 3639 C CA . SER C 1 54 ? 39.916 34.282 50.211 1.00 47.70 ? 378 SER E CA 1 ATOM 3640 C C . SER C 1 54 ? 40.166 33.207 49.158 1.00 48.14 ? 378 SER E C 1 ATOM 3641 O O . SER C 1 54 ? 39.272 32.913 48.369 1.00 49.16 ? 378 SER E O 1 ATOM 3642 C CB . SER C 1 54 ? 39.911 35.603 49.455 1.00 47.50 ? 378 SER E CB 1 ATOM 3643 O OG . SER C 1 54 ? 41.165 35.797 48.789 1.00 46.32 ? 378 SER E OG 1 ATOM 3644 N N . GLY C 1 55 ? 41.392 32.688 49.086 1.00 48.29 ? 379 GLY E N 1 ATOM 3645 C CA . GLY C 1 55 ? 41.744 31.676 48.092 1.00 48.60 ? 379 GLY E CA 1 ATOM 3646 C C . GLY C 1 55 ? 42.091 32.260 46.730 1.00 48.62 ? 379 GLY E C 1 ATOM 3647 O O . GLY C 1 55 ? 42.256 31.522 45.755 1.00 47.77 ? 379 GLY E O 1 ATOM 3648 N N . LYS C 1 56 ? 42.214 33.584 46.663 1.00 48.36 ? 380 LYS E N 1 ATOM 3649 C CA . LYS C 1 56 ? 42.513 34.259 45.408 1.00 48.96 ? 380 LYS E CA 1 ATOM 3650 C C . LYS C 1 56 ? 44.029 34.275 45.144 1.00 49.26 ? 380 LYS E C 1 ATOM 3651 O O . LYS C 1 56 ? 44.828 33.957 46.039 1.00 47.91 ? 380 LYS E O 1 ATOM 3652 C CB . LYS C 1 56 ? 41.916 35.672 45.402 1.00 49.70 ? 380 LYS E CB 1 ATOM 3653 C CG . LYS C 1 56 ? 40.393 35.712 45.470 1.00 50.21 ? 380 LYS E CG 1 ATOM 3654 C CD . LYS C 1 56 ? 39.868 37.144 45.362 1.00 50.54 ? 380 LYS E CD 1 ATOM 3655 C CE . LYS C 1 56 ? 38.344 37.197 45.504 1.00 51.11 ? 380 LYS E CE 1 ATOM 3656 N NZ . LYS C 1 56 ? 37.783 38.581 45.533 1.00 50.32 ? 380 LYS E NZ 1 ATOM 3657 N N . PRO C 1 57 ? 44.425 34.614 43.900 1.00 50.09 ? 381 PRO E N 1 ATOM 3658 C CA . PRO C 1 57 ? 45.833 34.493 43.546 1.00 50.24 ? 381 PRO E CA 1 ATOM 3659 C C . PRO C 1 57 ? 46.701 35.528 44.251 1.00 51.10 ? 381 PRO E C 1 ATOM 3660 O O . PRO C 1 57 ? 46.316 36.694 44.387 1.00 51.51 ? 381 PRO E O 1 ATOM 3661 C CB . PRO C 1 57 ? 45.853 34.704 42.023 1.00 50.25 ? 381 PRO E CB 1 ATOM 3662 C CG . PRO C 1 57 ? 44.421 34.619 41.567 1.00 50.40 ? 381 PRO E CG 1 ATOM 3663 C CD . PRO C 1 57 ? 43.605 35.046 42.751 1.00 50.31 ? 381 PRO E CD 1 ATOM 3664 N N . VAL C 1 58 ? 47.869 35.090 44.712 1.00 51.31 ? 382 VAL E N 1 ATOM 3665 C CA . VAL C 1 58 ? 48.861 36.000 45.238 1.00 50.94 ? 382 VAL E CA 1 ATOM 3666 C C . VAL C 1 58 ? 49.850 36.322 44.126 1.00 51.59 ? 382 VAL E C 1 ATOM 3667 O O . VAL C 1 58 ? 50.047 35.519 43.223 1.00 50.10 ? 382 VAL E O 1 ATOM 3668 C CB . VAL C 1 58 ? 49.610 35.383 46.427 1.00 51.00 ? 382 VAL E CB 1 ATOM 3669 C CG1 . VAL C 1 58 ? 48.646 35.089 47.567 1.00 50.07 ? 382 VAL E CG1 1 ATOM 3670 C CG2 . VAL C 1 58 ? 50.377 34.128 45.987 1.00 50.47 ? 382 VAL E CG2 1 ATOM 3671 N N . GLN C 1 59 ? 50.471 37.497 44.203 1.00 52.09 ? 383 GLN E N 1 ATOM 3672 C CA . GLN C 1 59 ? 51.455 37.931 43.215 1.00 53.08 ? 383 GLN E CA 1 ATOM 3673 C C . GLN C 1 59 ? 52.791 37.209 43.428 1.00 52.88 ? 383 GLN E C 1 ATOM 3674 O O . GLN C 1 59 ? 52.942 36.409 44.347 1.00 52.43 ? 383 GLN E O 1 ATOM 3675 C CB . GLN C 1 59 ? 51.646 39.459 43.266 1.00 53.68 ? 383 GLN E CB 1 ATOM 3676 C CG . GLN C 1 59 ? 50.407 40.248 42.878 1.00 55.35 ? 383 GLN E CG 1 ATOM 3677 C CD . GLN C 1 59 ? 50.546 41.740 43.132 1.00 56.47 ? 383 GLN E CD 1 ATOM 3678 O OE1 . GLN C 1 59 ? 51.591 42.338 42.842 1.00 58.04 ? 383 GLN E OE1 1 ATOM 3679 N NE2 . GLN C 1 59 ? 49.491 42.353 43.678 1.00 56.17 ? 383 GLN E NE2 1 ATOM 3680 N N . HIS C 1 60 ? 53.752 37.483 42.554 1.00 52.45 ? 384 HIS E N 1 ATOM 3681 C CA . HIS C 1 60 ? 55.102 36.950 42.702 1.00 52.56 ? 384 HIS E CA 1 ATOM 3682 C C . HIS C 1 60 ? 55.895 37.667 43.792 1.00 51.27 ? 384 HIS E C 1 ATOM 3683 O O . HIS C 1 60 ? 56.121 38.875 43.738 1.00 51.06 ? 384 HIS E O 1 ATOM 3684 C CB . HIS C 1 60 ? 55.842 37.048 41.372 1.00 53.90 ? 384 HIS E CB 1 ATOM 3685 C CG . HIS C 1 60 ? 55.277 36.158 40.308 1.00 55.87 ? 384 HIS E CG 1 ATOM 3686 N ND1 . HIS C 1 60 ? 55.160 34.793 40.464 1.00 56.30 ? 384 HIS E ND1 1 ATOM 3687 C CD2 . HIS C 1 60 ? 54.815 36.436 39.067 1.00 57.03 ? 384 HIS E CD2 1 ATOM 3688 C CE1 . HIS C 1 60 ? 54.651 34.265 39.366 1.00 56.72 ? 384 HIS E CE1 1 ATOM 3689 N NE2 . HIS C 1 60 ? 54.429 35.242 38.503 1.00 57.66 ? 384 HIS E NE2 1 ATOM 3690 N N . SER C 1 61 ? 56.306 36.910 44.797 1.00 50.91 ? 385 SER E N 1 ATOM 3691 C CA . SER C 1 61 ? 57.067 37.461 45.904 1.00 51.21 ? 385 SER E CA 1 ATOM 3692 C C . SER C 1 61 ? 58.575 37.471 45.615 1.00 51.29 ? 385 SER E C 1 ATOM 3693 O O . SER C 1 61 ? 59.040 36.929 44.618 1.00 50.55 ? 385 SER E O 1 ATOM 3694 C CB . SER C 1 61 ? 56.768 36.685 47.189 1.00 51.15 ? 385 SER E CB 1 ATOM 3695 O OG . SER C 1 61 ? 57.178 35.339 47.083 1.00 50.87 ? 385 SER E OG 1 ATOM 3696 N N . THR C 1 62 ? 59.317 38.146 46.485 1.00 52.48 ? 386 THR E N 1 ATOM 3697 C CA . THR C 1 62 ? 60.759 38.279 46.359 1.00 53.24 ? 386 THR E CA 1 ATOM 3698 C C . THR C 1 62 ? 61.405 37.700 47.608 1.00 54.00 ? 386 THR E C 1 ATOM 3699 O O . THR C 1 62 ? 61.091 38.107 48.730 1.00 53.78 ? 386 THR E O 1 ATOM 3700 C CB . THR C 1 62 ? 61.190 39.750 46.202 1.00 53.59 ? 386 THR E CB 1 ATOM 3701 O OG1 . THR C 1 62 ? 60.633 40.298 44.999 1.00 52.99 ? 386 THR E OG1 1 ATOM 3702 C CG2 . THR C 1 62 ? 62.714 39.850 46.144 1.00 53.70 ? 386 THR E CG2 1 ATOM 3703 N N . ARG C 1 63 ? 62.300 36.739 47.396 1.00 55.21 ? 387 ARG E N 1 ATOM 3704 C CA . ARG C 1 63 ? 62.962 36.035 48.476 1.00 56.13 ? 387 ARG E CA 1 ATOM 3705 C C . ARG C 1 63 ? 64.349 36.605 48.675 1.00 56.75 ? 387 ARG E C 1 ATOM 3706 O O . ARG C 1 63 ? 65.021 36.970 47.721 1.00 56.74 ? 387 ARG E O 1 ATOM 3707 C CB . ARG C 1 63 ? 63.084 34.542 48.161 1.00 57.21 ? 387 ARG E CB 1 ATOM 3708 C CG . ARG C 1 63 ? 63.659 33.712 49.308 1.00 57.98 ? 387 ARG E CG 1 ATOM 3709 C CD . ARG C 1 63 ? 64.182 32.370 48.825 1.00 59.32 ? 387 ARG E CD 1 ATOM 3710 N NE . ARG C 1 63 ? 64.787 31.598 49.908 1.00 60.25 ? 387 ARG E NE 1 ATOM 3711 C CZ . ARG C 1 63 ? 64.156 30.673 50.631 1.00 61.22 ? 387 ARG E CZ 1 ATOM 3712 N NH1 . ARG C 1 63 ? 62.883 30.368 50.395 1.00 60.88 ? 387 ARG E NH1 1 ATOM 3713 N NH2 . ARG C 1 63 ? 64.812 30.041 51.599 1.00 61.85 ? 387 ARG E NH2 1 ATOM 3714 N N . LYS C 1 64 ? 64.781 36.647 49.928 1.00 57.82 ? 388 LYS E N 1 ATOM 3715 C CA . LYS C 1 64 ? 66.098 37.150 50.269 1.00 58.54 ? 388 LYS E CA 1 ATOM 3716 C C . LYS C 1 64 ? 66.688 36.362 51.445 1.00 58.29 ? 388 LYS E C 1 ATOM 3717 O O . LYS C 1 64 ? 66.019 36.159 52.457 1.00 57.21 ? 388 LYS E O 1 ATOM 3718 C CB . LYS C 1 64 ? 66.010 38.634 50.601 1.00 59.54 ? 388 LYS E CB 1 ATOM 3719 C CG . LYS C 1 64 ? 67.184 39.158 51.397 1.00 61.12 ? 388 LYS E CG 1 ATOM 3720 C CD . LYS C 1 64 ? 66.910 40.555 51.929 1.00 62.54 ? 388 LYS E CD 1 ATOM 3721 C CE . LYS C 1 64 ? 67.872 40.920 53.061 1.00 63.37 ? 388 LYS E CE 1 ATOM 3722 N NZ . LYS C 1 64 ? 67.426 42.139 53.822 1.00 64.11 ? 388 LYS E NZ 1 ATOM 3723 N N . GLU C 1 65 ? 67.936 35.918 51.283 1.00 58.03 ? 389 GLU E N 1 ATOM 3724 C CA . GLU C 1 65 ? 68.676 35.167 52.305 1.00 57.89 ? 389 GLU E CA 1 ATOM 3725 C C . GLU C 1 65 ? 69.984 35.858 52.643 1.00 57.37 ? 389 GLU E C 1 ATOM 3726 O O . GLU C 1 65 ? 70.738 36.244 51.750 1.00 55.06 ? 389 GLU E O 1 ATOM 3727 C CB . GLU C 1 65 ? 69.068 33.776 51.808 1.00 58.35 ? 389 GLU E CB 1 ATOM 3728 C CG . GLU C 1 65 ? 67.939 32.831 51.471 1.00 59.08 ? 389 GLU E CG 1 ATOM 3729 C CD . GLU C 1 65 ? 68.464 31.447 51.137 1.00 59.72 ? 389 GLU E CD 1 ATOM 3730 O OE1 . GLU C 1 65 ? 69.515 31.054 51.690 1.00 60.48 ? 389 GLU E OE1 1 ATOM 3731 O OE2 . GLU C 1 65 ? 67.843 30.751 50.309 1.00 60.75 ? 389 GLU E OE2 1 ATOM 3732 N N . GLU C 1 66 ? 70.282 35.946 53.933 1.00 58.38 ? 390 GLU E N 1 ATOM 3733 C CA . GLU C 1 66 ? 71.529 36.560 54.373 1.00 59.70 ? 390 GLU E CA 1 ATOM 3734 C C . GLU C 1 66 ? 72.076 35.882 55.624 1.00 60.19 ? 390 GLU E C 1 ATOM 3735 O O . GLU C 1 66 ? 71.458 35.940 56.690 1.00 60.12 ? 390 GLU E O 1 ATOM 3736 C CB . GLU C 1 66 ? 71.311 38.044 54.641 1.00 60.11 ? 390 GLU E CB 1 ATOM 3737 C CG . GLU C 1 66 ? 72.591 38.821 54.810 1.00 60.96 ? 390 GLU E CG 1 ATOM 3738 C CD . GLU C 1 66 ? 72.356 40.301 55.045 1.00 61.78 ? 390 GLU E CD 1 ATOM 3739 O OE1 . GLU C 1 66 ? 71.182 40.746 55.002 1.00 62.33 ? 390 GLU E OE1 1 ATOM 3740 O OE2 . GLU C 1 66 ? 73.363 41.010 55.268 1.00 61.99 ? 390 GLU E OE2 1 ATOM 3741 N N . LYS C 1 67 ? 73.230 35.234 55.487 1.00 60.57 ? 391 LYS E N 1 ATOM 3742 C CA . LYS C 1 67 ? 73.910 34.654 56.642 1.00 61.07 ? 391 LYS E CA 1 ATOM 3743 C C . LYS C 1 67 ? 74.534 35.777 57.463 1.00 60.91 ? 391 LYS E C 1 ATOM 3744 O O . LYS C 1 67 ? 75.281 36.602 56.939 1.00 61.47 ? 391 LYS E O 1 ATOM 3745 C CB . LYS C 1 67 ? 74.958 33.613 56.223 1.00 61.65 ? 391 LYS E CB 1 ATOM 3746 C CG . LYS C 1 67 ? 75.806 34.003 55.009 1.00 62.40 ? 391 LYS E CG 1 ATOM 3747 C CD . LYS C 1 67 ? 76.774 32.897 54.600 1.00 62.62 ? 391 LYS E CD 1 ATOM 3748 C CE . LYS C 1 67 ? 77.538 33.282 53.345 1.00 62.57 ? 391 LYS E CE 1 ATOM 3749 N NZ . LYS C 1 67 ? 78.662 32.354 53.081 1.00 62.65 ? 391 LYS E NZ 1 ATOM 3750 N N . GLN C 1 68 ? 74.211 35.813 58.751 1.00 61.02 ? 392 GLN E N 1 ATOM 3751 C CA . GLN C 1 68 ? 74.652 36.896 59.631 1.00 61.36 ? 392 GLN E CA 1 ATOM 3752 C C . GLN C 1 68 ? 76.043 36.661 60.234 1.00 62.10 ? 392 GLN E C 1 ATOM 3753 O O . GLN C 1 68 ? 76.637 35.596 60.073 1.00 62.19 ? 392 GLN E O 1 ATOM 3754 C CB . GLN C 1 68 ? 73.629 37.093 60.757 1.00 61.08 ? 392 GLN E CB 1 ATOM 3755 C CG . GLN C 1 68 ? 72.235 37.459 60.273 1.00 60.92 ? 392 GLN E CG 1 ATOM 3756 C CD . GLN C 1 68 ? 72.227 38.774 59.528 1.00 60.83 ? 392 GLN E CD 1 ATOM 3757 O OE1 . GLN C 1 68 ? 73.112 39.603 59.736 1.00 61.14 ? 392 GLN E OE1 1 ATOM 3758 N NE2 . GLN C 1 68 ? 71.244 38.970 58.651 1.00 60.16 ? 392 GLN E NE2 1 ATOM 3759 N N . ARG C 1 69 ? 76.551 37.668 60.940 1.00 63.06 ? 393 ARG E N 1 ATOM 3760 C CA . ARG C 1 69 ? 77.883 37.613 61.536 1.00 64.08 ? 393 ARG E CA 1 ATOM 3761 C C . ARG C 1 69 ? 77.978 36.563 62.643 1.00 64.19 ? 393 ARG E C 1 ATOM 3762 O O . ARG C 1 69 ? 79.036 35.956 62.846 1.00 63.67 ? 393 ARG E O 1 ATOM 3763 C CB . ARG C 1 69 ? 78.249 38.986 62.099 1.00 65.05 ? 393 ARG E CB 1 ATOM 3764 C CG . ARG C 1 69 ? 79.721 39.169 62.406 1.00 65.93 ? 393 ARG E CG 1 ATOM 3765 C CD . ARG C 1 69 ? 79.997 40.589 62.854 1.00 66.79 ? 393 ARG E CD 1 ATOM 3766 N NE . ARG C 1 69 ? 79.666 41.555 61.809 1.00 67.62 ? 393 ARG E NE 1 ATOM 3767 C CZ . ARG C 1 69 ? 79.572 42.869 62.003 1.00 68.42 ? 393 ARG E CZ 1 ATOM 3768 N NH1 . ARG C 1 69 ? 79.787 43.388 63.209 1.00 68.95 ? 393 ARG E NH1 1 ATOM 3769 N NH2 . ARG C 1 69 ? 79.266 43.667 60.988 1.00 68.34 ? 393 ARG E NH2 1 ATOM 3770 N N . ASN C 1 70 ? 76.867 36.349 63.347 1.00 64.39 ? 394 ASN E N 1 ATOM 3771 C CA . ASN C 1 70 ? 76.804 35.340 64.405 1.00 64.54 ? 394 ASN E CA 1 ATOM 3772 C C . ASN C 1 70 ? 76.513 33.923 63.897 1.00 63.76 ? 394 ASN E C 1 ATOM 3773 O O . ASN C 1 70 ? 76.431 32.991 64.692 1.00 64.25 ? 394 ASN E O 1 ATOM 3774 C CB . ASN C 1 70 ? 75.794 35.742 65.495 1.00 65.49 ? 394 ASN E CB 1 ATOM 3775 C CG . ASN C 1 70 ? 74.397 36.014 64.947 1.00 66.25 ? 394 ASN E CG 1 ATOM 3776 O OD1 . ASN C 1 70 ? 74.048 35.564 63.855 1.00 66.35 ? 394 ASN E OD1 1 ATOM 3777 N ND2 . ASN C 1 70 ? 73.595 36.761 65.717 1.00 67.27 ? 394 ASN E ND2 1 ATOM 3778 N N . GLY C 1 71 ? 76.372 33.757 62.583 1.00 62.78 ? 395 GLY E N 1 ATOM 3779 C CA . GLY C 1 71 ? 76.124 32.445 61.992 1.00 62.07 ? 395 GLY E CA 1 ATOM 3780 C C . GLY C 1 71 ? 74.651 32.158 61.743 1.00 61.48 ? 395 GLY E C 1 ATOM 3781 O O . GLY C 1 71 ? 74.300 31.110 61.199 1.00 61.45 ? 395 GLY E O 1 ATOM 3782 N N . THR C 1 72 ? 73.786 33.090 62.135 1.00 60.72 ? 396 THR E N 1 ATOM 3783 C CA . THR C 1 72 ? 72.345 32.962 61.896 1.00 60.10 ? 396 THR E CA 1 ATOM 3784 C C . THR C 1 72 ? 72.011 33.203 60.422 1.00 59.38 ? 396 THR E C 1 ATOM 3785 O O . THR C 1 72 ? 72.500 34.159 59.826 1.00 59.18 ? 396 THR E O 1 ATOM 3786 C CB . THR C 1 72 ? 71.539 33.968 62.758 1.00 59.85 ? 396 THR E CB 1 ATOM 3787 O OG1 . THR C 1 72 ? 71.654 33.620 64.143 1.00 59.66 ? 396 THR E OG1 1 ATOM 3788 C CG2 . THR C 1 72 ? 70.066 33.988 62.366 1.00 59.50 ? 396 THR E CG2 1 ATOM 3789 N N . LEU C 1 73 ? 71.194 32.327 59.841 1.00 58.81 ? 397 LEU E N 1 ATOM 3790 C CA . LEU C 1 73 ? 70.657 32.543 58.499 1.00 58.45 ? 397 LEU E CA 1 ATOM 3791 C C . LEU C 1 73 ? 69.289 33.214 58.583 1.00 58.15 ? 397 LEU E C 1 ATOM 3792 O O . LEU C 1 73 ? 68.345 32.643 59.124 1.00 57.98 ? 397 LEU E O 1 ATOM 3793 C CB . LEU C 1 73 ? 70.520 31.225 57.723 1.00 58.55 ? 397 LEU E CB 1 ATOM 3794 C CG . LEU C 1 73 ? 69.840 31.372 56.349 1.00 58.49 ? 397 LEU E CG 1 ATOM 3795 C CD1 . LEU C 1 73 ? 70.720 32.207 55.413 1.00 58.40 ? 397 LEU E CD1 1 ATOM 3796 C CD2 . LEU C 1 73 ? 69.487 30.030 55.700 1.00 58.11 ? 397 LEU E CD2 1 ATOM 3797 N N . THR C 1 74 ? 69.187 34.420 58.033 1.00 57.99 ? 398 THR E N 1 ATOM 3798 C CA . THR C 1 74 ? 67.915 35.128 57.944 1.00 57.57 ? 398 THR E CA 1 ATOM 3799 C C . THR C 1 74 ? 67.290 34.959 56.555 1.00 56.68 ? 398 THR E C 1 ATOM 3800 O O . THR C 1 74 ? 67.923 35.270 55.551 1.00 57.39 ? 398 THR E O 1 ATOM 3801 C CB . THR C 1 74 ? 68.123 36.623 58.238 1.00 58.22 ? 398 THR E CB 1 ATOM 3802 O OG1 . THR C 1 74 ? 68.801 36.766 59.492 1.00 58.57 ? 398 THR E OG1 1 ATOM 3803 C CG2 . THR C 1 74 ? 66.785 37.371 58.281 1.00 58.23 ? 398 THR E CG2 1 ATOM 3804 N N . VAL C 1 75 ? 66.054 34.469 56.500 1.00 55.62 ? 399 VAL E N 1 ATOM 3805 C CA . VAL C 1 75 ? 65.339 34.304 55.233 1.00 54.98 ? 399 VAL E CA 1 ATOM 3806 C C . VAL C 1 75 ? 64.037 35.114 55.208 1.00 54.62 ? 399 VAL E C 1 ATOM 3807 O O . VAL C 1 75 ? 63.145 34.912 56.027 1.00 55.83 ? 399 VAL E O 1 ATOM 3808 C CB . VAL C 1 75 ? 65.033 32.811 54.925 1.00 54.62 ? 399 VAL E CB 1 ATOM 3809 C CG1 . VAL C 1 75 ? 64.316 32.677 53.585 1.00 54.18 ? 399 VAL E CG1 1 ATOM 3810 C CG2 . VAL C 1 75 ? 66.325 31.985 54.929 1.00 54.09 ? 399 VAL E CG2 1 ATOM 3811 N N . THR C 1 76 ? 63.926 36.036 54.257 1.00 53.99 ? 400 THR E N 1 ATOM 3812 C CA . THR C 1 76 ? 62.731 36.860 54.128 1.00 52.53 ? 400 THR E CA 1 ATOM 3813 C C . THR C 1 76 ? 62.116 36.663 52.748 1.00 52.08 ? 400 THR E C 1 ATOM 3814 O O . THR C 1 76 ? 62.824 36.414 51.769 1.00 52.52 ? 400 THR E O 1 ATOM 3815 C CB . THR C 1 76 ? 63.014 38.371 54.326 1.00 52.01 ? 400 THR E CB 1 ATOM 3816 O OG1 . THR C 1 76 ? 63.954 38.814 53.344 1.00 52.84 ? 400 THR E OG1 1 ATOM 3817 C CG2 . THR C 1 76 ? 63.571 38.663 55.695 1.00 51.45 ? 400 THR E CG2 1 ATOM 3818 N N . SER C 1 77 ? 60.789 36.760 52.694 1.00 50.50 ? 401 SER E N 1 ATOM 3819 C CA . SER C 1 77 ? 60.046 36.808 51.447 1.00 48.76 ? 401 SER E CA 1 ATOM 3820 C C . SER C 1 77 ? 59.117 38.016 51.469 1.00 47.69 ? 401 SER E C 1 ATOM 3821 O O . SER C 1 77 ? 58.336 38.159 52.412 1.00 46.51 ? 401 SER E O 1 ATOM 3822 C CB . SER C 1 77 ? 59.228 35.531 51.273 1.00 49.06 ? 401 SER E CB 1 ATOM 3823 O OG . SER C 1 77 ? 58.573 35.500 50.016 1.00 48.98 ? 401 SER E OG 1 ATOM 3824 N N . THR C 1 78 ? 59.213 38.877 50.450 1.00 47.48 ? 402 THR E N 1 ATOM 3825 C CA . THR C 1 78 ? 58.366 40.088 50.335 1.00 47.79 ? 402 THR E CA 1 ATOM 3826 C C . THR C 1 78 ? 57.288 39.954 49.255 1.00 46.50 ? 402 THR E C 1 ATOM 3827 O O . THR C 1 78 ? 57.574 39.781 48.082 1.00 45.11 ? 402 THR E O 1 ATOM 3828 C CB . THR C 1 78 ? 59.207 41.345 50.054 1.00 48.28 ? 402 THR E CB 1 ATOM 3829 O OG1 . THR C 1 78 ? 60.151 41.517 51.116 1.00 50.61 ? 402 THR E OG1 1 ATOM 3830 C CG2 . THR C 1 78 ? 58.342 42.592 49.971 1.00 48.32 ? 402 THR E CG2 1 ATOM 3831 N N . LEU C 1 79 ? 56.032 40.008 49.669 1.00 47.68 ? 403 LEU E N 1 ATOM 3832 C CA . LEU C 1 79 ? 54.909 39.833 48.740 1.00 47.63 ? 403 LEU E CA 1 ATOM 3833 C C . LEU C 1 79 ? 54.199 41.166 48.505 1.00 47.23 ? 403 LEU E C 1 ATOM 3834 O O . LEU C 1 79 ? 53.724 41.785 49.450 1.00 45.90 ? 403 LEU E O 1 ATOM 3835 C CB . LEU C 1 79 ? 53.920 38.793 49.273 1.00 47.65 ? 403 LEU E CB 1 ATOM 3836 C CG . LEU C 1 79 ? 52.638 38.573 48.464 1.00 48.07 ? 403 LEU E CG 1 ATOM 3837 C CD1 . LEU C 1 79 ? 52.927 37.920 47.110 1.00 48.89 ? 403 LEU E CD1 1 ATOM 3838 C CD2 . LEU C 1 79 ? 51.645 37.740 49.244 1.00 48.21 ? 403 LEU E CD2 1 ATOM 3839 N N . PRO C 1 80 ? 54.133 41.616 47.238 1.00 47.25 ? 404 PRO E N 1 ATOM 3840 C CA . PRO C 1 80 ? 53.338 42.804 46.965 1.00 46.96 ? 404 PRO E CA 1 ATOM 3841 C C . PRO C 1 80 ? 51.849 42.475 47.067 1.00 46.26 ? 404 PRO E C 1 ATOM 3842 O O . PRO C 1 80 ? 51.423 41.443 46.590 1.00 45.93 ? 404 PRO E O 1 ATOM 3843 C CB . PRO C 1 80 ? 53.748 43.190 45.531 1.00 47.07 ? 404 PRO E CB 1 ATOM 3844 C CG . PRO C 1 80 ? 55.015 42.469 45.253 1.00 46.96 ? 404 PRO E CG 1 ATOM 3845 C CD . PRO C 1 80 ? 54.914 41.203 46.057 1.00 47.43 ? 404 PRO E CD 1 ATOM 3846 N N . VAL C 1 81 ? 51.083 43.321 47.741 1.00 46.49 ? 405 VAL E N 1 ATOM 3847 C CA . VAL C 1 81 ? 49.649 43.116 47.919 1.00 46.48 ? 405 VAL E CA 1 ATOM 3848 C C . VAL C 1 81 ? 48.914 44.250 47.236 1.00 47.02 ? 405 VAL E C 1 ATOM 3849 O O . VAL C 1 81 ? 49.464 45.331 47.049 1.00 47.76 ? 405 VAL E O 1 ATOM 3850 C CB . VAL C 1 81 ? 49.231 43.075 49.421 1.00 46.59 ? 405 VAL E CB 1 ATOM 3851 C CG1 . VAL C 1 81 ? 49.943 41.941 50.180 1.00 45.39 ? 405 VAL E CG1 1 ATOM 3852 C CG2 . VAL C 1 81 ? 49.468 44.444 50.106 1.00 46.00 ? 405 VAL E CG2 1 ATOM 3853 N N . GLY C 1 82 ? 47.667 44.004 46.858 1.00 47.92 ? 406 GLY E N 1 ATOM 3854 C CA . GLY C 1 82 ? 46.840 45.042 46.254 1.00 48.08 ? 406 GLY E CA 1 ATOM 3855 C C . GLY C 1 82 ? 46.377 46.036 47.300 1.00 48.55 ? 406 GLY E C 1 ATOM 3856 O O . GLY C 1 82 ? 46.044 45.645 48.424 1.00 46.87 ? 406 GLY E O 1 ATOM 3857 N N . THR C 1 83 ? 46.334 47.314 46.918 1.00 50.17 ? 407 THR E N 1 ATOM 3858 C CA . THR C 1 83 ? 45.990 48.397 47.845 1.00 51.48 ? 407 THR E CA 1 ATOM 3859 C C . THR C 1 83 ? 44.546 48.264 48.326 1.00 52.34 ? 407 THR E C 1 ATOM 3860 O O . THR C 1 83 ? 44.277 48.429 49.516 1.00 52.00 ? 407 THR E O 1 ATOM 3861 C CB . THR C 1 83 ? 46.233 49.814 47.230 1.00 51.74 ? 407 THR E CB 1 ATOM 3862 O OG1 . THR C 1 83 ? 47.599 49.934 46.828 1.00 52.13 ? 407 THR E OG1 1 ATOM 3863 C CG2 . THR C 1 83 ? 45.967 50.925 48.252 1.00 51.25 ? 407 THR E CG2 1 ATOM 3864 N N . ARG C 1 84 ? 43.634 47.938 47.410 1.00 53.73 ? 408 ARG E N 1 ATOM 3865 C CA . ARG C 1 84 ? 42.224 47.707 47.752 1.00 55.34 ? 408 ARG E CA 1 ATOM 3866 C C . ARG C 1 84 ? 42.023 46.398 48.530 1.00 54.58 ? 408 ARG E C 1 ATOM 3867 O O . ARG C 1 84 ? 41.219 46.334 49.463 1.00 54.42 ? 408 ARG E O 1 ATOM 3868 C CB . ARG C 1 84 ? 41.360 47.666 46.484 1.00 57.30 ? 408 ARG E CB 1 ATOM 3869 C CG . ARG C 1 84 ? 41.203 48.993 45.752 1.00 59.52 ? 408 ARG E CG 1 ATOM 3870 C CD . ARG C 1 84 ? 40.406 49.976 46.579 1.00 61.58 ? 408 ARG E CD 1 ATOM 3871 N NE . ARG C 1 84 ? 39.801 51.046 45.785 1.00 63.43 ? 408 ARG E NE 1 ATOM 3872 C CZ . ARG C 1 84 ? 40.446 52.132 45.358 1.00 64.84 ? 408 ARG E CZ 1 ATOM 3873 N NH1 . ARG C 1 84 ? 41.740 52.302 45.617 1.00 65.25 ? 408 ARG E NH1 1 ATOM 3874 N NH2 . ARG C 1 84 ? 39.788 53.054 44.662 1.00 65.55 ? 408 ARG E NH2 1 ATOM 3875 N N . ASP C 1 85 ? 42.726 45.349 48.112 1.00 53.79 ? 409 ASP E N 1 ATOM 3876 C CA . ASP C 1 85 ? 42.671 44.041 48.774 1.00 53.01 ? 409 ASP E CA 1 ATOM 3877 C C . ASP C 1 85 ? 43.043 44.162 50.263 1.00 52.00 ? 409 ASP E C 1 ATOM 3878 O O . ASP C 1 85 ? 42.414 43.549 51.126 1.00 51.15 ? 409 ASP E O 1 ATOM 3879 C CB . ASP C 1 85 ? 43.656 43.050 48.126 1.00 53.50 ? 409 ASP E CB 1 ATOM 3880 C CG . ASP C 1 85 ? 43.321 42.698 46.671 1.00 54.37 ? 409 ASP E CG 1 ATOM 3881 O OD1 . ASP C 1 85 ? 42.216 43.031 46.185 1.00 54.88 ? 409 ASP E OD1 1 ATOM 3882 O OD2 . ASP C 1 85 ? 44.185 42.067 46.007 1.00 54.27 ? 409 ASP E OD2 1 ATOM 3883 N N . TRP C 1 86 ? 44.096 44.928 50.547 1.00 50.54 ? 410 TRP E N 1 ATOM 3884 C CA . TRP C 1 86 ? 44.563 45.136 51.919 1.00 50.01 ? 410 TRP E CA 1 ATOM 3885 C C . TRP C 1 86 ? 43.668 46.058 52.744 1.00 50.51 ? 410 TRP E C 1 ATOM 3886 O O . TRP C 1 86 ? 43.316 45.732 53.888 1.00 49.62 ? 410 TRP E O 1 ATOM 3887 C CB . TRP C 1 86 ? 45.974 45.726 51.954 1.00 48.51 ? 410 TRP E CB 1 ATOM 3888 C CG . TRP C 1 86 ? 46.411 45.913 53.369 1.00 46.89 ? 410 TRP E CG 1 ATOM 3889 C CD1 . TRP C 1 86 ? 46.299 47.040 54.117 1.00 46.24 ? 410 TRP E CD1 1 ATOM 3890 C CD2 . TRP C 1 86 ? 46.972 44.913 54.230 1.00 46.65 ? 410 TRP E CD2 1 ATOM 3891 N NE1 . TRP C 1 86 ? 46.775 46.817 55.378 1.00 45.58 ? 410 TRP E NE1 1 ATOM 3892 C CE2 . TRP C 1 86 ? 47.194 45.519 55.477 1.00 45.15 ? 410 TRP E CE2 1 ATOM 3893 C CE3 . TRP C 1 86 ? 47.316 43.560 54.061 1.00 46.44 ? 410 TRP E CE3 1 ATOM 3894 C CZ2 . TRP C 1 86 ? 47.753 44.830 56.552 1.00 45.43 ? 410 TRP E CZ2 1 ATOM 3895 C CZ3 . TRP C 1 86 ? 47.868 42.878 55.135 1.00 45.94 ? 410 TRP E CZ3 1 ATOM 3896 C CH2 . TRP C 1 86 ? 48.069 43.513 56.365 1.00 45.24 ? 410 TRP E CH2 1 ATOM 3897 N N . ILE C 1 87 ? 43.330 47.207 52.154 1.00 51.60 ? 411 ILE E N 1 ATOM 3898 C CA . ILE C 1 87 ? 42.503 48.224 52.802 1.00 52.23 ? 411 ILE E CA 1 ATOM 3899 C C . ILE C 1 87 ? 41.105 47.673 53.112 1.00 52.48 ? 411 ILE E C 1 ATOM 3900 O O . ILE C 1 87 ? 40.490 48.080 54.096 1.00 52.37 ? 411 ILE E O 1 ATOM 3901 C CB . ILE C 1 87 ? 42.390 49.524 51.939 1.00 52.69 ? 411 ILE E CB 1 ATOM 3902 C CG1 . ILE C 1 87 ? 43.714 50.296 51.900 1.00 53.11 ? 411 ILE E CG1 1 ATOM 3903 C CG2 . ILE C 1 87 ? 41.324 50.451 52.486 1.00 52.57 ? 411 ILE E CG2 1 ATOM 3904 C CD1 . ILE C 1 87 ? 44.033 51.030 53.187 1.00 53.80 ? 411 ILE E CD1 1 ATOM 3905 N N . GLU C 1 88 ? 40.614 46.750 52.288 1.00 53.10 ? 412 GLU E N 1 ATOM 3906 C CA . GLU C 1 88 ? 39.271 46.163 52.481 1.00 53.82 ? 412 GLU E CA 1 ATOM 3907 C C . GLU C 1 88 ? 39.282 44.867 53.301 1.00 53.30 ? 412 GLU E C 1 ATOM 3908 O O . GLU C 1 88 ? 38.293 44.147 53.347 1.00 53.13 ? 412 GLU E O 1 ATOM 3909 C CB . GLU C 1 88 ? 38.573 45.919 51.140 1.00 53.96 ? 412 GLU E CB 1 ATOM 3910 C CG . GLU C 1 88 ? 38.212 47.190 50.398 1.00 54.76 ? 412 GLU E CG 1 ATOM 3911 C CD . GLU C 1 88 ? 37.477 46.921 49.102 1.00 55.61 ? 412 GLU E CD 1 ATOM 3912 O OE1 . GLU C 1 88 ? 36.963 45.797 48.919 1.00 56.83 ? 412 GLU E OE1 1 ATOM 3913 O OE2 . GLU C 1 88 ? 37.413 47.839 48.259 1.00 56.49 ? 412 GLU E OE2 1 ATOM 3914 N N . GLY C 1 89 ? 40.410 44.579 53.938 1.00 53.51 ? 413 GLY E N 1 ATOM 3915 C CA . GLY C 1 89 ? 40.489 43.556 54.977 1.00 53.31 ? 413 GLY E CA 1 ATOM 3916 C C . GLY C 1 89 ? 40.875 42.158 54.528 1.00 53.30 ? 413 GLY E C 1 ATOM 3917 O O . GLY C 1 89 ? 40.448 41.172 55.146 1.00 53.64 ? 413 GLY E O 1 ATOM 3918 N N . GLU C 1 90 ? 41.703 42.049 53.487 1.00 52.61 ? 414 GLU E N 1 ATOM 3919 C CA . GLU C 1 90 ? 42.129 40.730 53.027 1.00 52.52 ? 414 GLU E CA 1 ATOM 3920 C C . GLU C 1 90 ? 43.158 40.175 54.006 1.00 52.73 ? 414 GLU E C 1 ATOM 3921 O O . GLU C 1 90 ? 43.929 40.937 54.609 1.00 51.46 ? 414 GLU E O 1 ATOM 3922 C CB . GLU C 1 90 ? 42.675 40.780 51.592 1.00 52.73 ? 414 GLU E CB 1 ATOM 3923 C CG . GLU C 1 90 ? 43.297 39.477 51.048 1.00 52.90 ? 414 GLU E CG 1 ATOM 3924 C CD . GLU C 1 90 ? 42.342 38.276 50.948 1.00 53.13 ? 414 GLU E CD 1 ATOM 3925 O OE1 . GLU C 1 90 ? 42.055 37.624 51.980 1.00 53.17 ? 414 GLU E OE1 1 ATOM 3926 O OE2 . GLU C 1 90 ? 41.904 37.956 49.821 1.00 52.04 ? 414 GLU E OE2 1 ATOM 3927 N N . THR C 1 91 ? 