data_3BES # _entry.id 3BES # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.289 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3BES RCSB RCSB045429 WWPDB D_1000045429 # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3BES _pdbx_database_status.recvd_initial_deposition_date 2007-11-20 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Nuara, A.A.' 1 'Walter, M.R.' 2 # _citation.id primary _citation.title 'Structure and mechanism of IFN-gamma antagonism by an orthopoxvirus IFN-gamma-binding protein.' _citation.journal_abbrev Proc.Natl.Acad.Sci.Usa _citation.journal_volume 105 _citation.page_first 1861 _citation.page_last 1866 _citation.year 2008 _citation.journal_id_ASTM PNASA6 _citation.country US _citation.journal_id_ISSN 0027-8424 _citation.journal_id_CSD 0040 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 18252829 _citation.pdbx_database_id_DOI 10.1073/pnas.0705753105 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Nuara, A.A.' 1 primary 'Walter, L.J.' 2 primary 'Logsdon, N.J.' 3 primary 'Yoon, S.I.' 4 primary 'Jones, B.C.' 5 primary 'Schriewer, J.M.' 6 primary 'Buller, R.M.' 7 primary 'Walter, M.R.' 8 # _cell.entry_id 3BES _cell.length_a 92.63 _cell.length_b 119.13 _cell.length_c 184.74 _cell.angle_alpha 90 _cell.angle_beta 90 _cell.angle_gamma 90 _cell.pdbx_unique_axis ? _cell.Z_PDB 8 _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 3BES _symmetry.space_group_name_H-M 'I 2 2 2' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.Int_Tables_number 23 _symmetry.cell_setting ? _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'Interferon gamma' 16336.715 1 ? ? ? ? 2 polymer man 'Interferon-gamma binding protein C4R' 28721.410 1 ? ? ? ? 3 non-polymer syn 'PHOSPHATE ION' 94.971 3 ? ? ? ? 4 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 3 ? ? ? ? 5 non-polymer man BETA-D-MANNOSE 180.156 1 ? ? ? ? 6 water nat water 18.015 237 ? ? ? ? # loop_ _entity_name_com.entity_id _entity_name_com.name 1 'IFN-gamma, Immune interferon' 2 'Interferon-gamma receptor' # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;MQDPYVKEAENLKKYFNAGHSDVADNGTLFLGILKNWKEESDRKIMQSQIVSFYFKLFKNFKDDQSIQKSVETIKEDMNV KFFNSNKKKRDDFEKLTNYSVTDLNVQRKAIHELIQVMAELSPAAKTGKRKRSQMLFRG ; ;MQDPYVKEAENLKKYFNAGHSDVADNGTLFLGILKNWKEESDRKIMQSQIVSFYFKLFKNFKDDQSIQKSVETIKEDMNV KFFNSNKKKRDDFEKLTNYSVTDLNVQRKAIHELIQVMAELSPAAKTGKRKRSQMLFRG ; L ? 2 'polypeptide(L)' no no ;TITSYKFESVNFDSKIEWTGNGLYNISLRNYGIKTWQTMYTNVPEGTYDISGFPNNDFVSFWVKFEQGDYKVDKYCTGLC IEVKIGPPTVTLTEYDDHINLYIEHPYATRGSKKIPIYKRNDMCDIYLLYTANFTFGDSEEPVIYDIDDYDCTSTGCSID FATTEKVCVMAQGATEGLLDKITPWSSEVCLTPKKNVYTCAIRSKEDVPNFKEKMTRVIKRKFNKQSHSYLTKFLGSTSN DITTFLSMLD ; ;TITSYKFESVNFDSKIEWTGNGLYNISLRNYGIKTWQTMYTNVPEGTYDISGFPNNDFVSFWVKFEQGDYKVDKYCTGLC IEVKIGPPTVTLTEYDDHINLYIEHPYATRGSKKIPIYKRNDMCDIYLLYTANFTFGDSEEPVIYDIDDYDCTSTGCSID FATTEKVCVMAQGATEGLLDKITPWSSEVCLTPKKNVYTCAIRSKEDVPNFKEKMTRVIKRKFNKQSHSYLTKFLGSTSN DITTFLSMLD ; R ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 MET n 1 2 GLN n 1 3 ASP n 1 4 PRO n 1 5 TYR n 1 6 VAL n 1 7 LYS n 1 8 GLU n 1 9 ALA n 1 10 GLU n 1 11 ASN n 1 12 LEU n 1 13 LYS n 1 14 LYS n 1 15 TYR n 1 16 PHE n 1 17 ASN n 1 18 ALA n 1 19 GLY n 1 20 HIS n 1 21 SER n 1 22 ASP n 1 23 VAL n 1 24 ALA n 1 25 ASP n 1 26 ASN n 1 27 GLY n 1 28 THR n 1 29 LEU n 1 30 PHE n 1 31 LEU n 1 32 GLY n 1 33 ILE n 1 34 LEU n 1 35 LYS n 1 36 ASN n 1 37 TRP n 1 38 LYS n 1 39 GLU n 1 40 GLU n 1 41 SER n 1 42 ASP n 1 43 ARG n 1 44 LYS n 1 45 ILE n 1 46 MET n 1 47 GLN n 1 48 SER n 1 49 GLN n 1 50 ILE n 1 51 VAL n 1 52 SER n 1 53 PHE n 1 54 TYR n 1 55 PHE n 1 56 LYS n 1 57 LEU n 1 58 PHE n 1 59 LYS n 1 60 ASN n 1 61 PHE n 1 62 LYS n 1 63 ASP n 1 64 ASP n 1 65 GLN n 1 66 SER n 1 67 ILE n 1 68 GLN n 1 69 LYS n 1 70 SER n 1 71 VAL n 1 72 GLU n 1 73 THR n 1 74 ILE n 1 75 LYS n 1 76 GLU n 1 77 ASP n 1 78 MET n 1 79 ASN n 1 80 VAL n 1 81 LYS n 1 82 PHE n 1 83 PHE n 1 84 ASN n 1 85 SER n 1 86 ASN n 1 87 LYS n 1 88 LYS n 1 89 LYS n 1 90 ARG n 1 91 ASP n 1 92 ASP n 1 93 PHE n 1 94 GLU n 1 95 LYS n 1 96 LEU n 1 97 THR n 1 98 ASN n 1 99 TYR n 1 100 SER n 1 101 VAL n 1 102 THR n 1 103 ASP n 1 104 LEU n 1 105 ASN n 1 106 VAL n 1 107 GLN n 1 108 ARG n 1 109 LYS n 1 110 ALA n 1 111 ILE n 1 112 HIS n 1 113 GLU n 1 114 LEU n 1 115 ILE n 1 116 GLN n 1 117 VAL n 1 118 MET n 1 119 ALA n 1 120 GLU n 1 121 LEU n 1 122 SER n 1 123 PRO n 1 124 ALA n 1 125 ALA n 1 126 LYS n 1 127 THR n 1 128 GLY n 1 129 LYS n 1 130 ARG n 1 131 LYS n 1 132 ARG n 1 133 SER n 1 134 GLN n 1 135 MET n 1 136 LEU n 1 137 PHE n 1 138 ARG n 1 139 GLY n 2 1 THR n 2 2 ILE n 2 3 THR n 2 4 SER n 2 5 TYR n 2 6 LYS n 2 7 PHE n 2 8 GLU n 2 9 SER n 2 10 VAL n 2 11 ASN n 2 12 PHE n 2 13 ASP n 2 14 SER n 2 15 LYS n 2 16 ILE n 2 17 GLU n 2 18 TRP n 2 19 THR n 2 20 GLY n 2 21 ASN n 2 22 GLY n 2 23 LEU n 2 24 TYR n 2 25 ASN n 2 26 ILE n 2 27 SER n 2 28 LEU n 2 29 ARG n 2 30 ASN n 2 31 TYR n 2 32 GLY n 2 33 ILE n 2 34 LYS n 2 35 THR n 2 36 TRP n 2 37 GLN n 2 38 THR n 2 39 MET n 2 40 TYR n 2 41 THR n 2 42 ASN n 2 43 VAL n 2 44 PRO n 2 45 GLU n 2 46 GLY n 2 47 THR n 2 48 TYR n 2 49 ASP n 2 50 ILE n 2 51 SER n 2 52 GLY n 2 53 PHE n 2 54 PRO n 2 55 ASN n 2 56 ASN n 2 57 ASP n 2 58 PHE n 2 59 VAL n 2 60 SER n 2 61 PHE n 2 62 TRP n 2 63 VAL n 2 64 LYS n 2 65 PHE n 2 66 GLU n 2 67 GLN n 2 68 GLY n 2 69 ASP n 2 70 TYR n 2 71 LYS n 2 72 VAL n 2 73 ASP n 2 74 LYS n 2 75 TYR n 2 76 CYS n 2 77 THR n 2 78 GLY n 2 79 LEU n 2 80 CYS n 2 81 ILE n 2 82 GLU n 2 83 VAL n 2 84 LYS n 2 85 ILE n 2 86 GLY n 2 87 PRO n 2 88 PRO n 2 89 THR n 2 90 VAL n 2 91 THR n 2 92 LEU n 2 93 THR n 2 94 GLU n 2 95 TYR n 2 96 ASP n 2 97 ASP n 2 98 HIS n 2 99 ILE n 2 100 ASN n 2 101 LEU n 2 102 TYR n 2 103 ILE n 2 104 GLU n 2 105 HIS n 2 106 PRO n 2 107 TYR n 2 108 ALA n 2 109 THR n 2 110 ARG n 2 111 GLY n 2 112 SER n 2 113 LYS n 2 114 LYS n 2 115 ILE n 2 116 PRO n 2 117 ILE n 2 118 TYR n 2 119 LYS n 2 120 ARG n 2 121 ASN n 2 122 ASP n 2 123 MET n 2 124 CYS n 2 125 ASP n 2 126 ILE n 2 127 TYR n 2 128 LEU n 2 129 LEU n 2 130 TYR n 2 131 THR n 2 132 ALA n 2 133 ASN n 2 134 PHE n 2 135 THR n 2 136 PHE n 2 137 GLY n 2 138 ASP n 2 139 SER n 2 140 GLU n 2 141 GLU n 2 142 PRO n 2 143 VAL n 2 144 ILE n 2 145 TYR n 2 146 ASP n 2 147 ILE n 2 148 ASP n 2 149 ASP n 2 150 TYR n 2 151 ASP n 2 152 CYS n 2 153 THR n 2 154 SER n 2 155 THR n 2 156 GLY n 2 157 CYS n 2 158 SER n 2 159 ILE n 2 160 ASP n 2 161 PHE n 2 162 ALA n 2 163 THR n 2 164 THR n 2 165 GLU n 2 166 LYS n 2 167 VAL n 2 168 CYS n 2 169 VAL n 2 170 MET n 2 171 ALA n 2 172 GLN n 2 173 GLY n 2 174 ALA n 2 175 THR n 2 176 GLU n 2 177 GLY n 2 178 LEU n 2 179 LEU n 2 180 ASP n 2 181 LYS n 2 182 ILE n 2 183 THR n 2 184 PRO n 2 185 TRP n 2 186 SER n 2 187 SER n 2 188 GLU n 2 189 VAL n 2 190 CYS n 2 191 LEU n 2 192 THR n 2 193 PRO n 2 194 LYS n 2 195 LYS n 2 196 ASN n 2 197 VAL n 2 198 TYR n 2 199 THR n 2 200 CYS n 2 201 ALA n 2 202 ILE n 2 203 ARG n 2 204 SER n 2 205 LYS n 2 206 GLU n 2 207 ASP n 2 208 VAL n 2 209 PRO n 2 210 ASN n 2 211 PHE n 2 212 LYS n 2 213 GLU n 2 214 LYS n 2 215 MET n 2 216 THR n 2 217 ARG n 2 218 VAL n 2 219 ILE n 2 220 LYS n 2 221 ARG n 2 222 LYS n 2 223 PHE n 2 224 ASN n 2 225 LYS n 2 226 GLN n 2 227 SER n 2 228 HIS n 2 229 SER n 2 230 TYR n 2 231 LEU n 2 232 THR n 2 233 LYS n 2 234 PHE n 2 235 LEU n 2 236 GLY n 2 237 SER n 2 238 THR n 2 239 SER n 2 240 ASN n 2 241 ASP n 2 242 ILE n 2 243 THR n 2 244 THR n 2 245 PHE n 2 246 LEU n 2 247 SER n 2 248 MET n 2 249 LEU n 2 250 ASP n # loop_ _entity_src_gen.entity_id _entity_src_gen.pdbx_src_id _entity_src_gen.pdbx_alt_source_flag _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 _entity_src_gen.gene_src_genus _entity_src_gen.pdbx_gene_src_gene _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 _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id _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 _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id _entity_src_gen.host_org_genus _entity_src_gen.pdbx_host_org_gene _entity_src_gen.pdbx_host_org_organ _entity_src_gen.host_org_species _entity_src_gen.pdbx_host_org_tissue _entity_src_gen.pdbx_host_org_tissue_fraction _entity_src_gen.pdbx_host_org_strain _entity_src_gen.pdbx_host_org_variant _entity_src_gen.pdbx_host_org_cell_line _entity_src_gen.pdbx_host_org_atcc _entity_src_gen.pdbx_host_org_culture_collection _entity_src_gen.pdbx_host_org_cell _entity_src_gen.pdbx_host_org_organelle _entity_src_gen.pdbx_host_org_cellular_location _entity_src_gen.pdbx_host_org_vector_type _entity_src_gen.pdbx_host_org_vector _entity_src_gen.host_org_details _entity_src_gen.expression_system_id _entity_src_gen.plasmid_name _entity_src_gen.plasmid_details _entity_src_gen.pdbx_description 1 1 sample ? ? ? human Homo IFNG ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Escherichia coli' 562 Escherichia ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 sample ? ? ? ? Orthopoxvirus 'C4R, IFNGR' ? ? ? ? ? ? 'Ectromelia virus' 12643 ? ? ? ? ? ? ? 'fruit fly' 'Drosophila melanogaster' 7227 Drosophila ? ? ? ? ? ? ? S2 ? ? ? ? ? ? ? ? ? ? ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin _struct_ref.pdbx_db_isoform 1 UNP IFNG_HUMAN P01579 1 ;QDPYVKEAENLKKYFNAGHSDVADNGTLFLGILKNWKEESDRKIMQSQIVSFYFKLFKNFKDDQSIQKSVETIKEDMNVK FFNSNKKKRDDFEKLTNYSVTDLNVQRKAIHELIQVMAELSPAAKTGKRKRSQMLFRG ; 24 ? 2 UNP Q66793_9POXV Q66793 2 ;TITSYKFESVNFDSKIEWTGNGLYNISLRNYGIKTWQTMYTNVPEGTYDISGFPNNDFVSFWVKFEQGDYKVDKYCTGLC IEVKIGPPTVTLTEYDDHINLYIEHPYATRGSKKIPIYKRNDMCDIYLLYTANFTFGDSEEPVIYDIDDYDCTSTGCSID FATTEKVCVMAQGATEGLLDKITPWSSEVCLTPKKNVYTCAIRSKEDVPNFKEKMTRVIKRKFNKQSHSYLTKFLGSTSN DITTFLSMLD ; 17 ? # 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 3BES L 2 ? 139 ? P01579 24 ? 161 ? 1 138 2 2 3BES R 1 ? 250 ? Q66793 17 ? 266 ? 17 266 # _struct_ref_seq_dif.align_id 1 _struct_ref_seq_dif.pdbx_pdb_id_code 3BES _struct_ref_seq_dif.mon_id MET _struct_ref_seq_dif.pdbx_pdb_strand_id L _struct_ref_seq_dif.seq_num 1 _struct_ref_seq_dif.pdbx_pdb_ins_code ? _struct_ref_seq_dif.pdbx_seq_db_name UNP _struct_ref_seq_dif.pdbx_seq_db_accession_code P01579 _struct_ref_seq_dif.db_mon_id ? _struct_ref_seq_dif.pdbx_seq_db_seq_num ? _struct_ref_seq_dif.details 'INITIATING METHIONINE' _struct_ref_seq_dif.pdbx_auth_seq_num 0 _struct_ref_seq_dif.pdbx_ordinal 1 # 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 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PO4 non-polymer . 'PHOSPHATE ION' ? 'O4 P -3' 94.971 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 3BES _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews ? _exptl_crystal.density_percent_sol ? _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 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.4 _exptl_crystal_grow.pdbx_details '0.8M NaH2PO4/0.8M KH2PO4 solutions, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 298K' _exptl_crystal_grow.pdbx_pH_range . # _diffrn.id 1 _diffrn.ambient_temp ? _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'MARMOSAIC 300 mm CCD' _diffrn_detector.pdbx_collection_date 2006-10-05 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.0 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'APS BEAMLINE 22-ID' _diffrn_source.pdbx_synchrotron_site APS _diffrn_source.pdbx_synchrotron_beamline 22-ID _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.0 # _reflns.entry_id 3BES _reflns.observed_criterion_sigma_F 0 _reflns.observed_criterion_sigma_I -3 _reflns.d_resolution_high 2.2 _reflns.d_resolution_low 20 _reflns.number_all 28006 _reflns.number_obs 27031 _reflns.percent_possible_obs 99.6 _reflns.pdbx_Rmerge_I_obs 0.049 _reflns.pdbx_Rsym_value 0.049 _reflns.pdbx_netI_over_sigmaI ? _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 7.5 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _refine.entry_id 3BES _refine.ls_d_res_high 2.2 _refine.ls_d_res_low 20. _refine.pdbx_ls_sigma_F 0 _refine.pdbx_ls_sigma_I -3 _refine.ls_number_reflns_all 28006 _refine.ls_number_reflns_obs 27031 _refine.ls_number_reflns_R_free 1367 _refine.ls_percent_reflns_obs 99.6 _refine.ls_R_factor_all 0.219 _refine.ls_R_factor_obs 0.219 _refine.ls_R_factor_R_work 0.219 _refine.ls_R_factor_R_free 0.245 _refine.ls_redundancy_reflns_obs ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.ls_percent_reflns_R_free ? _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model ? _refine.pdbx_ls_cross_valid_method R-Free _refine.pdbx_R_Free_selection_details random _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_stereochemistry_target_values 'Engh & Huber' _refine.solvent_model_details ? _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.pdbx_isotropic_thermal_model isotropic _refine.B_iso_mean 44.4 _refine.aniso_B[1][1] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][2] ? _refine.aniso_B[2][3] ? _refine.aniso_B[3][3] ? _refine.details ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_SU_ML ? _refine.overall_SU_B ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_overall_ESU_R ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_diffrn_id 1 _refine.pdbx_overall_phase_error ? _refine.pdbx_TLS_residual_ADP_flag ? _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 3114 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 68 _refine_hist.number_atoms_solvent 237 _refine_hist.number_atoms_total 3419 _refine_hist.d_res_high 2.2 _refine_hist.d_res_low 20. # 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 c_bond_d 0.006 ? ? ? 'X-RAY DIFFRACTION' ? c_angle_deg 1.3 ? ? ? 'X-RAY DIFFRACTION' ? # _struct.entry_id 3BES _struct.title 'Structure of a Poxvirus ifngbp/ifng Complex' _struct.pdbx_descriptor 'Interferon gamma, Interferon-gamma binding protein C4R' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3BES _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' _struct_keywords.text 'ectromelia virus, orthopoxvirus, interferon, protein complex, Antiviral defense, Cytokine, Glycoprotein, Receptor, 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 2 ? C N N 3 ? D N N 4 ? E N N 4 ? F N N 5 ? G N N 4 ? H N N 3 ? I N N 3 ? J N N 6 ? K N N 6 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLN A 2 ? PHE A 16 ? GLN L 1 PHE L 15 1 ? 15 HELX_P HELX_P2 2 HIS A 20 ? ASP A 25 ? HIS L 19 ASP L 24 5 ? 6 HELX_P HELX_P3 3 PHE A 30 ? TRP A 37 ? PHE L 29 TRP L 36 1 ? 8 HELX_P HELX_P4 4 GLU A 39 ? ASN A 60 ? GLU L 38 ASN L 59 1 ? 22 HELX_P HELX_P5 5 ILE A 67 ? PHE A 82 ? ILE L 66 PHE L 81 1 ? 16 HELX_P HELX_P6 6 ASN A 86 ? TYR A 99 ? ASN L 85 TYR L 98 1 ? 14 HELX_P HELX_P7 7 ASP A 103 ? SER A 122 ? ASP L 102 SER L 121 1 ? 20 HELX_P HELX_P8 8 PRO A 123 ? THR A 127 ? PRO L 122 THR L 126 5 ? 5 HELX_P HELX_P9 9 GLY B 78 ? VAL B 83 ? GLY R 94 VAL R 99 1 ? 6 HELX_P HELX_P10 10 ARG B 120 ? CYS B 124 ? ARG R 136 CYS R 140 5 ? 5 HELX_P HELX_P11 11 ASP B 148 ? CYS B 152 ? ASP R 164 CYS R 168 5 ? 5 HELX_P HELX_P12 12 SER B 204 ? GLU B 206 ? SER R 220 GLU R 222 5 ? 3 HELX_P HELX_P13 13 ASP B 207 ? PHE B 223 ? ASP R 223 PHE R 239 1 ? 17 HELX_P HELX_P14 14 ASN B 224 ? MET B 248 ? ASN R 240 MET R 264 1 ? 25 # _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 ? ? B CYS 80 SG ? ? ? 1_555 B CYS 124 SG ? ? R CYS 96 R CYS 140 1_555 ? ? ? ? ? ? ? 2.031 ? disulf2 disulf ? ? B CYS 152 SG ? ? ? 1_555 B CYS 157 SG ? ? R CYS 168 R CYS 173 1_555 ? ? ? ? ? ? ? 2.036 ? disulf3 disulf ? ? B CYS 168 SG ? ? ? 1_555 B CYS 190 SG ? ? R CYS 184 R CYS 206 1_555 ? ? ? ? ? ? ? 2.038 ? disulf4 disulf ? ? B CYS 200 SG ? ? ? 1_555 B CYS 200 SG ? ? R CYS 216 R CYS 216 3_655 ? ? ? ? ? ? ? 2.241 ? covale1 covale ? ? B ASN 25 ND2 ? ? ? 1_555 D NAG . C1 ? ? R ASN 41 R NAG 267 1_555 ? ? ? ? ? ? ? 1.449 ? covale2 covale ? ? B ASN 133 ND2 ? ? ? 1_555 G NAG . C1 ? ? R ASN 149 R NAG 270 1_555 ? ? ? ? ? ? ? 1.452 ? covale3 covale ? ? D NAG . O4 ? ? ? 1_555 E NAG . C1 ? ? R NAG 267 R NAG 268 1_555 ? ? ? ? ? ? ? 1.384 ? covale4 covale ? ? E NAG . O4 ? ? ? 1_555 F BMA . C1 ? ? R NAG 268 R BMA 269 1_555 ? ? ? ? ? ? ? 1.385 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 3 ? B ? 4 ? C ? 3 ? D ? 2 ? E ? 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 B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel D 1 2 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 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 ILE B 2 ? VAL B 10 ? ILE R 18 VAL R 26 A 2 ASP B 13 ? GLY B 20 ? ASP R 29 GLY R 36 A 3 GLY B 46 ? ASP B 49 ? GLY R 62 ASP R 65 B 1 GLN B 37 ? VAL B 43 ? GLN R 53 VAL R 59 B 2 TYR B 24 ? ASN B 30 ? TYR R 40 ASN R 46 B 3 PHE B 61 ? GLN B 67 ? PHE R 77 GLN R 83 B 4 TYR B 70 ? CYS B 76 ? TYR R 86 CYS R 92 C 1 THR B 89 ? TYR B 95 ? THR R 105 TYR R 111 C 2 HIS B 98 ? GLU B 104 ? HIS R 114 GLU R 120 C 3 GLY B 156 ? PHE B 161 ? GLY R 172 PHE R 177 D 1 TYR B 107 ? ARG B 110 ? TYR R 123 ARG R 126 D 2 LYS B 113 ? PRO B 116 ? LYS R 129 PRO R 132 E 1 VAL B 143 ? ASP B 146 ? VAL R 159 ASP R 162 E 2 LEU B 129 ? PHE B 136 ? LEU R 145 PHE R 152 E 3 VAL B 167 ? ALA B 174 ? VAL R 183 ALA R 190 E 4 VAL B 189 ? LEU B 191 ? VAL R 205 LEU R 207 # 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 GLU B 8 ? N GLU R 24 O LYS B 15 ? O LYS R 31 A 2 3 N ILE B 16 ? N ILE R 32 O TYR B 48 ? O TYR R 64 B 1 2 O MET B 39 ? O MET R 55 N ILE B 26 ? N ILE R 42 B 2 3 N SER B 27 ? N SER R 43 O LYS B 64 ? O LYS R 80 B 3 4 N VAL B 63 ? N VAL R 79 O LYS B 74 ? O LYS R 90 C 1 2 N THR B 89 ? N THR R 105 O GLU B 104 ? O GLU R 120 C 2 3 N ILE B 99 ? N ILE R 115 O PHE B 161 ? O PHE R 177 D 1 2 N ALA B 108 ? N ALA R 124 O ILE B 115 ? O ILE R 131 E 1 2 O VAL B 143 ? O VAL R 159 N PHE B 134 ? N PHE R 150 E 2 3 N THR B 135 ? N THR R 151 O CYS B 168 ? O CYS R 184 E 3 4 N VAL B 169 ? N VAL R 185 O VAL B 189 ? O VAL R 205 # 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 ? ? ? ? 8 'BINDING SITE FOR RESIDUE NAG R 267' AC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG R 268' AC4 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE BMA R 269' AC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG R 270' AC6 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE PO4 R 1' AC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE PO4 L 139' AC8 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE PO4 R 3' # 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 8 LEU B 23 ? LEU R 39 . ? 1_555 ? 2 AC1 8 ASN B 25 ? ASN R 41 . ? 1_555 ? 3 AC1 8 ASN B 42 ? ASN R 58 . ? 1_555 ? 4 AC1 8 GLU B 66 ? GLU R 82 . ? 1_555 ? 5 AC1 8 GLN B 67 ? GLN R 83 . ? 1_555 ? 6 AC1 8 GLY B 68 ? GLY R 84 . ? 1_555 ? 7 AC1 8 NAG E . ? NAG R 268 . ? 1_555 ? 8 AC1 8 HOH K . ? HOH R 435 . ? 1_555 ? 9 AC3 2 NAG D . ? NAG R 267 . ? 1_555 ? 10 AC3 2 BMA F . ? BMA R 269 . ? 1_555 ? 11 AC4 2 ILE B 182 ? ILE R 198 . ? 8_455 ? 12 AC4 2 NAG E . ? NAG R 268 . ? 1_555 ? 13 AC5 5 ASN B 133 ? ASN R 149 . ? 1_555 ? 14 AC5 5 ILE B 144 ? ILE R 160 . ? 1_555 ? 15 AC5 5 MET B 170 ? MET R 186 . ? 1_555 ? 16 AC5 5 HOH K . ? HOH R 326 . ? 1_555 ? 17 AC5 5 HOH K . ? HOH R 397 . ? 1_555 ? 18 AC6 9 SER B 237 ? SER R 253 . ? 3_655 ? 19 AC6 9 SER B 237 ? SER R 253 . ? 1_555 ? 20 AC6 9 THR B 238 ? THR R 254 . ? 1_555 ? 21 AC6 9 THR B 238 ? THR R 254 . ? 3_655 ? 22 AC6 9 ASP B 241 ? ASP R 257 . ? 2_665 ? 23 AC6 9 ASP B 241 ? ASP R 257 . ? 4_565 ? 24 AC6 9 ASP B 241 ? ASP R 257 . ? 3_655 ? 25 AC6 9 ASP B 241 ? ASP R 257 . ? 1_555 ? 26 AC6 9 HOH K . ? HOH R 352 . ? 2_665 ? 27 AC7 4 HIS A 20 ? HIS L 19 . ? 1_555 ? 28 AC7 4 SER A 21 ? SER L 20 . ? 1_555 ? 29 AC7 4 HOH J . ? HOH L 187 . ? 1_555 ? 30 AC7 4 ASP B 73 ? ASP R 89 . ? 1_555 ? 31 AC8 6 ASP B 151 ? ASP R 167 . ? 3_655 ? 32 AC8 6 ASP B 160 ? ASP R 176 . ? 3_655 ? 33 AC8 6 THR B 199 ? THR R 215 . ? 1_555 ? 34 AC8 6 CYS B 200 ? CYS R 216 . ? 1_555 ? 35 AC8 6 LYS B 214 ? LYS R 230 . ? 1_555 ? 36 AC8 6 HOH K . ? HOH R 336 . ? 1_555 ? # _database_PDB_matrix.entry_id 3BES _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 3BES _atom_sites.fract_transf_matrix[1][1] 0.010796 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.008394 _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] 0.005413 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O P S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 1 ? 46.851 39.289 37.919 1.00 83.05 ? 0 MET L N 1 ATOM 2 C CA . MET A 1 1 ? 46.827 38.681 36.557 1.00 82.47 ? 0 MET L CA 1 ATOM 3 C C . MET A 1 1 ? 46.871 37.159 36.683 1.00 80.86 ? 0 MET L C 1 ATOM 4 O O . MET A 1 1 ? 47.474 36.481 35.848 1.00 82.01 ? 0 MET L O 1 ATOM 5 C CB . MET A 1 1 ? 48.033 39.175 35.741 1.00 84.56 ? 0 MET L CB 1 ATOM 6 C CG . MET A 1 1 ? 47.794 39.305 34.230 1.00 86.67 ? 0 MET L CG 1 ATOM 7 S SD . MET A 1 1 ? 47.823 37.760 33.277 1.00 90.48 ? 0 MET L SD 1 ATOM 8 C CE . MET A 1 1 ? 49.398 37.918 32.410 1.00 89.79 ? 0 MET L CE 1 ATOM 9 N N . GLN A 1 2 ? 46.229 36.628 37.725 1.00 77.65 ? 1 GLN L N 1 ATOM 10 C CA . GLN A 1 2 ? 46.202 35.183 37.957 1.00 73.91 ? 1 GLN L CA 1 ATOM 11 C C . GLN A 1 2 ? 45.207 34.694 39.017 1.00 69.52 ? 1 GLN L C 1 ATOM 12 O O . GLN A 1 2 ? 44.584 35.481 39.729 1.00 68.91 ? 1 GLN L O 1 ATOM 13 C CB . GLN A 1 2 ? 47.579 34.686 38.398 1.00 76.10 ? 1 GLN L CB 1 ATOM 14 C CG . GLN A 1 2 ? 48.648 34.787 37.324 1.00 78.37 ? 1 GLN L CG 1 ATOM 15 C CD . GLN A 1 2 ? 49.999 34.286 37.796 1.00 80.92 ? 1 GLN L CD 1 ATOM 16 O OE1 . GLN A 1 2 ? 50.287 34.287 38.992 1.00 81.40 ? 1 GLN L OE1 1 ATOM 17 N NE2 . GLN A 1 2 ? 50.975 33.814 37.032 1.00 81.98 ? 1 GLN L NE2 1 ATOM 18 N N . ASP A 1 3 ? 45.078 33.372 39.101 1.00 65.33 ? 2 ASP L N 1 ATOM 19 C CA . ASP A 1 3 ? 44.197 32.702 40.054 1.00 58.24 ? 2 ASP L CA 1 ATOM 20 C C . ASP A 1 3 ? 44.702 32.815 41.502 1.00 52.68 ? 2 ASP L C 1 ATOM 21 O O . ASP A 1 3 ? 43.904 32.889 42.437 1.00 50.20 ? 2 ASP L O 1 ATOM 22 C CB . ASP A 1 3 ? 44.061 31.227 39.667 1.00 60.48 ? 2 ASP L CB 1 ATOM 23 C CG . ASP A 1 3 ? 43.193 30.448 40.630 1.00 63.54 ? 2 ASP L CG 1 ATOM 24 O OD1 . ASP A 1 3 ? 41.989 30.768 40.743 1.00 64.56 ? 2 ASP L OD1 1 ATOM 25 O OD2 . ASP A 1 3 ? 43.715 29.514 41.277 1.00 65.68 ? 2 ASP L OD2 1 ATOM 26 N N . PRO A 1 4 ? 46.035 32.816 41.706 1.00 47.59 ? 3 PRO L N 1 ATOM 27 C CA . PRO A 1 4 ? 46.598 32.925 43.058 1.00 44.13 ? 3 PRO L CA 1 ATOM 28 C C . PRO A 1 4 ? 46.168 34.214 43.761 1.00 40.21 ? 3 PRO L C 1 ATOM 29 O O . PRO A 1 4 ? 45.928 34.223 44.964 1.00 38.24 ? 3 PRO L O 1 ATOM 30 C CB . PRO A 1 4 ? 48.103 32.894 42.810 1.00 45.13 ? 3 PRO L CB 1 ATOM 31 C CG . PRO A 1 4 ? 48.225 32.060 41.585 1.00 47.78 ? 3 PRO L CG 1 ATOM 32 C CD . PRO A 1 4 ? 47.106 32.585 40.721 1.00 47.48 ? 3 PRO L CD 1 ATOM 33 N N . TYR A 1 5 ? 46.080 35.303 43.004 1.00 38.50 ? 4 TYR L N 1 ATOM 34 C CA . TYR A 1 5 ? 45.676 36.586 43.571 1.00 37.06 ? 4 TYR L CA 1 ATOM 35 C C . TYR A 1 5 ? 44.251 36.504 44.114 1.00 36.69 ? 4 TYR L C 1 ATOM 36 O O . TYR A 1 5 ? 43.949 37.025 45.189 1.00 37.56 ? 4 TYR L O 1 ATOM 37 C CB . TYR A 1 5 ? 45.778 37.678 42.509 1.00 37.32 ? 4 TYR L CB 1 ATOM 38 C CG . TYR A 1 5 ? 47.190 37.914 42.012 1.00 37.49 ? 4 TYR L CG 1 ATOM 39 C CD1 . TYR A 1 5 ? 47.516 37.741 40.664 1.00 38.14 ? 4 TYR L CD1 1 ATOM 40 C CD2 . TYR A 1 5 ? 48.193 38.339 42.885 1.00 36.03 ? 4 TYR L CD2 1 ATOM 41 C CE1 . TYR A 1 5 ? 48.811 37.992 40.197 1.00 37.75 ? 4 TYR L CE1 1 ATOM 42 C CE2 . TYR A 1 5 ? 49.486 38.593 42.431 1.00 35.55 ? 4 TYR L CE2 1 ATOM 43 C CZ . TYR A 1 5 ? 49.786 38.422 41.089 1.00 38.07 ? 4 TYR L CZ 1 ATOM 44 O OH . TYR A 1 5 ? 51.049 38.717 40.635 1.00 38.58 ? 4 TYR L OH 1 ATOM 45 N N . VAL A 1 6 ? 43.382 35.833 43.369 1.00 36.85 ? 5 VAL L N 1 ATOM 46 C CA . VAL A 1 6 ? 41.996 35.658 43.780 1.00 37.36 ? 5 VAL L CA 1 ATOM 47 C C . VAL A 1 6 ? 41.966 34.774 45.022 1.00 37.47 ? 5 VAL L C 1 ATOM 48 O O . VAL A 1 6 ? 41.266 35.059 45.991 1.00 37.68 ? 5 VAL L O 1 ATOM 49 C CB . VAL A 1 6 ? 41.169 34.997 42.647 1.00 37.81 ? 5 VAL L CB 1 ATOM 50 C CG1 . VAL A 1 6 ? 39.819 34.519 43.176 1.00 37.82 ? 5 VAL L CG1 1 ATOM 51 C CG2 . VAL A 1 6 ? 40.974 35.992 41.512 1.00 36.33 ? 5 VAL L CG2 1 ATOM 52 N N . LYS A 1 7 ? 42.745 33.701 44.989 1.00 38.70 ? 6 LYS L N 1 ATOM 53 C CA . LYS A 1 7 ? 42.812 32.776 46.112 1.00 38.92 ? 6 LYS L CA 1 ATOM 54 C C . LYS A 1 7 ? 43.231 33.498 47.394 1.00 37.51 ? 6 LYS L C 1 ATOM 55 O O . LYS A 1 7 ? 42.618 33.317 48.444 1.00 38.16 ? 6 LYS L O 1 ATOM 56 C CB . LYS A 1 7 ? 43.794 31.647 45.783 1.00 41.87 ? 6 LYS L CB 1 ATOM 57 C CG . LYS A 1 7 ? 43.992 30.622 46.886 1.00 48.20 ? 6 LYS L CG 1 ATOM 58 C CD . LYS A 1 7 ? 45.086 29.625 46.497 1.00 51.41 ? 6 LYS L CD 1 ATOM 59 C CE . LYS A 1 7 ? 45.368 28.633 47.621 1.00 55.66 ? 6 LYS L CE 1 ATOM 60 N NZ . LYS A 1 7 ? 44.152 27.848 47.989 1.00 57.40 ? 6 LYS L NZ 1 ATOM 61 N N . GLU A 1 8 ? 44.261 34.334 47.314 1.00 36.12 ? 7 GLU L N 1 ATOM 62 C CA . GLU A 1 8 ? 44.711 35.048 48.507 1.00 36.38 ? 7 GLU L CA 1 ATOM 63 C C . GLU A 1 8 ? 43.727 36.125 48.955 1.00 35.79 ? 7 GLU L C 1 ATOM 64 O O . GLU A 1 8 ? 43.575 36.367 50.151 1.00 35.50 ? 7 GLU L O 1 ATOM 65 C CB . GLU A 1 8 ? 46.098 35.657 48.283 1.00 36.16 ? 7 GLU L CB 1 ATOM 66 C CG . GLU A 1 8 ? 47.200 34.611 48.174 1.00 40.63 ? 7 GLU L CG 1 ATOM 67 C CD . GLU A 1 8 ? 47.015 33.463 49.163 1.00 42.32 ? 7 GLU L CD 1 ATOM 68 O OE1 . GLU A 1 8 ? 46.737 33.729 50.351 1.00 45.67 ? 7 GLU L OE1 1 ATOM 69 O OE2 . GLU A 1 8 ? 47.154 32.293 48.753 1.00 46.86 ? 7 GLU L OE2 1 ATOM 70 N N . ALA A 1 9 ? 43.062 36.776 48.003 1.00 35.13 ? 8 ALA L N 1 ATOM 71 C CA . ALA A 1 9 ? 42.075 37.792 48.364 1.00 36.73 ? 8 ALA L CA 1 ATOM 72 C C . ALA A 1 9 ? 40.954 37.094 49.140 1.00 36.64 ? 8 ALA L C 1 ATOM 73 O O . ALA A 1 9 ? 40.463 37.615 50.144 1.00 35.36 ? 8 ALA L O 1 ATOM 74 C CB . ALA A 1 9 ? 41.516 38.465 47.113 1.00 34.49 ? 8 ALA L CB 1 ATOM 75 N N . GLU A 1 10 ? 40.554 35.911 48.682 1.00 37.90 ? 9 GLU L N 1 ATOM 76 C CA . GLU A 1 10 ? 39.500 35.166 49.374 1.00 42.34 ? 9 GLU L CA 1 ATOM 77 C C . GLU A 1 10 ? 39.946 34.750 50.772 1.00 42.54 ? 9 GLU L C 1 ATOM 78 O O . GLU A 1 10 ? 39.161 34.797 51.716 1.00 41.93 ? 9 GLU L O 1 ATOM 79 C CB . GLU A 1 10 ? 39.083 33.927 48.576 1.00 44.98 ? 9 GLU L CB 1 ATOM 80 C CG . GLU A 1 10 ? 37.988 34.187 47.550 1.00 51.95 ? 9 GLU L CG 1 ATOM 81 C CD . GLU A 1 10 ? 36.703 34.745 48.173 1.00 55.89 ? 9 GLU L CD 1 ATOM 82 O OE1 . GLU A 1 10 ? 36.105 34.077 49.053 1.00 56.92 ? 9 GLU L OE1 1 ATOM 83 O OE2 . GLU A 1 10 ? 36.289 35.856 47.776 1.00 57.06 ? 9 GLU L OE2 1 ATOM 84 N N . ASN A 1 11 ? 41.206 34.343 50.906 1.00 42.86 ? 10 ASN L N 1 ATOM 85 C CA . ASN A 1 11 ? 41.728 33.950 52.211 1.00 44.65 ? 10 ASN L CA 1 ATOM 86 C C . ASN A 1 11 ? 41.620 35.139 53.168 1.00 43.96 ? 10 ASN L C 1 ATOM 87 O O . ASN A 1 11 ? 41.288 34.973 54.340 1.00 44.07 ? 10 ASN L O 1 ATOM 88 C CB . ASN A 1 11 ? 43.195 33.515 52.106 1.00 48.42 ? 10 ASN L CB 1 ATOM 89 C CG . ASN A 1 11 ? 43.751 33.004 53.432 1.00 55.27 ? 10 ASN L CG 1 ATOM 90 O OD1 . ASN A 1 11 ? 44.913 33.252 53.773 1.00 58.18 ? 10 ASN L OD1 1 ATOM 91 N ND2 . ASN A 1 11 ? 42.923 32.276 54.184 1.00 56.50 ? 10 ASN L ND2 1 ATOM 92 N N . LEU A 1 12 ? 41.905 36.340 52.670 1.00 42.69 ? 11 LEU L N 1 ATOM 93 C CA . LEU A 1 12 ? 41.814 37.529 53.509 1.00 42.90 ? 11 LEU L CA 1 ATOM 94 C C . LEU A 1 12 ? 40.366 37.798 53.892 1.00 43.20 ? 11 LEU L C 1 ATOM 95 O O . LEU A 1 12 ? 40.088 38.233 55.005 1.00 42.55 ? 11 LEU L O 1 ATOM 96 C CB . LEU A 1 12 ? 42.391 38.757 52.796 1.00 43.28 ? 11 LEU L CB 1 ATOM 97 C CG . LEU A 1 12 ? 43.916 38.895 52.768 1.00 44.74 ? 11 LEU L CG 1 ATOM 98 C CD1 . LEU A 1 12 ? 44.299 40.193 52.068 1.00 44.87 ? 11 LEU L CD1 1 ATOM 99 C CD2 . LEU A 1 12 ? 44.456 38.890 54.190 1.00 44.09 ? 11 LEU L CD2 1 ATOM 100 N N . LYS A 1 13 ? 39.444 37.542 52.969 1.00 44.29 ? 12 LYS L N 1 ATOM 101 C CA . LYS A 1 13 ? 38.031 37.758 53.256 1.00 47.99 ? 12 LYS L CA 1 ATOM 102 C C . LYS A 1 13 ? 37.625 36.884 54.444 1.00 49.57 ? 12 LYS L C 1 ATOM 103 O O . LYS A 1 13 ? 36.922 37.337 55.350 1.00 49.83 ? 12 LYS L O 1 ATOM 104 C CB . LYS A 1 13 ? 37.166 37.417 52.038 1.00 46.94 ? 12 LYS L CB 1 ATOM 105 C CG . LYS A 1 13 ? 35.710 37.828 52.213 1.00 49.19 ? 12 LYS L CG 1 ATOM 106 C CD . LYS A 1 13 ? 34.830 37.373 51.059 1.00 48.92 ? 12 LYS L CD 1 ATOM 107 C CE . LYS A 1 13 ? 35.194 38.055 49.752 1.00 49.42 ? 12 LYS L CE 1 ATOM 108 N NZ . LYS A 1 13 ? 34.303 37.579 48.654 1.00 49.38 ? 12 LYS L NZ 1 ATOM 109 N N . LYS A 1 14 ? 38.080 35.633 54.436 1.00 52.23 ? 13 LYS L N 1 ATOM 110 C CA . LYS A 1 14 ? 37.782 34.698 55.520 1.00 55.84 ? 13 LYS L CA 1 ATOM 111 C C . LYS A 1 14 ? 38.414 35.153 56.830 1.00 56.06 ? 13 LYS L C 1 ATOM 112 O O . LYS A 1 14 ? 37.755 35.203 57.866 1.00 56.48 ? 13 LYS L O 1 ATOM 113 C CB . LYS A 1 14 ? 38.301 33.295 55.186 1.00 57.77 ? 13 LYS L CB 1 ATOM 114 C CG . LYS A 1 14 ? 37.522 32.567 54.106 1.00 62.17 ? 13 LYS L CG 1 ATOM 115 C CD . LYS A 1 14 ? 38.053 31.149 53.915 1.00 64.94 ? 13 LYS L CD 1 ATOM 116 C CE . LYS A 1 14 ? 37.226 30.382 52.891 1.00 67.01 ? 13 LYS L CE 1 ATOM 117 N NZ . LYS A 1 14 ? 37.215 31.060 51.563 1.00 67.61 ? 13 LYS L NZ 1 ATOM 118 N N . TYR A 1 15 ? 39.700 35.481 56.776 1.00 57.35 ? 14 TYR L N 1 ATOM 119 C CA . TYR A 1 15 ? 40.426 35.921 57.960 1.00 57.56 ? 14 TYR L CA 1 ATOM 120 C C . TYR A 1 15 ? 39.768 37.117 58.644 1.00 56.51 ? 14 TYR L C 1 ATOM 121 O O . TYR A 1 15 ? 39.666 37.159 59.868 1.00 56.96 ? 14 TYR L O 1 ATOM 122 C CB . TYR A 1 15 ? 41.863 36.285 57.592 1.00 60.08 ? 14 TYR L CB 1 ATOM 123 C CG . TYR A 1 15 ? 42.703 36.654 58.789 1.00 63.73 ? 14 TYR L CG 1 ATOM 124 C CD1 . TYR A 1 15 ? 43.111 35.682 59.702 1.00 64.94 ? 14 TYR L CD1 1 ATOM 125 C CD2 . TYR A 1 15 ? 43.067 37.978 59.028 1.00 65.11 ? 14 TYR L CD2 1 ATOM 126 C CE1 . TYR A 1 15 ? 43.861 36.020 60.826 1.00 66.52 ? 14 TYR L CE1 1 ATOM 127 C CE2 . TYR A 1 15 ? 43.818 38.328 60.149 1.00 66.65 ? 14 TYR L CE2 1 ATOM 128 C CZ . TYR A 1 15 ? 44.209 37.344 61.043 1.00 66.93 ? 14 TYR L CZ 1 ATOM 129 O OH . TYR A 1 15 ? 44.938 37.686 62.160 1.00 69.03 ? 14 TYR L OH 1 ATOM 130 N N . PHE A 1 16 ? 39.328 38.089 57.852 1.00 54.71 ? 15 PHE L N 1 ATOM 131 C CA . PHE A 1 16 ? 38.685 39.285 58.388 1.00 53.48 ? 15 PHE L CA 1 ATOM 132 C C . PHE A 1 16 ? 37.201 39.073 58.679 1.00 52.45 ? 15 PHE L C 1 ATOM 133 O O . PHE A 1 16 ? 36.510 39.998 59.105 1.00 50.01 ? 15 PHE L O 1 ATOM 134 C CB . PHE A 1 16 ? 38.857 40.453 57.410 1.00 54.63 ? 15 PHE L CB 1 ATOM 135 C CG . PHE A 1 16 ? 40.145 41.211 57.584 1.00 56.04 ? 15 PHE L CG 1 ATOM 136 C CD1 . PHE A 1 16 ? 40.184 42.371 58.356 1.00 56.40 ? 15 PHE L CD1 1 ATOM 137 C CD2 . PHE A 1 16 ? 41.320 40.765 56.982 1.00 56.43 ? 15 PHE L CD2 1 ATOM 138 C CE1 . PHE A 1 16 ? 41.374 43.078 58.527 1.00 57.05 ? 15 PHE L CE1 1 ATOM 139 C CE2 . PHE A 1 16 ? 42.518 41.464 57.146 1.00 57.14 ? 15 PHE L CE2 1 ATOM 140 C CZ . PHE A 1 16 ? 42.545 42.623 57.920 1.00 57.73 ? 15 PHE L CZ 1 ATOM 141 N N . ASN A 1 17 ? 36.714 37.858 58.443 1.00 52.57 ? 16 ASN L N 1 ATOM 142 C CA . ASN A 1 17 ? 35.311 37.537 58.688 1.00 53.67 ? 16 ASN L CA 1 ATOM 143 C C . ASN A 1 17 ? 34.427 38.536 57.938 1.00 52.95 ? 16 ASN L C 1 ATOM 144 O O . ASN A 1 17 ? 33.462 39.069 58.487 1.00 53.44 ? 16 ASN L O 1 ATOM 145 C CB . ASN A 1 17 ? 35.019 37.609 60.192 1.00 54.99 ? 16 ASN L CB 1 ATOM 146 C CG . ASN A 1 17 ? 33.713 36.935 60.569 1.00 58.43 ? 16 ASN L CG 1 ATOM 147 O OD1 . ASN A 1 17 ? 33.188 37.140 61.668 1.00 60.71 ? 16 ASN L OD1 1 ATOM 148 N ND2 . ASN A 1 17 ? 33.186 36.117 59.665 1.00 59.39 ? 16 ASN L ND2 1 ATOM 149 N N . ALA A 1 18 ? 34.762 38.783 56.676 1.00 52.58 ? 17 ALA L N 1 ATOM 150 C CA . ALA A 1 18 ? 34.018 39.734 55.860 1.00 52.00 ? 17 ALA L CA 1 ATOM 151 C C . ALA A 1 18 ? 33.120 39.055 54.823 1.00 52.77 ? 17 ALA L C 1 ATOM 152 O O . ALA A 1 18 ? 32.870 39.612 53.752 1.00 52.61 ? 17 ALA L O 1 ATOM 153 C CB . ALA A 1 18 ? 34.995 40.679 55.167 1.00 51.15 ? 17 ALA L CB 1 ATOM 154 N N . GLY A 1 19 ? 32.631 37.861 55.151 1.00 52.55 ? 18 GLY L N 1 ATOM 155 C CA . GLY A 1 19 ? 31.773 37.129 54.236 1.00 52.09 ? 18 GLY L CA 1 ATOM 156 C C . GLY A 1 19 ? 30.321 36.987 54.672 1.00 52.40 ? 18 GLY L C 1 ATOM 157 O O . GLY A 1 19 ? 29.590 36.163 54.128 1.00 52.87 ? 18 GLY L O 1 ATOM 158 N N . HIS A 1 20 ? 29.897 37.780 55.650 1.00 53.14 ? 19 HIS L N 1 ATOM 159 C CA . HIS A 1 20 ? 28.517 37.730 56.128 1.00 53.54 ? 19 HIS L CA 1 ATOM 160 C C . HIS A 1 20 ? 27.653 38.691 55.319 1.00 52.64 ? 19 HIS L C 1 ATOM 161 O O . HIS A 1 20 ? 28.110 39.764 54.933 1.00 50.87 ? 19 HIS L O 1 ATOM 162 C CB . HIS A 1 20 ? 28.463 38.085 57.613 1.00 57.12 ? 19 HIS L CB 1 ATOM 163 C CG . HIS A 1 20 ? 29.167 37.095 58.488 1.00 61.07 ? 19 HIS L CG 1 ATOM 164 N ND1 . HIS A 1 20 ? 28.820 35.761 58.528 1.00 62.70 ? 19 HIS L ND1 1 ATOM 165 C CD2 . HIS A 1 20 ? 30.202 37.241 59.348 1.00 62.25 ? 19 HIS L CD2 1 ATOM 166 C CE1 . HIS A 1 20 ? 29.611 35.127 59.375 1.00 63.81 ? 19 HIS L CE1 1 ATOM 167 N NE2 . HIS A 1 20 ? 30.459 36.002 59.887 1.00 63.78 ? 19 HIS L NE2 1 ATOM 168 N N . SER A 1 21 ? 26.406 38.302 55.067 1.00 51.53 ? 20 SER L N 1 ATOM 169 C CA . SER A 1 21 ? 25.493 39.113 54.265 1.00 52.33 ? 20 SER L CA 1 ATOM 170 C C . SER A 1 21 ? 25.298 40.550 54.741 1.00 53.03 ? 20 SER L C 1 ATOM 171 O O . SER A 1 21 ? 24.913 41.418 53.952 1.00 51.69 ? 20 SER L O 1 ATOM 172 C CB . SER A 1 21 ? 24.127 38.429 54.164 1.00 51.79 ? 20 SER L CB 1 ATOM 173 O OG . SER A 1 21 ? 23.466 38.425 55.415 1.00 53.31 ? 20 SER L OG 1 ATOM 174 N N . ASP A 1 22 ? 25.565 40.805 56.018 1.00 53.79 ? 21 ASP L N 1 ATOM 175 C CA . ASP A 1 22 ? 25.391 42.147 56.566 1.00 56.26 ? 21 ASP L CA 1 ATOM 176 C C . ASP A 1 22 ? 26.561 43.078 56.245 1.00 56.36 ? 21 ASP L C 1 ATOM 177 O O . ASP A 1 22 ? 26.487 44.280 56.503 1.00 55.27 ? 21 ASP L O 1 ATOM 178 C CB . ASP A 1 22 ? 25.182 42.072 58.079 1.00 59.52 ? 21 ASP L CB 1 ATOM 179 C CG . ASP A 1 22 ? 26.434 41.661 58.820 1.00 62.41 ? 21 ASP L CG 1 ATOM 180 O OD1 . ASP A 1 22 ? 27.165 40.778 58.322 1.00 63.84 ? 21 ASP L OD1 1 ATOM 181 O OD2 . ASP A 1 22 ? 26.679 42.213 59.912 1.00 66.01 ? 21 ASP L OD2 1 ATOM 182 N N . VAL A 1 23 ? 27.636 42.525 55.686 1.00 56.95 ? 22 VAL L N 1 ATOM 183 C CA . VAL A 1 23 ? 28.799 43.332 55.322 1.00 57.44 ? 22 VAL L CA 1 ATOM 184 C C . VAL A 1 23 ? 28.385 44.257 54.181 1.00 59.09 ? 22 VAL L C 1 ATOM 185 O O . VAL A 1 23 ? 28.856 45.390 54.075 1.00 58.85 ? 22 VAL L O 1 ATOM 186 C CB . VAL A 1 23 ? 29.987 42.446 54.853 1.00 56.44 ? 22 VAL L CB 1 ATOM 187 C CG1 . VAL A 1 23 ? 29.670 41.814 53.501 1.00 54.07 ? 22 VAL L CG1 1 ATOM 188 C CG2 . VAL A 1 23 ? 31.258 43.276 54.771 1.00 54.25 ? 22 VAL L CG2 1 ATOM 189 N N . ALA A 1 24 ? 27.478 43.755 53.346 1.00 61.00 ? 23 ALA L N 1 ATOM 190 C CA . ALA A 1 24 ? 26.964 44.483 52.190 1.00 63.05 ? 23 ALA L CA 1 ATOM 191 C C . ALA A 1 24 ? 26.220 45.770 52.535 1.00 64.53 ? 23 ALA L C 1 ATOM 192 O O . ALA A 1 24 ? 25.901 46.558 51.647 1.00 64.32 ? 23 ALA L O 1 ATOM 193 C CB . ALA A 1 24 ? 26.050 43.576 51.375 1.00 62.59 ? 23 ALA L CB 1 ATOM 194 N N . ASP A 1 25 ? 25.933 45.983 53.814 1.00 66.26 ? 24 ASP L N 1 ATOM 195 C CA . ASP A 1 25 ? 25.218 47.187 54.217 1.00 68.25 ? 24 ASP L CA 1 ATOM 196 C C . ASP A 1 25 ? 25.989 48.453 53.852 1.00 68.70 ? 24 ASP L C 1 ATOM 197 O O . ASP A 1 25 ? 27.208 48.428 53.666 1.00 69.85 ? 24 ASP L O 1 ATOM 198 C CB . ASP A 1 25 ? 24.928 47.163 55.725 1.00 69.15 ? 24 ASP L CB 1 ATOM 199 C CG . ASP A 1 25 ? 23.969 46.044 56.120 1.00 70.21 ? 24 ASP L CG 1 ATOM 200 O OD1 . ASP A 1 25 ? 22.930 45.891 55.448 1.00 70.08 ? 24 ASP L OD1 1 ATOM 201 O OD2 . ASP A 1 25 ? 24.243 45.320 57.102 1.00 70.60 ? 24 ASP L OD2 1 ATOM 202 N N . ASN A 1 26 ? 25.252 49.553 53.731 1.00 67.31 ? 25 ASN L N 1 ATOM 203 C CA . ASN A 1 26 ? 25.813 50.859 53.394 1.00 65.79 ? 25 ASN L CA 1 ATOM 204 C C . ASN A 1 26 ? 26.579 50.912 52.076 1.00 62.67 ? 25 ASN L C 1 ATOM 205 O O . ASN A 1 26 ? 27.787 51.172 52.063 1.00 63.87 ? 25 ASN L O 1 ATOM 206 C CB . ASN A 1 26 ? 26.727 51.348 54.520 1.00 68.62 ? 25 ASN L CB 1 ATOM 207 C CG . ASN A 1 26 ? 26.028 51.372 55.860 1.00 71.11 ? 25 ASN L CG 1 ATOM 208 O OD1 . ASN A 1 26 ? 25.824 50.329 56.485 1.00 72.22 ? 25 ASN L OD1 1 ATOM 209 N ND2 . ASN A 1 26 ? 25.638 52.563 56.304 1.00 71.81 ? 25 ASN L ND2 1 ATOM 210 N N . GLY A 1 27 ? 25.875 50.677 50.972 1.00 57.45 ? 26 GLY L N 1 ATOM 211 C CA . GLY A 1 27 ? 26.505 50.722 49.663 1.00 51.90 ? 26 GLY L CA 1 ATOM 212 C C . GLY A 1 27 ? 27.908 50.138 49.622 1.00 47.73 ? 26 GLY L C 1 ATOM 213 O O . GLY A 1 27 ? 28.175 49.099 50.226 1.00 46.10 ? 26 GLY L O 1 ATOM 214 N N . THR A 1 28 ? 28.814 50.812 48.919 1.00 43.99 ? 27 THR L N 1 ATOM 215 C CA . THR A 1 28 ? 30.183 50.327 48.806 1.00 40.38 ? 27 THR L CA 1 ATOM 216 C C . THR A 1 28 ? 31.192 51.428 49.105 1.00 38.89 ? 27 THR L C 1 ATOM 217 O O . THR A 1 28 ? 30.848 52.607 49.138 1.00 38.47 ? 27 THR L O 1 ATOM 218 C CB . THR A 1 28 ? 30.463 49.785 47.394 1.00 38.97 ? 27 THR L CB 1 ATOM 219 O OG1 . THR A 1 28 ? 30.417 50.862 46.453 1.00 41.67 ? 27 THR L OG1 1 ATOM 220 C CG2 . THR A 1 28 ? 29.416 48.747 47.001 1.00 40.57 ? 27 THR L CG2 1 ATOM 221 N N . LEU A 1 29 ? 32.439 51.031 49.330 1.00 35.64 ? 28 LEU L N 1 ATOM 222 C CA . LEU A 1 29 ? 33.506 51.984 49.603 1.00 34.56 ? 28 LEU L CA 1 ATOM 223 C C . LEU A 1 29 ? 34.122 52.492 48.316 1.00 32.62 ? 28 LEU L C 1 ATOM 224 O O . LEU A 1 29 ? 34.201 53.696 48.087 1.00 33.99 ? 28 LEU L O 1 ATOM 225 C CB . LEU A 1 29 ? 34.632 51.335 50.411 1.00 34.53 ? 28 LEU L CB 1 ATOM 226 C CG . LEU A 1 29 ? 34.462 51.000 51.886 1.00 34.82 ? 28 LEU L CG 1 ATOM 227 C CD1 . LEU A 1 29 ? 35.760 50.365 52.379 1.00 33.38 ? 28 LEU L CD1 1 ATOM 228 C CD2 . LEU A 1 29 ? 34.134 52.261 52.684 1.00 31.90 ? 28 LEU L CD2 1 ATOM 229 N N . PHE A 1 30 ? 34.544 51.550 47.479 1.00 31.71 ? 29 PHE L N 1 ATOM 230 C CA . PHE A 1 30 ? 35.232 51.855 46.235 1.00 31.73 ? 29 PHE L CA 1 ATOM 231 C C . PHE A 1 30 ? 34.530 51.491 44.934 1.00 34.15 ? 29 PHE L C 1 ATOM 232 O O . PHE A 1 30 ? 34.800 52.099 43.904 1.00 33.30 ? 29 PHE L O 1 ATOM 233 C CB . PHE A 1 30 ? 36.598 51.151 46.234 1.00 30.00 ? 29 PHE L CB 1 ATOM 234 C CG . PHE A 1 30 ? 37.371 51.304 47.518 1.00 28.57 ? 29 PHE L CG 1 ATOM 235 C CD1 . PHE A 1 30 ? 37.631 52.563 48.045 1.00 27.30 ? 29 PHE L CD1 1 ATOM 236 C CD2 . PHE A 1 30 ? 37.863 50.183 48.185 1.00 29.31 ? 29 PHE L CD2 1 ATOM 237 C CE1 . PHE A 1 30 ? 38.370 52.710 49.218 1.00 29.87 ? 29 PHE L CE1 1 ATOM 238 C CE2 . PHE A 1 30 ? 38.607 50.314 49.361 1.00 29.90 ? 29 PHE L CE2 1 ATOM 239 C CZ . PHE A 1 30 ? 38.863 51.584 49.881 1.00 30.88 ? 29 PHE L CZ 1 ATOM 240 N N . LEU A 1 31 ? 33.655 50.491 44.962 1.00 35.59 ? 30 LEU L N 1 ATOM 241 C CA . LEU A 1 31 ? 32.989 50.052 43.738 1.00 37.66 ? 30 LEU L CA 1 ATOM 242 C C . LEU A 1 31 ? 32.252 51.136 42.969 1.00 36.30 ? 30 LEU L C 1 ATOM 243 O O . LEU A 1 31 ? 32.454 51.289 41.768 1.00 37.38 ? 30 LEU L O 1 ATOM 244 C CB . LEU A 1 31 ? 32.028 48.897 44.041 1.00 39.84 ? 30 LEU L CB 1 ATOM 245 C CG . LEU A 1 31 ? 32.627 47.491 44.056 1.00 44.26 ? 30 LEU L CG 1 ATOM 246 C CD1 . LEU A 1 31 ? 33.862 47.470 44.924 1.00 45.52 ? 30 LEU L CD1 1 ATOM 247 C CD2 . LEU A 1 31 ? 31.588 46.485 44.551 1.00 45.28 ? 30 LEU L CD2 1 ATOM 248 N N . GLY A 1 32 ? 31.392 51.878 43.654 1.00 37.86 ? 31 GLY L N 1 ATOM 249 C CA . GLY A 1 32 ? 30.642 52.929 42.988 1.00 39.56 ? 31 GLY L CA 1 ATOM 250 C C . GLY A 1 32 ? 31.524 54.034 42.429 1.00 41.49 ? 31 GLY L C 1 ATOM 251 O O . GLY A 1 32 ? 31.342 54.479 41.294 1.00 41.77 ? 31 GLY L O 1 ATOM 252 N N . ILE A 1 33 ? 32.494 54.474 43.223 1.00 42.39 ? 32 ILE L N 1 ATOM 253 C CA . ILE A 1 33 ? 33.396 55.536 42.795 1.00 42.39 ? 