data_5FF6 # _entry.id 5FF6 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.288 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 5FF6 WWPDB D_1000216485 # loop_ _pdbx_database_related.content_type _pdbx_database_related.db_id _pdbx_database_related.db_name _pdbx_database_related.details unspecified 5ESQ PDB . unspecified 5ETU PDB . unspecified 5EUK PDB . unspecified 5F88 PDB . # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 5FF6 _pdbx_database_status.recvd_initial_deposition_date 2015-12-17 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _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 'Bzymek, K.P.' 1 'Williams, J.C.' 2 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country US _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev 'Acta Crystallogr F Struct Biol Commun' _citation.journal_id_ASTM ACSFEN _citation.journal_id_CSD ? _citation.journal_id_ISSN 2053-230X _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 72 _citation.language ? _citation.page_first 820 _citation.page_last 830 _citation.title 'Natural and non-natural amino-acid side-chain substitutions: affinity and diffraction studies of meditope-Fab complexes.' _citation.year 2016 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1107/S2053230X16016149 _citation.pdbx_database_id_PubMed 27834791 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Bzymek, K.P.' 1 primary 'Avery, K.A.' 2 primary 'Ma, Y.' 3 primary 'Horne, D.A.' 4 primary 'Williams, J.C.' 5 # _cell.angle_alpha 90.00 _cell.angle_alpha_esd ? _cell.angle_beta 90.00 _cell.angle_beta_esd ? _cell.angle_gamma 90.00 _cell.angle_gamma_esd ? _cell.entry_id 5FF6 _cell.details ? _cell.formula_units_Z ? _cell.length_a 64.080 _cell.length_a_esd ? _cell.length_b 83.050 _cell.length_b_esd ? _cell.length_c 212.670 _cell.length_c_esd ? _cell.volume ? _cell.volume_esd ? _cell.Z_PDB 8 _cell.reciprocal_angle_alpha ? _cell.reciprocal_angle_beta ? _cell.reciprocal_angle_gamma ? _cell.reciprocal_angle_alpha_esd ? _cell.reciprocal_angle_beta_esd ? _cell.reciprocal_angle_gamma_esd ? _cell.reciprocal_length_a ? _cell.reciprocal_length_b ? _cell.reciprocal_length_c ? _cell.reciprocal_length_a_esd ? _cell.reciprocal_length_b_esd ? _cell.reciprocal_length_c_esd ? _cell.pdbx_unique_axis ? # _symmetry.entry_id 5FF6 _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 _symmetry.space_group_name_Hall ? _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? # 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 'Cetuximab Fab light chain' 23287.705 2 ? ? ? ? 2 polymer man 'Cetuximab Fab heavy chain' 23725.504 2 ? ? ? ? 3 polymer syn 'L10Q meditope' 1487.727 2 ? ? ? ? 4 non-polymer syn 'PHOSPHATE ION' 94.971 8 ? ? ? ? 5 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 6 water nat water 18.015 532 ? ? ? ? # 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 ;DILLTQSPVILSVSPGERVSFSCRASQSIGTNIHWYQQRTNGSPRLLIKYASESISGIPSRFSGSGSGTDFTLSINSVES EDIADYYCQQNNNWPTTFGAGTKLELKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGA ; ;DILLTQSPVILSVSPGERVSFSCRASQSIGTNIHWYQQRTNGSPRLLIKYASESISGIPSRFSGSGSGTDFTLSINSVES EDIADYYCQQNNNWPTTFGAGTKLELKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQ ESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGA ; A,C ? 2 'polypeptide(L)' no no ;QVQLKQSGPGLVQPSQSLSITCTVSGFSLTNYGVHWVRQSPGKGLEWLGVIWSGGNTDYNTPFTSRLSINKDNSKSQVFF KMNSLQSNDTAIYYCARALTYYDYEFAYWGQGTLVTVSAASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSW NSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKS ; ;QVQLKQSGPGLVQPSQSLSITCTVSGFSLTNYGVHWVRQSPGKGLEWLGVIWSGGNTDYNTPFTSRLSINKDNSKSQVFF KMNSLQSNDTAIYYCARALTYYDYEFAYWGQGTLVTVSAASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSW NSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKS ; B,D ? 3 'polypeptide(L)' no no CQFDLSTRRQKC CQFDLSTRRQKC E,F ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 ASP n 1 2 ILE n 1 3 LEU n 1 4 LEU n 1 5 THR n 1 6 GLN n 1 7 SER n 1 8 PRO n 1 9 VAL n 1 10 ILE n 1 11 LEU n 1 12 SER n 1 13 VAL n 1 14 SER n 1 15 PRO n 1 16 GLY n 1 17 GLU n 1 18 ARG n 1 19 VAL n 1 20 SER n 1 21 PHE n 1 22 SER n 1 23 CYS n 1 24 ARG n 1 25 ALA n 1 26 SER n 1 27 GLN n 1 28 SER n 1 29 ILE n 1 30 GLY n 1 31 THR n 1 32 ASN n 1 33 ILE n 1 34 HIS n 1 35 TRP n 1 36 TYR n 1 37 GLN n 1 38 GLN n 1 39 ARG n 1 40 THR n 1 41 ASN n 1 42 GLY n 1 43 SER n 1 44 PRO n 1 45 ARG n 1 46 LEU n 1 47 LEU n 1 48 ILE n 1 49 LYS n 1 50 TYR n 1 51 ALA n 1 52 SER n 1 53 GLU n 1 54 SER n 1 55 ILE n 1 56 SER n 1 57 GLY n 1 58 ILE n 1 59 PRO n 1 60 SER n 1 61 ARG n 1 62 PHE n 1 63 SER n 1 64 GLY n 1 65 SER n 1 66 GLY n 1 67 SER n 1 68 GLY n 1 69 THR n 1 70 ASP n 1 71 PHE n 1 72 THR n 1 73 LEU n 1 74 SER n 1 75 ILE n 1 76 ASN n 1 77 SER n 1 78 VAL n 1 79 GLU n 1 80 SER n 1 81 GLU n 1 82 ASP n 1 83 ILE n 1 84 ALA n 1 85 ASP n 1 86 TYR n 1 87 TYR n 1 88 CYS n 1 89 GLN n 1 90 GLN n 1 91 ASN n 1 92 ASN n 1 93 ASN n 1 94 TRP n 1 95 PRO n 1 96 THR n 1 97 THR n 1 98 PHE n 1 99 GLY n 1 100 ALA n 1 101 GLY n 1 102 THR n 1 103 LYS n 1 104 LEU n 1 105 GLU n 1 106 LEU n 1 107 LYS n 1 108 ARG n 1 109 THR n 1 110 VAL n 1 111 ALA n 1 112 ALA n 1 113 PRO n 1 114 SER n 1 115 VAL n 1 116 PHE n 1 117 ILE n 1 118 PHE n 1 119 PRO n 1 120 PRO n 1 121 SER n 1 122 ASP n 1 123 GLU n 1 124 GLN n 1 125 LEU n 1 126 LYS n 1 127 SER n 1 128 GLY n 1 129 THR n 1 130 ALA n 1 131 SER n 1 132 VAL n 1 133 VAL n 1 134 CYS n 1 135 LEU n 1 136 LEU n 1 137 ASN n 1 138 ASN n 1 139 PHE n 1 140 TYR n 1 141 PRO n 1 142 ARG n 1 143 GLU n 1 144 ALA n 1 145 LYS n 1 146 VAL n 1 147 GLN n 1 148 TRP n 1 149 LYS n 1 150 VAL n 1 151 ASP n 1 152 ASN n 1 153 ALA n 1 154 LEU n 1 155 GLN n 1 156 SER n 1 157 GLY n 1 158 ASN n 1 159 SER n 1 160 GLN n 1 161 GLU n 1 162 SER n 1 163 VAL n 1 164 THR n 1 165 GLU n 1 166 GLN n 1 167 ASP n 1 168 SER n 1 169 LYS n 1 170 ASP n 1 171 SER n 1 172 THR n 1 173 TYR n 1 174 SER n 1 175 LEU n 1 176 SER n 1 177 SER n 1 178 THR n 1 179 LEU n 1 180 THR n 1 181 LEU n 1 182 SER n 1 183 LYS n 1 184 ALA n 1 185 ASP n 1 186 TYR n 1 187 GLU n 1 188 LYS n 1 189 HIS n 1 190 LYS n 1 191 VAL n 1 192 TYR n 1 193 ALA n 1 194 CYS n 1 195 GLU n 1 196 VAL n 1 197 THR n 1 198 HIS n 1 199 GLN n 1 200 GLY n 1 201 LEU n 1 202 SER n 1 203 SER n 1 204 PRO n 1 205 VAL n 1 206 THR n 1 207 LYS n 1 208 SER n 1 209 PHE n 1 210 ASN n 1 211 ARG n 1 212 GLY n 1 213 ALA n 2 1 GLN n 2 2 VAL n 2 3 GLN n 2 4 LEU n 2 5 LYS n 2 6 GLN n 2 7 SER n 2 8 GLY n 2 9 PRO n 2 10 GLY n 2 11 LEU n 2 12 VAL n 2 13 GLN n 2 14 PRO n 2 15 SER n 2 16 GLN n 2 17 SER n 2 18 LEU n 2 19 SER n 2 20 ILE n 2 21 THR n 2 22 CYS n 2 23 THR n 2 24 VAL n 2 25 SER n 2 26 GLY n 2 27 PHE n 2 28 SER n 2 29 LEU n 2 30 THR n 2 31 ASN n 2 32 TYR n 2 33 GLY n 2 34 VAL n 2 35 HIS n 2 36 TRP n 2 37 VAL n 2 38 ARG n 2 39 GLN n 2 40 SER n 2 41 PRO n 2 42 GLY n 2 43 LYS n 2 44 GLY n 2 45 LEU n 2 46 GLU n 2 47 TRP n 2 48 LEU n 2 49 GLY n 2 50 VAL n 2 51 ILE n 2 52 TRP n 2 53 SER n 2 54 GLY n 2 55 GLY n 2 56 ASN n 2 57 THR n 2 58 ASP n 2 59 TYR n 2 60 ASN n 2 61 THR n 2 62 PRO n 2 63 PHE n 2 64 THR n 2 65 SER n 2 66 ARG n 2 67 LEU n 2 68 SER n 2 69 ILE n 2 70 ASN n 2 71 LYS n 2 72 ASP n 2 73 ASN n 2 74 SER n 2 75 LYS n 2 76 SER n 2 77 GLN n 2 78 VAL n 2 79 PHE n 2 80 PHE n 2 81 LYS n 2 82 MET n 2 83 ASN n 2 84 SER n 2 85 LEU n 2 86 GLN n 2 87 SER n 2 88 ASN n 2 89 ASP n 2 90 THR n 2 91 ALA n 2 92 ILE n 2 93 TYR n 2 94 TYR n 2 95 CYS n 2 96 ALA n 2 97 ARG n 2 98 ALA n 2 99 LEU n 2 100 THR n 2 101 TYR n 2 102 TYR n 2 103 ASP n 2 104 TYR n 2 105 GLU n 2 106 PHE n 2 107 ALA n 2 108 TYR n 2 109 TRP n 2 110 GLY n 2 111 GLN n 2 112 GLY n 2 113 THR n 2 114 LEU n 2 115 VAL n 2 116 THR n 2 117 VAL n 2 118 SER n 2 119 ALA n 2 120 ALA n 2 121 SER n 2 122 THR n 2 123 LYS n 2 124 GLY n 2 125 PRO n 2 126 SER n 2 127 VAL n 2 128 PHE n 2 129 PRO n 2 130 LEU n 2 131 ALA n 2 132 PRO n 2 133 SER n 2 134 SER n 2 135 LYS n 2 136 SER n 2 137 THR n 2 138 SER n 2 139 GLY n 2 140 GLY n 2 141 THR n 2 142 ALA n 2 143 ALA n 2 144 LEU n 2 145 GLY n 2 146 CYS n 2 147 LEU n 2 148 VAL n 2 149 LYS n 2 150 ASP n 2 151 TYR n 2 152 PHE n 2 153 PRO n 2 154 GLU n 2 155 PRO n 2 156 VAL n 2 157 THR n 2 158 VAL n 2 159 SER n 2 160 TRP n 2 161 ASN n 2 162 SER n 2 163 GLY n 2 164 ALA n 2 165 LEU n 2 166 THR n 2 167 SER n 2 168 GLY n 2 169 VAL n 2 170 HIS n 2 171 THR n 2 172 PHE n 2 173 PRO n 2 174 ALA n 2 175 VAL n 2 176 LEU n 2 177 GLN n 2 178 SER n 2 179 SER n 2 180 GLY n 2 181 LEU n 2 182 TYR n 2 183 SER n 2 184 LEU n 2 185 SER n 2 186 SER n 2 187 VAL n 2 188 VAL n 2 189 THR n 2 190 VAL n 2 191 PRO n 2 192 SER n 2 193 SER n 2 194 SER n 2 195 LEU n 2 196 GLY n 2 197 THR n 2 198 GLN n 2 199 THR n 2 200 TYR n 2 201 ILE n 2 202 CYS n 2 203 ASN n 2 204 VAL n 2 205 ASN n 2 206 HIS n 2 207 LYS n 2 208 PRO n 2 209 SER n 2 210 ASN n 2 211 THR n 2 212 LYS n 2 213 VAL n 2 214 ASP n 2 215 LYS n 2 216 ARG n 2 217 VAL n 2 218 GLU n 2 219 PRO n 2 220 LYS n 2 221 SER n 3 1 CYS n 3 2 GLN n 3 3 PHE n 3 4 ASP n 3 5 LEU n 3 6 SER n 3 7 THR n 3 8 ARG n 3 9 ARG n 3 10 GLN n 3 11 LYS n 3 12 CYS 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 'Biological sequence' 1 213 'mouse, human' ? ? ? ? ? ? ? ? 'MUS MUSCULUS, HOMO SAPIENS' '10090, 9606' ? ? ? ? ? ? ? ? unidentified 32644 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 'commercially available' 2 1 sample 'Biological sequence' 1 220 'mouse, human' ? ? ? ? ? ? ? ? 'MUS MUSCULUS, HOMO SAPIENS' '10090, 9606' ? ? ? ? ? ? ? ? unidentified 32644 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 'commercially available' # _pdbx_entity_src_syn.entity_id 3 _pdbx_entity_src_syn.pdbx_src_id 1 _pdbx_entity_src_syn.pdbx_alt_source_flag sample _pdbx_entity_src_syn.pdbx_beg_seq_num 1 _pdbx_entity_src_syn.pdbx_end_seq_num 12 _pdbx_entity_src_syn.organism_scientific 'synthetic construct' _pdbx_entity_src_syn.organism_common_name ? _pdbx_entity_src_syn.ncbi_taxonomy_id 32630 _pdbx_entity_src_syn.details ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.pdbx_db_isoform _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin 1 PDB 5FF6 5FF6 ? 1 ? 1 2 PDB 5FF6 5FF6 ? 2 ? 1 3 PDB 5FF6 5FF6 ? 3 ? 1 # 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 5FF6 A 1 ? 213 ? 5FF6 1 ? 213 ? 1 213 2 2 5FF6 B 1 ? 220 ? 5FF6 1 ? 220 ? 1 220 3 1 5FF6 C 1 ? 213 ? 5FF6 1 ? 213 ? 1 213 4 2 5FF6 D 1 ? 220 ? 5FF6 1 ? 220 ? 1 220 5 3 5FF6 E 1 ? 12 ? 5FF6 1 ? 12 ? 1 12 6 3 5FF6 F 1 ? 12 ? 5FF6 1 ? 12 ? 1 12 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 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.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 5FF6 _exptl.crystals_number ? _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 2.90 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 57.66 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.id 1 _exptl_crystal.preparation ? _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.colour_lustre ? _exptl_crystal.colour_modifier ? _exptl_crystal.colour_primary ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_esd ? _exptl_crystal.density_meas_gt ? _exptl_crystal.density_meas_lt ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_meas_temp_esd ? _exptl_crystal.density_meas_temp_gt ? _exptl_crystal.density_meas_temp_lt ? _exptl_crystal.pdbx_crystal_image_url ? _exptl_crystal.pdbx_crystal_image_format ? _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? # _exptl_crystal_grow.apparatus ? _exptl_crystal_grow.atmosphere ? _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.details ? _exptl_crystal_grow.method 'VAPOR DIFFUSION' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH 5.5 _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details '0.1 M citric acid, 0.1 M sodium hydrogen phosphate, 0.4 M potassium hydrogen phosphate, 1.6 M sodium dihydrogen phosphate' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.ambient_environment ? _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.ambient_temp_esd ? _diffrn.crystal_id 1 _diffrn.crystal_support ? _diffrn.crystal_treatment ? _diffrn.details ? _diffrn.id 1 _diffrn.ambient_pressure ? _diffrn.ambient_pressure_esd ? _diffrn.ambient_pressure_gt ? _diffrn.ambient_pressure_lt ? _diffrn.ambient_temp_gt ? _diffrn.ambient_temp_lt ? # _diffrn_detector.details ? _diffrn_detector.detector 'IMAGE PLATE' _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'RIGAKU RAXIS IV++' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2011-10-19 # _diffrn_radiation.collimation ? _diffrn_radiation.diffrn_id 1 _diffrn_radiation.filter_edge ? _diffrn_radiation.inhomogeneity ? _diffrn_radiation.monochromator ? _diffrn_radiation.polarisn_norm ? _diffrn_radiation.polarisn_ratio ? _diffrn_radiation.probe ? _diffrn_radiation.type ? _diffrn_radiation.xray_symbol ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_wavelength_list ? _diffrn_radiation.pdbx_wavelength ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_analyzer ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.5418 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.current ? _diffrn_source.details ? _diffrn_source.diffrn_id 1 _diffrn_source.power ? _diffrn_source.size ? _diffrn_source.source 'ROTATING ANODE' _diffrn_source.target ? _diffrn_source.type 'RIGAKU MICROMAX-007 HF' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 1.5418 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline ? _diffrn_source.pdbx_synchrotron_site ? # _reflns.B_iso_Wilson_estimate ? _reflns.entry_id 5FF6 _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 2.50 _reflns.d_resolution_low 33.12 _reflns.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.number_all ? _reflns.number_obs 39902 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 99.3 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 4.8 _reflns.pdbx_Rmerge_I_obs 0.049 _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 23.5 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all ? _reflns.pdbx_Rpim_I_all ? _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half ? _reflns.pdbx_R_split ? # _reflns_shell.d_res_high 2.50 _reflns_shell.d_res_low 2.56 _reflns_shell.meanI_over_sigI_all ? _reflns_shell.meanI_over_sigI_obs 7.3 _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_possible ? _reflns_shell.number_unique_all ? _reflns_shell.number_unique_obs ? _reflns_shell.percent_possible_all 92.6 _reflns_shell.percent_possible_obs ? _reflns_shell.Rmerge_F_all ? _reflns_shell.Rmerge_F_obs ? _reflns_shell.Rmerge_I_all ? _reflns_shell.Rmerge_I_obs 0.185 _reflns_shell.meanI_over_sigI_gt ? _reflns_shell.meanI_over_uI_all ? _reflns_shell.meanI_over_uI_gt ? _reflns_shell.number_measured_gt ? _reflns_shell.number_unique_gt ? _reflns_shell.percent_possible_gt ? _reflns_shell.Rmerge_F_gt ? _reflns_shell.Rmerge_I_gt ? _reflns_shell.pdbx_redundancy 3.7 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_netI_over_sigmaI_all ? _reflns_shell.pdbx_netI_over_sigmaI_obs ? _reflns_shell.pdbx_Rrim_I_all ? _reflns_shell.pdbx_Rpim_I_all ? _reflns_shell.pdbx_rejects ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_CC_half ? _reflns_shell.pdbx_R_split ? # _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.B_iso_max ? _refine.B_iso_mean ? _refine.B_iso_min ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.details ? _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 5FF6 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 2.500 _refine.ls_d_res_low 32.726 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 39902 _refine.ls_number_reflns_R_free 1996 _refine.ls_number_reflns_R_work ? _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 99.36 _refine.ls_percent_reflns_R_free 5.00 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.1575 _refine.ls_R_factor_R_free 0.2005 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.1551 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 2.04 _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model 4gw1 _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_R_Free_selection_details ? _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_solvent_vdw_probe_radii 1.11 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.90 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error 17.93 _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B ? _refine.overall_SU_ML 0.25 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 6780 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 40 _refine_hist.number_atoms_solvent 532 _refine_hist.number_atoms_total 7352 _refine_hist.d_res_high 2.500 _refine_hist.d_res_low 32.726 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.criterion _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.rejects _refine_ls_restr.type _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' ? 0.008 ? 7023 ? f_bond_d ? ? 'X-RAY DIFFRACTION' ? 1.180 ? 9582 ? f_angle_d ? ? 'X-RAY DIFFRACTION' ? 11.706 ? 4184 ? f_dihedral_angle_d ? ? 'X-RAY DIFFRACTION' ? 0.078 ? 1080 ? f_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.004 ? 1222 ? f_plane_restr ? ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.R_factor_all _refine_ls_shell.R_factor_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.R_factor_R_work _refine_ls_shell.redundancy_reflns_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.wR_factor_all _refine_ls_shell.wR_factor_obs _refine_ls_shell.wR_factor_R_free _refine_ls_shell.wR_factor_R_work _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.pdbx_phase_error _refine_ls_shell.pdbx_fsc_work _refine_ls_shell.pdbx_fsc_free 'X-RAY DIFFRACTION' 2.5000 2.5625 . . 131 2483 92.00 . . . 0.2666 . 0.1941 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.5625 2.6318 . . 139 2645 100.00 . . . 0.2419 . 0.1742 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.6318 2.7092 . . 141 2683 100.00 . . . 0.2504 . 0.1794 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.7092 2.7966 . . 142 2696 100.00 . . . 0.2673 . 0.1812 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.7966 2.8965 . . 142 2695 100.00 . . . 0.2400 . 0.1780 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.8965 3.0124 . . 141 2688 100.00 . . . 0.2215 . 0.1703 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.0124 3.1494 . . 141 2683 100.00 . . . 0.2174 . 0.1632 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.1494 3.3152 . . 144 2723 100.00 . . . 0.1825 . 0.1669 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.3152 3.5227 . . 142 2700 100.00 . . . 0.2063 . 0.1504 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.5227 3.7944 . . 144 2736 100.00 . . . 0.2025 . 0.1449 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.7944 4.1755 . . 143 2710 100.00 . . . 0.1862 . 0.1338 . . . . . . . . . . 'X-RAY DIFFRACTION' 4.1755 4.7781 . . 145 2757 100.00 . . . 0.1437 . 0.1150 . . . . . . . . . . 'X-RAY DIFFRACTION' 4.7781 6.0138 . . 146 2790 100.00 . . . 0.1716 . 0.1366 . . . . . . . . . . 'X-RAY DIFFRACTION' 6.0138 32.7291 . . 155 2917 100.00 . . . 0.1830 . 0.1824 . . . . . . . . . . # _struct.entry_id 5FF6 _struct.title 'Cetuximab Fab in complex with L10Q meditope variant' _struct.pdbx_descriptor 'Cetuximab Fab light chain, Cetuximab Fab heavy chain, L10Q meditope' _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag ? # _struct_keywords.entry_id 5FF6 _struct_keywords.text 'antibody, anti-EGFR, immune system' _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 1 ? D N N 2 ? E N N 3 ? F N N 3 ? G N N 4 ? H N N 5 ? I N N 4 ? J N N 4 ? K N N 5 ? L N N 4 ? M N N 4 ? N N N 4 ? O N N 4 ? P N N 4 ? Q N N 6 ? R N N 6 ? S N N 6 ? T N N 6 ? U N N 6 ? V N N 6 ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 AA1 GLU A 79 ? ILE A 83 ? GLU A 79 ILE A 83 5 ? 5 HELX_P HELX_P2 AA2 SER A 121 ? LYS A 126 ? SER A 121 LYS A 126 1 ? 6 HELX_P HELX_P3 AA3 LYS A 183 ? LYS A 188 ? LYS A 183 LYS A 188 1 ? 6 HELX_P HELX_P4 AA4 THR B 61 ? THR B 64 ? THR B 61 THR B 64 5 ? 4 HELX_P HELX_P5 AA5 GLN B 86 ? THR B 90 ? GLN B 86 THR B 90 5 ? 5 HELX_P HELX_P6 AA6 SER B 162 ? ALA B 164 ? SER B 162 ALA B 164 5 ? 3 HELX_P HELX_P7 AA7 SER B 193 ? LEU B 195 ? SER B 193 LEU B 195 5 ? 3 HELX_P HELX_P8 AA8 LYS B 207 ? ASN B 210 ? LYS B 207 ASN B 210 5 ? 4 HELX_P HELX_P9 AA9 GLU C 79 ? ILE C 83 ? GLU C 79 ILE C 83 5 ? 5 HELX_P HELX_P10 AB1 SER C 121 ? LYS C 126 ? SER C 121 LYS C 126 1 ? 6 HELX_P HELX_P11 AB2 LYS C 183 ? LYS C 188 ? LYS C 183 LYS C 188 1 ? 6 HELX_P HELX_P12 AB3 THR D 61 ? THR D 64 ? THR D 61 THR D 64 5 ? 4 HELX_P HELX_P13 AB4 GLN D 86 ? THR D 90 ? GLN D 86 THR D 90 5 ? 5 HELX_P HELX_P14 AB5 SER D 162 ? ALA D 164 ? SER D 162 ALA D 164 5 ? 3 HELX_P HELX_P15 AB6 SER D 193 ? LEU D 195 ? SER D 193 LEU D 195 5 ? 3 HELX_P HELX_P16 AB7 LYS D 207 ? ASN D 210 ? LYS D 207 ASN D 210 5 ? 4 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 23 SG ? ? ? 1_555 A CYS 88 SG ? ? A CYS 23 A CYS 88 1_555 ? ? ? ? ? ? ? 2.056 ? disulf2 disulf ? ? A CYS 134 SG ? ? ? 1_555 A CYS 194 SG ? ? A CYS 134 A CYS 194 1_555 ? ? ? ? ? ? ? 2.028 ? disulf3 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 95 SG ? ? B CYS 22 B CYS 95 1_555 ? ? ? ? ? ? ? 2.050 ? disulf4 disulf ? ? B CYS 146 SG ? ? ? 1_555 B CYS 202 SG ? ? B CYS 146 B CYS 202 1_555 ? ? ? ? ? ? ? 2.005 ? disulf5 disulf ? ? C CYS 23 SG ? ? ? 1_555 C CYS 88 SG ? ? C CYS 23 C CYS 88 1_555 ? ? ? ? ? ? ? 2.046 ? disulf6 disulf ? ? C CYS 134 SG ? ? ? 1_555 C CYS 194 SG ? ? C CYS 134 C CYS 194 1_555 ? ? ? ? ? ? ? 2.020 ? disulf7 disulf ? ? D CYS 22 SG ? ? ? 1_555 D CYS 95 SG ? ? D CYS 22 D CYS 95 1_555 ? ? ? ? ? ? ? 2.062 ? disulf8 disulf ? ? D CYS 146 SG ? ? ? 1_555 D CYS 202 SG ? ? D CYS 146 D CYS 202 1_555 ? ? ? ? ? ? ? 2.034 ? disulf9 disulf ? ? E CYS 1 SG ? ? ? 1_555 E CYS 12 SG ? ? E CYS 1 E CYS 12 1_555 ? ? ? ? ? ? ? 2.038 ? disulf10 disulf ? ? F CYS 1 SG ? ? ? 1_555 F CYS 12 SG ? ? F CYS 1 F CYS 12 1_555 ? ? ? ? ? ? ? 2.040 ? covale1 covale one ? B ASN 88 ND2 ? ? ? 1_555 H NAG . C1 ? ? B ASN 88 B NAG 301 1_555 ? ? ? ? ? ? ? 1.425 ? covale2 covale one ? D ASN 88 ND2 ? ? ? 1_555 K NAG . C1 ? ? D ASN 88 D NAG 301 1_555 ? ? ? ? ? ? ? 1.421 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 SER 7 A . ? SER 7 A PRO 8 A ? PRO 8 A 1 -8.54 2 TRP 94 A . ? TRP 94 A PRO 95 A ? PRO 95 A 1 -0.11 3 TYR 140 A . ? TYR 140 A PRO 141 A ? PRO 141 A 1 7.21 4 PHE 152 B . ? PHE 152 B PRO 153 B ? PRO 153 B 1 -1.79 5 GLU 154 B . ? GLU 154 B PRO 155 B ? PRO 155 B 1 3.24 6 SER 7 C . ? SER 7 C PRO 8 C ? PRO 8 C 1 -2.40 7 TRP 94 C . ? TRP 94 C PRO 95 C ? PRO 95 C 1 -2.21 8 TYR 140 C . ? TYR 140 C PRO 141 C ? PRO 141 C 1 -0.23 9 PHE 152 D . ? PHE 152 D PRO 153 D ? PRO 153 D 1 -5.93 10 GLU 154 D . ? GLU 154 D PRO 155 D ? PRO 155 D 1 -3.05 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 4 ? AA2 ? 6 ? AA3 ? 4 ? AA4 ? 4 ? AA5 ? 4 ? AA6 ? 4 ? AA7 ? 6 ? AA8 ? 4 ? AA9 ? 4 ? AB1 ? 4 ? AB2 ? 3 ? AB3 ? 4 ? AB4 ? 6 ? AB5 ? 4 ? AB6 ? 4 ? AB7 ? 4 ? AB8 ? 4 ? AB9 ? 6 ? AC1 ? 4 ? AC2 ? 4 ? AC3 ? 4 ? AC4 ? 3 ? AC5 ? 2 ? AC6 ? 2 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense AA1 1 2 ? anti-parallel AA1 2 3 ? anti-parallel AA1 3 4 ? anti-parallel AA2 1 2 ? parallel AA2 2 3 ? anti-parallel AA2 3 4 ? anti-parallel AA2 4 5 ? anti-parallel AA2 5 6 ? anti-parallel AA3 1 2 ? parallel AA3 2 3 ? anti-parallel AA3 3 4 ? anti-parallel AA4 1 2 ? anti-parallel AA4 2 3 ? anti-parallel AA4 3 4 ? anti-parallel AA5 1 2 ? anti-parallel AA5 2 3 ? anti-parallel AA5 3 4 ? anti-parallel AA6 1 2 ? anti-parallel AA6 2 3 ? anti-parallel AA6 3 4 ? anti-parallel AA7 1 2 ? parallel AA7 2 3 ? anti-parallel AA7 3 4 ? anti-parallel AA7 4 5 ? anti-parallel AA7 5 6 ? anti-parallel AA8 1 2 ? parallel AA8 2 3 ? anti-parallel AA8 3 4 ? anti-parallel AA9 1 2 ? anti-parallel AA9 2 3 ? anti-parallel AA9 3 4 ? anti-parallel AB1 1 2 ? anti-parallel AB1 2 3 ? anti-parallel AB1 3 4 ? anti-parallel AB2 1 2 ? anti-parallel AB2 2 3 ? anti-parallel AB3 1 2 ? anti-parallel AB3 2 3 ? anti-parallel AB3 3 4 ? anti-parallel AB4 1 2 ? parallel AB4 2 3 ? anti-parallel AB4 3 4 ? anti-parallel AB4 4 5 ? anti-parallel AB4 5 6 ? anti-parallel AB5 1 2 ? parallel AB5 2 3 ? anti-parallel AB5 3 4 ? anti-parallel AB6 1 2 ? anti-parallel AB6 2 3 ? anti-parallel AB6 3 4 ? anti-parallel AB7 1 2 ? anti-parallel AB7 2 3 ? anti-parallel AB7 3 4 ? anti-parallel AB8 1 2 ? anti-parallel AB8 2 3 ? anti-parallel AB8 3 4 ? anti-parallel AB9 1 2 ? parallel AB9 2 3 ? anti-parallel AB9 3 4 ? anti-parallel AB9 4 5 ? anti-parallel AB9 5 6 ? anti-parallel AC1 1 2 ? parallel AC1 2 3 ? anti-parallel AC1 3 4 ? anti-parallel AC2 1 2 ? anti-parallel AC2 2 3 ? anti-parallel AC2 3 4 ? anti-parallel AC3 1 2 ? anti-parallel AC3 2 3 ? anti-parallel AC3 3 4 ? anti-parallel AC4 1 2 ? anti-parallel AC4 2 3 ? anti-parallel AC5 1 2 ? anti-parallel AC6 1 2 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id AA1 1 LEU A 4 ? SER A 7 ? LEU A 4 SER A 7 AA1 2 VAL A 19 ? ALA A 25 ? VAL A 19 ALA A 25 AA1 3 ASP A 70 ? ILE A 75 ? ASP A 70 ILE A 75 AA1 4 PHE A 62 ? SER A 67 ? PHE A 62 SER A 67 AA2 1 ILE A 10 ? VAL A 13 ? ILE A 10 VAL A 13 AA2 2 THR A 102 ? LEU A 106 ? THR A 102 LEU A 106 AA2 3 ALA A 84 ? GLN A 90 ? ALA A 84 GLN A 90 AA2 4 ILE A 33 ? GLN A 38 ? ILE A 33 GLN A 38 AA2 5 ARG A 45 ? LYS A 49 ? ARG A 45 LYS A 49 AA2 6 GLU A 53 ? SER A 54 ? GLU A 53 SER A 54 AA3 1 ILE A 10 ? VAL A 13 ? ILE A 10 VAL A 13 AA3 2 THR A 102 ? LEU A 106 ? THR A 102 LEU A 106 AA3 3 ALA A 84 ? GLN A 90 ? ALA A 84 GLN A 90 AA3 4 THR A 97 ? PHE A 98 ? THR A 97 PHE A 98 AA4 1 SER A 114 ? PHE A 118 ? SER A 114 PHE A 118 AA4 2 THR A 129 ? PHE A 139 ? THR A 129 PHE A 139 AA4 3 TYR A 173 ? SER A 182 ? TYR A 173 SER A 182 AA4 4 SER A 159 ? VAL A 163 ? SER A 159 VAL A 163 AA5 1 ALA A 153 ? LEU A 154 ? ALA A 153 LEU A 154 AA5 2 LYS A 145 ? VAL A 150 ? LYS A 145 VAL A 150 AA5 3 VAL A 191 ? THR A 197 ? VAL A 191 THR A 197 AA5 4 VAL A 205 ? ASN A 210 ? VAL A 205 ASN A 210 AA6 1 GLN B 3 ? GLN B 6 ? GLN B 3 GLN B 6 AA6 2 LEU B 18 ? SER B 25 ? LEU B 18 SER B 25 AA6 3 GLN B 77 ? MET B 82 ? GLN B 77 MET B 82 AA6 4 LEU B 67 ? ASP B 72 ? LEU B 67 ASP B 72 AA7 1 GLY B 10 ? VAL B 12 ? GLY B 10 VAL B 12 AA7 2 THR B 113 ? VAL B 117 ? THR B 113 VAL B 117 AA7 3 ALA B 91 ? ALA B 98 ? ALA B 91 ALA B 98 AA7 4 VAL B 34 ? SER B 40 ? VAL B 34 SER B 40 AA7 5 GLY B 44 ? ILE B 51 ? GLY B 44 ILE B 51 AA7 6 THR B 57 ? TYR B 59 ? THR B 57 TYR B 59 AA8 1 GLY B 10 ? VAL B 12 ? GLY B 10 VAL B 12 AA8 2 THR B 113 ? VAL B 117 ? THR B 113 VAL B 117 AA8 3 ALA B 91 ? ALA B 98 ? ALA B 91 ALA B 98 AA8 4 PHE B 106 ? TRP B 109 ? PHE B 106 TRP B 109 AA9 1 SER B 126 ? LEU B 130 ? SER B 126 LEU B 130 AA9 2 THR B 141 ? TYR B 151 ? THR B 141 TYR B 151 AA9 3 TYR B 182 ? PRO B 191 ? TYR B 182 PRO B 191 AA9 4 VAL B 169 ? THR B 171 ? VAL B 169 THR B 171 AB1 1 THR B 137 ? SER B 138 ? THR B 137 SER B 138 AB1 2 THR B 141 ? TYR B 151 ? THR B 141 TYR B 151 AB1 3 TYR B 182 ? PRO B 191 ? TYR B 182 PRO B 191 AB1 4 VAL B 175 ? LEU B 176 ? VAL B 175 LEU B 176 AB2 1 THR B 157 ? TRP B 160 ? THR B 157 TRP B 160 AB2 2 ILE B 201 ? HIS B 206 ? ILE B 201 HIS B 206 AB2 3 THR B 211 ? ARG B 216 ? THR B 211 ARG B 216 AB3 1 LEU C 4 ? SER C 7 ? LEU C 4 SER C 7 AB3 2 VAL C 19 ? ALA C 25 ? VAL C 19 ALA C 25 AB3 3 ASP C 70 ? ILE C 75 ? ASP C 70 ILE C 75 AB3 4 PHE C 62 ? SER C 67 ? PHE C 62 SER C 67 AB4 1 ILE C 10 ? VAL C 13 ? ILE C 10 VAL C 13 AB4 2 THR C 102 ? LEU C 106 ? THR C 102 LEU C 106 AB4 3 ASP C 85 ? GLN C 90 ? ASP C 85 GLN C 90 AB4 4 ILE C 33 ? GLN C 38 ? ILE C 33 GLN C 38 AB4 5 ARG C 45 ? LYS C 49 ? ARG C 45 LYS C 49 AB4 6 GLU C 53 ? SER C 54 ? GLU C 53 SER C 54 AB5 1 ILE C 10 ? VAL C 13 ? ILE C 10 VAL C 13 AB5 2 THR C 102 ? LEU C 106 ? THR C 102 LEU C 106 AB5 3 ASP C 85 ? GLN C 90 ? ASP C 85 GLN C 90 AB5 4 THR C 97 ? PHE C 98 ? THR C 97 PHE C 98 AB6 1 SER C 114 ? PHE C 118 ? SER C 114 PHE C 118 AB6 2 THR C 129 ? PHE C 139 ? THR C 129 PHE C 139 AB6 3 TYR C 173 ? SER C 182 ? TYR C 173 SER C 182 AB6 4 SER C 159 ? VAL C 163 ? SER C 159 VAL C 163 AB7 1 ALA C 153 ? LEU C 154 ? ALA C 153 LEU C 154 AB7 2 LYS C 145 ? VAL C 150 ? LYS C 145 VAL C 150 AB7 3 VAL C 191 ? THR C 197 ? VAL C 191 THR C 197 AB7 4 VAL C 205 ? ASN C 210 ? VAL C 205 ASN C 210 AB8 1 GLN D 3 ? GLN D 6 ? GLN D 3 GLN D 6 AB8 2 LEU D 18 ? SER D 25 ? LEU D 18 SER D 25 AB8 3 GLN D 77 ? MET D 82 ? GLN D 77 MET D 82 AB8 4 LEU D 67 ? ASP D 72 ? LEU D 67 ASP D 72 AB9 1 GLY D 10 ? VAL D 12 ? GLY D 10 VAL D 12 AB9 2 THR D 113 ? VAL D 117 ? THR D 113 VAL D 117 AB9 3 ALA D 91 ? ALA D 98 ? ALA D 91 ALA D 98 AB9 4 VAL D 34 ? SER D 40 ? VAL D 34 SER D 40 AB9 5 GLY D 44 ? ILE D 51 ? GLY D 44 ILE D 51 AB9 6 THR D 57 ? TYR D 59 ? THR D 57 TYR D 59 AC1 1 GLY D 10 ? VAL D 12 ? GLY D 10 VAL D 12 AC1 2 THR D 113 ? VAL D 117 ? THR D 113 VAL D 117 AC1 3 ALA D 91 ? ALA D 98 ? ALA D 91 ALA D 98 AC1 4 PHE D 106 ? TRP D 109 ? PHE D 106 TRP D 109 AC2 1 SER D 126 ? LEU D 130 ? SER D 126 LEU D 130 AC2 2 THR D 141 ? TYR D 151 ? THR D 141 TYR D 151 AC2 3 TYR D 182 ? PRO D 191 ? TYR D 182 PRO D 191 AC2 4 VAL D 169 ? THR D 171 ? VAL D 169 THR D 171 AC3 1 SER D 126 ? LEU D 130 ? SER D 126 LEU D 130 AC3 2 THR D 141 ? TYR D 151 ? THR D 141 TYR D 151 AC3 3 TYR D 182 ? PRO D 191 ? TYR D 182 PRO D 191 AC3 4 VAL D 175 ? LEU D 176 ? VAL D 175 LEU D 176 AC4 1 THR D 157 ? TRP D 160 ? THR D 157 TRP D 160 AC4 2 ILE D 201 ? HIS D 206 ? ILE D 201 HIS D 206 AC4 3 THR D 211 ? ARG D 216 ? THR D 211 ARG D 216 AC5 1 GLN E 2 ? ASP E 4 ? GLN E 2 ASP E 4 AC5 2 ARG E 9 ? LYS E 11 ? ARG E 9 LYS E 11 AC6 1 GLN F 2 ? ASP F 4 ? GLN F 2 ASP F 4 AC6 2 ARG F 9 ? LYS F 11 ? ARG F 9 LYS F 11 # 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 AA1 1 2 N THR A 5 ? N THR A 5 O ARG A 24 ? O ARG A 24 AA1 2 3 N PHE A 21 ? N PHE A 21 O LEU A 73 ? O LEU A 73 AA1 3 4 O SER A 74 ? O SER A 74 N SER A 63 ? N SER A 63 AA2 1 2 N LEU A 11 ? N LEU A 11 O LYS A 103 ? O LYS A 103 AA2 2 3 O LEU A 104 ? O LEU A 104 N ALA A 84 ? N ALA A 84 AA2 3 4 O TYR A 87 ? O TYR A 87 N TYR A 36 ? N TYR A 36 AA2 4 5 N TRP A 35 ? N TRP A 35 O LEU A 47 ? O LEU A 47 AA2 5 6 N LYS A 49 ? N LYS A 49 O GLU A 53 ? O GLU A 53 AA3 1 2 N LEU A 11 ? N LEU A 11 O LYS A 103 ? O LYS A 103 AA3 2 3 O LEU A 104 ? O LEU A 104 N ALA A 84 ? N ALA A 84 AA3 3 4 N GLN A 90 ? N GLN A 90 O THR A 97 ? O THR A 97 AA4 1 2 N SER A 114 ? N SER A 114 O ASN A 137 ? O ASN A 137 AA4 2 3 N VAL A 132 ? N VAL A 132 O LEU A 179 ? O LEU A 179 AA4 3 4 O SER A 176 ? O SER A 176 N SER A 162 ? N SER A 162 AA5 1 2 O ALA A 153 ? O ALA A 153 N VAL A 150 ? N VAL A 150 AA5 2 3 N GLN A 147 ? N GLN A 147 O GLU A 195 ? O GLU A 195 AA5 3 4 N CYS A 194 ? N CYS A 194 O LYS A 207 ? O LYS A 207 AA6 1 2 N LYS B 5 ? N LYS B 5 O THR B 23 ? O THR B 23 AA6 2 3 N CYS B 22 ? N CYS B 22 O VAL B 78 ? O VAL B 78 AA6 3 4 O PHE B 79 ? O PHE B 79 N ASN B 70 ? N ASN B 70 AA7 1 2 N VAL B 12 ? N VAL B 12 O THR B 116 ? O THR B 116 AA7 2 3 O VAL B 115 ? O VAL B 115 N ALA B 91 ? N ALA B 91 AA7 3 4 O ALA B 96 ? O ALA B 96 N HIS B 35 ? N HIS B 35 AA7 4 5 N TRP B 36 ? N TRP B 36 O LEU B 48 ? O LEU B 48 AA7 5 6 N VAL B 50 ? N VAL B 50 O ASP B 58 ? O ASP B 58 AA8 1 2 N VAL B 12 ? N VAL B 12 O THR B 116 ? O THR B 116 AA8 2 3 O VAL B 115 ? O VAL B 115 N ALA B 91 ? N ALA B 91 AA8 3 4 N ARG B 97 ? N ARG B 97 O TYR B 108 ? O TYR B 108 AA9 1 2 N PHE B 128 ? N PHE B 128 O LEU B 147 ? O LEU B 147 AA9 2 3 N VAL B 148 ? N VAL B 148 O LEU B 184 ? O LEU B 184 AA9 3 4 O VAL B 187 ? O VAL B 187 N HIS B 170 ? N HIS B 170 AB1 1 2 N SER B 138 ? N SER B 138 O THR B 141 ? O THR B 141 AB1 2 3 N VAL B 148 ? N VAL B 148 O LEU B 184 ? O LEU B 184 AB1 3 4 O SER B 183 ? O SER B 183 N VAL B 175 ? N VAL B 175 AB2 1 2 N SER B 159 ? N SER B 159 O ASN B 203 ? O ASN B 203 AB2 2 3 N VAL B 204 ? N VAL B 204 O VAL B 213 ? O VAL B 213 AB3 1 2 N THR C 5 ? N THR C 5 O ARG C 24 ? O ARG C 24 AB3 2 3 N VAL C 19 ? N VAL C 19 O ILE C 75 ? O ILE C 75 AB3 3 4 O SER C 74 ? O SER C 74 N SER C 63 ? N SER C 63 AB4 1 2 N LEU C 11 ? N LEU C 11 O LYS C 103 ? O LYS C 103 AB4 2 3 O THR C 102 ? O THR C 102 N TYR C 86 ? N TYR C 86 AB4 3 4 O GLN C 89 ? O GLN C 89 N HIS C 34 ? N HIS C 34 AB4 4 5 N TRP C 35 ? N TRP C 35 O LEU C 47 ? O LEU C 47 AB4 5 6 N LYS C 49 ? N LYS C 49 O GLU C 53 ? O GLU C 53 AB5 1 2 N LEU C 11 ? N LEU C 11 O LYS C 103 ? O LYS C 103 AB5 2 3 O THR C 102 ? O THR C 102 N TYR C 86 ? N TYR C 86 AB5 3 4 N GLN C 90 ? N GLN C 90 O THR C 97 ? O THR C 97 AB6 1 2 N PHE C 116 ? N PHE C 116 O LEU C 135 ? O LEU C 135 AB6 2 3 N VAL C 132 ? N VAL C 132 O LEU C 179 ? O LEU C 179 AB6 3 4 O THR C 178 ? O THR C 178 N GLN C 160 ? N GLN C 160 AB7 1 2 O ALA C 153 ? O ALA C 153 N VAL C 150 ? N VAL C 150 AB7 2 3 N GLN C 147 ? N GLN C 147 O GLU C 195 ? O GLU C 195 AB7 3 4 N CYS C 194 ? N CYS C 194 O LYS C 207 ? O LYS C 207 AB8 1 2 N LYS D 5 ? N LYS D 5 O THR D 23 ? O THR D 23 AB8 2 3 N CYS D 22 ? N CYS D 22 O VAL D 78 ? O VAL D 78 AB8 3 4 O PHE D 79 ? O PHE D 79 N ASN D 70 ? N ASN D 70 AB9 1 2 N VAL D 12 ? N VAL D 12 O THR D 116 ? O THR D 116 AB9 2 3 O VAL D 115 ? O VAL D 115 N ALA D 91 ? N ALA D 91 AB9 3 4 O TYR D 94 ? O TYR D 94 N VAL D 37 ? N VAL D 37 AB9 4 5 N TRP D 36 ? N TRP D 36 O LEU D 48 ? O LEU D 48 AB9 5 6 N VAL D 50 ? N VAL D 50 O ASP D 58 ? O ASP D 58 AC1 1 2 N VAL D 12 ? N VAL D 12 O THR D 116 ? O THR D 116 AC1 2 3 O VAL D 115 ? O VAL D 115 N ALA D 91 ? N ALA D 91 AC1 3 4 N ARG D 97 ? N ARG D 97 O TYR D 108 ? O TYR D 108 AC2 1 2 N LEU D 130 ? N LEU D 130 O GLY D 145 ? O GLY D 145 AC2 2 3 N VAL D 148 ? N VAL D 148 O LEU D 184 ? O LEU D 184 AC2 3 4 O VAL D 187 ? O VAL D 187 N HIS D 170 ? N HIS D 170 AC3 1 2 N LEU D 130 ? N LEU D 130 O GLY D 145 ? O GLY D 145 AC3 2 3 N VAL D 148 ? N VAL D 148 O LEU D 184 ? O LEU D 184 AC3 3 4 O SER D 183 ? O SER D 183 N VAL D 175 ? N VAL D 175 AC4 1 2 N SER D 159 ? N SER D 159 O ASN D 203 ? O ASN D 203 AC4 2 3 N VAL D 204 ? N VAL D 204 O VAL D 213 ? O VAL D 213 AC5 1 2 N GLN E 2 ? N GLN E 2 O LYS E 11 ? O LYS E 11 AC6 1 2 N GLN F 2 ? N GLN F 2 O LYS F 11 ? O LYS F 11 # 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 A PO4 301 ? 7 'binding site for residue PO4 A 301' AC2 Software B PO4 302 ? 8 'binding site for residue PO4 B 302' AC3 Software C PO4 301 ? 3 'binding site for residue PO4 C 301' AC4 Software D PO4 302 ? 8 'binding site for residue PO4 D 302' AC5 Software D PO4 303 ? 4 'binding site for residue PO4 D 303' AC6 Software D PO4 304 ? 8 'binding site for residue PO4 D 304' AC7 Software D PO4 305 ? 5 'binding site for residue PO4 D 305' AC8 Software D PO4 306 ? 3 'binding site for residue PO4 D 306' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 7 ARG A 39 ? ARG A 39 . ? 1_555 ? 2 AC1 7 ARG A 45 ? ARG A 45 . ? 1_555 ? 3 AC1 7 PRO A 59 ? PRO A 59 . ? 1_555 ? 4 AC1 7 ARG A 61 ? ARG A 61 . ? 1_555 ? 5 AC1 7 GLU A 81 ? GLU A 81 . ? 1_555 ? 6 AC1 7 HOH Q . ? HOH A 409 . ? 1_555 ? 7 AC1 7 HOH Q . ? HOH A 453 . ? 1_555 ? 8 AC2 8 GLU A 165 ? GLU A 165 . ? 1_555 ? 9 AC2 8 ASP A 167 ? ASP A 167 . ? 1_555 ? 10 AC2 8 HOH Q . ? HOH A 426 . ? 1_555 ? 11 AC2 8 VAL B 169 ? VAL B 169 . ? 1_555 ? 12 AC2 8 HIS B 170 ? HIS B 170 . ? 1_555 ? 13 AC2 8 HOH R . ? HOH B 401 . ? 1_555 ? 14 AC2 8 HOH R . ? HOH B 402 . ? 1_555 ? 15 AC2 8 HOH R . ? HOH B 455 . ? 1_555 ? 16 AC3 3 SER C 156 ? SER C 156 . ? 1_555 ? 17 AC3 3 HOH S . ? HOH C 403 . ? 1_555 ? 18 AC3 3 HOH S . ? HOH C 459 . ? 1_555 ? 19 AC4 8 GLU C 165 ? GLU C 165 . ? 1_555 ? 20 AC4 8 ASP C 167 ? ASP C 167 . ? 1_555 ? 21 AC4 8 HOH S . ? HOH C 421 . ? 1_555 ? 22 AC4 8 VAL D 169 ? VAL D 169 . ? 1_555 ? 23 AC4 8 HIS D 170 ? HIS D 170 . ? 1_555 ? 24 AC4 8 HOH T . ? HOH D 406 . ? 1_555 ? 25 AC4 8 HOH T . ? HOH D 419 . ? 1_555 ? 26 AC4 8 HOH T . ? HOH D 420 . ? 1_555 ? 27 AC5 4 SER D 126 ? SER D 126 . ? 1_555 ? 28 AC5 4 VAL D 127 ? VAL D 127 . ? 1_555 ? 29 AC5 4 HOH T . ? HOH D 412 . ? 1_555 ? 30 AC5 4 HOH T . ? HOH D 446 . ? 1_555 ? 31 AC6 8 PHE C 98 ? PHE C 98 . ? 1_555 ? 32 AC6 8 GLY C 99 ? GLY C 99 . ? 1_555 ? 33 AC6 8 ALA C 100 ? ALA C 100 . ? 1_555 ? 34 AC6 8 HOH S . ? HOH C 436 . ? 1_555 ? 35 AC6 8 LYS D 43 ? LYS D 43 . ? 1_555 ? 36 AC6 8 GLY D 44 ? GLY D 44 . ? 1_555 ? 37 AC6 8 LEU D 45 ? LEU D 45 . ? 1_555 ? 38 AC6 8 HOH T . ? HOH D 411 . ? 1_555 ? 39 AC7 5 GLY D 8 ? GLY D 8 . ? 1_555 ? 40 AC7 5 GLY D 10 ? GLY D 10 . ? 1_555 ? 41 AC7 5 LEU D 11 ? LEU D 11 . ? 1_555 ? 42 AC7 5 SER D 19 ? SER D 19 . ? 1_555 ? 43 AC7 5 HOH T . ? HOH D 405 . ? 1_555 ? 44 AC8 3 ASN D 205 ? ASN D 205 . ? 1_555 ? 45 AC8 3 ASN D 210 ? ASN D 210 . ? 1_555 ? 46 AC8 3 LYS D 212 ? LYS D 212 . ? 1_555 ? # _atom_sites.entry_id 5FF6 _atom_sites.fract_transf_matrix[1][1] 0.015605 _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] 0.012041 _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] 0.004702 _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 . ASP A 1 1 ? 14.305 -42.304 -8.914 1.00 35.97 ? 1 ASP A N 1 ATOM 2 C CA . ASP A 1 1 ? 15.473 -41.466 -9.154 1.00 34.67 ? 1 ASP A CA 1 ATOM 3 C C . ASP A 1 1 ? 15.042 -40.020 -9.347 1.00 34.23 ? 1 ASP A C 1 ATOM 4 O O . ASP A 1 1 ? 13.912 -39.767 -9.741 1.00 37.78 ? 1 ASP A O 1 ATOM 5 C CB . ASP A 1 1 ? 16.229 -41.922 -10.406 1.00 35.70 ? 1 ASP A CB 1 ATOM 6 C CG . ASP A 1 1 ? 16.645 -43.379 -10.354 1.00 41.26 ? 1 ASP A CG 1 ATOM 7 O OD1 . ASP A 1 1 ? 16.586 -44.009 -9.265 1.00 43.78 ? 1 ASP A OD1 1 ATOM 8 O OD2 . ASP A 1 1 ? 17.055 -43.883 -11.423 1.00 41.10 ? 1 ASP A OD2 1 ATOM 9 N N . ILE A 1 2 ? 15.947 -39.077 -9.089 1.00 32.74 ? 2 ILE A N 1 ATOM 10 C CA . ILE A 1 2 ? 15.654 -37.656 -9.287 1.00 30.75 ? 2 ILE A CA 1 ATOM 11 C C . ILE A 1 2 ? 15.571 -37.299 -10.766 1.00 28.77 ? 2 ILE A C 1 ATOM 12 O O . ILE A 1 2 ? 16.484 -37.591 -11.540 1.00 21.13 ? 2 ILE A O 1 ATOM 13 C CB . ILE A 1 2 ? 16.732 -36.747 -8.645 1.00 28.26 ? 2 ILE A CB 1 ATOM 14 C CG1 . ILE A 1 2 ? 16.939 -37.109 -7.179 1.00 25.44 ? 2 ILE A CG1 1 ATOM 15 C CG2 . ILE A 1 2 ? 16.329 -35.285 -8.755 1.00 19.66 ? 2 ILE A CG2 1 ATOM 16 C CD1 . ILE A 1 2 ? 15.757 -36.780 -6.348 1.00 23.50 ? 2 ILE A CD1 1 ATOM 17 N N . LEU A 1 3 ? 14.476 -36.658 -11.154 1.00 29.56 ? 3 LEU A N 1 ATOM 18 C CA . LEU A 1 3 ? 14.341 -36.154 -12.513 1.00 27.75 ? 3 LEU A CA 1 ATOM 19 C C . LEU A 1 3 ? 14.822 -34.709 -12.587 1.00 29.46 ? 3 LEU A C 1 ATOM 20 O O . LEU A 1 3 ? 14.321 -33.830 -11.863 1.00 25.11 ? 3 LEU A O 1 ATOM 21 C CB . LEU A 1 3 ? 12.892 -36.255 -12.994 1.00 30.26 ? 3 LEU A CB 1 ATOM 22 C CG . LEU A 1 3 ? 12.598 -35.586 -14.343 1.00 37.12 ? 3 LEU A CG 1 ATOM 23 C CD1 . LEU A 1 3 ? 13.371 -36.269 -15.471 1.00 33.68 ? 3 LEU A CD1 1 ATOM 24 C CD2 . LEU A 1 3 ? 11.096 -35.534 -14.655 1.00 34.05 ? 3 LEU A CD2 1 ATOM 25 N N . LEU A 1 4 ? 15.798 -34.470 -13.457 1.00 23.36 ? 4 LEU A N 1 ATOM 26 C CA . LEU A 1 4 ? 16.284 -33.119 -13.704 1.00 23.52 ? 4 LEU A CA 1 ATOM 27 C C . LEU A 1 4 ? 15.732 -32.605 -15.019 1.00 28.07 ? 4 LEU A C 1 ATOM 28 O O . LEU A 1 4 ? 15.913 -33.231 -16.068 1.00 29.66 ? 4 LEU A O 1 ATOM 29 C CB . LEU A 1 4 ? 17.807 -33.091 -13.739 1.00 23.56 ? 4 LEU A CB 1 ATOM 30 C CG . LEU A 1 4 ? 18.502 -33.491 -12.445 1.00 24.79 ? 4 LEU A CG 1 ATOM 31 C CD1 . LEU A 1 4 ? 19.999 -33.561 -12.670 1.00 30.36 ? 4 LEU A CD1 1 ATOM 32 C CD2 . LEU A 1 4 ? 18.146 -32.525 -11.303 1.00 16.48 ? 4 LEU A CD2 1 ATOM 33 N N . THR A 1 5 ? 15.066 -31.458 -14.956 1.00 26.89 ? 5 THR A N 1 ATOM 34 C CA . THR A 1 5 ? 14.464 -30.860 -16.136 1.00 28.25 ? 5 THR A CA 1 ATOM 35 C C . THR A 1 5 ? 15.220 -29.596 -16.523 1.00 27.13 ? 5 THR A C 1 ATOM 36 O O . THR A 1 5 ? 15.272 -28.632 -15.759 1.00 27.12 ? 5 THR A O 1 ATOM 37 C CB . THR A 1 5 ? 12.957 -30.549 -15.915 1.00 26.56 ? 5 THR A CB 1 ATOM 38 O OG1 . THR A 1 5 ? 12.277 -31.753 -15.545 1.00 25.15 ? 5 THR A OG1 1 ATOM 39 C CG2 . THR A 1 5 ? 12.313 -29.975 -17.195 1.00 21.02 ? 5 THR A CG2 1 ATOM 40 N N . GLN A 1 6 ? 15.802 -29.609 -17.718 1.00 28.90 ? 6 GLN A N 1 ATOM 41 C CA . GLN A 1 6 ? 16.568 -28.470 -18.206 1.00 26.59 ? 6 GLN A CA 1 ATOM 42 C C . GLN A 1 6 ? 15.784 -27.661 -19.216 1.00 32.04 ? 6 GLN A C 1 ATOM 43 O O . GLN A 1 6 ? 15.181 -28.216 -20.140 1.00 35.68 ? 6 GLN A O 1 ATOM 44 C CB . GLN A 1 6 ? 17.882 -28.928 -18.817 1.00 17.13 ? 6 GLN A CB 1 ATOM 45 C CG . GLN A 1 6 ? 18.942 -29.237 -17.781 1.00 20.23 ? 6 GLN A CG 1 ATOM 46 C CD . GLN A 1 6 ? 20.302 -29.437 -18.396 1.00 18.83 ? 6 GLN A CD 1 ATOM 47 O OE1 . GLN A 1 6 ? 20.789 -30.568 -18.488 1.00 18.64 ? 6 GLN A OE1 1 ATOM 48 N NE2 . GLN A 1 6 ? 20.930 -28.338 -18.826 1.00 14.83 ? 6 GLN A NE2 1 ATOM 49 N N . SER A 1 7 ? 15.796 -26.346 -19.033 1.00 29.66 ? 7 SER A N 1 ATOM 50 C CA . SER A 1 7 ? 15.064 -25.449 -19.915 1.00 38.16 ? 7 SER A CA 1 ATOM 51 C C . SER A 1 7 ? 15.869 -24.174 -20.198 1.00 39.01 ? 7 SER A C 1 ATOM 52 O O . SER A 1 7 ? 16.719 -23.770 -19.395 1.00 38.84 ? 7 SER A O 1 ATOM 53 C CB . SER A 1 7 ? 13.695 -25.103 -19.324 1.00 42.24 ? 7 SER A CB 1 ATOM 54 O OG . SER A 1 7 ? 13.746 -23.865 -18.643 1.00 48.22 ? 7 SER A OG 1 ATOM 55 N N . PRO A 1 8 ? 15.638 -23.564 -21.370 1.00 33.25 ? 8 PRO A N 1 ATOM 56 C CA . PRO A 1 8 ? 14.812 -24.167 -22.415 1.00 31.65 ? 8 PRO A CA 1 ATOM 57 C C . PRO A 1 8 ? 15.620 -25.219 -23.153 1.00 30.17 ? 8 PRO A C 1 ATOM 58 O O . PRO A 1 8 ? 16.741 -25.540 -22.760 1.00 30.82 ? 8 PRO A O 1 ATOM 59 C CB . PRO A 1 8 ? 14.519 -22.993 -23.342 1.00 33.37 ? 8 PRO A CB 1 ATOM 60 C CG . PRO A 1 8 ? 15.684 -22.101 -23.179 1.00 36.74 ? 8 PRO A CG 1 ATOM 61 C CD . PRO A 1 8 ? 16.099 -22.216 -21.743 1.00 36.65 ? 8 PRO A CD 1 ATOM 62 N N . VAL A 1 9 ? 15.059 -25.746 -24.226 1.00 29.38 ? 9 VAL A N 1 ATOM 63 C CA . VAL A 1 9 ? 15.731 -26.802 -24.953 1.00 30.19 ? 9 VAL A CA 1 ATOM 64 C C . VAL A 1 9 ? 16.878 -26.246 -25.809 1.00 24.11 ? 9 VAL A C 1 ATOM 65 O O . VAL A 1 9 ? 17.944 -26.846 -25.906 1.00 21.70 ? 9 VAL A O 1 ATOM 66 C CB . VAL A 1 9 ? 14.693 -27.631 -25.741 1.00 33.37 ? 9 VAL A CB 1 ATOM 67 C CG1 . VAL A 1 9 ? 15.104 -27.831 -27.169 1.00 30.00 ? 9 VAL A CG1 1 ATOM 68 C CG2 . VAL A 1 9 ? 14.465 -28.940 -25.036 1.00 29.76 ? 9 VAL A CG2 1 ATOM 69 N N . ILE A 1 10 ? 16.653 -25.077 -26.397 1.00 31.29 ? 10 ILE A N 1 ATOM 70 C CA . ILE A 1 10 ? 17.673 -24.367 -27.160 1.00 28.84 ? 10 ILE A CA 1 ATOM 71 C C . ILE A 1 10 ? 17.728 -22.919 -26.707 1.00 30.33 ? 10 ILE A C 1 ATOM 72 O O . ILE A 1 10 ? 16.690 -22.301 -26.460 1.00 37.39 ? 10 ILE A O 1 ATOM 73 C CB . ILE A 1 10 ? 17.349 -24.341 -28.663 1.00 29.00 ? 10 ILE A CB 1 ATOM 74 C CG1 . ILE A 1 10 ? 17.194 -25.756 -29.219 1.00 31.38 ? 10 ILE A CG1 1 ATOM 75 C CG2 . ILE A 1 10 ? 18.434 -23.608 -29.432 1.00 30.81 ? 10 ILE A CG2 1 ATOM 76 C CD1 . ILE A 1 10 ? 17.021 -25.772 -30.736 1.00 35.39 ? 10 ILE A CD1 1 ATOM 77 N N . LEU A 1 11 ? 18.940 -22.390 -26.576 1.00 23.95 ? 11 LEU A N 1 ATOM 78 C CA . LEU A 1 11 ? 19.137 -20.958 -26.394 1.00 27.73 ? 11 LEU A CA 1 ATOM 79 C C . LEU A 1 11 ? 19.917 -20.374 -27.566 1.00 31.76 ? 11 LEU A C 1 ATOM 80 O O . LEU A 1 11 ? 20.853 -20.995 -28.078 1.00 30.36 ? 11 LEU A O 1 ATOM 81 C CB . LEU A 1 11 ? 19.865 -20.671 -25.088 1.00 25.49 ? 11 LEU A CB 1 ATOM 82 C CG . LEU A 1 11 ? 18.966 -20.688 -23.861 1.00 26.37 ? 11 LEU A CG 1 ATOM 83 C CD1 . LEU A 1 11 ? 19.799 -20.739 -22.595 1.00 29.50 ? 11 LEU A CD1 1 ATOM 84 C CD2 . LEU A 1 11 ? 18.068 -19.465 -23.869 1.00 22.91 ? 11 LEU A CD2 1 ATOM 85 N N . SER A 1 12 ? 19.523 -19.182 -27.996 1.00 28.09 ? 12 SER A N 1 ATOM 86 C CA . SER A 1 12 ? 20.229 -18.502 -29.076 1.00 28.97 ? 12 SER A CA 1 ATOM 87 C C . SER A 1 12 ? 20.474 -17.059 -28.675 1.00 31.87 ? 12 SER A C 1 ATOM 88 O O . SER A 1 12 ? 19.535 -16.309 -28.393 1.00 33.85 ? 12 SER A O 1 ATOM 89 C CB . SER A 1 12 ? 19.435 -18.575 -30.374 1.00 26.61 ? 12 SER A CB 1 ATOM 90 O OG . SER A 1 12 ? 20.166 -17.997 -31.435 1.00 42.99 ? 12 SER A OG 1 ATOM 91 N N . VAL A 1 13 ? 21.747 -16.687 -28.611 1.00 30.45 ? 13 VAL A N 1 ATOM 92 C CA . VAL A 1 13 ? 22.133 -15.367 -28.138 1.00 33.76 ? 13 VAL A CA 1 ATOM 93 C C . VAL A 1 13 ? 23.234 -14.782 -29.006 1.00 35.81 ? 13 VAL A C 1 ATOM 94 O O . VAL A 1 13 ? 23.891 -15.500 -29.759 1.00 33.83 ? 13 VAL A O 1 ATOM 95 C CB . VAL A 1 13 ? 22.609 -15.413 -26.660 1.00 35.06 ? 13 VAL A CB 1 ATOM 96 C CG1 . VAL A 1 13 ? 21.506 -15.961 -25.757 1.00 34.91 ? 13 VAL A CG1 1 ATOM 97 C CG2 . VAL A 1 13 ? 23.870 -16.262 -26.522 1.00 31.92 ? 13 VAL A CG2 1 ATOM 98 N N . SER A 1 14 ? 23.427 -13.471 -28.903 1.00 38.13 ? 14 SER A N 1 ATOM 99 C CA . SER A 1 14 ? 24.500 -12.798 -29.626 1.00 35.63 ? 14 SER A CA 1 ATOM 100 C C . SER A 1 14 ? 25.738 -12.740 -28.742 1.00 31.62 ? 14 SER A C 1 ATOM 101 O O . SER A 1 14 ? 25.618 -12.730 -27.518 1.00 30.89 ? 14 SER A O 1 ATOM 102 C CB . SER A 1 14 ? 24.058 -11.393 -30.028 1.00 38.22 ? 14 SER A CB 1 ATOM 103 O OG . SER A 1 14 ? 22.864 -11.443 -30.789 1.00 43.60 ? 14 SER A OG 1 ATOM 104 N N . PRO A 1 15 ? 26.933 -12.716 -29.354 1.00 32.29 ? 15 PRO A N 1 ATOM 105 C CA . PRO A 1 15 ? 28.172 -12.636 -28.572 1.00 38.57 ? 15 PRO A CA 1 ATOM 106 C C . PRO A 1 15 ? 28.205 -11.393 -27.698 1.00 38.24 ? 15 PRO A C 1 ATOM 107 O O . PRO A 1 15 ? 27.729 -10.338 -28.120 1.00 35.43 ? 15 PRO A O 1 ATOM 108 C CB . PRO A 1 15 ? 29.267 -12.563 -29.644 1.00 33.55 ? 15 PRO A CB 1 ATOM 109 C CG . PRO A 1 15 ? 28.570 -12.194 -30.887 1.00 34.74 ? 15 PRO A CG 1 ATOM 110 C CD . PRO A 1 15 ? 27.205 -12.774 -30.796 1.00 33.35 ? 15 PRO A CD 1 ATOM 111 N N . GLY A 1 16 ? 28.735 -11.535 -26.487 1.00 38.37 ? 16 GLY A N 1 ATOM 112 C CA . GLY A 1 16 ? 28.826 -10.427 -25.557 1.00 34.33 ? 16 GLY A CA 1 ATOM 113 C C . GLY A 1 16 ? 27.663 -10.359 -24.591 1.00 38.52 ? 16 GLY A C 1 ATOM 114 O O . GLY A 1 16 ? 27.747 -9.659 -23.584 1.00 46.11 ? 16 GLY A O 1 ATOM 115 N N . GLU A 1 17 ? 26.585 -11.082 -24.892 1.00 36.47 ? 17 GLU A N 1 ATOM 116 C CA . GLU A 1 17 ? 25.385 -11.070 -24.059 1.00 35.13 ? 17 GLU A CA 1 ATOM 117 C C . GLU A 1 17 ? 25.521 -12.013 -22.868 1.00 34.53 ? 17 GLU A C 1 ATOM 118 O O . GLU A 1 17 ? 26.227 -13.019 -22.943 1.00 33.69 ? 17 GLU A O 1 ATOM 119 C CB . GLU A 1 17 ? 24.153 -11.470 -24.885 1.00 34.54 ? 17 GLU A CB 1 ATOM 120 C CG . GLU A 1 17 ? 23.528 -10.323 -25.677 1.00 49.53 ? 17 GLU A CG 1 ATOM 121 C CD . GLU A 1 17 ? 22.486 -10.794 -26.693 1.00 53.96 ? 17 GLU A CD 1 ATOM 122 O OE1 . GLU A 1 17 ? 22.184 -12.011 -26.706 1.00 42.43 ? 17 GLU A OE1 1 ATOM 123 O OE2 . GLU A 1 17 ? 21.979 -9.948 -27.478 1.00 57.72 ? 17 GLU A OE2 1 ATOM 124 N N . ARG A 1 18 ? 24.838 -11.693 -21.773 1.00 36.21 ? 18 ARG A N 1 ATOM 125 C CA . ARG A 1 18 ? 24.706 -12.640 -20.674 1.00 35.38 ? 18 ARG A CA 1 ATOM 126 C C . ARG A 1 18 ? 23.715 -13.725 -21.081 1.00 35.20 ? 18 ARG A C 1 ATOM 127 O O . ARG A 1 18 ? 22.827 -13.484 -21.896 1.00 33.23 ? 18 ARG A O 1 ATOM 128 C CB . ARG A 1 18 ? 24.231 -11.940 -19.392 1.00 30.12 ? 18 ARG A CB 1 ATOM 129 N N . VAL A 1 19 ? 23.868 -14.920 -20.520 1.00 33.35 ? 19 VAL A N 1 ATOM 130 C CA . VAL A 1 19 ? 22.917 -15.997 -20.771 1.00 30.57 ? 19 VAL A CA 1 ATOM 131 C C . VAL A 1 19 ? 22.830 -16.926 -19.565 1.00 26.07 ? 19 VAL A C 1 ATOM 132 O O . VAL A 1 19 ? 23.828 -17.150 -18.874 1.00 26.75 ? 19 VAL A O 1 ATOM 133 C CB . VAL A 1 19 ? 23.276 -16.804 -22.044 1.00 32.31 ? 19 VAL A CB 1 ATOM 134 C CG1 . VAL A 1 19 ? 24.408 -17.793 -21.765 1.00 28.36 ? 19 VAL A CG1 1 ATOM 135 C CG2 . VAL A 1 19 ? 22.050 -17.535 -22.572 1.00 33.56 ? 19 VAL A CG2 1 ATOM 136 N N . SER A 1 20 ? 21.634 -17.454 -19.305 1.00 28.09 ? 20 SER A N 1 ATOM 137 C CA . SER A 1 20 ? 21.410 -18.334 -18.157 1.00 21.85 ? 20 SER A CA 1 ATOM 138 C C . SER A 1 20 ? 20.745 -19.643 -18.550 1.00 24.82 ? 20 SER A C 1 ATOM 139 O O . SER A 1 20 ? 19.889 -19.670 -19.424 1.00 28.72 ? 20 SER A O 1 ATOM 140 C CB . SER A 1 20 ? 20.572 -17.625 -17.098 1.00 26.93 ? 20 SER A CB 1 ATOM 141 O OG . SER A 1 20 ? 21.328 -16.596 -16.497 1.00 38.50 ? 20 SER A OG 1 ATOM 142 N N . PHE A 1 21 ? 21.153 -20.726 -17.893 1.00 27.84 ? 21 PHE A N 1 ATOM 143 C CA . PHE A 1 21 ? 20.560 -22.045 -18.101 1.00 23.95 ? 21 PHE A CA 1 ATOM 144 C C . PHE A 1 21 ? 19.811 -22.473 -16.850 1.00 29.68 ? 21 PHE A C 1 ATOM 145 O O . PHE A 1 21 ? 20.275 -22.277 -15.725 1.00 27.28 ? 21 PHE A O 1 ATOM 146 C CB . PHE A 1 21 ? 21.633 -23.093 -18.403 1.00 17.14 ? 21 PHE A CB 1 ATOM 147 C CG . PHE A 1 21 ? 22.515 -22.745 -19.561 1.00 19.19 ? 21 PHE A CG 1 ATOM 148 C CD1 . PHE A 1 21 ? 23.619 -21.922 -19.385 1.00 18.70 ? 21 PHE A CD1 1 ATOM 149 C CD2 . PHE A 1 21 ? 22.263 -23.262 -20.824 1.00 20.51 ? 21 PHE A CD2 1 ATOM 150 C CE1 . PHE A 1 21 ? 24.445 -21.605 -20.454 1.00 25.08 ? 21 PHE A CE1 1 ATOM 151 C CE2 . PHE A 1 21 ? 23.087 -22.949 -21.893 1.00 22.66 ? 21 PHE A CE2 1 ATOM 152 C CZ . PHE A 1 21 ? 24.175 -22.113 -21.708 1.00 21.47 ? 21 PHE A CZ 1 ATOM 153 N N . SER A 1 22 ? 18.658 -23.084 -17.046 1.00 30.83 ? 22 SER A N 1 ATOM 154 C CA . SER A 1 22 ? 17.846 -23.490 -15.920 1.00 28.55 ? 22 SER A CA 1 ATOM 155 C C . SER A 1 22 ? 17.890 -25.002 -15.749 1.00 30.66 ? 22 SER A C 1 ATOM 156 O O . SER A 1 22 ? 17.772 -25.750 -16.722 1.00 30.24 ? 22 SER A O 1 ATOM 157 C CB . SER A 1 22 ? 16.410 -23.010 -16.120 1.00 20.35 ? 22 SER A CB 1 ATOM 158 O OG . SER A 1 22 ? 15.558 -23.592 -15.158 1.00 44.99 ? 22 SER A OG 1 ATOM 159 N N . CYS A 1 23 ? 18.080 -25.446 -14.509 1.00 33.59 ? 23 CYS A N 1 ATOM 160 C CA . CYS A 1 23 ? 18.004 -26.866 -14.181 1.00 27.18 ? 23 CYS A CA 1 ATOM 161 C C . CYS A 1 23 ? 17.096 -27.044 -12.987 1.00 29.77 ? 23 CYS A C 1 ATOM 162 O O . CYS A 1 23 ? 17.414 -26.586 -11.877 1.00 27.64 ? 23 CYS A O 1 ATOM 163 C CB . CYS A 1 23 ? 19.381 -27.432 -13.848 1.00 22.67 ? 23 CYS A CB 1 ATOM 164 S SG . CYS A 1 23 ? 19.408 -29.204 -13.436 1.00 26.46 ? 23 CYS A SG 1 ATOM 165 N N . ARG A 1 24 ? 15.963 -27.706 -13.209 1.00 22.10 ? 24 ARG A N 1 ATOM 166 C CA . ARG A 1 24 ? 15.016 -27.933 -12.124 1.00 28.89 ? 24 ARG A CA 1 ATOM 167 C C . ARG A 1 24 ? 14.924 -29.405 -11.684 1.00 31.63 ? 24 ARG A C 1 ATOM 168 O O . ARG A 1 24 ? 14.872 -30.326 -12.509 1.00 30.72 ? 24 ARG A O 1 ATOM 169 C CB . ARG A 1 24 ? 13.647 -27.343 -12.468 1.00 26.73 ? 24 ARG A CB 1 ATOM 170 C CG . ARG A 1 24 ? 13.674 -25.824 -12.643 1.00 38.34 ? 24 ARG A CG 1 ATOM 171 C CD . ARG A 1 24 ? 12.287 -25.246 -12.985 1.00 43.05 ? 24 ARG A CD 1 ATOM 172 N NE . ARG A 1 24 ? 12.188 -23.813 -12.693 1.00 45.23 ? 24 ARG A NE 1 ATOM 173 C CZ . ARG A 1 24 ? 12.522 -22.845 -13.547 1.00 44.21 ? 24 ARG A CZ 1 ATOM 174 N NH1 . ARG A 1 24 ? 12.982 -23.147 -14.759 1.00 41.00 ? 24 ARG A NH1 1 ATOM 175 N NH2 . ARG A 1 24 ? 12.399 -21.570 -13.192 1.00 41.43 ? 24 ARG A NH2 1 ATOM 176 N N . ALA A 1 25 ? 14.920 -29.612 -10.372 1.00 27.80 ? 25 ALA A N 1 ATOM 177 C CA . ALA A 1 25 ? 14.898 -30.957 -9.810 1.00 29.68 ? 25 ALA A CA 1 ATOM 178 C C . ALA A 1 25 ? 13.521 -31.354 -9.248 1.00 30.82 ? 25 ALA A C 1 ATOM 179 O O . ALA A 1 25 ? 12.764 -30.510 -8.770 1.00 28.27 ? 25 ALA A O 1 ATOM 180 C CB . ALA A 1 25 ? 15.968 -31.092 -8.747 1.00 26.31 ? 25 ALA A CB 1 ATOM 181 N N . SER A 1 26 ? 13.224 -32.649 -9.307 1.00 28.33 ? 26 SER A N 1 ATOM 182 C CA . SER A 1 26 ? 11.909 -33.184 -8.961 1.00 27.07 ? 26 SER A CA 1 ATOM 183 C C . SER A 1 26 ? 11.636 -33.188 -7.457 1.00 30.57 ? 26 SER A C 1 ATOM 184 O O . SER A 1 26 ? 10.481 -33.221 -7.030 1.00 32.38 ? 26 SER A O 1 ATOM 185 C CB . SER A 1 26 ? 11.754 -34.596 -9.533 1.00 30.98 ? 26 SER A CB 1 ATOM 186 O OG . SER A 1 26 ? 12.894 -35.387 -9.242 1.00 37.10 ? 26 SER A OG 1 ATOM 187 N N . GLN A 1 27 ? 12.701 -33.179 -6.663 1.00 24.09 ? 27 GLN A N 1 ATOM 188 C CA . GLN A 1 27 ? 12.595 -32.915 -5.229 1.00 30.26 ? 27 GLN A CA 1 ATOM 189 C C . GLN A 1 27 ? 13.875 -32.189 -4.784 1.00 30.76 ? 27 GLN A C 1 ATOM 190 O O . GLN A 1 27 ? 14.851 -32.120 -5.543 1.00 25.63 ? 27 GLN A O 1 ATOM 191 C CB . GLN A 1 27 ? 12.368 -34.206 -4.437 1.00 34.78 ? 27 GLN A CB 1 ATOM 192 C CG . GLN A 1 27 ? 13.642 -34.977 -4.132 1.00 40.35 ? 27 GLN A CG 1 ATOM 193 C CD . GLN A 1 27 ? 13.392 -36.436 -3.754 1.00 46.28 ? 27 GLN A CD 1 ATOM 194 O OE1 . GLN A 1 27 ? 12.789 -37.196 -4.516 1.00 45.24 ? 27 GLN A OE1 1 ATOM 195 N NE2 . GLN A 1 27 ? 13.869 -36.833 -2.578 1.00 48.71 ? 27 GLN A NE2 1 ATOM 196 N N . SER A 1 28 ? 13.869 -31.627 -3.578 1.00 29.27 ? 28 SER A N 1 ATOM 197 C CA . SER A 1 28 ? 14.991 -30.797 -3.142 1.00 30.52 ? 28 SER A CA 1 ATOM 198 C C . SER A 1 28 ? 16.298 -31.588 -3.148 1.00 33.00 ? 28 SER A C 1 ATOM 199 O O . SER A 1 28 ? 16.316 -32.766 -2.812 1.00 31.12 ? 28 SER A O 1 ATOM 200 C CB . SER A 1 28 ? 14.724 -30.217 -1.753 1.00 31.47 ? 28 SER A CB 1 ATOM 201 O OG . SER A 1 28 ? 15.797 -29.386 -1.344 1.00 40.28 ? 28 SER A OG 1 ATOM 202 N N . ILE A 1 29 ? 17.386 -30.950 -3.560 1.00 37.25 ? 29 ILE A N 1 ATOM 203 C CA . ILE A 1 29 ? 18.678 -31.632 -3.622 1.00 32.01 ? 29 ILE A CA 1 ATOM 204 C C . ILE A 1 29 ? 19.789 -30.784 -3.019 1.00 27.25 ? 29 ILE A C 1 ATOM 205 O O . ILE A 1 29 ? 20.956 -30.925 -3.400 1.00 25.26 ? 29 ILE A O 1 ATOM 206 C CB . ILE A 1 29 ? 19.073 -32.035 -5.067 1.00 33.16 ? 29 ILE A CB 1 ATOM 207 C CG1 . ILE A 1 29 ? 18.982 -30.841 -6.018 1.00 30.53 ? 29 ILE A CG1 1 ATOM 208 C CG2 . ILE A 1 29 ? 18.199 -33.167 -5.565 1.00 40.08 ? 29 ILE A CG2 1 ATOM 209 C CD1 . ILE A 1 29 ? 19.599 -31.090 -7.378 1.00 19.79 ? 29 ILE A CD1 1 ATOM 210 N N . GLY A 1 30 ? 19.412 -29.923 -2.067 1.00 25.84 ? 30 GLY A N 1 ATOM 211 C CA . GLY A 1 30 ? 20.324 -28.959 -1.467 1.00 22.58 ? 30 GLY A CA 1 ATOM 212 C C . GLY A 1 30 ? 21.054 -28.156 -2.531 1.00 32.41 ? 30 GLY A C 1 ATOM 213 O O . GLY A 1 30 ? 20.442 -27.414 -3.311 1.00 35.15 ? 30 GLY A O 1 ATOM 214 N N . THR A 1 31 ? 22.369 -28.327 -2.581 1.00 20.77 ? 31 THR A N 1 ATOM 215 C CA . THR A 1 31 ? 23.179 -27.679 -3.595 1.00 21.17 ? 31 THR A CA 1 ATOM 216 C C . THR A 1 31 ? 24.023 -28.709 -4.335 1.00 23.20 ? 31 THR A C 1 ATOM 217 O O . THR A 1 31 ? 25.034 -28.366 -4.944 1.00 22.69 ? 31 THR A O 1 ATOM 218 C CB . THR A 1 31 ? 24.114 -26.646 -2.954 1.00 23.70 ? 31 THR A CB 1 ATOM 219 O OG1 . THR A 1 31 ? 24.692 -27.221 -1.778 1.00 22.32 ? 31 THR A OG1 1 ATOM 220 C CG2 . THR A 1 31 ? 23.346 -25.391 -2.559 1.00 22.19 ? 31 THR A CG2 1 ATOM 221 N N . ASN A 1 32 ? 23.601 -29.970 -4.277 1.00 23.75 ? 32 ASN A N 1 ATOM 222 C CA . ASN A 1 32 ? 24.357 -31.078 -4.863 1.00 19.66 ? 32 ASN A CA 1 ATOM 223 C C . ASN A 1 32 ? 24.111 -31.186 -6.365 1.00 19.69 ? 32 ASN A C 1 ATOM 224 O O . ASN A 1 32 ? 23.482 -32.131 -6.856 1.00 18.14 ? 32 ASN A O 1 ATOM 225 C CB . ASN A 1 32 ? 23.980 -32.388 -4.181 1.00 17.78 ? 32 ASN A CB 1 ATOM 226 C CG . ASN A 1 32 ? 25.171 -33.297 -3.959 1.00 28.58 ? 32 ASN A CG 1 ATOM 227 O OD1 . ASN A 1 32 ? 25.906 -33.629 -4.890 1.00 27.08 ? 32 ASN A OD1 1 ATOM 228 N ND2 . ASN A 1 32 ? 25.367 -33.708 -2.710 1.00 25.68 ? 32 ASN A ND2 1 ATOM 229 N N . ILE A 1 33 ? 24.618 -30.205 -7.092 1.00 24.19 ? 33 ILE A N 1 ATOM 230 C CA . ILE A 1 33 ? 24.404 -30.128 -8.517 1.00 23.31 ? 33 ILE A CA 1 ATOM 231 C C . ILE A 1 33 ? 25.735 -29.749 -9.172 1.00 25.60 ? 33 ILE A C 1 ATOM 232 O O . ILE A 1 33 ? 26.460 -28.887 -8.667 1.00 21.81 ? 33 ILE A O 1 ATOM 233 C CB . ILE A 1 33 ? 23.265 -29.114 -8.825 1.00 29.03 ? 33 ILE A CB 1 ATOM 234 C CG1 . ILE A 1 33 ? 22.877 -29.117 -10.296 1.00 34.83 ? 33 ILE A CG1 1 ATOM 235 C CG2 . ILE A 1 33 ? 23.635 -27.731 -8.387 1.00 34.21 ? 33 ILE A CG2 1 ATOM 236 C CD1 . ILE A 1 33 ? 21.679 -29.977 -10.569 1.00 42.93 ? 33 ILE A CD1 1 ATOM 237 N N . HIS A 1 34 ? 26.073 -30.426 -10.268 1.00 28.41 ? 34 HIS A N 1 ATOM 238 C CA . HIS A 1 34 ? 27.262 -30.095 -11.061 1.00 22.15 ? 34 HIS A CA 1 ATOM 239 C C . HIS A 1 34 ? 26.871 -29.777 -12.510 1.00 24.78 ? 34 HIS A C 1 ATOM 240 O O . HIS A 1 34 ? 25.880 -30.298 -13.019 1.00 22.38 ? 34 HIS A O 1 ATOM 241 C CB . HIS A 1 34 ? 28.255 -31.253 -11.041 1.00 19.80 ? 34 HIS A CB 1 ATOM 242 C CG . HIS A 1 34 ? 28.475 -31.837 -9.683 1.00 22.98 ? 34 HIS A CG 1 ATOM 243 N ND1 . HIS A 1 34 ? 28.774 -31.064 -8.576 1.00 17.06 ? 34 HIS A ND1 1 ATOM 244 C CD2 . HIS A 1 34 ? 28.438 -33.118 -9.238 1.00 25.66 ? 34 HIS A CD2 1 ATOM 245 C CE1 . HIS A 1 34 ? 28.907 -31.841 -7.521 1.00 20.65 ? 34 HIS A CE1 1 ATOM 246 N NE2 . HIS A 1 34 ? 28.708 -33.098 -7.894 1.00 22.40 ? 34 HIS A NE2 1 ATOM 247 N N . TRP A 1 35 ? 27.642 -28.920 -13.171 1.00 21.78 ? 35 TRP A N 1 ATOM 248 C CA . TRP A 1 35 ? 27.339 -28.528 -14.540 1.00 18.67 ? 35 TRP A CA 1 ATOM 249 C C . TRP A 1 35 ? 28.476 -28.897 -15.488 1.00 23.12 ? 35 TRP A C 1 ATOM 250 O O . TRP A 1 35 ? 29.651 -28.788 -15.141 1.00 28.53 ? 35 TRP A O 1 ATOM 251 C CB . TRP A 1 35 ? 27.126 -27.025 -14.627 1.00 22.45 ? 35 TRP A CB 1 ATOM 252 C CG . TRP A 1 35 ? 25.890 -26.500 -13.994 1.00 23.38 ? 35 TRP A CG 1 ATOM 253 C CD1 . TRP A 1 35 ? 25.755 -26.037 -12.715 1.00 15.26 ? 35 TRP A CD1 1 ATOM 254 C CD2 . TRP A 1 35 ? 24.616 -26.327 -14.624 1.00 23.70 ? 35 TRP A CD2 1 ATOM 255 N NE1 . TRP A 1 35 ? 24.469 -25.598 -12.507 1.00 23.68 ? 35 TRP A NE1 1 ATOM 256 C CE2 . TRP A 1 35 ? 23.747 -25.765 -13.662 1.00 25.78 ? 35 TRP A CE2 1 ATOM 257 C CE3 . TRP A 1 35 ? 24.123 -26.595 -15.908 1.00 23.73 ? 35 TRP A CE3 1 ATOM 258 C CZ2 . TRP A 1 35 ? 22.408 -25.469 -13.943 1.00 22.92 ? 35 TRP A CZ2 1 ATOM 259 C CZ3 . TRP A 1 35 ? 22.798 -26.303 -16.187 1.00 25.56 ? 35 TRP A CZ3 1 ATOM 260 C CH2 . TRP A 1 35 ? 21.958 -25.738 -15.210 1.00 27.19 ? 35 TRP A CH2 1 ATOM 261 N N . TYR A 1 36 ? 28.117 -29.310 -16.697 1.00 20.10 ? 36 TYR A N 1 ATOM 262 C CA . TYR A 1 36 ? 29.098 -29.704 -17.694 1.00 17.16 ? 36 TYR A CA 1 ATOM 263 C C . TYR A 1 36 ? 28.838 -29.047 -19.033 1.00 17.29 ? 36 TYR A C 1 ATOM 264 O O . TYR A 1 36 ? 27.686 -28.766 -19.395 1.00 16.75 ? 36 TYR A O 1 ATOM 265 C CB . TYR A 1 36 ? 29.086 -31.217 -17.902 1.00 14.44 ? 36 TYR A CB 1 ATOM 266 C CG . TYR A 1 36 ? 29.379 -32.017 -16.668 1.00 19.85 ? 36 TYR A CG 1 ATOM 267 C CD1 . TYR A 1 36 ? 28.391 -32.247 -15.715 1.00 13.96 ? 36 TYR A CD1 1 ATOM 268 C CD2 . TYR A 1 36 ? 30.642 -32.563 -16.455 1.00 22.64 ? 36 TYR A CD2 1 ATOM 269 C CE1 . TYR A 1 36 ? 28.650 -32.996 -14.588 1.00 23.27 ? 36 TYR A CE1 1 ATOM 270 C CE2 . TYR A 1 36 ? 30.916 -33.312 -15.316 1.00 24.66 ? 36 TYR A CE2 1 ATOM 271 C CZ . TYR A 1 36 ? 29.909 -33.524 -14.390 1.00 22.71 ? 36 TYR A CZ 1 ATOM 272 O OH . TYR A 1 36 ? 30.160 -34.264 -13.263 1.00 20.65 ? 36 TYR A OH 1 ATOM 273 N N . GLN A 1 37 ? 29.925 -28.837 -19.772 1.00 23.34 ? 37 GLN A N 1 ATOM 274 C CA . GLN A 1 37 ? 29.878 -28.349 -21.141 1.00 18.40 ? 37 GLN A CA 1 ATOM 275 C C . GLN A 1 37 ? 30.264 -29.502 -22.057 1.00 23.62 ? 37 GLN A C 1 ATOM 276 O O . GLN A 1 37 ? 31.201 -30.237 -21.754 1.00 22.86 ? 37 GLN A O 1 ATOM 277 C CB . GLN A 1 37 ? 30.878 -27.202 -21.309 1.00 16.90 ? 37 GLN A CB 1 ATOM 278 C CG . GLN A 1 37 ? 31.112 -26.768 -22.749 1.00 22.41 ? 37 GLN A CG 1 ATOM 279 C CD . GLN A 1 37 ? 32.198 -25.717 -22.874 1.00 26.99 ? 37 GLN A CD 1 ATOM 280 O OE1 . GLN A 1 37 ? 33.392 -26.037 -22.876 1.00 19.76 ? 37 GLN A OE1 1 ATOM 281 N NE2 . GLN A 1 37 ? 31.790 -24.453 -22.986 1.00 20.39 ? 37 GLN A NE2 1 ATOM 282 N N . GLN A 1 38 ? 29.551 -29.672 -23.171 1.00 22.54 ? 38 GLN A N 1 ATOM 283 C CA . GLN A 1 38 ? 29.995 -30.607 -24.198 1.00 19.29 ? 38 GLN A CA 1 ATOM 284 C C . GLN A 1 38 ? 30.089 -29.938 -25.567 1.00 25.68 ? 38 GLN A C 1 ATOM 285 O O . GLN A 1 38 ? 29.087 -29.503 -26.117 1.00 24.53 ? 38 GLN A O 1 ATOM 286 C CB . GLN A 1 38 ? 29.090 -31.838 -24.278 1.00 22.72 ? 38 GLN A CB 1 ATOM 287 C CG . GLN A 1 38 ? 29.591 -32.889 -25.307 1.00 23.49 ? 38 GLN A CG 1 ATOM 288 C CD . GLN A 1 38 ? 28.903 -34.235 -25.161 1.00 23.85 ? 38 GLN A CD 1 ATOM 289 O OE1 . GLN A 1 38 ? 27.719 -34.303 -24.836 1.00 23.59 ? 38 GLN A OE1 1 ATOM 290 N NE2 . GLN A 1 38 ? 29.645 -35.311 -25.390 1.00 19.16 ? 38 GLN A NE2 1 ATOM 291 N N . ARG A 1 39 ? 31.304 -29.864 -26.105 1.00 19.49 ? 39 ARG A N 1 ATOM 292 C CA . ARG A 1 39 ? 31.535 -29.303 -27.427 1.00 24.93 ? 39 ARG A CA 1 ATOM 293 C C . ARG A 1 39 ? 31.492 -30.383 -28.501 1.00 29.88 ? 39 ARG A C 1 ATOM 294 O O . ARG A 1 39 ? 31.591 -31.569 -28.195 1.00 27.62 ? 39 ARG A O 1 ATOM 295 C CB . ARG A 1 39 ? 32.889 -28.618 -27.474 1.00 22.90 ? 39 ARG A CB 1 ATOM 296 C CG . ARG A 1 39 ? 32.977 -27.359 -26.663 1.00 26.63 ? 39 ARG A CG 1 ATOM 297 C CD . ARG A 1 39 ? 34.376 -26.824 -26.751 1.00 28.49 ? 39 ARG A CD 1 ATOM 298 N NE . ARG A 1 39 ? 34.528 -25.557 -26.058 1.00 32.47 ? 39 ARG A NE 1 ATOM 299 C CZ . ARG A 1 39 ? 35.704 -25.003 -25.790 1.00 43.59 ? 39 ARG A CZ 1 ATOM 300 N NH1 . ARG A 1 39 ? 36.825 -25.622 -26.143 1.00 42.45 ? 39 ARG A NH1 1 ATOM 301 N NH2 . ARG A 1 39 ? 35.760 -23.838 -25.158 1.00 51.02 ? 39 ARG A NH2 1 ATOM 302 N N . THR A 1 40 ? 31.352 -29.962 -29.755 1.00 26.58 ? 40 THR A N 1 ATOM 303 C CA . THR A 1 40 ? 31.288 -30.889 -30.879 1.00 23.89 ? 40 THR A CA 1 ATOM 304 C C . THR A 1 40 ? 32.416 -31.929 -30.847 1.00 27.66 ? 40 THR A C 1 ATOM 305 O O . THR A 1 40 ? 33.597 -31.584 -30.795 1.00 25.88 ? 40 THR A O 1 ATOM 306 C CB . THR A 1 40 ? 31.310 -30.134 -32.232 1.00 25.33 ? 40 THR A CB 1 ATOM 307 O OG1 . THR A 1 40 ? 30.224 -29.204 -32.277 1.00 30.81 ? 40 THR A OG1 1 ATOM 308 C CG2 . THR A 1 40 ? 31.185 -31.108 -33.393 1.00 26.77 ? 40 THR A CG2 1 ATOM 309 N N . ASN A 1 41 ? 32.021 -33.198 -30.864 1.00 27.61 ? 41 ASN A N 1 ATOM 310 C CA . ASN A 1 41 ? 32.947 -34.339 -30.794 1.00 33.24 ? 41 ASN A CA 1 ATOM 311 C C . ASN A 1 41 ? 33.727 -34.483 -29.488 1.00 28.72 ? 41 ASN A C 1 ATOM 312 O O . ASN A 1 41 ? 34.722 -35.194 -29.439 1.00 28.49 ? 41 ASN A O 1 ATOM 313 C CB . ASN A 1 41 ? 33.914 -34.352 -31.976 1.00 28.51 ? 41 ASN A CB 1 ATOM 314 C CG . ASN A 1 41 ? 33.210 -34.565 -33.287 1.00 37.39 ? 41 ASN A CG 1 ATOM 315 O OD1 . ASN A 1 41 ? 33.459 -33.861 -34.265 1.00 36.82 ? 41 ASN A OD1 1 ATOM 316 N ND2 . ASN A 1 41 ? 32.304 -35.531 -33.311 1.00 37.52 ? 41 ASN A ND2 1 ATOM 317 N N . GLY A 1 42 ? 33.269 -33.828 -28.432 1.00 23.79 ? 42 GLY A N 1 ATOM 318 C CA . GLY A 1 42 ? 34.014 -33.829 -27.188 1.00 24.86 ? 42 GLY A CA 1 ATOM 319 C C . GLY A 1 42 ? 33.449 -34.717 -26.100 1.00 29.04 ? 42 GLY A C 1 ATOM 320 O O . GLY A 1 42 ? 32.363 -35.289 -26.224 1.00 31.13 ? 