43.127 38.852 54.194 1.00 53.00 ? 415 THR E N 1 ATOM 3928 C CA . THR C 1 91 ? 44.113 38.165 55.032 1.00 53.80 ? 415 THR E CA 1 ATOM 3929 C C . THR C 1 91 ? 45.095 37.329 54.212 1.00 53.91 ? 415 THR E C 1 ATOM 3930 O O . THR C 1 91 ? 44.694 36.538 53.354 1.00 53.68 ? 415 THR E O 1 ATOM 3931 C CB . THR C 1 91 ? 43.457 37.260 56.082 1.00 54.35 ? 415 THR E CB 1 ATOM 3932 O OG1 . THR C 1 91 ? 42.718 38.069 57.003 1.00 55.12 ? 415 THR E OG1 1 ATOM 3933 C CG2 . THR C 1 91 ? 44.512 36.456 56.846 1.00 54.15 ? 415 THR E CG2 1 ATOM 3934 N N . TYR C 1 92 ? 46.383 37.527 54.493 1.00 54.10 ? 416 TYR E N 1 ATOM 3935 C CA . TYR C 1 92 ? 47.453 36.855 53.784 1.00 54.10 ? 416 TYR E CA 1 ATOM 3936 C C . TYR C 1 92 ? 48.189 35.925 54.750 1.00 55.12 ? 416 TYR E C 1 ATOM 3937 O O . TYR C 1 92 ? 48.436 36.287 55.899 1.00 55.08 ? 416 TYR E O 1 ATOM 3938 C CB . TYR C 1 92 ? 48.401 37.895 53.188 1.00 53.90 ? 416 TYR E CB 1 ATOM 3939 C CG . TYR C 1 92 ? 47.737 38.833 52.205 1.00 53.21 ? 416 TYR E CG 1 ATOM 3940 C CD1 . TYR C 1 92 ? 47.021 39.946 52.643 1.00 53.31 ? 416 TYR E CD1 1 ATOM 3941 C CD2 . TYR C 1 92 ? 47.832 38.611 50.837 1.00 52.59 ? 416 TYR E CD2 1 ATOM 3942 C CE1 . TYR C 1 92 ? 46.412 40.814 51.732 1.00 53.43 ? 416 TYR E CE1 1 ATOM 3943 C CE2 . TYR C 1 92 ? 47.230 39.464 49.928 1.00 52.47 ? 416 TYR E CE2 1 ATOM 3944 C CZ . TYR C 1 92 ? 46.525 40.559 50.372 1.00 52.82 ? 416 TYR E CZ 1 ATOM 3945 O OH . TYR C 1 92 ? 45.939 41.394 49.448 1.00 52.70 ? 416 TYR E OH 1 ATOM 3946 N N . GLN C 1 93 ? 48.519 34.720 54.283 1.00 55.56 ? 417 GLN E N 1 ATOM 3947 C CA . GLN C 1 93 ? 49.181 33.731 55.122 1.00 55.56 ? 417 GLN E CA 1 ATOM 3948 C C . GLN C 1 93 ? 50.543 33.329 54.561 1.00 55.35 ? 417 GLN E C 1 ATOM 3949 O O . GLN C 1 93 ? 50.693 33.096 53.362 1.00 53.30 ? 417 GLN E O 1 ATOM 3950 C CB . GLN C 1 93 ? 48.296 32.491 55.271 1.00 56.68 ? 417 GLN E CB 1 ATOM 3951 C CG . GLN C 1 93 ? 48.723 31.539 56.390 1.00 57.14 ? 417 GLN E CG 1 ATOM 3952 C CD . GLN C 1 93 ? 48.196 30.127 56.196 1.00 57.66 ? 417 GLN E CD 1 ATOM 3953 O OE1 . GLN C 1 93 ? 48.406 29.516 55.147 1.00 57.68 ? 417 GLN E OE1 1 ATOM 3954 N NE2 . GLN C 1 93 ? 47.523 29.596 57.215 1.00 57.60 ? 417 GLN E NE2 1 ATOM 3955 N N . CYS C 1 94 ? 51.532 33.274 55.453 1.00 56.10 ? 418 CYS E N 1 ATOM 3956 C CA . CYS C 1 94 ? 52.853 32.735 55.147 1.00 56.60 ? 418 CYS E CA 1 ATOM 3957 C C . CYS C 1 94 ? 53.057 31.379 55.852 1.00 56.93 ? 418 CYS E C 1 ATOM 3958 O O . CYS C 1 94 ? 52.944 31.269 57.081 1.00 55.23 ? 418 CYS E O 1 ATOM 3959 C CB . CYS C 1 94 ? 53.962 33.732 55.527 1.00 56.37 ? 418 CYS E CB 1 ATOM 3960 S SG . CYS C 1 94 ? 55.680 33.116 55.326 1.00 56.64 ? 418 CYS E SG 1 ATOM 3961 N N . ARG C 1 95 ? 53.356 30.354 55.056 1.00 58.13 ? 419 ARG E N 1 ATOM 3962 C CA . ARG C 1 95 ? 53.734 29.051 55.587 1.00 59.56 ? 419 ARG E CA 1 ATOM 3963 C C . ARG C 1 95 ? 55.239 28.797 55.427 1.00 60.51 ? 419 ARG E C 1 ATOM 3964 O O . ARG C 1 95 ? 55.819 29.057 54.369 1.00 59.85 ? 419 ARG E O 1 ATOM 3965 C CB . ARG C 1 95 ? 52.925 27.954 54.897 1.00 60.41 ? 419 ARG E CB 1 ATOM 3966 C CG . ARG C 1 95 ? 53.000 26.604 55.599 1.00 61.20 ? 419 ARG E CG 1 ATOM 3967 C CD . ARG C 1 95 ? 52.029 25.606 54.998 1.00 62.19 ? 419 ARG E CD 1 ATOM 3968 N NE . ARG C 1 95 ? 52.003 24.368 55.773 1.00 63.09 ? 419 ARG E NE 1 ATOM 3969 C CZ . ARG C 1 95 ? 51.363 23.263 55.408 1.00 63.67 ? 419 ARG E CZ 1 ATOM 3970 N NH1 . ARG C 1 95 ? 50.675 23.230 54.275 1.00 64.25 ? 419 ARG E NH1 1 ATOM 3971 N NH2 . ARG C 1 95 ? 51.408 22.188 56.182 1.00 63.78 ? 419 ARG E NH2 1 ATOM 3972 N N . VAL C 1 96 ? 55.869 28.295 56.487 1.00 61.93 ? 420 VAL E N 1 ATOM 3973 C CA . VAL C 1 96 ? 57.300 27.979 56.461 1.00 63.63 ? 420 VAL E CA 1 ATOM 3974 C C . VAL C 1 96 ? 57.572 26.471 56.570 1.00 65.02 ? 420 VAL E C 1 ATOM 3975 O O . VAL C 1 96 ? 56.996 25.785 57.415 1.00 64.78 ? 420 VAL E O 1 ATOM 3976 C CB . VAL C 1 96 ? 58.065 28.698 57.599 1.00 63.41 ? 420 VAL E CB 1 ATOM 3977 C CG1 . VAL C 1 96 ? 59.575 28.569 57.387 1.00 63.40 ? 420 VAL E CG1 1 ATOM 3978 C CG2 . VAL C 1 96 ? 57.658 30.166 57.689 1.00 63.44 ? 420 VAL E CG2 1 ATOM 3979 N N . THR C 1 97 ? 58.475 25.969 55.731 1.00 67.30 ? 421 THR E N 1 ATOM 3980 C CA . THR C 1 97 ? 58.844 24.551 55.737 1.00 69.15 ? 421 THR E CA 1 ATOM 3981 C C . THR C 1 97 ? 60.365 24.375 55.803 1.00 71.37 ? 421 THR E C 1 ATOM 3982 O O . THR C 1 97 ? 61.045 24.363 54.774 1.00 71.78 ? 421 THR E O 1 ATOM 3983 C CB . THR C 1 97 ? 58.301 23.824 54.489 1.00 68.85 ? 421 THR E CB 1 ATOM 3984 O OG1 . THR C 1 97 ? 56.867 23.849 54.497 1.00 68.65 ? 421 THR E OG1 1 ATOM 3985 C CG2 . THR C 1 97 ? 58.774 22.380 54.457 1.00 69.14 ? 421 THR E CG2 1 ATOM 3986 N N . HIS C 1 98 ? 60.888 24.256 57.022 1.00 73.88 ? 422 HIS E N 1 ATOM 3987 C CA . HIS C 1 98 ? 62.309 23.976 57.252 1.00 75.89 ? 422 HIS E CA 1 ATOM 3988 C C . HIS C 1 98 ? 62.559 22.484 56.993 1.00 76.85 ? 422 HIS E C 1 ATOM 3989 O O . HIS C 1 98 ? 61.668 21.656 57.216 1.00 77.06 ? 422 HIS E O 1 ATOM 3990 C CB . HIS C 1 98 ? 62.691 24.359 58.694 1.00 76.70 ? 422 HIS E CB 1 ATOM 3991 C CG . HIS C 1 98 ? 64.156 24.613 58.905 1.00 77.56 ? 422 HIS E CG 1 ATOM 3992 N ND1 . HIS C 1 98 ? 65.017 23.651 59.392 1.00 77.89 ? 422 HIS E ND1 1 ATOM 3993 C CD2 . HIS C 1 98 ? 64.906 25.727 58.722 1.00 77.97 ? 422 HIS E CD2 1 ATOM 3994 C CE1 . HIS C 1 98 ? 66.236 24.154 59.482 1.00 78.21 ? 422 HIS E CE1 1 ATOM 3995 N NE2 . HIS C 1 98 ? 66.195 25.413 59.082 1.00 78.44 ? 422 HIS E NE2 1 ATOM 3996 N N . PRO C 1 99 ? 63.764 22.128 56.506 1.00 77.83 ? 423 PRO E N 1 ATOM 3997 C CA . PRO C 1 99 ? 64.070 20.715 56.259 1.00 77.98 ? 423 PRO E CA 1 ATOM 3998 C C . PRO C 1 99 ? 64.171 19.883 57.543 1.00 78.33 ? 423 PRO E C 1 ATOM 3999 O O . PRO C 1 99 ? 64.118 18.653 57.490 1.00 77.55 ? 423 PRO E O 1 ATOM 4000 C CB . PRO C 1 99 ? 65.431 20.770 55.555 1.00 78.04 ? 423 PRO E CB 1 ATOM 4001 C CG . PRO C 1 99 ? 66.045 22.057 56.019 1.00 78.05 ? 423 PRO E CG 1 ATOM 4002 C CD . PRO C 1 99 ? 64.883 23.006 56.114 1.00 78.05 ? 423 PRO E CD 1 ATOM 4003 N N . HIS C 1 100 ? 64.319 20.562 58.678 1.00 78.89 ? 424 HIS E N 1 ATOM 4004 C CA . HIS C 1 100 ? 64.437 19.905 59.973 1.00 79.34 ? 424 HIS E CA 1 ATOM 4005 C C . HIS C 1 100 ? 63.488 20.523 61.004 1.00 79.59 ? 424 HIS E C 1 ATOM 4006 O O . HIS C 1 100 ? 63.907 20.879 62.106 1.00 79.42 ? 424 HIS E O 1 ATOM 4007 C CB . HIS C 1 100 ? 65.885 19.978 60.476 1.00 79.54 ? 424 HIS E CB 1 ATOM 4008 C CG . HIS C 1 100 ? 66.871 19.276 59.593 1.00 79.85 ? 424 HIS E CG 1 ATOM 4009 N ND1 . HIS C 1 100 ? 67.775 19.954 58.803 1.00 79.91 ? 424 HIS E ND1 1 ATOM 4010 C CD2 . HIS C 1 100 ? 67.096 17.957 59.376 1.00 79.99 ? 424 HIS E CD2 1 ATOM 4011 C CE1 . HIS C 1 100 ? 68.511 19.084 58.134 1.00 79.99 ? 424 HIS E CE1 1 ATOM 4012 N NE2 . HIS C 1 100 ? 68.120 17.866 58.464 1.00 80.07 ? 424 HIS E NE2 1 ATOM 4013 N N . LEU C 1 101 ? 62.213 20.655 60.642 1.00 79.86 ? 425 LEU E N 1 ATOM 4014 C CA . LEU C 1 101 ? 61.171 21.024 61.600 1.00 80.00 ? 425 LEU E CA 1 ATOM 4015 C C . LEU C 1 101 ? 59.999 20.054 61.492 1.00 80.16 ? 425 LEU E C 1 ATOM 4016 O O . LEU C 1 101 ? 59.612 19.679 60.385 1.00 79.92 ? 425 LEU E O 1 ATOM 4017 C CB . LEU C 1 101 ? 60.691 22.464 61.383 1.00 80.16 ? 425 LEU E CB 1 ATOM 4018 C CG . LEU C 1 101 ? 59.993 22.877 60.076 1.00 80.20 ? 425 LEU E CG 1 ATOM 4019 C CD1 . LEU C 1 101 ? 58.725 22.086 59.777 1.00 80.34 ? 425 LEU E CD1 1 ATOM 4020 C CD2 . LEU C 1 101 ? 59.669 24.365 60.119 1.00 80.08 ? 425 LEU E CD2 1 ATOM 4021 N N . PRO C 1 102 ? 59.427 19.648 62.642 1.00 80.50 ? 426 PRO E N 1 ATOM 4022 C CA . PRO C 1 102 ? 58.322 18.684 62.655 1.00 80.45 ? 426 PRO E CA 1 ATOM 4023 C C . PRO C 1 102 ? 57.012 19.255 62.104 1.00 80.05 ? 426 PRO E C 1 ATOM 4024 O O . PRO C 1 102 ? 56.364 18.618 61.272 1.00 80.23 ? 426 PRO E O 1 ATOM 4025 C CB . PRO C 1 102 ? 58.178 18.325 64.139 1.00 80.62 ? 426 PRO E CB 1 ATOM 4026 C CG . PRO C 1 102 ? 58.734 19.493 64.879 1.00 80.71 ? 426 PRO E CG 1 ATOM 4027 C CD . PRO C 1 102 ? 59.789 20.102 63.998 1.00 80.67 ? 426 PRO E CD 1 ATOM 4028 N N . ARG C 1 103 ? 56.628 20.442 62.566 1.00 79.30 ? 427 ARG E N 1 ATOM 4029 C CA . ARG C 1 103 ? 55.417 21.095 62.084 1.00 78.62 ? 427 ARG E CA 1 ATOM 4030 C C . ARG C 1 103 ? 55.752 22.408 61.376 1.00 77.63 ? 427 ARG E C 1 ATOM 4031 O O . ARG C 1 103 ? 56.564 23.203 61.859 1.00 77.34 ? 427 ARG E O 1 ATOM 4032 C CB . ARG C 1 103 ? 54.445 21.354 63.238 1.00 78.89 ? 427 ARG E CB 1 ATOM 4033 C CG . ARG C 1 103 ? 53.910 20.092 63.894 1.00 79.15 ? 427 ARG E CG 1 ATOM 4034 C CD . ARG C 1 103 ? 52.583 20.352 64.592 1.00 79.25 ? 427 ARG E CD 1 ATOM 4035 N NE . ARG C 1 103 ? 52.077 19.165 65.276 1.00 79.29 ? 427 ARG E NE 1 ATOM 4036 C CZ . ARG C 1 103 ? 50.890 19.086 65.872 1.00 79.40 ? 427 ARG E CZ 1 ATOM 4037 N NH1 . ARG C 1 103 ? 50.064 20.125 65.871 1.00 79.54 ? 427 ARG E NH1 1 ATOM 4038 N NH2 . ARG C 1 103 ? 50.522 17.962 66.471 1.00 79.24 ? 427 ARG E NH2 1 ATOM 4039 N N . ALA C 1 104 ? 55.122 22.618 60.224 1.00 76.26 ? 428 ALA E N 1 ATOM 4040 C CA . ALA C 1 104 ? 55.309 23.830 59.443 1.00 75.30 ? 428 ALA E CA 1 ATOM 4041 C C . ALA C 1 104 ? 54.710 25.019 60.191 1.00 74.22 ? 428 ALA E C 1 ATOM 4042 O O . ALA C 1 104 ? 53.586 24.937 60.692 1.00 74.00 ? 428 ALA E O 1 ATOM 4043 C CB . ALA C 1 104 ? 54.669 23.674 58.071 1.00 74.92 ? 428 ALA E CB 1 ATOM 4044 N N . LEU C 1 105 ? 55.477 26.106 60.280 1.00 73.05 ? 429 LEU E N 1 ATOM 4045 C CA . LEU C 1 105 ? 55.037 27.327 60.957 1.00 71.89 ? 429 LEU E CA 1 ATOM 4046 C C . LEU C 1 105 ? 54.059 28.118 60.094 1.00 70.72 ? 429 LEU E C 1 ATOM 4047 O O . LEU C 1 105 ? 54.260 28.263 58.890 1.00 69.81 ? 429 LEU E O 1 ATOM 4048 C CB . LEU C 1 105 ? 56.235 28.217 61.295 1.00 71.85 ? 429 LEU E CB 1 ATOM 4049 C CG . LEU C 1 105 ? 57.194 27.736 62.382 1.00 72.15 ? 429 LEU E CG 1 ATOM 4050 C CD1 . LEU C 1 105 ? 58.466 28.573 62.374 1.00 72.24 ? 429 LEU E CD1 1 ATOM 4051 C CD2 . LEU C 1 105 ? 56.513 27.802 63.743 1.00 72.29 ? 429 LEU E CD2 1 ATOM 4052 N N . MET C 1 106 ? 53.010 28.641 60.721 1.00 70.21 ? 430 MET E N 1 ATOM 4053 C CA . MET C 1 106 ? 51.999 29.425 60.020 1.00 70.05 ? 430 MET E CA 1 ATOM 4054 C C . MET C 1 106 ? 51.895 30.832 60.607 1.00 68.35 ? 430 MET E C 1 ATOM 4055 O O . MET C 1 106 ? 51.726 31.014 61.814 1.00 67.93 ? 430 MET E O 1 ATOM 4056 C CB . MET C 1 106 ? 50.639 28.714 60.058 1.00 71.59 ? 430 MET E CB 1 ATOM 4057 C CG . MET C 1 106 ? 50.581 27.470 59.162 1.00 72.75 ? 430 MET E CG 1 ATOM 4058 S SD . MET C 1 106 ? 49.049 26.500 59.228 1.00 74.92 ? 430 MET E SD 1 ATOM 4059 C CE . MET C 1 106 ? 49.110 25.793 60.884 1.00 74.59 ? 430 MET E CE 1 ATOM 4060 N N . ARG C 1 107 ? 52.023 31.823 59.731 1.00 66.33 ? 431 ARG E N 1 ATOM 4061 C CA . ARG C 1 107 ? 51.873 33.217 60.108 1.00 64.55 ? 431 ARG E CA 1 ATOM 4062 C C . ARG C 1 107 ? 50.821 33.831 59.192 1.00 62.66 ? 431 ARG E C 1 ATOM 4063 O O . ARG C 1 107 ? 50.796 33.552 57.997 1.00 61.37 ? 431 ARG E O 1 ATOM 4064 C CB . ARG C 1 107 ? 53.212 33.955 59.993 1.00 64.57 ? 431 ARG E CB 1 ATOM 4065 C CG . ARG C 1 107 ? 54.362 33.307 60.766 1.00 64.68 ? 431 ARG E CG 1 ATOM 4066 C CD . ARG C 1 107 ? 54.208 33.501 62.270 1.00 65.22 ? 431 ARG E CD 1 ATOM 4067 N NE . ARG C 1 107 ? 54.694 32.349 63.028 1.00 66.12 ? 431 ARG E NE 1 ATOM 4068 C CZ . ARG C 1 107 ? 54.822 32.315 64.349 1.00 66.49 ? 431 ARG E CZ 1 ATOM 4069 N NH1 . ARG C 1 107 ? 54.504 33.375 65.082 1.00 66.92 ? 431 ARG E NH1 1 ATOM 4070 N NH2 . ARG C 1 107 ? 55.266 31.214 64.938 1.00 66.50 ? 431 ARG E NH2 1 ATOM 4071 N N . SER C 1 108 ? 49.928 34.631 59.767 1.00 61.24 ? 432 SER E N 1 ATOM 4072 C CA . SER C 1 108 ? 48.919 35.344 58.989 1.00 60.47 ? 432 SER E CA 1 ATOM 4073 C C . SER C 1 108 ? 48.908 36.842 59.346 1.00 59.48 ? 432 SER E C 1 ATOM 4074 O O . SER C 1 108 ? 49.275 37.229 60.457 1.00 58.45 ? 432 SER E O 1 ATOM 4075 C CB . SER C 1 108 ? 47.537 34.713 59.187 1.00 60.00 ? 432 SER E CB 1 ATOM 4076 O OG . SER C 1 108 ? 47.188 34.673 60.556 1.00 59.90 ? 432 SER E OG 1 ATOM 4077 N N . THR C 1 109 ? 48.509 37.674 58.388 1.00 58.52 ? 433 THR E N 1 ATOM 4078 C CA . THR C 1 109 ? 48.489 39.122 58.575 1.00 58.67 ? 433 THR E CA 1 ATOM 4079 C C . THR C 1 109 ? 47.271 39.739 57.890 1.00 58.79 ? 433 THR E C 1 ATOM 4080 O O . THR C 1 109 ? 46.762 39.210 56.903 1.00 57.75 ? 433 THR E O 1 ATOM 4081 C CB . THR C 1 109 ? 49.792 39.812 58.052 1.00 58.40 ? 433 THR E CB 1 ATOM 4082 O OG1 . THR C 1 109 ? 49.917 41.121 58.633 1.00 57.60 ? 433 THR E OG1 1 ATOM 4083 C CG2 . THR C 1 109 ? 49.801 39.920 56.523 1.00 57.38 ? 433 THR E CG2 1 ATOM 4084 N N . THR C 1 110 ? 46.816 40.866 58.429 1.00 59.52 ? 434 THR E N 1 ATOM 4085 C CA . THR C 1 110 ? 45.595 41.512 57.967 1.00 60.16 ? 434 THR E CA 1 ATOM 4086 C C . THR C 1 110 ? 45.541 42.944 58.495 1.00 61.11 ? 434 THR E C 1 ATOM 4087 O O . THR C 1 110 ? 46.213 43.286 59.466 1.00 60.09 ? 434 THR E O 1 ATOM 4088 C CB . THR C 1 110 ? 44.331 40.710 58.411 1.00 60.17 ? 434 THR E CB 1 ATOM 4089 O OG1 . THR C 1 110 ? 43.142 41.274 57.833 1.00 59.39 ? 434 THR E OG1 1 ATOM 4090 C CG2 . THR C 1 110 ? 44.206 40.657 59.938 1.00 59.99 ? 434 THR E CG2 1 ATOM 4091 N N . LYS C 1 111 ? 44.760 43.779 57.818 1.00 62.66 ? 435 LYS E N 1 ATOM 4092 C CA . LYS C 1 111 ? 44.553 45.158 58.219 1.00 64.02 ? 435 LYS E CA 1 ATOM 4093 C C . LYS C 1 111 ? 44.005 45.226 59.646 1.00 64.70 ? 435 LYS E C 1 ATOM 4094 O O . LYS C 1 111 ? 42.965 44.625 59.946 1.00 63.95 ? 435 LYS E O 1 ATOM 4095 C CB . LYS C 1 111 ? 43.565 45.823 57.260 1.00 64.86 ? 435 LYS E CB 1 ATOM 4096 C CG . LYS C 1 111 ? 43.157 47.229 57.666 1.00 65.66 ? 435 LYS E CG 1 ATOM 4097 C CD . LYS C 1 111 ? 42.152 47.829 56.695 1.00 66.04 ? 435 LYS E CD 1 ATOM 4098 C CE . LYS C 1 111 ? 41.695 49.214 57.150 1.00 66.19 ? 435 LYS E CE 1 ATOM 4099 N NZ . LYS C 1 111 ? 40.931 49.138 58.428 1.00 65.72 ? 435 LYS E NZ 1 ATOM 4100 N N . THR C 1 112 ? 44.718 45.950 60.512 1.00 64.76 ? 436 THR E N 1 ATOM 4101 C CA . THR C 1 112 ? 44.268 46.220 61.880 1.00 64.82 ? 436 THR E CA 1 ATOM 4102 C C . THR C 1 112 ? 43.178 47.281 61.895 1.00 63.48 ? 436 THR E C 1 ATOM 4103 O O . THR C 1 112 ? 43.402 48.400 61.432 1.00 63.61 ? 436 THR E O 1 ATOM 4104 C CB . THR C 1 112 ? 45.413 46.732 62.773 1.00 65.61 ? 436 THR E CB 1 ATOM 4105 O OG1 . THR C 1 112 ? 44.870 47.168 64.029 1.00 66.14 ? 436 THR E OG1 1 ATOM 4106 C CG2 . THR C 1 112 ? 46.166 47.895 62.104 1.00 66.04 ? 436 THR E CG2 1 ATOM 4107 N N . SER C 1 113 ? 42.014 46.935 62.442 1.00 62.29 ? 437 SER E N 1 ATOM 4108 C CA . SER C 1 113 ? 40.844 47.816 62.369 1.00 60.91 ? 437 SER E CA 1 ATOM 4109 C C . SER C 1 113 ? 40.126 48.051 63.702 1.00 59.51 ? 437 SER E C 1 ATOM 4110 O O . SER C 1 113 ? 39.047 47.502 63.952 1.00 60.25 ? 437 SER E O 1 ATOM 4111 C CB . SER C 1 113 ? 39.861 47.302 61.317 1.00 60.96 ? 437 SER E CB 1 ATOM 4112 O OG . SER C 1 113 ? 40.438 47.449 60.031 1.00 60.35 ? 437 SER E OG 1 ATOM 4113 N N . GLY C 1 114 ? 40.734 48.888 64.540 1.00 56.76 ? 438 GLY E N 1 ATOM 4114 C CA . GLY C 1 114 ? 40.090 49.364 65.759 1.00 54.02 ? 438 GLY E CA 1 ATOM 4115 C C . GLY C 1 114 ? 39.633 50.802 65.577 1.00 51.40 ? 438 GLY E C 1 ATOM 4116 O O . GLY C 1 114 ? 39.366 51.246 64.448 1.00 51.33 ? 438 GLY E O 1 ATOM 4117 N N . PRO C 1 115 ? 39.546 51.549 66.687 1.00 47.74 ? 439 PRO E N 1 ATOM 4118 C CA . PRO C 1 115 ? 39.342 52.993 66.576 1.00 45.54 ? 439 PRO E CA 1 ATOM 4119 C C . PRO C 1 115 ? 40.518 53.656 65.848 1.00 42.73 ? 439 PRO E C 1 ATOM 4120 O O . PRO C 1 115 ? 41.631 53.135 65.888 1.00 41.17 ? 439 PRO E O 1 ATOM 4121 C CB . PRO C 1 115 ? 39.263 53.459 68.039 1.00 45.63 ? 439 PRO E CB 1 ATOM 4122 C CG . PRO C 1 115 ? 39.107 52.227 68.862 1.00 46.27 ? 439 PRO E CG 1 ATOM 4123 C CD . PRO C 1 115 ? 39.743 51.121 68.083 1.00 47.07 ? 439 PRO E CD 1 ATOM 4124 N N . ARG C 1 116 ? 40.261 54.783 65.191 1.00 40.74 ? 440 ARG E N 1 ATOM 4125 C CA . ARG C 1 116 ? 41.287 55.552 64.489 1.00 39.63 ? 440 ARG E CA 1 ATOM 4126 C C . ARG C 1 116 ? 41.552 56.871 65.192 1.00 38.42 ? 440 ARG E C 1 ATOM 4127 O O . ARG C 1 116 ? 40.638 57.443 65.764 1.00 38.51 ? 440 ARG E O 1 ATOM 4128 C CB . ARG C 1 116 ? 40.824 55.893 63.077 1.00 40.28 ? 440 ARG E CB 1 ATOM 4129 C CG . ARG C 1 116 ? 41.037 54.811 62.052 1.00 41.54 ? 440 ARG E CG 1 ATOM 4130 C CD . ARG C 1 116 ? 40.812 55.384 60.666 1.00 42.70 ? 440 ARG E CD 1 ATOM 4131 N NE . ARG C 1 116 ? 40.938 54.363 59.626 1.00 44.45 ? 440 ARG E NE 1 ATOM 4132 C CZ . ARG C 1 116 ? 40.830 54.615 58.326 1.00 45.00 ? 440 ARG E CZ 1 ATOM 4133 N NH1 . ARG C 1 116 ? 40.591 55.849 57.904 1.00 44.78 ? 440 ARG E NH1 1 ATOM 4134 N NH2 . ARG C 1 116 ? 40.956 53.631 57.448 1.00 45.89 ? 440 ARG E NH2 1 ATOM 4135 N N . ALA C 1 117 ? 42.784 57.374 65.120 1.00 36.29 ? 441 ALA E N 1 ATOM 4136 C CA . ALA C 1 117 ? 43.103 58.717 65.628 1.00 35.00 ? 441 ALA E CA 1 ATOM 4137 C C . ALA C 1 117 ? 44.401 59.209 65.002 1.00 34.54 ? 441 ALA E C 1 ATOM 4138 O O . ALA C 1 117 ? 45.380 58.457 64.932 1.00 32.23 ? 441 ALA E O 1 ATOM 4139 C CB . ALA C 1 117 ? 43.204 58.720 67.150 1.00 34.01 ? 441 ALA E CB 1 ATOM 4140 N N . ALA C 1 118 ? 44.388 60.462 64.541 1.00 33.67 ? 442 ALA E N 1 ATOM 4141 C CA . ALA C 1 118 ? 45.507 61.063 63.823 1.00 32.39 ? 442 ALA E CA 1 ATOM 4142 C C . ALA C 1 118 ? 46.640 61.379 64.788 1.00 31.78 ? 442 ALA E C 1 ATOM 4143 O O . ALA C 1 118 ? 46.390 61.734 65.942 1.00 30.64 ? 442 ALA E O 1 ATOM 4144 C CB . ALA C 1 118 ? 45.047 62.345 63.114 1.00 33.47 ? 442 ALA E CB 1 ATOM 4145 N N . PRO C 1 119 ? 47.899 61.239 64.322 1.00 29.53 ? 443 PRO E N 1 ATOM 4146 C CA . PRO C 1 119 ? 49.004 61.593 65.178 1.00 28.29 ? 443 PRO E CA 1 ATOM 4147 C C . PRO C 1 119 ? 49.143 63.112 65.370 1.00 28.00 ? 443 PRO E C 1 ATOM 4148 O O . PRO C 1 119 ? 48.831 63.915 64.491 1.00 27.32 ? 443 PRO E O 1 ATOM 4149 C CB . PRO C 1 119 ? 50.221 60.979 64.468 1.00 29.05 ? 443 PRO E CB 1 ATOM 4150 C CG . PRO C 1 119 ? 49.843 60.836 63.048 1.00 28.83 ? 443 PRO E CG 1 ATOM 4151 C CD . PRO C 1 119 ? 48.333 60.830 62.976 1.00 29.31 ? 443 PRO E CD 1 ATOM 4152 N N . GLU C 1 120 ? 49.583 63.481 66.561 1.00 28.71 ? 444 GLU E N 1 ATOM 4153 C CA . GLU C 1 120 ? 50.208 64.767 66.797 1.00 29.25 ? 444 GLU E CA 1 ATOM 4154 C C . GLU C 1 120 ? 51.729 64.646 66.594 1.00 28.92 ? 444 GLU E C 1 ATOM 4155 O O . GLU C 1 120 ? 52.349 63.706 67.062 1.00 28.04 ? 444 GLU E O 1 ATOM 4156 C CB . GLU C 1 120 ? 49.906 65.203 68.216 1.00 29.17 ? 444 GLU E CB 1 ATOM 4157 C CG . GLU C 1 120 ? 48.454 65.060 68.569 1.00 28.88 ? 444 GLU E CG 1 ATOM 4158 C CD . GLU C 1 120 ? 48.234 65.114 70.039 1.00 29.37 ? 444 GLU E CD 1 ATOM 4159 O OE1 . GLU C 1 120 ? 49.124 65.598 70.750 1.00 30.64 ? 444 GLU E OE1 1 ATOM 4160 O OE2 . GLU C 1 120 ? 47.141 64.723 70.488 1.00 34.58 ? 444 GLU E OE2 1 ATOM 4161 N N . VAL C 1 121 ? 52.309 65.620 65.896 1.00 29.61 ? 445 VAL E N 1 ATOM 4162 C CA . VAL C 1 121 ? 53.747 65.678 65.624 1.00 27.66 ? 445 VAL E CA 1 ATOM 4163 C C . VAL C 1 121 ? 54.406 66.935 66.205 1.00 27.71 ? 445 VAL E C 1 ATOM 4164 O O . VAL C 1 121 ? 53.967 68.062 65.970 1.00 26.93 ? 445 VAL E O 1 ATOM 4165 C CB . VAL C 1 121 ? 54.016 65.653 64.091 1.00 27.75 ? 445 VAL E CB 1 ATOM 4166 C CG1 . VAL C 1 121 ? 55.528 65.720 63.838 1.00 26.11 ? 445 VAL E CG1 1 ATOM 4167 C CG2 . VAL C 1 121 ? 53.391 64.399 63.432 1.00 25.24 ? 445 VAL E CG2 1 ATOM 4168 N N . TYR C 1 122 ? 55.472 66.727 66.978 1.00 28.33 ? 446 TYR E N 1 ATOM 4169 C CA . TYR C 1 122 ? 56.239 67.806 67.596 1.00 27.57 ? 446 TYR E CA 1 ATOM 4170 C C . TYR C 1 122 ? 57.729 67.593 67.350 1.00 28.48 ? 446 TYR E C 1 ATOM 4171 O O . TYR C 1 122 ? 58.283 66.519 67.576 1.00 30.04 ? 446 TYR E O 1 ATOM 4172 C CB . TYR C 1 122 ? 55.991 67.863 69.115 1.00 28.48 ? 446 TYR E CB 1 ATOM 4173 C CG . TYR C 1 122 ? 54.522 67.884 69.493 1.00 28.44 ? 446 TYR E CG 1 ATOM 4174 C CD1 . TYR C 1 122 ? 53.852 66.721 69.851 1.00 28.44 ? 446 TYR E CD1 1 ATOM 4175 C CD2 . TYR C 1 122 ? 53.799 69.069 69.451 1.00 27.71 ? 446 TYR E CD2 1 ATOM 4176 C CE1 . TYR C 1 122 ? 52.492 66.768 70.167 1.00 28.73 ? 446 TYR E CE1 1 ATOM 4177 C CE2 . TYR C 1 122 ? 52.467 69.102 69.762 1.00 28.22 ? 446 TYR E CE2 1 ATOM 4178 C CZ . TYR C 1 122 ? 51.822 67.963 70.121 1.00 27.51 ? 446 TYR E CZ 1 ATOM 4179 O OH . TYR C 1 122 ? 50.484 68.029 70.430 1.00 29.25 ? 446 TYR E OH 1 ATOM 4180 N N . ALA C 1 123 ? 58.400 68.643 66.911 1.00 29.80 ? 447 ALA E N 1 ATOM 4181 C CA . ALA C 1 123 ? 59.793 68.528 66.518 1.00 30.89 ? 447 ALA E CA 1 ATOM 4182 C C . ALA C 1 123 ? 60.652 69.489 67.328 1.00 29.72 ? 447 ALA E C 1 ATOM 4183 O O . ALA C 1 123 ? 60.289 70.638 67.549 1.00 28.67 ? 447 ALA E O 1 ATOM 4184 C CB . ALA C 1 123 ? 59.971 68.749 64.999 1.00 29.73 ? 447 ALA E CB 1 ATOM 4185 N N . PHE C 1 124 ? 61.795 68.989 67.766 1.00 29.57 ? 448 PHE E N 1 ATOM 4186 C CA . PHE C 1 124 ? 62.680 69.771 68.628 1.00 32.47 ? 448 PHE E CA 1 ATOM 4187 C C . PHE C 1 124 ? 64.120 69.675 68.149 1.00 31.97 ? 448 PHE E C 1 ATOM 4188 O O . PHE C 1 124 ? 64.491 68.710 67.523 1.00 32.90 ? 448 PHE E O 1 ATOM 4189 C CB . PHE C 1 124 ? 62.618 69.270 70.070 1.00 32.03 ? 448 PHE E CB 1 ATOM 4190 C CG . PHE C 1 124 ? 61.236 69.111 70.596 1.00 32.52 ? 448 PHE E CG 1 ATOM 4191 C CD1 . PHE C 1 124 ? 60.614 67.886 70.551 1.00 32.22 ? 448 PHE E CD1 1 ATOM 4192 C CD2 . PHE C 1 124 ? 60.566 70.197 71.163 1.00 34.32 ? 448 PHE E CD2 1 ATOM 4193 C CE1 . PHE C 1 124 ? 59.347 67.750 71.036 1.00 34.46 ? 448 PHE E CE1 1 ATOM 4194 C CE2 . PHE C 1 124 ? 59.292 70.063 71.670 1.00 34.41 ? 448 PHE E CE2 1 ATOM 4195 C CZ . PHE C 1 124 ? 58.683 68.837 71.615 1.00 34.89 ? 448 PHE E CZ 1 ATOM 4196 N N . ALA C 1 125 ? 64.899 70.707 68.430 1.00 33.38 ? 449 ALA E N 1 ATOM 4197 C CA . ALA C 1 125 ? 66.336 70.698 68.217 1.00 33.66 ? 449 ALA E CA 1 ATOM 4198 C C . ALA C 1 125 ? 67.032 70.949 69.559 1.00 32.60 ? 449 ALA E C 1 ATOM 4199 O O . ALA C 1 125 ? 66.574 71.754 70.349 1.00 31.35 ? 449 ALA E O 1 ATOM 4200 C CB . ALA C 1 125 ? 66.713 71.770 67.227 1.00 35.43 ? 449 ALA E CB 1 ATOM 4201 N N . THR C 1 126 ? 68.122 70.237 69.828 1.00 34.14 ? 450 THR E N 1 ATOM 4202 C CA . THR C 1 126 ? 68.914 70.484 71.041 1.00 33.40 ? 450 THR E CA 1 ATOM 4203 C C . THR C 1 126 ? 69.544 71.870 70.919 1.00 34.12 ? 450 THR E C 1 ATOM 4204 O O . THR C 1 126 ? 69.848 72.300 69.815 1.00 33.68 ? 450 THR E O 1 ATOM 4205 C CB . THR C 1 126 ? 70.008 69.429 71.259 1.00 32.05 ? 450 THR E CB 1 ATOM 4206 O OG1 . THR C 1 126 ? 70.844 69.350 70.094 1.00 31.21 ? 450 THR E OG1 1 ATOM 4207 C CG2 . THR C 1 126 ? 69.378 68.081 71.580 1.00 31.92 ? 450 THR E CG2 1 ATOM 4208 N N . PRO C 1 127 ? 69.721 72.570 72.053 1.00 34.95 ? 451 PRO E N 1 ATOM 4209 C CA . PRO C 1 127 ? 70.300 73.904 72.042 1.00 36.13 ? 451 PRO E CA 1 ATOM 4210 C C . PRO C 1 127 ? 71.790 73.880 71.720 1.00 37.71 ? 451 PRO E C 1 ATOM 4211 O O . PRO C 1 127 ? 72.436 72.839 71.808 1.00 37.36 ? 451 PRO E O 1 ATOM 4212 C CB . PRO C 1 127 ? 70.076 74.409 73.474 1.00 36.63 ? 