32 ILE L CA 1 ATOM 254 C C . ILE A 1 33 ? 34.199 55.133 41.562 1.00 42.19 ? 32 ILE L C 1 ATOM 255 O O . ILE A 1 33 ? 34.279 55.892 40.600 1.00 43.50 ? 32 ILE L O 1 ATOM 256 C CB . ILE A 1 33 ? 34.328 55.945 43.954 1.00 42.69 ? 32 ILE L CB 1 ATOM 257 C CG1 . ILE A 1 33 ? 33.482 56.583 45.063 1.00 41.54 ? 32 ILE L CG1 1 ATOM 258 C CG2 . ILE A 1 33 ? 35.397 56.913 43.468 1.00 42.34 ? 32 ILE L CG2 1 ATOM 259 C CD1 . ILE A 1 33 ? 34.248 56.929 46.326 1.00 43.79 ? 32 ILE L CD1 1 ATOM 260 N N . LEU A 1 34 ? 34.775 53.938 41.571 1.00 42.45 ? 33 LEU L N 1 ATOM 261 C CA . LEU A 1 34 ? 35.548 53.486 40.422 1.00 44.52 ? 33 LEU L CA 1 ATOM 262 C C . LEU A 1 34 ? 34.672 53.389 39.178 1.00 47.38 ? 33 LEU L C 1 ATOM 263 O O . LEU A 1 34 ? 35.161 53.484 38.052 1.00 48.69 ? 33 LEU L O 1 ATOM 264 C CB . LEU A 1 34 ? 36.190 52.130 40.704 1.00 43.60 ? 33 LEU L CB 1 ATOM 265 C CG . LEU A 1 34 ? 37.345 52.136 41.706 1.00 44.86 ? 33 LEU L CG 1 ATOM 266 C CD1 . LEU A 1 34 ? 37.730 50.714 42.058 1.00 43.01 ? 33 LEU L CD1 1 ATOM 267 C CD2 . LEU A 1 34 ? 38.529 52.890 41.113 1.00 45.37 ? 33 LEU L CD2 1 ATOM 268 N N . LYS A 1 35 ? 33.373 53.199 39.382 1.00 48.03 ? 34 LYS L N 1 ATOM 269 C CA . LYS A 1 35 ? 32.446 53.094 38.264 1.00 48.61 ? 34 LYS L CA 1 ATOM 270 C C . LYS A 1 35 ? 32.133 54.468 37.663 1.00 46.44 ? 34 LYS L C 1 ATOM 271 O O . LYS A 1 35 ? 31.847 54.578 36.476 1.00 46.62 ? 34 LYS L O 1 ATOM 272 C CB . LYS A 1 35 ? 31.154 52.404 38.722 1.00 51.70 ? 34 LYS L CB 1 ATOM 273 C CG . LYS A 1 35 ? 30.127 52.215 37.622 1.00 57.46 ? 34 LYS L CG 1 ATOM 274 C CD . LYS A 1 35 ? 28.964 51.331 38.075 1.00 61.96 ? 34 LYS L CD 1 ATOM 275 C CE . LYS A 1 35 ? 29.372 49.861 38.187 1.00 63.80 ? 34 LYS L CE 1 ATOM 276 N NZ . LYS A 1 35 ? 30.429 49.612 39.208 1.00 65.95 ? 34 LYS L NZ 1 ATOM 277 N N . ASN A 1 36 ? 32.197 55.513 38.484 1.00 44.95 ? 35 ASN L N 1 ATOM 278 C CA . ASN A 1 36 ? 31.923 56.875 38.023 1.00 45.75 ? 35 ASN L CA 1 ATOM 279 C C . ASN A 1 36 ? 32.990 57.482 37.114 1.00 44.57 ? 35 ASN L C 1 ATOM 280 O O . ASN A 1 36 ? 32.707 58.430 36.392 1.00 44.92 ? 35 ASN L O 1 ATOM 281 C CB . ASN A 1 36 ? 31.758 57.836 39.205 1.00 47.61 ? 35 ASN L CB 1 ATOM 282 C CG . ASN A 1 36 ? 30.601 57.473 40.102 1.00 50.86 ? 35 ASN L CG 1 ATOM 283 O OD1 . ASN A 1 36 ? 29.629 56.862 39.658 1.00 50.96 ? 35 ASN L OD1 1 ATOM 284 N ND2 . ASN A 1 36 ? 30.686 57.869 41.374 1.00 50.08 ? 35 ASN L ND2 1 ATOM 285 N N . TRP A 1 37 ? 34.209 56.956 37.150 1.00 42.93 ? 36 TRP L N 1 ATOM 286 C CA . TRP A 1 37 ? 35.287 57.534 36.352 1.00 42.49 ? 36 TRP L CA 1 ATOM 287 C C . TRP A 1 37 ? 35.964 56.575 35.384 1.00 43.39 ? 36 TRP L C 1 ATOM 288 O O . TRP A 1 37 ? 36.628 55.627 35.792 1.00 44.62 ? 36 TRP L O 1 ATOM 289 C CB . TRP A 1 37 ? 36.320 58.156 37.302 1.00 38.94 ? 36 TRP L CB 1 ATOM 290 C CG . TRP A 1 37 ? 35.650 59.000 38.344 1.00 35.37 ? 36 TRP L CG 1 ATOM 291 C CD1 . TRP A 1 37 ? 35.350 58.639 39.627 1.00 33.81 ? 36 TRP L CD1 1 ATOM 292 C CD2 . TRP A 1 37 ? 35.042 60.283 38.137 1.00 34.69 ? 36 TRP L CD2 1 ATOM 293 N NE1 . TRP A 1 37 ? 34.584 59.610 40.228 1.00 32.96 ? 36 TRP L NE1 1 ATOM 294 C CE2 . TRP A 1 37 ? 34.380 60.629 39.335 1.00 33.74 ? 36 TRP L CE2 1 ATOM 295 C CE3 . TRP A 1 37 ? 34.986 61.169 37.049 1.00 34.16 ? 36 TRP L CE3 1 ATOM 296 C CZ2 . TRP A 1 37 ? 33.665 61.824 39.477 1.00 33.67 ? 36 TRP L CZ2 1 ATOM 297 C CZ3 . TRP A 1 37 ? 34.275 62.358 37.189 1.00 32.94 ? 36 TRP L CZ3 1 ATOM 298 C CH2 . TRP A 1 37 ? 33.623 62.672 38.398 1.00 32.94 ? 36 TRP L CH2 1 ATOM 299 N N . LYS A 1 38 ? 35.808 56.841 34.092 1.00 45.39 ? 37 LYS L N 1 ATOM 300 C CA . LYS A 1 38 ? 36.403 55.988 33.073 1.00 47.52 ? 37 LYS L CA 1 ATOM 301 C C . LYS A 1 38 ? 37.632 56.575 32.384 1.00 46.81 ? 37 LYS L C 1 ATOM 302 O O . LYS A 1 38 ? 38.438 55.831 31.822 1.00 46.65 ? 37 LYS L O 1 ATOM 303 C CB . LYS A 1 38 ? 35.346 55.602 32.034 1.00 49.45 ? 37 LYS L CB 1 ATOM 304 C CG . LYS A 1 38 ? 34.229 54.733 32.609 1.00 54.50 ? 37 LYS L CG 1 ATOM 305 C CD . LYS A 1 38 ? 34.800 53.490 33.302 1.00 58.70 ? 37 LYS L CD 1 ATOM 306 C CE . LYS A 1 38 ? 33.705 52.633 33.938 1.00 61.57 ? 37 LYS L CE 1 ATOM 307 N NZ . LYS A 1 38 ? 34.271 51.473 34.700 1.00 61.42 ? 37 LYS L NZ 1 ATOM 308 N N . GLU A 1 39 ? 37.785 57.895 32.415 1.00 46.88 ? 38 GLU L N 1 ATOM 309 C CA . GLU A 1 39 ? 38.958 58.509 31.793 1.00 48.21 ? 38 GLU L CA 1 ATOM 310 C C . GLU A 1 39 ? 40.169 58.069 32.622 1.00 46.31 ? 38 GLU L C 1 ATOM 311 O O . GLU A 1 39 ? 40.131 58.101 33.855 1.00 43.36 ? 38 GLU L O 1 ATOM 312 C CB . GLU A 1 39 ? 38.823 60.036 31.790 1.00 52.23 ? 38 GLU L CB 1 ATOM 313 C CG . GLU A 1 39 ? 39.680 60.747 30.747 1.00 60.04 ? 38 GLU L CG 1 ATOM 314 C CD . GLU A 1 39 ? 40.983 61.291 31.312 1.00 64.84 ? 38 GLU L CD 1 ATOM 315 O OE1 . GLU A 1 39 ? 40.921 62.135 32.235 1.00 67.35 ? 38 GLU L OE1 1 ATOM 316 O OE2 . GLU A 1 39 ? 42.066 60.882 30.830 1.00 66.62 ? 38 GLU L OE2 1 ATOM 317 N N . GLU A 1 40 ? 41.231 57.646 31.945 1.00 45.67 ? 39 GLU L N 1 ATOM 318 C CA . GLU A 1 40 ? 42.432 57.164 32.617 1.00 46.58 ? 39 GLU L CA 1 ATOM 319 C C . GLU A 1 40 ? 42.954 58.092 33.705 1.00 44.22 ? 39 GLU L C 1 ATOM 320 O O . GLU A 1 40 ? 43.286 57.636 34.800 1.00 43.81 ? 39 GLU L O 1 ATOM 321 C CB . GLU A 1 40 ? 43.548 56.897 31.602 1.00 51.14 ? 39 GLU L CB 1 ATOM 322 C CG . GLU A 1 40 ? 44.832 56.355 32.226 1.00 57.22 ? 39 GLU L CG 1 ATOM 323 C CD . GLU A 1 40 ? 44.735 54.890 32.633 1.00 62.14 ? 39 GLU L CD 1 ATOM 324 O OE1 . GLU A 1 40 ? 43.717 54.491 33.247 1.00 64.32 ? 39 GLU L OE1 1 ATOM 325 O OE2 . GLU A 1 40 ? 45.691 54.134 32.344 1.00 65.57 ? 39 GLU L OE2 1 ATOM 326 N N . SER A 1 41 ? 43.032 59.387 33.411 1.00 41.71 ? 40 SER L N 1 ATOM 327 C CA . SER A 1 41 ? 43.523 60.347 34.400 1.00 41.73 ? 40 SER L CA 1 ATOM 328 C C . SER A 1 41 ? 42.654 60.395 35.650 1.00 37.45 ? 40 SER L C 1 ATOM 329 O O . SER A 1 41 ? 43.173 60.388 36.762 1.00 36.95 ? 40 SER L O 1 ATOM 330 C CB . SER A 1 41 ? 43.632 61.749 33.791 1.00 42.31 ? 40 SER L CB 1 ATOM 331 O OG . SER A 1 41 ? 44.767 61.829 32.950 1.00 49.09 ? 40 SER L OG 1 ATOM 332 N N . ASP A 1 42 ? 41.338 60.452 35.472 1.00 36.16 ? 41 ASP L N 1 ATOM 333 C CA . ASP A 1 42 ? 40.436 60.479 36.619 1.00 36.83 ? 41 ASP L CA 1 ATOM 334 C C . ASP A 1 42 ? 40.563 59.179 37.411 1.00 34.32 ? 41 ASP L C 1 ATOM 335 O O . ASP A 1 42 ? 40.536 59.191 38.633 1.00 34.47 ? 41 ASP L O 1 ATOM 336 C CB . ASP A 1 42 ? 38.978 60.665 36.178 1.00 38.75 ? 41 ASP L CB 1 ATOM 337 C CG . ASP A 1 42 ? 38.740 61.987 35.466 1.00 42.54 ? 41 ASP L CG 1 ATOM 338 O OD1 . ASP A 1 42 ? 39.426 62.980 35.789 1.00 41.85 ? 41 ASP L OD1 1 ATOM 339 O OD2 . ASP A 1 42 ? 37.847 62.037 34.591 1.00 44.98 ? 41 ASP L OD2 1 ATOM 340 N N . ARG A 1 43 ? 40.710 58.059 36.711 1.00 35.03 ? 42 ARG L N 1 ATOM 341 C CA . ARG A 1 43 ? 40.847 56.765 37.381 1.00 34.93 ? 42 ARG L CA 1 ATOM 342 C C . ARG A 1 43 ? 42.090 56.712 38.259 1.00 32.14 ? 42 ARG L C 1 ATOM 343 O O . ARG A 1 43 ? 42.034 56.240 39.397 1.00 32.39 ? 42 ARG L O 1 ATOM 344 C CB . ARG A 1 43 ? 40.922 55.623 36.362 1.00 37.79 ? 42 ARG L CB 1 ATOM 345 C CG . ARG A 1 43 ? 39.639 55.373 35.598 1.00 43.91 ? 42 ARG L CG 1 ATOM 346 C CD . ARG A 1 43 ? 39.752 54.126 34.724 1.00 48.20 ? 42 ARG L CD 1 ATOM 347 N NE . ARG A 1 43 ? 39.748 52.880 35.492 1.00 52.67 ? 42 ARG L NE 1 ATOM 348 C CZ . ARG A 1 43 ? 38.721 52.445 36.223 1.00 54.26 ? 42 ARG L CZ 1 ATOM 349 N NH1 . ARG A 1 43 ? 37.601 53.153 36.297 1.00 52.67 ? 42 ARG L NH1 1 ATOM 350 N NH2 . ARG A 1 43 ? 38.808 51.293 36.876 1.00 54.85 ? 42 ARG L NH2 1 ATOM 351 N N . LYS A 1 44 ? 43.217 57.183 37.726 1.00 32.08 ? 43 LYS L N 1 ATOM 352 C CA . LYS A 1 44 ? 44.471 57.168 38.481 1.00 30.66 ? 43 LYS L CA 1 ATOM 353 C C . LYS A 1 44 ? 44.349 57.996 39.743 1.00 28.32 ? 43 LYS L C 1 ATOM 354 O O . LYS A 1 44 ? 44.847 57.615 40.796 1.00 30.61 ? 43 LYS L O 1 ATOM 355 C CB . LYS A 1 44 ? 45.625 57.688 37.616 1.00 33.62 ? 43 LYS L CB 1 ATOM 356 C CG . LYS A 1 44 ? 46.018 56.733 36.505 1.00 38.51 ? 43 LYS L CG 1 ATOM 357 C CD . LYS A 1 44 ? 46.410 55.371 37.070 1.00 40.39 ? 43 LYS L CD 1 ATOM 358 C CE . LYS A 1 44 ? 46.706 54.372 35.959 1.00 45.24 ? 43 LYS L CE 1 ATOM 359 N NZ . LYS A 1 44 ? 47.020 53.013 36.494 1.00 47.08 ? 43 LYS L NZ 1 ATOM 360 N N . ILE A 1 45 ? 43.670 59.130 39.639 1.00 27.61 ? 44 ILE L N 1 ATOM 361 C CA . ILE A 1 45 ? 43.476 59.997 40.794 1.00 26.70 ? 44 ILE L CA 1 ATOM 362 C C . ILE A 1 45 ? 42.773 59.255 41.920 1.00 27.19 ? 44 ILE L C 1 ATOM 363 O O . ILE A 1 45 ? 43.171 59.353 43.087 1.00 26.54 ? 44 ILE L O 1 ATOM 364 C CB . ILE A 1 45 ? 42.631 61.234 40.413 1.00 30.15 ? 44 ILE L CB 1 ATOM 365 C CG1 . ILE A 1 45 ? 43.433 62.131 39.466 1.00 33.91 ? 44 ILE L CG1 1 ATOM 366 C CG2 . ILE A 1 45 ? 42.218 61.989 41.653 1.00 30.54 ? 44 ILE L CG2 1 ATOM 367 C CD1 . ILE A 1 45 ? 42.659 63.335 38.954 1.00 38.04 ? 44 ILE L CD1 1 ATOM 368 N N . MET A 1 46 ? 41.718 58.520 41.570 1.00 25.82 ? 45 MET L N 1 ATOM 369 C CA . MET A 1 46 ? 40.947 57.766 42.555 1.00 25.55 ? 45 MET L CA 1 ATOM 370 C C . MET A 1 46 ? 41.706 56.514 43.016 1.00 24.05 ? 45 MET L C 1 ATOM 371 O O . MET A 1 46 ? 41.779 56.232 44.202 1.00 24.50 ? 45 MET L O 1 ATOM 372 C CB . MET A 1 46 ? 39.588 57.357 41.954 1.00 25.52 ? 45 MET L CB 1 ATOM 373 C CG . MET A 1 46 ? 38.739 58.528 41.459 1.00 26.32 ? 45 MET L CG 1 ATOM 374 S SD . MET A 1 46 ? 38.337 59.695 42.772 1.00 30.93 ? 45 MET L SD 1 ATOM 375 C CE . MET A 1 46 ? 37.885 61.145 41.804 1.00 27.54 ? 45 MET L CE 1 ATOM 376 N N . GLN A 1 47 ? 42.270 55.765 42.075 1.00 25.25 ? 46 GLN L N 1 ATOM 377 C CA . GLN A 1 47 ? 43.009 54.554 42.430 1.00 25.95 ? 46 GLN L CA 1 ATOM 378 C C . GLN A 1 47 ? 44.188 54.842 43.344 1.00 25.31 ? 46 GLN L C 1 ATOM 379 O O . GLN A 1 47 ? 44.485 54.056 44.243 1.00 26.72 ? 46 GLN L O 1 ATOM 380 C CB . GLN A 1 47 ? 43.488 53.837 41.172 1.00 29.78 ? 46 GLN L CB 1 ATOM 381 C CG . GLN A 1 47 ? 42.353 53.335 40.300 1.00 32.35 ? 46 GLN L CG 1 ATOM 382 C CD . GLN A 1 47 ? 42.847 52.808 38.975 1.00 36.60 ? 46 GLN L CD 1 ATOM 383 O OE1 . GLN A 1 47 ? 43.910 53.204 38.499 1.00 38.61 ? 46 GLN L OE1 1 ATOM 384 N NE2 . GLN A 1 47 ? 42.071 51.924 38.360 1.00 38.38 ? 46 GLN L NE2 1 ATOM 385 N N . SER A 1 48 ? 44.853 55.975 43.130 1.00 27.14 ? 47 SER L N 1 ATOM 386 C CA . SER A 1 48 ? 45.994 56.338 43.964 1.00 26.09 ? 47 SER L CA 1 ATOM 387 C C . SER A 1 48 ? 45.567 56.389 45.424 1.00 26.19 ? 47 SER L C 1 ATOM 388 O O . SER A 1 48 ? 46.267 55.875 46.298 1.00 26.27 ? 47 SER L O 1 ATOM 389 C CB . SER A 1 48 ? 46.573 57.696 43.524 1.00 27.41 ? 47 SER L CB 1 ATOM 390 O OG . SER A 1 48 ? 47.614 58.101 44.402 1.00 28.84 ? 47 SER L OG 1 ATOM 391 N N . GLN A 1 49 ? 44.415 57.004 45.690 1.00 24.83 ? 48 GLN L N 1 ATOM 392 C CA . GLN A 1 49 ? 43.891 57.088 47.052 1.00 25.64 ? 48 GLN L CA 1 ATOM 393 C C . GLN A 1 49 ? 43.422 55.724 47.577 1.00 26.28 ? 48 GLN L C 1 ATOM 394 O O . GLN A 1 49 ? 43.516 55.444 48.774 1.00 28.90 ? 48 GLN L O 1 ATOM 395 C CB . GLN A 1 49 ? 42.717 58.079 47.127 1.00 28.65 ? 48 GLN L CB 1 ATOM 396 C CG . GLN A 1 49 ? 43.089 59.541 46.891 1.00 27.53 ? 48 GLN L CG 1 ATOM 397 C CD . GLN A 1 49 ? 44.095 60.065 47.904 1.00 29.83 ? 48 GLN L CD 1 ATOM 398 O OE1 . GLN A 1 49 ? 44.060 59.698 49.081 1.00 30.42 ? 48 GLN L OE1 1 ATOM 399 N NE2 . GLN A 1 49 ? 44.987 60.944 47.453 1.00 30.46 ? 48 GLN L NE2 1 ATOM 400 N N . ILE A 1 50 ? 42.889 54.884 46.699 1.00 26.11 ? 49 ILE L N 1 ATOM 401 C CA . ILE A 1 50 ? 42.439 53.559 47.123 1.00 26.71 ? 49 ILE L CA 1 ATOM 402 C C . ILE A 1 50 ? 43.667 52.678 47.426 1.00 27.33 ? 49 ILE L C 1 ATOM 403 O O . ILE A 1 50 ? 43.688 51.935 48.412 1.00 27.56 ? 49 ILE L O 1 ATOM 404 C CB . ILE A 1 50 ? 41.578 52.895 46.020 1.00 27.76 ? 49 ILE L CB 1 ATOM 405 C CG1 . ILE A 1 50 ? 40.248 53.654 45.876 1.00 25.54 ? 49 ILE L CG1 1 ATOM 406 C CG2 . ILE A 1 50 ? 41.321 51.421 46.365 1.00 26.44 ? 49 ILE L CG2 1 ATOM 407 C CD1 . ILE A 1 50 ? 39.575 53.447 44.525 1.00 23.13 ? 49 ILE L CD1 1 ATOM 408 N N . VAL A 1 51 ? 44.697 52.775 46.589 1.00 27.57 ? 50 VAL L N 1 ATOM 409 C CA . VAL A 1 51 ? 45.907 51.985 46.810 1.00 27.95 ? 50 VAL L CA 1 ATOM 410 C C . VAL A 1 51 ? 46.600 52.393 48.107 1.00 29.12 ? 50 VAL L C 1 ATOM 411 O O . VAL A 1 51 ? 47.057 51.526 48.862 1.00 29.15 ? 50 VAL L O 1 ATOM 412 C CB . VAL A 1 51 ? 46.896 52.107 45.617 1.00 29.26 ? 50 VAL L CB 1 ATOM 413 C CG1 . VAL A 1 51 ? 48.257 51.488 45.982 1.00 28.25 ? 50 VAL L CG1 1 ATOM 414 C CG2 . VAL A 1 51 ? 46.319 51.386 44.408 1.00 24.98 ? 50 VAL L CG2 1 ATOM 415 N N . SER A 1 52 ? 46.675 53.698 48.382 1.00 29.65 ? 51 SER L N 1 ATOM 416 C CA . SER A 1 52 ? 47.308 54.140 49.625 1.00 29.79 ? 51 SER L CA 1 ATOM 417 C C . SER A 1 52 ? 46.460 53.681 50.805 1.00 29.58 ? 51 SER L C 1 ATOM 418 O O . SER A 1 52 ? 46.976 53.390 51.884 1.00 28.60 ? 51 SER L O 1 ATOM 419 C CB . SER A 1 52 ? 47.506 55.671 49.665 1.00 30.41 ? 51 SER L CB 1 ATOM 420 O OG . SER A 1 52 ? 46.292 56.401 49.533 1.00 32.17 ? 51 SER L OG 1 ATOM 421 N N . PHE A 1 53 ? 45.150 53.613 50.611 1.00 30.30 ? 52 PHE L N 1 ATOM 422 C CA . PHE A 1 53 ? 44.290 53.143 51.695 1.00 29.43 ? 52 PHE L CA 1 ATOM 423 C C . PHE A 1 53 ? 44.673 51.697 52.038 1.00 27.89 ? 52 PHE L C 1 ATOM 424 O O . PHE A 1 53 ? 44.891 51.362 53.196 1.00 30.12 ? 52 PHE L O 1 ATOM 425 C CB . PHE A 1 53 ? 42.813 53.183 51.287 1.00 30.61 ? 52 PHE L CB 1 ATOM 426 C CG . PHE A 1 53 ? 41.887 52.605 52.326 1.00 32.25 ? 52 PHE L CG 1 ATOM 427 C CD1 . PHE A 1 53 ? 41.359 53.407 53.331 1.00 33.96 ? 52 PHE L CD1 1 ATOM 428 C CD2 . PHE A 1 53 ? 41.577 51.248 52.319 1.00 33.29 ? 52 PHE L CD2 1 ATOM 429 C CE1 . PHE A 1 53 ? 40.531 52.868 54.318 1.00 36.76 ? 52 PHE L CE1 1 ATOM 430 C CE2 . PHE A 1 53 ? 40.749 50.695 53.304 1.00 35.61 ? 52 PHE L CE2 1 ATOM 431 C CZ . PHE A 1 53 ? 40.226 51.508 54.303 1.00 36.22 ? 52 PHE L CZ 1 ATOM 432 N N . TYR A 1 54 ? 44.756 50.844 51.024 1.00 28.32 ? 53 TYR L N 1 ATOM 433 C CA . TYR A 1 54 ? 45.100 49.445 51.251 1.00 31.00 ? 53 TYR L CA 1 ATOM 434 C C . TYR A 1 54 ? 46.500 49.245 51.842 1.00 32.46 ? 53 TYR L C 1 ATOM 435 O O . TYR A 1 54 ? 46.688 48.394 52.709 1.00 31.94 ? 53 TYR L O 1 ATOM 436 C CB . TYR A 1 54 ? 44.952 48.640 49.958 1.00 28.22 ? 53 TYR L CB 1 ATOM 437 C CG . TYR A 1 54 ? 43.521 48.260 49.637 1.00 30.52 ? 53 TYR L CG 1 ATOM 438 C CD1 . TYR A 1 54 ? 42.821 47.352 50.442 1.00 30.04 ? 53 TYR L CD1 1 ATOM 439 C CD2 . TYR A 1 54 ? 42.867 48.799 48.527 1.00 28.63 ? 53 TYR L CD2 1 ATOM 440 C CE1 . TYR A 1 54 ? 41.512 46.989 50.147 1.00 29.95 ? 53 TYR L CE1 1 ATOM 441 C CE2 . TYR A 1 54 ? 41.560 48.445 48.224 1.00 30.83 ? 53 TYR L CE2 1 ATOM 442 C CZ . TYR A 1 54 ? 40.888 47.538 49.036 1.00 32.27 ? 53 TYR L CZ 1 ATOM 443 O OH . TYR A 1 54 ? 39.606 47.166 48.720 1.00 31.50 ? 53 TYR L OH 1 ATOM 444 N N . PHE A 1 55 ? 47.480 50.017 51.384 1.00 33.90 ? 54 PHE L N 1 ATOM 445 C CA . PHE A 1 55 ? 48.828 49.880 51.929 1.00 35.22 ? 54 PHE L CA 1 ATOM 446 C C . PHE A 1 55 ? 48.819 50.222 53.408 1.00 35.84 ? 54 PHE L C 1 ATOM 447 O O . PHE A 1 55 ? 49.462 49.552 54.210 1.00 36.43 ? 54 PHE L O 1 ATOM 448 C CB . PHE A 1 55 ? 49.818 50.781 51.182 1.00 36.17 ? 54 PHE L CB 1 ATOM 449 C CG . PHE A 1 55 ? 50.278 50.216 49.867 1.00 38.23 ? 54 PHE L CG 1 ATOM 450 C CD1 . PHE A 1 55 ? 49.665 49.091 49.324 1.00 39.83 ? 54 PHE L CD1 1 ATOM 451 C CD2 . PHE A 1 55 ? 51.322 50.810 49.166 1.00 41.76 ? 54 PHE L CD2 1 ATOM 452 C CE1 . PHE A 1 55 ? 50.083 48.564 48.105 1.00 41.57 ? 54 PHE L CE1 1 ATOM 453 C CE2 . PHE A 1 55 ? 51.749 50.293 47.944 1.00 43.85 ? 54 PHE L CE2 1 ATOM 454 C CZ . PHE A 1 55 ? 51.128 49.166 47.412 1.00 41.78 ? 54 PHE L CZ 1 ATOM 455 N N . LYS A 1 56 ? 48.072 51.254 53.779 1.00 37.74 ? 55 LYS L N 1 ATOM 456 C CA . LYS A 1 56 ? 48.001 51.638 55.179 1.00 40.53 ? 55 LYS L CA 1 ATOM 457 C C . LYS A 1 56 ? 47.285 50.566 56.001 1.00 41.86 ? 55 LYS L C 1 ATOM 458 O O . LYS A 1 56 ? 47.697 50.256 57.122 1.00 41.54 ? 55 LYS L O 1 ATOM 459 C CB . LYS A 1 56 ? 47.288 52.981 55.330 1.00 44.29 ? 55 LYS L CB 1 ATOM 460 C CG . LYS A 1 56 ? 47.281 53.495 56.757 1.00 50.16 ? 55 LYS L CG 1 ATOM 461 C CD . LYS A 1 56 ? 46.765 54.922 56.844 1.00 55.66 ? 55 LYS L CD 1 ATOM 462 C CE . LYS A 1 56 ? 46.710 55.389 58.293 1.00 58.18 ? 55 LYS L CE 1 ATOM 463 N NZ . LYS A 1 56 ? 48.011 55.171 58.993 1.00 60.95 ? 55 LYS L NZ 1 ATOM 464 N N . LEU A 1 57 ? 46.214 50.002 55.446 1.00 41.34 ? 56 LEU L N 1 ATOM 465 C CA . LEU A 1 57 ? 45.467 48.948 56.135 1.00 41.66 ? 56 LEU L CA 1 ATOM 466 C C . LEU A 1 57 ? 46.369 47.733 56.367 1.00 42.16 ? 56 LEU L C 1 ATOM 467 O O . LEU A 1 57 ? 46.417 47.183 57.466 1.00 41.29 ? 56 LEU L O 1 ATOM 468 C CB . LEU A 1 57 ? 44.248 48.523 55.307 1.00 39.91 ? 56 LEU L CB 1 ATOM 469 C CG . LEU A 1 57 ? 43.457 47.297 55.792 1.00 42.55 ? 56 LEU L CG 1 ATOM 470 C CD1 . LEU A 1 57 ? 42.844 47.574 57.153 1.00 43.29 ? 56 LEU L CD1 1 ATOM 471 C CD2 . LEU A 1 57 ? 42.364 46.966 54.789 1.00 40.37 ? 56 LEU L CD2 1 ATOM 472 N N . PHE A 1 58 ? 47.084 47.322 55.326 1.00 42.48 ? 57 PHE L N 1 ATOM 473 C CA . PHE A 1 58 ? 47.973 46.173 55.430 1.00 45.95 ? 57 PHE L CA 1 ATOM 474 C C . PHE A 1 58 ? 49.085 46.423 56.436 1.00 49.83 ? 57 PHE L C 1 ATOM 475 O O . PHE A 1 58 ? 49.478 45.525 57.183 1.00 50.55 ? 57 PHE L O 1 ATOM 476 C CB . PHE A 1 58 ? 48.575 45.836 54.065 1.00 42.38 ? 57 PHE L CB 1 ATOM 477 C CG . PHE A 1 58 ? 47.560 45.380 53.051 1.00 40.87 ? 57 PHE L CG 1 ATOM 478 C CD1 . PHE A 1 58 ? 46.406 44.713 53.454 1.00 40.19 ? 57 PHE L CD1 1 ATOM 479 C CD2 . PHE A 1 58 ? 47.776 45.583 51.691 1.00 40.43 ? 57 PHE L CD2 1 ATOM 480 C CE1 . PHE A 1 58 ? 45.483 44.252 52.516 1.00 41.21 ? 57 PHE L CE1 1 ATOM 481 C CE2 . PHE A 1 58 ? 46.862 45.127 50.745 1.00 39.99 ? 57 PHE L CE2 1 ATOM 482 C CZ . PHE A 1 58 ? 45.712 44.460 51.157 1.00 40.78 ? 57 PHE L CZ 1 ATOM 483 N N . LYS A 1 59 ? 49.585 47.651 56.453 1.00 54.38 ? 58 LYS L N 1 ATOM 484 C CA . LYS A 1 59 ? 50.648 48.033 57.368 1.00 59.22 ? 58 LYS L CA 1 ATOM 485 C C . LYS A 1 59 ? 50.176 47.843 58.811 1.00 61.65 ? 58 LYS L C 1 ATOM 486 O O . LYS A 1 59 ? 50.951 47.440 59.677 1.00 62.33 ? 58 LYS L O 1 ATOM 487 C CB . LYS A 1 59 ? 51.032 49.494 57.116 1.00 60.84 ? 58 LYS L CB 1 ATOM 488 C CG . LYS A 1 59 ? 52.293 49.972 57.818 1.00 63.49 ? 58 LYS L CG 1 ATOM 489 C CD . LYS A 1 59 ? 52.608 51.407 57.405 1.00 65.08 ? 58 LYS L CD 1 ATOM 490 C CE . LYS A 1 59 ? 53.863 51.937 58.082 1.00 67.33 ? 58 LYS L CE 1 ATOM 491 N NZ . LYS A 1 59 ? 54.154 53.345 57.672 1.00 67.31 ? 58 LYS L NZ 1 ATOM 492 N N . ASN A 1 60 ? 48.898 48.118 59.057 1.00 63.94 ? 59 ASN L N 1 ATOM 493 C CA . ASN A 1 60 ? 48.322 47.985 60.394 1.00 66.85 ? 59 ASN L CA 1 ATOM 494 C C . ASN A 1 60 ? 48.138 46.534 60.835 1.00 68.61 ? 59 ASN L C 1 ATOM 495 O O . ASN A 1 60 ? 47.646 46.275 61.933 1.00 68.76 ? 59 ASN L O 1 ATOM 496 C CB . ASN A 1 60 ? 46.974 48.708 60.460 1.00 67.60 ? 59 ASN L CB 1 ATOM 497 C CG . ASN A 1 60 ? 47.121 50.214 60.560 1.00 69.13 ? 59 ASN L CG 1 ATOM 498 O OD1 . ASN A 1 60 ? 47.883 50.829 59.812 1.00 71.26 ? 59 ASN L OD1 1 ATOM 499 N ND2 . ASN A 1 60 ? 46.381 50.818 61.480 1.00 70.03 ? 59 ASN L ND2 1 ATOM 500 N N . PHE A 1 61 ? 48.523 45.592 59.981 1.00 70.20 ? 60 PHE L N 1 ATOM 501 C CA . PHE A 1 61 ? 48.397 44.175 60.308 1.00 72.15 ? 60 PHE L CA 1 ATOM 502 C C . PHE A 1 61 ? 49.658 43.400 59.943 1.00 73.64 ? 60 PHE L C 1 ATOM 503 O O . PHE A 1 61 ? 49.599 42.201 59.670 1.00 73.38 ? 60 PHE L O 1 ATOM 504 C CB . PHE A 1 61 ? 47.194 43.558 59.583 1.00 72.19 ? 60 PHE L CB 1 ATOM 505 C CG . PHE A 1 61 ? 45.863 43.990 60.130 1.00 72.55 ? 60 PHE L CG 1 ATOM 506 C CD1 . PHE A 1 61 ? 45.376 45.272 59.892 1.00 72.66 ? 60 PHE L CD1 1 ATOM 507 C CD2 . PHE A 1 61 ? 45.099 43.116 60.901 1.00 72.75 ? 60 PHE L CD2 1 ATOM 508 C CE1 . PHE A 1 61 ? 44.147 45.679 60.415 1.00 72.30 ? 60 PHE L CE1 1 ATOM 509 C CE2 . PHE A 1 61 ? 43.868 43.513 61.429 1.00 71.99 ? 60 PHE L CE2 1 ATOM 510 C CZ . PHE A 1 61 ? 43.393 44.797 61.185 1.00 72.34 ? 60 PHE L CZ 1 ATOM 511 N N . LYS A 1 62 ? 50.797 44.085 59.945 1.00 75.61 ? 61 LYS L N 1 ATOM 512 C CA . LYS A 1 62 ? 52.066 43.451 59.604 1.00 78.13 ? 61 LYS L CA 1 ATOM 513 C C . LYS A 1 62 ? 52.542 42.459 60.664 1.00 79.41 ? 61 LYS L C 1 ATOM 514 O O . LYS A 1 62 ? 53.604 41.855 60.523 1.00 79.18 ? 61 LYS L O 1 ATOM 515 C CB . LYS A 1 62 ? 53.145 44.514 59.377 1.00 78.96 ? 61 LYS L CB 1 ATOM 516 C CG . LYS A 1 62 ? 53.347 45.465 60.544 1.00 79.65 ? 61 LYS L CG 1 ATOM 517 C CD . LYS A 1 62 ? 54.490 46.428 60.266 1.00 81.36 ? 61 LYS L CD 1 ATOM 518 C CE . LYS A 1 62 ? 54.608 47.484 61.354 1.00 82.67 ? 61 LYS L CE 1 ATOM 519 N NZ . LYS A 1 62 ? 53.403 48.363 61.405 1.00 83.20 ? 61 LYS L NZ 1 ATOM 520 N N . ASP A 1 63 ? 51.755 42.290 61.722 1.00 81.12 ? 62 ASP L N 1 ATOM 521 C CA . ASP A 1 63 ? 52.115 41.363 62.788 1.00 83.06 ? 62 ASP L CA 1 ATOM 522 C C . ASP A 1 63 ? 51.482 39.991 62.593 1.00 83.17 ? 62 ASP L C 1 ATOM 523 O O . ASP A 1 63 ? 52.114 38.969 62.859 1.00 83.92 ? 62 ASP L O 1 ATOM 524 C CB . ASP A 1 63 ? 51.709 41.936 64.146 1.00 84.58 ? 62 ASP L CB 1 ATOM 525 C CG . ASP A 1 63 ? 52.435 43.226 64.467 1.00 86.33 ? 62 ASP L CG 1 ATOM 526 O OD1 . ASP A 1 63 ? 53.686 43.218 64.471 1.00 86.42 ? 62 ASP L OD1 1 ATOM 527 O OD2 . ASP A 1 63 ? 51.756 44.247 64.712 1.00 87.59 ? 62 ASP L OD2 1 ATOM 528 N N . ASP A 1 64 ? 50.235 39.970 62.131 1.00 82.70 ? 63 ASP L N 1 ATOM 529 C CA . ASP A 1 64 ? 49.539 38.711 61.894 1.00 82.31 ? 63 ASP L CA 1 ATOM 530 C C . ASP A 1 64 ? 50.324 37.918 60.858 1.00 81.74 ? 63 ASP L C 1 ATOM 531 O O . ASP A 1 64 ? 50.290 38.230 59.668 1.00 82.25 ? 63 ASP L O 1 ATOM 532 C CB . ASP A 1 64 ? 48.122 38.975 61.385 1.00 83.40 ? 63 ASP L CB 1 ATOM 533 C CG . ASP A 1 64 ? 47.307 39.819 62.346 1.00 84.47 ? 63 ASP L CG 1 ATOM 534 O OD1 . ASP A 1 64 ? 46.108 40.048 62.074 1.00 85.12 ? 63 ASP L OD1 1 ATOM 535 O OD2 . ASP A 1 64 ? 47.866 40.257 63.375 1.00 85.00 ? 63 ASP L OD2 1 ATOM 536 N N . GLN A 1 65 ? 51.034 36.895 61.321 1.00 80.52 ? 64 GLN L N 1 ATOM 537 C CA . GLN A 1 65 ? 51.854 36.063 60.450 1.00 79.74 ? 64 GLN L CA 1 ATOM 538 C C . GLN A 1 65 ? 51.024 35.202 59.504 1.00 78.06 ? 64 GLN L C 1 ATOM 539 O O . GLN A 1 65 ? 51.388 35.013 58.343 1.00 78.60 ? 64 GLN L O 1 ATOM 540 C CB . GLN A 1 65 ? 52.753 35.156 61.296 1.00 81.48 ? 64 GLN L CB 1 ATOM 541 C CG . GLN A 1 65 ? 53.599 35.896 62.324 1.00 83.95 ? 64 GLN L CG 1 ATOM 542 C CD . GLN A 1 65 ? 54.325 34.956 63.274 1.00 85.50 ? 64 GLN L CD 1 ATOM 543 O OE1 . GLN A 1 65 ? 53.700 34.166 63.986 1.00 85.84 ? 64 GLN L OE1 1 ATOM 544 N NE2 . GLN A 1 65 ? 55.652 35.038 63.289 1.00 85.89 ? 64 GLN L NE2 1 ATOM 545 N N . SER A 1 66 ? 49.908 34.689 60.009 1.00 75.96 ? 65 SER L N 1 ATOM 546 C CA . SER A 1 66 ? 49.024 33.819 59.237 1.00 73.93 ? 65 SER L CA 1 ATOM 547 C C . SER A 1 66 ? 48.556 34.360 57.885 1.00 72.02 ? 65 SER L C 1 ATOM 548 O O . SER A 1 66 ? 48.362 33.591 56.942 1.00 72.33 ? 65 SER L O 1 ATOM 549 C CB . SER A 1 66 ? 47.801 33.451 60.083 1.00 74.22 ? 65 SER L CB 1 ATOM 550 O OG . SER A 1 66 ? 47.103 34.611 60.504 1.00 74.93 ? 65 SER L OG 1 ATOM 551 N N . ILE A 1 67 ? 48.376 35.673 57.785 1.00 69.08 ? 66 ILE L N 1 ATOM 552 C CA . ILE A 1 67 ? 47.909 36.276 56.540 1.00 65.41 ? 66 ILE L CA 1 ATOM 553 C C . ILE A 1 67 ? 48.982 37.044 55.788 1.00 62.87 ? 66 ILE L C 1 ATOM 554 O O . ILE A 1 67 ? 48.705 37.641 54.746 1.00 61.54 ? 66 ILE L O 1 ATOM 555 C CB . ILE A 1 67 ? 46.760 37.258 56.796 1.00 65.47 ? 66 ILE L CB 1 ATOM 556 C CG1 . ILE A 1 67 ? 47.222 38.341 57.776 1.00 64.26 ? 66 ILE L CG1 1 ATOM 557 C CG2 . ILE A 1 67 ? 45.551 36.511 57.309 1.00 65.71 ? 66 ILE L CG2 1 ATOM 558 C CD1 . ILE A 1 67 ? 46.253 39.490 57.940 1.00 64.23 ? 66 ILE L CD1 1 ATOM 559 N N . GLN A 1 68 ? 50.204 37.033 56.304 1.00 59.56 ? 67 GLN L N 1 ATOM 560 C CA . GLN A 1 68 ? 51.273 37.771 55.658 1.00 56.04 ? 67 GLN L CA 1 ATOM 561 C C . GLN A 1 68 ? 51.494 37.345 54.211 1.00 52.36 ? 67 GLN L C 1 ATOM 562 O O . GLN A 1 68 ? 51.755 38.192 53.355 1.00 51.05 ? 67 GLN L O 1 ATOM 563 C CB . GLN A 1 68 ? 52.566 37.647 56.466 1.00 59.36 ? 67 GLN L CB 1 ATOM 564 C CG . GLN A 1 68 ? 53.368 38.946 56.527 1.00 62.39 ? 67 GLN L CG 1 ATOM 565 C CD . GLN A 1 68 ? 52.496 40.165 56.823 1.00 64.38 ? 67 GLN L CD 1 ATOM 566 O OE1 . GLN A 1 68 ? 51.731 40.184 57.792 1.00 64.81 ? 67 GLN L OE1 1 ATOM 567 N NE2 . GLN A 1 68 ? 52.613 41.191 55.984 1.00 64.09 ? 67 GLN L NE2 1 ATOM 568 N N . LYS A 1 69 ? 51.386 36.050 53.919 1.00 48.60 ? 68 LYS L N 1 ATOM 569 C CA . LYS A 1 69 ? 51.576 35.608 52.538 1.00 46.22 ? 68 LYS L CA 1 ATOM 570 C C . LYS A 1 69 ? 50.468 36.164 51.650 1.00 43.19 ? 68 LYS L C 1 ATOM 571 O O . LYS A 1 69 ? 50.711 36.533 50.504 1.00 42.79 ? 68 LYS L O 1 ATOM 572 C CB . LYS A 1 69 ? 51.573 34.082 52.399 1.00 45.76 ? 68 LYS L CB 1 ATOM 573 C CG . LYS A 1 69 ? 51.758 33.659 50.930 1.00 47.80 ? 68 LYS L CG 1 ATOM 574 C CD . LYS A 1 69 ? 51.404 32.204 50.640 1.00 49.36 ? 68 LYS L CD 1 ATOM 575 C CE . LYS A 1 69 ? 51.620 31.898 49.159 1.00 50.56 ? 68 LYS L CE 1 ATOM 576 N NZ . LYS A 1 69 ? 51.358 30.475 48.782 1.00 51.61 ? 68 LYS L NZ 1 ATOM 577 N N . SER A 1 70 ? 49.249 36.199 52.175 1.00 40.70 ? 69 SER L N 1 ATOM 578 C CA . SER A 1 70 ? 48.123 36.723 51.410 1.00 40.11 ? 69 SER L CA 1 ATOM 579 C C . SER A 1 70 ? 48.371 38.187 51.066 1.00 36.29 ? 69 SER L C 1 ATOM 580 O O . SER A 1 70 ? 48.244 38.595 49.912 1.00 36.96 ? 69 SER L O 1 ATOM 581 C CB . SER A 1 70 ? 46.825 36.584 52.211 1.00 39.75 ? 69 SER L CB 1 ATOM 582 O OG . SER A 1 70 ? 46.420 35.228 52.264 1.00 40.85 ? 69 SER L OG 1 ATOM 583 N N . VAL A 1 71 ? 48.739 38.962 52.080 1.00 35.18 ? 70 VAL L N 1 ATOM 584 C CA . VAL A 1 71 ? 49.014 40.379 51.918 1.00 36.12 ? 70 VAL L CA 1 ATOM 585 C C . VAL A 1 71 ? 50.143 40.622 50.927 1.00 37.34 ? 70 VAL L C 1 ATOM 586 O O . VAL A 1 71 ? 50.030 41.474 50.041 1.00 36.48 ? 70 VAL L O 1 ATOM 587 C CB . VAL A 1 71 ? 49.369 41.022 53.277 1.00 36.43 ? 70 VAL L CB 1 ATOM 588 C CG1 . VAL A 1 71 ? 49.903 42.427 53.082 1.00 35.01 ? 70 VAL L CG1 1 ATOM 589 C CG2 . VAL A 1 71 ? 48.136 41.060 54.159 1.00 35.44 ? 70 VAL L CG2 1 ATOM 590 N N . GLU A 1 72 ? 51.228 39.866 51.068 1.00 36.67 ? 71 GLU L N 1 ATOM 591 C CA . GLU A 1 72 ? 52.376 40.014 50.178 1.00 35.36 ? 71 GLU L CA 1 ATOM 592 C C . GLU A 1 72 ? 51.996 39.739 48.732 1.00 32.54 ? 71 GLU L C 1 ATOM 593 O O . GLU A 1 72 ? 52.484 40.404 47.818 1.00 32.30 ? 71 GLU L O 1 ATOM 594 C CB . GLU A 1 72 ? 53.514 39.086 50.631 1.00 40.11 ? 71 GLU L CB 1 ATOM 595 C CG . GLU A 1 72 ? 54.260 39.605 51.866 1.00 46.83 ? 71 GLU L CG 1 ATOM 596 C CD . GLU A 1 72 ? 54.945 38.507 52.672 1.00 53.93 ? 71 GLU L CD 1 ATOM 597 O OE1 . GLU A 1 72 ? 55.412 37.511 52.073 1.00 55.86 ? 71 GLU L OE1 1 ATOM 598 O OE2 . GLU A 1 72 ? 55.031 38.651 53.914 1.00 57.40 ? 71 GLU L OE2 1 ATOM 599 N N . THR A 1 73 ? 51.129 38.757 48.521 1.00 30.17 ? 72 THR L N 1 ATOM 600 C CA . THR A 1 73 ? 50.682 38.427 47.170 1.00 32.30 ? 72 THR L CA 1 ATOM 601 C C . THR A 1 73 ? 49.819 39.565 46.599 1.00 31.65 ? 72 THR L C 1 ATOM 602 O O . THR A 1 73 ? 49.966 39.939 45.438 1.00 32.72 ? 72 THR L O 1 ATOM 603 C CB . THR A 1 73 ? 49.873 37.108 47.168 1.00 34.11 ? 72 THR L CB 1 ATOM 604 O OG1 . THR A 1 73 ? 50.734 36.029 47.554 1.00 36.58 ? 72 THR L OG1 1 ATOM 605 C CG2 . THR A 1 73 ? 49.301 36.823 45.788 1.00 31.81 ? 72 THR L CG2 1 ATOM 606 N N . ILE A 1 74 ? 48.924 40.115 47.419 1.00 32.44 ? 73 ILE L N 1 ATOM 607 C CA . ILE A 1 74 ? 48.065 41.218 46.976 1.00 32.26 ? 73 ILE L CA 1 ATOM 608 C C . ILE A 1 74 ? 48.916 42.437 46.625 1.00 31.57 ? 73 ILE L C 1 ATOM 609 O O . ILE A 1 74 ? 48.745 43.041 45.565 1.00 31.63 ? 73 ILE L O 1 ATOM 610 C CB . ILE A 1 74 ? 47.047 41.628 48.071 1.00 32.64 ? 73 ILE L CB 1 ATOM 611 C CG1 . ILE A 1 74 ? 46.143 40.441 48.408 1.00 33.71 ? 73 ILE L CG1 1 ATOM 612 C CG2 . ILE A 1 74 ? 46.206 42.823 47.595 1.00 34.60 ? 73 ILE L CG2 1 ATOM 613 C CD1 . ILE A 1 74 ? 45.484 39.820 47.201 1.00 36.79 ? 73 ILE L CD1 1 ATOM 614 N N . LYS A 1 75 ? 49.835 42.796 47.515 1.00 31.43 ? 74 LYS L N 1 ATOM 615 C CA . LYS A 1 75 ? 50.706 43.939 47.268 1.00 33.15 ? 74 LYS L CA 1 ATOM 616 C C . LYS A 1 75 ? 51.482 43.754 45.972 1.00 32.38 ? 74 LYS L C 1 ATOM 617 O O . LYS A 1 75 ? 51.677 44.706 45.225 1.00 33.70 ? 74 LYS L O 1 ATOM 618 C CB . LYS A 1 75 ? 51.672 44.148 48.438 1.00 33.53 ? 74 LYS L CB 1 ATOM 619 C CG . LYS A 1 75 ? 50.978 44.628 49.705 1.00 40.70 ? 74 LYS L CG 1 ATOM 620 C CD . LYS A 1 75 ? 51.936 44.749 50.884 1.00 44.06 ? 74 LYS L CD 1 ATOM 621 C CE . LYS A 1 75 ? 52.938 45.870 50.689 1.00 48.64 ? 74 LYS L CE 1 ATOM 622 N NZ . LYS A 1 75 ? 53.902 45.921 51.832 1.00 53.27 ? 74 LYS L NZ 1 ATOM 623 N N . GLU A 1 76 ? 51.915 42.528 45.691 1.00 31.56 ? 75 GLU L N 1 ATOM 624 C CA . GLU A 1 76 ? 52.653 42.289 44.458 1.00 30.54 ? 75 GLU L CA 1 ATOM 625 C C . GLU A 1 76 ? 51.754 42.521 43.245 1.00 30.63 ? 75 GLU L C 1 ATOM 626 O O . GLU A 1 76 ? 52.203 43.077 42.243 1.00 29.55 ? 75 GLU L O 1 ATOM 627 C CB . GLU A 1 76 ? 53.231 40.867 44.432 1.00 31.98 ? 75 GLU L CB 1 ATOM 628 C CG . GLU A 1 76 ? 53.969 40.492 43.139 1.00 29.72 ? 75 GLU L CG 1 ATOM 629 C CD . GLU A 1 76 ? 55.017 41.515 42.717 1.00 34.00 ? 75 GLU L CD 1 ATOM 630 O OE1 . GLU A 1 76 ? 55.602 42.193 43.591 1.00 34.98 ? 75 GLU L OE1 1 ATOM 631 O OE2 . GLU A 1 76 ? 55.272 41.628 41.498 1.00 36.06 ? 75 GLU L OE2 1 ATOM 632 N N . ASP A 1 77 ? 50.491 42.102 43.320 1.00 31.87 ? 76 ASP L N 1 ATOM 633 C CA . ASP A 1 77 ? 49.589 42.329 42.189 1.00 32.80 ? 76 ASP L CA 1 ATOM 634 C C . ASP A 1 77 ? 49.434 43.832 41.959 1.00 31.11 ? 76 ASP L C 1 ATOM 635 O O . ASP A 1 77 ? 49.318 44.285 40.825 1.00 29.97 ? 76 ASP L O 1 ATOM 636 C CB . ASP A 1 77 ? 48.206 41.717 42.424 1.00 37.23 ? 76 ASP L CB 1 ATOM 637 C CG . ASP A 1 77 ? 47.279 41.912 41.222 1.00 42.98 ? 76 ASP L CG 1 ATOM 638 O OD1 . ASP A 1 77 ? 47.607 41.408 40.125 1.00 45.70 ? 76 ASP L OD1 1 ATOM 639 O OD2 . ASP A 1 77 ? 46.234 42.583 41.364 1.00 47.32 ? 76 ASP L OD2 1 ATOM 640 N N . MET A 1 78 ? 49.434 44.604 43.041 1.00 32.22 ? 77 MET L N 1 ATOM 641 C CA . MET A 1 78 ? 49.320 46.053 42.931 1.00 34.31 ? 77 MET L CA 1 ATOM 642 C C . MET A 1 78 ? 50.600 46.663 42.358 1.00 35.28 ? 77 MET L C 1 ATOM 643 O O . MET A 1 78 ? 50.543 47.608 41.564 1.00 32.97 ? 77 MET L O 1 ATOM 644 C CB . MET A 1 78 ? 48.984 46.667 44.294 1.00 35.73 ? 77 MET L CB 1 ATOM 645 C CG . MET A 1 78 ? 47.525 46.441 44.697 1.00 37.95 ? 77 MET L CG 1 ATOM 646 S SD . MET A 1 78 ? 47.088 47.176 46.275 1.00 41.75 ? 77 MET L SD 1 ATOM 647 C CE . MET A 1 78 ? 45.593 46.247 46.697 1.00 40.35 ? 77 MET L CE 1 ATOM 648 N N . ASN A 1 79 ? 51.754 46.122 42.742 1.00 35.54 ? 78 ASN L N 1 ATOM 649 C CA . ASN A 1 79 ? 53.011 46.633 42.203 1.00 36.58 ? 78 ASN L CA 1 ATOM 650 C C . ASN A 1 79 ? 53.021 46.437 40.696 1.00 34.26 ? 78 ASN L C 1 ATOM 651 O O . ASN A 1 79 ? 53.446 47.312 39.946 1.00 34.20 ? 78 ASN L O 1 ATOM 652 C CB . ASN A 1 79 ? 54.218 45.905 42.805 1.00 40.00 ? 78 ASN L CB 1 ATOM 653 C CG . ASN A 1 79 ? 54.405 46.204 44.275 1.00 45.85 ? 78 ASN L CG 1 ATOM 654 O OD1 . ASN A 1 79 ? 53.996 47.261 44.763 1.00 49.82 ? 78 ASN L OD1 1 ATOM 655 N ND2 . ASN A 1 79 ? 55.041 45.281 44.991 1.00 48.85 ? 78 ASN L ND2 1 ATOM 656 N N . VAL A 1 80 ? 52.543 45.280 40.255 1.00 33.72 ? 79 VAL L N 1 ATOM 657 C CA . VAL A 1 80 ? 52.505 44.968 38.834 1.00 34.00 ? 79 VAL L CA 1 ATOM 658 C C . VAL A 1 80 ? 51.485 45.801 38.047 1.00 34.41 ? 79 VAL L C 1 ATOM 659 O O . VAL A 1 80 ? 51.830 46.428 37.045 1.00 35.62 ? 79 VAL L O 1 ATOM 660 C CB . VAL A 1 80 ? 52.191 43.468 38.617 1.00 34.13 ? 79 VAL L CB 1 ATOM 661 C CG1 . VAL A 1 80 ? 51.970 43.182 37.132 1.00 33.31 ? 79 VAL L CG1 1 ATOM 662 C CG2 . VAL A 1 80 ? 53.339 42.613 39.165 1.00 35.45 ? 79 VAL L CG2 1 ATOM 663 N N . LYS A 1 81 ? 50.240 45.815 38.514 1.00 33.60 ? 80 LYS L N 1 ATOM 664 C CA . LYS A 1 81 ? 49.153 46.526 37.827 1.00 35.71 ? 80 LYS L CA 1 ATOM 665 C C . LYS A 1 81 ? 49.090 48.042 37.985 1.00 34.45 ? 80 LYS L C 1 ATOM 666 O O . LYS A 1 81 ? 48.838 48.754 37.018 1.00 35.72 ? 80 LYS L O 1 ATOM 667 C CB . LYS A 1 81 ? 47.798 45.944 38.255 1.00 35.24 ? 80 LYS L CB 1 ATOM 668 C CG . LYS A 1 81 ? 47.659 44.458 38.009 1.00 39.32 ? 80 LYS L CG 1 ATOM 669 C CD . LYS A 1 81 ? 47.901 44.135 36.549 1.00 43.26 ? 80 LYS L CD 1 ATOM 670 C CE . LYS A 1 81 ? 47.900 42.634 36.306 1.00 46.08 ? 80 LYS L CE 1 ATOM 671 N NZ . LYS A 1 81 ? 48.103 42.350 34.859 1.00 48.19 ? 80 LYS L NZ 1 ATOM 672 N N . PHE A 1 82 ? 49.302 48.537 39.197 1.00 33.57 ? 81 PHE L N 1 ATOM 673 C CA . PHE A 1 82 ? 49.231 49.973 39.442 1.00 33.04 ? 81 PHE L CA 1 ATOM 674 C C . PHE A 1 82 ? 50.559 50.700 39.252 1.00 34.63 ? 81 PHE L C 1 ATOM 675 O O . PHE A 1 82 ? 50.591 51.802 38.699 1.00 34.64 ? 81 PHE L O 1 ATOM 676 C CB . PHE A 1 82 ? 48.714 50.233 40.855 1.00 31.10 ? 81 PHE L CB 1 ATOM 677 C CG . PHE A 1 82 ? 48.398 51.677 41.130 1.00 31.57 ? 81 PHE L CG 1 ATOM 678 C CD1 . PHE A 1 82 ? 47.356 52.311 40.461 1.00 30.52 ? 81 PHE L CD1 1 ATOM 679 C CD2 . PHE A 1 82 ? 49.121 52.394 42.074 1.00 30.35 ? 81 PHE L CD2 1 ATOM 680 C CE1 . PHE A 1 82 ? 47.032 53.640 40.736 1.00 28.62 ? 81 PHE L CE1 1 ATOM 681 C CE2 . PHE A 1 82 ? 48.807 53.727 42.357 1.00 31.00 ? 81 PHE L CE2 1 ATOM 682 C CZ . PHE A 1 82 ? 47.759 54.348 41.687 1.00 28.77 ? 81 PHE L CZ 1 ATOM 683 N N . PHE A 1 83 ? 51.652 50.095 39.709 1.00 33.13 ? 82 PHE L N 1 ATOM 684 C CA . PHE A 1 83 ? 52.965 50.722 39.578 1.00 34.87 ? 82 PHE L CA 1 ATOM 685 C C . PHE A 1 83 ? 53.748 50.218 38.363 1.00 37.79 ? 82 PHE L C 1 ATOM 686 O O . PHE A 1 83 ? 54.890 50.628 38.132 1.00 36.67 ? 82 PHE L O 1 ATOM 687 C CB . PHE A 1 83 ? 53.780 50.495 40.853 1.00 32.92 ? 82 PHE L CB 1 ATOM 688 C CG . PHE A 1 83 ? 53.210 51.177 42.065 1.00 30.81 ? 82 PHE L CG 1 ATOM 689 C CD1 . PHE A 1 83 ? 53.135 52.566 42.126 1.00 31.07 ? 82 PHE L CD1 1 ATOM 690 C CD2 . PHE A 1 83 ? 52.728 50.434 43.138 1.00 30.72 ? 82 PHE L CD2 1 ATOM 691 C CE1 . PHE A 1 83 ? 52.586 53.205 43.236 1.00 30.91 ? 82 PHE L CE1 1 ATOM 692 C CE2 . PHE A 1 83 ? 52.176 51.063 44.257 1.00 30.72 ? 82 PHE L CE2 1 ATOM 693 C CZ . PHE A 1 83 ? 52.104 52.453 44.306 1.00 30.17 ? 82 PHE L CZ 1 ATOM 694 N N . ASN A 1 84 ? 53.128 49.330 37.591 1.00 39.55 ? 83 ASN L N 1 ATOM 695 C CA . ASN A 1 84 ? 53.756 48.771 36.401 1.00 42.85 ? 83 ASN L CA 1 ATOM 696 C C . ASN A 1 84 ? 55.111 48.129 36.713 1.00 42.54 ? 83 ASN L C 1 ATOM 697 O O . ASN A 1 84 ? 56.011 48.145 35.879 1.00 43.70 ? 83 ASN L O 1 ATOM 698 C CB . ASN A 1 84 ? 53.943 49.869 35.351 1.00 48.46 ? 83 ASN L CB 1 ATOM 699 C CG . ASN A 1 84 ? 54.318 49.317 33.986 1.00 54.52 ? 83 ASN L CG 1 ATOM 700 O OD1 . ASN A 1 84 ? 54.847 50.040 33.134 1.00 58.06 ? 83 ASN L OD1 1 ATOM 701 N ND2 . ASN A 1 84 ? 54.033 48.034 33.764 1.00 55.51 ? 83 ASN L ND2 1 ATOM 702 N N . SER A 1 85 ? 55.250 47.573 37.913 1.00 41.72 ? 84 SER L N 1 ATOM 703 C CA . SER A 1 85 ? 56.492 46.931 38.339 1.00 43.49 ? 84 SER L CA 1 ATOM 704 C C . SER A 1 85 ? 57.688 47.880 38.438 1.00 43.23 ? 84 SER L C 1 ATOM 705 O O . SER A 1 85 ? 58.833 47.436 38.493 1.00 42.89 ? 84 SER L O 1 ATOM 706 C CB . SER A 1 85 ? 56.851 45.771 37.395 1.00 44.69 ? 84 SER L CB 1 ATOM 707 O OG . SER A 1 85 ? 55.930 44.697 37.521 1.00 46.64 ? 84 SER L OG 1 ATOM 708 N N . ASN A 1 86 ? 57.430 49.183 38.460 1.00 42.05 ? 85 ASN L N 1 ATOM 709 C CA . ASN A 1 86 ? 58.509 50.161 38.568 1.00 39.28 ? 85 ASN L CA 1 ATOM 710 C C . ASN A 1 86 ? 58.771 50.477 40.039 1.00 39.97 ? 85 ASN L C 1 ATOM 711 O O . ASN A 1 86 ? 57.979 51.167 40.690 1.00 37.38 ? 85 ASN L O 1 ATOM 712 C CB . ASN A 1 86 ? 58.136 51.438 37.822 1.00 38.66 ? 85 ASN L CB 1 ATOM 713 C CG . ASN A 1 86 ? 59.249 52.464 37.833 1.00 35.88 ? 85 ASN L CG 1 ATOM 714 O OD1 . ASN A 1 86 ? 59.878 52.706 38.864 1.00 38.01 ? 85 ASN L OD1 1 ATOM 715 N ND2 . ASN A 1 86 ? 59.487 53.081 36.690 1.00 36.15 ? 85 ASN L ND2 1 ATOM 716 N N . LYS A 1 87 ? 59.888 49.971 40.558 1.00 40.04 ? 86 LYS L N 1 ATOM 717 C CA . LYS A 1 87 ? 60.256 50.174 41.956 1.00 40.59 ? 86 LYS L CA 1 ATOM 718 C C . LYS A 1 87 ? 60.433 51.640 42.366 1.00 40.10 ? 86 LYS L C 1 ATOM 719 O O . LYS A 1 87 ? 60.110 52.018 43.494 1.00 37.00 ? 86 LYS L O 1 ATOM 720 C CB . LYS A 1 87 ? 61.538 49.401 42.274 1.00 44.21 ? 86 LYS L CB 1 ATOM 721 C CG . LYS A 1 87 ? 62.089 49.661 43.669 1.00 48.42 ? 86 LYS L CG 1 ATOM 722 C CD . LYS A 1 87 ? 63.440 48.978 43.885 1.00 54.21 ? 86 LYS L CD 1 ATOM 723 C CE . LYS A 1 87 ? 64.482 49.420 42.846 1.00 56.64 ? 86 LYS L CE 1 ATOM 724 N NZ . LYS A 1 87 ? 64.754 50.895 42.855 1.00 59.64 ? 86 LYS L NZ 1 ATOM 725 N N . LYS A 1 88 ? 60.953 52.463 41.461 1.00 39.06 ? 87 LYS L N 1 ATOM 726 C CA . LYS A 1 88 ? 61.152 53.873 41.778 1.00 40.61 ? 87 LYS L CA 1 ATOM 727 C C . LYS A 1 88 ? 59.801 54.572 41.926 1.00 38.13 ? 87 LYS L C 1 ATOM 728 O O . LYS A 1 88 ? 59.617 55.416 42.803 1.00 36.82 ? 87 LYS L O 1 ATOM 729 C CB . LYS A 1 88 ? 61.971 54.555 40.678 1.00 43.36 ? 87 LYS L CB 1 ATOM 730 C CG . LYS A 1 88 ? 62.141 56.061 40.861 1.00 47.87 ? 87 LYS L CG 1 ATOM 731 C CD . LYS A 1 88 ? 62.795 56.396 42.194 1.00 52.28 ? 87 LYS L CD 1 ATOM 732 C CE . LYS A 1 88 ? 63.094 57.889 42.306 1.00 54.67 ? 87 LYS L CE 1 ATOM 733 N NZ . LYS A 1 88 ? 63.702 58.249 43.625 1.00 55.41 ? 87 LYS L NZ 1 ATOM 734 N N . LYS A 1 89 ? 58.862 54.204 41.061 1.00 36.34 ? 88 LYS L N 1 ATOM 735 C CA . LYS A 1 89 ? 57.526 54.781 41.082 1.00 36.04 ? 88 LYS L CA 1 ATOM 736 C C . LYS A 1 89 ? 56.854 54.432 42.404 1.00 34.86 ? 88 LYS L C 1 ATOM 737 O O . LYS A 1 89 ? 56.243 55.287 43.043 1.00 32.88 ? 88 LYS L O 1 ATOM 738 C CB . LYS A 1 89 ? 56.709 54.245 39.906 1.00 35.53 ? 88 LYS L CB 1 ATOM 739 C CG . LYS A 1 89 ? 55.445 55.043 39.610 1.00 38.19 ? 88 LYS L CG 1 ATOM 740 C CD . LYS A 1 89 ? 54.597 54.379 38.529 1.00 37.17 ? 88 LYS L CD 1 ATOM 741 C CE . LYS A 1 89 ? 55.369 54.224 37.223 1.00 38.00 ? 88 LYS L CE 1 ATOM 742 N NZ . LYS A 1 89 ? 54.487 53.746 36.123 1.00 35.73 ? 88 LYS L NZ 1 ATOM 743 N N . ARG A 1 90 ? 56.997 53.182 42.833 1.00 34.68 ? 89 ARG L N 1 ATOM 744 C CA . ARG A 1 90 ? 56.397 52.745 44.090 1.00 35.72 ? 89 ARG L CA 1 ATOM 745 C C . ARG A 1 90 ? 57.050 53.427 45.289 1.00 35.81 ? 89 ARG L C 1 ATOM 746 O O . ARG A 1 90 ? 56.369 53.795 46.256 1.00 35.28 ? 89 ARG L O 1 ATOM 747 C CB . ARG A 1 90 ? 56.525 51.228 44.254 1.00 37.25 ? 89 ARG L CB 1 ATOM 748 C CG . ARG A 1 90 ? 55.701 50.664 45.407 1.00 42.79 ? 89 ARG L CG 1 ATOM 749 C CD . ARG A 1 90 ? 56.369 49.447 46.018 1.00 45.97 ? 89 ARG L CD 1 ATOM 750 N NE . ARG A 1 90 ? 56.981 48.606 44.997 1.00 53.08 ? 89 ARG L NE 1 ATOM 751 C CZ . ARG A 1 90 ? 58.062 47.858 45.198 1.00 54.87 ? 89 ARG L CZ 1 ATOM 752 N NH1 . ARG A 1 90 ? 58.647 47.846 46.390 1.00 55.74 ? 89 ARG L NH1 1 ATOM 753 N NH2 . ARG A 1 90 ? 58.568 47.140 44.203 1.00 53.49 ? 89 ARG L NH2 1 ATOM 754 N N . ASP A 1 91 ? 58.372 53.582 45.240 1.00 34.45 ? 90 ASP L N 1 ATOM 755 C CA . ASP A 1 91 ? 59.086 54.225 46.343 1.00 35.12 ? 90 ASP L CA 1 ATOM 756 C C . ASP A 1 91 ? 58.709 55.700 46.482 1.00 30.41 ? 90 ASP L C 1 ATOM 757 O O . ASP A 1 91 ? 58.541 56.192 47.588 1.00 30.80 ? 90 ASP L O 1 ATOM 758 C CB . ASP A 1 91 ? 60.605 54.095 46.166 1.00 39.28 ? 90 ASP L CB 1 ATOM 759 C CG . ASP A 1 91 ? 61.084 52.656 46.281 1.00 45.88 ? 90 ASP L CG 1 ATOM 760 O OD1 . ASP A 1 91 ? 60.523 51.901 47.111 1.00 47.58 ? 90 ASP L OD1 1 ATOM 761 O OD2 . ASP A 1 91 ? 62.029 52.285 45.549 1.00 49.98 ? 90 ASP L OD2 1 ATOM 762 N N . ASP A 1 92 ? 58.602 56.408 45.364 1.00 29.32 ? 