42 GLY A O 1 ATOM 321 N N . SER A 1 43 ? 34.208 -34.844 -25.024 1.00 29.98 ? 43 SER A N 1 ATOM 322 C CA . SER A 1 43 ? 33.702 -35.468 -23.824 1.00 21.05 ? 43 SER A CA 1 ATOM 323 C C . SER A 1 43 ? 33.239 -34.325 -22.938 1.00 19.61 ? 43 SER A C 1 ATOM 324 O O . SER A 1 43 ? 33.701 -33.203 -23.093 1.00 22.31 ? 43 SER A O 1 ATOM 325 C CB . SER A 1 43 ? 34.806 -36.281 -23.156 1.00 22.10 ? 43 SER A CB 1 ATOM 326 O OG . SER A 1 43 ? 35.216 -37.370 -23.979 1.00 27.43 ? 43 SER A OG 1 ATOM 327 N N . PRO A 1 44 ? 32.309 -34.591 -22.017 1.00 24.10 ? 44 PRO A N 1 ATOM 328 C CA . PRO A 1 44 ? 31.895 -33.538 -21.086 1.00 19.00 ? 44 PRO A CA 1 ATOM 329 C C . PRO A 1 44 ? 33.076 -32.916 -20.335 1.00 22.53 ? 44 PRO A C 1 ATOM 330 O O . PRO A 1 44 ? 34.030 -33.617 -19.991 1.00 26.63 ? 44 PRO A O 1 ATOM 331 C CB . PRO A 1 44 ? 30.975 -34.284 -20.118 1.00 19.05 ? 44 PRO A CB 1 ATOM 332 C CG . PRO A 1 44 ? 30.393 -35.410 -20.953 1.00 20.23 ? 44 PRO A CG 1 ATOM 333 C CD . PRO A 1 44 ? 31.530 -35.832 -21.846 1.00 23.86 ? 44 PRO A CD 1 ATOM 334 N N . ARG A 1 45 ? 33.010 -31.603 -20.125 1.00 24.92 ? 45 ARG A N 1 ATOM 335 C CA . ARG A 1 45 ? 33.969 -30.862 -19.311 1.00 26.32 ? 45 ARG A CA 1 ATOM 336 C C . ARG A 1 45 ? 33.229 -30.255 -18.100 1.00 23.67 ? 45 ARG A C 1 ATOM 337 O O . ARG A 1 45 ? 32.222 -29.551 -18.258 1.00 21.42 ? 45 ARG A O 1 ATOM 338 C CB . ARG A 1 45 ? 34.684 -29.768 -20.141 1.00 27.47 ? 45 ARG A CB 1 ATOM 339 C CG . ARG A 1 45 ? 35.745 -28.985 -19.358 1.00 31.61 ? 45 ARG A CG 1 ATOM 340 C CD . ARG A 1 45 ? 36.481 -27.905 -20.170 1.00 42.44 ? 45 ARG A CD 1 ATOM 341 N NE . ARG A 1 45 ? 35.683 -26.709 -20.468 1.00 49.14 ? 45 ARG A NE 1 ATOM 342 C CZ . ARG A 1 45 ? 36.191 -25.546 -20.891 1.00 47.71 ? 45 ARG A CZ 1 ATOM 343 N NH1 . ARG A 1 45 ? 37.496 -25.401 -21.048 1.00 50.91 ? 45 ARG A NH1 1 ATOM 344 N NH2 . ARG A 1 45 ? 35.399 -24.517 -21.147 1.00 42.89 ? 45 ARG A NH2 1 ATOM 345 N N . LEU A 1 46 ? 33.727 -30.553 -16.900 1.00 21.54 ? 46 LEU A N 1 ATOM 346 C CA . LEU A 1 46 ? 33.152 -30.075 -15.642 1.00 19.47 ? 46 LEU A CA 1 ATOM 347 C C . LEU A 1 46 ? 33.320 -28.568 -15.487 1.00 23.85 ? 46 LEU A C 1 ATOM 348 O O . LEU A 1 46 ? 34.443 -28.068 -15.493 1.00 26.89 ? 46 LEU A O 1 ATOM 349 C CB . LEU A 1 46 ? 33.839 -30.772 -14.471 1.00 16.98 ? 46 LEU A CB 1 ATOM 350 C CG . LEU A 1 46 ? 33.368 -30.344 -13.078 1.00 23.79 ? 46 LEU A CG 1 ATOM 351 C CD1 . LEU A 1 46 ? 31.872 -30.663 -12.899 1.00 18.89 ? 46 LEU A CD1 1 ATOM 352 C CD2 . LEU A 1 46 ? 34.205 -31.010 -12.005 1.00 17.43 ? 46 LEU A CD2 1 ATOM 353 N N . LEU A 1 47 ? 32.210 -27.846 -15.332 1.00 21.83 ? 47 LEU A N 1 ATOM 354 C CA . LEU A 1 47 ? 32.250 -26.383 -15.292 1.00 21.73 ? 47 LEU A CA 1 ATOM 355 C C . LEU A 1 47 ? 32.141 -25.817 -13.884 1.00 27.11 ? 47 LEU A C 1 ATOM 356 O O . LEU A 1 47 ? 32.861 -24.874 -13.510 1.00 26.53 ? 47 LEU A O 1 ATOM 357 C CB . LEU A 1 47 ? 31.114 -25.794 -16.138 1.00 20.50 ? 47 LEU A CB 1 ATOM 358 C CG . LEU A 1 47 ? 31.199 -25.901 -17.659 1.00 21.40 ? 47 LEU A CG 1 ATOM 359 C CD1 . LEU A 1 47 ? 29.912 -25.378 -18.278 1.00 21.02 ? 47 LEU A CD1 1 ATOM 360 C CD2 . LEU A 1 47 ? 32.414 -25.150 -18.200 1.00 17.84 ? 47 LEU A CD2 1 ATOM 361 N N . ILE A 1 48 ? 31.209 -26.383 -13.122 1.00 24.62 ? 48 ILE A N 1 ATOM 362 C CA . ILE A 1 48 ? 30.857 -25.887 -11.803 1.00 19.76 ? 48 ILE A CA 1 ATOM 363 C C . ILE A 1 48 ? 30.513 -27.111 -10.967 1.00 22.80 ? 48 ILE A C 1 ATOM 364 O O . ILE A 1 48 ? 29.880 -28.037 -11.471 1.00 31.69 ? 48 ILE A O 1 ATOM 365 C CB . ILE A 1 48 ? 29.594 -24.988 -11.877 1.00 19.69 ? 48 ILE A CB 1 ATOM 366 C CG1 . ILE A 1 48 ? 29.842 -23.726 -12.708 1.00 20.68 ? 48 ILE A CG1 1 ATOM 367 C CG2 . ILE A 1 48 ? 29.097 -24.623 -10.488 1.00 17.34 ? 48 ILE A CG2 1 ATOM 368 C CD1 . ILE A 1 48 ? 30.658 -22.669 -12.008 1.00 23.36 ? 48 ILE A CD1 1 ATOM 369 N N . LYS A 1 49 ? 30.935 -27.135 -9.708 1.00 21.14 ? 49 LYS A N 1 ATOM 370 C CA . LYS A 1 49 ? 30.521 -28.195 -8.789 1.00 24.68 ? 49 LYS A CA 1 ATOM 371 C C . LYS A 1 49 ? 29.784 -27.612 -7.577 1.00 29.28 ? 49 LYS A C 1 ATOM 372 O O . LYS A 1 49 ? 30.087 -26.512 -7.119 1.00 26.52 ? 49 LYS A O 1 ATOM 373 C CB . LYS A 1 49 ? 31.727 -29.026 -8.323 1.00 21.17 ? 49 LYS A CB 1 ATOM 374 C CG . LYS A 1 49 ? 32.710 -28.265 -7.412 1.00 19.59 ? 49 LYS A CG 1 ATOM 375 C CD . LYS A 1 49 ? 33.989 -29.071 -7.173 1.00 23.97 ? 49 LYS A CD 1 ATOM 376 C CE . LYS A 1 49 ? 35.047 -28.249 -6.461 1.00 20.67 ? 49 LYS A CE 1 ATOM 377 N NZ . LYS A 1 49 ? 34.568 -27.778 -5.143 1.00 32.03 ? 49 LYS A NZ 1 ATOM 378 N N . TYR A 1 50 ? 28.827 -28.367 -7.051 1.00 34.14 ? 50 TYR A N 1 ATOM 379 C CA . TYR A 1 50 ? 28.028 -27.917 -5.910 1.00 35.24 ? 50 TYR A CA 1 ATOM 380 C C . TYR A 1 50 ? 27.418 -26.534 -6.143 1.00 25.13 ? 50 TYR A C 1 ATOM 381 O O . TYR A 1 50 ? 27.628 -25.610 -5.367 1.00 22.03 ? 50 TYR A O 1 ATOM 382 C CB . TYR A 1 50 ? 28.825 -27.987 -4.601 1.00 18.69 ? 50 TYR A CB 1 ATOM 383 C CG . TYR A 1 50 ? 29.180 -29.406 -4.231 1.00 22.83 ? 50 TYR A CG 1 ATOM 384 C CD1 . TYR A 1 50 ? 28.250 -30.240 -3.599 1.00 24.99 ? 50 TYR A CD1 1 ATOM 385 C CD2 . TYR A 1 50 ? 30.435 -29.929 -4.530 1.00 21.77 ? 50 TYR A CD2 1 ATOM 386 C CE1 . TYR A 1 50 ? 28.568 -31.559 -3.273 1.00 18.56 ? 50 TYR A CE1 1 ATOM 387 C CE2 . TYR A 1 50 ? 30.765 -31.232 -4.204 1.00 25.27 ? 50 TYR A CE2 1 ATOM 388 C CZ . TYR A 1 50 ? 29.829 -32.045 -3.583 1.00 27.13 ? 50 TYR A CZ 1 ATOM 389 O OH . TYR A 1 50 ? 30.163 -33.342 -3.274 1.00 24.78 ? 50 TYR A OH 1 ATOM 390 N N . ALA A 1 51 ? 26.689 -26.418 -7.246 1.00 20.49 ? 51 ALA A N 1 ATOM 391 C CA . ALA A 1 51 ? 25.885 -25.239 -7.561 1.00 28.43 ? 51 ALA A CA 1 ATOM 392 C C . ALA A 1 51 ? 26.670 -23.996 -7.930 1.00 28.48 ? 51 ALA A C 1 ATOM 393 O O . ALA A 1 51 ? 26.357 -23.366 -8.934 1.00 23.20 ? 51 ALA A O 1 ATOM 394 C CB . ALA A 1 51 ? 24.855 -24.926 -6.437 1.00 25.66 ? 51 ALA A CB 1 ATOM 395 N N . SER A 1 52 ? 27.679 -23.646 -7.134 1.00 23.56 ? 52 SER A N 1 ATOM 396 C CA . SER A 1 52 ? 28.332 -22.349 -7.292 1.00 27.58 ? 52 SER A CA 1 ATOM 397 C C . SER A 1 52 ? 29.854 -22.370 -7.223 1.00 27.50 ? 52 SER A C 1 ATOM 398 O O . SER A 1 52 ? 30.497 -21.346 -7.463 1.00 24.29 ? 52 SER A O 1 ATOM 399 C CB . SER A 1 52 ? 27.813 -21.371 -6.230 1.00 28.95 ? 52 SER A CB 1 ATOM 400 O OG . SER A 1 52 ? 28.033 -21.875 -4.919 1.00 27.63 ? 52 SER A OG 1 ATOM 401 N N . GLU A 1 53 ? 30.430 -23.514 -6.877 1.00 26.43 ? 53 GLU A N 1 ATOM 402 C CA . GLU A 1 53 ? 31.878 -23.588 -6.657 1.00 24.73 ? 53 GLU A CA 1 ATOM 403 C C . GLU A 1 53 ? 32.680 -23.693 -7.959 1.00 28.85 ? 53 GLU A C 1 ATOM 404 O O . GLU A 1 53 ? 32.330 -24.458 -8.873 1.00 24.78 ? 53 GLU A O 1 ATOM 405 C CB . GLU A 1 53 ? 32.219 -24.751 -5.727 1.00 22.23 ? 53 GLU A CB 1 ATOM 406 C CG . GLU A 1 53 ? 31.428 -24.731 -4.443 1.00 33.15 ? 53 GLU A CG 1 ATOM 407 C CD . GLU A 1 53 ? 31.867 -25.812 -3.496 1.00 34.63 ? 53 GLU A CD 1 ATOM 408 O OE1 . GLU A 1 53 ? 32.622 -26.699 -3.949 1.00 32.89 ? 53 GLU A OE1 1 ATOM 409 O OE2 . GLU A 1 53 ? 31.461 -25.780 -2.313 1.00 40.14 ? 53 GLU A OE2 1 ATOM 410 N N . SER A 1 54 ? 33.765 -22.932 -8.037 1.00 24.75 ? 54 SER A N 1 ATOM 411 C CA . SER A 1 54 ? 34.521 -22.861 -9.276 1.00 28.06 ? 54 SER A CA 1 ATOM 412 C C . SER A 1 54 ? 35.442 -24.060 -9.484 1.00 31.47 ? 54 SER A C 1 ATOM 413 O O . SER A 1 54 ? 35.782 -24.779 -8.547 1.00 32.39 ? 54 SER A O 1 ATOM 414 C CB . SER A 1 54 ? 35.313 -21.558 -9.364 1.00 32.22 ? 54 SER A CB 1 ATOM 415 O OG . SER A 1 54 ? 36.504 -21.670 -8.621 1.00 40.23 ? 54 SER A OG 1 ATOM 416 N N . ILE A 1 55 ? 35.831 -24.257 -10.738 1.00 31.15 ? 55 ILE A N 1 ATOM 417 C CA . ILE A 1 55 ? 36.676 -25.361 -11.146 1.00 23.65 ? 55 ILE A CA 1 ATOM 418 C C . ILE A 1 55 ? 37.936 -24.761 -11.736 1.00 29.04 ? 55 ILE A C 1 ATOM 419 O O . ILE A 1 55 ? 37.865 -23.778 -12.486 1.00 35.49 ? 55 ILE A O 1 ATOM 420 C CB . ILE A 1 55 ? 35.960 -26.196 -12.228 1.00 27.92 ? 55 ILE A CB 1 ATOM 421 C CG1 . ILE A 1 55 ? 34.666 -26.808 -11.665 1.00 27.66 ? 55 ILE A CG1 1 ATOM 422 C CG2 . ILE A 1 55 ? 36.900 -27.254 -12.834 1.00 20.69 ? 55 ILE A CG2 1 ATOM 423 C CD1 . ILE A 1 55 ? 34.859 -27.632 -10.401 1.00 24.90 ? 55 ILE A CD1 1 ATOM 424 N N . SER A 1 56 ? 39.090 -25.326 -11.394 1.00 28.34 ? 56 SER A N 1 ATOM 425 C CA . SER A 1 56 ? 40.360 -24.849 -11.952 1.00 32.49 ? 56 SER A CA 1 ATOM 426 C C . SER A 1 56 ? 40.403 -24.929 -13.485 1.00 33.54 ? 56 SER A C 1 ATOM 427 O O . SER A 1 56 ? 39.981 -25.926 -14.073 1.00 38.98 ? 56 SER A O 1 ATOM 428 C CB . SER A 1 56 ? 41.530 -25.641 -11.370 1.00 40.08 ? 56 SER A CB 1 ATOM 429 O OG . SER A 1 56 ? 42.613 -25.662 -12.289 1.00 50.81 ? 56 SER A OG 1 ATOM 430 N N . GLY A 1 57 ? 40.909 -23.879 -14.128 1.00 30.88 ? 57 GLY A N 1 ATOM 431 C CA . GLY A 1 57 ? 41.028 -23.865 -15.578 1.00 29.05 ? 57 GLY A CA 1 ATOM 432 C C . GLY A 1 57 ? 39.781 -23.447 -16.355 1.00 32.49 ? 57 GLY A C 1 ATOM 433 O O . GLY A 1 57 ? 39.824 -23.300 -17.575 1.00 39.05 ? 57 GLY A O 1 ATOM 434 N N . ILE A 1 58 ? 38.666 -23.263 -15.657 1.00 34.15 ? 58 ILE A N 1 ATOM 435 C CA . ILE A 1 58 ? 37.429 -22.806 -16.284 1.00 27.50 ? 58 ILE A CA 1 ATOM 436 C C . ILE A 1 58 ? 37.379 -21.282 -16.219 1.00 26.91 ? 58 ILE A C 1 ATOM 437 O O . ILE A 1 58 ? 37.577 -20.708 -15.156 1.00 28.97 ? 58 ILE A O 1 ATOM 438 C CB . ILE A 1 58 ? 36.189 -23.408 -15.575 1.00 24.16 ? 58 ILE A CB 1 ATOM 439 C CG1 . ILE A 1 58 ? 36.209 -24.937 -15.661 1.00 22.70 ? 58 ILE A CG1 1 ATOM 440 C CG2 . ILE A 1 58 ? 34.886 -22.859 -16.159 1.00 23.89 ? 58 ILE A CG2 1 ATOM 441 C CD1 . ILE A 1 58 ? 36.261 -25.473 -17.085 1.00 20.83 ? 58 ILE A CD1 1 ATOM 442 N N . PRO A 1 59 ? 37.121 -20.623 -17.357 1.00 28.45 ? 59 PRO A N 1 ATOM 443 C CA . PRO A 1 59 ? 37.070 -19.155 -17.429 1.00 31.16 ? 59 PRO A CA 1 ATOM 444 C C . PRO A 1 59 ? 36.133 -18.554 -16.385 1.00 34.22 ? 59 PRO A C 1 ATOM 445 O O . PRO A 1 59 ? 35.138 -19.182 -16.025 1.00 37.40 ? 59 PRO A O 1 ATOM 446 C CB . PRO A 1 59 ? 36.525 -18.894 -18.841 1.00 33.08 ? 59 PRO A CB 1 ATOM 447 C CG . PRO A 1 59 ? 36.993 -20.067 -19.629 1.00 34.04 ? 59 PRO A CG 1 ATOM 448 C CD . PRO A 1 59 ? 36.913 -21.246 -18.677 1.00 30.61 ? 59 PRO A CD 1 ATOM 449 N N . SER A 1 60 ? 36.441 -17.352 -15.913 1.00 34.21 ? 60 SER A N 1 ATOM 450 C CA . SER A 1 60 ? 35.675 -16.744 -14.831 1.00 35.21 ? 60 SER A CA 1 ATOM 451 C C . SER A 1 60 ? 34.244 -16.382 -15.238 1.00 35.38 ? 60 SER A C 1 ATOM 452 O O . SER A 1 60 ? 33.381 -16.145 -14.382 1.00 33.78 ? 60 SER A O 1 ATOM 453 C CB . SER A 1 60 ? 36.383 -15.487 -14.337 1.00 30.22 ? 60 SER A CB 1 ATOM 454 O OG . SER A 1 60 ? 36.263 -14.454 -15.301 1.00 36.66 ? 60 SER A OG 1 ATOM 455 N N . ARG A 1 61 ? 33.992 -16.331 -16.542 1.00 34.17 ? 61 ARG A N 1 ATOM 456 C CA . ARG A 1 61 ? 32.694 -15.891 -17.024 1.00 26.37 ? 61 ARG A CA 1 ATOM 457 C C . ARG A 1 61 ? 31.599 -16.903 -16.735 1.00 29.42 ? 61 ARG A C 1 ATOM 458 O O . ARG A 1 61 ? 30.420 -16.567 -16.785 1.00 24.23 ? 61 ARG A O 1 ATOM 459 C CB . ARG A 1 61 ? 32.738 -15.550 -18.513 1.00 26.89 ? 61 ARG A CB 1 ATOM 460 C CG . ARG A 1 61 ? 32.868 -16.736 -19.440 1.00 35.13 ? 61 ARG A CG 1 ATOM 461 C CD . ARG A 1 61 ? 32.952 -16.255 -20.891 1.00 38.95 ? 61 ARG A CD 1 ATOM 462 N NE . ARG A 1 61 ? 33.257 -17.358 -21.787 1.00 36.69 ? 61 ARG A NE 1 ATOM 463 C CZ . ARG A 1 61 ? 34.487 -17.688 -22.155 1.00 34.06 ? 61 ARG A CZ 1 ATOM 464 N NH1 . ARG A 1 61 ? 35.518 -16.972 -21.724 1.00 29.45 ? 61 ARG A NH1 1 ATOM 465 N NH2 . ARG A 1 61 ? 34.682 -18.726 -22.963 1.00 33.68 ? 61 ARG A NH2 1 ATOM 466 N N . PHE A 1 62 ? 31.997 -18.136 -16.434 1.00 23.65 ? 62 PHE A N 1 ATOM 467 C CA . PHE A 1 62 ? 31.062 -19.160 -15.996 1.00 22.39 ? 62 PHE A CA 1 ATOM 468 C C . PHE A 1 62 ? 30.799 -19.067 -14.488 1.00 27.36 ? 62 PHE A C 1 ATOM 469 O O . PHE A 1 62 ? 31.745 -18.996 -13.705 1.00 29.22 ? 62 PHE A O 1 ATOM 470 C CB . PHE A 1 62 ? 31.606 -20.548 -16.332 1.00 23.37 ? 62 PHE A CB 1 ATOM 471 C CG . PHE A 1 62 ? 31.630 -20.843 -17.790 1.00 21.81 ? 62 PHE A CG 1 ATOM 472 C CD1 . PHE A 1 62 ? 30.550 -21.442 -18.400 1.00 21.00 ? 62 PHE A CD1 1 ATOM 473 C CD2 . PHE A 1 62 ? 32.732 -20.512 -18.559 1.00 25.20 ? 62 PHE A CD2 1 ATOM 474 C CE1 . PHE A 1 62 ? 30.565 -21.702 -19.760 1.00 27.04 ? 62 PHE A CE1 1 ATOM 475 C CE2 . PHE A 1 62 ? 32.757 -20.770 -19.916 1.00 26.31 ? 62 PHE A CE2 1 ATOM 476 C CZ . PHE A 1 62 ? 31.670 -21.363 -20.519 1.00 26.66 ? 62 PHE A CZ 1 ATOM 477 N N . SER A 1 63 ? 29.523 -19.064 -14.092 1.00 21.28 ? 63 SER A N 1 ATOM 478 C CA . SER A 1 63 ? 29.132 -19.198 -12.682 1.00 21.37 ? 63 SER A CA 1 ATOM 479 C C . SER A 1 63 ? 27.813 -19.961 -12.541 1.00 29.95 ? 63 SER A C 1 ATOM 480 O O . SER A 1 63 ? 27.103 -20.191 -13.523 1.00 29.14 ? 63 SER A O 1 ATOM 481 C CB . SER A 1 63 ? 29.029 -17.829 -11.984 1.00 23.17 ? 63 SER A CB 1 ATOM 482 O OG . SER A 1 63 ? 27.958 -17.043 -12.485 1.00 26.07 ? 63 SER A OG 1 ATOM 483 N N . GLY A 1 64 ? 27.492 -20.360 -11.316 1.00 25.74 ? 64 GLY A N 1 ATOM 484 C CA . GLY A 1 64 ? 26.229 -21.022 -11.040 1.00 19.89 ? 64 GLY A CA 1 ATOM 485 C C . GLY A 1 64 ? 25.607 -20.574 -9.726 1.00 24.95 ? 64 GLY A C 1 ATOM 486 O O . GLY A 1 64 ? 26.312 -20.178 -8.802 1.00 28.37 ? 64 GLY A O 1 ATOM 487 N N . SER A 1 65 ? 24.283 -20.629 -9.638 1.00 27.87 ? 65 SER A N 1 ATOM 488 C CA . SER A 1 65 ? 23.594 -20.341 -8.380 1.00 28.61 ? 65 SER A CA 1 ATOM 489 C C . SER A 1 65 ? 22.413 -21.297 -8.158 1.00 27.07 ? 65 SER A C 1 ATOM 490 O O . SER A 1 65 ? 22.147 -22.171 -8.984 1.00 31.78 ? 65 SER A O 1 ATOM 491 C CB . SER A 1 65 ? 23.152 -18.873 -8.316 1.00 23.85 ? 65 SER A CB 1 ATOM 492 O OG . SER A 1 65 ? 22.289 -18.551 -9.385 1.00 40.44 ? 65 SER A OG 1 ATOM 493 N N . GLY A 1 66 ? 21.720 -21.139 -7.037 1.00 28.29 ? 66 GLY A N 1 ATOM 494 C CA . GLY A 1 66 ? 20.551 -21.951 -6.751 1.00 33.91 ? 66 GLY A CA 1 ATOM 495 C C . GLY A 1 66 ? 20.685 -22.888 -5.559 1.00 35.91 ? 66 GLY A C 1 ATOM 496 O O . GLY A 1 66 ? 21.792 -23.209 -5.116 1.00 31.21 ? 66 GLY A O 1 ATOM 497 N N . SER A 1 67 ? 19.539 -23.320 -5.043 1.00 36.56 ? 67 SER A N 1 ATOM 498 C CA . SER A 1 67 ? 19.476 -24.317 -3.978 1.00 35.89 ? 67 SER A CA 1 ATOM 499 C C . SER A 1 67 ? 18.072 -24.901 -3.917 1.00 39.81 ? 67 SER A C 1 ATOM 500 O O . SER A 1 67 ? 17.108 -24.261 -4.352 1.00 45.77 ? 67 SER A O 1 ATOM 501 C CB . SER A 1 67 ? 19.816 -23.686 -2.637 1.00 31.06 ? 67 SER A CB 1 ATOM 502 O OG . SER A 1 67 ? 19.012 -22.543 -2.448 1.00 39.54 ? 67 SER A OG 1 ATOM 503 N N . GLY A 1 68 ? 17.953 -26.109 -3.373 1.00 34.79 ? 68 GLY A N 1 ATOM 504 C CA . GLY A 1 68 ? 16.667 -26.776 -3.317 1.00 24.68 ? 68 GLY A CA 1 ATOM 505 C C . GLY A 1 68 ? 16.337 -27.410 -4.655 1.00 34.82 ? 68 GLY A C 1 ATOM 506 O O . GLY A 1 68 ? 16.846 -28.484 -4.975 1.00 32.69 ? 68 GLY A O 1 ATOM 507 N N . THR A 1 69 ? 15.505 -26.747 -5.456 1.00 23.90 ? 69 THR A N 1 ATOM 508 C CA . THR A 1 69 ? 15.081 -27.340 -6.722 1.00 33.24 ? 69 THR A CA 1 ATOM 509 C C . THR A 1 69 ? 15.439 -26.526 -7.972 1.00 33.45 ? 69 THR A C 1 ATOM 510 O O . THR A 1 69 ? 15.492 -27.067 -9.075 1.00 34.40 ? 69 THR A O 1 ATOM 511 C CB . THR A 1 69 ? 13.572 -27.611 -6.722 1.00 31.33 ? 69 THR A CB 1 ATOM 512 O OG1 . THR A 1 69 ? 12.872 -26.370 -6.577 1.00 36.08 ? 69 THR A OG1 1 ATOM 513 C CG2 . THR A 1 69 ? 13.197 -28.550 -5.581 1.00 25.43 ? 69 THR A CG2 1 ATOM 514 N N . ASP A 1 70 ? 15.692 -25.233 -7.795 1.00 31.84 ? 70 ASP A N 1 ATOM 515 C CA . ASP A 1 70 ? 15.871 -24.327 -8.922 1.00 27.81 ? 70 ASP A CA 1 ATOM 516 C C . ASP A 1 70 ? 17.321 -23.843 -9.009 1.00 23.89 ? 70 ASP A C 1 ATOM 517 O O . ASP A 1 70 ? 17.842 -23.243 -8.076 1.00 30.88 ? 70 ASP A O 1 ATOM 518 C CB . ASP A 1 70 ? 14.897 -23.157 -8.797 1.00 30.44 ? 70 ASP A CB 1 ATOM 519 C CG . ASP A 1 70 ? 14.812 -22.322 -10.058 1.00 41.81 ? 70 ASP A CG 1 ATOM 520 O OD1 . ASP A 1 70 ? 15.338 -22.760 -11.107 1.00 50.52 ? 70 ASP A OD1 1 ATOM 521 O OD2 . ASP A 1 70 ? 14.206 -21.228 -9.997 1.00 37.24 ? 70 ASP A OD2 1 ATOM 522 N N . PHE A 1 71 ? 17.969 -24.126 -10.135 1.00 25.39 ? 71 PHE A N 1 ATOM 523 C CA . PHE A 1 71 ? 19.405 -23.894 -10.290 1.00 24.49 ? 71 PHE A CA 1 ATOM 524 C C . PHE A 1 71 ? 19.720 -23.204 -11.595 1.00 30.08 ? 71 PHE A C 1 ATOM 525 O O . PHE A 1 71 ? 19.031 -23.396 -12.610 1.00 34.02 ? 71 PHE A O 1 ATOM 526 C CB . PHE A 1 71 ? 20.178 -25.213 -10.227 1.00 22.92 ? 71 PHE A CB 1 ATOM 527 C CG . PHE A 1 71 ? 20.047 -25.924 -8.913 1.00 25.71 ? 71 PHE A CG 1 ATOM 528 C CD1 . PHE A 1 71 ? 20.860 -25.582 -7.843 1.00 21.93 ? 71 PHE A CD1 1 ATOM 529 C CD2 . PHE A 1 71 ? 19.097 -26.919 -8.741 1.00 21.42 ? 71 PHE A CD2 1 ATOM 530 C CE1 . PHE A 1 71 ? 20.744 -26.234 -6.629 1.00 21.91 ? 71 PHE A CE1 1 ATOM 531 C CE2 . PHE A 1 71 ? 18.969 -27.567 -7.538 1.00 23.17 ? 71 PHE A CE2 1 ATOM 532 C CZ . PHE A 1 71 ? 19.795 -27.230 -6.474 1.00 25.13 ? 71 PHE A CZ 1 ATOM 533 N N . THR A 1 72 ? 20.779 -22.409 -11.576 1.00 30.11 ? 72 THR A N 1 ATOM 534 C CA . THR A 1 72 ? 21.102 -21.606 -12.737 1.00 25.29 ? 72 THR A CA 1 ATOM 535 C C . THR A 1 72 ? 22.588 -21.616 -13.023 1.00 24.54 ? 72 THR A C 1 ATOM 536 O O . THR A 1 72 ? 23.401 -21.329 -12.156 1.00 28.55 ? 72 THR A O 1 ATOM 537 C CB . THR A 1 72 ? 20.596 -20.152 -12.575 1.00 29.82 ? 72 THR A CB 1 ATOM 538 O OG1 . THR A 1 72 ? 19.196 -20.163 -12.245 1.00 22.08 ? 72 THR A OG1 1 ATOM 539 C CG2 . THR A 1 72 ? 20.826 -19.357 -13.862 1.00 21.47 ? 72 THR A CG2 1 ATOM 540 N N . LEU A 1 73 ? 22.926 -21.981 -14.251 1.00 26.37 ? 73 LEU A N 1 ATOM 541 C CA . LEU A 1 73 ? 24.267 -21.813 -14.775 1.00 24.81 ? 73 LEU A CA 1 ATOM 542 C C . LEU A 1 73 ? 24.248 -20.544 -15.605 1.00 25.82 ? 73 LEU A C 1 ATOM 543 O O . LEU A 1 73 ? 23.349 -20.352 -16.423 1.00 28.91 ? 73 LEU A O 1 ATOM 544 C CB . LEU A 1 73 ? 24.644 -23.003 -15.658 1.00 27.83 ? 73 LEU A CB 1 ATOM 545 C CG . LEU A 1 73 ? 25.957 -22.867 -16.429 1.00 24.95 ? 73 LEU A CG 1 ATOM 546 C CD1 . LEU A 1 73 ? 27.143 -22.839 -15.465 1.00 21.52 ? 73 LEU A CD1 1 ATOM 547 C CD2 . LEU A 1 73 ? 26.088 -23.993 -17.435 1.00 22.86 ? 73 LEU A CD2 1 ATOM 548 N N . SER A 1 74 ? 25.226 -19.671 -15.391 1.00 26.23 ? 74 SER A N 1 ATOM 549 C CA . SER A 1 74 ? 25.282 -18.409 -16.119 1.00 23.04 ? 74 SER A CA 1 ATOM 550 C C . SER A 1 74 ? 26.602 -18.178 -16.837 1.00 26.13 ? 74 SER A C 1 ATOM 551 O O . SER A 1 74 ? 27.659 -18.560 -16.343 1.00 27.12 ? 74 SER A O 1 ATOM 552 C CB . SER A 1 74 ? 25.017 -17.242 -15.171 1.00 29.26 ? 74 SER A CB 1 ATOM 553 O OG . SER A 1 74 ? 23.672 -17.255 -14.727 1.00 38.78 ? 74 SER A OG 1 ATOM 554 N N . ILE A 1 75 ? 26.529 -17.540 -18.003 1.00 21.91 ? 75 ILE A N 1 ATOM 555 C CA . ILE A 1 75 ? 27.719 -17.042 -18.693 1.00 30.37 ? 75 ILE A CA 1 ATOM 556 C C . ILE A 1 75 ? 27.569 -15.538 -18.885 1.00 30.01 ? 75 ILE A C 1 ATOM 557 O O . ILE A 1 75 ? 26.703 -15.093 -19.642 1.00 34.06 ? 75 ILE A O 1 ATOM 558 C CB . ILE A 1 75 ? 27.904 -17.707 -20.077 1.00 29.90 ? 75 ILE A CB 1 ATOM 559 C CG1 . ILE A 1 75 ? 27.889 -19.229 -19.956 1.00 20.46 ? 75 ILE A CG1 1 ATOM 560 C CG2 . ILE A 1 75 ? 29.203 -17.254 -20.729 1.00 27.32 ? 75 ILE A CG2 1 ATOM 561 C CD1 . ILE A 1 75 ? 27.952 -19.929 -21.291 1.00 21.29 ? 75 ILE A CD1 1 ATOM 562 N N . ASN A 1 76 ? 28.403 -14.750 -18.215 1.00 34.79 ? 76 ASN A N 1 ATOM 563 C CA . ASN A 1 76 ? 28.176 -13.300 -18.184 1.00 43.15 ? 76 ASN A CA 1 ATOM 564 C C . ASN A 1 76 ? 28.465 -12.527 -19.480 1.00 47.43 ? 76 ASN A C 1 ATOM 565 O O . ASN A 1 76 ? 27.955 -11.419 -19.663 1.00 56.77 ? 76 ASN A O 1 ATOM 566 C CB . ASN A 1 76 ? 28.834 -12.629 -16.966 1.00 54.73 ? 76 ASN A CB 1 ATOM 567 C CG . ASN A 1 76 ? 30.350 -12.704 -16.988 1.00 67.71 ? 76 ASN A CG 1 ATOM 568 O OD1 . ASN A 1 76 ? 30.962 -12.902 -18.038 1.00 73.07 ? 76 ASN A OD1 1 ATOM 569 N ND2 . ASN A 1 76 ? 30.968 -12.532 -15.817 1.00 71.85 ? 76 ASN A ND2 1 ATOM 570 N N . SER A 1 77 ? 29.273 -13.109 -20.368 1.00 39.23 ? 77 SER A N 1 ATOM 571 C CA . SER A 1 77 ? 29.553 -12.498 -21.662 1.00 34.75 ? 77 SER A CA 1 ATOM 572 C C . SER A 1 77 ? 29.964 -13.551 -22.689 1.00 46.19 ? 77 SER A C 1 ATOM 573 O O . SER A 1 77 ? 31.152 -13.843 -22.859 1.00 47.63 ? 77 SER A O 1 ATOM 574 C CB . SER A 1 77 ? 30.638 -11.437 -21.533 1.00 37.98 ? 77 SER A CB 1 ATOM 575 O OG . SER A 1 77 ? 30.663 -10.632 -22.696 1.00 53.93 ? 77 SER A OG 1 ATOM 576 N N . VAL A 1 78 ? 28.969 -14.107 -23.375 1.00 40.47 ? 78 VAL A N 1 ATOM 577 C CA . VAL A 1 78 ? 29.155 -15.274 -24.232 1.00 34.12 ? 78 VAL A CA 1 ATOM 578 C C . VAL A 1 78 ? 30.174 -15.038 -25.339 1.00 35.59 ? 78 VAL A C 1 ATOM 579 O O . VAL A 1 78 ? 30.198 -13.981 -25.965 1.00 39.71 ? 78 VAL A O 1 ATOM 580 C CB . VAL A 1 78 ? 27.798 -15.751 -24.821 1.00 36.90 ? 78 VAL A CB 1 ATOM 581 C CG1 . VAL A 1 78 ? 27.994 -16.714 -25.974 1.00 39.80 ? 78 VAL A CG1 1 ATOM 582 C CG2 . VAL A 1 78 ? 26.979 -16.406 -23.752 1.00 25.44 ? 78 VAL A CG2 1 ATOM 583 N N . GLU A 1 79 ? 31.038 -16.022 -25.546 1.00 35.45 ? 79 GLU A N 1 ATOM 584 C CA . GLU A 1 79 ? 31.974 -15.998 -26.654 1.00 35.73 ? 79 GLU A CA 1 ATOM 585 C C . GLU A 1 79 ? 31.646 -17.153 -27.586 1.00 33.02 ? 79 GLU A C 1 ATOM 586 O O . GLU A 1 79 ? 30.940 -18.090 -27.196 1.00 26.80 ? 79 GLU A O 1 ATOM 587 C CB . GLU A 1 79 ? 33.404 -16.091 -26.131 1.00 41.72 ? 79 GLU A CB 1 ATOM 588 C CG . GLU A 1 79 ? 33.845 -14.808 -25.450 1.00 54.69 ? 79 GLU A CG 1 ATOM 589 C CD . GLU A 1 79 ? 35.117 -14.962 -24.649 1.00 65.32 ? 79 GLU A CD 1 ATOM 590 O OE1 . GLU A 1 79 ? 35.772 -16.017 -24.770 1.00 67.28 ? 79 GLU A OE1 1 ATOM 591 O OE2 . GLU A 1 79 ? 35.460 -14.025 -23.894 1.00 72.41 ? 79 GLU A OE2 1 ATOM 592 N N . SER A 1 80 ? 32.133 -17.079 -28.821 1.00 27.79 ? 80 SER A N 1 ATOM 593 C CA . SER A 1 80 ? 31.806 -18.087 -29.825 1.00 29.40 ? 80 SER A CA 1 ATOM 594 C C . SER A 1 80 ? 32.280 -19.475 -29.423 1.00 33.05 ? 80 SER A C 1 ATOM 595 O O . SER A 1 80 ? 31.693 -20.470 -29.814 1.00 43.30 ? 80 SER A O 1 ATOM 596 C CB . SER A 1 80 ? 32.379 -17.709 -31.193 1.00 33.67 ? 80 SER A CB 1 ATOM 597 O OG . SER A 1 80 ? 33.796 -17.693 -31.174 1.00 35.05 ? 80 SER A OG 1 ATOM 598 N N . GLU A 1 81 ? 33.342 -19.537 -28.631 1.00 29.49 ? 81 GLU A N 1 ATOM 599 C CA A GLU A 1 81 ? 33.880 -20.811 -28.183 0.37 28.10 ? 81 GLU A CA 1 ATOM 600 C CA B GLU A 1 81 ? 33.882 -20.807 -28.188 0.63 27.62 ? 81 GLU A CA 1 ATOM 601 C C . GLU A 1 81 ? 32.939 -21.470 -27.186 1.00 28.76 ? 81 GLU A C 1 ATOM 602 O O . GLU A 1 81 ? 33.151 -22.614 -26.799 1.00 35.70 ? 81 GLU A O 1 ATOM 603 C CB A GLU A 1 81 ? 35.257 -20.621 -27.544 0.37 32.15 ? 81 GLU A CB 1 ATOM 604 C CB B GLU A 1 81 ? 35.276 -20.616 -27.579 0.63 32.11 ? 81 GLU A CB 1 ATOM 605 C CG A GLU A 1 81 ? 35.217 -19.835 -26.243 0.37 35.19 ? 81 GLU A CG 1 ATOM 606 C CG B GLU A 1 81 ? 36.354 -20.132 -28.561 0.63 37.06 ? 81 GLU A CG 1 ATOM 607 C CD A GLU A 1 81 ? 36.590 -19.554 -25.676 0.37 40.33 ? 81 GLU A CD 1 ATOM 608 C CD B GLU A 1 81 ? 36.288 -18.639 -28.862 0.63 42.64 ? 81 GLU A CD 1 ATOM 609 O OE1 A GLU A 1 81 ? 37.570 -20.183 -26.121 0.37 46.36 ? 81 GLU A OE1 1 ATOM 610 O OE1 B GLU A 1 81 ? 35.567 -17.905 -28.148 0.63 38.82 ? 81 GLU A OE1 1 ATOM 611 O OE2 A GLU A 1 81 ? 36.691 -18.698 -24.779 0.37 43.59 ? 81 GLU A OE2 1 ATOM 612 O OE2 B GLU A 1 81 ? 36.965 -18.202 -29.822 0.63 47.96 ? 81 GLU A OE2 1 ATOM 613 N N . ASP A 1 82 ? 31.894 -20.749 -26.767 1.00 26.02 ? 82 ASP A N 1 ATOM 614 C CA . ASP A 1 82 ? 30.925 -21.305 -25.814 1.00 23.84 ? 82 ASP A CA 1 ATOM 615 C C . ASP A 1 82 ? 29.851 -22.140 -26.486 1.00 20.93 ? 82 ASP A C 1 ATOM 616 O O . ASP A 1 82 ? 29.044 -22.772 -25.795 1.00 27.44 ? 82 ASP A O 1 ATOM 617 C CB . ASP A 1 82 ? 30.239 -20.213 -24.975 1.00 23.98 ? 82 ASP A CB 1 ATOM 618 C CG . ASP A 1 82 ? 31.211 -19.441 -24.101 1.00 27.64 ? 82 ASP A CG 1 ATOM 619 O OD1 . ASP A 1 82 ? 32.266 -20.011 -23.747 1.00 24.36 ? 82 ASP A OD1 1 ATOM 620 O OD2 . ASP A 1 82 ? 30.918 -18.260 -23.775 1.00 29.19 ? 82 ASP A OD2 1 ATOM 621 N N . ILE A 1 83 ? 29.805 -22.100 -27.817 1.00 20.89 ? 83 ILE A N 1 ATOM 622 C CA . ILE A 1 83 ? 28.910 -22.960 -28.588 1.00 24.71 ? 83 ILE A CA 1 ATOM 623 C C . ILE A 1 83 ? 29.065 -24.428 -28.158 1.00 20.94 ? 83 ILE A C 1 ATOM 624 O O . ILE A 1 83 ? 30.121 -25.039 -28.343 1.00 25.04 ? 83 ILE A O 1 ATOM 625 C CB . ILE A 1 83 ? 29.146 -22.800 -30.107 1.00 30.45 ? 83 ILE A CB 1 ATOM 626 C CG1 . ILE A 1 83 ? 28.721 -21.394 -30.549 1.00 38.27 ? 83 ILE A CG1 1 ATOM 627 C CG2 . ILE A 1 83 ? 28.372 -23.860 -30.886 1.00 31.98 ? 83 ILE A CG2 1 ATOM 628 C CD1 . ILE A 1 83 ? 29.231 -20.938 -31.932 1.00 36.08 ? 83 ILE A CD1 1 ATOM 629 N N . ALA A 1 84 ? 28.007 -24.972 -27.570 1.00 20.38 ? 84 ALA A N 1 ATOM 630 C CA . ALA A 1 84 ? 28.048 -26.292 -26.946 1.00 20.09 ? 84 ALA A CA 1 ATOM 631 C C . ALA A 1 84 ? 26.683 -26.668 -26.374 1.00 22.54 ? 84 ALA A C 1 ATOM 632 O O . ALA A 1 84 ? 25.747 -25.861 -26.367 1.00 18.04 ? 84 ALA A O 1 ATOM 633 C CB . ALA A 1 84 ? 29.080 -26.312 -25.823 1.00 17.30 ? 84 ALA A CB 1 ATOM 634 N N . ASP A 1 85 ? 26.582 -27.893 -25.872 1.00 16.34 ? 85 ASP A N 1 ATOM 635 C CA . ASP A 1 85 ? 25.464 -28.248 -25.009 1.00 15.66 ? 85 ASP A CA 1 ATOM 636 C C . ASP A 1 85 ? 25.881 -28.153 -23.537 1.00 18.99 ? 85 ASP A C 1 ATOM 637 O O . ASP A 1 85 ? 27.062 -28.248 -23.200 1.00 17.10 ? 85 ASP A O 1 ATOM 638 C CB . ASP A 1 85 ? 24.927 -29.640 -25.355 1.00 16.24 ? 85 ASP A CB 1 ATOM 639 C CG . ASP A 1 85 ? 24.588 -29.776 -26.824 1.00 26.80 ? 85 ASP A CG 1 ATOM 640 O OD1 . ASP A 1 85 ? 24.020 -28.815 -27.399 1.00 29.66 ? 85 ASP A OD1 1 ATOM 641 O OD2 . ASP A 1 85 ? 24.904 -30.834 -27.408 1.00 27.06 ? 85 ASP A OD2 1 ATOM 642 N N . TYR A 1 86 ? 24.907 -27.950 -22.660 1.00 25.38 ? 86 TYR A N 1 ATOM 643 C CA . TYR A 1 86 ? 25.192 -27.802 -21.239 1.00 19.85 ? 86 TYR A CA 1 ATOM 644 C C . TYR A 1 86 ? 24.281 -28.679 -20.405 1.00 23.28 ? 86 TYR A C 1 ATOM 645 O O . TYR A 1 86 ? 23.061 -28.668 -20.577 1.00 24.87 ? 86 TYR A O 1 ATOM 646 C CB . TYR A 1 86 ? 25.062 -26.341 -20.829 1.00 18.63 ? 86 TYR A CB 1 ATOM 647 C CG . TYR A 1 86 ? 26.118 -25.484 -21.469 1.00 21.32 ? 86 TYR A CG 1 ATOM 648 C CD1 . TYR A 1 86 ? 25.936 -24.954 -22.743 1.00 20.90 ? 86 TYR A CD1 1 ATOM 649 C CD2 . TYR A 1 86 ? 27.312 -25.224 -20.812 1.00 20.23 ? 86 TYR A CD2 1 ATOM 650 C CE1 . TYR A 1 86 ? 26.921 -24.187 -23.339 1.00 22.79 ? 86 TYR A CE1 1 ATOM 651 C CE2 . TYR A 1 86 ? 28.290 -24.450 -21.394 1.00 21.96 ? 86 TYR A CE2 1 ATOM 652 C CZ . TYR A 1 86 ? 28.096 -23.939 -22.656 1.00 23.21 ? 86 TYR A CZ 1 ATOM 653 O OH . TYR A 1 86 ? 29.087 -23.179 -23.228 1.00 20.57 ? 86 TYR A OH 1 ATOM 654 N N . TYR A 1 87 ? 24.886 -29.439 -19.499 1.00 21.28 ? 87 TYR A N 1 ATOM 655 C CA . TYR A 1 87 ? 24.151 -30.424 -18.709 1.00 16.15 ? 87 TYR A CA 1 ATOM 656 C C . TYR A 1 87 ? 24.307 -30.177 -17.218 1.00 20.62 ? 87 TYR A C 1 ATOM 657 O O . TYR A 1 87 ? 25.356 -29.727 -16.744 1.00 16.06 ? 87 TYR A O 1 ATOM 658 C CB . TYR A 1 87 ? 24.648 -31.839 -19.015 1.00 14.35 ? 87 TYR A CB 1 ATOM 659 C CG . TYR A 1 87 ? 24.428 -32.306 -20.442 1.00 21.01 ? 87 TYR A CG 1 ATOM 660 C CD1 . TYR A 1 87 ? 23.267 -32.981 -20.806 1.00 19.32 ? 87 TYR A CD1 1 ATOM 661 C CD2 . TYR A 1 87 ? 25.391 -32.088 -21.420 1.00 17.96 ? 87 TYR A CD2 1 ATOM 662 C CE1 . TYR A 1 87 ? 23.068 -33.414 -22.103 1.00 23.04 ? 87 TYR A CE1 1 ATOM 663 C CE2 . TYR A 1 87 ? 25.205 -32.521 -22.716 1.00 17.38 ? 87 TYR A CE2 1 ATOM 664 C CZ . TYR A 1 87 ? 24.043 -33.182 -23.054 1.00 21.33 ? 87 TYR A CZ 1 ATOM 665 O OH . TYR A 1 87 ? 23.867 -33.610 -24.348 1.00 23.56 ? 87 TYR A OH 1 ATOM 666 N N . CYS A 1 88 ? 23.254 -30.488 -16.477 1.00 20.40 ? 88 CYS A N 1 ATOM 667 C CA . CYS A 1 88 ? 23.347 -30.508 -15.031 1.00 17.49 ? 88 CYS A CA 1 ATOM 668 C C . CYS A 1 88 ? 23.347 -31.951 -14.554 1.00 18.57 ? 88 CYS A C 1 ATOM 669 O O . CYS A 1 88 ? 22.944 -32.858 -15.285 1.00 26.18 ? 88 CYS A O 1 ATOM 670 C CB . CYS A 1 88 ? 22.223 -29.693 -14.380 1.00 19.41 ? 88 CYS A CB 1 ATOM 671 S SG . CYS A 1 88 ? 20.547 -30.172 -14.848 1.00 35.82 ? 88 CYS A SG 1 ATOM 672 N N . GLN A 1 89 ? 23.832 -32.148 -13.334 1.00 20.38 ? 89 GLN A N 1 ATOM 673 C CA . GLN A 1 89 ? 23.948 -33.462 -12.717 1.00 15.08 ? 89 GLN A CA 1 ATOM 674 C C . GLN A 1 89 ? 23.611 -33.285 -11.247 1.00 17.86 ? 89 GLN A C 1 ATOM 675 O O . GLN A 1 89 ? 24.098 -32.345 -10.622 1.00 18.52 ? 89 GLN A O 1 ATOM 676 C CB . GLN A 1 89 ? 25.390 -33.976 -12.854 1.00 20.33 ? 89 GLN A CB 1 ATOM 677 C CG . GLN A 1 89 ? 25.657 -35.325 -12.169 1.00 19.19 ? 89 GLN A CG 1 ATOM 678 C CD . GLN A 1 89 ? 27.130 -35.532 -11.813 1.00 20.42 ? 89 GLN A CD 1 ATOM 679 O OE1 . GLN A 1 89 ? 27.966 -34.662 -12.062 1.00 21.58 ? 89 GLN A OE1 1 ATOM 680 N NE2 . GLN A 1 89 ? 27.449 -36.687 -11.221 1.00 18.72 ? 89 GLN A NE2 1 ATOM 681 N N . GLN A 1 90 ? 22.760 -34.147 -10.692 1.00 19.73 ? 90 GLN A N 1 ATOM 682 C CA . GLN A 1 90 ? 22.514 -34.115 -9.244 1.00 19.60 ? 90 GLN A CA 1 ATOM 683 C C . GLN A 1 90 ? 23.161 -35.315 -8.575 1.00 22.52 ? 90 GLN A C 1 ATOM 684 O O . GLN A 1 90 ? 23.200 -36.407 -9.139 1.00 23.82 ? 90 GLN A O 1 ATOM 685 C CB . GLN A 1 90 ? 21.021 -34.051 -8.905 1.00 17.02 ? 90 GLN A CB 1 ATOM 686 C CG . GLN A 1 90 ? 20.222 -35.325 -9.178 1.00 21.50 ? 90 GLN A CG 1 ATOM 687 C CD . GLN A 1 90 ? 20.423 -36.437 -8.135 1.00 22.12 ? 90 GLN A CD 1 ATOM 688 O OE1 . GLN A 1 90 ? 20.687 -36.179 -6.955 1.00 18.24 ? 90 GLN A OE1 1 ATOM 689 N NE2 . GLN A 1 90 ? 20.317 -37.679 -8.586 1.00 23.77 ? 90 GLN A NE2 1 ATOM 690 N N . ASN A 1 91 ? 23.671 -35.116 -7.370 1.00 21.10 ? 91 ASN A N 1 ATOM 691 C CA . ASN A 1 91 ? 24.186 -36.240 -6.599 1.00 20.99 ? 91 ASN A CA 1 ATOM 692 C C . ASN A 1 91 ? 23.805 -36.164 -5.114 1.00 27.57 ? 91 ASN A C 1 ATOM 693 O O . ASN A 1 91 ? 24.596 -36.496 -4.224 1.00 26.98 ? 91 ASN A O 1 ATOM 694 C CB . ASN A 1 91 ? 25.697 -36.388 -6.767 1.00 23.00 ? 91 ASN A CB 1 ATOM 695 C CG . ASN A 1 91 ? 26.190 -37.730 -6.286 1.00 32.27 ? 91 ASN A CG 1 ATOM 696 O OD1 . ASN A 1 91 ? 25.528 -38.755 -6.494 1.00 33.29 ? 91 ASN A OD1 1 ATOM 697 N ND2 . ASN A 1 91 ? 27.331 -37.733 -5.596 1.00 30.77 ? 91 ASN A ND2 1 ATOM 698 N N . ASN A 1 92 ? 22.589 -35.710 -4.852 1.00 25.67 ? 92 ASN A N 1 ATOM 699 C CA . ASN A 1 92 ? 22.090 -35.697 -3.492 1.00 25.50 ? 92 ASN A CA 1 ATOM 700 C C . ASN A 1 92 ? 21.482 -37.059 -3.190 1.00 28.19 ? 92 ASN A C 1 ATOM 701 O O . ASN A 1 92 ? 21.436 -37.482 -2.043 1.00 23.55 ? 92 ASN A O 1 ATOM 702 C CB . ASN A 1 92 ? 21.075 -34.561 -3.302 1.00 27.17 ? 92 ASN A CB 1 ATOM 703 C CG . ASN A 1 92 ? 20.524 -34.497 -1.887 1.00 32.11 ? 92 ASN A CG 1 ATOM 704 O OD1 . ASN A 1 92 ? 21.202 -34.055 -0.959 1.00 33.94 ? 92 ASN A OD1 1 ATOM 705 N ND2 . ASN A 1 92 ? 19.284 -34.936 -1.717 1.00 35.85 ? 92 ASN A ND2 1 ATOM 706 N N . ASN A 1 93 ? 21.047 -37.742 -4.247 1.00 31.75 ? 93 ASN A N 1 ATOM 707 C CA . ASN A 1 93 ? 20.367 -39.035 -4.162 1.00 30.03 ? 93 ASN A CA 1 ATOM 708 C C . ASN A 1 93 ? 20.969 -40.018 -5.124 1.00 24.43 ? 93 ASN A C 1 ATOM 709 O O . ASN A 1 93 ? 21.040 -39.745 -6.317 1.00 22.00 ? 93 ASN A O 1 ATOM 710 C CB . ASN A 1 93 ? 18.894 -38.907 -4.548 1.00 32.05 ? 93 ASN A CB 1 ATOM 711 C CG . ASN A 1 93 ? 18.070 -38.241 -3.485 1.00 49.01 ? 93 ASN A CG 1 ATOM 712 O OD1 . ASN A 1 93 ? 18.086 -37.016 -3.348 1.00 56.06 ? 93 ASN A OD1 1 ATOM 713 N ND2 . ASN A 1 93 ? 17.328 -39.040 -2.727 1.00 56.51 ? 93 ASN A ND2 1 ATOM 714 N N . TRP A 1 94 ? 21.369 -41.174 -4.609 1.00 27.08 ? 94 TRP A N 1 ATOM 715 C CA . TRP A 1 94 ? 21.831 -42.271 -5.442 1.00 26.16 ? 94 TRP A CA 1 ATOM 716 C C . TRP A 1 94 ? 20.634 -42.839 -6.206 1.00 26.77 ? 94 TRP A C 1 ATOM 717 O O . TRP A 1 94 ? 19.570 -43.043 -5.619 1.00 23.47 ? 94 TRP A O 1 ATOM 718 C CB . TRP A 1 94 ? 22.459 -43.357 -4.561 1.00 21.99 ? 94 TRP A CB 1 ATOM 719 C CG . TRP A 1 94 ? 23.223 -44.393 -5.329 1.00 24.24 ? 94 TRP A CG 1 ATOM 720 C CD1 . TRP A 1 94 ? 24.580 -44.439 -5.537 1.00 24.04 ? 94 TRP A CD1 1 ATOM 721 C CD2 . TRP A 1 94 ? 22.675 -45.535 -5.994 1.00 28.57 ? 94 TRP A CD2 1 ATOM 722 N NE1 . TRP A 1 94 ? 24.904 -45.544 -6.292 1.00 21.78 ? 94 TRP A NE1 1 ATOM 723 C CE2 . TRP A 1 94 ? 23.754 -46.233 -6.586 1.00 25.14 ? 94 TRP A CE2 1 ATOM 724 C CE3 . TRP A 1 94 ? 21.376 -46.039 -6.148 1.00 23.87 ? 94 TRP A CE3 1 ATOM 725 C CZ2 . TRP A 1 94 ? 23.571 -47.405 -7.322 1.00 22.06 ? 94 TRP A CZ2 1 ATOM 726 C CZ3 . TRP A 1 94 ? 21.198 -47.208 -6.884 1.00 26.62 ? 94 TRP A CZ3 1 ATOM 727 C CH2 . TRP A 1 94 ? 22.290 -47.876 -7.460 1.00 21.87 ? 94 TRP A CH2 1 ATOM 728 N N . PRO A 1 95 ? 20.806 -43.098 -7.517 1.00 24.59 ? 95 PRO A N 1 ATOM 729 C CA . PRO A 1 95 ? 22.055 -42.872 -8.260 1.00 22.21 ? 95 PRO A CA 1 ATOM 730 C C . PRO A 1 95 ? 22.123 -41.475 -8.870 1.00 16.30 ? 95 PRO A C 1 ATOM 731 O O . PRO A 1 95 ? 21.090 -40.853 -9.121 1.00 24.77 ? 95 PRO A O 1 ATOM 732 C CB . PRO A 1 95 ? 21.970 -43.911 -9.383 1.00 26.10 ? 95 PRO A CB 1 ATOM 733 C CG . PRO A 1 95 ? 20.479 -43.973 -9.697 1.00 18.62 ? 95 PRO A CG 1 ATOM 734 C CD . PRO A 1 95 ? 19.785 -43.768 -8.351 1.00 19.32 ? 95 PRO A CD 1 ATOM 735 N N . THR A 1 96 ? 23.334 -40.992 -9.118 1.00 19.12 ? 96 THR A N 1 ATOM 736 C CA . THR A 1 96 ? 23.515 -39.685 -9.736 1.00 16.46 ? 96 THR A CA 1 ATOM 737 C C . THR A 1 96 ? 22.850 -39.636 -11.116 1.00 18.90 ? 96 THR A C 1 ATOM 738 O O . THR A 1 96 ? 22.934 -40.580 -11.900 1.00 20.23 ? 96 THR A O 1 ATOM 739 C CB . THR A 1 96 ? 25.001 -39.312 -9.829 1.00 18.79 ? 96 THR A CB 1 ATOM 740 O OG1 . THR A 1 96 ? 25.125 -37.948 -10.232 1.00 25.13 ? 96 THR A OG1 1 ATOM 741 C CG2 . THR A 1 96 ? 25.732 -40.195 -10.825 1.00 14.62 ? 96 THR A CG2 1 ATOM 742 N N . THR A 1 97 ? 22.144 -38.550 -11.391 1.00 22.97 ? 97 THR A N 1 ATOM 743 C CA . THR A 1 97 ? 21.397 -38.435 -12.641 1.00 23.18 ? 97 THR A CA 1 ATOM 744 C C . THR A 1 97 ? 21.692 -37.113 -13.343 1.00 20.93 ? 97 THR A C 1 ATOM 745 O O . THR A 1 97 ? 22.041 -36.123 -12.699 1.00 22.04 ? 97 THR A O 1 ATOM 746 C CB . THR A 1 97 ? 19.861 -38.569 -12.425 1.00 24.43 ? 97 THR A CB 1 ATOM 747 O OG1 . THR A 1 97 ? 19.432 -37.662 -11.403 1.00 31.59 ? 97 THR A OG1 1 ATOM 748 C CG2 . THR A 1 97 ? 19.483 -39.976 -12.021 1.00 16.74 ? 97 THR A CG2 1 ATOM 749 N N . PHE A 1 98 ? 21.548 -37.107 -14.664 1.00 19.95 ? 98 PHE A N 1 ATOM 750 C CA . PHE A 1 98 ? 21.815 -35.919 -15.470 1.00 16.30 ? 98 PHE A CA 1 ATOM 751 C C . PHE A 1 98 ? 20.547 -35.387 -16.114 1.00 22.67 ? 98 PHE A C 1 ATOM 752 O O . PHE A 1 98 ? 19.604 -36.142 -16.364 1.00 23.76 ? 98 PHE A O 1 ATOM 753 C CB . PHE A 1 98 ? 22.802 -36.250 -16.581 1.00 14.44 ? 98 PHE A CB 1 ATOM 754 C CG . PHE A 1 98 ? 24.143 -36.699 -16.093 1.00 20.55 ? 98 PHE A CG 1 ATOM 755 C CD1 . PHE A 1 98 ? 24.367 -38.031 -15.761 1.00 19.97 ? 98 PHE A CD1 1 ATOM 756 C CD2 . PHE A 1 98 ? 25.185 -35.793 -15.982 1.00 21.61 ? 98 PHE A CD2 1 ATOM 757 C CE1 . PHE A 1 98 ? 25.607 -38.452 -15.320 1.00 22.88 ? 98 PHE A CE1 1 ATOM 758 C CE2 . PHE A 1 98 ? 26.435 -36.200 -15.537 1.00 26.87 ? 98 PHE A CE2 1 ATOM 759 C CZ . PHE A 1 98 ? 26.649 -37.535 -15.205 1.00 26.32 ? 98 PHE A CZ 1 ATOM 760 N N . GLY A 1 99 ? 20.525 -34.086 -16.393 1.00 21.89 ? 99 GLY A N 1 ATOM 761 C CA . GLY A 1 99 ? 19.457 -33.509 -17.193 1.00 24.33 ? 99 GLY A CA 1 ATOM 762 C C . GLY A 1 99 ? 19.657 -33.824 -18.670 1.00 19.85 ? 99 GLY A C 1 ATOM 763 O O . GLY A 1 99 ? 20.671 -34.405 -19.063 1.00 21.83 ? 99 GLY A O 1 ATOM 764 N N . ALA A 1 100 ? 18.693 -33.435 -19.496 1.00 18.16 ? 100 ALA A N 1 ATOM 765 C CA . ALA A 1 100 ? 18.730 -33.750 -20.920 1.00 18.12 ? 100 ALA A CA 1 ATOM 766 C C . ALA A 1 100 ? 19.507 -32.720 -21.767 1.00 23.98 ? 100 ALA A C 1 ATOM 767 O O . ALA A 1 100 ? 19.603 -32.849 -22.991 1.00 28.53 ? 100 ALA A O 1 ATOM 768 C CB . ALA A 1 100 ? 17.316 -33.935 -21.448 1.00 20.65 ? 100 ALA A CB 1 ATOM 769 N N . GLY A 1 101 ? 20.047 -31.697 -21.111 1.00 22.47 ? 101 GLY A N 1 ATOM 770 C CA . GLY A 1 101 ? 20.861 -30.689 -21.775 1.00 23.94 ? 101 GLY A CA 1 ATOM 771 C C . GLY A 1 101 ? 20.125 -29.504 -22.388 1.00 24.02 ? 101 GLY A C 1 ATOM 772 O O . GLY A 1 101 ? 18.962 -29.618 -22.775 1.00 30.16 ? 101 GLY A O 1 ATOM 773 N N . THR A 1 102 ? 20.809 -28.365 -22.468 1.00 18.14 ? 102 THR A N 1 ATOM 774 C CA . THR A 1 102 ? 20.327 -27.209 -23.217 1.00 17.95 ? 102 THR A CA 1 ATOM 775 C C . THR A 1 102 ? 21.346 -26.839 -24.313 1.00 26.44 ? 102 THR A C 1 ATOM 776 O O . THR A 1 102 ? 22.549 -26.769 -24.058 1.00 22.92 ? 102 THR A O 1 ATOM 777 C CB . THR A 1 102 ? 20.094 -25.985 -22.277 1.00 26.32 ? 102 THR A CB 1 ATOM 778 O OG1 . THR A 1 102 ? 18.988 -26.247 -21.409 1.00 26.47 ? 102 THR A OG1 1 ATOM 779 C CG2 . THR A 1 102 ? 19.793 -24.725 -23.066 1.00 18.28 ? 102 THR A CG2 1 ATOM 780 N N . LYS A 1 103 ? 20.873 -26.606 -25.534 1.00 26.62 ? 103 LYS A N 1 ATOM 781 C CA . LYS A 1 103 ? 21.774 -26.259 -26.626 1.00 22.58 ? 103 LYS A CA 1 ATOM 782 C C . LYS A 1 103 ? 21.992 -24.745 -26.703 1.00 26.23 ? 103 LYS A C 1 ATOM 783 O O . LYS A 1 103 ? 21.038 -23.968 -26.610 1.00 24.28 ? 103 LYS A O 1 ATOM 784 C CB . LYS A 1 103 ? 21.237 -26.798 -27.953 1.00 17.02 ? 103 LYS A CB 1 ATOM 785 C CG . LYS A 1 103 ? 22.057 -26.422 -29.173 1.00 16.80 ? 103 LYS A CG 1 ATOM 786 C CD . LYS A 1 103 ? 21.761 -27.365 -30.336 1.00 27.89 ? 103 LYS A CD 1 ATOM 787 C CE . LYS A 1 103 ? 22.587 -27.015 -31.578 1.00 33.83 ? 103 LYS A CE 1 ATOM 788 N NZ . LYS A 1 103 ? 22.582 -28.118 -32.593 1.00 36.43 ? 103 LYS A NZ 1 ATOM 789 N N . LEU A 1 104 ? 23.250 -24.332 -26.856 1.00 25.64 ? 104 LEU A N 1 ATOM 790 C CA . LEU A 1 104 ? 23.593 -22.917 -26.984 1.00 23.03 ? 104 LEU A CA 1 ATOM 791 C C . LEU A 1 104 ? 24.084 -22.557 -28.400 1.00 23.98 ? 104 LEU A C 1 ATOM 792 O O . LEU A 1 104 ? 25.190 -22.915 -28.807 1.00 24.90 ? 104 LEU A O 1 ATOM 793 C CB . LEU A 1 104 ? 24.626 -22.495 -25.932 1.00 17.29 ? 104 LEU A CB 1 ATOM 794 C CG . LEU A 1 104 ? 25.008 -21.007 -26.049 1.00 25.97 ? 104 LEU A CG 1 ATOM 795 C CD1 . LEU A 1 104 ? 23.902 -20.080 -25.522 1.00 18.19 ? 104 LEU A CD1 1 ATOM 796 C CD2 . LEU A 1 104 ? 26.349 -20.680 -25.395 1.00 23.86 ? 104 LEU A CD2 1 ATOM 797 N N . GLU A 1 105 ? 23.244 -21.851 -29.147 1.00 25.32 ? 105 GLU A N 1 ATOM 798 C CA . GLU A 1 105 ? 23.610 -21.379 -30.477 1.00 27.88 ? 105 GLU A CA 1 ATOM 799 C C . GLU A 1 105 ? 23.982 -19.903 -30.416 1.00 30.49 ? 105 GLU A C 1 ATOM 800 O O . GLU A 1 105 ? 23.433 -19.141 -29.614 1.00 30.61 ? 105 GLU A O 1 ATOM 801 C CB . GLU A 1 105 ? 22.451 -21.571 -31.451 1.00 26.61 ? 105 GLU A CB 1 ATOM 802 C CG . GLU A 1 105 ? 21.929 -22.989 -31.522 1.00 34.18 ? 105 GLU A CG 1 ATOM 803 C CD . GLU A 1 105 ? 20.679 -23.092 -32.378 1.00 41.13 ? 105 GLU A CD 1 ATOM 804 O OE1 . GLU A 1 105 ? 19.948 -22.084 -32.485 1.00 44.12 ? 105 GLU A OE1 1 ATOM 805 O OE2 . GLU A 1 105 ? 20.433 -24.176 -32.945 1.00 45.83 ? 105 GLU A OE2 1 ATOM 806 N N . LEU A 1 106 ? 24.917 -19.503 -31.266 1.00 23.62 ? 106 LEU A N 1 ATOM 807 C CA . LEU A 1 106 ? 25.305 -18.108 -31.348 1.00 21.29 ? 106 LEU A CA 1 ATOM 808 C C . LEU A 1 106 ? 24.801 -17.451 -32.606 1.00 22.70 ? 106 LEU A C 1 ATOM 809 O O . LEU A 1 106 ? 24.962 -17.992 -33.705 1.00 19.62 ? 106 LEU A O 1 ATOM 810 C CB . LEU A 1 106 ? 26.813 -17.967 -31.314 1.00 29.57 ? 106 LEU A CB 1 ATOM 811 C CG . LEU A 1 106 ? 27.269 -17.455 -29.963 1.00 36.54 ? 106 LEU A CG 1 ATOM 812 C CD1 . LEU A 1 106 ? 27.250 -18.603 -28.968 1.00 44.34 ? 106 LEU A CD1 1 ATOM 813 C CD2 . LEU A 1 106 ? 28.632 -16.841 -30.088 1.00 35.11 ? 106 LEU A CD2 1 ATOM 814 N N . LYS A 1 107 ? 24.206 -16.273 -32.433 1.00 29.53 ? 107 LYS A N 1 ATOM 815 C CA . LYS A 1 107 ? 23.855 -15.408 -33.550 1.00 30.58 ? 107 LYS A CA 1 ATOM 816 C C . LYS A 1 107 ? 25.091 -14.702 -34.112 1.00 31.37 ? 107 LYS A C 1 ATOM 817 O O . LYS A 1 107 ? 26.090 -14.511 -33.416 1.00 33.95 ? 107 LYS A O 1 ATOM 818 C CB . LYS A 1 107 ? 22.837 -14.370 -33.101 1.00 32.00 ? 107 LYS A CB 1 ATOM 819 C CG . LYS A 1 107 ? 21.409 -14.879 -33.006 1.00 37.03 ? 107 LYS A CG 1 ATOM 820 C CD . LYS A 1 107 ? 20.527 -13.863 -32.276 1.00 41.61 ? 107 LYS A CD 1 ATOM 821 C CE . LYS A 1 107 ? 19.058 -14.202 -32.421 1.00 45.11 ? 107 LYS A CE 1 ATOM 822 N NZ . LYS A 1 107 ? 18.806 -15.640 -32.153 1.00 44.39 ? 107 LYS A NZ 1 ATOM 823 N N . ARG A 1 108 ? 25.021 -14.324 -35.378 1.00 22.39 ? 108 ARG A N 1 ATOM 824 C CA . ARG A 1 108 ? 26.044 -13.483 -35.971 1.00 19.96 ? 108 ARG A CA 1 ATOM 825 C C . ARG A 1 108 ? 25.475 -12.838 -37.224 1.00 23.11 ? 108 ARG A C 1 ATOM 826 O O . ARG A 1 108 ? 24.323 -13.084 -37.582 1.00 28.67 ? 108 ARG A O 1 ATOM 827 C CB . ARG A 1 108 ? 27.298 -14.292 -36.315 1.00 18.19 ? 108 ARG A CB 1 ATOM 828 C CG . ARG A 1 108 ? 27.067 -15.473 -37.231 1.00 21.21 ? 108 ARG A CG 1 ATOM 829 C CD . ARG A 1 108 ? 28.314 -15.713 -38.050 1.00 25.58 ? 108 ARG A CD 1 ATOM 830 N NE . ARG A 1 108 ? 28.524 -14.627 -39.004 1.00 26.73 ? 108 ARG A NE 1 ATOM 831 C CZ . ARG A 1 108 ? 29.696 -14.308 -39.545 1.00 18.42 ? 108 ARG A CZ 1 ATOM 832 N NH1 . ARG A 1 108 ? 30.790 -14.976 -39.223 1.00 19.03 ? 108 ARG A NH1 1 ATOM 833 N NH2 . ARG A 1 108 ? 29.776 -13.306 -40.408 1.00 18.57 ? 108 ARG A NH2 1 ATOM 834 N N . THR A 1 109 ? 26.277 -12.017 -37.889 1.00 18.50 ? 109 THR A N 1 ATOM 835 C CA . THR A 1 109 ? 25.829 -11.354 -39.103 1.00 22.89 ? 109 THR A CA 1 ATOM 836 C C . THR A 1 109 ? 25.674 -12.364 -40.234 1.00 26.40 ? 109 THR A C 1 ATOM 837 O O . THR A 1 109 ? 26.302 -13.434 -40.222 1.00 23.25 ? 109 THR A O 1 ATOM 838 C CB . THR A 1 109 ? 26.800 -10.248 -39.549 1.00 25.08 ? 109 THR A CB 1 ATOM 839 O OG1 . THR A 1 109 ? 28.096 -10.813 -39.773 1.00 28.89 ? 109 THR A OG1 1 ATOM 840 C CG2 . THR A 1 109 ? 26.909 -9.170 -38.487 1.00 20.31 ? 109 THR A CG2 1 ATOM 841 N N . VAL A 1 110 ? 24.823 -12.026 -41.200 1.00 30.01 ? 110 VAL A N 1 ATOM 842 C CA . VAL A 1 110 ? 24.582 -12.899 -42.342 1.00 31.43 ? 110 VAL A CA 1 ATOM 843 C C . VAL A 1 110 ? 25.858 -13.051 -43.158 1.00 26.04 ? 110 VAL A C 1 ATOM 844 O O . VAL A 1 110 ? 26.543 -12.062 -43.417 1.00 16.94 ? 110 VAL A O 1 ATOM 845 C CB . VAL A 1 110 ? 23.455 -12.365 -43.253 1.00 25.19 ? 110 VAL A CB 1 ATOM 846 C CG1 . VAL A 1 110 ? 23.404 -13.169 -44.548 1.00 16.29 ? 110 VAL A CG1 1 ATOM 847 C CG2 . VAL A 1 110 ? 22.118 -12.429 -42.531 1.00 16.99 ? 110 VAL A CG2 1 ATOM 848 N N . ALA A 1 111 ? 26.180 -14.290 -43.532 1.00 18.76 ? 111 ALA A N 1 ATOM 849 C CA . ALA A 1 111 ? 27.351 -14.572 -44.357 1.00 19.51 ? 111 ALA A CA 1 ATOM 850 C C . ALA A 1 111 ? 26.953 -15.490 -45.509 1.00 23.08 ? 111 ALA A C 1 ATOM 851 O O . ALA A 1 111 ? 26.422 -16.579 -45.294 1.00 23.98 ? 111 ALA A O 1 ATOM 852 C CB . ALA A 1 111 ? 28.456 -15.204 -43.521 1.00 16.98 ? 111 ALA A CB 1 ATOM 853 N N . ALA A 1 112 ? 27.200 -15.041 -46.732 1.00 17.46 ? 112 ALA A N 1 ATOM 854 C CA . ALA A 1 112 ? 26.879 -15.837 -47.910 1.00 18.94 ? 112 ALA A CA 1 ATOM 855 C C . ALA A 1 112 ? 27.860 -16.994 -48.037 1.00 18.49 ? 112 ALA A C 1 ATOM 856 O O . ALA A 1 112 ? 29.040 -16.834 -47.733 1.00 21.37 ? 112 ALA A O 1 ATOM 857 C CB . ALA A 1 112 ? 26.896 -14.963 -49.175 1.00 16.43 ? 112 ALA A CB 1 ATOM 858 N N . PRO A 1 113 ? 27.367 -18.175 -48.447 1.00 18.92 ? 113 PRO A N 1 ATOM 859 C CA . PRO A 1 113 ? 28.252 -19.334 -48.646 1.00 25.40 ? 113 PRO A CA 1 ATOM 860 C C . PRO A 1 113 ? 29.181 -19.156 -49.850 1.00 27.59 ? 113 PRO A C 1 ATOM 861 O O . PRO A 1 113 ? 28.795 -18.526 -50.829 1.00 26.00 ? 113 PRO A O 1 ATOM 862 C CB . PRO A 1 113 ? 27.269 -20.487 -48.922 1.00 18.65 ? 113 PRO A CB 1 ATOM 863 C CG . PRO A 1 113 ? 26.027 -19.813 -49.471 1.00 18.13 ? 113 PRO A CG 1 ATOM 864 C CD . PRO A 1 113 ? 25.947 -18.508 -48.687 1.00 17.25 ? 113 PRO A CD 1 ATOM 865 N N . SER A 1 114 ? 30.397 -19.685 -49.764 1.00 24.00 ? 114 SER A N 1 ATOM 866 C CA . SER A 1 114 ? 31.213 -19.872 -50.951 1.00 17.58 ? 114 SER A CA 1 ATOM 867 C C . SER A 1 114 ? 30.888 -21.260 -51.471 1.00 15.08 ? 114 SER A C 1 ATOM 868 O O . SER A 1 114 ? 30.896 -22.229 -50.710 1.00 21.05 ? 114 SER A O 1 ATOM 869 C CB . SER A 1 114 ? 32.703 -19.769 -50.611 1.00 15.18 ? 114 SER A CB 1 ATOM 870 O OG . SER A 1 114 ? 33.023 -18.481 -50.128 1.00 31.35 ? 114 SER A OG 1 ATOM 871 N N . VAL A 1 115 ? 30.594 -21.355 -52.760 1.00 14.75 ? 115 VAL A N 1 ATOM 872 C CA . VAL A 1 115 ? 30.098 -22.595 -53.356 1.00 13.50 ? 115 VAL A CA 1 ATOM 873 C C . VAL A 1 115 ? 31.161 -23.202 -54.250 1.00 17.70 ? 115 VAL A C 1 ATOM 874 O O . VAL A 1 115 ? 31.740 -22.525 -55.085 1.00 19.26 ? 115 VAL A O 1 ATOM 875 C CB . VAL A 1 115 ? 28.830 -22.352 -54.211 1.00 20.43 ? 115 VAL A CB 1 ATOM 876 C CG1 . VAL A 1 115 ? 28.279 -23.663 -54.751 1.00 16.64 ? 115 VAL A CG1 1 ATOM 877 C CG2 . VAL A 1 115 ? 27.762 -21.611 -53.417 1.00 14.07 ? 115 VAL A CG2 1 ATOM 878 N N . PHE A 1 116 ? 31.416 -24.487 -54.068 1.00 22.18 ? 116 PHE A N 1 ATOM 879 C CA . PHE A 1 116 ? 32.366 -25.200 -54.899 1.00 23.95 ? 116 PHE A CA 1 ATOM 880 C C . PHE A 1 116 ? 31.697 -26.496 -55.346 1.00 26.29 ? 116 PHE A C 1 ATOM 881 O O . PHE A 1 116 ? 30.913 -27.079 -54.587 1.00 26.84 ? 116 PHE A O 1 ATOM 882 C CB . PHE A 1 116 ? 33.636 -25.523 -54.110 1.00 20.06 ? 116 PHE A CB 1 ATOM 883 C CG . PHE A 1 116 ? 34.283 -24.327 -53.454 1.00 19.72 ? 116 PHE A CG 1 ATOM 884 C CD1 . PHE A 1 116 ? 33.863 -23.888 -52.205 1.00 14.16 ? 116 PHE A CD1 1 ATOM 885 C CD2 . PHE A 1 116 ? 35.344 -23.671 -54.067 1.00 17.87 ? 116 PHE A CD2 1 ATOM 886 C CE1 . PHE A 1 116 ? 34.469 -22.797 -51.585 1.00 16.40 ? 116 PHE A CE1 1 ATOM 887 C CE2 . PHE A 1 116 ? 35.973 -22.585 -53.458 1.00 18.62 ? 116 PHE A CE2 1 ATOM 888 C CZ . PHE A 1 116 ? 35.530 -22.143 -52.210 1.00 19.11 ? 116 PHE A CZ 1 ATOM 889 N N . ILE A 1 117 ? 32.000 -26.947 -56.565 1.00 21.19 ? 117 ILE A N 1 ATOM 890 C CA . ILE A 1 117 ? 31.453 -28.212 -57.060 1.00 14.89 ? 117 ILE A CA 1 ATOM 891 C C . ILE A 1 117 ? 32.570 -29.145 -57.508 1.00 16.75 ? 117 ILE A C 1 ATOM 892 O O . ILE A 1 117 ? 33.567 -28.707 -58.079 1.00 20.84 ? 117 ILE A O 1 ATOM 893 C CB . ILE A 1 117 ? 30.421 -27.990 -58.193 1.00 16.95 ? 117 ILE A CB 1 ATOM 894 C CG1 . ILE A 1 117 ? 29.654 -29.275 -58.496 1.00 13.62 ? 117 ILE A CG1 1 ATOM 895 C CG2 . ILE A 1 117 ? 31.094 -27.443 -59.457 1.00 20.20 ? 117 ILE A CG2 1 ATOM 896 C CD1 . ILE A 1 117 ? 28.692 -29.127 -59.678 1.00 14.19 ? 117 ILE A CD1 1 ATOM 897 N N . PHE A 1 118 ? 32.407 -30.433 -57.222 1.00 18.25 ? 118 PHE A N 1 ATOM 898 C CA . PHE A 1 118 ? 33.429 -31.435 -57.505 1.00 14.86 ? 118 PHE A CA 1 ATOM 899 C C . PHE A 1 118 ? 32.841 -32.595 -58.294 1.00 19.38 ? 118 PHE A C 1 ATOM 900 O O . PHE A 1 118 ? 31.946 -33.287 -57.812 1.00 14.55 ? 118 PHE A O 1 ATOM 901 C CB . PHE A 1 118 ? 33.972 -32.004 -56.205 1.00 14.94 ? 118 PHE A CB 1 ATOM 902 C CG . PHE A 1 118 ? 34.640 -30.997 -55.317 1.00 19.16 ? 118 PHE A CG 1 ATOM 903 C CD1 . PHE A 1 118 ? 36.006 -30.742 -55.432 1.00 16.22 ? 118 PHE A CD1 1 ATOM 904 C CD2 . PHE A 1 118 ? 33.919 -30.339 -54.331 1.00 14.14 ? 118 PHE A CD2 1 ATOM 905 C CE1 . PHE A 1 118 ? 36.635 -29.831 -54.580 1.00 16.93 ? 118 PHE A CE1 1 ATOM 906 C CE2 . PHE A 1 118 ? 34.533 -29.436 -53.487 1.00 14.33 ? 118 PHE A CE2 1 ATOM 907 C CZ . PHE A 1 118 ? 35.902 -29.179 -53.606 1.00 15.49 ? 118 PHE A CZ 1 ATOM 908 N N . PRO A 1 119 ? 33.340 -32.820 -59.511 1.00 19.52 ? 119 PRO A N 1 ATOM 909 C CA . PRO A 1 119 ? 32.898 -34.003 -60.262 1.00 23.93 ? 119 PRO A CA 1 ATOM 910 C C . PRO A 1 119 ? 33.388 -35.266 -59.577 1.00 23.29 ? 119 PRO A C 1 ATOM 911 O O . PRO A 1 119 ? 34.242 -35.167 -58.695 1.00 26.70 ? 119 PRO A O 1 ATOM 912 C CB . PRO A 1 119 ? 33.570 -33.840 -61.638 1.00 20.94 ? 119 PRO A CB 1 ATOM 913 C CG . PRO A 1 119 ? 34.586 -32.772 -61.482 1.00 18.34 ? 119 PRO A CG 1 ATOM 914 C CD . PRO A 1 119 ? 34.186 -31.919 -60.310 1.00 19.66 ? 119 PRO A CD 1 ATOM 915 N N . PRO A 1 120 ? 32.844 -36.432 -59.955 1.00 24.36 ? 120 PRO A N 1 ATOM 916 C CA . PRO A 1 120 ? 33.388 -37.686 -59.423 1.00 25.70 ? 120 PRO A CA 1 ATOM 917 C C . PRO A 1 120 ? 34.792 -37.943 -59.945 1.00 25.48 ? 120 PRO A C 1 ATOM 918 O O . PRO A 1 120 ? 35.083 -37.669 -61.112 1.00 28.03 ? 120 PRO A O 1 ATOM 919 C CB . PRO A 1 120 ? 32.428 -38.752 -59.973 1.00 18.40 ? 120 PRO A CB 1 ATOM 920 C CG . PRO A 1 120 ? 31.850 -38.138 -61.180 1.00 29.97 ? 120 PRO A CG 1 ATOM 921 C CD . PRO A 1 120 ? 31.712 -36.671 -60.864 1.00 27.82 ? 120 PRO A CD 1 ATOM 922 N N . SER A 1 121 ? 35.652 -38.460 -59.077 1.00 20.50 ? 121 SER A N 1 ATOM 923 C CA . SER A 1 121 ? 36.991 -38.866 -59.475 1.00 31.08 ? 121 SER A CA 1 ATOM 924 C C . SER A 1 121 ? 36.923 -40.066 -60.422 1.00 25.68 ? 121 SER A C 1 ATOM 925 O O . SER A 1 121 ? 35.985 -40.864 -60.349 1.00 26.46 ? 121 SER A O 1 ATOM 926 C CB . SER A 1 121 ? 37.816 -39.227 -58.237 1.00 31.90 ? 121 SER A CB 1 ATOM 927 O OG . SER A 1 121 ? 37.192 -40.272 -57.508 1.00 30.60 ? 121 SER A OG 1 ATOM 928 N N . ASP A 1 122 ? 37.914 -40.196 -61.301 1.00 25.34 ? 122 ASP A N 1 ATOM 929 C CA . ASP A 1 122 ? 37.982 -41.360 -62.185 1.00 32.91 ? 122 ASP A CA 1 ATOM 930 C C . ASP A 1 122 ? 38.209 -42.629 -61.377 1.00 28.08 ? 122 ASP A C 1 ATOM 931 O O . ASP A 1 122 ? 37.834 -43.720 -61.804 1.00 28.92 ? 122 ASP A O 1 ATOM 932 C CB . ASP A 1 122 ? 39.068 -41.189 -63.250 1.00 37.53 ? 122 ASP A CB 1 ATOM 933 C CG . ASP A 1 122 ? 38.820 -39.985 -64.138 1.00 45.32 ? 122 ASP A CG 1 ATOM 934 O OD1 . ASP A 1 122 ? 37.645 -39.685 -64.440 1.00 45.60 ? 122 ASP A OD1 1 ATOM 935 O OD2 . ASP A 1 122 ? 39.802 -39.319 -64.520 1.00 52.34 ? 122 ASP A OD2 1 ATOM 936 N N . GLU A 1 123 ? 38.815 -42.472 -60.201 1.00 31.55 ? 123 GLU A N 1 ATOM 937 C CA . GLU A 1 123 ? 38.980 -43.575 -59.253 1.00 34.93 ? 123 GLU A CA 1 ATOM 938 C C . GLU A 1 123 ? 37.628 -44.175 -58.853 1.00 28.70 ? 123 GLU A C 1 ATOM 939 O O . GLU A 1 123 ? 37.416 -45.389 -58.979 1.00 30.11 ? 123 GLU A O 1 ATOM 940 C CB . GLU A 1 123 ? 39.735 -43.116 -58.002 1.00 37.57 ? 123 GLU A CB 1 ATOM 941 C CG . GLU A 1 123 ? 41.194 -42.745 -58.215 1.00 42.12 ? 123 GLU A CG 1 ATOM 942 C CD . GLU A 1 123 ? 41.383 -41.343 -58.787 1.00 52.88 ? 123 GLU A CD 1 ATOM 943 O OE1 . GLU A 1 123 ? 40.398 -40.728 -59.256 1.00 53.26 ? 123 GLU A OE1 1 ATOM 944 O OE2 . GLU A 1 123 ? 42.532 -40.858 -58.763 1.00 57.96 ? 123 GLU A OE2 1 ATOM 945 N N . GLN A 1 124 ? 36.719 -43.319 -58.387 1.00 26.49 ? 124 GLN A N 1 ATOM 946 C CA . GLN A 1 124 ? 35.400 -43.777 -57.958 1.00 38.53 ? 124 GLN A CA 1 ATOM 947 C C . GLN A 1 124 ? 34.648 -44.422 -59.122 1.00 34.21 ? 124 GLN A C 1 ATOM 948 O O . GLN A 1 124 ? 33.970 -45.440 -58.950 1.00 34.64 ? 124 GLN A O 1 ATOM 949 C CB . GLN A 1 124 ? 34.563 -42.641 -57.331 1.00 23.55 ? 124 GLN A CB 1 ATOM 950 C CG . GLN A 1 124 ? 33.271 -43.162 -56.696 1.00 23.35 ? 124 GLN A CG 1 ATOM 951 C CD . GLN A 1 124 ? 32.282 -42.083 -56.294 1.00 23.04 ? 124 GLN A CD 1 ATOM 952 O OE1 . GLN A 1 124 ? 32.449 -40.907 -56.608 1.00 28.95 ? 124 GLN A OE1 1 ATOM 953 N NE2 . GLN A 1 124 ? 31.236 -42.488 -55.593 1.00 26.73 ? 124 GLN A NE2 1 ATOM 954 N N . LEU A 1 125 ? 34.783 -43.827 -60.305 1.00 28.75 ? 125 LEU A N 1 ATOM 955 C CA . LEU A 1 125 ? 34.108 -44.316 -61.504 1.00 25.47 ? 125 LEU A CA 1 ATOM 956 C C . LEU A 1 125 ? 34.483 -45.756 -61.852 1.00 32.01 ? 125 LEU A C 1 ATOM 957 O O . LEU A 1 125 ? 33.700 -46.471 -62.471 1.00 36.83 ? 125 LEU A O 1 ATOM 958 C CB . LEU A 1 125 ? 34.386 -43.390 -62.687 1.00 24.99 ? 125 LEU A CB 1 ATOM 959 C CG . LEU A 1 125 ? 33.749 -42.009 -62.553 1.00 31.93 ? 125 LEU A CG 1 ATOM 960 C CD1 . LEU A 1 125 ? 34.013 -41.166 -63.791 1.00 34.67 ? 125 LEU A CD1 1 ATOM 961 C CD2 . LEU A 1 125 ? 32.259 -42.159 -62.318 1.00 25.44 ? 125 LEU A CD2 1 ATOM 962 N N . LYS A 1 126 ? 35.670 -46.189 -61.441 1.00 35.96 ? 126 LYS A N 1 ATOM 963 C CA . LYS A 1 126 ? 36.072 -47.581 -61.641 1.00 42.56 ? 126 LYS A CA 1 ATOM 964 C C . LYS A 1 126 ? 35.216 -48.564 -60.835 1.00 38.53 ? 126 LYS A C 1 ATOM 965 O O . LYS A 1 126 ? 35.090 -49.725 -61.208 1.00 40.86 ? 126 LYS A O 1 ATOM 966 C CB . LYS A 1 126 ? 37.555 -47.763 -61.321 1.00 45.61 ? 126 LYS A CB 1 ATOM 967 C CG . LYS A 1 126 ? 38.468 -47.115 -62.342 1.00 45.89 ? 126 LYS A CG 1 ATOM 968 C CD . LYS A 1 126 ? 39.896 -46.997 -61.840 1.00 49.65 ? 126 LYS A CD 1 ATOM 969 C CE . LYS A 1 126 ? 40.757 -48.144 -62.298 1.00 56.22 ? 126 LYS A CE 1 ATOM 970 N NZ . LYS A 1 126 ? 42.193 -47.776 -62.193 1.00 61.59 ? 126 LYS A NZ 1 ATOM 971 N N . SER A 1 127 ? 34.626 -48.092 -59.741 1.00 35.13 ? 127 SER A N 1 ATOM 972 C CA . SER A 1 127 ? 33.744 -48.924 -58.918 1.00 41.47 ? 127 SER A CA 1 ATOM 973 C C . SER A 1 127 ? 32.279 -48.926 -59.406 1.00 45.49 ? 127 SER A C 1 ATOM 974 O O . SER A 1 127 ? 31.432 -49.646 -58.868 1.00 47.10 ? 127 SER A O 1 ATOM 975 C CB . SER A 1 127 ? 33.806 -48.478 -57.453 1.00 44.55 ? 127 SER A CB 1 ATOM 976 O OG . SER A 1 127 ? 33.158 -47.224 -57.273 1.00 40.89 ? 127 SER A OG 1 ATOM 977 N N . GLY A 1 128 ? 31.974 -48.118 -60.415 1.00 42.19 ? 128 GLY A N 1 ATOM 978 C CA . GLY A 1 128 ? 30.642 -48.125 -60.991 1.00 44.87 ? 128 GLY A CA 1 ATOM 979 C C . GLY A 1 128 ? 29.675 -47.174 -60.311 1.00 45.14 ? 128 GLY A C 1 ATOM 980 O O . GLY A 1 128 ? 28.470 -47.205 -60.565 1.00 43.00 ? 128 GLY A O 1 ATOM 981 N N . THR A 1 129 ? 30.203 -46.317 -59.448 1.00 40.69 ? 129 THR A N 1 ATOM 982 C CA . THR A 1 129 ? 29.376 -45.322 -58.789 1.00 40.79 ? 129 THR A CA 1 ATOM 983 C C . THR A 1 129 ? 29.965 -43.924 -58.981 1.00 35.57 ? 129 THR A C 1 ATOM 984 O O . THR A 1 129 ? 31.182 -43.755 -59.087 1.00 28.43 ? 129 THR A O 1 ATOM 985 C CB . THR A 1 129 ? 29.194 -45.664 -57.298 1.00 38.35 ? 129 THR A CB 1 ATOM 986 O OG1 . THR A 1 129 ? 28.552 -46.937 -57.193 1.00 39.40 ? 129 THR A OG1 1 ATOM 987 C CG2 . THR A 1 129 ? 28.338 -44.618 -56.581 1.00 34.14 ? 129 THR A CG2 1 ATOM 988 N N . ALA A 1 130 ? 29.094 -42.925 -59.051 1.00 33.85 ? 130 ALA A N 1 ATOM 989 C CA . ALA A 1 130 ? 29.536 -41.554 -59.255 1.00 33.37 ? 130 ALA A CA 1 ATOM 990 C C . ALA A 1 130 ? 28.945 -40.639 -58.195 1.00 28.06 ? 130 ALA A C 1 ATOM 991 O O . ALA A 1 130 ? 27.733 -40.493 -58.107 1.00 28.28 ? 130 ALA A O 1 ATOM 992 C CB . ALA A 1 130 ? 29.144 -41.069 -60.654 1.00 26.37 ? 130 ALA A CB 1 ATOM 993 N N . SER A 1 131 ? 29.803 -40.027 -57.386 1.00 27.56 ? 131 SER A N 1 ATOM 994 C CA . SER A 1 131 ? 29.349 -39.030 -56.429 1.00 21.31 ? 131 SER A CA 1 ATOM 995 C C . SER A 1 131 ? 29.731 -37.651 -56.925 1.00 17.50 ? 131 SER A C 1 ATOM 996 O O . SER A 1 131 ? 30.880 -37.409 -57.281 1.00 20.88 ? 131 SER A O 1 ATOM 997 C CB . SER A 1 131 ? 29.958 -39.271 -55.048 1.00 17.80 ? 131 SER A CB 1 ATOM 998 O OG . SER A 1 131 ? 29.532 -40.507 -54.517 1.00 20.68 ? 131 SER A OG 1 ATOM 999 N N . VAL A 1 132 ? 28.765 -36.745 -56.950 1.00 15.32 ? 132 VAL A N 1 ATOM 1000 C CA . VAL A 1 132 ? 29.045 -35.366 -57.300 1.00 18.82 ? 132 VAL A CA 1 ATOM 1001 C C . VAL A 1 132 ? 28.826 -34.510 -56.064 1.00 26.15 ? 132 VAL A C 1 ATOM 1002 O O . VAL A 1 132 ? 27.739 -34.501 -55.482 1.00 26.01 ? 132 VAL A O 1 ATOM 1003 C CB . VAL A 1 132 ? 28.136 -34.880 -58.434 1.00 17.62 ? 132 VAL A CB 1 ATOM 1004 C CG1 . VAL A 1 132 ? 28.597 -33.519 -58.908 1.00 15.07 ? 132 VAL A CG1 1 ATOM 1005 C CG2 . VAL A 1 132 ? 28.132 -35.880 -59.576 1.00 15.26 ? 132 VAL A CG2 1 ATOM 1006 N N . VAL A 1 133 ? 29.861 -33.796 -55.647 1.00 24.07 ? 133 VAL A N 1 ATOM 1007 C CA . VAL A 1 133 ? 29.779 -33.080 -54.390 1.00 15.84 ? 133 VAL A CA 1 ATOM 1008 C C . VAL A 1 133 ? 29.672 -31.574 -54.573 1.00 21.86 ? 133 VAL A C 1 ATOM 1009 O O . VAL A 1 133 ? 30.410 -30.968 -55.356 1.00 23.71 ? 133 VAL A O 1 ATOM 1010 C CB . VAL A 1 133 ? 30.952 -33.428 -53.471 1.00 14.50 ? 133 VAL A CB 1 ATOM 1011 C CG1 . VAL A 1 133 ? 30.935 -32.562 -52.203 1.00 13.52 ? 133 VAL A CG1 1 ATOM 1012 C CG2 . VAL A 1 133 ? 30.910 -34.909 -53.122 1.00 15.52 ? 133 VAL A CG2 1 ATOM 1013 N N . CYS A 1 134 ? 28.736 -30.983 -53.837 1.00 19.40 ? 134 CYS A N 1 ATOM 1014 C CA . CYS A 1 134 ? 28.594 -29.545 -53.807 1.00 18.55 ? 134 CYS A CA 1 ATOM 1015 C C . CYS A 1 134 ? 28.853 -29.025 -52.389 1.00 23.19 ? 134 CYS A C 1 ATOM 1016 O O . CYS A 1 134 ? 28.197 -29.446 -51.432 1.00 21.17 ? 134 CYS A O 1 ATOM 1017 C CB . CYS A 1 134 ? 27.191 -29.164 -54.244 1.00 22.34 ? 134 CYS A CB 1 ATOM 1018 S SG . CYS A 1 134 ? 27.007 -27.440 -54.566 1.00 34.71 ? 134 CYS A SG 1 ATOM 1019 N N . LEU A 1 135 ? 29.807 -28.106 -52.265 1.00 19.39 ? 135 LEU A N 1 ATOM 1020 C CA . LEU A 1 135 ? 30.178 -27.550 -50.971 1.00 22.06 ? 135 LEU A CA 1 ATOM 1021 C C . LEU A 1 135 ? 29.692 -26.103 -50.826 1.00 22.26 ? 135 LEU A C 1 ATOM 1022 O O . LEU A 1 135 ? 29.940 -25.277 -51.697 1.00 23.48 ? 135 LEU A O 1 ATOM 1023 C CB . LEU A 1 135 ? 31.694 -27.625 -50.787 1.00 12.51 ? 135 LEU A CB 1 ATOM 1024 C CG . LEU A 1 135 ? 32.292 -26.881 -49.595 1.00 26.24 ? 135 LEU A CG 1 ATOM 1025 C CD1 . LEU A 1 135 ? 31.895 -27.523 -48.288 1.00 20.21 ? 135 LEU A CD1 1 ATOM 1026 C CD2 . LEU A 1 135 ? 33.801 -26.832 -49.717 1.00 30.42 ? 135 LEU A CD2 1 ATOM 1027 N N . LEU A 1 136 ? 28.980 -25.822 -49.734 1.00 16.22 ? 136 LEU A N 1 ATOM 1028 C CA . LEU A 1 136 ? 28.581 -24.464 -49.367 1.00 19.67 ? 136 LEU A CA 1 ATOM 1029 C C . LEU A 1 136 ? 29.364 -24.130 -48.115 1.00 22.91 ? 136 LEU A C 1 ATOM 1030 O O . LEU A 1 136 ? 29.101 -24.679 -47.039 1.00 18.98 ? 136 LEU A O 1 ATOM 1031 C CB . LEU A 1 136 ? 27.084 -24.368 -49.055 1.00 12.81 ? 136 LEU A CB 1 ATOM 1032 C CG . LEU A 1 136 ? 26.043 -24.470 -50.173 1.00 20.71 ? 136 LEU A CG 1 ATOM 1033 C CD1 . LEU A 1 136 ? 26.098 -25.804 -50.958 1.00 12.74 ? 136 LEU A CD1 1 ATOM 1034 C CD2 . LEU A 1 136 ? 24.666 -24.252 -49.562 1.00 16.83 ? 136 LEU A CD2 1 ATOM 1035 N N . ASN A 1 137 ? 30.325 -23.228 -48.245 1.00 22.53 ? 137 ASN A N 1 ATOM 1036 C CA . ASN A 1 137 ? 31.301 -23.043 -47.183 1.00 19.59 ? 137 ASN A CA 1 ATOM 1037 C C . ASN A 1 137 ? 31.114 -21.750 -46.401 1.00 17.91 ? 137 ASN A C 1 ATOM 1038 O O . ASN A 1 137 ? 30.895 -20.682 -46.984 1.00 16.05 ? 137 ASN A O 1 ATOM 1039 C CB . ASN A 1 137 ? 32.719 -23.135 -47.747 1.00 13.58 ? 137 ASN A CB 1 ATOM 1040 C CG . ASN A 1 137 ? 33.716 -23.605 -46.726 1.00 15.48 ? 137 ASN A CG 1 ATOM 1041 O OD1 . ASN A 1 137 ? 33.435 -24.520 -45.945 1.00 18.12 ? 137 ASN A OD1 1 ATOM 1042 N ND2 . ASN A 1 137 ? 34.894 -22.979 -46.713 1.00 15.06 ? 137 ASN A ND2 1 ATOM 1043 N N . ASN A 1 138 ? 31.139 -21.864 -45.070 1.00 18.29 ? 138 ASN A N 1 ATOM 1044 C CA . ASN A 1 138 ? 31.214 -20.730 -44.137 1.00 17.11 ? 138 ASN A CA 1 ATOM 1045 C C . ASN A 1 138 ? 30.100 -19.696 -44.360 1.00 20.30 ? 138 ASN A C 1 ATOM 1046 O O . ASN A 1 138 ? 30.349 -18.558 -44.760 1.00 19.94 ? 138 ASN A O 1 ATOM 1047 C CB . ASN A 1 138 ? 32.588 -20.064 -44.235 1.00 15.33 ? 138 ASN A CB 1 ATOM 1048 C CG . ASN A 1 138 ? 33.713 -20.997 -43.850 1.00 20.19 ? 138 ASN A CG 1 ATOM 1049 O OD1 . ASN A 1 138 ? 33.491 -22.075 -43.304 1.00 24.05 ? 138 ASN A OD1 1 ATOM 1050 N ND2 . ASN A 1 138 ? 34.928 -20.582 -44.123 1.00 27.84 ? 138 ASN A ND2 1 ATOM 1051 N N . PHE A 1 139 ? 28.861 -20.099 -44.052 1.00 18.81 ? 139 PHE A N 1 ATOM 1052 C CA . PHE A 1 139 ? 27.715 -19.212 -44.202 1.00 19.67 ? 139 PHE A CA 1 ATOM 1053 C C . PHE A 1 139 ? 26.885 -19.142 -42.927 1.00 19.57 ? 139 PHE A C 1 ATOM 1054 O O . PHE A 1 139 ? 27.048 -19.964 -42.026 1.00 19.21 ? 139 PHE A O 1 ATOM 1055 C CB . PHE A 1 139 ? 26.835 -19.663 -45.370 1.00 15.24 ? 139 PHE A CB 1 ATOM 1056 C CG . PHE A 1 139 ? 26.294 -21.059 -45.221 1.00 22.74 ? 139 PHE A CG 1 ATOM 1057 C CD1 . PHE A 1 139 ? 27.056 -22.156 -45.599 1.00 24.32 ? 139 PHE A CD1 1 ATOM 1058 C CD2 . PHE A 1 139 ? 25.018 -21.273 -44.711 1.00 15.92 ? 139 PHE A CD2 1 ATOM 1059 C CE1 . PHE A 1 139 ? 26.560 -23.443 -45.463 1.00 24.16 ? 139 PHE A CE1 1 ATOM 1060 C CE2 . PHE A 1 139 ? 24.516 -22.551 -44.570 1.00 18.24 ? 139 PHE A CE2 1 ATOM 1061 C CZ . PHE A 1 139 ? 25.283 -23.640 -44.947 1.00 19.67 ? 139 PHE A CZ 1 ATOM 1062 N N . TYR A 1 140 ? 26.001 -18.153 -42.870 1.00 17.38 ? 140 TYR A N 1 ATOM 1063 C CA . TYR A 1 140 ? 25.079 -17.962 -41.756 1.00 18.68 ? 140 TYR A CA 1 ATOM 1064 C C . TYR A 1 140 ? 23.912 -17.124 -42.249 1.00 19.72 ? 140 TYR A C 1 ATOM 1065 O O . TYR A 1 140 ? 24.127 -16.112 -42.913 1.00 31.60 ? 140 TYR A O 1 ATOM 1066 C CB . TYR A 1 140 ? 25.759 -17.251 -40.577 1.00 25.13 ? 140 TYR A CB 1 ATOM 1067 C CG . TYR A 1 140 ? 24.846 -17.158 -39.372 1.00 30.10 ? 140 TYR A CG 1 ATOM 1068 C CD1 . TYR A 1 140 ? 24.770 -18.200 -38.455 1.00 25.49 ? 140 TYR A CD1 1 ATOM 1069 C CD2 . TYR A 1 140 ? 24.032 -16.047 -39.174 1.00 22.25 ? 140 TYR A CD2 1 ATOM 1070 C CE1 . TYR A 1 140 ? 23.923 -18.137 -37.364 1.00 26.13 ? 140 TYR A CE1 1 ATOM 1071 C CE2 . TYR A 1 140 ? 23.179 -15.973 -38.093 1.00 27.83 ? 140 TYR A CE2 1 ATOM 1072 C CZ . TYR A 1 140 ? 23.131 -17.022 -37.186 1.00 29.89 ? 140 TYR A CZ 1 ATOM 1073 O OH . TYR A 1 140 ? 22.288 -16.954 -36.108 1.00 26.62 ? 140 TYR A OH 1 ATOM 1074 N N . PRO A 1 141 ? 22.674 -17.511 -41.897 1.00 25.37 ? 141 PRO A N 1 ATOM 1075 C CA . PRO A 1 141 ? 22.322 -18.583 -40.958 1.00 26.12 ? 141 PRO A CA 1 ATOM 1076 C C . PRO A 1 141 ? 22.224 -19.929 -41.650 1.00 22.76 ? 141 PRO A C 1 ATOM 1077 O O . PRO A 1 141 ? 22.538 -20.025 -42.830 1.00 23.65 ? 141 PRO A O 1 ATOM 1078 C CB . PRO A 1 141 ? 20.936 -18.152 -40.466 1.00 23.64 ? 141 PRO A CB 1 ATOM 1079 C CG . PRO A 1 141 ? 20.315 -17.538 -41.703 1.00 23.82 ? 141 PRO A CG 1 ATOM 1080 C CD . PRO A 1 141 ? 21.468 -16.846 -42.432 1.00 22.28 ? 141 PRO A CD 1 ATOM 1081 N N . ARG A 1 142 ? 21.747 -20.932 -40.922 1.00 24.98 ? 142 ARG A N 1 ATOM 1082 C CA . ARG A 1 142 ? 21.849 -22.334 -41.322 1.00 23.20 ? 142 ARG A CA 1 ATOM 1083 C C . ARG A 1 142 ? 20.992 -22.699 -42.523 1.00 23.21 ? 142 ARG A C 1 ATOM 1084 O O . ARG A 1 142 ? 21.379 -23.548 -43.316 1.00 23.16 ? 142 ARG A O 1 ATOM 1085 C CB . ARG A 1 142 ? 21.474 -23.229 -40.147 1.00 31.05 ? 142 ARG A CB 1 ATOM 1086 C CG . ARG A 1 142 ? 22.006 -24.650 -40.231 1.00 34.02 ? 142 ARG A CG 1 ATOM 1087 C CD . ARG A 1 142 ? 21.442 -25.480 -39.080 1.00 38.52 ? 142 ARG A CD 1 ATOM 1088 N NE . ARG A 1 142 ? 21.982 -26.834 -39.032 1.00 48.06 ? 142 ARG A NE 1 ATOM 1089 C CZ . ARG A 1 142 ? 21.417 -27.885 -39.619 1.00 56.58 ? 142 ARG A CZ 1 ATOM 1090 N NH1 . ARG A 1 142 ? 20.295 -27.737 -40.311 1.00 55.03 ? 142 ARG A NH1 1 ATOM 1091 N NH2 . ARG A 1 142 ? 21.976 -29.083 -39.516 1.00 62.01 ? 