451 PRO E CB 1 ATOM 4213 C CG . PRO C 1 127 ? 69.907 73.171 74.316 1.00 36.28 ? 451 PRO E CG 1 ATOM 4214 C CD . PRO C 1 127 ? 69.291 72.146 73.403 1.00 35.64 ? 451 PRO E CD 1 ATOM 4215 N N . GLU C 1 128 ? 72.305 75.036 71.333 1.00 39.93 ? 452 GLU E N 1 ATOM 4216 C CA . GLU C 1 128 ? 73.721 75.221 71.061 1.00 42.68 ? 452 GLU E CA 1 ATOM 4217 C C . GLU C 1 128 ? 74.514 75.338 72.355 1.00 42.22 ? 452 GLU E C 1 ATOM 4218 O O . GLU C 1 128 ? 74.398 76.342 73.067 1.00 42.41 ? 452 GLU E O 1 ATOM 4219 C CB . GLU C 1 128 ? 73.924 76.500 70.250 1.00 45.06 ? 452 GLU E CB 1 ATOM 4220 C CG . GLU C 1 128 ? 75.271 76.563 69.536 1.00 47.31 ? 452 GLU E CG 1 ATOM 4221 C CD . GLU C 1 128 ? 75.402 77.797 68.659 1.00 49.09 ? 452 GLU E CD 1 ATOM 4222 O OE1 . GLU C 1 128 ? 75.104 78.910 69.158 1.00 49.47 ? 452 GLU E OE1 1 ATOM 4223 O OE2 . GLU C 1 128 ? 75.816 77.652 67.483 1.00 50.47 ? 452 GLU E OE2 1 ATOM 4224 N N . TRP C 1 129 ? 75.287 74.298 72.664 1.00 41.56 ? 453 TRP E N 1 ATOM 4225 C CA . TRP C 1 129 ? 76.196 74.319 73.809 1.00 41.78 ? 453 TRP E CA 1 ATOM 4226 C C . TRP C 1 129 ? 77.579 74.695 73.307 1.00 41.12 ? 453 TRP E C 1 ATOM 4227 O O . TRP C 1 129 ? 78.049 74.154 72.304 1.00 40.27 ? 453 TRP E O 1 ATOM 4228 C CB . TRP C 1 129 ? 76.253 72.969 74.537 1.00 41.43 ? 453 TRP E CB 1 ATOM 4229 C CG . TRP C 1 129 ? 75.094 72.735 75.484 1.00 41.00 ? 453 TRP E CG 1 ATOM 4230 C CD1 . TRP C 1 129 ? 73.981 71.975 75.246 1.00 39.97 ? 453 TRP E CD1 1 ATOM 4231 C CD2 . TRP C 1 129 ? 74.952 73.253 76.820 1.00 40.07 ? 453 TRP E CD2 1 ATOM 4232 N NE1 . TRP C 1 129 ? 73.159 71.994 76.344 1.00 40.16 ? 453 TRP E NE1 1 ATOM 4233 C CE2 . TRP C 1 129 ? 73.729 72.763 77.326 1.00 40.12 ? 453 TRP E CE2 1 ATOM 4234 C CE3 . TRP C 1 129 ? 75.741 74.078 77.634 1.00 39.63 ? 453 TRP E CE3 1 ATOM 4235 C CZ2 . TRP C 1 129 ? 73.266 73.075 78.615 1.00 39.43 ? 453 TRP E CZ2 1 ATOM 4236 C CZ3 . TRP C 1 129 ? 75.281 74.388 78.921 1.00 39.88 ? 453 TRP E CZ3 1 ATOM 4237 C CH2 . TRP C 1 129 ? 74.048 73.888 79.389 1.00 39.64 ? 453 TRP E CH2 1 ATOM 4238 N N . PRO C 1 130 ? 78.217 75.655 73.984 1.00 40.70 ? 454 PRO E N 1 ATOM 4239 C CA . PRO C 1 130 ? 79.532 76.074 73.526 1.00 40.29 ? 454 PRO E CA 1 ATOM 4240 C C . PRO C 1 130 ? 80.527 74.919 73.552 1.00 39.65 ? 454 PRO E C 1 ATOM 4241 O O . PRO C 1 130 ? 80.586 74.168 74.541 1.00 38.72 ? 454 PRO E O 1 ATOM 4242 C CB . PRO C 1 130 ? 79.928 77.157 74.534 1.00 40.18 ? 454 PRO E CB 1 ATOM 4243 C CG . PRO C 1 130 ? 78.632 77.657 75.081 1.00 40.14 ? 454 PRO E CG 1 ATOM 4244 C CD . PRO C 1 130 ? 77.753 76.451 75.134 1.00 40.54 ? 454 PRO E CD 1 ATOM 4245 N N . GLY C 1 131 ? 81.315 74.824 72.480 1.00 39.19 ? 455 GLY E N 1 ATOM 4246 C CA . GLY C 1 131 ? 82.340 73.798 72.344 1.00 39.51 ? 455 GLY E CA 1 ATOM 4247 C C . GLY C 1 131 ? 82.012 72.831 71.221 1.00 39.94 ? 455 GLY E C 1 ATOM 4248 O O . GLY C 1 131 ? 82.892 72.150 70.710 1.00 37.97 ? 455 GLY E O 1 ATOM 4249 N N . SER C 1 132 ? 80.739 72.765 70.844 1.00 42.34 ? 456 SER E N 1 ATOM 4250 C CA . SER C 1 132 ? 80.285 71.839 69.803 1.00 44.76 ? 456 SER E CA 1 ATOM 4251 C C . SER C 1 132 ? 79.212 72.467 68.898 1.00 45.84 ? 456 SER E C 1 ATOM 4252 O O . SER C 1 132 ? 78.007 72.303 69.110 1.00 43.49 ? 456 SER E O 1 ATOM 4253 C CB . SER C 1 132 ? 79.743 70.564 70.450 1.00 45.34 ? 456 SER E CB 1 ATOM 4254 O OG . SER C 1 132 ? 78.673 70.895 71.308 1.00 45.90 ? 456 SER E OG 1 ATOM 4255 N N . ARG C 1 133 ? 79.677 73.181 67.881 1.00 48.07 ? 457 ARG E N 1 ATOM 4256 C CA . ARG C 1 133 ? 78.796 73.965 67.021 1.00 50.91 ? 457 ARG E CA 1 ATOM 4257 C C . ARG C 1 133 ? 78.773 73.401 65.590 1.00 50.68 ? 457 ARG E C 1 ATOM 4258 O O . ARG C 1 133 ? 78.321 74.065 64.654 1.00 51.18 ? 457 ARG E O 1 ATOM 4259 C CB . ARG C 1 133 ? 79.210 75.446 67.056 1.00 52.57 ? 457 ARG E CB 1 ATOM 4260 C CG . ARG C 1 133 ? 80.681 75.717 66.750 1.00 54.53 ? 457 ARG E CG 1 ATOM 4261 C CD . ARG C 1 133 ? 81.052 77.192 66.941 1.00 56.12 ? 457 ARG E CD 1 ATOM 4262 N NE . ARG C 1 133 ? 80.563 78.055 65.864 1.00 57.79 ? 457 ARG E NE 1 ATOM 4263 C CZ . ARG C 1 133 ? 79.419 78.739 65.888 1.00 59.17 ? 457 ARG E CZ 1 ATOM 4264 N NH1 . ARG C 1 133 ? 78.601 78.678 66.935 1.00 59.48 ? 457 ARG E NH1 1 ATOM 4265 N NH2 . ARG C 1 133 ? 79.087 79.499 64.849 1.00 59.80 ? 457 ARG E NH2 1 ATOM 4266 N N . ASP C 1 134 ? 79.249 72.162 65.453 1.00 50.07 ? 458 ASP E N 1 ATOM 4267 C CA . ASP C 1 134 ? 79.374 71.481 64.168 1.00 49.33 ? 458 ASP E CA 1 ATOM 4268 C C . ASP C 1 134 ? 78.302 70.387 63.993 1.00 48.18 ? 458 ASP E C 1 ATOM 4269 O O . ASP C 1 134 ? 78.120 69.858 62.893 1.00 45.53 ? 458 ASP E O 1 ATOM 4270 C CB . ASP C 1 134 ? 80.769 70.853 64.034 1.00 49.94 ? 458 ASP E CB 1 ATOM 4271 C CG . ASP C 1 134 ? 81.888 71.893 63.809 1.00 51.02 ? 458 ASP E CG 1 ATOM 4272 O OD1 . ASP C 1 134 ? 81.585 73.066 63.465 1.00 51.14 ? 458 ASP E OD1 1 ATOM 4273 O OD2 . ASP C 1 134 ? 83.079 71.525 63.973 1.00 50.63 ? 458 ASP E OD2 1 ATOM 4274 N N . LYS C 1 135 ? 77.619 70.040 65.083 1.00 47.39 ? 459 LYS E N 1 ATOM 4275 C CA . LYS C 1 135 ? 76.563 69.039 65.048 1.00 47.82 ? 459 LYS E CA 1 ATOM 4276 C C . LYS C 1 135 ? 75.439 69.374 66.024 1.00 46.28 ? 459 LYS E C 1 ATOM 4277 O O . LYS C 1 135 ? 75.664 70.070 67.012 1.00 45.96 ? 459 LYS E O 1 ATOM 4278 C CB . LYS C 1 135 ? 77.136 67.639 65.323 1.00 49.25 ? 459 LYS E CB 1 ATOM 4279 C CG . LYS C 1 135 ? 77.921 67.099 64.130 1.00 50.66 ? 459 LYS E CG 1 ATOM 4280 C CD . LYS C 1 135 ? 78.440 65.682 64.333 1.00 51.64 ? 459 LYS E CD 1 ATOM 4281 C CE . LYS C 1 135 ? 79.371 65.277 63.176 1.00 51.56 ? 459 LYS E CE 1 ATOM 4282 N NZ . LYS C 1 135 ? 79.933 63.911 63.388 1.00 52.06 ? 459 LYS E NZ 1 ATOM 4283 N N . ARG C 1 136 ? 74.225 68.913 65.701 1.00 44.84 ? 460 ARG E N 1 ATOM 4284 C CA . ARG C 1 136 ? 73.059 69.016 66.588 1.00 43.00 ? 460 ARG E CA 1 ATOM 4285 C C . ARG C 1 136 ? 72.236 67.745 66.548 1.00 40.05 ? 460 ARG E C 1 ATOM 4286 O O . ARG C 1 136 ? 72.325 66.969 65.616 1.00 38.82 ? 460 ARG E O 1 ATOM 4287 C CB . ARG C 1 136 ? 72.117 70.145 66.199 1.00 44.00 ? 460 ARG E CB 1 ATOM 4288 C CG . ARG C 1 136 ? 72.711 71.509 66.204 1.00 45.62 ? 460 ARG E CG 1 ATOM 4289 C CD . ARG C 1 136 ? 72.973 72.049 67.611 1.00 46.97 ? 460 ARG E CD 1 ATOM 4290 N NE . ARG C 1 136 ? 73.326 73.457 67.473 1.00 48.26 ? 460 ARG E NE 1 ATOM 4291 C CZ . ARG C 1 136 ? 72.464 74.457 67.562 1.00 49.42 ? 460 ARG E CZ 1 ATOM 4292 N NH1 . ARG C 1 136 ? 71.191 74.225 67.866 1.00 50.42 ? 460 ARG E NH1 1 ATOM 4293 N NH2 . ARG C 1 136 ? 72.886 75.698 67.367 1.00 51.02 ? 460 ARG E NH2 1 ATOM 4294 N N . THR C 1 137 ? 71.401 67.561 67.562 1.00 38.22 ? 461 THR E N 1 ATOM 4295 C CA . THR C 1 137 ? 70.484 66.440 67.571 1.00 37.33 ? 461 THR E CA 1 ATOM 4296 C C . THR C 1 137 ? 69.042 66.969 67.475 1.00 35.80 ? 461 THR E C 1 ATOM 4297 O O . THR C 1 137 ? 68.629 67.830 68.238 1.00 36.83 ? 461 THR E O 1 ATOM 4298 C CB . THR C 1 137 ? 70.674 65.559 68.821 1.00 36.97 ? 461 THR E CB 1 ATOM 4299 O OG1 . THR C 1 137 ? 72.070 65.311 69.016 1.00 37.34 ? 461 THR E OG1 1 ATOM 4300 C CG2 . THR C 1 137 ? 69.950 64.228 68.651 1.00 35.85 ? 461 THR E CG2 1 ATOM 4301 N N . LEU C 1 138 ? 68.313 66.482 66.483 1.00 34.32 ? 462 LEU E N 1 ATOM 4302 C CA . LEU C 1 138 ? 66.891 66.764 66.341 1.00 32.47 ? 462 LEU E CA 1 ATOM 4303 C C . LEU C 1 138 ? 66.076 65.629 66.916 1.00 31.50 ? 462 LEU E C 1 ATOM 4304 O O . LEU C 1 138 ? 66.465 64.471 66.854 1.00 33.21 ? 462 LEU E O 1 ATOM 4305 C CB . LEU C 1 138 ? 66.513 66.982 64.867 1.00 31.51 ? 462 LEU E CB 1 ATOM 4306 C CG . LEU C 1 138 ? 67.229 68.113 64.126 1.00 30.62 ? 462 LEU E CG 1 ATOM 4307 C CD1 . LEU C 1 138 ? 66.639 68.205 62.725 1.00 30.11 ? 462 LEU E CD1 1 ATOM 4308 C CD2 . LEU C 1 138 ? 67.181 69.467 64.877 1.00 29.88 ? 462 LEU E CD2 1 ATOM 4309 N N . ALA C 1 139 ? 64.951 65.991 67.514 1.00 32.41 ? 463 ALA E N 1 ATOM 4310 C CA . ALA C 1 139 ? 64.044 65.048 68.160 1.00 31.75 ? 463 ALA E CA 1 ATOM 4311 C C . ALA C 1 139 ? 62.617 65.296 67.666 1.00 31.01 ? 463 ALA E C 1 ATOM 4312 O O . ALA C 1 139 ? 62.185 66.412 67.448 1.00 29.83 ? 463 ALA E O 1 ATOM 4313 C CB . ALA C 1 139 ? 64.111 65.185 69.685 1.00 32.31 ? 463 ALA E CB 1 ATOM 4314 N N . CYS C 1 140 ? 61.885 64.214 67.491 1.00 33.48 ? 464 CYS E N 1 ATOM 4315 C CA . CYS C 1 140 ? 60.493 64.266 67.093 1.00 33.96 ? 464 CYS E CA 1 ATOM 4316 C C . CYS C 1 140 ? 59.668 63.382 68.020 1.00 33.26 ? 464 CYS E C 1 ATOM 4317 O O . CYS C 1 140 ? 60.046 62.259 68.293 1.00 33.75 ? 464 CYS E O 1 ATOM 4318 C CB . CYS C 1 140 ? 60.361 63.825 65.642 1.00 33.72 ? 464 CYS E CB 1 ATOM 4319 S SG . CYS C 1 140 ? 58.748 64.174 64.914 1.00 36.47 ? 464 CYS E SG 1 ATOM 4320 N N . LEU C 1 141 ? 58.556 63.919 68.519 1.00 34.64 ? 465 LEU E N 1 ATOM 4321 C CA . LEU C 1 141 ? 57.539 63.145 69.238 1.00 33.76 ? 465 LEU E CA 1 ATOM 4322 C C . LEU C 1 141 ? 56.262 63.059 68.386 1.00 33.49 ? 465 LEU E C 1 ATOM 4323 O O . LEU C 1 141 ? 55.695 64.079 68.022 1.00 31.08 ? 465 LEU E O 1 ATOM 4324 C CB . LEU C 1 141 ? 57.223 63.793 70.591 1.00 33.71 ? 465 LEU E CB 1 ATOM 4325 C CG . LEU C 1 141 ? 56.102 63.203 71.481 1.00 32.40 ? 465 LEU E CG 1 ATOM 4326 C CD1 . LEU C 1 141 ? 56.313 61.711 71.852 1.00 29.92 ? 465 LEU E CD1 1 ATOM 4327 C CD2 . LEU C 1 141 ? 55.943 64.070 72.720 1.00 31.67 ? 465 LEU E CD2 1 ATOM 4328 N N . ILE C 1 142 ? 55.900 61.828 68.011 1.00 33.32 ? 466 ILE E N 1 ATOM 4329 C CA . ILE C 1 142 ? 54.647 61.489 67.339 1.00 31.86 ? 466 ILE E CA 1 ATOM 4330 C C . ILE C 1 142 ? 53.766 60.732 68.340 1.00 30.05 ? 466 ILE E C 1 ATOM 4331 O O . ILE C 1 142 ? 54.166 59.689 68.861 1.00 29.51 ? 466 ILE E O 1 ATOM 4332 C CB . ILE C 1 142 ? 54.876 60.611 66.076 1.00 32.99 ? 466 ILE E CB 1 ATOM 4333 C CG1 . ILE C 1 142 ? 56.063 61.140 65.270 1.00 34.58 ? 466 ILE E CG1 1 ATOM 4334 C CG2 . ILE C 1 142 ? 53.618 60.540 65.182 1.00 33.27 ? 466 ILE E CG2 1 ATOM 4335 C CD1 . ILE C 1 142 ? 55.895 62.575 64.885 1.00 37.31 ? 466 ILE E CD1 1 ATOM 4336 N N . GLN C 1 143 ? 52.579 61.259 68.624 1.00 28.41 ? 467 GLN E N 1 ATOM 4337 C CA . GLN C 1 143 ? 51.753 60.726 69.712 1.00 28.48 ? 467 GLN E CA 1 ATOM 4338 C C . GLN C 1 143 ? 50.246 60.808 69.459 1.00 29.64 ? 467 GLN E C 1 ATOM 4339 O O . GLN C 1 143 ? 49.766 61.578 68.601 1.00 26.53 ? 467 GLN E O 1 ATOM 4340 C CB . GLN C 1 143 ? 52.075 61.450 71.024 1.00 29.60 ? 467 GLN E CB 1 ATOM 4341 C CG . GLN C 1 143 ? 51.722 62.937 71.041 1.00 29.57 ? 467 GLN E CG 1 ATOM 4342 C CD . GLN C 1 143 ? 51.949 63.522 72.416 1.00 31.10 ? 467 GLN E CD 1 ATOM 4343 O OE1 . GLN C 1 143 ? 52.815 63.047 73.144 1.00 32.42 ? 467 GLN E OE1 1 ATOM 4344 N NE2 . GLN C 1 143 ? 51.178 64.538 72.787 1.00 30.14 ? 467 GLN E NE2 1 ATOM 4345 N N . ASN C 1 144 ? 49.538 59.994 70.244 1.00 30.80 ? 468 ASN E N 1 ATOM 4346 C CA . ASN C 1 144 ? 48.082 59.916 70.317 1.00 31.59 ? 468 ASN E CA 1 ATOM 4347 C C . ASN C 1 144 ? 47.464 59.460 69.006 1.00 32.85 ? 468 ASN E C 1 ATOM 4348 O O . ASN C 1 144 ? 46.437 59.999 68.602 1.00 34.04 ? 468 ASN E O 1 ATOM 4349 C CB . ASN C 1 144 ? 47.463 61.255 70.730 1.00 31.83 ? 468 ASN E CB 1 ATOM 4350 C CG . ASN C 1 144 ? 47.938 61.717 72.091 1.00 30.44 ? 468 ASN E CG 1 ATOM 4351 O OD1 . ASN C 1 144 ? 48.292 60.916 72.945 1.00 30.70 ? 468 ASN E OD1 1 ATOM 4352 N ND2 . ASN C 1 144 ? 47.983 63.007 72.274 1.00 27.80 ? 468 ASN E ND2 1 ATOM 4353 N N . PHE C 1 145 ? 48.113 58.489 68.353 1.00 31.84 ? 469 PHE E N 1 ATOM 4354 C CA . PHE C 1 145 ? 47.598 57.892 67.138 1.00 29.57 ? 469 PHE E CA 1 ATOM 4355 C C . PHE C 1 145 ? 47.147 56.472 67.403 1.00 29.96 ? 469 PHE E C 1 ATOM 4356 O O . PHE C 1 145 ? 47.592 55.816 68.349 1.00 29.11 ? 469 PHE E O 1 ATOM 4357 C CB . PHE C 1 145 ? 48.611 57.974 65.991 1.00 28.33 ? 469 PHE E CB 1 ATOM 4358 C CG . PHE C 1 145 ? 49.941 57.333 66.285 1.00 26.73 ? 469 PHE E CG 1 ATOM 4359 C CD1 . PHE C 1 145 ? 50.153 55.991 65.988 1.00 25.57 ? 469 PHE E CD1 1 ATOM 4360 C CD2 . PHE C 1 145 ? 50.967 58.060 66.851 1.00 25.88 ? 469 PHE E CD2 1 ATOM 4361 C CE1 . PHE C 1 145 ? 51.378 55.406 66.225 1.00 26.79 ? 469 PHE E CE1 1 ATOM 4362 C CE2 . PHE C 1 145 ? 52.191 57.478 67.103 1.00 26.59 ? 469 PHE E CE2 1 ATOM 4363 C CZ . PHE C 1 145 ? 52.403 56.145 66.795 1.00 26.36 ? 469 PHE E CZ 1 ATOM 4364 N N . MET C 1 146 ? 46.176 56.031 66.616 1.00 31.71 ? 470 MET E N 1 ATOM 4365 C CA . MET C 1 146 ? 45.781 54.637 66.620 1.00 32.99 ? 470 MET E CA 1 ATOM 4366 C C . MET C 1 146 ? 45.190 54.333 65.255 1.00 32.42 ? 470 MET E C 1 ATOM 4367 O O . MET C 1 146 ? 44.621 55.216 64.625 1.00 30.95 ? 470 MET E O 1 ATOM 4368 C CB . MET C 1 146 ? 44.817 54.291 67.778 1.00 35.99 ? 470 MET E CB 1 ATOM 4369 C CG . MET C 1 146 ? 43.658 55.241 67.999 1.00 37.77 ? 470 MET E CG 1 ATOM 4370 S SD . MET C 1 146 ? 42.787 55.064 69.605 1.00 40.01 ? 470 MET E SD 1 ATOM 4371 C CE . MET C 1 146 ? 42.498 53.295 69.737 1.00 39.92 ? 470 MET E CE 1 ATOM 4372 N N . PRO C 1 147 ? 45.417 53.109 64.748 1.00 31.36 ? 471 PRO E N 1 ATOM 4373 C CA . PRO C 1 147 ? 46.253 52.065 65.369 1.00 31.59 ? 471 PRO E CA 1 ATOM 4374 C C . PRO C 1 147 ? 47.759 52.414 65.373 1.00 30.46 ? 471 PRO E C 1 ATOM 4375 O O . PRO C 1 147 ? 48.140 53.531 65.026 1.00 26.12 ? 471 PRO E O 1 ATOM 4376 C CB . PRO C 1 147 ? 45.929 50.802 64.551 1.00 31.59 ? 471 PRO E CB 1 ATOM 4377 C CG . PRO C 1 147 ? 45.432 51.304 63.243 1.00 32.05 ? 471 PRO E CG 1 ATOM 4378 C CD . PRO C 1 147 ? 44.796 52.666 63.494 1.00 31.99 ? 471 PRO E CD 1 ATOM 4379 N N . GLU C 1 148 ? 48.583 51.461 65.787 1.00 31.03 ? 472 GLU E N 1 ATOM 4380 C CA . GLU C 1 148 ? 50.010 51.678 66.005 1.00 33.35 ? 472 GLU E CA 1 ATOM 4381 C C . GLU C 1 148 ? 50.908 51.782 64.780 1.00 32.70 ? 472 GLU E C 1 ATOM 4382 O O . GLU C 1 148 ? 52.048 52.215 64.922 1.00 33.59 ? 472 GLU E O 1 ATOM 4383 C CB . GLU C 1 148 ? 50.570 50.588 66.904 1.00 34.79 ? 472 GLU E CB 1 ATOM 4384 C CG . GLU C 1 148 ? 50.400 49.212 66.358 1.00 37.96 ? 472 GLU E CG 1 ATOM 4385 C CD . GLU C 1 148 ? 50.841 48.197 67.369 1.00 40.38 ? 472 GLU E CD 1 ATOM 4386 O OE1 . GLU C 1 148 ? 50.133 47.177 67.522 1.00 42.37 ? 472 GLU E OE1 1 ATOM 4387 O OE2 . GLU C 1 148 ? 51.884 48.448 68.026 1.00 42.33 ? 472 GLU E OE2 1 ATOM 4388 N N . ASP C 1 149 ? 50.409 51.379 63.615 1.00 32.88 ? 473 ASP E N 1 ATOM 4389 C CA . ASP C 1 149 ? 51.154 51.432 62.354 1.00 33.39 ? 473 ASP E CA 1 ATOM 4390 C C . ASP C 1 149 ? 51.406 52.842 61.849 1.00 32.41 ? 473 ASP E C 1 ATOM 4391 O O . ASP C 1 149 ? 50.503 53.544 61.433 1.00 30.55 ? 473 ASP E O 1 ATOM 4392 C CB . ASP C 1 149 ? 50.430 50.659 61.258 1.00 35.03 ? 473 ASP E CB 1 ATOM 4393 C CG . ASP C 1 149 ? 50.440 49.159 61.497 1.00 37.03 ? 473 ASP E CG 1 ATOM 4394 O OD1 . ASP C 1 149 ? 51.175 48.676 62.389 1.00 37.32 ? 473 ASP E OD1 1 ATOM 4395 O OD2 . ASP C 1 149 ? 49.689 48.460 60.788 1.00 39.55 ? 473 ASP E OD2 1 ATOM 4396 N N . ILE C 1 150 ? 52.674 53.228 61.857 1.00 32.58 ? 474 ILE E N 1 ATOM 4397 C CA . ILE C 1 150 ? 53.066 54.563 61.458 1.00 32.56 ? 474 ILE E CA 1 ATOM 4398 C C . ILE C 1 150 ? 54.440 54.518 60.759 1.00 33.22 ? 474 ILE E C 1 ATOM 4399 O O . ILE C 1 150 ? 55.303 53.684 61.078 1.00 33.08 ? 474 ILE E O 1 ATOM 4400 C CB . ILE C 1 150 ? 53.039 55.491 62.684 1.00 32.35 ? 474 ILE E CB 1 ATOM 4401 C CG1 . ILE C 1 150 ? 53.099 56.952 62.251 1.00 32.45 ? 474 ILE E CG1 1 ATOM 4402 C CG2 . ILE C 1 150 ? 54.124 55.083 63.708 1.00 33.49 ? 474 ILE E CG2 1 ATOM 4403 C CD1 . ILE C 1 150 ? 52.563 57.920 63.278 1.00 33.43 ? 474 ILE E CD1 1 ATOM 4404 N N . SER C 1 151 ? 54.609 55.369 59.754 1.00 32.93 ? 475 SER E N 1 ATOM 4405 C CA . SER C 1 151 ? 55.887 55.540 59.081 1.00 31.59 ? 475 SER E CA 1 ATOM 4406 C C . SER C 1 151 ? 56.435 56.910 59.472 1.00 32.80 ? 475 SER E C 1 ATOM 4407 O O . SER C 1 151 ? 55.763 57.921 59.309 1.00 31.62 ? 475 SER E O 1 ATOM 4408 C CB . SER C 1 151 ? 55.721 55.462 57.559 1.00 30.85 ? 475 SER E CB 1 ATOM 4409 O OG . SER C 1 151 ? 55.559 54.140 57.092 1.00 30.19 ? 475 SER E OG 1 ATOM 4410 N N . VAL C 1 152 ? 57.656 56.947 60.007 1.00 34.59 ? 476 VAL E N 1 ATOM 4411 C CA . VAL C 1 152 ? 58.283 58.221 60.379 1.00 34.34 ? 476 VAL E CA 1 ATOM 4412 C C . VAL C 1 152 ? 59.405 58.477 59.394 1.00 35.26 ? 476 VAL E C 1 ATOM 4413 O O . VAL C 1 152 ? 60.171 57.576 59.062 1.00 33.46 ? 476 VAL E O 1 ATOM 4414 C CB . VAL C 1 152 ? 58.831 58.188 61.820 1.00 34.13 ? 476 VAL E CB 1 ATOM 4415 C CG1 . VAL C 1 152 ? 59.503 59.499 62.184 1.00 34.63 ? 476 VAL E CG1 1 ATOM 4416 C CG2 . VAL C 1 152 ? 57.704 57.879 62.795 1.00 35.16 ? 476 VAL E CG2 1 ATOM 4417 N N . GLN C 1 153 ? 59.479 59.697 58.879 1.00 35.63 ? 477 GLN E N 1 ATOM 4418 C CA . GLN C 1 153 ? 60.606 60.048 58.045 1.00 37.44 ? 477 GLN E CA 1 ATOM 4419 C C . GLN C 1 153 ? 61.034 61.500 58.291 1.00 36.63 ? 477 GLN E C 1 ATOM 4420 O O . GLN C 1 153 ? 60.274 62.311 58.809 1.00 35.39 ? 477 GLN E O 1 ATOM 4421 C CB . GLN C 1 153 ? 60.266 59.762 56.583 1.00 39.56 ? 477 GLN E CB 1 ATOM 4422 C CG . GLN C 1 153 ? 59.049 60.496 56.129 1.00 42.22 ? 477 GLN E CG 1 ATOM 4423 C CD . GLN C 1 153 ? 58.350 59.861 54.970 1.00 42.43 ? 477 GLN E CD 1 ATOM 4424 O OE1 . GLN C 1 153 ? 57.633 60.538 54.258 1.00 44.43 ? 477 GLN E OE1 1 ATOM 4425 N NE2 . GLN C 1 153 ? 58.560 58.571 54.760 1.00 44.14 ? 477 GLN E NE2 1 ATOM 4426 N N . TRP C 1 154 ? 62.295 61.786 58.009 1.00 34.81 ? 478 TRP E N 1 ATOM 4427 C CA . TRP C 1 154 ? 62.794 63.135 58.078 1.00 34.54 ? 478 TRP E CA 1 ATOM 4428 C C . TRP C 1 154 ? 63.089 63.649 56.680 1.00 34.20 ? 478 TRP E C 1 ATOM 4429 O O . TRP C 1 154 ? 63.585 62.934 55.826 1.00 34.20 ? 478 TRP E O 1 ATOM 4430 C CB . TRP C 1 154 ? 64.068 63.193 58.921 1.00 34.30 ? 478 TRP E CB 1 ATOM 4431 C CG . TRP C 1 154 ? 63.860 62.998 60.392 1.00 33.75 ? 478 TRP E CG 1 ATOM 4432 C CD1 . TRP C 1 154 ? 63.903 61.817 61.072 1.00 33.72 ? 478 TRP E CD1 1 ATOM 4433 C CD2 . TRP C 1 154 ? 63.664 64.018 61.369 1.00 32.39 ? 478 TRP E CD2 1 ATOM 4434 N NE1 . TRP C 1 154 ? 63.743 62.031 62.410 1.00 34.23 ? 478 TRP E NE1 1 ATOM 4435 C CE2 . TRP C 1 154 ? 63.607 63.381 62.624 1.00 34.03 ? 478 TRP E CE2 1 ATOM 4436 C CE3 . TRP C 1 154 ? 63.585 65.409 61.315 1.00 31.37 ? 478 TRP E CE3 1 ATOM 4437 C CZ2 . TRP C 1 154 ? 63.425 64.089 63.805 1.00 31.48 ? 478 TRP E CZ2 1 ATOM 4438 C CZ3 . TRP C 1 154 ? 63.382 66.098 62.475 1.00 31.37 ? 478 TRP E CZ3 1 ATOM 4439 C CH2 . TRP C 1 154 ? 63.302 65.444 63.703 1.00 30.52 ? 478 TRP E CH2 1 ATOM 4440 N N . LEU C 1 155 ? 62.819 64.926 56.470 1.00 34.91 ? 479 LEU E N 1 ATOM 4441 C CA . LEU C 1 155 ? 63.058 65.545 55.188 1.00 35.57 ? 479 LEU E CA 1 ATOM 4442 C C . LEU C 1 155 ? 63.972 66.735 55.324 1.00 35.24 ? 479 LEU E C 1 ATOM 4443 O O . LEU C 1 155 ? 63.860 67.523 56.262 1.00 34.92 ? 479 LEU E O 1 ATOM 4444 C CB . LEU C 1 155 ? 61.725 65.985 54.555 1.00 37.03 ? 479 LEU E CB 1 ATOM 4445 C CG . LEU C 1 155 ? 60.893 64.810 54.059 1.00 37.42 ? 479 LEU E CG 1 ATOM 4446 C CD1 . LEU C 1 155 ? 59.918 64.413 55.117 1.00 37.13 ? 479 LEU E CD1 1 ATOM 4447 C CD2 . LEU C 1 155 ? 60.186 65.201 52.768 1.00 40.56 ? 479 LEU E CD2 1 ATOM 4448 N N . HIS C 1 156 ? 64.876 66.864 54.366 1.00 35.56 ? 480 HIS E N 1 ATOM 4449 C CA . HIS C 1 156 ? 65.723 68.054 54.262 1.00 36.70 ? 480 HIS E CA 1 ATOM 4450 C C . HIS C 1 156 ? 65.750 68.460 52.787 1.00 37.07 ? 480 HIS E C 1 ATOM 4451 O O . HIS C 1 156 ? 65.795 67.596 51.927 1.00 35.24 ? 480 HIS E O 1 ATOM 4452 C CB . HIS C 1 156 ? 67.123 67.776 54.819 1.00 34.99 ? 480 HIS E CB 1 ATOM 4453 C CG . HIS C 1 156 ? 67.995 68.991 54.893 1.00 35.04 ? 480 HIS E CG 1 ATOM 4454 N ND1 . HIS C 1 156 ? 69.253 69.037 54.327 1.00 34.50 ? 480 HIS E ND1 1 ATOM 4455 C CD2 . HIS C 1 156 ? 67.790 70.206 55.454 1.00 33.78 ? 480 HIS E CD2 1 ATOM 4456 C CE1 . HIS C 1 156 ? 69.778 70.234 54.524 1.00 34.47 ? 480 HIS E CE1 1 ATOM 4457 N NE2 . HIS C 1 156 ? 68.917 70.958 55.215 1.00 35.01 ? 480 HIS E NE2 1 ATOM 4458 N N . ASN C 1 157 ? 65.650 69.753 52.494 1.00 40.50 ? 481 ASN E N 1 ATOM 4459 C CA . ASN C 1 157 ? 65.508 70.217 51.099 1.00 44.84 ? 481 ASN E CA 1 ATOM 4460 C C . ASN C 1 157 ? 64.470 69.446 50.304 1.00 47.42 ? 481 ASN E C 1 ATOM 4461 O O . ASN C 1 157 ? 64.726 69.007 49.184 1.00 50.07 ? 481 ASN E O 1 ATOM 4462 C CB . ASN C 1 157 ? 66.822 70.106 50.323 1.00 44.70 ? 481 ASN E CB 1 ATOM 4463 C CG . ASN C 1 157 ? 67.850 71.067 50.805 1.00 45.64 ? 481 ASN E CG 1 ATOM 4464 O OD1 . ASN C 1 157 ? 67.774 72.260 50.531 1.00 47.33 ? 481 ASN E OD1 1 ATOM 4465 N ND2 . ASN C 1 157 ? 68.837 70.555 51.518 1.00 47.64 ? 481 ASN E ND2 1 ATOM 4466 N N . GLU C 1 158 ? 63.302 69.263 50.891 1.00 49.93 ? 482 GLU E N 1 ATOM 4467 C CA . GLU C 1 158 ? 62.182 68.677 50.179 1.00 51.73 ? 482 GLU E CA 1 ATOM 4468 C C . GLU C 1 158 ? 62.335 67.158 50.038 1.00 51.85 ? 482 GLU E C 1 ATOM 4469 O O . GLU C 1 158 ? 61.334 66.428 49.904 1.00 51.84 ? 482 GLU E O 1 ATOM 4470 C CB . GLU C 1 158 ? 61.980 69.411 48.842 1.00 52.32 ? 482 GLU E CB 1 ATOM 4471 C CG . GLU C 1 158 ? 62.132 70.951 48.949 1.00 52.59 ? 482 GLU E CG 1 ATOM 4472 C CD . GLU C 1 158 ? 61.491 71.512 50.215 1.00 53.38 ? 482 GLU E CD 1 ATOM 4473 O OE1 . GLU C 1 158 ? 60.294 71.225 50.424 1.00 54.88 ? 482 GLU E OE1 1 ATOM 4474 O OE2 . GLU C 1 158 ? 62.170 72.208 51.012 1.00 53.13 ? 482 GLU E OE2 1 ATOM 4475 N N . VAL C 1 159 ? 63.573 66.678 50.149 1.00 50.63 ? 483 VAL E N 1 ATOM 4476 C CA . VAL C 1 159 ? 63.829 65.250 49.991 1.00 49.64 ? 483 VAL E CA 1 ATOM 4477 C C . VAL C 1 159 ? 63.932 64.462 51.297 1.00 47.71 ? 483 VAL E C 1 ATOM 4478 O O . VAL C 1 159 ? 64.520 64.893 52.282 1.00 47.27 ? 483 VAL E O 1 ATOM 4479 C CB . VAL C 1 159 ? 65.092 64.971 49.128 1.00 50.63 ? 483 VAL E CB 1 ATOM 4480 C CG1 . VAL C 1 159 ? 66.340 65.578 49.753 1.00 51.04 ? 483 VAL E CG1 1 ATOM 4481 C CG2 . VAL C 1 159 ? 65.264 63.464 48.942 1.00 50.92 ? 483 VAL E CG2 1 ATOM 4482 N N . GLN C 1 160 ? 63.354 63.275 51.279 1.00 45.76 ? 484 GLN E N 1 ATOM 4483 C CA . GLN C 1 160 ? 63.497 62.342 52.364 1.00 44.88 ? 484 GLN E CA 1 ATOM 4484 C C . GLN C 1 160 ? 64.954 61.879 52.559 1.00 44.35 ? 484 GLN E C 1 ATOM 4485 O O . GLN C 1 160 ? 65.615 61.405 51.635 1.00 43.98 ? 484 GLN E O 1 ATOM 4486 C CB . GLN C 1 160 ? 62.578 61.158 52.084 1.00 45.08 ? 484 GLN E CB 1 ATOM 4487 C CG . GLN C 1 160 ? 62.311 60.208 53.234 1.00 44.98 ? 484 GLN E CG 1 ATOM 4488 C CD . GLN C 1 160 ? 61.468 59.018 52.772 1.00 45.72 ? 484 GLN E CD 1 ATOM 4489 O OE1 . GLN C 1 160 ? 61.432 57.961 53.411 1.00 47.24 ? 484 GLN E OE1 1 ATOM 4490 N NE2 . GLN C 1 160 ? 60.778 59.193 51.654 1.00 44.96 ? 484 GLN E NE2 1 ATOM 4491 N N . LEU C 1 161 ? 65.445 62.014 53.788 1.00 42.67 ? 485 LEU E N 1 ATOM 4492 C CA . LEU C 1 161 ? 66.759 61.529 54.160 1.00 41.69 ? 485 LEU E CA 1 ATOM 4493 C C . LEU C 1 161 ? 66.740 59.999 54.230 1.00 42.53 ? 485 LEU E C 1 ATOM 4494 O O . LEU C 1 161 ? 65.675 59.399 54.365 1.00 41.26 ? 485 LEU E O 1 ATOM 4495 C CB . LEU C 1 161 ? 67.194 62.148 55.502 1.00 41.47 ? 485 LEU E CB 1 ATOM 4496 C CG . LEU C 1 161 ? 67.426 63.676 55.511 1.00 41.19 ? 