91 ASP L N 1 ATOM 763 C CA . ASP A 1 92 ? 58.206 57.808 45.419 1.00 30.46 ? 91 ASP L CA 1 ATOM 764 C C . ASP A 1 92 ? 56.787 57.890 46.003 1.00 30.77 ? 91 ASP L C 1 ATOM 765 O O . ASP A 1 92 ? 56.515 58.704 46.881 1.00 31.70 ? 91 ASP L O 1 ATOM 766 C CB . ASP A 1 92 ? 58.243 58.427 44.021 1.00 30.43 ? 91 ASP L CB 1 ATOM 767 C CG . ASP A 1 92 ? 59.641 58.916 43.629 1.00 33.84 ? 91 ASP L CG 1 ATOM 768 O OD1 . ASP A 1 92 ? 60.576 58.796 44.453 1.00 32.97 ? 91 ASP L OD1 1 ATOM 769 O OD2 . ASP A 1 92 ? 59.796 59.425 42.498 1.00 32.94 ? 91 ASP L OD2 1 ATOM 770 N N . PHE A 1 93 ? 55.897 57.021 45.527 1.00 29.39 ? 92 PHE L N 1 ATOM 771 C CA . PHE A 1 93 ? 54.516 56.997 46.010 1.00 30.23 ? 92 PHE L CA 1 ATOM 772 C C . PHE A 1 93 ? 54.519 56.824 47.519 1.00 29.96 ? 92 PHE L C 1 ATOM 773 O O . PHE A 1 93 ? 53.907 57.608 48.241 1.00 30.18 ? 92 PHE L O 1 ATOM 774 C CB . PHE A 1 93 ? 53.745 55.837 45.360 1.00 27.52 ? 92 PHE L CB 1 ATOM 775 C CG . PHE A 1 93 ? 52.323 55.689 45.843 1.00 28.30 ? 92 PHE L CG 1 ATOM 776 C CD1 . PHE A 1 93 ? 51.277 56.351 45.197 1.00 28.21 ? 92 PHE L CD1 1 ATOM 777 C CD2 . PHE A 1 93 ? 52.025 54.847 46.908 1.00 27.45 ? 92 PHE L CD2 1 ATOM 778 C CE1 . PHE A 1 93 ? 49.941 56.166 45.604 1.00 28.49 ? 92 PHE L CE1 1 ATOM 779 C CE2 . PHE A 1 93 ? 50.703 54.653 47.324 1.00 29.84 ? 92 PHE L CE2 1 ATOM 780 C CZ . PHE A 1 93 ? 49.655 55.318 46.664 1.00 28.85 ? 92 PHE L CZ 1 ATOM 781 N N . GLU A 1 94 ? 55.224 55.803 47.996 1.00 31.37 ? 93 GLU L N 1 ATOM 782 C CA . GLU A 1 94 ? 55.280 55.537 49.429 1.00 34.94 ? 93 GLU L CA 1 ATOM 783 C C . GLU A 1 94 ? 55.900 56.686 50.216 1.00 34.88 ? 93 GLU L C 1 ATOM 784 O O . GLU A 1 94 ? 55.518 56.941 51.356 1.00 34.00 ? 93 GLU L O 1 ATOM 785 C CB . GLU A 1 94 ? 56.027 54.227 49.697 1.00 39.51 ? 93 GLU L CB 1 ATOM 786 C CG . GLU A 1 94 ? 55.326 53.021 49.073 1.00 47.25 ? 93 GLU L CG 1 ATOM 787 C CD . GLU A 1 94 ? 56.000 51.696 49.398 1.00 52.65 ? 93 GLU L CD 1 ATOM 788 O OE1 . GLU A 1 94 ? 57.238 51.594 49.242 1.00 54.49 ? 93 GLU L OE1 1 ATOM 789 O OE2 . GLU A 1 94 ? 55.288 50.750 49.797 1.00 56.35 ? 93 GLU L OE2 1 ATOM 790 N N . LYS A 1 95 ? 56.854 57.385 49.610 1.00 35.18 ? 94 LYS L N 1 ATOM 791 C CA . LYS A 1 95 ? 57.474 58.527 50.277 1.00 36.14 ? 94 LYS L CA 1 ATOM 792 C C . LYS A 1 95 ? 56.378 59.592 50.498 1.00 32.85 ? 94 LYS L C 1 ATOM 793 O O . LYS A 1 95 ? 56.218 60.127 51.592 1.00 31.38 ? 94 LYS L O 1 ATOM 794 C CB . LYS A 1 95 ? 58.589 59.101 49.397 1.00 39.92 ? 94 LYS L CB 1 ATOM 795 C CG . LYS A 1 95 ? 59.548 60.023 50.126 1.00 46.80 ? 94 LYS L CG 1 ATOM 796 C CD . LYS A 1 95 ? 60.561 60.665 49.173 1.00 49.66 ? 94 LYS L CD 1 ATOM 797 C CE . LYS A 1 95 ? 61.312 59.624 48.356 1.00 52.96 ? 94 LYS L CE 1 ATOM 798 N NZ . LYS A 1 95 ? 62.067 58.666 49.216 1.00 56.76 ? 94 LYS L NZ 1 ATOM 799 N N . LEU A 1 96 ? 55.613 59.886 49.454 1.00 30.94 ? 95 LEU L N 1 ATOM 800 C CA . LEU A 1 96 ? 54.545 60.879 49.575 1.00 31.73 ? 95 LEU L CA 1 ATOM 801 C C . LEU A 1 96 ? 53.550 60.525 50.678 1.00 33.54 ? 95 LEU L C 1 ATOM 802 O O . LEU A 1 96 ? 53.222 61.366 51.510 1.00 34.64 ? 95 LEU L O 1 ATOM 803 C CB . LEU A 1 96 ? 53.799 61.024 48.251 1.00 26.77 ? 95 LEU L CB 1 ATOM 804 C CG . LEU A 1 96 ? 54.621 61.546 47.075 1.00 29.82 ? 95 LEU L CG 1 ATOM 805 C CD1 . LEU A 1 96 ? 53.777 61.524 45.810 1.00 23.59 ? 95 LEU L CD1 1 ATOM 806 C CD2 . LEU A 1 96 ? 55.109 62.976 47.380 1.00 25.81 ? 95 LEU L CD2 1 ATOM 807 N N . THR A 1 97 ? 53.087 59.277 50.698 1.00 34.73 ? 96 THR L N 1 ATOM 808 C CA . THR A 1 97 ? 52.105 58.851 51.694 1.00 36.10 ? 96 THR L CA 1 ATOM 809 C C . THR A 1 97 ? 52.596 58.865 53.133 1.00 39.36 ? 96 THR L C 1 ATOM 810 O O . THR A 1 97 ? 51.786 58.887 54.058 1.00 41.22 ? 96 THR L O 1 ATOM 811 C CB . THR A 1 97 ? 51.556 57.424 51.400 1.00 35.44 ? 96 THR L CB 1 ATOM 812 O OG1 . THR A 1 97 ? 52.615 56.463 51.505 1.00 36.15 ? 96 THR L OG1 1 ATOM 813 C CG2 . THR A 1 97 ? 50.957 57.356 50.010 1.00 31.54 ? 96 THR L CG2 1 ATOM 814 N N . ASN A 1 98 ? 53.909 58.846 53.333 1.00 41.46 ? 97 ASN L N 1 ATOM 815 C CA . ASN A 1 98 ? 54.450 58.845 54.688 1.00 42.87 ? 97 ASN L CA 1 ATOM 816 C C . ASN A 1 98 ? 54.756 60.219 55.277 1.00 43.86 ? 97 ASN L C 1 ATOM 817 O O . ASN A 1 98 ? 55.044 60.327 56.465 1.00 43.70 ? 97 ASN L O 1 ATOM 818 C CB . ASN A 1 98 ? 55.701 57.967 54.762 1.00 44.86 ? 97 ASN L CB 1 ATOM 819 C CG . ASN A 1 98 ? 55.368 56.489 54.791 1.00 48.38 ? 97 ASN L CG 1 ATOM 820 O OD1 . ASN A 1 98 ? 54.565 56.043 55.611 1.00 51.11 ? 97 ASN L OD1 1 ATOM 821 N ND2 . ASN A 1 98 ? 55.986 55.720 53.900 1.00 48.11 ? 97 ASN L ND2 1 ATOM 822 N N . TYR A 1 99 ? 54.700 61.270 54.467 1.00 43.37 ? 98 TYR L N 1 ATOM 823 C CA . TYR A 1 99 ? 54.967 62.601 55.000 1.00 44.39 ? 98 TYR L CA 1 ATOM 824 C C . TYR A 1 99 ? 53.941 62.925 56.076 1.00 45.55 ? 98 TYR L C 1 ATOM 825 O O . TYR A 1 99 ? 52.748 62.700 55.893 1.00 45.76 ? 98 TYR L O 1 ATOM 826 C CB . TYR A 1 99 ? 54.883 63.667 53.907 1.00 41.91 ? 98 TYR L CB 1 ATOM 827 C CG . TYR A 1 99 ? 55.983 63.615 52.876 1.00 39.46 ? 98 TYR L CG 1 ATOM 828 C CD1 . TYR A 1 99 ? 57.301 63.319 53.238 1.00 38.73 ? 98 TYR L CD1 1 ATOM 829 C CD2 . TYR A 1 99 ? 55.720 63.933 51.548 1.00 36.70 ? 98 TYR L CD2 1 ATOM 830 C CE1 . TYR A 1 99 ? 58.335 63.346 52.293 1.00 36.25 ? 98 TYR L CE1 1 ATOM 831 C CE2 . TYR A 1 99 ? 56.738 63.967 50.602 1.00 39.56 ? 98 TYR L CE2 1 ATOM 832 C CZ . TYR A 1 99 ? 58.043 63.675 50.980 1.00 38.66 ? 98 TYR L CZ 1 ATOM 833 O OH . TYR A 1 99 ? 59.044 63.742 50.039 1.00 38.90 ? 98 TYR L OH 1 ATOM 834 N N . SER A 1 100 ? 54.410 63.465 57.193 1.00 47.87 ? 99 SER L N 1 ATOM 835 C CA . SER A 1 100 ? 53.531 63.821 58.300 1.00 50.04 ? 99 SER L CA 1 ATOM 836 C C . SER A 1 100 ? 53.066 65.272 58.247 1.00 48.82 ? 99 SER L C 1 ATOM 837 O O . SER A 1 100 ? 53.884 66.189 58.188 1.00 48.95 ? 99 SER L O 1 ATOM 838 C CB . SER A 1 100 ? 54.246 63.577 59.630 1.00 51.58 ? 99 SER L CB 1 ATOM 839 O OG . SER A 1 100 ? 53.511 64.145 60.699 1.00 57.14 ? 99 SER L OG 1 ATOM 840 N N . VAL A 1 101 ? 51.753 65.477 58.282 1.00 48.67 ? 100 VAL L N 1 ATOM 841 C CA . VAL A 1 101 ? 51.188 66.822 58.252 1.00 49.31 ? 100 VAL L CA 1 ATOM 842 C C . VAL A 1 101 ? 51.339 67.569 59.577 1.00 49.94 ? 100 VAL L C 1 ATOM 843 O O . VAL A 1 101 ? 51.156 68.785 59.623 1.00 50.46 ? 100 VAL L O 1 ATOM 844 C CB . VAL A 1 101 ? 49.683 66.805 57.900 1.00 50.87 ? 100 VAL L CB 1 ATOM 845 C CG1 . VAL A 1 101 ? 49.487 66.392 56.454 1.00 50.32 ? 100 VAL L CG1 1 ATOM 846 C CG2 . VAL A 1 101 ? 48.943 65.859 58.839 1.00 50.87 ? 100 VAL L CG2 1 ATOM 847 N N . THR A 1 102 ? 51.661 66.855 60.653 1.00 50.08 ? 101 THR L N 1 ATOM 848 C CA . THR A 1 102 ? 51.817 67.506 61.953 1.00 52.19 ? 101 THR L CA 1 ATOM 849 C C . THR A 1 102 ? 53.258 67.922 62.231 1.00 53.50 ? 101 THR L C 1 ATOM 850 O O . THR A 1 102 ? 53.519 68.675 63.170 1.00 54.77 ? 101 THR L O 1 ATOM 851 C CB . THR A 1 102 ? 51.331 66.602 63.117 1.00 52.46 ? 101 THR L CB 1 ATOM 852 O OG1 . THR A 1 102 ? 52.087 65.385 63.136 1.00 52.92 ? 101 THR L OG1 1 ATOM 853 C CG2 . THR A 1 102 ? 49.851 66.279 62.957 1.00 50.74 ? 101 THR L CG2 1 ATOM 854 N N . ASP A 1 103 ? 54.194 67.430 61.423 1.00 53.60 ? 102 ASP L N 1 ATOM 855 C CA . ASP A 1 103 ? 55.599 67.787 61.594 1.00 53.57 ? 102 ASP L CA 1 ATOM 856 C C . ASP A 1 103 ? 55.803 69.227 61.126 1.00 53.01 ? 102 ASP L C 1 ATOM 857 O O . ASP A 1 103 ? 55.659 69.537 59.940 1.00 52.52 ? 102 ASP L O 1 ATOM 858 C CB . ASP A 1 103 ? 56.490 66.850 60.782 1.00 55.61 ? 102 ASP L CB 1 ATOM 859 C CG . ASP A 1 103 ? 57.957 67.205 60.893 1.00 58.14 ? 102 ASP L CG 1 ATOM 860 O OD1 . ASP A 1 103 ? 58.302 68.390 60.699 1.00 59.59 ? 102 ASP L OD1 1 ATOM 861 O OD2 . ASP A 1 103 ? 58.770 66.298 61.165 1.00 60.79 ? 102 ASP L OD2 1 ATOM 862 N N . LEU A 1 104 ? 56.147 70.097 62.069 1.00 52.24 ? 103 LEU L N 1 ATOM 863 C CA . LEU A 1 104 ? 56.358 71.518 61.802 1.00 50.88 ? 103 LEU L CA 1 ATOM 864 C C . LEU A 1 104 ? 57.304 71.806 60.637 1.00 47.92 ? 103 LEU L C 1 ATOM 865 O O . LEU A 1 104 ? 57.066 72.721 59.856 1.00 46.53 ? 103 LEU L O 1 ATOM 866 C CB . LEU A 1 104 ? 56.873 72.200 63.071 1.00 54.59 ? 103 LEU L CB 1 ATOM 867 C CG . LEU A 1 104 ? 56.722 73.720 63.187 1.00 58.16 ? 103 LEU L CG 1 ATOM 868 C CD1 . LEU A 1 104 ? 56.934 74.120 64.642 1.00 59.99 ? 103 LEU L CD1 1 ATOM 869 C CD2 . LEU A 1 104 ? 57.710 74.440 62.273 1.00 59.46 ? 103 LEU L CD2 1 ATOM 870 N N . ASN A 1 105 ? 58.378 71.031 60.525 1.00 46.31 ? 104 ASN L N 1 ATOM 871 C CA . ASN A 1 105 ? 59.343 71.226 59.450 1.00 44.61 ? 104 ASN L CA 1 ATOM 872 C C . ASN A 1 105 ? 58.745 70.822 58.100 1.00 42.84 ? 104 ASN L C 1 ATOM 873 O O . ASN A 1 105 ? 58.936 71.508 57.091 1.00 40.34 ? 104 ASN L O 1 ATOM 874 C CB . ASN A 1 105 ? 60.614 70.420 59.738 1.00 47.69 ? 104 ASN L CB 1 ATOM 875 C CG . ASN A 1 105 ? 61.383 70.952 60.949 1.00 53.31 ? 104 ASN L CG 1 ATOM 876 O OD1 . ASN A 1 105 ? 61.939 72.054 60.913 1.00 53.64 ? 104 ASN L OD1 1 ATOM 877 N ND2 . ASN A 1 105 ? 61.409 70.170 62.028 1.00 55.12 ? 104 ASN L ND2 1 ATOM 878 N N . VAL A 1 106 ? 58.020 69.707 58.084 1.00 39.84 ? 105 VAL L N 1 ATOM 879 C CA . VAL A 1 106 ? 57.386 69.241 56.855 1.00 37.92 ? 105 VAL L CA 1 ATOM 880 C C . VAL A 1 106 ? 56.397 70.301 56.388 1.00 36.88 ? 105 VAL L C 1 ATOM 881 O O . VAL A 1 106 ? 56.325 70.620 55.206 1.00 35.42 ? 105 VAL L O 1 ATOM 882 C CB . VAL A 1 106 ? 56.634 67.912 57.082 1.00 38.55 ? 105 VAL L CB 1 ATOM 883 C CG1 . VAL A 1 106 ? 55.740 67.599 55.879 1.00 37.88 ? 105 VAL L CG1 1 ATOM 884 C CG2 . VAL A 1 106 ? 57.635 66.788 57.298 1.00 36.61 ? 105 VAL L CG2 1 ATOM 885 N N . GLN A 1 107 ? 55.645 70.849 57.335 1.00 37.55 ? 106 GLN L N 1 ATOM 886 C CA . GLN A 1 107 ? 54.659 71.883 57.042 1.00 38.95 ? 106 GLN L CA 1 ATOM 887 C C . GLN A 1 107 ? 55.272 73.079 56.318 1.00 38.38 ? 106 GLN L C 1 ATOM 888 O O . GLN A 1 107 ? 54.724 73.566 55.326 1.00 36.79 ? 106 GLN L O 1 ATOM 889 C CB . GLN A 1 107 ? 54.009 72.369 58.336 1.00 40.76 ? 106 GLN L CB 1 ATOM 890 C CG . GLN A 1 107 ? 52.987 71.422 58.928 1.00 45.47 ? 106 GLN L CG 1 ATOM 891 C CD . GLN A 1 107 ? 52.494 71.891 60.288 1.00 49.32 ? 106 GLN L CD 1 ATOM 892 O OE1 . GLN A 1 107 ? 52.523 73.086 60.595 1.00 49.61 ? 106 GLN L OE1 1 ATOM 893 N NE2 . GLN A 1 107 ? 52.027 70.951 61.105 1.00 51.15 ? 106 GLN L NE2 1 ATOM 894 N N . ARG A 1 108 ? 56.405 73.557 56.821 1.00 38.20 ? 107 ARG L N 1 ATOM 895 C CA . ARG A 1 108 ? 57.073 74.703 56.213 1.00 38.77 ? 107 ARG L CA 1 ATOM 896 C C . ARG A 1 108 ? 57.532 74.417 54.793 1.00 35.27 ? 107 ARG L C 1 ATOM 897 O O . ARG A 1 108 ? 57.399 75.263 53.914 1.00 34.63 ? 107 ARG L O 1 ATOM 898 C CB . ARG A 1 108 ? 58.266 75.146 57.068 1.00 41.94 ? 107 ARG L CB 1 ATOM 899 C CG . ARG A 1 108 ? 57.860 75.745 58.403 1.00 47.86 ? 107 ARG L CG 1 ATOM 900 C CD . ARG A 1 108 ? 59.030 76.427 59.104 1.00 52.65 ? 107 ARG L CD 1 ATOM 901 N NE . ARG A 1 108 ? 58.607 77.047 60.358 1.00 59.98 ? 107 ARG L NE 1 ATOM 902 C CZ . ARG A 1 108 ? 59.389 77.796 61.132 1.00 63.70 ? 107 ARG L CZ 1 ATOM 903 N NH1 . ARG A 1 108 ? 60.651 78.028 60.786 1.00 65.37 ? 107 ARG L NH1 1 ATOM 904 N NH2 . ARG A 1 108 ? 58.908 78.318 62.254 1.00 64.48 ? 107 ARG L NH2 1 ATOM 905 N N . LYS A 1 109 ? 58.077 73.227 54.569 1.00 34.32 ? 108 LYS L N 1 ATOM 906 C CA . LYS A 1 109 ? 58.536 72.852 53.238 1.00 33.34 ? 108 LYS L CA 1 ATOM 907 C C . LYS A 1 109 ? 57.344 72.734 52.299 1.00 31.45 ? 108 LYS L C 1 ATOM 908 O O . LYS A 1 109 ? 57.409 73.162 51.148 1.00 31.56 ? 108 LYS L O 1 ATOM 909 C CB . LYS A 1 109 ? 59.307 71.524 53.286 1.00 33.75 ? 108 LYS L CB 1 ATOM 910 C CG . LYS A 1 109 ? 60.599 71.610 54.105 1.00 38.66 ? 108 LYS L CG 1 ATOM 911 C CD . LYS A 1 109 ? 61.348 70.281 54.200 1.00 39.56 ? 108 LYS L CD 1 ATOM 912 C CE . LYS A 1 109 ? 61.911 69.848 52.853 1.00 43.55 ? 108 LYS L CE 1 ATOM 913 N NZ . LYS A 1 109 ? 62.804 70.883 52.245 1.00 47.33 ? 108 LYS L NZ 1 ATOM 914 N N . ALA A 1 110 ? 56.247 72.168 52.791 1.00 30.02 ? 109 ALA L N 1 ATOM 915 C CA . ALA A 1 110 ? 55.061 72.019 51.954 1.00 30.47 ? 109 ALA L CA 1 ATOM 916 C C . ALA A 1 110 ? 54.553 73.398 51.539 1.00 29.02 ? 109 ALA L C 1 ATOM 917 O O . ALA A 1 110 ? 54.290 73.646 50.364 1.00 30.00 ? 109 ALA L O 1 ATOM 918 C CB . ALA A 1 110 ? 53.963 71.249 52.707 1.00 27.16 ? 109 ALA L CB 1 ATOM 919 N N . ILE A 1 111 ? 54.418 74.298 52.506 1.00 29.88 ? 110 ILE L N 1 ATOM 920 C CA . ILE A 1 111 ? 53.941 75.639 52.204 1.00 30.48 ? 110 ILE L CA 1 ATOM 921 C C . ILE A 1 111 ? 54.906 76.343 51.262 1.00 31.48 ? 110 ILE L C 1 ATOM 922 O O . ILE A 1 111 ? 54.490 77.041 50.340 1.00 30.36 ? 110 ILE L O 1 ATOM 923 C CB . ILE A 1 111 ? 53.784 76.485 53.487 1.00 32.94 ? 110 ILE L CB 1 ATOM 924 C CG1 . ILE A 1 111 ? 52.700 75.871 54.379 1.00 33.41 ? 110 ILE L CG1 1 ATOM 925 C CG2 . ILE A 1 111 ? 53.436 77.931 53.127 1.00 30.74 ? 110 ILE L CG2 1 ATOM 926 C CD1 . ILE A 1 111 ? 51.354 75.710 53.689 1.00 36.72 ? 110 ILE L CD1 1 ATOM 927 N N . HIS A 1 112 ? 56.201 76.142 51.475 1.00 31.86 ? 111 HIS L N 1 ATOM 928 C CA . HIS A 1 112 ? 57.180 76.791 50.619 1.00 34.80 ? 111 HIS L CA 1 ATOM 929 C C . HIS A 1 112 ? 57.109 76.308 49.169 1.00 33.52 ? 111 HIS L C 1 ATOM 930 O O . HIS A 1 112 ? 57.312 77.090 48.238 1.00 33.02 ? 111 HIS L O 1 ATOM 931 C CB . HIS A 1 112 ? 58.597 76.568 51.149 1.00 36.43 ? 111 HIS L CB 1 ATOM 932 C CG . HIS A 1 112 ? 59.608 77.483 50.531 1.00 41.25 ? 111 HIS L CG 1 ATOM 933 N ND1 . HIS A 1 112 ? 60.157 78.550 51.209 1.00 40.27 ? 111 HIS L ND1 1 ATOM 934 C CD2 . HIS A 1 112 ? 60.110 77.537 49.273 1.00 42.10 ? 111 HIS L CD2 1 ATOM 935 C CE1 . HIS A 1 112 ? 60.951 79.223 50.395 1.00 43.79 ? 111 HIS L CE1 1 ATOM 936 N NE2 . HIS A 1 112 ? 60.940 78.630 49.214 1.00 44.17 ? 111 HIS L NE2 1 ATOM 937 N N . GLU A 1 113 ? 56.813 75.025 48.976 1.00 30.93 ? 112 GLU L N 1 ATOM 938 C CA . GLU A 1 113 ? 56.750 74.450 47.631 1.00 30.15 ? 112 GLU L CA 1 ATOM 939 C C . GLU A 1 113 ? 55.381 74.554 46.955 1.00 29.39 ? 112 GLU L C 1 ATOM 940 O O . GLU A 1 113 ? 55.206 74.115 45.821 1.00 28.52 ? 112 GLU L O 1 ATOM 941 C CB . GLU A 1 113 ? 57.157 72.976 47.693 1.00 32.76 ? 112 GLU L CB 1 ATOM 942 C CG . GLU A 1 113 ? 58.612 72.728 48.084 1.00 31.94 ? 112 GLU L CG 1 ATOM 943 C CD . GLU A 1 113 ? 58.910 71.251 48.285 1.00 33.33 ? 112 GLU L CD 1 ATOM 944 O OE1 . GLU A 1 113 ? 58.343 70.417 47.540 1.00 32.30 ? 112 GLU L OE1 1 ATOM 945 O OE2 . GLU A 1 113 ? 59.713 70.925 49.184 1.00 30.09 ? 112 GLU L OE2 1 ATOM 946 N N . LEU A 1 114 ? 54.421 75.143 47.651 1.00 30.48 ? 113 LEU L N 1 ATOM 947 C CA . LEU A 1 114 ? 53.053 75.260 47.147 1.00 32.43 ? 113 LEU L CA 1 ATOM 948 C C . LEU A 1 114 ? 52.905 75.850 45.747 1.00 31.74 ? 113 LEU L C 1 ATOM 949 O O . LEU A 1 114 ? 52.207 75.278 44.901 1.00 30.04 ? 113 LEU L O 1 ATOM 950 C CB . LEU A 1 114 ? 52.219 76.054 48.156 1.00 32.37 ? 113 LEU L CB 1 ATOM 951 C CG . LEU A 1 114 ? 50.706 76.170 47.985 1.00 37.85 ? 113 LEU L CG 1 ATOM 952 C CD1 . LEU A 1 114 ? 50.064 74.788 47.809 1.00 35.67 ? 113 LEU L CD1 1 ATOM 953 C CD2 . LEU A 1 114 ? 50.149 76.872 49.222 1.00 37.96 ? 113 LEU L CD2 1 ATOM 954 N N . ILE A 1 115 ? 53.559 76.979 45.489 1.00 30.63 ? 114 ILE L N 1 ATOM 955 C CA . ILE A 1 115 ? 53.463 77.607 44.174 1.00 32.18 ? 114 ILE L CA 1 ATOM 956 C C . ILE A 1 115 ? 54.010 76.712 43.071 1.00 31.17 ? 114 ILE L C 1 ATOM 957 O O . ILE A 1 115 ? 53.466 76.683 41.970 1.00 32.30 ? 114 ILE L O 1 ATOM 958 C CB . ILE A 1 115 ? 54.230 78.958 44.100 1.00 35.86 ? 114 ILE L CB 1 ATOM 959 C CG1 . ILE A 1 115 ? 53.667 79.947 45.119 1.00 39.96 ? 114 ILE L CG1 1 ATOM 960 C CG2 . ILE A 1 115 ? 54.080 79.561 42.708 1.00 37.88 ? 114 ILE L CG2 1 ATOM 961 C CD1 . ILE A 1 115 ? 54.346 81.317 45.105 1.00 41.70 ? 114 ILE L CD1 1 ATOM 962 N N . GLN A 1 116 ? 55.092 75.992 43.350 1.00 28.34 ? 115 GLN L N 1 ATOM 963 C CA . GLN A 1 116 ? 55.657 75.125 42.328 1.00 28.19 ? 115 GLN L CA 1 ATOM 964 C C . GLN A 1 116 ? 54.724 73.942 42.079 1.00 25.87 ? 115 GLN L C 1 ATOM 965 O O . GLN A 1 116 ? 54.586 73.487 40.950 1.00 23.71 ? 115 GLN L O 1 ATOM 966 C CB . GLN A 1 116 ? 57.043 74.616 42.731 1.00 27.87 ? 115 GLN L CB 1 ATOM 967 C CG . GLN A 1 116 ? 57.686 73.829 41.610 1.00 33.20 ? 115 GLN L CG 1 ATOM 968 C CD . GLN A 1 116 ? 59.109 74.248 41.349 1.00 39.04 ? 115 GLN L CD 1 ATOM 969 O OE1 . GLN A 1 116 ? 59.478 75.411 41.541 1.00 44.40 ? 115 GLN L OE1 1 ATOM 970 N NE2 . GLN A 1 116 ? 59.920 73.306 40.885 1.00 36.79 ? 115 GLN L NE2 1 ATOM 971 N N . VAL A 1 117 ? 54.094 73.441 43.134 1.00 26.25 ? 116 VAL L N 1 ATOM 972 C CA . VAL A 1 117 ? 53.151 72.338 42.978 1.00 27.47 ? 116 VAL L CA 1 ATOM 973 C C . VAL A 1 117 ? 51.989 72.819 42.104 1.00 29.32 ? 116 VAL L C 1 ATOM 974 O O . VAL A 1 117 ? 51.596 72.152 41.144 1.00 30.96 ? 116 VAL L O 1 ATOM 975 C CB . VAL A 1 117 ? 52.618 71.861 44.350 1.00 27.65 ? 116 VAL L CB 1 ATOM 976 C CG1 . VAL A 1 117 ? 51.419 70.914 44.160 1.00 24.23 ? 116 VAL L CG1 1 ATOM 977 C CG2 . VAL A 1 117 ? 53.733 71.145 45.108 1.00 27.52 ? 116 VAL L CG2 1 ATOM 978 N N . MET A 1 118 ? 51.454 73.993 42.421 1.00 30.72 ? 117 MET L N 1 ATOM 979 C CA . MET A 1 118 ? 50.349 74.545 41.641 1.00 33.14 ? 117 MET L CA 1 ATOM 980 C C . MET A 1 118 ? 50.750 74.681 40.175 1.00 34.24 ? 117 MET L C 1 ATOM 981 O O . MET A 1 118 ? 49.956 74.398 39.276 1.00 34.62 ? 117 MET L O 1 ATOM 982 C CB . MET A 1 118 ? 49.923 75.904 42.210 1.00 35.27 ? 117 MET L CB 1 ATOM 983 C CG . MET A 1 118 ? 49.257 75.810 43.589 1.00 42.16 ? 117 MET L CG 1 ATOM 984 S SD . MET A 1 118 ? 49.088 77.418 44.421 1.00 52.13 ? 117 MET L SD 1 ATOM 985 C CE . MET A 1 118 ? 47.730 78.119 43.528 1.00 48.49 ? 117 MET L CE 1 ATOM 986 N N . ALA A 1 119 ? 51.989 75.101 39.930 1.00 33.14 ? 118 ALA L N 1 ATOM 987 C CA . ALA A 1 119 ? 52.459 75.243 38.561 1.00 33.84 ? 118 ALA L CA 1 ATOM 988 C C . ALA A 1 119 ? 52.553 73.877 37.881 1.00 35.39 ? 118 ALA L C 1 ATOM 989 O O . ALA A 1 119 ? 52.423 73.778 36.662 1.00 34.37 ? 118 ALA L O 1 ATOM 990 C CB . ALA A 1 119 ? 53.817 75.929 38.538 1.00 32.98 ? 118 ALA L CB 1 ATOM 991 N N . GLU A 1 120 ? 52.779 72.830 38.674 1.00 37.27 ? 119 GLU L N 1 ATOM 992 C CA . GLU A 1 120 ? 52.906 71.469 38.152 1.00 41.48 ? 119 GLU L CA 1 ATOM 993 C C . GLU A 1 120 ? 51.547 70.819 37.849 1.00 42.37 ? 119 GLU L C 1 ATOM 994 O O . GLU A 1 120 ? 51.473 69.885 37.057 1.00 40.55 ? 119 GLU L O 1 ATOM 995 C CB . GLU A 1 120 ? 53.660 70.576 39.152 1.00 43.35 ? 119 GLU L CB 1 ATOM 996 C CG . GLU A 1 120 ? 55.123 70.936 39.417 1.00 51.33 ? 119 GLU L CG 1 ATOM 997 C CD . GLU A 1 120 ? 56.054 70.569 38.268 1.00 56.41 ? 119 GLU L CD 1 ATOM 998 O OE1 . GLU A 1 120 ? 56.021 69.403 37.813 1.00 58.84 ? 119 GLU L OE1 1 ATOM 999 O OE2 . GLU A 1 120 ? 56.828 71.446 37.826 1.00 58.84 ? 119 GLU L OE2 1 ATOM 1000 N N . LEU A 1 121 ? 50.485 71.295 38.499 1.00 43.87 ? 120 LEU L N 1 ATOM 1001 C CA . LEU A 1 121 ? 49.151 70.739 38.281 1.00 46.69 ? 120 LEU L CA 1 ATOM 1002 C C . LEU A 1 121 ? 48.654 71.128 36.896 1.00 51.03 ? 120 LEU L C 1 ATOM 1003 O O . LEU A 1 121 ? 47.901 70.389 36.266 1.00 51.69 ? 120 LEU L O 1 ATOM 1004 C CB . LEU A 1 121 ? 48.171 71.249 39.341 1.00 43.63 ? 120 LEU L CB 1 ATOM 1005 C CG . LEU A 1 121 ? 48.446 70.897 40.807 1.00 43.19 ? 120 LEU L CG 1 ATOM 1006 C CD1 . LEU A 1 121 ? 47.326 71.459 41.681 1.00 42.14 ? 120 LEU L CD1 1 ATOM 1007 C CD2 . LEU A 1 121 ? 48.552 69.398 40.976 1.00 38.85 ? 120 LEU L CD2 1 ATOM 1008 N N . SER A 1 122 ? 49.084 72.295 36.428 1.00 56.33 ? 121 SER L N 1 ATOM 1009 C CA . SER A 1 122 ? 48.703 72.784 35.109 1.00 62.47 ? 121 SER L CA 1 ATOM 1010 C C . SER A 1 122 ? 49.953 73.217 34.346 1.00 65.71 ? 121 SER L C 1 ATOM 1011 O O . SER A 1 122 ? 50.224 74.412 34.205 1.00 66.43 ? 121 SER L O 1 ATOM 1012 C CB . SER A 1 122 ? 47.732 73.964 35.231 1.00 63.58 ? 121 SER L CB 1 ATOM 1013 O OG . SER A 1 122 ? 48.290 75.018 36.002 1.00 66.51 ? 121 SER L OG 1 ATOM 1014 N N . PRO A 1 123 ? 50.738 72.241 33.855 1.00 68.40 ? 122 PRO L N 1 ATOM 1015 C CA . PRO A 1 123 ? 51.971 72.497 33.101 1.00 70.42 ? 122 PRO L CA 1 ATOM 1016 C C . PRO A 1 123 ? 51.778 73.561 32.019 1.00 72.53 ? 122 PRO L C 1 ATOM 1017 O O . PRO A 1 123 ? 50.950 73.402 31.117 1.00 72.44 ? 122 PRO L O 1 ATOM 1018 C CB . PRO A 1 123 ? 52.302 71.126 32.524 1.00 70.80 ? 122 PRO L CB 1 ATOM 1019 C CG . PRO A 1 123 ? 51.840 70.202 33.615 1.00 69.85 ? 122 PRO L CG 1 ATOM 1020 C CD . PRO A 1 123 ? 50.494 70.792 33.981 1.00 68.49 ? 122 PRO L CD 1 ATOM 1021 N N . ALA A 1 124 ? 52.555 74.638 32.121 1.00 74.72 ? 123 ALA L N 1 ATOM 1022 C CA . ALA A 1 124 ? 52.485 75.762 31.188 1.00 77.23 ? 123 ALA L CA 1 ATOM 1023 C C . ALA A 1 124 ? 52.580 75.382 29.710 1.00 78.33 ? 123 ALA L C 1 ATOM 1024 O O . ALA A 1 124 ? 51.667 75.664 28.931 1.00 78.50 ? 123 ALA L O 1 ATOM 1025 C CB . ALA A 1 124 ? 53.572 76.785 31.530 1.00 76.89 ? 123 ALA L CB 1 ATOM 1026 N N . ALA A 1 125 ? 53.686 74.753 29.327 1.00 79.55 ? 124 ALA L N 1 ATOM 1027 C CA . ALA A 1 125 ? 53.900 74.353 27.939 1.00 80.76 ? 124 ALA L CA 1 ATOM 1028 C C . ALA A 1 125 ? 52.909 73.285 27.479 1.00 81.64 ? 124 ALA L C 1 ATOM 1029 O O . ALA A 1 125 ? 52.829 72.978 26.287 1.00 81.33 ? 124 ALA L O 1 ATOM 1030 C CB . ALA A 1 125 ? 55.332 73.850 27.758 1.00 80.43 ? 124 ALA L CB 1 ATOM 1031 N N . LYS A 1 126 ? 52.158 72.725 28.424 1.00 82.20 ? 125 LYS L N 1 ATOM 1032 C CA . LYS A 1 126 ? 51.181 71.688 28.110 1.00 82.83 ? 125 LYS L CA 1 ATOM 1033 C C . LYS A 1 126 ? 49.741 72.192 28.016 1.00 82.53 ? 125 LYS L C 1 ATOM 1034 O O . LYS A 1 126 ? 48.864 71.481 27.523 1.00 82.60 ? 125 LYS L O 1 ATOM 1035 C CB . LYS A 1 126 ? 51.270 70.553 29.136 1.00 84.17 ? 125 LYS L CB 1 ATOM 1036 C CG . LYS A 1 126 ? 52.259 69.451 28.766 1.00 85.81 ? 125 LYS L CG 1 ATOM 1037 C CD . LYS A 1 126 ? 53.674 69.981 28.573 1.00 87.41 ? 125 LYS L CD 1 ATOM 1038 C CE . LYS A 1 126 ? 54.261 70.514 29.873 1.00 88.04 ? 125 LYS L CE 1 ATOM 1039 N NZ . LYS A 1 126 ? 55.655 71.011 29.693 1.00 88.44 ? 125 LYS L NZ 1 ATOM 1040 N N . THR A 1 127 ? 49.491 73.407 28.495 1.00 81.60 ? 126 THR L N 1 ATOM 1041 C CA . THR A 1 127 ? 48.150 73.978 28.418 1.00 80.83 ? 126 THR L CA 1 ATOM 1042 C C . THR A 1 127 ? 47.978 74.487 26.992 1.00 79.47 ? 126 THR L C 1 ATOM 1043 O O . THR A 1 127 ? 48.544 75.516 26.617 1.00 80.19 ? 126 THR L O 1 ATOM 1044 C CB . THR A 1 127 ? 47.969 75.157 29.395 1.00 81.85 ? 126 THR L CB 1 ATOM 1045 O OG1 . THR A 1 127 ? 48.864 76.218 29.038 1.00 83.31 ? 126 THR L OG1 1 ATOM 1046 C CG2 . THR A 1 127 ? 48.252 74.714 30.827 1.00 81.81 ? 126 THR L CG2 1 ATOM 1047 N N . GLY A 1 128 ? 47.195 73.756 26.205 1.00 76.81 ? 127 GLY L N 1 ATOM 1048 C CA . GLY A 1 128 ? 46.976 74.105 24.811 1.00 73.25 ? 127 GLY L CA 1 ATOM 1049 C C . GLY A 1 128 ? 46.525 75.504 24.420 1.00 70.50 ? 127 GLY L C 1 ATOM 1050 O O . GLY A 1 128 ? 45.786 75.643 23.444 1.00 71.02 ? 127 GLY L O 1 ATOM 1051 N N . LYS A 1 129 ? 46.951 76.538 25.143 1.00 67.01 ? 128 LYS L N 1 ATOM 1052 C CA . LYS A 1 129 ? 46.560 77.902 24.785 1.00 64.10 ? 128 LYS L CA 1 ATOM 1053 C C . LYS A 1 129 ? 47.246 78.329 23.488 1.00 60.80 ? 128 LYS L C 1 ATOM 1054 O O . LYS A 1 129 ? 48.474 78.380 23.408 1.00 59.22 ? 128 LYS L O 1 ATOM 1055 C CB . LYS A 1 129 ? 46.899 78.879 25.916 1.00 65.14 ? 128 LYS L CB 1 ATOM 1056 C CG . LYS A 1 129 ? 45.833 78.927 27.002 1.00 67.72 ? 128 LYS L CG 1 ATOM 1057 C CD . LYS A 1 129 ? 46.129 79.960 28.082 1.00 69.75 ? 128 LYS L CD 1 ATOM 1058 C CE . LYS A 1 129 ? 47.241 79.499 29.010 1.00 71.93 ? 128 LYS L CE 1 ATOM 1059 N NZ . LYS A 1 129 ? 47.424 80.429 30.164 1.00 73.59 ? 128 LYS L NZ 1 ATOM 1060 N N . ARG A 1 130 ? 46.438 78.632 22.476 1.00 57.71 ? 129 ARG L N 1 ATOM 1061 C CA . ARG A 1 130 ? 46.946 79.031 21.166 1.00 55.57 ? 129 ARG L CA 1 ATOM 1062 C C . ARG A 1 130 ? 46.912 80.527 20.902 1.00 53.92 ? 129 ARG L C 1 ATOM 1063 O O . ARG A 1 130 ? 47.753 81.044 20.174 1.00 53.79 ? 129 ARG L O 1 ATOM 1064 C CB . ARG A 1 130 ? 46.157 78.322 20.060 1.00 54.51 ? 129 ARG L CB 1 ATOM 1065 C CG . ARG A 1 130 ? 46.417 76.828 19.957 1.00 53.27 ? 129 ARG L CG 1 ATOM 1066 C CD . ARG A 1 130 ? 45.375 76.157 19.077 1.00 51.41 ? 129 ARG L CD 1 ATOM 1067 N NE . ARG A 1 130 ? 45.315 76.728 17.733 1.00 49.62 ? 129 ARG L NE 1 ATOM 1068 C CZ . ARG A 1 130 ? 44.382 76.419 16.836 1.00 48.94 ? 129 ARG L CZ 1 ATOM 1069 N NH1 . ARG A 1 130 ? 43.432 75.547 17.147 1.00 50.56 ? 129 ARG L NH1 1 ATOM 1070 N NH2 . ARG A 1 130 ? 44.399 76.973 15.629 1.00 46.06 ? 129 ARG L NH2 1 ATOM 1071 N N . LYS A 1 131 ? 45.938 81.218 21.481 1.00 53.88 ? 130 LYS L N 1 ATOM 1072 C CA . LYS A 1 131 ? 45.803 82.655 21.274 1.00 55.02 ? 130 LYS L CA 1 ATOM 1073 C C . LYS A 1 131 ? 45.472 83.391 22.559 1.00 55.38 ? 130 LYS L C 1 ATOM 1074 O O . LYS A 1 131 ? 44.994 82.794 23.522 1.00 54.99 ? 130 LYS L O 1 ATOM 1075 C CB . LYS A 1 131 ? 44.700 82.945 20.253 1.00 55.41 ? 130 LYS L CB 1 ATOM 1076 C CG . LYS A 1 131 ? 44.981 82.441 18.858 1.00 56.34 ? 130 LYS L CG 1 ATOM 1077 C CD . LYS A 1 131 ? 43.842 82.776 17.909 1.00 56.87 ? 130 LYS L CD 1 ATOM 1078 C CE . LYS A 1 131 ? 44.164 82.305 16.497 1.00 59.14 ? 130 LYS L CE 1 ATOM 1079 N NZ . LYS A 1 131 ? 43.033 82.496 15.547 1.00 60.06 ? 130 LYS L NZ 1 ATOM 1080 N N . ARG A 1 132 ? 45.723 84.696 22.561 1.00 56.81 ? 131 ARG L N 1 ATOM 1081 C CA . ARG A 1 132 ? 45.428 85.525 23.720 1.00 59.55 ? 131 ARG L CA 1 ATOM 1082 C C . ARG A 1 132 ? 43.918 85.625 23.923 1.00 62.21 ? 131 ARG L C 1 ATOM 1083 O O . ARG A 1 132 ? 43.166 85.805 22.966 1.00 62.29 ? 131 ARG L O 1 ATOM 1084 C CB . ARG A 1 132 ? 46.020 86.922 23.537 1.00 58.25 ? 131 ARG L CB 1 ATOM 1085 C CG . ARG A 1 132 ? 47.483 87.024 23.929 1.00 59.25 ? 131 ARG L CG 1 ATOM 1086 C CD . ARG A 1 132 ? 47.671 88.089 24.992 1.00 59.00 ? 131 ARG L CD 1 ATOM 1087 N NE . ARG A 1 132 ? 48.350 89.271 24.468 1.00 61.52 ? 131 ARG L NE 1 ATOM 1088 C CZ . ARG A 1 132 ? 48.363 90.452 25.077 1.00 61.93 ? 131 ARG L CZ 1 ATOM 1089 N NH1 . ARG A 1 132 ? 47.729 90.611 26.231 1.00 61.01 ? 131 ARG L NH1 1 ATOM 1090 N NH2 . ARG A 1 132 ? 49.015 91.474 24.536 1.00 62.90 ? 131 ARG L NH2 1 ATOM 1091 N N . SER A 1 133 ? 43.484 85.503 25.174 1.00 65.26 ? 132 SER L N 1 ATOM 1092 C CA . SER A 1 133 ? 42.066 85.575 25.513 1.00 68.86 ? 132 SER L CA 1 ATOM 1093 C C . SER A 1 133 ? 41.506 86.983 25.315 1.00 70.84 ? 132 SER L C 1 ATOM 1094 O O . SER A 1 133 ? 40.955 87.541 26.291 1.00 71.84 ? 132 SER L O 1 ATOM 1095 C CB . SER A 1 133 ? 41.857 85.139 26.966 1.00 69.17 ? 132 SER L CB 1 ATOM 1096 O OG . SER A 1 133 ? 42.383 83.841 27.185 1.00 70.59 ? 132 SER L OG 1 ATOM 1097 N N . THR B 2 1 ? 14.740 22.429 56.818 1.00 50.92 ? 17 THR R N 1 ATOM 1098 C CA . THR B 2 1 ? 16.223 22.558 56.882 1.00 49.27 ? 17 THR R CA 1 ATOM 1099 C C . THR B 2 1 ? 16.867 22.163 55.560 1.00 48.42 ? 17 THR R C 1 ATOM 1100 O O . THR B 2 1 ? 16.571 21.100 55.009 1.00 47.90 ? 17 THR R O 1 ATOM 1101 C CB . THR B 2 1 ? 16.799 21.676 58.010 1.00 50.77 ? 17 THR R CB 1 ATOM 1102 O OG1 . THR B 2 1 ? 16.415 22.223 59.279 1.00 54.58 ? 17 THR R OG1 1 ATOM 1103 C CG2 . THR B 2 1 ? 18.316 21.611 57.929 1.00 51.16 ? 17 THR R CG2 1 ATOM 1104 N N . ILE B 2 2 ? 17.749 23.024 55.055 1.00 45.54 ? 18 ILE R N 1 ATOM 1105 C CA . ILE B 2 2 ? 18.441 22.769 53.797 1.00 43.41 ? 18 ILE R CA 1 ATOM 1106 C C . ILE B 2 2 ? 19.557 21.766 54.053 1.00 43.77 ? 18 ILE R C 1 ATOM 1107 O O . ILE B 2 2 ? 20.493 22.048 54.796 1.00 43.61 ? 18 ILE R O 1 ATOM 1108 C CB . ILE B 2 2 ? 19.034 24.080 53.213 1.00 42.54 ? 18 ILE R CB 1 ATOM 1109 C CG1 . ILE B 2 2 ? 17.907 25.083 52.959 1.00 38.91 ? 18 ILE R CG1 1 ATOM 1110 C CG2 . ILE B 2 2 ? 19.807 23.792 51.935 1.00 39.02 ? 18 ILE R CG2 1 ATOM 1111 C CD1 . ILE B 2 2 ? 16.803 24.557 52.066 1.00 39.89 ? 18 ILE R CD1 1 ATOM 1112 N N . THR B 2 3 ? 19.460 20.596 53.431 1.00 43.44 ? 19 THR R N 1 ATOM 1113 C CA . THR B 2 3 ? 20.455 19.549 53.640 1.00 43.55 ? 19 THR R CA 1 ATOM 1114 C C . THR B 2 3 ? 21.583 19.478 52.613 1.00 44.17 ? 19 THR R C 1 ATOM 1115 O O . THR B 2 3 ? 22.608 18.837 52.853 1.00 43.25 ? 19 THR R O 1 ATOM 1116 C CB . THR B 2 3 ? 19.772 18.182 53.735 1.00 44.52 ? 19 THR R CB 1 ATOM 1117 O OG1 . THR B 2 3 ? 18.867 18.021 52.634 1.00 43.00 ? 19 THR R OG1 1 ATOM 1118 C CG2 . THR B 2 3 ? 19.000 18.073 55.052 1.00 43.58 ? 19 THR R CG2 1 ATOM 1119 N N . SER B 2 4 ? 21.388 20.115 51.465 1.00 43.18 ? 20 SER R N 1 ATOM 1120 C CA . SER B 2 4 ? 22.419 20.153 50.433 1.00 43.19 ? 20 SER R CA 1 ATOM 1121 C C . SER B 2 4 ? 22.125 21.346 49.539 1.00 42.50 ? 20 SER R C 1 ATOM 1122 O O . SER B 2 4 ? 20.968 21.663 49.270 1.00 41.91 ? 20 SER R O 1 ATOM 1123 C CB . SER B 2 4 ? 22.437 18.866 49.599 1.00 41.66 ? 20 SER R CB 1 ATOM 1124 O OG . SER B 2 4 ? 21.377 18.845 48.663 1.00 45.41 ? 20 SER R OG 1 ATOM 1125 N N . TYR B 2 5 ? 23.180 22.010 49.087 1.00 41.28 ? 21 TYR R N 1 ATOM 1126 C CA . TYR B 2 5 ? 23.032 23.179 48.239 1.00 40.14 ? 21 TYR R CA 1 ATOM 1127 C C . TYR B 2 5 ? 24.233 23.325 47.324 1.00 40.16 ? 21 TYR R C 1 ATOM 1128 O O . TYR B 2 5 ? 25.373 23.114 47.741 1.00 38.90 ? 21 TYR R O 1 ATOM 1129 C CB . TYR B 2 5 ? 22.911 24.436 49.104 1.00 39.25 ? 21 TYR R CB 1 ATOM 1130 C CG . TYR B 2 5 ? 22.991 25.731 48.327 1.00 37.69 ? 21 TYR R CG 1 ATOM 1131 C CD1 . TYR B 2 5 ? 21.870 26.253 47.687 1.00 37.39 ? 21 TYR R CD1 1 ATOM 1132 C CD2 . TYR B 2 5 ? 24.199 26.436 48.229 1.00 38.89 ? 21 TYR R CD2 1 ATOM 1133 C CE1 . TYR B 2 5 ? 21.939 27.443 46.972 1.00 36.73 ? 21 TYR R CE1 1 ATOM 1134 C CE2 . TYR B 2 5 ? 24.281 27.632 47.510 1.00 35.14 ? 21 TYR R CE2 1 ATOM 1135 C CZ . TYR B 2 5 ? 23.148 28.126 46.886 1.00 35.22 ? 21 TYR R CZ 1 ATOM 1136 O OH . TYR B 2 5 ? 23.212 29.292 46.174 1.00 32.84 ? 21 TYR R OH 1 ATOM 1137 N N . LYS B 2 6 ? 23.969 23.686 46.075 1.00 39.26 ? 22 LYS R N 1 ATOM 1138 C CA . LYS B 2 6 ? 25.032 23.895 45.110 1.00 40.08 ? 22 LYS R CA 1 ATOM 1139 C C . LYS B 2 6 ? 24.620 24.948 44.092 1.00 38.60 ? 22 LYS R C 1 ATOM 1140 O O . LYS B 2 6 ? 23.510 24.914 43.556 1.00 36.87 ? 22 LYS R O 1 ATOM 1141 C CB . LYS B 2 6 ? 25.380 22.592 44.386 1.00 44.15 ? 22 LYS R CB 1 ATOM 1142 C CG . LYS B 2 6 ? 26.602 22.719 43.485 1.00 49.52 ? 22 LYS R CG 1 ATOM 1143 C CD . LYS B 2 6 ? 27.026 21.383 42.880 1.00 54.60 ? 22 LYS R CD 1 ATOM 1144 C CE . LYS B 2 6 ? 25.955 20.809 41.959 1.00 57.57 ? 22 LYS R CE 1 ATOM 1145 N NZ . LYS B 2 6 ? 26.429 19.575 41.257 1.00 59.82 ? 22 LYS R NZ 1 ATOM 1146 N N . PHE B 2 7 ? 25.519 25.893 43.851 1.00 36.67 ? 23 PHE R N 1 ATOM 1147 C CA . PHE B 2 7 ? 25.296 26.952 42.879 1.00 37.30 ? 23 PHE R CA 1 ATOM 1148 C C . PHE B 2 7 ? 26.197 26.660 41.681 1.00 38.59 ? 23 PHE R C 1 ATOM 1149 O O . PHE B 2 7 ? 27.349 26.254 41.850 1.00 38.46 ? 23 PHE R O 1 ATOM 1150 C CB . PHE B 2 7 ? 25.670 28.320 43.462 1.00 33.33 ? 23 PHE R CB 1 ATOM 1151 C CG . PHE B 2 7 ? 25.638 29.432 42.448 1.00 32.70 ? 23 PHE R CG 1 ATOM 1152 C CD1 . PHE B 2 7 ? 24.452 30.102 42.165 1.00 33.47 ? 23 PHE R CD1 1 ATOM 1153 C CD2 . PHE B 2 7 ? 26.789 29.769 41.728 1.00 33.94 ? 23 PHE R CD2 1 ATOM 1154 C CE1 . PHE B 2 7 ? 24.404 31.090 41.175 1.00 33.83 ? 23 PHE R CE1 1 ATOM 1155 C CE2 . PHE B 2 7 ? 26.755 30.753 40.736 1.00 32.34 ? 23 PHE R CE2 1 ATOM 1156 C CZ . PHE B 2 7 ? 25.559 31.416 40.459 1.00 34.69 ? 23 PHE R CZ 1 ATOM 1157 N N . GLU B 2 8 ? 25.669 26.858 40.479 1.00 38.41 ? 24 GLU R N 1 ATOM 1158 C CA . GLU B 2 8 ? 26.438 26.640 39.257 1.00 40.40 ? 24 GLU R CA 1 ATOM 1159 C C . GLU B 2 8 ? 26.007 27.665 38.215 1.00 38.74 ? 24 GLU R C 1 ATOM 1160 O O . GLU B 2 8 ? 24.838 28.043 38.151 1.00 36.15 ? 24 GLU R O 1 ATOM 1161 C CB . GLU B 2 8 ? 26.200 25.233 38.698 1.00 44.86 ? 24 GLU R CB 1 ATOM 1162 C CG . GLU B 2 8 ? 26.721 24.091 39.571 1.00 55.87 ? 24 GLU R CG 1 ATOM 1163 C CD . GLU B 2 8 ? 28.242 23.964 39.554 1.00 60.65 ? 24 GLU R CD 1 ATOM 1164 O OE1 . GLU B 2 8 ? 28.810 23.726 38.462 1.00 64.33 ? 24 GLU R OE1 1 ATOM 1165 O OE2 . GLU B 2 8 ? 28.868 24.097 40.632 1.00 62.96 ? 24 GLU R OE2 1 ATOM 1166 N N . SER B 2 9 ? 26.955 28.121 37.406 1.00 36.61 ? 25 SER R N 1 ATOM 1167 C CA . SER B 2 9 ? 26.638 29.078 36.359 1.00 35.40 ? 25 SER R CA 1 ATOM 1168 C C . SER B 2 9 ? 27.525 28.836 35.153 1.00 36.58 ? 25 SER R C 1 ATOM 1169 O O . SER B 2 9 ? 28.756 28.875 35.253 1.00 36.97 ? 25 SER R O 1 ATOM 1170 C CB . SER B 2 9 ? 26.825 30.510 36.860 1.00 34.23 ? 25 SER R CB 1 ATOM 1171 O OG . SER B 2 9 ? 26.325 31.446 35.918 1.00 33.89 ? 25 SER R OG 1 ATOM 1172 N N . VAL B 2 10 ? 26.887 28.561 34.020 1.00 35.71 ? 26 VAL R N 1 ATOM 1173 C CA . VAL B 2 10 ? 27.582 28.333 32.761 1.00 36.44 ? 26 VAL R CA 1 ATOM 1174 C C . VAL B 2 10 ? 27.086 29.413 31.809 1.00 35.94 ? 26 VAL R C 1 ATOM 1175 O O . VAL B 2 10 ? 25.883 29.524 31.564 1.00 35.30 ? 26 VAL R O 1 ATOM 1176 C CB . VAL B 2 10 ? 27.258 26.939 32.172 1.00 38.56 ? 26 VAL R CB 1 ATOM 1177 C CG1 . VAL B 2 10 ? 27.942 26.768 30.812 1.00 39.69 ? 26 VAL R CG1 1 ATOM 1178 C CG2 . VAL B 2 10 ? 27.729 25.857 33.123 1.00 38.79 ? 26 VAL R CG2 1 ATOM 1179 N N . ASN B 2 11 ? 28.014 30.214 31.291 1.00 34.42 ? 27 ASN R N 1 ATOM 1180 C CA . ASN B 2 11 ? 27.685 31.311 30.385 1.00 32.95 ? 27 ASN R CA 1 ATOM 1181 C C . ASN B 2 11 ? 26.615 32.217 30.984 1.00 33.90 ? 27 ASN R C 1 ATOM 1182 O O . ASN B 2 11 ? 25.725 32.711 30.284 1.00 33.93 ? 27 ASN R O 1 ATOM 1183 C CB . ASN B 2 11 ? 27.227 30.783 29.022 1.00 34.53 ? 27 ASN R CB 1 ATOM 1184 C CG . ASN B 2 11 ? 28.327 30.024 28.287 1.00 35.80 ? 27 ASN R CG 1 ATOM 1185 O OD1 . ASN B 2 11 ? 29.512 30.189 28.576 1.00 34.27 ? 27 ASN R OD1 1 ATOM 1186 N ND2 . ASN B 2 11 ? 27.936 29.195 27.327 1.00 36.24 ? 27 ASN R ND2 1 ATOM 1187 N N . PHE B 2 12 ? 26.712 32.417 32.295 1.00 32.28 ? 28 PHE R N 1 ATOM 1188 C CA . PHE B 2 12 ? 25.805 33.272 33.043 1.00 33.39 ? 28 PHE R CA 1 ATOM 1189 C C . PHE B 2 12 ? 24.366 32.772 33.209 1.00 34.51 ? 28 PHE R C 1 ATOM 1190 O O . PHE B 2 12 ? 23.464 33.532 33.558 1.00 33.81 ? 28 PHE R O 1 ATOM 1191 C CB . PHE B 2 12 ? 25.843 34.684 32.456 1.00 34.44 ? 28 PHE R CB 1 ATOM 1192 C CG . PHE B 2 12 ? 27.181 35.361 32.625 1.00 35.04 ? 28 PHE R CG 1 ATOM 1193 C CD1 . PHE B 2 12 ? 27.567 35.865 33.863 1.00 33.34 ? 28 PHE R CD1 1 ATOM 1194 C CD2 . PHE B 2 12 ? 28.073 35.452 31.560 1.00 34.42 ? 28 PHE R CD2 1 ATOM 1195 C CE1 . PHE B 2 12 ? 28.822 36.452 34.040 1.00 36.08 ? 28 PHE R CE1 1 ATOM 1196 C CE2 . PHE B 2 12 ? 29.333 36.037 31.728 1.00 33.58 ? 28 PHE R CE2 1 ATOM 1197 C CZ . PHE B 2 12 ? 29.706 36.537 32.967 1.00 34.48 ? 28 PHE R CZ 1 ATOM 1198 N N . ASP B 2 13 ? 24.157 31.488 32.949 1.00 35.04 ? 29 ASP R N 1 ATOM 1199 C CA . ASP B 2 13 ? 22.854 30.882 33.166 1.00 35.23 ? 29 ASP R CA 1 ATOM 1200 C C . ASP B 2 13 ? 23.074 30.260 34.547 1.00 33.56 ? 29 ASP R C 1 ATOM 1201 O O . ASP B 2 13 ? 23.633 29.176 34.668 1.00 33.50 ? 29 ASP R O 1 ATOM 1202 C CB . ASP B 2 13 ? 22.562 29.803 32.112 1.00 38.75 ? 29 ASP R CB 1 ATOM 1203 C CG . ASP B 2 13 ? 21.190 29.154 32.302 1.00 44.84 ? 29 ASP R CG 1 ATOM 1204 O OD1 . ASP B 2 13 ? 20.294 29.805 32.884 1.00 47.48 ? 29 ASP R OD1 1 ATOM 1205 O OD2 . ASP B 2 13 ? 21.000 28.001 31.861 1.00 48.64 ? 29 ASP R OD2 1 ATOM 1206 N N . SER B 2 14 ? 22.665 30.979 35.584 1.00 32.04 ? 30 SER R N 1 ATOM 1207 C CA . SER B 2 14 ? 22.860 30.545 36.961 1.00 32.06 ? 30 SER R CA 1 ATOM 1208 C C . SER B 2 14 ? 21.740 29.673 37.517 1.00 32.55 ? 30 SER R C 1 ATOM 1209 O O . SER B 2 14 ? 20.563 29.976 37.347 1.00 31.99 ? 30 SER R O 1 ATOM 1210 C CB . SER B 2 14 ? 23.029 31.777 37.845 1.00 32.27 ? 30 SER R CB 1 ATOM 1211 O OG . SER B 2 14 ? 24.043 32.617 37.324 1.00 32.42 ? 30 SER R OG 1 ATOM 1212 N N . LYS B 2 15 ? 22.121 28.596 38.195 1.00 31.79 ? 31 LYS R N 1 ATOM 1213 C CA . LYS B 2 15 ? 21.159 27.675 38.784 1.00 33.60 ? 31 LYS R CA 1 ATOM 1214 C C . LYS B 2 15 ? 21.579 27.242 40.178 1.00 33.59 ? 31 LYS R C 1 ATOM 1215 O O . LYS B 2 15 ? 22.772 27.183 40.496 1.00 32.83 ? 31 LYS R O 1 ATOM 1216 C CB . LYS B 2 15 ? 21.026 26.410 37.933 1.00 33.60 ? 31 LYS R CB 1 ATOM 1217 C CG . LYS B 2 15 ? 20.600 26.624 36.497 1.00 37.56 ? 31 LYS R CG 1 ATOM 1218 C CD . LYS B 2 15 ? 20.511 25.285 35.775 1.00 39.81 ? 31 LYS R CD 1 ATOM 1219 C CE . LYS B 2 15 ? 20.142 25.461 34.310 1.00 44.54 ? 31 LYS R CE 1 ATOM 1220 N NZ . LYS B 2 15 ? 18.887 26.266 34.156 1.00 50.30 ? 31 LYS R NZ 1 ATOM 1221 N N . ILE B 2 16 ? 20.588 26.943 41.009 1.00 32.52 ? 32 ILE R N 1 ATOM 1222 C CA . ILE B 2 16 ? 20.846 26.447 42.350 1.00 33.68 ? 32 ILE R CA 1 ATOM 1223 C C . ILE B 2 16 ? 20.166 25.087 42.458 1.00 35.33 ? 32 ILE R C 1 ATOM 1224 O O . ILE B 2 16 ? 19.051 24.885 41.963 1.00 34.99 ? 32 ILE R O 1 ATOM 1225 C CB . ILE B 2 16 ? 20.305 27.387 43.462 1.00 33.65 ? 32 ILE R CB 1 ATOM 1226 C CG1 . ILE B 2 16 ? 18.816 27.681 43.247 1.00 34.17 ? 32 ILE R CG1 1 ATOM 1227 C CG2 . ILE B 2 16 ? 21.124 28.670 43.493 1.00 34.46 ? 32 ILE R CG2 1 ATOM 1228 C CD1 . ILE B 2 16 ? 18.203 28.520 44.359 1.00 31.91 ? 32 ILE R CD1 1 ATOM 1229 N N . GLU B 2 17 ? 20.862 24.147 43.081 1.00 36.43 ? 33 GLU R N 1 ATOM 1230 C CA . GLU B 2 17 ? 20.347 22.799 43.265 1.00 39.01 ? 33 GLU R CA 1 ATOM 1231 C C . GLU B 2 17 ? 20.401 22.577 44.764 1.00 37.70 ? 33 GLU R C 1 ATOM 1232 O O . GLU B 2 17 ? 21.450 22.764 45.382 1.00 36.66 ? 33 GLU R O 1 ATOM 1233 C CB . GLU B 2 17 ? 21.248 21.798 42.549 1.00 42.62 ? 33 GLU R CB 1 ATOM 1234 C CG . GLU B 2 17 ? 20.654 20.418 42.391 1.00 52.00 ? 33 GLU R CG 1 ATOM 1235 C CD . GLU B 2 17 ? 21.606 19.461 41.690 1.00 56.76 ? 33 GLU R CD 1 ATOM 1236 O OE1 . GLU B 2 17 ? 22.235 19.869 40.686 1.00 58.51 ? 33 GLU R OE1 1 ATOM 1237 O OE2 . GLU B 2 17 ? 21.716 18.299 42.138 1.00 59.73 ? 33 GLU R OE2 1 ATOM 1238 N N . TRP B 2 18 ? 19.275 22.192 45.354 1.00 34.87 ? 34 TRP R N 1 ATOM 1239 C CA . TRP B 2 18 ? 19.231 21.990 46.793 1.00 34.61 ? 34 TRP R CA 1 ATOM 1240 C C . TRP B 2 18 ? 18.211 20.938 47.242 1.00 35.26 ? 34 TRP R C 1 ATOM 1241 O O . TRP B 2 18 ? 17.316 20.561 46.491 1.00 35.13 ? 34 TRP R O 1 ATOM 1242 C CB . TRP B 2 18 ? 18.911 23.318 47.477 1.00 32.92 ? 34 TRP R CB 1 ATOM 1243 C CG . TRP B 2 18 ? 17.623 23.924 46.992 1.00 33.68 ? 34 TRP R CG 1 ATOM 1244 C CD1 . TRP B 2 18 ? 17.425 24.621 45.834 1.00 34.33 ? 34 TRP R CD1 1 ATOM 1245 C CD2 . TRP B 2 18 ? 16.348 23.852 47.639 1.00 34.48 ? 34 TRP R CD2 1 ATOM 1246 N NE1 . TRP B 2 18 ? 16.105 24.990 45.721 1.00 33.30 ? 34 TRP R NE1 1 ATOM 1247 C CE2 . TRP B 2 18 ? 15.423 24.531 46.816 1.00 33.29 ? 34 TRP R CE2 1 ATOM 1248 C CE3 . TRP B 2 18 ? 15.896 23.277 48.836 1.00 34.67 ? 34 TRP R CE3 1 ATOM 1249 C CZ2 . TRP B 2 18 ? 14.070 24.654 47.150 1.00 34.86 ? 34 TRP R CZ2 1 ATOM 1250 C CZ3 . TRP B 2 18 ? 14.548 23.397 49.168 1.00 34.40 ? 34 TRP R CZ3 1 ATOM 1251 C CH2 . TRP B 2 18 ? 13.653 24.084 48.326 1.00 35.09 ? 34 TRP R CH2 1 ATOM 1252 N N . THR B 2 19 ? 18.363 20.472 48.478 1.00 36.23 ? 35 THR R N 1 ATOM 1253 C CA . THR B 2 19 ? 17.450 19.488 49.052 1.00 39.01 ? 35 THR R CA 1 ATOM 1254 C C . THR B 2 19 ? 17.027 19.961 50.436 1.00 39.09 ? 35 THR R C 1 ATOM 1255 O O . THR B 2 19 ? 17.774 20.666 51.123 1.00 38.42 ? 35 THR R O 1 ATOM 1256 C CB . THR B 2 19 ? 18.103 18.091 49.184 1.00 39.47 ? 35 THR R CB 1 ATOM 1257 O OG1 . THR B 2 19 ? 19.288 18.187 49.981 1.00 42.23 ? 35 THR R OG1 1 ATOM 1258 C CG2 . THR B 2 19 ? 18.457 17.532 47.814 1.00 38.96 ? 35 THR R CG2 1 ATOM 1259 N N . GLY B 2 20 ? 15.818 19.574 50.825 1.00 40.20 ? 36 GLY R N 1 ATOM 1260 C CA . GLY B 2 20 ? 15.267 19.951 52.114 1.00 40.91 ? 36 GLY R CA 1 ATOM 1261 C C . GLY B 2 20 ? 13.795 19.588 52.124 1.00 42.20 ? 36 GLY R C 1 ATOM 1262 O O . GLY B 2 20 ? 13.163 19.529 51.068 1.00 42.98 ? 