142 ARG A NH2 1 ATOM 1092 N N . GLU A 1 143 ? 19.828 -22.066 -42.667 1.00 23.75 ? 143 GLU A N 1 ATOM 1093 C CA . GLU A 1 143 ? 18.929 -22.384 -43.769 1.00 23.01 ? 143 GLU A CA 1 ATOM 1094 C C . GLU A 1 143 ? 19.596 -22.133 -45.124 1.00 23.44 ? 143 GLU A C 1 ATOM 1095 O O . GLU A 1 143 ? 20.129 -21.053 -45.387 1.00 28.21 ? 143 GLU A O 1 ATOM 1096 C CB . GLU A 1 143 ? 17.637 -21.570 -43.635 1.00 25.19 ? 143 GLU A CB 1 ATOM 1097 C CG . GLU A 1 143 ? 16.878 -21.312 -44.945 1.00 39.77 ? 143 GLU A CG 1 ATOM 1098 C CD . GLU A 1 143 ? 16.227 -22.559 -45.559 1.00 43.30 ? 143 GLU A CD 1 ATOM 1099 O OE1 . GLU A 1 143 ? 15.817 -22.484 -46.738 1.00 46.50 ? 143 GLU A OE1 1 ATOM 1100 O OE2 . GLU A 1 143 ? 16.109 -23.605 -44.881 1.00 43.68 ? 143 GLU A OE2 1 ATOM 1101 N N . ALA A 1 144 ? 19.577 -23.154 -45.975 1.00 20.49 ? 144 ALA A N 1 ATOM 1102 C CA . ALA A 1 144 ? 20.033 -23.067 -47.361 1.00 27.85 ? 144 ALA A CA 1 ATOM 1103 C C . ALA A 1 144 ? 19.305 -24.113 -48.200 1.00 28.29 ? 144 ALA A C 1 ATOM 1104 O O . ALA A 1 144 ? 18.845 -25.125 -47.676 1.00 35.29 ? 144 ALA A O 1 ATOM 1105 C CB . ALA A 1 144 ? 21.544 -23.266 -47.469 1.00 17.35 ? 144 ALA A CB 1 ATOM 1106 N N . LYS A 1 145 ? 19.194 -23.856 -49.497 1.00 23.73 ? 145 LYS A N 1 ATOM 1107 C CA . LYS A 1 145 ? 18.605 -24.810 -50.423 1.00 24.58 ? 145 LYS A CA 1 ATOM 1108 C C . LYS A 1 145 ? 19.649 -25.183 -51.464 1.00 23.27 ? 145 LYS A C 1 ATOM 1109 O O . LYS A 1 145 ? 20.371 -24.324 -51.984 1.00 23.58 ? 145 LYS A O 1 ATOM 1110 C CB . LYS A 1 145 ? 17.374 -24.214 -51.121 1.00 32.47 ? 145 LYS A CB 1 ATOM 1111 C CG . LYS A 1 145 ? 16.162 -24.011 -50.239 1.00 38.92 ? 145 LYS A CG 1 ATOM 1112 C CD . LYS A 1 145 ? 15.725 -25.310 -49.576 1.00 45.47 ? 145 LYS A CD 1 ATOM 1113 C CE . LYS A 1 145 ? 14.460 -25.119 -48.749 1.00 47.23 ? 145 LYS A CE 1 ATOM 1114 N NZ . LYS A 1 145 ? 13.361 -24.590 -49.598 1.00 50.37 ? 145 LYS A NZ 1 ATOM 1115 N N . VAL A 1 146 ? 19.747 -26.467 -51.760 1.00 22.59 ? 146 VAL A N 1 ATOM 1116 C CA . VAL A 1 146 ? 20.605 -26.902 -52.840 1.00 19.94 ? 146 VAL A CA 1 ATOM 1117 C C . VAL A 1 146 ? 19.725 -27.610 -53.853 1.00 22.02 ? 146 VAL A C 1 ATOM 1118 O O . VAL A 1 146 ? 18.999 -28.540 -53.512 1.00 21.23 ? 146 VAL A O 1 ATOM 1119 C CB . VAL A 1 146 ? 21.728 -27.830 -52.353 1.00 19.88 ? 146 VAL A CB 1 ATOM 1120 C CG1 . VAL A 1 146 ? 22.479 -28.428 -53.541 1.00 23.00 ? 146 VAL A CG1 1 ATOM 1121 C CG2 . VAL A 1 146 ? 22.680 -27.068 -51.465 1.00 21.95 ? 146 VAL A CG2 1 ATOM 1122 N N . GLN A 1 147 ? 19.769 -27.147 -55.093 1.00 21.43 ? 147 GLN A N 1 ATOM 1123 C CA . GLN A 1 147 ? 19.030 -27.797 -56.155 1.00 22.01 ? 147 GLN A CA 1 ATOM 1124 C C . GLN A 1 147 ? 19.979 -28.383 -57.192 1.00 28.71 ? 147 GLN A C 1 ATOM 1125 O O . GLN A 1 147 ? 20.871 -27.700 -57.712 1.00 24.70 ? 147 GLN A O 1 ATOM 1126 C CB . GLN A 1 147 ? 18.079 -26.818 -56.811 1.00 30.89 ? 147 GLN A CB 1 ATOM 1127 C CG . GLN A 1 147 ? 17.291 -27.419 -57.945 1.00 42.05 ? 147 GLN A CG 1 ATOM 1128 C CD . GLN A 1 147 ? 16.357 -26.417 -58.586 1.00 46.45 ? 147 GLN A CD 1 ATOM 1129 O OE1 . GLN A 1 147 ? 16.723 -25.741 -59.558 1.00 39.85 ? 147 GLN A OE1 1 ATOM 1130 N NE2 . GLN A 1 147 ? 15.145 -26.302 -58.040 1.00 47.41 ? 147 GLN A NE2 1 ATOM 1131 N N . TRP A 1 148 ? 19.787 -29.659 -57.484 1.00 18.14 ? 148 TRP A N 1 ATOM 1132 C CA . TRP A 1 148 ? 20.623 -30.344 -58.449 1.00 17.49 ? 148 TRP A CA 1 ATOM 1133 C C . TRP A 1 148 ? 19.899 -30.439 -59.783 1.00 18.79 ? 148 TRP A C 1 ATOM 1134 O O . TRP A 1 148 ? 18.685 -30.613 -59.832 1.00 20.28 ? 148 TRP A O 1 ATOM 1135 C CB . TRP A 1 148 ? 20.986 -31.749 -57.958 1.00 17.10 ? 148 TRP A CB 1 ATOM 1136 C CG . TRP A 1 148 ? 22.055 -31.795 -56.920 1.00 19.52 ? 148 TRP A CG 1 ATOM 1137 C CD1 . TRP A 1 148 ? 21.886 -31.943 -55.566 1.00 22.58 ? 148 TRP A CD1 1 ATOM 1138 C CD2 . TRP A 1 148 ? 23.466 -31.712 -57.141 1.00 21.96 ? 148 TRP A CD2 1 ATOM 1139 N NE1 . TRP A 1 148 ? 23.107 -31.955 -54.937 1.00 22.75 ? 148 TRP A NE1 1 ATOM 1140 C CE2 . TRP A 1 148 ? 24.093 -31.811 -55.880 1.00 25.20 ? 148 TRP A CE2 1 ATOM 1141 C CE3 . TRP A 1 148 ? 24.261 -31.559 -58.284 1.00 23.22 ? 148 TRP A CE3 1 ATOM 1142 C CZ2 . TRP A 1 148 ? 25.483 -31.760 -55.730 1.00 24.95 ? 148 TRP A CZ2 1 ATOM 1143 C CZ3 . TRP A 1 148 ? 25.639 -31.517 -58.137 1.00 20.63 ? 148 TRP A CZ3 1 ATOM 1144 C CH2 . TRP A 1 148 ? 26.236 -31.615 -56.866 1.00 23.46 ? 148 TRP A CH2 1 ATOM 1145 N N . LYS A 1 149 ? 20.660 -30.325 -60.865 1.00 26.52 ? 149 LYS A N 1 ATOM 1146 C CA . LYS A 1 149 ? 20.114 -30.474 -62.204 1.00 24.69 ? 149 LYS A CA 1 ATOM 1147 C C . LYS A 1 149 ? 21.113 -31.163 -63.097 1.00 21.46 ? 149 LYS A C 1 ATOM 1148 O O . LYS A 1 149 ? 22.282 -30.796 -63.146 1.00 24.64 ? 149 LYS A O 1 ATOM 1149 C CB . LYS A 1 149 ? 19.726 -29.123 -62.818 1.00 24.13 ? 149 LYS A CB 1 ATOM 1150 C CG . LYS A 1 149 ? 18.348 -28.648 -62.428 1.00 30.82 ? 149 LYS A CG 1 ATOM 1151 C CD . LYS A 1 149 ? 17.893 -27.510 -63.310 1.00 35.07 ? 149 LYS A CD 1 ATOM 1152 C CE . LYS A 1 149 ? 16.591 -26.915 -62.796 1.00 41.47 ? 149 LYS A CE 1 ATOM 1153 N NZ . LYS A 1 149 ? 16.178 -25.690 -63.548 1.00 48.84 ? 149 LYS A NZ 1 ATOM 1154 N N . VAL A 1 150 ? 20.638 -32.164 -63.814 1.00 22.18 ? 150 VAL A N 1 ATOM 1155 C CA . VAL A 1 150 ? 21.465 -32.856 -64.773 1.00 26.21 ? 150 VAL A CA 1 ATOM 1156 C C . VAL A 1 150 ? 20.806 -32.657 -66.135 1.00 27.68 ? 150 VAL A C 1 ATOM 1157 O O . VAL A 1 150 ? 19.652 -33.044 -66.323 1.00 25.80 ? 150 VAL A O 1 ATOM 1158 C CB . VAL A 1 150 ? 21.575 -34.350 -64.415 1.00 23.84 ? 150 VAL A CB 1 ATOM 1159 C CG1 . VAL A 1 150 ? 22.488 -35.056 -65.372 1.00 20.16 ? 150 VAL A CG1 1 ATOM 1160 C CG2 . VAL A 1 150 ? 22.091 -34.514 -62.994 1.00 18.70 ? 150 VAL A CG2 1 ATOM 1161 N N . ASP A 1 151 ? 21.529 -32.034 -67.066 1.00 33.67 ? 151 ASP A N 1 ATOM 1162 C CA . ASP A 1 151 ? 20.983 -31.713 -68.385 1.00 32.64 ? 151 ASP A CA 1 ATOM 1163 C C . ASP A 1 151 ? 19.607 -31.067 -68.242 1.00 31.32 ? 151 ASP A C 1 ATOM 1164 O O . ASP A 1 151 ? 18.642 -31.502 -68.866 1.00 31.35 ? 151 ASP A O 1 ATOM 1165 C CB . ASP A 1 151 ? 20.865 -32.973 -69.259 1.00 35.25 ? 151 ASP A CB 1 ATOM 1166 C CG . ASP A 1 151 ? 22.216 -33.519 -69.715 1.00 39.19 ? 151 ASP A CG 1 ATOM 1167 O OD1 . ASP A 1 151 ? 23.180 -32.736 -69.905 1.00 39.35 ? 151 ASP A OD1 1 ATOM 1168 O OD2 . ASP A 1 151 ? 22.299 -34.752 -69.900 1.00 37.42 ? 151 ASP A OD2 1 ATOM 1169 N N . ASN A 1 152 ? 19.503 -30.103 -67.330 1.00 33.36 ? 152 ASN A N 1 ATOM 1170 C CA . ASN A 1 152 ? 18.287 -29.344 -67.032 1.00 40.41 ? 152 ASN A CA 1 ATOM 1171 C C . ASN A 1 152 ? 17.139 -30.176 -66.459 1.00 36.79 ? 152 ASN A C 1 ATOM 1172 O O . ASN A 1 152 ? 16.020 -29.664 -66.344 1.00 39.97 ? 152 ASN A O 1 ATOM 1173 C CB . ASN A 1 152 ? 17.785 -28.584 -68.260 1.00 45.75 ? 152 ASN A CB 1 ATOM 1174 C CG . ASN A 1 152 ? 18.178 -27.125 -68.233 1.00 62.20 ? 152 ASN A CG 1 ATOM 1175 O OD1 . ASN A 1 152 ? 19.002 -26.701 -67.414 1.00 62.10 ? 152 ASN A OD1 1 ATOM 1176 N ND2 . ASN A 1 152 ? 17.584 -26.339 -69.125 1.00 73.24 ? 152 ASN A ND2 1 ATOM 1177 N N . ALA A 1 153 ? 17.359 -31.439 -66.105 1.00 28.44 ? 153 ALA A N 1 ATOM 1178 C CA . ALA A 1 153 ? 16.357 -32.210 -65.377 1.00 27.08 ? 153 ALA A CA 1 ATOM 1179 C C . ALA A 1 153 ? 16.544 -32.026 -63.873 1.00 31.06 ? 153 ALA A C 1 ATOM 1180 O O . ALA A 1 153 ? 17.652 -32.206 -63.344 1.00 28.58 ? 153 ALA A O 1 ATOM 1181 C CB . ALA A 1 153 ? 16.452 -33.671 -65.734 1.00 25.54 ? 153 ALA A CB 1 ATOM 1182 N N . LEU A 1 154 ? 15.467 -31.659 -63.186 1.00 28.85 ? 154 LEU A N 1 ATOM 1183 C CA . LEU A 1 154 ? 15.509 -31.554 -61.731 1.00 32.21 ? 154 LEU A CA 1 ATOM 1184 C C . LEU A 1 154 ? 15.838 -32.913 -61.101 1.00 28.72 ? 154 LEU A C 1 ATOM 1185 O O . LEU A 1 154 ? 15.173 -33.906 -61.388 1.00 24.69 ? 154 LEU A O 1 ATOM 1186 C CB . LEU A 1 154 ? 14.181 -31.012 -61.177 1.00 27.80 ? 154 LEU A CB 1 ATOM 1187 C CG . LEU A 1 154 ? 14.101 -30.907 -59.641 1.00 29.85 ? 154 LEU A CG 1 ATOM 1188 C CD1 . LEU A 1 154 ? 15.127 -29.930 -59.093 1.00 27.80 ? 154 LEU A CD1 1 ATOM 1189 C CD2 . LEU A 1 154 ? 12.714 -30.512 -59.172 1.00 33.10 ? 154 LEU A CD2 1 ATOM 1190 N N . GLN A 1 155 ? 16.876 -32.961 -60.268 1.00 27.77 ? 155 GLN A N 1 ATOM 1191 C CA . GLN A 1 155 ? 17.179 -34.178 -59.519 1.00 26.23 ? 155 GLN A CA 1 ATOM 1192 C C . GLN A 1 155 ? 16.420 -34.184 -58.203 1.00 26.97 ? 155 GLN A C 1 ATOM 1193 O O . GLN A 1 155 ? 16.459 -33.212 -57.445 1.00 30.07 ? 155 GLN A O 1 ATOM 1194 C CB . GLN A 1 155 ? 18.674 -34.302 -59.247 1.00 20.26 ? 155 GLN A CB 1 ATOM 1195 C CG . GLN A 1 155 ? 19.511 -34.395 -60.505 1.00 25.24 ? 155 GLN A CG 1 ATOM 1196 C CD . GLN A 1 155 ? 19.063 -35.516 -61.429 1.00 20.35 ? 155 GLN A CD 1 ATOM 1197 O OE1 . GLN A 1 155 ? 19.310 -36.685 -61.163 1.00 19.65 ? 155 GLN A OE1 1 ATOM 1198 N NE2 . GLN A 1 155 ? 18.408 -35.158 -62.521 1.00 21.35 ? 155 GLN A NE2 1 ATOM 1199 N N . SER A 1 156 ? 15.725 -35.278 -57.928 1.00 25.13 ? 156 SER A N 1 ATOM 1200 C CA . SER A 1 156 ? 15.003 -35.380 -56.670 1.00 28.09 ? 156 SER A CA 1 ATOM 1201 C C . SER A 1 156 ? 15.125 -36.744 -56.009 1.00 30.35 ? 156 SER A C 1 ATOM 1202 O O . SER A 1 156 ? 14.790 -37.772 -56.613 1.00 29.23 ? 156 SER A O 1 ATOM 1203 C CB . SER A 1 156 ? 13.525 -35.054 -56.867 1.00 24.39 ? 156 SER A CB 1 ATOM 1204 O OG . SER A 1 156 ? 12.842 -35.198 -55.635 1.00 25.65 ? 156 SER A OG 1 ATOM 1205 N N . GLY A 1 157 ? 15.586 -36.742 -54.761 1.00 27.89 ? 157 GLY A N 1 ATOM 1206 C CA . GLY A 1 157 ? 15.639 -37.953 -53.964 1.00 23.03 ? 157 GLY A CA 1 ATOM 1207 C C . GLY A 1 157 ? 16.951 -38.721 -54.052 1.00 21.09 ? 157 GLY A C 1 ATOM 1208 O O . GLY A 1 157 ? 17.133 -39.715 -53.353 1.00 25.19 ? 157 GLY A O 1 ATOM 1209 N N . ASN A 1 158 ? 17.860 -38.276 -54.916 1.00 21.88 ? 158 ASN A N 1 ATOM 1210 C CA . ASN A 1 158 ? 19.149 -38.951 -55.078 1.00 26.13 ? 158 ASN A CA 1 ATOM 1211 C C . ASN A 1 158 ? 20.340 -38.137 -54.548 1.00 30.18 ? 158 ASN A C 1 ATOM 1212 O O . ASN A 1 158 ? 21.476 -38.291 -55.008 1.00 33.99 ? 158 ASN A O 1 ATOM 1213 C CB . ASN A 1 158 ? 19.366 -39.364 -56.536 1.00 18.72 ? 158 ASN A CB 1 ATOM 1214 C CG . ASN A 1 158 ? 19.171 -38.219 -57.501 1.00 26.17 ? 158 ASN A CG 1 ATOM 1215 O OD1 . ASN A 1 158 ? 18.716 -37.140 -57.126 1.00 27.64 ? 158 ASN A OD1 1 ATOM 1216 N ND2 . ASN A 1 158 ? 19.501 -38.455 -58.766 1.00 23.41 ? 158 ASN A ND2 1 ATOM 1217 N N . SER A 1 159 ? 20.072 -37.271 -53.578 1.00 23.87 ? 159 SER A N 1 ATOM 1218 C CA . SER A 1 159 ? 21.137 -36.510 -52.944 1.00 25.53 ? 159 SER A CA 1 ATOM 1219 C C . SER A 1 159 ? 20.968 -36.536 -51.429 1.00 21.42 ? 159 SER A C 1 ATOM 1220 O O . SER A 1 159 ? 19.866 -36.729 -50.916 1.00 18.89 ? 159 SER A O 1 ATOM 1221 C CB . SER A 1 159 ? 21.171 -35.067 -53.460 1.00 17.54 ? 159 SER A CB 1 ATOM 1222 O OG . SER A 1 159 ? 20.000 -34.350 -53.085 1.00 18.44 ? 159 SER A OG 1 ATOM 1223 N N . GLN A 1 160 ? 22.070 -36.343 -50.721 1.00 18.82 ? 160 GLN A N 1 ATOM 1224 C CA . GLN A 1 160 ? 22.043 -36.252 -49.274 1.00 17.70 ? 160 GLN A CA 1 ATOM 1225 C C . GLN A 1 160 ? 22.876 -35.066 -48.799 1.00 25.26 ? 160 GLN A C 1 ATOM 1226 O O . GLN A 1 160 ? 23.912 -34.726 -49.388 1.00 16.41 ? 160 GLN A O 1 ATOM 1227 C CB . GLN A 1 160 ? 22.515 -37.561 -48.640 1.00 18.14 ? 160 GLN A CB 1 ATOM 1228 C CG . GLN A 1 160 ? 21.547 -38.727 -48.866 1.00 34.76 ? 160 GLN A CG 1 ATOM 1229 C CD . GLN A 1 160 ? 22.005 -40.027 -48.216 1.00 36.71 ? 160 GLN A CD 1 ATOM 1230 O OE1 . GLN A 1 160 ? 23.131 -40.487 -48.436 1.00 38.27 ? 160 GLN A OE1 1 ATOM 1231 N NE2 . GLN A 1 160 ? 21.131 -40.625 -47.410 1.00 34.44 ? 160 GLN A NE2 1 ATOM 1232 N N . GLU A 1 161 ? 22.401 -34.431 -47.736 1.00 19.51 ? 161 GLU A N 1 ATOM 1233 C CA . GLU A 1 161 ? 23.068 -33.277 -47.172 1.00 21.20 ? 161 GLU A CA 1 ATOM 1234 C C . GLU A 1 161 ? 23.639 -33.589 -45.803 1.00 24.66 ? 161 GLU A C 1 ATOM 1235 O O . GLU A 1 161 ? 23.017 -34.288 -45.020 1.00 19.64 ? 161 GLU A O 1 ATOM 1236 C CB . GLU A 1 161 ? 22.086 -32.124 -47.018 1.00 24.36 ? 161 GLU A CB 1 ATOM 1237 C CG . GLU A 1 161 ? 21.577 -31.573 -48.318 1.00 40.39 ? 161 GLU A CG 1 ATOM 1238 C CD . GLU A 1 161 ? 20.778 -30.303 -48.130 1.00 46.14 ? 161 GLU A CD 1 ATOM 1239 O OE1 . GLU A 1 161 ? 20.634 -29.862 -46.964 1.00 45.10 ? 161 GLU A OE1 1 ATOM 1240 O OE2 . GLU A 1 161 ? 20.297 -29.750 -49.147 1.00 47.61 ? 161 GLU A OE2 1 ATOM 1241 N N . SER A 1 162 ? 24.826 -33.056 -45.529 1.00 24.41 ? 162 SER A N 1 ATOM 1242 C CA . SER A 1 162 ? 25.354 -33.010 -44.181 1.00 20.10 ? 162 SER A CA 1 ATOM 1243 C C . SER A 1 162 ? 25.724 -31.563 -43.875 1.00 21.26 ? 162 SER A C 1 ATOM 1244 O O . SER A 1 162 ? 26.191 -30.834 -44.753 1.00 27.64 ? 162 SER A O 1 ATOM 1245 C CB . SER A 1 162 ? 26.573 -33.920 -44.056 1.00 23.63 ? 162 SER A CB 1 ATOM 1246 O OG . SER A 1 162 ? 26.945 -34.098 -42.700 1.00 27.25 ? 162 SER A OG 1 ATOM 1247 N N . VAL A 1 163 ? 25.500 -31.149 -42.634 1.00 17.23 ? 163 VAL A N 1 ATOM 1248 C CA . VAL A 1 163 ? 25.822 -29.797 -42.178 1.00 20.40 ? 163 VAL A CA 1 ATOM 1249 C C . VAL A 1 163 ? 26.679 -29.859 -40.915 1.00 23.41 ? 163 VAL A C 1 ATOM 1250 O O . VAL A 1 163 ? 26.395 -30.637 -40.008 1.00 22.41 ? 163 VAL A O 1 ATOM 1251 C CB . VAL A 1 163 ? 24.546 -29.000 -41.843 1.00 21.69 ? 163 VAL A CB 1 ATOM 1252 C CG1 . VAL A 1 163 ? 24.904 -27.590 -41.426 1.00 23.76 ? 163 VAL A CG1 1 ATOM 1253 C CG2 . VAL A 1 163 ? 23.615 -28.974 -43.023 1.00 21.98 ? 163 VAL A CG2 1 ATOM 1254 N N . THR A 1 164 ? 27.730 -29.048 -40.857 1.00 17.24 ? 164 THR A N 1 ATOM 1255 C CA . THR A 1 164 ? 28.575 -29.000 -39.671 1.00 21.06 ? 164 THR A CA 1 ATOM 1256 C C . THR A 1 164 ? 27.846 -28.307 -38.536 1.00 25.16 ? 164 THR A C 1 ATOM 1257 O O . THR A 1 164 ? 26.825 -27.644 -38.737 1.00 22.55 ? 164 THR A O 1 ATOM 1258 C CB . THR A 1 164 ? 29.881 -28.234 -39.935 1.00 19.59 ? 164 THR A CB 1 ATOM 1259 O OG1 . THR A 1 164 ? 29.582 -26.887 -40.324 1.00 20.64 ? 164 THR A OG1 1 ATOM 1260 C CG2 . THR A 1 164 ? 30.672 -28.906 -41.035 1.00 19.04 ? 164 THR A CG2 1 ATOM 1261 N N . GLU A 1 165 ? 28.340 -28.524 -37.323 1.00 29.43 ? 165 GLU A N 1 ATOM 1262 C CA . GLU A 1 165 ? 27.903 -27.715 -36.202 1.00 21.31 ? 165 GLU A CA 1 ATOM 1263 C C . GLU A 1 165 ? 28.530 -26.339 -36.333 1.00 20.18 ? 165 GLU A C 1 ATOM 1264 O O . GLU A 1 165 ? 29.397 -26.116 -37.180 1.00 23.22 ? 165 GLU A O 1 ATOM 1265 C CB . GLU A 1 165 ? 28.298 -28.374 -34.886 1.00 23.52 ? 165 GLU A CB 1 ATOM 1266 C CG . GLU A 1 165 ? 27.574 -29.667 -34.629 1.00 31.56 ? 165 GLU A CG 1 ATOM 1267 C CD . GLU A 1 165 ? 26.081 -29.460 -34.444 1.00 40.13 ? 165 GLU A CD 1 ATOM 1268 O OE1 . GLU A 1 165 ? 25.679 -28.394 -33.930 1.00 40.05 ? 165 GLU A OE1 1 ATOM 1269 O OE2 . GLU A 1 165 ? 25.304 -30.363 -34.816 1.00 49.62 ? 165 GLU A OE2 1 ATOM 1270 N N . GLN A 1 166 ? 28.088 -25.397 -35.504 1.00 20.79 ? 166 GLN A N 1 ATOM 1271 C CA . GLN A 1 166 ? 28.625 -24.050 -35.636 1.00 22.63 ? 166 GLN A CA 1 ATOM 1272 C C . GLN A 1 166 ? 30.123 -24.009 -35.373 1.00 23.09 ? 166 GLN A C 1 ATOM 1273 O O . GLN A 1 166 ? 30.635 -24.640 -34.443 1.00 24.52 ? 166 GLN A O 1 ATOM 1274 C CB . GLN A 1 166 ? 27.897 -23.081 -34.714 1.00 28.16 ? 166 GLN A CB 1 ATOM 1275 C CG . GLN A 1 166 ? 27.015 -22.100 -35.445 1.00 29.30 ? 166 GLN A CG 1 ATOM 1276 C CD . GLN A 1 166 ? 26.317 -21.141 -34.500 1.00 32.69 ? 166 GLN A CD 1 ATOM 1277 O OE1 . GLN A 1 166 ? 25.839 -21.544 -33.437 1.00 30.85 ? 166 GLN A OE1 1 ATOM 1278 N NE2 . GLN A 1 166 ? 26.266 -19.856 -34.877 1.00 28.92 ? 166 GLN A NE2 1 ATOM 1279 N N . ASP A 1 167 ? 30.833 -23.272 -36.210 1.00 22.72 ? 167 ASP A N 1 ATOM 1280 C CA . ASP A 1 167 ? 32.260 -23.144 -36.027 1.00 19.76 ? 167 ASP A CA 1 ATOM 1281 C C . ASP A 1 167 ? 32.544 -22.380 -34.740 1.00 25.02 ? 167 ASP A C 1 ATOM 1282 O O . ASP A 1 167 ? 31.867 -21.407 -34.420 1.00 21.56 ? 167 ASP A O 1 ATOM 1283 C CB . ASP A 1 167 ? 32.894 -22.443 -37.224 1.00 19.45 ? 167 ASP A CB 1 ATOM 1284 C CG . ASP A 1 167 ? 34.380 -22.248 -37.049 1.00 25.75 ? 167 ASP A CG 1 ATOM 1285 O OD1 . ASP A 1 167 ? 35.132 -23.195 -37.356 1.00 20.10 ? 167 ASP A OD1 1 ATOM 1286 O OD2 . ASP A 1 167 ? 34.790 -21.162 -36.574 1.00 28.10 ? 167 ASP A OD2 1 ATOM 1287 N N . SER A 1 168 ? 33.543 -22.824 -33.989 1.00 29.19 ? 168 SER A N 1 ATOM 1288 C CA . SER A 1 168 ? 33.783 -22.234 -32.679 1.00 31.65 ? 168 SER A CA 1 ATOM 1289 C C . SER A 1 168 ? 34.477 -20.872 -32.784 1.00 33.38 ? 168 SER A C 1 ATOM 1290 O O . SER A 1 168 ? 34.524 -20.116 -31.810 1.00 25.68 ? 168 SER A O 1 ATOM 1291 C CB . SER A 1 168 ? 34.592 -23.185 -31.798 1.00 30.19 ? 168 SER A CB 1 ATOM 1292 O OG . SER A 1 168 ? 35.953 -23.184 -32.183 1.00 37.71 ? 168 SER A OG 1 ATOM 1293 N N . LYS A 1 169 ? 35.005 -20.558 -33.965 1.00 24.70 ? 169 LYS A N 1 ATOM 1294 C CA . LYS A 1 169 ? 35.730 -19.306 -34.133 1.00 28.16 ? 169 LYS A CA 1 ATOM 1295 C C . LYS A 1 169 ? 34.886 -18.230 -34.778 1.00 22.57 ? 169 LYS A C 1 ATOM 1296 O O . LYS A 1 169 ? 34.765 -17.141 -34.240 1.00 36.64 ? 169 LYS A O 1 ATOM 1297 C CB . LYS A 1 169 ? 37.027 -19.522 -34.920 1.00 33.64 ? 169 LYS A CB 1 ATOM 1298 C CG . LYS A 1 169 ? 38.130 -20.216 -34.123 1.00 43.24 ? 169 LYS A CG 1 ATOM 1299 C CD . LYS A 1 169 ? 39.319 -20.580 -35.008 1.00 56.45 ? 169 LYS A CD 1 ATOM 1300 C CE . LYS A 1 169 ? 40.124 -21.734 -34.415 1.00 66.29 ? 169 LYS A CE 1 ATOM 1301 N NZ . LYS A 1 169 ? 41.082 -22.317 -35.407 1.00 73.06 ? 169 LYS A NZ 1 ATOM 1302 N N . ASP A 1 170 ? 34.296 -18.536 -35.930 1.00 25.27 ? 170 ASP A N 1 ATOM 1303 C CA . ASP A 1 170 ? 33.547 -17.534 -36.693 1.00 24.98 ? 170 ASP A CA 1 ATOM 1304 C C . ASP A 1 170 ? 32.029 -17.734 -36.715 1.00 23.05 ? 170 ASP A C 1 ATOM 1305 O O . ASP A 1 170 ? 31.323 -16.972 -37.377 1.00 19.63 ? 170 ASP A O 1 ATOM 1306 C CB . ASP A 1 170 ? 34.091 -17.417 -38.128 1.00 25.36 ? 170 ASP A CB 1 ATOM 1307 C CG . ASP A 1 170 ? 33.870 -18.677 -38.964 1.00 32.91 ? 170 ASP A CG 1 ATOM 1308 O OD1 . ASP A 1 170 ? 32.963 -19.482 -38.660 1.00 30.82 ? 170 ASP A OD1 1 ATOM 1309 O OD2 . ASP A 1 170 ? 34.607 -18.852 -39.955 1.00 41.06 ? 170 ASP A OD2 1 ATOM 1310 N N . SER A 1 171 ? 31.545 -18.781 -36.041 1.00 21.48 ? 171 SER A N 1 ATOM 1311 C CA . SER A 1 171 ? 30.100 -19.048 -35.892 1.00 21.21 ? 171 SER A CA 1 ATOM 1312 C C . SER A 1 171 ? 29.335 -19.433 -37.172 1.00 19.58 ? 171 SER A C 1 ATOM 1313 O O . SER A 1 171 ? 28.108 -19.390 -37.200 1.00 29.79 ? 171 SER A O 1 ATOM 1314 C CB . SER A 1 171 ? 29.391 -17.864 -35.209 1.00 20.04 ? 171 SER A CB 1 ATOM 1315 O OG . SER A 1 171 ? 29.829 -17.703 -33.873 1.00 22.24 ? 171 SER A OG 1 ATOM 1316 N N . THR A 1 172 ? 30.047 -19.806 -38.223 1.00 18.48 ? 172 THR A N 1 ATOM 1317 C CA . THR A 1 172 ? 29.392 -20.163 -39.472 1.00 22.22 ? 172 THR A CA 1 ATOM 1318 C C . THR A 1 172 ? 29.103 -21.663 -39.563 1.00 23.13 ? 172 THR A C 1 ATOM 1319 O O . THR A 1 172 ? 29.638 -22.476 -38.806 1.00 18.60 ? 172 THR A O 1 ATOM 1320 C CB . THR A 1 172 ? 30.267 -19.806 -40.688 1.00 23.70 ? 172 THR A CB 1 ATOM 1321 O OG1 . THR A 1 172 ? 31.443 -20.636 -40.685 1.00 24.40 ? 172 THR A OG1 1 ATOM 1322 C CG2 . THR A 1 172 ? 30.649 -18.323 -40.679 1.00 15.99 ? 172 THR A CG2 1 ATOM 1323 N N . TYR A 1 173 ? 28.250 -22.022 -40.508 1.00 15.11 ? 173 TYR A N 1 ATOM 1324 C CA . TYR A 1 173 ? 28.044 -23.415 -40.835 1.00 19.10 ? 173 TYR A CA 1 ATOM 1325 C C . TYR A 1 173 ? 28.693 -23.675 -42.194 1.00 19.49 ? 173 TYR A C 1 ATOM 1326 O O . TYR A 1 173 ? 28.965 -22.742 -42.962 1.00 21.26 ? 173 TYR A O 1 ATOM 1327 C CB . TYR A 1 173 ? 26.545 -23.730 -40.911 1.00 15.29 ? 173 TYR A CB 1 ATOM 1328 C CG . TYR A 1 173 ? 25.774 -23.466 -39.640 1.00 22.76 ? 173 TYR A CG 1 ATOM 1329 C CD1 . TYR A 1 173 ? 25.216 -22.210 -39.388 1.00 23.11 ? 173 TYR A CD1 1 ATOM 1330 C CD2 . TYR A 1 173 ? 25.595 -24.471 -38.688 1.00 21.91 ? 173 TYR A CD2 1 ATOM 1331 C CE1 . TYR A 1 173 ? 24.507 -21.960 -38.222 1.00 23.40 ? 173 TYR A CE1 1 ATOM 1332 C CE2 . TYR A 1 173 ? 24.887 -24.230 -37.519 1.00 25.37 ? 173 TYR A CE2 1 ATOM 1333 C CZ . TYR A 1 173 ? 24.344 -22.972 -37.296 1.00 28.47 ? 173 TYR A CZ 1 ATOM 1334 O OH . TYR A 1 173 ? 23.643 -22.726 -36.147 1.00 33.70 ? 173 TYR A OH 1 ATOM 1335 N N . SER A 1 174 ? 28.951 -24.943 -42.483 1.00 19.28 ? 174 SER A N 1 ATOM 1336 C CA . SER A 1 174 ? 29.264 -25.363 -43.843 1.00 20.54 ? 174 SER A CA 1 ATOM 1337 C C . SER A 1 174 ? 28.369 -26.542 -44.186 1.00 20.17 ? 174 SER A C 1 ATOM 1338 O O . SER A 1 174 ? 27.916 -27.258 -43.294 1.00 23.27 ? 174 SER A O 1 ATOM 1339 C CB . SER A 1 174 ? 30.751 -25.700 -44.004 1.00 13.93 ? 174 SER A CB 1 ATOM 1340 O OG . SER A 1 174 ? 31.532 -24.508 -44.032 1.00 14.00 ? 174 SER A OG 1 ATOM 1341 N N . LEU A 1 175 ? 28.084 -26.727 -45.469 1.00 23.45 ? 175 LEU A N 1 ATOM 1342 C CA . LEU A 1 175 ? 27.164 -27.780 -45.892 1.00 16.75 ? 175 LEU A CA 1 ATOM 1343 C C . LEU A 1 175 ? 27.716 -28.523 -47.093 1.00 21.79 ? 175 LEU A C 1 ATOM 1344 O O . LEU A 1 175 ? 28.318 -27.931 -47.993 1.00 20.78 ? 175 LEU A O 1 ATOM 1345 C CB . LEU A 1 175 ? 25.788 -27.193 -46.232 1.00 15.82 ? 175 LEU A CB 1 ATOM 1346 C CG . LEU A 1 175 ? 24.661 -28.120 -46.706 1.00 23.31 ? 175 LEU A CG 1 ATOM 1347 C CD1 . LEU A 1 175 ? 23.294 -27.561 -46.329 1.00 15.14 ? 175 LEU A CD1 1 ATOM 1348 C CD2 . LEU A 1 175 ? 24.735 -28.354 -48.201 1.00 14.17 ? 175 LEU A CD2 1 ATOM 1349 N N . SER A 1 176 ? 27.487 -29.827 -47.109 1.00 19.93 ? 176 SER A N 1 ATOM 1350 C CA . SER A 1 176 ? 27.823 -30.629 -48.267 1.00 17.10 ? 176 SER A CA 1 ATOM 1351 C C . SER A 1 176 ? 26.570 -31.282 -48.826 1.00 26.26 ? 176 SER A C 1 ATOM 1352 O O . SER A 1 176 ? 25.807 -31.928 -48.099 1.00 27.98 ? 176 SER A O 1 ATOM 1353 C CB . SER A 1 176 ? 28.869 -31.695 -47.913 1.00 18.14 ? 176 SER A CB 1 ATOM 1354 O OG . SER A 1 176 ? 28.300 -32.767 -47.177 1.00 27.05 ? 176 SER A OG 1 ATOM 1355 N N . SER A 1 177 ? 26.350 -31.097 -50.121 1.00 27.22 ? 177 SER A N 1 ATOM 1356 C CA . SER A 1 177 ? 25.309 -31.840 -50.818 1.00 26.65 ? 177 SER A CA 1 ATOM 1357 C C . SER A 1 177 ? 25.943 -32.818 -51.804 1.00 28.14 ? 177 SER A C 1 ATOM 1358 O O . SER A 1 177 ? 26.644 -32.411 -52.740 1.00 28.74 ? 177 SER A O 1 ATOM 1359 C CB . SER A 1 177 ? 24.350 -30.890 -51.530 1.00 25.46 ? 177 SER A CB 1 ATOM 1360 O OG . SER A 1 177 ? 23.245 -31.602 -52.048 1.00 22.15 ? 177 SER A OG 1 ATOM 1361 N N . THR A 1 178 ? 25.716 -34.106 -51.575 1.00 16.93 ? 178 THR A N 1 ATOM 1362 C CA . THR A 1 178 ? 26.268 -35.147 -52.438 1.00 20.99 ? 178 THR A CA 1 ATOM 1363 C C . THR A 1 178 ? 25.188 -35.804 -53.315 1.00 22.81 ? 178 THR A C 1 ATOM 1364 O O . THR A 1 178 ? 24.202 -36.346 -52.818 1.00 26.55 ? 178 THR A O 1 ATOM 1365 C CB . THR A 1 178 ? 26.986 -36.237 -51.615 1.00 23.90 ? 178 THR A CB 1 ATOM 1366 O OG1 . THR A 1 178 ? 27.875 -35.621 -50.678 1.00 21.72 ? 178 THR A OG1 1 ATOM 1367 C CG2 . THR A 1 178 ? 27.767 -37.170 -52.524 1.00 19.34 ? 178 THR A CG2 1 ATOM 1368 N N . LEU A 1 179 ? 25.384 -35.748 -54.625 1.00 22.33 ? 179 LEU A N 1 ATOM 1369 C CA . LEU A 1 179 ? 24.464 -36.363 -55.570 1.00 23.96 ? 179 LEU A CA 1 ATOM 1370 C C . LEU A 1 179 ? 25.063 -37.681 -56.034 1.00 26.82 ? 179 LEU A C 1 ATOM 1371 O O . LEU A 1 179 ? 26.220 -37.719 -56.443 1.00 31.23 ? 179 LEU A O 1 ATOM 1372 C CB . LEU A 1 179 ? 24.256 -35.434 -56.760 1.00 19.83 ? 179 LEU A CB 1 ATOM 1373 C CG . LEU A 1 179 ? 23.498 -35.932 -57.993 1.00 21.24 ? 179 LEU A CG 1 ATOM 1374 C CD1 . LEU A 1 179 ? 21.998 -36.070 -57.736 1.00 22.20 ? 179 LEU A CD1 1 ATOM 1375 C CD2 . LEU A 1 179 ? 23.770 -34.955 -59.132 1.00 21.13 ? 179 LEU A CD2 1 ATOM 1376 N N . THR A 1 180 ? 24.285 -38.759 -55.969 1.00 22.65 ? 180 THR A N 1 ATOM 1377 C CA . THR A 1 180 ? 24.811 -40.087 -56.270 1.00 24.03 ? 180 THR A CA 1 ATOM 1378 C C . THR A 1 180 ? 24.078 -40.785 -57.417 1.00 25.62 ? 180 THR A C 1 ATOM 1379 O O . THR A 1 180 ? 22.857 -40.918 -57.405 1.00 30.39 ? 180 THR A O 1 ATOM 1380 C CB . THR A 1 180 ? 24.838 -40.991 -55.015 1.00 29.26 ? 180 THR A CB 1 ATOM 1381 O OG1 . THR A 1 180 ? 25.648 -40.375 -54.014 1.00 34.46 ? 180 THR A OG1 1 ATOM 1382 C CG2 . THR A 1 180 ? 25.435 -42.358 -55.344 1.00 26.65 ? 180 THR A CG2 1 ATOM 1383 N N . LEU A 1 181 ? 24.858 -41.238 -58.396 1.00 26.20 ? 181 LEU A N 1 ATOM 1384 C CA . LEU A 1 181 ? 24.357 -41.814 -59.630 1.00 28.32 ? 181 LEU A CA 1 ATOM 1385 C C . LEU A 1 181 ? 25.170 -43.056 -59.933 1.00 33.52 ? 181 LEU A C 1 ATOM 1386 O O . LEU A 1 181 ? 26.336 -43.157 -59.539 1.00 36.52 ? 181 LEU A O 1 ATOM 1387 C CB . LEU A 1 181 ? 24.605 -40.860 -60.791 1.00 35.88 ? 181 LEU A CB 1 ATOM 1388 C CG . LEU A 1 181 ? 24.127 -39.421 -60.822 1.00 48.49 ? 181 LEU A CG 1 ATOM 1389 C CD1 . LEU A 1 181 ? 24.920 -38.718 -61.901 1.00 54.27 ? 181 LEU A CD1 1 ATOM 1390 C CD2 . LEU A 1 181 ? 22.647 -39.358 -61.140 1.00 56.05 ? 181 LEU A CD2 1 ATOM 1391 N N . SER A 1 182 ? 24.569 -43.985 -60.669 1.00 34.81 ? 182 SER A N 1 ATOM 1392 C CA . SER A 1 182 ? 25.300 -45.125 -61.188 1.00 34.61 ? 182 SER A CA 1 ATOM 1393 C C . SER A 1 182 ? 26.277 -44.590 -62.219 1.00 34.61 ? 182 SER A C 1 ATOM 1394 O O . SER A 1 182 ? 26.030 -43.541 -62.821 1.00 33.57 ? 182 SER A O 1 ATOM 1395 C CB . SER A 1 182 ? 24.337 -46.123 -61.828 1.00 36.70 ? 182 SER A CB 1 ATOM 1396 O OG . SER A 1 182 ? 23.733 -45.582 -62.991 1.00 35.75 ? 182 SER A OG 1 ATOM 1397 N N . LYS A 1 183 ? 27.393 -45.283 -62.412 1.00 35.01 ? 183 LYS A N 1 ATOM 1398 C CA . LYS A 1 183 ? 28.327 -44.887 -63.456 1.00 35.53 ? 183 LYS A CA 1 ATOM 1399 C C . LYS A 1 183 ? 27.624 -44.837 -64.805 1.00 37.91 ? 183 LYS A C 1 ATOM 1400 O O . LYS A 1 183 ? 27.933 -43.986 -65.638 1.00 42.00 ? 183 LYS A O 1 ATOM 1401 C CB . LYS A 1 183 ? 29.512 -45.846 -63.541 1.00 35.44 ? 183 LYS A CB 1 ATOM 1402 C CG . LYS A 1 183 ? 30.549 -45.426 -64.569 1.00 38.20 ? 183 LYS A CG 1 ATOM 1403 C CD . LYS A 1 183 ? 31.495 -46.570 -64.910 1.00 44.67 ? 183 LYS A CD 1 ATOM 1404 C CE . LYS A 1 183 ? 32.482 -46.169 -65.994 1.00 53.85 ? 183 LYS A CE 1 ATOM 1405 N NZ . LYS A 1 183 ? 33.331 -47.324 -66.443 1.00 64.55 ? 183 LYS A NZ 1 ATOM 1406 N N . ALA A 1 184 ? 26.673 -45.745 -65.013 1.00 36.54 ? 184 ALA A N 1 ATOM 1407 C CA . ALA A 1 184 ? 25.974 -45.825 -66.293 1.00 45.01 ? 184 ALA A CA 1 ATOM 1408 C C . ALA A 1 184 ? 25.176 -44.553 -66.548 1.00 48.48 ? 184 ALA A C 1 ATOM 1409 O O . ALA A 1 184 ? 25.303 -43.947 -67.612 1.00 37.37 ? 184 ALA A O 1 ATOM 1410 C CB . ALA A 1 184 ? 25.069 -47.052 -66.344 1.00 40.24 ? 184 ALA A CB 1 ATOM 1411 N N . ASP A 1 185 ? 24.370 -44.153 -65.562 1.00 49.51 ? 185 ASP A N 1 ATOM 1412 C CA . ASP A 1 185 ? 23.585 -42.918 -65.656 1.00 47.55 ? 185 ASP A CA 1 ATOM 1413 C C . ASP A 1 185 ? 24.488 -41.694 -65.818 1.00 40.04 ? 185 ASP A C 1 ATOM 1414 O O . ASP A 1 185 ? 24.221 -40.835 -66.648 1.00 41.90 ? 185 ASP A O 1 ATOM 1415 C CB . ASP A 1 185 ? 22.649 -42.740 -64.444 1.00 54.01 ? 185 ASP A CB 1 ATOM 1416 C CG . ASP A 1 185 ? 21.420 -43.652 -64.499 1.00 57.86 ? 185 ASP A CG 1 ATOM 1417 O OD1 . ASP A 1 185 ? 21.125 -44.185 -65.587 1.00 64.32 ? 185 ASP A OD1 1 ATOM 1418 O OD2 . ASP A 1 185 ? 20.741 -43.829 -63.460 1.00 50.06 ? 185 ASP A OD2 1 ATOM 1419 N N . TYR A 1 186 ? 25.558 -41.628 -65.032 1.00 36.93 ? 186 TYR A N 1 ATOM 1420 C CA . TYR A 1 186 ? 26.493 -40.508 -65.096 1.00 31.59 ? 186 TYR A CA 1 ATOM 1421 C C . TYR A 1 186 ? 27.050 -40.298 -66.496 1.00 35.24 ? 186 TYR A C 1 ATOM 1422 O O . TYR A 1 186 ? 27.106 -39.169 -66.980 1.00 39.29 ? 186 TYR A O 1 ATOM 1423 C CB . TYR A 1 186 ? 27.644 -40.694 -64.099 1.00 31.29 ? 186 TYR A CB 1 ATOM 1424 C CG . TYR A 1 186 ? 28.696 -39.596 -64.144 1.00 29.93 ? 186 TYR A CG 1 ATOM 1425 C CD1 . TYR A 1 186 ? 28.450 -38.339 -63.588 1.00 28.97 ? 186 TYR A CD1 1 ATOM 1426 C CD2 . TYR A 1 186 ? 29.942 -39.823 -64.724 1.00 29.70 ? 186 TYR A CD2 1 ATOM 1427 C CE1 . TYR A 1 186 ? 29.410 -37.336 -63.618 1.00 26.32 ? 186 TYR A CE1 1 ATOM 1428 C CE2 . TYR A 1 186 ? 30.909 -38.826 -64.762 1.00 30.95 ? 186 TYR A CE2 1 ATOM 1429 C CZ . TYR A 1 186 ? 30.638 -37.582 -64.217 1.00 33.67 ? 186 TYR A CZ 1 ATOM 1430 O OH . TYR A 1 186 ? 31.602 -36.593 -64.253 1.00 32.79 ? 186 TYR A OH 1 ATOM 1431 N N . GLU A 1 187 ? 27.458 -41.384 -67.147 1.00 36.30 ? 187 GLU A N 1 ATOM 1432 C CA . GLU A 1 187 ? 28.016 -41.289 -68.497 1.00 39.36 ? 187 GLU A CA 1 ATOM 1433 C C . GLU A 1 187 ? 26.980 -40.904 -69.569 1.00 38.48 ? 187 GLU A C 1 ATOM 1434 O O . GLU A 1 187 ? 27.347 -40.459 -70.650 1.00 41.16 ? 187 GLU A O 1 ATOM 1435 C CB . GLU A 1 187 ? 28.751 -42.581 -68.899 1.00 39.21 ? 187 GLU A CB 1 ATOM 1436 C CG . GLU A 1 187 ? 29.988 -42.939 -68.044 1.00 43.81 ? 187 GLU A CG 1 ATOM 1437 C CD . GLU A 1 187 ? 31.148 -41.942 -68.162 1.00 50.03 ? 187 GLU A CD 1 ATOM 1438 O OE1 . GLU A 1 187 ? 31.107 -41.062 -69.049 1.00 50.04 ? 187 GLU A OE1 1 ATOM 1439 O OE2 . GLU A 1 187 ? 32.107 -42.041 -67.359 1.00 49.41 ? 187 GLU A OE2 1 ATOM 1440 N N . LYS A 1 188 ? 25.696 -41.068 -69.270 1.00 36.67 ? 188 LYS A N 1 ATOM 1441 C CA . LYS A 1 188 ? 24.649 -40.725 -70.234 1.00 43.88 ? 188 LYS A CA 1 ATOM 1442 C C . LYS A 1 188 ? 24.267 -39.243 -70.221 1.00 43.26 ? 188 LYS A C 1 ATOM 1443 O O . LYS A 1 188 ? 23.340 -38.834 -70.912 1.00 49.85 ? 188 LYS A O 1 ATOM 1444 C CB . LYS A 1 188 ? 23.399 -41.593 -70.021 1.00 47.41 ? 188 LYS A CB 1 ATOM 1445 C CG . LYS A 1 188 ? 23.472 -42.974 -70.674 1.00 55.69 ? 188 LYS A CG 1 ATOM 1446 C CD . LYS A 1 188 ? 22.562 -43.988 -69.986 1.00 59.59 ? 188 LYS A CD 1 ATOM 1447 C CE . LYS A 1 188 ? 23.022 -45.425 -70.264 1.00 59.91 ? 188 LYS A CE 1 ATOM 1448 N NZ . LYS A 1 188 ? 22.469 -46.432 -69.297 1.00 51.62 ? 188 LYS A NZ 1 ATOM 1449 N N . HIS A 1 189 ? 24.982 -38.436 -69.448 1.00 40.89 ? 189 HIS A N 1 ATOM 1450 C CA . HIS A 1 189 ? 24.622 -37.027 -69.296 1.00 42.19 ? 189 HIS A CA 1 ATOM 1451 C C . HIS A 1 189 ? 25.835 -36.103 -69.295 1.00 40.41 ? 189 HIS A C 1 ATOM 1452 O O . HIS A 1 189 ? 26.962 -36.538 -69.050 1.00 42.53 ? 189 HIS A O 1 ATOM 1453 C CB . HIS A 1 189 ? 23.809 -36.818 -68.021 1.00 41.88 ? 189 HIS A CB 1 ATOM 1454 C CG . HIS A 1 189 ? 22.519 -37.585 -67.984 1.00 50.04 ? 189 HIS A CG 1 ATOM 1455 N ND1 . HIS A 1 189 ? 22.349 -38.725 -67.225 1.00 50.63 ? 189 HIS A ND1 1 ATOM 1456 C CD2 . HIS A 1 189 ? 21.334 -37.369 -68.604 1.00 48.66 ? 189 HIS A CD2 1 ATOM 1457 C CE1 . HIS A 1 189 ? 21.117 -39.176 -67.377 1.00 47.42 ? 189 HIS A CE1 1 ATOM 1458 N NE2 . HIS A 1 189 ? 20.481 -38.372 -68.209 1.00 49.00 ? 189 HIS A NE2 1 ATOM 1459 N N . LYS A 1 190 ? 25.601 -34.824 -69.559 1.00 38.01 ? 190 LYS A N 1 ATOM 1460 C CA . LYS A 1 190 ? 26.700 -33.880 -69.754 1.00 38.38 ? 190 LYS A CA 1 ATOM 1461 C C . LYS A 1 190 ? 26.812 -32.762 -68.697 1.00 37.54 ? 190 LYS A C 1 ATOM 1462 O O . LYS A 1 190 ? 27.873 -32.566 -68.106 1.00 43.70 ? 190 LYS A O 1 ATOM 1463 C CB . LYS A 1 190 ? 26.612 -33.268 -71.157 1.00 42.53 ? 190 LYS A CB 1 ATOM 1464 C CG . LYS A 1 190 ? 27.672 -32.209 -71.450 1.00 51.43 ? 190 LYS A CG 1 ATOM 1465 C CD . LYS A 1 190 ? 27.495 -31.597 -72.842 1.00 57.93 ? 190 LYS A CD 1 ATOM 1466 C CE . LYS A 1 190 ? 28.383 -30.370 -73.027 1.00 58.67 ? 190 LYS A CE 1 ATOM 1467 N NZ . LYS A 1 190 ? 28.222 -29.736 -74.365 1.00 61.29 ? 190 LYS A NZ 1 ATOM 1468 N N . VAL A 1 191 ? 25.730 -32.024 -68.476 1.00 33.62 ? 191 VAL A N 1 ATOM 1469 C CA . VAL A 1 191 ? 25.787 -30.834 -67.638 1.00 29.84 ? 191 VAL A CA 1 ATOM 1470 C C . VAL A 1 191 ? 25.296 -31.102 -66.217 1.00 32.74 ? 191 VAL A C 1 ATOM 1471 O O . VAL A 1 191 ? 24.133 -31.448 -66.000 1.00 27.47 ? 191 VAL A O 1 ATOM 1472 C CB . VAL A 1 191 ? 24.976 -29.670 -68.257 1.00 31.18 ? 191 VAL A CB 1 ATOM 1473 C CG1 . VAL A 1 191 ? 25.097 -28.442 -67.400 1.00 29.90 ? 191 VAL A CG1 1 ATOM 1474 C CG2 . VAL A 1 191 ? 25.480 -29.368 -69.648 1.00 33.86 ? 191 VAL A CG2 1 ATOM 1475 N N . TYR A 1 192 ? 26.194 -30.931 -65.256 1.00 26.30 ? 192 TYR A N 1 ATOM 1476 C CA . TYR A 1 192 ? 25.883 -31.157 -63.846 1.00 23.95 ? 192 TYR A CA 1 ATOM 1477 C C . TYR A 1 192 ? 25.919 -29.847 -63.075 1.00 29.33 ? 192 TYR A C 1 ATOM 1478 O O . TYR A 1 192 ? 26.969 -29.232 -62.940 1.00 22.65 ? 192 TYR A O 1 ATOM 1479 C CB . TYR A 1 192 ? 26.852 -32.176 -63.239 1.00 25.32 ? 192 TYR A CB 1 ATOM 1480 C CG . TYR A 1 192 ? 26.649 -33.551 -63.823 1.00 26.87 ? 192 TYR A CG 1 ATOM 1481 C CD1 . TYR A 1 192 ? 27.159 -33.875 -65.068 1.00 26.14 ? 192 TYR A CD1 1 ATOM 1482 C CD2 . TYR A 1 192 ? 25.916 -34.511 -63.148 1.00 23.98 ? 192 TYR A CD2 1 ATOM 1483 C CE1 . TYR A 1 192 ? 26.954 -35.120 -65.619 1.00 30.94 ? 192 TYR A CE1 1 ATOM 1484 C CE2 . TYR A 1 192 ? 25.710 -35.760 -63.691 1.00 32.64 ? 192 TYR A CE2 1 ATOM 1485 C CZ . TYR A 1 192 ? 26.233 -36.060 -64.926 1.00 31.22 ? 192 TYR A CZ 1 ATOM 1486 O OH . TYR A 1 192 ? 26.029 -37.303 -65.475 1.00 30.44 ? 192 TYR A OH 1 ATOM 1487 N N . ALA A 1 193 ? 24.763 -29.415 -62.583 1.00 26.00 ? 193 ALA A N 1 ATOM 1488 C CA . ALA A 1 193 ? 24.680 -28.128 -61.904 1.00 25.17 ? 193 ALA A CA 1 ATOM 1489 C C . ALA A 1 193 ? 24.118 -28.191 -60.484 1.00 22.98 ? 193 ALA A C 1 ATOM 1490 O O . ALA A 1 193 ? 23.120 -28.856 -60.194 1.00 20.33 ? 193 ALA A O 1 ATOM 1491 C CB . ALA A 1 193 ? 23.914 -27.115 -62.741 1.00 23.20 ? 193 ALA A CB 1 ATOM 1492 N N . CYS A 1 194 ? 24.801 -27.475 -59.608 1.00 20.00 ? 194 CYS A N 1 ATOM 1493 C CA . CYS A 1 194 ? 24.390 -27.284 -58.249 1.00 19.39 ? 194 CYS A CA 1 ATOM 1494 C C . CYS A 1 194 ? 23.937 -25.838 -58.129 1.00 24.97 ? 194 CYS A C 1 ATOM 1495 O O . CYS A 1 194 ? 24.726 -24.919 -58.383 1.00 28.04 ? 194 CYS A O 1 ATOM 1496 C CB . CYS A 1 194 ? 25.600 -27.524 -57.351 1.00 22.50 ? 194 CYS A CB 1 ATOM 1497 S SG . CYS A 1 194 ? 25.338 -27.115 -55.672 1.00 38.99 ? 194 CYS A SG 1 ATOM 1498 N N . GLU A 1 195 ? 22.672 -25.629 -57.766 1.00 20.73 ? 195 GLU A N 1 ATOM 1499 C CA . GLU A 1 195 ? 22.163 -24.275 -57.537 1.00 23.63 ? 195 GLU A CA 1 ATOM 1500 C C . GLU A 1 195 ? 21.889 -24.000 -56.053 1.00 28.07 ? 195 GLU A C 1 ATOM 1501 O O . GLU A 1 195 ? 21.189 -24.762 -55.380 1.00 22.73 ? 195 GLU A O 1 ATOM 1502 C CB . GLU A 1 195 ? 20.913 -23.996 -58.366 1.00 31.02 ? 195 GLU A CB 1 ATOM 1503 C CG . GLU A 1 195 ? 20.580 -22.515 -58.473 1.00 33.86 ? 195 GLU A CG 1 ATOM 1504 C CD . GLU A 1 195 ? 19.135 -22.262 -58.859 1.00 41.52 ? 195 GLU A CD 1 ATOM 1505 O OE1 . GLU A 1 195 ? 18.251 -22.451 -57.988 1.00 40.89 ? 195 GLU A OE1 1 ATOM 1506 O OE2 . GLU A 1 195 ? 18.885 -21.881 -60.027 1.00 46.03 ? 195 GLU A OE2 1 ATOM 1507 N N . VAL A 1 196 ? 22.437 -22.894 -55.560 1.00 26.01 ? 196 VAL A N 1 ATOM 1508 C CA . VAL A 1 196 ? 22.436 -22.602 -54.136 1.00 21.55 ? 196 VAL A CA 1 ATOM 1509 C C . VAL A 1 196 ? 21.646 -21.334 -53.835 1.00 25.35 ? 196 VAL A C 1 ATOM 1510 O O . VAL A 1 196 ? 21.874 -20.278 -54.430 1.00 25.76 ? 196 VAL A O 1 ATOM 1511 C CB . VAL A 1 196 ? 23.886 -22.485 -53.601 1.00 22.80 ? 196 VAL A CB 1 ATOM 1512 C CG1 . VAL A 1 196 ? 23.903 -21.922 -52.191 1.00 15.18 ? 196 VAL A CG1 1 ATOM 1513 C CG2 . VAL A 1 196 ? 24.586 -23.849 -53.660 1.00 16.62 ? 196 VAL A CG2 1 ATOM 1514 N N . THR A 1 197 ? 20.697 -21.462 -52.919 1.00 23.39 ? 197 THR A N 1 ATOM 1515 C CA . THR A 1 197 ? 19.880 -20.340 -52.489 1.00 18.89 ? 197 THR A CA 1 ATOM 1516 C C . THR A 1 197 ? 20.163 -20.072 -51.026 1.00 20.27 ? 197 THR A C 1 ATOM 1517 O O . THR A 1 197 ? 20.174 -20.999 -50.216 1.00 27.36 ? 197 THR A O 1 ATOM 1518 C CB . THR A 1 197 ? 18.377 -20.647 -52.668 1.00 25.39 ? 197 THR A CB 1 ATOM 1519 O OG1 . THR A 1 197 ? 18.087 -20.792 -54.063 1.00 24.84 ? 197 THR A OG1 1 ATOM 1520 C CG2 . THR A 1 197 ? 17.510 -19.532 -52.075 1.00 22.86 ? 197 THR A CG2 1 ATOM 1521 N N . HIS A 1 198 ? 20.402 -18.812 -50.683 1.00 18.45 ? 198 HIS A N 1 ATOM 1522 C CA . HIS A 1 198 ? 20.687 -18.458 -49.301 1.00 21.67 ? 198 HIS A CA 1 ATOM 1523 C C . HIS A 1 198 ? 20.379 -16.991 -49.041 1.00 21.98 ? 198 HIS A C 1 ATOM 1524 O O . HIS A 1 198 ? 20.509 -16.155 -49.929 1.00 22.58 ? 198 HIS A O 1 ATOM 1525 C CB . HIS A 1 198 ? 22.154 -18.760 -48.971 1.00 17.53 ? 198 HIS A CB 1 ATOM 1526 C CG . HIS A 1 198 ? 22.515 -18.537 -47.533 1.00 23.38 ? 198 HIS A CG 1 ATOM 1527 N ND1 . HIS A 1 198 ? 23.000 -17.333 -47.065 1.00 18.09 ? 198 HIS A ND1 1 ATOM 1528 C CD2 . HIS A 1 198 ? 22.470 -19.368 -46.463 1.00 15.82 ? 198 HIS A CD2 1 ATOM 1529 C CE1 . HIS A 1 198 ? 23.230 -17.430 -45.766 1.00 19.38 ? 198 HIS A CE1 1 ATOM 1530 N NE2 . HIS A 1 198 ? 22.921 -18.655 -45.377 1.00 16.34 ? 198 HIS A NE2 1 ATOM 1531 N N . GLN A 1 199 ? 19.987 -16.685 -47.812 1.00 21.85 ? 199 GLN A N 1 ATOM 1532 C CA . GLN A 1 199 ? 19.646 -15.318 -47.427 1.00 29.83 ? 199 GLN A CA 1 ATOM 1533 C C . GLN A 1 199 ? 20.745 -14.295 -47.752 1.00 29.89 ? 199 GLN A C 1 ATOM 1534 O O . GLN A 1 199 ? 20.454 -13.130 -48.003 1.00 31.87 ? 199 GLN A O 1 ATOM 1535 C CB . GLN A 1 199 ? 19.307 -15.277 -45.936 1.00 32.79 ? 199 GLN A CB 1 ATOM 1536 C CG . GLN A 1 199 ? 18.928 -13.925 -45.408 1.00 34.70 ? 199 GLN A CG 1 ATOM 1537 C CD . GLN A 1 199 ? 18.589 -13.959 -43.928 1.00 40.96 ? 199 GLN A CD 1 ATOM 1538 O OE1 . GLN A 1 199 ? 18.270 -15.016 -43.375 1.00 41.25 ? 199 GLN A OE1 1 ATOM 1539 N NE2 . GLN A 1 199 ? 18.653 -12.796 -43.277 1.00 38.56 ? 199 GLN A NE2 1 ATOM 1540 N N . GLY A 1 200 ? 22.002 -14.732 -47.755 1.00 22.84 ? 200 GLY A N 1 ATOM 1541 C CA . GLY A 1 200 ? 23.115 -13.838 -48.017 1.00 21.31 ? 200 GLY A CA 1 ATOM 1542 C C . GLY A 1 200 ? 23.440 -13.635 -49.488 1.00 25.81 ? 200 GLY A C 1 ATOM 1543 O O . GLY A 1 200 ? 24.375 -12.920 -49.821 1.00 32.50 ? 200 GLY A O 1 ATOM 1544 N N . LEU A 1 201 ? 22.674 -14.268 -50.371 1.00 28.22 ? 201 LEU A N 1 ATOM 1545 C CA . LEU A 1 201 ? 22.858 -14.112 -51.812 1.00 27.79 ? 201 LEU A CA 1 ATOM 1546 C C . LEU A 1 201 ? 21.675 -13.353 -52.421 1.00 31.24 ? 201 LEU A C 1 ATOM 1547 O O . LEU A 1 201 ? 20.515 -13.673 -52.144 1.00 38.33 ? 201 LEU A O 1 ATOM 1548 C CB . LEU A 1 201 ? 23.008 -15.485 -52.480 1.00 21.68 ? 201 LEU A CB 1 ATOM 1549 C CG . LEU A 1 201 ? 24.210 -16.329 -52.047 1.00 18.56 ? 201 LEU A CG 1 ATOM 1550 C CD1 . LEU A 1 201 ? 24.115 -17.763 -52.561 1.00 17.71 ? 201 LEU A CD1 1 ATOM 1551 C CD2 . LEU A 1 201 ? 25.494 -15.686 -52.539 1.00 19.15 ? 201 LEU A CD2 1 ATOM 1552 N N . SER A 1 202 ? 21.957 -12.344 -53.240 1.00 24.99 ? 202 SER A N 1 ATOM 1553 C CA . SER A 1 202 ? 20.878 -11.604 -53.892 1.00 27.32 ? 202 SER A CA 1 ATOM 1554 C C . SER A 1 202 ? 20.244 -12.436 -55.005 1.00 27.76 ? 202 SER A C 1 ATOM 1555 O O . SER A 1 202 ? 19.077 -12.251 -55.348 1.00 40.65 ? 202 SER A O 1 ATOM 1556 C CB . SER A 1 202 ? 21.349 -10.233 -54.399 1.00 29.51 ? 202 SER A CB 1 ATOM 1557 O OG . SER A 1 202 ? 22.513 -10.344 -55.187 1.00 44.80 ? 202 SER A OG 1 ATOM 1558 N N . SER A 1 203 ? 21.015 -13.370 -55.548 1.00 26.51 ? 203 SER A N 1 ATOM 1559 C CA . SER A 1 203 ? 20.524 -14.281 -56.575 1.00 30.51 ? 203 SER A CA 1 ATOM 1560 C C . SER A 1 203 ? 21.070 -15.668 -56.280 1.00 29.15 ? 203 SER A C 1 ATOM 1561 O O . SER A 1 203 ? 22.138 -15.797 -55.680 1.00 28.77 ? 203 SER A O 1 ATOM 1562 C CB . SER A 1 203 ? 21.008 -13.850 -57.967 1.00 31.94 ? 203 SER A CB 1 ATOM 1563 O OG . SER A 1 203 ? 20.655 -12.517 -58.254 1.00 31.19 ? 203 SER A OG 1 ATOM 1564 N N . PRO A 1 204 ? 20.344 -16.711 -56.700 1.00 28.70 ? 204 PRO A N 1 ATOM 1565 C CA . PRO A 1 204 ? 20.899 -18.053 -56.534 1.00 26.11 ? 204 PRO A CA 1 ATOM 1566 C C . PRO A 1 204 ? 22.223 -18.143 -57.282 1.00 26.24 ? 204 PRO A C 1 ATOM 1567 O O . PRO A 1 204 ? 22.371 -17.551 -58.345 1.00 31.54 ? 204 PRO A O 1 ATOM 1568 C CB . PRO A 1 204 ? 19.841 -18.955 -57.183 1.00 24.75 ? 204 PRO A CB 1 ATOM 1569 C CG . PRO A 1 204 ? 18.566 -18.155 -57.107 1.00 25.92 ? 204 PRO A CG 1 ATOM 1570 C CD . PRO A 1 204 ? 18.997 -16.729 -57.301 1.00 26.96 ? 204 PRO A CD 1 ATOM 1571 N N . VAL A 1 205 ? 23.183 -18.845 -56.701 1.00 20.69 ? 205 VAL A N 1 ATOM 1572 C CA . VAL A 1 205 ? 24.478 -19.027 -57.327 1.00 20.71 ? 205 VAL A CA 1 ATOM 1573 C C . VAL A 1 205 ? 24.543 -20.442 -57.861 1.00 21.62 ? 205 VAL A C 1 ATOM 1574 O O . VAL A 1 205 ? 24.248 -21.393 -57.138 1.00 20.31 ? 205 VAL A O 1 ATOM 1575 C CB . VAL A 1 205 ? 25.626 -18.806 -56.301 1.00 22.53 ? 205 VAL A CB 1 ATOM 1576 C CG1 . VAL A 1 205 ? 26.929 -19.401 -56.801 1.00 25.24 ? 205 VAL A CG1 1 ATOM 1577 C CG2 . VAL A 1 205 ? 25.801 -17.333 -56.021 1.00 24.45 ? 205 VAL A CG2 1 ATOM 1578 N N . THR A 1 206 ? 24.916 -20.582 -59.124 1.00 21.46 ? 206 THR A N 1 ATOM 1579 C CA . THR A 1 206 ? 25.012 -21.894 -59.740 1.00 21.28 ? 206 THR A CA 1 ATOM 1580 C C . THR A 1 206 ? 26.464 -22.262 -60.070 1.00 23.17 ? 206 THR A C 1 ATOM 1581 O O . THR A 1 206 ? 27.178 -21.486 -60.697 1.00 25.30 ? 206 THR A O 1 ATOM 1582 C CB . THR A 1 206 ? 24.175 -21.962 -61.017 1.00 24.23 ? 206 THR A CB 1 ATOM 1583 O OG1 . THR A 1 206 ? 22.802 -21.733 -60.691 1.00 23.37 ? 206 THR A OG1 1 ATOM 1584 C CG2 . THR A 1 206 ? 24.317 -23.344 -61.671 1.00 23.11 ? 206 THR A CG2 1 ATOM 1585 N N . LYS A 1 207 ? 26.903 -23.434 -59.619 1.00 20.14 ? 207 LYS A N 1 ATOM 1586 C CA . LYS A 1 207 ? 28.205 -23.955 -60.006 1.00 24.38 ? 207 LYS A CA 1 ATOM 1587 C C . LYS A 1 207 ? 27.971 -25.217 -60.822 1.00 30.34 ? 207 LYS A C 1 ATOM 1588 O O . LYS A 1 207 ? 27.129 -26.037 -60.459 1.00 30.11 ? 207 LYS A O 1 ATOM 1589 C CB . LYS A 1 207 ? 29.043 -24.286 -58.775 1.00 19.02 ? 207 LYS A CB 1 ATOM 1590 C CG . LYS A 1 207 ? 29.514 -23.080 -58.009 1.00 28.54 ? 207 LYS A CG 1 ATOM 1591 C CD . LYS A 1 207 ? 30.557 -22.294 -58.771 1.00 20.65 ? 207 LYS A CD 1 ATOM 1592 C CE . LYS A 1 207 ? 30.968 -21.037 -57.997 1.00 28.18 ? 207 LYS A CE 1 ATOM 1593 N NZ . LYS A 1 207 ? 32.120 -20.349 -58.652 1.00 38.17 ? 207 LYS A NZ 1 ATOM 1594 N N . SER A 1 208 ? 28.709 -25.379 -61.918 1.00 30.30 ? 208 SER A N 1 ATOM 1595 C CA . SER A 1 208 ? 28.494 -26.532 -62.792 1.00 27.03 ? 208 SER A CA 1 ATOM 1596 C C . SER A 1 208 ? 29.726 -26.932 -63.570 1.00 31.24 ? 208 SER A C 1 ATOM 1597 O O . SER A 1 208 ? 30.673 -26.160 -63.695 1.00 38.29 ? 208 SER A O 1 ATOM 1598 C CB . SER A 1 208 ? 27.360 -26.248 -63.774 1.00 24.55 ? 208 SER A CB 1 ATOM 1599 O OG . SER A 1 208 ? 27.608 -25.036 -64.456 1.00 28.46 ? 208 SER A OG 1 ATOM 1600 N N . PHE A 1 209 ? 29.699 -28.154 -64.093 1.00 31.71 ? 209 PHE A N 1 ATOM 1601 C CA . PHE A 1 209 ? 30.741 -28.640 -64.978 1.00 27.49 ? 209 PHE A CA 1 ATOM 1602 C C . PHE A 1 209 ? 30.133 -29.501 -66.060 1.00 36.03 ? 209 PHE A C 1 ATOM 1603 O O . PHE A 1 209 ? 29.028 -30.025 -65.893 1.00 41.38 ? 209 PHE A O 1 ATOM 1604 C CB . PHE A 1 209 ? 31.787 -29.453 -64.217 1.00 27.54 ? 209 PHE A CB 1 ATOM 1605 C CG . PHE A 1 209 ? 31.259 -30.721 -63.609 1.00 29.46 ? 209 PHE A CG 1 ATOM 1606 C CD1 . PHE A 1 209 ? 31.320 -31.925 -64.307 1.00 29.70 ? 209 PHE A CD1 1 ATOM 1607 C CD2 . PHE A 1 209 ? 30.721 -30.716 -62.329 1.00 24.89 ? 209 PHE A CD2 1 ATOM 1608 C CE1 . PHE A 1 209 ? 30.836 -33.099 -63.742 1.00 27.59 ? 209 PHE A CE1 1 ATOM 1609 C CE2 . PHE A 1 209 ? 30.241 -31.883 -61.756 1.00 22.92 ? 209 PHE A CE2 1 ATOM 1610 C CZ . PHE A 1 209 ? 30.297 -33.076 -62.460 1.00 27.31 ? 209 PHE A CZ 1 ATOM 1611 N N . ASN A 1 210 ? 30.856 -29.637 -67.168 1.00 34.26 ? 210 ASN A N 1 ATOM 1612 C CA . ASN A 1 210 ? 30.513 -30.599 -68.192 1.00 36.03 ? 210 ASN A CA 1 ATOM 1613 C C . ASN A 1 210 ? 31.387 -31.827 -68.013 1.00 37.01 ? 210 ASN A C 1 ATOM 1614 O O . ASN A 1 210 ? 32.606 -31.700 -67.877 1.00 44.00 ? 210 ASN A O 1 ATOM 1615 C CB . ASN A 1 210 ? 30.761 -30.000 -69.573 1.00 44.69 ? 210 ASN A CB 1 ATOM 1616 C CG . ASN A 1 210 ? 29.907 -28.785 -69.836 1.00 45.05 ? 210 ASN A CG 1 ATOM 1617 O OD1 . ASN A 1 210 ? 28.782 -28.697 -69.353 1.00 48.21 ? 210 ASN A OD1 1 ATOM 1618 N ND2 . ASN A 1 210 ? 30.435 -27.839 -70.606 1.00 38.57 ? 210 ASN A ND2 1 ATOM 1619 N N . ARG A 1 211 ? 30.775 -33.010 -68.011 1.00 35.60 ? 211 ARG A N 1 ATOM 1620 C CA . ARG A 1 211 ? 31.536 -34.256 -67.915 1.00 38.28 ? 211 ARG A CA 1 ATOM 1621 C C . ARG A 1 211 ? 32.631 -34.339 -68.994 1.00 49.53 ? 211 ARG A C 1 ATOM 1622 O O . ARG A 1 211 ? 32.343 -34.528 -70.177 1.00 56.12 ? 211 ARG A O 1 ATOM 1623 C CB . ARG A 1 211 ? 30.605 -35.465 -67.987 1.00 33.40 ? 211 ARG A CB 1 ATOM 1624 C CG . ARG A 1 211 ? 31.322 -36.786 -67.778 1.00 34.67 ? 211 ARG A CG 1 ATOM 1625 C CD . ARG A 1 211 ? 30.410 -37.976 -68.006 1.00 34.79 ? 211 ARG A CD 1 ATOM 1626 N NE . ARG A 1 211 ? 29.478 -37.751 -69.108 1.00 41.36 ? 211 ARG A NE 1 ATOM 1627 C CZ . ARG A 1 211 ? 29.794 -37.849 -70.396 1.00 45.75 ? 211 ARG A CZ 1 ATOM 1628 N NH1 . ARG A 1 211 ? 31.032 -38.160 -70.768 1.00 38.44 ? 211 ARG A NH1 1 ATOM 1629 N NH2 . ARG A 1 211 ? 28.868 -37.623 -71.315 1.00 48.87 ? 211 ARG A NH2 1 ATOM 1630 N N . GLY A 1 212 ? 33.886 -34.195 -68.576 1.00 49.16 ? 212 GLY A N 1 ATOM 1631 C CA . GLY A 1 212 ? 34.985 -33.976 -69.504 1.00 58.07 ? 212 GLY A CA 1 ATOM 1632 C C . GLY A 1 212 ? 35.512 -32.559 -69.338 1.00 70.27 ? 212 GLY A C 1 ATOM 1633 O O . GLY A 1 212 ? 36.275 -32.274 -68.410 1.00 70.66 ? 212 GLY A O 1 ATOM 1634 N N . ALA A 1 213 ? 35.093 -31.665 -70.231 1.00 79.29 ? 213 ALA A N 1 ATOM 1635 C CA . ALA A 1 213 ? 35.372 -30.231 -70.087 1.00 85.47 ? 213 ALA A CA 1 ATOM 1636 C C . ALA A 1 213 ? 34.450 -29.340 -70.945 1.00 88.52 ? 213 ALA A C 1 ATOM 1637 O O . ALA A 1 213 ? 33.827 -29.775 -71.921 1.00 88.30 ? 213 ALA A O 1 ATOM 1638 C CB . ALA A 1 213 ? 36.843 -29.934 -70.383 1.00 90.03 ? 213 ALA A CB 1 ATOM 1639 O OXT . ALA A 1 213 ? 34.301 -28.146 -70.675 1.00 87.30 ? 213 ALA A OXT 1 ATOM 1640 N N . GLN B 2 1 ? 50.234 -35.042 -15.903 1.00 40.50 ? 1 GLN B N 1 ATOM 1641 C CA . GLN B 2 1 ? 48.826 -34.697 -16.096 1.00 41.50 ? 1 GLN B CA 1 ATOM 1642 C C . GLN B 2 1 ? 47.892 -35.904 -15.900 1.00 39.31 ? 1 GLN B C 1 ATOM 1643 O O . GLN B 2 1 ? 48.270 -37.030 -16.208 1.00 45.32 ? 1 GLN B O 1 ATOM 1644 C CB . GLN B 2 1 ? 48.631 -34.100 -17.489 1.00 39.31 ? 1 GLN B CB 1 ATOM 1645 N N . VAL B 2 2 ? 46.681 -35.677 -15.387 1.00 32.20 ? 2 VAL B N 1 ATOM 1646 C CA . VAL B 2 2 ? 45.711 -36.763 -15.231 1.00 28.64 ? 2 VAL B CA 1 ATOM 1647 C C . VAL B 2 2 ? 45.012 -37.093 -16.546 1.00 33.56 ? 2 VAL B C 1 ATOM 1648 O O . VAL B 2 2 ? 44.440 -36.212 -17.190 1.00 34.56 ? 2 VAL B O 1 ATOM 1649 C CB . VAL B 2 2 ? 44.641 -36.441 -14.171 1.00 29.19 ? 2 VAL B CB 1 ATOM 1650 C CG1 . VAL B 2 2 ? 43.449 -37.390 -14.303 1.00 23.23 ? 2 VAL B CG1 1 ATOM 1651 C CG2 . VAL B 2 2 ? 45.239 -36.539 -12.780 1.00 26.90 ? 2 VAL B CG2 1 ATOM 1652 N N . GLN B 2 3 ? 45.053 -38.365 -16.934 1.00 30.63 ? 3 GLN B N 1 ATOM 1653 C CA . GLN B 2 3 ? 44.491 -38.797 -18.206 1.00 29.95 ? 3 GLN B CA 1 ATOM 1654 C C . GLN B 2 3 ? 43.820 -40.160 -18.115 1.00 29.36 ? 3 GLN B C 1 ATOM 1655 O O . GLN B 2 3 ? 44.226 -41.009 -17.326 1.00 30.69 ? 3 GLN B O 1 ATOM 1656 C CB . GLN B 2 3 ? 45.577 -38.845 -19.285 1.00 35.15 ? 3 GLN B CB 1 ATOM 1657 C CG . GLN B 2 3 ? 46.038 -37.484 -19.747 1.00 49.15 ? 3 GLN B CG 1 ATOM 1658 C CD . GLN B 2 3 ? 47.150 -37.563 -20.769 1.00 60.83 ? 3 GLN B CD 1 ATOM 1659 O OE1 . GLN B 2 3 ? 47.794 -38.600 -20.925 1.00 65.17 ? 3 GLN B OE1 1 ATOM 1660 N NE2 . GLN B 2 3 ? 47.380 -36.462 -21.476 1.00 64.11 ? 3 GLN B NE2 1 ATOM 1661 N N . LEU B 2 4 ? 42.793 -40.352 -18.938 1.00 26.75 ? 4 LEU B N 1 ATOM 1662 C CA . LEU B 2 4 ? 42.136 -41.643 -19.090 1.00 25.11 ? 4 LEU B CA 1 ATOM 1663 C C . LEU B 2 4 ? 42.011 -41.916 -20.578 1.00 24.79 ? 4 LEU B C 1 ATOM 1664 O O . LEU B 2 4 ? 41.426 -41.111 -21.300 1.00 27.95 ? 4 LEU B O 1 ATOM 1665 C CB . LEU B 2 4 ? 40.748 -41.641 -18.432 1.00 25.82 ? 4 LEU B CB 1 ATOM 1666 C CG . LEU B 2 4 ? 40.662 -41.330 -16.930 1.00 28.30 ? 4 LEU B CG 1 ATOM 1667 C CD1 . LEU B 2 4 ? 40.515 -39.837 -16.691 1.00 29.71 ? 4 LEU B CD1 1 ATOM 1668 C CD2 . LEU B 2 4 ? 39.527 -42.087 -16.254 1.00 22.52 ? 4 LEU B CD2 1 ATOM 1669 N N . LYS B 2 5 ? 42.589 -43.025 -21.044 1.00 23.07 ? 5 LYS B N 1 ATOM 1670 C CA . LYS B 2 5 ? 42.547 -43.377 -22.467 1.00 22.91 ? 5 LYS B CA 1 ATOM 1671 C C . LYS B 2 5 ? 41.804 -44.681 -22.620 1.00 28.03 ? 5 LYS B C 1 ATOM 1672 O O . LYS B 2 5 ? 42.174 -45.681 -22.011 1.00 27.36 ? 5 LYS B O 1 ATOM 1673 C CB . LYS B 2 5 ? 43.950 -43.551 -23.049 1.00 29.91 ? 5 LYS B CB 1 ATOM 1674 C CG . LYS B 2 5 ? 44.983 -42.518 -22.634 1.00 38.37 ? 5 LYS B CG 1 ATOM 1675 C CD . LYS B 2 5 ? 44.881 -41.237 -23.440 1.00 47.87 ? 5 LYS B CD 1 ATOM 1676 C CE . LYS B 2 5 ? 46.137 -40.372 -23.257 1.00 53.45 ? 5 LYS B CE 1 ATOM 1677 N NZ . LYS B 2 5 ? 47.350 -40.972 -23.896 1.00 60.81 ? 5 LYS B NZ 1 ATOM 1678 N N . GLN B 2 6 ? 40.763 -44.676 -23.444 1.00 31.66 ? 6 GLN B N 1 ATOM 1679 C CA . GLN B 2 6 ? 39.916 -45.851 -23.610 1.00 23.90 ? 6 GLN B CA 1 ATOM 1680 C C . GLN B 2 6 ? 40.316 -46.644 -24.838 1.00 22.06 ? 6 GLN B C 1 ATOM 1681 O O . GLN B 2 6 ? 40.955 -46.119 -25.740 1.00 25.74 ? 6 GLN B O 1 ATOM 1682 C CB . GLN B 2 6 ? 38.454 -45.428 -23.715 1.00 17.51 ? 6 GLN B CB 1 ATOM 1683 C CG . GLN B 2 6 ? 38.039 -44.525 -22.577 1.00 24.10 ? 6 GLN B CG 1 ATOM 1684 C CD . GLN B 2 6 ? 36.558 -44.248 -22.567 1.00 27.02 ? 6 GLN B CD 1 ATOM 1685 O OE1 . GLN B 2 6 ? 36.123 -43.185 -22.127 1.00 31.13 ? 6 GLN B OE1 1 ATOM 1686 N NE2 . GLN B 2 6 ? 35.772 -45.205 -23.044 1.00 22.22 ? 6 GLN B NE2 1 ATOM 1687 N N . SER B 2 7 ? 39.950 -47.918 -24.860 1.00 23.42 ? 7 SER B N 1 ATOM 1688 C CA . SER B 2 7 ? 40.169 -48.742 -26.035 1.00 27.59 ? 7 SER B CA 1 ATOM 1689 C C . SER B 2 7 ? 39.275 -48.280 -27.191 1.00 33.33 ? 7 SER B C 1 ATOM 1690 O O . SER B 2 7 ? 38.259 -47.603 -26.976 1.00 27.34 ? 7 SER B O 1 ATOM 1691 C CB . SER B 2 7 ? 39.898 -50.200 -25.703 1.00 24.81 ? 7 SER B CB 1 ATOM 1692 O OG . SER B 2 7 ? 38.754 -50.302 -24.876 1.00 26.34 ? 7 SER B OG 1 ATOM 1693 N N . GLY B 2 8 ? 39.657 -48.655 -28.412 1.00 36.34 ? 8 GLY B N 1 ATOM 1694 C CA . GLY B 2 8 ? 38.987 -48.199 -29.620 1.00 38.25 ? 8 GLY B CA 1 ATOM 1695 C C . GLY B 2 8 ? 37.532 -48.609 -29.796 1.00 32.58 ? 8 GLY B C 1 ATOM 1696 O O . GLY B 2 8 ? 37.054 -49.576 -29.200 1.00 27.57 ? 8 GLY B O 1 ATOM 1697 N N . PRO B 2 9 ? 36.815 -47.876 -30.649 1.00 30.19 ? 9 PRO B N 1 ATOM 1698 C CA . PRO B 2 9 ? 35.392 -48.118 -30.897 1.00 27.70 ? 9 PRO B CA 1 ATOM 1699 C C . PRO B 2 9 ? 35.163 -49.349 -31.776 1.00 33.09 ? 9 PRO B C 1 ATOM 1700 O O . PRO B 2 9 ? 36.062 -49.776 -32.514 1.00 38.54 ? 9 PRO B O 1 ATOM 1701 C CB . PRO B 2 9 ? 34.962 -46.854 -31.638 1.00 28.06 ? 9 PRO B CB 1 ATOM 1702 C CG . PRO B 2 9 ? 36.206 -46.471 -32.418 1.00 35.81 ? 9 PRO B CG 1 ATOM 1703 C CD . PRO B 2 9 ? 37.359 -46.798 -31.498 1.00 35.43 ? 9 PRO B CD 1 ATOM 1704 N N . GLY B 2 10 ? 33.957 -49.914 -31.702 1.00 29.70 ? 10 GLY B N 1 ATOM 1705 C CA . GLY B 2 10 ? 33.684 -51.039 -32.582 1.00 31.21 ? 10 GLY B CA 1 ATOM 1706 C C . GLY B 2 10 ? 32.261 -51.565 -32.531 1.00 30.06 ? 10 GLY B C 1 ATOM 1707 O O . GLY B 2 10 ? 31.375 -51.017 -31.865 1.00 29.88 ? 10 GLY B O 1 ATOM 1708 N N . LEU B 2 11 ? 32.072 -52.662 -33.267 1.00 33.02 ? 11 LEU B N 1 ATOM 1709 C CA . LEU B 2 11 ? 30.806 -53.324 -33.431 1.00 25.88 ? 11 LEU B CA 1 ATOM 1710 C C . LEU B 2 11 ? 30.684 -54.404 -32.376 1.00 32.93 ? 11 LEU B C 1 ATOM 1711 O O . LEU B 2 11 ? 31.657 -55.063 -32.047 1.00 35.44 ? 11 LEU B O 1 ATOM 1712 C CB . LEU B 2 11 ? 30.788 -53.964 -34.811 1.00 28.46 ? 11 LEU B CB 1 ATOM 1713 C CG . LEU B 2 11 ? 29.461 -54.278 -35.475 1.00 37.00 ? 11 LEU B CG 1 ATOM 1714 C CD1 . LEU B 2 11 ? 28.571 -53.053 -35.452 1.00 39.19 ? 11 LEU B CD1 1 ATOM 1715 C CD2 . LEU B 2 11 ? 29.735 -54.714 -36.902 1.00 37.46 ? 11 LEU B CD2 1 ATOM 1716 N N . VAL B 2 12 ? 29.488 -54.576 -31.833 1.00 34.95 ? 12 VAL B N 1 ATOM 1717 C CA . VAL B 2 12 ? 29.172 -55.765 -31.061 1.00 33.18 ? 12 VAL B CA 1 ATOM 1718 C C . VAL B 2 12 ? 27.855 -56.339 -31.572 1.00 30.66 ? 12 VAL B C 1 ATOM 1719 O O . VAL B 2 12 ? 26.884 -55.605 -31.796 1.00 27.14 ? 12 VAL B O 1 ATOM 1720 C CB . VAL B 2 12 ? 29.100 -55.500 -29.537 1.00 36.23 ? 12 VAL B CB 1 ATOM 1721 C CG1 . VAL B 2 12 ? 30.441 -55.036 -29.019 1.00 39.77 ? 12 VAL B CG1 1 ATOM 1722 C CG2 . VAL B 2 12 ? 28.045 -54.473 -29.218 1.00 36.94 ? 12 VAL B CG2 1 ATOM 1723 N N . GLN B 2 13 ? 27.834 -57.652 -31.778 1.00 28.28 ? 13 GLN B N 1 ATOM 1724 C CA A GLN B 2 13 ? 26.636 -58.321 -32.263 0.54 33.68 ? 13 GLN B CA 1 ATOM 1725 C CA B GLN B 2 13 ? 26.638 -58.335 -32.260 0.46 33.66 ? 13 GLN B CA 1 ATOM 1726 C C . GLN B 2 13 ? 25.542 -58.325 -31.196 1.00 34.70 ? 13 GLN B C 1 ATOM 1727 O O . GLN B 2 13 ? 25.827 -58.407 -30.002 1.00 32.08 ? 13 GLN B O 1 ATOM 1728 C CB A GLN B 2 13 ? 26.970 -59.741 -32.723 0.54 34.89 ? 13 GLN B CB 1 ATOM 1729 C CB B GLN B 2 13 ? 26.971 -59.770 -32.688 0.46 34.97 ? 13 GLN B CB 1 ATOM 1730 C CG A GLN B 2 13 ? 27.997 -59.792 -33.853 0.54 37.06 ? 13 GLN B CG 1 ATOM 1731 C CG B GLN B 2 13 ? 27.872 -59.864 -33.919 0.46 37.26 ? 13 GLN B CG 1 ATOM 1732 C CD A GLN B 2 13 ? 27.469 -59.204 -35.153 0.54 36.99 ? 13 GLN B CD 1 ATOM 1733 C CD B GLN B 2 13 ? 28.489 -61.241 -34.106 0.46 40.37 ? 13 GLN B CD 1 ATOM 1734 O OE1 A GLN B 2 13 ? 28.024 -58.241 -35.695 0.54 33.55 ? 13 GLN B OE1 1 ATOM 1735 O OE1 B GLN B 2 13 ? 27.785 -62.236 -34.280 0.46 39.38 ? 13 GLN B OE1 1 ATOM 1736 N NE2 A GLN B 2 13 ? 26.394 -59.788 -35.662 0.54 37.62 ? 13 GLN B NE2 1 ATOM 1737 N NE2 B GLN B 2 13 ? 29.815 -61.302 -34.063 0.46 37.98 ? 13 GLN B NE2 1 ATOM 1738 N N . PRO B 2 14 ? 24.278 -58.200 -31.621 1.00 35.59 ? 14 PRO B N 1 ATOM 1739 C CA . PRO B 2 14 ? 23.188 -58.209 -30.640 1.00 32.54 ? 14 PRO B CA 1 ATOM 1740 C C . PRO B 2 14 ? 23.191 -59.479 -29.782 1.00 36.42 ? 14 PRO B C 1 ATOM 1741 O O . PRO B 2 14 ? 23.447 -60.569 -30.296 1.00 38.52 ? 14 PRO B O 1 ATOM 1742 C CB . PRO B 2 14 ? 21.926 -58.111 -31.509 1.00 35.00 ? 14 PRO B CB 1 ATOM 1743 C CG . PRO B 2 14 ? 22.394 -58.277 -32.935 1.00 33.87 ? 14 PRO B CG 1 ATOM 1744 C CD . PRO B 2 14 ? 23.807 -57.868 -32.973 1.00 31.73 ? 14 PRO B CD 1 ATOM 1745 N N . SER B 2 15 ? 22.934 -59.303 -28.486 1.00 35.06 ? 15 SER B N 1 ATOM 1746 C CA . SER B 2 15 ? 22.972 -60.358 -27.464 1.00 39.65 ? 15 SER B CA 1 ATOM 1747 C C . SER B 2 15 ? 24.390 -60.789 -27.081 1.00 41.54 ? 15 SER B C 1 ATOM 1748 O O . SER B 2 15 ? 24.565 -61.711 -26.286 1.00 44.32 ? 15 SER B O 1 ATOM 1749 C CB . SER B 2 15 ? 22.134 -61.577 -27.853 1.00 40.98 ? 15 SER B CB 1 ATOM 1750 O OG . SER B 2 15 ? 22.886 -62.427 -28.695 1.00 46.30 ? 15 SER B OG 1 ATOM 1751 N N . GLN B 2 16 ? 25.394 -60.118 -27.642 1.00 40.65 ? 16 GLN B N 1 ATOM 1752 C CA . GLN B 2 16 ? 26.782 -60.346 -27.253 1.00 36.82 ? 16 GLN B CA 1 ATOM 1753 C C . GLN B 2 16 ? 27.238 -59.336 -26.212 1.00 36.25 ? 16 GLN B C 1 ATOM 1754 O O . GLN B 2 16 ? 26.490 -58.426 -25.841 1.00 38.87 ? 16 GLN B O 1 ATOM 1755 C CB . GLN B 2 16 ? 27.711 -60.243 -28.457 1.00 36.42 ? 16 GLN B CB 1 ATOM 1756 C CG . GLN B 2 16 ? 27.432 -61.236 -29.527 1.00 43.73 ? 16 GLN B CG 1 ATOM 1757 C CD . GLN B 2 16 ? 28.028 -62.574 -29.215 1.00 57.03 ? 16 GLN B CD 1 ATOM 1758 O OE1 . GLN B 2 16 ? 27.685 -63.198 -28.208 1.00 60.14 ? 16 GLN B OE1 1 ATOM 1759 N NE2 . GLN B 2 16 ? 28.939 -63.029 -30.075 1.00 63.16 ? 16 GLN B NE2 1 ATOM 1760 N N . SER B 2 17 ? 28.489 -59.476 -25.783 1.00 32.33 ? 17 SER B N 1 ATOM 1761 C CA . SER B 2 17 ? 29.023 -58.651 -24.710 1.00 32.10 ? 17 SER B CA 1 ATOM 1762 C C . SER B 2 17 ? 30.016 -57.581 -25.170 1.00 37.74 ? 17 SER B C 1 ATOM 1763 O O . SER B 2 17 ? 30.736 -57.744 -26.158 1.00 37.66 ? 17 SER B O 1 ATOM 1764 C CB . SER B 2 17 ? 29.646 -59.517 -23.607 1.00 32.13 ? 17 SER B CB 1 ATOM 1765 O OG . SER B 2 17 ? 30.913 -60.002 -23.998 1.00 35.98 ? 17 SER B OG 1 ATOM 1766 N N . LEU B 2 18 ? 30.039 -56.489 -24.414 1.00 35.45 ? 18 LEU B N 1 ATOM 1767 C CA . LEU B 2 18 ? 30.876 -55.341 -24.692 1.00 28.43 ? 18 LEU B CA 1 ATOM 1768 C C . LEU B 2 18 ? 32.060 -55.295 -23.714 1.00 27.32 ? 18 LEU B C 1 ATOM 1769 O O . LEU B 2 18 ? 31.877 -55.452 -22.514 1.00 30.57 ? 18 LEU B O 1 ATOM 1770 C CB . LEU B 2 18 ? 30.011 -54.099 -24.531 1.00 25.75 ? 18 LEU B CB 1 ATOM 1771 C CG . LEU B 2 18 ? 30.667 -52.736 -24.475 1.00 23.99 ? 18 LEU B CG 1 ATOM 1772 C CD1 . LEU B 2 18 ? 31.477 -52.533 -25.735 1.00 18.84 ? 18 LEU B CD1 1 ATOM 1773 C CD2 . LEU B 2 18 ? 29.586 -51.691 -24.346 1.00 23.49 ? 18 LEU B CD2 1 ATOM 1774 N N . SER B 2 19 ? 33.272 -55.084 -24.217 1.00 25.10 ? 19 SER B N 1 ATOM 1775 C CA . SER B 2 19 ? 34.431 -54.926 -23.335 1.00 27.29 ? 19 SER B CA 1 ATOM 1776 C C . SER B 2 19 ? 35.199 -53.661 -23.662 1.00 26.61 ? 19 SER B C 1 ATOM 1777 O O . SER B 2 19 ? 35.595 -53.452 -24.811 1.00 28.77 ? 19 SER B O 1 ATOM 1778 C CB . SER B 2 19 ? 35.378 -56.127 -23.429 1.00 31.23 ? 19 SER B CB 1 ATOM 1779 O OG . SER B 2 19 ? 34.743 -57.320 -22.998 1.00 38.34 ? 19 SER B OG 1 ATOM 1780 N N . ILE B 2 20 ? 35.414 -52.820 -22.654 1.00 21.66 ? 20 ILE B N 1 ATOM 1781 C CA . ILE B 2 20 ? 36.219 -51.620 -22.825 1.00 18.33 ? 20 ILE B CA 1 ATOM 1782 C C . ILE B 2 20 ? 37.302 -51.549 -21.766 1.00 22.07 ? 20 ILE B C 1 ATOM 1783 O O . ILE B 2 20 ? 37.074 -51.860 -20.593 1.00 24.58 ? 20 ILE B O 1 ATOM 1784 C CB . ILE B 2 20 ? 35.358 -50.354 -22.740 1.00 23.84 ? 20 ILE B CB 1 ATOM 1785 C CG1 . ILE B 2 20 ? 34.237 -50.408 -23.773 1.00 20.91 ? 20 ILE B CG1 1 ATOM 1786 C CG2 . ILE B 2 20 ? 36.207 -49.104 -22.957 1.00 22.62 ? 20 ILE B CG2 1 ATOM 1787 C CD1 . ILE B 2 20 ? 33.266 -49.274 -23.639 1.00 17.61 ? 20 ILE B CD1 1 ATOM 1788 N N . THR B 2 21 ? 38.488 -51.139 -22.187 1.00 22.08 ? 21 THR B N 1 ATOM 1789 C CA . THR B 2 21 ? 39.602 -50.954 -21.273 1.00 23.19 ? 21 THR B CA 1 ATOM 1790 C C . THR B 2 21 ? 39.875 -49.471 -21.106 1.00 28.70 ? 21 THR B C 1 ATOM 1791 O O . THR B 2 21 ? 39.954 -48.733 -22.089 1.00 28.00 ? 21 THR B O 1 ATOM 1792 C CB . THR B 2 21 ? 40.867 -51.648 -21.797 1.00 27.41 ? 21 THR B CB 1 ATOM 1793 O OG1 . THR B 2 21 ? 40.693 -53.069 -21.730 1.00 28.96 ? 21 THR B OG1 1 ATOM 1794 C CG2 . THR B 2 21 ? 42.087 -51.246 -20.979 1.00 23.37 ? 21 THR B CG2 1 ATOM 1795 N N . CYS B 2 22 ? 39.991 -49.041 -19.853 1.00 30.31 ? 22 CYS B N 1 ATOM 1796 C CA . CYS B 2 22 ? 40.323 -47.663 -19.526 1.00 23.60 ? 22 CYS B CA 1 ATOM 1797 C C . CYS B 2 22 ? 41.705 -47.684 -18.903 1.00 24.09 ? 22 CYS B C 1 ATOM 1798 O O . CYS B 2 22 ? 41.931 -48.383 -17.916 1.00 28.10 ? 22 CYS B O 1 ATOM 1799 C CB . CYS B 2 22 ? 39.300 -47.087 -18.540 1.00 21.77 ? 22 CYS B CB 1 ATOM 1800 S SG . CYS B 2 22 ? 39.557 -45.349 -18.062 1.00 26.70 ? 22 CYS B SG 1 ATOM 1801 N N . THR B 2 23 ? 42.638 -46.944 -19.493 1.00 29.04 ? 23 THR B N 1 ATOM 1802 C CA . THR B 2 23 ? 44.009 -46.887 -18.980 1.00 28.75 ? 23 THR B CA 1 ATOM 1803 C C . THR B 2 23 ? 44.300 -45.491 -18.447 1.00 33.07 ? 23 THR B C 1 ATOM 1804 O O . THR B 2 23 ? 44.165 -44.501 -19.163 1.00 45.87 ? 23 THR B O 1 ATOM 1805 C CB . THR B 2 23 ? 45.045 -47.229 -20.071 1.00 29.15 ? 23 THR B CB 1 ATOM 1806 O OG1 . THR B 2 23 ? 44.752 -48.513 -20.644 1.00 32.83 ? 23 THR B OG1 1 ATOM 1807 C CG2 . THR B 2 23 ? 46.462 -47.231 -19.495 1.00 26.14 ? 23 THR B CG2 1 ATOM 1808 N N . VAL B 2 24 ? 44.700 -45.405 -17.191 1.00 26.93 ? 24 VAL B N 1 ATOM 1809 C CA . VAL B 2 24 ? 44.857 -44.101 -16.565 1.00 26.09 ? 24 VAL B CA 1 ATOM 1810 C C . VAL B 2 24 ? 46.319 -43.769 -16.303 1.00 27.62 ? 24 VAL B C 1 ATOM 1811 O O . VAL B 2 24 ? 47.167 -44.652 -16.263 1.00 27.67 ? 24 VAL B O 1 ATOM 1812 C CB . VAL B 2 24 ? 44.081 -44.012 -15.228 1.00 25.81 ? 24 VAL B CB 1 ATOM 1813 C CG1 . VAL B 2 24 ? 42.617 -44.365 -15.438 1.00 25.44 ? 24 VAL B CG1 1 ATOM 1814 C CG2 . VAL B 2 24 ? 44.720 -44.930 -14.170 1.00 24.51 ? 24 VAL B CG2 1 ATOM 1815 N N . SER B 2 25 ? 46.595 -42.483 -16.130 1.00 28.18 ? 25 SER B N 1 ATOM 1816 C CA . SER B 2 25 ? 47.914 -42.011 -15.744 1.00 29.69 ? 25 SER B CA 1 ATOM 1817 C C . SER B 2 25 ? 47.765 -40.667 -15.042 1.00 33.89 ? 25 SER B C 1 ATOM 1818 O O . SER B 2 25 ? 46.708 -40.025 -15.127 1.00 24.33 ? 25 SER B O 1 ATOM 1819 C CB . SER B 2 25 ? 48.836 -41.895 -16.961 1.00 29.59 ? 25 SER B CB 1 ATOM 1820 O OG . SER B 2 25 ? 48.227 -41.126 -17.980 1.00 35.35 ? 25 SER B OG 1 ATOM 1821 N N . GLY B 2 26 ? 48.817 -40.254 -14.337 1.00 32.39 ? 26 GLY B N 1 ATOM 1822 C CA . GLY B 2 26 ? 48.760 -39.068 -13.499 1.00 31.63 ? 26 GLY B CA 1 ATOM 1823 C C . GLY B 2 26 ? 48.084 -39.298 -12.151 1.00 31.79 ? 26 GLY B C 1 ATOM 1824 O O . GLY B 2 26 ? 47.889 -38.354 -11.394 1.00 35.32 ? 26 GLY B O 1 ATOM 1825 N N . PHE B 2 27 ? 47.710 -40.546 -11.861 1.00 30.30 ? 27 PHE B N 1 ATOM 1826 C CA . PHE B 2 27 ? 47.193 -40.933 -10.543 1.00 25.59 ? 27 PHE B CA 1 ATOM 1827 C C . PHE B 2 27 ? 47.155 -42.456 -10.391 1.00 32.48 ? 27 PHE B C 1 ATOM 1828 O O . PHE B 2 27 ? 47.357 -43.189 -11.356 1.00 27.09 ? 27 PHE B O 1 ATOM 1829 C CB . PHE B 2 27 ? 45.804 -40.331 -10.275 1.00 26.76 ? 27 PHE B CB 1 ATOM 1830 C CG . PHE B 2 27 ? 44.706 -40.900 -11.132 1.00 22.74 ? 27 PHE B CG 1 ATOM 1831 C CD1 . PHE B 2 27 ? 44.502 -40.435 -12.422 1.00 25.93 ? 27 PHE B CD1 1 ATOM 1832 C CD2 . PHE B 2 27 ? 43.872 -41.892 -10.642 1.00 22.28 ? 27 PHE B CD2 1 ATOM 1833 C CE1 . PHE B 2 27 ? 43.484 -40.953 -13.217 1.00 23.05 ? 27 PHE B CE1 1 ATOM 1834 C CE2 . PHE B 2 27 ? 42.856 -42.419 -11.423 1.00 20.98 ? 27 PHE B CE2 1 ATOM 1835 C CZ . PHE B 2 27 ? 42.657 -41.941 -12.714 1.00 23.93 ? 27 PHE B CZ 1 ATOM 1836 N N . SER B 2 28 ? 46.881 -42.930 -9.180 1.00 36.08 ? 28 SER B N 1 ATOM 1837 C CA . SER B 2 28 ? 46.849 -44.366 -8.913 1.00 34.36 ? 28 SER B CA 1 ATOM 1838 C C . SER B 2 28 ? 45.436 -44.892 -8.659 1.00 35.68 ? 28 SER B C 1 ATOM 1839 O O . SER B 2 28 ? 44.648 -44.271 -7.938 1.00 37.50 ? 28 SER B O 1 ATOM 1840 C CB . SER B 2 28 ? 47.757 -44.702 -7.729 1.00 32.76 ? 28 SER B CB 1 ATOM 1841 O OG . SER B 2 28 ? 47.597 -46.055 -7.352 1.00 31.19 ? 28 SER B OG 1 ATOM 1842 N N . LEU B 2 29 ? 45.125 -46.050 -9.236 1.00 35.15 ? 29 LEU B N 1 ATOM 1843 C CA . LEU B 2 29 ? 43.811 -46.667 -9.058 1.00 30.91 ? 29 LEU B CA 1 ATOM 1844 C C . LEU B 2 29 ? 43.585 -47.090 -7.609 1.00 38.04 ? 29 LEU B C 1 ATOM 1845 O O . LEU B 2 29 ? 42.462 -47.422 -7.224 1.00 37.14 ? 29 LEU B O 1 ATOM 1846 C CB . LEU B 2 29 ? 43.651 -47.871 -9.991 1.00 27.36 ? 29 LEU B CB 1 ATOM 1847 C CG . LEU B 2 29 ? 43.498 -47.549 -11.483 1.00 29.60 ? 29 LEU B CG 1 ATOM 1848 C CD1 . LEU B 2 29 ? 43.457 -48.819 -12.344 1.00 24.29 ? 