485 LEU E CG 1 ATOM 4497 C CD1 . LEU C 1 161 ? 67.590 64.216 56.926 1.00 39.53 ? 485 LEU E CD1 1 ATOM 4498 C CD2 . LEU C 1 161 ? 68.646 64.083 54.644 1.00 39.92 ? 485 LEU E CD2 1 ATOM 4499 N N . PRO C 1 162 ? 67.915 59.355 54.089 1.00 43.87 ? 486 PRO E N 1 ATOM 4500 C CA . PRO C 1 162 ? 68.031 57.902 54.261 1.00 45.06 ? 486 PRO E CA 1 ATOM 4501 C C . PRO C 1 162 ? 67.534 57.417 55.626 1.00 46.27 ? 486 PRO E C 1 ATOM 4502 O O . PRO C 1 162 ? 67.737 58.090 56.642 1.00 45.99 ? 486 PRO E O 1 ATOM 4503 C CB . PRO C 1 162 ? 69.540 57.651 54.168 1.00 45.16 ? 486 PRO E CB 1 ATOM 4504 C CG . PRO C 1 162 ? 70.087 58.813 53.409 1.00 45.01 ? 486 PRO E CG 1 ATOM 4505 C CD . PRO C 1 162 ? 69.207 59.981 53.757 1.00 44.37 ? 486 PRO E CD 1 ATOM 4506 N N . ASP C 1 163 ? 66.903 56.248 55.647 1.00 47.49 ? 487 ASP E N 1 ATOM 4507 C CA . ASP C 1 163 ? 66.349 55.692 56.880 1.00 48.46 ? 487 ASP E CA 1 ATOM 4508 C C . ASP C 1 163 ? 67.431 55.385 57.915 1.00 46.63 ? 487 ASP E C 1 ATOM 4509 O O . ASP C 1 163 ? 67.170 55.456 59.112 1.00 46.86 ? 487 ASP E O 1 ATOM 4510 C CB . ASP C 1 163 ? 65.519 54.440 56.572 1.00 50.51 ? 487 ASP E CB 1 ATOM 4511 C CG . ASP C 1 163 ? 64.243 54.774 55.840 1.00 52.51 ? 487 ASP E CG 1 ATOM 4512 O OD1 . ASP C 1 163 ? 63.961 55.984 55.687 1.00 53.83 ? 487 ASP E OD1 1 ATOM 4513 O OD2 . ASP C 1 163 ? 63.524 53.843 55.424 1.00 54.20 ? 487 ASP E OD2 1 ATOM 4514 N N . ALA C 1 164 ? 68.642 55.084 57.455 1.00 45.42 ? 488 ALA E N 1 ATOM 4515 C CA . ALA C 1 164 ? 69.779 54.805 58.348 1.00 44.83 ? 488 ALA E CA 1 ATOM 4516 C C . ALA C 1 164 ? 70.178 56.024 59.176 1.00 43.96 ? 488 ALA E C 1 ATOM 4517 O O . ALA C 1 164 ? 70.820 55.899 60.213 1.00 43.84 ? 488 ALA E O 1 ATOM 4518 C CB . ALA C 1 164 ? 70.975 54.321 57.545 1.00 43.71 ? 488 ALA E CB 1 ATOM 4519 N N . ARG C 1 165 ? 69.797 57.201 58.693 1.00 43.96 ? 489 ARG E N 1 ATOM 4520 C CA . ARG C 1 165 ? 70.121 58.469 59.331 1.00 43.90 ? 489 ARG E CA 1 ATOM 4521 C C . ARG C 1 165 ? 69.460 58.691 60.691 1.00 43.17 ? 489 ARG E C 1 ATOM 4522 O O . ARG C 1 165 ? 70.044 59.323 61.549 1.00 43.57 ? 489 ARG E O 1 ATOM 4523 C CB . ARG C 1 165 ? 69.695 59.624 58.419 1.00 44.58 ? 489 ARG E CB 1 ATOM 4524 C CG . ARG C 1 165 ? 70.789 60.120 57.500 1.00 46.85 ? 489 ARG E CG 1 ATOM 4525 C CD . ARG C 1 165 ? 71.937 60.651 58.330 1.00 47.93 ? 489 ARG E CD 1 ATOM 4526 N NE . ARG C 1 165 ? 72.540 61.817 57.711 1.00 49.58 ? 489 ARG E NE 1 ATOM 4527 C CZ . ARG C 1 165 ? 72.313 63.080 58.045 1.00 50.73 ? 489 ARG E CZ 1 ATOM 4528 N NH1 . ARG C 1 165 ? 71.497 63.401 59.021 1.00 51.29 ? 489 ARG E NH1 1 ATOM 4529 N NH2 . ARG C 1 165 ? 72.940 64.044 57.391 1.00 53.27 ? 489 ARG E NH2 1 ATOM 4530 N N . HIS C 1 166 ? 68.214 58.248 60.835 1.00 41.82 ? 490 HIS E N 1 ATOM 4531 C CA . HIS C 1 166 ? 67.469 58.442 62.057 1.00 41.39 ? 490 HIS E CA 1 ATOM 4532 C C . HIS C 1 166 ? 67.216 57.126 62.780 1.00 41.24 ? 490 HIS E C 1 ATOM 4533 O O . HIS C 1 166 ? 67.412 56.031 62.236 1.00 39.29 ? 490 HIS E O 1 ATOM 4534 C CB . HIS C 1 166 ? 66.132 59.151 61.793 1.00 41.59 ? 490 HIS E CB 1 ATOM 4535 C CG . HIS C 1 166 ? 65.151 58.342 61.002 1.00 42.37 ? 490 HIS E CG 1 ATOM 4536 N ND1 . HIS C 1 166 ? 64.963 58.514 59.646 1.00 43.32 ? 490 HIS E ND1 1 ATOM 4537 C CD2 . HIS C 1 166 ? 64.284 57.373 61.379 1.00 42.75 ? 490 HIS E CD2 1 ATOM 4538 C CE1 . HIS C 1 166 ? 64.034 57.676 59.220 1.00 43.25 ? 490 HIS E CE1 1 ATOM 4539 N NE2 . HIS C 1 166 ? 63.602 56.974 60.252 1.00 43.43 ? 490 HIS E NE2 1 ATOM 4540 N N . SER C 1 167 ? 66.803 57.267 64.035 1.00 40.68 ? 491 SER E N 1 ATOM 4541 C CA . SER C 1 167 ? 66.478 56.142 64.879 1.00 41.20 ? 491 SER E CA 1 ATOM 4542 C C . SER C 1 167 ? 65.104 56.397 65.489 1.00 41.14 ? 491 SER E C 1 ATOM 4543 O O . SER C 1 167 ? 64.920 57.349 66.257 1.00 40.82 ? 491 SER E O 1 ATOM 4544 C CB . SER C 1 167 ? 67.538 55.977 65.965 1.00 41.57 ? 491 SER E CB 1 ATOM 4545 O OG . SER C 1 167 ? 67.252 54.853 66.760 1.00 41.84 ? 491 SER E OG 1 ATOM 4546 N N . THR C 1 168 ? 64.143 55.556 65.111 1.00 40.54 ? 492 THR E N 1 ATOM 4547 C CA . THR C 1 168 ? 62.772 55.648 65.596 1.00 39.64 ? 492 THR E CA 1 ATOM 4548 C C . THR C 1 168 ? 62.403 54.542 66.597 1.00 38.84 ? 492 THR E C 1 ATOM 4549 O O . THR C 1 168 ? 62.605 53.358 66.367 1.00 38.55 ? 492 THR E O 1 ATOM 4550 C CB . THR C 1 168 ? 61.766 55.698 64.411 1.00 39.93 ? 492 THR E CB 1 ATOM 4551 O OG1 . THR C 1 168 ? 62.053 56.838 63.591 1.00 40.26 ? 492 THR E OG1 1 ATOM 4552 C CG2 . THR C 1 168 ? 60.333 55.841 64.901 1.00 40.29 ? 492 THR E CG2 1 ATOM 4553 N N . THR C 1 169 ? 61.848 54.946 67.732 1.00 39.38 ? 493 THR E N 1 ATOM 4554 C CA . THR C 1 169 ? 61.438 53.992 68.748 1.00 40.08 ? 493 THR E CA 1 ATOM 4555 C C . THR C 1 169 ? 60.241 53.181 68.269 1.00 41.23 ? 493 THR E C 1 ATOM 4556 O O . THR C 1 169 ? 59.586 53.523 67.277 1.00 40.90 ? 493 THR E O 1 ATOM 4557 C CB . THR C 1 169 ? 61.068 54.658 70.096 1.00 39.86 ? 493 THR E CB 1 ATOM 4558 O OG1 . THR C 1 169 ? 59.854 55.410 69.941 1.00 39.91 ? 493 THR E OG1 1 ATOM 4559 C CG2 . THR C 1 169 ? 62.191 55.550 70.618 1.00 38.25 ? 493 THR E CG2 1 ATOM 4560 N N . GLN C 1 170 ? 60.013 52.063 68.953 1.00 42.41 ? 494 GLN E N 1 ATOM 4561 C CA . GLN C 1 170 ? 58.880 51.196 68.664 1.00 44.31 ? 494 GLN E CA 1 ATOM 4562 C C . GLN C 1 170 ? 57.641 51.754 69.378 1.00 42.47 ? 494 GLN E C 1 ATOM 4563 O O . GLN C 1 170 ? 57.752 52.269 70.490 1.00 40.71 ? 494 GLN E O 1 ATOM 4564 C CB . GLN C 1 170 ? 59.188 49.760 69.121 1.00 46.74 ? 494 GLN E CB 1 ATOM 4565 C CG . GLN C 1 170 ? 60.230 49.025 68.244 1.00 49.01 ? 494 GLN E CG 1 ATOM 4566 C CD . GLN C 1 170 ? 59.706 48.662 66.850 1.00 50.36 ? 494 GLN E CD 1 ATOM 4567 O OE1 . GLN C 1 170 ? 58.519 48.386 66.677 1.00 52.41 ? 494 GLN E OE1 1 ATOM 4568 N NE2 . GLN C 1 170 ? 60.586 48.673 65.856 1.00 51.80 ? 494 GLN E NE2 1 ATOM 4569 N N . PRO C 1 171 ? 56.462 51.653 68.746 1.00 42.23 ? 495 PRO E N 1 ATOM 4570 C CA . PRO C 1 171 ? 55.230 52.203 69.334 1.00 43.77 ? 495 PRO E CA 1 ATOM 4571 C C . PRO C 1 171 ? 54.936 51.740 70.764 1.00 44.71 ? 495 PRO E C 1 ATOM 4572 O O . PRO C 1 171 ? 54.814 50.543 71.015 1.00 44.19 ? 495 PRO E O 1 ATOM 4573 C CB . PRO C 1 171 ? 54.135 51.730 68.376 1.00 43.10 ? 495 PRO E CB 1 ATOM 4574 C CG . PRO C 1 171 ? 54.838 51.600 67.064 1.00 43.03 ? 495 PRO E CG 1 ATOM 4575 C CD . PRO C 1 171 ? 56.232 51.138 67.388 1.00 42.56 ? 495 PRO E CD 1 ATOM 4576 N N . ARG C 1 172 ? 54.848 52.703 71.680 1.00 46.11 ? 496 ARG E N 1 ATOM 4577 C CA . ARG C 1 172 ? 54.452 52.446 73.060 1.00 47.69 ? 496 ARG E CA 1 ATOM 4578 C C . ARG C 1 172 ? 53.067 53.049 73.319 1.00 47.59 ? 496 ARG E C 1 ATOM 4579 O O . ARG C 1 172 ? 52.614 53.926 72.585 1.00 45.78 ? 496 ARG E O 1 ATOM 4580 C CB . ARG C 1 172 ? 55.465 53.055 74.039 1.00 48.63 ? 496 ARG E CB 1 ATOM 4581 C CG . ARG C 1 172 ? 56.697 52.208 74.323 1.00 49.74 ? 496 ARG E CG 1 ATOM 4582 C CD . ARG C 1 172 ? 57.715 53.012 75.154 1.00 51.14 ? 496 ARG E CD 1 ATOM 4583 N NE . ARG C 1 172 ? 58.835 52.198 75.613 1.00 52.16 ? 496 ARG E NE 1 ATOM 4584 C CZ . ARG C 1 172 ? 58.904 51.568 76.785 1.00 52.03 ? 496 ARG E CZ 1 ATOM 4585 N NH1 . ARG C 1 172 ? 57.923 51.665 77.673 1.00 52.19 ? 496 ARG E NH1 1 ATOM 4586 N NH2 . ARG C 1 172 ? 59.984 50.849 77.075 1.00 52.37 ? 496 ARG E NH2 1 ATOM 4587 N N . LYS C 1 173 ? 52.409 52.579 74.375 1.00 48.68 ? 497 LYS E N 1 ATOM 4588 C CA . LYS C 1 173 ? 51.103 53.104 74.776 1.00 50.05 ? 497 LYS E CA 1 ATOM 4589 C C . LYS C 1 173 ? 51.207 54.393 75.595 1.00 50.51 ? 497 LYS E C 1 ATOM 4590 O O . LYS C 1 173 ? 52.009 54.502 76.527 1.00 51.40 ? 497 LYS E O 1 ATOM 4591 C CB . LYS C 1 173 ? 50.326 52.055 75.567 1.00 50.86 ? 497 LYS E CB 1 ATOM 4592 C CG . LYS C 1 173 ? 49.733 50.956 74.697 1.00 51.47 ? 497 LYS E CG 1 ATOM 4593 C CD . LYS C 1 173 ? 49.054 49.898 75.548 1.00 52.28 ? 497 LYS E CD 1 ATOM 4594 C CE . LYS C 1 173 ? 48.305 48.867 74.704 1.00 52.48 ? 497 LYS E CE 1 ATOM 4595 N NZ . LYS C 1 173 ? 47.551 47.924 75.579 1.00 52.59 ? 497 LYS E NZ 1 ATOM 4596 N N . THR C 1 174 ? 50.405 55.383 75.219 1.00 50.71 ? 498 THR E N 1 ATOM 4597 C CA . THR C 1 174 ? 50.291 56.610 75.990 1.00 50.77 ? 498 THR E CA 1 ATOM 4598 C C . THR C 1 174 ? 49.476 56.303 77.256 1.00 51.25 ? 498 THR E C 1 ATOM 4599 O O . THR C 1 174 ? 49.131 55.147 77.502 1.00 51.00 ? 498 THR E O 1 ATOM 4600 C CB . THR C 1 174 ? 49.595 57.719 75.182 1.00 50.46 ? 498 THR E CB 1 ATOM 4601 O OG1 . THR C 1 174 ? 48.213 57.387 75.010 1.00 50.70 ? 498 THR E OG1 1 ATOM 4602 C CG2 . THR C 1 174 ? 50.248 57.920 73.803 1.00 49.79 ? 498 THR E CG2 1 ATOM 4603 N N . LYS C 1 175 ? 49.187 57.329 78.058 1.00 52.04 ? 499 LYS E N 1 ATOM 4604 C CA . LYS C 1 175 ? 48.337 57.188 79.252 1.00 52.81 ? 499 LYS E CA 1 ATOM 4605 C C . LYS C 1 175 ? 46.879 56.954 78.849 1.00 52.01 ? 499 LYS E C 1 ATOM 4606 O O . LYS C 1 175 ? 46.090 56.405 79.615 1.00 52.73 ? 499 LYS E O 1 ATOM 4607 C CB . LYS C 1 175 ? 48.431 58.429 80.151 1.00 53.93 ? 499 LYS E CB 1 ATOM 4608 C CG . LYS C 1 175 ? 49.841 58.778 80.623 1.00 54.57 ? 499 LYS E CG 1 ATOM 4609 C CD . LYS C 1 175 ? 50.235 57.999 81.859 1.00 55.21 ? 499 LYS E CD 1 ATOM 4610 C CE . LYS C 1 175 ? 49.867 58.759 83.133 1.00 56.02 ? 499 LYS E CE 1 ATOM 4611 N NZ . LYS C 1 175 ? 50.634 60.054 83.273 1.00 56.50 ? 499 LYS E NZ 1 ATOM 4612 N N . GLY C 1 176 ? 46.523 57.383 77.644 1.00 51.01 ? 500 GLY E N 1 ATOM 4613 C CA . GLY C 1 176 ? 45.229 57.045 77.060 1.00 49.80 ? 500 GLY E CA 1 ATOM 4614 C C . GLY C 1 176 ? 45.301 55.758 76.260 1.00 48.67 ? 500 GLY E C 1 ATOM 4615 O O . GLY C 1 176 ? 45.986 54.807 76.639 1.00 48.11 ? 500 GLY E O 1 ATOM 4616 N N . SER C 1 177 ? 44.611 55.740 75.126 1.00 47.62 ? 501 SER E N 1 ATOM 4617 C CA . SER C 1 177 ? 44.530 54.536 74.300 1.00 46.78 ? 501 SER E CA 1 ATOM 4618 C C . SER C 1 177 ? 45.435 54.555 73.061 1.00 44.28 ? 501 SER E C 1 ATOM 4619 O O . SER C 1 177 ? 45.627 53.519 72.406 1.00 44.54 ? 501 SER E O 1 ATOM 4620 C CB . SER C 1 177 ? 43.086 54.322 73.853 1.00 47.48 ? 501 SER E CB 1 ATOM 4621 O OG . SER C 1 177 ? 42.981 53.067 73.211 1.00 49.06 ? 501 SER E OG 1 ATOM 4622 N N . GLY C 1 178 ? 45.984 55.726 72.742 1.00 40.73 ? 502 GLY E N 1 ATOM 4623 C CA . GLY C 1 178 ? 46.810 55.874 71.556 1.00 38.37 ? 502 GLY E CA 1 ATOM 4624 C C . GLY C 1 178 ? 48.259 55.494 71.781 1.00 36.27 ? 502 GLY E C 1 ATOM 4625 O O . GLY C 1 178 ? 48.706 55.257 72.890 1.00 35.65 ? 502 GLY E O 1 ATOM 4626 N N . PHE C 1 179 ? 49.018 55.454 70.700 1.00 35.96 ? 503 PHE E N 1 ATOM 4627 C CA . PHE C 1 179 ? 50.428 55.147 70.771 1.00 34.33 ? 503 PHE E CA 1 ATOM 4628 C C . PHE C 1 179 ? 51.322 56.385 70.591 1.00 33.76 ? 503 PHE E C 1 ATOM 4629 O O . PHE C 1 179 ? 50.869 57.467 70.238 1.00 33.43 ? 503 PHE E O 1 ATOM 4630 C CB . PHE C 1 179 ? 50.760 54.072 69.739 1.00 34.63 ? 503 PHE E CB 1 ATOM 4631 C CG . PHE C 1 179 ? 49.955 52.818 69.902 1.00 35.24 ? 503 PHE E CG 1 ATOM 4632 C CD1 . PHE C 1 179 ? 48.706 52.688 69.303 1.00 34.57 ? 503 PHE E CD1 1 ATOM 4633 C CD2 . PHE C 1 179 ? 50.447 51.762 70.663 1.00 35.02 ? 503 PHE E CD2 1 ATOM 4634 C CE1 . PHE C 1 179 ? 47.964 51.524 69.472 1.00 34.84 ? 503 PHE E CE1 1 ATOM 4635 C CE2 . PHE C 1 179 ? 49.721 50.603 70.832 1.00 35.03 ? 503 PHE E CE2 1 ATOM 4636 C CZ . PHE C 1 179 ? 48.469 50.481 70.244 1.00 34.94 ? 503 PHE E CZ 1 ATOM 4637 N N . PHE C 1 180 ? 52.608 56.219 70.885 1.00 33.11 ? 504 PHE E N 1 ATOM 4638 C CA . PHE C 1 180 ? 53.586 57.268 70.646 1.00 32.41 ? 504 PHE E CA 1 ATOM 4639 C C . PHE C 1 180 ? 54.891 56.632 70.200 1.00 32.50 ? 504 PHE E C 1 ATOM 4640 O O . PHE C 1 180 ? 55.172 55.469 70.483 1.00 32.57 ? 504 PHE E O 1 ATOM 4641 C CB . PHE C 1 180 ? 53.787 58.183 71.868 1.00 32.17 ? 504 PHE E CB 1 ATOM 4642 C CG . PHE C 1 180 ? 54.603 57.567 72.978 1.00 31.30 ? 504 PHE E CG 1 ATOM 4643 C CD1 . PHE C 1 180 ? 55.977 57.720 73.006 1.00 31.45 ? 504 PHE E CD1 1 ATOM 4644 C CD2 . PHE C 1 180 ? 53.990 56.849 73.992 1.00 31.11 ? 504 PHE E CD2 1 ATOM 4645 C CE1 . PHE C 1 180 ? 56.736 57.168 74.014 1.00 30.93 ? 504 PHE E CE1 1 ATOM 4646 C CE2 . PHE C 1 180 ? 54.726 56.294 75.011 1.00 30.65 ? 504 PHE E CE2 1 ATOM 4647 C CZ . PHE C 1 180 ? 56.116 56.445 75.013 1.00 31.95 ? 504 PHE E CZ 1 ATOM 4648 N N . VAL C 1 181 ? 55.655 57.405 69.446 1.00 33.95 ? 505 VAL E N 1 ATOM 4649 C CA . VAL C 1 181 ? 56.982 57.018 68.985 1.00 33.11 ? 505 VAL E CA 1 ATOM 4650 C C . VAL C 1 181 ? 57.873 58.259 69.095 1.00 33.07 ? 505 VAL E C 1 ATOM 4651 O O . VAL C 1 181 ? 57.394 59.414 69.013 1.00 31.85 ? 505 VAL E O 1 ATOM 4652 C CB . VAL C 1 181 ? 56.952 56.450 67.537 1.00 34.29 ? 505 VAL E CB 1 ATOM 4653 C CG1 . VAL C 1 181 ? 56.352 57.443 66.561 1.00 34.52 ? 505 VAL E CG1 1 ATOM 4654 C CG2 . VAL C 1 181 ? 58.343 56.120 67.043 1.00 37.13 ? 505 VAL E CG2 1 ATOM 4655 N N . PHE C 1 182 ? 59.155 57.999 69.343 1.00 32.38 ? 506 PHE E N 1 ATOM 4656 C CA . PHE C 1 182 ? 60.212 59.016 69.278 1.00 32.63 ? 506 PHE E CA 1 ATOM 4657 C C . PHE C 1 182 ? 61.180 58.743 68.115 1.00 32.26 ? 506 PHE E C 1 ATOM 4658 O O . PHE C 1 182 ? 61.517 57.604 67.821 1.00 32.59 ? 506 PHE E O 1 ATOM 4659 C CB . PHE C 1 182 ? 61.030 59.043 70.576 1.00 30.95 ? 506 PHE E CB 1 ATOM 4660 C CG . PHE C 1 182 ? 60.388 59.790 71.720 1.00 28.95 ? 506 PHE E CG 1 ATOM 4661 C CD1 . PHE C 1 182 ? 59.844 59.109 72.775 1.00 28.29 ? 506 PHE E CD1 1 ATOM 4662 C CD2 . PHE C 1 182 ? 60.376 61.190 71.760 1.00 29.07 ? 506 PHE E CD2 1 ATOM 4663 C CE1 . PHE C 1 182 ? 59.256 59.795 73.862 1.00 27.73 ? 506 PHE E CE1 1 ATOM 4664 C CE2 . PHE C 1 182 ? 59.807 61.866 72.827 1.00 27.47 ? 506 PHE E CE2 1 ATOM 4665 C CZ . PHE C 1 182 ? 59.238 61.165 73.876 1.00 27.22 ? 506 PHE E CZ 1 ATOM 4666 N N . SER C 1 183 ? 61.654 59.804 67.478 1.00 33.43 ? 507 SER E N 1 ATOM 4667 C CA . SER C 1 183 ? 62.656 59.709 66.429 1.00 32.91 ? 507 SER E CA 1 ATOM 4668 C C . SER C 1 183 ? 63.820 60.665 66.704 1.00 33.77 ? 507 SER E C 1 ATOM 4669 O O . SER C 1 183 ? 63.614 61.804 67.110 1.00 33.75 ? 507 SER E O 1 ATOM 4670 C CB . SER C 1 183 ? 62.020 60.002 65.073 1.00 33.76 ? 507 SER E CB 1 ATOM 4671 O OG . SER C 1 183 ? 62.852 59.567 64.017 1.00 33.77 ? 507 SER E OG 1 ATOM 4672 N N . ARG C 1 184 ? 65.043 60.177 66.484 1.00 34.24 ? 508 ARG E N 1 ATOM 4673 C CA . ARG C 1 184 ? 66.275 60.944 66.723 1.00 33.70 ? 508 ARG E CA 1 ATOM 4674 C C . ARG C 1 184 ? 67.122 61.058 65.452 1.00 32.96 ? 508 ARG E C 1 ATOM 4675 O O . ARG C 1 184 ? 67.337 60.076 64.760 1.00 29.68 ? 508 ARG E O 1 ATOM 4676 C CB . ARG C 1 184 ? 67.102 60.296 67.834 1.00 33.79 ? 508 ARG E CB 1 ATOM 4677 C CG . ARG C 1 184 ? 68.369 61.082 68.196 1.00 34.43 ? 508 ARG E CG 1 ATOM 4678 C CD . ARG C 1 184 ? 69.091 60.387 69.315 1.00 34.44 ? 508 ARG E CD 1 ATOM 4679 N NE . ARG C 1 184 ? 70.380 60.998 69.618 1.00 35.91 ? 508 ARG E NE 1 ATOM 4680 C CZ . ARG C 1 184 ? 71.507 60.735 68.967 1.00 36.22 ? 508 ARG E CZ 1 ATOM 4681 N NH1 . ARG C 1 184 ? 71.504 59.891 67.944 1.00 37.23 ? 508 ARG E NH1 1 ATOM 4682 N NH2 . ARG C 1 184 ? 72.623 61.351 69.310 1.00 36.27 ? 508 ARG E NH2 1 ATOM 4683 N N . LEU C 1 185 ? 67.517 62.289 65.129 1.00 33.48 ? 509 LEU E N 1 ATOM 4684 C CA . LEU C 1 185 ? 68.291 62.600 63.936 1.00 33.85 ? 509 LEU E CA 1 ATOM 4685 C C . LEU C 1 185 ? 69.443 63.553 64.266 1.00 34.42 ? 509 LEU E C 1 ATOM 4686 O O . LEU C 1 185 ? 69.239 64.735 64.574 1.00 32.84 ? 509 LEU E O 1 ATOM 4687 C CB . LEU C 1 185 ? 67.402 63.257 62.876 1.00 34.70 ? 509 LEU E CB 1 ATOM 4688 C CG . LEU C 1 185 ? 68.065 63.563 61.530 1.00 34.25 ? 509 LEU E CG 1 ATOM 4689 C CD1 . LEU C 1 185 ? 68.423 62.266 60.799 1.00 33.98 ? 509 LEU E CD1 1 ATOM 4690 C CD2 . LEU C 1 185 ? 67.220 64.453 60.649 1.00 33.05 ? 509 LEU E CD2 1 ATOM 4691 N N . GLU C 1 186 ? 70.658 63.030 64.185 1.00 35.31 ? 510 GLU E N 1 ATOM 4692 C CA . GLU C 1 186 ? 71.853 63.863 64.208 1.00 36.84 ? 510 GLU E CA 1 ATOM 4693 C C . GLU C 1 186 ? 72.028 64.559 62.872 1.00 35.44 ? 510 GLU E C 1 ATOM 4694 O O . GLU C 1 186 ? 72.042 63.897 61.831 1.00 33.62 ? 510 GLU E O 1 ATOM 4695 C CB . GLU C 1 186 ? 73.089 62.996 64.454 1.00 39.16 ? 510 GLU E CB 1 ATOM 4696 C CG . GLU C 1 186 ? 73.068 62.216 65.750 1.00 40.59 ? 510 GLU E CG 1 ATOM 4697 C CD . GLU C 1 186 ? 74.407 61.503 65.993 1.00 42.23 ? 510 GLU E CD 1 ATOM 4698 O OE1 . GLU C 1 186 ? 75.464 62.096 65.626 1.00 42.06 ? 510 GLU E OE1 1 ATOM 4699 O OE2 . GLU C 1 186 ? 74.378 60.361 66.530 1.00 41.64 ? 510 GLU E OE2 1 ATOM 4700 N N . VAL C 1 187 ? 72.130 65.887 62.923 1.00 36.40 ? 511 VAL E N 1 ATOM 4701 C CA . VAL C 1 187 ? 72.338 66.723 61.745 1.00 37.03 ? 511 VAL E CA 1 ATOM 4702 C C . VAL C 1 187 ? 73.723 67.379 61.786 1.00 38.49 ? 511 VAL E C 1 ATOM 4703 O O . VAL C 1 187 ? 74.273 67.650 62.851 1.00 38.53 ? 511 VAL E O 1 ATOM 4704 C CB . VAL C 1 187 ? 71.205 67.773 61.506 1.00 36.36 ? 511 VAL E CB 1 ATOM 4705 C CG1 . VAL C 1 187 ? 69.867 67.056 61.298 1.00 36.41 ? 511 VAL E CG1 1 ATOM 4706 C CG2 . VAL C 1 187 ? 71.104 68.788 62.605 1.00 34.40 ? 511 VAL E CG2 1 ATOM 4707 N N . THR C 1 188 ? 74.294 67.595 60.602 1.00 39.55 ? 512 THR E N 1 ATOM 4708 C CA . THR C 1 188 ? 75.592 68.247 60.489 1.00 40.58 ? 512 THR E CA 1 ATOM 4709 C C . THR C 1 188 ? 75.399 69.737 60.209 1.00 40.65 ? 512 THR E C 1 ATOM 4710 O O . THR C 1 188 ? 74.335 70.176 59.743 1.00 40.24 ? 512 THR E O 1 ATOM 4711 C CB . THR C 1 188 ? 76.452 67.613 59.374 1.00 40.52 ? 512 THR E CB 1 ATOM 4712 O OG1 . THR C 1 188 ? 75.763 67.713 58.132 1.00 41.85 ? 512 THR E OG1 1 ATOM 4713 C CG2 . THR C 1 188 ? 76.712 66.148 59.636 1.00 41.28 ? 512 THR E CG2 1 ATOM 4714 N N . ARG C 1 189 ? 76.428 70.507 60.532 1.00 39.90 ? 513 ARG E N 1 ATOM 4715 C CA . ARG C 1 189 ? 76.450 71.942 60.281 1.00 40.76 ? 513 ARG E CA 1 ATOM 4716 C C . ARG C 1 189 ? 76.357 72.265 58.768 1.00 40.51 ? 513 ARG E C 1 ATOM 4717 O O . ARG C 1 189 ? 75.827 73.312 58.376 1.00 38.97 ? 513 ARG E O 1 ATOM 4718 C CB . ARG C 1 189 ? 77.738 72.508 60.882 1.00 42.12 ? 513 ARG E CB 1 ATOM 4719 C CG . ARG C 1 189 ? 77.942 74.001 60.758 1.00 44.00 ? 513 ARG E CG 1 ATOM 4720 C CD . ARG C 1 189 ? 79.365 74.369 61.188 1.00 45.54 ? 513 ARG E CD 1 ATOM 4721 N NE . ARG C 1 189 ? 79.693 75.742 60.826 1.00 48.12 ? 513 ARG E NE 1 ATOM 4722 C CZ . ARG C 1 189 ? 80.920 76.269 60.842 1.00 49.96 ? 513 ARG E CZ 1 ATOM 4723 N NH1 . ARG C 1 189 ? 81.966 75.547 61.237 1.00 50.91 ? 513 ARG E NH1 1 ATOM 4724 N NH2 . ARG C 1 189 ? 81.103 77.535 60.469 1.00 50.46 ? 513 ARG E NH2 1 ATOM 4725 N N . ALA C 1 190 ? 76.873 71.370 57.922 1.00 39.95 ? 514 ALA E N 1 ATOM 4726 C CA . ALA C 1 190 ? 76.819 71.564 56.464 1.00 40.17 ? 514 ALA E CA 1 ATOM 4727 C C . ALA C 1 190 ? 75.377 71.482 55.951 1.00 39.41 ? 514 ALA E C 1 ATOM 4728 O O . ALA C 1 190 ? 75.044 72.067 54.916 1.00 39.11 ? 514 ALA E O 1 ATOM 4729 C CB . ALA C 1 190 ? 77.689 70.536 55.752 1.00 40.05 ? 514 ALA E CB 1 ATOM 4730 N N . GLU C 1 191 ? 74.537 70.742 56.673 1.00 38.94 ? 515 GLU E N 1 ATOM 4731 C CA . GLU C 1 191 ? 73.113 70.622 56.356 1.00 39.04 ? 515 GLU E CA 1 ATOM 4732 C C . GLU C 1 191 ? 72.310 71.851 56.722 1.00 36.91 ? 515 GLU E C 1 ATOM 4733 O O . GLU C 1 191 ? 71.660 72.434 55.878 1.00 38.48 ? 515 GLU E O 1 ATOM 4734 C CB . GLU C 1 191 ? 72.514 69.398 57.028 1.00 40.85 ? 515 GLU E CB 1 ATOM 4735 C CG . GLU C 1 191 ? 72.864 68.127 56.289 1.00 42.96 ? 515 GLU E CG 1 ATOM 4736 C CD . GLU C 1 191 ? 72.247 66.915 56.934 1.00 44.22 ? 515 GLU E CD 1 ATOM 4737 O OE1 . GLU C 1 191 ? 71.725 66.058 56.189 1.00 45.65 ? 515 GLU E OE1 1 ATOM 4738 O OE2 . GLU C 1 191 ? 72.282 66.822 58.185 1.00 44.85 ? 515 GLU E OE2 1 ATOM 4739 N N . TRP C 1 192 ? 72.365 72.286 57.964 1.00 36.58 ? 516 TRP E N 1 ATOM 4740 C CA . TRP C 1 192 ? 71.549 73.430 58.350 1.00 36.73 ? 516 TRP E CA 1 ATOM 4741 C C . TRP C 1 192 ? 72.016 74.756 57.736 1.00 36.36 ? 516 TRP E C 1 ATOM 4742 O O . TRP C 1 192 ? 71.239 75.709 57.612 1.00 36.46 ? 516 TRP E O 1 ATOM 4743 C CB . TRP C 1 192 ? 71.381 73.492 59.872 1.00 36.53 ? 516 TRP E CB 1 ATOM 4744 C CG . TRP C 1 192 ? 72.509 74.036 60.661 1.00 36.78 ? 516 TRP E CG 1 ATOM 4745 C CD1 . TRP C 1 192 ? 72.915 75.331 60.706 1.00 37.36 ? 516 TRP E CD1 1 ATOM 4746 C CD2 . TRP C 1 192 ? 73.318 73.330 61.609 1.00 36.55 ? 516 TRP E CD2 1 ATOM 4747 N NE1 . TRP C 1 192 ? 73.971 75.471 61.566 1.00 37.36 ? 516 TRP E NE1 1 ATOM 4748 C CE2 . TRP C 1 192 ? 74.220 74.261 62.160 1.00 37.54 ? 516 TRP E CE2 1 ATOM 4749 C CE3 . TRP C 1 192 ? 73.377 71.999 62.038 1.00 36.72 ? 516 TRP E CE3 1 ATOM 4750 C CZ2 . TRP C 1 192 ? 75.185 73.901 63.121 1.00 37.15 ? 516 TRP E CZ2 1 ATOM 4751 C CZ3 . TRP C 1 192 ? 74.330 71.638 62.997 1.00 36.57 ? 516 TRP E CZ3 1 ATOM 4752 C CH2 . TRP C 1 192 ? 75.219 72.586 63.522 1.00 37.19 ? 516 TRP E CH2 1 ATOM 4753 N N . GLU C 1 193 ? 73.282 74.807 57.334 1.00 36.40 ? 517 GLU E N 1 ATOM 4754 C CA . GLU C 1 193 ? 73.817 75.959 56.614 1.00 36.14 ? 517 GLU E CA 1 ATOM 4755 C C . GLU C 1 193 ? 73.310 76.031 55.175 1.00 34.96 ? 517 GLU E C 1 ATOM 4756 O O . GLU C 1 193 ? 73.016 77.110 54.655 1.00 33.83 ? 517 GLU E O 1 ATOM 4757 C CB . GLU C 1 193 ? 75.340 75.906 56.619 1.00 37.41 ? 517 GLU E CB 1 ATOM 4758 C CG . GLU C 1 193 ? 75.913 76.368 57.939 1.00 38.20 ? 517 GLU E CG 1 ATOM 4759 C CD . GLU C 1 193 ? 77.410 76.510 57.925 1.00 38.87 ? 517 GLU E CD 1 ATOM 4760 O OE1 . GLU C 1 193 ? 78.085 76.032 56.976 1.00 38.98 ? 517 GLU E OE1 1 ATOM 4761 O OE2 . GLU C 1 193 ? 77.895 77.112 58.906 1.00 40.44 ? 517 GLU E OE2 1 ATOM 4762 N N . GLN C 1 194 ? 73.219 74.871 54.541 1.00 34.54 ? 518 GLN E N 1 ATOM 4763 C CA . GLN C 1 194 ? 72.625 74.767 53.228 1.00 35.82 ? 518 GLN E CA 1 ATOM 4764 C C . GLN C 1 194 ? 71.143 75.123 53.294 1.00 35.50 ? 518 GLN E C 1 ATOM 4765 O O . GLN C 1 194 ? 70.692 76.003 52.557 1.00 35.96 ? 518 GLN E O 1 ATOM 4766 C CB . GLN C 1 194 ? 72.859 73.364 52.663 1.00 37.52 ? 518 GLN E CB 1 ATOM 4767 C CG . GLN C 1 194 ? 72.519 73.205 51.192 1.00 38.67 ? 518 GLN E CG 1 ATOM 4768 C CD . GLN C 1 194 ? 71.182 72.564 51.024 1.00 40.30 ? 518 GLN E CD 1 ATOM 4769 O OE1 . GLN C 1 194 ? 70.939 71.493 51.570 1.00 40.71 ? 518 GLN E OE1 1 ATOM 4770 N NE2 . GLN C 1 194 ? 70.287 73.212 50.283 1.00 42.72 ? 518 GLN E NE2 1 ATOM 4771 N N . LYS C 1 195 ? 70.406 74.478 54.199 1.00 35.31 ? 519 LYS E N 1 ATOM 4772 C CA . LYS C 1 195 ? 69.012 74.832 54.481 1.00 36.41 ? 519 LYS E CA 1 ATOM 4773 C C . LYS C 1 195 ? 68.579 74.503 55.928 1.00 35.27 ? 519 LYS E C 1 ATOM 4774 O O . LYS C 1 195 ? 68.528 73.343 56.315 1.00 31.89 ? 519 LYS E O 1 ATOM 4775 C CB . LYS C 1 195 ? 68.103 74.101 53.494 1.00 38.21 ? 519 LYS E CB 1 ATOM 4776 C CG . LYS C 1 195 ? 66.652 74.479 53.592 1.00 40.22 ? 519 LYS E CG 1 ATOM 4777 C CD . LYS C 1 195 ? 66.406 75.919 53.163 1.00 41.74 ? 519 LYS E CD 1 ATOM 4778 C CE . LYS C 1 195 ? 64.913 76.165 52.935 1.00 42.72 ? 519 LYS E CE 1 ATOM 4779 N NZ . LYS C 1 195 ? 64.358 75.345 51.830 1.00 43.36 ? 519 LYS E NZ 1 ATOM 4780 N N . ASP C 1 196 ? 68.243 75.525 56.708 1.00 35.25 ? 520 ASP E N 1 ATOM 4781 C CA . ASP C 1 196 ? 