36 GLY R O 1 ATOM 1263 N N . ASN B 2 21 ? 13.242 19.348 53.308 1.00 42.53 ? 37 ASN R N 1 ATOM 1264 C CA . ASN B 2 21 ? 11.837 18.964 53.439 1.00 41.74 ? 37 ASN R CA 1 ATOM 1265 C C . ASN B 2 21 ? 10.908 20.165 53.491 1.00 40.34 ? 37 ASN R C 1 ATOM 1266 O O . ASN B 2 21 ? 11.194 21.150 54.164 1.00 41.90 ? 37 ASN R O 1 ATOM 1267 C CB . ASN B 2 21 ? 11.633 18.136 54.711 1.00 42.88 ? 37 ASN R CB 1 ATOM 1268 C CG . ASN B 2 21 ? 12.492 16.886 54.746 1.00 44.05 ? 37 ASN R CG 1 ATOM 1269 O OD1 . ASN B 2 21 ? 12.821 16.384 55.826 1.00 46.11 ? 37 ASN R OD1 1 ATOM 1270 N ND2 . ASN B 2 21 ? 12.847 16.367 53.572 1.00 42.84 ? 37 ASN R ND2 1 ATOM 1271 N N . GLY B 2 22 ? 9.784 20.073 52.790 1.00 39.58 ? 38 GLY R N 1 ATOM 1272 C CA . GLY B 2 22 ? 8.830 21.164 52.800 1.00 37.10 ? 38 GLY R CA 1 ATOM 1273 C C . GLY B 2 22 ? 9.025 22.203 51.712 1.00 37.06 ? 38 GLY R C 1 ATOM 1274 O O . GLY B 2 22 ? 9.767 21.996 50.747 1.00 35.31 ? 38 GLY R O 1 ATOM 1275 N N . LEU B 2 23 ? 8.338 23.327 51.876 1.00 35.46 ? 39 LEU R N 1 ATOM 1276 C CA . LEU B 2 23 ? 8.401 24.420 50.928 1.00 36.55 ? 39 LEU R CA 1 ATOM 1277 C C . LEU B 2 23 ? 9.270 25.540 51.508 1.00 37.41 ? 39 LEU R C 1 ATOM 1278 O O . LEU B 2 23 ? 9.407 25.667 52.730 1.00 37.36 ? 39 LEU R O 1 ATOM 1279 C CB . LEU B 2 23 ? 6.991 24.926 50.637 1.00 34.56 ? 39 LEU R CB 1 ATOM 1280 C CG . LEU B 2 23 ? 5.986 23.856 50.181 1.00 37.50 ? 39 LEU R CG 1 ATOM 1281 C CD1 . LEU B 2 23 ? 4.616 24.496 49.995 1.00 34.16 ? 39 LEU R CD1 1 ATOM 1282 C CD2 . LEU B 2 23 ? 6.458 23.210 48.877 1.00 36.20 ? 39 LEU R CD2 1 ATOM 1283 N N . TYR B 2 24 ? 9.864 26.341 50.630 1.00 36.20 ? 40 TYR R N 1 ATOM 1284 C CA . TYR B 2 24 ? 10.738 27.428 51.072 1.00 35.48 ? 40 TYR R CA 1 ATOM 1285 C C . TYR B 2 24 ? 10.611 28.676 50.221 1.00 33.76 ? 40 TYR R C 1 ATOM 1286 O O . TYR B 2 24 ? 10.213 28.615 49.059 1.00 33.28 ? 40 TYR R O 1 ATOM 1287 C CB . TYR B 2 24 ? 12.199 26.990 51.019 1.00 33.91 ? 40 TYR R CB 1 ATOM 1288 C CG . TYR B 2 24 ? 12.561 25.842 51.921 1.00 36.48 ? 40 TYR R CG 1 ATOM 1289 C CD1 . TYR B 2 24 ? 13.273 26.055 53.100 1.00 35.71 ? 40 TYR R CD1 1 ATOM 1290 C CD2 . TYR B 2 24 ? 12.209 24.531 51.587 1.00 37.66 ? 40 TYR R CD2 1 ATOM 1291 C CE1 . TYR B 2 24 ? 13.630 24.991 53.923 1.00 37.66 ? 40 TYR R CE1 1 ATOM 1292 C CE2 . TYR B 2 24 ? 12.558 23.461 52.404 1.00 35.85 ? 40 TYR R CE2 1 ATOM 1293 C CZ . TYR B 2 24 ? 13.268 23.696 53.566 1.00 38.21 ? 40 TYR R CZ 1 ATOM 1294 O OH . TYR B 2 24 ? 13.624 22.637 54.367 1.00 40.88 ? 40 TYR R OH 1 ATOM 1295 N N . ASN B 2 25 ? 10.941 29.813 50.818 1.00 34.47 ? 41 ASN R N 1 ATOM 1296 C CA . ASN B 2 25 ? 10.949 31.073 50.092 1.00 36.25 ? 41 ASN R CA 1 ATOM 1297 C C . ASN B 2 25 ? 12.418 31.297 49.787 1.00 35.50 ? 41 ASN R C 1 ATOM 1298 O O . ASN B 2 25 ? 13.261 31.168 50.672 1.00 35.40 ? 41 ASN R O 1 ATOM 1299 C CB . ASN B 2 25 ? 10.419 32.216 50.947 1.00 39.11 ? 41 ASN R CB 1 ATOM 1300 C CG . ASN B 2 25 ? 8.920 32.182 51.078 1.00 43.01 ? 41 ASN R CG 1 ATOM 1301 O OD1 . ASN B 2 25 ? 8.220 31.744 50.164 1.00 43.27 ? 41 ASN R OD1 1 ATOM 1302 N ND2 . ASN B 2 25 ? 8.422 32.660 52.210 1.00 45.09 ? 41 ASN R ND2 1 ATOM 1303 N N . ILE B 2 26 ? 12.732 31.606 48.535 1.00 34.34 ? 42 ILE R N 1 ATOM 1304 C CA . ILE B 2 26 ? 14.123 31.810 48.160 1.00 32.88 ? 42 ILE R CA 1 ATOM 1305 C C . ILE B 2 26 ? 14.346 33.245 47.702 1.00 31.93 ? 42 ILE R C 1 ATOM 1306 O O . ILE B 2 26 ? 13.640 33.752 46.829 1.00 31.80 ? 42 ILE R O 1 ATOM 1307 C CB . ILE B 2 26 ? 14.550 30.834 47.038 1.00 31.63 ? 42 ILE R CB 1 ATOM 1308 C CG1 . ILE B 2 26 ? 14.014 29.423 47.336 1.00 30.84 ? 42 ILE R CG1 1 ATOM 1309 C CG2 . ILE B 2 26 ? 16.082 30.793 46.946 1.00 29.37 ? 42 ILE R CG2 1 ATOM 1310 C CD1 . ILE B 2 26 ? 14.402 28.376 46.293 1.00 29.83 ? 42 ILE R CD1 1 ATOM 1311 N N . SER B 2 27 ? 15.326 33.902 48.309 1.00 31.07 ? 43 SER R N 1 ATOM 1312 C CA . SER B 2 27 ? 15.629 35.287 47.963 1.00 32.40 ? 43 SER R CA 1 ATOM 1313 C C . SER B 2 27 ? 17.139 35.484 47.826 1.00 31.79 ? 43 SER R C 1 ATOM 1314 O O . SER B 2 27 ? 17.927 34.651 48.284 1.00 31.81 ? 43 SER R O 1 ATOM 1315 C CB . SER B 2 27 ? 15.061 36.229 49.028 1.00 28.01 ? 43 SER R CB 1 ATOM 1316 O OG . SER B 2 27 ? 15.621 35.931 50.288 1.00 33.85 ? 43 SER R OG 1 ATOM 1317 N N . LEU B 2 28 ? 17.541 36.588 47.203 1.00 31.80 ? 44 LEU R N 1 ATOM 1318 C CA . LEU B 2 28 ? 18.964 36.842 46.991 1.00 32.02 ? 44 LEU R CA 1 ATOM 1319 C C . LEU B 2 28 ? 19.389 38.275 47.285 1.00 31.04 ? 44 LEU R C 1 ATOM 1320 O O . LEU B 2 28 ? 18.677 39.236 46.983 1.00 29.48 ? 44 LEU R O 1 ATOM 1321 C CB . LEU B 2 28 ? 19.346 36.470 45.549 1.00 31.71 ? 44 LEU R CB 1 ATOM 1322 C CG . LEU B 2 28 ? 20.813 36.623 45.094 1.00 31.41 ? 44 LEU R CG 1 ATOM 1323 C CD1 . LEU B 2 28 ? 21.115 35.619 43.994 1.00 28.96 ? 44 LEU R CD1 1 ATOM 1324 C CD2 . LEU B 2 28 ? 21.069 38.038 44.596 1.00 29.81 ? 44 LEU R CD2 1 ATOM 1325 N N . ARG B 2 29 ? 20.549 38.409 47.906 1.00 30.86 ? 45 ARG R N 1 ATOM 1326 C CA . ARG B 2 29 ? 21.079 39.726 48.206 1.00 32.04 ? 45 ARG R CA 1 ATOM 1327 C C . ARG B 2 29 ? 22.464 39.897 47.579 1.00 31.80 ? 45 ARG R C 1 ATOM 1328 O O . ARG B 2 29 ? 23.320 39.020 47.706 1.00 29.32 ? 45 ARG R O 1 ATOM 1329 C CB . ARG B 2 29 ? 21.184 39.932 49.708 1.00 34.86 ? 45 ARG R CB 1 ATOM 1330 C CG . ARG B 2 29 ? 21.719 41.299 50.064 1.00 43.47 ? 45 ARG R CG 1 ATOM 1331 C CD . ARG B 2 29 ? 21.722 41.517 51.556 1.00 49.36 ? 45 ARG R CD 1 ATOM 1332 N NE . ARG B 2 29 ? 22.112 42.881 51.870 1.00 56.19 ? 45 ARG R NE 1 ATOM 1333 C CZ . ARG B 2 29 ? 22.123 43.391 53.096 1.00 60.18 ? 45 ARG R CZ 1 ATOM 1334 N NH1 . ARG B 2 29 ? 21.760 42.639 54.129 1.00 59.30 ? 45 ARG R NH1 1 ATOM 1335 N NH2 . ARG B 2 29 ? 22.499 44.652 53.282 1.00 60.53 ? 45 ARG R NH2 1 ATOM 1336 N N . ASN B 2 30 ? 22.668 41.019 46.895 1.00 29.29 ? 46 ASN R N 1 ATOM 1337 C CA . ASN B 2 30 ? 23.953 41.321 46.272 1.00 31.54 ? 46 ASN R CA 1 ATOM 1338 C C . ASN B 2 30 ? 24.724 42.294 47.161 1.00 30.09 ? 46 ASN R C 1 ATOM 1339 O O . ASN B 2 30 ? 24.135 43.188 47.774 1.00 28.71 ? 46 ASN R O 1 ATOM 1340 C CB . ASN B 2 30 ? 23.768 41.970 44.892 1.00 28.53 ? 46 ASN R CB 1 ATOM 1341 C CG . ASN B 2 30 ? 23.408 40.974 43.812 1.00 30.36 ? 46 ASN R CG 1 ATOM 1342 O OD1 . ASN B 2 30 ? 22.309 41.021 43.249 1.00 32.48 ? 46 ASN R OD1 1 ATOM 1343 N ND2 . ASN B 2 30 ? 24.333 40.072 43.502 1.00 25.40 ? 46 ASN R ND2 1 ATOM 1344 N N . TYR B 2 31 ? 26.037 42.110 47.239 1.00 29.47 ? 47 TYR R N 1 ATOM 1345 C CA . TYR B 2 31 ? 26.887 43.005 48.027 1.00 29.95 ? 47 TYR R CA 1 ATOM 1346 C C . TYR B 2 31 ? 26.634 44.453 47.596 1.00 29.39 ? 47 TYR R C 1 ATOM 1347 O O . TYR B 2 31 ? 26.560 44.740 46.404 1.00 28.49 ? 47 TYR R O 1 ATOM 1348 C CB . TYR B 2 31 ? 28.368 42.690 47.784 1.00 28.42 ? 47 TYR R CB 1 ATOM 1349 C CG . TYR B 2 31 ? 29.303 43.631 48.509 1.00 28.99 ? 47 TYR R CG 1 ATOM 1350 C CD1 . TYR B 2 31 ? 29.618 43.431 49.850 1.00 30.80 ? 47 TYR R CD1 1 ATOM 1351 C CD2 . TYR B 2 31 ? 29.820 44.761 47.869 1.00 30.16 ? 47 TYR R CD2 1 ATOM 1352 C CE1 . TYR B 2 31 ? 30.420 44.329 50.544 1.00 33.16 ? 47 TYR R CE1 1 ATOM 1353 C CE2 . TYR B 2 31 ? 30.630 45.674 48.555 1.00 30.89 ? 47 TYR R CE2 1 ATOM 1354 C CZ . TYR B 2 31 ? 30.922 45.454 49.888 1.00 32.66 ? 47 TYR R CZ 1 ATOM 1355 O OH . TYR B 2 31 ? 31.691 46.360 50.584 1.00 32.99 ? 47 TYR R OH 1 ATOM 1356 N N . GLY B 2 32 ? 26.501 45.353 48.563 1.00 31.63 ? 48 GLY R N 1 ATOM 1357 C CA . GLY B 2 32 ? 26.291 46.755 48.243 1.00 36.14 ? 48 GLY R CA 1 ATOM 1358 C C . GLY B 2 32 ? 24.853 47.199 48.054 1.00 40.14 ? 48 GLY R C 1 ATOM 1359 O O . GLY B 2 32 ? 24.593 48.392 47.903 1.00 39.94 ? 48 GLY R O 1 ATOM 1360 N N . ILE B 2 33 ? 23.924 46.247 48.056 1.00 41.08 ? 49 ILE R N 1 ATOM 1361 C CA . ILE B 2 33 ? 22.506 46.539 47.882 1.00 42.71 ? 49 ILE R CA 1 ATOM 1362 C C . ILE B 2 33 ? 21.791 46.070 49.144 1.00 45.33 ? 49 ILE R C 1 ATOM 1363 O O . ILE B 2 33 ? 21.920 44.919 49.551 1.00 45.27 ? 49 ILE R O 1 ATOM 1364 C CB . ILE B 2 33 ? 21.925 45.784 46.673 1.00 44.43 ? 49 ILE R CB 1 ATOM 1365 C CG1 . ILE B 2 33 ? 22.828 45.971 45.446 1.00 45.09 ? 49 ILE R CG1 1 ATOM 1366 C CG2 . ILE B 2 33 ? 20.510 46.285 46.377 1.00 44.05 ? 49 ILE R CG2 1 ATOM 1367 C CD1 . ILE B 2 33 ? 22.875 47.386 44.907 1.00 45.89 ? 49 ILE R CD1 1 ATOM 1368 N N . LYS B 2 34 ? 21.030 46.964 49.757 1.00 48.27 ? 50 LYS R N 1 ATOM 1369 C CA . LYS B 2 34 ? 20.326 46.650 50.996 1.00 52.54 ? 50 LYS R CA 1 ATOM 1370 C C . LYS B 2 34 ? 19.204 45.612 50.946 1.00 52.30 ? 50 LYS R C 1 ATOM 1371 O O . LYS B 2 34 ? 19.115 44.746 51.817 1.00 54.27 ? 50 LYS R O 1 ATOM 1372 C CB . LYS B 2 34 ? 19.786 47.948 51.607 1.00 56.27 ? 50 LYS R CB 1 ATOM 1373 C CG . LYS B 2 34 ? 19.264 48.945 50.576 1.00 61.12 ? 50 LYS R CG 1 ATOM 1374 C CD . LYS B 2 34 ? 18.984 50.310 51.202 1.00 65.05 ? 50 LYS R CD 1 ATOM 1375 C CE . LYS B 2 34 ? 17.688 50.319 52.002 1.00 66.84 ? 50 LYS R CE 1 ATOM 1376 N NZ . LYS B 2 34 ? 16.494 50.229 51.109 1.00 68.60 ? 50 LYS R NZ 1 ATOM 1377 N N . THR B 2 35 ? 18.364 45.678 49.925 1.00 51.39 ? 51 THR R N 1 ATOM 1378 C CA . THR B 2 35 ? 17.223 44.776 49.845 1.00 51.26 ? 51 THR R CA 1 ATOM 1379 C C . THR B 2 35 ? 17.410 43.384 49.252 1.00 49.97 ? 51 THR R C 1 ATOM 1380 O O . THR B 2 35 ? 18.151 43.185 48.288 1.00 50.01 ? 51 THR R O 1 ATOM 1381 C CB . THR B 2 35 ? 16.069 45.448 49.083 1.00 53.13 ? 51 THR R CB 1 ATOM 1382 O OG1 . THR B 2 35 ? 16.486 45.721 47.740 1.00 55.70 ? 51 THR R OG1 1 ATOM 1383 C CG2 . THR B 2 35 ? 15.673 46.757 49.760 1.00 53.56 ? 51 THR R CG2 1 ATOM 1384 N N . TRP B 2 36 ? 16.713 42.420 49.847 1.00 46.11 ? 52 TRP R N 1 ATOM 1385 C CA . TRP B 2 36 ? 16.736 41.048 49.371 1.00 42.85 ? 52 TRP R CA 1 ATOM 1386 C C . TRP B 2 36 ? 15.735 40.977 48.229 1.00 42.19 ? 52 TRP R C 1 ATOM 1387 O O . TRP B 2 36 ? 14.654 41.554 48.322 1.00 45.58 ? 52 TRP R O 1 ATOM 1388 C CB . TRP B 2 36 ? 16.303 40.078 50.474 1.00 39.52 ? 52 TRP R CB 1 ATOM 1389 C CG . TRP B 2 36 ? 17.304 39.923 51.569 1.00 36.43 ? 52 TRP R CG 1 ATOM 1390 C CD1 . TRP B 2 36 ? 17.461 40.730 52.654 1.00 33.98 ? 52 TRP R CD1 1 ATOM 1391 C CD2 . TRP B 2 36 ? 18.330 38.919 51.659 1.00 35.40 ? 52 TRP R CD2 1 ATOM 1392 N NE1 . TRP B 2 36 ? 18.522 40.296 53.416 1.00 36.49 ? 52 TRP R NE1 1 ATOM 1393 C CE2 . TRP B 2 36 ? 19.074 39.189 52.828 1.00 33.77 ? 52 TRP R CE2 1 ATOM 1394 C CE3 . TRP B 2 36 ? 18.692 37.823 50.860 1.00 32.23 ? 52 TRP R CE3 1 ATOM 1395 C CZ2 . TRP B 2 36 ? 20.164 38.404 53.223 1.00 33.29 ? 52 TRP R CZ2 1 ATOM 1396 C CZ3 . TRP B 2 36 ? 19.775 37.041 51.249 1.00 30.35 ? 52 TRP R CZ3 1 ATOM 1397 C CH2 . TRP B 2 36 ? 20.501 37.337 52.422 1.00 33.99 ? 52 TRP R CH2 1 ATOM 1398 N N . GLN B 2 37 ? 16.097 40.297 47.150 1.00 39.83 ? 53 GLN R N 1 ATOM 1399 C CA . GLN B 2 37 ? 15.201 40.143 46.010 1.00 41.07 ? 53 GLN R CA 1 ATOM 1400 C C . GLN B 2 37 ? 14.569 38.752 46.064 1.00 41.05 ? 53 GLN R C 1 ATOM 1401 O O . GLN B 2 37 ? 15.271 37.744 45.950 1.00 39.51 ? 53 GLN R O 1 ATOM 1402 C CB . GLN B 2 37 ? 15.962 40.265 44.690 1.00 42.97 ? 53 GLN R CB 1 ATOM 1403 C CG . GLN B 2 37 ? 16.421 41.658 44.309 1.00 48.95 ? 53 GLN R CG 1 ATOM 1404 C CD . GLN B 2 37 ? 17.198 41.645 43.004 1.00 51.94 ? 53 GLN R CD 1 ATOM 1405 O OE1 . GLN B 2 37 ? 18.384 41.293 42.971 1.00 52.93 ? 53 GLN R OE1 1 ATOM 1406 N NE2 . GLN B 2 37 ? 16.526 42.003 41.912 1.00 52.67 ? 53 GLN R NE2 1 ATOM 1407 N N . THR B 2 38 ? 13.252 38.698 46.235 1.00 39.89 ? 54 THR R N 1 ATOM 1408 C CA . THR B 2 38 ? 12.547 37.421 46.286 1.00 38.82 ? 54 THR R CA 1 ATOM 1409 C C . THR B 2 38 ? 12.607 36.744 44.925 1.00 35.81 ? 54 THR R C 1 ATOM 1410 O O . THR B 2 38 ? 12.250 37.338 43.913 1.00 37.72 ? 54 THR R O 1 ATOM 1411 C CB . THR B 2 38 ? 11.067 37.621 46.683 1.00 42.41 ? 54 THR R CB 1 ATOM 1412 O OG1 . THR B 2 38 ? 11.005 38.103 48.031 1.00 44.68 ? 54 THR R OG1 1 ATOM 1413 C CG2 . THR B 2 38 ? 10.294 36.302 46.584 1.00 41.89 ? 54 THR R CG2 1 ATOM 1414 N N . MET B 2 39 ? 13.061 35.499 44.891 1.00 33.55 ? 55 MET R N 1 ATOM 1415 C CA . MET B 2 39 ? 13.146 34.795 43.619 1.00 33.76 ? 55 MET R CA 1 ATOM 1416 C C . MET B 2 39 ? 12.066 33.723 43.470 1.00 33.83 ? 55 MET R C 1 ATOM 1417 O O . MET B 2 39 ? 11.486 33.569 42.401 1.00 34.56 ? 55 MET R O 1 ATOM 1418 C CB . MET B 2 39 ? 14.529 34.166 43.463 1.00 31.91 ? 55 MET R CB 1 ATOM 1419 C CG . MET B 2 39 ? 15.677 35.167 43.628 1.00 31.85 ? 55 MET R CG 1 ATOM 1420 S SD . MET B 2 39 ? 17.234 34.426 43.146 1.00 30.26 ? 55 MET R SD 1 ATOM 1421 C CE . MET B 2 39 ? 17.632 33.496 44.593 1.00 23.43 ? 55 MET R CE 1 ATOM 1422 N N . TYR B 2 40 ? 11.807 32.984 44.544 1.00 34.73 ? 56 TYR R N 1 ATOM 1423 C CA . TYR B 2 40 ? 10.796 31.925 44.528 1.00 34.94 ? 56 TYR R CA 1 ATOM 1424 C C . TYR B 2 40 ? 10.026 31.911 45.833 1.00 35.58 ? 56 TYR R C 1 ATOM 1425 O O . TYR B 2 40 ? 10.603 32.131 46.897 1.00 34.15 ? 56 TYR R O 1 ATOM 1426 C CB . TYR B 2 40 ? 11.456 30.562 44.312 1.00 32.97 ? 56 TYR R CB 1 ATOM 1427 C CG . TYR B 2 40 ? 11.971 30.379 42.908 1.00 34.52 ? 56 TYR R CG 1 ATOM 1428 C CD1 . TYR B 2 40 ? 11.093 30.121 41.852 1.00 30.02 ? 56 TYR R CD1 1 ATOM 1429 C CD2 . TYR B 2 40 ? 13.335 30.521 42.621 1.00 31.72 ? 56 TYR R CD2 1 ATOM 1430 C CE1 . TYR B 2 40 ? 11.559 30.009 40.539 1.00 32.17 ? 56 TYR R CE1 1 ATOM 1431 C CE2 . TYR B 2 40 ? 13.811 30.418 41.316 1.00 29.56 ? 56 TYR R CE2 1 ATOM 1432 C CZ . TYR B 2 40 ? 12.928 30.163 40.282 1.00 32.83 ? 56 TYR R CZ 1 ATOM 1433 O OH . TYR B 2 40 ? 13.411 30.055 38.997 1.00 30.53 ? 56 TYR R OH 1 ATOM 1434 N N . THR B 2 41 ? 8.724 31.643 45.743 1.00 37.51 ? 57 THR R N 1 ATOM 1435 C CA . THR B 2 41 ? 7.858 31.596 46.918 1.00 38.33 ? 57 THR R CA 1 ATOM 1436 C C . THR B 2 41 ? 7.249 30.205 47.131 1.00 37.55 ? 57 THR R C 1 ATOM 1437 O O . THR B 2 41 ? 6.682 29.619 46.214 1.00 36.42 ? 57 THR R O 1 ATOM 1438 C CB . THR B 2 41 ? 6.714 32.627 46.791 1.00 39.73 ? 57 THR R CB 1 ATOM 1439 O OG1 . THR B 2 41 ? 7.274 33.939 46.639 1.00 43.59 ? 57 THR R OG1 1 ATOM 1440 C CG2 . THR B 2 41 ? 5.828 32.605 48.032 1.00 41.19 ? 57 THR R CG2 1 ATOM 1441 N N . ASN B 2 42 ? 7.388 29.686 48.347 1.00 37.64 ? 58 ASN R N 1 ATOM 1442 C CA . ASN B 2 42 ? 6.854 28.374 48.715 1.00 37.68 ? 58 ASN R CA 1 ATOM 1443 C C . ASN B 2 42 ? 7.135 27.288 47.689 1.00 36.73 ? 58 ASN R C 1 ATOM 1444 O O . ASN B 2 42 ? 6.211 26.699 47.138 1.00 37.48 ? 58 ASN R O 1 ATOM 1445 C CB . ASN B 2 42 ? 5.338 28.474 48.950 1.00 36.62 ? 58 ASN R CB 1 ATOM 1446 C CG . ASN B 2 42 ? 4.996 29.417 50.081 1.00 34.38 ? 58 ASN R CG 1 ATOM 1447 O OD1 . ASN B 2 42 ? 4.101 30.251 49.963 1.00 37.48 ? 58 ASN R OD1 1 ATOM 1448 N ND2 . ASN B 2 42 ? 5.711 29.291 51.184 1.00 32.51 ? 58 ASN R ND2 1 ATOM 1449 N N . VAL B 2 43 ? 8.410 27.014 47.438 1.00 34.76 ? 59 VAL R N 1 ATOM 1450 C CA . VAL B 2 43 ? 8.769 25.985 46.479 1.00 30.86 ? 59 VAL R CA 1 ATOM 1451 C C . VAL B 2 43 ? 9.490 24.831 47.142 1.00 31.56 ? 59 VAL R C 1 ATOM 1452 O O . VAL B 2 43 ? 10.163 25.008 48.159 1.00 31.98 ? 59 VAL R O 1 ATOM 1453 C CB . VAL B 2 43 ? 9.671 26.539 45.344 1.00 31.56 ? 59 VAL R CB 1 ATOM 1454 C CG1 . VAL B 2 43 ? 8.864 27.473 44.461 1.00 27.80 ? 59 VAL R CG1 1 ATOM 1455 C CG2 . VAL B 2 43 ? 10.908 27.252 45.939 1.00 26.96 ? 59 VAL R CG2 1 ATOM 1456 N N . PRO B 2 44 ? 9.347 23.622 46.574 1.00 31.58 ? 60 PRO R N 1 ATOM 1457 C CA . PRO B 2 44 ? 9.968 22.388 47.063 1.00 32.90 ? 60 PRO R CA 1 ATOM 1458 C C . PRO B 2 44 ? 11.373 22.204 46.495 1.00 34.18 ? 60 PRO R C 1 ATOM 1459 O O . PRO B 2 44 ? 11.719 22.824 45.493 1.00 34.70 ? 60 PRO R O 1 ATOM 1460 C CB . PRO B 2 44 ? 9.014 21.312 46.562 1.00 32.31 ? 60 PRO R CB 1 ATOM 1461 C CG . PRO B 2 44 ? 8.607 21.855 45.212 1.00 31.51 ? 60 PRO R CG 1 ATOM 1462 C CD . PRO B 2 44 ? 8.360 23.328 45.513 1.00 31.71 ? 60 PRO R CD 1 ATOM 1463 N N . GLU B 2 45 ? 12.163 21.337 47.126 1.00 35.30 ? 61 GLU R N 1 ATOM 1464 C CA . GLU B 2 45 ? 13.525 21.058 46.691 1.00 37.05 ? 61 GLU R CA 1 ATOM 1465 C C . GLU B 2 45 ? 13.602 20.760 45.198 1.00 38.18 ? 61 GLU R C 1 ATOM 1466 O O . GLU B 2 45 ? 12.629 20.311 44.591 1.00 36.33 ? 61 GLU R O 1 ATOM 1467 C CB . GLU B 2 45 ? 14.115 19.878 47.484 1.00 38.79 ? 61 GLU R CB 1 ATOM 1468 C CG . GLU B 2 45 ? 13.280 18.590 47.444 1.00 41.21 ? 61 GLU R CG 1 ATOM 1469 C CD . GLU B 2 45 ? 13.948 17.414 48.158 1.00 45.27 ? 61 GLU R CD 1 ATOM 1470 O OE1 . GLU B 2 45 ? 14.727 17.641 49.110 1.00 46.06 ? 61 GLU R OE1 1 ATOM 1471 O OE2 . GLU B 2 45 ? 13.679 16.251 47.776 1.00 47.77 ? 61 GLU R OE2 1 ATOM 1472 N N . GLY B 2 46 ? 14.772 21.012 44.613 1.00 38.54 ? 62 GLY R N 1 ATOM 1473 C CA . GLY B 2 46 ? 14.966 20.772 43.192 1.00 38.00 ? 62 GLY R CA 1 ATOM 1474 C C . GLY B 2 46 ? 16.025 21.694 42.604 1.00 37.41 ? 62 GLY R C 1 ATOM 1475 O O . GLY B 2 46 ? 16.872 22.215 43.330 1.00 36.07 ? 62 GLY R O 1 ATOM 1476 N N . THR B 2 47 ? 15.973 21.895 41.291 1.00 36.81 ? 63 THR R N 1 ATOM 1477 C CA . THR B 2 47 ? 16.922 22.754 40.589 1.00 36.27 ? 63 THR R CA 1 ATOM 1478 C C . THR B 2 47 ? 16.160 23.945 40.045 1.00 36.35 ? 63 THR R C 1 ATOM 1479 O O . THR B 2 47 ? 15.194 23.782 39.296 1.00 38.14 ? 63 THR R O 1 ATOM 1480 C CB . THR B 2 47 ? 17.591 22.008 39.424 1.00 36.13 ? 63 THR R CB 1 ATOM 1481 O OG1 . THR B 2 47 ? 18.365 20.929 39.950 1.00 38.50 ? 63 THR R OG1 1 ATOM 1482 C CG2 . THR B 2 47 ? 18.508 22.941 38.631 1.00 35.88 ? 63 THR R CG2 1 ATOM 1483 N N . TYR B 2 48 ? 16.605 25.139 40.419 1.00 34.14 ? 64 TYR R N 1 ATOM 1484 C CA . TYR B 2 48 ? 15.945 26.371 40.011 1.00 34.32 ? 64 TYR R CA 1 ATOM 1485 C C . TYR B 2 48 ? 16.878 27.354 39.318 1.00 34.75 ? 64 TYR R C 1 ATOM 1486 O O . TYR B 2 48 ? 18.001 27.589 39.771 1.00 33.07 ? 64 TYR R O 1 ATOM 1487 C CB . TYR B 2 48 ? 15.339 27.056 41.240 1.00 34.36 ? 64 TYR R CB 1 ATOM 1488 C CG . TYR B 2 48 ? 14.194 26.296 41.869 1.00 36.93 ? 64 TYR R CG 1 ATOM 1489 C CD1 . TYR B 2 48 ? 12.873 26.559 41.499 1.00 35.32 ? 64 TYR R CD1 1 ATOM 1490 C CD2 . TYR B 2 48 ? 14.431 25.286 42.809 1.00 36.34 ? 64 TYR R CD2 1 ATOM 1491 C CE1 . TYR B 2 48 ? 11.814 25.837 42.042 1.00 37.38 ? 64 TYR R CE1 1 ATOM 1492 C CE2 . TYR B 2 48 ? 13.374 24.553 43.360 1.00 37.52 ? 64 TYR R CE2 1 ATOM 1493 C CZ . TYR B 2 48 ? 12.071 24.836 42.968 1.00 37.76 ? 64 TYR R CZ 1 ATOM 1494 O OH . TYR B 2 48 ? 11.025 24.115 43.486 1.00 40.24 ? 64 TYR R OH 1 ATOM 1495 N N . ASP B 2 49 ? 16.396 27.941 38.229 1.00 34.57 ? 65 ASP R N 1 ATOM 1496 C CA . ASP B 2 49 ? 17.174 28.917 37.493 1.00 36.28 ? 65 ASP R CA 1 ATOM 1497 C C . ASP B 2 49 ? 17.034 30.269 38.176 1.00 34.37 ? 65 ASP R C 1 ATOM 1498 O O . ASP B 2 49 ? 15.924 30.720 38.443 1.00 35.48 ? 65 ASP R O 1 ATOM 1499 C CB . ASP B 2 49 ? 16.675 29.033 36.052 1.00 38.52 ? 65 ASP R CB 1 ATOM 1500 C CG . ASP B 2 49 ? 17.638 29.811 35.171 1.00 42.38 ? 65 ASP R CG 1 ATOM 1501 O OD1 . ASP B 2 49 ? 18.273 29.191 34.290 1.00 46.87 ? 65 ASP R OD1 1 ATOM 1502 O OD2 . ASP B 2 49 ? 17.775 31.036 35.370 1.00 43.35 ? 65 ASP R OD2 1 ATOM 1503 N N . ILE B 2 50 ? 18.155 30.916 38.475 1.00 32.89 ? 66 ILE R N 1 ATOM 1504 C CA . ILE B 2 50 ? 18.095 32.226 39.101 1.00 30.95 ? 66 ILE R CA 1 ATOM 1505 C C . ILE B 2 50 ? 18.869 33.258 38.279 1.00 33.43 ? 66 ILE R C 1 ATOM 1506 O O . ILE B 2 50 ? 19.346 34.261 38.813 1.00 31.48 ? 66 ILE R O 1 ATOM 1507 C CB . ILE B 2 50 ? 18.643 32.198 40.552 1.00 31.99 ? 66 ILE R CB 1 ATOM 1508 C CG1 . ILE B 2 50 ? 20.121 31.798 40.568 1.00 30.49 ? 66 ILE R CG1 1 ATOM 1509 C CG2 . ILE B 2 50 ? 17.819 31.225 41.400 1.00 31.15 ? 66 ILE R CG2 1 ATOM 1510 C CD1 . ILE B 2 50 ? 20.798 32.095 41.905 1.00 31.14 ? 66 ILE R CD1 1 ATOM 1511 N N . SER B 2 51 ? 18.989 32.999 36.977 1.00 33.20 ? 67 SER R N 1 ATOM 1512 C CA . SER B 2 51 ? 19.694 33.908 36.073 1.00 35.94 ? 67 SER R CA 1 ATOM 1513 C C . SER B 2 51 ? 19.164 35.330 36.205 1.00 35.99 ? 67 SER R C 1 ATOM 1514 O O . SER B 2 51 ? 17.954 35.545 36.261 1.00 35.59 ? 67 SER R O 1 ATOM 1515 C CB . SER B 2 51 ? 19.528 33.460 34.615 1.00 34.83 ? 67 SER R CB 1 ATOM 1516 O OG . SER B 2 51 ? 20.173 32.223 34.366 1.00 37.37 ? 67 SER R OG 1 ATOM 1517 N N . GLY B 2 52 ? 20.074 36.300 36.260 1.00 37.75 ? 68 GLY R N 1 ATOM 1518 C CA . GLY B 2 52 ? 19.663 37.691 36.361 1.00 36.60 ? 68 GLY R CA 1 ATOM 1519 C C . GLY B 2 52 ? 19.633 38.282 37.758 1.00 37.83 ? 68 GLY R C 1 ATOM 1520 O O . GLY B 2 52 ? 19.732 39.498 37.918 1.00 37.23 ? 68 GLY R O 1 ATOM 1521 N N . PHE B 2 53 ? 19.497 37.442 38.777 1.00 34.54 ? 69 PHE R N 1 ATOM 1522 C CA . PHE B 2 53 ? 19.452 37.955 40.137 1.00 32.79 ? 69 PHE R CA 1 ATOM 1523 C C . PHE B 2 53 ? 20.837 38.285 40.690 1.00 29.94 ? 69 PHE R C 1 ATOM 1524 O O . PHE B 2 53 ? 21.028 39.350 41.271 1.00 29.95 ? 69 PHE R O 1 ATOM 1525 C CB . PHE B 2 53 ? 18.686 36.974 41.039 1.00 33.13 ? 69 PHE R CB 1 ATOM 1526 C CG . PHE B 2 53 ? 17.198 37.005 40.816 1.00 34.09 ? 69 PHE R CG 1 ATOM 1527 C CD1 . PHE B 2 53 ? 16.424 38.025 41.363 1.00 33.90 ? 69 PHE R CD1 1 ATOM 1528 C CD2 . PHE B 2 53 ? 16.576 36.045 40.017 1.00 34.63 ? 69 PHE R CD2 1 ATOM 1529 C CE1 . PHE B 2 53 ? 15.040 38.095 41.117 1.00 34.30 ? 69 PHE R CE1 1 ATOM 1530 C CE2 . PHE B 2 53 ? 15.195 36.104 39.764 1.00 35.71 ? 69 PHE R CE2 1 ATOM 1531 C CZ . PHE B 2 53 ? 14.429 37.132 40.316 1.00 34.39 ? 69 PHE R CZ 1 ATOM 1532 N N . PRO B 2 54 ? 21.819 37.380 40.524 1.00 28.36 ? 70 PRO R N 1 ATOM 1533 C CA . PRO B 2 54 ? 23.160 37.691 41.039 1.00 29.07 ? 70 PRO R CA 1 ATOM 1534 C C . PRO B 2 54 ? 23.764 38.803 40.163 1.00 30.42 ? 70 PRO R C 1 ATOM 1535 O O . PRO B 2 54 ? 23.579 38.793 38.948 1.00 29.63 ? 70 PRO R O 1 ATOM 1536 C CB . PRO B 2 54 ? 23.938 36.383 40.848 1.00 29.53 ? 70 PRO R CB 1 ATOM 1537 C CG . PRO B 2 54 ? 22.876 35.325 40.524 1.00 29.48 ? 70 PRO R CG 1 ATOM 1538 C CD . PRO B 2 54 ? 21.803 36.085 39.819 1.00 27.85 ? 70 PRO R CD 1 ATOM 1539 N N . ASN B 2 55 ? 24.461 39.766 40.759 1.00 31.28 ? 71 ASN R N 1 ATOM 1540 C CA . ASN B 2 55 ? 25.090 40.800 39.940 1.00 31.99 ? 71 ASN R CA 1 ATOM 1541 C C . ASN B 2 55 ? 26.330 40.203 39.292 1.00 32.99 ? 71 ASN R C 1 ATOM 1542 O O . ASN B 2 55 ? 26.987 39.329 39.865 1.00 33.29 ? 71 ASN R O 1 ATOM 1543 C CB . ASN B 2 55 ? 25.493 42.021 40.774 1.00 31.18 ? 71 ASN R CB 1 ATOM 1544 C CG . ASN B 2 55 ? 24.327 42.947 41.041 1.00 32.31 ? 71 ASN R CG 1 ATOM 1545 O OD1 . ASN B 2 55 ? 23.347 42.933 40.307 1.00 32.61 ? 71 ASN R OD1 1 ATOM 1546 N ND2 . ASN B 2 55 ? 24.432 43.765 42.086 1.00 32.31 ? 71 ASN R ND2 1 ATOM 1547 N N . ASN B 2 56 ? 26.642 40.658 38.088 1.00 32.78 ? 72 ASN R N 1 ATOM 1548 C CA . ASN B 2 56 ? 27.816 40.155 37.402 1.00 35.05 ? 72 ASN R CA 1 ATOM 1549 C C . ASN B 2 56 ? 29.029 40.987 37.809 1.00 36.30 ? 72 ASN R C 1 ATOM 1550 O O . ASN B 2 56 ? 29.432 41.912 37.107 1.00 37.64 ? 72 ASN R O 1 ATOM 1551 C CB . ASN B 2 56 ? 27.616 40.200 35.883 1.00 35.27 ? 72 ASN R CB 1 ATOM 1552 C CG . ASN B 2 56 ? 26.528 39.240 35.405 1.00 35.97 ? 72 ASN R CG 1 ATOM 1553 O OD1 . ASN B 2 56 ? 26.285 38.201 36.018 1.00 34.84 ? 72 ASN R OD1 1 ATOM 1554 N ND2 . ASN B 2 56 ? 25.890 39.575 34.292 1.00 36.40 ? 72 ASN R ND2 1 ATOM 1555 N N . ASP B 2 57 ? 29.585 40.673 38.974 1.00 36.62 ? 73 ASP R N 1 ATOM 1556 C CA . ASP B 2 57 ? 30.758 41.378 39.463 1.00 35.65 ? 73 ASP R CA 1 ATOM 1557 C C . ASP B 2 57 ? 31.649 40.454 40.281 1.00 35.32 ? 73 ASP R C 1 ATOM 1558 O O . ASP B 2 57 ? 31.442 39.235 40.307 1.00 33.97 ? 73 ASP R O 1 ATOM 1559 C CB . ASP B 2 57 ? 30.368 42.623 40.276 1.00 37.31 ? 73 ASP R CB 1 ATOM 1560 C CG . ASP B 2 57 ? 29.314 42.339 41.334 1.00 39.48 ? 73 ASP R CG 1 ATOM 1561 O OD1 . ASP B 2 57 ? 29.325 41.236 41.918 1.00 39.86 ? 73 ASP R OD1 1 ATOM 1562 O OD2 . ASP B 2 57 ? 28.484 43.240 41.593 1.00 40.46 ? 73 ASP R OD2 1 ATOM 1563 N N . PHE B 2 58 ? 32.638 41.037 40.950 1.00 33.37 ? 74 PHE R N 1 ATOM 1564 C CA . PHE B 2 58 ? 33.590 40.258 41.727 1.00 32.60 ? 74 PHE R CA 1 ATOM 1565 C C . PHE B 2 58 ? 33.290 40.237 43.215 1.00 33.30 ? 74 PHE R C 1 ATOM 1566 O O . PHE B 2 58 ? 34.067 39.692 43.996 1.00 35.81 ? 74 PHE R O 1 ATOM 1567 C CB . PHE B 2 58 ? 35.006 40.796 41.492 1.00 33.03 ? 74 PHE R CB 1 ATOM 1568 C CG . PHE B 2 58 ? 35.455 40.703 40.064 1.00 33.00 ? 74 PHE R CG 1 ATOM 1569 C CD1 . PHE B 2 58 ? 36.301 39.680 39.651 1.00 34.78 ? 74 PHE R CD1 1 ATOM 1570 C CD2 . PHE B 2 58 ? 35.024 41.634 39.128 1.00 33.17 ? 74 PHE R CD2 1 ATOM 1571 C CE1 . PHE B 2 58 ? 36.715 39.584 38.323 1.00 34.02 ? 74 PHE R CE1 1 ATOM 1572 C CE2 . PHE B 2 58 ? 35.430 41.545 37.795 1.00 36.17 ? 74 PHE R CE2 1 ATOM 1573 C CZ . PHE B 2 58 ? 36.278 40.515 37.395 1.00 33.21 ? 74 PHE R CZ 1 ATOM 1574 N N . VAL B 2 59 ? 32.175 40.836 43.614 1.00 30.66 ? 75 VAL R N 1 ATOM 1575 C CA . VAL B 2 59 ? 31.797 40.837 45.017 1.00 30.83 ? 75 VAL R CA 1 ATOM 1576 C C . VAL B 2 59 ? 30.696 39.790 45.221 1.00 33.12 ? 75 VAL R C 1 ATOM 1577 O O . VAL B 2 59 ? 30.012 39.396 44.275 1.00 31.68 ? 75 VAL R O 1 ATOM 1578 C CB . VAL B 2 59 ? 31.333 42.243 45.477 1.00 31.90 ? 75 VAL R CB 1 ATOM 1579 C CG1 . VAL B 2 59 ? 32.558 43.134 45.696 1.00 30.44 ? 75 VAL R CG1 1 ATOM 1580 C CG2 . VAL B 2 59 ? 30.421 42.872 44.432 1.00 30.14 ? 75 VAL R CG2 1 ATOM 1581 N N . SER B 2 60 ? 30.536 39.346 46.458 1.00 32.83 ? 76 SER R N 1 ATOM 1582 C CA . SER B 2 60 ? 29.584 38.296 46.794 1.00 34.41 ? 76 SER R CA 1 ATOM 1583 C C . SER B 2 60 ? 28.090 38.578 46.706 1.00 33.55 ? 76 SER R C 1 ATOM 1584 O O . SER B 2 60 ? 27.640 39.716 46.562 1.00 30.56 ? 76 SER R O 1 ATOM 1585 C CB . SER B 2 60 ? 29.883 37.782 48.209 1.00 35.91 ? 76 SER R CB 1 ATOM 1586 O OG . SER B 2 60 ? 31.220 37.319 48.322 1.00 40.21 ? 76 SER R OG 1 ATOM 1587 N N . PHE B 2 61 ? 27.334 37.488 46.771 1.00 32.99 ? 77 PHE R N 1 ATOM 1588 C CA . PHE B 2 61 ? 25.884 37.526 46.800 1.00 32.34 ? 77 PHE R CA 1 ATOM 1589 C C . PHE B 2 61 ? 25.509 36.376 47.734 1.00 32.10 ? 77 PHE R C 1 ATOM 1590 O O . PHE B 2 61 ? 26.288 35.432 47.920 1.00 30.55 ? 77 PHE R O 1 ATOM 1591 C CB . PHE B 2 61 ? 25.266 37.389 45.391 1.00 31.58 ? 77 PHE R CB 1 ATOM 1592 C CG . PHE B 2 61 ? 25.485 36.055 44.723 1.00 32.10 ? 77 PHE R CG 1 ATOM 1593 C CD1 . PHE B 2 61 ? 24.592 35.003 44.919 1.00 29.77 ? 77 PHE R CD1 1 ATOM 1594 C CD2 . PHE B 2 61 ? 26.556 35.871 43.846 1.00 31.97 ? 77 PHE R CD2 1 ATOM 1595 C CE1 . PHE B 2 61 ? 24.757 33.784 44.245 1.00 28.71 ? 77 PHE R CE1 1 ATOM 1596 C CE2 . PHE B 2 61 ? 26.733 34.663 43.172 1.00 30.84 ? 77 PHE R CE2 1 ATOM 1597 C CZ . PHE B 2 61 ? 25.825 33.614 43.373 1.00 31.68 ? 77 PHE R CZ 1 ATOM 1598 N N . TRP B 2 62 ? 24.356 36.497 48.372 1.00 30.80 ? 78 TRP R N 1 ATOM 1599 C CA . TRP B 2 62 ? 23.873 35.490 49.308 1.00 30.25 ? 78 TRP R CA 1 ATOM 1600 C C . TRP B 2 62 ? 22.498 35.016 48.879 1.00 30.55 ? 78 TRP R C 1 ATOM 1601 O O . TRP B 2 62 ? 21.653 35.822 48.482 1.00 29.90 ? 78 TRP R O 1 ATOM 1602 C CB . TRP B 2 62 ? 23.766 36.085 50.716 1.00 28.69 ? 78 TRP R CB 1 ATOM 1603 C CG . TRP B 2 62 ? 25.086 36.452 51.318 1.00 32.99 ? 78 TRP R CG 1 ATOM 1604 C CD1 . TRP B 2 62 ? 25.834 35.701 52.179 1.00 31.50 ? 78 TRP R CD1 1 ATOM 1605 C CD2 . TRP B 2 62 ? 25.840 37.641 51.061 1.00 32.44 ? 78 TRP R CD2 1 ATOM 1606 N NE1 . TRP B 2 62 ? 27.010 36.349 52.474 1.00 34.67 ? 78 TRP R NE1 1 ATOM 1607 C CE2 . TRP B 2 62 ? 27.040 37.542 51.799 1.00 35.38 ? 78 TRP R CE2 1 ATOM 1608 C CE3 . TRP B 2 62 ? 25.619 38.782 50.275 1.00 35.66 ? 78 TRP R CE3 1 ATOM 1609 C CZ2 . TRP B 2 62 ? 28.023 38.546 51.776 1.00 35.54 ? 78 TRP R CZ2 1 ATOM 1610 C CZ3 . TRP B 2 62 ? 26.599 39.784 50.252 1.00 35.04 ? 78 TRP R CZ3 1 ATOM 1611 C CH2 . TRP B 2 62 ? 27.783 39.654 50.999 1.00 36.05 ? 78 TRP R CH2 1 ATOM 1612 N N . VAL B 2 63 ? 22.285 33.707 48.948 1.00 31.73 ? 79 VAL R N 1 ATOM 1613 C CA . VAL B 2 63 ? 20.993 33.125 48.611 1.00 31.17 ? 79 VAL R CA 1 ATOM 1614 C C . VAL B 2 63 ? 20.373 32.702 49.939 1.00 33.10 ? 79 VAL R C 1 ATOM 1615 O O . VAL B 2 63 ? 20.936 31.876 50.657 1.00 33.60 ? 79 VAL R O 1 ATOM 1616 C CB . VAL B 2 63 ? 21.145 31.898 47.715 1.00 31.12 ? 79 VAL R CB 1 ATOM 1617 C CG1 . VAL B 2 63 ? 19.776 31.238 47.497 1.00 28.50 ? 79 VAL R CG1 1 ATOM 1618 C CG2 . VAL B 2 63 ? 21.756 32.302 46.387 1.00 28.69 ? 79 VAL R CG2 1 ATOM 1619 N N . LYS B 2 64 ? 19.225 33.275 50.278 1.00 32.75 ? 80 LYS R N 1 ATOM 1620 C CA . LYS B 2 64 ? 18.585 32.938 51.541 1.00 33.80 ? 80 LYS R CA 1 ATOM 1621 C C . LYS B 2 64 ? 17.373 32.021 51.397 1.00 33.61 ? 80 LYS R C 1 ATOM 1622 O O . LYS B 2 64 ? 16.510 32.229 50.540 1.00 31.83 ? 80 LYS R O 1 ATOM 1623 C CB . LYS B 2 64 ? 18.166 34.210 52.275 1.00 35.49 ? 80 LYS R CB 1 ATOM 1624 C CG . LYS B 2 64 ? 17.455 33.952 53.602 1.00 38.04 ? 80 LYS R CG 1 ATOM 1625 C CD . LYS B 2 64 ? 17.222 35.241 54.373 1.00 41.30 ? 80 LYS R CD 1 ATOM 1626 C CE . LYS B 2 64 ? 16.309 36.192 53.623 1.00 44.49 ? 80 LYS R CE 1 ATOM 1627 N NZ . LYS B 2 64 ? 16.188 37.503 54.337 1.00 48.02 ? 80 LYS R NZ 1 ATOM 1628 N N . PHE B 2 65 ? 17.321 31.008 52.255 1.00 35.35 ? 81 PHE R N 1 ATOM 1629 C CA . PHE B 2 65 ? 16.209 30.052 52.269 1.00 36.07 ? 81 PHE R CA 1 ATOM 1630 C C . PHE B 2 65 ? 15.422 30.248 53.554 1.00 36.44 ? 81 PHE R C 1 ATOM 1631 O O . PHE B 2 65 ? 15.992 30.249 54.639 1.00 36.74 ? 81 PHE R O 1 ATOM 1632 C CB . PHE B 2 65 ? 16.732 28.619 52.234 1.00 33.62 ? 81 PHE R CB 1 ATOM 1633 C CG . PHE B 2 65 ? 17.304 28.213 50.913 1.00 31.83 ? 81 PHE R CG 1 ATOM 1634 C CD1 . PHE B 2 65 ? 16.503 27.617 49.951 1.00 30.98 ? 81 PHE R CD1 1 ATOM 1635 C CD2 . PHE B 2 65 ? 18.655 28.405 50.640 1.00 32.18 ? 81 PHE R CD2 1 ATOM 1636 C CE1 . PHE B 2 65 ? 17.040 27.208 48.732 1.00 32.40 ? 81 PHE R CE1 1 ATOM 1637 C CE2 . PHE B 2 65 ? 19.204 28.004 49.427 1.00 30.99 ? 81 PHE R CE2 1 ATOM 1638 C CZ . PHE B 2 65 ? 18.395 27.402 48.470 1.00 31.23 ? 81 PHE R CZ 1 ATOM 1639 N N . GLU B 2 66 ? 14.115 30.424 53.434 1.00 38.14 ? 82 GLU R N 1 ATOM 1640 C CA . GLU B 2 66 ? 13.287 30.600 54.615 1.00 40.50 ? 82 GLU R CA 1 ATOM 1641 C C . GLU B 2 66 ? 12.072 29.676 54.637 1.00 41.00 ? 82 GLU R C 1 ATOM 1642 O O . GLU B 2 66 ? 11.431 29.444 53.612 1.00 37.68 ? 82 GLU R O 1 ATOM 1643 C CB . GLU B 2 66 ? 12.789 32.038 54.719 1.00 42.61 ? 82 GLU R CB 1 ATOM 1644 C CG . GLU B 2 66 ? 13.832 33.054 55.112 1.00 49.48 ? 82 GLU R CG 1 ATOM 1645 C CD . GLU B 2 66 ? 13.269 34.456 55.096 1.00 53.63 ? 82 GLU R CD 1 ATOM 1646 O OE1 . GLU B 2 66 ? 12.775 34.888 54.027 1.00 56.14 ? 82 GLU R OE1 1 ATOM 1647 O OE2 . GLU B 2 66 ? 13.314 35.125 56.148 1.00 57.45 ? 82 GLU R OE2 1 ATOM 1648 N N . GLN B 2 67 ? 11.775 29.159 55.826 1.00 41.90 ? 83 GLN R N 1 ATOM 1649 C CA . GLN B 2 67 ? 10.616 28.302 56.055 1.00 43.78 ? 83 GLN R CA 1 ATOM 1650 C C . GLN B 2 67 ? 10.144 28.627 57.464 1.00 44.33 ? 83 GLN R C 1 ATOM 1651 O O . GLN B 2 67 ? 10.722 28.157 58.446 1.00 44.46 ? 83 GLN R O 1 ATOM 1652 C CB . GLN B 2 67 ? 10.980 26.821 55.963 1.00 41.52 ? 83 GLN R CB 1 ATOM 1653 C CG . GLN B 2 67 ? 9.762 25.907 56.091 1.00 44.70 ? 83 GLN R CG 1 ATOM 1654 C CD . GLN B 2 67 ? 10.113 24.447 55.915 1.00 44.92 ? 83 GLN R CD 1 ATOM 1655 O OE1 . GLN B 2 67 ? 10.715 23.832 56.794 1.00 45.01 ? 83 GLN R OE1 1 ATOM 1656 N NE2 . GLN B 2 67 ? 9.756 23.888 54.766 1.00 44.08 ? 83 GLN R NE2 1 ATOM 1657 N N . GLY B 2 68 ? 9.106 29.447 57.562 1.00 45.86 ? 84 GLY R N 1 ATOM 1658 C CA . GLY B 2 68 ? 8.614 29.827 58.872 1.00 49.08 ? 84 GLY R CA 1 ATOM 1659 C C . GLY B 2 68 ? 9.668 30.658 59.578 1.00 50.89 ? 84 GLY R C 1 ATOM 1660 O O . GLY B 2 68 ? 10.025 31.737 59.108 1.00 50.10 ? 84 GLY R O 1 ATOM 1661 N N . ASP B 2 69 ? 10.170 30.156 60.702 1.00 52.64 ? 85 ASP R N 1 ATOM 1662 C CA . ASP B 2 69 ? 11.195 30.866 61.459 1.00 54.01 ? 85 ASP R CA 1 ATOM 1663 C C . ASP B 2 69 ? 12.586 30.395 61.073 1.00 52.47 ? 85 ASP R C 1 ATOM 1664 O O . ASP B 2 69 ? 13.580 31.012 61.453 1.00 52.43 ? 85 ASP R O 1 ATOM 1665 C CB . ASP B 2 69 ? 10.999 30.672 62.965 1.00 57.28 ? 85 ASP R CB 1 ATOM 1666 C CG . ASP B 2 69 ? 9.780 31.398 63.488 1.00 62.00 ? 85 ASP R CG 1 ATOM 1667 O OD1 . ASP B 2 69 ? 9.582 32.571 63.104 1.00 63.69 ? 85 ASP R OD1 1 ATOM 1668 O OD2 . ASP B 2 69 ? 9.027 30.800 64.290 1.00 65.28 ? 85 ASP R OD2 1 ATOM 1669 N N . TYR B 2 70 ? 12.658 29.293 60.335 1.00 49.68 ? 86 TYR R N 1 ATOM 1670 C CA . TYR B 2 70 ? 13.943 28.771 59.894 1.00 48.44 ? 86 TYR R CA 1 ATOM 1671 C C . TYR B 2 70 ? 14.500 29.707 58.821 1.00 47.48 ? 86 TYR R C 1 ATOM 1672 O O . TYR B 2 70 ? 13.753 30.263 58.017 1.00 45.31 ? 86 TYR R O 1 ATOM 1673 C CB . TYR B 2 70 ? 13.788 27.364 59.317 1.00 47.64 ? 86 TYR R CB 1 ATOM 1674 C CG . TYR B 2 70 ? 15.060 26.820 58.704 1.00 47.81 ? 86 TYR R CG 1 ATOM 1675 C CD1 . TYR B 2 70 ? 16.119 26.389 59.507 1.00 47.67 ? 86 TYR R CD1 1 ATOM 1676 C CD2 . TYR B 2 70 ? 15.211 26.749 57.316 1.00 47.87 ? 86 TYR R CD2 1 ATOM 1677 C CE1 . TYR B 2 70 ? 17.296 25.898 58.943 1.00 46.59 ? 86 TYR R CE1 1 ATOM 1678 C CE2 . TYR B 2 70 ? 16.385 26.262 56.740 1.00 45.81 ? 86 TYR R CE2 1 ATOM 1679 C CZ . TYR B 2 70 ? 17.419 25.838 57.556 1.00 47.89 ? 86 TYR R CZ 1 ATOM 1680 O OH . TYR B 2 70 ? 18.571 25.342 56.989 1.00 47.46 ? 86 TYR R OH 1 ATOM 1681 N N . LYS B 2 71 ? 15.816 29.872 58.811 1.00 48.42 ? 87 LYS R N 1 ATOM 1682 C CA . LYS B 2 71 ? 16.467 30.748 57.847 1.00 49.81 ? 87 LYS R CA 1 ATOM 1683 C C . LYS B 2 71 ? 17.934 30.377 57.722 1.00 48.79 ? 87 LYS R C 1 ATOM 1684 O O . LYS B 2 71 ? 18.608 30.137 58.720 1.00 48.97 ? 87 LYS R O 1 ATOM 1685 C CB . LYS B 2 71 ? 16.343 32.205 58.303 1.00 52.18 ? 87 LYS R CB 1 ATOM 1686 C CG . LYS B 2 71 ? 17.136 33.193 57.464 1.00 58.83 ? 87 LYS R CG 1 ATOM 1687 C CD . LYS B 2 71 ? 17.022 34.617 58.006 1.00 62.25 ? 87 LYS R CD 1 ATOM 1688 C CE . LYS B 2 71 ? 15.575 35.109 57.991 1.00 65.40 ? 87 LYS R CE 1 ATOM 1689 N NZ . LYS B 2 71 ? 15.435 36.523 58.458 1.00 66.76 ? 87 LYS R NZ 1 ATOM 1690 N N . VAL B 2 72 ? 18.425 30.314 56.490 1.00 46.74 ? 88 VAL R N 1 ATOM 1691 C CA . VAL B 2 72 ? 19.823 29.991 56.259 1.00 43.33 ? 88 VAL R CA 1 ATOM 1692 C C . VAL B 2 72 ? 20.287 30.738 55.010 1.00 42.84 ? 88 VAL R C 1 ATOM 1693 O O . VAL B 2 72 ? 19.555 30.832 54.027 1.00 41.27 ? 88 VAL R O 1 ATOM 1694 C CB . VAL B 2 72 ? 20.029 28.459 56.096 1.00 43.09 ? 88 VAL R CB 1 ATOM 1695 C CG1 . VAL B 2 72 ? 19.391 27.965 54.802 1.00 42.61 ? 88 VAL R CG1 1 ATOM 1696 C CG2 . VAL B 2 72 ? 21.512 28.129 56.137 1.00 41.80 ? 88 VAL R CG2 1 ATOM 1697 N N . ASP B 2 73 ? 21.492 31.295 55.069 1.00 42.77 ? 89 ASP R N 1 ATOM 1698 C CA . ASP B 2 73 ? 22.045 32.042 53.947 1.00 43.81 ? 89 ASP R CA 1 ATOM 1699 C C . ASP B 2 73 ? 23.210 31.286 53.333 1.00 42.39 ? 89 ASP R C 1 ATOM 1700 O O . ASP B 2 73 ? 24.078 30.786 54.043 1.00 43.84 ? 89 ASP R O 1 ATOM 1701 C CB . ASP B 2 73 ? 22.527 33.426 54.400 1.00 46.95 ? 89 ASP R CB 1 ATOM 1702 C CG . ASP B 2 73 ? 21.405 34.283 54.962 1.00 51.31 ? 89 ASP R CG 1 ATOM 1703 O OD1 . ASP B 2 73 ? 20.330 34.359 54.328 1.00 51.29 ? 89 ASP R OD1 1 ATOM 1704 O OD2 . ASP B 2 73 ? 21.601 34.891 56.037 1.00 55.20 ? 89 ASP R OD2 1 ATOM 1705 N N . LYS B 2 74 ? 23.217 31.197 52.010 1.00 40.44 ? 90 LYS R N 1 ATOM 1706 C CA . LYS B 2 74 ? 24.283 30.509 51.299 1.00 39.67 ? 90 LYS R CA 1 ATOM 1707 C C . LYS B 2 74 ? 25.169 31.537 50.598 1.00 39.27 ? 90 LYS R C 1 ATOM 1708 O O . LYS B 2 74 ? 24.723 32.286 49.728 1.00 36.80 ? 90 LYS R O 1 ATOM 1709 C CB . LYS B 2 74 ? 23.690 29.523 50.291 1.00 39.35 ? 90 LYS R CB 1 ATOM 1710 C CG . LYS B 2 74 ? 22.843 28.423 50.942 1.00 41.84 ? 90 LYS R CG 1 ATOM 1711 C CD . LYS B 2 74 ? 23.679 27.579 51.899 1.00 42.27 ? 90 LYS R CD 1 ATOM 1712 C CE . LYS B 2 74 ? 22.844 26.486 52.555 1.00 44.96 ? 90 LYS R CE 1 ATOM 1713 N NZ . LYS B 2 74 ? 23.657 25.639 53.473 1.00 43.29 ? 90 LYS R NZ 1 ATOM 1714 N N . TYR B 2 75 ? 26.433 31.556 51.001 1.00 40.82 ? 91 TYR R N 1 ATOM 1715 C CA . TYR B 2 75 ? 27.431 32.480 50.477 1.00 41.12 ? 91 TYR R CA 1 ATOM 1716 C C . TYR B 2 75 ? 28.082 32.016 49.177 1.00 41.32 ? 91 TYR R C 1 ATOM 1717 O O . TYR B 2 75 ? 28.328 30.826 48.976 1.00 42.72 ? 91 TYR R O 1 ATOM 1718 C CB . TYR B 2 75 ? 28.515 32.682 51.546 1.00 42.58 ? 91 TYR R CB 1 ATOM 1719 C CG . TYR B 2 75 ? 29.766 33.395 51.075 1.00 44.20 ? 91 TYR R CG 1 ATOM 1720 C CD1 . TYR B 2 75 ? 29.858 34.787 51.113 1.00 45.55 ? 91 TYR R CD1 1 ATOM 1721 C CD2 . TYR B 2 75 ? 30.855 32.675 50.578 1.00 46.11 ? 91 TYR R CD2 1 ATOM 1722 C CE1 . TYR B 2 75 ? 31.009 35.446 50.669 1.00 46.80 ? 91 TYR R CE1 1 ATOM 1723 C CE2 . TYR B 2 75 ? 32.005 33.321 50.127 1.00 46.44 ? 91 TYR R CE2 1 ATOM 1724 C CZ . TYR B 2 75 ? 32.074 34.705 50.177 1.00 47.30 ? 91 TYR R CZ 1 ATOM 1725 O OH . TYR B 2 75 ? 33.205 35.343 49.731 1.00 50.58 ? 91 TYR R OH 1 ATOM 1726 N N . CYS B 2 76 ? 28.335 32.968 48.286 1.00 40.96 ? 92 CYS R N 1 ATOM 1727 C CA . CYS B 2 76 ? 29.028 32.703 47.029 1.00 41.12 ? 92 CYS R CA 1 ATOM 1728 C C . CYS B 2 76 ? 29.999 33.865 46.857 1.00 40.57 ? 92 CYS R C 1 ATOM 1729 O O . CYS B 2 76 ? 29.642 35.012 47.122 1.00 38.62 ? 92 CYS R O 1 ATOM 1730 C CB . CYS B 2 76 ? 28.081 32.655 45.837 1.00 41.76 ? 92 CYS R CB 1 ATOM 1731 S SG . CYS B 2 76 ? 28.960 32.120 44.327 1.00 52.69 ? 92 CYS R SG 1 ATOM 1732 N N . THR B 2 77 ? 31.214 33.573 46.406 1.00 39.84 ? 93 THR R N 1 ATOM 1733 C CA . THR B 2 77 ? 32.239 34.604 46.253 1.00 43.26 ? 93 THR R CA 1 ATOM 1734 C C . THR B 2 77 ? 31.981 35.747 45.271 1.00 41.77 ? 93 THR R C 1 ATOM 1735 O O . THR B 2 77 ? 32.318 36.897 45.551 1.00 45.52 ? 93 THR R O 1 ATOM 1736 C CB . THR B 2 77 ? 33.599 33.982 45.885 1.00 44.63 ? 93 THR R CB 1 ATOM 1737 O OG1 . THR B 2 77 ? 34.546 35.034 45.653 1.00 50.83 ? 93 THR R OG1 1 ATOM 1738 C CG2 . THR B 2 77 ? 33.478 33.133 44.633 1.00 44.83 ? 93 THR R CG2 1 ATOM 1739 N N . GLY B 2 78 ? 31.391 35.440 44.126 1.00 39.05 ? 94 GLY R N 1 ATOM 1740 C CA . GLY B 2 78 ? 31.144 36.473 43.132 1.00 35.22 ? 94 GLY R CA 1 ATOM 1741 C C . GLY B 2 78 ? 30.968 35.774 41.802 1.00 33.14 ? 94 GLY R C 1 ATOM 1742 O O . GLY B 2 78 ? 31.778 34.923 41.439 1.00 31.86 ? 94 GLY R O 1 ATOM 1743 N N . LEU B 2 79 ? 29.919 36.124 41.072 1.00 31.21 ? 95 LEU R N 1 ATOM 1744 C CA . LEU B 2 79 ? 29.642 35.468 39.805 1.00 33.08 ? 95 LEU R CA 1 ATOM 1745 C C . LEU B 2 79 ? 30.759 35.524 38.755 1.00 34.08 ? 95 LEU R C 1 ATOM 1746 O O . LEU B 2 79 ? 30.979 34.545 38.045 1.00 35.34 ? 95 LEU R O 1 ATOM 1747 C CB . LEU B 2 79 ? 28.336 36.009 39.214 1.00 32.20 ? 95 LEU R CB 1 ATOM 1748 C CG . LEU B 2 79 ? 27.746 35.188 38.065 1.00 34.93 ? 95 LEU R CG 1 ATOM 1749 C CD1 . LEU B 2 79 ? 27.661 33.719 38.453 1.00 33.96 ? 95 LEU R CD1 1 ATOM 1750 C CD2 . LEU B 2 79 ? 26.368 35.723 37.722 1.00 35.46 ? 95 LEU R CD2 1 ATOM 1751 N N . CYS B 2 80 ? 31.462 36.647 38.638 1.00 33.96 ? 96 CYS R N 1 ATOM 1752 C CA . CYS B 2 80 ? 32.536 36.723 37.650 1.00 36.22 ? 96 CYS R CA 1 ATOM 1753 C C . CYS B 2 80 ? 33.617 35.690 37.970 1.00 35.31 ? 96 CYS R C 1 ATOM 1754 O O . CYS B 2 80 ? 34.292 35.187 37.078 1.00 34.81 ? 96 CYS R O 1 ATOM 1755 C CB . CYS B 2 80 ? 33.147 38.131 37.607 1.00 39.91 ? 96 CYS R CB 1 ATOM 1756 S SG . CYS B 2 80 ? 32.016 39.445 37.015 1.00 48.43 ? 96 CYS R SG 1 ATOM 1757 N N . ILE B 2 81 ? 33.768 35.363 39.248 1.00 35.07 ? 97 ILE R N 1 ATOM 1758 C CA . ILE B 2 81 ? 34.762 34.386 39.669 1.00 36.04 ? 97 ILE R CA 1 ATOM 1759 C C . ILE B 2 81 ? 34.268 32.956 39.479 1.00 36.19 ? 97 ILE R C 1 ATOM 1760 O O . ILE B 2 81 ? 35.017 32.085 39.038 1.00 35.63 ? 97 ILE R O 1 ATOM 1761 C CB . ILE B 2 81 ? 35.128 34.582 41.157 1.00 39.00 ? 97 ILE R CB 1 ATOM 1762 C CG1 . ILE B 2 81 ? 35.775 35.954 41.351 1.00 39.67 ? 97 ILE R CG1 1 ATOM 1763 C CG2 . ILE B 2 81 ? 36.068 33.476 41.623 1.00 38.33 ? 97 ILE R CG2 1 ATOM 1764 C CD1 . ILE B 2 81 ? 35.753 36.433 42.782 1.00 40.14 ? 97 ILE R CD1 1 ATOM 1765 N N . GLU B 2 82 ? 32.999 32.724 39.794 1.00 35.26 ? 