29 LEU B CD1 1 ATOM 1849 C CD2 . LEU B 2 29 ? 42.265 -46.693 -11.724 1.00 21.77 ? 29 LEU B CD2 1 ATOM 1850 N N . THR B 2 30 ? 44.658 -47.081 -6.816 1.00 33.92 ? 30 THR B N 1 ATOM 1851 C CA . THR B 2 30 ? 44.577 -47.403 -5.396 1.00 32.66 ? 30 THR B CA 1 ATOM 1852 C C . THR B 2 30 ? 44.111 -46.197 -4.590 1.00 37.02 ? 30 THR B C 1 ATOM 1853 O O . THR B 2 30 ? 43.699 -46.344 -3.443 1.00 37.92 ? 30 THR B O 1 ATOM 1854 C CB . THR B 2 30 ? 45.928 -47.886 -4.833 1.00 35.40 ? 30 THR B CB 1 ATOM 1855 O OG1 . THR B 2 30 ? 46.915 -46.866 -5.022 1.00 34.69 ? 30 THR B OG1 1 ATOM 1856 C CG2 . THR B 2 30 ? 46.381 -49.159 -5.526 1.00 36.58 ? 30 THR B CG2 1 ATOM 1857 N N . ASN B 2 31 ? 44.173 -45.008 -5.194 1.00 36.41 ? 31 ASN B N 1 ATOM 1858 C CA . ASN B 2 31 ? 43.749 -43.779 -4.515 1.00 37.36 ? 31 ASN B CA 1 ATOM 1859 C C . ASN B 2 31 ? 42.417 -43.215 -4.990 1.00 34.84 ? 31 ASN B C 1 ATOM 1860 O O . ASN B 2 31 ? 41.799 -42.431 -4.275 1.00 38.15 ? 31 ASN B O 1 ATOM 1861 C CB . ASN B 2 31 ? 44.804 -42.675 -4.626 1.00 34.18 ? 31 ASN B CB 1 ATOM 1862 C CG . ASN B 2 31 ? 46.107 -43.045 -3.959 1.00 33.61 ? 31 ASN B CG 1 ATOM 1863 O OD1 . ASN B 2 31 ? 47.180 -42.669 -4.427 1.00 32.40 ? 31 ASN B OD1 1 ATOM 1864 N ND2 . ASN B 2 31 ? 46.026 -43.800 -2.875 1.00 34.90 ? 31 ASN B ND2 1 ATOM 1865 N N . TYR B 2 32 ? 41.986 -43.592 -6.192 1.00 27.25 ? 32 TYR B N 1 ATOM 1866 C CA . TYR B 2 32 ? 40.753 -43.054 -6.763 1.00 26.14 ? 32 TYR B CA 1 ATOM 1867 C C . TYR B 2 32 ? 39.840 -44.124 -7.331 1.00 28.21 ? 32 TYR B C 1 ATOM 1868 O O . TYR B 2 32 ? 40.306 -45.147 -7.842 1.00 32.47 ? 32 TYR B O 1 ATOM 1869 C CB . TYR B 2 32 ? 41.074 -42.033 -7.862 1.00 28.48 ? 32 TYR B CB 1 ATOM 1870 C CG . TYR B 2 32 ? 41.609 -40.726 -7.334 1.00 32.00 ? 32 TYR B CG 1 ATOM 1871 C CD1 . TYR B 2 32 ? 42.956 -40.577 -7.024 1.00 32.42 ? 32 TYR B CD1 1 ATOM 1872 C CD2 . TYR B 2 32 ? 40.760 -39.642 -7.125 1.00 26.28 ? 32 TYR B CD2 1 ATOM 1873 C CE1 . TYR B 2 32 ? 43.443 -39.380 -6.528 1.00 32.52 ? 32 TYR B CE1 1 ATOM 1874 C CE2 . TYR B 2 32 ? 41.238 -38.442 -6.636 1.00 27.70 ? 32 TYR B CE2 1 ATOM 1875 C CZ . TYR B 2 32 ? 42.581 -38.317 -6.340 1.00 38.24 ? 32 TYR B CZ 1 ATOM 1876 O OH . TYR B 2 32 ? 43.054 -37.122 -5.849 1.00 49.83 ? 32 TYR B OH 1 ATOM 1877 N N . GLY B 2 33 ? 38.534 -43.882 -7.250 1.00 29.03 ? 33 GLY B N 1 ATOM 1878 C CA . GLY B 2 33 ? 37.560 -44.726 -7.925 1.00 28.83 ? 33 GLY B CA 1 ATOM 1879 C C . GLY B 2 33 ? 37.425 -44.327 -9.392 1.00 30.89 ? 33 GLY B C 1 ATOM 1880 O O . GLY B 2 33 ? 37.602 -43.154 -9.729 1.00 29.70 ? 33 GLY B O 1 ATOM 1881 N N . VAL B 2 34 ? 37.130 -45.289 -10.269 1.00 21.10 ? 34 VAL B N 1 ATOM 1882 C CA . VAL B 2 34 ? 36.843 -44.969 -11.665 1.00 19.83 ? 34 VAL B CA 1 ATOM 1883 C C . VAL B 2 34 ? 35.393 -45.271 -12.017 1.00 25.25 ? 34 VAL B C 1 ATOM 1884 O O . VAL B 2 34 ? 34.887 -46.377 -11.777 1.00 27.08 ? 34 VAL B O 1 ATOM 1885 C CB . VAL B 2 34 ? 37.805 -45.671 -12.643 1.00 22.99 ? 34 VAL B CB 1 ATOM 1886 C CG1 . VAL B 2 34 ? 37.299 -45.563 -14.082 1.00 17.28 ? 34 VAL B CG1 1 ATOM 1887 C CG2 . VAL B 2 34 ? 39.200 -45.073 -12.513 1.00 24.81 ? 34 VAL B CG2 1 ATOM 1888 N N . HIS B 2 35 ? 34.725 -44.267 -12.574 1.00 20.48 ? 35 HIS B N 1 ATOM 1889 C CA . HIS B 2 35 ? 33.311 -44.366 -12.896 1.00 24.36 ? 35 HIS B CA 1 ATOM 1890 C C . HIS B 2 35 ? 33.127 -44.615 -14.381 1.00 25.08 ? 35 HIS B C 1 ATOM 1891 O O . HIS B 2 35 ? 34.008 -44.304 -15.192 1.00 22.64 ? 35 HIS B O 1 ATOM 1892 C CB . HIS B 2 35 ? 32.588 -43.072 -12.509 1.00 22.09 ? 35 HIS B CB 1 ATOM 1893 C CG . HIS B 2 35 ? 32.655 -42.761 -11.048 1.00 24.65 ? 35 HIS B CG 1 ATOM 1894 N ND1 . HIS B 2 35 ? 31.546 -42.800 -10.228 1.00 16.65 ? 35 HIS B ND1 1 ATOM 1895 C CD2 . HIS B 2 35 ? 33.698 -42.415 -10.256 1.00 22.74 ? 35 HIS B CD2 1 ATOM 1896 C CE1 . HIS B 2 35 ? 31.905 -42.489 -8.996 1.00 21.00 ? 35 HIS B CE1 1 ATOM 1897 N NE2 . HIS B 2 35 ? 33.205 -42.249 -8.986 1.00 24.11 ? 35 HIS B NE2 1 ATOM 1898 N N . TRP B 2 36 ? 31.971 -45.176 -14.722 1.00 21.26 ? 36 TRP B N 1 ATOM 1899 C CA . TRP B 2 36 ? 31.579 -45.367 -16.106 1.00 19.12 ? 36 TRP B CA 1 ATOM 1900 C C . TRP B 2 36 ? 30.222 -44.742 -16.359 1.00 22.42 ? 36 TRP B C 1 ATOM 1901 O O . TRP B 2 36 ? 29.266 -44.947 -15.600 1.00 20.55 ? 36 TRP B O 1 ATOM 1902 C CB . TRP B 2 36 ? 31.575 -46.845 -16.485 1.00 19.68 ? 36 TRP B CB 1 ATOM 1903 C CG . TRP B 2 36 ? 32.938 -47.440 -16.447 1.00 21.93 ? 36 TRP B CG 1 ATOM 1904 C CD1 . TRP B 2 36 ? 33.604 -47.876 -15.346 1.00 18.72 ? 36 TRP B CD1 1 ATOM 1905 C CD2 . TRP B 2 36 ? 33.820 -47.652 -17.560 1.00 22.10 ? 36 TRP B CD2 1 ATOM 1906 N NE1 . TRP B 2 36 ? 34.837 -48.356 -15.697 1.00 17.22 ? 36 TRP B NE1 1 ATOM 1907 C CE2 . TRP B 2 36 ? 34.997 -48.228 -17.053 1.00 24.32 ? 36 TRP B CE2 1 ATOM 1908 C CE3 . TRP B 2 36 ? 33.723 -47.419 -18.933 1.00 22.60 ? 36 TRP B CE3 1 ATOM 1909 C CZ2 . TRP B 2 36 ? 36.074 -48.573 -17.869 1.00 29.92 ? 36 TRP B CZ2 1 ATOM 1910 C CZ3 . TRP B 2 36 ? 34.791 -47.762 -19.743 1.00 25.54 ? 36 TRP B CZ3 1 ATOM 1911 C CH2 . TRP B 2 36 ? 35.952 -48.332 -19.209 1.00 30.11 ? 36 TRP B CH2 1 ATOM 1912 N N . VAL B 2 37 ? 30.169 -43.961 -17.431 1.00 22.50 ? 37 VAL B N 1 ATOM 1913 C CA . VAL B 2 37 ? 28.995 -43.205 -17.829 1.00 18.65 ? 37 VAL B CA 1 ATOM 1914 C C . VAL B 2 37 ? 28.816 -43.467 -19.313 1.00 20.28 ? 37 VAL B C 1 ATOM 1915 O O . VAL B 2 37 ? 29.792 -43.559 -20.059 1.00 27.98 ? 37 VAL B O 1 ATOM 1916 C CB . VAL B 2 37 ? 29.235 -41.680 -17.625 1.00 17.16 ? 37 VAL B CB 1 ATOM 1917 C CG1 . VAL B 2 37 ? 28.077 -40.849 -18.194 1.00 17.04 ? 37 VAL B CG1 1 ATOM 1918 C CG2 . VAL B 2 37 ? 29.477 -41.354 -16.146 1.00 13.52 ? 37 VAL B CG2 1 ATOM 1919 N N . ARG B 2 38 ? 27.581 -43.599 -19.758 1.00 18.03 ? 38 ARG B N 1 ATOM 1920 C CA . ARG B 2 38 ? 27.344 -43.681 -21.186 1.00 13.82 ? 38 ARG B CA 1 ATOM 1921 C C . ARG B 2 38 ? 26.409 -42.576 -21.640 1.00 22.48 ? 38 ARG B C 1 ATOM 1922 O O . ARG B 2 38 ? 25.760 -41.900 -20.823 1.00 19.54 ? 38 ARG B O 1 ATOM 1923 C CB . ARG B 2 38 ? 26.795 -45.053 -21.588 1.00 15.03 ? 38 ARG B CB 1 ATOM 1924 C CG . ARG B 2 38 ? 25.297 -45.221 -21.388 1.00 15.53 ? 38 ARG B CG 1 ATOM 1925 C CD . ARG B 2 38 ? 24.859 -46.605 -21.795 1.00 21.33 ? 38 ARG B CD 1 ATOM 1926 N NE . ARG B 2 38 ? 23.438 -46.809 -21.555 1.00 29.77 ? 38 ARG B NE 1 ATOM 1927 C CZ . ARG B 2 38 ? 22.771 -47.897 -21.924 1.00 32.08 ? 38 ARG B CZ 1 ATOM 1928 N NH1 . ARG B 2 38 ? 23.403 -48.883 -22.554 1.00 37.78 ? 38 ARG B NH1 1 ATOM 1929 N NH2 . ARG B 2 38 ? 21.474 -47.999 -21.662 1.00 23.08 ? 38 ARG B NH2 1 ATOM 1930 N N . GLN B 2 39 ? 26.345 -42.404 -22.953 1.00 21.23 ? 39 GLN B N 1 ATOM 1931 C CA . GLN B 2 39 ? 25.546 -41.353 -23.539 1.00 18.75 ? 39 GLN B CA 1 ATOM 1932 C C . GLN B 2 39 ? 24.905 -41.910 -24.800 1.00 19.79 ? 39 GLN B C 1 ATOM 1933 O O . GLN B 2 39 ? 25.604 -42.398 -25.686 1.00 21.63 ? 39 GLN B O 1 ATOM 1934 C CB . GLN B 2 39 ? 26.437 -40.153 -23.847 1.00 14.77 ? 39 GLN B CB 1 ATOM 1935 C CG . GLN B 2 39 ? 25.700 -38.852 -24.089 1.00 15.03 ? 39 GLN B CG 1 ATOM 1936 C CD . GLN B 2 39 ? 26.644 -37.655 -24.077 1.00 24.64 ? 39 GLN B CD 1 ATOM 1937 O OE1 . GLN B 2 39 ? 27.861 -37.817 -24.139 1.00 21.88 ? 39 GLN B OE1 1 ATOM 1938 N NE2 . GLN B 2 39 ? 26.085 -36.450 -23.995 1.00 26.39 ? 39 GLN B NE2 1 ATOM 1939 N N . SER B 2 40 ? 23.576 -41.850 -24.866 1.00 20.96 ? 40 SER B N 1 ATOM 1940 C CA . SER B 2 40 ? 22.823 -42.459 -25.964 1.00 26.84 ? 40 SER B CA 1 ATOM 1941 C C . SER B 2 40 ? 21.724 -41.527 -26.463 1.00 27.63 ? 40 SER B C 1 ATOM 1942 O O . SER B 2 40 ? 21.321 -40.603 -25.753 1.00 29.19 ? 40 SER B O 1 ATOM 1943 C CB . SER B 2 40 ? 22.205 -43.789 -25.514 1.00 23.39 ? 40 SER B CB 1 ATOM 1944 O OG . SER B 2 40 ? 21.212 -43.577 -24.525 1.00 22.71 ? 40 SER B OG 1 ATOM 1945 N N . PRO B 2 41 ? 21.245 -41.756 -27.695 1.00 27.32 ? 41 PRO B N 1 ATOM 1946 C CA . PRO B 2 41 ? 20.145 -40.926 -28.200 1.00 29.68 ? 41 PRO B CA 1 ATOM 1947 C C . PRO B 2 41 ? 18.891 -41.063 -27.331 1.00 27.80 ? 41 PRO B C 1 ATOM 1948 O O . PRO B 2 41 ? 18.317 -40.055 -26.921 1.00 24.90 ? 41 PRO B O 1 ATOM 1949 C CB . PRO B 2 41 ? 19.899 -41.488 -29.608 1.00 28.56 ? 41 PRO B CB 1 ATOM 1950 C CG . PRO B 2 41 ? 21.218 -42.099 -30.001 1.00 23.38 ? 41 PRO B CG 1 ATOM 1951 C CD . PRO B 2 41 ? 21.774 -42.666 -28.730 1.00 21.84 ? 41 PRO B CD 1 ATOM 1952 N N . GLY B 2 42 ? 18.490 -42.293 -27.031 1.00 22.33 ? 42 GLY B N 1 ATOM 1953 C CA . GLY B 2 42 ? 17.288 -42.519 -26.251 1.00 23.66 ? 42 GLY B CA 1 ATOM 1954 C C . GLY B 2 42 ? 17.293 -42.093 -24.789 1.00 30.14 ? 42 GLY B C 1 ATOM 1955 O O . GLY B 2 42 ? 16.262 -41.668 -24.270 1.00 31.40 ? 42 GLY B O 1 ATOM 1956 N N . LYS B 2 43 ? 18.438 -42.195 -24.117 1.00 27.00 ? 43 LYS B N 1 ATOM 1957 C CA . LYS B 2 43 ? 18.477 -41.967 -22.675 1.00 27.14 ? 43 LYS B CA 1 ATOM 1958 C C . LYS B 2 43 ? 19.495 -40.918 -22.181 1.00 25.84 ? 43 LYS B C 1 ATOM 1959 O O . LYS B 2 43 ? 19.655 -40.735 -20.976 1.00 30.97 ? 43 LYS B O 1 ATOM 1960 C CB . LYS B 2 43 ? 18.678 -43.300 -21.940 1.00 27.82 ? 43 LYS B CB 1 ATOM 1961 C CG . LYS B 2 43 ? 17.384 -44.060 -21.633 1.00 38.15 ? 43 LYS B CG 1 ATOM 1962 C CD . LYS B 2 43 ? 17.211 -44.211 -20.115 1.00 51.60 ? 43 LYS B CD 1 ATOM 1963 C CE . LYS B 2 43 ? 16.007 -45.066 -19.734 1.00 62.80 ? 43 LYS B CE 1 ATOM 1964 N NZ . LYS B 2 43 ? 16.255 -46.521 -19.957 1.00 63.70 ? 43 LYS B NZ 1 ATOM 1965 N N . GLY B 2 44 ? 20.170 -40.236 -23.105 1.00 22.60 ? 44 GLY B N 1 ATOM 1966 C CA . GLY B 2 44 ? 21.162 -39.235 -22.752 1.00 19.47 ? 44 GLY B CA 1 ATOM 1967 C C . GLY B 2 44 ? 22.282 -39.752 -21.861 1.00 20.70 ? 44 GLY B C 1 ATOM 1968 O O . GLY B 2 44 ? 22.728 -40.884 -22.010 1.00 22.68 ? 44 GLY B O 1 ATOM 1969 N N . LEU B 2 45 ? 22.746 -38.917 -20.937 1.00 20.16 ? 45 LEU B N 1 ATOM 1970 C CA . LEU B 2 45 ? 23.791 -39.317 -19.993 1.00 20.67 ? 45 LEU B CA 1 ATOM 1971 C C . LEU B 2 45 ? 23.248 -40.234 -18.878 1.00 23.42 ? 45 LEU B C 1 ATOM 1972 O O . LEU B 2 45 ? 22.305 -39.881 -18.158 1.00 24.72 ? 45 LEU B O 1 ATOM 1973 C CB . LEU B 2 45 ? 24.467 -38.081 -19.387 1.00 16.84 ? 45 LEU B CB 1 ATOM 1974 C CG . LEU B 2 45 ? 25.365 -37.278 -20.337 1.00 17.46 ? 45 LEU B CG 1 ATOM 1975 C CD1 . LEU B 2 45 ? 25.500 -35.841 -19.890 1.00 20.89 ? 45 LEU B CD1 1 ATOM 1976 C CD2 . LEU B 2 45 ? 26.742 -37.916 -20.446 1.00 17.36 ? 45 LEU B CD2 1 ATOM 1977 N N . GLU B 2 46 ? 23.843 -41.415 -18.756 1.00 20.00 ? 46 GLU B N 1 ATOM 1978 C CA . GLU B 2 46 ? 23.506 -42.349 -17.694 1.00 20.88 ? 46 GLU B CA 1 ATOM 1979 C C . GLU B 2 46 ? 24.762 -42.741 -16.958 1.00 22.32 ? 46 GLU B C 1 ATOM 1980 O O . GLU B 2 46 ? 25.754 -43.139 -17.582 1.00 21.49 ? 46 GLU B O 1 ATOM 1981 C CB . GLU B 2 46 ? 22.939 -43.646 -18.264 1.00 24.02 ? 46 GLU B CB 1 ATOM 1982 C CG . GLU B 2 46 ? 21.558 -43.573 -18.832 1.00 33.50 ? 46 GLU B CG 1 ATOM 1983 C CD . GLU B 2 46 ? 21.110 -44.932 -19.332 1.00 37.48 ? 46 GLU B CD 1 ATOM 1984 O OE1 . GLU B 2 46 ? 21.660 -45.390 -20.364 1.00 36.81 ? 46 GLU B OE1 1 ATOM 1985 O OE2 . GLU B 2 46 ? 20.227 -45.547 -18.686 1.00 37.31 ? 46 GLU B OE2 1 ATOM 1986 N N . TRP B 2 47 ? 24.718 -42.669 -15.634 1.00 18.82 ? 47 TRP B N 1 ATOM 1987 C CA . TRP B 2 47 ? 25.801 -43.224 -14.836 1.00 25.39 ? 47 TRP B CA 1 ATOM 1988 C C . TRP B 2 47 ? 25.589 -44.743 -14.753 1.00 25.72 ? 47 TRP B C 1 ATOM 1989 O O . TRP B 2 47 ? 24.492 -45.208 -14.428 1.00 22.42 ? 47 TRP B O 1 ATOM 1990 C CB . TRP B 2 47 ? 25.816 -42.566 -13.456 1.00 24.63 ? 47 TRP B CB 1 ATOM 1991 C CG . TRP B 2 47 ? 26.866 -43.063 -12.513 1.00 20.54 ? 47 TRP B CG 1 ATOM 1992 C CD1 . TRP B 2 47 ? 28.188 -42.701 -12.484 1.00 19.30 ? 47 TRP B CD1 1 ATOM 1993 C CD2 . TRP B 2 47 ? 26.680 -43.995 -11.438 1.00 21.97 ? 47 TRP B CD2 1 ATOM 1994 N NE1 . TRP B 2 47 ? 28.835 -43.366 -11.464 1.00 24.05 ? 47 TRP B NE1 1 ATOM 1995 C CE2 . TRP B 2 47 ? 27.930 -44.161 -10.807 1.00 24.86 ? 47 TRP B CE2 1 ATOM 1996 C CE3 . TRP B 2 47 ? 25.577 -44.707 -10.948 1.00 28.69 ? 47 TRP B CE3 1 ATOM 1997 C CZ2 . TRP B 2 47 ? 28.106 -45.006 -9.706 1.00 27.65 ? 47 TRP B CZ2 1 ATOM 1998 C CZ3 . TRP B 2 47 ? 25.755 -45.553 -9.858 1.00 29.50 ? 47 TRP B CZ3 1 ATOM 1999 C CH2 . TRP B 2 47 ? 27.011 -45.695 -9.252 1.00 29.01 ? 47 TRP B CH2 1 ATOM 2000 N N . LEU B 2 48 ? 26.627 -45.515 -15.069 1.00 23.01 ? 48 LEU B N 1 ATOM 2001 C CA . LEU B 2 48 ? 26.507 -46.977 -15.066 1.00 24.43 ? 48 LEU B CA 1 ATOM 2002 C C . LEU B 2 48 ? 26.994 -47.646 -13.770 1.00 24.92 ? 48 LEU B C 1 ATOM 2003 O O . LEU B 2 48 ? 26.324 -48.522 -13.213 1.00 24.34 ? 48 LEU B O 1 ATOM 2004 C CB . LEU B 2 48 ? 27.231 -47.562 -16.268 1.00 23.24 ? 48 LEU B CB 1 ATOM 2005 C CG . LEU B 2 48 ? 26.668 -47.081 -17.604 1.00 22.22 ? 48 LEU B CG 1 ATOM 2006 C CD1 . LEU B 2 48 ? 27.587 -47.477 -18.747 1.00 23.43 ? 48 LEU B CD1 1 ATOM 2007 C CD2 . LEU B 2 48 ? 25.254 -47.625 -17.821 1.00 16.98 ? 48 LEU B CD2 1 ATOM 2008 N N . GLY B 2 49 ? 28.155 -47.227 -13.286 1.00 25.92 ? 49 GLY B N 1 ATOM 2009 C CA . GLY B 2 49 ? 28.694 -47.775 -12.059 1.00 16.06 ? 49 GLY B CA 1 ATOM 2010 C C . GLY B 2 49 ? 30.093 -47.277 -11.766 1.00 17.76 ? 49 GLY B C 1 ATOM 2011 O O . GLY B 2 49 ? 30.586 -46.349 -12.406 1.00 15.62 ? 49 GLY B O 1 ATOM 2012 N N . VAL B 2 50 ? 30.748 -47.912 -10.803 1.00 18.61 ? 50 VAL B N 1 ATOM 2013 C CA . VAL B 2 50 ? 32.049 -47.457 -10.349 1.00 17.89 ? 50 VAL B CA 1 ATOM 2014 C C . VAL B 2 50 ? 32.851 -48.590 -9.702 1.00 20.21 ? 50 VAL B C 1 ATOM 2015 O O . VAL B 2 50 ? 32.293 -49.456 -9.042 1.00 22.08 ? 50 VAL B O 1 ATOM 2016 C CB . VAL B 2 50 ? 31.874 -46.290 -9.343 1.00 23.34 ? 50 VAL B CB 1 ATOM 2017 C CG1 . VAL B 2 50 ? 30.835 -46.657 -8.289 1.00 17.82 ? 50 VAL B CG1 1 ATOM 2018 C CG2 . VAL B 2 50 ? 33.218 -45.896 -8.703 1.00 16.72 ? 50 VAL B CG2 1 ATOM 2019 N N . ILE B 2 51 ? 34.162 -48.595 -9.907 1.00 27.20 ? 51 ILE B N 1 ATOM 2020 C CA . ILE B 2 51 ? 35.029 -49.402 -9.060 1.00 29.04 ? 51 ILE B CA 1 ATOM 2021 C C . ILE B 2 51 ? 35.859 -48.478 -8.160 1.00 31.75 ? 51 ILE B C 1 ATOM 2022 O O . ILE B 2 51 ? 36.536 -47.569 -8.641 1.00 25.13 ? 51 ILE B O 1 ATOM 2023 C CB . ILE B 2 51 ? 35.890 -50.396 -9.872 1.00 29.52 ? 51 ILE B CB 1 ATOM 2024 C CG1 . ILE B 2 51 ? 36.577 -51.408 -8.945 1.00 32.64 ? 51 ILE B CG1 1 ATOM 2025 C CG2 . ILE B 2 51 ? 36.889 -49.681 -10.772 1.00 27.29 ? 51 ILE B CG2 1 ATOM 2026 C CD1 . ILE B 2 51 ? 37.190 -52.602 -9.705 1.00 20.47 ? 51 ILE B CD1 1 ATOM 2027 N N . TRP B 2 52 ? 35.761 -48.694 -6.850 1.00 35.09 ? 52 TRP B N 1 ATOM 2028 C CA . TRP B 2 52 ? 36.403 -47.831 -5.856 1.00 28.25 ? 52 TRP B CA 1 ATOM 2029 C C . TRP B 2 52 ? 37.858 -48.204 -5.647 1.00 30.05 ? 52 TRP B C 1 ATOM 2030 O O . TRP B 2 52 ? 38.319 -49.221 -6.171 1.00 32.10 ? 52 TRP B O 1 ATOM 2031 C CB . TRP B 2 52 ? 35.660 -47.917 -4.523 1.00 26.81 ? 52 TRP B CB 1 ATOM 2032 C CG . TRP B 2 52 ? 34.268 -47.451 -4.626 1.00 23.98 ? 52 TRP B CG 1 ATOM 2033 C CD1 . TRP B 2 52 ? 33.148 -48.216 -4.616 1.00 23.92 ? 52 TRP B CD1 1 ATOM 2034 C CD2 . TRP B 2 52 ? 33.834 -46.098 -4.801 1.00 36.83 ? 52 TRP B CD2 1 ATOM 2035 N NE1 . TRP B 2 52 ? 32.034 -47.426 -4.761 1.00 23.50 ? 52 TRP B NE1 1 ATOM 2036 C CE2 . TRP B 2 52 ? 32.427 -46.120 -4.876 1.00 33.39 ? 52 TRP B CE2 1 ATOM 2037 C CE3 . TRP B 2 52 ? 34.499 -44.869 -4.897 1.00 30.07 ? 52 TRP B CE3 1 ATOM 2038 C CZ2 . TRP B 2 52 ? 31.670 -44.962 -5.040 1.00 34.59 ? 52 TRP B CZ2 1 ATOM 2039 C CZ3 . TRP B 2 52 ? 33.751 -43.725 -5.056 1.00 32.07 ? 52 TRP B CZ3 1 ATOM 2040 C CH2 . TRP B 2 52 ? 32.349 -43.778 -5.130 1.00 34.13 ? 52 TRP B CH2 1 ATOM 2041 N N . SER B 2 53 ? 38.575 -47.388 -4.876 1.00 33.52 ? 53 SER B N 1 ATOM 2042 C CA . SER B 2 53 ? 39.994 -47.647 -4.595 1.00 39.63 ? 53 SER B CA 1 ATOM 2043 C C . SER B 2 53 ? 40.262 -49.088 -4.163 1.00 35.99 ? 53 SER B C 1 ATOM 2044 O O . SER B 2 53 ? 41.109 -49.769 -4.742 1.00 31.54 ? 53 SER B O 1 ATOM 2045 C CB . SER B 2 53 ? 40.512 -46.692 -3.522 1.00 44.17 ? 53 SER B CB 1 ATOM 2046 O OG . SER B 2 53 ? 40.428 -45.353 -3.960 1.00 45.02 ? 53 SER B OG 1 ATOM 2047 N N . GLY B 2 54 ? 39.512 -49.551 -3.166 1.00 29.13 ? 54 GLY B N 1 ATOM 2048 C CA . GLY B 2 54 ? 39.742 -50.860 -2.585 1.00 30.82 ? 54 GLY B CA 1 ATOM 2049 C C . GLY B 2 54 ? 39.074 -52.032 -3.284 1.00 35.94 ? 54 GLY B C 1 ATOM 2050 O O . GLY B 2 54 ? 39.051 -53.135 -2.733 1.00 31.88 ? 54 GLY B O 1 ATOM 2051 N N . GLY B 2 55 ? 38.515 -51.810 -4.475 1.00 27.84 ? 55 GLY B N 1 ATOM 2052 C CA . GLY B 2 55 ? 37.944 -52.905 -5.251 1.00 27.41 ? 55 GLY B CA 1 ATOM 2053 C C . GLY B 2 55 ? 36.430 -53.107 -5.226 1.00 26.92 ? 55 GLY B C 1 ATOM 2054 O O . GLY B 2 55 ? 35.888 -53.819 -6.068 1.00 28.81 ? 55 GLY B O 1 ATOM 2055 N N . ASN B 2 56 ? 35.736 -52.514 -4.263 1.00 33.31 ? 56 ASN B N 1 ATOM 2056 C CA . ASN B 2 56 ? 34.278 -52.604 -4.237 1.00 31.59 ? 56 ASN B CA 1 ATOM 2057 C C . ASN B 2 56 ? 33.634 -51.998 -5.485 1.00 29.37 ? 56 ASN B C 1 ATOM 2058 O O . ASN B 2 56 ? 34.149 -51.035 -6.057 1.00 25.79 ? 56 ASN B O 1 ATOM 2059 C CB . ASN B 2 56 ? 33.721 -51.920 -2.989 1.00 33.96 ? 56 ASN B CB 1 ATOM 2060 C CG . ASN B 2 56 ? 33.967 -52.718 -1.731 1.00 36.82 ? 56 ASN B CG 1 ATOM 2061 O OD1 . ASN B 2 56 ? 34.057 -53.947 -1.767 1.00 40.08 ? 56 ASN B OD1 1 ATOM 2062 N ND2 . ASN B 2 56 ? 34.074 -52.024 -0.605 1.00 39.05 ? 56 ASN B ND2 1 ATOM 2063 N N . THR B 2 57 ? 32.508 -52.559 -5.909 1.00 27.65 ? 57 THR B N 1 ATOM 2064 C CA . THR B 2 57 ? 31.793 -52.002 -7.051 1.00 24.68 ? 57 THR B CA 1 ATOM 2065 C C . THR B 2 57 ? 30.336 -51.677 -6.739 1.00 25.88 ? 57 THR B C 1 ATOM 2066 O O . THR B 2 57 ? 29.700 -52.355 -5.933 1.00 32.70 ? 57 THR B O 1 ATOM 2067 C CB . THR B 2 57 ? 31.850 -52.938 -8.266 1.00 28.61 ? 57 THR B CB 1 ATOM 2068 O OG1 . THR B 2 57 ? 31.434 -54.253 -7.878 1.00 29.96 ? 57 THR B OG1 1 ATOM 2069 C CG2 . THR B 2 57 ? 33.268 -52.995 -8.824 1.00 22.17 ? 57 THR B CG2 1 ATOM 2070 N N . ASP B 2 58 ? 29.831 -50.617 -7.369 1.00 26.12 ? 58 ASP B N 1 ATOM 2071 C CA . ASP B 2 58 ? 28.409 -50.267 -7.341 1.00 25.54 ? 58 ASP B CA 1 ATOM 2072 C C . ASP B 2 58 ? 27.938 -50.168 -8.770 1.00 29.72 ? 58 ASP B C 1 ATOM 2073 O O . ASP B 2 58 ? 28.598 -49.534 -9.592 1.00 27.64 ? 58 ASP B O 1 ATOM 2074 C CB . ASP B 2 58 ? 28.176 -48.907 -6.684 1.00 24.17 ? 58 ASP B CB 1 ATOM 2075 C CG . ASP B 2 58 ? 28.630 -48.869 -5.238 1.00 23.78 ? 58 ASP B CG 1 ATOM 2076 O OD1 . ASP B 2 58 ? 28.280 -49.794 -4.485 1.00 25.51 ? 58 ASP B OD1 1 ATOM 2077 O OD2 . ASP B 2 58 ? 29.341 -47.914 -4.868 1.00 33.98 ? 58 ASP B OD2 1 ATOM 2078 N N . TYR B 2 59 ? 26.793 -50.779 -9.059 1.00 21.09 ? 59 TYR B N 1 ATOM 2079 C CA . TYR B 2 59 ? 26.200 -50.714 -10.383 1.00 27.05 ? 59 TYR B CA 1 ATOM 2080 C C . TYR B 2 59 ? 24.834 -50.040 -10.323 1.00 28.12 ? 59 TYR B C 1 ATOM 2081 O O . TYR B 2 59 ? 24.031 -50.331 -9.424 1.00 22.14 ? 59 TYR B O 1 ATOM 2082 C CB . TYR B 2 59 ? 26.048 -52.127 -10.947 1.00 28.43 ? 59 TYR B CB 1 ATOM 2083 C CG . TYR B 2 59 ? 27.341 -52.897 -11.014 1.00 26.95 ? 59 TYR B CG 1 ATOM 2084 C CD1 . TYR B 2 59 ? 28.480 -52.336 -11.574 1.00 25.72 ? 59 TYR B CD1 1 ATOM 2085 C CD2 . TYR B 2 59 ? 27.429 -54.178 -10.495 1.00 29.46 ? 59 TYR B CD2 1 ATOM 2086 C CE1 . TYR B 2 59 ? 29.665 -53.036 -11.622 1.00 23.57 ? 59 TYR B CE1 1 ATOM 2087 C CE2 . TYR B 2 59 ? 28.612 -54.891 -10.539 1.00 28.40 ? 59 TYR B CE2 1 ATOM 2088 C CZ . TYR B 2 59 ? 29.724 -54.317 -11.106 1.00 30.19 ? 59 TYR B CZ 1 ATOM 2089 O OH . TYR B 2 59 ? 30.898 -55.028 -11.153 1.00 36.36 ? 59 TYR B OH 1 ATOM 2090 N N . ASN B 2 60 ? 24.573 -49.141 -11.272 1.00 24.60 ? 60 ASN B N 1 ATOM 2091 C CA . ASN B 2 60 ? 23.250 -48.522 -11.369 1.00 27.78 ? 60 ASN B CA 1 ATOM 2092 C C . ASN B 2 60 ? 22.197 -49.630 -11.500 1.00 30.81 ? 60 ASN B C 1 ATOM 2093 O O . ASN B 2 60 ? 22.405 -50.590 -12.238 1.00 27.55 ? 60 ASN B O 1 ATOM 2094 C CB . ASN B 2 60 ? 23.173 -47.539 -12.549 1.00 26.61 ? 60 ASN B CB 1 ATOM 2095 C CG . ASN B 2 60 ? 22.058 -46.492 -12.385 1.00 27.98 ? 60 ASN B CG 1 ATOM 2096 O OD1 . ASN B 2 60 ? 21.164 -46.644 -11.561 1.00 28.06 ? 60 ASN B OD1 1 ATOM 2097 N ND2 . ASN B 2 60 ? 22.114 -45.431 -13.182 1.00 24.04 ? 60 ASN B ND2 1 ATOM 2098 N N . THR B 2 61 ? 21.068 -49.467 -10.798 1.00 23.02 ? 61 THR B N 1 ATOM 2099 C CA . THR B 2 61 ? 20.069 -50.533 -10.641 1.00 28.05 ? 61 THR B CA 1 ATOM 2100 C C . THR B 2 61 ? 19.709 -51.324 -11.888 1.00 30.79 ? 61 THR B C 1 ATOM 2101 O O . THR B 2 61 ? 19.723 -52.569 -11.811 1.00 35.20 ? 61 THR B O 1 ATOM 2102 C CB . THR B 2 61 ? 18.789 -49.916 -10.023 1.00 32.81 ? 61 THR B CB 1 ATOM 2103 O OG1 . THR B 2 61 ? 19.098 -49.413 -8.722 1.00 41.30 ? 61 THR B OG1 1 ATOM 2104 C CG2 . THR B 2 61 ? 17.717 -50.962 -9.925 1.00 28.99 ? 61 THR B CG2 1 ATOM 2105 N N . PRO B 2 62 ? 19.401 -50.741 -13.051 1.00 29.66 ? 62 PRO B N 1 ATOM 2106 C CA . PRO B 2 62 ? 19.032 -51.566 -14.209 1.00 31.20 ? 62 PRO B CA 1 ATOM 2107 C C . PRO B 2 62 ? 20.212 -52.262 -14.888 1.00 32.86 ? 62 PRO B C 1 ATOM 2108 O O . PRO B 2 62 ? 20.039 -52.817 -15.977 1.00 39.27 ? 62 PRO B O 1 ATOM 2109 C CB . PRO B 2 62 ? 18.436 -50.545 -15.179 1.00 27.24 ? 62 PRO B CB 1 ATOM 2110 C CG . PRO B 2 62 ? 19.141 -49.290 -14.855 1.00 22.97 ? 62 PRO B CG 1 ATOM 2111 C CD . PRO B 2 62 ? 19.324 -49.303 -13.370 1.00 23.24 ? 62 PRO B CD 1 ATOM 2112 N N . PHE B 2 63 ? 21.385 -52.236 -14.266 1.00 28.47 ? 63 PHE B N 1 ATOM 2113 C CA . PHE B 2 63 ? 22.577 -52.776 -14.901 1.00 29.21 ? 63 PHE B CA 1 ATOM 2114 C C . PHE B 2 63 ? 23.277 -53.835 -14.053 1.00 32.28 ? 63 PHE B C 1 ATOM 2115 O O . PHE B 2 63 ? 24.200 -54.495 -14.529 1.00 38.22 ? 63 PHE B O 1 ATOM 2116 C CB . PHE B 2 63 ? 23.557 -51.649 -15.261 1.00 28.15 ? 63 PHE B CB 1 ATOM 2117 C CG . PHE B 2 63 ? 23.011 -50.665 -16.262 1.00 31.97 ? 63 PHE B CG 1 ATOM 2118 C CD1 . PHE B 2 63 ? 22.937 -50.990 -17.611 1.00 38.84 ? 63 PHE B CD1 1 ATOM 2119 C CD2 . PHE B 2 63 ? 22.571 -49.416 -15.860 1.00 33.24 ? 63 PHE B CD2 1 ATOM 2120 C CE1 . PHE B 2 63 ? 22.426 -50.088 -18.535 1.00 37.11 ? 63 PHE B CE1 1 ATOM 2121 C CE2 . PHE B 2 63 ? 22.057 -48.513 -16.782 1.00 32.79 ? 63 PHE B CE2 1 ATOM 2122 C CZ . PHE B 2 63 ? 21.987 -48.848 -18.117 1.00 33.49 ? 63 PHE B CZ 1 ATOM 2123 N N . THR B 2 64 ? 22.834 -54.007 -12.812 1.00 29.09 ? 64 THR B N 1 ATOM 2124 C CA . THR B 2 64 ? 23.455 -54.975 -11.903 1.00 35.93 ? 64 THR B CA 1 ATOM 2125 C C . THR B 2 64 ? 23.549 -56.400 -12.462 1.00 40.15 ? 64 THR B C 1 ATOM 2126 O O . THR B 2 64 ? 24.489 -57.129 -12.155 1.00 45.85 ? 64 THR B O 1 ATOM 2127 C CB . THR B 2 64 ? 22.731 -55.017 -10.537 1.00 43.74 ? 64 THR B CB 1 ATOM 2128 O OG1 . THR B 2 64 ? 21.314 -55.077 -10.740 1.00 46.59 ? 64 THR B OG1 1 ATOM 2129 C CG2 . THR B 2 64 ? 23.055 -53.780 -9.730 1.00 47.39 ? 64 THR B CG2 1 ATOM 2130 N N . SER B 2 65 ? 22.586 -56.782 -13.296 1.00 39.13 ? 65 SER B N 1 ATOM 2131 C CA . SER B 2 65 ? 22.506 -58.146 -13.826 1.00 42.29 ? 65 SER B CA 1 ATOM 2132 C C . SER B 2 65 ? 23.465 -58.419 -14.978 1.00 37.22 ? 65 SER B C 1 ATOM 2133 O O . SER B 2 65 ? 23.718 -59.569 -15.319 1.00 44.48 ? 65 SER B O 1 ATOM 2134 C CB . SER B 2 65 ? 21.083 -58.448 -14.299 1.00 47.05 ? 65 SER B CB 1 ATOM 2135 O OG . SER B 2 65 ? 20.130 -58.094 -13.310 1.00 61.63 ? 65 SER B OG 1 ATOM 2136 N N . ARG B 2 66 ? 23.988 -57.373 -15.597 1.00 30.56 ? 66 ARG B N 1 ATOM 2137 C CA . ARG B 2 66 ? 24.770 -57.590 -16.803 1.00 35.98 ? 66 ARG B CA 1 ATOM 2138 C C . ARG B 2 66 ? 26.041 -56.758 -16.861 1.00 33.85 ? 66 ARG B C 1 ATOM 2139 O O . ARG B 2 66 ? 26.680 -56.658 -17.895 1.00 38.42 ? 66 ARG B O 1 ATOM 2140 C CB . ARG B 2 66 ? 23.911 -57.371 -18.056 1.00 35.14 ? 66 ARG B CB 1 ATOM 2141 C CG . ARG B 2 66 ? 23.323 -55.975 -18.213 1.00 36.33 ? 66 ARG B CG 1 ATOM 2142 C CD . ARG B 2 66 ? 22.320 -55.978 -19.370 1.00 42.16 ? 66 ARG B CD 1 ATOM 2143 N NE . ARG B 2 66 ? 21.877 -54.640 -19.750 1.00 40.41 ? 66 ARG B NE 1 ATOM 2144 C CZ . ARG B 2 66 ? 22.113 -54.081 -20.934 1.00 38.47 ? 66 ARG B CZ 1 ATOM 2145 N NH1 . ARG B 2 66 ? 22.795 -54.748 -21.859 1.00 27.90 ? 66 ARG B NH1 1 ATOM 2146 N NH2 . ARG B 2 66 ? 21.664 -52.856 -21.194 1.00 33.03 ? 66 ARG B NH2 1 ATOM 2147 N N . LEU B 2 67 ? 26.428 -56.192 -15.737 1.00 24.90 ? 67 LEU B N 1 ATOM 2148 C CA . LEU B 2 67 ? 27.599 -55.337 -15.720 1.00 28.72 ? 67 LEU B CA 1 ATOM 2149 C C . LEU B 2 67 ? 28.668 -55.878 -14.768 1.00 32.84 ? 67 LEU B C 1 ATOM 2150 O O . LEU B 2 67 ? 28.366 -56.252 -13.634 1.00 36.32 ? 67 LEU B O 1 ATOM 2151 C CB . LEU B 2 67 ? 27.175 -53.924 -15.319 1.00 30.05 ? 67 LEU B CB 1 ATOM 2152 C CG . LEU B 2 67 ? 28.190 -52.798 -15.396 1.00 35.70 ? 67 LEU B CG 1 ATOM 2153 C CD1 . LEU B 2 67 ? 28.749 -52.780 -16.796 1.00 39.06 ? 67 LEU B CD1 1 ATOM 2154 C CD2 . LEU B 2 67 ? 27.510 -51.476 -15.051 1.00 34.43 ? 67 LEU B CD2 1 ATOM 2155 N N . SER B 2 68 ? 29.909 -55.937 -15.242 1.00 29.86 ? 68 SER B N 1 ATOM 2156 C CA . SER B 2 68 ? 31.042 -56.298 -14.395 1.00 29.08 ? 68 SER B CA 1 ATOM 2157 C C . SER B 2 68 ? 32.141 -55.271 -14.567 1.00 30.29 ? 68 SER B C 1 ATOM 2158 O O . SER B 2 68 ? 32.537 -54.973 -15.688 1.00 30.76 ? 68 SER B O 1 ATOM 2159 C CB . SER B 2 68 ? 31.601 -57.664 -14.783 1.00 31.79 ? 68 SER B CB 1 ATOM 2160 O OG . SER B 2 68 ? 30.569 -58.626 -14.883 1.00 47.86 ? 68 SER B OG 1 ATOM 2161 N N . ILE B 2 69 ? 32.644 -54.736 -13.461 1.00 23.55 ? 69 ILE B N 1 ATOM 2162 C CA . ILE B 2 69 ? 33.808 -53.869 -13.530 1.00 26.60 ? 69 ILE B CA 1 ATOM 2163 C C . ILE B 2 69 ? 34.982 -54.444 -12.738 1.00 29.71 ? 69 ILE B C 1 ATOM 2164 O O . ILE B 2 69 ? 34.849 -54.768 -11.563 1.00 29.07 ? 69 ILE B O 1 ATOM 2165 C CB . ILE B 2 69 ? 33.498 -52.449 -13.029 1.00 25.56 ? 69 ILE B CB 1 ATOM 2166 C CG1 . ILE B 2 69 ? 32.326 -51.846 -13.808 1.00 22.83 ? 69 ILE B CG1 1 ATOM 2167 C CG2 . ILE B 2 69 ? 34.737 -51.579 -13.156 1.00 20.80 ? 69 ILE B CG2 1 ATOM 2168 C CD1 . ILE B 2 69 ? 31.837 -50.503 -13.258 1.00 20.76 ? 69 ILE B CD1 1 ATOM 2169 N N . ASN B 2 70 ? 36.133 -54.577 -13.393 1.00 31.77 ? 70 ASN B N 1 ATOM 2170 C CA . ASN B 2 70 ? 37.352 -55.046 -12.729 1.00 30.29 ? 70 ASN B CA 1 ATOM 2171 C C . ASN B 2 70 ? 38.536 -54.156 -13.061 1.00 33.22 ? 70 ASN B C 1 ATOM 2172 O O . ASN B 2 70 ? 38.470 -53.332 -13.977 1.00 35.58 ? 70 ASN B O 1 ATOM 2173 C CB . ASN B 2 70 ? 37.676 -56.485 -13.131 1.00 27.70 ? 70 ASN B CB 1 ATOM 2174 C CG . ASN B 2 70 ? 36.619 -57.453 -12.693 1.00 39.27 ? 70 ASN B CG 1 ATOM 2175 O OD1 . ASN B 2 70 ? 36.698 -58.026 -11.608 1.00 51.83 ? 70 ASN B OD1 1 ATOM 2176 N ND2 . ASN B 2 70 ? 35.604 -57.633 -13.526 1.00 44.96 ? 70 ASN B ND2 1 ATOM 2177 N N . LYS B 2 71 ? 39.627 -54.337 -12.327 1.00 29.80 ? 71 LYS B N 1 ATOM 2178 C CA . LYS B 2 71 ? 40.818 -53.552 -12.578 1.00 25.52 ? 71 LYS B CA 1 ATOM 2179 C C . LYS B 2 71 ? 42.088 -54.278 -12.177 1.00 27.67 ? 71 LYS B C 1 ATOM 2180 O O . LYS B 2 71 ? 42.067 -55.251 -11.430 1.00 28.89 ? 71 LYS B O 1 ATOM 2181 C CB . LYS B 2 71 ? 40.748 -52.227 -11.825 1.00 26.56 ? 71 LYS B CB 1 ATOM 2182 C CG . LYS B 2 71 ? 40.849 -52.393 -10.321 1.00 30.07 ? 71 LYS B CG 1 ATOM 2183 C CD . LYS B 2 71 ? 40.817 -51.052 -9.627 1.00 28.68 ? 71 LYS B CD 1 ATOM 2184 C CE . LYS B 2 71 ? 40.948 -51.227 -8.124 1.00 27.46 ? 71 LYS B CE 1 ATOM 2185 N NZ . LYS B 2 71 ? 41.438 -49.973 -7.524 1.00 28.57 ? 71 LYS B NZ 1 ATOM 2186 N N . ASP B 2 72 ? 43.194 -53.769 -12.702 1.00 28.44 ? 72 ASP B N 1 ATOM 2187 C CA . ASP B 2 72 ? 44.531 -54.209 -12.366 1.00 30.66 ? 72 ASP B CA 1 ATOM 2188 C C . ASP B 2 72 ? 45.245 -52.943 -11.934 1.00 30.92 ? 72 ASP B C 1 ATOM 2189 O O . ASP B 2 72 ? 45.631 -52.128 -12.775 1.00 33.12 ? 72 ASP B O 1 ATOM 2190 C CB . ASP B 2 72 ? 45.212 -54.800 -13.608 1.00 34.39 ? 72 ASP B CB 1 ATOM 2191 C CG . ASP B 2 72 ? 46.580 -55.398 -13.312 1.00 41.29 ? 72 ASP B CG 1 ATOM 2192 O OD1 . ASP B 2 72 ? 47.248 -54.981 -12.339 1.00 43.63 ? 72 ASP B OD1 1 ATOM 2193 O OD2 . ASP B 2 72 ? 46.995 -56.296 -14.072 1.00 45.59 ? 72 ASP B OD2 1 ATOM 2194 N N . ASN B 2 73 ? 45.410 -52.777 -10.625 1.00 38.68 ? 73 ASN B N 1 ATOM 2195 C CA . ASN B 2 73 ? 46.077 -51.606 -10.071 1.00 30.44 ? 73 ASN B CA 1 ATOM 2196 C C . ASN B 2 73 ? 47.467 -51.378 -10.649 1.00 41.91 ? 73 ASN B C 1 ATOM 2197 O O . ASN B 2 73 ? 47.786 -50.277 -11.098 1.00 40.67 ? 73 ASN B O 1 ATOM 2198 C CB . ASN B 2 73 ? 46.164 -51.704 -8.555 1.00 35.89 ? 73 ASN B CB 1 ATOM 2199 C CG . ASN B 2 73 ? 44.871 -51.333 -7.878 1.00 37.09 ? 73 ASN B CG 1 ATOM 2200 O OD1 . ASN B 2 73 ? 44.042 -50.617 -8.450 1.00 29.01 ? 73 ASN B OD1 1 ATOM 2201 N ND2 . ASN B 2 73 ? 44.687 -51.811 -6.647 1.00 33.64 ? 73 ASN B ND2 1 ATOM 2202 N N . SER B 2 74 ? 48.286 -52.423 -10.645 1.00 43.76 ? 74 SER B N 1 ATOM 2203 C CA . SER B 2 74 ? 49.658 -52.313 -11.124 1.00 45.74 ? 74 SER B CA 1 ATOM 2204 C C . SER B 2 74 ? 49.731 -51.822 -12.570 1.00 41.59 ? 74 SER B C 1 ATOM 2205 O O . SER B 2 74 ? 50.547 -50.958 -12.901 1.00 39.93 ? 74 SER B O 1 ATOM 2206 C CB . SER B 2 74 ? 50.382 -53.650 -10.959 1.00 54.28 ? 74 SER B CB 1 ATOM 2207 O OG . SER B 2 74 ? 49.505 -54.733 -11.221 1.00 60.39 ? 74 SER B OG 1 ATOM 2208 N N . LYS B 2 75 ? 48.855 -52.349 -13.419 1.00 35.67 ? 75 LYS B N 1 ATOM 2209 C CA . LYS B 2 75 ? 48.837 -51.971 -14.832 1.00 34.40 ? 75 LYS B CA 1 ATOM 2210 C C . LYS B 2 75 ? 48.037 -50.698 -15.093 1.00 31.84 ? 75 LYS B C 1 ATOM 2211 O O . LYS B 2 75 ? 47.942 -50.245 -16.237 1.00 29.42 ? 75 LYS B O 1 ATOM 2212 C CB . LYS B 2 75 ? 48.270 -53.112 -15.683 1.00 37.26 ? 75 LYS B CB 1 ATOM 2213 C CG . LYS B 2 75 ? 49.146 -54.345 -15.752 1.00 41.74 ? 75 LYS B CG 1 ATOM 2214 C CD . LYS B 2 75 ? 48.531 -55.373 -16.682 1.00 54.41 ? 75 LYS B CD 1 ATOM 2215 C CE . LYS B 2 75 ? 49.373 -56.632 -16.759 1.00 64.03 ? 75 LYS B CE 1 ATOM 2216 N NZ . LYS B 2 75 ? 48.792 -57.616 -17.727 1.00 69.72 ? 75 LYS B NZ 1 ATOM 2217 N N . SER B 2 76 ? 47.459 -50.134 -14.032 1.00 32.78 ? 76 SER B N 1 ATOM 2218 C CA . SER B 2 76 ? 46.647 -48.916 -14.120 1.00 30.00 ? 76 SER B CA 1 ATOM 2219 C C . SER B 2 76 ? 45.471 -49.059 -15.075 1.00 31.61 ? 76 SER B C 1 ATOM 2220 O O . SER B 2 76 ? 45.068 -48.085 -15.704 1.00 35.36 ? 76 SER B O 1 ATOM 2221 C CB . SER B 2 76 ? 47.488 -47.712 -14.561 1.00 26.38 ? 76 SER B CB 1 ATOM 2222 O OG . SER B 2 76 ? 48.280 -47.210 -13.507 1.00 28.07 ? 76 SER B OG 1 ATOM 2223 N N . GLN B 2 77 ? 44.927 -50.264 -15.193 1.00 30.85 ? 77 GLN B N 1 ATOM 2224 C CA . GLN B 2 77 ? 43.825 -50.492 -16.116 1.00 33.93 ? 77 GLN B CA 1 ATOM 2225 C C . GLN B 2 77 ? 42.502 -50.757 -15.405 1.00 31.93 ? 77 GLN B C 1 ATOM 2226 O O . GLN B 2 77 ? 42.465 -51.416 -14.368 1.00 32.52 ? 77 GLN B O 1 ATOM 2227 C CB . GLN B 2 77 ? 44.162 -51.643 -17.068 1.00 38.32 ? 77 GLN B CB 1 ATOM 2228 C CG . GLN B 2 77 ? 45.430 -51.400 -17.880 1.00 41.44 ? 77 GLN B CG 1 ATOM 2229 C CD . GLN B 2 77 ? 45.722 -52.507 -18.874 1.00 41.01 ? 77 GLN B CD 1 ATOM 2230 O OE1 . GLN B 2 77 ? 45.959 -53.658 -18.496 1.00 46.81 ? 77 GLN B OE1 1 ATOM 2231 N NE2 . GLN B 2 77 ? 45.713 -52.161 -20.157 1.00 34.34 ? 77 GLN B NE2 1 ATOM 2232 N N . VAL B 2 78 ? 41.417 -50.232 -15.964 1.00 28.21 ? 78 VAL B N 1 ATOM 2233 C CA . VAL B 2 78 ? 40.082 -50.575 -15.491 1.00 26.37 ? 78 VAL B CA 1 ATOM 2234 C C . VAL B 2 78 ? 39.325 -51.300 -16.598 1.00 29.90 ? 78 VAL B C 1 ATOM 2235 O O . VAL B 2 78 ? 39.325 -50.851 -17.755 1.00 33.97 ? 78 VAL B O 1 ATOM 2236 C CB . VAL B 2 78 ? 39.297 -49.331 -15.065 1.00 28.12 ? 78 VAL B CB 1 ATOM 2237 C CG1 . VAL B 2 78 ? 37.889 -49.722 -14.644 1.00 19.17 ? 78 VAL B CG1 1 ATOM 2238 C CG2 . VAL B 2 78 ? 40.030 -48.601 -13.943 1.00 19.51 ? 78 VAL B CG2 1 ATOM 2239 N N . PHE B 2 79 ? 38.688 -52.420 -16.255 1.00 25.06 ? 79 PHE B N 1 ATOM 2240 C CA . PHE B 2 79 ? 37.994 -53.227 -17.263 1.00 25.44 ? 79 PHE B CA 1 ATOM 2241 C C . PHE B 2 79 ? 36.466 -53.216 -17.133 1.00 24.96 ? 79 PHE B C 1 ATOM 2242 O O . PHE B 2 79 ? 35.897 -53.637 -16.127 1.00 28.37 ? 79 PHE B O 1 ATOM 2243 C CB . PHE B 2 79 ? 38.521 -54.661 -17.275 1.00 26.04 ? 79 PHE B CB 1 ATOM 2244 C CG . PHE B 2 79 ? 40.012 -54.756 -17.297 1.00 35.44 ? 79 PHE B CG 1 ATOM 2245 C CD1 . PHE B 2 79 ? 40.730 -54.381 -18.422 1.00 35.80 ? 79 PHE B CD1 1 ATOM 2246 C CD2 . PHE B 2 79 ? 40.704 -55.232 -16.190 1.00 36.34 ? 79 PHE B CD2 1 ATOM 2247 C CE1 . PHE B 2 79 ? 42.108 -54.474 -18.441 1.00 33.89 ? 79 PHE B CE1 1 ATOM 2248 C CE2 . PHE B 2 79 ? 42.087 -55.331 -16.205 1.00 34.54 ? 79 PHE B CE2 1 ATOM 2249 C CZ . PHE B 2 79 ? 42.789 -54.952 -17.330 1.00 34.95 ? 79 PHE B CZ 1 ATOM 2250 N N . PHE B 2 80 ? 35.813 -52.727 -18.176 1.00 24.40 ? 80 PHE B N 1 ATOM 2251 C CA . PHE B 2 80 ? 34.366 -52.610 -18.193 1.00 27.45 ? 80 PHE B CA 1 ATOM 2252 C C . PHE B 2 80 ? 33.831 -53.733 -19.076 1.00 25.65 ? 80 PHE B C 1 ATOM 2253 O O . PHE B 2 80 ? 34.371 -54.005 -20.147 1.00 28.22 ? 80 PHE B O 1 ATOM 2254 C CB . PHE B 2 80 ? 33.992 -51.231 -18.745 1.00 27.27 ? 80 PHE B CB 1 ATOM 2255 C CG . PHE B 2 80 ? 32.512 -50.997 -18.916 1.00 26.05 ? 80 PHE B CG 1 ATOM 2256 C CD1 . PHE B 2 80 ? 31.868 -51.357 -20.086 1.00 18.18 ? 80 PHE B CD1 1 ATOM 2257 C CD2 . PHE B 2 80 ? 31.779 -50.366 -17.924 1.00 26.95 ? 80 PHE B CD2 1 ATOM 2258 C CE1 . PHE B 2 80 ? 30.508 -51.121 -20.256 1.00 20.75 ? 80 PHE B CE1 1 ATOM 2259 C CE2 . PHE B 2 80 ? 30.430 -50.126 -18.087 1.00 21.60 ? 80 PHE B CE2 1 ATOM 2260 C CZ . PHE B 2 80 ? 29.791 -50.505 -19.262 1.00 23.25 ? 80 PHE B CZ 1 ATOM 2261 N N . LYS B 2 81 ? 32.784 -54.402 -18.617 1.00 24.51 ? 81 LYS B N 1 ATOM 2262 C CA . LYS B 2 81 ? 32.172 -55.464 -19.403 1.00 27.48 ? 81 LYS B CA 1 ATOM 2263 C C . LYS B 2 81 ? 30.670 -55.494 -19.155 1.00 33.68 ? 81 LYS B C 1 ATOM 2264 O O . LYS B 2 81 ? 30.211 -55.476 -18.011 1.00 37.38 ? 81 LYS B O 1 ATOM 2265 C CB . LYS B 2 81 ? 32.815 -56.816 -19.095 1.00 26.15 ? 81 LYS B CB 1 ATOM 2266 C CG . LYS B 2 81 ? 32.338 -57.973 -19.969 1.00 42.53 ? 81 LYS B CG 1 ATOM 2267 C CD . LYS B 2 81 ? 33.205 -59.209 -19.727 1.00 45.42 ? 81 LYS B CD 1 ATOM 2268 C CE . LYS B 2 81 ? 32.993 -60.302 -20.768 1.00 45.13 ? 81 LYS B CE 1 ATOM 2269 N NZ . LYS B 2 81 ? 31.867 -61.209 -20.435 1.00 47.26 ? 81 LYS B NZ 1 ATOM 2270 N N . MET B 2 82 ? 29.908 -55.502 -20.241 1.00 31.27 ? 82 MET B N 1 ATOM 2271 C CA . MET B 2 82 ? 28.454 -55.553 -20.161 1.00 33.39 ? 82 MET B CA 1 ATOM 2272 C C . MET B 2 82 ? 27.920 -56.675 -21.058 1.00 34.66 ? 82 MET B C 1 ATOM 2273 O O . MET B 2 82 ? 28.321 -56.793 -22.219 1.00 29.90 ? 82 MET B O 1 ATOM 2274 C CB . MET B 2 82 ? 27.851 -54.199 -20.542 1.00 33.72 ? 82 MET B CB 1 ATOM 2275 C CG . MET B 2 82 ? 26.361 -54.052 -20.249 1.00 37.44 ? 82 MET B CG 1 ATOM 2276 S SD . MET B 2 82 ? 25.740 -52.387 -20.605 1.00 38.32 ? 82 MET B SD 1 ATOM 2277 C CE . MET B 2 82 ? 26.202 -51.528 -19.106 1.00 50.96 ? 82 MET B CE 1 ATOM 2278 N N . ASN B 2 83 ? 27.029 -57.496 -20.505 1.00 31.79 ? 83 ASN B N 1 ATOM 2279 C CA . ASN B 2 83 ? 26.498 -58.662 -21.202 1.00 37.50 ? 83 ASN B CA 1 ATOM 2280 C C . ASN B 2 83 ? 25.248 -58.347 -21.993 1.00 39.20 ? 83 ASN B C 1 ATOM 2281 O O . ASN B 2 83 ? 24.560 -57.356 -21.722 1.00 31.29 ? 83 ASN B O 1 ATOM 2282 C CB . ASN B 2 83 ? 26.178 -59.790 -20.216 1.00 42.86 ? 83 ASN B CB 1 ATOM 2283 C CG . ASN B 2 83 ? 27.400 -60.260 -19.461 1.00 60.03 ? 83 ASN B CG 1 ATOM 2284 O OD1 . ASN B 2 83 ? 28.460 -60.485 -20.049 1.00 66.40 ? 83 ASN B OD1 1 ATOM 2285 N ND2 . ASN B 2 83 ? 27.265 -60.399 -18.143 1.00 66.38 ? 83 ASN B ND2 1 ATOM 2286 N N . SER B 2 84 ? 24.977 -59.218 -22.964 1.00 37.99 ? 84 SER B N 1 ATOM 2287 C CA . SER B 2 84 ? 23.744 -59.216 -23.740 1.00 40.57 ? 84 SER B CA 1 ATOM 2288 C C . SER B 2 84 ? 23.288 -57.825 -24.174 1.00 39.59 ? 84 SER B C 1 ATOM 2289 O O . SER B 2 84 ? 22.249 -57.341 -23.724 1.00 41.27 ? 84 SER B O 1 ATOM 2290 C CB . SER B 2 84 ? 22.632 -59.898 -22.946 1.00 50.03 ? 84 SER B CB 1 ATOM 2291 O OG . SER B 2 84 ? 22.307 -59.131 -21.801 1.00 52.98 ? 84 SER B OG 1 ATOM 2292 N N . LEU B 2 85 ? 24.060 -57.189 -25.052 1.00 38.96 ? 85 LEU B N 1 ATOM 2293 C CA . LEU B 2 85 ? 23.697 -55.873 -25.562 1.00 33.64 ? 85 LEU B CA 1 ATOM 2294 C C . LEU B 2 85 ? 22.558 -55.962 -26.570 1.00 37.48 ? 85 LEU B C 1 ATOM 2295 O O . LEU B 2 85 ? 22.454 -56.934 -27.318 1.00 47.47 ? 85 LEU B O 1 ATOM 2296 C CB . LEU B 2 85 ? 24.903 -55.184 -26.191 1.00 30.95 ? 85 LEU B CB 1 ATOM 2297 C CG . LEU B 2 85 ? 25.765 -54.376 -25.223 1.00 32.75 ? 85 LEU B CG 1 ATOM 2298 C CD1 . LEU B 2 85 ? 26.519 -55.281 -24.277 1.00 31.39 ? 85 LEU B CD1 1 ATOM 2299 C CD2 . LEU B 2 85 ? 26.726 -53.471 -25.979 1.00 38.20 ? 85 LEU B CD2 1 ATOM 2300 N N . GLN B 2 86 ? 21.690 -54.958 -26.568 1.00 29.63 ? 86 GLN B N 1 ATOM 2301 C CA . GLN B 2 86 ? 20.677 -54.834 -27.609 1.00 31.59 ? 86 GLN B CA 1 ATOM 2302 C C . GLN B 2 86 ? 20.892 -53.498 -28.318 1.00 34.53 ? 86 GLN B C 1 ATOM 2303 O O . GLN B 2 86 ? 21.794 -52.741 -27.949 1.00 39.04 ? 86 GLN B O 1 ATOM 2304 C CB . GLN B 2 86 ? 19.269 -54.929 -27.023 1.00 34.79 ? 86 GLN B CB 1 ATOM 2305 C CG . GLN B 2 86 ? 18.992 -56.215 -26.240 1.00 41.63 ? 86 GLN B CG 1 ATOM 2306 C CD . GLN B 2 86 ? 19.057 -57.487 -27.094 1.00 48.83 ? 86 GLN B CD 1 ATOM 2307 O OE1 . GLN B 2 86 ? 18.648 -57.501 -28.260 1.00 50.23 ? 86 GLN B OE1 1 ATOM 2308 N NE2 . GLN B 2 86 ? 19.576 -58.560 -26.507 1.00 50.44 ? 86 GLN B NE2 1 ATOM 2309 N N . SER B 2 87 ? 20.078 -53.212 -29.329 1.00 34.19 ? 87 SER B N 1 ATOM 2310 C CA . SER B 2 87 ? 20.276 -52.016 -30.147 1.00 34.02 ? 87 SER B CA 1 ATOM 2311 C C . SER B 2 87 ? 20.355 -50.728 -29.344 1.00 27.07 ? 87 SER B C 1 ATOM 2312 O O . SER B 2 87 ? 21.241 -49.910 -29.567 1.00 29.30 ? 87 SER B O 1 ATOM 2313 C CB . SER B 2 87 ? 19.195 -51.897 -31.225 1.00 38.74 ? 87 SER B CB 1 ATOM 2314 O OG . SER B 2 87 ? 19.602 -52.585 -32.391 1.00 46.58 ? 87 SER B OG 1 ATOM 2315 N N . ASN B 2 88 ? 19.469 -50.570 -28.403 1.00 33.87 ? 88 ASN B N 1 ATOM 2316 C CA . ASN B 2 88 ? 19.454 -49.309 -27.715 1.00 35.62 ? 88 ASN B CA 1 ATOM 2317 C C . ASN B 2 88 ? 20.594 -49.199 -26.702 1.00 32.72 ? 88 ASN B C 1 ATOM 2318 O O . ASN B 2 88 ? 20.671 -48.213 -25.978 1.00 38.90 ? 88 ASN B O 1 ATOM 2319 C CB . ASN B 2 88 ? 18.061 -49.123 -27.120 1.00 36.38 ? 88 ASN B CB 1 ATOM 2320 C CG . ASN B 2 88 ? 17.820 -49.976 -25.916 1.00 45.37 ? 88 ASN B CG 1 ATOM 2321 O OD1 . ASN B 2 88 ? 18.680 -50.748 -25.471 1.00 45.37 ? 88 ASN B OD1 1 ATOM 2322 N ND2 . ASN B 2 88 ? 16.619 -49.835 -25.368 1.00 52.35 ? 88 ASN B ND2 1 ATOM 2323 N N . ASP B 2 89 ? 21.493 -50.172 -26.658 1.00 31.65 ? 89 ASP B N 1 ATOM 2324 C CA . ASP B 2 89 ? 22.744 -50.066 -25.904 1.00 31.99 ? 89 ASP B CA 1 ATOM 2325 C C . ASP B 2 89 ? 23.829 -49.411 -26.747 1.00 30.73 ? 89 ASP B C 1 ATOM 2326 O O . ASP B 2 89 ? 24.932 -49.161 -26.265 1.00 21.01 ? 89 ASP B O 1 ATOM 2327 C CB . ASP B 2 89 ? 23.209 -51.433 -25.395 1.00 25.14 ? 89 ASP B CB 1 ATOM 2328 C CG . ASP B 2 89 ? 22.334 -51.956 -24.270 1.00 32.28 ? 89 ASP B CG 1 ATOM 2329 O OD1 . ASP B 2 89 ? 22.073 -51.176 -23.331 1.00 35.47 ? 89 ASP B OD1 1 ATOM 2330 O OD2 . ASP B 2 89 ? 21.897 -53.130 -24.329 1.00 29.09 ? 89 ASP B OD2 1 ATOM 2331 N N . THR B 2 90 ? 23.505 -49.139 -28.008 1.00 29.83 ? 90 THR B N 1 ATOM 2332 C CA . THR B 2 90 ? 24.363 -48.326 -28.854 1.00 28.29 ? 90 THR B CA 1 ATOM 2333 C C . THR B 2 90 ? 24.509 -46.964 -28.200 1.00 25.25 ? 90 THR B C 1 ATOM 2334 O O . THR B 2 90 ? 23.515 -46.282 -27.950 1.00 23.07 ? 90 THR B O 1 ATOM 2335 C CB . THR B 2 90 ? 23.782 -48.156 -30.267 1.00 23.00 ? 90 THR B CB 1 ATOM 2336 O OG1 . THR B 2 90 ? 23.723 -49.432 -30.915 1.00 30.03 ? 90 THR B OG1 1 ATOM 2337 C CG2 . THR B 2 90 ? 24.642 -47.221 -31.085 1.00 23.07 ? 90 THR B CG2 1 ATOM 2338 N N . ALA B 2 91 ? 25.751 -46.583 -27.918 1.00 21.39 ? 91 ALA B N 1 ATOM 2339 C CA . ALA B 2 91 ? 26.041 -45.374 -27.151 1.00 25.42 ? 91 ALA B CA 1 ATOM 2340 C C . ALA B 2 91 ? 27.536 -45.086 -27.143 1.00 23.62 ? 91 ALA B C 1 ATOM 2341 O O . ALA B 2 91 ? 28.344 -45.913 -27.565 1.00 26.07 ? 91 ALA B O 1 ATOM 2342 C CB . ALA B 2 91 ? 25.533 -45.521 -25.708 1.00 25.79 ? 91 ALA B CB 1 ATOM 2343 N N . ILE B 2 92 ? 27.890 -43.896 -26.674 1.00 21.86 ? 92 ILE B N 1 ATOM 2344 C CA . ILE B 2 92 ? 29.271 -43.587 -26.342 1.00 18.81 ? 92 ILE B CA 1 ATOM 2345 C C . ILE B 2 92 ? 29.510 -43.930 -24.880 1.00 20.41 ? 92 ILE B C 1 ATOM 2346 O O . ILE B 2 92 ? 28.792 -43.468 -23.994 1.00 17.55 ? 92 ILE B O 1 ATOM 2347 C CB . ILE B 2 92 ? 29.595 -42.104 -26.575 1.00 18.69 ? 92 ILE B CB 1 ATOM 2348 C CG1 . ILE B 2 92 ? 29.422 -41.777 -28.056 1.00 21.54 ? 92 ILE B CG1 1 ATOM 2349 C CG2 . ILE B 2 92 ? 31.038 -41.780 -26.119 1.00 13.46 ? 92 ILE B CG2 1 ATOM 2350 C CD1 . ILE B 2 92 ? 29.240 -40.324 -28.311 1.00 30.20 ? 92 ILE B CD1 1 ATOM 2351 N N . TYR B 2 93 ? 30.518 -44.753 -24.635 1.00 21.90 ? 93 TYR B N 1 ATOM 2352 C CA . TYR B 2 93 ? 30.851 -45.157 -23.279 1.00 18.76 ? 93 TYR B CA 1 ATOM 2353 C C . TYR B 2 93 ? 32.102 -44.421 -22.814 1.00 24.68 ? 93 TYR B C 1 ATOM 2354 O O . TYR B 2 93 ? 33.096 -44.317 -23.554 1.00 24.14 ? 93 TYR B O 1 ATOM 2355 C CB . TYR B 2 93 ? 31.042 -46.674 -23.225 1.00 17.72 ? 93 TYR B CB 1 ATOM 2356 C CG . TYR B 2 93 ? 29.744 -47.422 -23.393 1.00 20.36 ? 93 TYR B CG 1 ATOM 2357 C CD1 . TYR B 2 93 ? 29.144 -47.547 -24.642 1.00 19.00 ? 93 TYR B CD1 1 ATOM 2358 C CD2 . TYR B 2 93 ? 29.108 -47.994 -22.301 1.00 20.44 ? 93 TYR B CD2 1 ATOM 2359 C CE1 . TYR B 2 93 ? 27.946 -48.221 -24.796 1.00 24.80 ? 93 TYR B CE1 1 ATOM 2360 C CE2 . TYR B 2 93 ? 27.915 -48.674 -22.449 1.00 20.28 ? 93 TYR B CE2 1 ATOM 2361 C CZ . TYR B 2 93 ? 27.334 -48.778 -23.689 1.00 26.45 ? 93 TYR B CZ 1 ATOM 2362 O OH . TYR B 2 93 ? 26.145 -49.448 -23.820 1.00 31.55 ? 93 TYR B OH 1 ATOM 2363 N N . TYR B 2 94 ? 32.041 -43.879 -21.601 1.00 18.88 ? 94 TYR B N 1 ATOM 2364 C CA . TYR B 2 94 ? 33.174 -43.154 -21.055 1.00 20.26 ? 94 TYR B CA 1 ATOM 2365 C C . TYR B 2 94 ? 33.549 -43.695 -19.698 1.00 22.15 ? 94 TYR B C 1 ATOM 2366 O O . TYR B 2 94 ? 32.672 -44.067 -18.906 1.00 20.72 ? 94 TYR B O 1 ATOM 2367 C CB . TYR B 2 94 ? 32.853 -41.688 -20.801 1.00 13.50 ? 94 TYR B CB 1 ATOM 2368 C CG . TYR B 2 94 ? 32.192 -40.881 -21.883 1.00 16.94 ? 94 TYR B CG 1 ATOM 2369 C CD1 . TYR B 2 94 ? 30.818 -40.937 -22.078 1.00 19.08 ? 94 TYR B CD1 1 ATOM 2370 C CD2 . TYR B 2 94 ? 32.927 -39.981 -22.643 1.00 15.94 ? 94 TYR B CD2 1 ATOM 2371 C CE1 . TYR B 2 94 ? 30.201 -40.154 -23.038 1.00 22.75 ? 94 TYR B CE1 1 ATOM 2372 C CE2 . TYR B 2 94 ? 32.321 -39.190 -23.602 1.00 15.90 ? 94 TYR B CE2 1 ATOM 2373 C CZ . TYR B 2 94 ? 30.957 -39.279 -23.792 1.00 18.88 ? 94 TYR B CZ 1 ATOM 2374 O OH . TYR B 2 94 ? 30.354 -38.502 -24.748 1.00 21.50 ? 94 TYR B OH 1 ATOM 2375 N N . CYS B 2 95 ? 34.848 -43.683 -19.413 1.00 16.72 ? 95 CYS B N 1 ATOM 2376 C CA . CYS B 2 95 ? 35.332 -43.820 -18.042 1.00 18.17 ? 95 CYS B CA 1 ATOM 2377 C C . CYS B 2 95 ? 35.643 -42.430 -17.499 1.00 19.43 ? 95 CYS B C 1 ATOM 2378 O O . CYS B 2 95 ? 35.927 -41.512 -18.263 1.00 21.48 ? 95 CYS B O 1 ATOM 2379 C CB . CYS B 2 95 ? 36.555 -44.741 -17.956 1.00 21.08 ? 95 CYS B CB 1 ATOM 2380 S SG . CYS B 2 95 ? 38.042 -44.208 -18.841 1.00 29.97 ? 95 CYS B SG 1 ATOM 2381 N N . ALA B 2 96 ? 35.564 -42.260 -16.185 1.00 21.74 ? 96 ALA B N 1 ATOM 2382 C CA . ALA B 2 96 ? 35.731 -40.930 -15.611 1.00 19.04 ? 96 ALA B CA 1 ATOM 2383 C C . ALA B 2 96 ? 36.218 -41.006 -14.190 1.00 20.67 ? 96 ALA B C 1 ATOM 2384 O O . ALA B 2 96 ? 35.956 -41.986 -13.506 1.00 21.29 ? 96 ALA B O 1 ATOM 2385 C CB . ALA B 2 96 ? 34.422 -40.170 -15.666 1.00 20.29 ? 96 ALA B CB 1 ATOM 2386 N N . ARG B 2 97 ? 36.918 -39.960 -13.753 1.00 22.72 ? 97 ARG B N 1 ATOM 2387 C CA . ARG B 2 97 ? 37.396 -39.860 -12.376 1.00 20.24 ? 97 ARG B CA 1 ATOM 2388 C C . ARG B 2 97 ? 36.880 -38.579 -11.721 1.00 24.67 ? 97 ARG B C 1 ATOM 2389 O O . ARG B 2 97 ? 36.840 -37.517 -12.360 1.00 26.13 ? 97 ARG B O 1 ATOM 2390 C CB . ARG B 2 97 ? 38.914 -39.859 -12.348 1.00 18.36 ? 97 ARG B CB 1 ATOM 2391 C CG . ARG B 2 97 ? 39.502 -40.311 -11.036 1.00 18.74 ? 97 ARG B CG 1 ATOM 2392 C CD . ARG B 2 97 ? 40.806 -39.604 -10.768 1.00 21.35 ? 97 ARG B CD 1 ATOM 2393 N NE . ARG B 2 97 ? 40.573 -38.306 -10.148 1.00 27.87 ? 97 ARG B NE 1 ATOM 2394 C CZ . ARG B 2 97 ? 41.545 -37.467 -9.810 1.00 28.99 ? 97 ARG B CZ 1 ATOM 2395 N NH1 . ARG B 2 97 ? 42.809 -37.800 -10.052 1.00 26.11 ? 97 ARG B NH1 1 ATOM 2396 N NH2 . ARG B 2 97 ? 41.257 -36.306 -9.230 1.00 26.18 ? 97 ARG B NH2 1 ATOM 2397 N N . ALA B 2 98 ? 36.487 -38.677 -10.452 1.00 24.52 ? 98 ALA B N 1 ATOM 2398 C CA . ALA B 2 98 ? 35.984 -37.516 -9.707 1.00 19.60 ? 98 ALA B CA 1 ATOM 2399 C C . ALA B 2 98 ? 37.115 -36.610 -9.231 1.00 22.71 ? 98 ALA B C 1 ATOM 2400 O O . ALA B 2 98 ? 38.296 -36.959 -9.348 1.00 27.11 ? 98 ALA B O 1 ATOM 2401 C CB . ALA B 2 98 ? 35.139 -37.972 -8.517 1.00 17.23 ? 98 ALA B CB 1 ATOM 2402 N N . LEU B 2 99 ? 36.755 -35.448 -8.694 1.00 24.58 ? 99 LEU B N 1 ATOM 2403 C CA . LEU B 2 99 ? 37.739 -34.567 -8.057 1.00 27.35 ? 99 LEU B CA 1 ATOM 2404 C C . LEU B 2 99 ? 38.352 -35.189 -6.795 1.00 25.98 ? 99 LEU B C 1 ATOM 2405 O O . LEU B 2 99 ? 39.573 -35.154 -6.599 1.00 26.84 ? 99 LEU B O 1 ATOM 2406 C CB . LEU B 2 99 ? 37.116 -33.218 -7.696 1.00 26.23 ? 99 LEU B CB 1 ATOM 2407 C CG . LEU B 2 99 ? 37.522 -32.036 -8.564 1.00 33.24 ? 99 LEU B CG 1 ATOM 2408 C CD1 . LEU B 2 99 ? 37.208 -30.756 -7.837 1.00 36.01 ? 99 LEU B CD1 1 ATOM 2409 C CD2 . LEU B 2 99 ? 38.996 -32.097 -8.928 1.00 35.95 ? 99 LEU B CD2 1 ATOM 2410 N N . THR B 2 100 ? 37.503 -35.738 -5.931 1.00 24.87 ? 100 THR B N 1 ATOM 2411 C CA . THR B 2 100 ? 37.991 -36.379 -4.716 1.00 33.78 ? 100 THR B CA 1 ATOM 2412 C C . THR B 2 100 ? 37.680 -37.867 -4.765 1.00 31.09 ? 100 THR B C 1 ATOM 2413 O O . THR B 2 100 ? 36.827 -38.297 -5.543 1.00 30.84 ? 100 THR B O 1 ATOM 2414 C CB . THR B 2 100 ? 37.406 -35.726 -3.448 1.00 44.31 ? 100 THR B CB 1 ATOM 2415 O OG1 . THR B 2 100 ? 36.045 -36.126 -3.286 1.00 53.33 ? 100 THR B OG1 1 ATOM 2416 C CG2 . THR B 2 100 ? 37.465 -34.217 -3.560 1.00 51.30 ? 100 THR B CG2 1 ATOM 2417 N N . TYR B 2 101 ? 38.374 -38.650 -3.945 1.00 26.98 ? 101 TYR B N 1 ATOM 2418 C CA . TYR B 2 101 ? 38.298 -40.106 -4.035 1.00 30.58 ? 101 TYR B CA 1 ATOM 2419 C C . TYR B 2 101 ? 36.904 -40.716 -3.818 1.00 35.02 ? 101 TYR B C 1 ATOM 2420 O O . TYR B 2 101 ? 36.613 -41.796 -4.331 1.00 38.03 ? 101 TYR B O 1 ATOM 2421 C CB . TYR B 2 101 ? 39.326 -40.767 -3.106 1.00 25.09 ? 101 TYR B CB 1 ATOM 2422 C CG . TYR B 2 101 ? 38.946 -40.811 -1.642 1.00 26.64 ? 101 TYR B CG 1 ATOM 2423 C CD1 . TYR B 2 101 ? 38.183 -41.862 -1.131 1.00 20.39 ? 101 TYR B CD1 1 ATOM 2424 C CD2 . TYR B 2 101 ? 39.374 -39.822 -0.761 1.00 25.35 ? 101 TYR B CD2 1 ATOM 2425 C CE1 . TYR B 2 101 ? 37.843 -41.919 0.211 1.00 23.55 ? 101 TYR B CE1 1 ATOM 2426 C CE2 . TYR B 2 101 ? 39.041 -39.873 0.593 1.00 24.39 ? 101 TYR B CE2 1 ATOM 2427 C CZ . TYR B 2 101 ? 38.274 -40.926 1.069 1.00 24.09 ? 101 TYR B CZ 1 ATOM 2428 O OH . TYR B 2 101 ? 37.929 -40.986 2.402 1.00 24.69 ? 101 TYR B OH 1 ATOM 2429 N N . TYR B 2 102 ? 36.050 -40.030 -3.068 1.00 30.16 ? 102 TYR B N 1 ATOM 2430 C CA . TYR B 2 102 ? 34.753 -40.595 -2.684 1.00 27.04 ? 102 TYR B CA 1 ATOM 2431 C C . TYR B 2 102 ? 33.582 -39.990 -3.460 1.00 23.74 ? 102 TYR B C 1 ATOM 2432 O O . TYR B 2 102 ? 32.437 -40.419 -3.298 1.00 22.48 ? 102 TYR B O 1 ATOM 2433 C CB . TYR B 2 102 ? 34.515 -40.371 -1.188 1.00 16.35 ? 102 TYR B CB 1 ATOM 2434 C CG . TYR B 2 102 ? 34.612 -38.909 -0.825 1.00 23.02 ? 102 TYR B CG 1 ATOM 2435 C CD1 . TYR B 2 102 ? 33.505 -38.079 -0.911 1.00 22.52 ? 102 TYR B CD1 1 ATOM 2436 C CD2 . TYR B 2 102 ? 35.822 -38.348 -0.440 1.00 20.66 ? 102 TYR B CD2 1 ATOM 2437 C CE1 . TYR B 2 102 ? 33.590 -36.731 -0.607 1.00 24.21 ? 102 TYR B CE1 1 ATOM 2438 C CE2 . TYR B 2 102 ? 35.914 -36.997 -0.121 1.00 25.96 ? 102 TYR B CE2 1 ATOM 2439 C CZ . TYR B 2 102 ? 34.793 -36.196 -0.209 1.00 27.29 ? 102 TYR B CZ 1 ATOM 2440 O OH . TYR B 2 102 ? 34.873 -34.857 0.098 1.00 28.85 ? 102 TYR B OH 1 ATOM 2441 N N . ASP B 2 103 ? 33.869 -38.991 -4.289 1.00 26.00 ? 103 ASP B N 1 ATOM 2442 C CA . ASP B 2 103 ? 32.823 -38.131 -4.837 1.00 22.61 ? 103 ASP B CA 1 ATOM 2443 C C . ASP B 2 103 ? 32.418 -38.499 -6.271 1.00 22.50 ? 103 ASP B C 1 ATOM 2444 O O . ASP B 2 103 ? 32.843 -39.523 -6.808 1.00 25.88 ? 103 ASP B O 1 ATOM 2445 C CB . ASP B 2 103 ? 33.267 -36.667 -4.740 1.00 21.29 ? 103 ASP B CB 1 ATOM 2446 C CG . ASP B 2 103 ? 32.118 -35.710 -4.453 1.00 23.24 ? 103 ASP B CG 1 ATOM 2447 O OD1 . ASP B 2 103 ? 30.970 -35.973 -4.875 1.00 28.51 ? 103 ASP B OD1 1 ATOM 2448 O OD2 . ASP B 2 103 ? 32.371 -34.672 -3.813 1.00 21.83 ? 103 ASP B OD2 1 ATOM 2449 N N . TYR B 2 104 ? 31.583 -37.659 -6.876 1.00 20.38 ? 104 TYR B N 1 ATOM 2450 C CA . TYR B 2 104 ? 30.960 -37.966 -8.158 1.00 20.00 ? 104 TYR B CA 1 ATOM 2451 C C . TYR B 2 104 ? 30.982 -36.754 -9.072 1.00 23.88 ? 104 TYR B C 1 ATOM 2452 O O . TYR B 2 104 ? 30.230 -36.695 -10.047 1.00 23.02 ? 104 TYR B O 1 ATOM 2453 C CB . TYR B 2 104 ? 29.502 -38.416 -7.975 1.00 17.15 ? 104 TYR B CB 1 ATOM 2454 C CG . TYR B 2 104 ? 29.315 -39.760 -7.291 1.00 25.73 ? 104 TYR B CG 1 ATOM 2455 C CD1 . TYR B 2 104 ? 29.554 -39.908 -5.931 1.00 23.76 ? 104 TYR B CD1 1 ATOM 2456 C CD2 . TYR B 2 104 ? 28.880 -40.874 -8.001 1.00 21.80 ? 104 TYR B CD2 1 ATOM 2457 C CE1 . TYR B 2 104 ? 29.376 -41.111 -5.300 1.00 18.74 ? 104 TYR B CE1 1 ATOM 2458 C CE2 . TYR B 2 104 ? 28.702 -42.094 -7.372 1.00 24.22 ? 104 TYR B CE2 1 ATOM 2459 C CZ . TYR B 2 104 ? 28.949 -42.204 -6.014 1.00 23.93 ? 104 TYR B CZ 1 ATOM 2460 O OH . TYR B 2 104 ? 28.781 -43.411 -5.357 1.00 25.50 ? 104 TYR B OH 1 ATOM 2461 N N . GLU B 2 105 ? 31.826 -35.778 -8.756 1.00 22.71 ? 105 GLU B N 1 ATOM 2462 C CA . GLU B 2 105 ? 31.956 -34.624 -9.635 1.00 21.91 ? 105 GLU B CA 1 ATOM 2463 C C . GLU B 2 105 ? 33.084 -34.887 -10.638 1.00 29.84 ? 105 GLU B C 1 ATOM 2464 O O . GLU B 2 105 ? 34.267 -34.891 -10.293 1.00 37.88 ? 105 GLU B O 1 ATOM 2465 C CB . GLU B 2 105 ? 32.086 -33.304 -8.847 1.00 26.78 ? 105 GLU B CB 1 ATOM 2466 C CG . GLU B 2 105 ? 33.454 -32.942 -8.275 1.00 33.20 ? 105 GLU B CG 1 ATOM 2467 C CD . GLU B 2 105 ? 33.770 -33.640 -6.973 1.00 33.85 ? 105 GLU B CD 1 ATOM 2468 O OE1 . GLU B 2 105 ? 33.981 -34.860 -7.000 1.00 32.65 ? 105 GLU B OE1 1 ATOM 2469 O OE2 . GLU B 2 105 ? 33.830 -32.960 -5.929 1.00 42.18 ? 105 GLU B OE2 1 ATOM 2470 N N . PHE B 2 106 ? 32.697 -35.158 -11.884 1.00 27.95 ? 106 PHE B N 1 ATOM 2471 C CA . PHE B 2 106 ? 33.611 -35.762 -12.848 1.00 20.39 ? 106 PHE B CA 1 ATOM 2472 C C . PHE B 2 106 ? 34.468 -34.753 -13.603 1.00 24.38 ? 106 PHE B C 1 ATOM 2473 O O . PHE B 2 106 ? 34.063 -34.206 -14.631 1.00 18.16 ? 106 PHE B O 1 ATOM 2474 C CB . PHE B 2 106 ? 32.851 -36.682 -13.798 1.00 19.69 ? 106 PHE B CB 1 ATOM 2475 C CG . PHE B 2 106 ? 32.002 -37.705 -13.089 1.00 23.06 ? 106 PHE B CG 1 ATOM 2476 C CD1 . PHE B 2 106 ? 32.573 -38.588 -12.186 1.00 24.24 ? 106 PHE B CD1 1 ATOM 2477 C CD2 . PHE B 2 106 ? 30.638 -37.782 -13.326 1.00 21.14 ? 106 PHE B CD2 1 ATOM 2478 C CE1 . PHE B 2 106 ? 31.802 -39.532 -11.529 1.00 29.01 ? 106 PHE B CE1 1 ATOM 2479 C CE2 . PHE B 2 106 ? 29.863 -38.715 -12.685 1.00 26.17 ? 106 PHE B CE2 1 ATOM 2480 C CZ . PHE B 2 106 ? 30.446 -39.594 -11.776 1.00 29.73 ? 106 PHE B CZ 1 ATOM 2481 N N . ALA B 2 107 ? 35.668 -34.532 -13.074 1.00 22.77 ? 107 ALA B N 1 ATOM 2482 C CA . ALA B 2 107 ? 36.590 -33.541 -13.606 1.00 25.62 ? 107 ALA B CA 1 ATOM 2483 C C . ALA B 2 107 ? 37.468 -34.111 -14.700 1.00 25.49 ? 107 ALA B C 1 ATOM 2484 O O . ALA B 2 107 ? 38.043 -33.368 -15.474 1.00 27.62 ? 107 ALA B O 1 ATOM 2485 C CB . ALA B 2 107 ? 37.453 -32.981 -12.490 1.00 28.28 ? 107 ALA B CB 1 ATOM 2486 N N . TYR B 2 108 ? 37.587 -35.432 -14.753 1.00 27.63 ? 108 TYR B N 1 ATOM 2487 C CA . TYR B 2 108 ? 38.450 -36.062 -15.746 1.00 24.26 ? 108 TYR B CA 1 ATOM 2488 C C . TYR B 2 108 ? 37.709 -37.148 -16.523 1.00 23.30 ? 108 TYR B C 1 ATOM 2489 O O . TYR B 2 108 ? 37.137 -38.072 -15.931 1.00 26.34 ? 108 TYR B O 1 ATOM 2490 C CB . TYR B 2 108 ? 39.701 -36.628 -15.072 1.00 19.68 ? 108 TYR B CB 1 ATOM 2491 C CG . TYR B 2 108 ? 40.414 -35.615 -14.220 1.00 22.08 ? 108 TYR B CG 1 ATOM 2492 C CD1 . TYR B 2 108 ? 41.279 -34.682 -14.788 1.00 27.08 ? 108 TYR B CD1 1 ATOM 2493 C CD2 . TYR B 2 108 ? 40.220 -35.579 -12.845 1.00 21.18 ? 108 TYR B CD2 1 ATOM 2494 C CE1 . TYR B 2 108 ? 41.932 -33.736 -14.004 1.00 28.57 ? 108 TYR B CE1 1 ATOM 2495 C CE2 . TYR B 2 108 ? 40.857 -34.638 -12.057 1.00 21.01 ? 108 TYR B CE2 1 ATOM 2496 C CZ . TYR B 2 108 ? 41.714 -33.719 -12.641 1.00 31.87 ? 108 TYR B CZ 1 ATOM 2497 O OH . TYR B 2 108 ? 42.348 -32.790 -11.853 1.00 39.03 ? 108 TYR B OH 1 ATOM 2498 N N . TRP B 2 109 ? 37.713 -37.026 -17.846 1.00 21.06 ? 109 TRP B N 1 ATOM 2499 C CA . TRP B 2 109 ? 37.010 -37.981 -18.708 1.00 22.62 ? 109 TRP B CA 1 ATOM 2500 C C . TRP B 2 109 ? 37.908 -38.673 -19.717 1.00 24.30 ? 109 TRP B C 1 ATOM 2501 O O . TRP B 2 109 ? 38.873 -38.085 -20.219 1.00 25.26 ? 109 TRP B O 1 ATOM 2502 C CB . TRP B 2 109 ? 35.905 -37.282 -19.485 1.00 16.84 ? 109 TRP B CB 1 ATOM 2503 C CG . TRP B 2 109 ? 34.806 -36.749 -18.627 1.00 21.68 ? 109 TRP B CG 1 ATOM 2504 C CD1 . TRP B 2 109 ? 34.865 -35.667 -17.805 1.00 21.48 ? 109 TRP B CD1 1 ATOM 2505 C CD2 . TRP B 2 109 ? 33.467 -37.250 -18.539 1.00 19.95 ? 109 TRP B CD2 1 ATOM 2506 N NE1 . TRP B 2 109 ? 33.651 -35.468 -17.196 1.00 23.25 ? 109 TRP B NE1 1 ATOM 2507 C CE2 . TRP B 2 109 ? 32.772 -36.423 -17.633 1.00 19.53 ? 109 TRP B CE2 1 ATOM 2508 C CE3 . TRP B 2 109 ? 32.788 -38.321 -19.137 1.00 20.07 ? 109 TRP B CE3 1 ATOM 2509 C CZ2 . TRP B 2 109 ? 31.435 -36.638 -17.297 1.00 17.46 ? 109 TRP B CZ2 1 ATOM 2510 C CZ3 . TRP B 2 109 ? 31.454 -38.529 -18.811 1.00 17.08 ? 109 TRP B CZ3 1 ATOM 2511 C CH2 . TRP B 2 109 ? 30.792 -37.690 -17.903 1.00 17.77 ? 109 TRP B CH2 1 ATOM 2512 N N . GLY B 2 110 ? 37.577 -39.925 -20.019 1.00 18.47 ? 110 GLY B N 1 ATOM 2513 C CA . GLY B 2 110 ? 38.171 -40.614 -21.154 1.00 16.92 ? 110 GLY B CA 1 ATOM 2514 C C . GLY B 2 110 ? 37.613 -40.028 -22.444 1.00 22.36 ? 110 GLY B C 1 ATOM 2515 O O . GLY B 2 110 ? 36.646 -39.248 -22.421 1.00 16.08 ? 110 GLY B O 1 ATOM 2516 N N . GLN B 2 111 ? 38.198 -40.401 -23.579 1.00 20.43 ? 111 GLN B N 1 ATOM 2517 C CA . GLN B 2 111 ? 37.824 -39.763 -24.844 1.00 20.42 ? 111 GLN B CA 1 ATOM 2518 C C . GLN B 2 111 ? 36.528 -40.329 -25.403 1.00 16.12 ? 111 GLN B C 1 ATOM 2519 O O . GLN B 2 111 ? 36.065 -39.904 -26.448 1.00 15.33 ? 111 GLN B O 1 ATOM 2520 C CB . GLN B 2 111 ? 38.959 -39.845 -25.880 1.00 13.04 ? 111 GLN B CB 1 ATOM 2521 C CG . GLN B 2 111 ? 39.015 -41.144 -26.668 1.00 13.77 ? 111 GLN B CG 1 ATOM 2522 C CD . GLN B 2 111 ? 39.731 -42.250 -25.937 1.00 20.77 ? 111 GLN B CD 1 ATOM 2523 O OE1 . GLN B 2 111 ? 39.876 -42.218 -24.711 1.00 26.12 ? 111 GLN B OE1 1 ATOM 2524 N NE2 . GLN B 2 111 ? 40.198 -43.241 -26.687 1.00 21.22 ? 111 GLN B NE2 1 ATOM 2525 N N . GLY B 2 112 ? 35.937 -41.279 -24.685 1.00 19.27 ? 112 GLY B N 1 ATOM 2526 C CA . GLY B 2 112 ? 34.702 -41.908 -25.118 1.00 16.03 ? 112 GLY B CA 1 ATOM 2527 C C . GLY B 2 112 ? 34.972 -43.046 -26.085 1.00 19.30 ? 112 GLY B C 1 ATOM 2528 O O . GLY B 2 112 ? 35.928 -42.996 -26.850 1.00 24.47 ? 112 GLY B O 1 ATOM 2529 N N . THR B 2 113 ? 34.137 -44.077 -26.039 1.00 21.17 ? 113 THR B N 1 ATOM 2530 C CA . THR B 2 113 ? 34.219 -45.183 -26.987 1.00 16.46 ? 113 THR B CA 1 ATOM 2531 C C . THR B 2 113 ? 32.857 -45.425 -27.623 1.00 20.49 ? 113 THR B C 1 ATOM 2532 O O . THR B 2 113 ? 31.911 -45.843 -26.947 1.00 25.85 ? 113 THR B O 1 ATOM 2533 C CB . THR B 2 113 ? 34.651 -46.492 -26.299 1.00 23.03 ? 113 THR B CB 1 ATOM 2534 O OG1 . THR B 2 113 ? 35.881 -46.294 -25.597 1.00 30.00 ? 113 THR B OG1 1 ATOM 2535 C CG2 . THR B 2 113 ? 34.833 -47.597 -27.328 1.00 24.03 ? 113 THR B CG2 1 ATOM 2536 N N . LEU B 2 114 ? 32.750 -45.165 -28.920 1.00 21.69 ? 114 LEU B N 1 ATOM 2537 C CA . LEU B 2 114 ? 31.486 -45.385 -29.625 1.00 16.44 ? 114 LEU B CA 1 ATOM 2538 C C . LEU B 2 114 ? 31.232 -46.863 -29.863 1.00 15.26 ? 114 LEU B C 1 ATOM 2539 O O . LEU B 2 114 ? 31.980 -47.541 -30.564 1.00 17.87 ? 114 LEU B O 1 ATOM 2540 C CB . LEU B 2 114 ? 31.427 -44.614 -30.949 1.00 18.71 ? 114 LEU B CB 1 ATOM 2541 C CG . LEU B 2 114 ? 30.151 -44.832 -31.783 1.00 25.99 ? 114 LEU B CG 1 ATOM 2542 C CD1 . LEU B 2 114 ? 28.911 -44.502 -30.969 1.00 25.22 ? 114 LEU B CD1 1 ATOM 2543 C CD2 . LEU B 2 114 ? 30.181 -43.992 -33.054 1.00 25.24 ? 114 LEU B CD2 1 ATOM 2544 N N . VAL B 2 115 ? 30.164 -47.363 -29.274 1.00 20.87 ? 115 VAL B N 1 ATOM 2545 C CA . VAL B 2 115 ? 29.833 -48.758 -29.442 1.00 25.79 ? 115 VAL B CA 1 ATOM 2546 C C . VAL B 2 115 ? 28.556 -48.882 -30.251 1.00 28.43 ? 115 VAL B C 1 ATOM 2547 O O . VAL B 2 115 ? 27.516 -48.347 -29.871 1.00 26.39 ? 115 VAL B O 1 ATOM 2548 C CB . VAL B 2 115 ? 29.696 -49.458 -28.087 1.00 26.80 ? 115 VAL B CB 1 ATOM 2549 C CG1 . VAL B 2 115 ? 29.277 -50.907 -28.273 1.00 28.60 ? 115 VAL B CG1 1 ATOM 2550 C CG2 . VAL B 2 115 ? 31.010 -49.372 -27.339 1.00 26.02 ? 115 VAL B CG2 1 ATOM 2551 N N . THR B 2 116 ? 28.651 -49.568 -31.385 1.00 29.02 ? 116 THR B N 1 ATOM 2552 C CA . THR B 2 116 ? 27.489 -49.808 -32.224 1.00 23.75 ? 116 THR B CA 1 ATOM 2553 C C . THR B 2 116 ? 27.025 -51.248 -32.028 1.00 24.09 ? 116 THR B C 1 ATOM 2554 O O . THR B 2 116 ? 27.792 -52.188 -32.217 1.00 25.24 ? 116 THR B O 1 ATOM 2555 C CB . THR B 2 116 ? 27.797 -49.533 -33.721 1.00 28.94 ? 116 THR B CB 1 ATOM 2556 O OG1 . THR B 2 116 ? 28.326 -48.207 -33.889 1.00 22.85 ? 116 THR B OG1 1 ATOM 2557 C CG2 . THR B 2 116 ? 26.535 -49.686 -34.575 1.00 27.27 ? 116 THR B CG2 1 ATOM 2558 N N . VAL B 2 117 ? 25.776 -51.422 -31.618 1.00 27.00 ? 117 VAL B N 1 ATOM 2559 C CA . VAL B 2 117 ? 25.224 -52.757 -31.502 1.00 23.40 ? 117 VAL B CA 1 ATOM 2560 C C . VAL B 2 117 ? 24.464 -53.090 -32.769 1.00 33.28 ? 117 VAL B C 1 ATOM 2561 O O . VAL B 2 117 ? 23.434 -52.485 -33.057 1.00 34.57 ? 117 VAL B O 1 ATOM 2562 C CB . VAL B 2 117 ? 24.263 -52.884 -30.325 1.00 30.32 ? 117 VAL B CB 1 ATOM 2563 C CG1 . VAL B 2 117 ? 23.685 -54.299 -30.288 1.00 26.36 ? 117 VAL B CG1 1 ATOM 2564 C CG2 . VAL B 2 117 ? 24.971 -52.551 -29.028 1.00 28.28 ? 117 VAL B CG2 1 ATOM 2565 N N . SER B 2 118 ? 24.971 -54.056 -33.526 1.00 35.06 ? 118 SER B N 1 ATOM 2566 C CA . SER B 2 118 ? 24.399 -54.369 -34.826 1.00 29.91 ? 118 SER B CA 1 ATOM 2567 C C . SER B 2 118 ? 24.802 -55.750 -35.294 1.00 31.29 ? 118 SER B C 1 ATOM 2568 O O . SER B 2 118 ? 25.854 -56.260 -34.923 1.00 41.14 ? 118 SER B O 1 ATOM 2569 C CB . SER B 2 118 ? 24.842 -53.341 -35.865 1.00 29.01 ? 118 SER B CB 1 ATOM 2570 O OG . SER B 2 118 ? 24.566 -53.806 -37.176 1.00 36.29 ? 118 SER B OG 1 ATOM 2571 N N . ALA B 2 119 ? 23.953 -56.348 -36.122 1.00 29.07 ? 119 ALA B N 1 ATOM 2572 C CA . ALA B 2 119 ? 24.203 -57.676 -36.651 1.00 34.93 ? 119 ALA B CA 1 ATOM 2573 C C . ALA B 2 119 ? 25.065 -57.612 -37.916 1.00 40.35 ? 119 ALA B C 1 ATOM 2574 O O . ALA B 2 119 ? 25.578 -58.627 -38.382 1.00 41.18 ? 119 ALA B O 1 ATOM 2575 C CB . ALA B 2 119 ? 22.890 -58.377 -36.927 1.00 33.98 ? 119 ALA B CB 1 ATOM 2576 N N . ALA B 2 120 ? 25.232 -56.407 -38.450 1.00 37.84 ? 120 ALA B N 1 ATOM 2577 C CA . ALA B 2 120 ? 25.972 -56.198 -39.688 1.00 35.45 ? 120 ALA B CA 1 ATOM 2578 C C . ALA B 2 120 ? 27.454 -56.519 -39.569 1.00 36.70 ? 120 ALA B C 1 ATOM 2579 O O . ALA B 2 120 ? 27.932 -56.946 -38.522 1.00 43.42 ? 120 ALA B O 1 ATOM 2580 C CB . ALA B 2 120 ? 25.793 -54.764 -40.172 1.00 34.90 ? 120 ALA B CB 1 ATOM 2581 N N . SER B 2 121 ? 28.173 -56.288 -40.660 1.00 31.21 ? 121 SER B N 1 ATOM 2582 C CA . SER B 2 121 ? 29.598 -56.571 -40.739 1.00 31.60 ? 121 SER B CA 1 ATOM 2583 C C . SER B 2 121 ? 30.395 -55.283 -40.741 1.00 32.17 ? 121 SER B C 1 ATOM 2584 O O . SER B 2 121 ? 29.933 -54.255 -41.241 1.00 31.22 ? 121 SER B O 1 ATOM 2585 C CB . SER B 2 121 ? 29.913 -57.335 -42.020 1.00 25.85 ? 121 SER B CB 1 ATOM 2586 O OG . SER B 2 121 ? 29.071 -58.465 -42.142 1.00 43.87 ? 121 SER B OG 1 ATOM 2587 N N . THR B 2 122 ? 31.600 -55.346 -40.190 1.00 29.96 ? 122 THR B N 1 ATOM 2588 C CA . THR B 2 122 ? 32.513 -54.222 -40.272 1.00 29.35 ? 122 THR B CA 1 ATOM 2589 C C . THR B 2 122 ? 33.007 -54.111 -41.705 1.00 30.21 ? 122 THR B C 1 ATOM 2590 O O . THR B 2 122 ? 33.323 -55.117 -42.334 1.00 36.88 ? 122 THR B O 1 ATOM 2591 C CB . THR B 2 122 ? 33.699 -54.391 -39.311 1.00 32.72 ? 122 THR B CB 1 ATOM 2592 O OG1 . THR B 2 122 ? 33.205 -54.572 -37.976 1.00 39.11 ? 122 THR B OG1 1 ATOM 2593 C CG2 . THR B 2 122 ? 34.562 -53.158 -39.331 1.00 32.99 ? 122 THR B CG2 1 ATOM 2594 N N . LYS B 2 123 ? 33.028 -52.892 -42.232 1.00 28.99 ? 123 LYS B N 1 ATOM 2595 C CA . LYS B 2 123 ? 33.515 -52.649 -43.581 1.00 29.35 ? 123 LYS B CA 1 ATOM 2596 C C . LYS B 2 123 ? 34.304 -51.350 -43.651 1.00 28.60 ? 123 LYS B C 1 ATOM 2597 O O . LYS B 2 123 ? 33.808 -50.292 -43.258 1.00 27.83 ? 123 LYS B O 1 ATOM 2598 C CB . LYS B 2 123 ? 32.360 -52.591 -44.579 1.00 29.69 ? 123 LYS B CB 1 ATOM 2599 C CG . LYS B 2 123 ? 32.837 -52.551 -46.022 1.00 30.15 ? 123 LYS B CG 1 ATOM 2600 C CD . LYS B 2 123 ? 31.696 -52.441 -47.020 1.00 38.53 ? 123 LYS B CD 1 ATOM 2601 C CE . LYS B 2 123 ? 32.233 -52.231 -48.442 1.00 40.21 ? 123 LYS B CE 1 ATOM 2602 N NZ . LYS B 2 123 ? 33.188 -51.070 -48.528 1.00 37.83 ? 123 LYS B NZ 1 ATOM 2603 N N . GLY B 2 124 ? 35.531 -51.427 -44.153 1.00 24.64 ? 124 GLY B N 1 ATOM 2604 C CA . GLY B 2 124 ? 36.373 -50.247 -44.266 1.00 22.50 ? 124 GLY B CA 1 ATOM 2605 C C . GLY B 2 124 ? 35.944 -49.355 -45.423 1.00 23.51 ? 124 GLY B C 1 ATOM 2606 O O . GLY B 2 124 ? 35.317 -49.812 -46.376 1.00 27.07 ? 124 GLY B O 1 ATOM 2607 N N . PRO B 2 125 ? 36.294 -48.078 -45.355 1.00 19.14 ? 125 PRO B N 1 ATOM 2608 C CA . PRO B 2 125 ? 35.905 -47.138 -46.405 1.00 24.83 ? 125 PRO B CA 1 ATOM 2609 C C . PRO B 2 125 ? 36.870 -47.145 -47.585 1.00 26.00 ? 125 PRO B C 1 ATOM 2610 O O . PRO B 2 125 ? 38.036 -47.536 -47.480 1.00 18.45 ? 125 PRO B O 1 ATOM 2611 C CB . PRO B 2 125 ? 35.957 -45.791 -45.682 1.00 22.11 ? 125 PRO B CB 1 ATOM 2612 C CG . PRO B 2 125 ? 37.114 -45.973 -44.732 1.00 17.68 ? 125 PRO B CG 1 ATOM 2613 C CD . PRO B 2 125 ? 37.055 -47.419 -44.280 1.00 16.78 ? 125 PRO B CD 1 ATOM 2614 N N . SER B 2 126 ? 