67.959 75.348 58.143 1.00 37.13 ? 520 ASP E CA 1 ATOM 4782 C C . ASP C 1 196 ? 66.460 75.086 58.369 1.00 37.22 ? 520 ASP E C 1 ATOM 4783 O O . ASP C 1 196 ? 65.734 75.938 58.876 1.00 37.32 ? 520 ASP E O 1 ATOM 4784 C CB . ASP C 1 196 ? 68.411 76.574 58.954 1.00 37.13 ? 520 ASP E CB 1 ATOM 4785 C CG . ASP C 1 196 ? 68.348 76.347 60.469 1.00 38.23 ? 520 ASP E CG 1 ATOM 4786 O OD1 . ASP C 1 196 ? 68.363 77.339 61.230 1.00 37.98 ? 520 ASP E OD1 1 ATOM 4787 O OD2 . ASP C 1 196 ? 68.285 75.183 60.912 1.00 38.39 ? 520 ASP E OD2 1 ATOM 4788 N N . GLU C 1 197 ? 66.010 73.908 57.945 1.00 37.21 ? 521 GLU E N 1 ATOM 4789 C CA . GLU C 1 197 ? 64.646 73.477 58.133 1.00 36.62 ? 521 GLU E CA 1 ATOM 4790 C C . GLU C 1 197 ? 64.701 71.973 57.992 1.00 35.75 ? 521 GLU E C 1 ATOM 4791 O O . GLU C 1 197 ? 65.230 71.463 56.998 1.00 34.23 ? 521 GLU E O 1 ATOM 4792 C CB . GLU C 1 197 ? 63.715 74.085 57.086 1.00 38.87 ? 521 GLU E CB 1 ATOM 4793 C CG . GLU C 1 197 ? 62.259 73.720 57.333 1.00 40.26 ? 521 GLU E CG 1 ATOM 4794 C CD . GLU C 1 197 ? 61.306 74.161 56.245 1.00 42.11 ? 521 GLU E CD 1 ATOM 4795 O OE1 . GLU C 1 197 ? 61.736 74.670 55.193 1.00 43.37 ? 521 GLU E OE1 1 ATOM 4796 O OE2 . GLU C 1 197 ? 60.088 74.000 56.468 1.00 44.49 ? 521 GLU E OE2 1 ATOM 4797 N N . PHE C 1 198 ? 64.205 71.276 59.016 1.00 34.94 ? 522 PHE E N 1 ATOM 4798 C CA . PHE C 1 198 ? 64.158 69.816 59.015 1.00 33.90 ? 522 PHE E CA 1 ATOM 4799 C C . PHE C 1 198 ? 62.735 69.438 59.350 1.00 32.66 ? 522 PHE E C 1 ATOM 4800 O O . PHE C 1 198 ? 62.184 69.886 60.359 1.00 36.22 ? 522 PHE E O 1 ATOM 4801 C CB . PHE C 1 198 ? 65.181 69.212 59.990 1.00 34.58 ? 522 PHE E CB 1 ATOM 4802 C CG . PHE C 1 198 ? 66.609 69.558 59.645 1.00 34.09 ? 522 PHE E CG 1 ATOM 4803 C CD1 . PHE C 1 198 ? 67.138 70.799 59.980 1.00 34.20 ? 522 PHE E CD1 1 ATOM 4804 C CD2 . PHE C 1 198 ? 67.408 68.679 58.948 1.00 33.61 ? 522 PHE E CD2 1 ATOM 4805 C CE1 . PHE C 1 198 ? 68.436 71.125 59.640 1.00 33.17 ? 522 PHE E CE1 1 ATOM 4806 C CE2 . PHE C 1 198 ? 68.707 69.015 58.628 1.00 32.57 ? 522 PHE E CE2 1 ATOM 4807 C CZ . PHE C 1 198 ? 69.210 70.231 58.976 1.00 32.18 ? 522 PHE E CZ 1 ATOM 4808 N N . ILE C 1 199 ? 62.128 68.633 58.485 1.00 30.42 ? 523 ILE E N 1 ATOM 4809 C CA . ILE C 1 199 ? 60.768 68.229 58.670 1.00 29.55 ? 523 ILE E CA 1 ATOM 4810 C C . ILE C 1 199 ? 60.650 66.795 59.166 1.00 31.24 ? 523 ILE E C 1 ATOM 4811 O O . ILE C 1 199 ? 61.134 65.865 58.560 1.00 31.99 ? 523 ILE E O 1 ATOM 4812 C CB . ILE C 1 199 ? 59.945 68.400 57.396 1.00 28.97 ? 523 ILE E CB 1 ATOM 4813 C CG1 . ILE C 1 199 ? 59.823 69.895 57.046 1.00 28.59 ? 523 ILE E CG1 1 ATOM 4814 C CG2 . ILE C 1 199 ? 58.597 67.717 57.604 1.00 28.66 ? 523 ILE E CG2 1 ATOM 4815 C CD1 . ILE C 1 199 ? 59.102 70.158 55.725 1.00 28.29 ? 523 ILE E CD1 1 ATOM 4816 N N . CYS C 1 200 ? 59.982 66.625 60.299 1.00 32.92 ? 524 CYS E N 1 ATOM 4817 C CA . CYS C 1 200 ? 59.556 65.314 60.743 1.00 33.69 ? 524 CYS E CA 1 ATOM 4818 C C . CYS C 1 200 ? 58.134 65.029 60.257 1.00 33.87 ? 524 CYS E C 1 ATOM 4819 O O . CYS C 1 200 ? 57.205 65.748 60.595 1.00 33.56 ? 524 CYS E O 1 ATOM 4820 C CB . CYS C 1 200 ? 59.604 65.260 62.253 1.00 34.55 ? 524 CYS E CB 1 ATOM 4821 S SG . CYS C 1 200 ? 58.958 63.756 62.917 1.00 34.57 ? 524 CYS E SG 1 ATOM 4822 N N . ARG C 1 201 ? 57.975 63.968 59.479 1.00 33.85 ? 525 ARG E N 1 ATOM 4823 C CA . ARG C 1 201 ? 56.703 63.648 58.868 1.00 35.47 ? 525 ARG E CA 1 ATOM 4824 C C . ARG C 1 201 ? 56.255 62.250 59.258 1.00 35.58 ? 525 ARG E C 1 ATOM 4825 O O . ARG C 1 201 ? 57.034 61.312 59.216 1.00 34.59 ? 525 ARG E O 1 ATOM 4826 C CB . ARG C 1 201 ? 56.817 63.743 57.347 1.00 37.24 ? 525 ARG E CB 1 ATOM 4827 C CG . ARG C 1 201 ? 55.552 63.397 56.619 1.00 38.82 ? 525 ARG E CG 1 ATOM 4828 C CD . ARG C 1 201 ? 55.444 64.238 55.357 1.00 40.57 ? 525 ARG E CD 1 ATOM 4829 N NE . ARG C 1 201 ? 56.270 63.731 54.286 1.00 42.38 ? 525 ARG E NE 1 ATOM 4830 C CZ . ARG C 1 201 ? 56.489 64.372 53.135 1.00 44.93 ? 525 ARG E CZ 1 ATOM 4831 N NH1 . ARG C 1 201 ? 55.969 65.574 52.902 1.00 46.56 ? 525 ARG E NH1 1 ATOM 4832 N NH2 . ARG C 1 201 ? 57.244 63.813 52.207 1.00 44.73 ? 525 ARG E NH2 1 ATOM 4833 N N . ALA C 1 202 ? 54.986 62.134 59.655 1.00 34.46 ? 526 ALA E N 1 ATOM 4834 C CA . ALA C 1 202 ? 54.384 60.849 59.965 1.00 32.60 ? 526 ALA E CA 1 ATOM 4835 C C . ALA C 1 202 ? 53.334 60.512 58.906 1.00 32.69 ? 526 ALA E C 1 ATOM 4836 O O . ALA C 1 202 ? 52.501 61.350 58.522 1.00 33.01 ? 526 ALA E O 1 ATOM 4837 C CB . ALA C 1 202 ? 53.756 60.860 61.338 1.00 30.39 ? 526 ALA E CB 1 ATOM 4838 N N . VAL C 1 203 ? 53.409 59.278 58.417 1.00 31.93 ? 527 VAL E N 1 ATOM 4839 C CA . VAL C 1 203 ? 52.384 58.745 57.540 1.00 31.71 ? 527 VAL E CA 1 ATOM 4840 C C . VAL C 1 203 ? 51.521 57.786 58.343 1.00 30.94 ? 527 VAL E C 1 ATOM 4841 O O . VAL C 1 203 ? 52.000 56.817 58.940 1.00 30.46 ? 527 VAL E O 1 ATOM 4842 C CB . VAL C 1 203 ? 52.955 58.054 56.293 1.00 30.88 ? 527 VAL E CB 1 ATOM 4843 C CG1 . VAL C 1 203 ? 51.826 57.593 55.412 1.00 31.97 ? 527 VAL E CG1 1 ATOM 4844 C CG2 . VAL C 1 203 ? 53.864 59.004 55.538 1.00 31.80 ? 527 VAL E CG2 1 ATOM 4845 N N . HIS C 1 204 ? 50.227 58.073 58.338 1.00 30.52 ? 528 HIS E N 1 ATOM 4846 C CA . HIS C 1 204 ? 49.280 57.380 59.193 1.00 29.04 ? 528 HIS E CA 1 ATOM 4847 C C . HIS C 1 204 ? 47.878 57.393 58.606 1.00 30.48 ? 528 HIS E C 1 ATOM 4848 O O . HIS C 1 204 ? 47.404 58.412 58.093 1.00 28.53 ? 528 HIS E O 1 ATOM 4849 C CB . HIS C 1 204 ? 49.202 58.007 60.585 1.00 27.43 ? 528 HIS E CB 1 ATOM 4850 C CG . HIS C 1 204 ? 48.498 57.137 61.580 1.00 25.71 ? 528 HIS E CG 1 ATOM 4851 N ND1 . HIS C 1 204 ? 47.126 57.147 61.762 1.00 24.70 ? 528 HIS E ND1 1 ATOM 4852 C CD2 . HIS C 1 204 ? 48.985 56.208 62.437 1.00 24.74 ? 528 HIS E CD2 1 ATOM 4853 C CE1 . HIS C 1 204 ? 46.803 56.255 62.679 1.00 23.41 ? 528 HIS E CE1 1 ATOM 4854 N NE2 . HIS C 1 204 ? 47.910 55.686 63.120 1.00 24.01 ? 528 HIS E NE2 1 ATOM 4855 N N . GLU C 1 205 ? 47.252 56.228 58.738 1.00 32.06 ? 529 GLU E N 1 ATOM 4856 C CA . GLU C 1 205 ? 45.941 55.909 58.214 1.00 34.98 ? 529 GLU E CA 1 ATOM 4857 C C . GLU C 1 205 ? 44.816 56.858 58.618 1.00 34.77 ? 529 GLU E C 1 ATOM 4858 O O . GLU C 1 205 ? 43.877 57.041 57.858 1.00 35.06 ? 529 GLU E O 1 ATOM 4859 C CB . GLU C 1 205 ? 45.599 54.513 58.712 1.00 36.72 ? 529 GLU E CB 1 ATOM 4860 C CG . GLU C 1 205 ? 44.187 54.103 58.525 1.00 39.40 ? 529 GLU E CG 1 ATOM 4861 C CD . GLU C 1 205 ? 43.990 52.708 59.043 1.00 41.56 ? 529 GLU E CD 1 ATOM 4862 O OE1 . GLU C 1 205 ? 44.997 52.121 59.514 1.00 42.66 ? 529 GLU E OE1 1 ATOM 4863 O OE2 . GLU C 1 205 ? 42.835 52.231 58.999 1.00 44.75 ? 529 GLU E OE2 1 ATOM 4864 N N . ALA C 1 206 ? 44.913 57.446 59.811 1.00 34.54 ? 530 ALA E N 1 ATOM 4865 C CA . ALA C 1 206 ? 43.879 58.307 60.362 1.00 33.57 ? 530 ALA E CA 1 ATOM 4866 C C . ALA C 1 206 ? 44.096 59.793 60.057 1.00 34.08 ? 530 ALA E C 1 ATOM 4867 O O . ALA C 1 206 ? 43.206 60.607 60.326 1.00 34.49 ? 530 ALA E O 1 ATOM 4868 C CB . ALA C 1 206 ? 43.789 58.091 61.853 1.00 32.74 ? 530 ALA E CB 1 ATOM 4869 N N . ALA C 1 207 ? 45.246 60.152 59.480 1.00 32.66 ? 531 ALA E N 1 ATOM 4870 C CA . ALA C 1 207 ? 45.583 61.559 59.201 1.00 31.95 ? 531 ALA E CA 1 ATOM 4871 C C . ALA C 1 207 ? 44.987 62.091 57.892 1.00 33.48 ? 531 ALA E C 1 ATOM 4872 O O . ALA C 1 207 ? 45.704 62.589 57.020 1.00 33.68 ? 531 ALA E O 1 ATOM 4873 C CB . ALA C 1 207 ? 47.113 61.734 59.203 1.00 32.72 ? 531 ALA E CB 1 ATOM 4874 N N . SER C 1 208 ? 43.666 61.988 57.755 1.00 34.89 ? 532 SER E N 1 ATOM 4875 C CA . SER C 1 208 ? 42.968 62.363 56.532 1.00 35.54 ? 532 SER E CA 1 ATOM 4876 C C . SER C 1 208 ? 42.927 63.884 56.351 1.00 36.42 ? 532 SER E C 1 ATOM 4877 O O . SER C 1 208 ? 42.960 64.629 57.348 1.00 36.49 ? 532 SER E O 1 ATOM 4878 C CB . SER C 1 208 ? 41.543 61.805 56.558 1.00 36.18 ? 532 SER E CB 1 ATOM 4879 O OG . SER C 1 208 ? 40.907 62.081 57.794 1.00 37.61 ? 532 SER E OG 1 ATOM 4880 N N . PRO C 1 209 ? 42.858 64.355 55.085 1.00 34.92 ? 533 PRO E N 1 ATOM 4881 C CA . PRO C 1 209 ? 42.760 63.583 53.855 1.00 35.22 ? 533 PRO E CA 1 ATOM 4882 C C . PRO C 1 209 ? 44.065 63.101 53.210 1.00 35.04 ? 533 PRO E C 1 ATOM 4883 O O . PRO C 1 209 ? 43.991 62.305 52.287 1.00 35.95 ? 533 PRO E O 1 ATOM 4884 C CB . PRO C 1 209 ? 42.077 64.572 52.893 1.00 35.68 ? 533 PRO E CB 1 ATOM 4885 C CG . PRO C 1 209 ? 42.571 65.918 53.349 1.00 35.32 ? 533 PRO E CG 1 ATOM 4886 C CD . PRO C 1 209 ? 42.890 65.804 54.816 1.00 34.65 ? 533 PRO E CD 1 ATOM 4887 N N . SER C 1 210 ? 45.226 63.578 53.653 1.00 35.55 ? 534 SER E N 1 ATOM 4888 C CA . SER C 1 210 ? 46.501 63.286 52.969 1.00 35.79 ? 534 SER E CA 1 ATOM 4889 C C . SER C 1 210 ? 47.264 62.122 53.579 1.00 35.97 ? 534 SER E C 1 ATOM 4890 O O . SER C 1 210 ? 48.302 61.731 53.054 1.00 35.33 ? 534 SER E O 1 ATOM 4891 C CB . SER C 1 210 ? 47.438 64.498 52.985 1.00 34.99 ? 534 SER E CB 1 ATOM 4892 O OG . SER C 1 210 ? 47.772 64.839 54.314 1.00 35.25 ? 534 SER E OG 1 ATOM 4893 N N . GLN C 1 211 ? 46.762 61.588 54.687 1.00 35.82 ? 535 GLN E N 1 ATOM 4894 C CA . GLN C 1 211 ? 47.420 60.482 55.377 1.00 37.23 ? 535 GLN E CA 1 ATOM 4895 C C . GLN C 1 211 ? 48.791 60.890 55.926 1.00 36.20 ? 535 GLN E C 1 ATOM 4896 O O . GLN C 1 211 ? 49.630 60.057 56.190 1.00 35.24 ? 535 GLN E O 1 ATOM 4897 C CB . GLN C 1 211 ? 47.544 59.247 54.472 1.00 39.21 ? 535 GLN E CB 1 ATOM 4898 C CG . GLN C 1 211 ? 46.334 58.983 53.547 1.00 41.28 ? 535 GLN E CG 1 ATOM 4899 C CD . GLN C 1 211 ? 45.099 58.715 54.319 1.00 42.14 ? 535 GLN E CD 1 ATOM 4900 O OE1 . GLN C 1 211 ? 45.124 57.915 55.252 1.00 45.21 ? 535 GLN E OE1 1 ATOM 4901 N NE2 . GLN C 1 211 ? 44.015 59.390 53.968 1.00 42.52 ? 535 GLN E NE2 1 ATOM 4902 N N . THR C 1 212 ? 48.956 62.177 56.205 1.00 36.47 ? 536 THR E N 1 ATOM 4903 C CA . THR C 1 212 ? 50.246 62.759 56.516 1.00 36.19 ? 536 THR E CA 1 ATOM 4904 C C . THR C 1 212 ? 50.085 63.901 57.544 1.00 35.21 ? 536 THR E C 1 ATOM 4905 O O . THR C 1 212 ? 49.139 64.683 57.484 1.00 35.50 ? 536 THR E O 1 ATOM 4906 C CB . THR C 1 212 ? 50.866 63.287 55.215 1.00 37.20 ? 536 THR E CB 1 ATOM 4907 O OG1 . THR C 1 212 ? 51.659 62.252 54.606 1.00 38.05 ? 536 THR E OG1 1 ATOM 4908 C CG2 . THR C 1 212 ? 51.699 64.530 55.458 1.00 39.56 ? 536 THR E CG2 1 ATOM 4909 N N . VAL C 1 213 ? 50.998 63.956 58.503 1.00 34.22 ? 537 VAL E N 1 ATOM 4910 C CA . VAL C 1 213 ? 51.101 65.054 59.458 1.00 34.02 ? 537 VAL E CA 1 ATOM 4911 C C . VAL C 1 213 ? 52.601 65.283 59.595 1.00 33.63 ? 537 VAL E C 1 ATOM 4912 O O . VAL C 1 213 ? 53.372 64.332 59.728 1.00 33.73 ? 537 VAL E O 1 ATOM 4913 C CB . VAL C 1 213 ? 50.497 64.688 60.837 1.00 34.71 ? 537 VAL E CB 1 ATOM 4914 C CG1 . VAL C 1 213 ? 50.570 65.877 61.798 1.00 35.70 ? 537 VAL E CG1 1 ATOM 4915 C CG2 . VAL C 1 213 ? 49.039 64.217 60.708 1.00 34.39 ? 537 VAL E CG2 1 ATOM 4916 N N . GLN C 1 214 ? 53.025 66.538 59.536 1.00 31.85 ? 538 GLN E N 1 ATOM 4917 C CA . GLN C 1 214 ? 54.429 66.860 59.670 1.00 30.86 ? 538 GLN E CA 1 ATOM 4918 C C . GLN C 1 214 ? 54.641 68.089 60.533 1.00 30.82 ? 538 GLN E C 1 ATOM 4919 O O . GLN C 1 214 ? 53.732 68.855 60.787 1.00 31.57 ? 538 GLN E O 1 ATOM 4920 C CB . GLN C 1 214 ? 55.101 67.086 58.299 1.00 29.91 ? 538 GLN E CB 1 ATOM 4921 C CG . GLN C 1 214 ? 54.715 68.400 57.619 1.00 30.00 ? 538 GLN E CG 1 ATOM 4922 C CD . GLN C 1 214 ? 55.208 68.471 56.186 1.00 29.81 ? 538 GLN E CD 1 ATOM 4923 O OE1 . GLN C 1 214 ? 55.186 67.483 55.468 1.00 31.43 ? 538 GLN E OE1 1 ATOM 4924 N NE2 . GLN C 1 214 ? 55.657 69.636 55.768 1.00 28.44 ? 538 GLN E NE2 1 ATOM 4925 N N . ARG C 1 215 ? 55.884 68.274 60.948 1.00 31.34 ? 539 ARG E N 1 ATOM 4926 C CA . ARG C 1 215 ? 56.294 69.434 61.709 1.00 31.67 ? 539 ARG E CA 1 ATOM 4927 C C . ARG C 1 215 ? 57.751 69.742 61.377 1.00 29.45 ? 539 ARG E C 1 ATOM 4928 O O . ARG C 1 215 ? 58.588 68.868 61.467 1.00 28.58 ? 539 ARG E O 1 ATOM 4929 C CB . ARG C 1 215 ? 56.119 69.150 63.215 1.00 33.86 ? 539 ARG E CB 1 ATOM 4930 C CG . ARG C 1 215 ? 56.495 70.303 64.136 1.00 35.36 ? 539 ARG E CG 1 ATOM 4931 C CD . ARG C 1 215 ? 55.673 71.534 63.793 1.00 37.92 ? 539 ARG E CD 1 ATOM 4932 N NE . ARG C 1 215 ? 55.970 72.610 64.735 1.00 41.38 ? 539 ARG E NE 1 ATOM 4933 C CZ . ARG C 1 215 ? 55.633 73.886 64.576 1.00 43.37 ? 539 ARG E CZ 1 ATOM 4934 N NH1 . ARG C 1 215 ? 54.966 74.286 63.498 1.00 44.73 ? 539 ARG E NH1 1 ATOM 4935 N NH2 . ARG C 1 215 ? 55.979 74.768 65.503 1.00 43.95 ? 539 ARG E NH2 1 ATOM 4936 N N . ALA C 1 216 ? 58.029 70.989 61.016 1.00 27.90 ? 540 ALA E N 1 ATOM 4937 C CA . ALA C 1 216 ? 59.368 71.495 60.767 1.00 28.73 ? 540 ALA E CA 1 ATOM 4938 C C . ALA C 1 216 ? 60.029 72.043 62.043 1.00 29.38 ? 540 ALA E C 1 ATOM 4939 O O . ALA C 1 216 ? 59.373 72.545 62.931 1.00 27.94 ? 540 ALA E O 1 ATOM 4940 C CB . ALA C 1 216 ? 59.339 72.613 59.695 1.00 26.75 ? 540 ALA E CB 1 ATOM 4941 N N . VAL C 1 217 ? 61.350 71.955 62.081 1.00 30.41 ? 541 VAL E N 1 ATOM 4942 C CA . VAL C 1 217 ? 62.164 72.553 63.143 1.00 31.66 ? 541 VAL E CA 1 ATOM 4943 C C . VAL C 1 217 ? 63.465 73.105 62.549 1.00 32.67 ? 541 VAL E C 1 ATOM 4944 O O . VAL C 1 217 ? 64.045 72.543 61.620 1.00 32.11 ? 541 VAL E O 1 ATOM 4945 C CB . VAL C 1 217 ? 62.470 71.529 64.283 1.00 31.60 ? 541 VAL E CB 1 ATOM 4946 C CG1 . VAL C 1 217 ? 63.300 70.388 63.779 1.00 30.65 ? 541 VAL E CG1 1 ATOM 4947 C CG2 . VAL C 1 217 ? 63.149 72.205 65.461 1.00 29.71 ? 541 VAL E CG2 1 ATOM 4948 N N . SER C 1 218 ? 63.888 74.250 63.066 1.00 35.25 ? 542 SER E N 1 ATOM 4949 C CA . SER C 1 218 ? 65.123 74.870 62.649 1.00 36.22 ? 542 SER E CA 1 ATOM 4950 C C . SER C 1 218 ? 66.156 74.702 63.760 1.00 37.87 ? 542 SER E C 1 ATOM 4951 O O . SER C 1 218 ? 65.818 74.723 64.956 1.00 37.26 ? 542 SER E O 1 ATOM 4952 C CB . SER C 1 218 ? 64.897 76.354 62.346 1.00 36.74 ? 542 SER E CB 1 ATOM 4953 O OG . SER C 1 218 ? 64.228 76.518 61.110 1.00 37.43 ? 542 SER E OG 1 ATOM 4954 N N . VAL C 1 219 ? 67.401 74.485 63.345 1.00 38.91 ? 543 VAL E N 1 ATOM 4955 C CA . VAL C 1 219 ? 68.533 74.429 64.261 1.00 40.99 ? 543 VAL E CA 1 ATOM 4956 C C . VAL C 1 219 ? 68.852 75.834 64.762 1.00 42.75 ? 543 VAL E C 1 ATOM 4957 O O . VAL C 1 219 ? 69.113 76.023 65.944 1.00 41.43 ? 543 VAL E O 1 ATOM 4958 C CB . VAL C 1 219 ? 69.785 73.800 63.592 1.00 40.92 ? 543 VAL E CB 1 ATOM 4959 C CG1 . VAL C 1 219 ? 71.017 74.093 64.391 1.00 41.73 ? 543 VAL E CG1 1 ATOM 4960 C CG2 . VAL C 1 219 ? 69.616 72.289 63.412 1.00 40.78 ? 543 VAL E CG2 1 ATOM 4961 N N . ASN C 1 220 ? 68.756 76.815 63.868 1.00 46.00 ? 544 ASN E N 1 ATOM 4962 C CA . ASN C 1 220 ? 69.258 78.169 64.110 1.00 47.99 ? 544 ASN E CA 1 ATOM 4963 C C . ASN C 1 220 ? 70.768 78.140 64.392 1.00 48.22 ? 544 ASN E C 1 ATOM 4964 O O . ASN C 1 220 ? 71.568 77.890 63.491 1.00 48.32 ? 544 ASN E O 1 ATOM 4965 C CB . ASN C 1 220 ? 68.468 78.844 65.229 1.00 48.91 ? 544 ASN E CB 1 ATOM 4966 C CG . ASN C 1 220 ? 67.011 79.023 64.874 1.00 49.54 ? 544 ASN E CG 1 ATOM 4967 O OD1 . ASN C 1 220 ? 66.667 79.208 63.702 1.00 51.22 ? 544 ASN E OD1 1 ATOM 4968 N ND2 . ASN C 1 220 ? 66.143 78.971 65.878 1.00 49.84 ? 544 ASN E ND2 1 HETATM 4969 C C1 . NAG D 2 . ? -0.636 38.572 66.540 1.00 83.62 ? 1 NAG A C1 1 HETATM 4970 C C2 . NAG D 2 . ? 0.082 39.149 67.755 1.00 84.22 ? 1 NAG A C2 1 HETATM 4971 C C3 . NAG D 2 . ? 1.358 39.853 67.313 1.00 84.47 ? 1 NAG A C3 1 HETATM 4972 C C4 . NAG D 2 . ? 2.231 38.914 66.482 1.00 84.74 ? 1 NAG A C4 1 HETATM 4973 C C5 . NAG D 2 . ? 1.410 38.221 65.393 1.00 84.58 ? 1 NAG A C5 1 HETATM 4974 C C6 . NAG D 2 . ? 2.223 37.173 64.631 1.00 84.65 ? 1 NAG A C6 1 HETATM 4975 C C7 . NAG D 2 . ? -1.165 39.909 69.728 1.00 84.17 ? 1 NAG A C7 1 HETATM 4976 C C8 . NAG D 2 . ? -2.042 40.979 70.309 1.00 84.05 ? 1 NAG A C8 1 HETATM 4977 N N2 . NAG D 2 . ? -0.772 40.089 68.466 1.00 84.27 ? 1 NAG A N2 1 HETATM 4978 O O3 . NAG D 2 . ? 2.057 40.286 68.459 1.00 84.22 ? 1 NAG A O3 1 HETATM 4979 O O4 . NAG D 2 . ? 3.271 39.646 65.858 1.00 85.19 ? 1 NAG A O4 1 HETATM 4980 O O5 . NAG D 2 . ? 0.219 37.647 65.901 1.00 84.03 ? 1 NAG A O5 1 HETATM 4981 O O6 . NAG D 2 . ? 2.736 36.188 65.500 1.00 84.65 ? 1 NAG A O6 1 HETATM 4982 O O7 . NAG D 2 . ? -0.850 38.938 70.414 1.00 84.01 ? 1 NAG A O7 1 HETATM 4983 C C1 . NAG E 2 . ? 4.485 39.636 66.639 1.00 85.46 ? 2 NAG A C1 1 HETATM 4984 C C2 . NAG E 2 . ? 5.655 40.105 65.775 1.00 85.61 ? 2 NAG A C2 1 HETATM 4985 C C3 . NAG E 2 . ? 6.940 40.108 66.593 1.00 85.63 ? 2 NAG A C3 1 HETATM 4986 C C4 . NAG E 2 . ? 6.765 40.943 67.857 1.00 85.85 ? 2 NAG A C4 1 HETATM 4987 C C5 . NAG E 2 . ? 5.519 40.473 68.617 1.00 85.64 ? 2 NAG A C5 1 HETATM 4988 C C6 . NAG E 2 . ? 5.206 41.281 69.876 1.00 85.43 ? 2 NAG A C6 1 HETATM 4989 C C7 . NAG E 2 . ? 5.344 39.513 63.407 1.00 85.67 ? 2 NAG A C7 1 HETATM 4990 C C8 . NAG E 2 . ? 5.649 38.507 62.335 1.00 85.58 ? 2 NAG A C8 1 HETATM 4991 N N2 . NAG E 2 . ? 5.846 39.249 64.614 1.00 85.72 ? 2 NAG A N2 1 HETATM 4992 O O3 . NAG E 2 . ? 7.986 40.637 65.810 1.00 85.46 ? 2 NAG A O3 1 HETATM 4993 O O4 . NAG E 2 . ? 7.906 40.754 68.669 1.00 86.18 ? 2 NAG A O4 1 HETATM 4994 O O5 . NAG E 2 . ? 4.376 40.459 67.783 1.00 85.46 ? 2 NAG A O5 1 HETATM 4995 O O6 . NAG E 2 . ? 5.842 42.537 69.858 1.00 85.01 ? 2 NAG A O6 1 HETATM 4996 O O7 . NAG E 2 . ? 4.664 40.503 63.143 1.00 85.46 ? 2 NAG A O7 1 HETATM 4997 C C1 . BMA F 3 . ? 8.834 41.855 68.609 1.00 86.39 ? 3 BMA A C1 1 HETATM 4998 C C2 . BMA F 3 . ? 9.659 41.853 69.891 1.00 86.55 ? 3 BMA A C2 1 HETATM 4999 C C3 . BMA F 3 . ? 10.711 42.953 69.879 1.00 86.91 ? 3 BMA A C3 1 HETATM 5000 C C4 . BMA F 3 . ? 11.564 42.816 68.624 1.00 86.60 ? 3 BMA A C4 1 HETATM 5001 C C5 . BMA F 3 . ? 10.674 42.772 67.386 1.00 86.58 ? 3 BMA A C5 1 HETATM 5002 C C6 . BMA F 3 . ? 11.503 42.559 66.119 1.00 86.81 ? 3 BMA A C6 1 HETATM 5003 O O2 . BMA F 3 . ? 10.296 40.601 70.026 1.00 86.06 ? 3 BMA A O2 1 HETATM 5004 O O3 . BMA F 3 . ? 11.544 42.799 71.007 1.00 87.80 ? 3 BMA A O3 1 HETATM 5005 O O4 . BMA F 3 . ? 12.488 43.882 68.544 1.00 85.98 ? 3 BMA A O4 1 HETATM 5006 O O5 . BMA F 3 . ? 9.695 41.755 67.497 1.00 86.47 ? 3 BMA A O5 1 HETATM 5007 O O6 . BMA F 3 . ? 12.659 41.781 66.369 1.00 86.99 ? 3 BMA A O6 1 HETATM 5008 C C1 . MAN G 4 . ? 12.337 40.380 66.211 1.00 87.46 ? 4 MAN A C1 1 HETATM 5009 C C2 . MAN G 4 . ? 13.535 39.476 66.493 1.00 87.48 ? 4 MAN A C2 1 HETATM 5010 C C3 . MAN G 4 . ? 14.628 39.695 65.460 1.00 87.71 ? 4 MAN A C3 1 HETATM 5011 C C4 . MAN G 4 . ? 14.054 39.527 64.054 1.00 87.84 ? 4 MAN A C4 1 HETATM 5012 C C5 . MAN G 4 . ? 12.752 40.316 63.866 1.00 88.04 ? 4 MAN A C5 1 HETATM 5013 C C6 . MAN G 4 . ? 12.001 39.975 62.579 1.00 88.51 ? 4 MAN A C6 1 HETATM 5014 O O2 . MAN G 4 . ? 13.135 38.120 66.436 1.00 87.12 ? 4 MAN A O2 1 HETATM 5015 O O3 . MAN G 4 . ? 15.689 38.794 65.714 1.00 87.31 ? 4 MAN A O3 1 HETATM 5016 O O4 . MAN G 4 . ? 15.004 39.992 63.121 1.00 87.78 ? 4 MAN A O4 1 HETATM 5017 O O5 . MAN G 4 . ? 11.847 40.082 64.922 1.00 87.72 ? 4 MAN A O5 1 HETATM 5018 O O6 . MAN G 4 . ? 12.813 39.292 61.651 1.00 89.28 ? 4 MAN A O6 1 HETATM 5019 C C1 . MAN H 4 . ? 12.532 37.877 61.683 1.00 90.07 ? 5 MAN A C1 1 HETATM 5020 C C2 . MAN H 4 . ? 13.795 37.142 61.244 1.00 90.26 ? 5 MAN A C2 1 HETATM 5021 C C3 . MAN H 4 . ? 14.113 37.551 59.809 1.00 90.29 ? 5 MAN A C3 1 HETATM 5022 C C4 . MAN H 4 . ? 12.895 37.292 58.918 1.00 90.61 ? 5 MAN A C4 1 HETATM 5023 C C5 . MAN H 4 . ? 11.600 37.872 59.503 1.00 90.55 ? 5 MAN A C5 1 HETATM 5024 C C6 . MAN H 4 . ? 10.387 37.390 58.703 1.00 90.43 ? 5 MAN A C6 1 HETATM 5025 O O2 . MAN H 4 . ? 13.616 35.742 61.352 1.00 90.28 ? 5 MAN A O2 1 HETATM 5026 O O3 . MAN H 4 . ? 15.275 36.890 59.353 1.00 89.76 ? 5 MAN A O3 1 HETATM 5027 O O4 . MAN H 4 . ? 13.120 37.833 57.632 1.00 90.85 ? 5 MAN A O4 1 HETATM 5028 O O5 . MAN H 4 . ? 11.450 37.487 60.856 1.00 90.36 ? 5 MAN A O5 1 HETATM 5029 O O6 . MAN H 4 . ? 9.197 37.366 59.481 1.00 90.25 ? 5 MAN A O6 1 HETATM 5030 C C1 . MAN I 4 . ? 11.464 43.902 71.933 1.00 88.37 ? 6 MAN A C1 1 HETATM 5031 C C2 . MAN I 4 . ? 12.695 44.800 71.782 1.00 88.62 ? 6 MAN A C2 1 HETATM 5032 C C3 . MAN I 4 . ? 13.955 43.999 72.089 1.00 88.44 ? 6 MAN A C3 1 HETATM 5033 C C4 . MAN I 4 . ? 13.824 43.349 73.462 1.00 88.24 ? 6 MAN A C4 1 HETATM 5034 C C5 . MAN I 4 . ? 12.499 42.602 73.608 1.00 88.33 ? 6 MAN A C5 1 HETATM 5035 C C6 . MAN I 4 . ? 12.286 42.103 75.031 1.00 88.15 ? 6 MAN A C6 1 HETATM 5036 O O2 . MAN I 4 . ? 12.642 45.912 72.654 1.00 88.88 ? 6 MAN A O2 1 HETATM 5037 O O3 . MAN I 4 . ? 15.087 44.843 72.048 1.00 88.45 ? 6 MAN A O3 1 HETATM 5038 O O4 . MAN I 4 . ? 14.884 42.436 73.627 1.00 88.09 ? 6 MAN A O4 1 HETATM 5039 O O5 . MAN I 4 . ? 11.399 43.425 73.259 1.00 88.55 ? 6 MAN A O5 1 HETATM 5040 O O6 . MAN I 4 . ? 10.991 41.550 75.102 1.00 87.85 ? 6 MAN A O6 1 HETATM 5041 C C1 . NAG J 2 . ? 15.262 49.282 32.118 1.00 68.74 ? 1 NAG B C1 1 HETATM 5042 C C2 . NAG J 2 . ? 14.800 48.356 30.993 1.00 70.18 ? 1 NAG B C2 1 HETATM 5043 C C3 . NAG J 2 . ? 14.378 47.021 31.585 1.00 70.43 ? 1 NAG B C3 1 HETATM 5044 C C4 . NAG J 2 . ? 15.503 46.430 32.426 1.00 70.93 ? 1 NAG B C4 1 HETATM 5045 C C5 . NAG J 2 . ? 16.032 47.457 33.429 1.00 70.10 ? 1 NAG B C5 1 HETATM 5046 C C6 . NAG J 2 . ? 17.227 46.927 34.223 1.00 69.92 ? 1 NAG B C6 1 HETATM 5047 C C7 . NAG J 2 . ? 13.675 49.020 28.913 1.00 70.86 ? 1 NAG B C7 1 HETATM 5048 C C8 . NAG J 2 . ? 12.434 49.611 28.312 1.00 70.63 ? 1 NAG B C8 1 HETATM 5049 N N2 . NAG J 2 . ? 13.683 48.917 30.246 1.00 70.56 ? 1 NAG B N2 1 HETATM 5050 O O3 . NAG J 2 . ? 14.068 46.132 30.540 1.00 70.41 ? 1 NAG B O3 1 HETATM 5051 O O4 . NAG J 2 . ? 14.989 45.318 33.131 1.00 72.19 ? 1 NAG B O4 1 HETATM 5052 O O5 . NAG J 2 . ? 16.351 48.680 32.794 1.00 69.16 ? 1 NAG B O5 1 HETATM 5053 O O6 . NAG J 2 . ? 18.273 46.554 33.356 1.00 69.79 ? 1 NAG B O6 1 HETATM 5054 O O7 . NAG J 2 . ? 14.607 48.672 28.183 1.00 71.16 ? 1 NAG B O7 1 HETATM 5055 C C1 . NAG K 2 . ? 15.347 44.066 32.524 1.00 73.06 ? 2 NAG B C1 1 HETATM 5056 C C2 . NAG K 2 . ? 15.549 43.035 33.627 1.00 73.40 ? 2 NAG B C2 1 HETATM 5057 C C3 . NAG K 2 . ? 15.930 41.697 33.007 1.00 74.25 ? 2 NAG B C3 1 HETATM 5058 C C4 . NAG K 2 . ? 14.905 41.284 31.952 1.00 75.00 ? 2 NAG B C4 1 HETATM 5059 C C5 . NAG K 2 . ? 14.643 42.420 30.967 1.00 74.44 ? 2 NAG B C5 1 HETATM 5060 C C6 . NAG K 2 . ? 13.523 42.087 29.988 1.00 74.14 ? 2 NAG B C6 1 HETATM 5061 C C7 . NAG K 2 . ? 16.544 43.457 35.831 1.00 72.61 ? 2 NAG B C7 1 HETATM 5062 C C8 . NAG K 2 . ? 17.778 43.872 36.577 1.00 72.82 ? 2 NAG B C8 1 HETATM 5063 N N2 . NAG K 2 . ? 16.641 43.429 34.501 1.00 72.96 ? 2 NAG B N2 1 HETATM 5064 O O3 . NAG K 2 . ? 16.021 40.733 34.037 1.00 73.31 ? 2 NAG B O3 1 HETATM 5065 O O4 . NAG K 2 . ? 15.392 40.169 31.233 1.00 76.86 ? 2 NAG B O4 1 HETATM 5066 O O5 . NAG K 2 . ? 14.346 43.628 31.636 1.00 73.68 ? 2 NAG B O5 1 HETATM 5067 O O6 . NAG K 2 . ? 12.324 41.968 30.714 1.00 74.06 ? 2 NAG B O6 1 HETATM 5068 O O7 . NAG K 2 . ? 