98 GLU R N 1 ATOM 1766 C CA . GLU B 2 82 ? 32.408 31.390 39.699 1.00 36.60 ? 98 GLU R CA 1 ATOM 1767 C C . GLU B 2 82 ? 31.953 30.926 38.324 1.00 33.85 ? 98 GLU R C 1 ATOM 1768 O O . GLU B 2 82 ? 31.975 29.734 38.037 1.00 34.46 ? 98 GLU R O 1 ATOM 1769 C CB . GLU B 2 82 ? 31.208 31.283 40.654 1.00 40.82 ? 98 GLU R CB 1 ATOM 1770 C CG . GLU B 2 82 ? 31.577 31.332 42.117 1.00 49.85 ? 98 GLU R CG 1 ATOM 1771 C CD . GLU B 2 82 ? 32.549 30.230 42.493 1.00 53.96 ? 98 GLU R CD 1 ATOM 1772 O OE1 . GLU B 2 82 ? 32.259 29.054 42.179 1.00 56.30 ? 98 GLU R OE1 1 ATOM 1773 O OE2 . GLU B 2 82 ? 33.598 30.537 43.101 1.00 57.46 ? 98 GLU R OE2 1 ATOM 1774 N N . VAL B 2 83 ? 31.530 31.856 37.478 1.00 32.88 ? 99 VAL R N 1 ATOM 1775 C CA . VAL B 2 83 ? 31.018 31.490 36.169 1.00 33.73 ? 99 VAL R CA 1 ATOM 1776 C C . VAL B 2 83 ? 31.987 30.690 35.300 1.00 34.99 ? 99 VAL R C 1 ATOM 1777 O O . VAL B 2 83 ? 33.183 30.975 35.250 1.00 34.92 ? 99 VAL R O 1 ATOM 1778 C CB . VAL B 2 83 ? 30.534 32.751 35.390 1.00 34.21 ? 99 VAL R CB 1 ATOM 1779 C CG1 . VAL B 2 83 ? 31.730 33.597 34.936 1.00 33.99 ? 99 VAL R CG1 1 ATOM 1780 C CG2 . VAL B 2 83 ? 29.685 32.335 34.203 1.00 33.50 ? 99 VAL R CG2 1 ATOM 1781 N N . LYS B 2 84 ? 31.453 29.669 34.639 1.00 35.40 ? 100 LYS R N 1 ATOM 1782 C CA . LYS B 2 84 ? 32.221 28.821 33.736 1.00 37.22 ? 100 LYS R CA 1 ATOM 1783 C C . LYS B 2 84 ? 31.804 29.260 32.338 1.00 37.18 ? 100 LYS R C 1 ATOM 1784 O O . LYS B 2 84 ? 30.653 29.643 32.120 1.00 38.43 ? 100 LYS R O 1 ATOM 1785 C CB . LYS B 2 84 ? 31.873 27.344 33.935 1.00 38.94 ? 100 LYS R CB 1 ATOM 1786 C CG . LYS B 2 84 ? 32.120 26.832 35.343 1.00 44.71 ? 100 LYS R CG 1 ATOM 1787 C CD . LYS B 2 84 ? 31.780 25.353 35.465 1.00 49.00 ? 100 LYS R CD 1 ATOM 1788 C CE . LYS B 2 84 ? 31.741 24.914 36.928 1.00 52.77 ? 100 LYS R CE 1 ATOM 1789 N NZ . LYS B 2 84 ? 33.015 25.225 37.645 1.00 55.39 ? 100 LYS R NZ 1 ATOM 1790 N N . ILE B 2 85 ? 32.735 29.211 31.395 1.00 35.89 ? 101 ILE R N 1 ATOM 1791 C CA . ILE B 2 85 ? 32.447 29.632 30.034 1.00 34.95 ? 101 ILE R CA 1 ATOM 1792 C C . ILE B 2 85 ? 32.443 28.433 29.104 1.00 35.68 ? 101 ILE R C 1 ATOM 1793 O O . ILE B 2 85 ? 33.418 27.686 29.036 1.00 35.47 ? 101 ILE R O 1 ATOM 1794 C CB . ILE B 2 85 ? 33.496 30.658 29.546 1.00 34.05 ? 101 ILE R CB 1 ATOM 1795 C CG1 . ILE B 2 85 ? 33.568 31.834 30.529 1.00 31.63 ? 101 ILE R CG1 1 ATOM 1796 C CG2 . ILE B 2 85 ? 33.152 31.134 28.147 1.00 31.33 ? 101 ILE R CG2 1 ATOM 1797 C CD1 . ILE B 2 85 ? 32.270 32.633 30.649 1.00 31.21 ? 101 ILE R CD1 1 ATOM 1798 N N . GLY B 2 86 ? 31.336 28.257 28.391 1.00 37.07 ? 102 GLY R N 1 ATOM 1799 C CA . GLY B 2 86 ? 31.208 27.139 27.474 1.00 38.25 ? 102 GLY R CA 1 ATOM 1800 C C . GLY B 2 86 ? 32.076 27.296 26.240 1.00 39.22 ? 102 GLY R C 1 ATOM 1801 O O . GLY B 2 86 ? 32.700 28.343 26.046 1.00 37.95 ? 102 GLY R O 1 ATOM 1802 N N . PRO B 2 87 ? 32.125 26.273 25.373 1.00 39.28 ? 103 PRO R N 1 ATOM 1803 C CA . PRO B 2 87 ? 32.931 26.303 24.149 1.00 38.90 ? 103 PRO R CA 1 ATOM 1804 C C . PRO B 2 87 ? 32.345 27.191 23.060 1.00 38.39 ? 103 PRO R C 1 ATOM 1805 O O . PRO B 2 87 ? 31.152 27.464 23.050 1.00 38.69 ? 103 PRO R O 1 ATOM 1806 C CB . PRO B 2 87 ? 32.948 24.841 23.724 1.00 39.95 ? 103 PRO R CB 1 ATOM 1807 C CG . PRO B 2 87 ? 31.531 24.413 24.067 1.00 40.99 ? 103 PRO R CG 1 ATOM 1808 C CD . PRO B 2 87 ? 31.332 25.029 25.451 1.00 39.42 ? 103 PRO R CD 1 ATOM 1809 N N . PRO B 2 88 ? 33.188 27.669 22.131 1.00 38.50 ? 104 PRO R N 1 ATOM 1810 C CA . PRO B 2 88 ? 32.680 28.517 21.051 1.00 38.43 ? 104 PRO R CA 1 ATOM 1811 C C . PRO B 2 88 ? 32.135 27.607 19.955 1.00 38.59 ? 104 PRO R C 1 ATOM 1812 O O . PRO B 2 88 ? 32.227 26.392 20.060 1.00 36.99 ? 104 PRO R O 1 ATOM 1813 C CB . PRO B 2 88 ? 33.924 29.268 20.594 1.00 36.57 ? 104 PRO R CB 1 ATOM 1814 C CG . PRO B 2 88 ? 34.993 28.241 20.761 1.00 36.52 ? 104 PRO R CG 1 ATOM 1815 C CD . PRO B 2 88 ? 34.663 27.636 22.122 1.00 37.61 ? 104 PRO R CD 1 ATOM 1816 N N . THR B 2 89 ? 31.570 28.199 18.912 1.00 41.31 ? 105 THR R N 1 ATOM 1817 C CA . THR B 2 89 ? 31.042 27.438 17.784 1.00 44.63 ? 105 THR R CA 1 ATOM 1818 C C . THR B 2 89 ? 31.855 27.799 16.539 1.00 44.79 ? 105 THR R C 1 ATOM 1819 O O . THR B 2 89 ? 32.037 28.979 16.243 1.00 44.15 ? 105 THR R O 1 ATOM 1820 C CB . THR B 2 89 ? 29.558 27.781 17.524 1.00 45.36 ? 105 THR R CB 1 ATOM 1821 O OG1 . THR B 2 89 ? 28.755 27.272 18.595 1.00 50.60 ? 105 THR R OG1 1 ATOM 1822 C CG2 . THR B 2 89 ? 29.088 27.169 16.224 1.00 46.61 ? 105 THR R CG2 1 ATOM 1823 N N . VAL B 2 90 ? 32.347 26.793 15.818 1.00 45.76 ? 106 VAL R N 1 ATOM 1824 C CA . VAL B 2 90 ? 33.131 27.047 14.609 1.00 46.33 ? 106 VAL R CA 1 ATOM 1825 C C . VAL B 2 90 ? 32.398 26.662 13.330 1.00 46.57 ? 106 VAL R C 1 ATOM 1826 O O . VAL B 2 90 ? 31.737 25.624 13.268 1.00 47.00 ? 106 VAL R O 1 ATOM 1827 C CB . VAL B 2 90 ? 34.483 26.298 14.629 1.00 46.09 ? 106 VAL R CB 1 ATOM 1828 C CG1 . VAL B 2 90 ? 35.334 26.792 15.782 1.00 46.09 ? 106 VAL R CG1 1 ATOM 1829 C CG2 . VAL B 2 90 ? 34.251 24.805 14.744 1.00 47.33 ? 106 VAL R CG2 1 ATOM 1830 N N . THR B 2 91 ? 32.519 27.514 12.315 1.00 46.34 ? 107 THR R N 1 ATOM 1831 C CA . THR B 2 91 ? 31.895 27.286 11.015 1.00 47.13 ? 107 THR R CA 1 ATOM 1832 C C . THR B 2 91 ? 32.908 27.530 9.899 1.00 47.48 ? 107 THR R C 1 ATOM 1833 O O . THR B 2 91 ? 33.665 28.502 9.930 1.00 48.07 ? 107 THR R O 1 ATOM 1834 C CB . THR B 2 91 ? 30.687 28.226 10.779 1.00 48.77 ? 107 THR R CB 1 ATOM 1835 O OG1 . THR B 2 91 ? 29.674 27.972 11.762 1.00 50.92 ? 107 THR R OG1 1 ATOM 1836 C CG2 . THR B 2 91 ? 30.094 27.994 9.388 1.00 49.05 ? 107 THR R CG2 1 ATOM 1837 N N . LEU B 2 92 ? 32.911 26.639 8.917 1.00 46.80 ? 108 LEU R N 1 ATOM 1838 C CA . LEU B 2 92 ? 33.811 26.731 7.774 1.00 46.51 ? 108 LEU R CA 1 ATOM 1839 C C . LEU B 2 92 ? 32.958 26.970 6.527 1.00 47.06 ? 108 LEU R C 1 ATOM 1840 O O . LEU B 2 92 ? 32.058 26.182 6.228 1.00 46.86 ? 108 LEU R O 1 ATOM 1841 C CB . LEU B 2 92 ? 34.595 25.425 7.645 1.00 46.68 ? 108 LEU R CB 1 ATOM 1842 C CG . LEU B 2 92 ? 36.125 25.407 7.743 1.00 48.19 ? 108 LEU R CG 1 ATOM 1843 C CD1 . LEU B 2 92 ? 36.647 26.496 8.666 1.00 47.67 ? 108 LEU R CD1 1 ATOM 1844 C CD2 . LEU B 2 92 ? 36.553 24.028 8.226 1.00 46.28 ? 108 LEU R CD2 1 ATOM 1845 N N . THR B 2 93 ? 33.230 28.059 5.812 1.00 45.98 ? 109 THR R N 1 ATOM 1846 C CA . THR B 2 93 ? 32.478 28.400 4.605 1.00 46.42 ? 109 THR R CA 1 ATOM 1847 C C . THR B 2 93 ? 33.418 28.541 3.411 1.00 47.90 ? 109 THR R C 1 ATOM 1848 O O . THR B 2 93 ? 34.477 29.165 3.520 1.00 47.75 ? 109 THR R O 1 ATOM 1849 C CB . THR B 2 93 ? 31.725 29.728 4.780 1.00 46.29 ? 109 THR R CB 1 ATOM 1850 O OG1 . THR B 2 93 ? 30.940 29.679 5.977 1.00 46.32 ? 109 THR R OG1 1 ATOM 1851 C CG2 . THR B 2 93 ? 30.809 29.981 3.591 1.00 46.75 ? 109 THR R CG2 1 ATOM 1852 N N . GLU B 2 94 ? 33.043 27.971 2.268 1.00 48.45 ? 110 GLU R N 1 ATOM 1853 C CA . GLU B 2 94 ? 33.907 28.071 1.098 1.00 49.52 ? 110 GLU R CA 1 ATOM 1854 C C . GLU B 2 94 ? 33.493 29.194 0.157 1.00 48.11 ? 110 GLU R C 1 ATOM 1855 O O . GLU B 2 94 ? 32.308 29.413 -0.092 1.00 47.26 ? 110 GLU R O 1 ATOM 1856 C CB . GLU B 2 94 ? 33.944 26.756 0.311 1.00 52.49 ? 110 GLU R CB 1 ATOM 1857 C CG . GLU B 2 94 ? 35.242 26.586 -0.487 1.00 56.92 ? 110 GLU R CG 1 ATOM 1858 C CD . GLU B 2 94 ? 35.209 25.439 -1.489 1.00 61.05 ? 110 GLU R CD 1 ATOM 1859 O OE1 . GLU B 2 94 ? 34.601 24.387 -1.182 1.00 63.38 ? 110 GLU R OE1 1 ATOM 1860 O OE2 . GLU B 2 94 ? 35.812 25.585 -2.580 1.00 61.30 ? 110 GLU R OE2 1 ATOM 1861 N N . TYR B 2 95 ? 34.492 29.908 -0.350 1.00 48.06 ? 111 TYR R N 1 ATOM 1862 C CA . TYR B 2 95 ? 34.281 31.000 -1.289 1.00 47.85 ? 111 TYR R CA 1 ATOM 1863 C C . TYR B 2 95 ? 35.095 30.696 -2.535 1.00 46.98 ? 111 TYR R C 1 ATOM 1864 O O . TYR B 2 95 ? 35.904 29.769 -2.543 1.00 46.46 ? 111 TYR R O 1 ATOM 1865 C CB . TYR B 2 95 ? 34.729 32.325 -0.670 1.00 47.06 ? 111 TYR R CB 1 ATOM 1866 C CG . TYR B 2 95 ? 33.795 32.807 0.408 1.00 47.80 ? 111 TYR R CG 1 ATOM 1867 C CD1 . TYR B 2 95 ? 32.694 33.601 0.095 1.00 47.20 ? 111 TYR R CD1 1 ATOM 1868 C CD2 . TYR B 2 95 ? 33.981 32.429 1.739 1.00 46.83 ? 111 TYR R CD2 1 ATOM 1869 C CE1 . TYR B 2 95 ? 31.797 34.008 1.078 1.00 48.38 ? 111 TYR R CE1 1 ATOM 1870 C CE2 . TYR B 2 95 ? 33.090 32.829 2.731 1.00 47.43 ? 111 TYR R CE2 1 ATOM 1871 C CZ . TYR B 2 95 ? 32.001 33.617 2.393 1.00 48.89 ? 111 TYR R CZ 1 ATOM 1872 O OH . TYR B 2 95 ? 31.116 34.014 3.366 1.00 51.32 ? 111 TYR R OH 1 ATOM 1873 N N . ASP B 2 96 ? 34.888 31.477 -3.585 1.00 48.42 ? 112 ASP R N 1 ATOM 1874 C CA . ASP B 2 96 ? 35.605 31.259 -4.832 1.00 49.41 ? 112 ASP R CA 1 ATOM 1875 C C . ASP B 2 96 ? 37.119 31.276 -4.683 1.00 47.53 ? 112 ASP R C 1 ATOM 1876 O O . ASP B 2 96 ? 37.807 30.437 -5.263 1.00 47.79 ? 112 ASP R O 1 ATOM 1877 C CB . ASP B 2 96 ? 35.193 32.307 -5.868 1.00 54.64 ? 112 ASP R CB 1 ATOM 1878 C CG . ASP B 2 96 ? 33.730 32.204 -6.251 1.00 59.96 ? 112 ASP R CG 1 ATOM 1879 O OD1 . ASP B 2 96 ? 33.282 32.987 -7.119 1.00 62.91 ? 112 ASP R OD1 1 ATOM 1880 O OD2 . ASP B 2 96 ? 33.024 31.341 -5.685 1.00 63.73 ? 112 ASP R OD2 1 ATOM 1881 N N . ASP B 2 97 ? 37.640 32.215 -3.896 1.00 45.59 ? 113 ASP R N 1 ATOM 1882 C CA . ASP B 2 97 ? 39.087 32.334 -3.736 1.00 43.12 ? 113 ASP R CA 1 ATOM 1883 C C . ASP B 2 97 ? 39.651 32.191 -2.322 1.00 41.25 ? 113 ASP R C 1 ATOM 1884 O O . ASP B 2 97 ? 40.765 32.641 -2.049 1.00 40.54 ? 113 ASP R O 1 ATOM 1885 C CB . ASP B 2 97 ? 39.556 33.665 -4.341 1.00 44.07 ? 113 ASP R CB 1 ATOM 1886 C CG . ASP B 2 97 ? 39.025 34.866 -3.585 1.00 45.02 ? 113 ASP R CG 1 ATOM 1887 O OD1 . ASP B 2 97 ? 38.158 34.676 -2.706 1.00 46.04 ? 113 ASP R OD1 1 ATOM 1888 O OD2 . ASP B 2 97 ? 39.469 35.999 -3.871 1.00 45.59 ? 113 ASP R OD2 1 ATOM 1889 N N . HIS B 2 98 ? 38.899 31.571 -1.421 1.00 39.91 ? 114 HIS R N 1 ATOM 1890 C CA . HIS B 2 98 ? 39.399 31.372 -0.061 1.00 40.12 ? 114 HIS R CA 1 ATOM 1891 C C . HIS B 2 98 ? 38.394 30.650 0.817 1.00 38.72 ? 114 HIS R C 1 ATOM 1892 O O . HIS B 2 98 ? 37.233 30.475 0.453 1.00 38.16 ? 114 HIS R O 1 ATOM 1893 C CB . HIS B 2 98 ? 39.756 32.718 0.590 1.00 37.83 ? 114 HIS R CB 1 ATOM 1894 C CG . HIS B 2 98 ? 38.564 33.561 0.923 1.00 36.14 ? 114 HIS R CG 1 ATOM 1895 N ND1 . HIS B 2 98 ? 37.856 33.419 2.098 1.00 37.64 ? 114 HIS R ND1 1 ATOM 1896 C CD2 . HIS B 2 98 ? 37.936 34.534 0.222 1.00 34.31 ? 114 HIS R CD2 1 ATOM 1897 C CE1 . HIS B 2 98 ? 36.844 34.268 2.106 1.00 36.59 ? 114 HIS R CE1 1 ATOM 1898 N NE2 . HIS B 2 98 ? 36.869 34.956 0.978 1.00 36.64 ? 114 HIS R NE2 1 ATOM 1899 N N . ILE B 2 99 ? 38.860 30.239 1.986 1.00 40.19 ? 115 ILE R N 1 ATOM 1900 C CA . ILE B 2 99 ? 38.013 29.560 2.952 1.00 39.54 ? 115 ILE R CA 1 ATOM 1901 C C . ILE B 2 99 ? 37.890 30.450 4.178 1.00 37.99 ? 115 ILE R C 1 ATOM 1902 O O . ILE B 2 99 ? 38.876 31.020 4.646 1.00 37.25 ? 115 ILE R O 1 ATOM 1903 C CB . ILE B 2 99 ? 38.629 28.220 3.388 1.00 41.92 ? 115 ILE R CB 1 ATOM 1904 C CG1 . ILE B 2 99 ? 38.809 27.308 2.170 1.00 40.81 ? 115 ILE R CG1 1 ATOM 1905 C CG2 . ILE B 2 99 ? 37.741 27.562 4.439 1.00 40.55 ? 115 ILE R CG2 1 ATOM 1906 C CD1 . ILE B 2 99 ? 39.647 26.086 2.461 1.00 41.99 ? 115 ILE R CD1 1 ATOM 1907 N N . ASN B 2 100 ? 36.678 30.577 4.696 1.00 38.36 ? 116 ASN R N 1 ATOM 1908 C CA . ASN B 2 100 ? 36.467 31.383 5.882 1.00 38.45 ? 116 ASN R CA 1 ATOM 1909 C C . ASN B 2 100 ? 36.181 30.540 7.120 1.00 39.20 ? 116 ASN R C 1 ATOM 1910 O O . ASN B 2 100 ? 35.322 29.651 7.097 1.00 39.11 ? 116 ASN R O 1 ATOM 1911 C CB . ASN B 2 100 ? 35.303 32.349 5.694 1.00 37.16 ? 116 ASN R CB 1 ATOM 1912 C CG . ASN B 2 100 ? 35.020 33.148 6.954 1.00 40.88 ? 116 ASN R CG 1 ATOM 1913 O OD1 . ASN B 2 100 ? 35.752 34.085 7.287 1.00 40.22 ? 116 ASN R OD1 1 ATOM 1914 N ND2 . ASN B 2 100 ? 33.971 32.766 7.677 1.00 39.30 ? 116 ASN R ND2 1 ATOM 1915 N N . LEU B 2 101 ? 36.922 30.819 8.190 1.00 37.25 ? 117 LEU R N 1 ATOM 1916 C CA . LEU B 2 101 ? 36.719 30.155 9.469 1.00 35.80 ? 117 LEU R CA 1 ATOM 1917 C C . LEU B 2 101 ? 36.015 31.191 10.328 1.00 36.64 ? 117 LEU R C 1 ATOM 1918 O O . LEU B 2 101 ? 36.505 32.315 10.478 1.00 35.45 ? 117 LEU R O 1 ATOM 1919 C CB . LEU B 2 101 ? 38.042 29.795 10.146 1.00 35.93 ? 117 LEU R CB 1 ATOM 1920 C CG . LEU B 2 101 ? 37.921 29.476 11.650 1.00 36.56 ? 117 LEU R CG 1 ATOM 1921 C CD1 . LEU B 2 101 ? 37.128 28.191 11.856 1.00 36.05 ? 117 LEU R CD1 1 ATOM 1922 C CD2 . LEU B 2 101 ? 39.300 29.339 12.264 1.00 36.34 ? 117 LEU R CD2 1 ATOM 1923 N N . TYR B 2 102 ? 34.861 30.833 10.871 1.00 36.23 ? 118 TYR R N 1 ATOM 1924 C CA . TYR B 2 102 ? 34.145 31.758 11.727 1.00 36.44 ? 118 TYR R CA 1 ATOM 1925 C C . TYR B 2 102 ? 33.968 31.153 13.111 1.00 36.71 ? 118 TYR R C 1 ATOM 1926 O O . TYR B 2 102 ? 33.434 30.057 13.256 1.00 35.49 ? 118 TYR R O 1 ATOM 1927 C CB . TYR B 2 102 ? 32.777 32.111 11.151 1.00 37.80 ? 118 TYR R CB 1 ATOM 1928 C CG . TYR B 2 102 ? 32.239 33.368 11.779 1.00 42.60 ? 118 TYR R CG 1 ATOM 1929 C CD1 . TYR B 2 102 ? 32.772 34.613 11.441 1.00 45.05 ? 118 TYR R CD1 1 ATOM 1930 C CD2 . TYR B 2 102 ? 31.265 33.316 12.777 1.00 44.15 ? 118 TYR R CD2 1 ATOM 1931 C CE1 . TYR B 2 102 ? 32.356 35.774 12.082 1.00 46.27 ? 118 TYR R CE1 1 ATOM 1932 C CE2 . TYR B 2 102 ? 30.841 34.472 13.429 1.00 44.41 ? 118 TYR R CE2 1 ATOM 1933 C CZ . TYR B 2 102 ? 31.394 35.697 13.077 1.00 46.29 ? 118 TYR R CZ 1 ATOM 1934 O OH . TYR B 2 102 ? 31.000 36.848 13.723 1.00 48.47 ? 118 TYR R OH 1 ATOM 1935 N N . ILE B 2 103 ? 34.444 31.867 14.126 1.00 37.44 ? 119 ILE R N 1 ATOM 1936 C CA . ILE B 2 103 ? 34.329 31.405 15.500 1.00 36.96 ? 119 ILE R CA 1 ATOM 1937 C C . ILE B 2 103 ? 33.309 32.285 16.197 1.00 38.79 ? 119 ILE R C 1 ATOM 1938 O O . ILE B 2 103 ? 33.523 33.487 16.354 1.00 38.58 ? 119 ILE R O 1 ATOM 1939 C CB . ILE B 2 103 ? 35.669 31.513 16.259 1.00 36.58 ? 119 ILE R CB 1 ATOM 1940 C CG1 . ILE B 2 103 ? 36.745 30.708 15.532 1.00 35.80 ? 119 ILE R CG1 1 ATOM 1941 C CG2 . ILE B 2 103 ? 35.510 30.971 17.687 1.00 36.40 ? 119 ILE R CG2 1 ATOM 1942 C CD1 . ILE B 2 103 ? 38.112 30.789 16.183 1.00 34.54 ? 119 ILE R CD1 1 ATOM 1943 N N . GLU B 2 104 ? 32.192 31.687 16.593 1.00 37.94 ? 120 GLU R N 1 ATOM 1944 C CA . GLU B 2 104 ? 31.149 32.420 17.290 1.00 39.41 ? 120 GLU R CA 1 ATOM 1945 C C . GLU B 2 104 ? 31.411 32.305 18.790 1.00 37.42 ? 120 GLU R C 1 ATOM 1946 O O . GLU B 2 104 ? 31.638 31.219 19.308 1.00 36.24 ? 120 GLU R O 1 ATOM 1947 C CB . GLU B 2 104 ? 29.781 31.838 16.946 1.00 43.26 ? 120 GLU R CB 1 ATOM 1948 C CG . GLU B 2 104 ? 28.617 32.589 17.559 1.00 51.07 ? 120 GLU R CG 1 ATOM 1949 C CD . GLU B 2 104 ? 27.283 31.943 17.233 1.00 56.36 ? 120 GLU R CD 1 ATOM 1950 O OE1 . GLU B 2 104 ? 27.037 30.813 17.710 1.00 58.03 ? 120 GLU R OE1 1 ATOM 1951 O OE2 . GLU B 2 104 ? 26.487 32.563 16.493 1.00 60.65 ? 120 GLU R OE2 1 ATOM 1952 N N . HIS B 2 105 ? 31.405 33.439 19.476 1.00 37.18 ? 121 HIS R N 1 ATOM 1953 C CA . HIS B 2 105 ? 31.647 33.470 20.912 1.00 38.25 ? 121 HIS R CA 1 ATOM 1954 C C . HIS B 2 105 ? 30.582 32.741 21.710 1.00 39.46 ? 121 HIS R C 1 ATOM 1955 O O . HIS B 2 105 ? 29.434 32.631 21.278 1.00 40.14 ? 121 HIS R O 1 ATOM 1956 C CB . HIS B 2 105 ? 31.660 34.910 21.418 1.00 36.48 ? 121 HIS R CB 1 ATOM 1957 C CG . HIS B 2 105 ? 32.722 35.763 20.808 1.00 36.23 ? 121 HIS R CG 1 ATOM 1958 N ND1 . HIS B 2 105 ? 32.452 36.989 20.239 1.00 36.03 ? 121 HIS R ND1 1 ATOM 1959 C CD2 . HIS B 2 105 ? 34.061 35.591 20.716 1.00 35.98 ? 121 HIS R CD2 1 ATOM 1960 C CE1 . HIS B 2 105 ? 33.580 37.535 19.823 1.00 34.93 ? 121 HIS R CE1 1 ATOM 1961 N NE2 . HIS B 2 105 ? 34.571 36.707 20.099 1.00 36.43 ? 121 HIS R NE2 1 ATOM 1962 N N . PRO B 2 106 ? 30.960 32.210 22.882 1.00 39.92 ? 122 PRO R N 1 ATOM 1963 C CA . PRO B 2 106 ? 29.976 31.520 23.716 1.00 40.34 ? 122 PRO R CA 1 ATOM 1964 C C . PRO B 2 106 ? 28.986 32.645 24.035 1.00 40.76 ? 122 PRO R C 1 ATOM 1965 O O . PRO B 2 106 ? 29.384 33.812 24.101 1.00 39.27 ? 122 PRO R O 1 ATOM 1966 C CB . PRO B 2 106 ? 30.784 31.129 24.948 1.00 40.05 ? 122 PRO R CB 1 ATOM 1967 C CG . PRO B 2 106 ? 32.159 30.934 24.402 1.00 41.61 ? 122 PRO R CG 1 ATOM 1968 C CD . PRO B 2 106 ? 32.314 32.089 23.447 1.00 39.65 ? 122 PRO R CD 1 ATOM 1969 N N . TYR B 2 107 ? 27.715 32.328 24.227 1.00 41.21 ? 123 TYR R N 1 ATOM 1970 C CA . TYR B 2 107 ? 26.764 33.391 24.517 1.00 44.12 ? 123 TYR R CA 1 ATOM 1971 C C . TYR B 2 107 ? 25.877 33.127 25.718 1.00 44.06 ? 123 TYR R C 1 ATOM 1972 O O . TYR B 2 107 ? 25.675 31.986 26.123 1.00 42.57 ? 123 TYR R O 1 ATOM 1973 C CB . TYR B 2 107 ? 25.890 33.665 23.282 1.00 46.38 ? 123 TYR R CB 1 ATOM 1974 C CG . TYR B 2 107 ? 25.113 32.460 22.803 1.00 50.57 ? 123 TYR R CG 1 ATOM 1975 C CD1 . TYR B 2 107 ? 23.949 32.049 23.456 1.00 51.87 ? 123 TYR R CD1 1 ATOM 1976 C CD2 . TYR B 2 107 ? 25.574 31.693 21.733 1.00 52.29 ? 123 TYR R CD2 1 ATOM 1977 C CE1 . TYR B 2 107 ? 23.266 30.901 23.059 1.00 53.96 ? 123 TYR R CE1 1 ATOM 1978 C CE2 . TYR B 2 107 ? 24.900 30.542 21.328 1.00 55.25 ? 123 TYR R CE2 1 ATOM 1979 C CZ . TYR B 2 107 ? 23.749 30.152 21.997 1.00 56.13 ? 123 TYR R CZ 1 ATOM 1980 O OH . TYR B 2 107 ? 23.091 29.004 21.613 1.00 58.92 ? 123 TYR R OH 1 ATOM 1981 N N . ALA B 2 108 ? 25.365 34.210 26.289 1.00 45.77 ? 124 ALA R N 1 ATOM 1982 C CA . ALA B 2 108 ? 24.455 34.139 27.417 1.00 49.54 ? 124 ALA R CA 1 ATOM 1983 C C . ALA B 2 108 ? 23.060 34.272 26.809 1.00 52.94 ? 124 ALA R C 1 ATOM 1984 O O . ALA B 2 108 ? 22.874 34.998 25.833 1.00 52.97 ? 124 ALA R O 1 ATOM 1985 C CB . ALA B 2 108 ? 24.718 35.289 28.380 1.00 45.46 ? 124 ALA R CB 1 ATOM 1986 N N . THR B 2 109 ? 22.088 33.564 27.367 1.00 57.71 ? 125 THR R N 1 ATOM 1987 C CA . THR B 2 109 ? 20.725 33.644 26.857 1.00 63.20 ? 125 THR R CA 1 ATOM 1988 C C . THR B 2 109 ? 19.817 34.359 27.848 1.00 66.16 ? 125 THR R C 1 ATOM 1989 O O . THR B 2 109 ? 19.369 33.766 28.829 1.00 67.15 ? 125 THR R O 1 ATOM 1990 C CB . THR B 2 109 ? 20.139 32.245 26.574 1.00 63.27 ? 125 THR R CB 1 ATOM 1991 O OG1 . THR B 2 109 ? 20.368 31.391 27.701 1.00 64.90 ? 125 THR R OG1 1 ATOM 1992 C CG2 . THR B 2 109 ? 20.778 31.640 25.337 1.00 64.56 ? 125 THR R CG2 1 ATOM 1993 N N . ARG B 2 110 ? 19.564 35.639 27.594 1.00 69.45 ? 126 ARG R N 1 ATOM 1994 C CA . ARG B 2 110 ? 18.692 36.428 28.452 1.00 72.99 ? 126 ARG R CA 1 ATOM 1995 C C . ARG B 2 110 ? 17.283 36.347 27.878 1.00 74.26 ? 126 ARG R C 1 ATOM 1996 O O . ARG B 2 110 ? 16.822 37.264 27.192 1.00 74.44 ? 126 ARG R O 1 ATOM 1997 C CB . ARG B 2 110 ? 19.153 37.888 28.504 1.00 75.41 ? 126 ARG R CB 1 ATOM 1998 C CG . ARG B 2 110 ? 18.298 38.766 29.412 1.00 79.18 ? 126 ARG R CG 1 ATOM 1999 C CD . ARG B 2 110 ? 18.848 40.185 29.530 1.00 82.21 ? 126 ARG R CD 1 ATOM 2000 N NE . ARG B 2 110 ? 18.040 41.008 30.433 1.00 84.70 ? 126 ARG R NE 1 ATOM 2001 C CZ . ARG B 2 110 ? 18.325 42.265 30.765 1.00 85.66 ? 126 ARG R CZ 1 ATOM 2002 N NH1 . ARG B 2 110 ? 19.405 42.859 30.270 1.00 85.96 ? 126 ARG R NH1 1 ATOM 2003 N NH2 . ARG B 2 110 ? 17.529 42.932 31.592 1.00 85.49 ? 126 ARG R NH2 1 ATOM 2004 N N . GLY B 2 111 ? 16.612 35.233 28.157 1.00 74.98 ? 127 GLY R N 1 ATOM 2005 C CA . GLY B 2 111 ? 15.265 35.027 27.662 1.00 75.39 ? 127 GLY R CA 1 ATOM 2006 C C . GLY B 2 111 ? 15.275 34.355 26.303 1.00 75.77 ? 127 GLY R C 1 ATOM 2007 O O . GLY B 2 111 ? 15.378 33.131 26.199 1.00 76.04 ? 127 GLY R O 1 ATOM 2008 N N . SER B 2 112 ? 15.166 35.163 25.256 1.00 75.65 ? 128 SER R N 1 ATOM 2009 C CA . SER B 2 112 ? 15.167 34.658 23.889 1.00 74.96 ? 128 SER R CA 1 ATOM 2010 C C . SER B 2 112 ? 16.337 35.276 23.135 1.00 73.85 ? 128 SER R C 1 ATOM 2011 O O . SER B 2 112 ? 16.700 34.827 22.048 1.00 73.48 ? 128 SER R O 1 ATOM 2012 C CB . SER B 2 112 ? 13.855 35.025 23.193 1.00 75.79 ? 128 SER R CB 1 ATOM 2013 O OG . SER B 2 112 ? 13.642 36.428 23.222 1.00 76.06 ? 128 SER R OG 1 ATOM 2014 N N . LYS B 2 113 ? 16.921 36.313 23.729 1.00 72.68 ? 129 LYS R N 1 ATOM 2015 C CA . LYS B 2 113 ? 18.048 37.016 23.129 1.00 71.26 ? 129 LYS R CA 1 ATOM 2016 C C . LYS B 2 113 ? 19.363 36.312 23.449 1.00 68.84 ? 129 LYS R C 1 ATOM 2017 O O . LYS B 2 113 ? 19.587 35.875 24.578 1.00 68.97 ? 129 LYS R O 1 ATOM 2018 C CB . LYS B 2 113 ? 18.116 38.454 23.654 1.00 72.70 ? 129 LYS R CB 1 ATOM 2019 C CG . LYS B 2 113 ? 16.807 39.228 23.566 1.00 75.24 ? 129 LYS R CG 1 ATOM 2020 C CD . LYS B 2 113 ? 16.348 39.422 22.125 1.00 77.27 ? 129 LYS R CD 1 ATOM 2021 C CE . LYS B 2 113 ? 15.026 40.186 22.069 1.00 78.23 ? 129 LYS R CE 1 ATOM 2022 N NZ . LYS B 2 113 ? 14.552 40.414 20.673 1.00 78.31 ? 129 LYS R NZ 1 ATOM 2023 N N . LYS B 2 114 ? 20.227 36.198 22.448 1.00 65.46 ? 130 LYS R N 1 ATOM 2024 C CA . LYS B 2 114 ? 21.529 35.575 22.640 1.00 61.96 ? 130 LYS R CA 1 ATOM 2025 C C . LYS B 2 114 ? 22.544 36.703 22.742 1.00 58.16 ? 130 LYS R C 1 ATOM 2026 O O . LYS B 2 114 ? 22.740 37.452 21.788 1.00 57.97 ? 130 LYS R O 1 ATOM 2027 C CB . LYS B 2 114 ? 21.869 34.661 21.461 1.00 62.98 ? 130 LYS R CB 1 ATOM 2028 C CG . LYS B 2 114 ? 20.914 33.491 21.290 1.00 65.09 ? 130 LYS R CG 1 ATOM 2029 C CD . LYS B 2 114 ? 21.353 32.579 20.155 1.00 66.90 ? 130 LYS R CD 1 ATOM 2030 C CE . LYS B 2 114 ? 20.327 31.483 19.894 1.00 68.53 ? 130 LYS R CE 1 ATOM 2031 N NZ . LYS B 2 114 ? 20.130 30.585 21.068 1.00 69.27 ? 130 LYS R NZ 1 ATOM 2032 N N . ILE B 2 115 ? 23.171 36.835 23.906 1.00 53.79 ? 131 ILE R N 1 ATOM 2033 C CA . ILE B 2 115 ? 24.155 37.888 24.127 1.00 50.58 ? 131 ILE R CA 1 ATOM 2034 C C . ILE B 2 115 ? 25.576 37.323 24.120 1.00 48.67 ? 131 ILE R C 1 ATOM 2035 O O . ILE B 2 115 ? 25.964 36.569 25.015 1.00 47.45 ? 131 ILE R O 1 ATOM 2036 C CB . ILE B 2 115 ? 23.916 38.599 25.477 1.00 50.71 ? 131 ILE R CB 1 ATOM 2037 C CG1 . ILE B 2 115 ? 22.440 38.987 25.619 1.00 53.24 ? 131 ILE R CG1 1 ATOM 2038 C CG2 . ILE B 2 115 ? 24.773 39.846 25.562 1.00 50.21 ? 131 ILE R CG2 1 ATOM 2039 C CD1 . ILE B 2 115 ? 21.959 40.008 24.602 1.00 54.55 ? 131 ILE R CD1 1 ATOM 2040 N N . PRO B 2 116 ? 26.371 37.679 23.099 1.00 47.33 ? 132 PRO R N 1 ATOM 2041 C CA . PRO B 2 116 ? 27.751 37.195 22.995 1.00 44.90 ? 132 PRO R CA 1 ATOM 2042 C C . PRO B 2 116 ? 28.585 37.624 24.193 1.00 41.31 ? 132 PRO R C 1 ATOM 2043 O O . PRO B 2 116 ? 28.533 38.775 24.613 1.00 39.89 ? 132 PRO R O 1 ATOM 2044 C CB . PRO B 2 116 ? 28.248 37.839 21.702 1.00 45.88 ? 132 PRO R CB 1 ATOM 2045 C CG . PRO B 2 116 ? 26.998 37.970 20.886 1.00 47.25 ? 132 PRO R CG 1 ATOM 2046 C CD . PRO B 2 116 ? 26.005 38.469 21.909 1.00 46.97 ? 132 PRO R CD 1 ATOM 2047 N N . ILE B 2 117 ? 29.345 36.690 24.748 1.00 40.09 ? 133 ILE R N 1 ATOM 2048 C CA . ILE B 2 117 ? 30.202 37.004 25.880 1.00 37.57 ? 133 ILE R CA 1 ATOM 2049 C C . ILE B 2 117 ? 31.519 37.521 25.306 1.00 37.81 ? 133 ILE R C 1 ATOM 2050 O O . ILE B 2 117 ? 32.453 36.754 25.056 1.00 37.49 ? 133 ILE R O 1 ATOM 2051 C CB . ILE B 2 117 ? 30.446 35.752 26.756 1.00 37.46 ? 133 ILE R CB 1 ATOM 2052 C CG1 . ILE B 2 117 ? 29.106 35.255 27.319 1.00 36.91 ? 133 ILE R CG1 1 ATOM 2053 C CG2 . ILE B 2 117 ? 31.396 36.085 27.905 1.00 34.32 ? 133 ILE R CG2 1 ATOM 2054 C CD1 . ILE B 2 117 ? 29.164 33.860 27.915 1.00 35.43 ? 133 ILE R CD1 1 ATOM 2055 N N . TYR B 2 118 ? 31.577 38.831 25.088 1.00 36.79 ? 134 TYR R N 1 ATOM 2056 C CA . TYR B 2 118 ? 32.766 39.463 24.533 1.00 35.75 ? 134 TYR R CA 1 ATOM 2057 C C . TYR B 2 118 ? 32.850 40.937 24.914 1.00 34.74 ? 134 TYR R C 1 ATOM 2058 O O . TYR B 2 118 ? 32.079 41.756 24.422 1.00 35.17 ? 134 TYR R O 1 ATOM 2059 C CB . TYR B 2 118 ? 32.755 39.331 23.005 1.00 36.14 ? 134 TYR R CB 1 ATOM 2060 C CG . TYR B 2 118 ? 33.968 39.918 22.312 1.00 34.82 ? 134 TYR R CG 1 ATOM 2061 C CD1 . TYR B 2 118 ? 35.166 39.210 22.245 1.00 35.09 ? 134 TYR R CD1 1 ATOM 2062 C CD2 . TYR B 2 118 ? 33.915 41.184 21.721 1.00 35.16 ? 134 TYR R CD2 1 ATOM 2063 C CE1 . TYR B 2 118 ? 36.287 39.743 21.604 1.00 36.15 ? 134 TYR R CE1 1 ATOM 2064 C CE2 . TYR B 2 118 ? 35.032 41.730 21.079 1.00 35.47 ? 134 TYR R CE2 1 ATOM 2065 C CZ . TYR B 2 118 ? 36.213 41.002 21.026 1.00 36.31 ? 134 TYR R CZ 1 ATOM 2066 O OH . TYR B 2 118 ? 37.324 41.532 20.411 1.00 37.69 ? 134 TYR R OH 1 ATOM 2067 N N . LYS B 2 119 ? 33.784 41.260 25.802 1.00 34.27 ? 135 LYS R N 1 ATOM 2068 C CA . LYS B 2 119 ? 34.018 42.634 26.242 1.00 36.55 ? 135 LYS R CA 1 ATOM 2069 C C . LYS B 2 119 ? 32.789 43.451 26.666 1.00 38.48 ? 135 LYS R C 1 ATOM 2070 O O . LYS B 2 119 ? 32.732 44.664 26.434 1.00 38.73 ? 135 LYS R O 1 ATOM 2071 C CB . LYS B 2 119 ? 34.780 43.396 25.148 1.00 36.02 ? 135 LYS R CB 1 ATOM 2072 C CG . LYS B 2 119 ? 36.108 42.750 24.762 1.00 36.67 ? 135 LYS R CG 1 ATOM 2073 C CD . LYS B 2 119 ? 36.841 43.545 23.681 1.00 38.26 ? 135 LYS R CD 1 ATOM 2074 C CE . LYS B 2 119 ? 38.126 42.836 23.248 1.00 37.55 ? 135 LYS R CE 1 ATOM 2075 N NZ . LYS B 2 119 ? 38.748 43.502 22.064 1.00 40.34 ? 135 LYS R NZ 1 ATOM 2076 N N . ARG B 2 120 ? 31.815 42.804 27.294 1.00 38.37 ? 136 ARG R N 1 ATOM 2077 C CA . ARG B 2 120 ? 30.623 43.520 27.746 1.00 39.32 ? 136 ARG R CA 1 ATOM 2078 C C . ARG B 2 120 ? 30.758 43.957 29.201 1.00 39.67 ? 136 ARG R C 1 ATOM 2079 O O . ARG B 2 120 ? 31.096 43.152 30.075 1.00 35.80 ? 136 ARG R O 1 ATOM 2080 C CB . ARG B 2 120 ? 29.378 42.644 27.598 1.00 40.99 ? 136 ARG R CB 1 ATOM 2081 C CG . ARG B 2 120 ? 28.929 42.433 26.161 1.00 44.43 ? 136 ARG R CG 1 ATOM 2082 C CD . ARG B 2 120 ? 27.636 41.649 26.126 1.00 47.41 ? 136 ARG R CD 1 ATOM 2083 N NE . ARG B 2 120 ? 26.549 42.365 26.792 1.00 49.90 ? 136 ARG R NE 1 ATOM 2084 C CZ . ARG B 2 120 ? 25.689 43.173 26.178 1.00 50.12 ? 136 ARG R CZ 1 ATOM 2085 N NH1 . ARG B 2 120 ? 25.774 43.376 24.869 1.00 49.83 ? 136 ARG R NH1 1 ATOM 2086 N NH2 . ARG B 2 120 ? 24.748 43.788 26.877 1.00 48.60 ? 136 ARG R NH2 1 ATOM 2087 N N . ASN B 2 121 ? 30.495 45.234 29.458 1.00 41.24 ? 137 ASN R N 1 ATOM 2088 C CA . ASN B 2 121 ? 30.579 45.770 30.809 1.00 44.52 ? 137 ASN R CA 1 ATOM 2089 C C . ASN B 2 121 ? 29.582 45.094 31.737 1.00 43.81 ? 137 ASN R C 1 ATOM 2090 O O . ASN B 2 121 ? 29.815 45.014 32.937 1.00 43.87 ? 137 ASN R O 1 ATOM 2091 C CB . ASN B 2 121 ? 30.334 47.282 30.808 1.00 48.57 ? 137 ASN R CB 1 ATOM 2092 C CG . ASN B 2 121 ? 31.531 48.069 30.294 1.00 54.14 ? 137 ASN R CG 1 ATOM 2093 O OD1 . ASN B 2 121 ? 31.416 49.254 29.966 1.00 57.77 ? 137 ASN R OD1 1 ATOM 2094 N ND2 . ASN B 2 121 ? 32.689 47.416 30.230 1.00 54.91 ? 137 ASN R ND2 1 ATOM 2095 N N . ASP B 2 122 ? 28.476 44.599 31.190 1.00 44.53 ? 138 ASP R N 1 ATOM 2096 C CA . ASP B 2 122 ? 27.488 43.939 32.032 1.00 46.36 ? 138 ASP R CA 1 ATOM 2097 C C . ASP B 2 122 ? 27.808 42.463 32.243 1.00 46.84 ? 138 ASP R C 1 ATOM 2098 O O . ASP B 2 122 ? 27.055 41.747 32.897 1.00 46.53 ? 138 ASP R O 1 ATOM 2099 C CB . ASP B 2 122 ? 26.068 44.105 31.464 1.00 46.79 ? 138 ASP R CB 1 ATOM 2100 C CG . ASP B 2 122 ? 25.874 43.408 30.134 1.00 49.09 ? 138 ASP R CG 1 ATOM 2101 O OD1 . ASP B 2 122 ? 26.695 42.539 29.776 1.00 50.02 ? 138 ASP R OD1 1 ATOM 2102 O OD2 . ASP B 2 122 ? 24.878 43.722 29.447 1.00 51.35 ? 138 ASP R OD2 1 ATOM 2103 N N . MET B 2 123 ? 28.924 42.007 31.682 1.00 47.72 ? 139 MET R N 1 ATOM 2104 C CA . MET B 2 123 ? 29.343 40.621 31.857 1.00 48.46 ? 139 MET R CA 1 ATOM 2105 C C . MET B 2 123 ? 30.833 40.486 32.161 1.00 48.72 ? 139 MET R C 1 ATOM 2106 O O . MET B 2 123 ? 31.557 39.752 31.489 1.00 50.95 ? 139 MET R O 1 ATOM 2107 C CB . MET B 2 123 ? 28.969 39.767 30.640 1.00 48.33 ? 139 MET R CB 1 ATOM 2108 C CG . MET B 2 123 ? 27.477 39.469 30.556 1.00 53.07 ? 139 MET R CG 1 ATOM 2109 S SD . MET B 2 123 ? 27.041 38.108 29.451 1.00 54.96 ? 139 MET R SD 1 ATOM 2110 C CE . MET B 2 123 ? 27.053 38.939 27.879 1.00 53.85 ? 139 MET R CE 1 ATOM 2111 N N . CYS B 2 124 ? 31.277 41.223 33.174 1.00 47.44 ? 140 CYS R N 1 ATOM 2112 C CA . CYS B 2 124 ? 32.659 41.182 33.645 1.00 48.16 ? 140 CYS R CA 1 ATOM 2113 C C . CYS B 2 124 ? 33.742 41.615 32.643 1.00 47.27 ? 140 CYS R C 1 ATOM 2114 O O . CYS B 2 124 ? 34.930 41.509 32.945 1.00 45.32 ? 140 CYS R O 1 ATOM 2115 C CB . CYS B 2 124 ? 32.975 39.764 34.141 1.00 48.27 ? 140 CYS R CB 1 ATOM 2116 S SG . CYS B 2 124 ? 31.638 38.938 35.085 1.00 50.92 ? 140 CYS R SG 1 ATOM 2117 N N . ASP B 2 125 ? 33.339 42.112 31.474 1.00 45.58 ? 141 ASP R N 1 ATOM 2118 C CA . ASP B 2 125 ? 34.284 42.525 30.435 1.00 45.20 ? 141 ASP R CA 1 ATOM 2119 C C . ASP B 2 125 ? 35.134 41.347 29.976 1.00 43.37 ? 141 ASP R C 1 ATOM 2120 O O . ASP B 2 125 ? 36.260 41.508 29.501 1.00 44.09 ? 141 ASP R O 1 ATOM 2121 C CB . ASP B 2 125 ? 35.192 43.654 30.930 1.00 49.45 ? 141 ASP R CB 1 ATOM 2122 C CG . ASP B 2 125 ? 34.593 45.024 30.688 1.00 53.99 ? 141 ASP R CG 1 ATOM 2123 O OD1 . ASP B 2 125 ? 34.306 45.340 29.512 1.00 56.10 ? 141 ASP R OD1 1 ATOM 2124 O OD2 . ASP B 2 125 ? 34.406 45.782 31.665 1.00 57.24 ? 141 ASP R OD2 1 ATOM 2125 N N . ILE B 2 126 ? 34.573 40.158 30.131 1.00 39.99 ? 142 ILE R N 1 ATOM 2126 C CA . ILE B 2 126 ? 35.230 38.924 29.741 1.00 38.31 ? 142 ILE R CA 1 ATOM 2127 C C . ILE B 2 126 ? 35.301 38.783 28.224 1.00 37.23 ? 142 ILE R C 1 ATOM 2128 O O . ILE B 2 126 ? 34.356 39.126 27.516 1.00 36.52 ? 142 ILE R O 1 ATOM 2129 C CB . ILE B 2 126 ? 34.447 37.699 30.269 1.00 37.33 ? 142 ILE R CB 1 ATOM 2130 C CG1 . ILE B 2 126 ? 34.593 37.590 31.784 1.00 39.62 ? 142 ILE R CG1 1 ATOM 2131 C CG2 . ILE B 2 126 ? 34.919 36.431 29.582 1.00 37.29 ? 142 ILE R CG2 1 ATOM 2132 C CD1 . ILE B 2 126 ? 33.783 36.448 32.373 1.00 41.15 ? 142 ILE R CD1 1 ATOM 2133 N N . TYR B 2 127 ? 36.433 38.291 27.734 1.00 35.17 ? 143 TYR R N 1 ATOM 2134 C CA . TYR B 2 127 ? 36.586 38.015 26.315 1.00 34.43 ? 143 TYR R CA 1 ATOM 2135 C C . TYR B 2 127 ? 37.649 36.942 26.190 1.00 33.03 ? 143 TYR R C 1 ATOM 2136 O O . TYR B 2 127 ? 38.619 36.914 26.951 1.00 32.95 ? 143 TYR R O 1 ATOM 2137 C CB . TYR B 2 127 ? 36.922 39.280 25.503 1.00 31.76 ? 143 TYR R CB 1 ATOM 2138 C CG . TYR B 2 127 ? 38.347 39.774 25.541 1.00 33.28 ? 143 TYR R CG 1 ATOM 2139 C CD1 . TYR B 2 127 ? 39.264 39.389 24.563 1.00 34.64 ? 143 TYR R CD1 1 ATOM 2140 C CD2 . TYR B 2 127 ? 38.754 40.703 26.498 1.00 32.98 ? 143 TYR R CD2 1 ATOM 2141 C CE1 . TYR B 2 127 ? 40.554 39.929 24.530 1.00 35.48 ? 143 TYR R CE1 1 ATOM 2142 C CE2 . TYR B 2 127 ? 40.034 41.245 26.478 1.00 33.85 ? 143 TYR R CE2 1 ATOM 2143 C CZ . TYR B 2 127 ? 40.927 40.859 25.489 1.00 36.24 ? 143 TYR R CZ 1 ATOM 2144 O OH . TYR B 2 127 ? 42.174 41.431 25.443 1.00 36.73 ? 143 TYR R OH 1 ATOM 2145 N N . LEU B 2 128 ? 37.436 36.036 25.249 1.00 32.23 ? 144 LEU R N 1 ATOM 2146 C CA . LEU B 2 128 ? 38.344 34.925 25.039 1.00 33.99 ? 144 LEU R CA 1 ATOM 2147 C C . LEU B 2 128 ? 39.394 35.137 23.954 1.00 35.12 ? 144 LEU R C 1 ATOM 2148 O O . LEU B 2 128 ? 39.136 35.769 22.930 1.00 35.08 ? 144 LEU R O 1 ATOM 2149 C CB . LEU B 2 128 ? 37.536 33.673 24.687 1.00 31.30 ? 144 LEU R CB 1 ATOM 2150 C CG . LEU B 2 128 ? 36.463 33.224 25.685 1.00 33.37 ? 144 LEU R CG 1 ATOM 2151 C CD1 . LEU B 2 128 ? 35.609 32.137 25.058 1.00 30.69 ? 144 LEU R CD1 1 ATOM 2152 C CD2 . LEU B 2 128 ? 37.123 32.725 26.964 1.00 31.69 ? 144 LEU R CD2 1 ATOM 2153 N N . LEU B 2 129 ? 40.581 34.604 24.208 1.00 34.15 ? 145 LEU R N 1 ATOM 2154 C CA . LEU B 2 129 ? 41.666 34.626 23.247 1.00 35.27 ? 145 LEU R CA 1 ATOM 2155 C C . LEU B 2 129 ? 41.590 33.197 22.734 1.00 34.74 ? 145 LEU R C 1 ATOM 2156 O O . LEU B 2 129 ? 41.714 32.250 23.510 1.00 33.43 ? 145 LEU R O 1 ATOM 2157 C CB . LEU B 2 129 ? 43.001 34.875 23.937 1.00 37.04 ? 145 LEU R CB 1 ATOM 2158 C CG . LEU B 2 129 ? 43.155 36.287 24.497 1.00 39.17 ? 145 LEU R CG 1 ATOM 2159 C CD1 . LEU B 2 129 ? 44.475 36.400 25.245 1.00 41.73 ? 145 LEU R CD1 1 ATOM 2160 C CD2 . LEU B 2 129 ? 43.097 37.290 23.349 1.00 40.83 ? 145 LEU R CD2 1 ATOM 2161 N N . TYR B 2 130 ? 41.368 33.044 21.436 1.00 33.60 ? 146 TYR R N 1 ATOM 2162 C CA . TYR B 2 130 ? 41.217 31.728 20.837 1.00 34.93 ? 146 TYR R CA 1 ATOM 2163 C C . TYR B 2 130 ? 42.448 31.072 20.223 1.00 36.54 ? 146 TYR R C 1 ATOM 2164 O O . TYR B 2 130 ? 43.343 31.741 19.696 1.00 36.88 ? 146 TYR R O 1 ATOM 2165 C CB . TYR B 2 130 ? 40.129 31.790 19.766 1.00 34.23 ? 146 TYR R CB 1 ATOM 2166 C CG . TYR B 2 130 ? 38.764 32.151 20.288 1.00 34.22 ? 146 TYR R CG 1 ATOM 2167 C CD1 . TYR B 2 130 ? 38.006 31.225 21.007 1.00 32.22 ? 146 TYR R CD1 1 ATOM 2168 C CD2 . TYR B 2 130 ? 38.216 33.410 20.049 1.00 34.19 ? 146 TYR R CD2 1 ATOM 2169 C CE1 . TYR B 2 130 ? 36.738 31.539 21.469 1.00 31.94 ? 146 TYR R CE1 1 ATOM 2170 C CE2 . TYR B 2 130 ? 36.941 33.735 20.511 1.00 35.80 ? 146 TYR R CE2 1 ATOM 2171 C CZ . TYR B 2 130 ? 36.209 32.790 21.219 1.00 35.19 ? 146 TYR R CZ 1 ATOM 2172 O OH . TYR B 2 130 ? 34.939 33.085 21.659 1.00 36.58 ? 146 TYR R OH 1 ATOM 2173 N N . THR B 2 131 ? 42.466 29.746 20.294 1.00 37.69 ? 147 THR R N 1 ATOM 2174 C CA . THR B 2 131 ? 43.522 28.939 19.703 1.00 40.02 ? 147 THR R CA 1 ATOM 2175 C C . THR B 2 131 ? 42.783 27.919 18.845 1.00 40.41 ? 147 THR R C 1 ATOM 2176 O O . THR B 2 131 ? 41.847 27.270 19.311 1.00 40.52 ? 147 THR R O 1 ATOM 2177 C CB . THR B 2 131 ? 44.361 28.191 20.760 1.00 42.45 ? 147 THR R CB 1 ATOM 2178 O OG1 . THR B 2 131 ? 45.026 29.135 21.610 1.00 44.92 ? 147 THR R OG1 1 ATOM 2179 C CG2 . THR B 2 131 ? 45.410 27.322 20.079 1.00 42.15 ? 147 THR R CG2 1 ATOM 2180 N N . ALA B 2 132 ? 43.179 27.799 17.585 1.00 40.73 ? 148 ALA R N 1 ATOM 2181 C CA . ALA B 2 132 ? 42.535 26.855 16.688 1.00 40.60 ? 148 ALA R CA 1 ATOM 2182 C C . ALA B 2 132 ? 43.505 25.771 16.248 1.00 41.56 ? 148 ALA R C 1 ATOM 2183 O O . ALA B 2 132 ? 44.678 26.037 15.984 1.00 41.27 ? 148 ALA R O 1 ATOM 2184 C CB . ALA B 2 132 ? 41.978 27.584 15.472 1.00 38.28 ? 148 ALA R CB 1 ATOM 2185 N N . ASN B 2 133 ? 43.011 24.540 16.199 1.00 43.50 ? 149 ASN R N 1 ATOM 2186 C CA . ASN B 2 133 ? 43.814 23.409 15.762 1.00 45.20 ? 149 ASN R CA 1 ATOM 2187 C C . ASN B 2 133 ? 43.353 23.076 14.360 1.00 44.46 ? 149 ASN R C 1 ATOM 2188 O O . ASN B 2 133 ? 42.218 22.644 14.157 1.00 43.53 ? 149 ASN R O 1 ATOM 2189 C CB . ASN B 2 133 ? 43.609 22.202 16.679 1.00 51.46 ? 149 ASN R CB 1 ATOM 2190 C CG . ASN B 2 133 ? 44.671 22.103 17.751 1.00 58.64 ? 149 ASN R CG 1 ATOM 2191 O OD1 . ASN B 2 133 ? 44.971 23.088 18.426 1.00 59.46 ? 149 ASN R OD1 1 ATOM 2192 N ND2 . ASN B 2 133 ? 45.241 20.910 17.908 1.00 66.24 ? 149 ASN R ND2 1 ATOM 2193 N N . PHE B 2 134 ? 44.239 23.301 13.396 1.00 43.69 ? 150 PHE R N 1 ATOM 2194 C CA . PHE B 2 134 ? 43.950 23.040 11.992 1.00 44.38 ? 150 PHE R CA 1 ATOM 2195 C C . PHE B 2 134 ? 44.483 21.684 11.550 1.00 45.16 ? 150 PHE R C 1 ATOM 2196 O O . PHE B 2 134 ? 45.652 21.367 11.758 1.00 45.68 ? 150 PHE R O 1 ATOM 2197 C CB . PHE B 2 134 ? 44.584 24.127 11.114 1.00 43.10 ? 150 PHE R CB 1 ATOM 2198 C CG . PHE B 2 134 ? 43.811 25.411 11.077 1.00 40.66 ? 150 PHE R CG 1 ATOM 2199 C CD1 . PHE B 2 134 ? 43.019 25.727 9.975 1.00 40.46 ? 150 PHE R CD1 1 ATOM 2200 C CD2 . PHE B 2 134 ? 43.874 26.309 12.137 1.00 39.99 ? 150 PHE R CD2 1 ATOM 2201 C CE1 . PHE B 2 134 ? 42.300 26.925 9.929 1.00 39.53 ? 150 PHE R CE1 1 ATOM 2202 C CE2 . PHE B 2 134 ? 43.159 27.510 12.102 1.00 37.86 ? 150 PHE R CE2 1 ATOM 2203 C CZ . PHE B 2 134 ? 42.372 27.817 10.995 1.00 37.56 ? 150 PHE R CZ 1 ATOM 2204 N N . THR B 2 135 ? 43.615 20.885 10.946 1.00 45.74 ? 151 THR R N 1 ATOM 2205 C CA . THR B 2 135 ? 44.014 19.580 10.436 1.00 47.30 ? 151 THR R CA 1 ATOM 2206 C C . THR B 2 135 ? 43.879 19.640 8.922 1.00 45.32 ? 151 THR R C 1 ATOM 2207 O O . THR B 2 135 ? 42.771 19.754 8.405 1.00 44.66 ? 151 THR R O 1 ATOM 2208 C CB . THR B 2 135 ? 43.113 18.450 10.984 1.00 48.73 ? 151 THR R CB 1 ATOM 2209 O OG1 . THR B 2 135 ? 43.384 18.256 12.379 1.00 51.18 ? 151 THR R OG1 1 ATOM 2210 C CG2 . THR B 2 135 ? 43.376 17.153 10.240 1.00 50.28 ? 151 THR R CG2 1 ATOM 2211 N N . PHE B 2 136 ? 45.013 19.585 8.227 1.00 45.35 ? 152 PHE R N 1 ATOM 2212 C CA . PHE B 2 136 ? 45.043 19.644 6.763 1.00 47.89 ? 152 PHE R CA 1 ATOM 2213 C C . PHE B 2 136 ? 45.225 18.259 6.140 1.00 49.60 ? 152 PHE R C 1 ATOM 2214 O O . PHE B 2 136 ? 46.158 17.535 6.483 1.00 48.51 ? 152 PHE R O 1 ATOM 2215 C CB . PHE B 2 136 ? 46.184 20.563 6.295 1.00 45.40 ? 152 PHE R CB 1 ATOM 2216 C CG . PHE B 2 136 ? 45.962 22.021 6.604 1.00 41.72 ? 152 PHE R CG 1 ATOM 2217 C CD1 . PHE B 2 136 ? 45.008 22.755 5.909 1.00 41.07 ? 152 PHE R CD1 1 ATOM 2218 C CD2 . PHE B 2 136 ? 46.706 22.657 7.592 1.00 42.22 ? 152 PHE R CD2 1 ATOM 2219 C CE1 . PHE B 2 136 ? 44.796 24.108 6.194 1.00 40.45 ? 152 PHE R CE1 1 ATOM 2220 C CE2 . PHE B 2 136 ? 46.503 24.010 7.888 1.00 40.59 ? 152 PHE R CE2 1 ATOM 2221 C CZ . PHE B 2 136 ? 45.546 24.736 7.186 1.00 39.14 ? 152 PHE R CZ 1 ATOM 2222 N N . GLY B 2 137 ? 44.336 17.902 5.219 1.00 53.16 ? 153 GLY R N 1 ATOM 2223 C CA . GLY B 2 137 ? 44.422 16.606 4.568 1.00 58.42 ? 153 GLY R CA 1 ATOM 2224 C C . GLY B 2 137 ? 44.304 15.449 5.547 1.00 62.67 ? 153 GLY R C 1 ATOM 2225 O O . GLY B 2 137 ? 43.313 15.338 6.271 1.00 62.77 ? 153 GLY R O 1 ATOM 2226 N N . ASP B 2 138 ? 45.313 14.584 5.568 1.00 66.12 ? 154 ASP R N 1 ATOM 2227 C CA . ASP B 2 138 ? 45.317 13.437 6.470 1.00 70.49 ? 154 ASP R CA 1 ATOM 2228 C C . ASP B 2 138 ? 46.523 13.482 7.397 1.00 71.91 ? 154 ASP R C 1 ATOM 2229 O O . ASP B 2 138 ? 47.039 12.445 7.816 1.00 71.95 ? 154 ASP R O 1 ATOM 2230 C CB . ASP B 2 138 ? 45.330 12.129 5.676 1.00 72.78 ? 154 ASP R CB 1 ATOM 2231 C CG . ASP B 2 138 ? 44.076 11.941 4.847 1.00 75.76 ? 154 ASP R CG 1 ATOM 2232 O OD1 . ASP B 2 138 ? 42.969 12.088 5.410 1.00 77.28 ? 154 ASP R OD1 1 ATOM 2233 O OD2 . ASP B 2 138 ? 44.195 11.642 3.638 1.00 77.00 ? 154 ASP R OD2 1 ATOM 2234 N N . SER B 2 139 ? 46.969 14.692 7.711 1.00 73.18 ? 155 SER R N 1 ATOM 2235 C CA . SER B 2 139 ? 48.114 14.877 8.588 1.00 74.90 ? 155 SER R CA 1 ATOM 2236 C C . SER B 2 139 ? 47.768 14.477 10.018 1.00 75.61 ? 155 SER R C 1 ATOM 2237 O O . SER B 2 139 ? 46.617 14.585 10.444 1.00 75.47 ? 155 SER R O 1 ATOM 2238 C CB . SER B 2 139 ? 48.569 16.338 8.558 1.00 75.49 ? 155 SER R CB 1 ATOM 2239 O OG . SER B 2 139 ? 49.666 16.548 9.430 1.00 76.87 ? 155 SER R OG 1 ATOM 2240 N N . GLU B 2 140 ? 48.771 14.007 10.749 1.00 76.65 ? 156 GLU R N 1 ATOM 2241 C CA . GLU B 2 140 ? 48.585 13.598 12.135 1.00 77.70 ? 156 GLU R CA 1 ATOM 2242 C C . GLU B 2 140 ? 49.176 14.671 13.040 1.00 77.06 ? 156 GLU R C 1 ATOM 2243 O O . GLU B 2 140 ? 49.155 14.550 14.267 1.00 77.60 ? 156 GLU R O 1 ATOM 2244 C CB . GLU B 2 140 ? 49.280 12.259 12.395 1.00 79.76 ? 156 GLU R CB 1 ATOM 2245 C CG . GLU B 2 140 ? 48.783 11.109 11.523 1.00 82.90 ? 156 GLU R CG 1 ATOM 2246 C CD . GLU B 2 140 ? 47.320 10.768 11.761 1.00 84.59 ? 156 GLU R CD 1 ATOM 2247 O OE1 . GLU B 2 140 ? 46.813 9.840 11.094 1.00 84.77 ? 156 GLU R OE1 1 ATOM 2248 O OE2 . GLU B 2 140 ? 46.677 11.423 12.611 1.00 85.99 ? 156 GLU R OE2 1 ATOM 2249 N N . GLU B 2 141 ? 49.705 15.719 12.417 1.00 75.41 ? 157 GLU R N 1 ATOM 2250 C CA . GLU B 2 141 ? 50.308 16.833 13.138 1.00 73.73 ? 157 GLU R CA 1 ATOM 2251 C C . GLU B 2 141 ? 49.488 18.102 12.911 1.00 70.64 ? 157 GLU R C 1 ATOM 2252 O O . GLU B 2 141 ? 49.743 18.859 11.974 1.00 70.82 ? 157 GLU R O 1 ATOM 2253 C CB . GLU B 2 141 ? 51.744 17.057 12.653 1.00 76.28 ? 157 GLU R CB 1 ATOM 2254 C CG . GLU B 2 141 ? 52.819 16.819 13.707 1.00 79.91 ? 157 GLU R CG 1 ATOM 2255 C CD . GLU B 2 141 ? 52.686 17.748 14.904 1.00 81.73 ? 157 GLU R CD 1 ATOM 2256 O OE1 . GLU B 2 141 ? 51.706 17.603 15.668 1.00 83.08 ? 157 GLU R OE1 1 ATOM 2257 O OE2 . GLU B 2 141 ? 53.560 18.626 15.077 1.00 82.46 ? 157 GLU R OE2 1 ATOM 2258 N N . PRO B 2 142 ? 48.483 18.347 13.767 1.00 67.16 ? 