36.344 -46.707 -48.727 1.00 22.93 ? 126 SER B N 1 ATOM 2615 C CA . SER B 2 126 ? 37.154 -46.235 -49.837 1.00 19.69 ? 126 SER B CA 1 ATOM 2616 C C . SER B 2 126 ? 37.315 -44.727 -49.706 1.00 20.95 ? 126 SER B C 1 ATOM 2617 O O . SER B 2 126 ? 36.383 -44.030 -49.291 1.00 19.31 ? 126 SER B O 1 ATOM 2618 C CB . SER B 2 126 ? 36.498 -46.577 -51.176 1.00 23.85 ? 126 SER B CB 1 ATOM 2619 O OG . SER B 2 126 ? 36.330 -47.975 -51.327 1.00 25.76 ? 126 SER B OG 1 ATOM 2620 N N . VAL B 2 127 ? 38.496 -44.219 -50.052 1.00 13.20 ? 127 VAL B N 1 ATOM 2621 C CA . VAL B 2 127 ? 38.747 -42.789 -49.994 1.00 11.00 ? 127 VAL B CA 1 ATOM 2622 C C . VAL B 2 127 ? 38.947 -42.237 -51.403 1.00 17.66 ? 127 VAL B C 1 ATOM 2623 O O . VAL B 2 127 ? 39.800 -42.715 -52.138 1.00 16.54 ? 127 VAL B O 1 ATOM 2624 C CB . VAL B 2 127 ? 39.979 -42.471 -49.118 1.00 19.97 ? 127 VAL B CB 1 ATOM 2625 C CG1 . VAL B 2 127 ? 40.123 -40.967 -48.934 1.00 18.00 ? 127 VAL B CG1 1 ATOM 2626 C CG2 . VAL B 2 127 ? 39.858 -43.165 -47.751 1.00 15.66 ? 127 VAL B CG2 1 ATOM 2627 N N . PHE B 2 128 ? 38.145 -41.246 -51.787 1.00 20.96 ? 128 PHE B N 1 ATOM 2628 C CA . PHE B 2 128 ? 38.250 -40.644 -53.118 1.00 21.73 ? 128 PHE B CA 1 ATOM 2629 C C . PHE B 2 128 ? 38.588 -39.148 -53.058 1.00 22.02 ? 128 PHE B C 1 ATOM 2630 O O . PHE B 2 128 ? 38.068 -38.413 -52.212 1.00 17.68 ? 128 PHE B O 1 ATOM 2631 C CB . PHE B 2 128 ? 36.961 -40.867 -53.918 1.00 13.85 ? 128 PHE B CB 1 ATOM 2632 C CG . PHE B 2 128 ? 36.594 -42.318 -54.080 1.00 13.79 ? 128 PHE B CG 1 ATOM 2633 C CD1 . PHE B 2 128 ? 37.429 -43.185 -54.784 1.00 11.02 ? 128 PHE B CD1 1 ATOM 2634 C CD2 . PHE B 2 128 ? 35.422 -42.817 -53.530 1.00 11.40 ? 128 PHE B CD2 1 ATOM 2635 C CE1 . PHE B 2 128 ? 37.095 -44.539 -54.934 1.00 13.16 ? 128 PHE B CE1 1 ATOM 2636 C CE2 . PHE B 2 128 ? 35.077 -44.166 -53.668 1.00 15.43 ? 128 PHE B CE2 1 ATOM 2637 C CZ . PHE B 2 128 ? 35.906 -45.027 -54.364 1.00 13.32 ? 128 PHE B CZ 1 ATOM 2638 N N . PRO B 2 129 ? 39.457 -38.688 -53.965 1.00 15.53 ? 129 PRO B N 1 ATOM 2639 C CA . PRO B 2 129 ? 39.845 -37.281 -53.917 1.00 10.47 ? 129 PRO B CA 1 ATOM 2640 C C . PRO B 2 129 ? 38.710 -36.376 -54.362 1.00 17.37 ? 129 PRO B C 1 ATOM 2641 O O . PRO B 2 129 ? 38.005 -36.697 -55.315 1.00 13.90 ? 129 PRO B O 1 ATOM 2642 C CB . PRO B 2 129 ? 40.996 -37.208 -54.923 1.00 10.49 ? 129 PRO B CB 1 ATOM 2643 C CG . PRO B 2 129 ? 40.649 -38.259 -55.926 1.00 11.75 ? 129 PRO B CG 1 ATOM 2644 C CD . PRO B 2 129 ? 40.072 -39.389 -55.105 1.00 16.20 ? 129 PRO B CD 1 ATOM 2645 N N . LEU B 2 130 ? 38.527 -35.269 -53.649 1.00 16.34 ? 130 LEU B N 1 ATOM 2646 C CA . LEU B 2 130 ? 37.713 -34.164 -54.130 1.00 20.92 ? 130 LEU B CA 1 ATOM 2647 C C . LEU B 2 130 ? 38.696 -33.113 -54.638 1.00 14.61 ? 130 LEU B C 1 ATOM 2648 O O . LEU B 2 130 ? 39.136 -32.237 -53.894 1.00 15.88 ? 130 LEU B O 1 ATOM 2649 C CB . LEU B 2 130 ? 36.813 -33.615 -53.015 1.00 19.48 ? 130 LEU B CB 1 ATOM 2650 C CG . LEU B 2 130 ? 35.775 -34.619 -52.491 1.00 20.28 ? 130 LEU B CG 1 ATOM 2651 C CD1 . LEU B 2 130 ? 35.078 -34.084 -51.238 1.00 15.37 ? 130 LEU B CD1 1 ATOM 2652 C CD2 . LEU B 2 130 ? 34.739 -34.967 -53.581 1.00 18.21 ? 130 LEU B CD2 1 ATOM 2653 N N . ALA B 2 131 ? 39.060 -33.235 -55.906 1.00 19.35 ? 131 ALA B N 1 ATOM 2654 C CA . ALA B 2 131 ? 40.141 -32.447 -56.476 1.00 24.34 ? 131 ALA B CA 1 ATOM 2655 C C . ALA B 2 131 ? 39.776 -30.980 -56.688 1.00 27.83 ? 131 ALA B C 1 ATOM 2656 O O . ALA B 2 131 ? 38.678 -30.666 -57.156 1.00 35.21 ? 131 ALA B O 1 ATOM 2657 C CB . ALA B 2 131 ? 40.590 -33.067 -57.787 1.00 22.33 ? 131 ALA B CB 1 ATOM 2658 N N . PRO B 2 132 ? 40.715 -30.077 -56.374 1.00 25.66 ? 132 PRO B N 1 ATOM 2659 C CA . PRO B 2 132 ? 40.522 -28.649 -56.652 1.00 24.44 ? 132 PRO B CA 1 ATOM 2660 C C . PRO B 2 132 ? 40.630 -28.386 -58.137 1.00 27.27 ? 132 PRO B C 1 ATOM 2661 O O . PRO B 2 132 ? 41.397 -29.067 -58.815 1.00 35.76 ? 132 PRO B O 1 ATOM 2662 C CB . PRO B 2 132 ? 41.710 -27.992 -55.940 1.00 24.25 ? 132 PRO B CB 1 ATOM 2663 C CG . PRO B 2 132 ? 42.769 -29.028 -55.949 1.00 30.80 ? 132 PRO B CG 1 ATOM 2664 C CD . PRO B 2 132 ? 42.051 -30.358 -55.816 1.00 21.82 ? 132 PRO B CD 1 ATOM 2665 N N . SER B 2 133 ? 39.872 -27.421 -58.641 1.00 35.34 ? 133 SER B N 1 ATOM 2666 C CA . SER B 2 133 ? 40.043 -26.961 -60.021 1.00 51.44 ? 133 SER B CA 1 ATOM 2667 C C . SER B 2 133 ? 39.739 -25.471 -60.095 1.00 56.97 ? 133 SER B C 1 ATOM 2668 O O . SER B 2 133 ? 39.894 -24.765 -59.107 1.00 56.76 ? 133 SER B O 1 ATOM 2669 C CB . SER B 2 133 ? 39.122 -27.723 -60.966 1.00 54.55 ? 133 SER B CB 1 ATOM 2670 O OG . SER B 2 133 ? 37.797 -27.251 -60.839 1.00 57.66 ? 133 SER B OG 1 ATOM 2671 N N . SER B 2 134 ? 39.307 -24.996 -61.259 1.00 61.77 ? 134 SER B N 1 ATOM 2672 C CA . SER B 2 134 ? 38.806 -23.625 -61.380 1.00 64.88 ? 134 SER B CA 1 ATOM 2673 C C . SER B 2 134 ? 37.339 -23.525 -60.939 1.00 72.65 ? 134 SER B C 1 ATOM 2674 O O . SER B 2 134 ? 36.875 -22.454 -60.544 1.00 73.52 ? 134 SER B O 1 ATOM 2675 C CB . SER B 2 134 ? 38.979 -23.103 -62.801 1.00 60.60 ? 134 SER B CB 1 ATOM 2676 O OG . SER B 2 134 ? 40.352 -22.940 -63.095 1.00 61.74 ? 134 SER B OG 1 ATOM 2677 N N . LYS B 2 135 ? 36.622 -24.650 -60.995 1.00 78.46 ? 135 LYS B N 1 ATOM 2678 C CA . LYS B 2 135 ? 35.240 -24.734 -60.504 1.00 79.76 ? 135 LYS B CA 1 ATOM 2679 C C . LYS B 2 135 ? 35.210 -24.971 -58.990 1.00 77.36 ? 135 LYS B C 1 ATOM 2680 O O . LYS B 2 135 ? 34.150 -25.239 -58.395 1.00 68.99 ? 135 LYS B O 1 ATOM 2681 C CB . LYS B 2 135 ? 34.460 -25.828 -61.238 1.00 73.01 ? 135 LYS B CB 1 ATOM 2682 C CG . LYS B 2 135 ? 34.262 -25.545 -62.713 1.00 74.07 ? 135 LYS B CG 1 ATOM 2683 C CD . LYS B 2 135 ? 33.830 -26.788 -63.451 1.00 74.05 ? 135 LYS B CD 1 ATOM 2684 C CE . LYS B 2 135 ? 33.980 -26.631 -64.963 1.00 81.41 ? 135 LYS B CE 1 ATOM 2685 N NZ . LYS B 2 135 ? 35.270 -27.191 -65.466 1.00 81.30 ? 135 LYS B NZ 1 ATOM 2686 N N . SER B 2 136 ? 36.394 -24.873 -58.385 1.00 74.57 ? 136 SER B N 1 ATOM 2687 C CA . SER B 2 136 ? 36.534 -24.867 -56.935 1.00 69.12 ? 136 SER B CA 1 ATOM 2688 C C . SER B 2 136 ? 37.633 -23.889 -56.462 1.00 72.11 ? 136 SER B C 1 ATOM 2689 O O . SER B 2 136 ? 38.211 -24.074 -55.385 1.00 66.48 ? 136 SER B O 1 ATOM 2690 C CB . SER B 2 136 ? 36.728 -26.296 -56.378 1.00 51.87 ? 136 SER B CB 1 ATOM 2691 O OG . SER B 2 136 ? 38.083 -26.603 -56.103 1.00 38.51 ? 136 SER B OG 1 ATOM 2692 N N . THR B 2 137 ? 37.895 -22.850 -57.268 1.00 76.35 ? 137 THR B N 1 ATOM 2693 C CA . THR B 2 137 ? 38.876 -21.795 -56.935 1.00 81.25 ? 137 THR B CA 1 ATOM 2694 C C . THR B 2 137 ? 38.368 -20.380 -57.238 1.00 86.78 ? 137 THR B C 1 ATOM 2695 O O . THR B 2 137 ? 38.341 -19.956 -58.402 1.00 92.06 ? 137 THR B O 1 ATOM 2696 C CB . THR B 2 137 ? 40.239 -21.966 -57.682 1.00 75.49 ? 137 THR B CB 1 ATOM 2697 O OG1 . THR B 2 137 ? 40.878 -23.189 -57.284 1.00 70.07 ? 137 THR B OG1 1 ATOM 2698 C CG2 . THR B 2 137 ? 41.179 -20.776 -57.386 1.00 71.39 ? 137 THR B CG2 1 ATOM 2699 N N . SER B 2 138 ? 37.989 -19.645 -56.193 1.00 82.88 ? 138 SER B N 1 ATOM 2700 C CA . SER B 2 138 ? 37.533 -18.264 -56.361 1.00 84.98 ? 138 SER B CA 1 ATOM 2701 C C . SER B 2 138 ? 38.268 -17.275 -55.451 1.00 74.74 ? 138 SER B C 1 ATOM 2702 O O . SER B 2 138 ? 38.387 -17.495 -54.244 1.00 68.96 ? 138 SER B O 1 ATOM 2703 C CB . SER B 2 138 ? 36.016 -18.155 -56.155 1.00 88.26 ? 138 SER B CB 1 ATOM 2704 O OG . SER B 2 138 ? 35.540 -16.884 -56.574 1.00 91.73 ? 138 SER B OG 1 ATOM 2705 N N . GLY B 2 139 ? 38.752 -16.186 -56.046 1.00 69.70 ? 139 GLY B N 1 ATOM 2706 C CA . GLY B 2 139 ? 39.457 -15.153 -55.309 1.00 63.17 ? 139 GLY B CA 1 ATOM 2707 C C . GLY B 2 139 ? 40.730 -15.662 -54.655 1.00 55.23 ? 139 GLY B C 1 ATOM 2708 O O . GLY B 2 139 ? 41.045 -15.295 -53.517 1.00 54.88 ? 139 GLY B O 1 ATOM 2709 N N . GLY B 2 140 ? 41.458 -16.516 -55.371 1.00 46.46 ? 140 GLY B N 1 ATOM 2710 C CA . GLY B 2 140 ? 42.702 -17.066 -54.860 1.00 41.13 ? 140 GLY B CA 1 ATOM 2711 C C . GLY B 2 140 ? 42.568 -18.213 -53.865 1.00 41.02 ? 140 GLY B C 1 ATOM 2712 O O . GLY B 2 140 ? 43.569 -18.795 -53.460 1.00 43.79 ? 140 GLY B O 1 ATOM 2713 N N . THR B 2 141 ? 41.345 -18.551 -53.472 1.00 35.14 ? 141 THR B N 1 ATOM 2714 C CA . THR B 2 141 ? 41.135 -19.634 -52.519 1.00 32.90 ? 141 THR B CA 1 ATOM 2715 C C . THR B 2 141 ? 40.614 -20.902 -53.187 1.00 30.08 ? 141 THR B C 1 ATOM 2716 O O . THR B 2 141 ? 39.600 -20.877 -53.873 1.00 31.34 ? 141 THR B O 1 ATOM 2717 C CB . THR B 2 141 ? 40.162 -19.212 -51.408 1.00 32.24 ? 141 THR B CB 1 ATOM 2718 O OG1 . THR B 2 141 ? 40.792 -18.217 -50.591 1.00 31.05 ? 141 THR B OG1 1 ATOM 2719 C CG2 . THR B 2 141 ? 39.777 -20.417 -50.546 1.00 26.99 ? 141 THR B CG2 1 ATOM 2720 N N . ALA B 2 142 ? 41.309 -22.011 -52.982 1.00 27.84 ? 142 ALA B N 1 ATOM 2721 C CA . ALA B 2 142 ? 40.878 -23.288 -53.544 1.00 26.65 ? 142 ALA B CA 1 ATOM 2722 C C . ALA B 2 142 ? 40.259 -24.194 -52.479 1.00 23.70 ? 142 ALA B C 1 ATOM 2723 O O . ALA B 2 142 ? 40.730 -24.258 -51.341 1.00 29.65 ? 142 ALA B O 1 ATOM 2724 C CB . ALA B 2 142 ? 42.048 -23.999 -54.232 1.00 26.80 ? 142 ALA B CB 1 ATOM 2725 N N . ALA B 2 143 ? 39.197 -24.894 -52.849 1.00 23.32 ? 143 ALA B N 1 ATOM 2726 C CA . ALA B 2 143 ? 38.636 -25.913 -51.972 1.00 20.90 ? 143 ALA B CA 1 ATOM 2727 C C . ALA B 2 143 ? 39.029 -27.304 -52.463 1.00 19.87 ? 143 ALA B C 1 ATOM 2728 O O . ALA B 2 143 ? 39.017 -27.579 -53.655 1.00 26.35 ? 143 ALA B O 1 ATOM 2729 C CB . ALA B 2 143 ? 37.141 -25.776 -51.897 1.00 21.31 ? 143 ALA B CB 1 ATOM 2730 N N . LEU B 2 144 ? 39.388 -28.181 -51.541 1.00 17.86 ? 144 LEU B N 1 ATOM 2731 C CA . LEU B 2 144 ? 39.696 -29.557 -51.901 1.00 17.07 ? 144 LEU B CA 1 ATOM 2732 C C . LEU B 2 144 ? 39.292 -30.454 -50.745 1.00 21.79 ? 144 LEU B C 1 ATOM 2733 O O . LEU B 2 144 ? 39.082 -29.978 -49.631 1.00 20.07 ? 144 LEU B O 1 ATOM 2734 C CB . LEU B 2 144 ? 41.178 -29.722 -52.259 1.00 18.10 ? 144 LEU B CB 1 ATOM 2735 C CG . LEU B 2 144 ? 42.238 -29.435 -51.189 1.00 21.44 ? 144 LEU B CG 1 ATOM 2736 C CD1 . LEU B 2 144 ? 42.497 -30.656 -50.321 1.00 18.64 ? 144 LEU B CD1 1 ATOM 2737 C CD2 . LEU B 2 144 ? 43.535 -28.981 -51.825 1.00 26.16 ? 144 LEU B CD2 1 ATOM 2738 N N . GLY B 2 145 ? 39.175 -31.750 -51.003 1.00 18.99 ? 145 GLY B N 1 ATOM 2739 C CA . GLY B 2 145 ? 38.718 -32.652 -49.966 1.00 19.15 ? 145 GLY B CA 1 ATOM 2740 C C . GLY B 2 145 ? 38.871 -34.128 -50.274 1.00 19.43 ? 145 GLY B C 1 ATOM 2741 O O . GLY B 2 145 ? 39.498 -34.518 -51.266 1.00 17.63 ? 145 GLY B O 1 ATOM 2742 N N . CYS B 2 146 ? 38.283 -34.939 -49.398 1.00 16.37 ? 146 CYS B N 1 ATOM 2743 C CA . CYS B 2 146 ? 38.281 -36.396 -49.507 1.00 17.85 ? 146 CYS B CA 1 ATOM 2744 C C . CYS B 2 146 ? 36.884 -36.923 -49.272 1.00 20.32 ? 146 CYS B C 1 ATOM 2745 O O . CYS B 2 146 ? 36.193 -36.515 -48.328 1.00 18.76 ? 146 CYS B O 1 ATOM 2746 C CB . CYS B 2 146 ? 39.214 -37.016 -48.466 1.00 19.07 ? 146 CYS B CB 1 ATOM 2747 S SG . CYS B 2 146 ? 40.948 -36.949 -48.953 1.00 26.70 ? 146 CYS B SG 1 ATOM 2748 N N . LEU B 2 147 ? 36.460 -37.827 -50.139 1.00 19.09 ? 147 LEU B N 1 ATOM 2749 C CA . LEU B 2 147 ? 35.196 -38.504 -49.945 1.00 17.24 ? 147 LEU B CA 1 ATOM 2750 C C . LEU B 2 147 ? 35.506 -39.834 -49.280 1.00 19.94 ? 147 LEU B C 1 ATOM 2751 O O . LEU B 2 147 ? 36.197 -40.677 -49.849 1.00 23.21 ? 147 LEU B O 1 ATOM 2752 C CB . LEU B 2 147 ? 34.497 -38.712 -51.287 1.00 17.41 ? 147 LEU B CB 1 ATOM 2753 C CG . LEU B 2 147 ? 33.188 -39.504 -51.245 1.00 21.40 ? 147 LEU B CG 1 ATOM 2754 C CD1 . LEU B 2 147 ? 32.140 -38.762 -50.439 1.00 21.43 ? 147 LEU B CD1 1 ATOM 2755 C CD2 . LEU B 2 147 ? 32.682 -39.805 -52.653 1.00 21.74 ? 147 LEU B CD2 1 ATOM 2756 N N . VAL B 2 148 ? 35.030 -40.005 -48.056 1.00 25.52 ? 148 VAL B N 1 ATOM 2757 C CA . VAL B 2 148 ? 35.248 -41.238 -47.328 1.00 14.38 ? 148 VAL B CA 1 ATOM 2758 C C . VAL B 2 148 ? 33.965 -42.051 -47.368 1.00 21.19 ? 148 VAL B C 1 ATOM 2759 O O . VAL B 2 148 ? 33.008 -41.740 -46.672 1.00 24.84 ? 148 VAL B O 1 ATOM 2760 C CB . VAL B 2 148 ? 35.675 -40.935 -45.896 1.00 22.27 ? 148 VAL B CB 1 ATOM 2761 C CG1 . VAL B 2 148 ? 35.942 -42.226 -45.115 1.00 20.58 ? 148 VAL B CG1 1 ATOM 2762 C CG2 . VAL B 2 148 ? 36.911 -40.035 -45.922 1.00 14.93 ? 148 VAL B CG2 1 ATOM 2763 N N . LYS B 2 149 ? 33.929 -43.118 -48.173 1.00 20.22 ? 149 LYS B N 1 ATOM 2764 C CA . LYS B 2 149 ? 32.664 -43.705 -48.603 1.00 17.35 ? 149 LYS B CA 1 ATOM 2765 C C . LYS B 2 149 ? 32.532 -45.183 -48.240 1.00 20.55 ? 149 LYS B C 1 ATOM 2766 O O . LYS B 2 149 ? 33.496 -45.951 -48.324 1.00 22.00 ? 149 LYS B O 1 ATOM 2767 C CB . LYS B 2 149 ? 32.487 -43.530 -50.115 1.00 17.61 ? 149 LYS B CB 1 ATOM 2768 C CG . LYS B 2 149 ? 31.064 -43.755 -50.604 1.00 23.10 ? 149 LYS B CG 1 ATOM 2769 C CD . LYS B 2 149 ? 30.936 -43.431 -52.075 1.00 24.90 ? 149 LYS B CD 1 ATOM 2770 C CE . LYS B 2 149 ? 29.497 -43.546 -52.526 1.00 26.81 ? 149 LYS B CE 1 ATOM 2771 N NZ . LYS B 2 149 ? 28.957 -44.894 -52.250 1.00 28.24 ? 149 LYS B NZ 1 ATOM 2772 N N . ASP B 2 150 ? 31.314 -45.561 -47.837 1.00 22.57 ? 150 ASP B N 1 ATOM 2773 C CA . ASP B 2 150 ? 30.879 -46.950 -47.679 1.00 24.58 ? 150 ASP B CA 1 ATOM 2774 C C . ASP B 2 150 ? 31.544 -47.715 -46.529 1.00 22.79 ? 150 ASP B C 1 ATOM 2775 O O . ASP B 2 150 ? 32.047 -48.818 -46.723 1.00 24.01 ? 150 ASP B O 1 ATOM 2776 C CB . ASP B 2 150 ? 31.022 -47.726 -49.003 1.00 26.64 ? 150 ASP B CB 1 ATOM 2777 C CG . ASP B 2 150 ? 30.022 -47.271 -50.064 1.00 30.43 ? 150 ASP B CG 1 ATOM 2778 O OD1 . ASP B 2 150 ? 29.031 -46.610 -49.708 1.00 28.04 ? 150 ASP B OD1 1 ATOM 2779 O OD2 . ASP B 2 150 ? 30.217 -47.583 -51.253 1.00 39.37 ? 150 ASP B OD2 1 ATOM 2780 N N . TYR B 2 151 ? 31.536 -47.140 -45.331 1.00 22.52 ? 151 TYR B N 1 ATOM 2781 C CA . TYR B 2 151 ? 32.096 -47.837 -44.176 1.00 26.40 ? 151 TYR B CA 1 ATOM 2782 C C . TYR B 2 151 ? 31.037 -48.136 -43.129 1.00 33.20 ? 151 TYR B C 1 ATOM 2783 O O . TYR B 2 151 ? 29.952 -47.551 -43.140 1.00 30.01 ? 151 TYR B O 1 ATOM 2784 C CB . TYR B 2 151 ? 33.241 -47.046 -43.544 1.00 22.43 ? 151 TYR B CB 1 ATOM 2785 C CG . TYR B 2 151 ? 32.823 -45.708 -42.995 1.00 25.28 ? 151 TYR B CG 1 ATOM 2786 C CD1 . TYR B 2 151 ? 32.775 -44.585 -43.815 1.00 19.29 ? 151 TYR B CD1 1 ATOM 2787 C CD2 . TYR B 2 151 ? 32.481 -45.558 -41.656 1.00 22.01 ? 151 TYR B CD2 1 ATOM 2788 C CE1 . TYR B 2 151 ? 32.396 -43.351 -43.320 1.00 26.30 ? 151 TYR B CE1 1 ATOM 2789 C CE2 . TYR B 2 151 ? 32.108 -44.326 -41.148 1.00 21.01 ? 151 TYR B CE2 1 ATOM 2790 C CZ . TYR B 2 151 ? 32.062 -43.222 -41.986 1.00 30.50 ? 151 TYR B CZ 1 ATOM 2791 O OH . TYR B 2 151 ? 31.680 -41.985 -41.495 1.00 26.40 ? 151 TYR B OH 1 ATOM 2792 N N . PHE B 2 152 ? 31.371 -49.050 -42.224 1.00 25.72 ? 152 PHE B N 1 ATOM 2793 C CA . PHE B 2 152 ? 30.510 -49.373 -41.100 1.00 23.12 ? 152 PHE B CA 1 ATOM 2794 C C . PHE B 2 152 ? 31.324 -50.101 -40.031 1.00 25.85 ? 152 PHE B C 1 ATOM 2795 O O . PHE B 2 152 ? 32.136 -50.976 -40.349 1.00 28.14 ? 152 PHE B O 1 ATOM 2796 C CB . PHE B 2 152 ? 29.341 -50.242 -41.558 1.00 18.35 ? 152 PHE B CB 1 ATOM 2797 C CG . PHE B 2 152 ? 28.296 -50.446 -40.510 1.00 17.87 ? 152 PHE B CG 1 ATOM 2798 C CD1 . PHE B 2 152 ? 28.362 -51.527 -39.648 1.00 18.30 ? 152 PHE B CD1 1 ATOM 2799 C CD2 . PHE B 2 152 ? 27.243 -49.551 -40.380 1.00 23.90 ? 152 PHE B CD2 1 ATOM 2800 C CE1 . PHE B 2 152 ? 27.389 -51.722 -38.673 1.00 21.43 ? 152 PHE B CE1 1 ATOM 2801 C CE2 . PHE B 2 152 ? 26.262 -49.733 -39.408 1.00 26.56 ? 152 PHE B CE2 1 ATOM 2802 C CZ . PHE B 2 152 ? 26.333 -50.826 -38.554 1.00 23.51 ? 152 PHE B CZ 1 ATOM 2803 N N . PRO B 2 153 ? 31.113 -49.743 -38.757 1.00 19.01 ? 153 PRO B N 1 ATOM 2804 C CA . PRO B 2 153 ? 30.193 -48.688 -38.336 1.00 21.85 ? 153 PRO B CA 1 ATOM 2805 C C . PRO B 2 153 ? 30.951 -47.379 -38.203 1.00 18.53 ? 153 PRO B C 1 ATOM 2806 O O . PRO B 2 153 ? 32.112 -47.312 -38.618 1.00 16.98 ? 153 PRO B O 1 ATOM 2807 C CB . PRO B 2 153 ? 29.771 -49.161 -36.950 1.00 21.04 ? 153 PRO B CB 1 ATOM 2808 C CG . PRO B 2 153 ? 31.050 -49.766 -36.397 1.00 21.14 ? 153 PRO B CG 1 ATOM 2809 C CD . PRO B 2 153 ? 31.767 -50.382 -37.601 1.00 19.30 ? 153 PRO B CD 1 ATOM 2810 N N . GLU B 2 154 ? 30.294 -46.363 -37.646 1.00 17.60 ? 154 GLU B N 1 ATOM 2811 C CA . GLU B 2 154 ? 30.961 -45.144 -37.182 1.00 17.63 ? 154 GLU B CA 1 ATOM 2812 C C . GLU B 2 154 ? 31.901 -45.555 -36.047 1.00 22.95 ? 154 GLU B C 1 ATOM 2813 O O . GLU B 2 154 ? 31.668 -46.576 -35.403 1.00 25.31 ? 154 GLU B O 1 ATOM 2814 C CB . GLU B 2 154 ? 29.912 -44.137 -36.678 1.00 19.72 ? 154 GLU B CB 1 ATOM 2815 C CG . GLU B 2 154 ? 29.213 -43.317 -37.768 1.00 23.36 ? 154 GLU B CG 1 ATOM 2816 C CD . GLU B 2 154 ? 29.825 -41.916 -37.937 1.00 35.62 ? 154 GLU B CD 1 ATOM 2817 O OE1 . GLU B 2 154 ? 29.178 -40.938 -37.496 1.00 40.70 ? 154 GLU B OE1 1 ATOM 2818 O OE2 . GLU B 2 154 ? 30.946 -41.784 -38.506 1.00 33.13 ? 154 GLU B OE2 1 ATOM 2819 N N . PRO B 2 155 ? 32.958 -44.768 -35.777 1.00 27.57 ? 155 PRO B N 1 ATOM 2820 C CA . PRO B 2 155 ? 33.357 -43.491 -36.367 1.00 27.48 ? 155 PRO B CA 1 ATOM 2821 C C . PRO B 2 155 ? 34.535 -43.662 -37.304 1.00 29.48 ? 155 PRO B C 1 ATOM 2822 O O . PRO B 2 155 ? 35.178 -44.715 -37.340 1.00 33.79 ? 155 PRO B O 1 ATOM 2823 C CB . PRO B 2 155 ? 33.856 -42.725 -35.150 1.00 21.01 ? 155 PRO B CB 1 ATOM 2824 C CG . PRO B 2 155 ? 34.549 -43.784 -34.355 1.00 22.50 ? 155 PRO B CG 1 ATOM 2825 C CD . PRO B 2 155 ? 33.829 -45.096 -34.634 1.00 24.83 ? 155 PRO B CD 1 ATOM 2826 N N . VAL B 2 156 ? 34.823 -42.611 -38.053 1.00 23.44 ? 156 VAL B N 1 ATOM 2827 C CA . VAL B 2 156 ? 36.060 -42.555 -38.807 1.00 18.86 ? 156 VAL B CA 1 ATOM 2828 C C . VAL B 2 156 ? 36.737 -41.240 -38.432 1.00 19.13 ? 156 VAL B C 1 ATOM 2829 O O . VAL B 2 156 ? 36.075 -40.222 -38.281 1.00 23.65 ? 156 VAL B O 1 ATOM 2830 C CB . VAL B 2 156 ? 35.796 -42.680 -40.328 1.00 22.41 ? 156 VAL B CB 1 ATOM 2831 C CG1 . VAL B 2 156 ? 34.880 -41.555 -40.819 1.00 26.01 ? 156 VAL B CG1 1 ATOM 2832 C CG2 . VAL B 2 156 ? 37.085 -42.699 -41.091 1.00 19.84 ? 156 VAL B CG2 1 ATOM 2833 N N . THR B 2 157 ? 38.042 -41.260 -38.212 1.00 18.08 ? 157 THR B N 1 ATOM 2834 C CA . THR B 2 157 ? 38.725 -40.010 -37.930 1.00 22.64 ? 157 THR B CA 1 ATOM 2835 C C . THR B 2 157 ? 39.423 -39.560 -39.199 1.00 26.62 ? 157 THR B C 1 ATOM 2836 O O . THR B 2 157 ? 39.918 -40.382 -39.983 1.00 24.96 ? 157 THR B O 1 ATOM 2837 C CB . THR B 2 157 ? 39.743 -40.123 -36.788 1.00 21.02 ? 157 THR B CB 1 ATOM 2838 O OG1 . THR B 2 157 ? 41.037 -40.365 -37.340 1.00 34.06 ? 157 THR B OG1 1 ATOM 2839 C CG2 . THR B 2 157 ? 39.380 -41.249 -35.850 1.00 25.07 ? 157 THR B CG2 1 ATOM 2840 N N . VAL B 2 158 ? 39.429 -38.250 -39.413 1.00 27.72 ? 158 VAL B N 1 ATOM 2841 C CA . VAL B 2 158 ? 40.066 -37.671 -40.578 1.00 20.78 ? 158 VAL B CA 1 ATOM 2842 C C . VAL B 2 158 ? 40.935 -36.506 -40.141 1.00 23.16 ? 158 VAL B C 1 ATOM 2843 O O . VAL B 2 158 ? 40.524 -35.665 -39.359 1.00 27.11 ? 158 VAL B O 1 ATOM 2844 C CB . VAL B 2 158 ? 39.028 -37.194 -41.613 1.00 20.04 ? 158 VAL B CB 1 ATOM 2845 C CG1 . VAL B 2 158 ? 39.708 -36.616 -42.848 1.00 15.63 ? 158 VAL B CG1 1 ATOM 2846 C CG2 . VAL B 2 158 ? 38.123 -38.346 -42.012 1.00 22.16 ? 158 VAL B CG2 1 ATOM 2847 N N . SER B 2 159 ? 42.157 -36.467 -40.642 1.00 21.51 ? 159 SER B N 1 ATOM 2848 C CA . SER B 2 159 ? 43.017 -35.329 -40.398 1.00 20.87 ? 159 SER B CA 1 ATOM 2849 C C . SER B 2 159 ? 43.719 -34.954 -41.704 1.00 21.24 ? 159 SER B C 1 ATOM 2850 O O . SER B 2 159 ? 43.660 -35.692 -42.691 1.00 21.08 ? 159 SER B O 1 ATOM 2851 C CB . SER B 2 159 ? 44.031 -35.644 -39.297 1.00 24.60 ? 159 SER B CB 1 ATOM 2852 O OG . SER B 2 159 ? 45.037 -36.522 -39.764 1.00 30.66 ? 159 SER B OG 1 ATOM 2853 N N . TRP B 2 160 ? 44.380 -33.808 -41.701 1.00 19.06 ? 160 TRP B N 1 ATOM 2854 C CA . TRP B 2 160 ? 45.061 -33.332 -42.886 1.00 20.41 ? 160 TRP B CA 1 ATOM 2855 C C . TRP B 2 160 ? 46.565 -33.097 -42.646 1.00 21.70 ? 160 TRP B C 1 ATOM 2856 O O . TRP B 2 160 ? 46.976 -32.496 -41.645 1.00 30.26 ? 160 TRP B O 1 ATOM 2857 C CB . TRP B 2 160 ? 44.358 -32.073 -43.412 1.00 16.81 ? 160 TRP B CB 1 ATOM 2858 C CG . TRP B 2 160 ? 43.047 -32.385 -44.104 1.00 21.32 ? 160 TRP B CG 1 ATOM 2859 C CD1 . TRP B 2 160 ? 41.805 -32.455 -43.531 1.00 16.77 ? 160 TRP B CD1 1 ATOM 2860 C CD2 . TRP B 2 160 ? 42.859 -32.674 -45.499 1.00 20.18 ? 160 TRP B CD2 1 ATOM 2861 N NE1 . TRP B 2 160 ? 40.861 -32.760 -44.482 1.00 16.84 ? 160 TRP B NE1 1 ATOM 2862 C CE2 . TRP B 2 160 ? 41.477 -32.900 -45.697 1.00 17.84 ? 160 TRP B CE2 1 ATOM 2863 C CE3 . TRP B 2 160 ? 43.721 -32.754 -46.598 1.00 16.90 ? 160 TRP B CE3 1 ATOM 2864 C CZ2 . TRP B 2 160 ? 40.941 -33.211 -46.950 1.00 21.96 ? 160 TRP B CZ2 1 ATOM 2865 C CZ3 . TRP B 2 160 ? 43.193 -33.069 -47.837 1.00 26.80 ? 160 TRP B CZ3 1 ATOM 2866 C CH2 . TRP B 2 160 ? 41.812 -33.295 -48.006 1.00 29.91 ? 160 TRP B CH2 1 ATOM 2867 N N . ASN B 2 161 ? 47.370 -33.590 -43.575 1.00 18.15 ? 161 ASN B N 1 ATOM 2868 C CA . ASN B 2 161 ? 48.820 -33.463 -43.499 1.00 22.22 ? 161 ASN B CA 1 ATOM 2869 C C . ASN B 2 161 ? 49.362 -33.882 -42.151 1.00 24.07 ? 161 ASN B C 1 ATOM 2870 O O . ASN B 2 161 ? 50.110 -33.151 -41.515 1.00 22.49 ? 161 ASN B O 1 ATOM 2871 C CB . ASN B 2 161 ? 49.265 -32.050 -43.891 1.00 19.10 ? 161 ASN B CB 1 ATOM 2872 C CG . ASN B 2 161 ? 48.983 -31.756 -45.363 1.00 25.05 ? 161 ASN B CG 1 ATOM 2873 O OD1 . ASN B 2 161 ? 48.615 -32.665 -46.118 1.00 26.78 ? 161 ASN B OD1 1 ATOM 2874 N ND2 . ASN B 2 161 ? 49.164 -30.506 -45.780 1.00 18.13 ? 161 ASN B ND2 1 ATOM 2875 N N . SER B 2 162 ? 48.926 -35.063 -41.721 1.00 28.16 ? 162 SER B N 1 ATOM 2876 C CA . SER B 2 162 ? 49.373 -35.685 -40.481 1.00 31.12 ? 162 SER B CA 1 ATOM 2877 C C . SER B 2 162 ? 49.180 -34.799 -39.264 1.00 29.43 ? 162 SER B C 1 ATOM 2878 O O . SER B 2 162 ? 49.986 -34.837 -38.340 1.00 32.26 ? 162 SER B O 1 ATOM 2879 C CB . SER B 2 162 ? 50.847 -36.093 -40.595 1.00 34.40 ? 162 SER B CB 1 ATOM 2880 O OG . SER B 2 162 ? 51.010 -37.151 -41.526 1.00 33.25 ? 162 SER B OG 1 ATOM 2881 N N . GLY B 2 163 ? 48.123 -33.994 -39.271 1.00 28.46 ? 163 GLY B N 1 ATOM 2882 C CA . GLY B 2 163 ? 47.858 -33.092 -38.162 1.00 25.21 ? 163 GLY B CA 1 ATOM 2883 C C . GLY B 2 163 ? 48.337 -31.664 -38.378 1.00 31.30 ? 163 GLY B C 1 ATOM 2884 O O . GLY B 2 163 ? 47.843 -30.750 -37.728 1.00 32.34 ? 163 GLY B O 1 ATOM 2885 N N . ALA B 2 164 ? 49.286 -31.461 -39.290 1.00 18.25 ? 164 ALA B N 1 ATOM 2886 C CA . ALA B 2 164 ? 49.868 -30.127 -39.501 1.00 18.34 ? 164 ALA B CA 1 ATOM 2887 C C . ALA B 2 164 ? 48.872 -29.121 -40.054 1.00 21.51 ? 164 ALA B C 1 ATOM 2888 O O . ALA B 2 164 ? 49.060 -27.920 -39.902 1.00 23.07 ? 164 ALA B O 1 ATOM 2889 C CB . ALA B 2 164 ? 51.094 -30.194 -40.414 1.00 18.97 ? 164 ALA B CB 1 ATOM 2890 N N . LEU B 2 165 ? 47.829 -29.604 -40.721 1.00 17.16 ? 165 LEU B N 1 ATOM 2891 C CA . LEU B 2 165 ? 46.864 -28.706 -41.342 1.00 16.86 ? 165 LEU B CA 1 ATOM 2892 C C . LEU B 2 165 ? 45.488 -28.873 -40.692 1.00 24.76 ? 165 LEU B C 1 ATOM 2893 O O . LEU B 2 165 ? 44.880 -29.952 -40.758 1.00 27.53 ? 165 LEU B O 1 ATOM 2894 C CB . LEU B 2 165 ? 46.796 -28.937 -42.860 1.00 16.61 ? 165 LEU B CB 1 ATOM 2895 C CG . LEU B 2 165 ? 45.668 -28.189 -43.585 1.00 21.66 ? 165 LEU B CG 1 ATOM 2896 C CD1 . LEU B 2 165 ? 45.806 -26.678 -43.436 1.00 16.81 ? 165 LEU B CD1 1 ATOM 2897 C CD2 . LEU B 2 165 ? 45.586 -28.582 -45.066 1.00 21.32 ? 165 LEU B CD2 1 ATOM 2898 N N . THR B 2 166 ? 45.007 -27.799 -40.071 1.00 19.69 ? 166 THR B N 1 ATOM 2899 C CA . THR B 2 166 ? 43.747 -27.820 -39.318 1.00 20.73 ? 166 THR B CA 1 ATOM 2900 C C . THR B 2 166 ? 42.887 -26.609 -39.656 1.00 21.52 ? 166 THR B C 1 ATOM 2901 O O . THR B 2 166 ? 41.660 -26.670 -39.632 1.00 26.90 ? 166 THR B O 1 ATOM 2902 C CB . THR B 2 166 ? 44.007 -27.797 -37.794 1.00 19.56 ? 166 THR B CB 1 ATOM 2903 O OG1 . THR B 2 166 ? 44.780 -26.634 -37.465 1.00 21.90 ? 166 THR B OG1 1 ATOM 2904 C CG2 . THR B 2 166 ? 44.763 -29.048 -37.350 1.00 18.27 ? 166 THR B CG2 1 ATOM 2905 N N . SER B 2 167 ? 43.547 -25.501 -39.958 1.00 19.07 ? 167 SER B N 1 ATOM 2906 C CA . SER B 2 167 ? 42.859 -24.272 -40.306 1.00 24.24 ? 167 SER B CA 1 ATOM 2907 C C . SER B 2 167 ? 42.036 -24.410 -41.601 1.00 26.76 ? 167 SER B C 1 ATOM 2908 O O . SER B 2 167 ? 42.563 -24.763 -42.655 1.00 24.09 ? 167 SER B O 1 ATOM 2909 C CB . SER B 2 167 ? 43.875 -23.133 -40.417 1.00 27.87 ? 167 SER B CB 1 ATOM 2910 O OG . SER B 2 167 ? 43.323 -22.029 -41.107 1.00 37.00 ? 167 SER B OG 1 ATOM 2911 N N . GLY B 2 168 ? 40.739 -24.133 -41.514 1.00 25.79 ? 168 GLY B N 1 ATOM 2912 C CA . GLY B 2 168 ? 39.896 -24.148 -42.695 1.00 16.08 ? 168 GLY B CA 1 ATOM 2913 C C . GLY B 2 168 ? 39.416 -25.539 -43.050 1.00 22.62 ? 168 GLY B C 1 ATOM 2914 O O . GLY B 2 168 ? 38.819 -25.738 -44.114 1.00 23.80 ? 168 GLY B O 1 ATOM 2915 N N . VAL B 2 169 ? 39.680 -26.501 -42.162 1.00 15.35 ? 169 VAL B N 1 ATOM 2916 C CA . VAL B 2 169 ? 39.178 -27.871 -42.314 1.00 15.61 ? 169 VAL B CA 1 ATOM 2917 C C . VAL B 2 169 ? 37.720 -28.038 -41.845 1.00 24.90 ? 169 VAL B C 1 ATOM 2918 O O . VAL B 2 169 ? 37.327 -27.541 -40.783 1.00 24.34 ? 169 VAL B O 1 ATOM 2919 C CB . VAL B 2 169 ? 40.059 -28.859 -41.546 1.00 14.83 ? 169 VAL B CB 1 ATOM 2920 C CG1 . VAL B 2 169 ? 39.467 -30.262 -41.600 1.00 14.45 ? 169 VAL B CG1 1 ATOM 2921 C CG2 . VAL B 2 169 ? 41.494 -28.831 -42.099 1.00 17.14 ? 169 VAL B CG2 1 ATOM 2922 N N . HIS B 2 170 ? 36.913 -28.719 -42.652 1.00 22.86 ? 170 HIS B N 1 ATOM 2923 C CA . HIS B 2 170 ? 35.571 -29.099 -42.227 1.00 22.83 ? 170 HIS B CA 1 ATOM 2924 C C . HIS B 2 170 ? 35.345 -30.585 -42.485 1.00 25.35 ? 170 HIS B C 1 ATOM 2925 O O . HIS B 2 170 ? 35.335 -31.041 -43.640 1.00 23.39 ? 170 HIS B O 1 ATOM 2926 C CB . HIS B 2 170 ? 34.501 -28.306 -42.965 1.00 14.94 ? 170 HIS B CB 1 ATOM 2927 C CG . HIS B 2 170 ? 34.492 -26.849 -42.648 1.00 18.73 ? 170 HIS B CG 1 ATOM 2928 N ND1 . HIS B 2 170 ? 34.363 -26.367 -41.364 1.00 15.67 ? 170 HIS B ND1 1 ATOM 2929 C CD2 . HIS B 2 170 ? 34.555 -25.763 -43.456 1.00 15.52 ? 170 HIS B CD2 1 ATOM 2930 C CE1 . HIS B 2 170 ? 34.365 -25.047 -41.391 1.00 16.05 ? 170 HIS B CE1 1 ATOM 2931 N NE2 . HIS B 2 170 ? 34.474 -24.656 -42.649 1.00 19.54 ? 170 HIS B NE2 1 ATOM 2932 N N . THR B 2 171 ? 35.165 -31.345 -41.413 1.00 20.33 ? 171 THR B N 1 ATOM 2933 C CA . THR B 2 171 ? 34.824 -32.744 -41.568 1.00 20.97 ? 171 THR B CA 1 ATOM 2934 C C . THR B 2 171 ? 33.344 -32.913 -41.274 1.00 24.98 ? 171 THR B C 1 ATOM 2935 O O . THR B 2 171 ? 32.884 -32.703 -40.143 1.00 31.07 ? 171 THR B O 1 ATOM 2936 C CB . THR B 2 171 ? 35.692 -33.640 -40.679 1.00 18.29 ? 171 THR B CB 1 ATOM 2937 O OG1 . THR B 2 171 ? 37.057 -33.501 -41.081 1.00 23.19 ? 171 THR B OG1 1 ATOM 2938 C CG2 . THR B 2 171 ? 35.280 -35.094 -40.821 1.00 14.14 ? 171 THR B CG2 1 ATOM 2939 N N . PHE B 2 172 ? 32.589 -33.264 -42.309 1.00 22.92 ? 172 PHE B N 1 ATOM 2940 C CA . PHE B 2 172 ? 31.134 -33.304 -42.195 1.00 21.53 ? 172 PHE B CA 1 ATOM 2941 C C . PHE B 2 172 ? 30.658 -34.499 -41.376 1.00 21.19 ? 172 PHE B C 1 ATOM 2942 O O . PHE B 2 172 ? 31.327 -35.526 -41.311 1.00 24.94 ? 172 PHE B O 1 ATOM 2943 C CB . PHE B 2 172 ? 30.475 -33.252 -43.581 1.00 22.61 ? 172 PHE B CB 1 ATOM 2944 C CG . PHE B 2 172 ? 30.587 -31.901 -44.244 1.00 20.65 ? 172 PHE B CG 1 ATOM 2945 C CD1 . PHE B 2 172 ? 29.705 -30.879 -43.915 1.00 17.19 ? 172 PHE B CD1 1 ATOM 2946 C CD2 . PHE B 2 172 ? 31.582 -31.647 -45.173 1.00 14.94 ? 172 PHE B CD2 1 ATOM 2947 C CE1 . PHE B 2 172 ? 29.814 -29.633 -44.493 1.00 15.92 ? 172 PHE B CE1 1 ATOM 2948 C CE2 . PHE B 2 172 ? 31.692 -30.396 -45.770 1.00 15.04 ? 172 PHE B CE2 1 ATOM 2949 C CZ . PHE B 2 172 ? 30.807 -29.389 -45.429 1.00 18.28 ? 172 PHE B CZ 1 ATOM 2950 N N . PRO B 2 173 ? 29.522 -34.342 -40.697 1.00 20.44 ? 173 PRO B N 1 ATOM 2951 C CA . PRO B 2 173 ? 28.943 -35.499 -40.028 1.00 21.15 ? 173 PRO B CA 1 ATOM 2952 C C . PRO B 2 173 ? 28.650 -36.599 -41.048 1.00 23.92 ? 173 PRO B C 1 ATOM 2953 O O . PRO B 2 173 ? 28.239 -36.292 -42.167 1.00 20.07 ? 173 PRO B O 1 ATOM 2954 C CB . PRO B 2 173 ? 27.633 -34.937 -39.451 1.00 17.31 ? 173 PRO B CB 1 ATOM 2955 C CG . PRO B 2 173 ? 27.911 -33.512 -39.227 1.00 17.27 ? 173 PRO B CG 1 ATOM 2956 C CD . PRO B 2 173 ? 28.839 -33.088 -40.337 1.00 22.14 ? 173 PRO B CD 1 ATOM 2957 N N . ALA B 2 174 ? 28.872 -37.855 -40.670 1.00 22.73 ? 174 ALA B N 1 ATOM 2958 C CA . ALA B 2 174 ? 28.533 -38.982 -41.527 1.00 25.45 ? 174 ALA B CA 1 ATOM 2959 C C . ALA B 2 174 ? 27.035 -39.041 -41.814 1.00 23.10 ? 174 ALA B C 1 ATOM 2960 O O . ALA B 2 174 ? 26.224 -38.574 -41.020 1.00 24.68 ? 174 ALA B O 1 ATOM 2961 C CB . ALA B 2 174 ? 28.985 -40.274 -40.888 1.00 25.22 ? 174 ALA B CB 1 ATOM 2962 N N . VAL B 2 175 ? 26.679 -39.604 -42.963 1.00 23.97 ? 175 VAL B N 1 ATOM 2963 C CA . VAL B 2 175 ? 25.283 -39.874 -43.283 1.00 24.51 ? 175 VAL B CA 1 ATOM 2964 C C . VAL B 2 175 ? 25.103 -41.346 -43.671 1.00 22.12 ? 175 VAL B C 1 ATOM 2965 O O . VAL B 2 175 ? 25.956 -41.950 -44.320 1.00 22.63 ? 175 VAL B O 1 ATOM 2966 C CB . VAL B 2 175 ? 24.726 -38.951 -44.401 1.00 24.92 ? 175 VAL B CB 1 ATOM 2967 C CG1 . VAL B 2 175 ? 25.113 -37.490 -44.143 1.00 19.59 ? 175 VAL B CG1 1 ATOM 2968 C CG2 . VAL B 2 175 ? 25.194 -39.403 -45.777 1.00 26.66 ? 175 VAL B CG2 1 ATOM 2969 N N . LEU B 2 176 ? 23.996 -41.922 -43.230 1.00 23.31 ? 176 LEU B N 1 ATOM 2970 C CA . LEU B 2 176 ? 23.688 -43.308 -43.499 1.00 24.23 ? 176 LEU B CA 1 ATOM 2971 C C . LEU B 2 176 ? 23.065 -43.400 -44.888 1.00 24.21 ? 176 LEU B C 1 ATOM 2972 O O . LEU B 2 176 ? 22.029 -42.802 -45.143 1.00 28.11 ? 176 LEU B O 1 ATOM 2973 C CB . LEU B 2 176 ? 22.719 -43.816 -42.431 1.00 24.69 ? 176 LEU B CB 1 ATOM 2974 C CG . LEU B 2 176 ? 22.384 -45.307 -42.333 1.00 30.07 ? 176 LEU B CG 1 ATOM 2975 C CD1 . LEU B 2 176 ? 23.638 -46.160 -42.256 1.00 21.14 ? 176 LEU B CD1 1 ATOM 2976 C CD2 . LEU B 2 176 ? 21.520 -45.534 -41.110 1.00 29.00 ? 176 LEU B CD2 1 ATOM 2977 N N . GLN B 2 177 ? 23.713 -44.126 -45.790 1.00 20.26 ? 177 GLN B N 1 ATOM 2978 C CA . GLN B 2 177 ? 23.161 -44.363 -47.119 1.00 20.78 ? 177 GLN B CA 1 ATOM 2979 C C . GLN B 2 177 ? 22.125 -45.482 -47.064 1.00 25.31 ? 177 GLN B C 1 ATOM 2980 O O . GLN B 2 177 ? 22.006 -46.179 -46.059 1.00 23.63 ? 177 GLN B O 1 ATOM 2981 C CB . GLN B 2 177 ? 24.279 -44.717 -48.105 1.00 20.00 ? 177 GLN B CB 1 ATOM 2982 C CG . GLN B 2 177 ? 25.395 -43.679 -48.156 1.00 22.03 ? 177 GLN B CG 1 ATOM 2983 C CD . GLN B 2 177 ? 26.663 -44.193 -48.826 1.00 23.27 ? 177 GLN B CD 1 ATOM 2984 O OE1 . GLN B 2 177 ? 26.920 -43.920 -50.004 1.00 28.63 ? 177 GLN B OE1 1 ATOM 2985 N NE2 . GLN B 2 177 ? 27.468 -44.930 -48.074 1.00 22.05 ? 177 GLN B NE2 1 ATOM 2986 N N . SER B 2 178 ? 21.374 -45.660 -48.144 1.00 35.48 ? 178 SER B N 1 ATOM 2987 C CA . SER B 2 178 ? 20.311 -46.665 -48.179 1.00 35.33 ? 178 SER B CA 1 ATOM 2988 C C . SER B 2 178 ? 20.913 -48.061 -48.043 1.00 32.73 ? 178 SER B C 1 ATOM 2989 O O . SER B 2 178 ? 20.247 -48.999 -47.597 1.00 33.96 ? 178 SER B O 1 ATOM 2990 C CB . SER B 2 178 ? 19.515 -46.554 -49.481 1.00 37.98 ? 178 SER B CB 1 ATOM 2991 O OG . SER B 2 178 ? 20.329 -46.884 -50.600 1.00 40.72 ? 178 SER B OG 1 ATOM 2992 N N . SER B 2 179 ? 22.181 -48.188 -48.429 1.00 27.24 ? 179 SER B N 1 ATOM 2993 C CA . SER B 2 179 ? 22.905 -49.441 -48.278 1.00 26.57 ? 179 SER B CA 1 ATOM 2994 C C . SER B 2 179 ? 23.156 -49.797 -46.809 1.00 26.69 ? 179 SER B C 1 ATOM 2995 O O . SER B 2 179 ? 23.570 -50.911 -46.505 1.00 22.62 ? 179 SER B O 1 ATOM 2996 C CB . SER B 2 179 ? 24.237 -49.364 -49.014 1.00 21.59 ? 179 SER B CB 1 ATOM 2997 O OG . SER B 2 179 ? 25.092 -48.422 -48.395 1.00 21.03 ? 179 SER B OG 1 ATOM 2998 N N . GLY B 2 180 ? 22.919 -48.853 -45.904 1.00 22.39 ? 180 GLY B N 1 ATOM 2999 C CA . GLY B 2 180 ? 23.190 -49.088 -44.501 1.00 22.28 ? 180 GLY B CA 1 ATOM 3000 C C . GLY B 2 180 ? 24.660 -48.901 -44.171 1.00 28.12 ? 180 GLY B C 1 ATOM 3001 O O . GLY B 2 180 ? 25.128 -49.310 -43.107 1.00 26.32 ? 180 GLY B O 1 ATOM 3002 N N . LEU B 2 181 ? 25.388 -48.288 -45.101 1.00 24.54 ? 181 LEU B N 1 ATOM 3003 C CA . LEU B 2 181 ? 26.789 -47.951 -44.906 1.00 23.94 ? 181 LEU B CA 1 ATOM 3004 C C . LEU B 2 181 ? 26.921 -46.448 -44.840 1.00 21.45 ? 181 LEU B C 1 ATOM 3005 O O . LEU B 2 181 ? 26.129 -45.728 -45.441 1.00 25.16 ? 181 LEU B O 1 ATOM 3006 C CB . LEU B 2 181 ? 27.640 -48.487 -46.060 1.00 25.61 ? 181 LEU B CB 1 ATOM 3007 C CG . LEU B 2 181 ? 27.624 -50.002 -46.269 1.00 21.41 ? 181 LEU B CG 1 ATOM 3008 C CD1 . LEU B 2 181 ? 28.408 -50.386 -47.504 1.00 18.90 ? 181 LEU B CD1 1 ATOM 3009 C CD2 . LEU B 2 181 ? 28.193 -50.702 -45.038 1.00 21.53 ? 181 LEU B CD2 1 ATOM 3010 N N . TYR B 2 182 ? 27.923 -45.971 -44.114 1.00 18.91 ? 182 TYR B N 1 ATOM 3011 C CA . TYR B 2 182 ? 28.097 -44.541 -43.926 1.00 19.18 ? 182 TYR B CA 1 ATOM 3012 C C . TYR B 2 182 ? 28.989 -43.932 -44.982 1.00 16.65 ? 182 TYR B C 1 ATOM 3013 O O . TYR B 2 182 ? 29.812 -44.603 -45.598 1.00 16.35 ? 182 TYR B O 1 ATOM 3014 C CB . TYR B 2 182 ? 28.686 -44.228 -42.551 1.00 17.05 ? 182 TYR B CB 1 ATOM 3015 C CG . TYR B 2 182 ? 27.730 -44.441 -41.410 1.00 24.98 ? 182 TYR B CG 1 ATOM 3016 C CD1 . TYR B 2 182 ? 26.855 -43.433 -41.007 1.00 24.00 ? 182 TYR B CD1 1 ATOM 3017 C CD2 . TYR B 2 182 ? 27.711 -45.643 -40.722 1.00 18.21 ? 182 TYR B CD2 1 ATOM 3018 C CE1 . TYR B 2 182 ? 25.982 -43.632 -39.957 1.00 19.07 ? 182 TYR B CE1 1 ATOM 3019 C CE2 . TYR B 2 182 ? 26.853 -45.847 -39.685 1.00 19.02 ? 182 TYR B CE2 1 ATOM 3020 C CZ . TYR B 2 182 ? 25.993 -44.843 -39.303 1.00 21.57 ? 182 TYR B CZ 1 ATOM 3021 O OH . TYR B 2 182 ? 25.143 -45.067 -38.254 1.00 24.05 ? 182 TYR B OH 1 ATOM 3022 N N . SER B 2 183 ? 28.828 -42.633 -45.157 1.00 23.12 ? 183 SER B N 1 ATOM 3023 C CA . SER B 2 183 ? 29.665 -41.875 -46.054 1.00 28.37 ? 183 SER B CA 1 ATOM 3024 C C . SER B 2 183 ? 29.869 -40.482 -45.468 1.00 30.64 ? 183 SER B C 1 ATOM 3025 O O . SER B 2 183 ? 28.970 -39.940 -44.826 1.00 34.03 ? 183 SER B O 1 ATOM 3026 C CB . SER B 2 183 ? 28.990 -41.781 -47.419 1.00 30.33 ? 183 SER B CB 1 ATOM 3027 O OG . SER B 2 183 ? 29.785 -41.047 -48.321 1.00 34.96 ? 183 SER B OG 1 ATOM 3028 N N . LEU B 2 184 ? 31.057 -39.915 -45.660 1.00 27.19 ? 184 LEU B N 1 ATOM 3029 C CA . LEU B 2 184 ? 31.268 -38.506 -45.360 1.00 22.48 ? 184 LEU B CA 1 ATOM 3030 C C . LEU B 2 184 ? 32.314 -37.855 -46.258 1.00 22.68 ? 184 LEU B C 1 ATOM 3031 O O . LEU B 2 184 ? 33.058 -38.531 -46.970 1.00 17.97 ? 184 LEU B O 1 ATOM 3032 C CB . LEU B 2 184 ? 31.595 -38.279 -43.872 1.00 19.68 ? 184 LEU B CB 1 ATOM 3033 C CG . LEU B 2 184 ? 32.918 -38.688 -43.201 1.00 19.81 ? 184 LEU B CG 1 ATOM 3034 C CD1 . LEU B 2 184 ? 34.095 -37.801 -43.597 1.00 20.67 ? 184 LEU B CD1 1 ATOM 3035 C CD2 . LEU B 2 184 ? 32.752 -38.668 -41.683 1.00 14.62 ? 184 LEU B CD2 1 ATOM 3036 N N . SER B 2 185 ? 32.358 -36.528 -46.210 1.00 19.21 ? 185 SER B N 1 ATOM 3037 C CA . SER B 2 185 ? 33.431 -35.785 -46.831 1.00 19.48 ? 185 SER B CA 1 ATOM 3038 C C . SER B 2 185 ? 34.111 -34.901 -45.811 1.00 20.12 ? 185 SER B C 1 ATOM 3039 O O . SER B 2 185 ? 33.499 -34.471 -44.833 1.00 19.13 ? 185 SER B O 1 ATOM 3040 C CB . SER B 2 185 ? 32.913 -34.929 -47.981 1.00 23.98 ? 185 SER B CB 1 ATOM 3041 O OG . SER B 2 185 ? 32.578 -35.731 -49.097 1.00 32.31 ? 185 SER B OG 1 ATOM 3042 N N . SER B 2 186 ? 35.391 -34.648 -46.060 1.00 20.25 ? 186 SER B N 1 ATOM 3043 C CA . SER B 2 186 ? 36.176 -33.706 -45.297 1.00 13.71 ? 186 SER B CA 1 ATOM 3044 C C . SER B 2 186 ? 36.795 -32.759 -46.311 1.00 19.72 ? 186 SER B C 1 ATOM 3045 O O . SER B 2 186 ? 37.390 -33.194 -47.289 1.00 20.68 ? 186 SER B O 1 ATOM 3046 C CB . SER B 2 186 ? 37.262 -34.443 -44.515 1.00 15.90 ? 186 SER B CB 1 ATOM 3047 O OG . SER B 2 186 ? 38.149 -33.540 -43.879 1.00 13.70 ? 186 SER B OG 1 ATOM 3048 N N . VAL B 2 187 ? 36.646 -31.460 -46.095 1.00 16.72 ? 187 VAL B N 1 ATOM 3049 C CA . VAL B 2 187 ? 37.186 -30.489 -47.033 1.00 15.70 ? 187 VAL B CA 1 ATOM 3050 C C . VAL B 2 187 ? 38.141 -29.534 -46.344 1.00 14.23 ? 187 VAL B C 1 ATOM 3051 O O . VAL B 2 187 ? 38.221 -29.495 -45.119 1.00 17.81 ? 187 VAL B O 1 ATOM 3052 C CB . VAL B 2 187 ? 36.053 -29.680 -47.674 1.00 14.30 ? 187 VAL B CB 1 ATOM 3053 C CG1 . VAL B 2 187 ? 35.142 -30.612 -48.457 1.00 14.28 ? 187 VAL B CG1 1 ATOM 3054 C CG2 . VAL B 2 187 ? 35.271 -28.923 -46.586 1.00 18.26 ? 187 VAL B CG2 1 ATOM 3055 N N . VAL B 2 188 ? 38.863 -28.756 -47.136 1.00 14.45 ? 188 VAL B N 1 ATOM 3056 C CA . VAL B 2 188 ? 39.719 -27.727 -46.589 1.00 14.76 ? 188 VAL B CA 1 ATOM 3057 C C . VAL B 2 188 ? 39.902 -26.669 -47.660 1.00 18.09 ? 188 VAL B C 1 ATOM 3058 O O . VAL B 2 188 ? 39.896 -26.979 -48.861 1.00 15.78 ? 188 VAL B O 1 ATOM 3059 C CB . VAL B 2 188 ? 41.067 -28.307 -46.111 1.00 22.32 ? 188 VAL B CB 1 ATOM 3060 C CG1 . VAL B 2 188 ? 41.812 -28.983 -47.254 1.00 14.82 ? 188 VAL B CG1 1 ATOM 3061 C CG2 . VAL B 2 188 ? 41.925 -27.234 -45.439 1.00 20.67 ? 188 VAL B CG2 1 ATOM 3062 N N . THR B 2 189 ? 39.987 -25.411 -47.242 1.00 15.48 ? 189 THR B N 1 ATOM 3063 C CA . THR B 2 189 ? 40.277 -24.342 -48.189 1.00 15.92 ? 189 THR B CA 1 ATOM 3064 C C . THR B 2 189 ? 41.723 -23.873 -47.990 1.00 20.37 ? 189 THR B C 1 ATOM 3065 O O . THR B 2 189 ? 42.217 -23.787 -46.866 1.00 25.07 ? 189 THR B O 1 ATOM 3066 C CB . THR B 2 189 ? 39.257 -23.178 -48.107 1.00 20.76 ? 189 THR B CB 1 ATOM 3067 O OG1 . THR B 2 189 ? 39.066 -22.802 -46.741 1.00 20.94 ? 189 THR B OG1 1 ATOM 3068 C CG2 . THR B 2 189 ? 37.904 -23.595 -48.676 1.00 15.94 ? 189 THR B CG2 1 ATOM 3069 N N . VAL B 2 190 ? 42.418 -23.623 -49.088 1.00 20.70 ? 190 VAL B N 1 ATOM 3070 C CA . VAL B 2 190 ? 43.829 -23.268 -49.033 1.00 23.22 ? 190 VAL B CA 1 ATOM 3071 C C . VAL B 2 190 ? 44.080 -22.222 -50.105 1.00 25.77 ? 190 VAL B C 1 ATOM 3072 O O . VAL B 2 190 ? 43.258 -22.065 -51.019 1.00 27.42 ? 190 VAL B O 1 ATOM 3073 C CB . VAL B 2 190 ? 44.735 -24.505 -49.301 1.00 22.42 ? 190 VAL B CB 1 ATOM 3074 C CG1 . VAL B 2 190 ? 44.558 -25.549 -48.217 1.00 16.70 ? 190 VAL B CG1 1 ATOM 3075 C CG2 . VAL B 2 190 ? 44.470 -25.095 -50.713 1.00 17.12 ? 190 VAL B CG2 1 ATOM 3076 N N . PRO B 2 191 ? 45.202 -21.489 -50.001 1.00 27.27 ? 191 PRO B N 1 ATOM 3077 C CA . PRO B 2 191 ? 45.536 -20.551 -51.079 1.00 28.08 ? 191 PRO B CA 1 ATOM 3078 C C . PRO B 2 191 ? 45.818 -21.317 -52.362 1.00 28.56 ? 191 PRO B C 1 ATOM 3079 O O . PRO B 2 191 ? 46.596 -22.271 -52.336 1.00 30.70 ? 191 PRO B O 1 ATOM 3080 C CB . PRO B 2 191 ? 46.825 -19.890 -50.580 1.00 20.36 ? 191 PRO B CB 1 ATOM 3081 C CG . PRO B 2 191 ? 46.779 -20.035 -49.111 1.00 20.08 ? 191 PRO B CG 1 ATOM 3082 C CD . PRO B 2 191 ? 46.156 -21.388 -48.884 1.00 28.25 ? 191 PRO B CD 1 ATOM 3083 N N . SER B 2 192 ? 45.201 -20.912 -53.466 1.00 19.61 ? 192 SER B N 1 ATOM 3084 C CA . SER B 2 192 ? 45.355 -21.661 -54.705 1.00 28.23 ? 192 SER B CA 1 ATOM 3085 C C . SER B 2 192 ? 46.787 -21.610 -55.233 1.00 24.75 ? 192 SER B C 1 ATOM 3086 O O . SER B 2 192 ? 47.214 -22.527 -55.923 1.00 27.41 ? 192 SER B O 1 ATOM 3087 C CB . SER B 2 192 ? 44.351 -21.200 -55.763 1.00 28.12 ? 192 SER B CB 1 ATOM 3088 O OG . SER B 2 192 ? 44.503 -19.823 -56.017 1.00 30.91 ? 192 SER B OG 1 ATOM 3089 N N . SER B 2 193 ? 47.532 -20.560 -54.883 1.00 22.96 ? 193 SER B N 1 ATOM 3090 C CA . SER B 2 193 ? 48.966 -20.476 -55.221 1.00 22.42 ? 193 SER B CA 1 ATOM 3091 C C . SER B 2 193 ? 49.824 -21.534 -54.539 1.00 24.70 ? 193 SER B C 1 ATOM 3092 O O . SER B 2 193 ? 50.982 -21.739 -54.904 1.00 29.28 ? 193 SER B O 1 ATOM 3093 C CB . SER B 2 193 ? 49.547 -19.096 -54.896 1.00 23.41 ? 193 SER B CB 1 ATOM 3094 O OG . SER B 2 193 ? 49.351 -18.731 -53.537 1.00 28.41 ? 193 SER B OG 1 ATOM 3095 N N . SER B 2 194 ? 49.262 -22.197 -53.538 1.00 23.70 ? 194 SER B N 1 ATOM 3096 C CA . SER B 2 194 ? 50.006 -23.195 -52.804 1.00 26.91 ? 194 SER B CA 1 ATOM 3097 C C . SER B 2 194 ? 49.817 -24.606 -53.388 1.00 29.44 ? 194 SER B C 1 ATOM 3098 O O . SER B 2 194 ? 50.473 -25.552 -52.951 1.00 28.09 ? 194 SER B O 1 ATOM 3099 C CB . SER B 2 194 ? 49.620 -23.161 -51.322 1.00 22.72 ? 194 SER B CB 1 ATOM 3100 O OG . SER B 2 194 ? 48.430 -23.901 -51.099 1.00 33.37 ? 194 SER B OG 1 ATOM 3101 N N . LEU B 2 195 ? 48.938 -24.751 -54.375 1.00 29.70 ? 195 LEU B N 1 ATOM 3102 C CA . LEU B 2 195 ? 48.665 -26.075 -54.944 1.00 27.31 ? 195 LEU B CA 1 ATOM 3103 C C . LEU B 2 195 ? 49.853 -26.646 -55.707 1.00 33.41 ? 195 LEU B C 1 ATOM 3104 O O . LEU B 2 195 ? 49.960 -27.859 -55.888 1.00 38.79 ? 195 LEU B O 1 ATOM 3105 C CB . LEU B 2 195 ? 47.446 -26.047 -55.868 1.00 23.20 ? 195 LEU B CB 1 ATOM 3106 C CG . LEU B 2 195 ? 46.115 -25.713 -55.207 1.00 22.46 ? 195 LEU B CG 1 ATOM 3107 C CD1 . LEU B 2 195 ? 45.020 -25.690 -56.248 1.00 21.86 ? 195 LEU B CD1 1 ATOM 3108 C CD2 . LEU B 2 195 ? 45.815 -26.741 -54.141 1.00 20.84 ? 195 LEU B CD2 1 ATOM 3109 N N . GLY B 2 196 ? 50.740 -25.769 -56.160 1.00 34.21 ? 196 GLY B N 1 ATOM 3110 C CA . GLY B 2 196 ? 51.879 -26.191 -56.954 1.00 29.83 ? 196 GLY B CA 1 ATOM 3111 C C . GLY B 2 196 ? 53.072 -26.584 -56.110 1.00 36.57 ? 196 GLY B C 1 ATOM 3112 O O . GLY B 2 196 ? 53.954 -27.304 -56.578 1.00 35.32 ? 196 GLY B O 1 ATOM 3113 N N . THR B 2 197 ? 53.093 -26.122 -54.862 1.00 41.22 ? 197 THR B N 1 ATOM 3114 C CA . THR B 2 197 ? 54.247 -26.320 -53.991 1.00 39.41 ? 197 THR B CA 1 ATOM 3115 C C . THR B 2 197 ? 53.964 -27.265 -52.813 1.00 37.32 ? 197 THR B C 1 ATOM 3116 O O . THR B 2 197 ? 54.812 -28.075 -52.438 1.00 38.54 ? 197 THR B O 1 ATOM 3117 C CB . THR B 2 197 ? 54.802 -24.961 -53.467 1.00 38.94 ? 197 THR B CB 1 ATOM 3118 O OG1 . THR B 2 197 ? 54.028 -24.508 -52.346 1.00 47.73 ? 197 THR B OG1 1 ATOM 3119 C CG2 . THR B 2 197 ? 54.754 -23.904 -54.560 1.00 28.37 ? 197 THR B CG2 1 ATOM 3120 N N . GLN B 2 198 ? 52.772 -27.162 -52.237 1.00 31.01 ? 198 GLN B N 1 ATOM 3121 C CA . GLN B 2 198 ? 52.420 -27.924 -51.039 1.00 26.75 ? 198 GLN B CA 1 ATOM 3122 C C . GLN B 2 198 ? 51.690 -29.208 -51.411 1.00 25.46 ? 198 GLN B C 1 ATOM 3123 O O . GLN B 2 198 ? 50.901 -29.224 -52.362 1.00 23.73 ? 198 GLN B O 1 ATOM 3124 C CB . GLN B 2 198 ? 51.517 -27.079 -50.135 1.00 30.08 ? 198 GLN B CB 1 ATOM 3125 C CG . GLN B 2 198 ? 51.981 -26.972 -48.695 1.00 43.99 ? 198 GLN B CG 1 ATOM 3126 C CD . GLN B 2 198 ? 53.254 -26.163 -48.560 1.00 53.81 ? 198 GLN B CD 1 ATOM 3127 O OE1 . GLN B 2 198 ? 53.455 -25.182 -49.279 1.00 58.37 ? 198 GLN B OE1 1 ATOM 3128 N NE2 . GLN B 2 198 ? 54.128 -26.576 -47.645 1.00 58.57 ? 198 GLN B NE2 1 ATOM 3129 N N . THR B 2 199 ? 51.938 -30.284 -50.671 1.00 22.90 ? 199 THR B N 1 ATOM 3130 C CA . THR B 2 199 ? 51.139 -31.500 -50.856 1.00 23.34 ? 199 THR B CA 1 ATOM 3131 C C . THR B 2 199 ? 49.958 -31.532 -49.875 1.00 20.25 ? 199 THR B C 1 ATOM 3132 O O . THR B 2 199 ? 50.069 -31.106 -48.728 1.00 21.28 ? 199 THR B O 1 ATOM 3133 C CB . THR B 2 199 ? 51.982 -32.800 -50.733 1.00 23.87 ? 199 THR B CB 1 ATOM 3134 O OG1 . THR B 2 199 ? 52.447 -32.969 -49.384 1.00 25.06 ? 199 THR B OG1 1 ATOM 3135 C CG2 . THR B 2 199 ? 53.172 -32.759 -51.683 1.00 25.30 ? 199 THR B CG2 1 ATOM 3136 N N . TYR B 2 200 ? 48.820 -32.033 -50.327 1.00 22.29 ? 200 TYR B N 1 ATOM 3137 C CA . TYR B 2 200 ? 47.667 -32.147 -49.443 1.00 17.81 ? 200 TYR B CA 1 ATOM 3138 C C . TYR B 2 200 ? 47.199 -33.593 -49.320 1.00 23.08 ? 200 TYR B C 1 ATOM 3139 O O . TYR B 2 200 ? 46.826 -34.233 -50.311 1.00 26.40 ? 200 TYR B O 1 ATOM 3140 C CB . TYR B 2 200 ? 46.553 -31.207 -49.898 1.00 17.13 ? 200 TYR B CB 1 ATOM 3141 C CG . TYR B 2 200 ? 46.950 -29.751 -49.760 1.00 21.29 ? 200 TYR B CG 1 ATOM 3142 C CD1 . TYR B 2 200 ? 46.901 -29.116 -48.527 1.00 19.60 ? 200 TYR B CD1 1 ATOM 3143 C CD2 . TYR B 2 200 ? 47.404 -29.024 -50.853 1.00 20.37 ? 200 TYR B CD2 1 ATOM 3144 C CE1 . TYR B 2 200 ? 47.276 -27.800 -48.387 1.00 21.42 ? 200 TYR B CE1 1 ATOM 3145 C CE2 . TYR B 2 200 ? 47.779 -27.699 -50.719 1.00 25.12 ? 200 TYR B CE2 1 ATOM 3146 C CZ . TYR B 2 200 ? 47.714 -27.095 -49.478 1.00 23.12 ? 200 TYR B CZ 1 ATOM 3147 O OH . TYR B 2 200 ? 48.081 -25.780 -49.329 1.00 23.66 ? 200 TYR B OH 1 ATOM 3148 N N . ILE B 2 201 ? 47.271 -34.113 -48.099 1.00 20.36 ? 201 ILE B N 1 ATOM 3149 C CA . ILE B 2 201 ? 46.916 -35.497 -47.818 1.00 17.90 ? 201 ILE B CA 1 ATOM 3150 C C . ILE B 2 201 ? 45.873 -35.575 -46.724 1.00 23.22 ? 201 ILE B C 1 ATOM 3151 O O . ILE B 2 201 ? 46.049 -35.006 -45.647 1.00 26.79 ? 201 ILE B O 1 ATOM 3152 C CB . ILE B 2 201 ? 48.141 -36.327 -47.382 1.00 19.92 ? 201 ILE B CB 1 ATOM 3153 C CG1 . ILE B 2 201 ? 49.136 -36.448 -48.544 1.00 21.23 ? 201 ILE B CG1 1 ATOM 3154 C CG2 . ILE B 2 201 ? 47.711 -37.714 -46.922 1.00 20.34 ? 201 ILE B CG2 1 ATOM 3155 C CD1 . ILE B 2 201 ? 50.291 -37.399 -48.276 1.00 24.22 ? 201 ILE B CD1 1 ATOM 3156 N N . CYS B 2 202 ? 44.780 -36.278 -46.995 1.00 16.48 ? 202 CYS B N 1 ATOM 3157 C CA . CYS B 2 202 ? 43.835 -36.581 -45.939 1.00 20.62 ? 202 CYS B CA 1 ATOM 3158 C C . CYS B 2 202 ? 44.218 -37.929 -45.361 1.00 16.92 ? 202 CYS B C 1 ATOM 3159 O O . CYS B 2 202 ? 44.412 -38.895 -46.094 1.00 25.41 ? 202 CYS B O 1 ATOM 3160 C CB . CYS B 2 202 ? 42.385 -36.585 -46.448 1.00 22.03 ? 202 CYS B CB 1 ATOM 3161 S SG . CYS B 2 202 ? 41.958 -37.957 -47.544 1.00 26.39 ? 202 CYS B SG 1 ATOM 3162 N N . ASN B 2 203 ? 44.356 -37.976 -44.044 1.00 21.84 ? 203 ASN B N 1 ATOM 3163 C CA . ASN B 2 203 ? 44.704 -39.202 -43.343 1.00 20.51 ? 203 ASN B CA 1 ATOM 3164 C C . ASN B 2 203 ? 43.435 -39.744 -42.768 1.00 20.26 ? 203 ASN B C 1 ATOM 3165 O O . ASN B 2 203 ? 42.824 -39.109 -41.907 1.00 18.32 ? 203 ASN B O 1 ATOM 3166 C CB . ASN B 2 203 ? 45.698 -38.911 -42.219 1.00 20.32 ? 203 ASN B CB 1 ATOM 3167 C CG . ASN B 2 203 ? 46.818 -37.985 -42.670 1.00 27.72 ? 203 ASN B CG 1 ATOM 3168 O OD1 . ASN B 2 203 ? 46.801 -36.791 -42.382 1.00 25.36 ? 203 ASN B OD1 1 ATOM 3169 N ND2 . ASN B 2 203 ? 47.773 -38.528 -43.420 1.00 22.59 ? 203 ASN B ND2 1 ATOM 3170 N N . VAL B 2 204 ? 43.025 -40.904 -43.263 1.00 18.01 ? 204 VAL B N 1 ATOM 3171 C CA . VAL B 2 204 ? 41.773 -41.506 -42.860 1.00 17.60 ? 204 VAL B CA 1 ATOM 3172 C C . VAL B 2 204 ? 42.022 -42.739 -42.002 1.00 27.51 ? 204 VAL B C 1 ATOM 3173 O O . VAL B 2 204 ? 42.878 -43.564 -42.314 1.00 33.81 ? 204 VAL B O 1 ATOM 3174 C CB . VAL B 2 204 ? 40.939 -41.852 -44.094 1.00 17.65 ? 204 VAL B CB 1 ATOM 3175 C CG1 . VAL B 2 204 ? 39.692 -42.633 -43.722 1.00 17.98 ? 204 VAL B CG1 1 ATOM 3176 C CG2 . VAL B 2 204 ? 40.589 -40.575 -44.833 1.00 16.79 ? 204 VAL B CG2 1 ATOM 3177 N N . ASN B 2 205 ? 41.284 -42.858 -40.907 1.00 22.05 ? 205 ASN B N 1 ATOM 3178 C CA . ASN B 2 205 ? 41.440 -44.013 -40.040 1.00 21.63 ? 205 ASN B CA 1 ATOM 3179 C C . ASN B 2 205 ? 40.088 -44.567 -39.618 1.00 26.39 ? 205 ASN B C 1 ATOM 3180 O O . ASN B 2 205 ? 39.280 -43.866 -39.007 1.00 29.71 ? 205 ASN B O 1 ATOM 3181 C CB . ASN B 2 205 ? 42.266 -43.647 -38.803 1.00 23.02 ? 205 ASN B CB 1 ATOM 3182 C CG . ASN B 2 205 ? 42.762 -44.872 -38.042 1.00 31.40 ? 205 ASN B CG 1 ATOM 3183 O OD1 . ASN B 2 205 ? 42.263 -45.980 -38.220 1.00 36.05 ? 205 ASN B OD1 1 ATOM 3184 N ND2 . ASN B 2 205 ? 43.746 -44.668 -37.183 1.00 34.13 ? 205 ASN B ND2 1 ATOM 3185 N N . HIS B 2 206 ? 39.837 -45.826 -39.954 1.00 32.16 ? 206 HIS B N 1 ATOM 3186 C CA . HIS B 2 206 ? 38.611 -46.484 -39.528 1.00 25.10 ? 206 HIS B CA 1 ATOM 3187 C C . HIS B 2 206 ? 39.016 -47.598 -38.597 1.00 23.74 ? 206 HIS B C 1 ATOM 3188 O O . HIS B 2 206 ? 39.202 -48.740 -39.018 1.00 26.20 ? 206 HIS B O 1 ATOM 3189 C CB . HIS B 2 206 ? 37.816 -47.023 -40.722 1.00 21.54 ? 206 HIS B CB 1 ATOM 3190 C CG . HIS B 2 206 ? 36.465 -47.565 -40.357 1.00 22.05 ? 206 HIS B CG 1 ATOM 3191 N ND1 . HIS B 2 206 ? 36.133 -48.896 -40.496 1.00 24.23 ? 206 HIS B ND1 1 ATOM 3192 C CD2 . HIS B 2 206 ? 35.362 -46.956 -39.860 1.00 21.25 ? 206 HIS B CD2 1 ATOM 3193 C CE1 . HIS B 2 206 ? 34.884 -49.082 -40.110 1.00 24.50 ? 206 HIS B CE1 1 ATOM 3194 N NE2 . HIS B 2 206 ? 34.396 -47.923 -39.711 1.00 23.31 ? 206 HIS B NE2 1 ATOM 3195 N N . LYS B 2 207 ? 39.172 -47.248 -37.326 1.00 25.89 ? 207 LYS B N 1 ATOM 3196 C CA . LYS B 2 207 ? 39.586 -48.208 -36.303 1.00 28.88 ? 207 LYS B CA 1 ATOM 3197 C C . LYS B 2 207 ? 38.796 -49.520 -36.229 1.00 24.99 ? 207 LYS B C 1 ATOM 3198 O O . LYS B 2 207 ? 39.412 -50.571 -36.100 1.00 32.31 ? 207 LYS B O 1 ATOM 3199 C CB . LYS B 2 207 ? 39.666 -47.532 -34.938 1.00 37.19 ? 207 LYS B CB 1 ATOM 3200 C CG . LYS B 2 207 ? 40.670 -46.393 -34.918 1.00 41.83 ? 207 LYS B CG 1 ATOM 3201 C CD . LYS B 2 207 ? 40.912 -45.876 -33.516 1.00 48.81 ? 207 LYS B CD 1 ATOM 3202 C CE . LYS B 2 207 ? 42.086 -44.914 -33.497 1.00 52.97 ? 207 LYS B CE 1 ATOM 3203 N NZ . LYS B 2 207 ? 42.411 -44.471 -32.118 1.00 58.40 ? 207 LYS B NZ 1 ATOM 3204 N N . PRO B 2 208 ? 37.445 -49.480 -36.332 1.00 24.71 ? 208 PRO B N 1 ATOM 3205 C CA . PRO B 2 208 ? 36.710 -50.753 -36.258 1.00 25.19 ? 208 PRO B CA 1 ATOM 3206 C C . PRO B 2 208 ? 37.106 -51.774 -37.330 1.00 27.71 ? 208 PRO B C 1 ATOM 3207 O O . PRO B 2 208 ? 36.888 -52.970 -37.145 1.00 30.04 ? 208 PRO B O 1 ATOM 3208 C CB . PRO B 2 208 ? 35.248 -50.331 -36.460 1.00 25.51 ? 208 PRO B CB 1 ATOM 3209 C CG . PRO B 2 208 ? 35.203 -48.901 -36.076 1.00 22.22 ? 208 PRO B CG 1 ATOM 3210 C CD . PRO B 2 208 ? 36.523 -48.339 -36.501 1.00 21.78 ? 208 PRO B CD 1 ATOM 3211 N N . SER B 2 209 ? 37.679 -51.312 -38.435 1.00 33.07 ? 209 SER B N 1 ATOM 3212 C CA . SER B 2 209 ? 38.103 -52.217 -39.497 1.00 37.49 ? 209 SER B CA 1 ATOM 3213 C C . SER B 2 209 ? 39.618 -52.222 -39.645 1.00 41.15 ? 209 SER B C 1 ATOM 3214 O O . SER B 2 209 ? 40.152 -52.859 -40.560 1.00 35.43 ? 209 SER B O 1 ATOM 3215 C CB . SER B 2 209 ? 37.472 -51.825 -40.831 1.00 30.85 ? 209 SER B CB 1 ATOM 3216 O OG . SER B 2 209 ? 37.903 -50.536 -41.223 1.00 35.21 ? 209 SER B OG 1 ATOM 3217 N N . ASN B 2 210 ? 40.297 -51.519 -38.739 1.00 42.95 ? 210 ASN B N 1 ATOM 3218 C CA . ASN B 2 210 ? 41.744 -51.302 -38.832 1.00 41.41 ? 210 ASN B CA 1 ATOM 3219 C C . ASN B 2 210 ? 42.170 -50.889 -40.234 1.00 37.34 ? 210 ASN B C 1 ATOM 3220 O O . ASN B 2 210 ? 43.099 -51.448 -40.803 1.00 44.00 ? 210 ASN B O 1 ATOM 3221 C CB . ASN B 2 210 ? 42.515 -52.542 -38.394 1.00 41.06 ? 210 ASN B CB 1 ATOM 3222 C CG . ASN B 2 210 ? 42.107 -53.017 -37.022 1.00 51.01 ? 210 ASN B CG 1 ATOM 3223 O OD1 . ASN B 2 210 ? 42.350 -52.341 -36.018 1.00 55.67 ? 210 ASN B OD1 1 ATOM 3224 N ND2 . ASN B 2 210 ? 41.481 -54.190 -36.968 1.00 53.27 ? 210 ASN B ND2 1 ATOM 3225 N N . THR B 2 211 ? 41.457 -49.925 -40.798 1.00 38.43 ? 211 THR B N 1 ATOM 3226 C CA . THR B 2 211 ? 41.734 -49.448 -42.142 1.00 40.31 ? 211 THR B CA 1 ATOM 3227 C C . THR B 2 211 ? 42.337 -48.053 -42.063 1.00 33.01 ? 211 THR B C 1 ATOM 3228 O O . THR B 2 211 ? 41.686 -47.097 -41.621 1.00 28.22 ? 211 THR B O 1 ATOM 3229 C CB . THR B 2 211 ? 40.457 -49.440 -42.990 1.00 38.34 ? 211 THR B CB 1 ATOM 3230 O OG1 . THR B 2 211 ? 39.929 -50.773 -43.043 1.00 42.74 ? 211 THR B OG1 1 ATOM 3231 C CG2 . THR B 2 211 ? 40.736 -48.935 -44.406 1.00 30.54 ? 211 THR B CG2 1 ATOM 3232 N N . LYS B 2 212 ? 43.605 -47.953 -42.439 1.00 33.71 ? 212 LYS B N 1 ATOM 3233 C CA . LYS B 2 212 ? 44.277 -46.661 -42.483 1.00 34.31 ? 212 LYS B CA 1 ATOM 3234 C C . LYS B 2 212 ? 44.670 -46.353 -43.916 1.00 26.85 ? 212 LYS B C 1 ATOM 3235 O O . LYS B 2 212 ? 45.355 -47.143 -44.565 1.00 28.83 ? 212 LYS B O 1 ATOM 3236 C CB . LYS B 2 212 ? 45.498 -46.636 -41.556 1.00 35.25 ? 212 LYS B CB 1 ATOM 3237 C CG . LYS B 2 212 ? 45.177 -46.208 -40.131 1.00 35.24 ? 212 LYS B CG 1 ATOM 3238 C CD . LYS B 2 212 ? 46.416 -46.176 -39.254 1.00 40.54 ? 212 LYS B CD 1 ATOM 3239 C CE . LYS B 2 212 ? 47.468 -45.255 -39.834 1.00 46.19 ? 212 LYS B CE 1 ATOM 3240 N NZ . LYS B 2 212 ? 48.757 -45.343 -39.087 1.00 54.29 ? 212 LYS B NZ 1 ATOM 3241 N N . VAL B 2 213 ? 44.207 -45.211 -44.405 1.00 24.16 ? 213 VAL B N 1 ATOM 3242 C CA . VAL B 2 213 ? 44.475 -44.782 -45.769 1.00 23.20 ? 213 VAL B CA 1 ATOM 3243 C C . VAL B 2 213 ? 44.931 -43.331 -45.782 1.00 22.35 ? 213 VAL B C 1 ATOM 3244 O O . VAL B 2 213 ? 44.314 -42.485 -45.138 1.00 23.60 ? 213 VAL B O 1 ATOM 3245 C CB . VAL B 2 213 ? 43.211 -44.882 -46.639 1.00 21.00 ? 213 VAL B CB 1 ATOM 3246 C CG1 . VAL B 2 213 ? 43.476 -44.321 -48.022 1.00 20.32 ? 213 VAL B CG1 1 ATOM 3247 C CG2 . VAL B 2 213 ? 42.740 -46.307 -46.726 1.00 22.19 ? 213 VAL B CG2 1 ATOM 3248 N N . ASP B 2 214 ? 46.015 -43.047 -46.498 1.00 24.21 ? 214 ASP B N 1 ATOM 3249 C CA . ASP B 2 214 ? 46.428 -41.665 -46.750 1.00 22.80 ? 214 ASP B CA 1 ATOM 3250 C C . ASP B 2 214 ? 46.158 -41.346 -48.202 1.00 28.72 ? 214 ASP B C 1 ATOM 3251 O O . ASP B 2 214 ? 46.736 -41.968 -49.097 1.00 26.09 ? 214 ASP B O 1 ATOM 3252 C CB . ASP B 2 214 ? 47.919 -41.446 -46.471 1.00 25.53 ? 214 ASP B CB 1 ATOM 3253 C CG . ASP B 2 214 ? 48.257 -41.473 -44.987 1.00 34.74 ? 214 ASP B CG 1 ATOM 3254 O OD1 . ASP B 2 214 ? 47.329 -41.289 -44.160 1.00 26.32 ? 214 ASP B OD1 1 ATOM 3255 O OD2 . ASP B 2 214 ? 49.458 -41.671 -44.655 1.00 31.29 ? 214 ASP B OD2 1 ATOM 3256 N N . LYS B 2 215 ? 45.277 -40.385 -48.443 1.00 19.32 ? 215 LYS B N 1 ATOM 3257 C CA . LYS B 2 215 ? 44.928 -40.041 -49.808 1.00 18.32 ? 215 LYS B CA 1 ATOM 3258 C C . LYS B 2 215 ? 45.495 -38.688 -50.191 1.00 20.79 ? 215 LYS B C 1 ATOM 3259 O O . LYS B 2 215 ? 45.127 -37.659 -49.618 1.00 17.81 ? 215 LYS B O 1 ATOM 3260 C CB . LYS B 2 215 ? 43.408 -40.034 -50.002 1.00 20.78 ? 215 LYS B CB 1 ATOM 3261 C CG . LYS B 2 215 ? 42.968 -39.627 -51.417 1.00 20.74 ? 215 LYS B CG 1 ATOM 3262 C CD . LYS B 2 215 ? 42.811 -40.841 -52.318 1.00 16.71 ? 215 LYS B CD 1 ATOM 3263 C CE . LYS B 2 215 ? 43.472 -40.624 -53.664 1.00 17.79 ? 215 LYS B CE 1 ATOM 3264 N NZ . LYS B 2 215 ? 43.484 -41.876 -54.483 1.00 22.01 ? 215 LYS B NZ 1 ATOM 3265 N N . ARG B 2 216 ? 46.390 -38.699 -51.170 1.00 19.53 ? 216 ARG B N 1 ATOM 3266 C CA . ARG B 2 216 ? 46.915 -37.475 -51.750 1.00 19.84 ? 216 ARG B CA 1 ATOM 3267 C C . ARG B 2 216 ? 45.867 -36.862 -52.675 1.00 18.43 ? 216 ARG B C 1 ATOM 3268 O O . ARG B 2 216 ? 45.245 -37.564 -53.473 1.00 20.67 ? 216 ARG B O 1 ATOM 3269 C CB . ARG B 2 216 ? 48.213 -37.780 -52.501 1.00 21.83 ? 216 ARG B CB 1 ATOM 3270 C CG . ARG B 2 216 ? 48.726 -36.675 -53.373 1.00 22.35 ? 216 ARG B CG 1 ATOM 3271 C CD . ARG B 2 216 ? 49.388 -35.557 -52.586 1.00 23.23 ? 216 ARG B CD 1 ATOM 3272 N NE . ARG B 2 216 ? 49.918 -34.556 -53.514 1.00 34.32 ? 216 ARG B NE 1 ATOM 3273 C CZ . ARG B 2 216 ? 51.146 -34.583 -54.023 1.00 36.40 ? 216 ARG B CZ 1 ATOM 3274 N NH1 . ARG B 2 216 ? 51.995 -35.542 -53.667 1.00 35.99 ? 216 ARG B NH1 1 ATOM 3275 N NH2 . ARG B 2 216 ? 51.530 -33.640 -54.874 1.00 34.24 ? 216 ARG B NH2 1 ATOM 3276 N N . VAL B 2 217 ? 45.645 -35.559 -52.547 1.00 18.16 ? 217 VAL B N 1 ATOM 3277 C CA . VAL B 2 217 ? 44.626 -34.892 -53.347 1.00 23.35 ? 217 VAL B CA 1 ATOM 3278 C C . VAL B 2 217 ? 45.261 -33.810 -54.191 1.00 29.69 ? 217 VAL B C 1 ATOM 3279 O O . VAL B 2 217 ? 45.771 -32.841 -53.652 1.00 29.39 ? 217 VAL B O 1 ATOM 3280 C CB . VAL B 2 217 ? 43.540 -34.256 -52.465 1.00 19.87 ? 217 VAL B CB 1 ATOM 3281 C CG1 . VAL B 2 217 ? 42.556 -33.459 -53.320 1.00 16.40 ? 217 VAL B CG1 1 ATOM 3282 C CG2 . VAL B 2 217 ? 42.821 -35.323 -51.681 1.00 18.98 ? 217 VAL B CG2 1 ATOM 3283 N N . GLU B 2 218 ? 45.258 -33.968 -55.511 1.00 35.09 ? 218 GLU B N 1 ATOM 3284 C CA . GLU B 2 218 ? 45.976 -33.072 -56.408 1.00 33.05 ? 218 GLU B CA 1 ATOM 3285 C C . GLU B 2 218 ? 44.982 -32.377 -57.317 1.00 30.22 ? 218 GLU B C 1 ATOM 3286 O O . GLU B 2 218 ? 43.881 -32.890 -57.533 1.00 32.71 ? 218 GLU B O 1 ATOM 3287 C CB . GLU B 2 218 ? 46.997 -33.827 -57.269 1.00 33.31 ? 218 GLU B CB 1 ATOM 3288 C CG . GLU B 2 218 ? 48.333 -33.992 -56.602 1.00 45.83 ? 218 GLU B CG 1 ATOM 3289 C CD . GLU B 2 218 ? 49.248 -34.908 -57.379 1.00 56.83 ? 218 GLU B CD 1 ATOM 3290 O OE1 . GLU B 2 218 ? 50.380 -35.182 -56.918 1.00 64.54 ? 218 GLU B OE1 1 ATOM 3291 O OE2 . GLU B 2 218 ? 48.825 -35.359 -58.460 1.00 55.06 ? 218 GLU B OE2 1 ATOM 3292 N N . PRO B 2 219 ? 45.325 -31.211 -57.867 1.00 35.61 ? 219 PRO B N 1 ATOM 3293 C CA . PRO B 2 219 ? 44.451 -30.645 -58.896 1.00 33.44 ? 219 PRO B CA 1 ATOM 3294 C C . PRO B 2 219 ? 44.468 -31.546 -60.118 1.00 34.40 ? 219 PRO B C 1 ATOM 3295 O O . PRO B 2 219 ? 45.533 -32.019 -60.509 1.00 34.99 ? 219 PRO B O 1 ATOM 3296 C CB . PRO B 2 219 ? 45.087 -29.288 -59.209 1.00 24.44 ? 219 PRO B CB 1 ATOM 3297 C CG . PRO B 2 219 ? 46.423 -29.310 -58.580 1.00 24.69 ? 219 PRO B CG 1 ATOM 3298 C CD . PRO B 2 219 ? 46.416 -30.301 -57.481 1.00 23.06 ? 219 PRO B CD 1 ATOM 3299 N N . LYS B 2 220 ? 43.298 -31.808 -60.687 1.00 39.62 ? 220 LYS B N 1 ATOM 3300 C CA . LYS B 2 220 ? 43.208 -32.617 -61.892 1.00 44.65 ? 220 LYS B CA 1 ATOM 3301 C C . LYS B 2 220 ? 43.182 -31.748 -63.140 1.00 43.19 ? 220 LYS B C 1 ATOM 3302 O O . LYS B 2 220 ? 44.018 -31.911 -64.023 1.00 49.31 ? 220 LYS B O 1 ATOM 3303 C CB . LYS B 2 220 ? 41.967 -33.496 -61.847 1.00 45.17 ? 220 LYS B CB 1 ATOM 3304 C CG . LYS B 2 220 ? 41.832 -34.429 -63.023 1.00 49.67 ? 220 LYS B CG 1 ATOM 3305 C CD . LYS B 2 220 ? 40.580 -35.251 -62.860 1.00 52.43 ? 220 LYS B CD 1 ATOM 3306 C CE . LYS B 2 220 ? 40.391 -36.217 -64.001 1.00 58.18 ? 220 LYS B CE 1 ATOM 3307 N NZ . LYS B 2 220 ? 39.203 -37.064 -63.736 1.00 61.54 ? 220 LYS B NZ 1 ATOM 3308 N N . ASP C 1 1 ? 17.344 0.333 -5.944 1.00 32.01 ? 1 ASP C N 1 ATOM 3309 C CA . ASP C 1 1 ? 16.152 -0.432 -6.287 1.00 32.26 ? 1 ASP C CA 1 ATOM 3310 C C . ASP C 1 1 ? 16.478 -1.914 -6.478 1.00 28.51 ? 1 ASP C C 1 ATOM 3311 O O . ASP C 1 1 ? 17.605 -2.268 -6.814 1.00 31.40 ? 1 ASP C O 1 ATOM 3312 C CB . ASP C 1 1 ? 15.520 0.118 -7.565 1.00 40.13 ? 1 ASP C CB 1 ATOM 3313 C CG . ASP C 1 1 ? 15.039 1.549 -7.417 1.00 48.19 ? 1 ASP C CG 1 ATOM 3314 O OD1 . ASP C 1 1 ? 15.461 2.237 -6.460 1.00 50.34 ? 1 ASP C OD1 1 ATOM 3315 O OD2 . ASP C 1 1 ? 14.241 1.989 -8.272 1.00 52.71 ? 1 ASP C OD2 1 ATOM 3316 N N . ILE C 1 2 ? 15.492 -2.779 -6.257 1.00 24.62 ? 2 ILE C N 1 ATOM 3317 C CA . ILE C 1 2 ? 15.658 -4.204 -6.543 1.00 24.57 ? 2 ILE C CA 1 ATOM 3318 C C . ILE C 1 2 ? 15.749 -4.432 -8.052 1.00 29.16 ? 2 ILE C C 1 ATOM 3319 O O . ILE C 1 2 ? 14.849 -4.044 -8.809 1.00 27.19 ? 2 ILE C O 1 ATOM 3320 C CB . ILE C 1 2 ? 14.470 -5.041 -6.005 1.00 26.13 ? 2 ILE C CB 1 ATOM 3321 C CG1 . ILE C 1 2 ? 14.248 -4.782 -4.510 1.00 28.51 ? 2 ILE C CG1 1 ATOM 3322 C CG2 . ILE C 1 2 ? 14.692 -6.520 -6.262 1.00 18.55 ? 2 ILE C CG2 1 ATOM 3323 C CD1 . ILE C 1 2 ? 15.404 -5.197 -3.637 1.00 23.84 ? 2 ILE C CD1 1 ATOM 3324 N N . LEU C 1 3 ? 16.833 -5.056 -8.496 1.00 26.04 ? 3 LEU C N 1 ATOM 3325 C CA . LEU C 1 3 ? 16.930 -5.452 -9.893 1.00 28.63 ? 3 LEU C CA 1 ATOM 3326 C C . LEU C 1 3 ? 16.324 -6.850 -10.069 1.00 30.29 ? 3 LEU C C 1 ATOM 3327 O O . LEU C 1 3 ? 16.556 -7.744 -9.256 1.00 37.62 ? 3 LEU C O 1 ATOM 3328 C CB . LEU C 1 3 ? 18.385 -5.417 -10.374 1.00 34.40 ? 3 LEU C CB 1 ATOM 3329 C CG . LEU C 1 3 ? 18.562 -5.632 -11.887 1.00 42.07 ? 3 LEU C CG 1 ATOM 3330 C CD1 . LEU C 1 3 ? 17.996 -4.449 -12.669 1.00 41.47 ? 3 LEU C CD1 1 ATOM 3331 C CD2 . LEU C 1 3 ? 20.028 -5.934 -12.301 1.00 33.67 ? 3 LEU C CD2 1 ATOM 3332 N N . LEU C 1 4 ? 15.529 -7.027 -11.117 1.00 23.64 ? 4 LEU C N 1 ATOM 3333 C CA . LEU C 1 4 ? 14.961 -8.334 -11.432 1.00 22.69 ? 4 LEU C CA 1 ATOM 3334 C C . LEU C 1 4 ? 15.522 -8.828 -12.752 1.00 26.59 ? 4 LEU C C 1 ATOM 3335 O O . LEU C 1 4 ? 15.422 -8.153 -13.780 1.00 31.84 ? 4 LEU C O 1 ATOM 3336 C CB . LEU C 1 4 ? 13.438 -8.263 -11.540 1.00 22.26 ? 4 LEU C CB 1 ATOM 3337 C CG . LEU C 1 4 ? 12.652 -7.784 -10.321 1.00 20.88 ? 4 LEU C CG 1 ATOM 3338 C CD1 . LEU C 1 4 ? 11.156 -7.652 -10.649 1.00 20.37 ? 4 LEU C CD1 1 ATOM 3339 C CD2 . LEU C 1 4 ? 12.885 -8.710 -9.145 1.00 15.34 ? 4 LEU C CD2 1 ATOM 3340 N N . THR C 1 5 ? 16.104 -10.015 -12.732 1.00 23.42 ? 5 THR C N 1 ATOM 3341 C CA . THR C 1 5 ? 16.630 -10.593 -13.947 1.00 20.83 ? 5 THR C CA 1 ATOM 3342 C C . THR C 1 5 ? 15.731 -11.735 -14.391 1.00 23.97 ? 5 THR C C 1 ATOM 3343 O O . THR C 1 5 ? 15.571 -12.727 -13.676 1.00 27.82 ? 5 THR C O 1 ATOM 3344 C CB . THR C 1 5 ? 18.075 -11.095 -13.746 1.00 20.23 ? 5 THR C CB 1 ATOM 3345 O OG1 . THR C 1 5 ? 18.905 -10.000 -13.339 1.00 19.83 ? 5 THR C OG1 1 ATOM 3346 C CG2 . THR C 1 5 ? 18.625 -11.693 -15.035 1.00 19.53 ? 5 THR C CG2 1 ATOM 3347 N N . GLN C 1 6 ? 15.129 -11.581 -15.569 1.00 23.37 ? 6 GLN C N 1 ATOM 3348 C CA . GLN C 1 6 ? 14.335 -12.652 -16.161 1.00 23.49 ? 6 GLN C CA 1 ATOM 3349 C C . GLN C 1 6 ? 15.163 -13.400 -17.192 1.00 21.65 ? 6 GLN C C 1 ATOM 3350 O O . GLN C 1 6 ? 15.956 -12.805 -17.907 1.00 24.45 ? 6 GLN C O 1 ATOM 3351 C CB . GLN C 1 6 ? 13.049 -12.111 -16.797 1.00 17.06 ? 6 GLN C CB 1 ATOM 3352 C CG . GLN C 1 6 ? 12.085 -11.517 -15.788 1.00 21.35 ? 6 GLN C CG 1 ATOM 3353 C CD . GLN C 1 6 ? 10.760 -11.113 -16.412 1.00 27.33 ? 6 GLN C CD 1 ATOM 3354 O OE1 . GLN C 1 6 ? 10.406 -9.938 -16.430 1.00 14.18 ? 6 GLN C OE1 1 ATOM 3355 N NE2 . GLN C 1 6 ? 10.021 -12.089 -16.923 1.00 25.41 ? 6 GLN C NE2 1 ATOM 3356 N N . SER C 1 7 ? 14.997 -14.714 -17.246 1.00 21.17 ? 7 SER C N 1 ATOM 3357 C CA . SER C 1 7 ? 15.641 -15.503 -18.281 1.00 24.16 ? 7 SER C CA 1 ATOM 3358 C C . SER C 1 7 ? 14.725 -16.673 -18.618 1.00 24.22 ? 7 SER C C 1 ATOM 3359 O O . SER C 1 7 ? 13.956 -17.119 -17.768 1.00 25.49 ? 7 SER C O 1 ATOM 3360 C CB . SER C 1 7 ? 17.009 -16.000 -17.812 1.00 23.99 ? 7 SER C CB 1 ATOM 3361 O OG . SER C 1 7 ? 16.863 -17.090 -16.927 1.00 29.67 ? 7 SER C OG 1 ATOM 3362 N N . PRO C 1 8 ? 14.788 -17.166 -19.863 1.00 23.62 ? 8 PRO C N 1 ATOM 3363 C CA . PRO C 1 8 ? 15.639 -16.619 -20.919 1.00 26.78 ? 8 PRO C CA 1 ATOM 3364 C C . PRO C 1 8 ? 14.997 -15.378 -21.510 1.00 22.13 ? 8 PRO C C 1 ATOM 3365 O O . PRO C 1 8 ? 13.849 -15.079 -21.214 1.00 22.05 ? 8 PRO C O 1 ATOM 3366 C CB . PRO C 1 8 ? 15.658 -17.737 -21.951 1.00 21.46 ? 8 PRO C CB 1 ATOM 3367 C CG . PRO C 1 8 ? 14.338 -18.382 -21.804 1.00 21.91 ? 8 PRO C CG 1 ATOM 3368 C CD . PRO C 1 8 ? 14.001 -18.315 -20.340 1.00 19.48 ? 