15.519 43.188 36.452 1.00 72.26 ? 2 NAG B O7 1 HETATM 5069 C C1 . BMA L 3 . ? 14.642 38.979 31.544 1.00 78.13 ? 3 BMA B C1 1 HETATM 5070 C C2 . BMA L 3 . ? 14.802 37.963 30.416 1.00 78.70 ? 3 BMA B C2 1 HETATM 5071 C C3 . BMA L 3 . ? 14.037 36.695 30.768 1.00 79.56 ? 3 BMA B C3 1 HETATM 5072 C C4 . BMA L 3 . ? 14.544 36.176 32.109 1.00 79.70 ? 3 BMA B C4 1 HETATM 5073 C C5 . BMA L 3 . ? 14.361 37.267 33.153 1.00 79.77 ? 3 BMA B C5 1 HETATM 5074 C C6 . BMA L 3 . ? 14.850 36.807 34.514 1.00 80.58 ? 3 BMA B C6 1 HETATM 5075 O O2 . BMA L 3 . ? 16.163 37.664 30.210 1.00 78.27 ? 3 BMA B O2 1 HETATM 5076 O O3 . BMA L 3 . ? 14.247 35.720 29.771 1.00 80.64 ? 3 BMA B O3 1 HETATM 5077 O O4 . BMA L 3 . ? 13.840 35.023 32.511 1.00 79.50 ? 3 BMA B O4 1 HETATM 5078 O O5 . BMA L 3 . ? 15.062 38.426 32.772 1.00 78.79 ? 3 BMA B O5 1 HETATM 5079 O O6 . BMA L 3 . ? 16.160 36.319 34.351 1.00 82.35 ? 3 BMA B O6 1 HETATM 5080 C C1 . MAN M 4 . ? 16.440 35.451 35.461 1.00 83.68 ? 4 MAN B C1 1 HETATM 5081 C C2 . MAN M 4 . ? 17.251 36.221 36.492 1.00 83.91 ? 4 MAN B C2 1 HETATM 5082 C C3 . MAN M 4 . ? 18.675 36.456 36.006 1.00 84.07 ? 4 MAN B C3 1 HETATM 5083 C C4 . MAN M 4 . ? 19.311 35.142 35.556 1.00 84.19 ? 4 MAN B C4 1 HETATM 5084 C C5 . MAN M 4 . ? 18.407 34.416 34.567 1.00 84.39 ? 4 MAN B C5 1 HETATM 5085 C C6 . MAN M 4 . ? 18.970 33.037 34.231 1.00 84.44 ? 4 MAN B C6 1 HETATM 5086 O O2 . MAN M 4 . ? 17.257 35.477 37.689 1.00 84.16 ? 4 MAN B O2 1 HETATM 5087 O O3 . MAN M 4 . ? 19.402 37.044 37.066 1.00 83.84 ? 4 MAN B O3 1 HETATM 5088 O O4 . MAN M 4 . ? 20.543 35.376 34.906 1.00 84.09 ? 4 MAN B O4 1 HETATM 5089 O O5 . MAN M 4 . ? 17.096 34.258 35.076 1.00 84.37 ? 4 MAN B O5 1 HETATM 5090 O O6 . MAN M 4 . ? 20.360 33.005 34.466 1.00 84.06 ? 4 MAN B O6 1 HETATM 5091 C C1 . MAN N 4 . ? 12.987 35.162 29.367 1.00 81.70 ? 5 MAN B C1 1 HETATM 5092 C C2 . MAN N 4 . ? 13.249 33.816 28.704 1.00 82.16 ? 5 MAN B C2 1 HETATM 5093 C C3 . MAN N 4 . ? 13.951 34.040 27.374 1.00 82.48 ? 5 MAN B C3 1 HETATM 5094 C C4 . MAN N 4 . ? 13.123 34.981 26.507 1.00 82.45 ? 5 MAN B C4 1 HETATM 5095 C C5 . MAN N 4 . ? 12.918 36.290 27.262 1.00 82.29 ? 5 MAN B C5 1 HETATM 5096 C C6 . MAN N 4 . ? 12.065 37.289 26.486 1.00 82.36 ? 5 MAN B C6 1 HETATM 5097 O O2 . MAN N 4 . ? 12.042 33.114 28.486 1.00 82.15 ? 5 MAN B O2 1 HETATM 5098 O O3 . MAN N 4 . ? 14.121 32.798 26.733 1.00 82.84 ? 5 MAN B O3 1 HETATM 5099 O O4 . MAN N 4 . ? 13.790 35.197 25.285 1.00 82.51 ? 5 MAN B O4 1 HETATM 5100 O O5 . MAN N 4 . ? 12.281 36.024 28.495 1.00 82.14 ? 5 MAN B O5 1 HETATM 5101 O O6 . MAN N 4 . ? 12.049 38.501 27.213 1.00 82.27 ? 5 MAN B O6 1 HETATM 5102 C C1 . NAG O 2 . ? 72.238 36.877 65.240 1.00 68.54 ? 1 NAG E C1 1 HETATM 5103 C C2 . NAG O 2 . ? 71.194 36.680 66.336 1.00 68.85 ? 1 NAG E C2 1 HETATM 5104 C C3 . NAG O 2 . ? 69.805 36.677 65.704 1.00 69.33 ? 1 NAG E C3 1 HETATM 5105 C C4 . NAG O 2 . ? 69.592 37.987 64.948 1.00 69.81 ? 1 NAG E C4 1 HETATM 5106 C C5 . NAG O 2 . ? 70.746 38.195 63.969 1.00 69.61 ? 1 NAG E C5 1 HETATM 5107 C C6 . NAG O 2 . ? 70.612 39.518 63.219 1.00 69.64 ? 1 NAG E C6 1 HETATM 5108 C C7 . NAG O 2 . ? 71.431 35.319 68.356 1.00 68.07 ? 1 NAG E C7 1 HETATM 5109 C C8 . NAG O 2 . ? 71.678 33.946 68.912 1.00 67.71 ? 1 NAG E C8 1 HETATM 5110 N N2 . NAG O 2 . ? 71.426 35.425 67.028 1.00 68.39 ? 1 NAG E N2 1 HETATM 5111 O O3 . NAG O 2 . ? 68.810 36.458 66.687 1.00 68.87 ? 1 NAG E O3 1 HETATM 5112 O O4 . NAG O 2 . ? 68.383 37.950 64.219 1.00 71.04 ? 1 NAG E O4 1 HETATM 5113 O O5 . NAG O 2 . ? 71.995 38.129 64.635 1.00 69.06 ? 1 NAG E O5 1 HETATM 5114 O O6 . NAG O 2 . ? 71.805 40.262 63.307 1.00 69.54 ? 1 NAG E O6 1 HETATM 5115 O O7 . NAG O 2 . ? 71.251 36.274 69.111 1.00 67.79 ? 1 NAG E O7 1 HETATM 5116 C C1 . NAG P 2 . ? 67.357 38.827 64.730 1.00 72.35 ? 2 NAG E C1 1 HETATM 5117 C C2 . NAG P 2 . ? 66.503 39.368 63.578 1.00 72.95 ? 2 NAG E C2 1 HETATM 5118 C C3 . NAG P 2 . ? 65.411 40.295 64.100 1.00 73.59 ? 2 NAG E C3 1 HETATM 5119 C C4 . NAG P 2 . ? 64.592 39.620 65.197 1.00 74.14 ? 2 NAG E C4 1 HETATM 5120 C C5 . NAG P 2 . ? 65.499 38.923 66.216 1.00 73.90 ? 2 NAG E C5 1 HETATM 5121 C C6 . NAG P 2 . ? 64.683 38.035 67.152 1.00 73.76 ? 2 NAG E C6 1 HETATM 5122 C C7 . NAG P 2 . ? 67.722 39.566 61.440 1.00 72.86 ? 2 NAG E C7 1 HETATM 5123 C C8 . NAG P 2 . ? 68.504 40.481 60.543 1.00 72.40 ? 2 NAG E C8 1 HETATM 5124 N N2 . NAG P 2 . ? 67.285 40.095 62.587 1.00 72.90 ? 2 NAG E N2 1 HETATM 5125 O O3 . NAG P 2 . ? 64.576 40.671 63.022 1.00 73.22 ? 2 NAG E O3 1 HETATM 5126 O O4 . NAG P 2 . ? 63.789 40.591 65.850 1.00 75.47 ? 2 NAG E O4 1 HETATM 5127 O O5 . NAG P 2 . ? 66.510 38.135 65.616 1.00 72.91 ? 2 NAG E O5 1 HETATM 5128 O O6 . NAG P 2 . ? 64.329 36.851 66.470 1.00 73.64 ? 2 NAG E O6 1 HETATM 5129 O O7 . NAG P 2 . ? 67.523 38.400 61.095 1.00 73.03 ? 2 NAG E O7 1 HETATM 5130 C C1 . BMA Q 3 . ? 62.404 40.543 65.444 1.00 76.62 ? 3 BMA E C1 1 HETATM 5131 C C2 . BMA Q 3 . ? 61.518 40.814 66.654 1.00 77.10 ? 3 BMA E C2 1 HETATM 5132 C C3 . BMA Q 3 . ? 60.052 40.688 66.244 1.00 77.78 ? 3 BMA E C3 1 HETATM 5133 C C4 . BMA Q 3 . ? 59.777 41.604 65.058 1.00 77.92 ? 3 BMA E C4 1 HETATM 5134 C C5 . BMA Q 3 . ? 60.794 41.422 63.933 1.00 78.17 ? 3 BMA E C5 1 HETATM 5135 C C6 . BMA Q 3 . ? 60.523 42.521 62.907 1.00 78.69 ? 3 BMA E C6 1 HETATM 5136 O O2 . BMA Q 3 . ? 61.801 42.127 67.080 1.00 77.32 ? 3 BMA E O2 1 HETATM 5137 O O3 . BMA Q 3 . ? 59.051 40.986 67.204 1.00 78.56 ? 3 BMA E O3 1 HETATM 5138 O O4 . BMA Q 3 . ? 58.468 41.391 64.568 1.00 77.54 ? 3 BMA E O4 1 HETATM 5139 O O5 . BMA Q 3 . ? 62.112 41.497 64.442 1.00 77.25 ? 3 BMA E O5 1 HETATM 5140 O O6 . BMA Q 3 . ? 61.642 42.740 62.078 1.00 79.95 ? 3 BMA E O6 1 HETATM 5141 C C1 . MAN R 4 . ? 62.411 43.929 62.360 1.00 81.11 ? 4 MAN E C1 1 HETATM 5142 C C2 . MAN R 4 . ? 61.657 45.057 63.069 1.00 81.45 ? 4 MAN E C2 1 HETATM 5143 C C3 . MAN R 4 . ? 60.588 45.669 62.165 1.00 81.68 ? 4 MAN E C3 1 HETATM 5144 C C4 . MAN R 4 . ? 61.195 46.072 60.833 1.00 81.92 ? 4 MAN E C4 1 HETATM 5145 C C5 . MAN R 4 . ? 62.032 44.946 60.222 1.00 82.36 ? 4 MAN E C5 1 HETATM 5146 C C6 . MAN R 4 . ? 62.783 45.448 58.988 1.00 82.42 ? 4 MAN E C6 1 HETATM 5147 O O2 . MAN R 4 . ? 62.595 46.045 63.442 1.00 81.31 ? 4 MAN E O2 1 HETATM 5148 O O3 . MAN R 4 . ? 60.052 46.835 62.758 1.00 81.56 ? 4 MAN E O3 1 HETATM 5149 O O4 . MAN R 4 . ? 60.142 46.430 59.971 1.00 81.84 ? 4 MAN E O4 1 HETATM 5150 O O5 . MAN R 4 . ? 62.963 44.433 61.161 1.00 82.03 ? 4 MAN E O5 1 HETATM 5151 O O6 . MAN R 4 . ? 63.242 44.360 58.223 1.00 82.73 ? 4 MAN E O6 1 HETATM 5152 C C1 . MAN S 4 . ? 59.435 41.192 68.576 1.00 79.58 ? 5 MAN E C1 1 HETATM 5153 C C2 . MAN S 4 . ? 59.144 39.939 69.395 1.00 80.02 ? 5 MAN E C2 1 HETATM 5154 C C3 . MAN S 4 . ? 57.643 39.652 69.333 1.00 80.29 ? 5 MAN E C3 1 HETATM 5155 C C4 . MAN S 4 . ? 56.859 40.867 69.820 1.00 80.39 ? 5 MAN E C4 1 HETATM 5156 C C5 . MAN S 4 . ? 57.307 42.117 69.073 1.00 80.32 ? 5 MAN E C5 1 HETATM 5157 C C6 . MAN S 4 . ? 56.617 43.349 69.653 1.00 80.47 ? 5 MAN E C6 1 HETATM 5158 O O2 . MAN S 4 . ? 59.582 40.167 70.721 1.00 79.67 ? 5 MAN E O2 1 HETATM 5159 O O3 . MAN S 4 . ? 57.294 38.511 70.086 1.00 80.36 ? 5 MAN E O3 1 HETATM 5160 O O4 . MAN S 4 . ? 55.480 40.670 69.599 1.00 80.73 ? 5 MAN E O4 1 HETATM 5161 O O5 . MAN S 4 . ? 58.713 42.263 69.149 1.00 79.98 ? 5 MAN E O5 1 HETATM 5162 O O6 . MAN S 4 . ? 56.666 44.408 68.719 1.00 80.44 ? 5 MAN E O6 1 HETATM 5163 N N . NH4 T 5 . ? 56.732 46.234 55.916 1.00 59.02 ? 548 NH4 E N 1 HETATM 5164 O O . HOH U 6 . ? 21.838 41.259 67.890 1.00 42.67 ? 8 HOH A O 1 HETATM 5165 O O . HOH U 6 . ? 34.725 23.162 70.790 1.00 30.14 ? 11 HOH A O 1 HETATM 5166 O O . HOH U 6 . ? 16.157 23.518 66.742 1.00 49.53 ? 12 HOH A O 1 HETATM 5167 O O . HOH U 6 . ? 21.594 12.342 70.517 1.00 35.15 ? 13 HOH A O 1 HETATM 5168 O O . HOH U 6 . ? 22.002 33.121 74.497 1.00 28.42 ? 14 HOH A O 1 HETATM 5169 O O . HOH U 6 . ? 23.422 23.176 52.349 1.00 55.85 ? 16 HOH A O 1 HETATM 5170 O O . HOH U 6 . ? 20.832 43.100 56.828 1.00 30.72 ? 18 HOH A O 1 HETATM 5171 O O . HOH U 6 . ? 19.513 9.946 57.776 1.00 45.83 ? 23 HOH A O 1 HETATM 5172 O O . HOH U 6 . ? 21.039 35.565 67.930 1.00 30.26 ? 30 HOH A O 1 HETATM 5173 O O . HOH U 6 . ? 21.977 47.045 50.681 1.00 41.18 ? 40 HOH A O 1 HETATM 5174 O O . HOH U 6 . ? 32.150 19.709 56.282 1.00 35.61 ? 45 HOH A O 1 HETATM 5175 O O . HOH U 6 . ? 29.072 42.173 64.583 1.00 28.59 ? 49 HOH A O 1 HETATM 5176 O O . HOH U 6 . ? 32.779 38.671 78.178 1.00 48.15 ? 52 HOH A O 1 HETATM 5177 O O . HOH U 6 . ? 22.209 34.384 63.109 1.00 34.65 ? 63 HOH A O 1 HETATM 5178 O O . HOH U 6 . ? 16.831 29.769 61.926 1.00 46.77 ? 64 HOH A O 1 HETATM 5179 O O . HOH U 6 . ? 25.724 45.289 72.221 1.00 56.54 ? 69 HOH A O 1 HETATM 5180 O O . HOH U 6 . ? 16.785 7.905 65.105 1.00 47.72 ? 73 HOH A O 1 HETATM 5181 O O . HOH U 6 . ? 28.006 11.514 68.861 1.00 41.10 ? 74 HOH A O 1 HETATM 5182 O O . HOH U 6 . ? 29.616 13.440 72.439 1.00 42.22 ? 77 HOH A O 1 HETATM 5183 O O . HOH U 6 . ? 31.743 16.930 70.787 1.00 33.30 ? 82 HOH A O 1 HETATM 5184 O O . HOH U 6 . ? 37.934 35.045 67.966 1.00 43.66 ? 83 HOH A O 1 HETATM 5185 O O . HOH U 6 . ? 38.109 30.277 62.321 1.00 31.77 ? 88 HOH A O 1 HETATM 5186 O O . HOH U 6 . ? 15.236 8.591 71.921 1.00 37.97 ? 95 HOH A O 1 HETATM 5187 O O . HOH U 6 . ? 17.446 31.195 65.014 1.00 40.03 ? 105 HOH A O 1 HETATM 5188 O O . HOH U 6 . ? 26.171 26.956 49.925 1.00 45.10 ? 106 HOH A O 1 HETATM 5189 O O . HOH U 6 . ? 22.816 35.798 81.042 1.00 48.04 ? 118 HOH A O 1 HETATM 5190 O O . HOH U 6 . ? 19.688 42.368 63.017 1.00 37.87 ? 128 HOH A O 1 HETATM 5191 O O . HOH U 6 . ? 18.289 43.808 59.687 1.00 43.67 ? 132 HOH A O 1 HETATM 5192 O O . HOH U 6 . ? 36.912 38.025 73.202 1.00 46.27 ? 134 HOH A O 1 HETATM 5193 O O . HOH U 6 . ? 13.010 49.737 67.849 1.00 43.38 ? 137 HOH A O 1 HETATM 5194 O O . HOH U 6 . ? 20.691 42.353 51.727 1.00 46.79 ? 144 HOH A O 1 HETATM 5195 O O . HOH U 6 . ? 22.318 31.542 59.961 1.00 62.35 ? 145 HOH A O 1 HETATM 5196 O O . HOH U 6 . ? 19.609 14.009 69.018 1.00 41.19 ? 150 HOH A O 1 HETATM 5197 O O . HOH U 6 . ? 20.539 10.249 69.536 1.00 33.45 ? 157 HOH A O 1 HETATM 5198 O O . HOH U 6 . ? 22.778 39.131 67.491 1.00 35.79 ? 167 HOH A O 1 HETATM 5199 O O . HOH U 6 . ? 21.787 18.532 53.611 1.00 43.67 ? 170 HOH A O 1 HETATM 5200 O O . HOH U 6 . ? 19.428 5.231 58.600 1.00 50.73 ? 172 HOH A O 1 HETATM 5201 O O . HOH U 6 . ? 18.822 38.127 66.544 1.00 55.95 ? 177 HOH A O 1 HETATM 5202 O O . HOH U 6 . ? 39.464 41.833 66.904 1.00 64.64 ? 179 HOH A O 1 HETATM 5203 O O . HOH U 6 . ? 27.173 49.795 50.034 1.00 42.67 ? 181 HOH A O 1 HETATM 5204 O O . HOH U 6 . ? 33.486 19.164 70.896 1.00 39.54 ? 189 HOH A O 1 HETATM 5205 O O . HOH U 6 . ? 20.605 2.655 62.613 1.00 52.26 ? 193 HOH A O 1 HETATM 5206 O O . HOH U 6 . ? 17.036 50.427 46.504 1.00 44.53 ? 196 HOH A O 1 HETATM 5207 O O . HOH U 6 . ? 18.746 57.926 47.019 1.00 61.90 ? 198 HOH A O 1 HETATM 5208 O O . HOH U 6 . ? 22.708 35.209 65.832 1.00 49.99 ? 199 HOH A O 1 HETATM 5209 O O . HOH U 6 . ? 34.829 20.755 67.919 1.00 37.37 ? 202 HOH A O 1 HETATM 5210 O O . HOH U 6 . ? 16.249 28.659 55.720 1.00 53.19 ? 203 HOH A O 1 HETATM 5211 O O . HOH U 6 . ? 18.547 44.869 65.798 1.00 45.74 ? 204 HOH A O 1 HETATM 5212 O O . HOH U 6 . ? 27.250 7.983 71.079 1.00 46.28 ? 207 HOH A O 1 HETATM 5213 O O . HOH U 6 . ? 25.292 7.040 74.048 1.00 37.73 ? 212 HOH A O 1 HETATM 5214 O O . HOH U 6 . ? 26.011 47.301 66.518 1.00 50.19 ? 215 HOH A O 1 HETATM 5215 O O . HOH U 6 . ? 35.737 48.861 58.500 1.00 45.69 ? 216 HOH A O 1 HETATM 5216 O O . HOH U 6 . ? 16.802 54.097 45.194 1.00 48.39 ? 217 HOH A O 1 HETATM 5217 O O . HOH U 6 . ? 38.175 36.208 74.459 1.00 50.86 ? 220 HOH A O 1 HETATM 5218 O O . HOH U 6 . ? 17.869 21.500 64.480 1.00 36.15 ? 226 HOH A O 1 HETATM 5219 O O . HOH U 6 . ? 38.855 44.231 59.398 1.00 62.76 ? 232 HOH A O 1 HETATM 5220 O O . HOH U 6 . ? 23.525 3.263 57.324 1.00 51.43 ? 233 HOH A O 1 HETATM 5221 O O . HOH U 6 . ? 15.602 40.431 69.947 1.00 54.85 ? 234 HOH A O 1 HETATM 5222 O O . HOH U 6 . ? 33.783 12.123 53.007 1.00 47.72 ? 238 HOH A O 1 HETATM 5223 O O . HOH U 6 . ? 37.985 41.902 62.013 1.00 59.64 ? 241 HOH A O 1 HETATM 5224 O O . HOH U 6 . ? 30.513 33.578 55.824 1.00 48.71 ? 244 HOH A O 1 HETATM 5225 O O . HOH U 6 . ? 34.940 39.937 76.655 1.00 62.38 ? 245 HOH A O 1 HETATM 5226 O O . HOH U 6 . ? 14.172 48.771 48.135 1.00 51.85 ? 246 HOH A O 1 HETATM 5227 O O . HOH U 6 . ? 26.098 34.921 82.404 1.00 40.00 ? 247 HOH A O 1 HETATM 5228 O O . HOH U 6 . ? 14.120 35.890 65.329 1.00 54.24 ? 249 HOH A O 1 HETATM 5229 O O . HOH U 6 . ? 16.553 44.428 57.687 1.00 38.17 ? 253 HOH A O 1 HETATM 5230 O O . HOH U 6 . ? 22.925 6.461 56.231 1.00 60.50 ? 254 HOH A O 1 HETATM 5231 O O . HOH U 6 . ? 20.792 50.020 70.204 1.00 58.29 ? 255 HOH A O 1 HETATM 5232 O O . HOH U 6 . ? 21.737 37.426 58.115 1.00 51.47 ? 257 HOH A O 1 HETATM 5233 O O . HOH U 6 . ? 30.735 47.158 72.722 1.00 47.85 ? 259 HOH A O 1 HETATM 5234 O O . HOH U 6 . ? 17.258 3.617 67.362 1.00 55.63 ? 260 HOH A O 1 HETATM 5235 O O . HOH U 6 . ? 12.106 6.150 69.266 1.00 52.93 ? 261 HOH A O 1 HETATM 5236 O O . HOH U 6 . ? 35.326 25.745 55.982 1.00 58.29 ? 262 HOH A O 1 HETATM 5237 O O . HOH U 6 . ? 22.774 33.295 56.439 1.00 47.58 ? 265 HOH A O 1 HETATM 5238 O O . HOH U 6 . ? 27.825 32.250 52.762 1.00 52.37 ? 269 HOH A O 1 HETATM 5239 O O . HOH U 6 . ? 18.649 35.514 67.467 1.00 48.45 ? 274 HOH A O 1 HETATM 5240 O O . HOH U 6 . ? 12.879 39.520 70.347 1.00 48.46 ? 275 HOH A O 1 HETATM 5241 O O . HOH U 6 . ? 32.983 15.165 68.836 1.00 43.36 ? 277 HOH A O 1 HETATM 5242 O O . HOH U 6 . ? 21.813 36.896 61.829 1.00 51.94 ? 283 HOH A O 1 HETATM 5243 O O . HOH U 6 . ? 15.965 6.576 60.308 1.00 49.14 ? 285 HOH A O 1 HETATM 5244 O O . HOH U 6 . ? 26.571 4.870 65.457 1.00 46.69 ? 287 HOH A O 1 HETATM 5245 O O . HOH U 6 . ? 24.620 18.865 53.541 1.00 56.21 ? 294 HOH A O 1 HETATM 5246 O O . HOH U 6 . ? 21.600 26.009 59.265 1.00 42.61 ? 548 HOH A O 1 HETATM 5247 O O . HOH V 6 . ? 11.461 18.932 29.445 1.00 33.11 ? 6 HOH B O 1 HETATM 5248 O O . HOH V 6 . ? 26.571 27.795 26.142 1.00 29.71 ? 9 HOH B O 1 HETATM 5249 O O . HOH V 6 . ? 3.896 12.804 43.726 1.00 49.58 ? 10 HOH B O 1 HETATM 5250 O O . HOH V 6 . ? 14.102 27.221 50.724 1.00 47.62 ? 17 HOH B O 1 HETATM 5251 O O . HOH V 6 . ? 25.854 27.322 38.127 1.00 37.86 ? 20 HOH B O 1 HETATM 5252 O O . HOH V 6 . ? 6.958 21.173 41.082 1.00 30.36 ? 21 HOH B O 1 HETATM 5253 O O . HOH V 6 . ? 11.836 23.557 30.446 1.00 31.76 ? 22 HOH B O 1 HETATM 5254 O O . HOH V 6 . ? 16.702 27.841 44.044 1.00 25.75 ? 24 HOH B O 1 HETATM 5255 O O . HOH V 6 . ? 14.308 44.352 42.586 1.00 47.64 ? 27 HOH B O 1 HETATM 5256 O O . HOH V 6 . ? 12.109 35.434 37.500 1.00 32.50 ? 28 HOH B O 1 HETATM 5257 O O . HOH V 6 . ? 47.310 27.967 29.223 1.00 51.65 ? 29 HOH B O 1 HETATM 5258 O O . HOH V 6 . ? 23.753 26.896 19.263 1.00 51.38 ? 31 HOH B O 1 HETATM 5259 O O . HOH V 6 . ? 38.130 17.452 44.690 1.00 36.41 ? 32 HOH B O 1 HETATM 5260 O O . HOH V 6 . ? 39.699 23.701 47.271 1.00 55.26 ? 34 HOH B O 1 HETATM 5261 O O . HOH V 6 . ? 29.621 11.459 38.085 1.00 29.62 ? 35 HOH B O 1 HETATM 5262 O O . HOH V 6 . ? 6.533 24.293 49.370 1.00 36.63 ? 36 HOH B O 1 HETATM 5263 O O . HOH V 6 . ? 6.402 28.060 49.968 1.00 41.96 ? 37 HOH B O 1 HETATM 5264 O O . HOH V 6 . ? 17.501 12.233 38.362 1.00 32.77 ? 38 HOH B O 1 HETATM 5265 O O . HOH V 6 . ? 14.008 12.679 35.823 1.00 59.61 ? 41 HOH B O 1 HETATM 5266 O O . HOH V 6 . ? -0.479 20.251 43.037 1.00 36.90 ? 42 HOH B O 1 HETATM 5267 O O . HOH V 6 . ? 38.227 15.007 27.990 1.00 54.55 ? 43 HOH B O 1 HETATM 5268 O O . HOH V 6 . ? 16.878 26.862 37.198 1.00 37.38 ? 44 HOH B O 1 HETATM 5269 O O . HOH V 6 . ? 5.044 19.972 33.347 1.00 47.34 ? 46 HOH B O 1 HETATM 5270 O O . HOH V 6 . ? 14.211 14.832 38.646 1.00 43.77 ? 50 HOH B O 1 HETATM 5271 O O . HOH V 6 . ? 42.908 18.160 28.675 1.00 34.11 ? 51 HOH B O 1 HETATM 5272 O O . HOH V 6 . ? -1.046 33.798 43.710 1.00 43.77 ? 56 HOH B O 1 HETATM 5273 O O . HOH V 6 . ? 36.074 32.234 33.945 1.00 27.85 ? 57 HOH B O 1 HETATM 5274 O O . HOH V 6 . ? 34.569 12.716 29.739 1.00 49.52 ? 59 HOH B O 1 HETATM 5275 O O . HOH V 6 . ? 11.055 18.928 51.998 1.00 43.57 ? 62 HOH B O 1 HETATM 5276 O O . HOH V 6 . ? 51.654 24.258 45.839 1.00 49.92 ? 65 HOH B O 1 HETATM 5277 O O . HOH V 6 . ? 28.700 19.615 47.856 1.00 51.39 ? 66 HOH B O 1 HETATM 5278 O O . HOH V 6 . ? 13.629 29.110 35.209 1.00 36.30 ? 67 HOH B O 1 HETATM 5279 O O . HOH V 6 . ? -0.291 30.879 52.724 1.00 46.69 ? 68 HOH B O 1 HETATM 5280 O O . HOH V 6 . ? 41.013 17.429 43.917 1.00 40.19 ? 72 HOH B O 1 HETATM 5281 O O . HOH V 6 . ? 49.744 28.840 29.840 1.00 37.11 ? 75 HOH B O 1 HETATM 5282 O O . HOH V 6 . ? 52.253 32.676 34.788 1.00 49.73 ? 80 HOH B O 1 HETATM 5283 O O . HOH V 6 . ? 24.834 11.531 32.143 1.00 28.55 ? 84 HOH B O 1 HETATM 5284 O O . HOH V 6 . ? 3.632 19.071 35.636 1.00 44.91 ? 86 HOH B O 1 HETATM 5285 O O . HOH V 6 . ? 20.270 26.885 33.560 1.00 37.33 ? 87 HOH B O 1 HETATM 5286 O O . HOH V 6 . ? 0.893 19.258 38.937 1.00 38.60 ? 89 HOH B O 1 HETATM 5287 O O . HOH V 6 . ? 36.801 14.407 29.945 1.00 44.87 ? 90 HOH B O 1 HETATM 5288 O O . HOH V 6 . ? 5.205 18.926 37.890 1.00 32.06 ? 91 HOH B O 1 HETATM 5289 O O . HOH V 6 . ? 31.801 32.838 45.443 1.00 46.29 ? 93 HOH B O 1 HETATM 5290 O O . HOH V 6 . ? 22.802 27.347 39.367 1.00 50.24 ? 96 HOH B O 1 HETATM 5291 O O . HOH V 6 . ? 24.211 8.003 44.446 1.00 53.91 ? 101 HOH B O 1 HETATM 5292 O O . HOH V 6 . ? 24.200 11.033 40.372 1.00 33.99 ? 107 HOH B O 1 HETATM 5293 O O . HOH V 6 . ? 24.559 28.651 32.854 1.00 41.06 ? 108 HOH B O 1 HETATM 5294 O O . HOH V 6 . ? -2.424 28.910 42.666 1.00 53.52 ? 109 HOH B O 1 HETATM 5295 O O . HOH V 6 . ? 18.295 29.125 48.682 1.00 58.42 ? 110 HOH B O 1 HETATM 5296 O O . HOH V 6 . ? 37.965 31.769 35.862 1.00 37.93 ? 111 HOH B O 1 HETATM 5297 O O . HOH V 6 . ? 50.978 20.219 27.012 1.00 57.09 ? 112 HOH B O 1 HETATM 5298 O O . HOH V 6 . ? 43.426 14.997 32.889 1.00 30.12 ? 115 HOH B O 1 HETATM 5299 O O . HOH V 6 . ? 54.907 33.490 36.039 1.00 56.11 ? 116 HOH B O 1 HETATM 5300 O O . HOH V 6 . ? 14.859 31.683 43.238 1.00 38.28 ? 117 HOH B O 1 HETATM 5301 O O . HOH V 6 . ? 33.166 13.878 44.468 1.00 37.28 ? 121 HOH B O 1 HETATM 5302 O O . HOH V 6 . ? 11.828 21.098 36.159 1.00 40.35 ? 123 HOH B O 1 HETATM 5303 O O . HOH V 6 . ? 28.595 12.952 40.101 1.00 53.29 ? 125 HOH B O 1 HETATM 5304 O O . HOH V 6 . ? -1.592 28.645 48.665 1.00 36.08 ? 127 HOH B O 1 HETATM 5305 O O . HOH V 6 . ? 9.072 12.301 46.997 1.00 45.48 ? 135 HOH B O 1 HETATM 5306 O O . HOH V 6 . ? 24.355 34.572 19.350 1.00 59.05 ? 138 HOH B O 1 HETATM 5307 O O . HOH V 6 . ? 7.445 33.178 33.542 1.00 43.97 ? 141 HOH B O 1 HETATM 5308 O O . HOH V 6 . ? 37.709 12.040 33.136 1.00 62.69 ? 142 HOH B O 1 HETATM 5309 O O . HOH V 6 . ? 27.314 26.646 44.093 1.00 54.18 ? 146 HOH B O 1 HETATM 5310 O O . HOH V 6 . ? 2.493 19.909 48.175 1.00 37.50 ? 147 HOH B O 1 HETATM 5311 O O . HOH V 6 . ? 49.903 26.877 23.476 1.00 63.59 ? 148 HOH B O 1 HETATM 5312 O O . HOH V 6 . ? 13.204 24.866 51.361 1.00 49.97 ? 149 HOH B O 1 HETATM 5313 O O . HOH V 6 . ? 23.434 11.870 25.506 1.00 40.40 ? 151 HOH B O 1 HETATM 5314 O O . HOH V 6 . ? 40.981 16.106 29.236 1.00 47.61 ? 152 HOH B O 1 HETATM 5315 O O . HOH V 6 . ? 34.285 27.993 41.143 1.00 45.44 ? 158 HOH B O 1 HETATM 5316 O O . HOH V 6 . ? 29.727 27.110 42.176 1.00 44.85 ? 160 HOH B O 1 HETATM 5317 O O . HOH V 6 . ? 8.731 19.661 51.108 1.00 42.95 ? 163 HOH B O 1 HETATM 5318 O O . HOH V 6 . ? 30.849 8.825 36.215 1.00 44.64 ? 173 HOH B O 1 HETATM 5319 O O . HOH V 6 . ? 4.635 16.802 48.974 1.00 50.03 ? 174 HOH B O 1 HETATM 5320 O O . HOH V 6 . ? 45.789 29.907 30.589 1.00 36.06 ? 178 HOH B O 1 HETATM 5321 O O . HOH V 6 . ? 7.135 25.757 34.733 1.00 45.92 ? 184 HOH B O 1 HETATM 5322 O O . HOH V 6 . ? 7.293 22.176 53.127 1.00 55.22 ? 185 HOH B O 1 HETATM 5323 O O . HOH V 6 . ? 5.831 26.049 51.389 1.00 49.30 ? 188 HOH B O 1 HETATM 5324 O O . HOH V 6 . ? 51.755 22.207 27.805 1.00 55.30 ? 191 HOH B O 1 HETATM 5325 O O . HOH V 6 . ? 19.466 10.962 30.052 1.00 44.39 ? 192 HOH B O 1 HETATM 5326 O O . HOH V 6 . ? 43.583 33.777 37.919 1.00 51.29 ? 194 HOH B O 1 HETATM 5327 O O . HOH V 6 . ? 20.189 28.669 21.691 1.00 45.20 ? 201 HOH B O 1 HETATM 5328 O O . HOH V 6 . ? 22.476 14.509 45.166 1.00 48.19 ? 206 HOH B O 1 HETATM 5329 O O . HOH V 6 . ? -0.214 21.002 40.557 1.00 50.87 ? 210 HOH B O 1 HETATM 5330 O O . HOH V 6 . ? 2.309 35.798 49.232 1.00 43.68 ? 211 HOH B O 1 HETATM 5331 O O . HOH V 6 . ? 4.375 34.467 50.673 1.00 47.16 ? 213 HOH B O 1 HETATM 5332 O O . HOH V 6 . ? 12.056 21.174 52.488 1.00 51.44 ? 214 HOH B O 1 HETATM 5333 O O . HOH V 6 . ? 24.989 26.988 34.907 1.00 47.64 ? 218 HOH B O 1 HETATM 5334 O O . HOH V 6 . ? -4.891 27.766 45.240 1.00 48.72 ? 219 HOH B O 1 HETATM 5335 O O . HOH V 6 . ? 51.276 29.782 41.472 1.00 34.78 ? 222 HOH B O 1 HETATM 5336 O O . HOH V 6 . ? 42.650 36.439 33.329 1.00 57.83 ? 223 HOH B O 1 HETATM 5337 O O . HOH V 6 . ? 23.348 10.700 34.138 1.00 40.51 ? 224 HOH B O 1 HETATM 5338 O O . HOH V 6 . ? 21.813 12.519 27.466 1.00 44.96 ? 227 HOH B O 1 HETATM 5339 O O . HOH V 6 . ? 8.255 45.386 30.606 1.00 75.36 ? 228 HOH B O 1 HETATM 5340 O O . HOH V 6 . ? 6.580 30.613 34.217 1.00 57.30 ? 231 HOH B O 1 HETATM 5341 O O . HOH V 6 . ? 5.900 38.927 30.858 1.00 54.96 ? 236 HOH B O 1 HETATM 5342 O O . HOH V 6 . ? 8.679 23.024 34.022 1.00 48.94 ? 237 HOH B O 1 HETATM 5343 O O . HOH V 6 . ? 31.139 18.636 47.711 1.00 47.98 ? 239 HOH B O 1 HETATM 5344 O O . HOH V 6 . ? 16.437 34.211 40.907 1.00 65.94 ? 240 HOH B O 1 HETATM 5345 O O . HOH V 6 . ? 56.317 29.684 28.482 1.00 48.64 ? 250 HOH B O 1 HETATM 5346 O O . HOH V 6 . ? 2.828 31.217 33.448 1.00 52.94 ? 251 HOH B O 1 HETATM 5347 O O . HOH V 6 . ? 20.755 9.074 33.163 1.00 47.47 ? 256 HOH B O 1 HETATM 5348 O O . HOH V 6 . ? 28.162 28.268 37.007 1.00 52.74 ? 266 HOH B O 1 HETATM 5349 O O . HOH V 6 . ? 49.471 16.185 42.737 1.00 47.86 ? 267 HOH B O 1 HETATM 5350 O O . HOH V 6 . ? 10.635 41.199 52.485 1.00 46.97 ? 268 HOH B O 1 HETATM 5351 O O . HOH V 6 . ? 29.987 31.697 38.732 1.00 55.79 ? 278 HOH B O 1 HETATM 5352 O O . HOH V 6 . ? 31.038 27.574 45.927 1.00 53.78 ? 279 HOH B O 1 HETATM 5353 O O . HOH V 6 . ? 26.471 10.138 37.277 1.00 47.95 ? 280 HOH B O 1 HETATM 5354 O O . HOH V 6 . ? 13.866 43.616 50.856 1.00 50.01 ? 282 HOH B O 1 HETATM 5355 O O . HOH V 6 . ? 12.091 28.784 55.035 1.00 60.19 ? 292 HOH B O 1 HETATM 5356 O O . HOH V 6 . ? 45.987 20.394 26.657 1.00 45.24 ? 293 HOH B O 1 HETATM 5357 O O . HOH V 6 . ? 52.450 19.505 35.835 1.00 63.47 ? 295 HOH B O 1 HETATM 5358 O O . HOH V 6 . ? 5.928 17.404 51.453 1.00 58.95 ? 296 HOH B O 1 HETATM 5359 O O . HOH V 6 . ? 32.169 25.796 42.695 1.00 27.38 ? 548 HOH B O 1 HETATM 5360 O O . HOH V 6 . ? 