158 PRO R N 1 ATOM 2259 C CA . PRO B 2 142 ? 47.645 19.541 13.622 1.00 63.15 ? 158 PRO R CA 1 ATOM 2260 C C . PRO B 2 142 ? 48.455 20.827 13.740 1.00 58.65 ? 158 PRO R C 1 ATOM 2261 O O . PRO B 2 142 ? 49.428 20.894 14.488 1.00 57.81 ? 158 PRO R O 1 ATOM 2262 C CB . PRO B 2 142 ? 46.635 19.397 14.762 1.00 64.76 ? 158 PRO R CB 1 ATOM 2263 C CG . PRO B 2 142 ? 46.542 17.905 14.952 1.00 66.10 ? 158 PRO R CG 1 ATOM 2264 C CD . PRO B 2 142 ? 47.989 17.488 14.858 1.00 66.58 ? 158 PRO R CD 1 ATOM 2265 N N . VAL B 2 143 ? 48.058 21.845 12.988 1.00 54.24 ? 159 VAL R N 1 ATOM 2266 C CA . VAL B 2 143 ? 48.741 23.129 13.043 1.00 49.52 ? 159 VAL R CA 1 ATOM 2267 C C . VAL B 2 143 ? 48.059 23.970 14.118 1.00 46.60 ? 159 VAL R C 1 ATOM 2268 O O . VAL B 2 143 ? 46.833 24.064 14.151 1.00 45.18 ? 159 VAL R O 1 ATOM 2269 C CB . VAL B 2 143 ? 48.660 23.872 11.685 1.00 49.17 ? 159 VAL R CB 1 ATOM 2270 C CG1 . VAL B 2 143 ? 49.294 25.251 11.804 1.00 47.75 ? 159 VAL R CG1 1 ATOM 2271 C CG2 . VAL B 2 143 ? 49.363 23.061 10.608 1.00 47.41 ? 159 VAL R CG2 1 ATOM 2272 N N . ILE B 2 144 ? 48.857 24.557 15.006 1.00 45.68 ? 160 ILE R N 1 ATOM 2273 C CA . ILE B 2 144 ? 48.334 25.399 16.074 1.00 44.00 ? 160 ILE R CA 1 ATOM 2274 C C . ILE B 2 144 ? 48.338 26.852 15.609 1.00 43.52 ? 160 ILE R C 1 ATOM 2275 O O . ILE B 2 144 ? 49.391 27.408 15.303 1.00 42.87 ? 160 ILE R O 1 ATOM 2276 C CB . ILE B 2 144 ? 49.193 25.293 17.351 1.00 45.03 ? 160 ILE R CB 1 ATOM 2277 C CG1 . ILE B 2 144 ? 49.274 23.835 17.808 1.00 46.34 ? 160 ILE R CG1 1 ATOM 2278 C CG2 . ILE B 2 144 ? 48.592 26.154 18.453 1.00 45.00 ? 160 ILE R CG2 1 ATOM 2279 C CD1 . ILE B 2 144 ? 47.923 23.177 17.986 1.00 47.85 ? 160 ILE R CD1 1 ATOM 2280 N N . TYR B 2 145 ? 47.155 27.458 15.564 1.00 41.22 ? 161 TYR R N 1 ATOM 2281 C CA . TYR B 2 145 ? 47.013 28.836 15.122 1.00 38.87 ? 161 TYR R CA 1 ATOM 2282 C C . TYR B 2 145 ? 46.324 29.712 16.174 1.00 38.37 ? 161 TYR R C 1 ATOM 2283 O O . TYR B 2 145 ? 45.182 29.457 16.563 1.00 36.63 ? 161 TYR R O 1 ATOM 2284 C CB . TYR B 2 145 ? 46.212 28.864 13.820 1.00 39.11 ? 161 TYR R CB 1 ATOM 2285 C CG . TYR B 2 145 ? 46.044 30.236 13.212 1.00 38.46 ? 161 TYR R CG 1 ATOM 2286 C CD1 . TYR B 2 145 ? 47.076 30.837 12.491 1.00 37.47 ? 161 TYR R CD1 1 ATOM 2287 C CD2 . TYR B 2 145 ? 44.851 30.938 13.367 1.00 38.54 ? 161 TYR R CD2 1 ATOM 2288 C CE1 . TYR B 2 145 ? 46.920 32.115 11.936 1.00 39.29 ? 161 TYR R CE1 1 ATOM 2289 C CE2 . TYR B 2 145 ? 44.682 32.203 12.823 1.00 40.46 ? 161 TYR R CE2 1 ATOM 2290 C CZ . TYR B 2 145 ? 45.716 32.787 12.111 1.00 39.20 ? 161 TYR R CZ 1 ATOM 2291 O OH . TYR B 2 145 ? 45.534 34.043 11.587 1.00 42.43 ? 161 TYR R OH 1 ATOM 2292 N N . ASP B 2 146 ? 47.027 30.740 16.636 1.00 37.34 ? 162 ASP R N 1 ATOM 2293 C CA . ASP B 2 146 ? 46.468 31.658 17.621 1.00 38.82 ? 162 ASP R CA 1 ATOM 2294 C C . ASP B 2 146 ? 45.735 32.801 16.930 1.00 38.18 ? 162 ASP R C 1 ATOM 2295 O O . ASP B 2 146 ? 46.336 33.576 16.187 1.00 39.51 ? 162 ASP R O 1 ATOM 2296 C CB . ASP B 2 146 ? 47.563 32.222 18.524 1.00 38.74 ? 162 ASP R CB 1 ATOM 2297 C CG . ASP B 2 146 ? 48.128 31.176 19.472 1.00 44.24 ? 162 ASP R CG 1 ATOM 2298 O OD1 . ASP B 2 146 ? 47.346 30.325 19.954 1.00 43.67 ? 162 ASP R OD1 1 ATOM 2299 O OD2 . ASP B 2 146 ? 49.347 31.211 19.745 1.00 46.47 ? 162 ASP R OD2 1 ATOM 2300 N N . ILE B 2 147 ? 44.432 32.890 17.176 1.00 36.85 ? 163 ILE R N 1 ATOM 2301 C CA . ILE B 2 147 ? 43.596 33.929 16.589 1.00 36.43 ? 163 ILE R CA 1 ATOM 2302 C C . ILE B 2 147 ? 43.925 35.300 17.173 1.00 35.92 ? 163 ILE R C 1 ATOM 2303 O O . ILE B 2 147 ? 43.987 35.470 18.390 1.00 36.44 ? 163 ILE R O 1 ATOM 2304 C CB . ILE B 2 147 ? 42.104 33.647 16.848 1.00 36.57 ? 163 ILE R CB 1 ATOM 2305 C CG1 . ILE B 2 147 ? 41.748 32.232 16.381 1.00 39.19 ? 163 ILE R CG1 1 ATOM 2306 C CG2 . ILE B 2 147 ? 41.252 34.689 16.159 1.00 35.39 ? 163 ILE R CG2 1 ATOM 2307 C CD1 . ILE B 2 147 ? 41.806 32.031 14.907 1.00 40.32 ? 163 ILE R CD1 1 ATOM 2308 N N . ASP B 2 148 ? 44.143 36.271 16.291 1.00 35.76 ? 164 ASP R N 1 ATOM 2309 C CA . ASP B 2 148 ? 44.446 37.646 16.686 1.00 33.27 ? 164 ASP R CA 1 ATOM 2310 C C . ASP B 2 148 ? 43.122 38.298 17.075 1.00 31.23 ? 164 ASP R C 1 ATOM 2311 O O . ASP B 2 148 ? 42.160 38.253 16.309 1.00 29.84 ? 164 ASP R O 1 ATOM 2312 C CB . ASP B 2 148 ? 45.049 38.397 15.493 1.00 36.94 ? 164 ASP R CB 1 ATOM 2313 C CG . ASP B 2 148 ? 45.551 39.788 15.854 1.00 39.70 ? 164 ASP R CG 1 ATOM 2314 O OD1 . ASP B 2 148 ? 45.075 40.383 16.848 1.00 40.05 ? 164 ASP R OD1 1 ATOM 2315 O OD2 . ASP B 2 148 ? 46.424 40.292 15.118 1.00 42.92 ? 164 ASP R OD2 1 ATOM 2316 N N . ASP B 2 149 ? 43.065 38.914 18.250 1.00 29.96 ? 165 ASP R N 1 ATOM 2317 C CA . ASP B 2 149 ? 41.830 39.560 18.685 1.00 30.26 ? 165 ASP R CA 1 ATOM 2318 C C . ASP B 2 149 ? 41.382 40.656 17.698 1.00 29.83 ? 165 ASP R C 1 ATOM 2319 O O . ASP B 2 149 ? 40.208 41.010 17.657 1.00 26.95 ? 165 ASP R O 1 ATOM 2320 C CB . ASP B 2 149 ? 42.001 40.133 20.103 1.00 29.78 ? 165 ASP R CB 1 ATOM 2321 C CG . ASP B 2 149 ? 40.718 40.751 20.649 1.00 33.04 ? 165 ASP R CG 1 ATOM 2322 O OD1 . ASP B 2 149 ? 39.643 40.116 20.562 1.00 33.08 ? 165 ASP R OD1 1 ATOM 2323 O OD2 . ASP B 2 149 ? 40.782 41.875 21.180 1.00 33.39 ? 165 ASP R OD2 1 ATOM 2324 N N . TYR B 2 150 ? 42.312 41.192 16.904 1.00 30.02 ? 166 TYR R N 1 ATOM 2325 C CA . TYR B 2 150 ? 41.943 42.213 15.919 1.00 32.57 ? 166 TYR R CA 1 ATOM 2326 C C . TYR B 2 150 ? 40.986 41.637 14.864 1.00 33.00 ? 166 TYR R C 1 ATOM 2327 O O . TYR B 2 150 ? 40.310 42.384 14.152 1.00 32.88 ? 166 TYR R O 1 ATOM 2328 C CB . TYR B 2 150 ? 43.183 42.789 15.218 1.00 32.64 ? 166 TYR R CB 1 ATOM 2329 C CG . TYR B 2 150 ? 43.975 43.789 16.036 1.00 33.56 ? 166 TYR R CG 1 ATOM 2330 C CD1 . TYR B 2 150 ? 43.365 44.543 17.043 1.00 33.89 ? 166 TYR R CD1 1 ATOM 2331 C CD2 . TYR B 2 150 ? 45.321 44.038 15.753 1.00 34.40 ? 166 TYR R CD2 1 ATOM 2332 C CE1 . TYR B 2 150 ? 44.073 45.522 17.745 1.00 34.82 ? 166 TYR R CE1 1 ATOM 2333 C CE2 . TYR B 2 150 ? 46.038 45.019 16.445 1.00 33.96 ? 166 TYR R CE2 1 ATOM 2334 C CZ . TYR B 2 150 ? 45.407 45.756 17.437 1.00 36.35 ? 166 TYR R CZ 1 ATOM 2335 O OH . TYR B 2 150 ? 46.104 46.739 18.105 1.00 37.92 ? 166 TYR R OH 1 ATOM 2336 N N . ASP B 2 151 ? 40.926 40.312 14.766 1.00 32.22 ? 167 ASP R N 1 ATOM 2337 C CA . ASP B 2 151 ? 40.023 39.674 13.810 1.00 34.61 ? 167 ASP R CA 1 ATOM 2338 C C . ASP B 2 151 ? 38.674 39.333 14.436 1.00 35.94 ? 167 ASP R C 1 ATOM 2339 O O . ASP B 2 151 ? 37.855 38.663 13.813 1.00 35.75 ? 167 ASP R O 1 ATOM 2340 C CB . ASP B 2 151 ? 40.643 38.395 13.241 1.00 34.22 ? 167 ASP R CB 1 ATOM 2341 C CG . ASP B 2 151 ? 41.818 38.675 12.325 1.00 35.53 ? 167 ASP R CG 1 ATOM 2342 O OD1 . ASP B 2 151 ? 41.715 39.603 11.493 1.00 36.32 ? 167 ASP R OD1 1 ATOM 2343 O OD2 . ASP B 2 151 ? 42.840 37.967 12.430 1.00 34.06 ? 167 ASP R OD2 1 ATOM 2344 N N . CYS B 2 152 ? 38.442 39.802 15.660 1.00 36.15 ? 168 CYS R N 1 ATOM 2345 C CA . CYS B 2 152 ? 37.187 39.518 16.357 1.00 38.48 ? 168 CYS R CA 1 ATOM 2346 C C . CYS B 2 152 ? 36.316 40.745 16.627 1.00 38.35 ? 168 CYS R C 1 ATOM 2347 O O . CYS B 2 152 ? 36.814 41.850 16.855 1.00 36.28 ? 168 CYS R O 1 ATOM 2348 C CB . CYS B 2 152 ? 37.471 38.838 17.699 1.00 39.93 ? 168 CYS R CB 1 ATOM 2349 S SG . CYS B 2 152 ? 38.596 37.406 17.655 1.00 45.13 ? 168 CYS R SG 1 ATOM 2350 N N . THR B 2 153 ? 35.008 40.524 16.620 1.00 39.54 ? 169 THR R N 1 ATOM 2351 C CA . THR B 2 153 ? 34.028 41.573 16.888 1.00 42.44 ? 169 THR R CA 1 ATOM 2352 C C . THR B 2 153 ? 33.168 41.057 18.030 1.00 43.01 ? 169 THR R C 1 ATOM 2353 O O . THR B 2 153 ? 33.443 39.994 18.578 1.00 42.13 ? 169 THR R O 1 ATOM 2354 C CB . THR B 2 153 ? 33.092 41.814 15.695 1.00 42.72 ? 169 THR R CB 1 ATOM 2355 O OG1 . THR B 2 153 ? 32.326 40.629 15.445 1.00 51.21 ? 169 THR R OG1 1 ATOM 2356 C CG2 . THR B 2 153 ? 33.887 42.165 14.456 1.00 39.41 ? 169 THR R CG2 1 ATOM 2357 N N . SER B 2 154 ? 32.118 41.799 18.366 1.00 43.37 ? 170 SER R N 1 ATOM 2358 C CA . SER B 2 154 ? 31.211 41.403 19.433 1.00 46.26 ? 170 SER R CA 1 ATOM 2359 C C . SER B 2 154 ? 30.536 40.080 19.112 1.00 47.12 ? 170 SER R C 1 ATOM 2360 O O . SER B 2 154 ? 30.105 39.372 20.010 1.00 50.84 ? 170 SER R O 1 ATOM 2361 C CB . SER B 2 154 ? 30.132 42.474 19.636 1.00 47.75 ? 170 SER R CB 1 ATOM 2362 O OG . SER B 2 154 ? 30.690 43.677 20.134 1.00 52.16 ? 170 SER R OG 1 ATOM 2363 N N . THR B 2 155 ? 30.447 39.748 17.830 1.00 46.88 ? 171 THR R N 1 ATOM 2364 C CA . THR B 2 155 ? 29.797 38.514 17.407 1.00 48.21 ? 171 THR R CA 1 ATOM 2365 C C . THR B 2 155 ? 30.717 37.296 17.374 1.00 48.20 ? 171 THR R C 1 ATOM 2366 O O . THR B 2 155 ? 30.353 36.214 17.848 1.00 49.95 ? 171 THR R O 1 ATOM 2367 C CB . THR B 2 155 ? 29.183 38.679 16.016 1.00 49.33 ? 171 THR R CB 1 ATOM 2368 O OG1 . THR B 2 155 ? 28.122 39.638 16.078 1.00 52.68 ? 171 THR R OG1 1 ATOM 2369 C CG2 . THR B 2 155 ? 28.642 37.352 15.513 1.00 52.77 ? 171 THR R CG2 1 ATOM 2370 N N . GLY B 2 156 ? 31.900 37.472 16.798 1.00 45.04 ? 172 GLY R N 1 ATOM 2371 C CA . GLY B 2 156 ? 32.840 36.375 16.706 1.00 41.70 ? 172 GLY R CA 1 ATOM 2372 C C . GLY B 2 156 ? 34.102 36.781 15.976 1.00 39.97 ? 172 GLY R C 1 ATOM 2373 O O . GLY B 2 156 ? 34.334 37.964 15.732 1.00 37.80 ? 172 GLY R O 1 ATOM 2374 N N . CYS B 2 157 ? 34.920 35.794 15.631 1.00 39.27 ? 173 CYS R N 1 ATOM 2375 C CA . CYS B 2 157 ? 36.167 36.047 14.933 1.00 39.71 ? 173 CYS R CA 1 ATOM 2376 C C . CYS B 2 157 ? 36.094 35.475 13.524 1.00 39.53 ? 173 CYS R C 1 ATOM 2377 O O . CYS B 2 157 ? 35.496 34.421 13.296 1.00 38.17 ? 173 CYS R O 1 ATOM 2378 C CB . CYS B 2 157 ? 37.329 35.412 15.689 1.00 42.15 ? 173 CYS R CB 1 ATOM 2379 S SG . CYS B 2 157 ? 37.378 35.784 17.474 1.00 47.98 ? 173 CYS R SG 1 ATOM 2380 N N . SER B 2 158 ? 36.715 36.175 12.583 1.00 37.69 ? 174 SER R N 1 ATOM 2381 C CA . SER B 2 158 ? 36.705 35.757 11.188 1.00 38.49 ? 174 SER R CA 1 ATOM 2382 C C . SER B 2 158 ? 38.121 35.651 10.633 1.00 37.00 ? 174 SER R C 1 ATOM 2383 O O . SER B 2 158 ? 38.897 36.609 10.683 1.00 36.19 ? 174 SER R O 1 ATOM 2384 C CB . SER B 2 158 ? 35.883 36.759 10.366 1.00 39.02 ? 174 SER R CB 1 ATOM 2385 O OG . SER B 2 158 ? 35.833 36.387 9.005 1.00 42.38 ? 174 SER R OG 1 ATOM 2386 N N . ILE B 2 159 ? 38.451 34.477 10.111 1.00 36.16 ? 175 ILE R N 1 ATOM 2387 C CA . ILE B 2 159 ? 39.768 34.215 9.548 1.00 35.48 ? 175 ILE R CA 1 ATOM 2388 C C . ILE B 2 159 ? 39.636 33.659 8.128 1.00 36.22 ? 175 ILE R C 1 ATOM 2389 O O . ILE B 2 159 ? 39.012 32.613 7.912 1.00 34.08 ? 175 ILE R O 1 ATOM 2390 C CB . ILE B 2 159 ? 40.542 33.175 10.406 1.00 38.57 ? 175 ILE R CB 1 ATOM 2391 C CG1 . ILE B 2 159 ? 40.731 33.701 11.832 1.00 40.64 ? 175 ILE R CG1 1 ATOM 2392 C CG2 . ILE B 2 159 ? 41.903 32.873 9.782 1.00 37.17 ? 175 ILE R CG2 1 ATOM 2393 C CD1 . ILE B 2 159 ? 41.613 34.926 11.918 1.00 43.58 ? 175 ILE R CD1 1 ATOM 2394 N N . ASP B 2 160 ? 40.208 34.364 7.158 1.00 35.10 ? 176 ASP R N 1 ATOM 2395 C CA . ASP B 2 160 ? 40.171 33.894 5.779 1.00 35.09 ? 176 ASP R CA 1 ATOM 2396 C C . ASP B 2 160 ? 41.516 33.260 5.476 1.00 34.29 ? 176 ASP R C 1 ATOM 2397 O O . ASP B 2 160 ? 42.564 33.801 5.832 1.00 33.95 ? 176 ASP R O 1 ATOM 2398 C CB . ASP B 2 160 ? 39.919 35.041 4.800 1.00 36.89 ? 176 ASP R CB 1 ATOM 2399 C CG . ASP B 2 160 ? 38.514 35.590 4.895 1.00 38.33 ? 176 ASP R CG 1 ATOM 2400 O OD1 . ASP B 2 160 ? 37.577 34.808 5.174 1.00 38.30 ? 176 ASP R OD1 1 ATOM 2401 O OD2 . ASP B 2 160 ? 38.340 36.802 4.671 1.00 40.71 ? 176 ASP R OD2 1 ATOM 2402 N N . PHE B 2 161 ? 41.493 32.101 4.832 1.00 33.20 ? 177 PHE R N 1 ATOM 2403 C CA . PHE B 2 161 ? 42.734 31.425 4.502 1.00 34.25 ? 177 PHE R CA 1 ATOM 2404 C C . PHE B 2 161 ? 42.548 30.612 3.234 1.00 35.19 ? 177 PHE R C 1 ATOM 2405 O O . PHE B 2 161 ? 41.433 30.482 2.729 1.00 36.50 ? 177 PHE R O 1 ATOM 2406 C CB . PHE B 2 161 ? 43.186 30.541 5.674 1.00 33.74 ? 177 PHE R CB 1 ATOM 2407 C CG . PHE B 2 161 ? 42.243 29.409 5.997 1.00 35.63 ? 177 PHE R CG 1 ATOM 2408 C CD1 . PHE B 2 161 ? 42.557 28.098 5.630 1.00 36.62 ? 177 PHE R CD1 1 ATOM 2409 C CD2 . PHE B 2 161 ? 41.050 29.647 6.669 1.00 35.14 ? 177 PHE R CD2 1 ATOM 2410 C CE1 . PHE B 2 161 ? 41.694 27.042 5.929 1.00 34.75 ? 177 PHE R CE1 1 ATOM 2411 C CE2 . PHE B 2 161 ? 40.174 28.596 6.973 1.00 35.89 ? 177 PHE R CE2 1 ATOM 2412 C CZ . PHE B 2 161 ? 40.499 27.291 6.601 1.00 34.28 ? 177 PHE R CZ 1 ATOM 2413 N N . ALA B 2 162 ? 43.639 30.075 2.706 1.00 36.29 ? 178 ALA R N 1 ATOM 2414 C CA . ALA B 2 162 ? 43.536 29.303 1.483 1.00 38.79 ? 178 ALA R CA 1 ATOM 2415 C C . ALA B 2 162 ? 44.373 28.038 1.478 1.00 38.50 ? 178 ALA R C 1 ATOM 2416 O O . ALA B 2 162 ? 45.485 27.995 2.002 1.00 39.13 ? 178 ALA R O 1 ATOM 2417 C CB . ALA B 2 162 ? 43.903 30.176 0.284 1.00 38.90 ? 178 ALA R CB 1 ATOM 2418 N N . THR B 2 163 ? 43.792 27.002 0.891 1.00 38.74 ? 179 THR R N 1 ATOM 2419 C CA . THR B 2 163 ? 44.428 25.707 0.739 1.00 39.83 ? 179 THR R CA 1 ATOM 2420 C C . THR B 2 163 ? 43.574 24.975 -0.280 1.00 39.99 ? 179 THR R C 1 ATOM 2421 O O . THR B 2 163 ? 42.403 25.318 -0.473 1.00 39.21 ? 179 THR R O 1 ATOM 2422 C CB . THR B 2 163 ? 44.454 24.897 2.048 1.00 40.62 ? 179 THR R CB 1 ATOM 2423 O OG1 . THR B 2 163 ? 45.128 23.655 1.808 1.00 43.90 ? 179 THR R OG1 1 ATOM 2424 C CG2 . THR B 2 163 ? 43.038 24.610 2.542 1.00 38.97 ? 179 THR R CG2 1 ATOM 2425 N N . THR B 2 164 ? 44.159 23.982 -0.937 1.00 40.66 ? 180 THR R N 1 ATOM 2426 C CA . THR B 2 164 ? 43.441 23.214 -1.947 1.00 42.44 ? 180 THR R CA 1 ATOM 2427 C C . THR B 2 164 ? 42.979 21.860 -1.422 1.00 44.15 ? 180 THR R C 1 ATOM 2428 O O . THR B 2 164 ? 42.211 21.163 -2.089 1.00 45.32 ? 180 THR R O 1 ATOM 2429 C CB . THR B 2 164 ? 44.321 22.987 -3.200 1.00 40.23 ? 180 THR R CB 1 ATOM 2430 O OG1 . THR B 2 164 ? 45.591 22.456 -2.802 1.00 36.59 ? 180 THR R OG1 1 ATOM 2431 C CG2 . THR B 2 164 ? 44.538 24.300 -3.946 1.00 39.69 ? 180 THR R CG2 1 ATOM 2432 N N . GLU B 2 165 ? 43.435 21.489 -0.230 1.00 44.93 ? 181 GLU R N 1 ATOM 2433 C CA . GLU B 2 165 ? 43.043 20.204 0.342 1.00 47.22 ? 181 GLU R CA 1 ATOM 2434 C C . GLU B 2 165 ? 42.051 20.321 1.500 1.00 48.22 ? 181 GLU R C 1 ATOM 2435 O O . GLU B 2 165 ? 41.711 21.419 1.949 1.00 48.23 ? 181 GLU R O 1 ATOM 2436 C CB . GLU B 2 165 ? 44.281 19.425 0.795 1.00 48.28 ? 181 GLU R CB 1 ATOM 2437 C CG . GLU B 2 165 ? 45.005 20.007 1.989 1.00 50.04 ? 181 GLU R CG 1 ATOM 2438 C CD . GLU B 2 165 ? 46.283 19.256 2.297 1.00 51.39 ? 181 GLU R CD 1 ATOM 2439 O OE1 . GLU B 2 165 ? 46.258 18.010 2.249 1.00 54.53 ? 181 GLU R OE1 1 ATOM 2440 O OE2 . GLU B 2 165 ? 47.311 19.902 2.595 1.00 52.74 ? 181 GLU R OE2 1 ATOM 2441 N N . LYS B 2 166 ? 41.591 19.168 1.973 1.00 47.86 ? 182 LYS R N 1 ATOM 2442 C CA . LYS B 2 166 ? 40.627 19.092 3.064 1.00 46.33 ? 182 LYS R CA 1 ATOM 2443 C C . LYS B 2 166 ? 41.149 19.696 4.361 1.00 43.73 ? 182 LYS R C 1 ATOM 2444 O O . LYS B 2 166 ? 42.302 19.495 4.743 1.00 40.55 ? 182 LYS R O 1 ATOM 2445 C CB . LYS B 2 166 ? 40.232 17.629 3.289 1.00 49.30 ? 182 LYS R CB 1 ATOM 2446 C CG . LYS B 2 166 ? 39.382 17.356 4.522 1.00 51.87 ? 182 LYS R CG 1 ATOM 2447 C CD . LYS B 2 166 ? 38.953 15.892 4.540 1.00 56.05 ? 182 LYS R CD 1 ATOM 2448 C CE . LYS B 2 166 ? 38.330 15.494 5.865 1.00 58.58 ? 182 LYS R CE 1 ATOM 2449 N NZ . LYS B 2 166 ? 39.348 15.469 6.951 1.00 61.81 ? 182 LYS R NZ 1 ATOM 2450 N N . VAL B 2 167 ? 40.291 20.440 5.043 1.00 43.00 ? 183 VAL R N 1 ATOM 2451 C CA . VAL B 2 167 ? 40.697 21.051 6.300 1.00 43.46 ? 183 VAL R CA 1 ATOM 2452 C C . VAL B 2 167 ? 39.630 20.886 7.375 1.00 42.18 ? 183 VAL R C 1 ATOM 2453 O O . VAL B 2 167 ? 38.439 21.049 7.118 1.00 41.98 ? 183 VAL R O 1 ATOM 2454 C CB . VAL B 2 167 ? 41.023 22.562 6.106 1.00 41.73 ? 183 VAL R CB 1 ATOM 2455 C CG1 . VAL B 2 167 ? 39.798 23.299 5.598 1.00 41.38 ? 183 VAL R CG1 1 ATOM 2456 C CG2 . VAL B 2 167 ? 41.515 23.166 7.410 1.00 40.16 ? 183 VAL R CG2 1 ATOM 2457 N N . CYS B 2 168 ? 40.071 20.536 8.576 1.00 43.22 ? 184 CYS R N 1 ATOM 2458 C CA . CYS B 2 168 ? 39.171 20.370 9.710 1.00 45.63 ? 184 CYS R CA 1 ATOM 2459 C C . CYS B 2 168 ? 39.684 21.276 10.816 1.00 43.85 ? 184 CYS R C 1 ATOM 2460 O O . CYS B 2 168 ? 40.896 21.426 10.989 1.00 43.31 ? 184 CYS R O 1 ATOM 2461 C CB . CYS B 2 168 ? 39.179 18.929 10.213 1.00 49.87 ? 184 CYS R CB 1 ATOM 2462 S SG . CYS B 2 168 ? 38.681 17.645 9.021 1.00 58.34 ? 184 CYS R SG 1 ATOM 2463 N N . VAL B 2 169 ? 38.771 21.875 11.572 1.00 42.70 ? 185 VAL R N 1 ATOM 2464 C CA . VAL B 2 169 ? 39.185 22.773 12.641 1.00 41.83 ? 185 VAL R CA 1 ATOM 2465 C C . VAL B 2 169 ? 38.308 22.725 13.888 1.00 40.12 ? 185 VAL R C 1 ATOM 2466 O O . VAL B 2 169 ? 37.109 22.469 13.821 1.00 39.27 ? 185 VAL R O 1 ATOM 2467 C CB . VAL B 2 169 ? 39.198 24.248 12.152 1.00 41.98 ? 185 VAL R CB 1 ATOM 2468 C CG1 . VAL B 2 169 ? 39.734 25.162 13.251 1.00 43.59 ? 185 VAL R CG1 1 ATOM 2469 C CG2 . VAL B 2 169 ? 40.047 24.382 10.901 1.00 44.33 ? 185 VAL R CG2 1 ATOM 2470 N N . MET B 2 170 ? 38.938 22.981 15.025 1.00 40.00 ? 186 MET R N 1 ATOM 2471 C CA . MET B 2 170 ? 38.250 23.061 16.304 1.00 41.27 ? 186 MET R CA 1 ATOM 2472 C C . MET B 2 170 ? 38.986 24.177 17.036 1.00 38.78 ? 186 MET R C 1 ATOM 2473 O O . MET B 2 170 ? 40.171 24.400 16.784 1.00 37.47 ? 186 MET R O 1 ATOM 2474 C CB . MET B 2 170 ? 38.331 21.740 17.080 1.00 42.05 ? 186 MET R CB 1 ATOM 2475 C CG . MET B 2 170 ? 39.725 21.248 17.387 1.00 47.32 ? 186 MET R CG 1 ATOM 2476 S SD . MET B 2 170 ? 39.679 19.862 18.555 1.00 56.12 ? 186 MET R SD 1 ATOM 2477 C CE . MET B 2 170 ? 38.573 18.746 17.698 1.00 50.64 ? 186 MET R CE 1 ATOM 2478 N N . ALA B 2 171 ? 38.289 24.881 17.923 1.00 36.90 ? 187 ALA R N 1 ATOM 2479 C CA . ALA B 2 171 ? 38.891 25.992 18.651 1.00 36.85 ? 187 ALA R CA 1 ATOM 2480 C C . ALA B 2 171 ? 38.575 25.992 20.144 1.00 36.55 ? 187 ALA R C 1 ATOM 2481 O O . ALA B 2 171 ? 37.561 25.459 20.581 1.00 36.48 ? 187 ALA R O 1 ATOM 2482 C CB . ALA B 2 171 ? 38.438 27.319 18.029 1.00 36.21 ? 187 ALA R CB 1 ATOM 2483 N N . GLN B 2 172 ? 39.455 26.619 20.914 1.00 37.00 ? 188 GLN R N 1 ATOM 2484 C CA . GLN B 2 172 ? 39.304 26.710 22.360 1.00 38.14 ? 188 GLN R CA 1 ATOM 2485 C C . GLN B 2 172 ? 39.630 28.136 22.782 1.00 37.00 ? 188 GLN R C 1 ATOM 2486 O O . GLN B 2 172 ? 40.505 28.769 22.192 1.00 36.45 ? 188 GLN R O 1 ATOM 2487 C CB . GLN B 2 172 ? 40.269 25.738 23.051 1.00 39.81 ? 188 GLN R CB 1 ATOM 2488 C CG . GLN B 2 172 ? 40.244 25.820 24.560 1.00 41.51 ? 188 GLN R CG 1 ATOM 2489 C CD . GLN B 2 172 ? 41.314 24.972 25.205 1.00 44.65 ? 188 GLN R CD 1 ATOM 2490 O OE1 . GLN B 2 172 ? 42.508 25.204 25.008 1.00 47.21 ? 188 GLN R OE1 1 ATOM 2491 N NE2 . GLN B 2 172 ? 40.895 23.981 25.983 1.00 44.68 ? 188 GLN R NE2 1 ATOM 2492 N N . GLY B 2 173 ? 38.935 28.633 23.804 1.00 36.67 ? 189 GLY R N 1 ATOM 2493 C CA . GLY B 2 173 ? 39.177 29.985 24.278 1.00 33.07 ? 189 GLY R CA 1 ATOM 2494 C C . GLY B 2 173 ? 39.676 30.074 25.708 1.00 33.79 ? 189 GLY R C 1 ATOM 2495 O O . GLY B 2 173 ? 39.380 29.210 26.539 1.00 33.24 ? 189 GLY R O 1 ATOM 2496 N N . ALA B 2 174 ? 40.435 31.129 25.992 1.00 31.70 ? 190 ALA R N 1 ATOM 2497 C CA . ALA B 2 174 ? 40.977 31.370 27.323 1.00 33.20 ? 190 ALA R CA 1 ATOM 2498 C C . ALA B 2 174 ? 41.047 32.875 27.552 1.00 35.11 ? 190 ALA R C 1 ATOM 2499 O O . ALA B 2 174 ? 41.353 33.635 26.630 1.00 35.70 ? 190 ALA R O 1 ATOM 2500 C CB . ALA B 2 174 ? 42.374 30.750 27.450 1.00 33.16 ? 190 ALA R CB 1 ATOM 2501 N N . THR B 2 175 ? 40.770 33.309 28.779 1.00 36.35 ? 191 THR R N 1 ATOM 2502 C CA . THR B 2 175 ? 40.803 34.736 29.095 1.00 38.21 ? 191 THR R CA 1 ATOM 2503 C C . THR B 2 175 ? 42.132 35.167 29.697 1.00 41.45 ? 191 THR R C 1 ATOM 2504 O O . THR B 2 175 ? 42.511 36.336 29.598 1.00 41.98 ? 191 THR R O 1 ATOM 2505 C CB . THR B 2 175 ? 39.729 35.124 30.134 1.00 37.18 ? 191 THR R CB 1 ATOM 2506 O OG1 . THR B 2 175 ? 40.089 34.568 31.406 1.00 37.39 ? 191 THR R OG1 1 ATOM 2507 C CG2 . THR B 2 175 ? 38.359 34.594 29.732 1.00 35.62 ? 191 THR R CG2 1 ATOM 2508 N N . GLU B 2 176 ? 42.830 34.229 30.332 1.00 43.57 ? 192 GLU R N 1 ATOM 2509 C CA . GLU B 2 176 ? 44.088 34.538 31.008 1.00 47.95 ? 192 GLU R CA 1 ATOM 2510 C C . GLU B 2 176 ? 43.750 35.619 32.040 1.00 48.14 ? 192 GLU R C 1 ATOM 2511 O O . GLU B 2 176 ? 42.583 35.814 32.372 1.00 48.90 ? 192 GLU R O 1 ATOM 2512 C CB . GLU B 2 176 ? 45.133 35.059 30.012 1.00 51.59 ? 192 GLU R CB 1 ATOM 2513 C CG . GLU B 2 176 ? 45.336 34.155 28.801 1.00 56.07 ? 192 GLU R CG 1 ATOM 2514 C CD . GLU B 2 176 ? 46.541 34.555 27.961 1.00 59.69 ? 192 GLU R CD 1 ATOM 2515 O OE1 . GLU B 2 176 ? 46.722 35.767 27.715 1.00 62.00 ? 192 GLU R OE1 1 ATOM 2516 O OE2 . GLU B 2 176 ? 47.300 33.656 27.538 1.00 60.83 ? 192 GLU R OE2 1 ATOM 2517 N N . GLY B 2 177 ? 44.753 36.318 32.553 1.00 48.29 ? 193 GLY R N 1 ATOM 2518 C CA . GLY B 2 177 ? 44.482 37.366 33.524 1.00 48.73 ? 193 GLY R CA 1 ATOM 2519 C C . GLY B 2 177 ? 43.897 36.908 34.853 1.00 49.56 ? 193 GLY R C 1 ATOM 2520 O O . GLY B 2 177 ? 43.979 35.731 35.218 1.00 49.88 ? 193 GLY R O 1 ATOM 2521 N N . LEU B 2 178 ? 43.301 37.854 35.575 1.00 48.61 ? 194 LEU R N 1 ATOM 2522 C CA . LEU B 2 178 ? 42.701 37.591 36.881 1.00 49.63 ? 194 LEU R CA 1 ATOM 2523 C C . LEU B 2 178 ? 41.706 36.426 36.834 1.00 50.13 ? 194 LEU R C 1 ATOM 2524 O O . LEU B 2 178 ? 41.764 35.523 37.663 1.00 49.51 ? 194 LEU R O 1 ATOM 2525 C CB . LEU B 2 178 ? 42.019 38.863 37.393 1.00 48.87 ? 194 LEU R CB 1 ATOM 2526 C CG . LEU B 2 178 ? 41.811 38.967 38.900 1.00 50.44 ? 194 LEU R CG 1 ATOM 2527 C CD1 . LEU B 2 178 ? 43.148 38.805 39.614 1.00 50.52 ? 194 LEU R CD1 1 ATOM 2528 C CD2 . LEU B 2 178 ? 41.191 40.315 39.233 1.00 51.29 ? 194 LEU R CD2 1 ATOM 2529 N N . LEU B 2 179 ? 40.782 36.453 35.882 1.00 50.88 ? 195 LEU R N 1 ATOM 2530 C CA . LEU B 2 179 ? 39.833 35.352 35.741 1.00 53.50 ? 195 LEU R CA 1 ATOM 2531 C C . LEU B 2 179 ? 40.525 34.357 34.823 1.00 54.75 ? 195 LEU R C 1 ATOM 2532 O O . LEU B 2 179 ? 40.803 34.665 33.668 1.00 58.33 ? 195 LEU R O 1 ATOM 2533 C CB . LEU B 2 179 ? 38.532 35.821 35.092 1.00 51.98 ? 195 LEU R CB 1 ATOM 2534 C CG . LEU B 2 179 ? 37.707 36.841 35.878 1.00 53.31 ? 195 LEU R CG 1 ATOM 2535 C CD1 . LEU B 2 179 ? 36.458 37.224 35.090 1.00 49.19 ? 195 LEU R CD1 1 ATOM 2536 C CD2 . LEU B 2 179 ? 37.330 36.247 37.229 1.00 53.00 ? 195 LEU R CD2 1 ATOM 2537 N N . ASP B 2 180 ? 40.824 33.173 35.331 1.00 55.09 ? 196 ASP R N 1 ATOM 2538 C CA . ASP B 2 180 ? 41.500 32.179 34.514 1.00 54.23 ? 196 ASP R CA 1 ATOM 2539 C C . ASP B 2 180 ? 40.499 31.244 33.856 1.00 51.34 ? 196 ASP R C 1 ATOM 2540 O O . ASP B 2 180 ? 40.504 30.043 34.115 1.00 53.14 ? 196 ASP R O 1 ATOM 2541 C CB . ASP B 2 180 ? 42.478 31.377 35.374 1.00 58.64 ? 196 ASP R CB 1 ATOM 2542 C CG . ASP B 2 180 ? 43.907 31.505 34.894 1.00 62.35 ? 196 ASP R CG 1 ATOM 2543 O OD1 . ASP B 2 180 ? 44.186 31.095 33.745 1.00 64.54 ? 196 ASP R OD1 1 ATOM 2544 O OD2 . ASP B 2 180 ? 44.748 32.019 35.664 1.00 66.11 ? 196 ASP R OD2 1 ATOM 2545 N N . LYS B 2 181 ? 39.647 31.792 32.998 1.00 47.17 ? 197 LYS R N 1 ATOM 2546 C CA . LYS B 2 181 ? 38.644 30.981 32.324 1.00 44.19 ? 197 LYS R CA 1 ATOM 2547 C C . LYS B 2 181 ? 39.204 30.250 31.112 1.00 43.04 ? 197 LYS R C 1 ATOM 2548 O O . LYS B 2 181 ? 39.871 30.841 30.259 1.00 41.37 ? 197 LYS R O 1 ATOM 2549 C CB . LYS B 2 181 ? 37.458 31.848 31.884 1.00 43.51 ? 197 LYS R CB 1 ATOM 2550 C CG . LYS B 2 181 ? 36.839 32.678 33.003 1.00 44.99 ? 197 LYS R CG 1 ATOM 2551 C CD . LYS B 2 181 ? 36.194 31.814 34.060 1.00 44.37 ? 197 LYS R CD 1 ATOM 2552 C CE . LYS B 2 181 ? 35.777 32.649 35.263 1.00 45.41 ? 197 LYS R CE 1 ATOM 2553 N NZ . LYS B 2 181 ? 35.090 33.893 34.849 1.00 45.25 ? 197 LYS R NZ 1 ATOM 2554 N N . ILE B 2 182 ? 38.937 28.952 31.057 1.00 41.30 ? 198 ILE R N 1 ATOM 2555 C CA . ILE B 2 182 ? 39.364 28.128 29.944 1.00 40.98 ? 198 ILE R CA 1 ATOM 2556 C C . ILE B 2 182 ? 38.129 27.362 29.506 1.00 40.62 ? 198 ILE R C 1 ATOM 2557 O O . ILE B 2 182 ? 37.442 26.740 30.313 1.00 41.29 ? 198 ILE R O 1 ATOM 2558 C CB . ILE B 2 182 ? 40.478 27.142 30.335 1.00 42.76 ? 198 ILE R CB 1 ATOM 2559 C CG1 . ILE B 2 182 ? 41.700 27.915 30.843 1.00 46.47 ? 198 ILE R CG1 1 ATOM 2560 C CG2 . ILE B 2 182 ? 40.876 26.320 29.120 1.00 44.36 ? 198 ILE R CG2 1 ATOM 2561 C CD1 . ILE B 2 182 ? 42.894 27.040 31.207 1.00 48.17 ? 198 ILE R CD1 1 ATOM 2562 N N . THR B 2 183 ? 37.844 27.424 28.217 1.00 38.88 ? 199 THR R N 1 ATOM 2563 C CA . THR B 2 183 ? 36.677 26.775 27.662 1.00 39.05 ? 199 THR R CA 1 ATOM 2564 C C . THR B 2 183 ? 36.979 25.370 27.156 1.00 40.30 ? 199 THR R C 1 ATOM 2565 O O . THR B 2 183 ? 38.138 24.989 26.990 1.00 39.02 ? 199 THR R O 1 ATOM 2566 C CB . THR B 2 183 ? 36.132 27.606 26.482 1.00 39.92 ? 199 THR R CB 1 ATOM 2567 O OG1 . THR B 2 183 ? 34.730 27.382 26.350 1.00 46.77 ? 199 THR R OG1 1 ATOM 2568 C CG2 . THR B 2 183 ? 36.807 27.193 25.177 1.00 31.71 ? 199 THR R CG2 1 ATOM 2569 N N . PRO B 2 184 ? 35.931 24.563 26.944 1.00 41.59 ? 200 PRO R N 1 ATOM 2570 C CA . PRO B 2 184 ? 36.150 23.208 26.433 1.00 42.65 ? 200 PRO R CA 1 ATOM 2571 C C . PRO B 2 184 ? 36.404 23.405 24.936 1.00 43.18 ? 200 PRO R C 1 ATOM 2572 O O . PRO B 2 184 ? 36.111 24.476 24.395 1.00 41.95 ? 200 PRO R O 1 ATOM 2573 C CB . PRO B 2 184 ? 34.804 22.522 26.673 1.00 42.43 ? 200 PRO R CB 1 ATOM 2574 C CG . PRO B 2 184 ? 34.219 23.285 27.830 1.00 43.14 ? 200 PRO R CG 1 ATOM 2575 C CD . PRO B 2 184 ? 34.567 24.706 27.482 1.00 42.82 ? 200 PRO R CD 1 ATOM 2576 N N . TRP B 2 185 ? 36.944 22.397 24.264 1.00 43.49 ? 201 TRP R N 1 ATOM 2577 C CA . TRP B 2 185 ? 37.175 22.517 22.830 1.00 42.73 ? 201 TRP R CA 1 ATOM 2578 C C . TRP B 2 185 ? 35.841 22.468 22.110 1.00 43.91 ? 201 TRP R C 1 ATOM 2579 O O . TRP B 2 185 ? 34.927 21.768 22.543 1.00 45.75 ? 201 TRP R O 1 ATOM 2580 C CB . TRP B 2 185 ? 38.059 21.378 22.321 1.00 41.77 ? 201 TRP R CB 1 ATOM 2581 C CG . TRP B 2 185 ? 39.494 21.568 22.649 1.00 40.74 ? 201 TRP R CG 1 ATOM 2582 C CD1 . TRP B 2 185 ? 40.141 21.160 23.778 1.00 41.44 ? 201 TRP R CD1 1 ATOM 2583 C CD2 . TRP B 2 185 ? 40.456 22.279 21.866 1.00 39.59 ? 201 TRP R CD2 1 ATOM 2584 N NE1 . TRP B 2 185 ? 41.453 21.577 23.748 1.00 42.50 ? 201 TRP R NE1 1 ATOM 2585 C CE2 . TRP B 2 185 ? 41.670 22.267 22.584 1.00 40.01 ? 201 TRP R CE2 1 ATOM 2586 C CE3 . TRP B 2 185 ? 40.407 22.932 20.627 1.00 39.30 ? 201 TRP R CE3 1 ATOM 2587 C CZ2 . TRP B 2 185 ? 42.828 22.880 22.104 1.00 39.80 ? 201 TRP R CZ2 1 ATOM 2588 C CZ3 . TRP B 2 185 ? 41.560 23.544 20.150 1.00 38.59 ? 201 TRP R CZ3 1 ATOM 2589 C CH2 . TRP B 2 185 ? 42.754 23.513 20.888 1.00 38.97 ? 201 TRP R CH2 1 ATOM 2590 N N . SER B 2 186 ? 35.715 23.221 21.022 1.00 43.37 ? 202 SER R N 1 ATOM 2591 C CA . SER B 2 186 ? 34.477 23.213 20.251 1.00 43.30 ? 202 SER R CA 1 ATOM 2592 C C . SER B 2 186 ? 34.434 21.888 19.503 1.00 44.45 ? 202 SER R C 1 ATOM 2593 O O . SER B 2 186 ? 35.396 21.121 19.533 1.00 42.84 ? 202 SER R O 1 ATOM 2594 C CB . SER B 2 186 ? 34.471 24.345 19.224 1.00 43.53 ? 202 SER R CB 1 ATOM 2595 O OG . SER B 2 186 ? 35.432 24.100 18.204 1.00 41.86 ? 202 SER R OG 1 ATOM 2596 N N . SER B 2 187 ? 33.324 21.615 18.832 1.00 46.28 ? 203 SER R N 1 ATOM 2597 C CA . SER B 2 187 ? 33.233 20.392 18.056 1.00 50.62 ? 203 SER R CA 1 ATOM 2598 C C . SER B 2 187 ? 34.078 20.654 16.810 1.00 52.29 ? 203 SER R C 1 ATOM 2599 O O . SER B 2 187 ? 34.334 21.808 16.458 1.00 51.68 ? 203 SER R O 1 ATOM 2600 C CB . SER B 2 187 ? 31.780 20.106 17.671 1.00 52.09 ? 203 SER R CB 1 ATOM 2601 O OG . SER B 2 187 ? 31.247 21.150 16.881 1.00 57.84 ? 203 SER R OG 1 ATOM 2602 N N . GLU B 2 188 ? 34.525 19.594 16.151 1.00 53.66 ? 204 GLU R N 1 ATOM 2603 C CA . GLU B 2 188 ? 35.348 19.758 14.963 1.00 54.89 ? 204 GLU R CA 1 ATOM 2604 C C . GLU B 2 188 ? 34.522 19.821 13.686 1.00 54.08 ? 204 GLU R C 1 ATOM 2605 O O . GLU B 2 188 ? 33.551 19.081 13.528 1.00 54.07 ? 204 GLU R O 1 ATOM 2606 C CB . GLU B 2 188 ? 36.364 18.618 14.867 1.00 56.89 ? 204 GLU R CB 1 ATOM 2607 C CG . GLU B 2 188 ? 37.280 18.718 13.664 1.00 62.22 ? 204 GLU R CG 1 ATOM 2608 C CD . GLU B 2 188 ? 38.415 17.717 13.713 1.00 65.36 ? 204 GLU R CD 1 ATOM 2609 O OE1 . GLU B 2 188 ? 38.136 16.498 13.758 1.00 67.71 ? 204 GLU R OE1 1 ATOM 2610 O OE2 . GLU B 2 188 ? 39.588 18.150 13.708 1.00 66.45 ? 204 GLU R OE2 1 ATOM 2611 N N . VAL B 2 189 ? 34.906 20.723 12.786 1.00 52.50 ? 205 VAL R N 1 ATOM 2612 C CA . VAL B 2 189 ? 34.221 20.874 11.505 1.00 51.14 ? 205 VAL R CA 1 ATOM 2613 C C . VAL B 2 189 ? 35.243 20.743 10.379 1.00 51.49 ? 205 VAL R C 1 ATOM 2614 O O . VAL B 2 189 ? 36.400 21.141 10.530 1.00 50.13 ? 205 VAL R O 1 ATOM 2615 C CB . VAL B 2 189 ? 33.510 22.240 11.386 1.00 51.06 ? 205 VAL R CB 1 ATOM 2616 C CG1 . VAL B 2 189 ? 32.423 22.350 12.446 1.00 51.96 ? 205 VAL R CG1 1 ATOM 2617 C CG2 . VAL B 2 189 ? 34.515 23.373 11.531 1.00 48.87 ? 205 VAL R CG2 1 ATOM 2618 N N . CYS B 2 190 ? 34.817 20.169 9.258 1.00 52.06 ? 206 CYS R N 1 ATOM 2619 C CA . CYS B 2 190 ? 35.703 19.980 8.118 1.00 52.61 ? 206 CYS R CA 1 ATOM 2620 C C . CYS B 2 190 ? 35.105 20.559 6.851 1.00 50.68 ? 206 CYS R C 1 ATOM 2621 O O . CYS B 2 190 ? 33.916 20.861 6.785 1.00 49.43 ? 206 CYS R O 1 ATOM 2622 C CB . CYS B 2 190 ? 35.970 18.496 7.869 1.00 55.14 ? 206 CYS R CB 1 ATOM 2623 S SG . CYS B 2 190 ? 36.659 17.502 9.233 1.00 62.85 ? 206 CYS R SG 1 ATOM 2624 N N . LEU B 2 191 ? 35.945 20.695 5.835 1.00 50.42 ? 207 LEU R N 1 ATOM 2625 C CA . LEU B 2 191 ? 35.511 21.221 4.552 1.00 49.14 ? 207 LEU R CA 1 ATOM 2626 C C . LEU B 2 191 ? 36.549 20.865 3.498 1.00 47.50 ? 207 LEU R C 1 ATOM 2627 O O . LEU B 2 191 ? 37.753 20.909 3.754 1.00 47.49 ? 207 LEU R O 1 ATOM 2628 C CB . LEU B 2 191 ? 35.321 22.741 4.641 1.00 50.25 ? 207 LEU R CB 1 ATOM 2629 C CG . LEU B 2 191 ? 34.867 23.506 3.392 1.00 51.03 ? 207 LEU R CG 1 ATOM 2630 C CD1 . LEU B 2 191 ? 34.140 24.776 3.802 1.00 50.63 ? 207 LEU R CD1 1 ATOM 2631 C CD2 . LEU B 2 191 ? 36.074 23.829 2.516 1.00 50.80 ? 207 LEU R CD2 1 ATOM 2632 N N . THR B 2 192 ? 36.070 20.478 2.322 1.00 47.64 ? 208 THR R N 1 ATOM 2633 C CA . THR B 2 192 ? 36.947 20.122 1.215 1.00 48.18 ? 208 THR R CA 1 ATOM 2634 C C . THR B 2 192 ? 36.736 21.176 0.138 1.00 47.46 ? 208 THR R C 1 ATOM 2635 O O . THR B 2 192 ? 35.668 21.257 -0.470 1.00 46.99 ? 208 THR R O 1 ATOM 2636 C CB . THR B 2 192 ? 36.605 18.727 0.656 1.00 49.39 ? 208 THR R CB 1 ATOM 2637 O OG1 . THR B 2 192 ? 36.734 17.752 1.701 1.00 50.25 ? 208 THR R OG1 1 ATOM 2638 C CG2 . THR B 2 192 ? 37.556 18.361 -0.482 1.00 49.84 ? 208 THR R CG2 1 ATOM 2639 N N . PRO B 2 193 ? 37.754 22.013 -0.099 1.00 46.78 ? 209 PRO R N 1 ATOM 2640 C CA . PRO B 2 193 ? 37.662 23.070 -1.104 1.00 47.15 ? 209 PRO R CA 1 ATOM 2641 C C . PRO B 2 193 ? 37.997 22.579 -2.504 1.00 46.92 ? 209 PRO R C 1 ATOM 2642 O O . PRO B 2 193 ? 38.531 21.487 -2.680 1.00 46.68 ? 209 PRO R O 1 ATOM 2643 C CB . PRO B 2 193 ? 38.674 24.087 -0.601 1.00 46.12 ? 209 PRO R CB 1 ATOM 2644 C CG . PRO B 2 193 ? 39.781 23.191 -0.136 1.00 46.45 ? 209 PRO R CG 1 ATOM 2645 C CD . PRO B 2 193 ? 39.041 22.087 0.618 1.00 47.08 ? 209 PRO R CD 1 ATOM 2646 N N . LYS B 2 194 ? 37.681 23.400 -3.496 1.00 46.92 ? 210 LYS R N 1 ATOM 2647 C CA . LYS B 2 194 ? 37.975 23.071 -4.880 1.00 47.34 ? 210 LYS R CA 1 ATOM 2648 C C . LYS B 2 194 ? 39.446 23.352 -5.156 1.00 46.41 ? 210 LYS R C 1 ATOM 2649 O O . LYS B 2 194 ? 40.058 24.200 -4.507 1.00 44.62 ? 210 LYS R O 1 ATOM 2650 C CB . LYS B 2 194 ? 37.110 23.915 -5.821 1.00 50.31 ? 210 LYS R CB 1 ATOM 2651 C CG . LYS B 2 194 ? 35.687 23.405 -5.998 1.00 55.19 ? 210 LYS R CG 1 ATOM 2652 C CD . LYS B 2 194 ? 34.932 23.337 -4.678 1.00 60.51 ? 210 LYS R CD 1 ATOM 2653 C CE . LYS B 2 194 ? 33.544 22.736 -4.867 1.00 62.94 ? 210 LYS R CE 1 ATOM 2654 N NZ . LYS B 2 194 ? 33.617 21.358 -5.445 1.00 65.42 ? 210 LYS R NZ 1 ATOM 2655 N N . LYS B 2 195 ? 40.016 22.624 -6.107 1.00 45.90 ? 211 LYS R N 1 ATOM 2656 C CA . LYS B 2 195 ? 41.407 22.826 -6.488 1.00 45.27 ? 211 LYS R CA 1 ATOM 2657 C C . LYS B 2 195 ? 41.450 24.137 -7.272 1.00 42.79 ? 211 LYS R C 1 ATOM 2658 O O . LYS B 2 195 ? 40.672 24.331 -8.198 1.00 43.53 ? 211 LYS R O 1 ATOM 2659 C CB . LYS B 2 195 ? 41.878 21.678 -7.381 1.00 47.14 ? 211 LYS R CB 1 ATOM 2660 C CG . LYS B 2 195 ? 41.744 20.299 -6.755 1.00 48.84 ? 211 LYS R CG 1 ATOM 2661 C CD . LYS B 2 195 ? 42.635 20.153 -5.538 1.00 49.92 ? 211 LYS R CD 1 ATOM 2662 C CE . LYS B 2 195 ? 42.588 18.733 -4.998 1.00 51.11 ? 211 LYS R CE 1 ATOM 2663 N NZ . LYS B 2 195 ? 43.450 18.571 -3.799 1.00 52.25 ? 211 LYS R NZ 1 ATOM 2664 N N . ASN B 2 196 ? 42.342 25.040 -6.888 1.00 42.02 ? 212 ASN R N 1 ATOM 2665 C CA . ASN B 2 196 ? 42.463 26.328 -7.567 1.00 41.69 ? 212 ASN R CA 1 ATOM 2666 C C . ASN B 2 196 ? 43.774 26.992 -7.207 1.00 38.44 ? 212 ASN R C 1 ATOM 2667 O O . ASN B 2 196 ? 44.395 26.646 -6.207 1.00 38.09 ? 212 ASN R O 1 ATOM 2668 C CB . ASN B 2 196 ? 41.330 27.275 -7.152 1.00 45.71 ? 212 ASN R CB 1 ATOM 2669 C CG . ASN B 2 196 ? 40.077 27.097 -7.976 1.00 49.50 ? 212 ASN R CG 1 ATOM 2670 O OD1 . ASN B 2 196 ? 40.082 27.300 -9.191 1.00 51.89 ? 212 ASN R OD1 1 ATOM 2671 N ND2 . ASN B 2 196 ? 38.985 26.727 -7.315 1.00 53.07 ? 212 ASN R ND2 1 ATOM 2672 N N . VAL B 2 197 ? 44.189 27.945 -8.033 1.00 36.96 ? 213 VAL R N 1 ATOM 2673 C CA . VAL B 2 197 ? 45.406 28.709 -7.779 1.00 35.52 ? 213 VAL R CA 1 ATOM 2674 C C . VAL B 2 197 ? 44.907 29.898 -6.952 1.00 36.71 ? 213 VAL R C 1 ATOM 2675 O O . VAL B 2 197 ? 44.260 30.804 -7.478 1.00 36.65 ? 213 VAL R O 1 ATOM 2676 C CB . VAL B 2 197 ? 46.042 29.212 -9.102 1.00 35.75 ? 213 VAL R CB 1 ATOM 2677 C CG1 . VAL B 2 197 ? 47.293 30.034 -8.807 1.00 34.88 ? 213 VAL R CG1 1 ATOM 2678 C CG2 . VAL B 2 197 ? 46.400 28.019 -9.996 1.00 34.77 ? 213 VAL R CG2 1 ATOM 2679 N N . TYR B 2 198 ? 45.184 29.878 -5.652 1.00 36.11 ? 214 TYR R N 1 ATOM 2680 C CA . TYR B 2 198 ? 44.726 30.942 -4.765 1.00 36.27 ? 214 TYR R CA 1 ATOM 2681 C C . TYR B 2 198 ? 45.769 32.035 -4.623 1.00 33.97 ? 214 TYR R C 1 ATOM 2682 O O . TYR B 2 198 ? 46.840 31.818 -4.072 1.00 34.25 ? 214 TYR R O 1 ATOM 2683 C CB . TYR B 2 198 ? 44.341 30.342 -3.406 1.00 37.83 ? 214 TYR R CB 1 ATOM 2684 C CG . TYR B 2 198 ? 43.147 29.411 -3.508 1.00 39.25 ? 214 TYR R CG 1 ATOM 2685 C CD1 . TYR B 2 198 ? 41.902 29.891 -3.907 1.00 42.28 ? 214 TYR R CD1 1 ATOM 2686 C CD2 . TYR B 2 198 ? 43.271 28.044 -3.248 1.00 41.77 ? 214 TYR R CD2 1 ATOM 2687 C CE1 . TYR B 2 198 ? 40.809 29.038 -4.051 1.00 42.94 ? 214 TYR R CE1 1 ATOM 2688 C CE2 . TYR B 2 198 ? 42.181 27.179 -3.387 1.00 40.84 ? 214 TYR R CE2 1 ATOM 2689 C CZ . TYR B 2 198 ? 40.957 27.683 -3.791 1.00 43.48 ? 214 TYR R CZ 1 ATOM 2690 O OH . TYR B 2 198 ? 39.876 26.841 -3.952 1.00 44.50 ? 214 TYR R OH 1 ATOM 2691 N N . THR B 2 199 ? 45.428 33.214 -5.131 1.00 33.92 ? 215 THR R N 1 ATOM 2692 C CA . THR B 2 199 ? 46.319 34.369 -5.134 1.00 34.73 ? 215 THR R CA 1 ATOM 2693 C C . THR B 2 199 ? 45.765 35.541 -4.323 1.00 35.36 ? 215 THR R C 1 ATOM 2694 O O . THR B 2 199 ? 44.595 35.545 -3.944 1.00 34.80 ? 215 THR R O 1 ATOM 2695 C CB . THR B 2 199 ? 46.549 34.851 -6.587 1.00 35.24 ? 215 THR R CB 1 ATOM 2696 O OG1 . THR B 2 199 ? 45.303 35.295 -7.141 1.00 36.48 ? 215 THR R OG1 1 ATOM 2697 C CG2 . THR B 2 199 ? 47.086 33.712 -7.457 1.00 35.19 ? 215 THR R CG2 1 ATOM 2698 N N . CYS B 2 200 ? 46.607 36.543 -4.084 1.00 36.48 ? 216 CYS R N 1 ATOM 2699 C CA . CYS B 2 200 ? 46.207 37.725 -3.320 1.00 38.94 ? 216 CYS R CA 1 ATOM 2700 C C . CYS B 2 200 ? 46.843 38.992 -3.881 1.00 37.94 ? 216 CYS R C 1 ATOM 2701 O O . CYS B 2 200 ? 47.934 38.945 -4.447 1.00 37.21 ? 216 CYS R O 1 ATOM 2702 C CB . CYS B 2 200 ? 46.624 37.567 -1.854 1.00 41.50 ? 216 CYS R CB 1 ATOM 2703 S SG . CYS B 2 200 ? 45.886 36.120 -1.035 1.00 55.27 ? 216 CYS R SG 1 ATOM 2704 N N . ALA B 2 201 ? 46.165 40.125 -3.712 1.00 35.84 ? 217 ALA R N 1 ATOM 2705 C CA . ALA B 2 201 ? 46.685 41.405 -4.190 1.00 34.40 ? 217 ALA R CA 1 ATOM 2706 C C . ALA B 2 201 ? 47.811 41.893 -3.276 1.00 34.67 ? 217 ALA R C 1 ATOM 2707 O O . ALA B 2 201 ? 48.873 42.301 -3.748 1.00 35.36 ? 217 ALA R O 1 ATOM 2708 C CB . ALA B 2 201 ? 45.568 42.435 -4.244 1.00 32.61 ? 217 ALA R CB 1 ATOM 2709 N N . ILE B 2 202 ? 47.574 41.859 -1.967 1.00 34.76 ? 218 ILE R N 1 ATOM 2710 C CA . ILE B 2 202 ? 48.577 42.281 -0.990 1.00 34.10 ? 218 ILE R CA 1 ATOM 2711 C C . ILE B 2 202 ? 48.525 41.306 0.182 1.00 35.20 ? 218 ILE R C 1 ATOM 2712 O O . ILE B 2 202 ? 47.627 41.362 1.032 1.00 34.62 ? 218 ILE R O 1 ATOM 2713 C CB . ILE B 2 202 ? 48.325 43.733 -0.501 1.00 35.71 ? 218 ILE R CB 1 ATOM 2714 C CG1 . ILE B 2 202 ? 48.349 44.688 -1.704 1.00 34.75 ? 218 ILE R CG1 1 ATOM 2715 C CG2 . ILE B 2 202 ? 49.400 44.139 0.520 1.00 33.33 ? 218 ILE R CG2 1 ATOM 2716 C CD1 . ILE B 2 202 ? 48.127 46.141 -1.361 1.00 36.13 ? 218 ILE R CD1 1 ATOM 2717 N N . ARG B 2 203 ? 49.511 40.417 0.203 1.00 35.17 ? 219 ARG R N 1 ATOM 2718 C CA . ARG B 2 203 ? 49.638 39.355 1.192 1.00 35.47 ? 219 ARG R CA 1 ATOM 2719 C C . ARG B 2 203 ? 49.975 39.818 2.605 1.00 35.75 ? 219 ARG R C 1 ATOM 2720 O O . ARG B 2 203 ? 49.429 39.302 3.576 1.00 36.04 ? 219 ARG R O 1 ATOM 2721 C CB . ARG B 2 203 ? 50.690 38.354 0.693 1.00 35.54 ? 219 ARG R CB 1 ATOM 2722 C CG . ARG B 2 203 ? 50.736 37.013 1.419 1.00 38.94 ? 219 ARG R CG 1 ATOM 2723 C CD . ARG B 2 203 ? 51.278 35.906 0.484 1.00 42.61 ? 219 ARG R CD 1 ATOM 2724 N NE . ARG B 2 203 ? 50.223 34.972 0.077 1.00 44.32 ? 219 ARG R NE 1 ATOM 2725 C CZ . ARG B 2 203 ? 49.811 34.787 -1.172 1.00 45.10 ? 219 ARG R CZ 1 ATOM 2726 N NH1 . ARG B 2 203 ? 50.360 35.468 -2.162 1.00 44.62 ? 219 ARG R NH1 1 ATOM 2727 N NH2 . ARG B 2 203 ? 48.835 33.924 -1.430 1.00 50.09 ? 219 ARG R NH2 1 ATOM 2728 N N . SER B 2 204 ? 50.864 40.795 2.719 1.00 35.35 ? 220 SER R N 1 ATOM 2729 C CA . SER B 2 204 ? 51.272 41.294 4.023 1.00 35.64 ? 220 SER R CA 1 ATOM 2730 C C . SER B 2 204 ? 52.006 42.613 3.840 1.00 36.68 ? 220 SER R C 1 ATOM 2731 O O . SER B 2 204 ? 52.099 43.128 2.729 1.00 34.73 ? 220 SER R O 1 ATOM 2732 C CB . SER B 2 204 ? 52.218 40.294 4.686 1.00 35.56 ? 220 SER R CB 1 ATOM 2733 O OG . SER B 2 204 ? 53.437 40.228 3.961 1.00 35.05 ? 220 SER R OG 1 ATOM 2734 N N . LYS B 2 205 ? 52.545 43.143 4.933 1.00 36.63 ? 221 LYS R N 1 ATOM 2735 C CA . LYS B 2 205 ? 53.285 44.397 4.876 1.00 38.83 ? 221 LYS R CA 1 ATOM 2736 C C . LYS B 2 205 ? 54.518 44.244 3.985 1.00 39.05 ? 221 LYS R C 1 ATOM 2737 O O . LYS B 2 205 ? 54.849 45.141 3.208 1.00 38.43 ? 221 LYS R O 1 ATOM 2738 C CB . LYS B 2 205 ? 53.719 44.822 6.280 1.00 38.90 ? 221 LYS R CB 1 ATOM 2739 C CG . LYS B 2 205 ? 54.267 46.235 6.347 1.00 43.12 ? 221 LYS R CG 1 ATOM 2740 C CD . LYS B 2 205 ? 54.674 46.623 7.763 1.00 46.83 ? 221 LYS R CD 1 ATOM 2741 C CE . LYS B 2 205 ? 55.824 45.760 8.258 1.00 48.85 ? 221 LYS R CE 1 ATOM 2742 N NZ . LYS B 2 205 ? 56.278 46.170 9.608 1.00 52.33 ? 221 LYS R NZ 1 ATOM 2743 N N . GLU B 2 206 ? 55.189 43.102 4.100 1.00 39.17 ? 222 GLU R N 1 ATOM 2744 C CA . GLU B 2 206 ? 56.388 42.829 3.312 1.00 40.45 ? 222 GLU R CA 1 ATOM 2745 C C . GLU B 2 206 ? 56.099 42.656 1.818 1.00 39.27 ? 222 GLU R C 1 ATOM 2746 O O . GLU B 2 206 ? 57.011 42.678 0.999 1.00 39.68 ? 222 GLU R O 1 ATOM 2747 C CB . GLU B 2 206 ? 57.085 41.566 3.834 1.00 43.25 ? 222 GLU R CB 1 ATOM 2748 C CG . GLU B 2 206 ? 57.665 41.670 5.248 1.00 49.02 ? 222 GLU R CG 1 ATOM 2749 C CD . GLU B 2 206 ? 56.606 41.862 6.328 1.00 53.67 ? 222 GLU R CD 1 ATOM 2750 O OE1 . GLU B 2 206 ? 55.614 41.097 6.354 1.00 54.33 ? 222 GLU R OE1 1 ATOM 2751 O OE2 . GLU B 2 206 ? 