8 PRO C CD 1 ATOM 3369 N N . VAL C 1 9 ? 15.753 -14.644 -22.306 1.00 24.02 ? 9 VAL C N 1 ATOM 3370 C CA . VAL C 1 9 ? 15.225 -13.480 -22.989 1.00 27.13 ? 9 VAL C CA 1 ATOM 3371 C C . VAL C 1 9 ? 14.135 -13.920 -23.973 1.00 30.25 ? 9 VAL C C 1 ATOM 3372 O O . VAL C 1 9 ? 13.058 -13.316 -24.059 1.00 29.41 ? 9 VAL C O 1 ATOM 3373 C CB . VAL C 1 9 ? 16.355 -12.757 -23.729 1.00 29.59 ? 9 VAL C CB 1 ATOM 3374 C CG1 . VAL C 1 9 ? 15.794 -11.720 -24.677 1.00 25.98 ? 9 VAL C CG1 1 ATOM 3375 C CG2 . VAL C 1 9 ? 17.338 -12.152 -22.715 1.00 26.86 ? 9 VAL C CG2 1 ATOM 3376 N N . ILE C 1 10 ? 14.422 -14.989 -24.705 1.00 30.26 ? 10 ILE C N 1 ATOM 3377 C CA . ILE C 1 10 ? 13.457 -15.578 -25.622 1.00 29.77 ? 10 ILE C CA 1 ATOM 3378 C C . ILE C 1 10 ? 13.276 -17.045 -25.279 1.00 27.03 ? 10 ILE C C 1 ATOM 3379 O O . ILE C 1 10 ? 14.241 -17.793 -25.195 1.00 29.77 ? 10 ILE C O 1 ATOM 3380 C CB . ILE C 1 10 ? 13.921 -15.469 -27.077 1.00 29.48 ? 10 ILE C CB 1 ATOM 3381 C CG1 . ILE C 1 10 ? 13.999 -14.005 -27.505 1.00 29.87 ? 10 ILE C CG1 1 ATOM 3382 C CG2 . ILE C 1 10 ? 12.973 -16.218 -27.990 1.00 24.48 ? 10 ILE C CG2 1 ATOM 3383 C CD1 . ILE C 1 10 ? 14.097 -13.812 -29.026 1.00 31.54 ? 10 ILE C CD1 1 ATOM 3384 N N . LEU C 1 11 ? 12.033 -17.450 -25.062 1.00 30.98 ? 11 LEU C N 1 ATOM 3385 C CA . LEU C 1 11 ? 11.722 -18.830 -24.703 1.00 27.98 ? 11 LEU C CA 1 ATOM 3386 C C . LEU C 1 11 ? 10.938 -19.511 -25.830 1.00 25.71 ? 11 LEU C C 1 ATOM 3387 O O . LEU C 1 11 ? 9.751 -19.255 -26.034 1.00 30.17 ? 11 LEU C O 1 ATOM 3388 C CB . LEU C 1 11 ? 10.946 -18.864 -23.385 1.00 29.38 ? 11 LEU C CB 1 ATOM 3389 C CG . LEU C 1 11 ? 10.458 -20.190 -22.807 1.00 39.91 ? 11 LEU C CG 1 ATOM 3390 C CD1 . LEU C 1 11 ? 11.509 -21.268 -22.912 1.00 43.10 ? 11 LEU C CD1 1 ATOM 3391 C CD2 . LEU C 1 11 ? 10.076 -19.993 -21.349 1.00 45.27 ? 11 LEU C CD2 1 ATOM 3392 N N . SER C 1 12 ? 11.622 -20.369 -26.569 1.00 24.74 ? 12 SER C N 1 ATOM 3393 C CA . SER C 1 12 ? 11.021 -21.071 -27.689 1.00 33.83 ? 12 SER C CA 1 ATOM 3394 C C . SER C 1 12 ? 10.627 -22.485 -27.283 1.00 32.72 ? 12 SER C C 1 ATOM 3395 O O . SER C 1 12 ? 11.482 -23.290 -26.906 1.00 31.32 ? 12 SER C O 1 ATOM 3396 C CB . SER C 1 12 ? 11.998 -21.125 -28.866 1.00 28.27 ? 12 SER C CB 1 ATOM 3397 O OG . SER C 1 12 ? 11.359 -21.644 -30.012 1.00 38.07 ? 12 SER C OG 1 ATOM 3398 N N . VAL C 1 13 ? 9.335 -22.788 -27.366 1.00 27.36 ? 13 VAL C N 1 ATOM 3399 C CA . VAL C 1 13 ? 8.841 -24.100 -26.967 1.00 34.33 ? 13 VAL C CA 1 ATOM 3400 C C . VAL C 1 13 ? 7.884 -24.696 -27.982 1.00 30.38 ? 13 VAL C C 1 ATOM 3401 O O . VAL C 1 13 ? 7.406 -24.012 -28.880 1.00 43.37 ? 13 VAL C O 1 ATOM 3402 C CB . VAL C 1 13 ? 8.128 -24.058 -25.587 1.00 37.04 ? 13 VAL C CB 1 ATOM 3403 C CG1 . VAL C 1 13 ? 9.027 -23.420 -24.540 1.00 35.94 ? 13 VAL C CG1 1 ATOM 3404 C CG2 . VAL C 1 13 ? 6.812 -23.306 -25.684 1.00 40.08 ? 13 VAL C CG2 1 ATOM 3405 N N . SER C 1 14 ? 7.608 -25.984 -27.813 1.00 35.06 ? 14 SER C N 1 ATOM 3406 C CA . SER C 1 14 ? 6.617 -26.691 -28.608 1.00 36.42 ? 14 SER C CA 1 ATOM 3407 C C . SER C 1 14 ? 5.308 -26.772 -27.824 1.00 35.51 ? 14 SER C C 1 ATOM 3408 O O . SER C 1 14 ? 5.325 -26.864 -26.602 1.00 39.96 ? 14 SER C O 1 ATOM 3409 C CB . SER C 1 14 ? 7.121 -28.097 -28.937 1.00 43.02 ? 14 SER C CB 1 ATOM 3410 O OG . SER C 1 14 ? 8.372 -28.047 -29.601 1.00 45.06 ? 14 SER C OG 1 ATOM 3411 N N . PRO C 1 15 ? 4.166 -26.745 -28.524 1.00 34.78 ? 15 PRO C N 1 ATOM 3412 C CA . PRO C 1 15 ? 2.875 -26.789 -27.828 1.00 34.70 ? 15 PRO C CA 1 ATOM 3413 C C . PRO C 1 15 ? 2.696 -28.099 -27.074 1.00 37.94 ? 15 PRO C C 1 ATOM 3414 O O . PRO C 1 15 ? 3.206 -29.129 -27.515 1.00 38.72 ? 15 PRO C O 1 ATOM 3415 C CB . PRO C 1 15 ? 1.854 -26.680 -28.973 1.00 38.63 ? 15 PRO C CB 1 ATOM 3416 C CG . PRO C 1 15 ? 2.586 -27.151 -30.190 1.00 38.05 ? 15 PRO C CG 1 ATOM 3417 C CD . PRO C 1 15 ? 4.017 -26.743 -29.992 1.00 39.22 ? 15 PRO C CD 1 ATOM 3418 N N . GLY C 1 16 ? 1.987 -28.051 -25.949 1.00 36.67 ? 16 GLY C N 1 ATOM 3419 C CA . GLY C 1 16 ? 1.781 -29.220 -25.116 1.00 37.75 ? 16 GLY C CA 1 ATOM 3420 C C . GLY C 1 16 ? 2.864 -29.379 -24.069 1.00 36.75 ? 16 GLY C C 1 ATOM 3421 O O . GLY C 1 16 ? 2.689 -30.078 -23.077 1.00 37.82 ? 16 GLY C O 1 ATOM 3422 N N . GLU C 1 17 ? 3.999 -28.728 -24.280 1.00 35.53 ? 17 GLU C N 1 ATOM 3423 C CA . GLU C 1 17 ? 5.100 -28.846 -23.342 1.00 34.26 ? 17 GLU C CA 1 ATOM 3424 C C . GLU C 1 17 ? 4.858 -28.051 -22.061 1.00 36.53 ? 17 GLU C C 1 ATOM 3425 O O . GLU C 1 17 ? 4.024 -27.142 -22.021 1.00 30.52 ? 17 GLU C O 1 ATOM 3426 C CB . GLU C 1 17 ? 6.396 -28.388 -23.996 1.00 33.45 ? 17 GLU C CB 1 ATOM 3427 C CG . GLU C 1 17 ? 6.929 -29.340 -25.031 1.00 49.32 ? 17 GLU C CG 1 ATOM 3428 C CD . GLU C 1 17 ? 8.233 -28.859 -25.628 1.00 56.31 ? 17 GLU C CD 1 ATOM 3429 O OE1 . GLU C 1 17 ? 8.481 -27.631 -25.606 1.00 51.97 ? 17 GLU C OE1 1 ATOM 3430 O OE2 . GLU C 1 17 ? 9.013 -29.708 -26.109 1.00 65.16 ? 17 GLU C OE2 1 ATOM 3431 N N . ARG C 1 18 ? 5.594 -28.406 -21.013 1.00 35.87 ? 18 ARG C N 1 ATOM 3432 C CA . ARG C 1 18 ? 5.572 -27.642 -19.776 1.00 31.42 ? 18 ARG C CA 1 ATOM 3433 C C . ARG C 1 18 ? 6.639 -26.565 -19.878 1.00 29.16 ? 18 ARG C C 1 ATOM 3434 O O . ARG C 1 18 ? 7.770 -26.835 -20.263 1.00 39.53 ? 18 ARG C O 1 ATOM 3435 C CB . ARG C 1 18 ? 5.802 -28.545 -18.562 1.00 37.01 ? 18 ARG C CB 1 ATOM 3436 C CG . ARG C 1 18 ? 5.770 -27.809 -17.211 1.00 48.27 ? 18 ARG C CG 1 ATOM 3437 C CD . ARG C 1 18 ? 5.665 -28.767 -16.011 1.00 57.08 ? 18 ARG C CD 1 ATOM 3438 N NE . ARG C 1 18 ? 4.382 -29.476 -15.964 1.00 70.19 ? 18 ARG C NE 1 ATOM 3439 C CZ . ARG C 1 18 ? 4.178 -30.713 -16.423 1.00 76.10 ? 18 ARG C CZ 1 ATOM 3440 N NH1 . ARG C 1 18 ? 5.175 -31.408 -16.965 1.00 73.43 ? 18 ARG C NH1 1 ATOM 3441 N NH2 . ARG C 1 18 ? 2.971 -31.262 -16.337 1.00 78.95 ? 18 ARG C NH2 1 ATOM 3442 N N . VAL C 1 19 ? 6.264 -25.342 -19.541 1.00 28.51 ? 19 VAL C N 1 ATOM 3443 C CA . VAL C 1 19 ? 7.100 -24.171 -19.772 1.00 23.69 ? 19 VAL C CA 1 ATOM 3444 C C . VAL C 1 19 ? 7.480 -23.475 -18.456 1.00 25.74 ? 19 VAL C C 1 ATOM 3445 O O . VAL C 1 19 ? 6.638 -23.302 -17.565 1.00 27.77 ? 19 VAL C O 1 ATOM 3446 C CB . VAL C 1 19 ? 6.344 -23.194 -20.687 1.00 26.93 ? 19 VAL C CB 1 ATOM 3447 C CG1 . VAL C 1 19 ? 6.984 -21.826 -20.691 1.00 25.46 ? 19 VAL C CG1 1 ATOM 3448 C CG2 . VAL C 1 19 ? 6.261 -23.764 -22.087 1.00 35.39 ? 19 VAL C CG2 1 ATOM 3449 N N . SER C 1 20 ? 8.743 -23.074 -18.329 1.00 24.38 ? 20 SER C N 1 ATOM 3450 C CA . SER C 1 20 ? 9.195 -22.411 -17.106 1.00 26.75 ? 20 SER C CA 1 ATOM 3451 C C . SER C 1 20 ? 9.930 -21.104 -17.350 1.00 27.50 ? 20 SER C C 1 ATOM 3452 O O . SER C 1 20 ? 10.916 -21.068 -18.084 1.00 36.92 ? 20 SER C O 1 ATOM 3453 C CB . SER C 1 20 ? 10.073 -23.351 -16.288 1.00 27.55 ? 20 SER C CB 1 ATOM 3454 O OG . SER C 1 20 ? 9.280 -24.371 -15.706 1.00 37.56 ? 20 SER C OG 1 ATOM 3455 N N . PHE C 1 21 ? 9.452 -20.035 -16.717 1.00 25.32 ? 21 PHE C N 1 ATOM 3456 C CA . PHE C 1 21 ? 10.089 -18.719 -16.814 1.00 23.03 ? 21 PHE C CA 1 ATOM 3457 C C . PHE C 1 21 ? 10.828 -18.404 -15.520 1.00 26.34 ? 21 PHE C C 1 ATOM 3458 O O . PHE C 1 21 ? 10.283 -18.564 -14.425 1.00 28.13 ? 21 PHE C O 1 ATOM 3459 C CB . PHE C 1 21 ? 9.057 -17.610 -17.023 1.00 22.16 ? 21 PHE C CB 1 ATOM 3460 C CG . PHE C 1 21 ? 8.139 -17.815 -18.195 1.00 19.80 ? 21 PHE C CG 1 ATOM 3461 C CD1 . PHE C 1 21 ? 8.476 -17.339 -19.444 1.00 21.25 ? 21 PHE C CD1 1 ATOM 3462 C CD2 . PHE C 1 21 ? 6.914 -18.430 -18.033 1.00 22.14 ? 21 PHE C CD2 1 ATOM 3463 C CE1 . PHE C 1 21 ? 7.620 -17.492 -20.517 1.00 25.19 ? 21 PHE C CE1 1 ATOM 3464 C CE2 . PHE C 1 21 ? 6.051 -18.588 -19.105 1.00 24.62 ? 21 PHE C CE2 1 ATOM 3465 C CZ . PHE C 1 21 ? 6.405 -18.115 -20.347 1.00 23.97 ? 21 PHE C CZ 1 ATOM 3466 N N . SER C 1 22 ? 12.053 -17.918 -15.633 1.00 25.73 ? 22 SER C N 1 ATOM 3467 C CA . SER C 1 22 ? 12.827 -17.616 -14.437 1.00 21.20 ? 22 SER C CA 1 ATOM 3468 C C . SER C 1 22 ? 12.890 -16.114 -14.130 1.00 18.88 ? 22 SER C C 1 ATOM 3469 O O . SER C 1 22 ? 13.068 -15.291 -15.030 1.00 20.66 ? 22 SER C O 1 ATOM 3470 C CB . SER C 1 22 ? 14.226 -18.229 -14.547 1.00 20.86 ? 22 SER C CB 1 ATOM 3471 O OG . SER C 1 22 ? 15.101 -17.607 -13.637 1.00 29.65 ? 22 SER C OG 1 ATOM 3472 N N . CYS C 1 23 ? 12.715 -15.772 -12.854 1.00 16.01 ? 23 CYS C N 1 ATOM 3473 C CA . CYS C 1 23 ? 12.875 -14.395 -12.378 1.00 21.56 ? 23 CYS C CA 1 ATOM 3474 C C . CYS C 1 23 ? 13.755 -14.391 -11.118 1.00 27.04 ? 23 CYS C C 1 ATOM 3475 O O . CYS C 1 23 ? 13.363 -14.935 -10.082 1.00 24.16 ? 23 CYS C O 1 ATOM 3476 C CB . CYS C 1 23 ? 11.515 -13.736 -12.090 1.00 20.34 ? 23 CYS C CB 1 ATOM 3477 S SG . CYS C 1 23 ? 11.580 -12.018 -11.443 1.00 33.36 ? 23 CYS C SG 1 ATOM 3478 N N . ARG C 1 24 ? 14.946 -13.803 -11.225 1.00 23.52 ? 24 ARG C N 1 ATOM 3479 C CA . ARG C 1 24 ? 15.877 -13.733 -10.109 1.00 22.75 ? 24 ARG C CA 1 ATOM 3480 C C . ARG C 1 24 ? 15.943 -12.317 -9.541 1.00 24.14 ? 24 ARG C C 1 ATOM 3481 O O . ARG C 1 24 ? 16.154 -11.347 -10.278 1.00 17.76 ? 24 ARG C O 1 ATOM 3482 C CB . ARG C 1 24 ? 17.269 -14.189 -10.547 1.00 18.29 ? 24 ARG C CB 1 ATOM 3483 N N . ALA C 1 25 ? 15.760 -12.194 -8.230 1.00 22.19 ? 25 ALA C N 1 ATOM 3484 C CA . ALA C 1 25 ? 15.869 -10.889 -7.580 1.00 25.70 ? 25 ALA C CA 1 ATOM 3485 C C . ALA C 1 25 ? 17.287 -10.614 -7.075 1.00 30.84 ? 25 ALA C C 1 ATOM 3486 O O . ALA C 1 25 ? 17.973 -11.518 -6.605 1.00 30.93 ? 25 ALA C O 1 ATOM 3487 C CB . ALA C 1 25 ? 14.865 -10.764 -6.453 1.00 20.28 ? 25 ALA C CB 1 ATOM 3488 N N . SER C 1 26 ? 17.711 -9.357 -7.166 1.00 30.30 ? 26 SER C N 1 ATOM 3489 C CA . SER C 1 26 ? 19.075 -8.974 -6.804 1.00 32.42 ? 26 SER C CA 1 ATOM 3490 C C . SER C 1 26 ? 19.348 -9.073 -5.302 1.00 39.88 ? 26 SER C C 1 ATOM 3491 O O . SER C 1 26 ? 20.501 -9.011 -4.869 1.00 42.81 ? 26 SER C O 1 ATOM 3492 C CB . SER C 1 26 ? 19.402 -7.573 -7.327 1.00 28.81 ? 26 SER C CB 1 ATOM 3493 O OG . SER C 1 26 ? 18.441 -6.624 -6.911 1.00 34.24 ? 26 SER C OG 1 ATOM 3494 N N . GLN C 1 27 ? 18.282 -9.222 -4.517 1.00 36.50 ? 27 GLN C N 1 ATOM 3495 C CA . GLN C 1 27 ? 18.390 -9.557 -3.100 1.00 34.01 ? 27 GLN C CA 1 ATOM 3496 C C . GLN C 1 27 ? 17.076 -10.188 -2.666 1.00 32.90 ? 27 GLN C C 1 ATOM 3497 O O . GLN C 1 27 ? 16.093 -10.133 -3.399 1.00 35.84 ? 27 GLN C O 1 ATOM 3498 C CB . GLN C 1 27 ? 18.676 -8.317 -2.261 1.00 36.41 ? 27 GLN C CB 1 ATOM 3499 C CG . GLN C 1 27 ? 17.437 -7.528 -1.925 1.00 42.83 ? 27 GLN C CG 1 ATOM 3500 C CD . GLN C 1 27 ? 17.748 -6.192 -1.284 1.00 52.71 ? 27 GLN C CD 1 ATOM 3501 O OE1 . GLN C 1 27 ? 18.630 -5.460 -1.738 1.00 52.76 ? 27 GLN C OE1 1 ATOM 3502 N NE2 . GLN C 1 27 ? 17.021 -5.866 -0.220 1.00 59.30 ? 27 GLN C NE2 1 ATOM 3503 N N . SER C 1 28 ? 17.050 -10.783 -1.482 1.00 33.02 ? 28 SER C N 1 ATOM 3504 C CA . SER C 1 28 ? 15.849 -11.471 -1.015 1.00 30.27 ? 28 SER C CA 1 ATOM 3505 C C . SER C 1 28 ? 14.594 -10.595 -0.968 1.00 29.94 ? 28 SER C C 1 ATOM 3506 O O . SER C 1 28 ? 14.640 -9.420 -0.599 1.00 30.58 ? 28 SER C O 1 ATOM 3507 C CB . SER C 1 28 ? 16.075 -12.118 0.346 1.00 34.42 ? 28 SER C CB 1 ATOM 3508 O OG . SER C 1 28 ? 14.922 -12.862 0.714 1.00 40.18 ? 28 SER C OG 1 ATOM 3509 N N . ILE C 1 29 ? 13.471 -11.184 -1.365 1.00 30.69 ? 29 ILE C N 1 ATOM 3510 C CA . ILE C 1 29 ? 12.204 -10.476 -1.395 1.00 25.58 ? 29 ILE C CA 1 ATOM 3511 C C . ILE C 1 29 ? 11.046 -11.322 -0.867 1.00 23.74 ? 29 ILE C C 1 ATOM 3512 O O . ILE C 1 29 ? 9.893 -11.039 -1.183 1.00 27.21 ? 29 ILE C O 1 ATOM 3513 C CB . ILE C 1 29 ? 11.851 -9.973 -2.820 1.00 23.17 ? 29 ILE C CB 1 ATOM 3514 C CG1 . ILE C 1 29 ? 11.850 -11.121 -3.820 1.00 21.94 ? 29 ILE C CG1 1 ATOM 3515 C CG2 . ILE C 1 29 ? 12.803 -8.891 -3.276 1.00 23.64 ? 29 ILE C CG2 1 ATOM 3516 C CD1 . ILE C 1 29 ? 11.297 -10.737 -5.168 1.00 21.97 ? 29 ILE C CD1 1 ATOM 3517 N N . GLY C 1 30 ? 11.353 -12.335 -0.054 1.00 20.83 ? 30 GLY C N 1 ATOM 3518 C CA . GLY C 1 30 ? 10.344 -13.226 0.492 1.00 21.55 ? 30 GLY C CA 1 ATOM 3519 C C . GLY C 1 30 ? 9.550 -13.906 -0.605 1.00 28.43 ? 30 GLY C C 1 ATOM 3520 O O . GLY C 1 30 ? 10.120 -14.598 -1.462 1.00 26.23 ? 30 GLY C O 1 ATOM 3521 N N . THR C 1 31 ? 8.236 -13.702 -0.602 1.00 20.46 ? 31 THR C N 1 ATOM 3522 C CA . THR C 1 31 ? 7.411 -14.159 -1.723 1.00 25.68 ? 31 THR C CA 1 ATOM 3523 C C . THR C 1 31 ? 6.677 -13.008 -2.405 1.00 25.90 ? 31 THR C C 1 ATOM 3524 O O . THR C 1 31 ? 5.633 -13.212 -3.026 1.00 24.15 ? 31 THR C O 1 ATOM 3525 C CB . THR C 1 31 ? 6.381 -15.234 -1.304 1.00 30.51 ? 31 THR C CB 1 ATOM 3526 O OG1 . THR C 1 31 ? 5.520 -14.713 -0.272 1.00 24.69 ? 31 THR C OG1 1 ATOM 3527 C CG2 . THR C 1 31 ? 7.092 -16.518 -0.821 1.00 25.47 ? 31 THR C CG2 1 ATOM 3528 N N . ASN C 1 32 ? 7.229 -11.802 -2.300 1.00 22.12 ? 32 ASN C N 1 ATOM 3529 C CA . ASN C 1 32 ? 6.567 -10.616 -2.831 1.00 23.81 ? 32 ASN C CA 1 ATOM 3530 C C . ASN C 1 32 ? 6.772 -10.398 -4.336 1.00 20.76 ? 32 ASN C C 1 ATOM 3531 O O . ASN C 1 32 ? 7.331 -9.383 -4.758 1.00 19.60 ? 32 ASN C O 1 ATOM 3532 C CB . ASN C 1 32 ? 6.987 -9.380 -2.040 1.00 20.52 ? 32 ASN C CB 1 ATOM 3533 C CG . ASN C 1 32 ? 5.837 -8.408 -1.824 1.00 27.99 ? 32 ASN C CG 1 ATOM 3534 O OD1 . ASN C 1 32 ? 5.161 -7.996 -2.773 1.00 30.65 ? 32 ASN C OD1 1 ATOM 3535 N ND2 . ASN C 1 32 ? 5.608 -8.036 -0.566 1.00 28.68 ? 32 ASN C ND2 1 ATOM 3536 N N . ILE C 1 33 ? 6.298 -11.343 -5.141 1.00 19.02 ? 33 ILE C N 1 ATOM 3537 C CA . ILE C 1 33 ? 6.481 -11.266 -6.586 1.00 20.46 ? 33 ILE C CA 1 ATOM 3538 C C . ILE C 1 33 ? 5.164 -11.504 -7.320 1.00 19.80 ? 33 ILE C C 1 ATOM 3539 O O . ILE C 1 33 ? 4.374 -12.355 -6.924 1.00 15.92 ? 33 ILE C O 1 ATOM 3540 C CB . ILE C 1 33 ? 7.555 -12.268 -7.060 1.00 29.11 ? 33 ILE C CB 1 ATOM 3541 C CG1 . ILE C 1 33 ? 7.880 -12.077 -8.536 1.00 36.20 ? 33 ILE C CG1 1 ATOM 3542 C CG2 . ILE C 1 33 ? 7.118 -13.679 -6.813 1.00 33.66 ? 33 ILE C CG2 1 ATOM 3543 C CD1 . ILE C 1 33 ? 9.178 -11.341 -8.753 1.00 42.31 ? 33 ILE C CD1 1 ATOM 3544 N N . HIS C 1 34 ? 4.912 -10.730 -8.374 1.00 19.56 ? 34 HIS C N 1 ATOM 3545 C CA . HIS C 1 34 ? 3.688 -10.892 -9.158 1.00 18.06 ? 34 HIS C CA 1 ATOM 3546 C C . HIS C 1 34 ? 4.030 -11.075 -10.628 1.00 19.46 ? 34 HIS C C 1 ATOM 3547 O O . HIS C 1 34 ? 5.023 -10.533 -11.110 1.00 20.26 ? 34 HIS C O 1 ATOM 3548 C CB . HIS C 1 34 ? 2.758 -9.688 -8.984 1.00 17.13 ? 34 HIS C CB 1 ATOM 3549 C CG . HIS C 1 34 ? 2.573 -9.267 -7.556 1.00 21.77 ? 34 HIS C CG 1 ATOM 3550 N ND1 . HIS C 1 34 ? 2.152 -10.133 -6.572 1.00 19.60 ? 34 HIS C ND1 1 ATOM 3551 C CD2 . HIS C 1 34 ? 2.747 -8.068 -6.952 1.00 29.15 ? 34 HIS C CD2 1 ATOM 3552 C CE1 . HIS C 1 34 ? 2.080 -9.488 -5.421 1.00 31.40 ? 34 HIS C CE1 1 ATOM 3553 N NE2 . HIS C 1 34 ? 2.433 -8.233 -5.626 1.00 33.67 ? 34 HIS C NE2 1 ATOM 3554 N N . TRP C 1 35 ? 3.200 -11.833 -11.337 1.00 20.74 ? 35 TRP C N 1 ATOM 3555 C CA . TRP C 1 35 ? 3.452 -12.142 -12.735 1.00 16.95 ? 35 TRP C CA 1 ATOM 3556 C C . TRP C 1 35 ? 2.350 -11.613 -13.658 1.00 16.38 ? 35 TRP C C 1 ATOM 3557 O O . TRP C 1 35 ? 1.159 -11.654 -13.318 1.00 17.86 ? 35 TRP C O 1 ATOM 3558 C CB . TRP C 1 35 ? 3.595 -13.649 -12.926 1.00 18.22 ? 35 TRP C CB 1 ATOM 3559 C CG . TRP C 1 35 ? 4.830 -14.254 -12.326 1.00 22.91 ? 35 TRP C CG 1 ATOM 3560 C CD1 . TRP C 1 35 ? 4.970 -14.770 -11.067 1.00 23.01 ? 35 TRP C CD1 1 ATOM 3561 C CD2 . TRP C 1 35 ? 6.095 -14.432 -12.974 1.00 23.98 ? 35 TRP C CD2 1 ATOM 3562 N NE1 . TRP C 1 35 ? 6.245 -15.255 -10.893 1.00 20.51 ? 35 TRP C NE1 1 ATOM 3563 C CE2 . TRP C 1 35 ? 6.956 -15.055 -12.045 1.00 18.91 ? 35 TRP C CE2 1 ATOM 3564 C CE3 . TRP C 1 35 ? 6.583 -14.121 -14.250 1.00 16.99 ? 35 TRP C CE3 1 ATOM 3565 C CZ2 . TRP C 1 35 ? 8.270 -15.374 -12.350 1.00 23.11 ? 35 TRP C CZ2 1 ATOM 3566 C CZ3 . TRP C 1 35 ? 7.883 -14.433 -14.552 1.00 16.51 ? 35 TRP C CZ3 1 ATOM 3567 C CH2 . TRP C 1 35 ? 8.717 -15.054 -13.609 1.00 23.20 ? 35 TRP C CH2 1 ATOM 3568 N N . TYR C 1 36 ? 2.764 -11.148 -14.838 1.00 14.97 ? 36 TYR C N 1 ATOM 3569 C CA . TYR C 1 36 ? 1.852 -10.583 -15.821 1.00 15.84 ? 36 TYR C CA 1 ATOM 3570 C C . TYR C 1 36 ? 2.075 -11.139 -17.213 1.00 19.51 ? 36 TYR C C 1 ATOM 3571 O O . TYR C 1 36 ? 3.195 -11.476 -17.615 1.00 18.30 ? 36 TYR C O 1 ATOM 3572 C CB . TYR C 1 36 ? 2.010 -9.066 -15.905 1.00 16.25 ? 36 TYR C CB 1 ATOM 3573 C CG . TYR C 1 36 ? 1.740 -8.338 -14.623 1.00 22.51 ? 36 TYR C CG 1 ATOM 3574 C CD1 . TYR C 1 36 ? 2.751 -8.150 -13.687 1.00 21.18 ? 36 TYR C CD1 1 ATOM 3575 C CD2 . TYR C 1 36 ? 0.476 -7.833 -14.343 1.00 17.86 ? 36 TYR C CD2 1 ATOM 3576 C CE1 . TYR C 1 36 ? 2.509 -7.488 -12.513 1.00 22.13 ? 36 TYR C CE1 1 ATOM 3577 C CE2 . TYR C 1 36 ? 0.225 -7.159 -13.168 1.00 19.85 ? 36 TYR C CE2 1 ATOM 3578 C CZ . TYR C 1 36 ? 1.245 -6.990 -12.253 1.00 19.37 ? 36 TYR C CZ 1 ATOM 3579 O OH . TYR C 1 36 ? 1.007 -6.313 -11.077 1.00 19.81 ? 36 TYR C OH 1 ATOM 3580 N N . GLN C 1 37 ? 0.992 -11.202 -17.968 1.00 22.52 ? 37 GLN C N 1 ATOM 3581 C CA . GLN C 1 37 ? 1.075 -11.586 -19.355 1.00 22.42 ? 37 GLN C CA 1 ATOM 3582 C C . GLN C 1 37 ? 0.738 -10.362 -20.184 1.00 26.97 ? 37 GLN C C 1 ATOM 3583 O O . GLN C 1 37 ? -0.187 -9.626 -19.847 1.00 32.58 ? 37 GLN C O 1 ATOM 3584 C CB . GLN C 1 37 ? 0.070 -12.688 -19.633 1.00 19.49 ? 37 GLN C CB 1 ATOM 3585 C CG . GLN C 1 37 ? 0.014 -13.130 -21.074 1.00 19.30 ? 37 GLN C CG 1 ATOM 3586 C CD . GLN C 1 37 ? -1.208 -13.964 -21.330 1.00 24.75 ? 37 GLN C CD 1 ATOM 3587 O OE1 . GLN C 1 37 ? -2.325 -13.450 -21.308 1.00 21.74 ? 37 GLN C OE1 1 ATOM 3588 N NE2 . GLN C 1 37 ? -1.014 -15.268 -21.533 1.00 20.78 ? 37 GLN C NE2 1 ATOM 3589 N N . GLN C 1 38 ? 1.498 -10.116 -21.245 1.00 22.62 ? 38 GLN C N 1 ATOM 3590 C CA . GLN C 1 38 ? 1.113 -9.079 -22.189 1.00 24.34 ? 38 GLN C CA 1 ATOM 3591 C C . GLN C 1 38 ? 1.030 -9.640 -23.611 1.00 27.33 ? 38 GLN C C 1 ATOM 3592 O O . GLN C 1 38 ? 2.040 -10.028 -24.204 1.00 27.50 ? 38 GLN C O 1 ATOM 3593 C CB . GLN C 1 38 ? 2.040 -7.858 -22.121 1.00 22.87 ? 38 GLN C CB 1 ATOM 3594 C CG . GLN C 1 38 ? 1.609 -6.738 -23.065 1.00 27.00 ? 38 GLN C CG 1 ATOM 3595 C CD . GLN C 1 38 ? 2.322 -5.421 -22.805 1.00 32.03 ? 38 GLN C CD 1 ATOM 3596 O OE1 . GLN C 1 38 ? 3.544 -5.374 -22.675 1.00 32.79 ? 38 GLN C OE1 1 ATOM 3597 N NE2 . GLN C 1 38 ? 1.556 -4.341 -22.743 1.00 24.11 ? 38 GLN C NE2 1 ATOM 3598 N N . ARG C 1 39 ? -0.190 -9.697 -24.137 1.00 17.45 ? 39 ARG C N 1 ATOM 3599 C CA . ARG C 1 39 ? -0.419 -10.150 -25.503 1.00 19.64 ? 39 ARG C CA 1 ATOM 3600 C C . ARG C 1 39 ? -0.348 -8.971 -26.466 1.00 18.97 ? 39 ARG C C 1 ATOM 3601 O O . ARG C 1 39 ? -0.448 -7.818 -26.055 1.00 24.72 ? 39 ARG C O 1 ATOM 3602 C CB . ARG C 1 39 ? -1.783 -10.816 -25.627 1.00 20.59 ? 39 ARG C CB 1 ATOM 3603 C CG . ARG C 1 39 ? -1.940 -12.114 -24.863 1.00 29.19 ? 39 ARG C CG 1 ATOM 3604 C CD . ARG C 1 39 ? -3.414 -12.506 -24.791 1.00 30.90 ? 39 ARG C CD 1 ATOM 3605 N NE . ARG C 1 39 ? -3.602 -13.850 -24.272 1.00 45.57 ? 39 ARG C NE 1 ATOM 3606 C CZ . ARG C 1 39 ? -4.789 -14.404 -24.044 1.00 57.31 ? 39 ARG C CZ 1 ATOM 3607 N NH1 . ARG C 1 39 ? -5.898 -13.720 -24.289 1.00 61.65 ? 39 ARG C NH1 1 ATOM 3608 N NH2 . ARG C 1 39 ? -4.868 -15.644 -23.569 1.00 57.08 ? 39 ARG C NH2 1 ATOM 3609 N N . THR C 1 40 ? -0.210 -9.273 -27.751 1.00 20.04 ? 40 THR C N 1 ATOM 3610 C CA . THR C 1 40 ? -0.101 -8.246 -28.786 1.00 24.70 ? 40 THR C CA 1 ATOM 3611 C C . THR C 1 40 ? -1.199 -7.176 -28.683 1.00 26.60 ? 40 THR C C 1 ATOM 3612 O O . THR C 1 40 ? -2.384 -7.502 -28.598 1.00 22.54 ? 40 THR C O 1 ATOM 3613 C CB . THR C 1 40 ? -0.093 -8.895 -30.188 1.00 25.91 ? 40 THR C CB 1 ATOM 3614 O OG1 . THR C 1 40 ? 0.985 -9.843 -30.267 1.00 25.46 ? 40 THR C OG1 1 ATOM 3615 C CG2 . THR C 1 40 ? 0.074 -7.840 -31.275 1.00 22.67 ? 40 THR C CG2 1 ATOM 3616 N N . ASN C 1 41 ? -0.782 -5.909 -28.660 1.00 22.14 ? 41 ASN C N 1 ATOM 3617 C CA . ASN C 1 41 ? -1.679 -4.749 -28.504 1.00 22.48 ? 41 ASN C CA 1 ATOM 3618 C C . ASN C 1 41 ? -2.400 -4.604 -27.156 1.00 28.21 ? 41 ASN C C 1 ATOM 3619 O O . ASN C 1 41 ? -3.116 -3.627 -26.942 1.00 34.99 ? 41 ASN C O 1 ATOM 3620 C CB . ASN C 1 41 ? -2.713 -4.668 -29.630 1.00 27.68 ? 41 ASN C CB 1 ATOM 3621 C CG . ASN C 1 41 ? -2.083 -4.621 -31.006 1.00 33.62 ? 41 ASN C CG 1 ATOM 3622 O OD1 . ASN C 1 41 ? -2.453 -5.396 -31.894 1.00 37.02 ? 41 ASN C OD1 1 ATOM 3623 N ND2 . ASN C 1 41 ? -1.125 -3.717 -31.192 1.00 30.57 ? 41 ASN C ND2 1 ATOM 3624 N N . GLY C 1 42 ? -2.219 -5.555 -26.248 1.00 26.26 ? 42 GLY C N 1 ATOM 3625 C CA . GLY C 1 42 ? -2.940 -5.509 -24.989 1.00 25.53 ? 42 GLY C CA 1 ATOM 3626 C C . GLY C 1 42 ? -2.241 -4.796 -23.842 1.00 25.30 ? 42 GLY C C 1 ATOM 3627 O O . GLY C 1 42 ? -1.089 -4.382 -23.950 1.00 24.96 ? 42 GLY C O 1 ATOM 3628 N N . SER C 1 43 ? -2.954 -4.648 -22.731 1.00 25.91 ? 43 SER C N 1 ATOM 3629 C CA . SER C 1 43 ? -2.360 -4.147 -21.501 1.00 21.77 ? 43 SER C CA 1 ATOM 3630 C C . SER C 1 43 ? -1.920 -5.378 -20.711 1.00 26.66 ? 43 SER C C 1 ATOM 3631 O O . SER C 1 43 ? -2.400 -6.475 -20.975 1.00 25.63 ? 43 SER C O 1 ATOM 3632 C CB . SER C 1 43 ? -3.388 -3.318 -20.727 1.00 17.51 ? 43 SER C CB 1 ATOM 3633 O OG . SER C 1 43 ? -3.806 -2.179 -21.471 1.00 21.34 ? 43 SER C OG 1 ATOM 3634 N N . PRO C 1 44 ? -0.983 -5.215 -19.766 1.00 26.58 ? 44 PRO C N 1 ATOM 3635 C CA . PRO C 1 44 ? -0.567 -6.367 -18.967 1.00 18.78 ? 44 PRO C CA 1 ATOM 3636 C C . PRO C 1 44 ? -1.753 -6.965 -18.229 1.00 26.56 ? 44 PRO C C 1 ATOM 3637 O O . PRO C 1 44 ? -2.681 -6.240 -17.865 1.00 26.26 ? 44 PRO C O 1 ATOM 3638 C CB . PRO C 1 44 ? 0.420 -5.760 -17.975 1.00 13.95 ? 44 PRO C CB 1 ATOM 3639 C CG . PRO C 1 44 ? 0.983 -4.588 -18.695 1.00 23.84 ? 44 PRO C CG 1 ATOM 3640 C CD . PRO C 1 44 ? -0.166 -4.024 -19.482 1.00 30.00 ? 44 PRO C CD 1 ATOM 3641 N N . ARG C 1 45 ? -1.722 -8.281 -18.045 1.00 20.77 ? 45 ARG C N 1 ATOM 3642 C CA . ARG C 1 45 ? -2.786 -9.011 -17.385 1.00 19.51 ? 45 ARG C CA 1 ATOM 3643 C C . ARG C 1 45 ? -2.156 -9.811 -16.251 1.00 28.69 ? 45 ARG C C 1 ATOM 3644 O O . ARG C 1 45 ? -1.199 -10.559 -16.462 1.00 27.59 ? 45 ARG C O 1 ATOM 3645 C CB . ARG C 1 45 ? -3.501 -9.937 -18.383 1.00 23.32 ? 45 ARG C CB 1 ATOM 3646 C CG . ARG C 1 45 ? -4.382 -11.007 -17.718 1.00 38.20 ? 45 ARG C CG 1 ATOM 3647 C CD . ARG C 1 45 ? -5.339 -11.700 -18.698 1.00 48.07 ? 45 ARG C CD 1 ATOM 3648 N NE . ARG C 1 45 ? -4.810 -12.949 -19.257 1.00 49.55 ? 45 ARG C NE 1 ATOM 3649 C CZ . ARG C 1 45 ? -5.547 -14.033 -19.502 1.00 46.49 ? 45 ARG C CZ 1 ATOM 3650 N NH1 . ARG C 1 45 ? -6.846 -14.030 -19.225 1.00 51.44 ? 45 ARG C NH1 1 ATOM 3651 N NH2 . ARG C 1 45 ? -4.991 -15.124 -20.015 1.00 43.12 ? 45 ARG C NH2 1 ATOM 3652 N N . LEU C 1 46 ? -2.685 -9.644 -15.045 1.00 25.89 ? 46 LEU C N 1 ATOM 3653 C CA . LEU C 1 46 ? -2.137 -10.301 -13.867 1.00 23.02 ? 46 LEU C CA 1 ATOM 3654 C C . LEU C 1 46 ? -2.421 -11.808 -13.893 1.00 23.96 ? 46 LEU C C 1 ATOM 3655 O O . LEU C 1 46 ? -3.558 -12.231 -14.100 1.00 26.94 ? 46 LEU C O 1 ATOM 3656 C CB . LEU C 1 46 ? -2.727 -9.658 -12.609 1.00 18.40 ? 46 LEU C CB 1 ATOM 3657 C CG . LEU C 1 46 ? -2.335 -10.170 -11.223 1.00 25.43 ? 46 LEU C CG 1 ATOM 3658 C CD1 . LEU C 1 46 ? -0.875 -9.835 -10.911 1.00 15.45 ? 46 LEU C CD1 1 ATOM 3659 C CD2 . LEU C 1 46 ? -3.277 -9.586 -10.167 1.00 17.36 ? 46 LEU C CD2 1 ATOM 3660 N N . LEU C 1 47 ? -1.384 -12.613 -13.673 1.00 23.16 ? 47 LEU C N 1 ATOM 3661 C CA . LEU C 1 47 ? -1.515 -14.069 -13.697 1.00 27.00 ? 47 LEU C CA 1 ATOM 3662 C C . LEU C 1 47 ? -1.402 -14.703 -12.317 1.00 34.16 ? 47 LEU C C 1 ATOM 3663 O O . LEU C 1 47 ? -2.139 -15.633 -11.978 1.00 31.70 ? 47 LEU C O 1 ATOM 3664 C CB . LEU C 1 47 ? -0.400 -14.665 -14.540 1.00 19.13 ? 47 LEU C CB 1 ATOM 3665 C CG . LEU C 1 47 ? -0.368 -14.235 -15.986 1.00 19.15 ? 47 LEU C CG 1 ATOM 3666 C CD1 . LEU C 1 47 ? 0.919 -14.742 -16.636 1.00 17.12 ? 47 LEU C CD1 1 ATOM 3667 C CD2 . LEU C 1 47 ? -1.611 -14.777 -16.666 1.00 18.73 ? 47 LEU C CD2 1 ATOM 3668 N N . ILE C 1 48 ? -0.435 -14.217 -11.545 1.00 28.97 ? 48 ILE C N 1 ATOM 3669 C CA . ILE C 1 48 ? -0.071 -14.815 -10.271 1.00 21.16 ? 48 ILE C CA 1 ATOM 3670 C C . ILE C 1 48 ? 0.312 -13.689 -9.319 1.00 28.53 ? 48 ILE C C 1 ATOM 3671 O O . ILE C 1 48 ? 0.974 -12.729 -9.723 1.00 31.04 ? 48 ILE C O 1 ATOM 3672 C CB . ILE C 1 48 ? 1.149 -15.759 -10.450 1.00 18.59 ? 48 ILE C CB 1 ATOM 3673 C CG1 . ILE C 1 48 ? 0.791 -16.989 -11.295 1.00 18.81 ? 48 ILE C CG1 1 ATOM 3674 C CG2 . ILE C 1 48 ? 1.724 -16.179 -9.116 1.00 20.47 ? 48 ILE C CG2 1 ATOM 3675 C CD1 . ILE C 1 48 ? -0.200 -17.914 -10.659 1.00 19.20 ? 48 ILE C CD1 1 ATOM 3676 N N . LYS C 1 49 ? -0.114 -13.782 -8.065 1.00 17.48 ? 49 LYS C N 1 ATOM 3677 C CA . LYS C 1 49 ? 0.320 -12.816 -7.068 1.00 17.33 ? 49 LYS C CA 1 ATOM 3678 C C . LYS C 1 49 ? 1.010 -13.532 -5.928 1.00 24.29 ? 49 LYS C C 1 ATOM 3679 O O . LYS C 1 49 ? 0.694 -14.683 -5.634 1.00 30.47 ? 49 LYS C O 1 ATOM 3680 C CB . LYS C 1 49 ? -0.851 -11.971 -6.545 1.00 18.02 ? 49 LYS C CB 1 ATOM 3681 C CG . LYS C 1 49 ? -1.862 -12.716 -5.676 1.00 19.13 ? 49 LYS C CG 1 ATOM 3682 C CD . LYS C 1 49 ? -3.119 -11.879 -5.471 1.00 21.98 ? 49 LYS C CD 1 ATOM 3683 C CE . LYS C 1 49 ? -4.286 -12.717 -4.936 1.00 21.24 ? 49 LYS C CE 1 ATOM 3684 N NZ . LYS C 1 49 ? -4.133 -13.126 -3.494 1.00 25.13 ? 49 LYS C NZ 1 ATOM 3685 N N . TYR C 1 50 ? 1.950 -12.838 -5.293 1.00 21.42 ? 50 TYR C N 1 ATOM 3686 C CA . TYR C 1 50 ? 2.707 -13.375 -4.170 1.00 18.80 ? 50 TYR C CA 1 ATOM 3687 C C . TYR C 1 50 ? 3.288 -14.761 -4.460 1.00 25.75 ? 50 TYR C C 1 ATOM 3688 O O . TYR C 1 50 ? 3.047 -15.717 -3.722 1.00 29.62 ? 50 TYR C O 1 ATOM 3689 C CB . TYR C 1 50 ? 1.867 -13.353 -2.886 1.00 19.93 ? 50 TYR C CB 1 ATOM 3690 C CG . TYR C 1 50 ? 1.589 -11.950 -2.393 1.00 24.66 ? 50 TYR C CG 1 ATOM 3691 C CD1 . TYR C 1 50 ? 2.563 -11.228 -1.693 1.00 24.23 ? 50 TYR C CD1 1 ATOM 3692 C CD2 . TYR C 1 50 ? 0.364 -11.330 -2.645 1.00 23.28 ? 50 TYR C CD2 1 ATOM 3693 C CE1 . TYR C 1 50 ? 2.316 -9.924 -1.251 1.00 29.94 ? 50 TYR C CE1 1 ATOM 3694 C CE2 . TYR C 1 50 ? 0.100 -10.029 -2.194 1.00 19.95 ? 50 TYR C CE2 1 ATOM 3695 C CZ . TYR C 1 50 ? 1.081 -9.336 -1.501 1.00 30.61 ? 50 TYR C CZ 1 ATOM 3696 O OH . TYR C 1 50 ? 0.832 -8.054 -1.060 1.00 24.80 ? 50 TYR C OH 1 ATOM 3697 N N . ALA C 1 51 ? 4.030 -14.852 -5.563 1.00 24.54 ? 51 ALA C N 1 ATOM 3698 C CA . ALA C 1 51 ? 4.740 -16.072 -5.957 1.00 30.97 ? 51 ALA C CA 1 ATOM 3699 C C . ALA C 1 51 ? 3.871 -17.222 -6.471 1.00 29.32 ? 51 ALA C C 1 ATOM 3700 O O . ALA C 1 51 ? 4.178 -17.802 -7.513 1.00 19.03 ? 51 ALA C O 1 ATOM 3701 C CB . ALA C 1 51 ? 5.683 -16.567 -4.820 1.00 20.05 ? 51 ALA C CB 1 ATOM 3702 N N . SER C 1 52 ? 2.803 -17.560 -5.750 1.00 20.88 ? 52 SER C N 1 ATOM 3703 C CA . SER C 1 52 ? 2.113 -18.813 -6.031 1.00 24.85 ? 52 SER C CA 1 ATOM 3704 C C . SER C 1 52 ? 0.595 -18.739 -6.000 1.00 28.94 ? 52 SER C C 1 ATOM 3705 O O . SER C 1 52 ? -0.063 -19.743 -6.251 1.00 35.22 ? 52 SER C O 1 ATOM 3706 C CB . SER C 1 52 ? 2.561 -19.880 -5.039 1.00 22.13 ? 52 SER C CB 1 ATOM 3707 O OG . SER C 1 52 ? 2.056 -19.592 -3.748 1.00 22.84 ? 52 SER C OG 1 ATOM 3708 N N . GLU C 1 53 ? 0.043 -17.568 -5.698 1.00 26.02 ? 53 GLU C N 1 ATOM 3709 C CA . GLU C 1 53 ? -1.394 -17.442 -5.457 1.00 24.56 ? 53 GLU C CA 1 ATOM 3710 C C . GLU C 1 53 ? -2.166 -17.133 -6.734 1.00 25.53 ? 53 GLU C C 1 ATOM 3711 O O . GLU C 1 53 ? -1.750 -16.304 -7.536 1.00 23.77 ? 53 GLU C O 1 ATOM 3712 C CB . GLU C 1 53 ? -1.668 -16.369 -4.402 1.00 21.51 ? 53 GLU C CB 1 ATOM 3713 C CG . GLU C 1 53 ? -0.942 -16.601 -3.093 1.00 27.37 ? 53 GLU C CG 1 ATOM 3714 C CD . GLU C 1 53 ? -1.199 -15.500 -2.088 1.00 32.05 ? 53 GLU C CD 1 ATOM 3715 O OE1 . GLU C 1 53 ? -1.758 -14.459 -2.494 1.00 31.52 ? 53 GLU C OE1 1 ATOM 3716 O OE2 . GLU C 1 53 ? -0.843 -15.671 -0.898 1.00 33.00 ? 53 GLU C OE2 1 ATOM 3717 N N . SER C 1 54 ? -3.303 -17.791 -6.921 1.00 26.40 ? 54 SER C N 1 ATOM 3718 C CA . SER C 1 54 ? -3.992 -17.689 -8.202 1.00 28.33 ? 54 SER C CA 1 ATOM 3719 C C . SER C 1 54 ? -4.900 -16.469 -8.289 1.00 34.63 ? 54 SER C C 1 ATOM 3720 O O . SER C 1 54 ? -5.261 -15.863 -7.279 1.00 39.59 ? 54 SER C O 1 ATOM 3721 C CB . SER C 1 54 ? -4.765 -18.968 -8.518 1.00 26.58 ? 54 SER C CB 1 ATOM 3722 O OG . SER C 1 54 ? -5.746 -19.195 -7.530 1.00 41.18 ? 54 SER C OG 1 ATOM 3723 N N . ILE C 1 55 ? -5.256 -16.121 -9.520 1.00 29.94 ? 55 ILE C N 1 ATOM 3724 C CA . ILE C 1 55 ? -6.027 -14.931 -9.805 1.00 26.56 ? 55 ILE C CA 1 ATOM 3725 C C . ILE C 1 55 ? -7.321 -15.348 -10.480 1.00 34.17 ? 55 ILE C C 1 ATOM 3726 O O . ILE C 1 55 ? -7.322 -16.226 -11.345 1.00 39.64 ? 55 ILE C O 1 ATOM 3727 C CB . ILE C 1 55 ? -5.244 -14.023 -10.755 1.00 26.70 ? 55 ILE C CB 1 ATOM 3728 C CG1 . ILE C 1 55 ? -3.884 -13.653 -10.141 1.00 19.36 ? 55 ILE C CG1 1 ATOM 3729 C CG2 . ILE C 1 55 ? -6.081 -12.798 -11.156 1.00 22.85 ? 55 ILE C CG2 1 ATOM 3730 C CD1 . ILE C 1 55 ? -3.982 -12.930 -8.808 1.00 19.44 ? 55 ILE C CD1 1 ATOM 3731 N N . SER C 1 56 ? -8.427 -14.730 -10.091 1.00 31.30 ? 56 SER C N 1 ATOM 3732 C CA . SER C 1 56 ? -9.719 -15.142 -10.620 1.00 29.07 ? 56 SER C CA 1 ATOM 3733 C C . SER C 1 56 ? -9.800 -14.970 -12.138 1.00 34.65 ? 56 SER C C 1 ATOM 3734 O O . SER C 1 56 ? -9.551 -13.889 -12.670 1.00 34.89 ? 56 SER C O 1 ATOM 3735 C CB . SER C 1 56 ? -10.845 -14.377 -9.934 1.00 33.54 ? 56 SER C CB 1 ATOM 3736 O OG . SER C 1 56 ? -12.111 -14.822 -10.392 1.00 43.48 ? 56 SER C OG 1 ATOM 3737 N N . GLY C 1 57 ? -10.131 -16.053 -12.834 1.00 40.75 ? 57 GLY C N 1 ATOM 3738 C CA . GLY C 1 57 ? -10.315 -15.999 -14.272 1.00 36.02 ? 57 GLY C CA 1 ATOM 3739 C C . GLY C 1 57 ? -9.105 -16.448 -15.063 1.00 36.05 ? 57 GLY C C 1 ATOM 3740 O O . GLY C 1 57 ? -9.194 -16.607 -16.278 1.00 28.14 ? 57 GLY C O 1 ATOM 3741 N N . ILE C 1 58 ? -7.974 -16.643 -14.385 1.00 31.91 ? 58 ILE C N 1 ATOM 3742 C CA . ILE C 1 58 ? -6.765 -17.130 -15.053 1.00 32.30 ? 58 ILE C CA 1 ATOM 3743 C C . ILE C 1 58 ? -6.790 -18.653 -15.122 1.00 35.71 ? 58 ILE C C 1 ATOM 3744 O O . ILE C 1 58 ? -7.060 -19.316 -14.118 1.00 37.17 ? 58 ILE C O 1 ATOM 3745 C CB . ILE C 1 58 ? -5.469 -16.659 -14.340 1.00 30.29 ? 58 ILE C CB 1 ATOM 3746 C CG1 . ILE C 1 58 ? -5.346 -15.128 -14.375 1.00 30.07 ? 58 ILE C CG1 1 ATOM 3747 C CG2 . ILE C 1 58 ? -4.243 -17.318 -14.942 1.00 21.90 ? 58 ILE C CG2 1 ATOM 3748 C CD1 . ILE C 1 58 ? -5.631 -14.505 -15.735 1.00 21.78 ? 58 ILE C CD1 1 ATOM 3749 N N . PRO C 1 59 ? -6.520 -19.212 -16.314 1.00 34.26 ? 59 PRO C N 1 ATOM 3750 C CA . PRO C 1 59 ? -6.478 -20.664 -16.536 1.00 33.17 ? 59 PRO C CA 1 ATOM 3751 C C . PRO C 1 59 ? -5.617 -21.397 -15.504 1.00 34.29 ? 59 PRO C C 1 ATOM 3752 O O . PRO C 1 59 ? -4.583 -20.889 -15.062 1.00 34.18 ? 59 PRO C O 1 ATOM 3753 C CB . PRO C 1 59 ? -5.847 -20.781 -17.925 1.00 37.79 ? 59 PRO C CB 1 ATOM 3754 C CG . PRO C 1 59 ? -6.237 -19.521 -18.611 1.00 34.81 ? 59 PRO C CG 1 ATOM 3755 C CD . PRO C 1 59 ? -6.292 -18.454 -17.558 1.00 30.22 ? 59 PRO C CD 1 ATOM 3756 N N . SER C 1 60 ? -6.047 -22.597 -15.136 1.00 32.22 ? 60 SER C N 1 ATOM 3757 C CA . SER C 1 60 ? -5.364 -23.386 -14.116 1.00 28.32 ? 60 SER C CA 1 ATOM 3758 C C . SER C 1 60 ? -3.990 -23.867 -14.562 1.00 30.72 ? 60 SER C C 1 ATOM 3759 O O . SER C 1 60 ? -3.224 -24.379 -13.758 1.00 28.52 ? 60 SER C O 1 ATOM 3760 C CB . SER C 1 60 ? -6.217 -24.595 -13.718 1.00 30.50 ? 60 SER C CB 1 ATOM 3761 O OG . SER C 1 60 ? -6.295 -25.548 -14.774 1.00 34.61 ? 60 SER C OG 1 ATOM 3762 N N . ARG C 1 61 ? -3.682 -23.721 -15.845 1.00 29.72 ? 61 ARG C N 1 ATOM 3763 C CA . ARG C 1 61 ? -2.414 -24.218 -16.359 1.00 30.94 ? 61 ARG C CA 1 ATOM 3764 C C . ARG C 1 61 ? -1.283 -23.260 -15.992 1.00 32.41 ? 61 ARG C C 1 ATOM 3765 O O . ARG C 1 61 ? -0.104 -23.598 -16.094 1.00 32.90 ? 61 ARG C O 1 ATOM 3766 C CB . ARG C 1 61 ? -2.486 -24.475 -17.869 1.00 38.53 ? 61 ARG C CB 1 ATOM 3767 C CG . ARG C 1 61 ? -2.724 -23.250 -18.724 1.00 37.16 ? 61 ARG C CG 1 ATOM 3768 C CD . ARG C 1 61 ? -2.717 -23.615 -20.208 1.00 34.32 ? 61 ARG C CD 1 ATOM 3769 N NE . ARG C 1 61 ? -2.804 -22.423 -21.037 1.00 31.30 ? 61 ARG C NE 1 ATOM 3770 C CZ . ARG C 1 61 ? -3.948 -21.827 -21.368 1.00 38.29 ? 61 ARG C CZ 1 ATOM 3771 N NH1 . ARG C 1 61 ? -5.106 -22.331 -20.956 1.00 38.22 ? 61 ARG C NH1 1 ATOM 3772 N NH2 . ARG C 1 61 ? -3.936 -20.724 -22.114 1.00 36.01 ? 61 ARG C NH2 1 ATOM 3773 N N . PHE C 1 62 ? -1.654 -22.066 -15.543 1.00 23.82 ? 62 PHE C N 1 ATOM 3774 C CA . PHE C 1 62 ? -0.680 -21.119 -15.018 1.00 25.68 ? 62 PHE C CA 1 ATOM 3775 C C . PHE C 1 62 ? -0.477 -21.348 -13.517 1.00 27.28 ? 62 PHE C C 1 ATOM 3776 O O . PHE C 1 62 ? -1.441 -21.467 -12.765 1.00 29.39 ? 62 PHE C O 1 ATOM 3777 C CB . PHE C 1 62 ? -1.155 -19.679 -15.240 1.00 21.13 ? 62 PHE C CB 1 ATOM 3778 C CG . PHE C 1 62 ? -1.179 -19.251 -16.680 1.00 21.08 ? 62 PHE C CG 1 ATOM 3779 C CD1 . PHE C 1 62 ? -0.025 -18.781 -17.299 1.00 22.75 ? 62 PHE C CD1 1 ATOM 3780 C CD2 . PHE C 1 62 ? -2.361 -19.289 -17.410 1.00 31.60 ? 62 PHE C CD2 1 ATOM 3781 C CE1 . PHE C 1 62 ? -0.044 -18.370 -18.633 1.00 29.22 ? 62 PHE C CE1 1 ATOM 3782 C CE2 . PHE C 1 62 ? -2.394 -18.887 -18.747 1.00 31.17 ? 62 PHE C CE2 1 ATOM 3783 C CZ . PHE C 1 62 ? -1.233 -18.426 -19.362 1.00 29.88 ? 62 PHE C CZ 1 ATOM 3784 N N . SER C 1 63 ? 0.775 -21.410 -13.087 1.00 25.22 ? 63 SER C N 1 ATOM 3785 C CA . SER C 1 63 ? 1.085 -21.432 -11.663 1.00 29.60 ? 63 SER C CA 1 ATOM 3786 C C . SER C 1 63 ? 2.467 -20.819 -11.421 1.00 27.82 ? 63 SER C C 1 ATOM 3787 O O . SER C 1 63 ? 3.220 -20.562 -12.369 1.00 24.68 ? 63 SER C O 1 ATOM 3788 C CB . SER C 1 63 ? 1.005 -22.862 -11.095 1.00 23.90 ? 63 SER C CB 1 ATOM 3789 O OG . SER C 1 63 ? 2.119 -23.646 -11.492 1.00 26.22 ? 63 SER C OG 1 ATOM 3790 N N . GLY C 1 64 ? 2.793 -20.586 -10.151 1.00 24.08 ? 64 GLY C N 1 ATOM 3791 C CA . GLY C 1 64 ? 4.094 -20.042 -9.796 1.00 24.06 ? 64 GLY C CA 1 ATOM 3792 C C . GLY C 1 64 ? 4.688 -20.582 -8.506 1.00 23.26 ? 64 GLY C C 1 ATOM 3793 O O . GLY C 1 64 ? 3.980 -21.089 -7.645 1.00 28.24 ? 64 GLY C O 1 ATOM 3794 N N . SER C 1 65 ? 5.999 -20.464 -8.360 1.00 25.22 ? 65 SER C N 1 ATOM 3795 C CA . SER C 1 65 ? 6.649 -20.933 -7.142 1.00 26.24 ? 65 SER C CA 1 ATOM 3796 C C . SER C 1 65 ? 7.921 -20.153 -6.848 1.00 24.07 ? 65 SER C C 1 ATOM 3797 O O . SER C 1 65 ? 8.334 -19.303 -7.633 1.00 25.24 ? 65 SER C O 1 ATOM 3798 C CB . SER C 1 65 ? 6.965 -22.428 -7.240 1.00 23.39 ? 65 SER C CB 1 ATOM 3799 O OG . SER C 1 65 ? 7.863 -22.672 -8.305 1.00 30.89 ? 65 SER C OG 1 ATOM 3800 N N . GLY C 1 66 ? 8.537 -20.459 -5.710 1.00 28.43 ? 66 GLY C N 1 ATOM 3801 C CA . GLY C 1 66 ? 9.775 -19.821 -5.305 1.00 25.08 ? 66 GLY C CA 1 ATOM 3802 C C . GLY C 1 66 ? 9.621 -18.916 -4.101 1.00 25.68 ? 66 GLY C C 1 ATOM 3803 O O . GLY C 1 66 ? 8.515 -18.491 -3.758 1.00 25.94 ? 66 GLY C O 1 ATOM 3804 N N . SER C 1 67 ? 10.749 -18.634 -3.457 1.00 29.78 ? 67 SER C N 1 ATOM 3805 C CA . SER C 1 67 ? 10.822 -17.686 -2.349 1.00 32.64 ? 67 SER C CA 1 ATOM 3806 C C . SER C 1 67 ? 12.272 -17.279 -2.154 1.00 34.94 ? 67 SER C C 1 ATOM 3807 O O . SER C 1 67 ? 13.183 -18.063 -2.426 1.00 41.27 ? 67 SER C O 1 ATOM 3808 C CB . SER C 1 67 ? 10.303 -18.312 -1.062 1.00 26.77 ? 67 SER C CB 1 ATOM 3809 O OG . SER C 1 67 ? 11.206 -19.308 -0.618 1.00 37.76 ? 67 SER C OG 1 ATOM 3810 N N . GLY C 1 68 ? 12.487 -16.058 -1.675 1.00 32.30 ? 68 GLY C N 1 ATOM 3811 C CA . GLY C 1 68 ? 13.832 -15.541 -1.515 1.00 27.63 ? 68 GLY C CA 1 ATOM 3812 C C . GLY C 1 68 ? 14.244 -14.739 -2.727 1.00 39.66 ? 68 GLY C C 1 ATOM 3813 O O . GLY C 1 68 ? 13.872 -13.569 -2.844 1.00 38.46 ? 68 GLY C O 1 ATOM 3814 N N . THR C 1 69 ? 14.988 -15.365 -3.639 1.00 26.35 ? 69 THR C N 1 ATOM 3815 C CA . THR C 1 69 ? 15.462 -14.664 -4.830 1.00 33.55 ? 69 THR C CA 1 ATOM 3816 C C . THR C 1 69 ? 15.051 -15.315 -6.152 1.00 28.68 ? 69 THR C C 1 ATOM 3817 O O . THR C 1 69 ? 14.860 -14.625 -7.144 1.00 33.95 ? 69 THR C O 1 ATOM 3818 C CB . THR C 1 69 ? 16.999 -14.467 -4.807 1.00 26.98 ? 69 THR C CB 1 ATOM 3819 O OG1 . THR C 1 69 ? 17.655 -15.737 -4.886 1.00 28.49 ? 69 THR C OG1 1 ATOM 3820 C CG2 . THR C 1 69 ? 17.432 -13.751 -3.542 1.00 28.58 ? 69 THR C CG2 1 ATOM 3821 N N . ASP C 1 70 ? 14.907 -16.634 -6.165 1.00 27.98 ? 70 ASP C N 1 ATOM 3822 C CA . ASP C 1 70 ? 14.599 -17.360 -7.397 1.00 23.74 ? 70 ASP C CA 1 ATOM 3823 C C . ASP C 1 70 ? 13.112 -17.707 -7.539 1.00 22.53 ? 70 ASP C C 1 ATOM 3824 O O . ASP C 1 70 ? 12.544 -18.410 -6.710 1.00 28.70 ? 70 ASP C O 1 ATOM 3825 C CB . ASP C 1 70 ? 15.458 -18.630 -7.489 1.00 30.97 ? 70 ASP C CB 1 ATOM 3826 C CG . ASP C 1 70 ? 16.955 -18.326 -7.483 1.00 33.20 ? 70 ASP C CG 1 ATOM 3827 O OD1 . ASP C 1 70 ? 17.339 -17.168 -7.770 1.00 32.83 ? 70 ASP C OD1 1 ATOM 3828 O OD2 . ASP C 1 70 ? 17.748 -19.247 -7.200 1.00 28.96 ? 70 ASP C OD2 1 ATOM 3829 N N . PHE C 1 71 ? 12.482 -17.216 -8.599 1.00 23.53 ? 71 PHE C N 1 ATOM 3830 C CA . PHE C 1 71 ? 11.050 -17.439 -8.778 1.00 25.12 ? 71 PHE C CA 1 ATOM 3831 C C . PHE C 1 71 ? 10.751 -18.052 -10.139 1.00 32.35 ? 71 PHE C C 1 ATOM 3832 O O . PHE C 1 71 ? 11.512 -17.881 -11.097 1.00 33.09 ? 71 PHE C O 1 ATOM 3833 C CB . PHE C 1 71 ? 10.270 -16.141 -8.572 1.00 18.81 ? 71 PHE C CB 1 ATOM 3834 C CG . PHE C 1 71 ? 10.524 -15.507 -7.239 1.00 25.70 ? 71 PHE C CG 1 ATOM 3835 C CD1 . PHE C 1 71 ? 11.595 -14.644 -7.056 1.00 24.88 ? 71 PHE C CD1 1 ATOM 3836 C CD2 . PHE C 1 71 ? 9.724 -15.809 -6.148 1.00 27.17 ? 71 PHE C CD2 1 ATOM 3837 C CE1 . PHE C 1 71 ? 11.849 -14.082 -5.812 1.00 26.89 ? 71 PHE C CE1 1 ATOM 3838 C CE2 . PHE C 1 71 ? 9.968 -15.242 -4.907 1.00 26.72 ? 71 PHE C CE2 1 ATOM 3839 C CZ . PHE C 1 71 ? 11.031 -14.376 -4.742 1.00 26.17 ? 71 PHE C CZ 1 ATOM 3840 N N . THR C 1 72 ? 9.645 -18.781 -10.209 1.00 27.48 ? 72 THR C N 1 ATOM 3841 C CA . THR C 1 72 ? 9.283 -19.489 -11.424 1.00 24.26 ? 72 THR C CA 1 ATOM 3842 C C . THR C 1 72 ? 7.819 -19.287 -11.781 1.00 24.37 ? 72 THR C C 1 ATOM 3843 O O . THR C 1 72 ? 6.943 -19.434 -10.929 1.00 23.75 ? 72 THR C O 1 ATOM 3844 C CB . THR C 1 72 ? 9.533 -20.988 -11.281 1.00 21.03 ? 72 THR C CB 1 ATOM 3845 O OG1 . THR C 1 72 ? 10.906 -21.217 -10.948 1.00 22.03 ? 72 THR C OG1 1 ATOM 3846 C CG2 . THR C 1 72 ? 9.201 -21.693 -12.583 1.00 26.69 ? 72 THR C CG2 1 ATOM 3847 N N . LEU C 1 73 ? 7.564 -18.930 -13.036 1.00 25.52 ? 73 LEU C N 1 ATOM 3848 C CA . LEU C 1 73 ? 6.212 -18.960 -13.584 1.00 24.53 ? 73 LEU C CA 1 ATOM 3849 C C . LEU C 1 73 ? 6.097 -20.206 -14.459 1.00 26.79 ? 73 LEU C C 1 ATOM 3850 O O . LEU C 1 73 ? 6.968 -20.464 -15.296 1.00 28.56 ? 73 LEU C O 1 ATOM 3851 C CB . LEU C 1 73 ? 5.924 -17.700 -14.406 1.00 22.46 ? 73 LEU C CB 1 ATOM 3852 C CG . LEU C 1 73 ? 4.527 -17.695 -15.038 1.00 25.19 ? 73 LEU C CG 1 ATOM 3853 C CD1 . LEU C 1 73 ? 3.449 -17.715 -13.952 1.00 26.35 ? 73 LEU C CD1 1 ATOM 3854 C CD2 . LEU C 1 73 ? 4.309 -16.529 -15.996 1.00 18.36 ? 73 LEU C CD2 1 ATOM 3855 N N . SER C 1 74 ? 5.040 -20.986 -14.253 1.00 25.84 ? 74 SER C N 1 ATOM 3856 C CA . SER C 1 74 ? 4.880 -22.252 -14.970 1.00 27.65 ? 74 SER C CA 1 ATOM 3857 C C . SER C 1 74 ? 3.600 -22.324 -15.789 1.00 25.82 ? 74 SER C C 1 ATOM 3858 O O . SER C 1 74 ? 2.520 -21.963 -15.318 1.00 27.28 ? 74 SER C O 1 ATOM 3859 C CB . SER C 1 74 ? 4.920 -23.441 -14.003 1.00 36.23 ? 74 SER C CB 1 ATOM 3860 O OG . SER C 1 74 ? 6.244 -23.887 -13.773 1.00 38.92 ? 74 SER C OG 1 ATOM 3861 N N . ILE C 1 75 ? 3.739 -22.786 -17.025 1.00 22.03 ? 75 ILE C N 1 ATOM 3862 C CA . ILE C 1 75 ? 2.597 -23.177 -17.839 1.00 33.49 ? 75 ILE C CA 1 ATOM 3863 C C . ILE C 1 75 ? 2.733 -24.672 -18.120 1.00 31.21 ? 75 ILE C C 1 ATOM 3864 O O . ILE C 1 75 ? 3.691 -25.095 -18.771 1.00 29.55 ? 75 ILE C O 1 ATOM 3865 C CB . ILE C 1 75 ? 2.575 -22.397 -19.154 1.00 33.69 ? 75 ILE C CB 1 ATOM 3866 C CG1 . ILE C 1 75 ? 3.008 -20.950 -18.907 1.00 28.08 ? 75 ILE C CG1 1 ATOM 3867 C CG2 . ILE C 1 75 ? 1.197 -22.476 -19.807 1.00 37.74 ? 75 ILE C CG2 1 ATOM 3868 C CD1 . ILE C 1 75 ? 2.875 -20.052 -20.120 1.00 26.52 ? 75 ILE C CD1 1 ATOM 3869 N N . ASN C 1 76 ? 1.800 -25.479 -17.616 1.00 32.33 ? 76 ASN C N 1 ATOM 3870 C CA . ASN C 1 76 ? 1.991 -26.937 -17.649 1.00 47.99 ? 76 ASN C CA 1 ATOM 3871 C C . ASN C 1 76 ? 1.736 -27.615 -19.004 1.00 50.27 ? 76 ASN C C 1 ATOM 3872 O O . ASN C 1 76 ? 2.227 -28.717 -19.261 1.00 60.79 ? 76 ASN C O 1 ATOM 3873 C CB . ASN C 1 76 ? 1.223 -27.645 -16.520 1.00 52.91 ? 76 ASN C CB 1 ATOM 3874 C CG . ASN C 1 76 ? -0.278 -27.513 -16.661 1.00 57.99 ? 76 ASN C CG 1 ATOM 3875 O OD1 . ASN C 1 76 ? -0.780 -27.029 -17.677 1.00 60.89 ? 76 ASN C OD1 1 ATOM 3876 N ND2 . ASN C 1 76 ? -1.006 -27.952 -15.642 1.00 59.66 ? 76 ASN C ND2 1 ATOM 3877 N N . SER C 1 77 ? 0.958 -26.959 -19.854 1.00 37.50 ? 77 SER C N 1 ATOM 3878 C CA . SER C 1 77 ? 0.725 -27.434 -21.212 1.00 33.53 ? 77 SER C CA 1 ATOM 3879 C C . SER C 1 77 ? 0.441 -26.223 -22.074 1.00 32.94 ? 77 SER C C 1 ATOM 3880 O O . SER C 1 77 ? -0.703 -25.786 -22.197 1.00 36.02 ? 77 SER C O 1 ATOM 3881 C CB . SER C 1 77 ? -0.457 -28.397 -21.261 1.00 36.59 ? 77 SER C CB 1 ATOM 3882 O OG . SER C 1 77 ? -0.791 -28.717 -22.596 1.00 37.98 ? 77 SER C OG 1 ATOM 3883 N N . VAL C 1 78 ? 1.501 -25.675 -22.651 1.00 29.30 ? 78 VAL C N 1 ATOM 3884 C CA . VAL C 1 78 ? 1.421 -24.412 -23.361 1.00 29.50 ? 78 VAL C CA 1 ATOM 3885 C C . VAL C 1 78 ? 0.606 -24.550 -24.640 1.00 28.74 ? 78 VAL C C 1 ATOM 3886 O O . VAL C 1 78 ? 0.690 -25.560 -25.339 1.00 28.62 ? 78 VAL C O 1 ATOM 3887 C CB . VAL C 1 78 ? 2.833 -23.885 -23.679 1.00 29.26 ? 78 VAL C CB 1 ATOM 3888 C CG1 . VAL C 1 78 ? 3.573 -24.852 -24.617 1.00 30.05 ? 78 VAL C CG1 1 ATOM 3889 C CG2 . VAL C 1 78 ? 2.763 -22.495 -24.264 1.00 22.54 ? 78 VAL C CG2 1 ATOM 3890 N N . GLU C 1 79 ? -0.183 -23.525 -24.959 1.00 29.57 ? 79 GLU C N 1 ATOM 3891 C CA . GLU C 1 79 ? -0.962 -23.502 -26.192 1.00 31.77 ? 79 GLU C CA 1 ATOM 3892 C C . GLU C 1 79 ? -0.688 -22.215 -26.961 1.00 30.15 ? 79 GLU C C 1 ATOM 3893 O O . GLU C 1 79 ? -0.095 -21.265 -26.444 1.00 30.90 ? 79 GLU C O 1 ATOM 3894 C CB . GLU C 1 79 ? -2.468 -23.655 -25.920 1.00 32.88 ? 79 GLU C CB 1 ATOM 3895 C CG . GLU C 1 79 ? -2.883 -23.414 -24.479 1.00 38.35 ? 79 GLU C CG 1 ATOM 3896 C CD . GLU C 1 79 ? -4.289 -23.928 -24.177 1.00 50.09 ? 79 GLU C CD 1 ATOM 3897 O OE1 . GLU C 1 79 ? -5.157 -23.112 -23.807 1.00 50.01 ? 79 GLU C OE1 1 ATOM 3898 O OE2 . GLU C 1 79 ? -4.533 -25.150 -24.306 1.00 58.07 ? 79 GLU C OE2 1 ATOM 3899 N N . SER C 1 80 ? -1.138 -22.200 -28.219 1.00 35.94 ? 80 SER C N 1 ATOM 3900 C CA . SER C 1 80 ? -0.871 -21.069 -29.102 1.00 34.15 ? 80 SER C CA 1 ATOM 3901 C C . SER C 1 80 ? -1.321 -19.708 -28.545 1.00 31.95 ? 80 SER C C 1 ATOM 3902 O O . SER C 1 80 ? -0.638 -18.708 -28.729 1.00 32.86 ? 80 SER C O 1 ATOM 3903 C CB . SER C 1 80 ? -1.500 -21.318 -30.465 1.00 36.87 ? 80 SER C CB 1 ATOM 3904 O OG . SER C 1 80 ? -2.897 -21.466 -30.340 1.00 42.03 ? 80 SER C OG 1 ATOM 3905 N N . GLU C 1 81 ? -2.453 -19.659 -27.856 1.00 25.20 ? 81 GLU C N 1 ATOM 3906 C CA . GLU C 1 81 ? -2.905 -18.385 -27.295 1.00 25.55 ? 81 GLU C CA 1 ATOM 3907 C C . GLU C 1 81 ? -2.060 -17.885 -26.119 1.00 24.91 ? 81 GLU C C 1 ATOM 3908 O O . GLU C 1 81 ? -2.305 -16.797 -25.600 1.00 27.79 ? 81 GLU C O 1 ATOM 3909 C CB . GLU C 1 81 ? -4.373 -18.439 -26.883 1.00 29.39 ? 81 GLU C CB 1 ATOM 3910 C CG . GLU C 1 81 ? -4.631 -19.261 -25.642 1.00 48.29 ? 81 GLU C CG 1 ATOM 3911 C CD . GLU C 1 81 ? -5.203 -20.629 -25.969 1.00 68.39 ? 81 GLU C CD 1 ATOM 3912 O OE1 . GLU C 1 81 ? -4.767 -21.236 -26.984 1.00 71.71 ? 81 GLU C OE1 1 ATOM 3913 O OE2 . GLU C 1 81 ? -6.101 -21.081 -25.218 1.00 72.54 ? 81 GLU C OE2 1 ATOM 3914 N N . ASP C 1 82 ? -1.066 -18.664 -25.702 1.00 25.95 ? 82 ASP C N 1 ATOM 3915 C CA . ASP C 1 82 ? -0.160 -18.213 -24.649 1.00 26.19 ? 82 ASP C CA 1 ATOM 3916 C C . ASP C 1 82 ? 0.998 -17.404 -25.227 1.00 22.97 ? 82 ASP C C 1 ATOM 3917 O O . ASP C 1 82 ? 1.859 -16.940 -24.481 1.00 22.05 ? 82 ASP C O 1 ATOM 3918 C CB . ASP C 1 82 ? 0.387 -19.388 -23.835 1.00 24.11 ? 82 ASP C CB 1 ATOM 3919 C CG . ASP C 1 82 ? -0.702 -20.169 -23.124 1.00 27.65 ? 82 ASP C CG 1 ATOM 3920 O OD1 . ASP C 1 82 ? -1.706 -19.554 -22.685 1.00 27.25 ? 82 ASP C OD1 1 ATOM 3921 O OD2 . ASP C 1 82 ? -0.546 -21.408 -23.006 1.00 31.36 ? 82 ASP C OD2 1 ATOM 3922 N N . ILE C 1 83 ? 1.027 -17.258 -26.551 1.00 24.58 ? 83 ILE C N 1 ATOM 3923 C CA . ILE C 1 83 ? 2.033 -16.429 -27.204 1.00 19.50 ? 83 ILE C CA 1 ATOM 3924 C C . ILE C 1 83 ? 1.899 -15.011 -26.681 1.00 19.12 ? 83 ILE C C 1 ATOM 3925 O O . ILE C 1 83 ? 0.872 -14.372 -26.871 1.00 19.98 ? 83 ILE C O 1 ATOM 3926 C CB . ILE C 1 83 ? 1.887 -16.454 -28.740 1.00 26.95 ? 83 ILE C CB 1 ATOM 3927 C CG1 . ILE C 1 83 ? 2.348 -17.798 -29.295 1.00 31.45 ? 83 ILE C CG1 1 ATOM 3928 C CG2 . ILE C 1 83 ? 2.736 -15.384 -29.376 1.00 24.69 ? 83 ILE C CG2 1 ATOM 3929 C CD1 . ILE C 1 83 ? 1.910 -18.038 -30.732 1.00 38.39 ? 83 ILE C CD1 1 ATOM 3930 N N . ALA C 1 84 ? 2.946 -14.536 -26.011 1.00 21.67 ? 84 ALA C N 1 ATOM 3931 C CA . ALA C 1 84 ? 2.928 -13.259 -25.304 1.00 17.76 ? 84 ALA C CA 1 ATOM 3932 C C . ALA C 1 84 ? 4.289 -12.982 -24.687 1.00 23.18 ? 84 ALA C C 1 ATOM 3933 O O . ALA C 1 84 ? 5.208 -13.803 -24.778 1.00 20.87 ? 84 ALA C O 1 ATOM 3934 C CB . ALA C 1 84 ? 1.887 -13.282 -24.206 1.00 17.65 ? 84 ALA C CB 1 ATOM 3935 N N . ASP C 1 85 ? 4.410 -11.819 -24.051 1.00 20.49 ? 85 ASP C N 1 ATOM 3936 C CA . ASP C 1 85 ? 5.532 -11.550 -23.167 1.00 17.84 ? 85 ASP C CA 1 ATOM 3937 C C . ASP C 1 85 ? 5.114 -11.747 -21.722 1.00 21.49 ? 85 ASP C C 1 ATOM 3938 O O . ASP C 1 85 ? 3.960 -11.529 -21.369 1.00 25.41 ? 85 ASP C O 1 ATOM 3939 C CB . ASP C 1 85 ? 6.048 -10.143 -23.385 1.00 18.38 ? 85 ASP C CB 1 ATOM 3940 C CG . ASP C 1 85 ? 6.467 -9.917 -24.808 1.00 22.53 ? 85 ASP C CG 1 ATOM 3941 O OD1 . ASP C 1 85 ? 7.075 -10.851 -25.375 1.00 30.77 ? 85 ASP C OD1 1 ATOM 3942 O OD2 . ASP C 1 85 ? 6.168 -8.835 -25.364 1.00 19.66 ? 85 ASP C OD2 1 ATOM 3943 N N . TYR C 1 86 ? 6.065 -12.166 -20.893 1.00 24.76 ? 86 TYR C N 1 ATOM 3944 C CA . TYR C 1 86 ? 5.802 -12.454 -19.487 1.00 18.05 ? 86 TYR C CA 1 ATOM 3945 C C . TYR C 1 86 ? 6.706 -11.645 -18.559 1.00 21.51 ? 86 TYR C C 1 ATOM 3946 O O . TYR C 1 86 ? 7.925 -11.628 -18.720 1.00 27.72 ? 86 TYR C O 1 ATOM 3947 C CB . TYR C 1 86 ? 5.901 -13.964 -19.236 1.00 18.02 ? 86 TYR C CB 1 ATOM 3948 C CG . TYR C 1 86 ? 4.782 -14.702 -19.947 1.00 24.10 ? 86 TYR C CG 1 ATOM 3949 C CD1 . TYR C 1 86 ? 4.925 -15.123 -21.264 1.00 19.16 ? 86 TYR C CD1 1 ATOM 3950 C CD2 . TYR C 1 86 ? 3.560 -14.927 -19.316 1.00 17.35 ? 86 TYR C CD2 1 ATOM 3951 C CE1 . TYR C 1 86 ? 3.897 -15.762 -21.922 1.00 21.63 ? 86 TYR C CE1 1 ATOM 3952 C CE2 . TYR C 1 86 ? 2.525 -15.571 -19.968 1.00 18.06 ? 86 TYR C CE2 1 ATOM 3953 C CZ . TYR C 1 86 ? 2.695 -15.986 -21.272 1.00 24.36 ? 86 TYR C CZ 1 ATOM 3954 O OH . TYR C 1 86 ? 1.660 -16.628 -21.929 1.00 26.59 ? 86 TYR C OH 1 ATOM 3955 N N . TYR C 1 87 ? 6.095 -10.953 -17.601 1.00 20.19 ? 87 TYR C N 1 ATOM 3956 C CA . TYR C 1 87 ? 6.836 -10.042 -16.740 1.00 19.12 ? 87 TYR C CA 1 ATOM 3957 C C . TYR C 1 87 ? 6.689 -10.395 -15.274 1.00 24.14 ? 87 TYR C C 1 ATOM 3958 O O . TYR C 1 87 ? 5.626 -10.817 -14.824 1.00 29.45 ? 87 TYR C O 1 ATOM 3959 C CB . TYR C 1 87 ? 6.370 -8.600 -16.948 1.00 14.52 ? 87 TYR C CB 1 ATOM 3960 C CG . TYR C 1 87 ? 6.681 -8.022 -18.308 1.00 15.02 ? 87 TYR C CG 1 ATOM 3961 C CD1 . TYR C 1 87 ? 7.922 -7.462 -18.578 1.00 24.02 ? 87 TYR C CD1 1 ATOM 3962 C CD2 . TYR C 1 87 ? 5.726 -8.022 -19.317 1.00 17.95 ? 87 TYR C CD2 1 ATOM 3963 C CE1 . TYR C 1 87 ? 8.208 -6.924 -19.824 1.00 25.60 ? 87 TYR C CE1 1 ATOM 3964 C CE2 . TYR C 1 87 ? 5.997 -7.492 -20.569 1.00 23.11 ? 87 TYR C CE2 1 ATOM 3965 C CZ . TYR C 1 87 ? 7.240 -6.944 -20.815 1.00 23.37 ? 87 TYR C CZ 1 ATOM 3966 O OH . TYR C 1 87 ? 7.516 -6.410 -22.047 1.00 18.07 ? 87 TYR C OH 1 ATOM 3967 N N . CYS C 1 88 ? 7.763 -10.206 -14.521 1.00 24.55 ? 88 CYS C N 1 ATOM 3968 C CA . CYS C 1 88 ? 7.666 -10.298 -13.077 1.00 26.45 ? 88 CYS C CA 1 ATOM 3969 C C . CYS C 1 88 ? 7.805 -8.900 -12.446 1.00 28.03 ? 88 CYS C C 1 ATOM 3970 O O . CYS C 1 88 ? 8.387 -7.986 -13.036 1.00 26.25 ? 88 CYS C O 1 ATOM 3971 C CB . CYS C 1 88 ? 8.675 -11.308 -12.502 1.00 21.11 ? 88 CYS C CB 1 ATOM 3972 S SG . CYS C 1 88 ? 10.436 -10.911 -12.729 1.00 30.50 ? 88 CYS C SG 1 ATOM 3973 N N . GLN C 1 89 ? 7.231 -8.748 -11.258 1.00 25.03 ? 89 GLN C N 1 ATOM 3974 C CA . GLN C 1 89 ? 7.260 -7.501 -10.503 1.00 23.35 ? 89 GLN C CA 1 ATOM 3975 C C . GLN C 1 89 ? 7.496 -7.865 -9.048 1.00 21.76 ? 89 GLN C C 1 ATOM 3976 O O . GLN C 1 89 ? 6.894 -8.814 -8.547 1.00 23.21 ? 89 GLN C O 1 ATOM 3977 C CB . GLN C 1 89 ? 5.926 -6.764 -10.652 1.00 22.63 ? 89 GLN C CB 1 ATOM 3978 C CG . GLN C 1 89 ? 5.588 -5.783 -9.525 1.00 15.70 ? 89 GLN C CG 1 ATOM 3979 C CD . GLN C 1 89 ? 4.084 -5.486 -9.451 1.00 21.83 ? 89 GLN C CD 1 ATOM 3980 O OE1 . GLN C 1 89 ? 3.264 -6.280 -9.918 1.00 19.78 ? 89 GLN C OE1 1 ATOM 3981 N NE2 . GLN C 1 89 ? 3.721 -4.350 -8.855 1.00 17.34 ? 89 GLN C NE2 1 ATOM 3982 N N . GLN C 1 90 ? 8.392 -7.141 -8.383 1.00 18.22 ? 90 GLN C N 1 ATOM 3983 C CA . GLN C 1 90 ? 8.604 -7.316 -6.949 1.00 18.00 ? 90 GLN C CA 1 ATOM 3984 C C . GLN C 1 90 ? 8.012 -6.129 -6.214 1.00 17.90 ? 90 GLN C C 1 ATOM 3985 O O . GLN C 1 90 ? 8.072 -4.999 -6.701 1.00 17.51 ? 90 GLN C O 1 ATOM 3986 C CB . GLN C 1 90 ? 10.095 -7.447 -6.612 1.00 18.94 ? 90 GLN C CB 1 ATOM 3987 C CG . GLN C 1 90 ? 10.908 -6.156 -6.766 1.00 21.60 ? 90 GLN C CG 1 ATOM 3988 C CD . GLN C 1 90 ? 10.786 -5.197 -5.568 1.00 21.49 ? 90 GLN C CD 1 ATOM 3989 O OE1 . GLN C 1 90 ? 10.625 -5.620 -4.421 1.00 20.62 ? 90 GLN C OE1 1 ATOM 3990 N NE2 . GLN C 1 90 ? 10.835 -3.896 -5.848 1.00 20.72 ? 90 GLN C NE2 1 ATOM 3991 N N . ASN C 1 91 ? 7.453 -6.376 -5.035 1.00 24.27 ? 91 ASN C N 1 ATOM 3992 C CA . ASN C 1 91 ? 7.007 -5.272 -4.181 1.00 23.08 ? 91 ASN C CA 1 ATOM 3993 C C . ASN C 1 91 ? 7.372 -5.476 -2.717 1.00 25.30 ? 91 ASN C C 1 ATOM 3994 O O . ASN C 1 91 ? 6.616 -5.106 -1.810 1.00 23.94 ? 91 ASN C O 1 ATOM 3995 C CB . ASN C 1 91 ? 5.506 -4.985 -4.337 1.00 22.28 ? 91 ASN C CB 1 ATOM 3996 C CG . ASN C 1 91 ? 5.097 -3.656 -3.697 1.00 29.36 ? 91 ASN C CG 1 ATOM 3997 O OD1 . ASN C 1 91 ? 5.796 -2.645 -3.823 1.00 26.95 ? 91 ASN C OD1 1 ATOM 3998 N ND2 . ASN C 1 91 ? 3.976 -3.664 -2.987 1.00 33.00 ? 91 ASN C ND2 1 ATOM 3999 N N . ASN C 1 92 ? 8.535 -6.073 -2.484 1.00 21.37 ? 92 ASN C N 1 ATOM 4000 C CA . ASN C 1 92 ? 9.068 -6.123 -1.127 1.00 25.77 ? 92 ASN C CA 1 ATOM 4001 C C . ASN C 1 92 ? 9.778 -4.807 -0.780 1.00 23.43 ? 92 ASN C C 1 ATOM 4002 O O . ASN C 1 92 ? 9.902 -4.443 0.386 1.00 24.76 ? 92 ASN C O 1 ATOM 4003 C CB . ASN C 1 92 ? 10.006 -7.317 -0.938 1.00 24.52 ? 92 ASN C CB 1 ATOM 4004 C CG . ASN C 1 92 ? 10.468 -7.471 0.510 1.00 26.86 ? 92 ASN C CG 1 ATOM 4005 O OD1 . ASN C 1 92 ? 9.677 -7.797 1.382 1.00 27.88 ? 92 ASN C OD1 1 ATOM 4006 N ND2 . ASN C 1 92 ? 11.749 -7.245 0.760 1.00 28.09 ? 92 ASN C ND2 1 ATOM 4007 N N . ASN C 1 93 ? 10.238 -4.094 -1.802 1.00 25.57 ? 93 ASN C N 1 ATOM 4008 C CA . ASN C 1 93 ? 10.976 -2.857 -1.593 1.00 27.55 ? 93 ASN C CA 1 ATOM 4009 C C . ASN C 1 93 ? 10.499 -1.711 -2.454 1.00 25.14 ? 93 ASN C C 1 ATOM 4010 O O . ASN C 1 93 ? 10.239 -1.867 -3.639 1.00 29.43 ? 93 ASN C O 1 ATOM 4011 C CB . ASN C 1 93 ? 12.471 -3.084 -1.783 1.00 30.65 ? 93 ASN C CB 1 ATOM 4012 C CG . ASN C 1 93 ? 13.059 -3.923 -0.675 1.00 43.21 ? 93 ASN C CG 1 ATOM 4013 O OD1 . ASN C 1 93 ? 13.297 -5.125 -0.842 1.00 47.48 ? 93 ASN C OD1 1 ATOM 4014 N ND2 . ASN C 1 93 ? 13.257 -3.305 0.487 1.00 42.27 ? 93 ASN C ND2 1 ATOM 4015 N N . TRP C 1 94 ? 10.375 -0.549 -1.840 1.00 24.83 ? 94 TRP C N 1 ATOM 4016 C CA . TRP C 1 94 ? 9.936 0.625 -2.562 1.00 25.91 ? 94 TRP C CA 1 ATOM 4017 C C . TRP C 1 94 ? 11.107 1.201 -3.352 1.00 26.12 ? 94 TRP C C 1 ATOM 4018 O O . TRP C 1 94 ? 12.214 1.302 -2.831 1.00 30.81 ? 94 TRP C O 1 ATOM 4019 C CB . TRP C 1 94 ? 9.376 1.656 -1.581 1.00 26.47 ? 94 TRP C CB 1 ATOM 4020 C CG . TRP C 1 94 ? 8.585 2.721 -2.248 1.00 30.87 ? 94 TRP C CG 1 ATOM 4021 C CD1 . TRP C 1 94 ? 7.236 2.733 -2.470 1.00 29.29 ? 94 TRP C CD1 1 ATOM 4022 C CD2 . TRP C 1 94 ? 9.096 3.933 -2.802 1.00 31.09 ? 94 TRP C CD2 1 ATOM 4023 N NE1 . TRP C 1 94 ? 6.878 3.890 -3.116 1.00 22.56 ? 94 TRP C NE1 1 ATOM 4024 C CE2 . TRP C 1 94 ? 8.002 4.643 -3.333 1.00 28.52 ? 94 TRP C CE2 1 ATOM 4025 C CE3 . TRP C 1 94 ? 10.376 4.490 -2.895 1.00 27.83 ? 94 TRP C CE3 1 ATOM 4026 C CZ2 . TRP C 1 94 ? 8.147 5.880 -3.955 1.00 30.48 ? 94 TRP C CZ2 1 ATOM 4027 C CZ3 . TRP C 1 94 ? 10.519 5.716 -3.517 1.00 28.62 ? 94 TRP C CZ3 1 ATOM 4028 C CH2 . TRP C 1 94 ? 9.411 6.401 -4.035 1.00 29.38 ? 94 TRP C CH2 1 ATOM 4029 N N . PRO C 1 95 ? 10.872 1.569 -4.620 1.00 23.98 ? 95 PRO C N 1 ATOM 4030 C CA . PRO C 1 95 ? 9.600 1.431 -5.347 1.00 23.97 ? 95 PRO C CA 1 ATOM 4031 C C . PRO C 1 95 ? 9.432 0.049 -5.975 1.00 23.61 ? 95 PRO C C 1 ATOM 4032 O O . PRO C 1 95 ? 10.406 -0.679 -6.164 1.00 24.59 ? 95 PRO C O 1 ATOM 4033 C CB . PRO C 1 95 ? 9.736 2.463 -6.465 1.00 30.16 ? 95 PRO C CB 1 ATOM 4034 C CG . PRO C 1 95 ? 11.223 2.478 -6.756 1.00 29.36 ? 95 PRO C CG 1 ATOM 4035 C CD . PRO C 1 95 ? 11.882 2.312 -5.402 1.00 24.94 ? 95 PRO C CD 1 ATOM 4036 N N . THR C 1 96 ? 8.200 -0.311 -6.297 1.00 18.96 ? 96 THR C N 1 ATOM 4037 C CA . THR C 1 96 ? 7.952 -1.567 -6.982 1.00 20.36 ? 96 THR C CA 1 ATOM 4038 C C . THR C 1 96 ? 8.671 -1.530 -8.332 1.00 19.65 ? 96 THR C C 1 ATOM 4039 O O . THR C 1 96 ? 8.669 -0.512 -9.017 1.00 22.80 ? 96 THR C O 1 ATOM 4040 C CB . THR C 1 96 ? 6.430 -1.824 -7.150 1.00 19.94 ? 96 THR C CB 1 ATOM 4041 O OG1 . THR C 1 96 ? 6.216 -3.091 -7.779 1.00 16.93 ? 96 THR C OG1 1 ATOM 4042 C CG2 . THR C 1 96 ? 5.778 -0.725 -7.979 1.00 17.73 ? 96 THR C CG2 1 ATOM 4043 N N . THR C 1 97 ? 9.322 -2.620 -8.710 1.00 19.37 ? 97 THR C N 1 ATOM 4044 C CA . THR C 1 97 ? 10.063 -2.620 -9.968 1.00 19.92 ? 97 THR C CA 1 ATOM 4045 C C . THR C 1 97 ? 9.710 -3.860 -10.790 1.00 22.68 ? 97 THR C C 1 ATOM 4046 O O . THR C 1 97 ? 9.158 -4.823 -10.250 1.00 21.79 ? 97 THR C O 1 ATOM 4047 C CB . THR C 1 97 ? 11.585 -2.538 -9.719 1.00 22.84 ? 97 THR C CB 1 ATOM 4048 O OG1 . THR C 1 97 ? 12.011 -3.656 -8.930 1.00 25.63 ? 97 THR C OG1 1 ATOM 4049 C CG2 . THR C 1 97 ? 11.946 -1.254 -8.989 1.00 20.38 ? 97 THR C CG2 1 ATOM 4050 N N . PHE C 1 98 ? 10.013 -3.831 -12.087 1.00 21.03 ? 98 PHE C N 1 ATOM 4051 C CA . PHE C 1 98 ? 9.640 -4.928 -12.987 1.00 19.87 ? 98 PHE C CA 1 ATOM 4052 C C . PHE C 1 98 ? 10.849 -5.601 -13.643 1.00 23.67 ? 98 PHE C C 1 ATOM 4053 O O . PHE C 1 98 ? 11.916 -5.000 -13.756 1.00 25.99 ? 98 PHE C O 1 ATOM 4054 C CB . PHE C 1 98 ? 8.690 -4.434 -14.090 1.00 17.48 ? 98 PHE C CB 1 ATOM 4055 C CG . PHE C 1 98 ? 7.322 -4.039 -13.598 1.00 21.00 ? 98 PHE C CG 1 ATOM 4056 C CD1 . PHE C 1 98 ? 7.112 -2.807 -13.001 1.00 17.85 ? 98 PHE C CD1 1 ATOM 4057 C CD2 . PHE C 1 98 ? 6.237 -4.897 -13.752 1.00 21.58 ? 98 PHE C CD2 1 ATOM 4058 C CE1 . PHE C 1 98 ? 5.838 -2.440 -12.553 1.00 17.21 ? 98 PHE C CE1 1 ATOM 4059 C CE2 . PHE C 1 98 ? 4.962 -4.543 -13.308 1.00 18.14 ? 98 PHE C CE2 1 ATOM 4060 C CZ . PHE C 1 98 ? 4.762 -3.314 -12.709 1.00 15.97 ? 98 PHE C CZ 1 ATOM 4061 N N . GLY C 1 99 ? 10.680 -6.845 -14.087 1.00 19.14 ? 99 GLY C N 1 ATOM 4062 C CA . GLY C 1 99 ? 11.686 -7.474 -14.929 1.00 20.18 ? 99 GLY C CA 1 ATOM 4063 C C . GLY C 1 99 ? 11.627 -6.987 -16.372 1.00 22.62 ? 99 GLY C C 1 ATOM 4064 O O . GLY C 1 99 ? 10.710 -6.256 -16.760 1.00 28.14 ? 99 GLY C O 1 ATOM 4065 N N . ALA C 1 100 ? 12.597 -7.388 -17.183 1.00 27.62 ? 100 ALA C N 1 ATOM 4066 C CA . ALA C 1 100 ? 12.624 -6.951 -18.582 1.00 28.27 ? 100 ALA C CA 1 ATOM 4067 C C . ALA C 1 100 ? 11.769 -7.848 -19.486 1.00 26.29 ? 100 ALA C C 1 ATOM 4068 O O . ALA C 1 100 ? 11.609 -7.589 -20.686 1.00 24.47 ? 100 ALA C O 1 ATOM 4069 C CB . ALA C 1 100 ? 14.042 -6.879 -19.089 1.00 21.35 ? 100 ALA C CB 1 ATOM 4070 N N . GLY C 1 101 ? 11.221 -8.907 -18.909 1.00 21.37 ? 101 GLY C N 1 ATOM 4071 C CA . GLY C 1 101 ? 10.330 -9.775 -19.654 1.00 16.63 ? 101 GLY C CA 1 ATOM 4072 C C . GLY C 1 101 ? 11.021 -10.904 -20.379 1.00 18.75 ? 101 GLY C C 1 ATOM 4073 O O . GLY C 1 101 ? 12.219 -10.837 -20.671 1.00 21.76 ? 101 GLY C O 1 ATOM 4074 N N . THR C 1 102 ? 10.254 -11.958 -20.644 1.00 20.40 ? 102 THR C N 1 ATOM 4075 C CA . THR C 1 102 ? 10.692 -13.095 -21.447 1.00 17.23 ? 102 THR C CA 1 ATOM 4076 C C . THR C 1 102 ? 9.654 -13.238 -22.540 1.00 19.62 ? 102 THR C C 1 ATOM 4077 O O . THR C 1 102 ? 8.446 -13.226 -22.254 1.00 19.72 ? 102 THR C O 1 ATOM 4078 C CB . THR C 1 102 ? 10.689 -14.413 -20.629 1.00 24.34 ? 102 THR C CB 1 ATOM 4079 O OG1 . THR C 1 102 ? 11.809 -14.444 -19.732 1.00 30.38 ? 102 THR C OG1 1 ATOM 4080 C CG2 . THR C 1 102 ? 10.746 -15.634 -21.557 1.00 17.80 ? 102 THR C CG2 1 ATOM 4081 N N . LYS C 1 103 ? 10.105 -13.373 -23.785 1.00 27.30 ? 103 LYS C N 1 ATOM 4082 C CA . LYS C 1 103 ? 9.189 -13.538 -24.908 1.00 25.12 ? 103 LYS C CA 1 ATOM 4083 C C . LYS C 1 103 ? 8.947 -15.019 -25.202 1.00 27.98 ? 103 LYS C C 1 ATOM 4084 O O . LYS C 1 103 ? 9.892 -15.796 -25.340 1.00 27.36 ? 103 LYS C O 1 ATOM 4085 C CB . LYS C 1 103 ? 9.721 -12.821 -26.154 1.00 30.77 ? 103 LYS C CB 1 ATOM 4086 C CG . LYS C 1 103 ? 8.898 -13.075 -27.413 1.00 31.49 ? 103 LYS C CG 1 ATOM 4087 C CD . LYS C 1 103 ? 9.323 -12.166 -28.554 1.00 29.04 ? 103 LYS C CD 1 ATOM 4088 C CE . LYS C 1 103 ? 8.283 -12.168 -29.672 1.00 26.83 ? 103 LYS C CE 1 ATOM 4089 N NZ . LYS C 1 103 ? 8.655 -11.219 -30.764 1.00 28.64 ? 103 LYS C NZ 1 ATOM 4090 N N . LEU C 1 104 ? 7.679 -15.408 -25.288 1.00 25.61 ? 104 LEU C N 1 ATOM 4091 C CA . LEU C 1 104 ? 7.330 -16.799 -25.556 1.00 26.36 ? 104 LEU C CA 1 ATOM 4092 C C . LEU C 1 104 ? 7.030 -16.988 -27.036 1.00 24.35 ? 104 LEU C C 1 ATOM 4093 O O . LEU C 1 104 ? 6.182 -16.297 -27.592 1.00 24.56 ? 104 LEU C O 1 ATOM 4094 C CB . LEU C 1 104 ? 6.126 -17.232 -24.714 1.00 28.04 ? 104 LEU C CB 1 ATOM 4095 C CG . LEU C 1 104 ? 5.660 -18.691 -24.849 1.00 34.62 ? 104 LEU C CG 1 ATOM 4096 C CD1 . LEU C 1 104 ? 6.768 -19.664 -24.475 1.00 34.78 ? 104 LEU C CD1 1 ATOM 4097 C CD2 . LEU C 1 104 ? 4.417 -18.955 -24.000 1.00 38.73 ? 104 LEU C CD2 1 ATOM 4098 N N . GLU C 1 105 ? 7.751 -17.906 -27.669 1.00 30.33 ? 105 GLU C N 1 ATOM 4099 C CA . GLU C 1 105 ? 7.513 -18.261 -29.065 1.00 29.87 ? 105 GLU C CA 1 ATOM 4100 C C . GLU C 1 105 ? 7.101 -19.726 -29.139 1.00 29.49 ? 105 GLU C C 1 ATOM 4101 O O . GLU C 1 105 ? 7.669 -20.577 -28.449 1.00 28.53 ? 105 GLU C O 1 ATOM 4102 C CB . GLU C 1 105 ? 8.774 -18.035 -29.911 1.00 33.11 ? 105 GLU C CB 1 ATOM 4103 C CG . GLU C 1 105 ? 9.297 -16.601 -29.886 1.00 41.64 ? 105 GLU C CG 1 ATOM 4104 C CD . GLU C 1 105 ? 10.534 -16.396 -30.760 1.00 46.48 ? 105 GLU C CD 1 ATOM 4105 O OE1 . GLU C 1 105 ? 11.259 -17.388 -31.016 1.00 46.61 ? 105 GLU C OE1 1 ATOM 4106 O OE2 . GLU C 1 105 ? 10.776 -15.240 -31.184 1.00 47.08 ? 105 GLU C OE2 1 ATOM 4107 N N . LEU C 1 106 ? 6.112 -20.026 -29.969 1.00 26.35 ? 106 LEU C N 1 ATOM 4108 C CA . LEU C 1 106 ? 5.722 -21.418 -30.175 1.00 25.78 ? 106 LEU C CA 1 ATOM 4109 C C . LEU C 1 106 ? 6.252 -21.988 -31.483 1.00 22.30 ? 106 LEU C C 1 ATOM 4110 O O . LEU C 1 106 ? 6.135 -21.363 -32.526 1.00 24.72 ? 106 LEU C O 1 ATOM 4111 C CB . LEU C 1 106 ? 4.205 -21.570 -30.115 1.00 26.57 ? 106 LEU C CB 1 ATOM 4112 C CG . LEU C 1 106 ? 3.754 -21.990 -28.721 1.00 38.96 ? 106 LEU C CG 1 ATOM 4113 C CD1 . LEU C 1 106 ? 3.842 -20.808 -27.772 1.00 49.33 ? 106 LEU C CD1 1 ATOM 4114 C CD2 . LEU C 1 106 ? 2.360 -22.585 -28.739 1.00 45.96 ? 106 LEU C CD2 1 ATOM 4115 N N . LYS C 1 107 ? 6.839 -23.179 -31.422 1.00 33.48 ? 107 LYS C N 1 ATOM 4116 C CA . LYS C 1 107 ? 7.241 -23.897 -32.633 1.00 30.59 ? 107 LYS C CA 1 ATOM 4117 C C . LYS C 1 107 ? 6.018 -24.531 -33.284 1.00 28.98 ? 107 LYS C C 1 ATOM 4118 O O . LYS C 1 107 ? 5.023 -24.802 -32.619 1.00 33.76 ? 107 LYS C O 1 ATOM 4119 C CB . LYS C 1 107 ? 8.265 -24.990 -32.318 1.00 33.81 ? 107 LYS C CB 1 ATOM 4120 C CG . LYS C 1 107 ? 9.503 -24.515 -31.565 1.00 40.40 ? 107 LYS C CG 1 ATOM 4121 C CD . LYS C 1 107 ? 10.634 -25.530 -31.663 1.00 45.51 ? 107 LYS C CD 1 ATOM 4122 C CE . LYS C 1 107 ? 11.801 -25.172 -30.746 1.00 55.71 ? 107 LYS C CE 1 ATOM 4123 N NZ . LYS C 1 107 ? 11.538 -25.507 -29.318 1.00 57.28 ? 107 LYS C NZ 1 ATOM 4124 N N . ARG C 1 108 ? 6.093 -24.747 -34.590 1.00 24.50 ? 108 ARG C N 1 ATOM 4125 C CA . ARG C 1 108 ? 5.051 -25.447 -35.318 1.00 22.65 ? 108 ARG C CA 1 ATOM 4126 C C . ARG C 1 108 ? 5.692 -25.964 -36.588 1.00 25.32 ? 108 ARG C C 1 ATOM 4127 O O . ARG C 1 108 ? 6.852 -25.670 -36.850 1.00 27.01 ? 108 ARG C O 1 ATOM 4128 C CB . ARG C 1 108 ? 3.865 -24.532 -35.644 1.00 22.67 ? 108 ARG C CB 1 ATOM 4129 C CG . ARG C 1 108 ? 4.206 -23.270 -36.436 1.00 21.72 ? 108 ARG C CG 1 ATOM 4130 C CD . ARG C 1 108 ? 3.060 -22.887 -37.338 1.00 22.42 ? 108 ARG C CD 1 ATOM 4131 N NE . ARG C 1 108 ? 2.831 -23.909 -38.358 1.00 21.41 ? 108 ARG C NE 1 ATOM 4132 C CZ . ARG C 1 108 ? 1.650 -24.177 -38.909 1.00 21.68 ? 108 ARG C CZ 1 ATOM 4133 N NH1 . ARG C 1 108 ? 0.560 -23.509 -38.543 1.00 24.82 ? 108 ARG C NH1 1 ATOM 4134 N NH2 . ARG C 1 108 ? 1.556 -25.129 -39.822 1.00 19.60 ? 108 ARG C NH2 1 ATOM 4135 N N . THR C 1 109 ? 4.950 -26.739 -37.368 1.00 23.69 ? 109 THR C N 1 ATOM 4136 C CA . THR C 1 109 ? 5.485 -27.293 -38.603 1.00 30.16 ? 109 THR C CA 1 ATOM 4137 C C . THR C 1 109 ? 5.695 -26.179 -39.611 1.00 28.93 ? 109 THR C C 1 ATOM 4138 O O . THR C 1 109 ? 5.058 -25.127 -39.524 1.00 29.03 ? 109 THR C O 1 ATOM 4139 C CB . THR C 1 109 ? 4.535 -28.347 -39.227 1.00 27.29 ? 109 THR C CB 1 ATOM 4140 O OG1 . THR C 1 109 ? 3.256 -27.751 -39.449 1.00 23.65 ? 109 THR C OG1 1 ATOM 4141 C CG2 . THR C 1 109 ? 4.366 -29.544 -38.305 1.00 19.58 ? 109 THR C CG2 1 ATOM 4142 N N . VAL C 1 110 ? 6.591 -26.424 -40.563 1.00 26.44 ? 110 VAL C N 1 ATOM 4143 C CA . VAL C 1 110 ? 6.841 -25.496 -41.656 1.00 24.09 ? 110 VAL C CA 1 ATOM 4144 C C . VAL C 1 110 ? 5.566 -25.274 -42.465 1.00 27.71 ? 110 VAL C C 1 ATOM 4145 O O . VAL C 1 110 ? 4.894 -26.226 -42.854 1.00 29.89 ? 110 VAL C O 1 ATOM 4146 C CB . VAL C 1 110 ? 