17.896 20.328 36.371 1.00 23.97 ? 549 HOH B O 1 HETATM 5361 O O . HOH V 6 . ? 3.854 18.384 29.762 1.00 48.60 ? 550 HOH B O 1 HETATM 5362 O O . HOH W 6 . ? 45.639 31.918 53.708 1.00 49.86 ? 7 HOH E O 1 HETATM 5363 O O . HOH W 6 . ? 73.881 67.922 70.040 1.00 39.15 ? 15 HOH E O 1 HETATM 5364 O O . HOH W 6 . ? 70.115 58.217 66.132 1.00 41.76 ? 19 HOH E O 1 HETATM 5365 O O . HOH W 6 . ? 44.094 43.423 55.140 1.00 37.42 ? 25 HOH E O 1 HETATM 5366 O O . HOH W 6 . ? 63.277 73.341 52.750 1.00 53.52 ? 33 HOH E O 1 HETATM 5367 O O . HOH W 6 . ? 63.260 73.242 69.471 1.00 26.48 ? 39 HOH E O 1 HETATM 5368 O O . HOH W 6 . ? 79.284 69.457 58.513 1.00 37.21 ? 47 HOH E O 1 HETATM 5369 O O . HOH W 6 . ? 54.887 47.929 52.651 1.00 31.66 ? 48 HOH E O 1 HETATM 5370 O O . HOH W 6 . ? 52.320 46.667 45.555 1.00 50.66 ? 58 HOH E O 1 HETATM 5371 O O . HOH W 6 . ? 40.542 38.705 55.686 1.00 44.04 ? 85 HOH E O 1 HETATM 5372 O O . HOH W 6 . ? 41.145 40.974 44.812 1.00 42.61 ? 94 HOH E O 1 HETATM 5373 O O . HOH W 6 . ? 59.177 49.240 53.459 1.00 39.98 ? 98 HOH E O 1 HETATM 5374 O O . HOH W 6 . ? 44.561 34.642 60.776 1.00 66.32 ? 100 HOH E O 1 HETATM 5375 O O . HOH W 6 . ? 53.872 48.829 64.101 1.00 39.18 ? 103 HOH E O 1 HETATM 5376 O O . HOH W 6 . ? 62.436 39.536 50.951 1.00 38.99 ? 119 HOH E O 1 HETATM 5377 O O . HOH W 6 . ? 47.168 47.625 44.243 1.00 50.96 ? 120 HOH E O 1 HETATM 5378 O O . HOH W 6 . ? 54.611 51.157 63.540 1.00 39.28 ? 122 HOH E O 1 HETATM 5379 O O . HOH W 6 . ? 45.727 32.055 47.792 1.00 41.92 ? 124 HOH E O 1 HETATM 5380 O O . HOH W 6 . ? 57.079 48.764 48.502 1.00 66.67 ? 126 HOH E O 1 HETATM 5381 O O . HOH W 6 . ? 66.221 60.209 58.470 1.00 52.18 ? 133 HOH E O 1 HETATM 5382 O O . HOH W 6 . ? 57.378 44.520 53.436 1.00 40.08 ? 136 HOH E O 1 HETATM 5383 O O . HOH W 6 . ? 43.197 51.029 66.813 1.00 44.61 ? 143 HOH E O 1 HETATM 5384 O O . HOH W 6 . ? 49.717 49.241 57.833 1.00 49.56 ? 153 HOH E O 1 HETATM 5385 O O . HOH W 6 . ? 58.189 40.588 59.921 1.00 50.03 ? 154 HOH E O 1 HETATM 5386 O O . HOH W 6 . ? 64.950 71.749 54.432 1.00 47.08 ? 156 HOH E O 1 HETATM 5387 O O . HOH W 6 . ? 73.600 70.116 71.287 1.00 39.77 ? 161 HOH E O 1 HETATM 5388 O O . HOH W 6 . ? 55.825 47.287 59.028 1.00 48.31 ? 176 HOH E O 1 HETATM 5389 O O . HOH W 6 . ? 42.164 51.083 62.107 1.00 54.14 ? 182 HOH E O 1 HETATM 5390 O O . HOH W 6 . ? 60.655 29.153 48.753 1.00 58.73 ? 186 HOH E O 1 HETATM 5391 O O . HOH W 6 . ? 38.304 44.803 65.515 1.00 53.38 ? 190 HOH E O 1 HETATM 5392 O O . HOH W 6 . ? 58.496 46.589 50.364 1.00 59.28 ? 195 HOH E O 1 HETATM 5393 O O . HOH W 6 . ? 49.940 46.983 44.797 1.00 54.38 ? 197 HOH E O 1 HETATM 5394 O O . HOH W 6 . ? 61.238 44.392 67.397 1.00 53.28 ? 200 HOH E O 1 HETATM 5395 O O . HOH W 6 . ? 68.212 78.329 55.826 1.00 54.35 ? 205 HOH E O 1 HETATM 5396 O O . HOH W 6 . ? 54.238 31.751 47.339 1.00 44.17 ? 208 HOH E O 1 HETATM 5397 O O . HOH W 6 . ? 46.284 41.010 46.969 1.00 44.77 ? 209 HOH E O 1 HETATM 5398 O O . HOH W 6 . ? 58.424 44.209 57.599 1.00 51.73 ? 242 HOH E O 1 HETATM 5399 O O . HOH W 6 . ? 55.812 26.436 52.991 1.00 53.84 ? 243 HOH E O 1 HETATM 5400 O O . HOH W 6 . ? 65.113 82.079 64.367 1.00 63.20 ? 248 HOH E O 1 HETATM 5401 O O . HOH W 6 . ? 39.401 44.050 46.808 1.00 53.25 ? 252 HOH E O 1 HETATM 5402 O O . HOH W 6 . ? 43.842 48.111 44.321 1.00 44.75 ? 263 HOH E O 1 HETATM 5403 O O . HOH W 6 . ? 46.778 48.662 57.853 1.00 49.15 ? 270 HOH E O 1 HETATM 5404 O O . HOH W 6 . ? 41.512 55.560 45.850 1.00 58.55 ? 271 HOH E O 1 HETATM 5405 O O . HOH W 6 . ? 42.615 45.630 64.870 1.00 61.23 ? 273 HOH E O 1 HETATM 5406 O O . HOH W 6 . ? 64.770 75.625 67.213 1.00 46.83 ? 276 HOH E O 1 HETATM 5407 O O . HOH W 6 . ? 66.957 79.470 60.608 1.00 62.02 ? 286 HOH E O 1 HETATM 5408 O O . HOH W 6 . ? 58.707 32.595 65.941 1.00 53.27 ? 288 HOH E O 1 HETATM 5409 O O . HOH W 6 . ? 47.596 39.539 45.378 1.00 58.05 ? 290 HOH E O 1 HETATM 5410 O O . HOH W 6 . ? 62.518 69.569 53.642 1.00 36.49 ? 549 HOH E O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 ALA 1 325 ? ? ? A . n A 1 2 ASP 2 326 ? ? ? A . n A 1 3 PRO 3 327 ? ? ? A . n A 1 4 CYS 4 328 ? ? ? A . n A 1 5 ALA 5 329 ? ? ? A . n A 1 6 ASP 6 330 ? ? ? A . n A 1 7 SER 7 331 ? ? ? A . n A 1 8 ASN 8 332 ? ? ? A . n A 1 9 PRO 9 333 ? ? ? A . n A 1 10 ARG 10 334 ? ? ? A . n A 1 11 GLY 11 335 ? ? ? A . n A 1 12 VAL 12 336 336 VAL VAL A . n A 1 13 SER 13 337 337 SER SER A . n A 1 14 ALA 14 338 338 ALA ALA A . n A 1 15 TYR 15 339 339 TYR TYR A . n A 1 16 LEU 16 340 340 LEU LEU A . n A 1 17 SER 17 341 341 SER SER A . n A 1 18 ARG 18 342 342 ARG ARG A . n A 1 19 PRO 19 343 343 PRO PRO A . n A 1 20 SER 20 344 344 SER SER A . n A 1 21 PRO 21 345 345 PRO PRO A . n A 1 22 PHE 22 346 346 PHE PHE A . n A 1 23 ASP 23 347 347 ASP ASP A . n A 1 24 LEU 24 348 348 LEU LEU A . n A 1 25 PHE 25 349 349 PHE PHE A . n A 1 26 ILE 26 350 350 ILE ILE A . n A 1 27 ARG 27 351 351 ARG ARG A . n A 1 28 LYS 28 352 352 LYS LYS A . n A 1 29 SER 29 353 353 SER SER A . n A 1 30 PRO 30 354 354 PRO PRO A . n A 1 31 THR 31 355 355 THR THR A . n A 1 32 ILE 32 356 356 ILE ILE A . n A 1 33 THR 33 357 357 THR THR A . n A 1 34 CYS 34 358 358 CYS CYS A . n A 1 35 LEU 35 359 359 LEU LEU A . n A 1 36 VAL 36 360 360 VAL VAL A . n A 1 37 VAL 37 361 361 VAL VAL A . n A 1 38 ASP 38 362 362 ASP ASP A . n A 1 39 LEU 39 363 363 LEU LEU A . n A 1 40 ALA 40 364 364 ALA ALA A . n A 1 41 PRO 41 365 365 PRO PRO A . n A 1 42 SER 42 366 366 SER SER A . n A 1 43 LYS 43 367 367 LYS LYS A . n A 1 44 GLY 44 368 368 GLY GLY A . n A 1 45 THR 45 369 369 THR THR A . n A 1 46 VAL 46 370 370 VAL VAL A . n A 1 47 GLN 47 371 371 GLN GLN A . n A 1 48 LEU 48 372 372 LEU LEU A . n A 1 49 THR 49 373 373 THR THR A . n A 1 50 TRP 50 374 374 TRP TRP A . n A 1 51 SER 51 375 375 SER SER A . n A 1 52 ARG 52 376 376 ARG ARG A . n A 1 53 ALA 53 377 377 ALA ALA A . n A 1 54 SER 54 378 378 SER SER A . n A 1 55 GLY 55 379 379 GLY GLY A . n A 1 56 LYS 56 380 380 LYS LYS A . n A 1 57 PRO 57 381 381 PRO PRO A . n A 1 58 VAL 58 382 382 VAL VAL A . n A 1 59 GLN 59 383 383 GLN GLN A . n A 1 60 HIS 60 384 384 HIS HIS A . n A 1 61 SER 61 385 385 SER SER A . n A 1 62 THR 62 386 386 THR THR A . n A 1 63 ARG 63 387 387 ARG ARG A . n A 1 64 LYS 64 388 388 LYS LYS A . n A 1 65 GLU 65 389 389 GLU GLU A . n A 1 66 GLU 66 390 390 GLU GLU A . n A 1 67 LYS 67 391 391 LYS LYS A . n A 1 68 GLN 68 392 392 GLN GLN A . n A 1 69 ARG 69 393 393 ARG ARG A . n A 1 70 ASN 70 394 394 ASN ASN A . n A 1 71 GLY 71 395 395 GLY GLY A . n A 1 72 THR 72 396 396 THR THR A . n A 1 73 LEU 73 397 397 LEU LEU A . n A 1 74 THR 74 398 398 THR THR A . n A 1 75 VAL 75 399 399 VAL VAL A . n A 1 76 THR 76 400 400 THR THR A . n A 1 77 SER 77 401 401 SER SER A . n A 1 78 THR 78 402 402 THR THR A . n A 1 79 LEU 79 403 403 LEU LEU A . n A 1 80 PRO 80 404 404 PRO PRO A . n A 1 81 VAL 81 405 405 VAL VAL A . n A 1 82 GLY 82 406 406 GLY GLY A . n A 1 83 THR 83 407 407 THR THR A . n A 1 84 ARG 84 408 408 ARG ARG A . n A 1 85 ASP 85 409 409 ASP ASP A . n A 1 86 TRP 86 410 410 TRP TRP A . n A 1 87 ILE 87 411 411 ILE ILE A . n A 1 88 GLU 88 412 412 GLU GLU A . n A 1 89 GLY 89 413 413 GLY GLY A . n A 1 90 GLU 90 414 414 GLU GLU A . n A 1 91 THR 91 415 415 THR THR A . n A 1 92 TYR 92 416 416 TYR TYR A . n A 1 93 GLN 93 417 417 GLN GLN A . n A 1 94 CYS 94 418 418 CYS CYS A . n A 1 95 ARG 95 419 419 ARG ARG A . n A 1 96 VAL 96 420 420 VAL VAL A . n A 1 97 THR 97 421 421 THR THR A . n A 1 98 HIS 98 422 422 HIS HIS A . n A 1 99 PRO 99 423 423 PRO PRO A . n A 1 100 HIS 100 424 424 HIS HIS A . n A 1 101 LEU 101 425 425 LEU LEU A . n A 1 102 PRO 102 426 426 PRO PRO A . n A 1 103 ARG 103 427 427 ARG ARG A . n A 1 104 ALA 104 428 428 ALA ALA A . n A 1 105 LEU 105 429 429 LEU LEU A . n A 1 106 MET 106 430 430 MET MET A . n A 1 107 ARG 107 431 431 ARG ARG A . n A 1 108 SER 108 432 432 SER SER A . n A 1 109 THR 109 433 433 THR THR A . n A 1 110 THR 110 434 434 THR THR A . n A 1 111 LYS 111 435 435 LYS LYS A . n A 1 112 THR 112 436 436 THR THR A . n A 1 113 SER 113 437 437 SER SER A . n A 1 114 GLY 114 438 438 GLY GLY A . n A 1 115 PRO 115 439 439 PRO PRO A . n A 1 116 ARG 116 440 440 ARG ARG A . n A 1 117 ALA 117 441 441 ALA ALA A . n A 1 118 ALA 118 442 442 ALA ALA A . n A 1 119 PRO 119 443 443 PRO PRO A . n A 1 120 GLU 120 444 444 GLU GLU A . n A 1 121 VAL 121 445 445 VAL VAL A . n A 1 122 TYR 122 446 446 TYR TYR A . n A 1 123 ALA 123 447 447 ALA ALA A . n A 1 124 PHE 124 448 448 PHE PHE A . n A 1 125 ALA 125 449 449 ALA ALA A . n A 1 126 THR 126 450 450 THR THR A . n A 1 127 PRO 127 451 451 PRO PRO A . n A 1 128 GLU 128 452 452 GLU GLU A . n A 1 129 TRP 129 453 453 TRP TRP A . n A 1 130 PRO 130 454 454 PRO PRO A . n A 1 131 GLY 131 455 455 GLY GLY A . n A 1 132 SER 132 456 456 SER SER A . n A 1 133 ARG 133 457 457 ARG ARG A . n A 1 134 ASP 134 458 458 ASP ASP A . n A 1 135 LYS 135 459 459 LYS LYS A . n A 1 136 ARG 136 460 460 ARG ARG A . n A 1 137 THR 137 461 461 THR THR A . n A 1 138 LEU 138 462 462 LEU LEU A . n A 1 139 ALA 139 463 463 ALA ALA A . n A 1 140 CYS 140 464 464 CYS CYS A . n A 1 141 LEU 141 465 465 LEU LEU A . n A 1 142 ILE 142 466 466 ILE ILE A . n A 1 143 GLN 143 467 467 GLN GLN A . n A 1 144 ASN 144 468 468 ASN ASN A . n A 1 145 PHE 145 469 469 PHE PHE A . n A 1 146 MET 146 470 470 MET MET A . n A 1 147 PRO 147 471 471 PRO PRO A . n A 1 148 GLU 148 472 472 GLU GLU A . n A 1 149 ASP 149 473 473 ASP ASP A . n A 1 150 ILE 150 474 474 ILE ILE A . n A 1 151 SER 151 475 475 SER SER A . n A 1 152 VAL 152 476 476 VAL VAL A . n A 1 153 GLN 153 477 477 GLN GLN A . n A 1 154 TRP 154 478 478 TRP TRP A . n A 1 155 LEU 155 479 479 LEU LEU A . n A 1 156 HIS 156 480 480 HIS HIS A . n A 1 157 ASN 157 481 481 ASN ASN A . n A 1 158 GLU 158 482 482 GLU GLU A . n A 1 159 VAL 159 483 483 VAL VAL A . n A 1 160 GLN 160 484 484 GLN GLN A . n A 1 161 LEU 161 485 485 LEU LEU A . n A 1 162 PRO 162 486 486 PRO PRO A . n A 1 163 ASP 163 487 487 ASP ASP A . n A 1 164 ALA 164 488 488 ALA ALA A . n A 1 165 ARG 165 489 489 ARG ARG A . n A 1 166 HIS 166 490 490 HIS HIS A . n A 1 167 SER 167 491 491 SER SER A . n A 1 168 THR 168 492 492 THR THR A . n A 1 169 THR 169 493 493 THR THR A . n A 1 170 GLN 170 494 494 GLN GLN A . n A 1 171 PRO 171 495 495 PRO PRO A . n A 1 172 ARG 172 496 496 ARG ARG A . n A 1 173 LYS 173 497 497 LYS LYS A . n A 1 174 THR 174 498 498 THR THR A . n A 1 175 LYS 175 499 499 LYS LYS A . n A 1 176 GLY 176 500 500 GLY GLY A . n A 1 177 SER 177 501 501 SER SER A . n A 1 178 GLY 178 502 502 GLY GLY A . n A 1 179 PHE 179 503 503 PHE PHE A . n A 1 180 PHE 180 504 504 PHE PHE A . n A 1 181 VAL 181 505 505 VAL VAL A . n A 1 182 PHE 182 506 506 PHE PHE A . n A 1 183 SER 183 507 507 SER SER A . n A 1 184 ARG 184 508 508 ARG ARG A . n A 1 185 LEU 185 509 509 LEU LEU A . n A 1 186 GLU 186 510 510 GLU GLU A . n A 1 187 VAL 187 511 511 VAL VAL A . n A 1 188 THR 188 512 512 THR THR A . n A 1 189 ARG 189 513 513 ARG ARG A . n A 1 190 ALA 190 514 514 ALA ALA A . n A 1 191 GLU 191 515 515 GLU GLU A . n A 1 192 TRP 192 516 516 TRP TRP A . n A 1 193 GLU 193 517 517 GLU GLU A . n A 1 194 GLN 194 518 518 GLN GLN A . n A 1 195 LYS 195 519 519 LYS LYS A . n A 1 196 ASP 196 520 520 ASP ASP A . n A 1 197 GLU 197 521 521 GLU GLU A . n A 1 198 PHE 198 522 522 PHE PHE A . n A 1 199 ILE 199 523 523 ILE ILE A . n A 1 200 CYS 200 524 524 CYS CYS A . n A 1 201 ARG 201 525 525 ARG ARG A . n A 1 202 ALA 202 526 526 ALA ALA A . n A 1 203 VAL 203 527 527 VAL VAL A . n A 1 204 HIS 204 528 528 HIS HIS A . n A 1 205 GLU 205 529 529 GLU GLU A . n A 1 206 ALA 206 530 530 ALA ALA A . n A 1 207 ALA 207 531 531 ALA ALA A . n A 1 208 SER 208 532 532 SER SER A . n A 1 209 PRO 209 533 533 PRO PRO A . n A 1 210 SER 210 534 534 SER SER A . n A 1 211 GLN 211 535 535 GLN GLN A . n A 1 212 THR 212 536 536 THR THR A . n A 1 213 VAL 213 537 537 VAL VAL A . n A 1 214 GLN 214 538 538 GLN GLN A . n A 1 215 ARG 215 539 539 ARG ARG A . n A 1 216 ALA 216 540 540 ALA ALA A . n A 1 217 VAL 217 541 541 VAL VAL A . n A 1 218 SER 218 542 542 SER SER A . n A 1 219 VAL 219 543 543 VAL VAL A . n A 1 220 ASN 220 544 544 ASN ASN A . n A 1 221 PRO 221 545 ? ? ? A . n A 1 222 GLY 222 546 ? ? ? A . n A 1 223 LYS 223 547 ? ? ? A . n B 1 1 ALA 1 325 ? ? ? B . n B 1 2 ASP 2 326 ? ? ? B . n B 1 3 PRO 3 327 ? ? ? B . n B 1 4 CYS 4 328 ? ? ? B . n B 1 5 ALA 5 329 ? ? ? B . n B 1 6 ASP 6 330 ? ? ? B . n B 1 7 SER 7 331 ? ? ? B . n B 1 8 ASN 8 332 ? ? ? B . n B 1 9 PRO 9 333 ? ? ? B . n B 1 10 ARG 10 334 ? ? ? B . n B 1 11 GLY 11 335 335 GLY GLY B . n B 1 12 VAL 12 336 336 VAL VAL B . n B 1 13 SER 13 337 337 SER SER B . n B 1 14 ALA 14 338 338 ALA ALA B . n B 1 15 TYR 15 339 339 TYR TYR B . n B 1 16 LEU 16 340 340 LEU LEU B . n B 1 17 SER 17 341 341 SER SER B . n B 1 18 ARG 18 342 342 ARG ARG B . n B 1 19 PRO 19 343 343 PRO PRO B . n B 1 20 SER 20 344 344 SER SER B . n B 1 21 PRO 21 345 345 PRO PRO B . n B 1 22 PHE 22 346 346 PHE PHE B . n B 1 23 ASP 23 347 347 ASP ASP B . n B 1 24 LEU 24 348 348 LEU LEU B . n B 1 25 PHE 25 349 349 PHE PHE B . n B 1 26 ILE 26 350 350 ILE ILE B . n B 1 27 ARG 27 351 351 ARG ARG B . n B 1 28 LYS 28 352 352 LYS LYS B . n B 1 29 SER 29 353 353 SER SER B . n B 1 30 PRO 30 354 354 PRO PRO B . n B 1 31 THR 31 355 355 THR THR B . n B 1 32 ILE 32 356 356 ILE ILE B . n B 1 33 THR 33 357 357 THR THR B . n B 1 34 CYS 34 358 358 CYS CYS B . n B 1 35 LEU 35 359 359 LEU LEU B . n B 1 36 VAL 36 360 360 VAL VAL B . n B 1 37 VAL 37 361 361 VAL VAL B . n B 1 38 ASP 38 362 362 ASP ASP B . n B 1 39 LEU 39 363 363 LEU GLY B . n B 1 40 ALA 40 364 364 ALA ALA B . n B 1 41 PRO 41 365 365 PRO PRO B . n B 1 42 SER 42 366 366 SER SER B . n B 1 43 LYS 43 367 367 LYS LYS B . n B 1 44 GLY 44 368 368 GLY GLY B . n B 1 45 THR 45 369 369 THR THR B . n B 1 46 VAL 46 370 370 VAL VAL B . n B 1 47 GLN 47 371 371 GLN GLN B . n B 1 48 LEU 48 372 372 LEU LEU B . n B 1 49 THR 49 373 373 THR THR B . n B 1 50 TRP 50 374 374 TRP TRP B . n B 1 51 SER 51 375 375 SER SER B . n B 1 52 ARG 52 376 376 ARG ARG B . n B 1 53 ALA 53 377 377 ALA ALA B . n B 1 54 SER 54 378 378 SER SER B . n B 1 55 GLY 55 379 379 GLY GLY B . n B 1 56 LYS 56 380 380 LYS LYS B . n B 1 57 PRO 57 381 381 PRO PRO B . n B 1 58 VAL 58 382 382 VAL VAL B . n B 1 59 GLN 59 383 383 GLN GLN B . n B 1 60 HIS 60 384 384 HIS HIS B . n B 1 61 SER 61 385 385 SER SER B . n B 1 62 THR 62 386 386 THR THR B . n B 1 63 ARG 63 387 387 ARG ARG B . n B 1 64 LYS 64 388 388 LYS LYS B . n B 1 65 GLU 65 389 389 GLU GLU B . n B 1 66 GLU 66 390 390 GLU GLU B . n B 1 67 LYS 67 391 391 LYS LYS B . n B 1 68 GLN 68 392 392 GLN GLN B . n B 1 69 ARG 69 393 393 ARG ARG B . n B 1 70 ASN 70 394 394 ASN ASN B . n B 1 71 GLY 71 395 395 GLY GLY B . n B 1 72 THR 72 396 396 THR THR B . n B 1 73 LEU 73 397 397 LEU LEU B . n B 1 74 THR 74 398 398 THR THR B . n B 1 75 VAL 75 399 399 VAL VAL B . n B 1 76 THR 76 400 400 THR THR B . n B 1 77 SER 77 401 401 SER SER B . n B 1 78 THR 78 402 402 THR THR B . n B 1 79 LEU 79 403 403 LEU LEU B . n B 1 80 PRO 80 404 404 PRO PRO B . n B 1 81 VAL 81 405 405 VAL VAL B . n B 1 82 GLY 82 406 406 GLY GLY B . n B 1 83 THR 83 407 407 THR THR B . n B 1 84 ARG 84 408 408 ARG ARG B . n B 1 85 ASP 85 409 409 ASP ASP B . n B 1 86 TRP 86 410 410 TRP TRP B . n B 1 87 ILE 87 411 411 ILE ILE B . n B 1 88 GLU 88 412 412 GLU GLU B . n B 1 89 GLY 89 413 413 GLY GLY B . n B 1 90 GLU 90 414 414 GLU GLU B . n B 1 91 THR 91 415 415 THR THR B . n B 1 92 TYR 92 416 416 TYR TYR B . n B 1 93 GLN 93 417 417 GLN GLN B . n B 1 94 CYS 94 418 418 CYS CYS B . n B 1 95 ARG 95 419 419 ARG ARG B . n B 1 96 VAL 96 420 420 VAL VAL B . n B 1 97 THR 97 421 421 THR THR B . n B 1 98 HIS 98 422 422 HIS HIS B . n B 1 99 PRO 99 423 423 PRO PRO B . n B 1 100 HIS 100 424 424 HIS HIS B . n B 1 101 LEU 101 425 425 LEU LEU B . n B 1 102 PRO 102 426 426 PRO PRO B . n B 1 103 ARG 103 427 427 ARG ARG B . n B 1 104 ALA 104 428 428 ALA ALA B . n B 1 105 LEU 105 429 429 LEU LEU B . n B 1 106 MET 106 430 430 MET MET B . n B 1 107 ARG 107 431 431 ARG ARG B . n B 1 108 SER 108 432 432 SER SER B . n B 1 109 THR 109 433 433 THR THR B . n B 1 110 THR 110 434 434 THR THR B . n B 1 111 LYS 111 435 435 LYS LYS B . n B 1 112 THR 112 436 436 THR THR B . n B 1 113 SER 113 437 437 SER SER B . n B 1 114 GLY 114 438 438 GLY GLY B . n B 1 115 PRO 115 439 439 PRO PRO B . n B 1 116 ARG 116 440 440 ARG ARG B . n B 1 117 ALA 117 441 441 ALA ALA B . n B 1 118 ALA 118 442 442 ALA ALA B . n B 1 119 PRO 119 443 443 PRO PRO B . n B 1 120 GLU 120 444 444 GLU GLU B . n B 1 121 VAL 121 445 445 VAL VAL B . n B 1 122 TYR 122 446 446 TYR TYR B . n B 1 123 ALA 123 447 447 ALA ALA B . n B 1 124 PHE 124 448 448 PHE PHE B . n B 1 125 ALA 125 449 449 ALA ALA B . n B 1 126 THR 126 450 450 THR THR B . n B 1 127 PRO 127 451 451 PRO PRO B . n B 1 128 GLU 128 452 452 GLU GLU B . n B 1 129 TRP 129 453 453 TRP TRP B . n B 1 130 PRO 130 454 454 PRO PRO B . n B 1 131 GLY 131 455 455 GLY GLY B . n B 1 132 SER 132 456 456 SER SER B . n B 1 133 ARG 133 457 457 ARG ARG B . n B 1 134 ASP 134 458 458 ASP ASP B . n B 1 135 LYS 135 459 459 LYS LYS B . n B 1 136 ARG 136 460 460 ARG ARG B . n B 1 137 THR 137 461 461 THR THR B . n B 1 138 LEU 138 462 462 LEU LEU B . n B 1 139 ALA 139 463 463 ALA ALA B . n B 1 140 CYS 140 464 464 CYS CYS B . n B 1 141 LEU 141 465 465 LEU LEU B . n B 1 142 ILE 142 466 466 ILE ILE B . n B 1 143 GLN 143 467 467 GLN GLN B . n B 1 144 ASN 144 468 468 ASN ASN B . n B 1 145 PHE 145 469 469 PHE PHE B . n B 1 146 MET 146 470 470 MET MET B . n B 1 147 PRO 147 471 471 PRO PRO B . n B 1 148 GLU 148 472 472 GLU GLU B . n B 1 149 ASP 149 473 473 ASP ASP B . n B 1 150 ILE 150 474 474 ILE ILE B . n B 1 151 SER 151 475 475 SER SER B . n B 1 152 VAL 152 476 476 VAL VAL B . n B 1 153 GLN 153 477 477 GLN GLN B . n B 1 154 TRP 154 478 478 TRP TRP B . n B 1 155 LEU 155 479 479 LEU LEU B . n B 1 156 HIS 156 480 480 HIS HIS B . n B 1 157 ASN 157 481 481 ASN ASN B . n B 1 158 GLU 158 482 482 GLU GLU B . n B 1 159 VAL 159 483 483 VAL VAL B . n B 1 160 GLN 160 484 484 GLN GLN B . n B 1 161 LEU 161 485 485 LEU LEU B . n B 1 162 PRO 162 486 486 PRO PRO B . n B 1 163 ASP 163 487 487 ASP ASP B . n B 1 164 ALA 164 488 488 ALA ALA B . n B 1 165 ARG 165 489 489 ARG ARG B . n B 1 166 HIS 166 490 490 HIS HIS B . n B 1 167 SER 167 491 491 SER SER B . n B 1 168 THR 168 492 492 THR THR B . n B 1 169 THR 169 493 493 THR THR B . n B 1 170 GLN 170 494 494 GLN GLN B . n B 1 171 PRO 171 495 495 PRO PRO B . n B 1 172 ARG 172 496 496 ARG ARG B . n B 1 173 LYS 173 497 497 LYS LYS B . n B 1 174 THR 174 498 498 THR THR B . n B 1 175 LYS 175 499 499 LYS LYS B . n B 1 176 GLY 176 500 500 GLY GLY B . n B 1 177 SER 177 501 501 SER SER B . n B 1 178 GLY 178 502 502 GLY GLY B . n B 1 179 PHE 179 503 503 PHE PHE B . n B 1 180 PHE 180 504 504 PHE PHE B . n B 1 181 VAL 181 505 505 VAL VAL B . n B 1 182 PHE 182 506 506 PHE PHE B . n B 1 183 SER 183 507 507 SER SER B . n B 1 184 ARG 184 508 508 ARG ARG B . n B 1 185 LEU 185 509 509 LEU LEU B . n B 1 186 GLU 186 510 510 GLU GLU B . n B 1 187 VAL 187 511 511 VAL VAL B . n B 1 188 THR 188 512 512 THR THR B . n B 1 189 ARG 189 513 513 ARG ARG B . n B 1 190 ALA 190 514 514 ALA ALA B . n B 1 191 GLU 191 515 515 GLU GLU B . n B 1 192 TRP 192 516 516 TRP TRP B . n B 1 193 GLU 193 517 517 GLU GLU B . n B 1 194 GLN 194 518 518 GLN GLN B . n B 1 195 LYS 195 519 519 LYS LYS B . n B 1 196 ASP 196 520 520 ASP ASP B . n B 1 197 GLU 197 521 521 GLU GLU B . n B 1 198 PHE 198 522 522 PHE PHE B . n B 1 199 ILE 199 523 523 ILE ILE B . n B 1 200 CYS 200 524 524 CYS CYS B . n B 1 201 ARG 201 525 525 ARG ARG B . n B 1 202 ALA 202 526 526 ALA ALA B . n B 1 203 VAL 203 527 527 VAL VAL B . n B 1 204 HIS 204 528 528 HIS HIS B . n B 1 205 GLU 205 529 529 GLU GLU B . n B 1 206 ALA 206 530 530 ALA ALA B . n B 1 207 ALA 207 531 531 ALA ALA B . n B 1 208 SER 208 532 532 SER SER B . n B 1 209 PRO 209 533 533 PRO PRO B . n B 1 210 SER 210 534 534 SER SER B . n B 1 211 GLN 211 535 535 GLN GLN B . n B 1 212 THR 212 536 536 THR THR B . n B 1 213 VAL 213 537 537 VAL VAL B . n B 1 214 GLN 214 538 538 GLN GLN B . n B 1 215 ARG 215 539 539 ARG ARG B . n B 1 216 ALA 216 540 540 ALA ALA B . n B 1 217 VAL 217 541 541 VAL VAL B . n B 1 218 SER 218 542 542 SER SER B . n B 1 219 VAL 219 543 543 VAL VAL B . n B 1 220 ASN 220 544 544 ASN ASN B . n B 1 221 PRO 221 545 ? ? ? B . n B 1 222 GLY 222 546 ? ? ? B . n B 1 223 LYS 223 547 ? ? ? B . n C 1 1 ALA 1 325 ? ? ? E . n C 1 2 ASP 2 326 ? ? ? E . n C 1 3 PRO 3 327 ? ? ? E . n C 1 4 CYS 4 328 ? ? ? E . n C 1 5 ALA 5 329 ? ? ? E . n C 1 6 ASP 6 330 ? ? ? E . n C 1 7 SER 7 331 ? ? ? E . n C 1 8 ASN 8 332 ? ? ? E . n C 1 9 PRO 9 333 ? ? ? E . n C 1 10 ARG 10 334 ? ? ? E . n C 1 11 GLY 11 335 ? ? ? E . n C 1 12 VAL 12 336 336 VAL VAL E . n C 1 13 SER 13 337 337 SER SER E . n C 1 14 ALA 14 338 338 ALA ALA E . n C 1 15 TYR 15 339 339 TYR TYR E . n C 1 16 LEU 16 340 340 LEU LEU E . n C 1 17 SER 17 341 341 SER SER E . n C 1 18 ARG 18 342 342 ARG ARG E . n C 1 19 PRO 19 343 343 PRO PRO E . n C 1 20 SER 20 344 344 SER SER E . n C 1 21 PRO 21 345 345 PRO PRO E . n C 1 22 PHE 22 346 346 PHE PHE E . n C 1 23 ASP 23 347 347 ASP ASP E . n C 1 24 LEU 24 348 348 LEU LEU E . n C 1 25 PHE 25 349 349 PHE PHE E . n C 1 26 ILE 26 350 350 ILE ILE E . n C 1 27 ARG 27 351 351 ARG ARG E . n C 1 28 LYS 28 352 352 LYS LYS E . n C 1 29 SER 29 353 353 SER SER E . n C 1 30 PRO 30 354 354 PRO PRO E . n C 1 31 THR 31 355 355 THR THR E . n C 1 32 ILE 32 356 356 ILE ILE E . n C 1 33 THR 33 357 357 THR THR E . n C 1 34 CYS 34 358 358 CYS CYS E . n C 1 35 LEU 35 359 359 LEU LEU E . n C 1 36 VAL 36 360 360 VAL VAL E . n C 1 37 VAL 37 361 361 VAL VAL E . n C 1 38 ASP 38 362 362 ASP ASP E . n C 1 39 LEU 39 363 363 LEU LEU E . n C 1 40 ALA 40 364 364 ALA ALA E . n C 1 41 PRO 41 365 365 PRO PRO E . n C 1 42 SER 42 366 366 SER SER E . n C 1 43 LYS 43 367 367 LYS LYS E . n C 1 44 GLY 44 368 368 GLY GLY E . n C 1 45 THR 45 369 369 THR THR E . n C 1 46 VAL 46 370 370 VAL VAL E . n C 1 47 GLN 47 371 371 GLN GLN E . n C 1 48 LEU 48 372 372 LEU LEU E . n C 1 49 THR 49 373 373 THR THR E . n C 1 50 TRP 50 374 374 TRP TRP E . n C 1 51 SER 51 375 375 SER SER E . n C 1 52 ARG 52 376 376 ARG ARG E . n C 1 53 ALA 53 377 377 ALA ALA E . n C 1 54 SER 54 378 378 SER SER E . n C 1 55 GLY 55 379 379 GLY GLY E . n C 1 56 LYS 56 380 380 LYS LYS E . n C 1 57 PRO 57 381 381 PRO PRO E . n C 1 58 VAL 58 382 382 VAL VAL E . n C 1 59 GLN 59 383 383 GLN GLN E . n C 1 60 HIS 60 384 384 HIS HIS E . n C 1 61 SER 61 385 385 SER SER E . n C 1 62 THR 62 386 386 THR THR E . n C 1 63 ARG 63 387 387 ARG ARG E . n C 1 64 LYS 64 388 388 LYS LYS E . n C 1 65 GLU 65 389 389 GLU GLU E . n C 1 66 GLU 66 390 390 GLU GLU E . n C 1 67 LYS 67 