56.775 42.777 7.165 1.00 56.38 ? 222 GLU R OE2 1 ATOM 2752 N N . ASP B 2 207 ? 54.829 42.484 1.467 1.00 38.12 ? 223 ASP R N 1 ATOM 2753 C CA . ASP B 2 207 ? 54.436 42.287 0.077 1.00 36.70 ? 223 ASP R CA 1 ATOM 2754 C C . ASP B 2 207 ? 54.077 43.598 -0.640 1.00 35.79 ? 223 ASP R C 1 ATOM 2755 O O . ASP B 2 207 ? 53.819 43.597 -1.841 1.00 36.12 ? 223 ASP R O 1 ATOM 2756 C CB . ASP B 2 207 ? 53.250 41.309 0.024 1.00 36.85 ? 223 ASP R CB 1 ATOM 2757 C CG . ASP B 2 207 ? 52.963 40.793 -1.383 1.00 40.77 ? 223 ASP R CG 1 ATOM 2758 O OD1 . ASP B 2 207 ? 53.927 40.476 -2.114 1.00 42.94 ? 223 ASP R OD1 1 ATOM 2759 O OD2 . ASP B 2 207 ? 51.768 40.683 -1.755 1.00 40.36 ? 223 ASP R OD2 1 ATOM 2760 N N . VAL B 2 208 ? 54.061 44.713 0.086 1.00 34.48 ? 224 VAL R N 1 ATOM 2761 C CA . VAL B 2 208 ? 53.710 45.994 -0.526 1.00 35.13 ? 224 VAL R CA 1 ATOM 2762 C C . VAL B 2 208 ? 54.688 46.408 -1.637 1.00 34.89 ? 224 VAL R C 1 ATOM 2763 O O . VAL B 2 208 ? 54.269 46.915 -2.669 1.00 33.71 ? 224 VAL R O 1 ATOM 2764 C CB . VAL B 2 208 ? 53.582 47.112 0.543 1.00 35.40 ? 224 VAL R CB 1 ATOM 2765 C CG1 . VAL B 2 208 ? 53.322 48.457 -0.118 1.00 35.60 ? 224 VAL R CG1 1 ATOM 2766 C CG2 . VAL B 2 208 ? 52.422 46.786 1.486 1.00 35.12 ? 224 VAL R CG2 1 ATOM 2767 N N . PRO B 2 209 ? 56.002 46.204 -1.437 1.00 35.18 ? 225 PRO R N 1 ATOM 2768 C CA . PRO B 2 209 ? 56.955 46.578 -2.491 1.00 35.27 ? 225 PRO R CA 1 ATOM 2769 C C . PRO B 2 209 ? 56.646 45.850 -3.808 1.00 35.61 ? 225 PRO R C 1 ATOM 2770 O O . PRO B 2 209 ? 56.853 46.400 -4.887 1.00 34.37 ? 225 PRO R O 1 ATOM 2771 C CB . PRO B 2 209 ? 58.303 46.165 -1.901 1.00 35.62 ? 225 PRO R CB 1 ATOM 2772 C CG . PRO B 2 209 ? 58.106 46.457 -0.426 1.00 35.01 ? 225 PRO R CG 1 ATOM 2773 C CD . PRO B 2 209 ? 56.703 45.901 -0.173 1.00 35.08 ? 225 PRO R CD 1 ATOM 2774 N N . ASN B 2 210 ? 56.154 44.617 -3.720 1.00 35.96 ? 226 ASN R N 1 ATOM 2775 C CA . ASN B 2 210 ? 55.802 43.859 -4.922 1.00 36.51 ? 226 ASN R CA 1 ATOM 2776 C C . ASN B 2 210 ? 54.540 44.447 -5.533 1.00 35.68 ? 226 ASN R C 1 ATOM 2777 O O . ASN B 2 210 ? 54.397 44.497 -6.750 1.00 35.99 ? 226 ASN R O 1 ATOM 2778 C CB . ASN B 2 210 ? 55.554 42.386 -4.603 1.00 38.67 ? 226 ASN R CB 1 ATOM 2779 C CG . ASN B 2 210 ? 56.800 41.681 -4.124 1.00 43.87 ? 226 ASN R CG 1 ATOM 2780 O OD1 . ASN B 2 210 ? 57.882 41.885 -4.667 1.00 45.80 ? 226 ASN R OD1 1 ATOM 2781 N ND2 . ASN B 2 210 ? 56.654 40.838 -3.107 1.00 46.53 ? 226 ASN R ND2 1 ATOM 2782 N N . PHE B 2 211 ? 53.619 44.883 -4.680 1.00 33.45 ? 227 PHE R N 1 ATOM 2783 C CA . PHE B 2 211 ? 52.381 45.490 -5.151 1.00 32.16 ? 227 PHE R CA 1 ATOM 2784 C C . PHE B 2 211 ? 52.734 46.769 -5.912 1.00 32.33 ? 227 PHE R C 1 ATOM 2785 O O . PHE B 2 211 ? 52.204 47.031 -6.993 1.00 32.37 ? 227 PHE R O 1 ATOM 2786 C CB . PHE B 2 211 ? 51.479 45.839 -3.963 1.00 31.34 ? 227 PHE R CB 1 ATOM 2787 C CG . PHE B 2 211 ? 50.305 46.704 -4.325 1.00 31.12 ? 227 PHE R CG 1 ATOM 2788 C CD1 . PHE B 2 211 ? 49.177 46.158 -4.932 1.00 31.78 ? 227 PHE R CD1 1 ATOM 2789 C CD2 . PHE B 2 211 ? 50.336 48.071 -4.080 1.00 31.57 ? 227 PHE R CD2 1 ATOM 2790 C CE1 . PHE B 2 211 ? 48.098 46.963 -5.288 1.00 31.93 ? 227 PHE R CE1 1 ATOM 2791 C CE2 . PHE B 2 211 ? 49.261 48.886 -4.433 1.00 32.39 ? 227 PHE R CE2 1 ATOM 2792 C CZ . PHE B 2 211 ? 48.142 48.330 -5.037 1.00 31.91 ? 227 PHE R CZ 1 ATOM 2793 N N . LYS B 2 212 ? 53.641 47.556 -5.340 1.00 30.83 ? 228 LYS R N 1 ATOM 2794 C CA . LYS B 2 212 ? 54.052 48.807 -5.955 1.00 33.32 ? 228 LYS R CA 1 ATOM 2795 C C . LYS B 2 212 ? 54.747 48.550 -7.295 1.00 33.80 ? 228 LYS R C 1 ATOM 2796 O O . LYS B 2 212 ? 54.467 49.222 -8.290 1.00 31.49 ? 228 LYS R O 1 ATOM 2797 C CB . LYS B 2 212 ? 54.983 49.573 -5.011 1.00 34.45 ? 228 LYS R CB 1 ATOM 2798 C CG . LYS B 2 212 ? 55.404 50.949 -5.528 1.00 36.86 ? 228 LYS R CG 1 ATOM 2799 C CD . LYS B 2 212 ? 56.387 51.621 -4.570 1.00 40.91 ? 228 LYS R CD 1 ATOM 2800 C CE . LYS B 2 212 ? 56.898 52.940 -5.140 1.00 44.82 ? 228 LYS R CE 1 ATOM 2801 N NZ . LYS B 2 212 ? 57.895 53.617 -4.255 1.00 45.65 ? 228 LYS R NZ 1 ATOM 2802 N N . GLU B 2 213 ? 55.642 47.568 -7.315 1.00 33.71 ? 229 GLU R N 1 ATOM 2803 C CA . GLU B 2 213 ? 56.375 47.219 -8.526 1.00 34.68 ? 229 GLU R CA 1 ATOM 2804 C C . GLU B 2 213 ? 55.413 46.832 -9.648 1.00 33.52 ? 229 GLU R C 1 ATOM 2805 O O . GLU B 2 213 ? 55.518 47.325 -10.773 1.00 32.14 ? 229 GLU R O 1 ATOM 2806 C CB . GLU B 2 213 ? 57.334 46.061 -8.238 1.00 38.98 ? 229 GLU R CB 1 ATOM 2807 C CG . GLU B 2 213 ? 58.346 45.778 -9.345 1.00 46.84 ? 229 GLU R CG 1 ATOM 2808 C CD . GLU B 2 213 ? 59.216 44.563 -9.041 1.00 52.31 ? 229 GLU R CD 1 ATOM 2809 O OE1 . GLU B 2 213 ? 59.686 44.433 -7.888 1.00 54.42 ? 229 GLU R OE1 1 ATOM 2810 O OE2 . GLU B 2 213 ? 59.437 43.739 -9.956 1.00 57.20 ? 229 GLU R OE2 1 ATOM 2811 N N . LYS B 2 214 ? 54.469 45.951 -9.336 1.00 31.05 ? 230 LYS R N 1 ATOM 2812 C CA . LYS B 2 214 ? 53.499 45.511 -10.323 1.00 30.85 ? 230 LYS R CA 1 ATOM 2813 C C . LYS B 2 214 ? 52.620 46.662 -10.822 1.00 31.19 ? 230 LYS R C 1 ATOM 2814 O O . LYS B 2 214 ? 52.465 46.853 -12.033 1.00 31.53 ? 230 LYS R O 1 ATOM 2815 C CB . LYS B 2 214 ? 52.618 44.400 -9.739 1.00 30.16 ? 230 LYS R CB 1 ATOM 2816 C CG . LYS B 2 214 ? 51.463 44.000 -10.641 1.00 31.40 ? 230 LYS R CG 1 ATOM 2817 C CD . LYS B 2 214 ? 50.691 42.799 -10.103 1.00 32.56 ? 230 LYS R CD 1 ATOM 2818 C CE . LYS B 2 214 ? 49.583 42.430 -11.076 1.00 30.37 ? 230 LYS R CE 1 ATOM 2819 N NZ . LYS B 2 214 ? 48.772 41.275 -10.621 1.00 30.68 ? 230 LYS R NZ 1 ATOM 2820 N N . MET B 2 215 ? 52.046 47.430 -9.899 1.00 29.85 ? 231 MET R N 1 ATOM 2821 C CA . MET B 2 215 ? 51.182 48.539 -10.295 1.00 29.59 ? 231 MET R CA 1 ATOM 2822 C C . MET B 2 215 ? 51.927 49.596 -11.112 1.00 27.53 ? 231 MET R C 1 ATOM 2823 O O . MET B 2 215 ? 51.335 50.262 -11.953 1.00 28.58 ? 231 MET R O 1 ATOM 2824 C CB . MET B 2 215 ? 50.528 49.191 -9.071 1.00 30.48 ? 231 MET R CB 1 ATOM 2825 C CG . MET B 2 215 ? 49.533 48.304 -8.342 1.00 34.10 ? 231 MET R CG 1 ATOM 2826 S SD . MET B 2 215 ? 48.402 47.406 -9.444 1.00 37.57 ? 231 MET R SD 1 ATOM 2827 C CE . MET B 2 215 ? 47.498 48.759 -10.222 1.00 35.55 ? 231 MET R CE 1 ATOM 2828 N N . THR B 2 216 ? 53.216 49.764 -10.862 1.00 28.62 ? 232 THR R N 1 ATOM 2829 C CA . THR B 2 216 ? 53.997 50.733 -11.626 1.00 31.25 ? 232 THR R CA 1 ATOM 2830 C C . THR B 2 216 ? 54.028 50.256 -13.084 1.00 33.83 ? 232 THR R C 1 ATOM 2831 O O . THR B 2 216 ? 53.892 51.045 -14.030 1.00 33.91 ? 232 THR R O 1 ATOM 2832 C CB . THR B 2 216 ? 55.429 50.823 -11.087 1.00 32.67 ? 232 THR R CB 1 ATOM 2833 O OG1 . THR B 2 216 ? 55.398 51.381 -9.765 1.00 36.32 ? 232 THR R OG1 1 ATOM 2834 C CG2 . THR B 2 216 ? 56.307 51.703 -11.995 1.00 32.63 ? 232 THR R CG2 1 ATOM 2835 N N . ARG B 2 217 ? 54.185 48.949 -13.242 1.00 33.26 ? 233 ARG R N 1 ATOM 2836 C CA . ARG B 2 217 ? 54.234 48.302 -14.546 1.00 35.61 ? 233 ARG R CA 1 ATOM 2837 C C . ARG B 2 217 ? 52.869 48.404 -15.236 1.00 34.47 ? 233 ARG R C 1 ATOM 2838 O O . ARG B 2 217 ? 52.779 48.681 -16.432 1.00 34.76 ? 233 ARG R O 1 ATOM 2839 C CB . ARG B 2 217 ? 54.637 46.840 -14.337 1.00 36.33 ? 233 ARG R CB 1 ATOM 2840 C CG . ARG B 2 217 ? 54.892 46.037 -15.571 1.00 40.03 ? 233 ARG R CG 1 ATOM 2841 C CD . ARG B 2 217 ? 55.642 44.766 -15.175 1.00 40.56 ? 233 ARG R CD 1 ATOM 2842 N NE . ARG B 2 217 ? 54.865 43.926 -14.274 1.00 39.39 ? 233 ARG R NE 1 ATOM 2843 C CZ . ARG B 2 217 ? 55.303 43.459 -13.107 1.00 39.67 ? 233 ARG R CZ 1 ATOM 2844 N NH1 . ARG B 2 217 ? 56.525 43.747 -12.674 1.00 36.63 ? 233 ARG R NH1 1 ATOM 2845 N NH2 . ARG B 2 217 ? 54.514 42.686 -12.375 1.00 35.88 ? 233 ARG R NH2 1 ATOM 2846 N N . VAL B 2 218 ? 51.802 48.192 -14.475 1.00 33.93 ? 234 VAL R N 1 ATOM 2847 C CA . VAL B 2 218 ? 50.458 48.282 -15.027 1.00 33.30 ? 234 VAL R CA 1 ATOM 2848 C C . VAL B 2 218 ? 50.156 49.697 -15.520 1.00 33.96 ? 234 VAL R C 1 ATOM 2849 O O . VAL B 2 218 ? 49.605 49.884 -16.606 1.00 33.84 ? 234 VAL R O 1 ATOM 2850 C CB . VAL B 2 218 ? 49.396 47.884 -13.978 1.00 33.66 ? 234 VAL R CB 1 ATOM 2851 C CG1 . VAL B 2 218 ? 48.010 48.284 -14.454 1.00 30.83 ? 234 VAL R CG1 1 ATOM 2852 C CG2 . VAL B 2 218 ? 49.449 46.386 -13.733 1.00 33.27 ? 234 VAL R CG2 1 ATOM 2853 N N . ILE B 2 219 ? 50.509 50.693 -14.715 1.00 32.85 ? 235 ILE R N 1 ATOM 2854 C CA . ILE B 2 219 ? 50.262 52.081 -15.082 1.00 32.84 ? 235 ILE R CA 1 ATOM 2855 C C . ILE B 2 219 ? 51.017 52.439 -16.362 1.00 33.67 ? 235 ILE R C 1 ATOM 2856 O O . ILE B 2 219 ? 50.478 53.085 -17.257 1.00 32.96 ? 235 ILE R O 1 ATOM 2857 C CB . ILE B 2 219 ? 50.710 53.039 -13.949 1.00 31.35 ? 235 ILE R CB 1 ATOM 2858 C CG1 . ILE B 2 219 ? 49.740 52.938 -12.769 1.00 31.77 ? 235 ILE R CG1 1 ATOM 2859 C CG2 . ILE B 2 219 ? 50.814 54.471 -14.478 1.00 31.70 ? 235 ILE R CG2 1 ATOM 2860 C CD1 . ILE B 2 219 ? 50.249 53.594 -11.487 1.00 28.78 ? 235 ILE R CD1 1 ATOM 2861 N N . LYS B 2 220 ? 52.268 52.009 -16.439 1.00 35.56 ? 236 LYS R N 1 ATOM 2862 C CA . LYS B 2 220 ? 53.111 52.292 -17.591 1.00 38.93 ? 236 LYS R CA 1 ATOM 2863 C C . LYS B 2 220 ? 52.562 51.684 -18.891 1.00 39.38 ? 236 LYS R C 1 ATOM 2864 O O . LYS B 2 220 ? 52.619 52.308 -19.949 1.00 39.28 ? 236 LYS R O 1 ATOM 2865 C CB . LYS B 2 220 ? 54.530 51.785 -17.306 1.00 41.53 ? 236 LYS R CB 1 ATOM 2866 C CG . LYS B 2 220 ? 55.569 52.122 -18.364 1.00 47.80 ? 236 LYS R CG 1 ATOM 2867 C CD . LYS B 2 220 ? 56.955 51.642 -17.929 1.00 50.37 ? 236 LYS R CD 1 ATOM 2868 C CE . LYS B 2 220 ? 57.974 51.723 -19.068 1.00 53.36 ? 236 LYS R CE 1 ATOM 2869 N NZ . LYS B 2 220 ? 58.107 53.106 -19.613 1.00 55.79 ? 236 LYS R NZ 1 ATOM 2870 N N . ARG B 2 221 ? 52.010 50.480 -18.809 1.00 38.49 ? 237 ARG R N 1 ATOM 2871 C CA . ARG B 2 221 ? 51.469 49.822 -19.994 1.00 38.39 ? 237 ARG R CA 1 ATOM 2872 C C . ARG B 2 221 ? 50.042 50.239 -20.324 1.00 39.03 ? 237 ARG R C 1 ATOM 2873 O O . ARG B 2 221 ? 49.654 50.274 -21.486 1.00 39.87 ? 237 ARG R O 1 ATOM 2874 C CB . ARG B 2 221 ? 51.497 48.298 -19.819 1.00 36.40 ? 237 ARG R CB 1 ATOM 2875 C CG . ARG B 2 221 ? 52.888 47.709 -19.697 1.00 35.05 ? 237 ARG R CG 1 ATOM 2876 C CD . ARG B 2 221 ? 52.842 46.215 -19.381 1.00 33.62 ? 237 ARG R CD 1 ATOM 2877 N NE . ARG B 2 221 ? 54.183 45.702 -19.115 1.00 34.23 ? 237 ARG R NE 1 ATOM 2878 C CZ . ARG B 2 221 ? 54.456 44.474 -18.686 1.00 32.70 ? 237 ARG R CZ 1 ATOM 2879 N NH1 . ARG B 2 221 ? 53.477 43.603 -18.466 1.00 30.80 ? 237 ARG R NH1 1 ATOM 2880 N NH2 . ARG B 2 221 ? 55.714 44.124 -18.463 1.00 32.46 ? 237 ARG R NH2 1 ATOM 2881 N N . LYS B 2 222 ? 49.267 50.563 -19.299 1.00 37.82 ? 238 LYS R N 1 ATOM 2882 C CA . LYS B 2 222 ? 47.867 50.913 -19.483 1.00 38.12 ? 238 LYS R CA 1 ATOM 2883 C C . LYS B 2 222 ? 47.516 52.334 -19.916 1.00 37.69 ? 238 LYS R C 1 ATOM 2884 O O . LYS B 2 222 ? 46.581 52.529 -20.687 1.00 39.11 ? 238 LYS R O 1 ATOM 2885 C CB . LYS B 2 222 ? 47.104 50.585 -18.193 1.00 37.80 ? 238 LYS R CB 1 ATOM 2886 C CG . LYS B 2 222 ? 45.592 50.739 -18.283 1.00 36.94 ? 238 LYS R CG 1 ATOM 2887 C CD . LYS B 2 222 ? 44.942 50.374 -16.954 1.00 37.92 ? 238 LYS R CD 1 ATOM 2888 C CE . LYS B 2 222 ? 43.435 50.588 -16.977 1.00 38.15 ? 238 LYS R CE 1 ATOM 2889 N NZ . LYS B 2 222 ? 42.756 49.731 -17.982 1.00 40.04 ? 238 LYS R NZ 1 ATOM 2890 N N . PHE B 2 223 ? 48.248 53.324 -19.424 1.00 38.03 ? 239 PHE R N 1 ATOM 2891 C CA . PHE B 2 223 ? 47.936 54.721 -19.736 1.00 38.50 ? 239 PHE R CA 1 ATOM 2892 C C . PHE B 2 223 ? 48.955 55.348 -20.675 1.00 39.17 ? 239 PHE R C 1 ATOM 2893 O O . PHE B 2 223 ? 50.031 54.798 -20.868 1.00 39.40 ? 239 PHE R O 1 ATOM 2894 C CB . PHE B 2 223 ? 47.877 55.519 -18.426 1.00 35.41 ? 239 PHE R CB 1 ATOM 2895 C CG . PHE B 2 223 ? 46.875 54.987 -17.447 1.00 33.70 ? 239 PHE R CG 1 ATOM 2896 C CD1 . PHE B 2 223 ? 45.533 55.328 -17.551 1.00 34.32 ? 239 PHE R CD1 1 ATOM 2897 C CD2 . PHE B 2 223 ? 47.268 54.109 -16.441 1.00 33.58 ? 239 PHE R CD2 1 ATOM 2898 C CE1 . PHE B 2 223 ? 44.588 54.799 -16.665 1.00 35.45 ? 239 PHE R CE1 1 ATOM 2899 C CE2 . PHE B 2 223 ? 46.338 53.576 -15.553 1.00 32.81 ? 239 PHE R CE2 1 ATOM 2900 C CZ . PHE B 2 223 ? 44.991 53.921 -15.666 1.00 33.26 ? 239 PHE R CZ 1 ATOM 2901 N N . ASN B 2 224 ? 48.620 56.493 -21.264 1.00 40.19 ? 240 ASN R N 1 ATOM 2902 C CA . ASN B 2 224 ? 49.569 57.157 -22.151 1.00 41.51 ? 240 ASN R CA 1 ATOM 2903 C C . ASN B 2 224 ? 50.697 57.773 -21.324 1.00 42.24 ? 240 ASN R C 1 ATOM 2904 O O . ASN B 2 224 ? 50.559 57.969 -20.115 1.00 40.97 ? 240 ASN R O 1 ATOM 2905 C CB . ASN B 2 224 ? 48.883 58.230 -23.020 1.00 43.00 ? 240 ASN R CB 1 ATOM 2906 C CG . ASN B 2 224 ? 48.319 59.397 -22.213 1.00 45.24 ? 240 ASN R CG 1 ATOM 2907 O OD1 . ASN B 2 224 ? 48.682 59.616 -21.059 1.00 46.30 ? 240 ASN R OD1 1 ATOM 2908 N ND2 . ASN B 2 224 ? 47.436 60.167 -22.842 1.00 44.70 ? 240 ASN R ND2 1 ATOM 2909 N N . LYS B 2 225 ? 51.811 58.067 -21.983 1.00 43.05 ? 241 LYS R N 1 ATOM 2910 C CA . LYS B 2 225 ? 52.987 58.631 -21.332 1.00 44.57 ? 241 LYS R CA 1 ATOM 2911 C C . LYS B 2 225 ? 52.713 59.809 -20.394 1.00 44.62 ? 241 LYS R C 1 ATOM 2912 O O . LYS B 2 225 ? 53.221 59.850 -19.270 1.00 44.40 ? 241 LYS R O 1 ATOM 2913 C CB . LYS B 2 225 ? 54.010 59.042 -22.402 1.00 47.59 ? 241 LYS R CB 1 ATOM 2914 C CG . LYS B 2 225 ? 55.243 59.765 -21.868 1.00 53.12 ? 241 LYS R CG 1 ATOM 2915 C CD . LYS B 2 225 ? 56.059 58.900 -20.903 1.00 58.66 ? 241 LYS R CD 1 ATOM 2916 C CE . LYS B 2 225 ? 56.748 57.732 -21.615 1.00 61.77 ? 241 LYS R CE 1 ATOM 2917 N NZ . LYS B 2 225 ? 57.481 56.834 -20.665 1.00 62.03 ? 241 LYS R NZ 1 ATOM 2918 N N . GLN B 2 226 ? 51.907 60.759 -20.854 1.00 42.87 ? 242 GLN R N 1 ATOM 2919 C CA . GLN B 2 226 ? 51.594 61.949 -20.073 1.00 42.30 ? 242 GLN R CA 1 ATOM 2920 C C . GLN B 2 226 ? 51.028 61.689 -18.674 1.00 41.40 ? 242 GLN R C 1 ATOM 2921 O O . GLN B 2 226 ? 51.417 62.346 -17.714 1.00 40.07 ? 242 GLN R O 1 ATOM 2922 C CB . GLN B 2 226 ? 50.619 62.841 -20.847 1.00 43.15 ? 242 GLN R CB 1 ATOM 2923 C CG . GLN B 2 226 ? 50.187 64.074 -20.071 1.00 46.49 ? 242 GLN R CG 1 ATOM 2924 C CD . GLN B 2 226 ? 49.033 64.801 -20.719 1.00 49.63 ? 242 GLN R CD 1 ATOM 2925 O OE1 . GLN B 2 226 ? 47.998 64.201 -21.023 1.00 52.11 ? 242 GLN R OE1 1 ATOM 2926 N NE2 . GLN B 2 226 ? 49.195 66.102 -20.929 1.00 50.06 ? 242 GLN R NE2 1 ATOM 2927 N N . SER B 2 227 ? 50.102 60.745 -18.559 1.00 40.44 ? 243 SER R N 1 ATOM 2928 C CA . SER B 2 227 ? 49.507 60.457 -17.265 1.00 41.91 ? 243 SER R CA 1 ATOM 2929 C C . SER B 2 227 ? 50.368 59.537 -16.390 1.00 42.32 ? 243 SER R C 1 ATOM 2930 O O . SER B 2 227 ? 50.146 59.454 -15.183 1.00 42.86 ? 243 SER R O 1 ATOM 2931 C CB . SER B 2 227 ? 48.107 59.864 -17.453 1.00 39.95 ? 243 SER R CB 1 ATOM 2932 O OG . SER B 2 227 ? 48.163 58.611 -18.100 1.00 43.54 ? 243 SER R OG 1 ATOM 2933 N N . HIS B 2 228 ? 51.352 58.872 -17.001 1.00 42.28 ? 244 HIS R N 1 ATOM 2934 C CA . HIS B 2 228 ? 52.267 57.953 -16.305 1.00 42.15 ? 244 HIS R CA 1 ATOM 2935 C C . HIS B 2 228 ? 52.812 58.467 -14.985 1.00 41.47 ? 244 HIS R C 1 ATOM 2936 O O . HIS B 2 228 ? 52.549 57.901 -13.925 1.00 40.31 ? 244 HIS R O 1 ATOM 2937 C CB . HIS B 2 228 ? 53.497 57.635 -17.169 1.00 45.13 ? 244 HIS R CB 1 ATOM 2938 C CG . HIS B 2 228 ? 53.277 56.570 -18.191 1.00 46.95 ? 244 HIS R CG 1 ATOM 2939 N ND1 . HIS B 2 228 ? 52.022 56.172 -18.598 1.00 49.41 ? 244 HIS R ND1 1 ATOM 2940 C CD2 . HIS B 2 228 ? 54.158 55.868 -18.943 1.00 47.85 ? 244 HIS R CD2 1 ATOM 2941 C CE1 . HIS B 2 228 ? 52.141 55.272 -19.560 1.00 47.89 ? 244 HIS R CE1 1 ATOM 2942 N NE2 . HIS B 2 228 ? 53.425 55.070 -19.789 1.00 47.37 ? 244 HIS R NE2 1 ATOM 2943 N N . SER B 2 229 ? 53.618 59.522 -15.079 1.00 38.99 ? 245 SER R N 1 ATOM 2944 C CA . SER B 2 229 ? 54.269 60.119 -13.926 1.00 40.24 ? 245 SER R CA 1 ATOM 2945 C C . SER B 2 229 ? 53.346 60.511 -12.775 1.00 38.50 ? 245 SER R C 1 ATOM 2946 O O . SER B 2 229 ? 53.681 60.281 -11.612 1.00 37.08 ? 245 SER R O 1 ATOM 2947 C CB . SER B 2 229 ? 55.078 61.346 -14.363 1.00 41.51 ? 245 SER R CB 1 ATOM 2948 O OG . SER B 2 229 ? 54.223 62.354 -14.878 1.00 45.35 ? 245 SER R OG 1 ATOM 2949 N N . TYR B 2 230 ? 52.201 61.113 -13.093 1.00 35.96 ? 246 TYR R N 1 ATOM 2950 C CA . TYR B 2 230 ? 51.264 61.537 -12.057 1.00 33.97 ? 246 TYR R CA 1 ATOM 2951 C C . TYR B 2 230 ? 50.689 60.335 -11.325 1.00 33.22 ? 246 TYR R C 1 ATOM 2952 O O . TYR B 2 230 ? 50.751 60.257 -10.096 1.00 32.18 ? 246 TYR R O 1 ATOM 2953 C CB . TYR B 2 230 ? 50.130 62.367 -12.665 1.00 33.30 ? 246 TYR R CB 1 ATOM 2954 C CG . TYR B 2 230 ? 50.581 63.704 -13.226 1.00 34.90 ? 246 TYR R CG 1 ATOM 2955 C CD1 . TYR B 2 230 ? 50.769 64.809 -12.393 1.00 33.28 ? 246 TYR R CD1 1 ATOM 2956 C CD2 . TYR B 2 230 ? 50.854 63.852 -14.588 1.00 34.44 ? 246 TYR R CD2 1 ATOM 2957 C CE1 . TYR B 2 230 ? 51.221 66.029 -12.902 1.00 34.99 ? 246 TYR R CE1 1 ATOM 2958 C CE2 . TYR B 2 230 ? 51.308 65.066 -15.109 1.00 34.74 ? 246 TYR R CE2 1 ATOM 2959 C CZ . TYR B 2 230 ? 51.489 66.146 -14.263 1.00 37.04 ? 246 TYR R CZ 1 ATOM 2960 O OH . TYR B 2 230 ? 51.948 67.339 -14.780 1.00 39.19 ? 246 TYR R OH 1 ATOM 2961 N N . LEU B 2 231 ? 50.143 59.391 -12.082 1.00 32.27 ? 247 LEU R N 1 ATOM 2962 C CA . LEU B 2 231 ? 49.555 58.199 -11.487 1.00 33.57 ? 247 LEU R CA 1 ATOM 2963 C C . LEU B 2 231 ? 50.571 57.428 -10.648 1.00 32.63 ? 247 LEU R C 1 ATOM 2964 O O . LEU B 2 231 ? 50.238 56.892 -9.590 1.00 31.49 ? 247 LEU R O 1 ATOM 2965 C CB . LEU B 2 231 ? 48.974 57.300 -12.579 1.00 32.34 ? 247 LEU R CB 1 ATOM 2966 C CG . LEU B 2 231 ? 47.708 57.861 -13.232 1.00 33.97 ? 247 LEU R CG 1 ATOM 2967 C CD1 . LEU B 2 231 ? 47.356 57.058 -14.484 1.00 36.46 ? 247 LEU R CD1 1 ATOM 2968 C CD2 . LEU B 2 231 ? 46.565 57.820 -12.230 1.00 32.91 ? 247 LEU R CD2 1 ATOM 2969 N N . THR B 2 232 ? 51.813 57.390 -11.111 1.00 30.51 ? 248 THR R N 1 ATOM 2970 C CA . THR B 2 232 ? 52.856 56.687 -10.390 1.00 32.95 ? 248 THR R CA 1 ATOM 2971 C C . THR B 2 232 ? 53.226 57.391 -9.085 1.00 33.93 ? 248 THR R C 1 ATOM 2972 O O . THR B 2 232 ? 53.590 56.735 -8.111 1.00 33.99 ? 248 THR R O 1 ATOM 2973 C CB . THR B 2 232 ? 54.091 56.499 -11.278 1.00 33.42 ? 248 THR R CB 1 ATOM 2974 O OG1 . THR B 2 232 ? 53.735 55.657 -12.381 1.00 36.86 ? 248 THR R OG1 1 ATOM 2975 C CG2 . THR B 2 232 ? 55.223 55.843 -10.508 1.00 35.69 ? 248 THR R CG2 1 ATOM 2976 N N . LYS B 2 233 ? 53.130 58.718 -9.053 1.00 33.90 ? 249 LYS R N 1 ATOM 2977 C CA . LYS B 2 233 ? 53.434 59.441 -7.821 1.00 34.68 ? 249 LYS R CA 1 ATOM 2978 C C . LYS B 2 233 ? 52.351 59.137 -6.781 1.00 32.65 ? 249 LYS R C 1 ATOM 2979 O O . LYS B 2 233 ? 52.654 58.968 -5.607 1.00 32.42 ? 249 LYS R O 1 ATOM 2980 C CB . LYS B 2 233 ? 53.505 60.952 -8.068 1.00 36.05 ? 249 LYS R CB 1 ATOM 2981 C CG . LYS B 2 233 ? 54.724 61.399 -8.863 1.00 39.41 ? 249 LYS R CG 1 ATOM 2982 C CD . LYS B 2 233 ? 54.648 62.884 -9.180 1.00 44.25 ? 249 LYS R CD 1 ATOM 2983 C CE . LYS B 2 233 ? 55.846 63.351 -9.995 1.00 47.12 ? 249 LYS R CE 1 ATOM 2984 N NZ . LYS B 2 233 ? 57.106 63.228 -9.222 1.00 51.98 ? 249 LYS R NZ 1 ATOM 2985 N N . PHE B 2 234 ? 51.092 59.064 -7.213 1.00 31.87 ? 250 PHE R N 1 ATOM 2986 C CA . PHE B 2 234 ? 50.002 58.763 -6.289 1.00 32.18 ? 250 PHE R CA 1 ATOM 2987 C C . PHE B 2 234 ? 50.125 57.321 -5.788 1.00 32.10 ? 250 PHE R C 1 ATOM 2988 O O . PHE B 2 234 ? 49.781 57.020 -4.646 1.00 33.25 ? 250 PHE R O 1 ATOM 2989 C CB . PHE B 2 234 ? 48.640 58.986 -6.958 1.00 30.47 ? 250 PHE R CB 1 ATOM 2990 C CG . PHE B 2 234 ? 48.386 60.420 -7.354 1.00 34.56 ? 250 PHE R CG 1 ATOM 2991 C CD1 . PHE B 2 234 ? 48.652 61.461 -6.462 1.00 35.07 ? 250 PHE R CD1 1 ATOM 2992 C CD2 . PHE B 2 234 ? 47.881 60.732 -8.613 1.00 33.63 ? 250 PHE R CD2 1 ATOM 2993 C CE1 . PHE B 2 234 ? 48.418 62.792 -6.820 1.00 35.10 ? 250 PHE R CE1 1 ATOM 2994 C CE2 . PHE B 2 234 ? 47.645 62.058 -8.981 1.00 36.05 ? 250 PHE R CE2 1 ATOM 2995 C CZ . PHE B 2 234 ? 47.915 63.089 -8.082 1.00 36.69 ? 250 PHE R CZ 1 ATOM 2996 N N . LEU B 2 235 ? 50.619 56.435 -6.645 1.00 31.91 ? 251 LEU R N 1 ATOM 2997 C CA . LEU B 2 235 ? 50.820 55.039 -6.267 1.00 31.69 ? 251 LEU R CA 1 ATOM 2998 C C . LEU B 2 235 ? 51.857 54.989 -5.156 1.00 31.64 ? 251 LEU R C 1 ATOM 2999 O O . LEU B 2 235 ? 51.766 54.175 -4.242 1.00 33.16 ? 251 LEU R O 1 ATOM 3000 C CB . LEU B 2 235 ? 51.333 54.223 -7.456 1.00 30.64 ? 251 LEU R CB 1 ATOM 3001 C CG . LEU B 2 235 ? 51.828 52.818 -7.099 1.00 31.97 ? 251 LEU R CG 1 ATOM 3002 C CD1 . LEU B 2 235 ? 50.650 51.992 -6.567 1.00 29.52 ? 251 LEU R CD1 1 ATOM 3003 C CD2 . LEU B 2 235 ? 52.461 52.153 -8.337 1.00 30.79 ? 251 LEU R CD2 1 ATOM 3004 N N . GLY B 2 236 ? 52.853 55.863 -5.253 1.00 31.95 ? 252 GLY R N 1 ATOM 3005 C CA . GLY B 2 236 ? 53.903 55.906 -4.254 1.00 31.60 ? 252 GLY R CA 1 ATOM 3006 C C . GLY B 2 236 ? 53.376 56.299 -2.887 1.00 32.14 ? 252 GLY R C 1 ATOM 3007 O O . GLY B 2 236 ? 53.755 55.707 -1.874 1.00 31.29 ? 252 GLY R O 1 ATOM 3008 N N . SER B 2 237 ? 52.501 57.298 -2.850 1.00 32.12 ? 253 SER R N 1 ATOM 3009 C CA . SER B 2 237 ? 51.937 57.746 -1.584 1.00 33.54 ? 253 SER R CA 1 ATOM 3010 C C . SER B 2 237 ? 50.946 56.729 -1.019 1.00 33.39 ? 253 SER R C 1 ATOM 3011 O O . SER B 2 237 ? 50.884 56.534 0.194 1.00 36.23 ? 253 SER R O 1 ATOM 3012 C CB . SER B 2 237 ? 51.259 59.110 -1.751 1.00 31.89 ? 253 SER R CB 1 ATOM 3013 O OG A SER B 2 237 ? 52.171 60.069 -2.248 0.50 31.90 ? 253 SER R OG 1 ATOM 3014 O OG B SER B 2 237 ? 50.213 59.058 -2.699 0.50 31.90 ? 253 SER R OG 1 ATOM 3015 N N . THR B 2 238 ? 50.166 56.086 -1.884 1.00 32.00 ? 254 THR R N 1 ATOM 3016 C CA . THR B 2 238 ? 49.206 55.088 -1.418 1.00 31.31 ? 254 THR R CA 1 ATOM 3017 C C . THR B 2 238 ? 49.934 53.845 -0.874 1.00 31.47 ? 254 THR R C 1 ATOM 3018 O O . THR B 2 238 ? 49.480 53.221 0.083 1.00 30.24 ? 254 THR R O 1 ATOM 3019 C CB . THR B 2 238 ? 48.260 54.653 -2.550 1.00 32.50 ? 254 THR R CB 1 ATOM 3020 O OG1 . THR B 2 238 ? 47.531 55.790 -3.025 1.00 34.06 ? 254 THR R OG1 1 ATOM 3021 C CG2 . THR B 2 238 ? 47.274 53.597 -2.056 1.00 30.48 ? 254 THR R CG2 1 ATOM 3022 N N . SER B 2 239 ? 51.061 53.495 -1.487 1.00 30.62 ? 255 SER R N 1 ATOM 3023 C CA . SER B 2 239 ? 51.839 52.338 -1.055 1.00 32.15 ? 255 SER R CA 1 ATOM 3024 C C . SER B 2 239 ? 52.429 52.582 0.328 1.00 32.64 ? 255 SER R C 1 ATOM 3025 O O . SER B 2 239 ? 52.477 51.672 1.157 1.00 32.94 ? 255 SER R O 1 ATOM 3026 C CB . SER B 2 239 ? 52.965 52.043 -2.049 1.00 31.20 ? 255 SER R CB 1 ATOM 3027 O OG . SER B 2 239 ? 52.426 51.624 -3.290 1.00 36.15 ? 255 SER R OG 1 ATOM 3028 N N . ASN B 2 240 ? 52.884 53.809 0.562 1.00 32.94 ? 256 ASN R N 1 ATOM 3029 C CA . ASN B 2 240 ? 53.444 54.188 1.853 1.00 34.44 ? 256 ASN R CA 1 ATOM 3030 C C . ASN B 2 240 ? 52.353 54.110 2.910 1.00 33.13 ? 256 ASN R C 1 ATOM 3031 O O . ASN B 2 240 ? 52.588 53.636 4.016 1.00 33.90 ? 256 ASN R O 1 ATOM 3032 C CB . ASN B 2 240 ? 53.996 55.618 1.803 1.00 35.95 ? 256 ASN R CB 1 ATOM 3033 C CG . ASN B 2 240 ? 55.389 55.690 1.194 1.00 40.57 ? 256 ASN R CG 1 ATOM 3034 O OD1 . ASN B 2 240 ? 55.872 56.771 0.846 1.00 42.03 ? 256 ASN R OD1 1 ATOM 3035 N ND2 . ASN B 2 240 ? 56.044 54.541 1.072 1.00 38.62 ? 256 ASN R ND2 1 ATOM 3036 N N . ASP B 2 241 ? 51.159 54.578 2.555 1.00 33.21 ? 257 ASP R N 1 ATOM 3037 C CA . ASP B 2 241 ? 50.025 54.573 3.467 1.00 33.56 ? 257 ASP R CA 1 ATOM 3038 C C . ASP B 2 241 ? 49.517 53.168 3.798 1.00 33.08 ? 257 ASP R C 1 ATOM 3039 O O . ASP B 2 241 ? 49.138 52.904 4.936 1.00 33.50 ? 257 ASP R O 1 ATOM 3040 C CB . ASP B 2 241 ? 48.888 55.421 2.894 1.00 35.12 ? 257 ASP R CB 1 ATOM 3041 C CG . ASP B 2 241 ? 49.265 56.886 2.767 1.00 39.78 ? 257 ASP R CG 1 ATOM 3042 O OD1 . ASP B 2 241 ? 50.326 57.274 3.310 1.00 42.01 ? 257 ASP R OD1 1 ATOM 3043 O OD2 . ASP B 2 241 ? 48.503 57.653 2.137 1.00 41.44 ? 257 ASP R OD2 1 ATOM 3044 N N . ILE B 2 242 ? 49.499 52.270 2.816 1.00 31.70 ? 258 ILE R N 1 ATOM 3045 C CA . ILE B 2 242 ? 49.053 50.904 3.072 1.00 33.07 ? 258 ILE R CA 1 ATOM 3046 C C . ILE B 2 242 ? 50.024 50.289 4.081 1.00 33.17 ? 258 ILE R C 1 ATOM 3047 O O . ILE B 2 242 ? 49.617 49.605 5.015 1.00 32.81 ? 258 ILE R O 1 ATOM 3048 C CB . ILE B 2 242 ? 49.068 50.039 1.791 1.00 34.26 ? 258 ILE R CB 1 ATOM 3049 C CG1 . ILE B 2 242 ? 48.079 50.594 0.766 1.00 37.50 ? 258 ILE R CG1 1 ATOM 3050 C CG2 . ILE B 2 242 ? 48.691 48.608 2.131 1.00 35.98 ? 258 ILE R CG2 1 ATOM 3051 C CD1 . ILE B 2 242 ? 48.160 49.901 -0.605 1.00 40.32 ? 258 ILE R CD1 1 ATOM 3052 N N . THR B 2 243 ? 51.312 50.553 3.884 1.00 32.93 ? 259 THR R N 1 ATOM 3053 C CA . THR B 2 243 ? 52.353 50.047 4.769 1.00 34.66 ? 259 THR R CA 1 ATOM 3054 C C . THR B 2 243 ? 52.158 50.600 6.178 1.00 35.25 ? 259 THR R C 1 ATOM 3055 O O . THR B 2 243 ? 52.301 49.878 7.169 1.00 34.57 ? 259 THR R O 1 ATOM 3056 C CB . THR B 2 243 ? 53.752 50.461 4.264 1.00 34.90 ? 259 THR R CB 1 ATOM 3057 O OG1 . THR B 2 243 ? 53.992 49.864 2.985 1.00 35.94 ? 259 THR R OG1 1 ATOM 3058 C CG2 . THR B 2 243 ? 54.838 50.015 5.239 1.00 35.38 ? 259 THR R CG2 1 ATOM 3059 N N . THR B 2 244 ? 51.825 51.884 6.261 1.00 33.25 ? 260 THR R N 1 ATOM 3060 C CA . THR B 2 244 ? 51.622 52.518 7.551 1.00 33.22 ? 260 THR R CA 1 ATOM 3061 C C . THR B 2 244 ? 50.461 51.865 8.286 1.00 33.28 ? 260 THR R C 1 ATOM 3062 O O . THR B 2 244 ? 50.567 51.564 9.471 1.00 32.92 ? 260 THR R O 1 ATOM 3063 C CB . THR B 2 244 ? 51.382 54.035 7.389 1.00 32.66 ? 260 THR R CB 1 ATOM 3064 O OG1 . THR B 2 244 ? 52.556 54.631 6.826 1.00 32.93 ? 260 THR R OG1 1 ATOM 3065 C CG2 . THR B 2 244 ? 51.097 54.684 8.729 1.00 31.27 ? 260 THR R CG2 1 ATOM 3066 N N . PHE B 2 245 ? 49.356 51.634 7.588 1.00 33.24 ? 261 PHE R N 1 ATOM 3067 C CA . PHE B 2 245 ? 48.216 50.988 8.223 1.00 32.83 ? 261 PHE R CA 1 ATOM 3068 C C . PHE B 2 245 ? 48.559 49.555 8.648 1.00 33.74 ? 261 PHE R C 1 ATOM 3069 O O . PHE B 2 245 ? 48.260 49.144 9.772 1.00 32.09 ? 261 PHE R O 1 ATOM 3070 C CB . PHE B 2 245 ? 47.011 50.994 7.285 1.00 30.33 ? 261 PHE R CB 1 ATOM 3071 C CG . PHE B 2 245 ? 46.272 52.302 7.272 1.00 32.27 ? 261 PHE R CG 1 ATOM 3072 C CD1 . PHE B 2 245 ? 45.681 52.787 8.440 1.00 30.55 ? 261 PHE R CD1 1 ATOM 3073 C CD2 . PHE B 2 245 ? 46.189 53.064 6.108 1.00 30.71 ? 261 PHE R CD2 1 ATOM 3074 C CE1 . PHE B 2 245 ? 45.022 54.008 8.453 1.00 32.82 ? 261 PHE R CE1 1 ATOM 3075 C CE2 . PHE B 2 245 ? 45.529 54.293 6.107 1.00 32.11 ? 261 PHE R CE2 1 ATOM 3076 C CZ . PHE B 2 245 ? 44.945 54.767 7.282 1.00 33.39 ? 261 PHE R CZ 1 ATOM 3077 N N . LEU B 2 246 ? 49.199 48.799 7.765 1.00 32.46 ? 262 LEU R N 1 ATOM 3078 C CA . LEU B 2 246 ? 49.557 47.428 8.104 1.00 33.32 ? 262 LEU R CA 1 ATOM 3079 C C . LEU B 2 246 ? 50.510 47.369 9.286 1.00 34.09 ? 262 LEU R C 1 ATOM 3080 O O . LEU B 2 246 ? 50.498 46.399 10.038 1.00 34.12 ? 262 LEU R O 1 ATOM 3081 C CB . LEU B 2 246 ? 50.168 46.713 6.898 1.00 32.17 ? 262 LEU R CB 1 ATOM 3082 C CG . LEU B 2 246 ? 49.180 46.455 5.754 1.00 33.37 ? 262 LEU R CG 1 ATOM 3083 C CD1 . LEU B 2 246 ? 49.887 45.761 4.591 1.00 33.78 ? 262 LEU R CD1 1 ATOM 3084 C CD2 . LEU B 2 246 ? 48.029 45.599 6.268 1.00 32.21 ? 262 LEU R CD2 1 ATOM 3085 N N . SER B 2 247 ? 51.329 48.404 9.460 1.00 33.97 ? 263 SER R N 1 ATOM 3086 C CA . SER B 2 247 ? 52.271 48.429 10.571 1.00 34.34 ? 263 SER R CA 1 ATOM 3087 C C . SER B 2 247 ? 51.531 48.520 11.908 1.00 34.57 ? 263 SER R C 1 ATOM 3088 O O . SER B 2 247 ? 52.100 48.220 12.952 1.00 34.56 ? 263 SER R O 1 ATOM 3089 C CB . SER B 2 247 ? 53.253 49.600 10.440 1.00 34.02 ? 263 SER R CB 1 ATOM 3090 O OG . SER B 2 247 ? 52.631 50.838 10.740 1.00 35.55 ? 263 SER R OG 1 ATOM 3091 N N . MET B 2 248 ? 50.268 48.934 11.873 1.00 34.75 ? 264 MET R N 1 ATOM 3092 C CA . MET B 2 248 ? 49.460 49.028 13.092 1.00 36.80 ? 264 MET R CA 1 ATOM 3093 C C . MET B 2 248 ? 49.172 47.632 13.644 1.00 38.56 ? 264 MET R C 1 ATOM 3094 O O . MET B 2 248 ? 48.755 47.487 14.794 1.00 39.14 ? 264 MET R O 1 ATOM 3095 C CB . MET B 2 248 ? 48.127 49.726 12.813 1.00 35.58 ? 264 MET R CB 1 ATOM 3096 C CG . MET B 2 248 ? 48.232 51.213 12.543 1.00 36.82 ? 264 MET R CG 1 ATOM 3097 S SD . MET B 2 248 ? 46.634 51.931 12.146 1.00 38.61 ? 264 MET R SD 1 ATOM 3098 C CE . MET B 2 248 ? 45.631 51.251 13.433 1.00 46.99 ? 264 MET R CE 1 ATOM 3099 N N . LEU B 2 249 ? 49.380 46.615 12.812 1.00 38.87 ? 265 LEU R N 1 ATOM 3100 C CA . LEU B 2 249 ? 49.148 45.229 13.209 1.00 42.13 ? 265 LEU R CA 1 ATOM 3101 C C . LEU B 2 249 ? 50.428 44.587 13.734 1.00 45.53 ? 265 LEU R C 1 ATOM 3102 O O . LEU B 2 249 ? 50.432 43.414 14.095 1.00 47.53 ? 265 LEU R O 1 ATOM 3103 C CB . LEU B 2 249 ? 48.629 44.412 12.024 1.00 37.03 ? 265 LEU R CB 1 ATOM 3104 C CG . LEU B 2 249 ? 47.423 44.966 11.259 1.00 38.75 ? 265 LEU R CG 1 ATOM 3105 C CD1 . LEU B 2 249 ? 47.188 44.115 10.009 1.00 35.64 ? 265 LEU R CD1 1 ATOM 3106 C CD2 . LEU B 2 249 ? 46.182 44.983 12.161 1.00 35.89 ? 265 LEU R CD2 1 ATOM 3107 N N . ASP B 2 250 ? 51.515 45.353 13.761 1.00 49.34 ? 266 ASP R N 1 ATOM 3108 C CA . ASP B 2 250 ? 52.797 44.849 14.252 1.00 52.43 ? 266 ASP R CA 1 ATOM 3109 C C . ASP B 2 250 ? 52.711 44.524 15.744 1.00 54.93 ? 266 ASP R C 1 ATOM 3110 O O . ASP B 2 250 ? 53.167 43.424 16.129 1.00 56.85 ? 266 ASP R O 1 ATOM 3111 C CB . ASP B 2 250 ? 53.911 45.879 14.014 1.00 53.71 ? 266 ASP R CB 1 ATOM 3112 C CG . ASP B 2 250 ? 54.362 45.940 12.556 1.00 55.50 ? 266 ASP R CG 1 ATOM 3113 O OD1 . ASP B 2 250 ? 55.121 46.871 12.209 1.00 56.87 ? 266 ASP R OD1 1 ATOM 3114 O OD2 . ASP B 2 250 ? 53.972 45.059 11.761 1.00 55.81 ? 266 ASP R OD2 1 ATOM 3115 O OXT . ASP B 2 250 ? 52.199 45.372 16.513 1.00 55.76 ? 266 ASP R OXT 1 HETATM 3116 P P . PO4 C 3 . ? 24.984 35.462 57.347 1.00 84.91 ? 139 PO4 L P 1 HETATM 3117 O O1 . PO4 C 3 . ? 25.711 35.302 56.060 1.00 83.81 ? 139 PO4 L O1 1 HETATM 3118 O O2 . PO4 C 3 . ? 24.015 36.581 57.232 1.00 83.88 ? 139 PO4 L O2 1 HETATM 3119 O O3 . PO4 C 3 . ? 25.955 35.756 58.433 1.00 84.45 ? 139 PO4 L O3 1 HETATM 3120 O O4 . PO4 C 3 . ? 24.255 34.206 57.665 1.00 84.60 ? 139 PO4 L O4 1 HETATM 3121 C C1 . NAG D 4 . ? 6.994 32.868 52.341 1.00 47.48 ? 267 NAG R C1 1 HETATM 3122 C C2 . NAG D 4 . ? 6.496 32.128 53.587 1.00 47.96 ? 267 NAG R C2 1 HETATM 3123 C C3 . NAG D 4 . ? 5.023 32.438 53.876 1.00 50.71 ? 267 NAG R C3 1 HETATM 3124 C C4 . NAG D 4 . ? 4.766 33.942 53.843 1.00 53.14 ? 267 NAG R C4 1 HETATM 3125 C C5 . NAG D 4 . ? 5.303 34.540 52.542 1.00 52.15 ? 267 NAG R C5 1 HETATM 3126 C C6 . NAG D 4 . ? 5.133 36.048 52.468 1.00 51.62 ? 267 NAG R C6 1 HETATM 3127 C C7 . NAG D 4 . ? 7.516 30.019 54.134 1.00 42.50 ? 267 NAG R C7 1 HETATM 3128 C C8 . NAG D 4 . ? 7.869 28.614 53.666 1.00 42.05 ? 267 NAG R C8 1 HETATM 3129 N N2 . NAG D 4 . ? 6.654 30.703 53.392 1.00 42.14 ? 267 NAG R N2 1 HETATM 3130 O O3 . NAG D 4 . ? 4.683 31.931 55.159 1.00 50.42 ? 267 NAG R O3 1 HETATM 3131 O O4 . NAG D 4 . ? 3.354 34.194 53.943 1.00 60.37 ? 267 NAG R O4 1 HETATM 3132 O O5 . NAG D 4 . ? 6.710 34.267 52.436 1.00 48.42 ? 267 NAG R O5 1 HETATM 3133 O O6 . NAG D 4 . ? 5.685 36.685 53.612 1.00 51.18 ? 267 NAG R O6 1 HETATM 3134 O O7 . NAG D 4 . ? 8.028 30.473 55.159 1.00 42.71 ? 267 NAG R O7 1 HETATM 3135 C C1 . NAG E 4 . ? 2.959 35.003 54.994 1.00 64.33 ? 268 NAG R C1 1 HETATM 3136 C C2 . NAG E 4 . ? 1.507 35.438 54.781 1.00 67.03 ? 268 NAG R C2 1 HETATM 3137 C C3 . NAG E 4 . ? 1.009 36.225 55.998 1.00 68.90 ? 268 NAG R C3 1 HETATM 3138 C C4 . NAG E 4 . ? 1.249 35.420 57.279 1.00 70.55 ? 268 NAG R C4 1 HETATM 3139 C C5 . NAG E 4 . ? 2.717 35.006 57.374 1.00 69.03 ? 268 NAG R C5 1 HETATM 3140 C C6 . NAG E 4 . ? 2.992 34.129 58.579 1.00 69.04 ? 268 NAG R C6 1 HETATM 3141 C C7 . NAG E 4 . ? 0.735 35.823 52.531 1.00 68.98 ? 268 NAG R C7 1 HETATM 3142 C C8 . NAG E 4 . ? -0.199 36.814 51.858 1.00 69.97 ? 268 NAG R C8 1 HETATM 3143 N N2 . NAG E 4 . ? 1.420 36.255 53.586 1.00 68.40 ? 268 NAG R N2 1 HETATM 3144 O O3 . NAG E 4 . ? -0.379 36.487 55.855 1.00 68.92 ? 268 NAG R O3 1 HETATM 3145 O O4 . NAG E 4 . ? 0.890 36.203 58.432 1.00 74.75 ? 268 NAG R O4 1 HETATM 3146 O O5 . NAG E 4 . ? 3.086 34.246 56.205 1.00 65.91 ? 268 NAG R O5 1 HETATM 3147 O O6 . NAG E 4 . ? 2.541 32.801 58.356 1.00 70.09 ? 268 NAG R O6 1 HETATM 3148 O O7 . NAG E 4 . ? 0.824 34.672 52.099 1.00 70.48 ? 268 NAG R O7 1 HETATM 3149 C C1 . BMA F 5 . ? -0.281 35.823 59.067 1.00 77.71 ? 269 BMA R C1 1 HETATM 3150 C C2 . BMA F 5 . ? -0.158 36.074 60.573 1.00 78.77 ? 269 BMA R C2 1 HETATM 3151 C C3 . BMA F 5 . ? -1.485 35.736 61.259 1.00 79.32 ? 269 BMA R C3 1 HETATM 3152 C C4 . BMA F 5 . ? -2.622 36.525 60.607 1.00 79.86 ? 269 BMA R C4 1 HETATM 3153 C C5 . BMA F 5 . ? -2.639 36.261 59.096 1.00 80.47 ? 269 BMA R C5 1 HETATM 3154 C C6 . BMA F 5 . ? -3.690 37.080 58.367 1.00 81.20 ? 269 BMA R C6 1 HETATM 3155 O O2 . BMA F 5 . ? 0.174 37.436 60.803 1.00 79.69 ? 269 BMA R O2 1 HETATM 3156 O O3 . BMA F 5 . ? -1.411 36.047 62.643 1.00 77.56 ? 269 BMA R O3 1 HETATM 3157 O O4 . BMA F 5 . ? -3.863 36.135 61.175 1.00 82.23 ? 269 BMA R O4 1 HETATM 3158 O O5 . BMA F 5 . ? -1.358 36.599 58.518 1.00 78.63 ? 269 BMA R O5 1 HETATM 3159 O O6 . BMA F 5 . ? -3.689 38.432 58.806 1.00 82.31 ? 269 BMA R O6 1 HETATM 3160 C C1 . NAG G 4 . ? 45.867 20.544 19.166 1.00 72.69 ? 270 NAG R C1 1 HETATM 3161 C C2 . NAG G 4 . ? 45.205 19.264 19.707 1.00 75.98 ? 270 NAG R C2 1 HETATM 3162 C C3 . NAG G 4 . ? 45.941 18.720 20.939 1.00 78.02 ? 270 NAG R C3 1 HETATM 3163 C C4 . NAG G 4 . ? 47.444 18.630 20.687 1.00 78.45 ? 270 NAG R C4 1 HETATM 3164 C C5 . NAG G 4 . ? 47.962 19.980 20.196 1.00 77.85 ? 270 NAG R C5 1 HETATM 3165 C C6 . NAG G 4 . ? 49.453 19.971 19.896 1.00 78.34 ? 270 NAG R C6 1 HETATM 3166 C C7 . NAG G 4 . ? 43.013 18.577 20.454 1.00 78.42 ? 270 NAG R C7 1 HETATM 3167 C C8 . NAG G 4 . ? 42.787 18.430 21.951 1.00 78.71 ? 270 NAG R C8 1 HETATM 3168 N N2 . NAG G 4 . ? 43.825 19.551 20.054 1.00 77.41 ? 270 NAG R N2 1 HETATM 3169 O O3 . NAG G 4 . ? 45.447 17.426 21.256 1.00 79.76 ? 270 NAG R O3 1 HETATM 3170 O O4 . NAG G 4 . ? 48.110 18.266 21.889 1.00 81.02 ? 270 NAG R O4 1 HETATM 3171 O O5 . NAG G 4 . ? 47.279 20.347 18.977 1.00 75.90 ? 270 NAG R O5 1 HETATM 3172 O O6 . NAG G 4 . ? 50.020 18.681 20.090 1.00 78.53 ? 270 NAG R O6 1 HETATM 3173 O O7 . NAG G 4 . ? 42.451 17.811 19.671 1.00 79.94 ? 270 NAG R O7 1 HETATM 3174 P P . PO4 H 3 . ? 46.271 57.727 0.000 0.50 102.19 ? 1 PO4 R P 1 HETATM 3175 O O1 . PO4 H 3 . ? 46.025 56.826 -1.114 0.50 102.57 ? 1 PO4 R O1 1 HETATM 3176 O O2 . PO4 H 3 . ? 45.077 58.564 0.367 0.50 102.72 ? 1 PO4 R O2 1 HETATM 3177 O O3 . PO4 H 3 . ? 47.511 58.611 -0.324 0.50 102.88 ? 1 PO4 R O3 1 HETATM 3178 O O4 . PO4 H 3 . ? 46.646 56.804 1.175 0.50 102.39 ? 1 PO4 R O4 1 HETATM 3179 P P . PO4 I 3 . ? 49.285 37.348 -8.569 1.00 85.93 ? 3 PO4 R P 1 HETATM 3180 O O1 . PO4 I 3 . ? 48.869 35.944 -8.333 1.00 85.63 ? 3 PO4 R O1 1 HETATM 3181 O O2 . PO4 I 3 . ? 48.775 38.210 -7.469 1.00 83.95 ? 3 PO4 R O2 1 HETATM 3182 O O3 . PO4 I 3 . ? 48.725 37.816 -9.870 1.00 83.09 ? 3 PO4 R O3 1 HETATM 3183 O O4 . PO4 I 3 . ? 50.772 37.421 -8.607 1.00 82.17 ? 3 PO4 R O4 1 HETATM 3184 O O . HOH J 6 . ? 32.308 53.739 45.904 1.00 37.08 ? 140 HOH L O 1 HETATM 3185 O O . HOH J 6 . ? 56.775 77.118 45.501 1.00 39.93 ? 141 HOH L O 1 HETATM 3186 O O . HOH J 6 . ? 51.973 52.599 36.514 1.00 43.31 ? 142 HOH L O 1 HETATM 3187 O O . HOH J 6 . ? 36.346 59.961 33.701 1.00 47.30 ? 143 HOH L O 1 HETATM 3188 O O . HOH J 6 . ? 56.899 52.695 33.776 1.00 54.18 ? 144 HOH L O 1 HETATM 3189 O O . HOH J 6 . ? 30.958 40.085 56.870 1.00 51.03 ? 145 HOH L O 1 HETATM 3190 O O . HOH J 6 . ? 58.247 60.103 53.667 1.00 52.75 ? 146 HOH L O 1 HETATM 3191 O O . HOH J 6 . ? 54.485 47.521 48.368 1.00 70.09 ? 147 HOH L O 1 HETATM 3192 O O . HOH J 6 . ? 33.043 35.559 56.862 1.00 60.52 ? 148 HOH L O 1 HETATM 3193 O O . HOH J 6 . ? 49.429 54.174 52.688 1.00 37.29 ? 149 HOH L O 1 HETATM 3194 O O . HOH J 6 . ? 57.418 63.088 57.573 1.00 48.74 ? 150 HOH L O 1 HETATM 3195 O O . HOH J 6 . ? 50.343 33.640 46.513 1.00 43.17 ? 151 HOH L O 1 HETATM 3196 O O . HOH J 6 . ? 48.399 33.628 54.132 1.00 50.65 ? 152 HOH L O 1 HETATM 3197 O O . HOH J 6 . ? 42.055 63.874 35.498 1.00 58.97 ? 153 HOH L O 1 HETATM 3198 O O . HOH J 6 . ? 61.960 57.300 46.282 1.00 62.64 ? 154 HOH L O 1 HETATM 3199 O O . HOH J 6 . ? 64.017 53.957 44.660 1.00 56.19 ? 155 HOH L O 1 HETATM 3200 O O . HOH J 6 . ? 51.701 48.097 53.315 1.00 44.82 ? 156 HOH L O 1 HETATM 3201 O O . HOH J 6 . ? 55.092 35.423 50.585 1.00 44.09 ? 157 HOH L O 1 HETATM 3202 O O . HOH J 6 . ? 54.747 41.820 48.032 1.00 45.50 ? 158 HOH L O 1 HETATM 3203 O O . HOH J 6 . ? 50.814 74.659 25.319 1.00 59.41 ? 159 HOH L O 1 HETATM 3204 O O . HOH J 6 . ? 43.437 57.412 50.810 1.00 43.77 ? 160 HOH L O 1 HETATM 3205 O O . HOH J 6 . ? 49.294 69.571 31.214 1.00 76.12 ? 161 HOH L O 1 HETATM 3206 O O . HOH J 6 . ? 61.037 74.489 60.328 1.00 73.72 ? 162 HOH L O 1 HETATM 3207 O O . HOH J 6 . ? 61.558 73.455 57.356 1.00 70.37 ? 163 HOH L O 1 HETATM 3208 O O . HOH J 6 . ? 33.475 59.222 33.338 1.00 61.53 ? 164 HOH L O 1 HETATM 3209 O O . HOH J 6 . ? 59.783 55.174 49.821 1.00 52.11 ? 165 HOH L O 1 HETATM 3210 O O . HOH J 6 . ? 44.825 42.426 38.897 1.00 86.50 ? 166 HOH L O 1 HETATM 3211 O O . HOH J 6 . ? 27.816 52.167 45.372 1.00 54.29 ? 167 HOH L O 1 HETATM 3212 O O . HOH J 6 . ? 23.782 48.550 51.934 1.00 84.25 ? 168 HOH L O 1 HETATM 3213 O O . HOH J 6 . ? 47.841 31.390 51.980 1.00 81.40 ? 169 HOH L O 1 HETATM 3214 O O . HOH J 6 . ? 27.825 53.602 48.117 1.00 57.71 ? 170 HOH L O 1 HETATM 3215 O O . HOH J 6 . ? 51.233 62.057 53.404 1.00 48.13 ? 171 HOH L O 1 HETATM 3216 O O . HOH J 6 . ? 56.330 44.257 40.090 1.00 63.48 ? 172 HOH L O 1 HETATM 3217 O O . HOH J 6 . ? 44.162 56.444 55.709 1.00 75.15 ? 173 HOH L O 1 HETATM 3218 O O . HOH J 6 . ? 37.402 63.993 32.817 1.00 78.26 ? 174 HOH L O 1 HETATM 3219 O O . HOH J 6 . ? 55.641 43.055 35.417 1.00 57.17 ? 175 HOH L O 1 HETATM 3220 O O . HOH J 6 . ? 45.525 56.621 52.915 1.00 65.92 ? 176 HOH L O 1 HETATM 3221 O O . HOH J 6 . ? 48.575 56.852 53.561 1.00 50.26 ? 177 HOH L O 1 HETATM 3222 O O . HOH J 6 . ? 44.384 80.585 13.674 1.00 52.64 ? 178 HOH L O 1 HETATM 3223 O O . HOH J 6 . ? 42.500 73.951 19.873 1.00 63.30 ? 179 HOH L O 1 HETATM 3224 O O . HOH J 6 . ? 51.652 38.847 37.899 1.00 60.10 ? 180 HOH L O 1 HETATM 3225 O O . HOH J 6 . ? 53.877 72.384 63.636 1.00 77.81 ? 181 HOH L O 1 HETATM 3226 O O . HOH J 6 . ? 48.064 31.764 46.069 1.00 51.58 ? 182 HOH L O 1 HETATM 3227 O O . HOH J 6 . ? 63.120 51.549 39.059 1.00 50.79 ? 183 HOH L O 1 HETATM 3228 O O . HOH J 6 . ? 62.952 60.753 44.740 1.00 64.00 ? 184 HOH L O 1 HETATM 3229 O O . HOH J 6 . ? 42.425 51.719 35.602 1.00 56.07 ? 185 HOH L O 1 HETATM 3230 O O . HOH J 6 . ? 47.768 68.705 33.788 1.00 68.03 ? 186 HOH L O 1 HETATM 3231 O O . HOH J 6 . ? 25.043 38.920 58.684 1.00 54.31 ? 187 HOH L O 1 HETATM 3232 O O . HOH J 6 . ? 34.760 39.033 46.526 1.00 54.06 ? 188 HOH L O 1 HETATM 3233 O O . HOH J 6 . ? 50.134 78.538 28.811 1.00 65.52 ? 189 HOH L O 1 HETATM 3234 O O . HOH J 6 . ? 52.037 53.820 51.180 1.00 49.23 ? 190 HOH L O 1 HETATM 3235 O O . HOH J 6 . ? 53.424 51.713 53.044 1.00 67.37 ? 191 HOH L O 1 HETATM 3236 O O . HOH J 6 . ? 47.942 28.777 50.131 1.00 82.22 ? 192 HOH L O 1 HETATM 3237 O O . HOH J 6 . ? 59.316 57.207 53.845 1.00 59.57 ? 193 HOH L O 1 HETATM 3238 O O . HOH J 6 . ? 59.091 70.136 40.299 1.00 57.59 ? 194 HOH L O 1 HETATM 3239 O O . HOH J 6 . ? 49.017 59.795 53.452 1.00 58.64 ? 195 HOH L O 1 HETATM 3240 O O . HOH J 6 . ? 49.443 51.720 34.155 1.00 61.99 ? 196 HOH L O 1 HETATM 3241 O O . HOH J 6 . ? 56.610 52.096 53.736 1.00 68.53 ? 