7.965 -26.011 -42.605 1.00 15.61 ? 110 VAL C CB 1 ATOM 4147 C CG1 . VAL C 1 110 ? 8.100 -25.114 -43.824 1.00 15.31 ? 110 VAL C CG1 1 ATOM 4148 C CG2 . VAL C 1 110 ? 9.293 -26.085 -41.882 1.00 16.76 ? 110 VAL C CG2 1 ATOM 4149 N N . ALA C 1 111 ? 5.239 -24.009 -42.706 1.00 25.41 ? 111 ALA C N 1 ATOM 4150 C CA . ALA C 1 111 ? 4.116 -23.658 -43.564 1.00 20.23 ? 111 ALA C CA 1 ATOM 4151 C C . ALA C 1 111 ? 4.515 -22.618 -44.613 1.00 20.86 ? 111 ALA C C 1 ATOM 4152 O O . ALA C 1 111 ? 5.072 -21.564 -44.289 1.00 22.68 ? 111 ALA C O 1 ATOM 4153 C CB . ALA C 1 111 ? 2.957 -23.147 -42.727 1.00 17.53 ? 111 ALA C CB 1 ATOM 4154 N N . ALA C 1 112 ? 4.227 -22.917 -45.873 1.00 24.43 ? 112 ALA C N 1 ATOM 4155 C CA . ALA C 1 112 ? 4.568 -22.020 -46.968 1.00 24.21 ? 112 ALA C CA 1 ATOM 4156 C C . ALA C 1 112 ? 3.639 -20.809 -46.989 1.00 23.21 ? 112 ALA C C 1 ATOM 4157 O O . ALA C 1 112 ? 2.459 -20.913 -46.629 1.00 25.24 ? 112 ALA C O 1 ATOM 4158 C CB . ALA C 1 112 ? 4.497 -22.759 -48.290 1.00 23.34 ? 112 ALA C CB 1 ATOM 4159 N N . PRO C 1 113 ? 4.172 -19.649 -47.396 1.00 18.35 ? 113 PRO C N 1 ATOM 4160 C CA . PRO C 1 113 ? 3.337 -18.452 -47.531 1.00 21.09 ? 113 PRO C CA 1 ATOM 4161 C C . PRO C 1 113 ? 2.482 -18.510 -48.776 1.00 22.31 ? 113 PRO C C 1 ATOM 4162 O O . PRO C 1 113 ? 2.941 -18.998 -49.802 1.00 31.39 ? 113 PRO C O 1 ATOM 4163 C CB . PRO C 1 113 ? 4.365 -17.322 -47.683 1.00 23.05 ? 113 PRO C CB 1 ATOM 4164 C CG . PRO C 1 113 ? 5.584 -18.001 -48.274 1.00 19.48 ? 113 PRO C CG 1 ATOM 4165 C CD . PRO C 1 113 ? 5.601 -19.370 -47.641 1.00 17.82 ? 113 PRO C CD 1 ATOM 4166 N N . SER C 1 114 ? 1.249 -18.033 -48.677 1.00 25.64 ? 114 SER C N 1 ATOM 4167 C CA . SER C 1 114 ? 0.450 -17.715 -49.853 1.00 20.21 ? 114 SER C CA 1 ATOM 4168 C C . SER C 1 114 ? 0.797 -16.280 -50.226 1.00 20.07 ? 114 SER C C 1 ATOM 4169 O O . SER C 1 114 ? 0.887 -15.412 -49.349 1.00 19.62 ? 114 SER C O 1 ATOM 4170 C CB . SER C 1 114 ? -1.034 -17.812 -49.523 1.00 19.75 ? 114 SER C CB 1 ATOM 4171 O OG . SER C 1 114 ? -1.308 -19.048 -48.914 1.00 25.60 ? 114 SER C OG 1 ATOM 4172 N N . VAL C 1 115 ? 1.000 -16.025 -51.514 1.00 20.04 ? 115 VAL C N 1 ATOM 4173 C CA . VAL C 1 115 ? 1.515 -14.722 -51.942 1.00 20.91 ? 115 VAL C CA 1 ATOM 4174 C C . VAL C 1 115 ? 0.495 -13.940 -52.765 1.00 21.28 ? 115 VAL C C 1 ATOM 4175 O O . VAL C 1 115 ? -0.199 -14.496 -53.610 1.00 18.50 ? 115 VAL C O 1 ATOM 4176 C CB . VAL C 1 115 ? 2.875 -14.848 -52.702 1.00 23.93 ? 115 VAL C CB 1 ATOM 4177 C CG1 . VAL C 1 115 ? 3.437 -13.464 -53.066 1.00 19.39 ? 115 VAL C CG1 1 ATOM 4178 C CG2 . VAL C 1 115 ? 3.879 -15.615 -51.870 1.00 20.69 ? 115 VAL C CG2 1 ATOM 4179 N N . PHE C 1 116 ? 0.408 -12.642 -52.495 1.00 21.29 ? 116 PHE C N 1 ATOM 4180 C CA . PHE C 1 116 ? -0.552 -11.780 -53.173 1.00 17.76 ? 116 PHE C CA 1 ATOM 4181 C C . PHE C 1 116 ? 0.086 -10.448 -53.523 1.00 23.46 ? 116 PHE C C 1 ATOM 4182 O O . PHE C 1 116 ? 0.792 -9.848 -52.685 1.00 16.44 ? 116 PHE C O 1 ATOM 4183 C CB . PHE C 1 116 ? -1.751 -11.518 -52.273 1.00 17.35 ? 116 PHE C CB 1 ATOM 4184 C CG . PHE C 1 116 ? -2.493 -12.756 -51.877 1.00 16.50 ? 116 PHE C CG 1 ATOM 4185 C CD1 . PHE C 1 116 ? -3.496 -13.263 -52.686 1.00 16.95 ? 116 PHE C CD1 1 ATOM 4186 C CD2 . PHE C 1 116 ? -2.193 -13.411 -50.694 1.00 16.61 ? 116 PHE C CD2 1 ATOM 4187 C CE1 . PHE C 1 116 ? -4.190 -14.399 -52.323 1.00 17.44 ? 116 PHE C CE1 1 ATOM 4188 C CE2 . PHE C 1 116 ? -2.880 -14.549 -50.329 1.00 19.95 ? 116 PHE C CE2 1 ATOM 4189 C CZ . PHE C 1 116 ? -3.882 -15.044 -51.143 1.00 17.49 ? 116 PHE C CZ 1 ATOM 4190 N N . ILE C 1 117 ? -0.152 -9.986 -54.753 1.00 17.04 ? 117 ILE C N 1 ATOM 4191 C CA . ILE C 1 117 ? 0.377 -8.694 -55.158 1.00 27.05 ? 117 ILE C CA 1 ATOM 4192 C C . ILE C 1 117 ? -0.748 -7.705 -55.434 1.00 25.09 ? 117 ILE C C 1 ATOM 4193 O O . ILE C 1 117 ? -1.797 -8.085 -55.944 1.00 23.61 ? 117 ILE C O 1 ATOM 4194 C CB . ILE C 1 117 ? 1.353 -8.788 -56.352 1.00 26.94 ? 117 ILE C CB 1 ATOM 4195 C CG1 . ILE C 1 117 ? 2.038 -7.430 -56.569 1.00 18.29 ? 117 ILE C CG1 1 ATOM 4196 C CG2 . ILE C 1 117 ? 0.631 -9.279 -57.598 1.00 18.89 ? 117 ILE C CG2 1 ATOM 4197 C CD1 . ILE C 1 117 ? 3.151 -7.443 -57.582 1.00 19.51 ? 117 ILE C CD1 1 ATOM 4198 N N . PHE C 1 118 ? -0.522 -6.448 -55.058 1.00 16.37 ? 118 PHE C N 1 ATOM 4199 C CA . PHE C 1 118 ? -1.499 -5.382 -55.227 1.00 16.18 ? 118 PHE C CA 1 ATOM 4200 C C . PHE C 1 118 ? -0.855 -4.177 -55.907 1.00 26.74 ? 118 PHE C C 1 ATOM 4201 O O . PHE C 1 118 ? 0.111 -3.592 -55.382 1.00 19.73 ? 118 PHE C O 1 ATOM 4202 C CB . PHE C 1 118 ? -2.038 -4.919 -53.880 1.00 16.31 ? 118 PHE C CB 1 ATOM 4203 C CG . PHE C 1 118 ? -2.616 -6.015 -53.034 1.00 20.77 ? 118 PHE C CG 1 ATOM 4204 C CD1 . PHE C 1 118 ? -3.919 -6.462 -53.244 1.00 14.95 ? 118 PHE C CD1 1 ATOM 4205 C CD2 . PHE C 1 118 ? -1.879 -6.561 -51.994 1.00 23.19 ? 118 PHE C CD2 1 ATOM 4206 C CE1 . PHE C 1 118 ? -4.472 -7.449 -52.455 1.00 14.75 ? 118 PHE C CE1 1 ATOM 4207 C CE2 . PHE C 1 118 ? -2.420 -7.554 -51.197 1.00 21.71 ? 118 PHE C CE2 1 ATOM 4208 C CZ . PHE C 1 118 ? -3.732 -8.002 -51.438 1.00 21.68 ? 118 PHE C CZ 1 ATOM 4209 N N . PRO C 1 119 ? -1.389 -3.800 -57.078 1.00 27.88 ? 119 PRO C N 1 ATOM 4210 C CA . PRO C 1 119 ? -0.955 -2.583 -57.770 1.00 28.45 ? 119 PRO C CA 1 ATOM 4211 C C . PRO C 1 119 ? -1.469 -1.368 -57.042 1.00 27.78 ? 119 PRO C C 1 ATOM 4212 O O . PRO C 1 119 ? -2.441 -1.471 -56.293 1.00 17.07 ? 119 PRO C O 1 ATOM 4213 C CB . PRO C 1 119 ? -1.658 -2.676 -59.129 1.00 25.97 ? 119 PRO C CB 1 ATOM 4214 C CG . PRO C 1 119 ? -2.870 -3.505 -58.865 1.00 19.14 ? 119 PRO C CG 1 ATOM 4215 C CD . PRO C 1 119 ? -2.458 -4.506 -57.807 1.00 23.35 ? 119 PRO C CD 1 ATOM 4216 N N . PRO C 1 120 ? -0.833 -0.216 -57.267 1.00 27.91 ? 120 PRO C N 1 ATOM 4217 C CA . PRO C 1 120 ? -1.312 1.009 -56.638 1.00 22.11 ? 120 PRO C CA 1 ATOM 4218 C C . PRO C 1 120 ? -2.686 1.369 -57.178 1.00 21.73 ? 120 PRO C C 1 ATOM 4219 O O . PRO C 1 120 ? -3.032 0.953 -58.277 1.00 19.46 ? 120 PRO C O 1 ATOM 4220 C CB . PRO C 1 120 ? -0.274 2.046 -57.070 1.00 24.57 ? 120 PRO C CB 1 ATOM 4221 C CG . PRO C 1 120 ? 0.293 1.490 -58.349 1.00 26.71 ? 120 PRO C CG 1 ATOM 4222 C CD . PRO C 1 120 ? 0.338 0.020 -58.127 1.00 27.63 ? 120 PRO C CD 1 ATOM 4223 N N . SER C 1 121 ? -3.457 2.121 -56.401 1.00 21.50 ? 121 SER C N 1 ATOM 4224 C CA . SER C 1 121 ? -4.768 2.565 -56.828 1.00 22.60 ? 121 SER C CA 1 ATOM 4225 C C . SER C 1 121 ? -4.602 3.810 -57.662 1.00 20.78 ? 121 SER C C 1 ATOM 4226 O O . SER C 1 121 ? -3.635 4.552 -57.500 1.00 23.80 ? 121 SER C O 1 ATOM 4227 C CB . SER C 1 121 ? -5.636 2.898 -55.613 1.00 24.44 ? 121 SER C CB 1 ATOM 4228 O OG . SER C 1 121 ? -5.095 4.000 -54.899 1.00 24.57 ? 121 SER C OG 1 ATOM 4229 N N . ASP C 1 122 ? -5.557 4.049 -58.544 1.00 21.34 ? 122 ASP C N 1 ATOM 4230 C CA . ASP C 1 122 ? -5.588 5.298 -59.286 1.00 32.50 ? 122 ASP C CA 1 ATOM 4231 C C . ASP C 1 122 ? -5.688 6.494 -58.327 1.00 31.20 ? 122 ASP C C 1 ATOM 4232 O O . ASP C 1 122 ? -5.174 7.580 -58.612 1.00 30.70 ? 122 ASP C O 1 ATOM 4233 C CB . ASP C 1 122 ? -6.764 5.299 -60.270 1.00 34.10 ? 122 ASP C CB 1 ATOM 4234 C CG . ASP C 1 122 ? -6.572 4.318 -61.412 1.00 37.58 ? 122 ASP C CG 1 ATOM 4235 O OD1 . ASP C 1 122 ? -5.417 4.086 -61.823 1.00 43.39 ? 122 ASP C OD1 1 ATOM 4236 O OD2 . ASP C 1 122 ? -7.576 3.773 -61.902 1.00 41.76 ? 122 ASP C OD2 1 ATOM 4237 N N A GLU C 1 123 ? -6.348 6.298 -57.186 0.51 30.35 ? 123 GLU C N 1 ATOM 4238 N N B GLU C 1 123 ? -6.354 6.268 -57.198 0.49 30.26 ? 123 GLU C N 1 ATOM 4239 C CA A GLU C 1 123 ? -6.516 7.384 -56.223 0.51 28.64 ? 123 GLU C CA 1 ATOM 4240 C CA B GLU C 1 123 ? -6.548 7.289 -56.182 0.49 28.48 ? 123 GLU C CA 1 ATOM 4241 C C A GLU C 1 123 ? -5.174 7.864 -55.677 0.51 29.91 ? 123 GLU C C 1 ATOM 4242 C C B GLU C 1 123 ? -5.212 7.831 -55.664 0.49 29.83 ? 123 GLU C C 1 ATOM 4243 O O A GLU C 1 123 ? -4.933 9.070 -55.586 0.51 31.44 ? 123 GLU C O 1 ATOM 4244 O O B GLU C 1 123 ? -5.012 9.045 -55.588 0.49 31.48 ? 123 GLU C O 1 ATOM 4245 C CB A GLU C 1 123 ? -7.451 6.985 -55.079 0.51 26.63 ? 123 GLU C CB 1 ATOM 4246 C CB B GLU C 1 123 ? -7.389 6.723 -55.036 0.49 26.69 ? 123 GLU C CB 1 ATOM 4247 C CG A GLU C 1 123 ? -7.834 8.149 -54.167 0.51 27.81 ? 123 GLU C CG 1 ATOM 4248 C CG B GLU C 1 123 ? -8.857 6.438 -55.390 0.49 30.82 ? 123 GLU C CG 1 ATOM 4249 C CD A GLU C 1 123 ? -8.887 7.780 -53.119 0.51 33.32 ? 123 GLU C CD 1 ATOM 4250 C CD B GLU C 1 123 ? -9.130 5.006 -55.865 0.49 30.29 ? 123 GLU C CD 1 ATOM 4251 O OE1 A GLU C 1 123 ? -8.803 6.680 -52.513 0.51 33.17 ? 123 GLU C OE1 1 ATOM 4252 O OE1 B GLU C 1 123 ? -8.352 4.455 -56.681 0.49 22.55 ? 123 GLU C OE1 1 ATOM 4253 O OE2 A GLU C 1 123 ? -9.799 8.606 -52.904 0.51 31.71 ? 123 GLU C OE2 1 ATOM 4254 O OE2 B GLU C 1 123 ? -10.152 4.440 -55.419 0.49 29.52 ? 123 GLU C OE2 1 ATOM 4255 N N . GLN C 1 124 ? -4.294 6.928 -55.328 1.00 22.89 ? 124 GLN C N 1 ATOM 4256 C CA . GLN C 1 124 ? -2.985 7.319 -54.806 1.00 22.00 ? 124 GLN C CA 1 ATOM 4257 C C . GLN C 1 124 ? -2.136 8.033 -55.867 1.00 25.72 ? 124 GLN C C 1 ATOM 4258 O O . GLN C 1 124 ? -1.454 9.009 -55.561 1.00 26.08 ? 124 GLN C O 1 ATOM 4259 C CB . GLN C 1 124 ? -2.211 6.126 -54.218 1.00 22.28 ? 124 GLN C CB 1 ATOM 4260 C CG . GLN C 1 124 ? -0.867 6.532 -53.593 1.00 18.41 ? 124 GLN C CG 1 ATOM 4261 C CD . GLN C 1 124 ? 0.017 5.349 -53.214 1.00 18.87 ? 124 GLN C CD 1 ATOM 4262 O OE1 . GLN C 1 124 ? -0.155 4.239 -53.709 1.00 21.30 ? 124 GLN C OE1 1 ATOM 4263 N NE2 . GLN C 1 124 ? 0.966 5.591 -52.325 1.00 21.42 ? 124 GLN C NE2 1 ATOM 4264 N N . LEU C 1 125 ? -2.194 7.545 -57.107 1.00 29.85 ? 125 LEU C N 1 ATOM 4265 C CA . LEU C 1 125 ? -1.387 8.089 -58.199 1.00 34.51 ? 125 LEU C CA 1 ATOM 4266 C C . LEU C 1 125 ? -1.559 9.597 -58.370 1.00 37.69 ? 125 LEU C C 1 ATOM 4267 O O . LEU C 1 125 ? -0.597 10.303 -58.671 1.00 38.62 ? 125 LEU C O 1 ATOM 4268 C CB . LEU C 1 125 ? -1.679 7.359 -59.515 1.00 27.30 ? 125 LEU C CB 1 ATOM 4269 C CG . LEU C 1 125 ? -1.267 5.884 -59.553 1.00 27.00 ? 125 LEU C CG 1 ATOM 4270 C CD1 . LEU C 1 125 ? -1.536 5.272 -60.900 1.00 24.43 ? 125 LEU C CD1 1 ATOM 4271 C CD2 . LEU C 1 125 ? 0.210 5.728 -59.195 1.00 22.96 ? 125 LEU C CD2 1 ATOM 4272 N N . LYS C 1 126 ? -2.780 10.081 -58.152 1.00 38.84 ? 126 LYS C N 1 ATOM 4273 C CA . LYS C 1 126 ? -3.076 11.518 -58.173 1.00 39.92 ? 126 LYS C CA 1 ATOM 4274 C C . LYS C 1 126 ? -2.114 12.339 -57.305 1.00 34.60 ? 126 LYS C C 1 ATOM 4275 O O . LYS C 1 126 ? -1.892 13.518 -57.564 1.00 39.64 ? 126 LYS C O 1 ATOM 4276 C CB . LYS C 1 126 ? -4.504 11.782 -57.679 1.00 39.62 ? 126 LYS C CB 1 ATOM 4277 C CG . LYS C 1 126 ? -5.610 11.151 -58.485 1.00 42.76 ? 126 LYS C CG 1 ATOM 4278 C CD . LYS C 1 126 ? -6.950 11.463 -57.829 1.00 55.94 ? 126 LYS C CD 1 ATOM 4279 C CE . LYS C 1 126 ? -8.120 10.834 -58.580 1.00 65.03 ? 126 LYS C CE 1 ATOM 4280 N NZ . LYS C 1 126 ? -9.404 11.012 -57.851 1.00 64.87 ? 126 LYS C NZ 1 ATOM 4281 N N . SER C 1 127 ? -1.562 11.718 -56.265 1.00 25.84 ? 127 SER C N 1 ATOM 4282 C CA . SER C 1 127 ? -0.673 12.417 -55.342 1.00 32.95 ? 127 SER C CA 1 ATOM 4283 C C . SER C 1 127 ? 0.813 12.353 -55.731 1.00 33.36 ? 127 SER C C 1 ATOM 4284 O O . SER C 1 127 ? 1.652 12.934 -55.049 1.00 41.23 ? 127 SER C O 1 ATOM 4285 C CB . SER C 1 127 ? -0.863 11.892 -53.916 1.00 30.53 ? 127 SER C CB 1 ATOM 4286 O OG . SER C 1 127 ? -0.393 10.556 -53.795 1.00 31.20 ? 127 SER C OG 1 ATOM 4287 N N . GLY C 1 128 ? 1.139 11.646 -56.809 1.00 26.98 ? 128 GLY C N 1 ATOM 4288 C CA . GLY C 1 128 ? 2.505 11.623 -57.304 1.00 26.32 ? 128 GLY C CA 1 ATOM 4289 C C . GLY C 1 128 ? 3.361 10.464 -56.825 1.00 30.36 ? 128 GLY C C 1 ATOM 4290 O O . GLY C 1 128 ? 4.571 10.427 -57.071 1.00 39.94 ? 128 GLY C O 1 ATOM 4291 N N . THR C 1 129 ? 2.725 9.506 -56.156 1.00 22.23 ? 129 THR C N 1 ATOM 4292 C CA . THR C 1 129 ? 3.425 8.376 -55.564 1.00 21.02 ? 129 THR C CA 1 ATOM 4293 C C . THR C 1 129 ? 2.654 7.082 -55.819 1.00 22.16 ? 129 THR C C 1 ATOM 4294 O O . THR C 1 129 ? 1.417 7.063 -55.759 1.00 27.01 ? 129 THR C O 1 ATOM 4295 C CB . THR C 1 129 ? 3.625 8.601 -54.034 1.00 25.60 ? 129 THR C CB 1 ATOM 4296 O OG1 . THR C 1 129 ? 4.528 9.689 -53.830 1.00 30.48 ? 129 THR C OG1 1 ATOM 4297 C CG2 . THR C 1 129 ? 4.189 7.370 -53.344 1.00 21.56 ? 129 THR C CG2 1 ATOM 4298 N N . ALA C 1 130 ? 3.385 6.009 -56.121 1.00 22.06 ? 130 ALA C N 1 ATOM 4299 C CA . ALA C 1 130 ? 2.796 4.675 -56.219 1.00 16.19 ? 130 ALA C CA 1 ATOM 4300 C C . ALA C 1 130 ? 3.328 3.755 -55.133 1.00 25.01 ? 130 ALA C C 1 ATOM 4301 O O . ALA C 1 130 ? 4.531 3.627 -54.962 1.00 21.64 ? 130 ALA C O 1 ATOM 4302 C CB . ALA C 1 130 ? 3.077 4.067 -57.576 1.00 26.42 ? 130 ALA C CB 1 ATOM 4303 N N . SER C 1 131 ? 2.424 3.108 -54.405 1.00 26.40 ? 131 SER C N 1 ATOM 4304 C CA . SER C 1 131 ? 2.802 2.048 -53.485 1.00 18.19 ? 131 SER C CA 1 ATOM 4305 C C . SER C 1 131 ? 2.428 0.701 -54.076 1.00 14.98 ? 131 SER C C 1 ATOM 4306 O O . SER C 1 131 ? 1.279 0.470 -54.447 1.00 21.76 ? 131 SER C O 1 ATOM 4307 C CB . SER C 1 131 ? 2.122 2.234 -52.127 1.00 17.24 ? 131 SER C CB 1 ATOM 4308 O OG . SER C 1 131 ? 2.629 3.374 -51.455 1.00 18.39 ? 131 SER C OG 1 ATOM 4309 N N . VAL C 1 132 ? 3.399 -0.192 -54.182 1.00 20.16 ? 132 VAL C N 1 ATOM 4310 C CA . VAL C 1 132 ? 3.104 -1.539 -54.637 1.00 13.61 ? 132 VAL C CA 1 ATOM 4311 C C . VAL C 1 132 ? 3.310 -2.488 -53.482 1.00 16.21 ? 132 VAL C C 1 ATOM 4312 O O . VAL C 1 132 ? 4.336 -2.439 -52.806 1.00 18.35 ? 132 VAL C O 1 ATOM 4313 C CB . VAL C 1 132 ? 4.011 -1.971 -55.787 1.00 19.50 ? 132 VAL C CB 1 ATOM 4314 C CG1 . VAL C 1 132 ? 3.394 -3.175 -56.502 1.00 19.57 ? 132 VAL C CG1 1 ATOM 4315 C CG2 . VAL C 1 132 ? 4.221 -0.822 -56.755 1.00 17.36 ? 132 VAL C CG2 1 ATOM 4316 N N . VAL C 1 133 ? 2.340 -3.361 -53.251 1.00 14.97 ? 133 VAL C N 1 ATOM 4317 C CA . VAL C 1 133 ? 2.349 -4.133 -52.034 1.00 13.84 ? 133 VAL C CA 1 ATOM 4318 C C . VAL C 1 133 ? 2.285 -5.610 -52.320 1.00 17.48 ? 133 VAL C C 1 ATOM 4319 O O . VAL C 1 133 ? 1.513 -6.071 -53.157 1.00 23.92 ? 133 VAL C O 1 ATOM 4320 C CB . VAL C 1 133 ? 1.209 -3.684 -51.077 1.00 23.40 ? 133 VAL C CB 1 ATOM 4321 C CG1 . VAL C 1 133 ? 1.072 -4.622 -49.870 1.00 15.43 ? 133 VAL C CG1 1 ATOM 4322 C CG2 . VAL C 1 133 ? 1.446 -2.249 -50.627 1.00 17.58 ? 133 VAL C CG2 1 ATOM 4323 N N . CYS C 1 134 ? 3.125 -6.346 -51.607 1.00 21.23 ? 134 CYS C N 1 ATOM 4324 C CA . CYS C 1 134 ? 3.162 -7.788 -51.704 1.00 24.28 ? 134 CYS C CA 1 ATOM 4325 C C . CYS C 1 134 ? 2.874 -8.398 -50.346 1.00 23.96 ? 134 CYS C C 1 ATOM 4326 O O . CYS C 1 134 ? 3.484 -8.007 -49.345 1.00 16.21 ? 134 CYS C O 1 ATOM 4327 C CB . CYS C 1 134 ? 4.524 -8.251 -52.196 1.00 32.66 ? 134 CYS C CB 1 ATOM 4328 S SG . CYS C 1 134 ? 4.548 -9.981 -52.570 1.00 42.12 ? 134 CYS C SG 1 ATOM 4329 N N . LEU C 1 135 ? 1.943 -9.355 -50.322 1.00 16.99 ? 135 LEU C N 1 ATOM 4330 C CA . LEU C 1 135 ? 1.501 -9.978 -49.089 1.00 14.50 ? 135 LEU C CA 1 ATOM 4331 C C . LEU C 1 135 ? 1.961 -11.431 -49.019 1.00 24.90 ? 135 LEU C C 1 ATOM 4332 O O . LEU C 1 135 ? 1.683 -12.227 -49.917 1.00 26.35 ? 135 LEU C O 1 ATOM 4333 C CB . LEU C 1 135 ? -0.029 -9.918 -48.981 1.00 15.87 ? 135 LEU C CB 1 ATOM 4334 C CG . LEU C 1 135 ? -0.675 -10.772 -47.871 1.00 18.91 ? 135 LEU C CG 1 ATOM 4335 C CD1 . LEU C 1 135 ? -0.239 -10.298 -46.496 1.00 22.19 ? 135 LEU C CD1 1 ATOM 4336 C CD2 . LEU C 1 135 ? -2.197 -10.818 -47.954 1.00 18.85 ? 135 LEU C CD2 1 ATOM 4337 N N . LEU C 1 136 ? 2.671 -11.774 -47.950 1.00 20.76 ? 136 LEU C N 1 ATOM 4338 C CA . LEU C 1 136 ? 2.985 -13.170 -47.653 1.00 21.95 ? 136 LEU C CA 1 ATOM 4339 C C . LEU C 1 136 ? 2.144 -13.603 -46.459 1.00 21.47 ? 136 LEU C C 1 ATOM 4340 O O . LEU C 1 136 ? 2.329 -13.105 -45.346 1.00 20.76 ? 136 LEU C O 1 ATOM 4341 C CB . LEU C 1 136 ? 4.467 -13.361 -47.332 1.00 13.57 ? 136 LEU C CB 1 ATOM 4342 C CG . LEU C 1 136 ? 5.527 -13.306 -48.428 1.00 13.62 ? 136 LEU C CG 1 ATOM 4343 C CD1 . LEU C 1 136 ? 5.479 -12.012 -49.237 1.00 13.24 ? 136 LEU C CD1 1 ATOM 4344 C CD2 . LEU C 1 136 ? 6.867 -13.432 -47.762 1.00 14.92 ? 136 LEU C CD2 1 ATOM 4345 N N . ASN C 1 137 ? 1.226 -14.542 -46.666 1.00 20.89 ? 137 ASN C N 1 ATOM 4346 C CA . ASN C 1 137 ? 0.204 -14.828 -45.665 1.00 17.73 ? 137 ASN C CA 1 ATOM 4347 C C . ASN C 1 137 ? 0.417 -16.163 -44.960 1.00 20.17 ? 137 ASN C C 1 ATOM 4348 O O . ASN C 1 137 ? 0.681 -17.187 -45.607 1.00 19.05 ? 137 ASN C O 1 ATOM 4349 C CB . ASN C 1 137 ? -1.187 -14.804 -46.283 1.00 22.42 ? 137 ASN C CB 1 ATOM 4350 C CG . ASN C 1 137 ? -2.230 -14.424 -45.278 1.00 26.42 ? 137 ASN C CG 1 ATOM 4351 O OD1 . ASN C 1 137 ? -1.977 -13.581 -44.413 1.00 27.84 ? 137 ASN C OD1 1 ATOM 4352 N ND2 . ASN C 1 137 ? -3.394 -15.059 -45.349 1.00 24.97 ? 137 ASN C ND2 1 ATOM 4353 N N . ASN C 1 138 ? 0.285 -16.135 -43.630 1.00 18.95 ? 138 ASN C N 1 ATOM 4354 C CA . ASN C 1 138 ? 0.233 -17.315 -42.765 1.00 22.15 ? 138 ASN C CA 1 ATOM 4355 C C . ASN C 1 138 ? 1.328 -18.360 -42.970 1.00 19.68 ? 138 ASN C C 1 ATOM 4356 O O . ASN C 1 138 ? 1.028 -19.481 -43.342 1.00 24.70 ? 138 ASN C O 1 ATOM 4357 C CB . ASN C 1 138 ? -1.138 -17.991 -42.880 1.00 24.28 ? 138 ASN C CB 1 ATOM 4358 C CG . ASN C 1 138 ? -2.274 -17.062 -42.510 1.00 30.10 ? 138 ASN C CG 1 ATOM 4359 O OD1 . ASN C 1 138 ? -2.047 -15.945 -42.041 1.00 35.77 ? 138 ASN C OD1 1 ATOM 4360 N ND2 . ASN C 1 138 ? -3.504 -17.519 -42.710 1.00 32.85 ? 138 ASN C ND2 1 ATOM 4361 N N . PHE C 1 139 ? 2.581 -17.998 -42.710 1.00 21.98 ? 139 PHE C N 1 ATOM 4362 C CA . PHE C 1 139 ? 3.715 -18.892 -42.963 1.00 20.63 ? 139 PHE C CA 1 ATOM 4363 C C . PHE C 1 139 ? 4.576 -19.106 -41.720 1.00 16.22 ? 139 PHE C C 1 ATOM 4364 O O . PHE C 1 139 ? 4.512 -18.335 -40.763 1.00 23.66 ? 139 PHE C O 1 ATOM 4365 C CB . PHE C 1 139 ? 4.588 -18.345 -44.106 1.00 22.22 ? 139 PHE C CB 1 ATOM 4366 C CG . PHE C 1 139 ? 5.197 -16.997 -43.815 1.00 16.73 ? 139 PHE C CG 1 ATOM 4367 C CD1 . PHE C 1 139 ? 4.498 -15.831 -44.103 1.00 14.65 ? 139 PHE C CD1 1 ATOM 4368 C CD2 . PHE C 1 139 ? 6.452 -16.896 -43.236 1.00 15.64 ? 139 PHE C CD2 1 ATOM 4369 C CE1 . PHE C 1 139 ? 5.040 -14.583 -43.826 1.00 17.47 ? 139 PHE C CE1 1 ATOM 4370 C CE2 . PHE C 1 139 ? 7.012 -15.648 -42.949 1.00 19.79 ? 139 PHE C CE2 1 ATOM 4371 C CZ . PHE C 1 139 ? 6.303 -14.490 -43.247 1.00 20.75 ? 139 PHE C CZ 1 ATOM 4372 N N . TYR C 1 140 ? 5.391 -20.154 -41.747 1.00 19.75 ? 140 TYR C N 1 ATOM 4373 C CA . TYR C 1 140 ? 6.309 -20.451 -40.653 1.00 17.65 ? 140 TYR C CA 1 ATOM 4374 C C . TYR C 1 140 ? 7.507 -21.206 -41.215 1.00 24.86 ? 140 TYR C C 1 ATOM 4375 O O . TYR C 1 140 ? 7.346 -22.081 -42.069 1.00 30.99 ? 140 TYR C O 1 ATOM 4376 C CB . TYR C 1 140 ? 5.624 -21.279 -39.551 1.00 18.08 ? 140 TYR C CB 1 ATOM 4377 C CG . TYR C 1 140 ? 6.511 -21.483 -38.342 1.00 21.88 ? 140 TYR C CG 1 ATOM 4378 C CD1 . TYR C 1 140 ? 7.407 -22.542 -38.280 1.00 22.19 ? 140 TYR C CD1 1 ATOM 4379 C CD2 . TYR C 1 140 ? 6.483 -20.591 -37.277 1.00 26.89 ? 140 TYR C CD2 1 ATOM 4380 C CE1 . TYR C 1 140 ? 8.250 -22.707 -37.182 1.00 27.21 ? 140 TYR C CE1 1 ATOM 4381 C CE2 . TYR C 1 140 ? 7.305 -20.755 -36.173 1.00 21.85 ? 140 TYR C CE2 1 ATOM 4382 C CZ . TYR C 1 140 ? 8.191 -21.807 -36.131 1.00 26.22 ? 140 TYR C CZ 1 ATOM 4383 O OH . TYR C 1 140 ? 9.018 -21.956 -35.036 1.00 24.98 ? 140 TYR C OH 1 ATOM 4384 N N . PRO C 1 141 ? 8.716 -20.885 -40.736 1.00 21.86 ? 141 PRO C N 1 ATOM 4385 C CA . PRO C 1 141 ? 9.057 -19.877 -39.721 1.00 25.18 ? 141 PRO C CA 1 ATOM 4386 C C . PRO C 1 141 ? 9.103 -18.435 -40.261 1.00 19.71 ? 141 PRO C C 1 ATOM 4387 O O . PRO C 1 141 ? 8.831 -18.200 -41.437 1.00 18.59 ? 141 PRO C O 1 ATOM 4388 C CB . PRO C 1 141 ? 10.454 -20.317 -39.274 1.00 26.19 ? 141 PRO C CB 1 ATOM 4389 C CG . PRO C 1 141 ? 11.052 -20.885 -40.519 1.00 22.92 ? 141 PRO C CG 1 ATOM 4390 C CD . PRO C 1 141 ? 9.905 -21.634 -41.175 1.00 21.38 ? 141 PRO C CD 1 ATOM 4391 N N . ARG C 1 142 ? 9.466 -17.494 -39.391 1.00 24.41 ? 142 ARG C N 1 ATOM 4392 C CA . ARG C 1 142 ? 9.379 -16.056 -39.671 1.00 27.93 ? 142 ARG C CA 1 ATOM 4393 C C . ARG C 1 142 ? 10.240 -15.566 -40.845 1.00 27.34 ? 142 ARG C C 1 ATOM 4394 O O . ARG C 1 142 ? 9.873 -14.614 -41.530 1.00 34.13 ? 142 ARG C O 1 ATOM 4395 C CB . ARG C 1 142 ? 9.707 -15.250 -38.399 1.00 31.16 ? 142 ARG C CB 1 ATOM 4396 C CG . ARG C 1 142 ? 9.495 -13.731 -38.519 1.00 33.83 ? 142 ARG C CG 1 ATOM 4397 C CD . ARG C 1 142 ? 9.654 -13.043 -37.171 1.00 42.04 ? 142 ARG C CD 1 ATOM 4398 N NE . ARG C 1 142 ? 10.989 -13.271 -36.621 1.00 59.80 ? 142 ARG C NE 1 ATOM 4399 C CZ . ARG C 1 142 ? 11.405 -12.858 -35.424 1.00 71.07 ? 142 ARG C CZ 1 ATOM 4400 N NH1 . ARG C 1 142 ? 10.580 -12.194 -34.622 1.00 76.85 ? 142 ARG C NH1 1 ATOM 4401 N NH2 . ARG C 1 142 ? 12.650 -13.110 -35.028 1.00 71.12 ? 142 ARG C NH2 1 ATOM 4402 N N . GLU C 1 143 ? 11.382 -16.204 -41.074 1.00 23.59 ? 143 GLU C N 1 ATOM 4403 C CA . GLU C 1 143 ? 12.307 -15.742 -42.106 1.00 31.45 ? 143 GLU C CA 1 ATOM 4404 C C . GLU C 1 143 ? 11.836 -16.019 -43.532 1.00 29.99 ? 143 GLU C C 1 ATOM 4405 O O . GLU C 1 143 ? 11.403 -17.123 -43.857 1.00 29.81 ? 143 GLU C O 1 ATOM 4406 C CB . GLU C 1 143 ? 13.721 -16.300 -41.904 1.00 38.92 ? 143 GLU C CB 1 ATOM 4407 C CG . GLU C 1 143 ? 14.726 -15.833 -42.980 1.00 53.70 ? 143 GLU C CG 1 ATOM 4408 C CD . GLU C 1 143 ? 14.734 -14.298 -43.213 1.00 66.44 ? 143 GLU C CD 1 ATOM 4409 O OE1 . GLU C 1 143 ? 14.650 -13.520 -42.234 1.00 68.67 ? 143 GLU C OE1 1 ATOM 4410 O OE2 . GLU C 1 143 ? 14.829 -13.869 -44.386 1.00 68.11 ? 143 GLU C OE2 1 ATOM 4411 N N . ALA C 1 144 ? 11.957 -14.998 -44.374 1.00 27.16 ? 144 ALA C N 1 ATOM 4412 C CA . ALA C 1 144 ? 11.477 -15.036 -45.746 1.00 22.86 ? 144 ALA C CA 1 ATOM 4413 C C . ALA C 1 144 ? 12.125 -13.887 -46.506 1.00 20.78 ? 144 ALA C C 1 ATOM 4414 O O . ALA C 1 144 ? 12.323 -12.802 -45.952 1.00 24.54 ? 144 ALA C O 1 ATOM 4415 C CB . ALA C 1 144 ? 9.949 -14.893 -45.775 1.00 17.07 ? 144 ALA C CB 1 ATOM 4416 N N . LYS C 1 145 ? 12.448 -14.121 -47.771 1.00 19.87 ? 145 LYS C N 1 ATOM 4417 C CA . LYS C 1 145 ? 13.025 -13.084 -48.626 1.00 22.28 ? 145 LYS C CA 1 ATOM 4418 C C . LYS C 1 145 ? 12.002 -12.638 -49.678 1.00 22.70 ? 145 LYS C C 1 ATOM 4419 O O . LYS C 1 145 ? 11.419 -13.465 -50.391 1.00 18.35 ? 145 LYS C O 1 ATOM 4420 C CB . LYS C 1 145 ? 14.287 -13.617 -49.311 1.00 22.91 ? 145 LYS C CB 1 ATOM 4421 C CG . LYS C 1 145 ? 15.269 -12.555 -49.796 1.00 35.07 ? 145 LYS C CG 1 ATOM 4422 C CD . LYS C 1 145 ? 16.368 -13.184 -50.658 1.00 40.09 ? 145 LYS C CD 1 ATOM 4423 C CE . LYS C 1 145 ? 17.459 -12.184 -51.007 1.00 45.03 ? 145 LYS C CE 1 ATOM 4424 N NZ . LYS C 1 145 ? 18.459 -11.968 -49.921 1.00 41.22 ? 145 LYS C NZ 1 ATOM 4425 N N . VAL C 1 146 ? 11.766 -11.333 -49.757 1.00 25.20 ? 146 VAL C N 1 ATOM 4426 C CA . VAL C 1 146 ? 10.939 -10.775 -50.812 1.00 16.28 ? 146 VAL C CA 1 ATOM 4427 C C . VAL C 1 146 ? 11.827 -9.918 -51.675 1.00 22.40 ? 146 VAL C C 1 ATOM 4428 O O . VAL C 1 146 ? 12.499 -9.021 -51.177 1.00 19.04 ? 146 VAL C O 1 ATOM 4429 C CB . VAL C 1 146 ? 9.829 -9.849 -50.270 1.00 18.80 ? 146 VAL C CB 1 ATOM 4430 C CG1 . VAL C 1 146 ? 9.050 -9.231 -51.430 1.00 16.61 ? 146 VAL C CG1 1 ATOM 4431 C CG2 . VAL C 1 146 ? 8.900 -10.599 -49.376 1.00 14.18 ? 146 VAL C CG2 1 ATOM 4432 N N . GLN C 1 147 ? 11.834 -10.193 -52.970 1.00 23.03 ? 147 GLN C N 1 ATOM 4433 C CA . GLN C 1 147 ? 12.537 -9.340 -53.917 1.00 21.73 ? 147 GLN C CA 1 ATOM 4434 C C . GLN C 1 147 ? 11.554 -8.747 -54.914 1.00 18.48 ? 147 GLN C C 1 ATOM 4435 O O . GLN C 1 147 ? 10.665 -9.447 -55.409 1.00 17.76 ? 147 GLN C O 1 ATOM 4436 C CB . GLN C 1 147 ? 13.643 -10.113 -54.641 1.00 24.21 ? 147 GLN C CB 1 ATOM 4437 C CG . GLN C 1 147 ? 14.796 -10.490 -53.728 1.00 34.40 ? 147 GLN C CG 1 ATOM 4438 C CD . GLN C 1 147 ? 15.972 -11.080 -54.474 1.00 38.83 ? 147 GLN C CD 1 ATOM 4439 O OE1 . GLN C 1 147 ? 15.825 -12.054 -55.216 1.00 43.85 ? 147 GLN C OE1 1 ATOM 4440 N NE2 . GLN C 1 147 ? 17.150 -10.485 -54.289 1.00 34.82 ? 147 GLN C NE2 1 ATOM 4441 N N . TRP C 1 148 ? 11.723 -7.450 -55.174 1.00 18.87 ? 148 TRP C N 1 ATOM 4442 C CA . TRP C 1 148 ? 10.941 -6.712 -56.151 1.00 16.09 ? 148 TRP C CA 1 ATOM 4443 C C . TRP C 1 148 ? 11.732 -6.560 -57.444 1.00 22.79 ? 148 TRP C C 1 ATOM 4444 O O . TRP C 1 148 ? 12.882 -6.127 -57.442 1.00 23.49 ? 148 TRP C O 1 ATOM 4445 C CB . TRP C 1 148 ? 10.595 -5.312 -55.627 1.00 16.55 ? 148 TRP C CB 1 ATOM 4446 C CG . TRP C 1 148 ? 9.547 -5.292 -54.573 1.00 24.70 ? 148 TRP C CG 1 ATOM 4447 C CD1 . TRP C 1 148 ? 9.743 -5.198 -53.223 1.00 24.34 ? 148 TRP C CD1 1 ATOM 4448 C CD2 . TRP C 1 148 ? 8.128 -5.363 -54.767 1.00 22.71 ? 148 TRP C CD2 1 ATOM 4449 N NE1 . TRP C 1 148 ? 8.538 -5.204 -52.568 1.00 21.59 ? 148 TRP C NE1 1 ATOM 4450 C CE2 . TRP C 1 148 ? 7.530 -5.302 -53.494 1.00 25.64 ? 148 TRP C CE2 1 ATOM 4451 C CE3 . TRP C 1 148 ? 7.306 -5.468 -55.894 1.00 20.15 ? 148 TRP C CE3 1 ATOM 4452 C CZ2 . TRP C 1 148 ? 6.145 -5.351 -53.316 1.00 27.40 ? 148 TRP C CZ2 1 ATOM 4453 C CZ3 . TRP C 1 148 ? 5.935 -5.509 -55.715 1.00 22.73 ? 148 TRP C CZ3 1 ATOM 4454 C CH2 . TRP C 1 148 ? 5.366 -5.454 -54.436 1.00 17.94 ? 148 TRP C CH2 1 ATOM 4455 N N . LYS C 1 149 ? 11.104 -6.907 -58.555 1.00 21.27 ? 149 LYS C N 1 ATOM 4456 C CA . LYS C 1 149 ? 11.685 -6.644 -59.863 1.00 28.21 ? 149 LYS C CA 1 ATOM 4457 C C . LYS C 1 149 ? 10.704 -5.835 -60.705 1.00 27.74 ? 149 LYS C C 1 ATOM 4458 O O . LYS C 1 149 ? 9.529 -6.179 -60.818 1.00 30.75 ? 149 LYS C O 1 ATOM 4459 C CB . LYS C 1 149 ? 12.052 -7.955 -60.567 1.00 26.64 ? 149 LYS C CB 1 ATOM 4460 C CG . LYS C 1 149 ? 13.379 -8.547 -60.116 1.00 29.02 ? 149 LYS C CG 1 ATOM 4461 C CD . LYS C 1 149 ? 13.419 -10.033 -60.396 1.00 40.74 ? 149 LYS C CD 1 ATOM 4462 C CE . LYS C 1 149 ? 14.642 -10.696 -59.787 1.00 45.66 ? 149 LYS C CE 1 ATOM 4463 N NZ . LYS C 1 149 ? 14.489 -12.185 -59.739 1.00 48.13 ? 149 LYS C NZ 1 ATOM 4464 N N . VAL C 1 150 ? 11.189 -4.743 -61.273 1.00 22.34 ? 150 VAL C N 1 ATOM 4465 C CA . VAL C 1 150 ? 10.386 -3.902 -62.146 1.00 23.84 ? 150 VAL C CA 1 ATOM 4466 C C . VAL C 1 150 ? 11.007 -3.997 -63.543 1.00 23.60 ? 150 VAL C C 1 ATOM 4467 O O . VAL C 1 150 ? 12.151 -3.589 -63.739 1.00 28.95 ? 150 VAL C O 1 ATOM 4468 C CB . VAL C 1 150 ? 10.392 -2.443 -61.657 1.00 17.42 ? 150 VAL C CB 1 ATOM 4469 C CG1 . VAL C 1 150 ? 9.603 -1.566 -62.587 1.00 17.37 ? 150 VAL C CG1 1 ATOM 4470 C CG2 . VAL C 1 150 ? 9.852 -2.356 -60.262 1.00 15.68 ? 150 VAL C CG2 1 ATOM 4471 N N . ASP C 1 151 ? 10.266 -4.568 -64.492 1.00 25.16 ? 151 ASP C N 1 ATOM 4472 C CA . ASP C 1 151 ? 10.823 -4.939 -65.798 1.00 29.30 ? 151 ASP C CA 1 ATOM 4473 C C . ASP C 1 151 ? 12.159 -5.673 -65.635 1.00 26.28 ? 151 ASP C C 1 ATOM 4474 O O . ASP C 1 151 ? 13.123 -5.405 -66.346 1.00 26.49 ? 151 ASP C O 1 ATOM 4475 C CB . ASP C 1 151 ? 10.991 -3.718 -66.712 1.00 26.91 ? 151 ASP C CB 1 ATOM 4476 C CG . ASP C 1 151 ? 9.666 -3.171 -67.216 1.00 30.56 ? 151 ASP C CG 1 ATOM 4477 O OD1 . ASP C 1 151 ? 8.696 -3.950 -67.301 1.00 31.05 ? 151 ASP C OD1 1 ATOM 4478 O OD2 . ASP C 1 151 ? 9.597 -1.966 -67.534 1.00 27.97 ? 151 ASP C OD2 1 ATOM 4479 N N . ASN C 1 152 ? 12.210 -6.575 -64.663 1.00 28.35 ? 152 ASN C N 1 ATOM 4480 C CA . ASN C 1 152 ? 13.397 -7.388 -64.399 1.00 29.53 ? 152 ASN C CA 1 ATOM 4481 C C . ASN C 1 152 ? 14.619 -6.667 -63.828 1.00 29.55 ? 152 ASN C C 1 ATOM 4482 O O . ASN C 1 152 ? 15.707 -7.234 -63.758 1.00 30.91 ? 152 ASN C O 1 ATOM 4483 C CB . ASN C 1 152 ? 13.766 -8.244 -65.614 1.00 32.47 ? 152 ASN C CB 1 ATOM 4484 C CG . ASN C 1 152 ? 13.002 -9.538 -65.634 1.00 51.05 ? 152 ASN C CG 1 ATOM 4485 O OD1 . ASN C 1 152 ? 12.113 -9.740 -66.466 1.00 60.75 ? 152 ASN C OD1 1 ATOM 4486 N ND2 . ASN C 1 152 ? 13.313 -10.419 -64.679 1.00 53.65 ? 152 ASN C ND2 1 ATOM 4487 N N . ALA C 1 153 ? 14.448 -5.422 -63.410 1.00 22.50 ? 153 ALA C N 1 ATOM 4488 C CA . ALA C 1 153 ? 15.522 -4.773 -62.690 1.00 22.16 ? 153 ALA C CA 1 ATOM 4489 C C . ALA C 1 153 ? 15.225 -5.005 -61.224 1.00 24.72 ? 153 ALA C C 1 ATOM 4490 O O . ALA C 1 153 ? 14.108 -4.734 -60.762 1.00 19.50 ? 153 ALA C O 1 ATOM 4491 C CB . ALA C 1 153 ? 15.588 -3.275 -63.023 1.00 20.39 ? 153 ALA C CB 1 ATOM 4492 N N . LEU C 1 154 ? 16.204 -5.549 -60.506 1.00 22.85 ? 154 LEU C N 1 ATOM 4493 C CA . LEU C 1 154 ? 16.059 -5.796 -59.082 1.00 21.77 ? 154 LEU C CA 1 ATOM 4494 C C . LEU C 1 154 ? 15.991 -4.457 -58.348 1.00 24.69 ? 154 LEU C C 1 ATOM 4495 O O . LEU C 1 154 ? 16.873 -3.618 -58.529 1.00 28.78 ? 154 LEU C O 1 ATOM 4496 C CB . LEU C 1 154 ? 17.237 -6.628 -58.566 1.00 20.69 ? 154 LEU C CB 1 ATOM 4497 C CG . LEU C 1 154 ? 17.306 -6.899 -57.049 1.00 19.63 ? 154 LEU C CG 1 ATOM 4498 C CD1 . LEU C 1 154 ? 16.078 -7.653 -56.542 1.00 20.51 ? 154 LEU C CD1 1 ATOM 4499 C CD2 . LEU C 1 154 ? 18.539 -7.674 -56.723 1.00 18.27 ? 154 LEU C CD2 1 ATOM 4500 N N . GLN C 1 155 ? 14.951 -4.250 -57.538 1.00 16.56 ? 155 GLN C N 1 ATOM 4501 C CA . GLN C 1 155 ? 14.828 -3.013 -56.760 1.00 15.61 ? 155 GLN C CA 1 ATOM 4502 C C . GLN C 1 155 ? 15.608 -3.139 -55.481 1.00 22.09 ? 155 GLN C C 1 ATOM 4503 O O . GLN C 1 155 ? 15.601 -4.189 -54.837 1.00 20.17 ? 155 GLN C O 1 ATOM 4504 C CB . GLN C 1 155 ? 13.376 -2.684 -56.412 1.00 15.60 ? 155 GLN C CB 1 ATOM 4505 C CG . GLN C 1 155 ? 12.458 -2.577 -57.611 1.00 20.86 ? 155 GLN C CG 1 ATOM 4506 C CD . GLN C 1 155 ? 12.886 -1.498 -58.601 1.00 24.96 ? 155 GLN C CD 1 ATOM 4507 O OE1 . GLN C 1 155 ? 12.821 -0.305 -58.303 1.00 23.93 ? 155 GLN C OE1 1 ATOM 4508 N NE2 . GLN C 1 155 ? 13.312 -1.916 -59.790 1.00 25.14 ? 155 GLN C NE2 1 ATOM 4509 N N . SER C 1 156 ? 16.282 -2.060 -55.109 1.00 23.13 ? 156 SER C N 1 ATOM 4510 C CA . SER C 1 156 ? 17.015 -2.022 -53.857 1.00 16.50 ? 156 SER C CA 1 ATOM 4511 C C . SER C 1 156 ? 16.923 -0.639 -53.218 1.00 18.81 ? 156 SER C C 1 ATOM 4512 O O . SER C 1 156 ? 17.245 0.376 -53.848 1.00 19.78 ? 156 SER C O 1 ATOM 4513 C CB . SER C 1 156 ? 18.480 -2.402 -54.086 1.00 14.43 ? 156 SER C CB 1 ATOM 4514 O OG . SER C 1 156 ? 19.203 -2.377 -52.864 1.00 14.31 ? 156 SER C OG 1 ATOM 4515 N N . GLY C 1 157 ? 16.488 -0.610 -51.960 1.00 21.00 ? 157 GLY C N 1 ATOM 4516 C CA . GLY C 1 157 ? 16.436 0.619 -51.191 1.00 13.54 ? 157 GLY C CA 1 ATOM 4517 C C . GLY C 1 157 ? 15.102 1.346 -51.236 1.00 21.90 ? 157 GLY C C 1 ATOM 4518 O O . GLY C 1 157 ? 14.956 2.381 -50.604 1.00 22.32 ? 157 GLY C O 1 ATOM 4519 N N . ASN C 1 158 ? 14.124 0.822 -51.975 1.00 13.70 ? 158 ASN C N 1 ATOM 4520 C CA . ASN C 1 158 ? 12.832 1.498 -52.098 1.00 14.10 ? 158 ASN C CA 1 ATOM 4521 C C . ASN C 1 158 ? 11.666 0.635 -51.594 1.00 25.57 ? 158 ASN C C 1 ATOM 4522 O O . ASN C 1 158 ? 10.504 0.791 -52.022 1.00 19.68 ? 158 ASN C O 1 ATOM 4523 C CB . ASN C 1 158 ? 12.600 1.954 -53.538 1.00 14.57 ? 158 ASN C CB 1 ATOM 4524 C CG . ASN C 1 158 ? 12.797 0.836 -54.538 1.00 14.62 ? 158 ASN C CG 1 ATOM 4525 O OD1 . ASN C 1 158 ? 13.069 -0.304 -54.166 1.00 20.77 ? 158 ASN C OD1 1 ATOM 4526 N ND2 . ASN C 1 158 ? 12.648 1.154 -55.812 1.00 15.19 ? 158 ASN C ND2 1 ATOM 4527 N N . SER C 1 159 ? 11.986 -0.279 -50.683 1.00 13.71 ? 159 SER C N 1 ATOM 4528 C CA . SER C 1 159 ? 10.975 -1.140 -50.115 1.00 20.90 ? 159 SER C CA 1 ATOM 4529 C C . SER C 1 159 ? 11.109 -1.209 -48.592 1.00 21.15 ? 159 SER C C 1 ATOM 4530 O O . SER C 1 159 ? 12.195 -1.006 -48.033 1.00 20.20 ? 159 SER C O 1 ATOM 4531 C CB . SER C 1 159 ? 11.021 -2.533 -50.753 1.00 15.23 ? 159 SER C CB 1 ATOM 4532 O OG . SER C 1 159 ? 12.202 -3.224 -50.390 1.00 19.21 ? 159 SER C OG 1 ATOM 4533 N N . GLN C 1 160 ? 9.990 -1.461 -47.921 1.00 19.61 ? 160 GLN C N 1 ATOM 4534 C CA . GLN C 1 160 ? 9.985 -1.646 -46.470 1.00 20.38 ? 160 GLN C CA 1 ATOM 4535 C C . GLN C 1 160 ? 9.088 -2.823 -46.146 1.00 20.93 ? 160 GLN C C 1 ATOM 4536 O O . GLN C 1 160 ? 8.053 -3.013 -46.788 1.00 17.15 ? 160 GLN C O 1 ATOM 4537 C CB . GLN C 1 160 ? 9.476 -0.399 -45.733 1.00 18.70 ? 160 GLN C CB 1 ATOM 4538 C CG . GLN C 1 160 ? 10.470 0.737 -45.651 1.00 23.07 ? 160 GLN C CG 1 ATOM 4539 C CD . GLN C 1 160 ? 9.988 1.857 -44.740 1.00 30.13 ? 160 GLN C CD 1 ATOM 4540 O OE1 . GLN C 1 160 ? 8.948 2.467 -44.990 1.00 34.80 ? 160 GLN C OE1 1 ATOM 4541 N NE2 . GLN C 1 160 ? 10.741 2.124 -43.668 1.00 25.33 ? 160 GLN C NE2 1 ATOM 4542 N N . GLU C 1 161 ? 9.481 -3.607 -45.148 1.00 17.85 ? 161 GLU C N 1 ATOM 4543 C CA . GLU C 1 161 ? 8.689 -4.762 -44.753 1.00 21.58 ? 161 GLU C CA 1 ATOM 4544 C C . GLU C 1 161 ? 8.100 -4.573 -43.380 1.00 21.12 ? 161 GLU C C 1 ATOM 4545 O O . GLU C 1 161 ? 8.571 -3.753 -42.609 1.00 23.15 ? 161 GLU C O 1 ATOM 4546 C CB . GLU C 1 161 ? 9.551 -6.014 -44.720 1.00 21.90 ? 161 GLU C CB 1 ATOM 4547 C CG . GLU C 1 161 ? 10.058 -6.473 -46.055 1.00 31.85 ? 161 GLU C CG 1 ATOM 4548 C CD . GLU C 1 161 ? 10.736 -7.800 -45.909 1.00 38.49 ? 161 GLU C CD 1 ATOM 4549 O OE1 . GLU C 1 161 ? 10.757 -8.303 -44.760 1.00 36.32 ? 161 GLU C OE1 1 ATOM 4550 O OE2 . GLU C 1 161 ? 11.237 -8.332 -46.922 1.00 40.52 ? 161 GLU C OE2 1 ATOM 4551 N N . SER C 1 162 ? 7.083 -5.369 -43.078 1.00 23.63 ? 162 SER C N 1 ATOM 4552 C CA . SER C 1 162 ? 6.480 -5.403 -41.758 1.00 14.98 ? 162 SER C CA 1 ATOM 4553 C C . SER C 1 162 ? 5.920 -6.808 -41.525 1.00 18.09 ? 162 SER C C 1 ATOM 4554 O O . SER C 1 162 ? 5.340 -7.416 -42.435 1.00 19.79 ? 162 SER C O 1 ATOM 4555 C CB . SER C 1 162 ? 5.387 -4.345 -41.650 1.00 15.64 ? 162 SER C CB 1 ATOM 4556 O OG . SER C 1 162 ? 4.764 -4.374 -40.383 1.00 25.39 ? 162 SER C OG 1 ATOM 4557 N N . VAL C 1 163 ? 6.120 -7.329 -40.316 1.00 15.35 ? 163 VAL C N 1 ATOM 4558 C CA . VAL C 1 163 ? 5.789 -8.705 -40.009 1.00 15.72 ? 163 VAL C CA 1 ATOM 4559 C C . VAL C 1 163 ? 4.903 -8.723 -38.771 1.00 21.63 ? 163 VAL C C 1 ATOM 4560 O O . VAL C 1 163 ? 5.201 -8.061 -37.775 1.00 16.76 ? 163 VAL C O 1 ATOM 4561 C CB . VAL C 1 163 ? 7.064 -9.532 -39.722 1.00 20.10 ? 163 VAL C CB 1 ATOM 4562 C CG1 . VAL C 1 163 ? 6.738 -11.031 -39.619 1.00 16.06 ? 163 VAL C CG1 1 ATOM 4563 C CG2 . VAL C 1 163 ? 8.103 -9.294 -40.788 1.00 20.02 ? 163 VAL C CG2 1 ATOM 4564 N N . THR C 1 164 ? 3.808 -9.471 -38.822 1.00 16.64 ? 164 THR C N 1 ATOM 4565 C CA . THR C 1 164 ? 2.956 -9.592 -37.643 1.00 16.78 ? 164 THR C CA 1 ATOM 4566 C C . THR C 1 164 ? 3.661 -10.367 -36.543 1.00 18.96 ? 164 THR C C 1 ATOM 4567 O O . THR C 1 164 ? 4.664 -11.055 -36.772 1.00 18.91 ? 164 THR C O 1 ATOM 4568 C CB . THR C 1 164 ? 1.656 -10.341 -37.947 1.00 18.21 ? 164 THR C CB 1 ATOM 4569 O OG1 . THR C 1 164 ? 1.966 -11.567 -38.617 1.00 22.63 ? 164 THR C OG1 1 ATOM 4570 C CG2 . THR C 1 164 ? 0.739 -9.504 -38.810 1.00 16.87 ? 164 THR C CG2 1 ATOM 4571 N N . GLU C 1 165 ? 3.132 -10.247 -35.338 1.00 22.65 ? 165 GLU C N 1 ATOM 4572 C CA . GLU C 1 165 ? 3.538 -11.136 -34.267 1.00 20.37 ? 165 GLU C CA 1 ATOM 4573 C C . GLU C 1 165 ? 2.932 -12.506 -34.526 1.00 22.74 ? 165 GLU C C 1 ATOM 4574 O O . GLU C 1 165 ? 1.997 -12.637 -35.318 1.00 22.06 ? 165 GLU C O 1 ATOM 4575 C CB . GLU C 1 165 ? 3.094 -10.585 -32.911 1.00 21.00 ? 165 GLU C CB 1 ATOM 4576 C CG . GLU C 1 165 ? 3.959 -9.420 -32.441 1.00 29.46 ? 165 GLU C CG 1 ATOM 4577 C CD . GLU C 1 165 ? 5.421 -9.809 -32.311 1.00 35.14 ? 165 GLU C CD 1 ATOM 4578 O OE1 . GLU C 1 165 ? 5.712 -11.015 -32.123 1.00 40.75 ? 165 GLU C OE1 1 ATOM 4579 O OE2 . GLU C 1 165 ? 6.284 -8.910 -32.399 1.00 30.00 ? 165 GLU C OE2 1 ATOM 4580 N N . GLN C 1 166 ? 3.473 -13.530 -33.884 1.00 26.56 ? 166 GLN C N 1 ATOM 4581 C CA . GLN C 1 166 ? 2.980 -14.876 -34.119 1.00 29.51 ? 166 GLN C CA 1 ATOM 4582 C C . GLN C 1 166 ? 1.483 -14.957 -33.828 1.00 24.50 ? 166 GLN C C 1 ATOM 4583 O O . GLN C 1 166 ? 1.020 -14.502 -32.779 1.00 23.81 ? 166 GLN C O 1 ATOM 4584 C CB . GLN C 1 166 ? 3.750 -15.882 -33.278 1.00 30.90 ? 166 GLN C CB 1 ATOM 4585 C CG . GLN C 1 166 ? 3.982 -17.165 -34.002 1.00 31.63 ? 166 GLN C CG 1 ATOM 4586 C CD . GLN C 1 166 ? 4.755 -18.174 -33.186 1.00 31.16 ? 166 GLN C CD 1 ATOM 4587 O OE1 . GLN C 1 166 ? 5.075 -17.940 -32.024 1.00 33.40 ? 166 GLN C OE1 1 ATOM 4588 N NE2 . GLN C 1 166 ? 5.059 -19.310 -33.796 1.00 27.21 ? 166 GLN C NE2 1 ATOM 4589 N N . ASP C 1 167 ? 0.726 -15.498 -34.781 1.00 22.44 ? 167 ASP C N 1 ATOM 4590 C CA . ASP C 1 167 ? -0.724 -15.583 -34.642 1.00 21.01 ? 167 ASP C CA 1 ATOM 4591 C C . ASP C 1 167 ? -1.144 -16.475 -33.476 1.00 19.64 ? 167 ASP C C 1 ATOM 4592 O O . ASP C 1 167 ? -0.673 -17.593 -33.335 1.00 24.66 ? 167 ASP C O 1 ATOM 4593 C CB . ASP C 1 167 ? -1.358 -16.087 -35.935 1.00 22.58 ? 167 ASP C CB 1 ATOM 4594 C CG . ASP C 1 167 ? -2.859 -16.274 -35.812 1.00 30.99 ? 167 ASP C CG 1 ATOM 4595 O OD1 . ASP C 1 167 ? -3.291 -17.352 -35.372 1.00 33.04 ? 167 ASP C OD1 1 ATOM 4596 O OD2 . ASP C 1 167 ? -3.613 -15.344 -36.146 1.00 38.39 ? 167 ASP C OD2 1 ATOM 4597 N N . SER C 1 168 ? -2.055 -15.989 -32.650 1.00 23.67 ? 168 SER C N 1 ATOM 4598 C CA . SER C 1 168 ? -2.424 -16.731 -31.444 1.00 26.41 ? 168 SER C CA 1 ATOM 4599 C C . SER C 1 168 ? -3.237 -18.004 -31.716 1.00 24.15 ? 168 SER C C 1 ATOM 4600 O O . SER C 1 168 ? -3.460 -18.800 -30.806 1.00 26.99 ? 168 SER C O 1 ATOM 4601 C CB . SER C 1 168 ? -3.158 -15.822 -30.452 1.00 23.92 ? 168 SER C CB 1 ATOM 4602 O OG . SER C 1 168 ? -4.422 -15.431 -30.956 1.00 26.06 ? 168 SER C OG 1 ATOM 4603 N N . LYS C 1 169 ? -3.674 -18.207 -32.957 1.00 23.76 ? 169 LYS C N 1 ATOM 4604 C CA . LYS C 1 169 ? -4.502 -19.373 -33.255 1.00 27.45 ? 169 LYS C CA 1 ATOM 4605 C C . LYS C 1 169 ? -3.740 -20.498 -33.962 1.00 24.14 ? 169 LYS C C 1 ATOM 4606 O O . LYS C 1 169 ? -3.878 -21.662 -33.594 1.00 29.49 ? 169 LYS C O 1 ATOM 4607 C CB . LYS C 1 169 ? -5.764 -18.970 -34.030 1.00 24.59 ? 169 LYS C CB 1 ATOM 4608 N N . ASP C 1 170 ? -2.918 -20.153 -34.950 1.00 22.36 ? 170 ASP C N 1 ATOM 4609 C CA . ASP C 1 170 ? -2.193 -21.160 -35.741 1.00 22.97 ? 170 ASP C CA 1 ATOM 4610 C C . ASP C 1 170 ? -0.669 -20.991 -35.703 1.00 24.20 ? 170 ASP C C 1 ATOM 4611 O O . ASP C 1 170 ? 0.065 -21.725 -36.384 1.00 22.17 ? 170 ASP C O 1 ATOM 4612 C CB . ASP C 1 170 ? -2.682 -21.175 -37.197 1.00 20.39 ? 170 ASP C CB 1 ATOM 4613 C CG . ASP C 1 170 ? -2.465 -19.836 -37.918 1.00 28.58 ? 170 ASP C CG 1 ATOM 4614 O OD1 . ASP C 1 170 ? -1.615 -19.018 -37.486 1.00 26.43 ? 170 ASP C OD1 1 ATOM 4615 O OD2 . ASP C 1 170 ? -3.150 -19.612 -38.937 1.00 29.67 ? 170 ASP C OD2 1 ATOM 4616 N N . SER C 1 171 ? -0.215 -19.996 -34.940 1.00 21.61 ? 171 SER C N 1 ATOM 4617 C CA . SER C 1 171 ? 1.217 -19.744 -34.722 1.00 21.21 ? 171 SER C CA 1 ATOM 4618 C C . SER C 1 171 ? 2.011 -19.316 -35.966 1.00 21.71 ? 171 SER C C 1 ATOM 4619 O O . SER C 1 171 ? 3.241 -19.439 -35.985 1.00 19.93 ? 171 SER C O 1 ATOM 4620 C CB . SER C 1 171 ? 1.887 -20.950 -34.052 1.00 19.30 ? 171 SER C CB 1 ATOM 4621 O OG . SER C 1 171 ? 1.168 -21.358 -32.901 1.00 22.95 ? 171 SER C OG 1 ATOM 4622 N N . THR C 1 172 ? 1.324 -18.802 -36.985 1.00 16.62 ? 172 THR C N 1 ATOM 4623 C CA . THR C 1 172 ? 2.009 -18.338 -38.195 1.00 17.99 ? 172 THR C CA 1 ATOM 4624 C C . THR C 1 172 ? 2.370 -16.860 -38.165 1.00 20.22 ? 172 THR C C 1 ATOM 4625 O O . THR C 1 172 ? 1.931 -16.100 -37.289 1.00 24.02 ? 172 THR C O 1 ATOM 4626 C CB . THR C 1 172 ? 1.173 -18.572 -39.471 1.00 20.61 ? 172 THR C CB 1 ATOM 4627 O OG1 . THR C 1 172 ? -0.037 -17.802 -39.406 1.00 18.77 ? 172 THR C OG1 1 ATOM 4628 C CG2 . THR C 1 172 ? 0.842 -20.047 -39.635 1.00 16.61 ? 172 THR C CG2 1 ATOM 4629 N N . TYR C 1 173 ? 3.167 -16.458 -39.145 1.00 20.51 ? 173 TYR C N 1 ATOM 4630 C CA . TYR C 1 173 ? 3.466 -15.055 -39.354 1.00 19.81 ? 173 TYR C CA 1 ATOM 4631 C C . TYR C 1 173 ? 2.859 -14.602 -40.676 1.00 17.50 ? 173 TYR C C 1 ATOM 4632 O O . TYR C 1 173 ? 2.593 -15.409 -41.555 1.00 15.77 ? 173 TYR C O 1 ATOM 4633 C CB . TYR C 1 173 ? 4.979 -14.816 -39.394 1.00 16.67 ? 173 TYR C CB 1 ATOM 4634 C CG . TYR C 1 173 ? 5.693 -15.169 -38.121 1.00 22.18 ? 173 TYR C CG 1 ATOM 4635 C CD1 . TYR C 1 173 ? 6.201 -16.449 -37.920 1.00 26.38 ? 173 TYR C CD1 1 ATOM 4636 C CD2 . TYR C 1 173 ? 5.869 -14.223 -37.115 1.00 25.83 ? 173 TYR C CD2 1 ATOM 4637 C CE1 . TYR C 1 173 ? 6.859 -16.780 -36.750 1.00 28.47 ? 173 TYR C CE1 1 ATOM 4638 C CE2 . TYR C 1 173 ? 6.525 -14.544 -35.933 1.00 24.87 ? 173 TYR C CE2 1 ATOM 4639 C CZ . TYR C 1 173 ? 7.016 -15.824 -35.757 1.00 27.68 ? 173 TYR C CZ 1 ATOM 4640 O OH . TYR C 1 173 ? 7.665 -16.157 -34.592 1.00 35.16 ? 173 TYR C OH 1 ATOM 4641 N N . SER C 1 174 ? 2.648 -13.302 -40.809 1.00 18.77 ? 174 SER C N 1 ATOM 4642 C CA . SER C 1 174 ? 2.343 -12.715 -42.094 1.00 13.81 ? 174 SER C CA 1 ATOM 4643 C C . SER C 1 174 ? 3.246 -11.502 -42.281 1.00 15.11 ? 174 SER C C 1 ATOM 4644 O O . SER C 1 174 ? 3.702 -10.894 -41.311 1.00 19.52 ? 174 SER C O 1 ATOM 4645 C CB . SER C 1 174 ? 0.863 -12.326 -42.194 1.00 14.44 ? 174 SER C CB 1 ATOM 4646 O OG . SER C 1 174 ? 0.021 -13.473 -42.212 1.00 21.50 ? 174 SER C OG 1 ATOM 4647 N N . LEU C 1 175 ? 3.491 -11.163 -43.540 1.00 14.52 ? 175 LEU C N 1 ATOM 4648 C CA . LEU C 1 175 ? 4.452 -10.142 -43.912 1.00 15.75 ? 175 LEU C CA 1 ATOM 4649 C C . LEU C 1 175 ? 3.877 -9.337 -45.078 1.00 20.29 ? 175 LEU C C 1 ATOM 4650 O O . LEU C 1 175 ? 3.305 -9.887 -46.016 1.00 12.85 ? 175 LEU C O 1 ATOM 4651 C CB . LEU C 1 175 ? 5.786 -10.782 -44.314 1.00 12.78 ? 175 LEU C CB 1 ATOM 4652 C CG . LEU C 1 175 ? 6.953 -9.869 -44.741 1.00 26.49 ? 175 LEU C CG 1 ATOM 4653 C CD1 . LEU C 1 175 ? 8.320 -10.506 -44.429 1.00 17.91 ? 175 LEU C CD1 1 ATOM 4654 C CD2 . LEU C 1 175 ? 6.891 -9.503 -46.226 1.00 25.35 ? 175 LEU C CD2 1 ATOM 4655 N N . SER C 1 176 ? 4.028 -8.025 -44.996 1.00 20.30 ? 176 SER C N 1 ATOM 4656 C CA . SER C 1 176 ? 3.725 -7.147 -46.105 1.00 19.63 ? 176 SER C CA 1 ATOM 4657 C C . SER C 1 176 ? 5.010 -6.432 -46.476 1.00 20.93 ? 176 SER C C 1 ATOM 4658 O O . SER C 1 176 ? 5.693 -5.876 -45.610 1.00 20.66 ? 176 SER C O 1 ATOM 4659 C CB . SER C 1 176 ? 2.684 -6.113 -45.700 1.00 16.55 ? 176 SER C CB 1 ATOM 4660 O OG . SER C 1 176 ? 3.242 -5.234 -44.739 1.00 28.59 ? 176 SER C OG 1 ATOM 4661 N N . SER C 1 177 ? 5.341 -6.455 -47.760 1.00 13.92 ? 177 SER C N 1 ATOM 4662 C CA . SER C 1 177 ? 6.427 -5.642 -48.283 1.00 15.05 ? 177 SER C CA 1 ATOM 4663 C C . SER C 1 177 ? 5.811 -4.559 -49.147 1.00 20.28 ? 177 SER C C 1 ATOM 4664 O O . SER C 1 177 ? 4.980 -4.847 -50.025 1.00 20.02 ? 177 SER C O 1 ATOM 4665 C CB . SER C 1 177 ? 7.402 -6.496 -49.110 1.00 15.71 ? 177 SER C CB 1 ATOM 4666 O OG . SER C 1 177 ? 8.336 -5.693 -49.805 1.00 19.22 ? 177 SER C OG 1 ATOM 4667 N N . THR C 1 178 ? 6.199 -3.312 -48.893 1.00 17.88 ? 178 THR C N 1 ATOM 4668 C CA . THR C 1 178 ? 5.728 -2.199 -49.714 1.00 18.24 ? 178 THR C CA 1 ATOM 4669 C C . THR C 1 178 ? 6.837 -1.585 -50.545 1.00 18.17 ? 178 THR C C 1 ATOM 4670 O O . THR C 1 178 ? 7.868 -1.175 -50.009 1.00 21.75 ? 178 THR C O 1 ATOM 4671 C CB . THR C 1 178 ? 5.111 -1.092 -48.871 1.00 15.16 ? 178 THR C CB 1 ATOM 4672 O OG1 . THR C 1 178 ? 4.058 -1.642 -48.079 1.00 20.87 ? 178 THR C OG1 1 ATOM 4673 C CG2 . THR C 1 178 ? 4.553 0.029 -49.781 1.00 19.21 ? 178 THR C CG2 1 ATOM 4674 N N . LEU C 1 179 ? 6.610 -1.515 -51.854 1.00 14.68 ? 179 LEU C N 1 ATOM 4675 C CA . LEU C 1 179 ? 7.552 -0.879 -52.777 1.00 16.20 ? 179 LEU C CA 1 ATOM 4676 C C . LEU C 1 179 ? 7.031 0.512 -53.117 1.00 15.12 ? 179 LEU C C 1 ATOM 4677 O O . LEU C 1 179 ? 5.874 0.669 -53.518 1.00 19.12 ? 179 LEU C O 1 ATOM 4678 C CB . LEU C 1 179 ? 7.716 -1.718 -54.055 1.00 14.03 ? 179 LEU C CB 1 ATOM 4679 C CG . LEU C 1 179 ? 8.503 -1.069 -55.194 1.00 20.20 ? 179 LEU C CG 1 ATOM 4680 C CD1 . LEU C 1 179 ? 10.018 -1.100 -54.923 1.00 14.79 ? 179 LEU C CD1 1 ATOM 4681 C CD2 . LEU C 1 179 ? 8.159 -1.728 -56.534 1.00 15.90 ? 179 LEU C CD2 1 ATOM 4682 N N . THR C 1 180 ? 7.876 1.522 -52.934 1.00 17.01 ? 180 THR C N 1 ATOM 4683 C CA . THR C 1 180 ? 7.472 2.916 -53.146 1.00 16.83 ? 180 THR C CA 1 ATOM 4684 C C . THR C 1 180 ? 8.207 3.562 -54.334 1.00 23.07 ? 180 THR C C 1 ATOM 4685 O O . THR C 1 180 ? 9.436 3.598 -54.372 1.00 22.11 ? 180 THR C O 1 ATOM 4686 C CB . THR C 1 180 ? 7.712 3.757 -51.874 1.00 24.09 ? 180 THR C CB 1 ATOM 4687 O OG1 . THR C 1 180 ? 7.030 3.154 -50.767 1.00 23.88 ? 180 THR C OG1 1 ATOM 4688 C CG2 . THR C 1 180 ? 7.198 5.164 -52.063 1.00 19.28 ? 180 THR C CG2 1 ATOM 4689 N N . LEU C 1 181 ? 7.443 4.065 -55.299 1.00 20.30 ? 181 LEU C N 1 ATOM 4690 C CA . LEU C 1 181 ? 7.999 4.653 -56.508 1.00 17.88 ? 181 LEU C CA 1 ATOM 4691 C C . LEU C 1 181 ? 7.306 5.973 -56.768 1.00 21.26 ? 181 LEU C C 1 ATOM 4692 O O . LEU C 1 181 ? 6.153 6.153 -56.366 1.00 24.69 ? 181 LEU C O 1 ATOM 4693 C CB . LEU C 1 181 ? 7.725 3.745 -57.708 1.00 25.81 ? 181 LEU C CB 1 ATOM 4694 C CG . LEU C 1 181 ? 8.332 2.347 -57.770 1.00 29.89 ? 181 LEU C CG 1 ATOM 4695 C CD1 . LEU C 1 181 ? 7.759 1.579 -58.966 1.00 24.06 ? 181 LEU C CD1 1 ATOM 4696 C CD2 . LEU C 1 181 ? 9.867 2.410 -57.824 1.00 27.64 ? 181 LEU C CD2 1 ATOM 4697 N N . SER C 1 182 ? 7.994 6.885 -57.456 1.00 21.00 ? 182 SER C N 1 ATOM 4698 C CA . SER C 1 182 ? 7.358 8.113 -57.930 1.00 23.95 ? 182 SER C CA 1 ATOM 4699 C C . SER C 1 182 ? 6.313 7.720 -58.954 1.00 20.93 ? 182 SER C C 1 ATOM 4700 O O . SER C 1 182 ? 6.432 6.662 -59.569 1.00 19.97 ? 182 SER C O 1 ATOM 4701 C CB . SER C 1 182 ? 8.389 9.045 -58.584 1.00 28.86 ? 182 SER C CB 1 ATOM 4702 O OG . SER C 1 182 ? 8.833 8.552 -59.847 1.00 26.36 ? 182 SER C OG 1 ATOM 4703 N N . LYS C 1 183 ? 5.302 8.557 -59.165 1.00 22.16 ? 183 LYS C N 1 ATOM 4704 C CA . LYS C 1 183 ? 4.350 8.269 -60.238 1.00 25.33 ? 183 LYS C CA 1 ATOM 4705 C C . LYS C 1 183 ? 5.068 8.148 -61.577 1.00 28.19 ? 183 LYS C C 1 ATOM 4706 O O . LYS C 1 183 ? 4.808 7.225 -62.357 1.00 29.96 ? 183 LYS C O 1 ATOM 4707 C CB . LYS C 1 183 ? 3.263 9.334 -60.343 1.00 26.80 ? 183 LYS C CB 1 ATOM 4708 C CG . LYS C 1 183 ? 2.265 9.064 -61.469 1.00 28.02 ? 183 LYS C CG 1 ATOM 4709 C CD . LYS C 1 183 ? 1.262 10.209 -61.637 1.00 37.74 ? 183 LYS C CD 1 ATOM 4710 C CE . LYS C 1 183 ? 0.222 9.904 -62.726 1.00 43.15 ? 183 LYS C CE 1 ATOM 4711 N NZ . LYS C 1 183 ? -0.650 11.081 -63.028 1.00 49.90 ? 183 LYS C NZ 1 ATOM 4712 N N . ALA C 1 184 ? 5.976 9.084 -61.829 1.00 22.77 ? 184 ALA C N 1 ATOM 4713 C CA . ALA C 1 184 ? 6.769 9.090 -63.063 1.00 30.90 ? 184 ALA C CA 1 ATOM 4714 C C . ALA C 1 184 ? 7.493 7.768 -63.325 1.00 27.38 ? 184 ALA C C 1 ATOM 4715 O O . ALA C 1 184 ? 7.401 7.235 -64.429 1.00 32.02 ? 184 ALA C O 1 ATOM 4716 C CB . ALA C 1 184 ? 7.769 10.251 -63.068 1.00 23.71 ? 184 ALA C CB 1 ATOM 4717 N N . ASP C 1 185 ? 8.212 7.252 -62.323 1.00 24.52 ? 185 ASP C N 1 ATOM 4718 C CA . ASP C 1 185 ? 8.907 5.970 -62.475 1.00 27.50 ? 185 ASP C CA 1 ATOM 4719 C C . ASP C 1 185 ? 7.921 4.848 -62.765 1.00 26.27 ? 185 ASP C C 1 ATOM 4720 O O . ASP C 1 185 ? 8.147 4.038 -63.669 1.00 19.45 ? 185 ASP C O 1 ATOM 4721 C CB . ASP C 1 185 ? 9.761 5.609 -61.249 1.00 29.15 ? 185 ASP C CB 1 ATOM 4722 C CG . ASP C 1 185 ? 11.104 6.340 -61.225 1.00 38.51 ? 185 ASP C CG 1 ATOM 4723 O OD1 . ASP C 1 185 ? 11.448 7.006 -62.228 1.00 38.79 ? 185 ASP C OD1 1 ATOM 4724 O OD2 . ASP C 1 185 ? 11.826 6.240 -60.206 1.00 40.93 ? 185 ASP C OD2 1 ATOM 4725 N N . TYR C 1 186 ? 6.832 4.816 -61.999 1.00 19.21 ? 186 TYR C N 1 ATOM 4726 C CA . TYR C 1 186 ? 5.803 3.797 -62.163 1.00 19.00 ? 186 TYR C CA 1 ATOM 4727 C C . TYR C 1 186 ? 5.250 3.779 -63.590 1.00 25.31 ? 186 TYR C C 1 ATOM 4728 O O . TYR C 1 186 ? 5.083 2.711 -64.190 1.00 22.73 ? 186 TYR C O 1 ATOM 4729 C CB . TYR C 1 186 ? 4.666 4.010 -61.168 1.00 19.12 ? 186 TYR C CB 1 ATOM 4730 C CG . TYR C 1 186 ? 3.554 2.991 -61.292 1.00 25.25 ? 186 TYR C CG 1 ATOM 4731 C CD1 . TYR C 1 186 ? 3.750 1.664 -60.909 1.00 25.04 ? 186 TYR C CD1 1 ATOM 4732 C CD2 . TYR C 1 186 ? 2.303 3.349 -61.789 1.00 23.31 ? 186 TYR C CD2 1 ATOM 4733 C CE1 . TYR C 1 186 ? 2.730 0.721 -61.022 1.00 18.64 ? 186 TYR C CE1 1 ATOM 4734 C CE2 . TYR C 1 186 ? 1.274 2.411 -61.904 1.00 23.48 ? 186 TYR C CE2 1 ATOM 4735 C CZ . TYR C 1 186 ? 1.495 1.099 -61.515 1.00 25.00 ? 186 TYR C CZ 1 ATOM 4736 O OH . TYR C 1 186 ? 0.483 0.165 -61.628 1.00 27.92 ? 186 TYR C OH 1 ATOM 4737 N N . GLU C 1 187 ? 4.986 4.963 -64.136 1.00 27.84 ? 187 GLU C N 1 ATOM 4738 C CA . GLU C 1 187 ? 4.371 5.068 -65.454 1.00 28.45 ? 187 GLU C CA 1 ATOM 4739 C C . GLU C 1 187 ? 5.343 4.680 -66.555 1.00 29.78 ? 187 GLU C C 1 ATOM 4740 O O . GLU C 1 187 ? 4.944 4.457 -67.697 1.00 33.46 ? 187 GLU C O 1 ATOM 4741 C CB . GLU C 1 187 ? 3.856 6.491 -65.705 1.00 29.70 ? 187 GLU C CB 1 ATOM 4742 C CG . GLU C 1 187 ? 2.728 6.944 -64.797 1.00 37.35 ? 187 GLU C CG 1 ATOM 4743 C CD . GLU C 1 187 ? 1.484 6.068 -64.894 1.00 51.42 ? 187 GLU C CD 1 ATOM 4744 O OE1 . GLU C 1 187 ? 1.363 5.287 -65.862 1.00 49.82 ? 187 GLU C OE1 1 ATOM 4745 O OE2 . GLU C 1 187 ? 0.619 6.163 -63.993 1.00 59.64 ? 187 GLU C OE2 1 ATOM 4746 N N . LYS C 1 188 ? 6.619 4.593 -66.197 1.00 31.71 ? 188 LYS C N 1 ATOM 4747 C CA A LYS C 1 188 ? 7.675 4.344 -67.167 0.42 30.26 ? 188 LYS C CA 1 ATOM 4748 C CA B LYS C 1 188 ? 7.676 4.341 -67.167 0.58 30.52 ? 188 LYS C CA 1 ATOM 4749 C C . LYS C 1 188 ? 7.918 2.848 -67.355 1.00 26.11 ? 188 LYS C C 1 ATOM 4750 O O . LYS C 1 188 ? 8.663 2.438 -68.239 1.00 22.58 ? 188 LYS C O 1 ATOM 4751 C CB A LYS C 1 188 ? 8.961 5.041 -66.711 0.42 30.36 ? 188 LYS C CB 1 ATOM 4752 C CB B LYS C 1 188 ? 8.975 5.017 -66.719 0.58 30.29 ? 188 LYS C CB 1 ATOM 4753 C CG A LYS C 1 188 ? 10.013 5.235 -67.791 0.42 32.90 ? 188 LYS C CG 1 ATOM 4754 C CG B LYS C 1 188 ? 9.712 5.757 -67.824 0.58 33.10 ? 188 LYS C CG 1 ATOM 4755 C CD A LYS C 1 188 ? 9.500 6.094 -68.938 0.42 33.13 ? 188 LYS C CD 1 ATOM 4756 C CD B LYS C 1 188 ? 9.393 7.245 -67.814 0.58 32.62 ? 188 LYS C CD 1 ATOM 4757 C CE A LYS C 1 188 ? 10.627 6.433 -69.897 0.42 28.34 ? 188 LYS C CE 1 ATOM 4758 C CE B LYS C 1 188 ? 10.018 7.939 -66.613 0.58 27.32 ? 188 LYS C CE 1 ATOM 4759 N NZ A LYS C 1 188 ? 11.427 5.223 -70.213 0.42 25.23 ? 188 LYS C NZ 1 ATOM 4760 N NZ B LYS C 1 188 ? 9.642 9.381 -66.506 0.58 24.12 ? 188 LYS C NZ 1 ATOM 4761 N N . HIS C 1 189 ? 7.290 2.029 -66.523 1.00 21.06 ? 189 HIS C N 1 ATOM 4762 C CA . HIS C 1 189 ? 7.565 0.596 -66.562 1.00 20.96 ? 189 HIS C CA 1 ATOM 4763 C C . HIS C 1 189 ? 6.310 -0.273 -66.658 1.00 25.81 ? 189 HIS C C 1 ATOM 4764 O O . HIS C 1 189 ? 5.195 0.191 -66.389 1.00 21.41 ? 189 HIS C O 1 ATOM 4765 C CB . HIS C 1 189 ? 8.409 0.191 -65.353 1.00 24.09 ? 189 HIS C CB 1 ATOM 4766 C CG . HIS C 1 189 ? 9.758 0.839 -65.320 1.00 30.86 ? 189 HIS C CG 1 ATOM 4767 N ND1 . HIS C 1 189 ? 10.775 0.479 -66.176 1.00 35.07 ? 189 HIS C ND1 1 ATOM 4768 C CD2 . HIS C 1 189 ? 10.253 1.833 -64.546 1.00 34.10 ? 189 HIS C CD2 1 ATOM 4769 C CE1 . HIS C 1 189 ? 11.841 1.220 -65.931 1.00 32.85 ? 189 HIS C CE1 1 ATOM 4770 N NE2 . HIS C 1 189 ? 11.551 2.047 -64.945 1.00 33.77 ? 189 HIS C NE2 1 ATOM 4771 N N . LYS C 1 190 ? 6.499 -1.540 -67.031 1.00 23.39 ? 190 LYS C N 1 ATOM 4772 C CA . LYS C 1 190 ? 5.359 -2.408 -67.316 1.00 24.21 ? 190 LYS C CA 1 ATOM 4773 C C . LYS C 1 190 ? 5.158 -3.556 -66.332 1.00 21.97 ? 190 LYS C C 1 ATOM 4774 O O . LYS C 1 190 ? 4.097 -3.680 -65.735 1.00 26.59 ? 190 LYS C O 1 ATOM 4775 C CB . LYS C 1 190 ? 5.420 -2.947 -68.749 1.00 24.64 ? 190 LYS C CB 1 ATOM 4776 C CG . LYS C 1 190 ? 4.182 -3.749 -69.150 1.00 37.47 ? 190 LYS C CG 1 ATOM 4777 C CD . LYS C 1 190 ? 4.312 -4.319 -70.550 1.00 45.04 ? 190 LYS C CD 1 ATOM 4778 C CE . LYS C 1 190 ? 3.215 -5.332 -70.856 1.00 50.98 ? 190 LYS C CE 1 ATOM 4779 N NZ . LYS C 1 190 ? 3.278 -5.792 -72.275 1.00 49.51 ? 190 LYS C NZ 1 ATOM 4780 N N . VAL C 1 191 ? 6.168 -4.398 -66.169 1.00 25.81 ? 191 VAL C N 1 ATOM 4781 C CA . VAL C 1 191 ? 6.009 -5.622 -65.391 1.00 21.46 ? 191 VAL C CA 1 ATOM 4782 C C . VAL C 1 191 ? 6.409 -5.435 -63.944 1.00 19.71 ? 191 VAL C C 1 ATOM 4783 O O . VAL C 1 191 ? 7.564 -5.153 -63.643 1.00 23.25 ? 191 VAL C O 1 ATOM 4784 C CB . VAL C 1 191 ? 6.836 -6.778 -65.985 1.00 30.18 ? 191 VAL C CB 1 ATOM 4785 C CG1 . VAL C 1 191 ? 6.753 -8.012 -65.081 1.00 22.36 ? 191 VAL C CG1 1 ATOM 4786 C CG2 . VAL C 1 191 ? 6.387 -7.094 -67.420 1.00 24.85 ? 191 VAL C CG2 1 ATOM 4787 N N . TYR C 1 192 ? 5.453 -5.619 -63.046 1.00 19.07 ? 192 TYR C N 1 ATOM 4788 C CA . TYR C 1 192 ? 5.725 -5.512 -61.623 1.00 20.74 ? 192 TYR C CA 1 ATOM 4789 C C . TYR C 1 192 ? 5.642 -6.867 -60.931 1.00 27.40 ? 192 TYR C C 1 ATOM 4790 O O . TYR C 1 192 ? 4.617 -7.559 -60.984 1.00 26.95 ? 192 TYR C O 1 ATOM 4791 C CB . TYR C 1 192 ? 4.803 -4.475 -60.979 1.00 20.55 ? 192 TYR C CB 1 ATOM 4792 C CG . TYR C 1 192 ? 5.155 -3.082 -61.449 1.00 20.13 ? 192 TYR C CG 1 ATOM 4793 C CD1 . TYR C 1 192 ? 4.630 -2.571 -62.634 1.00 18.32 ? 192 TYR C CD1 1 ATOM 4794 C CD2 . TYR C 1 192 ? 6.052 -2.299 -60.732 1.00 17.20 ? 192 TYR C CD2 1 ATOM 4795 C CE1 . TYR C 1 192 ? 4.970 -1.316 -63.076 1.00 27.41 ? 192 TYR C CE1 1 ATOM 4796 C CE2 . TYR C 1 192 ? 6.399 -1.040 -61.162 1.00 19.80 ? 192 TYR C CE2 1 ATOM 4797 C CZ . TYR C 1 192 ? 5.861 -0.551 -62.335 1.00 25.17 ? 192 TYR C CZ 1 ATOM 4798 O OH . TYR C 1 192 ? 6.214 0.709 -62.764 1.00 24.75 ? 192 TYR C OH 1 ATOM 4799 N N . ALA C 1 193 ? 6.740 -7.235 -60.282 1.00 26.58 ? 193 ALA C N 1 ATOM 4800 C CA . ALA C 1 193 ? 6.897 -8.584 -59.777 1.00 22.20 ? 193 ALA C CA 1 ATOM 4801 C C . ALA C 1 193 ? 7.415 -8.637 -58.350 1.00 22.85 ? 193 ALA C C 1 ATOM 4802 O O . ALA C 1 193 ? 8.353 -7.930 -57.953 1.00 25.82 ? 193 ALA C O 1 ATOM 4803 C CB . ALA C 1 193 ? 7.787 -9.396 -60.696 1.00 18.44 ? 193 ALA C CB 1 ATOM 4804 N N . CYS C 1 194 ? 6.784 -9.509 -57.587 1.00 20.18 ? 194 CYS C N 1 ATOM 4805 C CA . CYS C 1 194 ? 7.187 -9.778 -56.229 1.00 19.92 ? 194 CYS C CA 1 ATOM 4806 C C . CYS C 1 194 ? 7.628 -11.248 -56.191 1.00 18.78 ? 194 CYS C C 1 ATOM 4807 O O . CYS C 1 194 ? 6.849 -12.155 -56.494 1.00 24.42 ? 194 CYS C O 1 ATOM 4808 C CB . CYS C 1 194 ? 5.992 -9.535 -55.308 1.00 22.77 ? 194 CYS C CB 1 ATOM 4809 S SG . CYS C 1 194 ? 6.199 -10.222 -53.708 1.00 37.50 ? 194 CYS C SG 1 ATOM 4810 N N . GLU C 1 195 ? 8.882 -11.484 -55.847 1.00 17.38 ? 195 GLU C N 1 ATOM 4811 C CA . GLU C 1 195 ? 9.402 -12.844 -55.844 1.00 22.69 ? 195 GLU C CA 1 ATOM 4812 C C . GLU C 1 195 ? 9.674 -13.247 -54.414 1.00 22.50 ? 195 GLU C C 1 ATOM 4813 O O . GLU C 1 195 ? 10.228 -12.471 -53.641 1.00 24.49 ? 195 GLU C O 1 ATOM 4814 C CB . GLU C 1 195 ? 10.675 -12.949 -56.681 1.00 23.18 ? 195 GLU C CB 1 ATOM 4815 C CG . GLU C 1 195 ? 11.174 -14.367 -56.801 1.00 30.00 ? 195 GLU C CG 1 ATOM 4816 C CD . GLU C 1 195 ? 12.485 -14.477 -57.552 1.00 36.17 ? 195 GLU C CD 1 ATOM 4817 O OE1 . GLU C 1 195 ? 13.107 -13.429 -57.844 1.00 41.18 ? 195 GLU C OE1 1 ATOM 4818 O OE2 . GLU C 1 195 ? 12.887 -15.618 -57.853 1.00 36.35 ? 195 GLU C OE2 1 ATOM 4819 N N . VAL C 1 196 ? 9.262 -14.454 -54.051 1.00 20.84 ? 196 VAL C N 1 ATOM 4820 C CA . VAL C 1 196 ? 9.279 -14.846 -52.647 1.00 23.03 ? 196 VAL C CA 1 ATOM 4821 C C . VAL C 1 196 ? 10.029 -16.154 -52.464 1.00 23.47 ? 196 VAL C C 1 ATOM 4822 O O . VAL C 1 196 ? 9.773 -17.135 -53.156 1.00 31.17 ? 196 VAL C O 1 ATOM 4823 C CB . VAL C 1 196 ? 7.842 -14.936 -52.050 1.00 15.65 ? 196 VAL C CB 1 ATOM 4824 C CG1 . VAL C 1 196 ? 7.875 -15.519 -50.653 1.00 15.55 ? 196 VAL C CG1 1 ATOM 4825 C CG2 . VAL C 1 196 ? 7.206 -13.579 -52.017 1.00 14.62 ? 196 VAL C CG2 1 ATOM 4826 N N . THR C 1 197 ? 10.962 -16.141 -51.527 1.00 17.87 ? 197 THR C N 1 ATOM 4827 C CA . THR C 1 197 ? 11.771 -17.302 -51.202 1.00 20.53 ? 197 THR C CA 1 ATOM 4828 C C . THR C 1 197 ? 11.573 -17.651 -49.727 1.00 21.93 ? 197 THR C C 1 ATOM 4829 O O . THR C 1 197 ? 11.620 -16.771 -48.873 1.00 30.55 ? 197 THR C O 1 ATOM 4830 C CB . THR C 1 197 ? 13.250 -17.001 -51.479 1.00 20.39 ? 197 THR C CB 1 ATOM 4831 O OG1 . THR C 1 197 ? 13.470 -17.042 -52.891 1.00 32.59 ? 197 THR C OG1 1 ATOM 4832 C CG2 . THR C 1 197 ? 14.137 -18.017 -50.826 1.00 21.95 ? 197 THR C CG2 1 ATOM 4833 N N . HIS C 1 198 ? 11.332 -18.923 -49.429 1.00 19.51 ? 198 HIS C N 1 ATOM 4834 C CA . HIS C 1 198 ? 11.033 -19.340 -48.057 1.00 29.93 ? 198 HIS C CA 1 ATOM 4835 C C . HIS C 1 198 ? 11.269 -20.837 -47.866 1.00 32.19 ? 198 HIS C C 1 ATOM 4836 O O . HIS C 1 198 ? 11.093 -21.618 -48.801 1.00 31.18 ? 198 HIS C O 1 ATOM 4837 C CB . HIS C 1 198 ? 9.586 -18.974 -47.690 1.00 24.82 ? 198 HIS C CB 1 ATOM 4838 C CG . HIS C 1 198 ? 9.164 -19.431 -46.325 1.00 26.19 ? 198 HIS C CG 1 ATOM 4839 N ND1 . HIS C 1 198 ? 8.519 -20.629 -46.108 1.00 33.89 ? 198 HIS C ND1 1 ATOM 4840 C CD2 . HIS C 1 198 ? 9.272 -18.838 -45.112 1.00 20.63 ? 198 HIS C CD2 1 ATOM 4841 C CE1 . HIS C 1 198 ? 8.254 -20.758 -44.817 1.00 31.42 ? 198 HIS C CE1 1 ATOM 4842 N NE2 . HIS C 1 198 ? 8.700 -19.685 -44.192 1.00 27.29 ? 198 HIS C NE2 1 ATOM 4843 N N . GLN C 1 199 ? 11.649 -21.226 -46.650 1.00 34.44 ? 199 GLN C N 1 ATOM 4844 C CA . GLN C 1 199 ? 11.928 -22.625 -46.323 1.00 32.99 ? 199 GLN C CA 1 ATOM 4845 C C . GLN C 1 199 ? 10.862 -23.612 -46.828 1.00 28.57 ? 199 GLN C C 1 ATOM 4846 O O . GLN C 1 199 ? 11.194 -24.659 -47.371 1.00 33.49 ? 199 GLN C O 1 ATOM 4847 C CB . GLN C 1 199 ? 12.125 -22.783 -44.818 1.00 31.03 ? 199 GLN C CB 1 ATOM 4848 C CG . GLN C 1 199 ? 12.371 -24.208 -44.389 1.00 34.07 ? 199 GLN C CG 1 ATOM 4849 C CD . GLN C 1 199 ? 12.704 -24.310 -42.922 1.00 40.83 ? 199 GLN C CD 1 ATOM 4850 O OE1 . GLN C 1 199 ? 13.042 -23.313 -42.286 1.00 46.58 ? 199 GLN C OE1 1 ATOM 4851 N NE2 . GLN C 1 199 ? 12.605 -25.511 -42.371 1.00 44.41 ? 199 GLN C NE2 1 ATOM 4852 N N . GLY C 1 200 ? 9.590 -23.253 -46.689 1.00 23.79 ? 200 GLY C N 1 ATOM 4853 C CA . GLY C 1 200 ? 8.509 -24.104 -47.147 1.00 22.37 ? 200 GLY C CA 1 ATOM 4854 C C . GLY C 1 200 ? 8.284 -24.115 -48.652 1.00 30.62 ? 200 GLY C C 1 ATOM 4855 O O . GLY C 1 200 ? 7.409 -24.831 -49.143 1.00 29.09 ? 200 GLY C O 1 ATOM 4856 N N . LEU C 1 201 ? 9.048 -23.321 -49.394 1.00 28.40 ? 201 LEU C N 1 ATOM 4857 C CA . LEU C 1 201 ? 8.916 -23.346 -50.849 1.00 36.26 ? 201 LEU C CA 1 ATOM 4858 C C . LEU C 1 201 ? 10.105 -24.046 -51.519 1.00 41.36 ? 201 LEU C C 1 ATOM 4859 O O . LEU C 1 201 ? 11.258 -23.672 -51.304 1.00 43.66 ? 201 LEU C O 1 ATOM 4860 C CB . LEU C 1 201 ? 8.720 -21.932 -51.404 1.00 32.30 ? 201 LEU C CB 1 ATOM 4861 C CG . LEU C 1 201 ? 7.427 -21.241 -50.946 1.00 26.29 ? 201 LEU C CG 1 ATOM 4862 C CD1 . LEU C 1 201 ? 7.394 -19.788 -51.382 1.00 20.60 ? 201 LEU C CD1 1 ATOM 4863 C CD2 . LEU C 1 201 ? 6.189 -21.973 -51.443 1.00 25.93 ? 201 LEU C CD2 1 ATOM 4864 N N . SER C 1 202 ? 9.823 -25.075 -52.315 1.00 43.76 ? 202 SER C N 1 ATOM 4865 C CA . SER C 1 202 ? 10.886 -25.770 -53.050 1.00 48.96 ? 202 SER C CA 1 ATOM 4866 C C . SER C 1 202 ? 11.466 -24.884 -54.154 1.00 45.32 ? 202 SER C C 1 ATOM 4867 O O . SER C 1 202 ? 12.667 -24.900 -54.400 1.00 44.96 ? 202 SER C O 1 ATOM 4868 C CB . SER C 1 202 ? 10.379 -27.089 -53.628 1.00 49.38 ? 202 SER C CB 1 ATOM 4869 O OG . SER C 1 202 ? 9.141 -26.894 -54.285 1.00 52.71 ? 202 SER C OG 1 ATOM 4870 N N . SER C 1 203 ? 10.601 -24.113 -54.809 1.00 42.71 ? 203 SER C N 1 ATOM 4871 C CA . SER C 1 203 ? 11.022 -23.092 -55.768 1.00 40.04 ? 203 SER C CA 1 ATOM 4872 C C . SER C 1 203 ? 10.440 -21.764 -55.332 1.00 33.51 ? 203 SER C C 1 ATOM 4873 O O . SER C 1 203 ? 9.395 -21.738 -54.686 1.00 37.47 ? 203 SER C O 1 ATOM 4874 C CB . SER C 1 203 ? 10.505 -23.418 -57.170 1.00 31.87 ? 203 SER C CB 1 ATOM 4875 O OG . SER C 1 203 ? 11.117 -24.587 -57.656 1.00 42.84 ? 203 SER C OG 1 ATOM 4876 N N . PRO C 1 204 ? 11.090 -20.653 -55.708 1.00 28.53 ? 204 PRO C N 1 ATOM 4877 C CA . PRO C 1 204 ? 10.528 -19.347 -55.352 1.00 23.72 ? 204 PRO C CA 1 ATOM 4878 C C . PRO C 1 204 ? 9.153 -19.138 -55.976 1.00 27.44 ? 204 PRO C C 1 ATOM 4879 O O . PRO C 1 204 ? 8.864 -19.684 -57.040 1.00 25.96 ? 204 PRO C O 1 ATOM 4880 C CB . PRO C 1 204 ? 11.517 -18.353 -55.965 1.00 25.42 ? 204 PRO C CB 1 ATOM 4881 C CG . PRO C 1 204 ? 12.753 -19.158 -56.310 1.00 26.10 ? 204 PRO C CG 1 ATOM 4882 C CD . PRO C 1 204 ? 12.282 -20.541 -56.571 1.00 27.91 ? 204 PRO C CD 1 ATOM 4883 N N . VAL C 1 205 ? 8.309 -18.352 -55.321 1.00 23.62 ? 205 VAL C N 1 ATOM 4884 C CA . VAL C 1 205 ? 7.033 -17.991 -55.913 1.00 23.11 ? 205 VAL C CA 1 ATOM 4885 C C . VAL C 1 205 ? 7.045 -16.546 -56.436 1.00 27.10 ? 205 VAL C C 1 ATOM 4886 O O . VAL C 1 205 ? 7.370 -15.613 -55.703 1.00 18.64 ? 205 VAL C O 1 ATOM 4887 C CB . VAL C 1 205 ? 5.899 -18.192 -54.904 1.00 27.56 ? 205 VAL C CB 1 ATOM 4888 C CG1 . VAL C 1 205 ? 4.617 -17.514 -55.382 1.00 20.16 ? 205 VAL C CG1 1 ATOM 4889 C CG2 . VAL C 1 205 ? 5.688 -19.679 -54.647 1.00 21.85 ? 205 VAL C CG2 1 ATOM 4890 N N . THR C 1 206 ? 6.710 -16.362 -57.710 1.00 28.44 ? 206 THR C N 1 ATOM 4891 C CA . THR C 1 206 ? 6.588 -15.013 -58.259 1.00 26.13 ? 206 THR C CA 1 ATOM 4892 C C . THR C 1 206 ? 5.126 -14.643 -58.508 1.00 30.74 ? 206 THR C C 1 ATOM 4893 O O . THR C 1 206 ? 4.391 -15.390 -59.153 1.00 21.95 ? 206 THR C O 1 ATOM 4894 C CB . THR C 1 206 ? 7.377 -14.854 -59.569 1.00 25.13 ? 206 THR C CB 1 ATOM 4895 O OG1 . THR C 1 206 ? 8.760 -15.097 -59.316 1.00 29.72 ? 206 THR C OG1 1 ATOM 4896 C CG2 . THR C 1 206 ? 7.220 -13.452 -60.115 1.00 20.93 ? 206 THR C CG2 1 ATOM 4897 N N . LYS C 1 207 ? 4.708 -13.498 -57.976 1.00 25.76 ? 207 LYS C N 1 ATOM 4898 C CA . LYS C 1 207 ? 3.402 -12.941 -58.289 1.00 19.15 ? 207 LYS C CA 1 ATOM 4899 C C . LYS C 1 207 ? 3.602 -11.622 -59.017 1.00 24.32 ? 207 LYS C C 1 ATOM 4900 O O . LYS C 1 207 ? 4.509 -10.843 -58.698 1.00 24.45 ? 207 LYS C O 1 ATOM 4901 C CB . LYS C 1 207 ? 2.568 -12.722 -57.028 1.00 18.17 ? 207 LYS C CB 1 ATOM 4902 C CG . LYS C 1 207 ? 2.033 -14.003 -56.389 1.00 24.63 ? 207 LYS C CG 1 ATOM 4903 C CD . LYS C 1 207 ? 1.174 -14.821 -57.360 1.00 27.17 ? 207 LYS C CD 1 ATOM 4904 C CE . LYS C 1 207 ? 0.765 -16.137 -56.701 1.00 29.20 ? 207 LYS C CE 1 ATOM 4905 N NZ . LYS C 1 207 ? -0.273 -16.872 -57.438 1.00 28.44 ? 207 LYS C NZ 1 ATOM 4906 N N . SER C 1 208 ? 2.742 -11.351 -59.983 1.00 22.07 ? 208 SER C N 1 ATOM 4907 C CA . SER C 1 208 ? 3.075 -10.335 -60.952 1.00 20.99 ? 208 SER C CA 1 ATOM 4908 C C . SER C 1 208 ? 1.842 -9.694 -61.579 1.00 25.05 ? 208 SER C C 1 ATOM 4909 O O . SER C 1 208 ? 0.793 -10.326 -61.698 1.00 29.07 ? 