391 391 LYS LYS E . n C 1 68 GLN 68 392 392 GLN GLN E . n C 1 69 ARG 69 393 393 ARG ARG E . n C 1 70 ASN 70 394 394 ASN ASN E . n C 1 71 GLY 71 395 395 GLY GLY E . n C 1 72 THR 72 396 396 THR THR E . n C 1 73 LEU 73 397 397 LEU LEU E . n C 1 74 THR 74 398 398 THR THR E . n C 1 75 VAL 75 399 399 VAL VAL E . n C 1 76 THR 76 400 400 THR THR E . n C 1 77 SER 77 401 401 SER SER E . n C 1 78 THR 78 402 402 THR THR E . n C 1 79 LEU 79 403 403 LEU LEU E . n C 1 80 PRO 80 404 404 PRO PRO E . n C 1 81 VAL 81 405 405 VAL VAL E . n C 1 82 GLY 82 406 406 GLY GLY E . n C 1 83 THR 83 407 407 THR THR E . n C 1 84 ARG 84 408 408 ARG ARG E . n C 1 85 ASP 85 409 409 ASP ASP E . n C 1 86 TRP 86 410 410 TRP TRP E . n C 1 87 ILE 87 411 411 ILE ILE E . n C 1 88 GLU 88 412 412 GLU GLU E . n C 1 89 GLY 89 413 413 GLY GLY E . n C 1 90 GLU 90 414 414 GLU GLU E . n C 1 91 THR 91 415 415 THR THR E . n C 1 92 TYR 92 416 416 TYR TYR E . n C 1 93 GLN 93 417 417 GLN GLN E . n C 1 94 CYS 94 418 418 CYS CYS E . n C 1 95 ARG 95 419 419 ARG ARG E . n C 1 96 VAL 96 420 420 VAL VAL E . n C 1 97 THR 97 421 421 THR THR E . n C 1 98 HIS 98 422 422 HIS HIS E . n C 1 99 PRO 99 423 423 PRO PRO E . n C 1 100 HIS 100 424 424 HIS HIS E . n C 1 101 LEU 101 425 425 LEU LEU E . n C 1 102 PRO 102 426 426 PRO PRO E . n C 1 103 ARG 103 427 427 ARG ARG E . n C 1 104 ALA 104 428 428 ALA ALA E . n C 1 105 LEU 105 429 429 LEU LEU E . n C 1 106 MET 106 430 430 MET MET E . n C 1 107 ARG 107 431 431 ARG ARG E . n C 1 108 SER 108 432 432 SER SER E . n C 1 109 THR 109 433 433 THR THR E . n C 1 110 THR 110 434 434 THR THR E . n C 1 111 LYS 111 435 435 LYS LYS E . n C 1 112 THR 112 436 436 THR THR E . n C 1 113 SER 113 437 437 SER SER E . n C 1 114 GLY 114 438 438 GLY GLY E . n C 1 115 PRO 115 439 439 PRO PRO E . n C 1 116 ARG 116 440 440 ARG ARG E . n C 1 117 ALA 117 441 441 ALA ALA E . n C 1 118 ALA 118 442 442 ALA ALA E . n C 1 119 PRO 119 443 443 PRO PRO E . n C 1 120 GLU 120 444 444 GLU GLU E . n C 1 121 VAL 121 445 445 VAL VAL E . n C 1 122 TYR 122 446 446 TYR TYR E . n C 1 123 ALA 123 447 447 ALA ALA E . n C 1 124 PHE 124 448 448 PHE PHE E . n C 1 125 ALA 125 449 449 ALA ALA E . n C 1 126 THR 126 450 450 THR THR E . n C 1 127 PRO 127 451 451 PRO PRO E . n C 1 128 GLU 128 452 452 GLU GLU E . n C 1 129 TRP 129 453 453 TRP TRP E . n C 1 130 PRO 130 454 454 PRO PRO E . n C 1 131 GLY 131 455 455 GLY GLY E . n C 1 132 SER 132 456 456 SER SER E . n C 1 133 ARG 133 457 457 ARG ARG E . n C 1 134 ASP 134 458 458 ASP ASP E . n C 1 135 LYS 135 459 459 LYS LYS E . n C 1 136 ARG 136 460 460 ARG ARG E . n C 1 137 THR 137 461 461 THR THR E . n C 1 138 LEU 138 462 462 LEU LEU E . n C 1 139 ALA 139 463 463 ALA ALA E . n C 1 140 CYS 140 464 464 CYS CYS E . n C 1 141 LEU 141 465 465 LEU LEU E . n C 1 142 ILE 142 466 466 ILE ILE E . n C 1 143 GLN 143 467 467 GLN GLN E . n C 1 144 ASN 144 468 468 ASN ASN E . n C 1 145 PHE 145 469 469 PHE PHE E . n C 1 146 MET 146 470 470 MET MET E . n C 1 147 PRO 147 471 471 PRO PRO E . n C 1 148 GLU 148 472 472 GLU GLU E . n C 1 149 ASP 149 473 473 ASP ASP E . n C 1 150 ILE 150 474 474 ILE ILE E . n C 1 151 SER 151 475 475 SER SER E . n C 1 152 VAL 152 476 476 VAL VAL E . n C 1 153 GLN 153 477 477 GLN GLN E . n C 1 154 TRP 154 478 478 TRP TRP E . n C 1 155 LEU 155 479 479 LEU LEU E . n C 1 156 HIS 156 480 480 HIS HIS E . n C 1 157 ASN 157 481 481 ASN ASN E . n C 1 158 GLU 158 482 482 GLU GLU E . n C 1 159 VAL 159 483 483 VAL VAL E . n C 1 160 GLN 160 484 484 GLN GLN E . n C 1 161 LEU 161 485 485 LEU LEU E . n C 1 162 PRO 162 486 486 PRO PRO E . n C 1 163 ASP 163 487 487 ASP ASP E . n C 1 164 ALA 164 488 488 ALA ALA E . n C 1 165 ARG 165 489 489 ARG ARG E . n C 1 166 HIS 166 490 490 HIS HIS E . n C 1 167 SER 167 491 491 SER SER E . n C 1 168 THR 168 492 492 THR THR E . n C 1 169 THR 169 493 493 THR THR E . n C 1 170 GLN 170 494 494 GLN GLN E . n C 1 171 PRO 171 495 495 PRO PRO E . n C 1 172 ARG 172 496 496 ARG ARG E . n C 1 173 LYS 173 497 497 LYS LYS E . n C 1 174 THR 174 498 498 THR THR E . n C 1 175 LYS 175 499 499 LYS LYS E . n C 1 176 GLY 176 500 500 GLY GLY E . n C 1 177 SER 177 501 501 SER SER E . n C 1 178 GLY 178 502 502 GLY GLY E . n C 1 179 PHE 179 503 503 PHE PHE E . n C 1 180 PHE 180 504 504 PHE PHE E . n C 1 181 VAL 181 505 505 VAL VAL E . n C 1 182 PHE 182 506 506 PHE PHE E . n C 1 183 SER 183 507 507 SER SER E . n C 1 184 ARG 184 508 508 ARG ARG E . n C 1 185 LEU 185 509 509 LEU LEU E . n C 1 186 GLU 186 510 510 GLU GLU E . n C 1 187 VAL 187 511 511 VAL VAL E . n C 1 188 THR 188 512 512 THR THR E . n C 1 189 ARG 189 513 513 ARG ARG E . n C 1 190 ALA 190 514 514 ALA ALA E . n C 1 191 GLU 191 515 515 GLU GLU E . n C 1 192 TRP 192 516 516 TRP TRP E . n C 1 193 GLU 193 517 517 GLU GLU E . n C 1 194 GLN 194 518 518 GLN GLN E . n C 1 195 LYS 195 519 519 LYS LYS E . n C 1 196 ASP 196 520 520 ASP ASP E . n C 1 197 GLU 197 521 521 GLU GLU E . n C 1 198 PHE 198 522 522 PHE PHE E . n C 1 199 ILE 199 523 523 ILE ILE E . n C 1 200 CYS 200 524 524 CYS CYS E . n C 1 201 ARG 201 525 525 ARG ARG E . n C 1 202 ALA 202 526 526 ALA ALA E . n C 1 203 VAL 203 527 527 VAL VAL E . n C 1 204 HIS 204 528 528 HIS HIS E . n C 1 205 GLU 205 529 529 GLU GLU E . n C 1 206 ALA 206 530 530 ALA ALA E . n C 1 207 ALA 207 531 531 ALA ALA E . n C 1 208 SER 208 532 532 SER SER E . n C 1 209 PRO 209 533 533 PRO PRO E . n C 1 210 SER 210 534 534 SER SER E . n C 1 211 GLN 211 535 535 GLN GLN E . n C 1 212 THR 212 536 536 THR THR E . n C 1 213 VAL 213 537 537 VAL VAL E . n C 1 214 GLN 214 538 538 GLN GLN E . n C 1 215 ARG 215 539 539 ARG ARG E . n C 1 216 ALA 216 540 540 ALA ALA E . n C 1 217 VAL 217 541 541 VAL VAL E . n C 1 218 SER 218 542 542 SER SER E . n C 1 219 VAL 219 543 543 VAL VAL E . n C 1 220 ASN 220 544 544 ASN ASN E . n C 1 221 PRO 221 545 ? ? ? E . n C 1 222 GLY 222 546 ? ? ? E . n C 1 223 LYS 223 547 ? ? ? E . 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 D 2 NAG 1 1 1 NAG NAG A . E 2 NAG 2 2 2 NAG NAG A . F 3 BMA 3 3 3 BMA BMA A . G 4 MAN 4 4 4 MAN MAN A . H 4 MAN 5 5 5 MAN MAN A . I 4 MAN 6 6 6 MAN MAN A . J 2 NAG 1 1 1 NAG NAG B . K 2 NAG 2 2 2 NAG NAG B . L 3 BMA 3 3 3 BMA BMA B . M 4 MAN 4 4 4 MAN MAN B . N 4 MAN 5 5 5 MAN MAN B . O 2 NAG 1 1 1 NAG NAG E . P 2 NAG 2 2 2 NAG NAG E . Q 3 BMA 3 3 3 BMA BMA E . R 4 MAN 4 4 4 MAN MAN E . S 4 MAN 5 5 5 MAN MAN E . T 5 NH4 1 548 1 NH4 NH4 E . U 6 HOH 1 8 8 HOH HOH A . U 6 HOH 2 11 11 HOH HOH A . U 6 HOH 3 12 12 HOH HOH A . U 6 HOH 4 13 13 HOH HOH A . U 6 HOH 5 14 14 HOH HOH A . U 6 HOH 6 16 16 HOH HOH A . U 6 HOH 7 18 18 HOH HOH A . U 6 HOH 8 23 23 HOH HOH A . U 6 HOH 9 30 30 HOH HOH A . U 6 HOH 10 40 40 HOH HOH A . U 6 HOH 11 45 45 HOH HOH A . U 6 HOH 12 49 49 HOH HOH A . U 6 HOH 13 52 52 HOH HOH A . U 6 HOH 14 63 63 HOH HOH A . U 6 HOH 15 64 64 HOH HOH A . U 6 HOH 16 69 69 HOH HOH A . U 6 HOH 17 73 73 HOH HOH A . U 6 HOH 18 74 74 HOH HOH A . U 6 HOH 19 77 77 HOH HOH A . U 6 HOH 20 82 82 HOH HOH A . U 6 HOH 21 83 83 HOH HOH A . U 6 HOH 22 88 88 HOH HOH A . U 6 HOH 23 95 95 HOH HOH A . U 6 HOH 24 105 105 HOH HOH A . U 6 HOH 25 106 106 HOH HOH A . U 6 HOH 26 118 118 HOH HOH A . U 6 HOH 27 128 128 HOH HOH A . U 6 HOH 28 132 132 HOH HOH A . U 6 HOH 29 134 134 HOH HOH A . U 6 HOH 30 137 137 HOH HOH A . U 6 HOH 31 144 144 HOH HOH A . U 6 HOH 32 145 145 HOH HOH A . U 6 HOH 33 150 150 HOH HOH A . U 6 HOH 34 157 157 HOH HOH A . U 6 HOH 35 167 167 HOH HOH A . U 6 HOH 36 170 170 HOH HOH A . U 6 HOH 37 172 172 HOH HOH A . U 6 HOH 38 177 177 HOH HOH A . U 6 HOH 39 179 179 HOH HOH A . U 6 HOH 40 181 181 HOH HOH A . U 6 HOH 41 189 189 HOH HOH A . U 6 HOH 42 193 193 HOH HOH A . U 6 HOH 43 196 196 HOH HOH A . U 6 HOH 44 198 198 HOH HOH A . U 6 HOH 45 199 199 HOH HOH A . U 6 HOH 46 202 202 HOH HOH A . U 6 HOH 47 203 203 HOH HOH A . U 6 HOH 48 204 204 HOH HOH A . U 6 HOH 49 207 207 HOH HOH A . U 6 HOH 50 212 212 HOH HOH A . U 6 HOH 51 215 215 HOH HOH A . U 6 HOH 52 216 216 HOH HOH A . U 6 HOH 53 217 217 HOH HOH A . U 6 HOH 54 220 220 HOH HOH A . U 6 HOH 55 226 226 HOH HOH A . U 6 HOH 56 232 232 HOH HOH A . U 6 HOH 57 233 233 HOH HOH A . U 6 HOH 58 234 234 HOH HOH A . U 6 HOH 59 238 238 HOH HOH A . U 6 HOH 60 241 241 HOH HOH A . U 6 HOH 61 244 244 HOH HOH A . U 6 HOH 62 245 245 HOH HOH A . U 6 HOH 63 246 246 HOH HOH A . U 6 HOH 64 247 247 HOH HOH A . U 6 HOH 65 249 249 HOH HOH A . U 6 HOH 66 253 253 HOH HOH A . U 6 HOH 67 254 254 HOH HOH A . U 6 HOH 68 255 255 HOH HOH A . U 6 HOH 69 257 257 HOH HOH A . U 6 HOH 70 259 259 HOH HOH A . U 6 HOH 71 260 260 HOH HOH A . U 6 HOH 72 261 261 HOH HOH A . U 6 HOH 73 262 262 HOH HOH A . U 6 HOH 74 265 265 HOH HOH A . U 6 HOH 75 269 269 HOH HOH A . U 6 HOH 76 274 274 HOH HOH A . U 6 HOH 77 275 275 HOH HOH A . U 6 HOH 78 277 277 HOH HOH A . U 6 HOH 79 283 283 HOH HOH A . U 6 HOH 80 285 285 HOH HOH A . U 6 HOH 81 287 287 HOH HOH A . U 6 HOH 82 294 294 HOH HOH A . U 6 HOH 83 548 4 HOH HOH A . V 6 HOH 1 6 6 HOH HOH B . V 6 HOH 2 9 9 HOH HOH B . V 6 HOH 3 10 10 HOH HOH B . V 6 HOH 4 17 17 HOH HOH B . V 6 HOH 5 20 20 HOH HOH B . V 6 HOH 6 21 21 HOH HOH B . V 6 HOH 7 22 22 HOH HOH B . V 6 HOH 8 24 24 HOH HOH B . V 6 HOH 9 27 27 HOH HOH B . V 6 HOH 10 28 28 HOH HOH B . V 6 HOH 11 29 29 HOH HOH B . V 6 HOH 12 31 31 HOH HOH B . V 6 HOH 13 32 32 HOH HOH B . V 6 HOH 14 34 34 HOH HOH B . V 6 HOH 15 35 35 HOH HOH B . V 6 HOH 16 36 36 HOH HOH B . V 6 HOH 17 37 37 HOH HOH B . V 6 HOH 18 38 38 HOH HOH B . V 6 HOH 19 41 41 HOH HOH B . V 6 HOH 20 42 42 HOH HOH B . V 6 HOH 21 43 43 HOH HOH B . V 6 HOH 22 44 44 HOH HOH B . V 6 HOH 23 46 46 HOH HOH B . V 6 HOH 24 50 50 HOH HOH B . V 6 HOH 25 51 51 HOH HOH B . V 6 HOH 26 56 56 HOH HOH B . V 6 HOH 27 57 57 HOH HOH B . V 6 HOH 28 59 59 HOH HOH B . V 6 HOH 29 62 62 HOH HOH B . V 6 HOH 30 65 65 HOH HOH B . V 6 HOH 31 66 66 HOH HOH B . V 6 HOH 32 67 67 HOH HOH B . V 6 HOH 33 68 68 HOH HOH B . V 6 HOH 34 72 72 HOH HOH B . V 6 HOH 35 75 75 HOH HOH B . V 6 HOH 36 80 80 HOH HOH B . V 6 HOH 37 84 84 HOH HOH B . V 6 HOH 38 86 86 HOH HOH B . V 6 HOH 39 87 87 HOH HOH B . V 6 HOH 40 89 89 HOH HOH B . V 6 HOH 41 90 90 HOH HOH B . V 6 HOH 42 91 91 HOH HOH B . V 6 HOH 43 93 93 HOH HOH B . V 6 HOH 44 96 96 HOH HOH B . V 6 HOH 45 101 101 HOH HOH B . V 6 HOH 46 107 107 HOH HOH B . V 6 HOH 47 108 108 HOH HOH B . V 6 HOH 48 109 109 HOH HOH B . V 6 HOH 49 110 110 HOH HOH B . V 6 HOH 50 111 111 HOH HOH B . V 6 HOH 51 112 112 HOH HOH B . V 6 HOH 52 115 115 HOH HOH B . V 6 HOH 53 116 116 HOH HOH B . V 6 HOH 54 117 117 HOH HOH B . V 6 HOH 55 121 121 HOH HOH B . V 6 HOH 56 123 123 HOH HOH B . V 6 HOH 57 125 125 HOH HOH B . V 6 HOH 58 127 127 HOH HOH B . V 6 HOH 59 135 135 HOH HOH B . V 6 HOH 60 138 138 HOH HOH B . V 6 HOH 61 141 141 HOH HOH B . V 6 HOH 62 142 142 HOH HOH B . V 6 HOH 63 146 146 HOH HOH B . V 6 HOH 64 147 147 HOH HOH B . V 6 HOH 65 148 148 HOH HOH B . V 6 HOH 66 149 149 HOH HOH B . V 6 HOH 67 151 151 HOH HOH B . V 6 HOH 68 152 152 HOH HOH B . V 6 HOH 69 158 158 HOH HOH B . V 6 HOH 70 160 160 HOH HOH B . V 6 HOH 71 163 163 HOH HOH B . V 6 HOH 72 173 173 HOH HOH B . V 6 HOH 73 174 174 HOH HOH B . V 6 HOH 74 178 178 HOH HOH B . V 6 HOH 75 184 184 HOH HOH B . V 6 HOH 76 185 185 HOH HOH B . V 6 HOH 77 188 188 HOH HOH B . V 6 HOH 78 191 191 HOH HOH B . V 6 HOH 79 192 192 HOH HOH B . V 6 HOH 80 194 194 HOH HOH B . V 6 HOH 81 201 201 HOH HOH B . V 6 HOH 82 206 206 HOH HOH B . V 6 HOH 83 210 210 HOH HOH B . V 6 HOH 84 211 211 HOH HOH B . V 6 HOH 85 213 213 HOH HOH B . V 6 HOH 86 214 214 HOH HOH B . V 6 HOH 87 218 218 HOH HOH B . V 6 HOH 88 219 219 HOH HOH B . V 6 HOH 89 222 222 HOH HOH B . V 6 HOH 90 223 223 HOH HOH B . V 6 HOH 91 224 224 HOH HOH B . V 6 HOH 92 227 227 HOH HOH B . V 6 HOH 93 228 228 HOH HOH B . V 6 HOH 94 231 231 HOH HOH B . V 6 HOH 95 236 236 HOH HOH B . V 6 HOH 96 237 237 HOH HOH B . V 6 HOH 97 239 239 HOH HOH B . V 6 HOH 98 240 240 HOH HOH B . V 6 HOH 99 250 250 HOH HOH B . V 6 HOH 100 251 251 HOH HOH B . V 6 HOH 101 256 256 HOH HOH B . V 6 HOH 102 266 266 HOH HOH B . V 6 HOH 103 267 267 HOH HOH B . V 6 HOH 104 268 268 HOH HOH B . V 6 HOH 105 278 278 HOH HOH B . V 6 HOH 106 279 279 HOH HOH B . V 6 HOH 107 280 280 HOH HOH B . V 6 HOH 108 282 282 HOH HOH B . V 6 HOH 109 292 292 HOH HOH B . V 6 HOH 110 293 293 HOH HOH B . V 6 HOH 111 295 295 HOH HOH B . V 6 HOH 112 296 296 HOH HOH B . V 6 HOH 113 548 2 HOH HOH B . V 6 HOH 114 549 3 HOH HOH B . V 6 HOH 115 550 5 HOH HOH B . W 6 HOH 1 7 7 HOH HOH E . W 6 HOH 2 15 15 HOH HOH E . W 6 HOH 3 19 19 HOH HOH E . W 6 HOH 4 25 25 HOH HOH E . W 6 HOH 5 33 33 HOH HOH E . W 6 HOH 6 39 39 HOH HOH E . W 6 HOH 7 47 47 HOH HOH E . W 6 HOH 8 48 48 HOH HOH E . W 6 HOH 9 58 58 HOH HOH E . W 6 HOH 10 85 85 HOH HOH E . W 6 HOH 11 94 94 HOH HOH E . W 6 HOH 12 98 98 HOH HOH E . W 6 HOH 13 100 100 HOH HOH E . W 6 HOH 14 103 103 HOH HOH E . W 6 HOH 15 119 119 HOH HOH E . W 6 HOH 16 120 120 HOH HOH E . W 6 HOH 17 122 122 HOH HOH E . W 6 HOH 18 124 124 HOH HOH E . W 6 HOH 19 126 126 HOH HOH E . W 6 HOH 20 133 133 HOH HOH E . W 6 HOH 21 136 136 HOH HOH E . W 6 HOH 22 143 143 HOH HOH E . W 6 HOH 23 153 153 HOH HOH E . W 6 HOH 24 154 154 HOH HOH E . W 6 HOH 25 156 156 HOH HOH E . W 6 HOH 26 161 161 HOH HOH E . W 6 HOH 27 176 176 HOH HOH E . W 6 HOH 28 182 182 HOH HOH E . W 6 HOH 29 186 186 HOH HOH E . W 6 HOH 30 190 190 HOH HOH E . W 6 HOH 31 195 195 HOH HOH E . W 6 HOH 32 197 197 HOH HOH E . W 6 HOH 33 200 200 HOH HOH E . W 6 HOH 34 205 205 HOH HOH E . W 6 HOH 35 208 208 HOH HOH E . W 6 HOH 36 209 209 HOH HOH E . W 6 HOH 37 242 242 HOH HOH E . W 6 HOH 38 243 243 HOH HOH E . W 6 HOH 39 248 248 HOH HOH E . W 6 HOH 40 252 252 HOH HOH E . W 6 HOH 41 263 263 HOH HOH E . W 6 HOH 42 270 270 HOH HOH E . W 6 HOH 43 271 271 HOH HOH E . W 6 HOH 44 273 273 HOH HOH E . W 6 HOH 45 276 276 HOH HOH E . W 6 HOH 46 286 286 HOH HOH E . W 6 HOH 47 288 288 HOH HOH E . W 6 HOH 48 290 290 HOH HOH E . W 6 HOH 49 549 1 HOH HOH E . # 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 70 A ASN 394 ? ASN 'GLYCOSYLATION SITE' 2 B ASN 70 B ASN 394 ? ASN 'GLYCOSYLATION SITE' 3 C ASN 70 E ASN 394 ? 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_and_software_defined_assembly PISA dimeric 2 2 author_and_software_defined_assembly PISA dimeric 2 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,D,E,F,G,H,I,U 1 2 B,J,K,L,M,N,V 2 1,3 C,O,P,Q,R,S,T,W # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 5530 ? 1 MORE 21 ? 1 'SSA (A^2)' 22630 ? 2 'ABSA (A^2)' 5400 ? 2 MORE 27 ? 2 'SSA (A^2)' 22870 ? # loop_ _pdbx_struct_oper_list.id _pdbx_struct_oper_list.type _pdbx_struct_oper_list.name _pdbx_struct_oper_list.symmetry_operation _pdbx_struct_oper_list.matrix[1][1] _pdbx_struct_oper_list.matrix[1][2] _pdbx_struct_oper_list.matrix[1][3] _pdbx_struct_oper_list.vector[1] _pdbx_struct_oper_list.matrix[2][1] _pdbx_struct_oper_list.matrix[2][2] _pdbx_struct_oper_list.matrix[2][3] _pdbx_struct_oper_list.vector[2] _pdbx_struct_oper_list.matrix[3][1] _pdbx_struct_oper_list.matrix[3][2] _pdbx_struct_oper_list.matrix[3][3] _pdbx_struct_oper_list.vector[3] 1 'identity operation' 1_555 x,y,z 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 2 'crystal symmetry operation' 1_556 x,y,z+1 1.0000000000 0.0000000000 0.0000000000 -9.9058726773 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 48.2149247692 3 'crystal symmetry operation' 2_658 -x+1,y,-z+3 -1.0000000000 0.0000000000 0.0000000000 123.9583819680 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 -1.0000000000 144.6447743076 # 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 2009-09-08 2 'Structure model' 1 1 2011-07-13 3 'Structure model' 1 2 2017-11-01 4 'Structure model' 1 3 2018-05-30 # _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' 'Refinement description' 3 2 'Structure model' 'Version format compliance' 4 3 'Structure model' 'Refinement description' 5 4 'Structure model' 'Data collection' 6 4 'Structure model' 'Derived calculations' # loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 3 'Structure model' software 2 4 'Structure model' pdbx_struct_assembly 3 4 'Structure model' pdbx_struct_assembly_gen 4 4 'Structure model' pdbx_struct_assembly_prop 5 4 'Structure model' pdbx_struct_oper_list 6 4 'Structure model' struct_biol # 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[2][2] _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] 'X-RAY DIFFRACTION' 1 ? refined 11.6646 49.4660 59.2828 -0.0233 -0.1526 0.0145 -0.0314 -0.0218 -0.0438 1.2957 4.6031 3.2849 0.3913 0.5860 -0.7807 0.1140 -0.1237 0.0098 -0.1669 -0.0299 0.5914 0.0545 0.1455 -0.5425 'X-RAY DIFFRACTION' 2 ? refined 30.0029 50.0141 68.7810 0.0413 0.0026 0.0124 -0.0219 -0.0100 0.0062 10.9997 1.5503 2.8020 -4.1295 5.5517 -2.0842 0.1196 -0.1396 0.0201 0.0340 -0.0522 -0.0339 -0.0722 -0.0410 0.0837 'X-RAY DIFFRACTION' 3 ? refined 27.1147 25.5648 66.0729 -0.1067 -0.0367 -0.0683 -0.0048 0.0180 0.0242 1.5837 2.6348 2.1825 -0.2198 0.2890 -0.0518 0.0595 -0.1015 0.0419 0.2902 0.0967 -0.1742 -0.0423 0.0372 0.0588 'X-RAY DIFFRACTION' 4 ? refined 8.3173 35.4984 41.6861 -0.0784 -0.0028 -0.1218 -0.0131 0.0225 -0.0419 2.7713 3.4153 2.5266 0.3290 -0.0804 -0.3256 -0.0202 0.0398 -0.0196 -0.0160 0.3799 0.2611 -0.0180 -0.3250 -0.0607 'X-RAY DIFFRACTION' 5 ? refined 9.7302 17.3915 33.3219 -0.0277 0.0833 -0.0314 -0.0345 0.0213 0.0177 2.7712 3.5173 6.8634 -2.9049 -3.5874 4.7843 0.0119 0.0531 -0.0650 -0.1066 0.0056 -0.2863 -0.0381 0.0458 0.2847 'X-RAY DIFFRACTION' 6 ? refined 34.4197 22.4421 34.2315 -0.0149 -0.0897 -0.0708 -0.0165 -0.0298 -0.0061 2.9136 1.1049 1.6455 0.0911 -0.3808 0.0258 -0.0237 -0.0054 0.0291 -0.0349 0.1570 -0.1104 0.1541 -0.0113 0.0032 'X-RAY DIFFRACTION' 7 ? refined 57.0822 37.2173 55.0462 -0.0566 -0.1567 -0.0125 -0.0743 0.0128 -0.0125 1.9118 1.8784 2.3372 0.2706 -0.1777 0.4854 0.0905 -0.0815 -0.0089 -0.2782 -0.3935 0.1889 0.3246 0.2210 0.0270 'X-RAY DIFFRACTION' 8 ? refined 41.8840 49.4721 61.6624 0.1066 0.0184 -0.0136 -0.0477 0.1067 -0.0502 9.6506 11.5597 11.8982 -10.5621 -10.7157 11.7277 -1.0079 0.1119 0.8960 -0.0673 -0.0606 0.4518 0.5032 -0.0397 -0.1874 'X-RAY DIFFRACTION' 9 ? refined 61.3645 64.1193 63.7129 -0.1050 0.0566 -0.1195 0.0155 0.0044 -0.0079 2.7426 1.0899 1.3159 -0.0765 0.1454 -0.1205 0.0288 -0.0587 0.0299 0.0791 -0.0599 0.0179 0.0145 0.0015 0.1485 # 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.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection_details _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection 'X-RAY DIFFRACTION' 1 1 A 1 A 6 ? . . . . ? 'X-RAY DIFFRACTION' 2 1 A 336 A 433 ? . . . . ? 'X-RAY DIFFRACTION' 3 2 A 434 A 440 ? . . . . ? 'X-RAY DIFFRACTION' 4 3 A 441 A 544 ? . . . . ? 'X-RAY DIFFRACTION' 5 4 B 1 B 5 ? . . . . ? 'X-RAY DIFFRACTION' 6 4 B 335 B 433 ? . . . . ? 'X-RAY DIFFRACTION' 7 5 B 434 B 440 ? . . . . ? 'X-RAY DIFFRACTION' 8 6 B 441 B 544 ? . . . . ? 'X-RAY DIFFRACTION' 9 7 E 1 E 5 ? . . . . ? 'X-RAY DIFFRACTION' 10 7 E 336 E 433 ? . . . . ? 'X-RAY DIFFRACTION' 11 8 E 434 E 440 ? . . . . ? 'X-RAY DIFFRACTION' 12 9 E 441 E 544 ? . . . . ? # _pdbx_phasing_MR.entry_id 3H9Y _pdbx_phasing_MR.method_rotation ? _pdbx_phasing_MR.method_translation ? _pdbx_phasing_MR.model_details 'Phaser MODE: MR_AUTO' _pdbx_phasing_MR.R_factor ? _pdbx_phasing_MR.R_rigid_body ? _pdbx_phasing_MR.correlation_coeff_Fo_to_Fc ? _pdbx_phasing_MR.correlation_coeff_Io_to_Ic ? _pdbx_phasing_MR.d_res_high_rotation 2.500 _pdbx_phasing_MR.d_res_low_rotation 28.940 _pdbx_phasing_MR.d_res_high_translation 2.500 _pdbx_phasing_MR.d_res_low_translation 28.940 _pdbx_phasing_MR.packing ? _pdbx_phasing_MR.reflns_percent_rotation ? _pdbx_phasing_MR.reflns_percent_translation ? _pdbx_phasing_MR.sigma_F_rotation ? _pdbx_phasing_MR.sigma_F_translation ? _pdbx_phasing_MR.sigma_I_rotation ? _pdbx_phasing_MR.sigma_I_translation ? # _phasing.method MR # loop_ _software.pdbx_ordinal _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id 1 DENZO . ? program 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data reduction' http://www.hkl-xray.com/ ? ? 2 SCALEPACK . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data scaling' http://www.hkl-xray.com/ ? ? 3 PHASER 1.3.1 '1 June 2005' program 'Randy J. Read' cimr-phaser@lists.cam.ac.uk phasing http://www-structmed.cimr.cam.ac.uk/phaser/ ? ? 4 REFMAC . ? program 'Garib N. Murshudov' garib@ysbl.york.ac.uk refinement http://www.ccp4.ac.uk/dist/html/refmac5.html Fortran_77 ? 5 PDB_EXTRACT 3.005 'June 11, 2008' package PDB help@deposit.rcsb.org 'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? 6 MAR345 CCD ? ? ? ? 'data collection' ? ? ? # 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 ALA A 364 ? ? -178.98 71.60 2 1 SER A 366 ? ? -150.18 -153.18 3 1 LYS A 367 ? ? -58.35 86.00 4 1 THR A 369 ? ? -88.77 34.99 5 1 ASN A 394 ? ? -83.38 32.38 6 1 PRO A 426 ? ? -64.83 40.12 7 1 ARG A 427 ? ? 38.73 75.98 8 1 ALA A 428 ? ? 173.52 102.16 9 1 PRO A 471 ? ? -67.57 -175.88 10 1 GLU A 482 ? ? 54.56 18.69 11 1 ILE B 350 ? ? -93.35 -64.60 12 1 PRO B 365 ? ? -57.48 103.45 13 1 LYS B 367 ? ? -10.42 88.81 14 1 PRO B 471 ? ? -59.78 -179.39 15 1 GLU B 521 ? ? -163.11 110.60 16 1 ILE E 350 ? ? -94.87 -61.87 17 1 PRO E 471 ? ? -68.76 -173.12 18 1 GLU E 482 ? ? 76.62 -21.60 # 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 B LEU 363 ? CB ? B LEU 39 CB 2 1 Y 1 B LEU 363 ? CG ? B LEU 39 CG 3 1 Y 1 B LEU 363 ? CD1 ? B LEU 39 CD1 4 1 Y 1 B LEU 363 ? CD2 ? B LEU 39 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 ALA 325 ? A ALA 1 2 1 Y 1 A ASP 326 ? A ASP 2 3 1 Y 1 A PRO 327 ? A PRO 3 4 1 Y 1 A CYS 328 ? A CYS 4 5 1 Y 1 A ALA 329 ? A ALA 5 6 1 Y 1 A ASP 330 ? A ASP 6 7 1 Y 1 A SER 331 ? A SER 7 8 1 Y 1 A ASN 332 ? A ASN 8 9 1 Y 1 A PRO 333 ? A PRO 9 10 1 Y 1 A ARG 334 ? A ARG 10 11 1 Y 1 A GLY 335 ? A GLY 11 12 1 Y 1 A PRO 545 ? A PRO 221 13 1 Y 1 A GLY 546 ? A GLY 222 14 1 Y 1 A LYS 547 ? A LYS 223 15 1 Y 1 B ALA 325 ? B ALA 1 16 1 Y 1 B ASP 326 ? B ASP 2 17 1 Y 1 B PRO 327 ? B PRO 3 18 1 Y 1 B CYS 328 ? B CYS 4 19 1 Y 1 B ALA 329 ? B ALA 5 20 1 Y 1 B ASP 330 ? B ASP 6 21 1 Y 1 B SER 331 ? B SER 7 22 1 Y 1 B ASN 332 ? B ASN 8 23 1 Y 1 B PRO 333 ? B PRO 9 24 1 Y 1 B ARG 334 ? B ARG 10 25 1 Y 1 B PRO 545 ? B PRO 221 26 1 Y 1 B GLY 546 ? B GLY 222 27 1 Y 1 B LYS 547 ? B LYS 223 28 1 Y 1 E ALA 325 ? C ALA 1 29 1 Y 1 E ASP 326 ? C ASP 2 30 1 Y 1 E PRO 327 ? C PRO 3 31 1 Y 1 E CYS 328 ? C CYS 4 32 1 Y 1 E ALA 329 ? C ALA 5 33 1 Y 1 E ASP 330 ? C ASP 6 34 1 Y 1 E SER 331 ? C SER 7 35 1 Y 1 E ASN 332 ? C ASN 8 36 1 Y 1 E PRO 333 ? C PRO 9 37 1 Y 1 E ARG 334 ? C ARG 10 38 1 Y 1 E GLY 335 ? C GLY 11 39 1 Y 1 E PRO 545 ? C PRO 221 40 1 Y 1 E GLY 546 ? C GLY 222 41 1 Y 1 E LYS 547 ? C LYS 223 # 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 ALPHA-D-MANNOSE MAN 5 'AMMONIUM ION' NH4 6 water HOH #