197 HOH L O 1 HETATM 3242 O O . HOH J 6 . ? 54.866 42.537 51.902 1.00 71.53 ? 198 HOH L O 1 HETATM 3243 O O . HOH J 6 . ? 50.412 62.320 58.321 1.00 69.01 ? 199 HOH L O 1 HETATM 3244 O O . HOH J 6 . ? 49.609 75.884 22.588 1.00 77.43 ? 200 HOH L O 1 HETATM 3245 O O . HOH J 6 . ? 19.637 47.047 54.553 1.00 86.39 ? 201 HOH L O 1 HETATM 3246 O O . HOH K 6 . ? 46.078 27.510 4.743 1.00 32.27 ? 272 HOH R O 1 HETATM 3247 O O . HOH K 6 . ? 28.306 38.307 42.014 1.00 34.13 ? 273 HOH R O 1 HETATM 3248 O O . HOH K 6 . ? 44.979 33.812 20.448 1.00 37.53 ? 274 HOH R O 1 HETATM 3249 O O . HOH K 6 . ? 11.065 20.043 49.467 1.00 32.73 ? 275 HOH R O 1 HETATM 3250 O O . HOH K 6 . ? 23.128 34.626 35.958 1.00 33.63 ? 276 HOH R O 1 HETATM 3251 O O . HOH K 6 . ? 35.068 35.985 23.985 1.00 30.06 ? 277 HOH R O 1 HETATM 3252 O O . HOH K 6 . ? 31.827 40.163 28.347 1.00 32.01 ? 278 HOH R O 1 HETATM 3253 O O . HOH K 6 . ? 27.055 40.707 43.997 1.00 32.11 ? 279 HOH R O 1 HETATM 3254 O O . HOH K 6 . ? 14.199 33.831 51.527 1.00 38.74 ? 280 HOH R O 1 HETATM 3255 O O . HOH K 6 . ? 44.114 35.830 13.357 1.00 43.73 ? 281 HOH R O 1 HETATM 3256 O O . HOH K 6 . ? 13.790 27.199 37.257 1.00 41.57 ? 282 HOH R O 1 HETATM 3257 O O . HOH K 6 . ? 20.646 42.824 46.933 1.00 46.56 ? 283 HOH R O 1 HETATM 3258 O O . HOH K 6 . ? 23.634 37.364 36.535 1.00 39.28 ? 284 HOH R O 1 HETATM 3259 O O . HOH K 6 . ? 25.306 30.902 46.616 1.00 44.21 ? 285 HOH R O 1 HETATM 3260 O O . HOH K 6 . ? 41.511 35.262 19.801 1.00 33.96 ? 286 HOH R O 1 HETATM 3261 O O . HOH K 6 . ? 32.322 30.481 8.119 1.00 38.61 ? 287 HOH R O 1 HETATM 3262 O O . HOH K 6 . ? 26.837 43.793 43.950 1.00 35.67 ? 288 HOH R O 1 HETATM 3263 O O . HOH K 6 . ? 46.723 61.828 -20.677 1.00 45.72 ? 289 HOH R O 1 HETATM 3264 O O . HOH K 6 . ? 29.161 27.805 25.019 1.00 39.33 ? 290 HOH R O 1 HETATM 3265 O O . HOH K 6 . ? 55.460 55.138 -7.153 1.00 39.09 ? 291 HOH R O 1 HETATM 3266 O O . HOH K 6 . ? 39.501 39.132 10.254 1.00 40.24 ? 292 HOH R O 1 HETATM 3267 O O . HOH K 6 . ? 42.675 33.447 -6.131 1.00 46.80 ? 293 HOH R O 1 HETATM 3268 O O . HOH K 6 . ? 56.900 53.213 -8.817 1.00 36.85 ? 294 HOH R O 1 HETATM 3269 O O . HOH K 6 . ? 40.106 37.501 20.900 1.00 39.11 ? 295 HOH R O 1 HETATM 3270 O O . HOH K 6 . ? 51.054 61.197 -23.768 1.00 45.10 ? 296 HOH R O 1 HETATM 3271 O O . HOH K 6 . ? 43.382 33.612 -2.609 1.00 36.16 ? 297 HOH R O 1 HETATM 3272 O O . HOH K 6 . ? 26.942 29.510 23.621 1.00 46.84 ? 298 HOH R O 1 HETATM 3273 O O . HOH K 6 . ? 54.566 53.761 -14.021 1.00 38.02 ? 299 HOH R O 1 HETATM 3274 O O . HOH K 6 . ? 29.896 27.911 38.270 1.00 38.54 ? 300 HOH R O 1 HETATM 3275 O O . HOH K 6 . ? 58.816 45.519 -13.234 1.00 43.40 ? 301 HOH R O 1 HETATM 3276 O O . HOH K 6 . ? 43.239 36.342 5.053 1.00 34.17 ? 302 HOH R O 1 HETATM 3277 O O . HOH K 6 . ? 48.816 47.110 17.577 1.00 43.81 ? 303 HOH R O 1 HETATM 3278 O O . HOH K 6 . ? 35.445 28.555 32.088 1.00 43.39 ? 304 HOH R O 1 HETATM 3279 O O . HOH K 6 . ? 47.435 19.454 9.606 1.00 62.50 ? 305 HOH R O 1 HETATM 3280 O O . HOH K 6 . ? 38.751 38.804 29.730 1.00 37.74 ? 306 HOH R O 1 HETATM 3281 O O . HOH K 6 . ? 7.578 31.252 43.077 1.00 40.34 ? 307 HOH R O 1 HETATM 3282 O O . HOH K 6 . ? 28.043 26.069 45.635 1.00 47.78 ? 308 HOH R O 1 HETATM 3283 O O . HOH K 6 . ? 46.800 41.060 -12.388 1.00 39.73 ? 309 HOH R O 1 HETATM 3284 O O . HOH K 6 . ? 37.675 31.852 37.478 1.00 45.97 ? 310 HOH R O 1 HETATM 3285 O O . HOH K 6 . ? 24.892 42.623 36.709 1.00 51.26 ? 311 HOH R O 1 HETATM 3286 O O . HOH K 6 . ? 54.461 60.177 -1.080 1.00 43.36 ? 312 HOH R O 1 HETATM 3287 O O . HOH K 6 . ? 51.656 42.470 7.462 1.00 43.28 ? 313 HOH R O 1 HETATM 3288 O O . HOH K 6 . ? 22.822 32.254 29.823 1.00 46.97 ? 314 HOH R O 1 HETATM 3289 O O . HOH K 6 . ? 49.772 31.469 15.809 1.00 47.59 ? 315 HOH R O 1 HETATM 3290 O O . HOH K 6 . ? 30.494 29.618 13.875 1.00 54.24 ? 316 HOH R O 1 HETATM 3291 O O . HOH K 6 . ? 34.740 36.419 4.173 1.00 70.22 ? 317 HOH R O 1 HETATM 3292 O O . HOH K 6 . ? 51.848 44.124 9.896 1.00 42.09 ? 318 HOH R O 1 HETATM 3293 O O . HOH K 6 . ? 32.004 30.403 47.161 1.00 56.64 ? 319 HOH R O 1 HETATM 3294 O O . HOH K 6 . ? 13.727 20.473 39.884 1.00 47.49 ? 320 HOH R O 1 HETATM 3295 O O . HOH K 6 . ? 58.757 48.280 -5.023 1.00 47.30 ? 321 HOH R O 1 HETATM 3296 O O . HOH K 6 . ? 41.563 36.338 -5.596 1.00 48.27 ? 322 HOH R O 1 HETATM 3297 O O . HOH K 6 . ? 20.483 43.189 43.935 1.00 54.41 ? 323 HOH R O 1 HETATM 3298 O O . HOH K 6 . ? 17.472 18.852 44.488 1.00 46.93 ? 324 HOH R O 1 HETATM 3299 O O . HOH K 6 . ? 31.662 23.979 16.527 1.00 49.47 ? 325 HOH R O 1 HETATM 3300 O O . HOH K 6 . ? 49.939 19.387 16.997 1.00 69.09 ? 326 HOH R O 1 HETATM 3301 O O . HOH K 6 . ? 56.018 54.058 -1.788 1.00 54.12 ? 327 HOH R O 1 HETATM 3302 O O . HOH K 6 . ? 39.304 37.221 1.839 1.00 54.79 ? 328 HOH R O 1 HETATM 3303 O O . HOH K 6 . ? 50.213 42.352 -6.224 1.00 45.95 ? 329 HOH R O 1 HETATM 3304 O O . HOH K 6 . ? 41.648 19.853 13.844 1.00 53.48 ? 330 HOH R O 1 HETATM 3305 O O . HOH K 6 . ? 42.381 28.371 -10.154 1.00 53.66 ? 331 HOH R O 1 HETATM 3306 O O . HOH K 6 . ? 27.450 45.990 28.346 1.00 54.25 ? 332 HOH R O 1 HETATM 3307 O O . HOH K 6 . ? 42.629 31.596 31.089 1.00 42.34 ? 333 HOH R O 1 HETATM 3308 O O . HOH K 6 . ? 24.281 28.077 29.766 1.00 51.34 ? 334 HOH R O 1 HETATM 3309 O O . HOH K 6 . ? 40.892 28.170 -0.664 1.00 54.80 ? 335 HOH R O 1 HETATM 3310 O O . HOH K 6 . ? 47.909 40.945 -8.060 1.00 53.62 ? 336 HOH R O 1 HETATM 3311 O O . HOH K 6 . ? 30.462 26.391 1.923 1.00 55.82 ? 337 HOH R O 1 HETATM 3312 O O . HOH K 6 . ? 41.693 43.809 19.718 1.00 54.09 ? 338 HOH R O 1 HETATM 3313 O O . HOH K 6 . ? 54.177 63.919 -12.686 1.00 53.67 ? 339 HOH R O 1 HETATM 3314 O O . HOH K 6 . ? 57.679 48.191 -12.073 1.00 41.16 ? 340 HOH R O 1 HETATM 3315 O O . HOH K 6 . ? 40.833 38.537 33.708 1.00 71.50 ? 341 HOH R O 1 HETATM 3316 O O . HOH K 6 . ? 17.322 18.608 41.406 1.00 46.48 ? 342 HOH R O 1 HETATM 3317 O O . HOH K 6 . ? 22.925 31.122 57.805 1.00 56.02 ? 343 HOH R O 1 HETATM 3318 O O . HOH K 6 . ? 55.097 53.460 6.619 1.00 59.43 ? 344 HOH R O 1 HETATM 3319 O O . HOH K 6 . ? 11.575 41.059 46.191 1.00 47.95 ? 345 HOH R O 1 HETATM 3320 O O . HOH K 6 . ? 28.699 30.142 20.151 1.00 64.58 ? 346 HOH R O 1 HETATM 3321 O O . HOH K 6 . ? 52.580 67.457 -17.618 1.00 54.70 ? 347 HOH R O 1 HETATM 3322 O O . HOH K 6 . ? 48.430 37.355 26.196 1.00 67.01 ? 348 HOH R O 1 HETATM 3323 O O . HOH K 6 . ? 59.248 50.017 -2.334 1.00 58.64 ? 349 HOH R O 1 HETATM 3324 O O . HOH K 6 . ? 29.586 42.909 34.658 1.00 42.43 ? 350 HOH R O 1 HETATM 3325 O O . HOH K 6 . ? 15.658 33.983 36.161 1.00 53.40 ? 351 HOH R O 1 HETATM 3326 O O . HOH K 6 . ? 47.616 60.134 3.408 1.00 51.74 ? 352 HOH R O 1 HETATM 3327 O O . HOH K 6 . ? 41.095 38.068 27.813 1.00 45.43 ? 353 HOH R O 1 HETATM 3328 O O . HOH K 6 . ? 59.648 49.531 -10.212 1.00 54.59 ? 354 HOH R O 1 HETATM 3329 O O . HOH K 6 . ? 12.009 33.774 39.690 1.00 49.06 ? 355 HOH R O 1 HETATM 3330 O O . HOH K 6 . ? 51.915 48.156 15.873 1.00 54.46 ? 356 HOH R O 1 HETATM 3331 O O . HOH K 6 . ? 54.875 41.394 -10.221 1.00 54.08 ? 357 HOH R O 1 HETATM 3332 O O . HOH K 6 . ? 37.669 38.856 32.782 1.00 80.38 ? 358 HOH R O 1 HETATM 3333 O O . HOH K 6 . ? 57.693 49.418 -14.833 1.00 48.09 ? 359 HOH R O 1 HETATM 3334 O O . HOH K 6 . ? 54.210 38.125 2.581 1.00 47.78 ? 360 HOH R O 1 HETATM 3335 O O . HOH K 6 . ? 31.187 24.324 8.902 1.00 51.29 ? 361 HOH R O 1 HETATM 3336 O O . HOH K 6 . ? 32.009 39.332 12.967 1.00 63.66 ? 362 HOH R O 1 HETATM 3337 O O . HOH K 6 . ? 23.958 26.478 34.686 1.00 50.27 ? 363 HOH R O 1 HETATM 3338 O O . HOH K 6 . ? 21.875 35.683 32.289 1.00 58.70 ? 364 HOH R O 1 HETATM 3339 O O . HOH K 6 . ? 11.820 39.807 42.604 1.00 58.48 ? 365 HOH R O 1 HETATM 3340 O O . HOH K 6 . ? 56.271 47.339 3.401 1.00 56.98 ? 366 HOH R O 1 HETATM 3341 O O . HOH K 6 . ? 30.889 23.737 19.730 1.00 55.62 ? 367 HOH R O 1 HETATM 3342 O O . HOH K 6 . ? 6.838 23.499 54.419 1.00 44.37 ? 368 HOH R O 1 HETATM 3343 O O . HOH K 6 . ? 51.853 57.103 -24.839 1.00 58.25 ? 369 HOH R O 1 HETATM 3344 O O . HOH K 6 . ? 37.223 32.768 45.004 1.00 63.04 ? 370 HOH R O 1 HETATM 3345 O O . HOH K 6 . ? 56.814 42.485 -8.277 1.00 76.48 ? 371 HOH R O 1 HETATM 3346 O O . HOH K 6 . ? 35.738 39.782 12.382 1.00 58.78 ? 372 HOH R O 1 HETATM 3347 O O . HOH K 6 . ? 27.930 29.199 46.553 1.00 71.59 ? 373 HOH R O 1 HETATM 3348 O O . HOH K 6 . ? 40.401 31.742 -7.609 1.00 55.70 ? 374 HOH R O 1 HETATM 3349 O O . HOH K 6 . ? 22.520 40.672 36.913 1.00 52.61 ? 375 HOH R O 1 HETATM 3350 O O . HOH K 6 . ? 54.536 52.786 10.842 1.00 59.03 ? 376 HOH R O 1 HETATM 3351 O O . HOH K 6 . ? 17.277 44.211 45.800 1.00 69.44 ? 377 HOH R O 1 HETATM 3352 O O . HOH K 6 . ? 51.351 53.070 -22.861 1.00 58.40 ? 378 HOH R O 1 HETATM 3353 O O . HOH K 6 . ? 16.755 16.368 52.769 1.00 66.96 ? 379 HOH R O 1 HETATM 3354 O O . HOH K 6 . ? 54.089 64.291 -17.822 1.00 52.76 ? 380 HOH R O 1 HETATM 3355 O O . HOH K 6 . ? 30.259 47.041 27.391 1.00 54.73 ? 381 HOH R O 1 HETATM 3356 O O . HOH K 6 . ? 56.544 49.758 -0.961 1.00 53.75 ? 382 HOH R O 1 HETATM 3357 O O . HOH K 6 . ? 37.843 28.004 -1.648 1.00 57.04 ? 383 HOH R O 1 HETATM 3358 O O . HOH K 6 . ? 57.684 56.845 -5.646 1.00 68.33 ? 384 HOH R O 1 HETATM 3359 O O . HOH K 6 . ? 57.258 47.699 -18.331 1.00 66.78 ? 385 HOH R O 1 HETATM 3360 O O . HOH K 6 . ? 29.144 27.302 21.497 1.00 54.62 ? 386 HOH R O 1 HETATM 3361 O O . HOH K 6 . ? 28.400 34.917 20.306 1.00 71.67 ? 387 HOH R O 1 HETATM 3362 O O . HOH K 6 . ? 14.826 18.757 55.813 1.00 48.64 ? 388 HOH R O 1 HETATM 3363 O O . HOH K 6 . ? 57.579 54.067 -14.491 1.00 55.56 ? 389 HOH R O 1 HETATM 3364 O O . HOH K 6 . ? 33.814 17.028 17.214 1.00 64.31 ? 390 HOH R O 1 HETATM 3365 O O . HOH K 6 . ? 27.606 29.039 52.734 1.00 55.45 ? 391 HOH R O 1 HETATM 3366 O O . HOH K 6 . ? 50.828 41.210 10.870 1.00 63.57 ? 392 HOH R O 1 HETATM 3367 O O . HOH K 6 . ? 20.881 25.264 58.250 1.00 65.07 ? 393 HOH R O 1 HETATM 3368 O O . HOH K 6 . ? 13.961 38.409 57.040 1.00 69.81 ? 394 HOH R O 1 HETATM 3369 O O . HOH K 6 . ? 51.821 24.617 15.029 1.00 54.61 ? 395 HOH R O 1 HETATM 3370 O O . HOH K 6 . ? 25.822 49.702 45.649 1.00 55.69 ? 396 HOH R O 1 HETATM 3371 O O . HOH K 6 . ? 43.138 18.788 16.997 1.00 70.23 ? 397 HOH R O 1 HETATM 3372 O O . HOH K 6 . ? 44.052 41.066 34.990 1.00 64.22 ? 398 HOH R O 1 HETATM 3373 O O . HOH K 6 . ? 25.994 20.704 50.070 1.00 55.20 ? 399 HOH R O 1 HETATM 3374 O O . HOH K 6 . ? 41.589 17.002 -0.173 1.00 57.29 ? 400 HOH R O 1 HETATM 3375 O O . HOH K 6 . ? 27.534 30.214 14.703 1.00 79.33 ? 401 HOH R O 1 HETATM 3376 O O . HOH K 6 . ? 46.785 63.175 -23.589 1.00 68.91 ? 402 HOH R O 1 HETATM 3377 O O . HOH K 6 . ? 7.787 29.347 40.648 1.00 64.51 ? 403 HOH R O 1 HETATM 3378 O O . HOH K 6 . ? 58.386 45.818 -16.212 1.00 70.21 ? 404 HOH R O 1 HETATM 3379 O O . HOH K 6 . ? 45.575 47.237 20.705 1.00 64.69 ? 405 HOH R O 1 HETATM 3380 O O . HOH K 6 . ? 32.040 44.665 17.944 1.00 60.19 ? 406 HOH R O 1 HETATM 3381 O O . HOH K 6 . ? 9.017 26.622 39.895 1.00 64.00 ? 407 HOH R O 1 HETATM 3382 O O . HOH K 6 . ? 8.137 19.605 55.873 1.00 55.72 ? 408 HOH R O 1 HETATM 3383 O O . HOH K 6 . ? 58.306 50.029 -7.521 1.00 59.32 ? 409 HOH R O 1 HETATM 3384 O O . HOH K 6 . ? 41.052 14.878 9.144 1.00 65.47 ? 410 HOH R O 1 HETATM 3385 O O . HOH K 6 . ? 20.123 17.253 44.488 1.00 60.54 ? 411 HOH R O 1 HETATM 3386 O O . HOH K 6 . ? 56.984 57.561 -13.770 1.00 51.45 ? 412 HOH R O 1 HETATM 3387 O O . HOH K 6 . ? 45.609 38.238 -7.032 1.00 61.43 ? 413 HOH R O 1 HETATM 3388 O O . HOH K 6 . ? 47.986 40.197 10.474 1.00 56.35 ? 414 HOH R O 1 HETATM 3389 O O . HOH K 6 . ? 32.423 21.126 22.467 1.00 60.75 ? 415 HOH R O 1 HETATM 3390 O O . HOH K 6 . ? 27.310 23.377 36.100 1.00 63.37 ? 416 HOH R O 1 HETATM 3391 O O . HOH K 6 . ? 37.399 19.788 25.394 1.00 58.37 ? 417 HOH R O 1 HETATM 3392 O O . HOH K 6 . ? 20.459 42.916 37.754 1.00 79.13 ? 418 HOH R O 1 HETATM 3393 O O . HOH K 6 . ? 57.263 58.393 -9.064 1.00 58.83 ? 419 HOH R O 1 HETATM 3394 O O . HOH K 6 . ? 56.679 59.972 -11.677 1.00 67.49 ? 420 HOH R O 1 HETATM 3395 O O . HOH K 6 . ? 32.964 20.203 1.984 1.00 57.21 ? 421 HOH R O 1 HETATM 3396 O O . HOH K 6 . ? 56.454 53.053 3.704 1.00 67.61 ? 422 HOH R O 1 HETATM 3397 O O . HOH K 6 . ? 38.364 20.764 -7.520 1.00 58.45 ? 423 HOH R O 1 HETATM 3398 O O . HOH K 6 . ? 39.351 46.184 22.876 1.00 55.57 ? 424 HOH R O 1 HETATM 3399 O O . HOH K 6 . ? 40.266 19.372 -2.436 1.00 67.92 ? 425 HOH R O 1 HETATM 3400 O O . HOH K 6 . ? 21.749 40.924 56.309 1.00 66.38 ? 426 HOH R O 1 HETATM 3401 O O . HOH K 6 . ? 14.880 43.425 51.823 1.00 64.85 ? 427 HOH R O 1 HETATM 3402 O O . HOH K 6 . ? 32.230 43.752 37.287 1.00 70.94 ? 428 HOH R O 1 HETATM 3403 O O . HOH K 6 . ? 38.173 27.444 33.503 1.00 70.55 ? 429 HOH R O 1 HETATM 3404 O O . HOH K 6 . ? 23.897 38.139 32.468 1.00 55.82 ? 430 HOH R O 1 HETATM 3405 O O . HOH K 6 . ? 19.934 19.310 38.205 1.00 58.74 ? 431 HOH R O 1 HETATM 3406 O O . HOH K 6 . ? 37.322 44.427 35.000 1.00 90.03 ? 432 HOH R O 1 HETATM 3407 O O . HOH K 6 . ? 54.851 60.101 -4.412 1.00 62.59 ? 433 HOH R O 1 HETATM 3408 O O . HOH K 6 . ? 59.070 56.003 -16.826 1.00 73.37 ? 434 HOH R O 1 HETATM 3409 O O . HOH K 6 . ? 9.101 32.676 56.689 1.00 55.92 ? 435 HOH R O 1 HETATM 3410 O O . HOH K 6 . ? 56.335 46.889 -21.274 1.00 81.81 ? 436 HOH R O 1 HETATM 3411 O O . HOH K 6 . ? 22.147 24.210 55.428 1.00 59.71 ? 437 HOH R O 1 HETATM 3412 O O . HOH K 6 . ? 33.566 45.422 21.231 1.00 59.65 ? 438 HOH R O 1 HETATM 3413 O O . HOH K 6 . ? 44.082 13.816 9.548 1.00 79.36 ? 439 HOH R O 1 HETATM 3414 O O . HOH K 6 . ? 57.910 47.725 6.091 1.00 67.59 ? 440 HOH R O 1 HETATM 3415 O O . HOH K 6 . ? 35.709 30.082 44.687 1.00 65.78 ? 441 HOH R O 1 HETATM 3416 O O . HOH K 6 . ? 19.283 37.619 56.529 1.00 84.62 ? 442 HOH R O 1 HETATM 3417 O O . HOH K 6 . ? 29.512 42.591 15.175 1.00 62.41 ? 443 HOH R O 1 HETATM 3418 O O . HOH K 6 . ? 21.842 39.847 34.029 1.00 79.45 ? 444 HOH R O 1 HETATM 3419 O O . HOH K 6 . ? 13.906 38.175 52.147 1.00 62.67 ? 445 HOH R O 1 HETATM 3420 O O . HOH K 6 . ? 11.666 25.038 38.072 1.00 71.63 ? 446 HOH R 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 MET 1 0 0 MET MET L . n A 1 2 GLN 2 1 1 GLN GLN L . n A 1 3 ASP 3 2 2 ASP ASP L . n A 1 4 PRO 4 3 3 PRO PRO L . n A 1 5 TYR 5 4 4 TYR TYR L . n A 1 6 VAL 6 5 5 VAL VAL L . n A 1 7 LYS 7 6 6 LYS LYS L . n A 1 8 GLU 8 7 7 GLU GLU L . n A 1 9 ALA 9 8 8 ALA ALA L . n A 1 10 GLU 10 9 9 GLU GLU L . n A 1 11 ASN 11 10 10 ASN ASN L . n A 1 12 LEU 12 11 11 LEU LEU L . n A 1 13 LYS 13 12 12 LYS LYS L . n A 1 14 LYS 14 13 13 LYS LYS L . n A 1 15 TYR 15 14 14 TYR TYR L . n A 1 16 PHE 16 15 15 PHE PHE L . n A 1 17 ASN 17 16 16 ASN ASN L . n A 1 18 ALA 18 17 17 ALA ALA L . n A 1 19 GLY 19 18 18 GLY GLY L . n A 1 20 HIS 20 19 19 HIS HIS L . n A 1 21 SER 21 20 20 SER SER L . n A 1 22 ASP 22 21 21 ASP ASP L . n A 1 23 VAL 23 22 22 VAL VAL L . n A 1 24 ALA 24 23 23 ALA ALA L . n A 1 25 ASP 25 24 24 ASP ASP L . n A 1 26 ASN 26 25 25 ASN ASN L . n A 1 27 GLY 27 26 26 GLY GLY L . n A 1 28 THR 28 27 27 THR THR L . n A 1 29 LEU 29 28 28 LEU LEU L . n A 1 30 PHE 30 29 29 PHE PHE L . n A 1 31 LEU 31 30 30 LEU LEU L . n A 1 32 GLY 32 31 31 GLY GLY L . n A 1 33 ILE 33 32 32 ILE ILE L . n A 1 34 LEU 34 33 33 LEU LEU L . n A 1 35 LYS 35 34 34 LYS LYS L . n A 1 36 ASN 36 35 35 ASN ASN L . n A 1 37 TRP 37 36 36 TRP TRP L . n A 1 38 LYS 38 37 37 LYS LYS L . n A 1 39 GLU 39 38 38 GLU GLU L . n A 1 40 GLU 40 39 39 GLU GLU L . n A 1 41 SER 41 40 40 SER SER L . n A 1 42 ASP 42 41 41 ASP ASP L . n A 1 43 ARG 43 42 42 ARG ARG L . n A 1 44 LYS 44 43 43 LYS LYS L . n A 1 45 ILE 45 44 44 ILE ILE L . n A 1 46 MET 46 45 45 MET MET L . n A 1 47 GLN 47 46 46 GLN GLN L . n A 1 48 SER 48 47 47 SER SER L . n A 1 49 GLN 49 48 48 GLN GLN L . n A 1 50 ILE 50 49 49 ILE ILE L . n A 1 51 VAL 51 50 50 VAL VAL L . n A 1 52 SER 52 51 51 SER SER L . n A 1 53 PHE 53 52 52 PHE PHE L . n A 1 54 TYR 54 53 53 TYR TYR L . n A 1 55 PHE 55 54 54 PHE PHE L . n A 1 56 LYS 56 55 55 LYS LYS L . n A 1 57 LEU 57 56 56 LEU LEU L . n A 1 58 PHE 58 57 57 PHE PHE L . n A 1 59 LYS 59 58 58 LYS LYS L . n A 1 60 ASN 60 59 59 ASN ASN L . n A 1 61 PHE 61 60 60 PHE PHE L . n A 1 62 LYS 62 61 61 LYS LYS L . n A 1 63 ASP 63 62 62 ASP ASP L . n A 1 64 ASP 64 63 63 ASP ASP L . n A 1 65 GLN 65 64 64 GLN GLN L . n A 1 66 SER 66 65 65 SER SER L . n A 1 67 ILE 67 66 66 ILE ILE L . n A 1 68 GLN 68 67 67 GLN GLN L . n A 1 69 LYS 69 68 68 LYS LYS L . n A 1 70 SER 70 69 69 SER SER L . n A 1 71 VAL 71 70 70 VAL VAL L . n A 1 72 GLU 72 71 71 GLU GLU L . n A 1 73 THR 73 72 72 THR THR L . n A 1 74 ILE 74 73 73 ILE ILE L . n A 1 75 LYS 75 74 74 LYS LYS L . n A 1 76 GLU 76 75 75 GLU GLU L . n A 1 77 ASP 77 76 76 ASP ASP L . n A 1 78 MET 78 77 77 MET MET L . n A 1 79 ASN 79 78 78 ASN ASN L . n A 1 80 VAL 80 79 79 VAL VAL L . n A 1 81 LYS 81 80 80 LYS LYS L . n A 1 82 PHE 82 81 81 PHE PHE L . n A 1 83 PHE 83 82 82 PHE PHE L . n A 1 84 ASN 84 83 83 ASN ASN L . n A 1 85 SER 85 84 84 SER SER L . n A 1 86 ASN 86 85 85 ASN ASN L . n A 1 87 LYS 87 86 86 LYS LYS L . n A 1 88 LYS 88 87 87 LYS LYS L . n A 1 89 LYS 89 88 88 LYS LYS L . n A 1 90 ARG 90 89 89 ARG ARG L . n A 1 91 ASP 91 90 90 ASP ASP L . n A 1 92 ASP 92 91 91 ASP ASP L . n A 1 93 PHE 93 92 92 PHE PHE L . n A 1 94 GLU 94 93 93 GLU GLU L . n A 1 95 LYS 95 94 94 LYS LYS L . n A 1 96 LEU 96 95 95 LEU LEU L . n A 1 97 THR 97 96 96 THR THR L . n A 1 98 ASN 98 97 97 ASN ASN L . n A 1 99 TYR 99 98 98 TYR TYR L . n A 1 100 SER 100 99 99 SER SER L . n A 1 101 VAL 101 100 100 VAL VAL L . n A 1 102 THR 102 101 101 THR THR L . n A 1 103 ASP 103 102 102 ASP ASP L . n A 1 104 LEU 104 103 103 LEU LEU L . n A 1 105 ASN 105 104 104 ASN ASN L . n A 1 106 VAL 106 105 105 VAL VAL L . n A 1 107 GLN 107 106 106 GLN GLN L . n A 1 108 ARG 108 107 107 ARG ARG L . n A 1 109 LYS 109 108 108 LYS LYS L . n A 1 110 ALA 110 109 109 ALA ALA L . n A 1 111 ILE 111 110 110 ILE ILE L . n A 1 112 HIS 112 111 111 HIS HIS L . n A 1 113 GLU 113 112 112 GLU GLU L . n A 1 114 LEU 114 113 113 LEU LEU L . n A 1 115 ILE 115 114 114 ILE ILE L . n A 1 116 GLN 116 115 115 GLN GLN L . n A 1 117 VAL 117 116 116 VAL VAL L . n A 1 118 MET 118 117 117 MET MET L . n A 1 119 ALA 119 118 118 ALA ALA L . n A 1 120 GLU 120 119 119 GLU GLU L . n A 1 121 LEU 121 120 120 LEU LEU L . n A 1 122 SER 122 121 121 SER SER L . n A 1 123 PRO 123 122 122 PRO PRO L . n A 1 124 ALA 124 123 123 ALA ALA L . n A 1 125 ALA 125 124 124 ALA ALA L . n A 1 126 LYS 126 125 125 LYS LYS L . n A 1 127 THR 127 126 126 THR THR L . n A 1 128 GLY 128 127 127 GLY GLY L . n A 1 129 LYS 129 128 128 LYS LYS L . n A 1 130 ARG 130 129 129 ARG ARG L . n A 1 131 LYS 131 130 130 LYS LYS L . n A 1 132 ARG 132 131 131 ARG ARG L . n A 1 133 SER 133 132 132 SER SER L . n A 1 134 GLN 134 133 ? ? ? L . n A 1 135 MET 135 134 ? ? ? L . n A 1 136 LEU 136 135 ? ? ? L . n A 1 137 PHE 137 136 ? ? ? L . n A 1 138 ARG 138 137 ? ? ? L . n A 1 139 GLY 139 138 ? ? ? L . n B 2 1 THR 1 17 17 THR THR R . n B 2 2 ILE 2 18 18 ILE ILE R . n B 2 3 THR 3 19 19 THR THR R . n B 2 4 SER 4 20 20 SER SER R . n B 2 5 TYR 5 21 21 TYR TYR R . n B 2 6 LYS 6 22 22 LYS LYS R . n B 2 7 PHE 7 23 23 PHE PHE R . n B 2 8 GLU 8 24 24 GLU GLU R . n B 2 9 SER 9 25 25 SER SER R . n B 2 10 VAL 10 26 26 VAL VAL R . n B 2 11 ASN 11 27 27 ASN ASN R . n B 2 12 PHE 12 28 28 PHE PHE R . n B 2 13 ASP 13 29 29 ASP ASP R . n B 2 14 SER 14 30 30 SER SER R . n B 2 15 LYS 15 31 31 LYS LYS R . n B 2 16 ILE 16 32 32 ILE ILE R . n B 2 17 GLU 17 33 33 GLU GLU R . n B 2 18 TRP 18 34 34 TRP TRP R . n B 2 19 THR 19 35 35 THR THR R . n B 2 20 GLY 20 36 36 GLY GLY R . n B 2 21 ASN 21 37 37 ASN ASN R . n B 2 22 GLY 22 38 38 GLY GLY R . n B 2 23 LEU 23 39 39 LEU LEU R . n B 2 24 TYR 24 40 40 TYR TYR R . n B 2 25 ASN 25 41 41 ASN ASN R . n B 2 26 ILE 26 42 42 ILE ILE R . n B 2 27 SER 27 43 43 SER SER R . n B 2 28 LEU 28 44 44 LEU LEU R . n B 2 29 ARG 29 45 45 ARG ARG R . n B 2 30 ASN 30 46 46 ASN ASN R . n B 2 31 TYR 31 47 47 TYR TYR R . n B 2 32 GLY 32 48 48 GLY GLY R . n B 2 33 ILE 33 49 49 ILE ILE R . n B 2 34 LYS 34 50 50 LYS LYS R . n B 2 35 THR 35 51 51 THR THR R . n B 2 36 TRP 36 52 52 TRP TRP R . n B 2 37 GLN 37 53 53 GLN GLN R . n B 2 38 THR 38 54 54 THR THR R . n B 2 39 MET 39 55 55 MET MET R . n B 2 40 TYR 40 56 56 TYR TYR R . n B 2 41 THR 41 57 57 THR THR R . n B 2 42 ASN 42 58 58 ASN ASN R . n B 2 43 VAL 43 59 59 VAL VAL R . n B 2 44 PRO 44 60 60 PRO PRO R . n B 2 45 GLU 45 61 61 GLU GLU R . n B 2 46 GLY 46 62 62 GLY GLY R . n B 2 47 THR 47 63 63 THR THR R . n B 2 48 TYR 48 64 64 TYR TYR R . n B 2 49 ASP 49 65 65 ASP ASP R . n B 2 50 ILE 50 66 66 ILE ILE R . n B 2 51 SER 51 67 67 SER SER R . n B 2 52 GLY 52 68 68 GLY GLY R . n B 2 53 PHE 53 69 69 PHE PHE R . n B 2 54 PRO 54 70 70 PRO PRO R . n B 2 55 ASN 55 71 71 ASN ASN R . n B 2 56 ASN 56 72 72 ASN ASN R . n B 2 57 ASP 57 73 73 ASP ASP R . n B 2 58 PHE 58 74 74 PHE PHE R . n B 2 59 VAL 59 75 75 VAL VAL R . n B 2 60 SER 60 76 76 SER SER R . n B 2 61 PHE 61 77 77 PHE PHE R . n B 2 62 TRP 62 78 78 TRP TRP R . n B 2 63 VAL 63 79 79 VAL VAL R . n B 2 64 LYS 64 80 80 LYS LYS R . n B 2 65 PHE 65 81 81 PHE PHE R . n B 2 66 GLU 66 82 82 GLU GLU R . n B 2 67 GLN 67 83 83 GLN GLN R . n B 2 68 GLY 68 84 84 GLY GLY R . n B 2 69 ASP 69 85 85 ASP ASP R . n B 2 70 TYR 70 86 86 TYR TYR R . n B 2 71 LYS 71 87 87 LYS LYS R . n B 2 72 VAL 72 88 88 VAL VAL R . n B 2 73 ASP 73 89 89 ASP ASP R . n B 2 74 LYS 74 90 90 LYS LYS R . n B 2 75 TYR 75 91 91 TYR TYR R . n B 2 76 CYS 76 92 92 CYS CYS R . n B 2 77 THR 77 93 93 THR THR R . n B 2 78 GLY 78 94 94 GLY GLY R . n B 2 79 LEU 79 95 95 LEU LEU R . n B 2 80 CYS 80 96 96 CYS CYS R . n B 2 81 ILE 81 97 97 ILE ILE R . n B 2 82 GLU 82 98 98 GLU GLU R . n B 2 83 VAL 83 99 99 VAL VAL R . n B 2 84 LYS 84 100 100 LYS LYS R . n B 2 85 ILE 85 101 101 ILE ILE R . n B 2 86 GLY 86 102 102 GLY GLY R . n B 2 87 PRO 87 103 103 PRO PRO R . n B 2 88 PRO 88 104 104 PRO PRO R . n B 2 89 THR 89 105 105 THR THR R . n B 2 90 VAL 90 106 106 VAL VAL R . n B 2 91 THR 91 107 107 THR THR R . n B 2 92 LEU 92 108 108 LEU LEU R . n B 2 93 THR 93 109 109 THR THR R . n B 2 94 GLU 94 110 110 GLU GLU R . n B 2 95 TYR 95 111 111 TYR TYR R . n B 2 96 ASP 96 112 112 ASP ASP R . n B 2 97 ASP 97 113 113 ASP ASP R . n B 2 98 HIS 98 114 114 HIS HIS R . n B 2 99 ILE 99 115 115 ILE ILE R . n B 2 100 ASN 100 116 116 ASN ASN R . n B 2 101 LEU 101 117 117 LEU LEU R . n B 2 102 TYR 102 118 118 TYR TYR R . n B 2 103 ILE 103 119 119 ILE ILE R . n B 2 104 GLU 104 120 120 GLU GLU R . n B 2 105 HIS 105 121 121 HIS HIS R . n B 2 106 PRO 106 122 122 PRO PRO R . n B 2 107 TYR 107 123 123 TYR TYR R . n B 2 108 ALA 108 124 124 ALA ALA R . n B 2 109 THR 109 125 125 THR THR R . n B 2 110 ARG 110 126 126 ARG ARG R . n B 2 111 GLY 111 127 127 GLY GLY R . n B 2 112 SER 112 128 128 SER SER R . n B 2 113 LYS 113 129 129 LYS LYS R . n B 2 114 LYS 114 130 130 LYS LYS R . n B 2 115 ILE 115 131 131 ILE ILE R . n B 2 116 PRO 116 132 132 PRO PRO R . n B 2 117 ILE 117 133 133 ILE ILE R . n B 2 118 TYR 118 134 134 TYR TYR R . n B 2 119 LYS 119 135 135 LYS LYS R . n B 2 120 ARG 120 136 136 ARG ARG R . n B 2 121 ASN 121 137 137 ASN ASN R . n B 2 122 ASP 122 138 138 ASP ASP R . n B 2 123 MET 123 139 139 MET MET R . n B 2 124 CYS 124 140 140 CYS CYS R . n B 2 125 ASP 125 141 141 ASP ASP R . n B 2 126 ILE 126 142 142 ILE ILE R . n B 2 127 TYR 127 143 143 TYR TYR R . n B 2 128 LEU 128 144 144 LEU LEU R . n B 2 129 LEU 129 145 145 LEU LEU R . n B 2 130 TYR 130 146 146 TYR TYR R . n B 2 131 THR 131 147 147 THR THR R . n B 2 132 ALA 132 148 148 ALA ALA R . n B 2 133 ASN 133 149 149 ASN ASN R . n B 2 134 PHE 134 150 150 PHE PHE R . n B 2 135 THR 135 151 151 THR THR R . n B 2 136 PHE 136 152 152 PHE PHE R . n B 2 137 GLY 137 153 153 GLY GLY R . n B 2 138 ASP 138 154 154 ASP ASP R . n B 2 139 SER 139 155 155 SER SER R . n B 2 140 GLU 140 156 156 GLU GLU R . n B 2 141 GLU 141 157 157 GLU GLU R . n B 2 142 PRO 142 158 158 PRO PRO R . n B 2 143 VAL 143 159 159 VAL VAL R . n B 2 144 ILE 144 160 160 ILE ILE R . n B 2 145 TYR 145 161 161 TYR TYR R . n B 2 146 ASP 146 162 162 ASP ASP R . n B 2 147 ILE 147 163 163 ILE ILE R . n B 2 148 ASP 148 164 164 ASP ASP R . n B 2 149 ASP 149 165 165 ASP ASP R . n B 2 150 TYR 150 166 166 TYR TYR R . n B 2 151 ASP 151 167 167 ASP ASP R . n B 2 152 CYS 152 168 168 CYS CYS R . n B 2 153 THR 153 169 169 THR THR R . n B 2 154 SER 154 170 170 SER SER R . n B 2 155 THR 155 171 171 THR THR R . n B 2 156 GLY 156 172 172 GLY GLY R . n B 2 157 CYS 157 173 173 CYS CYS R . n B 2 158 SER 158 174 174 SER SER R . n B 2 159 ILE 159 175 175 ILE ILE R . n B 2 160 ASP 160 176 176 ASP ASP R . n B 2 161 PHE 161 177 177 PHE PHE R . n B 2 162 ALA 162 178 178 ALA ALA R . n B 2 163 THR 163 179 179 THR THR R . n B 2 164 THR 164 180 180 THR THR R . n B 2 165 GLU 165 181 181 GLU GLU R . n B 2 166 LYS 166 182 182 LYS LYS R . n B 2 167 VAL 167 183 183 VAL VAL R . n B 2 168 CYS 168 184 184 CYS CYS R . n B 2 169 VAL 169 185 185 VAL VAL R . n B 2 170 MET 170 186 186 MET MET R . n B 2 171 ALA 171 187 187 ALA ALA R . n B 2 172 GLN 172 188 188 GLN GLN R . n B 2 173 GLY 173 189 189 GLY GLY R . n B 2 174 ALA 174 190 190 ALA ALA R . n B 2 175 THR 175 191 191 THR THR R . n B 2 176 GLU 176 192 192 GLU GLU R . n B 2 177 GLY 177 193 193 GLY GLY R . n B 2 178 LEU 178 194 194 LEU LEU R . n B 2 179 LEU 179 195 195 LEU LEU R . n B 2 180 ASP 180 196 196 ASP ASP R . n B 2 181 LYS 181 197 197 LYS LYS R . n B 2 182 ILE 182 198 198 ILE ILE R . n B 2 183 THR 183 199 199 THR THR R . n B 2 184 PRO 184 200 200 PRO PRO R . n B 2 185 TRP 185 201 201 TRP TRP R . n B 2 186 SER 186 202 202 SER SER R . n B 2 187 SER 187 203 203 SER SER R . n B 2 188 GLU 188 204 204 GLU GLU R . n B 2 189 VAL 189 205 205 VAL VAL R . n B 2 190 CYS 190 206 206 CYS CYS R . n B 2 191 LEU 191 207 207 LEU LEU R . n B 2 192 THR 192 208 208 THR THR R . n B 2 193 PRO 193 209 209 PRO PRO R . n B 2 194 LYS 194 210 210 LYS LYS R . n B 2 195 LYS 195 211 211 LYS LYS R . n B 2 196 ASN 196 212 212 ASN ASN R . n B 2 197 VAL 197 213 213 VAL VAL R . n B 2 198 TYR 198 214 214 TYR TYR R . n B 2 199 THR 199 215 215 THR THR R . n B 2 200 CYS 200 216 216 CYS CYS R . n B 2 201 ALA 201 217 217 ALA ALA R . n B 2 202 ILE 202 218 218 ILE ILE R . n B 2 203 ARG 203 219 219 ARG ARG R . n B 2 204 SER 204 220 220 SER SER R . n B 2 205 LYS 205 221 221 LYS LYS R . n B 2 206 GLU 206 222 222 GLU GLU R . n B 2 207 ASP 207 223 223 ASP ASP R . n B 2 208 VAL 208 224 224 VAL VAL R . n B 2 209 PRO 209 225 225 PRO PRO R . n B 2 210 ASN 210 226 226 ASN ASN R . n B 2 211 PHE 211 227 227 PHE PHE R . n B 2 212 LYS 212 228 228 LYS LYS R . n B 2 213 GLU 213 229 229 GLU GLU R . n B 2 214 LYS 214 230 230 LYS LYS R . n B 2 215 MET 215 231 231 MET MET R . n B 2 216 THR 216 232 232 THR THR R . n B 2 217 ARG 217 233 233 ARG ARG R . n B 2 218 VAL 218 234 234 VAL VAL R . n B 2 219 ILE 219 235 235 ILE ILE R . n B 2 220 LYS 220 236 236 LYS LYS R . n B 2 221 ARG 221 237 237 ARG ARG R . n B 2 222 LYS 222 238 238 LYS LYS R . n B 2 223 PHE 223 239 239 PHE PHE R . n B 2 224 ASN 224 240 240 ASN ASN R . n B 2 225 LYS 225 241 241 LYS LYS R . n B 2 226 GLN 226 242 242 GLN GLN R . n B 2 227 SER 227 243 243 SER SER R . n B 2 228 HIS 228 244 244 HIS HIS R . n B 2 229 SER 229 245 245 SER SER R . n B 2 230 TYR 230 246 246 TYR TYR R . n B 2 231 LEU 231 247 247 LEU LEU R . n B 2 232 THR 232 248 248 THR THR R . n B 2 233 LYS 233 249 249 LYS LYS R . n B 2 234 PHE 234 250 250 PHE PHE R . n B 2 235 LEU 235 251 251 LEU LEU R . n B 2 236 GLY 236 252 252 GLY GLY R . n B 2 237 SER 237 253 253 SER SER R . n B 2 238 THR 238 254 254 THR THR R . n B 2 239 SER 239 255 255 SER SER R . n B 2 240 ASN 240 256 256 ASN ASN R . n B 2 241 ASP 241 257 257 ASP ASP R . n B 2 242 ILE 242 258 258 ILE ILE R . n B 2 243 THR 243 259 259 THR THR R . n B 2 244 THR 244 260 260 THR THR R . n B 2 245 PHE 245 261 261 PHE PHE R . n B 2 246 LEU 246 262 262 LEU LEU R . n B 2 247 SER 247 263 263 SER SER R . n B 2 248 MET 248 264 264 MET MET R . n B 2 249 LEU 249 265 265 LEU LEU R . n B 2 250 ASP 250 266 266 ASP ASP R . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code C 3 PO4 1 139 2 PO4 PO4 L . D 4 NAG 1 267 111 NAG NAG R . E 4 NAG 2 268 112 NAG NAG R . F 5 BMA 3 269 113 BMA MAN R . G 4 NAG 1 270 211 NAG NAG R . H 3 PO4 1 1 1 PO4 PO4 R . I 3 PO4 1 3 3 PO4 PO4 R . J 6 HOH 1 140 8 HOH HOH L . J 6 HOH 2 141 23 HOH HOH L . J 6 HOH 3 142 26 HOH HOH L . J 6 HOH 4 143 27 HOH HOH L . J 6 HOH 5 144 38 HOH HOH L . J 6 HOH 6 145 41 HOH HOH L . J 6 HOH 7 146 61 HOH HOH L . J 6 HOH 8 147 62 HOH HOH L . J 6 HOH 9 148 69 HOH HOH L . J 6 HOH 10 149 70 HOH HOH L . J 6 HOH 11 150 74 HOH HOH L . J 6 HOH 12 151 75 HOH HOH L . J 6 HOH 13 152 77 HOH HOH L . J 6 HOH 14 153 83 HOH HOH L . J 6 HOH 15 154 84 HOH HOH L . J 6 HOH 16 155 90 HOH HOH L . J 6 HOH 17 156 94 HOH HOH L . J 6 HOH 18 157 96 HOH HOH L . J 6 HOH 19 158 98 HOH HOH L . J 6 HOH 20 159 106 HOH HOH L . J 6 HOH 21 160 108 HOH HOH L . J 6 HOH 22 161 112 HOH HOH L . J 6 HOH 23 162 113 HOH HOH L . J 6 HOH 24 163 122 HOH HOH L . J 6 HOH 25 164 127 HOH HOH L . J 6 HOH 26 165 133 HOH HOH L . J 6 HOH 27 166 139 HOH HOH L . J 6 HOH 28 167 142 HOH HOH L . J 6 HOH 29 168 143 HOH HOH L . J 6 HOH 30 169 148 HOH HOH L . J 6 HOH 31 170 154 HOH HOH L . J 6 HOH 32 171 156 HOH HOH L . J 6 HOH 33 172 158 HOH HOH L . J 6 HOH 34 173 163 HOH HOH L . J 6 HOH 35 174 167 HOH HOH L . J 6 HOH 36 175 170 HOH HOH L . J 6 HOH 37 176 175 HOH HOH L . J 6 HOH 38 177 176 HOH HOH L . J 6 HOH 39 178 179 HOH HOH L . J 6 HOH 40 179 180 HOH HOH L . J 6 HOH 41 180 183 HOH HOH L . J 6 HOH 42 181 184 HOH HOH L . J 6 HOH 43 182 186 HOH HOH L . J 6 HOH 44 183 187 HOH HOH L . J 6 HOH 45 184 191 HOH HOH L . J 6 HOH 46 185 192 HOH HOH L . J 6 HOH 47 186 199 HOH HOH L . J 6 HOH 48 187 200 HOH HOH L . J 6 HOH 49 188 208 HOH HOH L . J 6 HOH 50 189 211 HOH HOH L . J 6 HOH 51 190 212 HOH HOH L . J 6 HOH 52 191 217 HOH HOH L . J 6 HOH 53 192 219 HOH HOH L . J 6 HOH 54 193 222 HOH HOH L . J 6 HOH 55 194 224 HOH HOH L . J 6 HOH 56 195 226 HOH HOH L . J 6 HOH 57 196 228 HOH HOH L . J 6 HOH 58 197 230 HOH HOH L . J 6 HOH 59 198 231 HOH HOH L . J 6 HOH 60 199 235 HOH HOH L . J 6 HOH 61 200 249 HOH HOH L . J 6 HOH 62 201 255 HOH HOH L . K 6 HOH 1 272 1 HOH HOH R . K 6 HOH 2 273 2 HOH HOH R . K 6 HOH 3 274 4 HOH HOH R . K 6 HOH 4 275 5 HOH HOH R . K 6 HOH 5 276 6 HOH HOH R . K 6 HOH 6 277 7 HOH HOH R . K 6 HOH 7 278 9 HOH HOH R . K 6 HOH 8 279 10 HOH HOH R . K 6 HOH 9 280 11 HOH HOH R . K 6 HOH 10 281 12 HOH HOH R . K 6 HOH 11 282 14 HOH HOH R . K 6 HOH 12 283 15 HOH HOH R . K 6 HOH 13 284 16 HOH HOH R . K 6 HOH 14 285 17 HOH HOH R . K 6 HOH 15 286 19 HOH HOH R . K 6 HOH 16 287 20 HOH HOH R . K 6 HOH 17 288 21 HOH HOH R . K 6 HOH 18 289 22 HOH HOH R . K 6 HOH 19 290 24 HOH HOH R . K 6 HOH 20 291 25 HOH HOH R . K 6 HOH 21 292 28 HOH HOH R . K 6 HOH 22 293 29 HOH HOH R . K 6 HOH 23 294 30 HOH HOH R . K 6 HOH 24 295 31 HOH HOH R . K 6 HOH 25 296 32 HOH HOH R . K 6 HOH 26 297 33 HOH HOH R . K 6 HOH 27 298 34 HOH HOH R . K 6 HOH 28 299 35 HOH HOH R . K 6 HOH 29 300 36 HOH HOH R . K 6 HOH 30 301 37 HOH HOH R . K 6 HOH 31 302 39 HOH HOH R . K 6 HOH 32 303 40 HOH HOH R . K 6 HOH 33 304 42 HOH HOH R . K 6 HOH 34 305 43 HOH HOH R . K 6 HOH 35 306 44 HOH HOH R . K 6 HOH 36 307 45 HOH HOH R . K 6 HOH 37 308 46 HOH HOH R . K 6 HOH 38 309 47 HOH HOH R . K 6 HOH 39 310 48 HOH HOH R . K 6 HOH 40 311 49 HOH HOH R . K 6 HOH 41 312 50 HOH HOH R . K 6 HOH 42 313 51 HOH HOH R . K 6 HOH 43 314 52 HOH HOH R . K 6 HOH 44 315 53 HOH HOH R . K 6 HOH 45 316 54 HOH HOH R . K 6 HOH 46 317 55 HOH HOH R . K 6 HOH 47 318 56 HOH HOH R . K 6 HOH 48 319 57 HOH HOH R . K 6 HOH 49 320 58 HOH HOH R . K 6 HOH 50 321 59 HOH HOH R . K 6 HOH 51 322 60 HOH HOH R . K 6 HOH 52 323 63 HOH HOH R . K 6 HOH 53 324 64 HOH HOH R . K 6 HOH 54 325 65 HOH HOH R . K 6 HOH 55 326 66 HOH HOH R . K 6 HOH 56 327 67 HOH HOH R . K 6 HOH 57 328 68 HOH HOH R . K 6 HOH 58 329 71 HOH HOH R . K 6 HOH 59 330 72 HOH HOH R . K 6 HOH 60 331 73 HOH HOH R . K 6 HOH 61 332 76 HOH HOH R . K 6 HOH 62 333 78 HOH HOH R . K 6 HOH 63 334 79 HOH HOH R . K 6 HOH 64 335 80 HOH HOH R . K 6 HOH 65 336 81 HOH HOH R . K 6 HOH 66 337 82 HOH HOH R . K 6 HOH 67 338 85 HOH HOH R . K 6 HOH 68 339 86 HOH HOH R . K 6 HOH 69 340 87 HOH HOH R . K 6 HOH 70 341 88 HOH HOH R . K 6 HOH 71 342 89 HOH HOH R . K 6 HOH 72 343 91 HOH HOH R . K 6 HOH 73 344 92 HOH HOH R . K 6 HOH 74 345 93 HOH HOH R . K 6 HOH 75 346 95 HOH HOH R . K 6 HOH 76 347 97 HOH HOH R . K 6 HOH 77 348 99 HOH HOH R . K 6 HOH 78 349 100 HOH HOH R . K 6 HOH 79 350 101 HOH HOH R . K 6 HOH 80 351 102 HOH HOH R . K 6 HOH 81 352 103 HOH HOH R . K 6 HOH 82 353 104 HOH HOH R . K 6 HOH 83 354 105 HOH HOH R . K 6 HOH 84 355 107 HOH HOH R . K 6 HOH 85 356 110 HOH HOH R . K 6 HOH 86 357 111 HOH HOH R . K 6 HOH 87 358 114 HOH HOH R . K 6 HOH 88 359 115 HOH HOH R . K 6 HOH 89 360 116 HOH HOH R . K 6 HOH 90 361 117 HOH HOH R . K 6 HOH 91 362 118 HOH HOH R . K 6 HOH 92 363 119 HOH HOH R . K 6 HOH 93 364 120 HOH HOH R . K 6 HOH 94 365 121 HOH HOH R . K 6 HOH 95 366 123 HOH HOH R . K 6 HOH 96 367 124 HOH HOH R . K 6 HOH 97 368 125 HOH HOH R . K 6 HOH 98 369 126 HOH HOH R . K 6 HOH 99 370 128 HOH HOH R . K 6 HOH 100 371 129 HOH HOH R . K 6 HOH 101 372 130 HOH HOH R . K 6 HOH 102 373 131 HOH HOH R . K 6 HOH 103 374 132 HOH HOH R . K 6 HOH 104 375 134 HOH HOH R . K 6 HOH 105 376 135 HOH HOH R . K 6 HOH 106 377 136 HOH HOH R . K 6 HOH 107 378 137 HOH HOH R . K 6 HOH 108 379 138 HOH HOH R . K 6 HOH 109 380 140 HOH HOH R . K 6 HOH 110 381 141 HOH HOH R . K 6 HOH 111 382 144 HOH HOH R . K 6 HOH 112 383 145 HOH HOH R . K 6 HOH 113 384 147 HOH HOH R . K 6 HOH 114 385 149 HOH HOH R . K 6 HOH 115 386 150 HOH HOH R . K 6 HOH 116 387 153 HOH HOH R . K 6 HOH 117 388 155 HOH HOH R . K 6 HOH 118 389 157 HOH HOH R . K 6 HOH 119 390 159 HOH HOH R . K 6 HOH 120 391 160 HOH HOH R . K 6 HOH 121 392 161 HOH HOH R . K 6 HOH 122 393 162 HOH HOH R . K 6 HOH 123 394 164 HOH HOH R . K 6 HOH 124 395 165 HOH HOH R . K 6 HOH 125 396 166 HOH HOH R . K 6 HOH 126 397 168 HOH HOH R . K 6 HOH 127 398 169 HOH HOH R . K 6 HOH 128 399 171 HOH HOH R . K 6 HOH 129 400 172 HOH HOH R . K 6 HOH 130 401 173 HOH HOH R . K 6 HOH 131 402 177 HOH HOH R . K 6 HOH 132 403 178 HOH HOH R . K 6 HOH 133 404 181 HOH HOH R . K 6 HOH 134 405 182 HOH HOH R . K 6 HOH 135 406 185 HOH HOH R . K 6 HOH 136 407 188 HOH HOH R . K 6 HOH 137 408 189 HOH HOH R . K 6 HOH 138 409 190 HOH HOH R . K 6 HOH 139 410 193 HOH HOH R . K 6 HOH 140 411 194 HOH HOH R . K 6 HOH 141 412 195 HOH HOH R . K 6 HOH 142 413 196 HOH HOH R . K 6 HOH 143 414 197 HOH HOH R . K 6 HOH 144 415 201 HOH HOH R . K 6 HOH 145 416 203 HOH HOH R . K 6 HOH 146 417 204 HOH HOH R . K 6 HOH 147 418 205 HOH HOH R . K 6 HOH 148 419 206 HOH HOH R . K 6 HOH 149 420 207 HOH HOH R . K 6 HOH 150 421 209 HOH HOH R . K 6 HOH 151 422 213 HOH HOH R . K 6 HOH 152 423 214 HOH HOH R . K 6 HOH 153 424 215 HOH HOH R . K 6 HOH 154 425 216 HOH HOH R . K 6 HOH 155 426 218 HOH HOH R . K 6 HOH 156 427 220 HOH HOH R . K 6 HOH 157 428 221 HOH HOH R . K 6 HOH 158 429 223 HOH HOH R . K 6 HOH 159 430 225 HOH HOH R . K 6 HOH 160 431 227 HOH HOH R . K 6 HOH 161 432 229 HOH HOH R . K 6 HOH 162 433 232 HOH HOH R . K 6 HOH 163 434 233 HOH HOH R . K 6 HOH 164 435 234 HOH HOH R . K 6 HOH 165 436 236 HOH HOH R . K 6 HOH 166 437 239 HOH HOH R . K 6 HOH 167 438 241 HOH HOH R . K 6 HOH 168 439 245 HOH HOH R . K 6 HOH 169 440 246 HOH HOH R . K 6 HOH 170 441 247 HOH HOH R . K 6 HOH 171 442 250 HOH HOH R . K 6 HOH 172 443 251 HOH HOH R . K 6 HOH 173 444 252 HOH HOH R . K 6 HOH 174 445 253 HOH HOH R . K 6 HOH 175 446 254 HOH HOH R . # 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 B ASN 25 R ASN 41 ? ASN 'GLYCOSYLATION SITE' 2 B ASN 133 R ASN 149 ? 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 software_defined_assembly PISA octameric 8 2 author_and_software_defined_assembly PISA tetrameric 4 3 software_defined_assembly PISA tetrameric 4 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1,2,3,4 A,B,C,D,E,F,G,H,I,J,K 2 1,2 A,B,C,D,E,F,G,H,I,J,K 3 5,6 A,C,J 3 1,7 B,D,E,F,G,H,I,K # 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)' 45680 ? 2 'ABSA (A^2)' 16970 ? 3 'ABSA (A^2)' 11080 ? # 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' 2_665 -x+1,-y+1,z -1.0000000000 0.0000000000 0.0000000000 92.6300000000 0.0000000000 -1.0000000000 0.0000000000 119.1300000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 3 'crystal symmetry operation' 3_655 -x+1,y,-z -1.0000000000 0.0000000000 0.0000000000 92.6300000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 -1.0000000000 0.0000000000 4 'crystal symmetry operation' 4_565 x,-y+1,-z 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 -1.0000000000 0.0000000000 119.1300000000 0.0000000000 0.0000000000 -1.0000000000 0.0000000000 5 'crystal symmetry operation' 7_545 -x+1/2,y-1/2,-z+1/2 -1.0000000000 0.0000000000 0.0000000000 46.3150000000 0.0000000000 1.0000000000 0.0000000000 -59.5650000000 0.0000000000 0.0000000000 -1.0000000000 92.3700000000 6 'crystal symmetry operation' 8_455 x-1/2,-y+1/2,-z+1/2 1.0000000000 0.0000000000 0.0000000000 -46.3150000000 0.0000000000 -1.0000000000 0.0000000000 59.5650000000 0.0000000000 0.0000000000 -1.0000000000 92.3700000000 7 'crystal symmetry operation' 2_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 # _pdbx_struct_special_symmetry.id 1 _pdbx_struct_special_symmetry.PDB_model_num 1 _pdbx_struct_special_symmetry.auth_asym_id R _pdbx_struct_special_symmetry.auth_comp_id PO4 _pdbx_struct_special_symmetry.auth_seq_id 1 _pdbx_struct_special_symmetry.PDB_ins_code ? _pdbx_struct_special_symmetry.label_asym_id H _pdbx_struct_special_symmetry.label_comp_id PO4 _pdbx_struct_special_symmetry.label_seq_id . # 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 2008-02-12 2 'Structure model' 1 1 2011-07-13 3 'Structure model' 1 2 2017-10-25 4 'Structure model' 1 3 2018-01-24 # _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' 'Non-polymer description' 2 2 'Structure model' 'Version format compliance' 3 3 'Structure model' 'Refinement description' 4 4 'Structure model' 'Structure summary' # 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' audit_author # loop_ _pdbx_audit_revision_item.ordinal _pdbx_audit_revision_item.revision_ordinal _pdbx_audit_revision_item.data_content_type _pdbx_audit_revision_item.item 1 3 'Structure model' '_software.name' 2 4 'Structure model' '_audit_author.name' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal SERGUI 'data collection' ID22 ? 1 CNS refinement . ? 2 HKL-2000 'data reduction' . ? 3 HKL-2000 'data scaling' . ? 4 CNS phasing . ? 5 # 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 LYS L 61 ? ? -69.87 0.88 2 1 GLU R 61 ? ? -49.26 154.40 3 1 HIS R 114 ? ? 179.83 169.18 4 1 GLU R 192 ? ? 58.10 -163.24 # 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 L GLN 133 ? A GLN 134 2 1 Y 1 L MET 134 ? A MET 135 3 1 Y 1 L LEU 135 ? A LEU 136 4 1 Y 1 L PHE 136 ? A PHE 137 5 1 Y 1 L ARG 137 ? A ARG 138 6 1 Y 1 L GLY 138 ? A GLY 139 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 'PHOSPHATE ION' PO4 4 N-ACETYL-D-GLUCOSAMINE NAG 5 BETA-D-MANNOSE BMA 6 water HOH #