208 SER C O 1 ATOM 4910 C CB . SER C 1 208 ? 3.958 -10.981 -62.020 1.00 24.38 ? 208 SER C CB 1 ATOM 4911 O OG . SER C 1 208 ? 3.978 -10.220 -63.203 1.00 36.67 ? 208 SER C OG 1 ATOM 4912 N N . PHE C 1 209 ? 1.969 -8.426 -61.958 1.00 20.76 ? 209 PHE C N 1 ATOM 4913 C CA . PHE C 1 209 ? 0.945 -7.767 -62.754 1.00 22.04 ? 209 PHE C CA 1 ATOM 4914 C C . PHE C 1 209 ? 1.592 -6.867 -63.797 1.00 22.30 ? 209 PHE C C 1 ATOM 4915 O O . PHE C 1 209 ? 2.734 -6.440 -63.633 1.00 31.35 ? 209 PHE C O 1 ATOM 4916 C CB . PHE C 1 209 ? -0.036 -6.977 -61.876 1.00 22.04 ? 209 PHE C CB 1 ATOM 4917 C CG . PHE C 1 209 ? 0.543 -5.718 -61.258 1.00 23.29 ? 209 PHE C CG 1 ATOM 4918 C CD1 . PHE C 1 209 ? 0.617 -4.529 -61.980 1.00 20.51 ? 209 PHE C CD1 1 ATOM 4919 C CD2 . PHE C 1 209 ? 0.970 -5.714 -59.936 1.00 25.45 ? 209 PHE C CD2 1 ATOM 4920 C CE1 . PHE C 1 209 ? 1.131 -3.376 -61.402 1.00 25.94 ? 209 PHE C CE1 1 ATOM 4921 C CE2 . PHE C 1 209 ? 1.480 -4.561 -59.349 1.00 24.31 ? 209 PHE C CE2 1 ATOM 4922 C CZ . PHE C 1 209 ? 1.565 -3.392 -60.085 1.00 23.48 ? 209 PHE C CZ 1 ATOM 4923 N N . ASN C 1 210 ? 0.859 -6.589 -64.867 1.00 24.02 ? 210 ASN C N 1 ATOM 4924 C CA . ASN C 1 210 ? 1.279 -5.602 -65.855 1.00 32.61 ? 210 ASN C CA 1 ATOM 4925 C C . ASN C 1 210 ? 0.491 -4.307 -65.687 1.00 33.36 ? 210 ASN C C 1 ATOM 4926 O O . ASN C 1 210 ? -0.745 -4.318 -65.759 1.00 30.55 ? 210 ASN C O 1 ATOM 4927 C CB . ASN C 1 210 ? 1.069 -6.133 -67.270 1.00 34.98 ? 210 ASN C CB 1 ATOM 4928 C CG . ASN C 1 210 ? 1.962 -7.309 -67.590 1.00 36.91 ? 210 ASN C CG 1 ATOM 4929 O OD1 . ASN C 1 210 ? 3.014 -7.500 -66.974 1.00 39.44 ? 210 ASN C OD1 1 ATOM 4930 N ND2 . ASN C 1 210 ? 1.548 -8.109 -68.560 1.00 35.08 ? 210 ASN C ND2 1 ATOM 4931 N N . ARG C 1 211 ? 1.208 -3.205 -65.469 1.00 26.18 ? 211 ARG C N 1 ATOM 4932 C CA . ARG C 1 211 ? 0.589 -1.896 -65.301 1.00 28.89 ? 211 ARG C CA 1 ATOM 4933 C C . ARG C 1 211 ? -0.314 -1.588 -66.486 1.00 38.26 ? 211 ARG C C 1 ATOM 4934 O O . ARG C 1 211 ? 0.106 -1.679 -67.635 1.00 38.14 ? 211 ARG C O 1 ATOM 4935 C CB . ARG C 1 211 ? 1.651 -0.795 -65.170 1.00 24.82 ? 211 ARG C CB 1 ATOM 4936 C CG . ARG C 1 211 ? 1.063 0.613 -65.060 1.00 23.72 ? 211 ARG C CG 1 ATOM 4937 C CD . ARG C 1 211 ? 2.116 1.708 -65.192 1.00 26.92 ? 211 ARG C CD 1 ATOM 4938 N NE . ARG C 1 211 ? 2.883 1.583 -66.427 1.00 31.00 ? 211 ARG C NE 1 ATOM 4939 C CZ . ARG C 1 211 ? 2.406 1.878 -67.634 1.00 31.31 ? 211 ARG C CZ 1 ATOM 4940 N NH1 . ARG C 1 211 ? 1.159 2.317 -67.777 1.00 28.49 ? 211 ARG C NH1 1 ATOM 4941 N NH2 . ARG C 1 211 ? 3.171 1.715 -68.700 1.00 24.99 ? 211 ARG C NH2 1 ATOM 4942 N N . GLY C 1 212 ? -1.559 -1.237 -66.200 1.00 42.90 ? 212 GLY C N 1 ATOM 4943 C CA . GLY C 1 212 ? -2.491 -0.868 -67.246 1.00 48.89 ? 212 GLY C CA 1 ATOM 4944 C C . GLY C 1 212 ? -2.988 -2.066 -68.021 1.00 56.37 ? 212 GLY C C 1 ATOM 4945 O O . GLY C 1 212 ? -3.104 -2.014 -69.246 1.00 65.20 ? 212 GLY C O 1 ATOM 4946 N N . ALA C 1 213 ? -3.274 -3.150 -67.306 1.00 51.29 ? 213 ALA C N 1 ATOM 4947 C CA . ALA C 1 213 ? -3.834 -4.341 -67.921 1.00 49.83 ? 213 ALA C CA 1 ATOM 4948 C C . ALA C 1 213 ? -4.755 -5.028 -66.932 1.00 58.23 ? 213 ALA C C 1 ATOM 4949 O O . ALA C 1 213 ? -4.379 -5.227 -65.776 1.00 57.67 ? 213 ALA C O 1 ATOM 4950 C CB . ALA C 1 213 ? -2.729 -5.281 -68.374 1.00 47.08 ? 213 ALA C CB 1 ATOM 4951 O OXT . ALA C 1 213 ? -5.892 -5.384 -67.253 1.00 66.94 ? 213 ALA C OXT 1 ATOM 4952 N N . GLN D 2 1 ? -18.966 -4.243 -14.016 1.00 50.91 ? 1 GLN D N 1 ATOM 4953 C CA . GLN D 2 1 ? -17.589 -4.719 -13.872 1.00 48.04 ? 1 GLN D CA 1 ATOM 4954 C C . GLN D 2 1 ? -16.590 -3.588 -13.595 1.00 51.60 ? 1 GLN D C 1 ATOM 4955 O O . GLN D 2 1 ? -16.899 -2.411 -13.794 1.00 46.46 ? 1 GLN D O 1 ATOM 4956 C CB . GLN D 2 1 ? -17.163 -5.493 -15.121 1.00 49.59 ? 1 GLN D CB 1 ATOM 4957 N N . VAL D 2 2 ? -15.390 -3.951 -13.143 1.00 49.06 ? 2 VAL D N 1 ATOM 4958 C CA . VAL D 2 2 ? -14.331 -2.977 -12.879 1.00 40.86 ? 2 VAL D CA 1 ATOM 4959 C C . VAL D 2 2 ? -13.573 -2.579 -14.145 1.00 39.19 ? 2 VAL D C 1 ATOM 4960 O O . VAL D 2 2 ? -13.032 -3.433 -14.842 1.00 42.46 ? 2 VAL D O 1 ATOM 4961 C CB . VAL D 2 2 ? -13.316 -3.515 -11.858 1.00 39.35 ? 2 VAL D CB 1 ATOM 4962 C CG1 . VAL D 2 2 ? -12.143 -2.543 -11.714 1.00 33.35 ? 2 VAL D CG1 1 ATOM 4963 C CG2 . VAL D 2 2 ? -13.993 -3.762 -10.522 1.00 38.98 ? 2 VAL D CG2 1 ATOM 4964 N N . GLN D 2 3 ? -13.526 -1.281 -14.434 1.00 35.68 ? 3 GLN D N 1 ATOM 4965 C CA . GLN D 2 3 ? -12.891 -0.792 -15.655 1.00 35.52 ? 3 GLN D CA 1 ATOM 4966 C C . GLN D 2 3 ? -12.174 0.536 -15.444 1.00 32.78 ? 3 GLN D C 1 ATOM 4967 O O . GLN D 2 3 ? -12.645 1.403 -14.699 1.00 29.04 ? 3 GLN D O 1 ATOM 4968 C CB . GLN D 2 3 ? -13.916 -0.615 -16.776 1.00 36.95 ? 3 GLN D CB 1 ATOM 4969 C CG . GLN D 2 3 ? -14.605 -1.888 -17.230 1.00 51.86 ? 3 GLN D CG 1 ATOM 4970 C CD . GLN D 2 3 ? -15.573 -1.642 -18.370 1.00 58.52 ? 3 GLN D CD 1 ATOM 4971 O OE1 . GLN D 2 3 ? -15.166 -1.465 -19.516 1.00 65.05 ? 3 GLN D OE1 1 ATOM 4972 N NE2 . GLN D 2 3 ? -16.857 -1.617 -18.059 1.00 60.92 ? 3 GLN D NE2 1 ATOM 4973 N N . LEU D 2 4 ? -11.039 0.681 -16.119 1.00 26.48 ? 4 LEU D N 1 ATOM 4974 C CA . LEU D 2 4 ? -10.317 1.939 -16.177 1.00 28.28 ? 4 LEU D CA 1 ATOM 4975 C C . LEU D 2 4 ? -10.216 2.364 -17.642 1.00 30.78 ? 4 LEU D C 1 ATOM 4976 O O . LEU D 2 4 ? -9.717 1.605 -18.474 1.00 30.39 ? 4 LEU D O 1 ATOM 4977 C CB . LEU D 2 4 ? -8.924 1.786 -15.566 1.00 31.02 ? 4 LEU D CB 1 ATOM 4978 C CG . LEU D 2 4 ? -8.914 1.419 -14.080 1.00 35.07 ? 4 LEU D CG 1 ATOM 4979 C CD1 . LEU D 2 4 ? -9.043 -0.088 -13.899 1.00 25.27 ? 4 LEU D CD1 1 ATOM 4980 C CD2 . LEU D 2 4 ? -7.660 1.945 -13.394 1.00 36.76 ? 4 LEU D CD2 1 ATOM 4981 N N . LYS D 2 5 ? -10.710 3.561 -17.954 1.00 30.28 ? 5 LYS D N 1 ATOM 4982 C CA . LYS D 2 5 ? -10.744 4.065 -19.329 1.00 30.05 ? 5 LYS D CA 1 ATOM 4983 C C . LYS D 2 5 ? -9.978 5.370 -19.437 1.00 26.78 ? 5 LYS D C 1 ATOM 4984 O O . LYS D 2 5 ? -10.323 6.361 -18.798 1.00 26.01 ? 5 LYS D O 1 ATOM 4985 C CB . LYS D 2 5 ? -12.184 4.263 -19.790 1.00 33.22 ? 5 LYS D CB 1 ATOM 4986 C CG . LYS D 2 5 ? -12.939 2.958 -19.973 1.00 48.51 ? 5 LYS D CG 1 ATOM 4987 C CD . LYS D 2 5 ? -14.431 3.188 -20.191 1.00 60.78 ? 5 LYS D CD 1 ATOM 4988 C CE . LYS D 2 5 ? -15.143 1.885 -20.520 1.00 63.54 ? 5 LYS D CE 1 ATOM 4989 N NZ . LYS D 2 5 ? -14.549 1.268 -21.735 1.00 65.75 ? 5 LYS D NZ 1 ATOM 4990 N N . GLN D 2 6 ? -8.931 5.367 -20.249 1.00 21.63 ? 6 GLN D N 1 ATOM 4991 C CA . GLN D 2 6 ? -8.038 6.514 -20.318 1.00 20.74 ? 6 GLN D CA 1 ATOM 4992 C C . GLN D 2 6 ? -8.382 7.394 -21.509 1.00 22.92 ? 6 GLN D C 1 ATOM 4993 O O . GLN D 2 6 ? -8.993 6.924 -22.463 1.00 25.37 ? 6 GLN D O 1 ATOM 4994 C CB . GLN D 2 6 ? -6.594 6.022 -20.416 1.00 20.87 ? 6 GLN D CB 1 ATOM 4995 C CG . GLN D 2 6 ? -6.301 4.876 -19.449 1.00 26.12 ? 6 GLN D CG 1 ATOM 4996 C CD . GLN D 2 6 ? -4.858 4.405 -19.504 1.00 29.02 ? 6 GLN D CD 1 ATOM 4997 O OE1 . GLN D 2 6 ? -4.528 3.331 -19.000 1.00 30.27 ? 6 GLN D OE1 1 ATOM 4998 N NE2 . GLN D 2 6 ? -3.989 5.212 -20.113 1.00 27.06 ? 6 GLN D NE2 1 ATOM 4999 N N . SER D 2 7 ? -7.992 8.663 -21.467 1.00 24.28 ? 7 SER D N 1 ATOM 5000 C CA . SER D 2 7 ? -8.159 9.532 -22.634 1.00 32.62 ? 7 SER D CA 1 ATOM 5001 C C . SER D 2 7 ? -7.218 9.138 -23.786 1.00 33.76 ? 7 SER D C 1 ATOM 5002 O O . SER D 2 7 ? -6.196 8.477 -23.580 1.00 29.84 ? 7 SER D O 1 ATOM 5003 C CB . SER D 2 7 ? -7.935 10.984 -22.253 1.00 23.86 ? 7 SER D CB 1 ATOM 5004 O OG . SER D 2 7 ? -6.825 11.080 -21.388 1.00 22.38 ? 7 SER D OG 1 ATOM 5005 N N . GLY D 2 8 ? -7.543 9.606 -24.990 1.00 33.88 ? 8 GLY D N 1 ATOM 5006 C CA . GLY D 2 8 ? -6.911 9.135 -26.205 1.00 36.55 ? 8 GLY D CA 1 ATOM 5007 C C . GLY D 2 8 ? -5.438 9.473 -26.405 1.00 34.44 ? 8 GLY D C 1 ATOM 5008 O O . GLY D 2 8 ? -4.863 10.340 -25.735 1.00 27.05 ? 8 GLY D O 1 ATOM 5009 N N . PRO D 2 9 ? -4.811 8.797 -27.369 1.00 34.15 ? 9 PRO D N 1 ATOM 5010 C CA . PRO D 2 9 ? -3.391 9.038 -27.656 1.00 31.67 ? 9 PRO D CA 1 ATOM 5011 C C . PRO D 2 9 ? -3.160 10.372 -28.351 1.00 35.71 ? 9 PRO D C 1 ATOM 5012 O O . PRO D 2 9 ? -4.066 10.964 -28.944 1.00 40.38 ? 9 PRO D O 1 ATOM 5013 C CB . PRO D 2 9 ? -3.022 7.880 -28.585 1.00 36.91 ? 9 PRO D CB 1 ATOM 5014 C CG . PRO D 2 9 ? -4.318 7.592 -29.316 1.00 37.92 ? 9 PRO D CG 1 ATOM 5015 C CD . PRO D 2 9 ? -5.398 7.791 -28.275 1.00 32.54 ? 9 PRO D CD 1 ATOM 5016 N N . GLY D 2 10 ? -1.913 10.829 -28.300 1.00 38.24 ? 10 GLY D N 1 ATOM 5017 C CA . GLY D 2 10 ? -1.584 12.072 -28.972 1.00 40.90 ? 10 GLY D CA 1 ATOM 5018 C C . GLY D 2 10 ? -0.130 12.458 -28.813 1.00 34.02 ? 10 GLY D C 1 ATOM 5019 O O . GLY D 2 10 ? 0.652 11.798 -28.115 1.00 27.49 ? 10 GLY D O 1 ATOM 5020 N N . LEU D 2 11 ? 0.198 13.572 -29.464 1.00 30.37 ? 11 LEU D N 1 ATOM 5021 C CA . LEU D 2 11 ? 1.531 14.120 -29.573 1.00 36.69 ? 11 LEU D CA 1 ATOM 5022 C C . LEU D 2 11 ? 1.739 15.188 -28.495 1.00 41.04 ? 11 LEU D C 1 ATOM 5023 O O . LEU D 2 11 ? 0.824 15.953 -28.188 1.00 45.21 ? 11 LEU D O 1 ATOM 5024 C CB . LEU D 2 11 ? 1.670 14.738 -30.962 1.00 34.71 ? 11 LEU D CB 1 ATOM 5025 C CG . LEU D 2 11 ? 3.010 15.285 -31.424 1.00 37.89 ? 11 LEU D CG 1 ATOM 5026 C CD1 . LEU D 2 11 ? 4.048 14.183 -31.420 1.00 42.88 ? 11 LEU D CD1 1 ATOM 5027 C CD2 . LEU D 2 11 ? 2.861 15.886 -32.820 1.00 40.68 ? 11 LEU D CD2 1 ATOM 5028 N N . VAL D 2 12 ? 2.930 15.217 -27.903 1.00 35.81 ? 12 VAL D N 1 ATOM 5029 C CA . VAL D 2 12 ? 3.332 16.303 -27.012 1.00 31.02 ? 12 VAL D CA 1 ATOM 5030 C C . VAL D 2 12 ? 4.642 16.899 -27.534 1.00 33.92 ? 12 VAL D C 1 ATOM 5031 O O . VAL D 2 12 ? 5.554 16.162 -27.906 1.00 38.05 ? 12 VAL D O 1 ATOM 5032 C CB . VAL D 2 12 ? 3.531 15.811 -25.556 1.00 32.23 ? 12 VAL D CB 1 ATOM 5033 C CG1 . VAL D 2 12 ? 3.979 16.955 -24.655 1.00 32.94 ? 12 VAL D CG1 1 ATOM 5034 C CG2 . VAL D 2 12 ? 2.250 15.207 -25.016 1.00 35.01 ? 12 VAL D CG2 1 ATOM 5035 N N . GLN D 2 13 ? 4.733 18.225 -27.580 1.00 35.73 ? 13 GLN D N 1 ATOM 5036 C CA . GLN D 2 13 ? 5.959 18.885 -28.027 1.00 38.78 ? 13 GLN D CA 1 ATOM 5037 C C . GLN D 2 13 ? 7.009 18.750 -26.937 1.00 38.93 ? 13 GLN D C 1 ATOM 5038 O O . GLN D 2 13 ? 6.677 18.775 -25.763 1.00 37.81 ? 13 GLN D O 1 ATOM 5039 C CB . GLN D 2 13 ? 5.706 20.369 -28.308 1.00 42.16 ? 13 GLN D CB 1 ATOM 5040 C CG . GLN D 2 13 ? 4.636 20.646 -29.339 1.00 52.72 ? 13 GLN D CG 1 ATOM 5041 C CD . GLN D 2 13 ? 5.057 20.231 -30.732 1.00 62.35 ? 13 GLN D CD 1 ATOM 5042 O OE1 . GLN D 2 13 ? 4.382 19.435 -31.391 1.00 68.50 ? 13 GLN D OE1 1 ATOM 5043 N NE2 . GLN D 2 13 ? 6.180 20.771 -31.193 1.00 62.11 ? 13 GLN D NE2 1 ATOM 5044 N N . PRO D 2 14 ? 8.282 18.601 -27.321 1.00 48.86 ? 14 PRO D N 1 ATOM 5045 C CA . PRO D 2 14 ? 9.363 18.606 -26.329 1.00 42.59 ? 14 PRO D CA 1 ATOM 5046 C C . PRO D 2 14 ? 9.258 19.802 -25.392 1.00 53.18 ? 14 PRO D C 1 ATOM 5047 O O . PRO D 2 14 ? 8.962 20.913 -25.846 1.00 46.75 ? 14 PRO D O 1 ATOM 5048 C CB . PRO D 2 14 ? 10.622 18.729 -27.188 1.00 46.12 ? 14 PRO D CB 1 ATOM 5049 C CG . PRO D 2 14 ? 10.245 18.081 -28.486 1.00 45.15 ? 14 PRO D CG 1 ATOM 5050 C CD . PRO D 2 14 ? 8.782 18.392 -28.692 1.00 48.94 ? 14 PRO D CD 1 ATOM 5051 N N . SER D 2 15 ? 9.480 19.544 -24.102 1.00 53.70 ? 15 SER D N 1 ATOM 5052 C CA . SER D 2 15 ? 9.403 20.539 -23.029 1.00 52.43 ? 15 SER D CA 1 ATOM 5053 C C . SER D 2 15 ? 7.976 20.865 -22.594 1.00 49.76 ? 15 SER D C 1 ATOM 5054 O O . SER D 2 15 ? 7.779 21.575 -21.608 1.00 54.09 ? 15 SER D O 1 ATOM 5055 C CB . SER D 2 15 ? 10.165 21.823 -23.376 1.00 52.26 ? 15 SER D CB 1 ATOM 5056 O OG . SER D 2 15 ? 11.540 21.552 -23.559 1.00 64.45 ? 15 SER D OG 1 ATOM 5057 N N . GLN D 2 16 ? 6.985 20.354 -23.318 1.00 41.89 ? 16 GLN D N 1 ATOM 5058 C CA . GLN D 2 16 ? 5.592 20.628 -22.968 1.00 45.45 ? 16 GLN D CA 1 ATOM 5059 C C . GLN D 2 16 ? 5.021 19.615 -21.986 1.00 39.53 ? 16 GLN D C 1 ATOM 5060 O O . GLN D 2 16 ? 5.705 18.690 -21.561 1.00 39.41 ? 16 GLN D O 1 ATOM 5061 C CB . GLN D 2 16 ? 4.695 20.727 -24.212 1.00 44.33 ? 16 GLN D CB 1 ATOM 5062 C CG . GLN D 2 16 ? 4.913 21.983 -25.029 1.00 49.22 ? 16 GLN D CG 1 ATOM 5063 C CD . GLN D 2 16 ? 5.231 23.173 -24.158 1.00 61.92 ? 16 GLN D CD 1 ATOM 5064 O OE1 . GLN D 2 16 ? 4.457 23.531 -23.267 1.00 70.63 ? 16 GLN D OE1 1 ATOM 5065 N NE2 . GLN D 2 16 ? 6.387 23.784 -24.394 1.00 63.64 ? 16 GLN D NE2 1 ATOM 5066 N N . SER D 2 17 ? 3.751 19.793 -21.651 1.00 38.98 ? 17 SER D N 1 ATOM 5067 C CA . SER D 2 17 ? 3.118 19.019 -20.594 1.00 35.89 ? 17 SER D CA 1 ATOM 5068 C C . SER D 2 17 ? 2.244 17.869 -21.099 1.00 38.25 ? 17 SER D C 1 ATOM 5069 O O . SER D 2 17 ? 1.549 17.998 -22.101 1.00 45.66 ? 17 SER D O 1 ATOM 5070 C CB . SER D 2 17 ? 2.280 19.948 -19.724 1.00 41.78 ? 17 SER D CB 1 ATOM 5071 O OG . SER D 2 17 ? 1.985 19.323 -18.494 1.00 53.47 ? 17 SER D OG 1 ATOM 5072 N N . LEU D 2 18 ? 2.266 16.750 -20.379 1.00 29.86 ? 18 LEU D N 1 ATOM 5073 C CA . LEU D 2 18 ? 1.438 15.601 -20.714 1.00 27.68 ? 18 LEU D CA 1 ATOM 5074 C C . LEU D 2 18 ? 0.266 15.466 -19.741 1.00 30.10 ? 18 LEU D C 1 ATOM 5075 O O . LEU D 2 18 ? 0.462 15.384 -18.532 1.00 38.06 ? 18 LEU D O 1 ATOM 5076 C CB . LEU D 2 18 ? 2.292 14.329 -20.688 1.00 22.99 ? 18 LEU D CB 1 ATOM 5077 C CG . LEU D 2 18 ? 1.557 12.993 -20.720 1.00 25.01 ? 18 LEU D CG 1 ATOM 5078 C CD1 . LEU D 2 18 ? 0.615 12.927 -21.919 1.00 27.22 ? 18 LEU D CD1 1 ATOM 5079 C CD2 . LEU D 2 18 ? 2.564 11.853 -20.754 1.00 25.22 ? 18 LEU D CD2 1 ATOM 5080 N N . SER D 2 19 ? -0.956 15.432 -20.262 1.00 28.84 ? 19 SER D N 1 ATOM 5081 C CA . SER D 2 19 ? -2.120 15.218 -19.405 1.00 30.26 ? 19 SER D CA 1 ATOM 5082 C C . SER D 2 19 ? -2.965 14.045 -19.878 1.00 30.36 ? 19 SER D C 1 ATOM 5083 O O . SER D 2 19 ? -3.342 13.981 -21.043 1.00 33.25 ? 19 SER D O 1 ATOM 5084 C CB . SER D 2 19 ? -2.981 16.481 -19.329 1.00 30.16 ? 19 SER D CB 1 ATOM 5085 O OG . SER D 2 19 ? -2.221 17.567 -18.844 1.00 35.13 ? 19 SER D OG 1 ATOM 5086 N N . ILE D 2 20 ? -3.259 13.122 -18.964 1.00 27.55 ? 20 ILE D N 1 ATOM 5087 C CA . ILE D 2 20 ? -4.110 11.970 -19.261 1.00 26.35 ? 20 ILE D CA 1 ATOM 5088 C C . ILE D 2 20 ? -5.206 11.840 -18.217 1.00 30.50 ? 20 ILE D C 1 ATOM 5089 O O . ILE D 2 20 ? -4.946 11.951 -17.020 1.00 29.08 ? 20 ILE D O 1 ATOM 5090 C CB . ILE D 2 20 ? -3.295 10.664 -19.277 1.00 22.58 ? 20 ILE D CB 1 ATOM 5091 C CG1 . ILE D 2 20 ? -2.196 10.732 -20.343 1.00 27.81 ? 20 ILE D CG1 1 ATOM 5092 C CG2 . ILE D 2 20 ? -4.199 9.452 -19.479 1.00 20.08 ? 20 ILE D CG2 1 ATOM 5093 C CD1 . ILE D 2 20 ? -1.117 9.671 -20.152 1.00 29.51 ? 20 ILE D CD1 1 ATOM 5094 N N . THR D 2 21 ? -6.430 11.576 -18.662 1.00 31.09 ? 21 THR D N 1 ATOM 5095 C CA . THR D 2 21 ? -7.533 11.355 -17.738 1.00 26.94 ? 21 THR D CA 1 ATOM 5096 C C . THR D 2 21 ? -7.865 9.871 -17.666 1.00 31.06 ? 21 THR D C 1 ATOM 5097 O O . THR D 2 21 ? -8.025 9.215 -18.698 1.00 32.15 ? 21 THR D O 1 ATOM 5098 C CB . THR D 2 21 ? -8.766 12.159 -18.140 1.00 31.58 ? 21 THR D CB 1 ATOM 5099 O OG1 . THR D 2 21 ? -8.490 13.552 -17.955 1.00 37.05 ? 21 THR D OG1 1 ATOM 5100 C CG2 . THR D 2 21 ? -9.958 11.781 -17.257 1.00 32.69 ? 21 THR D CG2 1 ATOM 5101 N N . CYS D 2 22 ? -7.955 9.350 -16.446 1.00 33.91 ? 22 CYS D N 1 ATOM 5102 C CA . CYS D 2 22 ? -8.365 7.974 -16.189 1.00 28.03 ? 22 CYS D CA 1 ATOM 5103 C C . CYS D 2 22 ? -9.732 8.015 -15.515 1.00 30.18 ? 22 CYS D C 1 ATOM 5104 O O . CYS D 2 22 ? -9.861 8.512 -14.392 1.00 37.21 ? 22 CYS D O 1 ATOM 5105 C CB . CYS D 2 22 ? -7.337 7.254 -15.317 1.00 20.41 ? 22 CYS D CB 1 ATOM 5106 S SG . CYS D 2 22 ? -7.717 5.518 -14.898 1.00 27.76 ? 22 CYS D SG 1 ATOM 5107 N N . THR D 2 23 ? -10.750 7.505 -16.202 1.00 28.61 ? 23 THR D N 1 ATOM 5108 C CA . THR D 2 23 ? -12.111 7.447 -15.682 1.00 29.57 ? 23 THR D CA 1 ATOM 5109 C C . THR D 2 23 ? -12.383 6.021 -15.231 1.00 33.47 ? 23 THR D C 1 ATOM 5110 O O . THR D 2 23 ? -12.148 5.080 -15.994 1.00 33.96 ? 23 THR D O 1 ATOM 5111 C CB . THR D 2 23 ? -13.129 7.858 -16.750 1.00 29.35 ? 23 THR D CB 1 ATOM 5112 O OG1 . THR D 2 23 ? -12.761 9.123 -17.310 1.00 32.92 ? 23 THR D OG1 1 ATOM 5113 C CG2 . THR D 2 23 ? -14.517 7.979 -16.156 1.00 27.84 ? 23 THR D CG2 1 ATOM 5114 N N . VAL D 2 24 ? -12.869 5.848 -14.005 1.00 34.31 ? 24 VAL D N 1 ATOM 5115 C CA . VAL D 2 24 ? -13.068 4.501 -13.490 1.00 28.89 ? 24 VAL D CA 1 ATOM 5116 C C . VAL D 2 24 ? -14.544 4.187 -13.301 1.00 35.05 ? 24 VAL D C 1 ATOM 5117 O O . VAL D 2 24 ? -15.386 5.093 -13.258 1.00 39.16 ? 24 VAL D O 1 ATOM 5118 C CB . VAL D 2 24 ? -12.293 4.261 -12.171 1.00 24.87 ? 24 VAL D CB 1 ATOM 5119 C CG1 . VAL D 2 24 ? -10.897 4.861 -12.265 1.00 21.07 ? 24 VAL D CG1 1 ATOM 5120 C CG2 . VAL D 2 24 ? -13.053 4.841 -10.973 1.00 26.28 ? 24 VAL D CG2 1 ATOM 5121 N N . SER D 2 25 ? -14.846 2.894 -13.208 1.00 32.68 ? 25 SER D N 1 ATOM 5122 C CA . SER D 2 25 ? -16.204 2.424 -12.935 1.00 33.21 ? 25 SER D CA 1 ATOM 5123 C C . SER D 2 25 ? -16.166 1.022 -12.330 1.00 33.03 ? 25 SER D C 1 ATOM 5124 O O . SER D 2 25 ? -15.224 0.261 -12.553 1.00 38.77 ? 25 SER D O 1 ATOM 5125 C CB . SER D 2 25 ? -17.051 2.434 -14.212 1.00 32.09 ? 25 SER D CB 1 ATOM 5126 O OG . SER D 2 25 ? -16.414 1.706 -15.253 1.00 38.02 ? 25 SER D OG 1 ATOM 5127 N N . GLY D 2 26 ? -17.186 0.684 -11.554 1.00 29.96 ? 26 GLY D N 1 ATOM 5128 C CA . GLY D 2 26 ? -17.245 -0.617 -10.919 1.00 27.78 ? 26 GLY D CA 1 ATOM 5129 C C . GLY D 2 26 ? -16.653 -0.580 -9.531 1.00 26.86 ? 26 GLY D C 1 ATOM 5130 O O . GLY D 2 26 ? -16.559 -1.606 -8.869 1.00 33.16 ? 26 GLY D O 1 ATOM 5131 N N . PHE D 2 27 ? -16.244 0.610 -9.100 1.00 29.81 ? 27 PHE D N 1 ATOM 5132 C CA . PHE D 2 27 ? -15.669 0.826 -7.772 1.00 27.25 ? 27 PHE D CA 1 ATOM 5133 C C . PHE D 2 27 ? -15.508 2.316 -7.574 1.00 31.32 ? 27 PHE D C 1 ATOM 5134 O O . PHE D 2 27 ? -15.597 3.080 -8.530 1.00 36.48 ? 27 PHE D O 1 ATOM 5135 C CB . PHE D 2 27 ? -14.312 0.134 -7.616 1.00 24.01 ? 27 PHE D CB 1 ATOM 5136 C CG . PHE D 2 27 ? -13.187 0.771 -8.408 1.00 27.87 ? 27 PHE D CG 1 ATOM 5137 C CD1 . PHE D 2 27 ? -12.968 0.431 -9.740 1.00 25.96 ? 27 PHE D CD1 1 ATOM 5138 C CD2 . PHE D 2 27 ? -12.320 1.678 -7.808 1.00 26.42 ? 27 PHE D CD2 1 ATOM 5139 C CE1 . PHE D 2 27 ? -11.912 1.000 -10.459 1.00 22.46 ? 27 PHE D CE1 1 ATOM 5140 C CE2 . PHE D 2 27 ? -11.273 2.251 -8.526 1.00 22.71 ? 27 PHE D CE2 1 ATOM 5141 C CZ . PHE D 2 27 ? -11.067 1.908 -9.845 1.00 20.56 ? 27 PHE D CZ 1 ATOM 5142 N N . SER D 2 28 ? -15.253 2.730 -6.341 1.00 31.72 ? 28 SER D N 1 ATOM 5143 C CA . SER D 2 28 ? -15.154 4.150 -6.024 1.00 35.19 ? 28 SER D CA 1 ATOM 5144 C C . SER D 2 28 ? -13.735 4.614 -5.695 1.00 32.06 ? 28 SER D C 1 ATOM 5145 O O . SER D 2 28 ? -12.991 3.937 -4.973 1.00 23.55 ? 28 SER D O 1 ATOM 5146 C CB . SER D 2 28 ? -16.081 4.496 -4.858 1.00 39.59 ? 28 SER D CB 1 ATOM 5147 O OG . SER D 2 28 ? -15.762 5.776 -4.331 1.00 42.98 ? 28 SER D OG 1 ATOM 5148 N N . LEU D 2 29 ? -13.377 5.794 -6.195 1.00 25.65 ? 29 LEU D N 1 ATOM 5149 C CA . LEU D 2 29 ? -12.061 6.360 -5.930 1.00 25.72 ? 29 LEU D CA 1 ATOM 5150 C C . LEU D 2 29 ? -11.830 6.585 -4.444 1.00 29.90 ? 29 LEU D C 1 ATOM 5151 O O . LEU D 2 29 ? -10.686 6.746 -4.012 1.00 26.75 ? 29 LEU D O 1 ATOM 5152 C CB . LEU D 2 29 ? -11.865 7.667 -6.692 1.00 25.00 ? 29 LEU D CB 1 ATOM 5153 C CG . LEU D 2 29 ? -11.628 7.496 -8.192 1.00 30.99 ? 29 LEU D CG 1 ATOM 5154 C CD1 . LEU D 2 29 ? -11.352 8.833 -8.853 1.00 32.14 ? 29 LEU D CD1 1 ATOM 5155 C CD2 . LEU D 2 29 ? -10.494 6.525 -8.437 1.00 21.55 ? 29 LEU D CD2 1 ATOM 5156 N N . THR D 2 30 ? -12.912 6.591 -3.662 1.00 31.90 ? 30 THR D N 1 ATOM 5157 C CA . THR D 2 30 ? -12.797 6.750 -2.212 1.00 32.78 ? 30 THR D CA 1 ATOM 5158 C C . THR D 2 30 ? -12.382 5.449 -1.525 1.00 27.67 ? 30 THR D C 1 ATOM 5159 O O . THR D 2 30 ? -12.054 5.450 -0.347 1.00 26.81 ? 30 THR D O 1 ATOM 5160 C CB . THR D 2 30 ? -14.097 7.314 -1.556 1.00 33.32 ? 30 THR D CB 1 ATOM 5161 O OG1 . THR D 2 30 ? -15.188 6.412 -1.768 1.00 31.41 ? 30 THR D OG1 1 ATOM 5162 C CG2 . THR D 2 30 ? -14.451 8.665 -2.142 1.00 32.58 ? 30 THR D CG2 1 ATOM 5163 N N . ASN D 2 31 ? -12.376 4.345 -2.262 1.00 30.77 ? 31 ASN D N 1 ATOM 5164 C CA . ASN D 2 31 ? -11.983 3.069 -1.665 1.00 37.35 ? 31 ASN D CA 1 ATOM 5165 C C . ASN D 2 31 ? -10.690 2.429 -2.196 1.00 43.65 ? 31 ASN D C 1 ATOM 5166 O O . ASN D 2 31 ? -10.154 1.526 -1.563 1.00 45.46 ? 31 ASN D O 1 ATOM 5167 C CB . ASN D 2 31 ? -13.126 2.053 -1.736 1.00 32.79 ? 31 ASN D CB 1 ATOM 5168 C CG . ASN D 2 31 ? -14.372 2.525 -1.021 1.00 33.89 ? 31 ASN D CG 1 ATOM 5169 O OD1 . ASN D 2 31 ? -15.487 2.256 -1.468 1.00 35.31 ? 31 ASN D OD1 1 ATOM 5170 N ND2 . ASN D 2 31 ? -14.194 3.235 0.091 1.00 35.18 ? 31 ASN D ND2 1 ATOM 5171 N N . TYR D 2 32 ? -10.201 2.875 -3.349 1.00 42.55 ? 32 TYR D N 1 ATOM 5172 C CA . TYR D 2 32 ? -8.970 2.316 -3.919 1.00 34.44 ? 32 TYR D CA 1 ATOM 5173 C C . TYR D 2 32 ? -8.039 3.395 -4.436 1.00 31.30 ? 32 TYR D C 1 ATOM 5174 O O . TYR D 2 32 ? -8.493 4.407 -4.960 1.00 32.83 ? 32 TYR D O 1 ATOM 5175 C CB . TYR D 2 32 ? -9.291 1.351 -5.060 1.00 29.62 ? 32 TYR D CB 1 ATOM 5176 C CG . TYR D 2 32 ? -10.064 0.137 -4.620 1.00 26.80 ? 32 TYR D CG 1 ATOM 5177 C CD1 . TYR D 2 32 ? -11.447 0.176 -4.526 1.00 24.78 ? 32 TYR D CD1 1 ATOM 5178 C CD2 . TYR D 2 32 ? -9.411 -1.049 -4.295 1.00 22.17 ? 32 TYR D CD2 1 ATOM 5179 C CE1 . TYR D 2 32 ? -12.167 -0.927 -4.119 1.00 28.45 ? 32 TYR D CE1 1 ATOM 5180 C CE2 . TYR D 2 32 ? -10.121 -2.161 -3.890 1.00 24.60 ? 32 TYR D CE2 1 ATOM 5181 C CZ . TYR D 2 32 ? -11.502 -2.095 -3.800 1.00 27.42 ? 32 TYR D CZ 1 ATOM 5182 O OH . TYR D 2 32 ? -12.239 -3.186 -3.392 1.00 32.72 ? 32 TYR D OH 1 ATOM 5183 N N . GLY D 2 33 ? -6.736 3.185 -4.285 1.00 31.23 ? 33 GLY D N 1 ATOM 5184 C CA . GLY D 2 33 ? -5.772 4.075 -4.905 1.00 24.21 ? 33 GLY D CA 1 ATOM 5185 C C . GLY D 2 33 ? -5.737 3.787 -6.395 1.00 22.49 ? 33 GLY D C 1 ATOM 5186 O O . GLY D 2 33 ? -6.078 2.690 -6.827 1.00 24.42 ? 33 GLY D O 1 ATOM 5187 N N . VAL D 2 34 ? -5.345 4.764 -7.201 1.00 23.67 ? 34 VAL D N 1 ATOM 5188 C CA . VAL D 2 34 ? -5.086 4.479 -8.611 1.00 19.31 ? 34 VAL D CA 1 ATOM 5189 C C . VAL D 2 34 ? -3.611 4.735 -8.901 1.00 20.42 ? 34 VAL D C 1 ATOM 5190 O O . VAL D 2 34 ? -3.075 5.799 -8.562 1.00 21.85 ? 34 VAL D O 1 ATOM 5191 C CB . VAL D 2 34 ? -6.004 5.292 -9.536 1.00 25.30 ? 34 VAL D CB 1 ATOM 5192 C CG1 . VAL D 2 34 ? -5.538 5.206 -10.978 1.00 23.27 ? 34 VAL D CG1 1 ATOM 5193 C CG2 . VAL D 2 34 ? -7.441 4.814 -9.394 1.00 28.75 ? 34 VAL D CG2 1 ATOM 5194 N N . HIS D 2 35 ? -2.947 3.738 -9.480 1.00 19.46 ? 35 HIS D N 1 ATOM 5195 C CA . HIS D 2 35 ? -1.525 3.847 -9.791 1.00 22.83 ? 35 HIS D CA 1 ATOM 5196 C C . HIS D 2 35 ? -1.324 4.215 -11.249 1.00 25.34 ? 35 HIS D C 1 ATOM 5197 O O . HIS D 2 35 ? -2.222 4.046 -12.075 1.00 23.21 ? 35 HIS D O 1 ATOM 5198 C CB . HIS D 2 35 ? -0.812 2.529 -9.520 1.00 24.06 ? 35 HIS D CB 1 ATOM 5199 C CG . HIS D 2 35 ? -0.939 2.049 -8.110 1.00 24.51 ? 35 HIS D CG 1 ATOM 5200 N ND1 . HIS D 2 35 ? 0.151 1.834 -7.296 1.00 22.82 ? 35 HIS D ND1 1 ATOM 5201 C CD2 . HIS D 2 35 ? -2.029 1.729 -7.372 1.00 20.56 ? 35 HIS D CD2 1 ATOM 5202 C CE1 . HIS D 2 35 ? -0.260 1.403 -6.116 1.00 20.06 ? 35 HIS D CE1 1 ATOM 5203 N NE2 . HIS D 2 35 ? -1.578 1.331 -6.136 1.00 19.54 ? 35 HIS D NE2 1 ATOM 5204 N N . TRP D 2 36 ? -0.131 4.707 -11.564 1.00 19.14 ? 36 TRP D N 1 ATOM 5205 C CA . TRP D 2 36 ? 0.239 4.957 -12.944 1.00 15.79 ? 36 TRP D CA 1 ATOM 5206 C C . TRP D 2 36 ? 1.558 4.268 -13.300 1.00 27.27 ? 36 TRP D C 1 ATOM 5207 O O . TRP D 2 36 ? 2.571 4.391 -12.591 1.00 24.66 ? 36 TRP D O 1 ATOM 5208 C CB . TRP D 2 36 ? 0.319 6.459 -13.226 1.00 17.46 ? 36 TRP D CB 1 ATOM 5209 C CG . TRP D 2 36 ? -1.004 7.129 -13.098 1.00 25.52 ? 36 TRP D CG 1 ATOM 5210 C CD1 . TRP D 2 36 ? -1.619 7.513 -11.937 1.00 19.31 ? 36 TRP D CD1 1 ATOM 5211 C CD2 . TRP D 2 36 ? -1.898 7.485 -14.163 1.00 25.74 ? 36 TRP D CD2 1 ATOM 5212 N NE1 . TRP D 2 36 ? -2.828 8.090 -12.215 1.00 18.68 ? 36 TRP D NE1 1 ATOM 5213 C CE2 . TRP D 2 36 ? -3.028 8.086 -13.572 1.00 19.85 ? 36 TRP D CE2 1 ATOM 5214 C CE3 . TRP D 2 36 ? -1.852 7.354 -15.555 1.00 24.42 ? 36 TRP D CE3 1 ATOM 5215 C CZ2 . TRP D 2 36 ? -4.104 8.558 -14.325 1.00 24.01 ? 36 TRP D CZ2 1 ATOM 5216 C CZ3 . TRP D 2 36 ? -2.919 7.823 -16.304 1.00 28.42 ? 36 TRP D CZ3 1 ATOM 5217 C CH2 . TRP D 2 36 ? -4.031 8.419 -15.686 1.00 30.11 ? 36 TRP D CH2 1 ATOM 5218 N N . VAL D 2 37 ? 1.526 3.544 -14.414 1.00 27.90 ? 37 VAL D N 1 ATOM 5219 C CA . VAL D 2 37 ? 2.673 2.800 -14.898 1.00 20.02 ? 37 VAL D CA 1 ATOM 5220 C C . VAL D 2 37 ? 2.873 3.199 -16.353 1.00 29.99 ? 37 VAL D C 1 ATOM 5221 O O . VAL D 2 37 ? 1.911 3.520 -17.061 1.00 35.15 ? 37 VAL D O 1 ATOM 5222 C CB . VAL D 2 37 ? 2.429 1.266 -14.785 1.00 19.35 ? 37 VAL D CB 1 ATOM 5223 C CG1 . VAL D 2 37 ? 3.564 0.457 -15.418 1.00 16.04 ? 37 VAL D CG1 1 ATOM 5224 C CG2 . VAL D 2 37 ? 2.219 0.864 -13.324 1.00 17.88 ? 37 VAL D CG2 1 ATOM 5225 N N . ARG D 2 38 ? 4.123 3.205 -16.800 1.00 28.39 ? 38 ARG D N 1 ATOM 5226 C CA . ARG D 2 38 ? 4.394 3.416 -18.210 1.00 21.87 ? 38 ARG D CA 1 ATOM 5227 C C . ARG D 2 38 ? 5.310 2.335 -18.764 1.00 21.84 ? 38 ARG D C 1 ATOM 5228 O O . ARG D 2 38 ? 5.964 1.598 -18.011 1.00 28.54 ? 38 ARG D O 1 ATOM 5229 C CB . ARG D 2 38 ? 4.962 4.815 -18.466 1.00 20.20 ? 38 ARG D CB 1 ATOM 5230 C CG . ARG D 2 38 ? 6.403 4.964 -18.087 1.00 17.90 ? 38 ARG D CG 1 ATOM 5231 C CD . ARG D 2 38 ? 6.900 6.334 -18.449 1.00 19.14 ? 38 ARG D CD 1 ATOM 5232 N NE . ARG D 2 38 ? 8.333 6.443 -18.222 1.00 25.01 ? 38 ARG D NE 1 ATOM 5233 C CZ . ARG D 2 38 ? 9.025 7.559 -18.394 1.00 26.80 ? 38 ARG D CZ 1 ATOM 5234 N NH1 . ARG D 2 38 ? 8.409 8.671 -18.789 1.00 27.17 ? 38 ARG D NH1 1 ATOM 5235 N NH2 . ARG D 2 38 ? 10.330 7.557 -18.170 1.00 26.64 ? 38 ARG D NH2 1 ATOM 5236 N N . GLN D 2 39 ? 5.350 2.249 -20.090 1.00 24.61 ? 39 GLN D N 1 ATOM 5237 C CA . GLN D 2 39 ? 6.092 1.201 -20.756 1.00 17.33 ? 39 GLN D CA 1 ATOM 5238 C C . GLN D 2 39 ? 6.770 1.775 -21.992 1.00 23.45 ? 39 GLN D C 1 ATOM 5239 O O . GLN D 2 39 ? 6.101 2.259 -22.902 1.00 27.96 ? 39 GLN D O 1 ATOM 5240 C CB . GLN D 2 39 ? 5.134 0.078 -21.121 1.00 17.38 ? 39 GLN D CB 1 ATOM 5241 C CG . GLN D 2 39 ? 5.783 -1.245 -21.384 1.00 23.63 ? 39 GLN D CG 1 ATOM 5242 C CD . GLN D 2 39 ? 4.769 -2.378 -21.493 1.00 28.22 ? 39 GLN D CD 1 ATOM 5243 O OE1 . GLN D 2 39 ? 3.581 -2.155 -21.773 1.00 24.34 ? 39 GLN D OE1 1 ATOM 5244 N NE2 . GLN D 2 39 ? 5.237 -3.604 -21.277 1.00 19.31 ? 39 GLN D NE2 1 ATOM 5245 N N . SER D 2 40 ? 8.102 1.735 -22.012 1.00 23.82 ? 40 SER D N 1 ATOM 5246 C CA . SER D 2 40 ? 8.883 2.354 -23.080 1.00 22.90 ? 40 SER D CA 1 ATOM 5247 C C . SER D 2 40 ? 9.995 1.423 -23.560 1.00 23.96 ? 40 SER D C 1 ATOM 5248 O O . SER D 2 40 ? 10.394 0.499 -22.841 1.00 20.49 ? 40 SER D O 1 ATOM 5249 C CB . SER D 2 40 ? 9.517 3.651 -22.574 1.00 19.36 ? 40 SER D CB 1 ATOM 5250 O OG . SER D 2 40 ? 10.589 3.365 -21.681 1.00 19.79 ? 40 SER D OG 1 ATOM 5251 N N . PRO D 2 41 ? 10.522 1.678 -24.770 1.00 25.05 ? 41 PRO D N 1 ATOM 5252 C CA . PRO D 2 41 ? 11.659 0.887 -25.253 1.00 23.73 ? 41 PRO D CA 1 ATOM 5253 C C . PRO D 2 41 ? 12.874 0.961 -24.322 1.00 23.22 ? 41 PRO D C 1 ATOM 5254 O O . PRO D 2 41 ? 13.458 -0.070 -23.985 1.00 27.10 ? 41 PRO D O 1 ATOM 5255 C CB . PRO D 2 41 ? 11.971 1.533 -26.602 1.00 24.64 ? 41 PRO D CB 1 ATOM 5256 C CG . PRO D 2 41 ? 10.644 2.056 -27.060 1.00 22.76 ? 41 PRO D CG 1 ATOM 5257 C CD . PRO D 2 41 ? 10.016 2.595 -25.808 1.00 22.42 ? 41 PRO D CD 1 ATOM 5258 N N . GLY D 2 42 ? 13.234 2.160 -23.887 1.00 24.65 ? 42 GLY D N 1 ATOM 5259 C CA . GLY D 2 42 ? 14.425 2.342 -23.074 1.00 25.59 ? 42 GLY D CA 1 ATOM 5260 C C . GLY D 2 42 ? 14.377 1.760 -21.669 1.00 31.34 ? 42 GLY D C 1 ATOM 5261 O O . GLY D 2 42 ? 15.385 1.261 -21.164 1.00 35.92 ? 42 GLY D O 1 ATOM 5262 N N . LYS D 2 43 ? 13.217 1.815 -21.023 1.00 28.57 ? 43 LYS D N 1 ATOM 5263 C CA . LYS D 2 43 ? 13.161 1.464 -19.607 1.00 35.64 ? 43 LYS D CA 1 ATOM 5264 C C . LYS D 2 43 ? 12.170 0.359 -19.259 1.00 29.02 ? 43 LYS D C 1 ATOM 5265 O O . LYS D 2 43 ? 12.022 0.029 -18.089 1.00 33.94 ? 43 LYS D O 1 ATOM 5266 C CB . LYS D 2 43 ? 12.871 2.706 -18.757 1.00 42.52 ? 43 LYS D CB 1 ATOM 5267 C CG . LYS D 2 43 ? 13.998 3.735 -18.739 1.00 47.70 ? 43 LYS D CG 1 ATOM 5268 C CD . LYS D 2 43 ? 15.175 3.260 -17.891 1.00 54.43 ? 43 LYS D CD 1 ATOM 5269 C CE . LYS D 2 43 ? 14.790 3.109 -16.412 1.00 59.24 ? 43 LYS D CE 1 ATOM 5270 N NZ . LYS D 2 43 ? 14.748 4.402 -15.655 1.00 57.37 ? 43 LYS D NZ 1 ATOM 5271 N N . GLY D 2 44 ? 11.511 -0.217 -20.262 1.00 29.30 ? 44 GLY D N 1 ATOM 5272 C CA . GLY D 2 44 ? 10.499 -1.232 -20.021 1.00 20.74 ? 44 GLY D CA 1 ATOM 5273 C C . GLY D 2 44 ? 9.368 -0.697 -19.162 1.00 21.06 ? 44 GLY D C 1 ATOM 5274 O O . GLY D 2 44 ? 9.013 0.483 -19.258 1.00 21.19 ? 44 GLY D O 1 ATOM 5275 N N . LEU D 2 45 ? 8.812 -1.559 -18.313 1.00 19.48 ? 45 LEU D N 1 ATOM 5276 C CA . LEU D 2 45 ? 7.793 -1.155 -17.343 1.00 19.69 ? 45 LEU D CA 1 ATOM 5277 C C . LEU D 2 45 ? 8.374 -0.379 -16.161 1.00 23.99 ? 45 LEU D C 1 ATOM 5278 O O . LEU D 2 45 ? 9.285 -0.861 -15.490 1.00 24.43 ? 45 LEU D O 1 ATOM 5279 C CB . LEU D 2 45 ? 7.047 -2.380 -16.827 1.00 23.60 ? 45 LEU D CB 1 ATOM 5280 C CG . LEU D 2 45 ? 6.128 -3.071 -17.837 1.00 23.10 ? 45 LEU D CG 1 ATOM 5281 C CD1 . LEU D 2 45 ? 5.855 -4.514 -17.403 1.00 21.46 ? 45 LEU D CD1 1 ATOM 5282 C CD2 . LEU D 2 45 ? 4.831 -2.292 -17.997 1.00 17.70 ? 45 LEU D CD2 1 ATOM 5283 N N . GLU D 2 46 ? 7.839 0.821 -15.927 1.00 21.92 ? 46 GLU D N 1 ATOM 5284 C CA . GLU D 2 46 ? 8.199 1.653 -14.773 1.00 26.03 ? 46 GLU D CA 1 ATOM 5285 C C . GLU D 2 46 ? 6.955 2.103 -14.024 1.00 27.39 ? 46 GLU D C 1 ATOM 5286 O O . GLU D 2 46 ? 6.001 2.608 -14.627 1.00 23.79 ? 46 GLU D O 1 ATOM 5287 C CB . GLU D 2 46 ? 8.918 2.935 -15.190 1.00 21.86 ? 46 GLU D CB 1 ATOM 5288 C CG . GLU D 2 46 ? 10.304 2.790 -15.746 1.00 29.31 ? 46 GLU D CG 1 ATOM 5289 C CD . GLU D 2 46 ? 10.854 4.139 -16.173 1.00 33.09 ? 46 GLU D CD 1 ATOM 5290 O OE1 . GLU D 2 46 ? 10.351 4.695 -17.176 1.00 29.70 ? 46 GLU D OE1 1 ATOM 5291 O OE2 . GLU D 2 46 ? 11.767 4.659 -15.495 1.00 32.80 ? 46 GLU D OE2 1 ATOM 5292 N N . TRP D 2 47 ? 6.984 1.953 -12.705 1.00 22.75 ? 47 TRP D N 1 ATOM 5293 C CA . TRP D 2 47 ? 5.930 2.487 -11.862 1.00 17.07 ? 47 TRP D CA 1 ATOM 5294 C C . TRP D 2 47 ? 6.190 3.974 -11.618 1.00 21.37 ? 47 TRP D C 1 ATOM 5295 O O . TRP D 2 47 ? 7.261 4.357 -11.150 1.00 26.59 ? 47 TRP D O 1 ATOM 5296 C CB . TRP D 2 47 ? 5.898 1.715 -10.549 1.00 25.03 ? 47 TRP D CB 1 ATOM 5297 C CG . TRP D 2 47 ? 4.900 2.199 -9.567 1.00 20.04 ? 47 TRP D CG 1 ATOM 5298 C CD1 . TRP D 2 47 ? 3.563 1.921 -9.546 1.00 21.54 ? 47 TRP D CD1 1 ATOM 5299 C CD2 . TRP D 2 47 ? 5.156 3.034 -8.436 1.00 21.52 ? 47 TRP D CD2 1 ATOM 5300 N NE1 . TRP D 2 47 ? 2.968 2.538 -8.468 1.00 20.61 ? 47 TRP D NE1 1 ATOM 5301 C CE2 . TRP D 2 47 ? 3.926 3.226 -7.770 1.00 20.91 ? 47 TRP D CE2 1 ATOM 5302 C CE3 . TRP D 2 47 ? 6.307 3.634 -7.916 1.00 22.68 ? 47 TRP D CE3 1 ATOM 5303 C CZ2 . TRP D 2 47 ? 3.816 3.999 -6.614 1.00 23.19 ? 47 TRP D CZ2 1 ATOM 5304 C CZ3 . TRP D 2 47 ? 6.199 4.395 -6.761 1.00 22.18 ? 47 TRP D CZ3 1 ATOM 5305 C CH2 . TRP D 2 47 ? 4.962 4.577 -6.128 1.00 18.84 ? 47 TRP D CH2 1 ATOM 5306 N N . LEU D 2 48 ? 5.213 4.812 -11.942 1.00 22.31 ? 48 LEU D N 1 ATOM 5307 C CA . LEU D 2 48 ? 5.393 6.256 -11.837 1.00 23.83 ? 48 LEU D CA 1 ATOM 5308 C C . LEU D 2 48 ? 4.911 6.821 -10.498 1.00 27.27 ? 48 LEU D C 1 ATOM 5309 O O . LEU D 2 48 ? 5.611 7.613 -9.855 1.00 28.08 ? 48 LEU D O 1 ATOM 5310 C CB . LEU D 2 48 ? 4.681 6.957 -12.990 1.00 24.61 ? 48 LEU D CB 1 ATOM 5311 C CG . LEU D 2 48 ? 5.140 6.532 -14.383 1.00 21.40 ? 48 LEU D CG 1 ATOM 5312 C CD1 . LEU D 2 48 ? 4.443 7.355 -15.452 1.00 20.60 ? 48 LEU D CD1 1 ATOM 5313 C CD2 . LEU D 2 48 ? 6.651 6.672 -14.489 1.00 17.49 ? 48 LEU D CD2 1 ATOM 5314 N N . GLY D 2 49 ? 3.716 6.416 -10.083 1.00 19.91 ? 49 GLY D N 1 ATOM 5315 C CA . GLY D 2 49 ? 3.156 6.912 -8.845 1.00 20.53 ? 49 GLY D CA 1 ATOM 5316 C C . GLY D 2 49 ? 1.748 6.437 -8.568 1.00 24.95 ? 49 GLY D C 1 ATOM 5317 O O . GLY D 2 49 ? 1.190 5.612 -9.301 1.00 29.23 ? 49 GLY D O 1 ATOM 5318 N N . VAL D 2 50 ? 1.166 6.990 -7.509 1.00 23.30 ? 50 VAL D N 1 ATOM 5319 C CA . VAL D 2 50 ? -0.151 6.588 -7.045 1.00 19.17 ? 50 VAL D CA 1 ATOM 5320 C C . VAL D 2 50 ? -0.834 7.740 -6.310 1.00 20.89 ? 50 VAL D C 1 ATOM 5321 O O . VAL D 2 50 ? -0.173 8.562 -5.663 1.00 23.83 ? 50 VAL D O 1 ATOM 5322 C CB . VAL D 2 50 ? -0.040 5.365 -6.089 1.00 24.63 ? 50 VAL D CB 1 ATOM 5323 C CG1 . VAL D 2 50 ? 0.844 5.695 -4.896 1.00 18.34 ? 50 VAL D CG1 1 ATOM 5324 C CG2 . VAL D 2 50 ? -1.420 4.879 -5.637 1.00 20.83 ? 50 VAL D CG2 1 ATOM 5325 N N . ILE D 2 51 ? -2.157 7.813 -6.437 1.00 20.65 ? 51 ILE D N 1 ATOM 5326 C CA . ILE D 2 51 ? -2.966 8.628 -5.550 1.00 25.26 ? 51 ILE D CA 1 ATOM 5327 C C . ILE D 2 51 ? -3.870 7.693 -4.731 1.00 26.91 ? 51 ILE D C 1 ATOM 5328 O O . ILE D 2 51 ? -4.579 6.847 -5.278 1.00 30.67 ? 51 ILE D O 1 ATOM 5329 C CB . ILE D 2 51 ? -3.760 9.711 -6.320 1.00 29.19 ? 51 ILE D CB 1 ATOM 5330 C CG1 . ILE D 2 51 ? -4.485 10.649 -5.351 1.00 31.59 ? 51 ILE D CG1 1 ATOM 5331 C CG2 . ILE D 2 51 ? -4.729 9.089 -7.335 1.00 23.24 ? 51 ILE D CG2 1 ATOM 5332 C CD1 . ILE D 2 51 ? -5.081 11.873 -6.044 1.00 27.29 ? 51 ILE D CD1 1 ATOM 5333 N N . TRP D 2 52 ? -3.812 7.821 -3.412 1.00 23.78 ? 52 TRP D N 1 ATOM 5334 C CA . TRP D 2 52 ? -4.516 6.894 -2.538 1.00 24.43 ? 52 TRP D CA 1 ATOM 5335 C C . TRP D 2 52 ? -5.943 7.354 -2.254 1.00 29.89 ? 52 TRP D C 1 ATOM 5336 O O . TRP D 2 52 ? -6.297 8.500 -2.542 1.00 30.17 ? 52 TRP D O 1 ATOM 5337 C CB . TRP D 2 52 ? -3.750 6.722 -1.226 1.00 27.31 ? 52 TRP D CB 1 ATOM 5338 C CG . TRP D 2 52 ? -2.369 6.162 -1.393 1.00 26.95 ? 52 TRP D CG 1 ATOM 5339 C CD1 . TRP D 2 52 ? -1.193 6.846 -1.321 1.00 24.33 ? 52 TRP D CD1 1 ATOM 5340 C CD2 . TRP D 2 52 ? -2.021 4.798 -1.673 1.00 33.36 ? 52 TRP D CD2 1 ATOM 5341 N NE1 . TRP D 2 52 ? -0.134 5.996 -1.538 1.00 27.47 ? 52 TRP D NE1 1 ATOM 5342 C CE2 . TRP D 2 52 ? -0.614 4.733 -1.753 1.00 31.98 ? 52 TRP D CE2 1 ATOM 5343 C CE3 . TRP D 2 52 ? -2.762 3.627 -1.864 1.00 34.67 ? 52 TRP D CE3 1 ATOM 5344 C CZ2 . TRP D 2 52 ? 0.067 3.544 -2.011 1.00 33.32 ? 52 TRP D CZ2 1 ATOM 5345 C CZ3 . TRP D 2 52 ? -2.083 2.445 -2.117 1.00 35.17 ? 52 TRP D CZ3 1 ATOM 5346 C CH2 . TRP D 2 52 ? -0.683 2.412 -2.189 1.00 33.01 ? 52 TRP D CH2 1 ATOM 5347 N N . SER D 2 53 ? -6.741 6.444 -1.689 1.00 29.90 ? 53 SER D N 1 ATOM 5348 C CA . SER D 2 53 ? -8.137 6.695 -1.323 1.00 28.66 ? 53 SER D CA 1 ATOM 5349 C C . SER D 2 53 ? -8.381 8.104 -0.816 1.00 29.83 ? 53 SER D C 1 ATOM 5350 O O . SER D 2 53 ? -9.233 8.828 -1.351 1.00 29.18 ? 53 SER D O 1 ATOM 5351 C CB . SER D 2 53 ? -8.592 5.709 -0.243 1.00 32.24 ? 53 SER D CB 1 ATOM 5352 O OG . SER D 2 53 ? -8.452 4.372 -0.676 1.00 41.31 ? 53 SER D OG 1 ATOM 5353 N N . GLY D 2 54 ? -7.616 8.495 0.205 1.00 29.40 ? 54 GLY D N 1 ATOM 5354 C CA . GLY D 2 54 ? -7.808 9.774 0.879 1.00 25.66 ? 54 GLY D CA 1 ATOM 5355 C C . GLY D 2 54 ? -7.082 10.978 0.286 1.00 29.49 ? 54 GLY D C 1 ATOM 5356 O O . GLY D 2 54 ? -7.046 12.043 0.898 1.00 34.25 ? 54 GLY D O 1 ATOM 5357 N N . GLY D 2 55 ? -6.493 10.822 -0.894 1.00 24.77 ? 55 GLY D N 1 ATOM 5358 C CA . GLY D 2 55 ? -5.940 11.964 -1.595 1.00 26.76 ? 55 GLY D CA 1 ATOM 5359 C C . GLY D 2 55 ? -4.430 12.140 -1.571 1.00 28.18 ? 55 GLY D C 1 ATOM 5360 O O . GLY D 2 55 ? -3.909 12.956 -2.325 1.00 34.88 ? 55 GLY D O 1 ATOM 5361 N N . ASN D 2 56 ? -3.738 11.410 -0.701 1.00 24.50 ? 56 ASN D N 1 ATOM 5362 C CA . ASN D 2 56 ? -2.282 11.440 -0.644 1.00 29.56 ? 56 ASN D CA 1 ATOM 5363 C C . ASN D 2 56 ? -1.681 10.951 -1.956 1.00 31.98 ? 56 ASN D C 1 ATOM 5364 O O . ASN D 2 56 ? -2.315 10.193 -2.705 1.00 27.25 ? 56 ASN D O 1 ATOM 5365 C CB . ASN D 2 56 ? -1.759 10.556 0.501 1.00 32.82 ? 56 ASN D CB 1 ATOM 5366 C CG . ASN D 2 56 ? -1.893 11.211 1.874 1.00 35.89 ? 56 ASN D CG 1 ATOM 5367 O OD1 . ASN D 2 56 ? -2.033 12.427 1.992 1.00 37.22 ? 56 ASN D OD1 1 ATOM 5368 N ND2 . ASN D 2 56 ? -1.834 10.396 2.922 1.00 33.59 ? 56 ASN D ND2 1 ATOM 5369 N N . THR D 2 57 ? -0.456 11.379 -2.241 1.00 23.14 ? 57 THR D N 1 ATOM 5370 C CA . THR D 2 57 ? 0.230 10.901 -3.427 1.00 22.03 ? 57 THR D CA 1 ATOM 5371 C C . THR D 2 57 ? 1.650 10.454 -3.105 1.00 27.91 ? 57 THR D C 1 ATOM 5372 O O . THR D 2 57 ? 2.323 11.058 -2.272 1.00 28.19 ? 57 THR D O 1 ATOM 5373 C CB . THR D 2 57 ? 0.278 11.974 -4.519 1.00 25.99 ? 57 THR D CB 1 ATOM 5374 O OG1 . THR D 2 57 ? 0.847 13.176 -3.980 1.00 32.35 ? 57 THR D OG1 1 ATOM 5375 C CG2 . THR D 2 57 ? -1.121 12.255 -5.045 1.00 22.41 ? 57 THR D CG2 1 ATOM 5376 N N . ASP D 2 58 ? 2.084 9.383 -3.764 1.00 26.96 ? 58 ASP D N 1 ATOM 5377 C CA . ASP D 2 58 ? 3.474 8.965 -3.754 1.00 28.01 ? 58 ASP D CA 1 ATOM 5378 C C . ASP D 2 58 ? 3.959 9.020 -5.199 1.00 35.10 ? 58 ASP D C 1 ATOM 5379 O O . ASP D 2 58 ? 3.241 8.585 -6.110 1.00 33.58 ? 58 ASP D O 1 ATOM 5380 C CB . ASP D 2 58 ? 3.610 7.521 -3.255 1.00 30.93 ? 58 ASP D CB 1 ATOM 5381 C CG . ASP D 2 58 ? 3.268 7.352 -1.773 1.00 35.44 ? 58 ASP D CG 1 ATOM 5382 O OD1 . ASP D 2 58 ? 3.697 8.183 -0.942 1.00 35.02 ? 58 ASP D OD1 1 ATOM 5383 O OD2 . ASP D 2 58 ? 2.583 6.357 -1.442 1.00 38.87 ? 58 ASP D OD2 1 ATOM 5384 N N . TYR D 2 59 ? 5.168 9.541 -5.419 1.00 29.02 ? 59 TYR D N 1 ATOM 5385 C CA . TYR D 2 59 ? 5.765 9.512 -6.754 1.00 27.20 ? 59 TYR D CA 1 ATOM 5386 C C . TYR D 2 59 ? 7.093 8.771 -6.729 1.00 29.94 ? 59 TYR D C 1 ATOM 5387 O O . TYR D 2 59 ? 7.885 8.922 -5.789 1.00 22.28 ? 59 TYR D O 1 ATOM 5388 C CB . TYR D 2 59 ? 5.977 10.932 -7.298 1.00 27.30 ? 59 TYR D CB 1 ATOM 5389 C CG . TYR D 2 59 ? 4.732 11.797 -7.270 1.00 31.83 ? 59 TYR D CG 1 ATOM 5390 C CD1 . TYR D 2 59 ? 3.534 11.354 -7.831 1.00 31.28 ? 59 TYR D CD1 1 ATOM 5391 C CD2 . TYR D 2 59 ? 4.748 13.048 -6.671 1.00 28.81 ? 59 TYR D CD2 1 ATOM 5392 C CE1 . TYR D 2 59 ? 2.390 12.144 -7.803 1.00 25.19 ? 59 TYR D CE1 1 ATOM 5393 C CE2 . TYR D 2 59 ? 3.613 13.842 -6.637 1.00 27.30 ? 59 TYR D CE2 1 ATOM 5394 C CZ . TYR D 2 59 ? 2.438 13.386 -7.203 1.00 24.63 ? 59 TYR D CZ 1 ATOM 5395 O OH . TYR D 2 59 ? 1.313 14.174 -7.160 1.00 26.36 ? 59 TYR D OH 1 ATOM 5396 N N . ASN D 2 60 ? 7.342 7.970 -7.761 1.00 25.02 ? 60 ASN D N 1 ATOM 5397 C CA . ASN D 2 60 ? 8.641 7.329 -7.890 1.00 26.05 ? 60 ASN D CA 1 ATOM 5398 C C . ASN D 2 60 ? 9.720 8.404 -7.978 1.00 25.51 ? 60 ASN D C 1 ATOM 5399 O O . ASN D 2 60 ? 9.551 9.394 -8.682 1.00 28.41 ? 60 ASN D O 1 ATOM 5400 C CB . ASN D 2 60 ? 8.686 6.405 -9.100 1.00 20.13 ? 60 ASN D CB 1 ATOM 5401 C CG . ASN D 2 60 ? 9.790 5.366 -8.995 1.00 25.48 ? 60 ASN D CG 1 ATOM 5402 O OD1 . ASN D 2 60 ? 10.673 5.474 -8.145 1.00 22.08 ? 60 ASN D OD1 1 ATOM 5403 N ND2 . ASN D 2 60 ? 9.744 4.352 -9.861 1.00 22.43 ? 60 ASN D ND2 1 ATOM 5404 N N . THR D 2 61 ? 10.807 8.208 -7.237 1.00 28.29 ? 61 THR D N 1 ATOM 5405 C CA . THR D 2 61 ? 11.848 9.226 -7.052 1.00 35.20 ? 61 THR D CA 1 ATOM 5406 C C . THR D 2 61 ? 12.228 10.062 -8.295 1.00 37.21 ? 61 THR D C 1 ATOM 5407 O O . THR D 2 61 ? 12.178 11.287 -8.241 1.00 37.13 ? 61 THR D O 1 ATOM 5408 C CB . THR D 2 61 ? 13.105 8.624 -6.362 1.00 35.79 ? 61 THR D CB 1 ATOM 5409 O OG1 . THR D 2 61 ? 12.736 8.113 -5.076 1.00 36.74 ? 61 THR D OG1 1 ATOM 5410 C CG2 . THR D 2 61 ? 14.191 9.672 -6.196 1.00 32.60 ? 61 THR D CG2 1 ATOM 5411 N N . PRO D 2 62 ? 12.565 9.415 -9.427 1.00 40.00 ? 62 PRO D N 1 ATOM 5412 C CA . PRO D 2 62 ? 12.926 10.227 -10.604 1.00 36.67 ? 62 PRO D CA 1 ATOM 5413 C C . PRO D 2 62 ? 11.825 11.119 -11.213 1.00 34.64 ? 62 PRO D C 1 ATOM 5414 O O . PRO D 2 62 ? 12.106 11.803 -12.193 1.00 40.24 ? 62 PRO D O 1 ATOM 5415 C CB . PRO D 2 62 ? 13.353 9.174 -11.643 1.00 35.74 ? 62 PRO D CB 1 ATOM 5416 C CG . PRO D 2 62 ? 12.681 7.915 -11.216 1.00 35.96 ? 62 PRO D CG 1 ATOM 5417 C CD . PRO D 2 62 ? 12.686 7.970 -9.704 1.00 38.51 ? 62 PRO D CD 1 ATOM 5418 N N . PHE D 2 63 ? 10.611 11.119 -10.675 1.00 31.81 ? 63 PHE D N 1 ATOM 5419 C CA . PHE D 2 63 ? 9.534 11.889 -11.291 1.00 22.93 ? 63 PHE D CA 1 ATOM 5420 C C . PHE D 2 63 ? 8.957 12.922 -10.334 1.00 37.08 ? 63 PHE D C 1 ATOM 5421 O O . PHE D 2 63 ? 8.100 13.727 -10.720 1.00 39.36 ? 63 PHE D O 1 ATOM 5422 C CB . PHE D 2 63 ? 8.427 10.961 -11.809 1.00 27.94 ? 63 PHE D CB 1 ATOM 5423 C CG . PHE D 2 63 ? 8.916 9.937 -12.807 1.00 28.01 ? 63 PHE D CG 1 ATOM 5424 C CD1 . PHE D 2 63 ? 9.023 10.254 -14.147 1.00 28.26 ? 63 PHE D CD1 1 ATOM 5425 C CD2 . PHE D 2 63 ? 9.296 8.673 -12.396 1.00 28.73 ? 63 PHE D CD2 1 ATOM 5426 C CE1 . PHE D 2 63 ? 9.487 9.326 -15.056 1.00 28.21 ? 63 PHE D CE1 1 ATOM 5427 C CE2 . PHE D 2 63 ? 9.769 7.744 -13.306 1.00 28.72 ? 63 PHE D CE2 1 ATOM 5428 C CZ . PHE D 2 63 ? 9.865 8.071 -14.633 1.00 19.96 ? 63 PHE D CZ 1 ATOM 5429 N N . THR D 2 64 ? 9.450 12.911 -9.095 1.00 33.11 ? 64 THR D N 1 ATOM 5430 C CA . THR D 2 64 ? 8.848 13.685 -8.015 1.00 32.45 ? 64 THR D CA 1 ATOM 5431 C C . THR D 2 64 ? 8.703 15.171 -8.332 1.00 32.48 ? 64 THR D C 1 ATOM 5432 O O . THR D 2 64 ? 7.694 15.785 -7.985 1.00 35.12 ? 64 THR D O 1 ATOM 5433 C CB . THR D 2 64 ? 9.598 13.488 -6.667 1.00 42.50 ? 64 THR D CB 1 ATOM 5434 O OG1 . THR D 2 64 ? 11.007 13.660 -6.859 1.00 47.23 ? 64 THR D OG1 1 ATOM 5435 C CG2 . THR D 2 64 ? 9.353 12.097 -6.122 1.00 44.85 ? 64 THR D CG2 1 ATOM 5436 N N . SER D 2 65 ? 9.686 15.729 -9.030 1.00 36.32 ? 65 SER D N 1 ATOM 5437 C CA A SER D 2 65 ? 9.694 17.161 -9.304 0.36 40.80 ? 65 SER D CA 1 ATOM 5438 C CA B SER D 2 65 ? 9.719 17.158 -9.322 0.64 40.78 ? 65 SER D CA 1 ATOM 5439 C C . SER D 2 65 ? 8.940 17.542 -10.579 1.00 45.49 ? 65 SER D C 1 ATOM 5440 O O . SER D 2 65 ? 8.832 18.723 -10.912 1.00 49.89 ? 65 SER D O 1 ATOM 5441 C CB A SER D 2 65 ? 11.130 17.693 -9.346 0.36 41.86 ? 65 SER D CB 1 ATOM 5442 C CB B SER D 2 65 ? 11.165 17.625 -9.479 0.64 41.23 ? 65 SER D CB 1 ATOM 5443 O OG A SER D 2 65 ? 11.729 17.643 -8.058 0.36 44.19 ? 65 SER D OG 1 ATOM 5444 O OG B SER D 2 65 ? 11.720 17.115 -10.677 0.64 41.42 ? 65 SER D OG 1 ATOM 5445 N N . ARG D 2 66 ? 8.408 16.558 -11.295 1.00 46.35 ? 66 ARG D N 1 ATOM 5446 C CA . ARG D 2 66 ? 7.683 16.904 -12.517 1.00 45.28 ? 66 ARG D CA 1 ATOM 5447 C C . ARG D 2 66 ? 6.363 16.186 -12.711 1.00 37.34 ? 66 ARG D C 1 ATOM 5448 O O . ARG D 2 66 ? 5.760 16.282 -13.775 1.00 29.04 ? 66 ARG D O 1 ATOM 5449 C CB . ARG D 2 66 ? 8.564 16.734 -13.758 1.00 41.40 ? 66 ARG D CB 1 ATOM 5450 C CG . ARG D 2 66 ? 8.945 15.311 -14.111 1.00 31.71 ? 66 ARG D CG 1 ATOM 5451 C CD . ARG D 2 66 ? 9.985 15.383 -15.218 1.00 34.21 ? 66 ARG D CD 1 ATOM 5452 N NE . ARG D 2 66 ? 10.375 14.075 -15.712 1.00 33.15 ? 66 ARG D NE 1 ATOM 5453 C CZ . ARG D 2 66 ? 10.106 13.634 -16.934 1.00 35.34 ? 66 ARG D CZ 1 ATOM 5454 N NH1 . ARG D 2 66 ? 9.446 14.409 -17.792 1.00 32.96 ? 66 ARG D NH1 1 ATOM 5455 N NH2 . ARG D 2 66 ? 10.500 12.417 -17.292 1.00 33.30 ? 66 ARG D NH2 1 ATOM 5456 N N . LEU D 2 67 ? 5.901 15.506 -11.671 1.00 33.52 ? 67 LEU D N 1 ATOM 5457 C CA . LEU D 2 67 ? 4.687 14.713 -11.767 1.00 33.66 ? 67 LEU D CA 1 ATOM 5458 C C . LEU D 2 67 ? 3.628 15.170 -10.769 1.00 35.03 ? 67 LEU D C 1 ATOM 5459 O O . LEU D 2 67 ? 3.925 15.386 -9.598 1.00 47.40 ? 67 LEU D O 1 ATOM 5460 C CB . LEU D 2 67 ? 5.030 13.243 -11.540 1.00 35.16 ? 67 LEU D CB 1 ATOM 5461 C CG . LEU D 2 67 ? 3.929 12.215 -11.742 1.00 38.42 ? 67 LEU D CG 1 ATOM 5462 C CD1 . LEU D 2 67 ? 3.348 12.392 -13.114 1.00 42.73 ? 67 LEU D CD1 1 ATOM 5463 C CD2 . LEU D 2 67 ? 4.507 10.825 -11.580 1.00 38.92 ? 67 LEU D CD2 1 ATOM 5464 N N . SER D 2 68 ? 2.392 15.326 -11.235 1.00 29.54 ? 68 SER D N 1 ATOM 5465 C CA . SER D 2 68 ? 1.272 15.647 -10.349 1.00 33.50 ? 68 SER D CA 1 ATOM 5466 C C . SER D 2 68 ? 0.100 14.741 -10.631 1.00 38.21 ? 68 SER D C 1 ATOM 5467 O O . SER D 2 68 ? -0.291 14.548 -11.788 1.00 39.88 ? 68 SER D O 1 ATOM 5468 C CB . SER D 2 68 ? 0.817 17.092 -10.517 1.00 41.31 ? 68 SER D CB 1 ATOM 5469 O OG . SER D 2 68 ? 1.836 17.976 -10.096 1.00 55.77 ? 68 SER D OG 1 ATOM 5470 N N . ILE D 2 69 ? -0.467 14.191 -9.568 1.00 33.57 ? 69 ILE D N 1 ATOM 5471 C CA . ILE D 2 69 ? -1.627 13.343 -9.702 1.00 22.00 ? 69 ILE D CA 1 ATOM 5472 C C . ILE D 2 69 ? -2.727 13.882 -8.806 1.00 23.12 ? 69 ILE D C 1 ATOM 5473 O O . ILE D 2 69 ? -2.530 14.040 -7.599 1.00 31.32 ? 69 ILE D O 1 ATOM 5474 C CB . ILE D 2 69 ? -1.281 11.881 -9.361 1.00 26.25 ? 69 ILE D CB 1 ATOM 5475 C CG1 . ILE D 2 69 ? -0.197 11.366 -10.318 1.00 19.67 ? 69 ILE D CG1 1 ATOM 5476 C CG2 . ILE D 2 69 ? -2.517 10.997 -9.429 1.00 22.94 ? 69 ILE D CG2 1 ATOM 5477 C CD1 . ILE D 2 69 ? 0.233 9.943 -10.052 1.00 18.54 ? 69 ILE D CD1 1 ATOM 5478 N N . ASN D 2 70 ? -3.870 14.197 -9.410 1.00 32.67 ? 70 ASN D N 1 ATOM 5479 C CA . ASN D 2 70 ? -5.064 14.630 -8.678 1.00 36.97 ? 70 ASN D CA 1 ATOM 5480 C C . ASN D 2 70 ? -6.269 13.821 -9.110 1.00 36.60 ? 70 ASN D C 1 ATOM 5481 O O . ASN D 2 70 ? -6.192 13.052 -10.071 1.00 36.08 ? 70 ASN D O 1 ATOM 5482 C CB . ASN D 2 70 ? -5.361 16.104 -8.930 1.00 41.62 ? 70 ASN D CB 1 ATOM 5483 C CG . ASN D 2 70 ? -4.327 17.015 -8.320 1.00 49.43 ? 70 ASN D CG 1 ATOM 5484 O OD1 . ASN D 2 70 ? -4.363 17.305 -7.117 1.00 59.16 ? 70 ASN D OD1 1 ATOM 5485 N ND2 . ASN D 2 70 ? -3.392 17.476 -9.145 1.00 40.60 ? 70 ASN D ND2 1 ATOM 5486 N N . LYS D 2 71 ? -7.390 14.012 -8.421 1.00 31.28 ? 71 LYS D N 1 ATOM 5487 C CA . LYS D 2 71 ? -8.605 13.287 -8.771 1.00 30.33 ? 71 LYS D CA 1 ATOM 5488 C C . LYS D 2 71 ? -9.885 14.019 -8.383 1.00 30.56 ? 71 LYS D C 1 ATOM 5489 O O . LYS D 2 71 ? -9.857 15.014 -7.671 1.00 35.33 ? 71 LYS D O 1 ATOM 5490 C CB . LYS D 2 71 ? -8.591 11.894 -8.135 1.00 32.59 ? 71 LYS D CB 1 ATOM 5491 C CG . LYS D 2 71 ? -8.740 11.894 -6.621 1.00 31.15 ? 71 LYS D CG 1 ATOM 5492 C CD . LYS D 2 71 ? -8.524 10.497 -6.075 1.00 23.32 ? 71 LYS D CD 1 ATOM 5493 C CE . LYS D 2 71 ? -8.512 10.477 -4.550 1.00 25.61 ? 71 LYS D CE 1 ATOM 5494 N NZ . LYS D 2 71 ? -9.516 9.517 -4.007 1.00 24.32 ? 71 LYS D NZ 1 ATOM 5495 N N . ASP D 2 72 ? -11.006 13.517 -8.880 1.00 35.38 ? 72 ASP D N 1 ATOM 5496 C CA . ASP D 2 72 ? -12.315 14.007 -8.495 1.00 38.28 ? 72 ASP D CA 1 ATOM 5497 C C . ASP D 2 72 ? -13.170 12.786 -8.199 1.00 39.13 ? 72 ASP D C 1 ATOM 5498 O O . ASP D 2 72 ? -13.564 12.062 -9.114 1.00 35.15 ? 72 ASP D O 1 ATOM 5499 C CB . ASP D 2 72 ? -12.932 14.826 -9.625 1.00 43.24 ? 72 ASP D CB 1 ATOM 5500 C CG . ASP D 2 72 ? -14.217 15.519 -9.212 1.00 52.40 ? 72 ASP D CG 1 ATOM 5501 O OD1 . ASP D 2 72 ? -15.083 14.873 -8.584 1.00 53.15 ? 72 ASP D OD1 1 ATOM 5502 O OD2 . ASP D 2 72 ? -14.360 16.720 -9.517 1.00 56.41 ? 72 ASP D OD2 1 ATOM 5503 N N . ASN D 2 73 ? -13.443 12.557 -6.919 1.00 41.56 ? 73 ASN D N 1 ATOM 5504 C CA . ASN D 2 73 ? -14.169 11.367 -6.481 1.00 38.97 ? 73 ASN D CA 1 ATOM 5505 C C . ASN D 2 73 ? -15.574 11.259 -7.066 1.00 38.38 ? 73 ASN D C 1 ATOM 5506 O O . ASN D 2 73 ? -15.993 10.182 -7.502 1.00 37.15 ? 73 ASN D O 1 ATOM 5507 C CB . ASN D 2 73 ? -14.231 11.310 -4.953 1.00 36.61 ? 73 ASN D CB 1 ATOM 5508 C CG . ASN D 2 73 ? -12.868 11.150 -4.324 1.00 36.62 ? 73 ASN D CG 1 ATOM 5509 O OD1 . ASN D 2 73 ? -12.038 10.369 -4.799 1.00 34.75 ? 73 ASN D OD1 1 ATOM 5510 N ND2 . ASN D 2 73 ? -12.619 11.897 -3.258 1.00 29.25 ? 73 ASN D ND2 1 ATOM 5511 N N . SER D 2 74 ? -16.292 12.378 -7.078 1.00 42.15 ? 74 SER D N 1 ATOM 5512 C CA . SER D 2 74 ? -17.658 12.407 -7.600 1.00 43.13 ? 74 SER D CA 1 ATOM 5513 C C . SER D 2 74 ? -17.705 12.092 -9.089 1.00 39.77 ? 74 SER D C 1 ATOM 5514 O O . SER D 2 74 ? -18.639 11.443 -9.557 1.00 41.75 ? 74 SER D O 1 ATOM 5515 C CB . SER D 2 74 ? -18.330 13.757 -7.321 1.00 43.97 ? 74 SER D CB 1 ATOM 5516 O OG . SER D 2 74 ? -17.606 14.829 -7.903 1.00 48.27 ? 74 SER D OG 1 ATOM 5517 N N . LYS D 2 75 ? -16.701 12.553 -9.831 1.00 38.36 ? 75 LYS D N 1 ATOM 5518 C CA . LYS D 2 75 ? -16.634 12.277 -11.267 1.00 37.52 ? 75 LYS D CA 1 ATOM 5519 C C . LYS D 2 75 ? -15.900 10.968 -11.591 1.00 33.74 ? 75 LYS D C 1 ATOM 5520 O O . LYS D 2 75 ? -15.778 10.608 -12.760 1.00 33.91 ? 75 LYS D O 1 ATOM 5521 C CB . LYS D 2 75 ? -16.003 13.455 -12.024 1.00 34.46 ? 75 LYS D CB 1 ATOM 5522 C CG . LYS D 2 75 ? -16.833 14.743 -11.985 1.00 37.49 ? 75 LYS D CG 1 ATOM 5523 C CD . LYS D 2 75 ? -16.236 15.852 -12.846 1.00 48.91 ? 75 LYS D CD 1 ATOM 5524 C CE . LYS D 2 75 ? -14.787 16.151 -12.457 1.00 52.41 ? 75 LYS D CE 1 ATOM 5525 N NZ . LYS D 2 75 ? -14.217 17.414 -13.039 1.00 53.68 ? 75 LYS D NZ 1 ATOM 5526 N N . SER D 2 76 ? -15.431 10.262 -10.557 1.00 30.13 ? 76 SER D N 1 ATOM 5527 C CA . SER D 2 76 ? -14.624 9.051 -10.731 1.00 32.67 ? 76 SER D CA 1 ATOM 5528 C C . SER D 2 76 ? -13.477 9.244 -11.712 1.00 32.67 ? 76 SER D C 1 ATOM 5529 O O . SER D 2 76 ? -13.183 8.352 -12.504 1.00 28.10 ? 76 SER D O 1 ATOM 5530 C CB . SER D 2 76 ? -15.480 7.874 -11.195 1.00 32.42 ? 76 SER D CB 1 ATOM 5531 O OG . SER D 2 76 ? -16.339 7.444 -10.161 1.00 38.08 ? 76 SER D OG 1 ATOM 5532 N N . GLN D 2 77 ? -12.841 10.409 -11.660 1.00 26.75 ? 77 GLN D N 1 ATOM 5533 C CA . GLN D 2 77 ? -11.742 10.711 -12.564 1.00 32.01 ? 77 GLN D CA 1 ATOM 5534 C C . GLN D 2 77 ? -10.419 10.911 -11.837 1.00 30.76 ? 77 GLN D C 1 ATOM 5535 O O . GLN D 2 77 ? -10.358 11.530 -10.778 1.00 28.33 ? 77 GLN D O 1 ATOM 5536 C CB . GLN D 2 77 ? -12.074 11.938 -13.415 1.00 35.13 ? 77 GLN D CB 1 ATOM 5537 C CG . GLN D 2 77 ? -13.236 11.689 -14.342 1.00 39.38 ? 77 GLN D CG 1 ATOM 5538 C CD . GLN D 2 77 ? -13.585 12.879 -15.210 1.00 40.98 ? 77 GLN D CD 1 ATOM 5539 O OE1 . GLN D 2 77 ? -13.590 14.023 -14.752 1.00 40.60 ? 77 GLN D OE1 1 ATOM 5540 N NE2 . GLN D 2 77 ? -13.887 12.609 -16.479 1.00 35.96 ? 77 GLN D NE2 1 ATOM 5541 N N . VAL D 2 78 ? -9.359 10.370 -12.419 1.00 31.10 ? 78 VAL D N 1 ATOM 5542 C CA . VAL D 2 78 ? -8.012 10.588 -11.911 1.00 26.20 ? 78 VAL D CA 1 ATOM 5543 C C . VAL D 2 78 ? -7.230 11.353 -12.970 1.00 28.60 ? 78 VAL D C 1 ATOM 5544 O O . VAL D 2 78 ? -7.327 11.037 -14.158 1.00 33.57 ? 78 VAL D O 1 ATOM 5545 C CB . VAL D 2 78 ? -7.319 9.250 -11.598 1.00 24.23 ? 78 VAL D CB 1 ATOM 5546 C CG1 . VAL D 2 78 ? -5.864 9.470 -11.248 1.00 19.83 ? 78 VAL D CG1 1 ATOM 5547 C CG2 . VAL D 2 78 ? -8.063 8.515 -10.471 1.00 20.61 ? 78 VAL D CG2 1 ATOM 5548 N N . PHE D 2 79 ? -6.473 12.362 -12.544 1.00 28.04 ? 79 PHE D N 1 ATOM 5549 C CA . PHE D 2 79 ? -5.749 13.239 -13.472 1.00 30.53 ? 79 PHE D CA 1 ATOM 5550 C C . PHE D 2 79 ? -4.227 13.113 -13.360 1.00 32.82 ? 79 PHE D C 1 ATOM 5551 O O . PHE D 2 79 ? -3.631 13.421 -12.327 1.00 35.59 ? 79 PHE D O 1 ATOM 5552 C CB . PHE D 2 79 ? -6.163 14.697 -13.252 1.00 27.42 ? 79 PHE D CB 1 ATOM 5553 C CG . PHE D 2 79 ? -7.646 14.899 -13.203 1.00 30.19 ? 79 PHE D CG 1 ATOM 5554 C CD1 . PHE D 2 79 ? -8.419 14.758 -14.352 1.00 33.47 ? 79 PHE D CD1 1 ATOM 5555 C CD2 . PHE D 2 79 ? -8.276 15.213 -12.011 1.00 28.61 ? 79 PHE D CD2 1 ATOM 5556 C CE1 . PHE D 2 79 ? -9.793 14.939 -14.310 1.00 33.38 ? 79 PHE D CE1 1 ATOM 5557 C CE2 . PHE D 2 79 ? -9.652 15.394 -11.962 1.00 32.08 ? 79 PHE D CE2 1 ATOM 5558 C CZ . PHE D 2 79 ? -10.411 15.259 -13.114 1.00 29.90 ? 79 PHE D CZ 1 ATOM 5559 N N . PHE D 2 80 ? -3.606 12.665 -14.442 1.00 31.82 ? 80 PHE D N 1 ATOM 5560 C CA . PHE D 2 80 ? -2.164 12.497 -14.483 1.00 33.65 ? 80 PHE D CA 1 ATOM 5561 C C . PHE D 2 80 ? -1.551 13.654 -15.255 1.00 35.58 ? 80 PHE D C 1 ATOM 5562 O O . PHE D 2 80 ? -2.051 14.042 -16.309 1.00 37.96 ? 80 PHE D O 1 ATOM 5563 C CB . PHE D 2 80 ? -1.839 11.165 -15.152 1.00 33.76 ? 80 PHE D CB 1 ATOM 5564 C CG . PHE D 2 80 ? -0.379 10.934 -15.398 1.00 30.38 ? 80 PHE D CG 1 ATOM 5565 C CD1 . PHE D 2 80 ? 0.231 11.405 -16.553 1.00 30.27 ? 80 PHE D CD1 1 ATOM 5566 C CD2 . PHE D 2 80 ? 0.376 10.209 -14.498 1.00 27.51 ? 80 PHE D CD2 1 ATOM 5567 C CE1 . PHE D 2 80 ? 1.577 11.175 -16.790 1.00 28.31 ? 80 PHE D CE1 1 ATOM 5568 C CE2 . PHE D 2 80 ? 1.717 9.969 -14.734 1.00 27.26 ? 80 PHE D CE2 1 ATOM 5569 C CZ . PHE D 2 80 ? 2.318 10.452 -15.882 1.00 24.42 ? 80 PHE D CZ 1 ATOM 5570 N N . LYS D 2 81 ? -0.464 14.206 -14.734 1.00 36.18 ? 81 LYS D N 1 ATOM 5571 C CA . LYS D 2 81 ? 0.202 15.315 -15.406 1.00 36.23 ? 81 LYS D CA 1 ATOM 5572 C C . LYS D 2 81 ? 1.704 15.264 -15.163 1.00 37.47 ? 81 LYS D C 1 ATOM 5573 O O . LYS D 2 81 ? 2.156 15.149 -14.020 1.00 37.14 ? 81 LYS D O 1 ATOM 5574 C CB . LYS D 2 81 ? -0.379 16.647 -14.939 1.00 31.62 ? 81 LYS D CB 1 ATOM 5575 C CG . LYS D 2 81 ? 0.036 17.835 -15.766 1.00 33.78 ? 81 LYS D CG 1 ATOM 5576 C CD . LYS D 2 81 ? -0.939 18.981 -15.557 1.00 35.44 ? 81 LYS D CD 1 ATOM 5577 C CE . LYS D 2 81 ? -0.594 20.184 -16.416 1.00 43.33 ? 81 LYS D CE 1 ATOM 5578 N NZ . LYS D 2 81 ? 0.534 20.976 -15.849 1.00 49.25 ? 81 LYS D NZ 1 ATOM 5579 N N A MET D 2 82 ? 2.485 15.315 -16.244 0.40 35.08 ? 82 MET D N 1 ATOM 5580 N N B MET D 2 82 ? 2.483 15.317 -16.245 0.60 34.98 ? 82 MET D N 1 ATOM 5581 C CA A MET D 2 82 ? 3.940 15.255 -16.152 0.40 34.51 ? 82 MET D CA 1 ATOM 5582 C CA B MET D 2 82 ? 3.939 15.251 -16.164 0.60 34.51 ? 82 MET D CA 1 ATOM 5583 C C A MET D 2 82 ? 4.552 16.366 -16.995 0.40 34.87 ? 82 MET D C 1 ATOM 5584 C C B MET D 2 82 ? 4.551 16.368 -16.999 0.60 34.84 ? 82 MET D C 1 ATOM 5585 O O A MET D 2 82 ? 4.112 16.608 -18.121 0.40 37.02 ? 82 MET D O 1 ATOM 5586 O O B MET D 2 82 ? 4.110 16.618 -18.122 0.60 37.41 ? 82 MET D O 1 ATOM 5587 C CB A MET D 2 82 ? 4.467 13.889 -16.596 0.40 33.42 ? 82 MET D CB 1 ATOM 5588 C CB B MET D 2 82 ? 4.456 13.896 -16.634 0.60 33.14 ? 82 MET D CB 1 ATOM 5589 C CG A MET D 2 82 ? 5.958 13.701 -16.393 0.40 36.07 ? 82 MET D CG 1 ATOM 5590 C CG B MET D 2 82 ? 5.915 13.647 -16.326 0.60 35.86 ? 82 MET D CG 1 ATOM 5591 S SD A MET D 2 82 ? 6.500 12.032 -16.809 0.40 37.48 ? 82 MET D SD 1 ATOM 5592 S SD B MET D 2 82 ? 6.415 11.979 -16.792 0.60 37.68 ? 82 MET D SD 1 ATOM 5593 C CE A MET D 2 82 ? 5.836 11.107 -15.428 0.40 37.60 ? 82 MET D CE 1 ATOM 5594 C CE B MET D 2 82 ? 6.366 12.104 -18.576 0.60 36.90 ? 82 MET D CE 1 ATOM 5595 N N . ASN D 2 83 ? 5.571 17.033 -16.452 1.00 31.52 ? 83 ASN D N 1 ATOM 5596 C CA . ASN D 2 83 ? 6.117 18.260 -17.036 1.00 32.53 ? 83 ASN D CA 1 ATOM 5597 C C . ASN D 2 83 ? 7.380 18.071 -17.858 1.00 34.78 ? 83 ASN D C 1 ATOM 5598 O O . ASN D 2 83 ? 8.143 17.130 -17.629 1.00 33.61 ? 83 ASN D O 1 ATOM 5599 C CB . ASN D 2 83 ? 6.419 19.277 -15.933 1.00 40.88 ? 83 ASN D CB 1 ATOM 5600 C CG . ASN D 2 83 ? 5.172 19.769 -15.238 1.00 57.74 ? 83 ASN D CG 1 ATOM 5601 O OD1 . ASN D 2 83 ? 4.092 19.810 -15.830 1.00 59.69 ? 83 ASN D OD1 1 ATOM 5602 N ND2 . ASN D 2 83 ? 5.311 20.148 -13.971 1.00 67.25 ? 83 ASN D ND2 1 ATOM 5603 N N . SER D 2 84 ? 7.596 19.006 -18.785 1.00 37.62 ? 84 SER D N 1 ATOM 5604 C CA . SER D 2 84 ? 8.772 19.045 -19.658 1.00 40.50 ? 84 SER D CA 1 ATOM 5605 C C . SER D 2 84 ? 9.229 17.671 -20.131 1.00 42.64 ? 84 SER D C 1 ATOM 5606 O O . SER D 2 84 ? 10.234 17.141 -19.651 1.00 43.66 ? 84 SER D O 1 ATOM 5607 C CB . SER D 2 84 ? 9.929 19.770 -18.972 1.00 46.17 ? 84 SER D CB 1 ATOM 5608 O OG . SER D 2 84 ? 10.200 19.176 -17.720 1.00 51.38 ? 84 SER D OG 1 ATOM 5609 N N . LEU D 2 85 ? 8.477 17.097 -21.062 1.00 38.49 ? 85 LEU D N 1 ATOM 5610 C CA . LEU D 2 85 ? 8.793 15.782 -21.591 1.00 39.69 ? 85 LEU D CA 1 ATOM 5611 C C . LEU D 2 85 ? 9.921 15.877 -22.594 1.00 39.94 ? 85 LEU D C 1 ATOM 5612 O O . LEU D 2 85 ? 10.087 16.900 -23.257 1.00 38.69 ? 85 LEU D O 1 ATOM 5613 C CB . LEU D 2 85 ? 7.571 15.152 -22.263 1.00 43.11 ? 85 LEU D CB 1 ATOM 5614 C CG . LEU D 2 85 ? 6.655 14.352 -21.347 1.00 43.69 ? 85 LEU D CG 1 ATOM 5615 C CD1 . LEU D 2 85 ? 5.785 15.282 -20.537 1.00 40.73 ? 85 LEU D CD1 1 ATOM 5616 C CD2 . LEU D 2 85 ? 5.825 13.370 -22.154 1.00 45.45 ? 85 LEU D CD2 1 ATOM 5617 N N . GLN D 2 86 ? 10.691 14.803 -22.704 1.00 26.17 ? 86 GLN D N 1 ATOM 5618 C CA . GLN D 2 86 ? 11.691 14.707 -23.749 1.00 35.29 ? 86 GLN D CA 1 ATOM 5619 C C . GLN D 2 86 ? 11.416 13.474 -24.612 1.00 34.38 ? 86 GLN D C 1 ATOM 5620 O O . GLN D 2 86 ? 10.470 12.720 -24.347 1.00 32.49 ? 86 GLN D O 1 ATOM 5621 C CB . GLN D 2 86 ? 13.089 14.684 -23.135 1.00 40.88 ? 86 GLN D CB 1 ATOM 5622 C CG . GLN D 2 86 ? 13.383 15.910 -22.249 1.00 48.66 ? 86 GLN D CG 1 ATOM 5623 C CD . GLN D 2 86 ? 13.386 17.220 -23.038 1.00 57.82 ? 86 GLN D CD 1 ATOM 5624 O OE1 . GLN D 2 86 ? 13.460 17.217 -24.270 1.00 58.44 ? 86 GLN D OE1 1 ATOM 5625 N NE2 . GLN D 2 86 ? 13.305 18.343 -22.328 1.00 57.29 ? 86 GLN D NE2 1 ATOM 5626 N N . SER D 2 87 ? 12.224 13.292 -25.652 1.00 26.59 ? 87 SER D N 1 ATOM 5627 C CA . SER D 2 87 ? 12.083 12.160 -26.556 1.00 25.88 ? 87 SER D CA 1 ATOM 5628 C C . SER D 2 87 ? 11.844 10.873 -25.803 1.00 26.13 ? 87 SER D C 1 ATOM 5629 O O . SER D 2 87 ? 10.867 10.166 -26.060 1.00 31.33 ? 87 SER D O 1 ATOM 5630 C CB . SER D 2 87 ? 13.330 11.996 -27.410 1.00 30.07 ? 87 SER D CB 1 ATOM 5631 O OG . SER D 2 87 ? 13.507 13.119 -28.247 1.00 50.77 ? 87 SER D OG 1 ATOM 5632 N N . ASN D 2 88 ? 12.686 10.600 -24.842 1.00 24.69 ? 88 ASN D N 1 ATOM 5633 C CA . ASN D 2 88 ? 12.595 9.294 -24.244 1.00 31.48 ? 88 ASN D CA 1 ATOM 5634 C C . ASN D 2 88 ? 11.460 9.190 -23.208 1.00 29.09 ? 88 ASN D C 1 ATOM 5635 O O . ASN D 2 88 ? 11.431 8.230 -22.445 1.00 39.73 ? 88 ASN D O 1 ATOM 5636 C CB . ASN D 2 88 ? 13.973 8.930 -23.689 1.00 28.70 ? 88 ASN D CB 1 ATOM 5637 C CG . ASN D 2 88 ? 14.281 9.611 -22.412 1.00 42.27 ? 88 ASN D CG 1 ATOM 5638 O OD1 . ASN D 2 88 ? 13.516 10.444 -21.906 1.00 45.81 ? 88 ASN D OD1 1 ATOM 5639 N ND2 . ASN D 2 88 ? 15.420 9.251 -21.855 1.00 52.72 ? 88 ASN D ND2 1 ATOM 5640 N N . ASP D 2 89 ? 10.546 10.151 -23.153 1.00 23.27 ? 89 ASP D N 1 ATOM 5641 C CA . ASP D 2 89 ? 9.310 10.007 -22.381 1.00 23.64 ? 89 ASP D CA 1 ATOM 5642 C C . ASP D 2 89 ? 8.212 9.475 -23.293 1.00 30.24 ? 89 ASP D C 1 ATOM 5643 O O . ASP D 2 89 ? 7.081 9.206 -22.854 1.00 27.30 ? 89 ASP D O 1 ATOM 5644 C CB . ASP D 2 89 ? 8.876 11.327 -21.728 1.00 26.79 ? 89 ASP D CB 1 ATOM 5645 C CG . ASP D 2 89 ? 9.750 11.712 -20.546 1.00 34.74 ? 89 ASP D CG 1 ATOM 5646 O OD1 . ASP D 2 89 ? 9.989 10.858 -19.670 1.00 30.97 ? 89 ASP D OD1 1 ATOM 5647 O OD2 . ASP D 2 89 ? 10.206 12.873 -20.494 1.00 44.58 ? 89 ASP D OD2 1 ATOM 5648 N N . THR D 2 90 ? 8.552 9.331 -24.568 1.00 21.08 ? 90 THR D N 1 ATOM 5649 C CA . THR D 2 90 ? 7.672 8.658 -25.503 1.00 20.78 ? 90 THR D CA 1 ATOM 5650 C C . THR D 2 90 ? 7.396 7.241 -24.987 1.00 22.42 ? 90 THR D C 1 ATOM 5651 O O . THR D 2 90 ? 8.322 6.434 -24.837 1.00 19.95 ? 90 THR D O 1 ATOM 5652 C CB . THR D 2 90 ? 8.300 8.610 -26.919 1.00 25.27 ? 90 THR D CB 1 ATOM 5653 O OG1 . THR D 2 90 ? 8.148 9.888 -27.557 1.00 26.82 ? 90 THR D OG1 1 ATOM 5654 C CG2 . THR D 2 90 ? 7.636 7.554 -27.768 1.00 21.45 ? 90 THR D CG2 1 ATOM 5655 N N . ALA D 2 91 ? 6.129 6.944 -24.708 1.00 20.55 ? 91 ALA D N 1 ATOM 5656 C CA . ALA D 2 91 ? 5.770 5.657 -24.116 1.00 24.04 ? 91 ALA D CA 1 ATOM 5657 C C . ALA D 2 91 ? 4.268 5.397 -24.102 1.00 21.96 ? 91 ALA D C 1 ATOM 5658 O O . ALA D 2 91 ? 3.474 6.232 -24.538 1.00 22.41 ? 91 ALA D O 1 ATOM 5659 C CB . ALA D 2 91 ? 6.312 5.567 -22.678 1.00 24.20 ? 91 ALA D CB 1 ATOM 5660 N N . ILE D 2 92 ? 3.898 4.227 -23.589 1.00 17.59 ? 92 ILE D N 1 ATOM 5661 C CA . ILE D 2 92 ? 2.513 3.923 -23.280 1.00 23.31 ? 92 ILE D CA 1 ATOM 5662 C C . ILE D 2 92 ? 2.264 4.129 -21.783 1.00 23.84 ? 92 ILE D C 1 ATOM 5663 O O . ILE D 2 92 ? 2.940 3.530 -20.956 1.00 24.15 ? 92 ILE D O 1 ATOM 5664 C CB . ILE D 2 92 ? 2.136 2.487 -23.697 1.00 22.22 ? 92 ILE D CB 1 ATOM 5665 C CG1 . ILE D 2 92 ? 2.238 2.362 -25.218 1.00 29.36 ? 92 ILE D CG1 1 ATOM 5666 C CG2 . ILE D 2 92 ? 0.724 2.169 -23.252 1.00 17.37 ? 92 ILE D CG2 1 ATOM 5667 C CD1 . ILE D 2 92 ? 1.870 1.021 -25.753 1.00 35.20 ? 92 ILE D CD1 1 ATOM 5668 N N . TYR D 2 93 ? 1.305 4.991 -21.448 1.00 18.13 ? 93 TYR D N 1 ATOM 5669 C CA . TYR D 2 93 ? 1.018 5.321 -20.058 1.00 18.78 ? 93 TYR D CA 1 ATOM 5670 C C . TYR D 2 93 ? -0.266 4.647 -19.640 1.00 24.08 ? 93 TYR D C 1 ATOM 5671 O O . TYR D 2 93 ? -1.289 4.799 -20.317 1.00 22.79 ? 93 TYR D O 1 ATOM 5672 C CB . TYR D 2 93 ? 0.914 6.841 -19.869 1.00 16.95 ? 93 TYR D CB 1 ATOM 5673 C CG . TYR D 2 93 ? 2.240 7.552 -20.010 1.00 17.23 ? 93 TYR D CG 1 ATOM 5674 C CD1 . TYR D 2 93 ? 2.811 7.746 -21.257 1.00 19.81 ? 93 TYR D CD1 1 ATOM 5675 C CD2 . TYR D 2 93 ? 2.936 8.009 -18.890 1.00 20.04 ? 93 TYR D CD2 1 ATOM 5676 C CE1 . TYR D 2 93 ? 4.028 8.382 -21.391 1.00 25.30 ? 93 TYR D CE1 1 ATOM 5677 C CE2 . TYR D 2 93 ? 4.155 8.647 -19.013 1.00 17.73 ? 93 TYR D CE2 1 ATOM 5678 C CZ . TYR D 2 93 ? 4.694 8.828 -20.270 1.00 27.29 ? 93 TYR D CZ 1 ATOM 5679 O OH . TYR D 2 93 ? 5.904 9.455 -20.420 1.00 28.99 ? 93 TYR D OH 1 ATOM 5680 N N . TYR D 2 94 ? -0.213 3.886 -18.547 1.00 15.92 ? 94 TYR D N 1 ATOM 5681 C CA . TYR D 2 94 ? -1.373 3.184 -18.009 1.00 21.27 ? 94 TYR D CA 1 ATOM 5682 C C . TYR D 2 94 ? -1.766 3.745 -16.647 1.00 26.38 ? 94 TYR D C 1 ATOM 5683 O O . TYR D 2 94 ? -0.902 4.094 -15.833 1.00 23.37 ? 94 TYR D O 1 ATOM 5684 C CB . TYR D 2 94 ? -1.111 1.684 -17.818 1.00 15.84 ? 94 TYR D CB 1 ATOM 5685 C CG . TYR D 2 94 ? -0.533 0.938 -18.987 1.00 20.10 ? 94 TYR D CG 1 ATOM 5686 C CD1 . TYR D 2 94 ? 0.834 0.924 -19.217 1.00 20.39 ? 94 TYR D CD1 1 ATOM 5687 C CD2 . TYR D 2 94 ? -1.350 0.197 -19.835 1.00 23.08 ? 94 TYR D CD2 1 ATOM 5688 C CE1 . TYR D 2 94 ? 1.371 0.210 -20.271 1.00 22.48 ? 94 TYR D CE1 1 ATOM 5689 C CE2 . TYR D 2 94 ? -0.822 -0.511 -20.899 1.00 17.09 ? 94 TYR D CE2 1 ATOM 5690 C CZ . TYR D 2 94 ? 0.541 -0.505 -21.109 1.00 17.93 ? 94 TYR D CZ 1 ATOM 5691 O OH . TYR D 2 94 ? 1.083 -1.196 -22.171 1.00 18.11 ? 94 TYR D OH 1 ATOM 5692 N N . CYS D 2 95 ? -3.071 3.798 -16.387 1.00 24.10 ? 95 CYS D N 1 ATOM 5693 C CA . CYS D 2 95 ? -3.562 3.813 -15.018 1.00 25.58 ? 95 CYS D CA 1 ATOM 5694 C C . CYS D 2 95 ? -3.925 2.386 -14.639 1.00 23.82 ? 95 CYS D C 1 ATOM 5695 O O . CYS D 2 95 ? -4.205 1.556 -15.506 1.00 25.30 ? 95 CYS D O 1 ATOM 5696 C CB . CYS D 2 95 ? -4.769 4.741 -14.831 1.00 24.14 ? 95 CYS D CB 1 ATOM 5697 S SG . CYS D 2 95 ? -6.261 4.365 -15.794 1.00 28.51 ? 95 CYS D SG 1 ATOM 5698 N N . ALA D 2 96 ? -3.898 2.096 -13.340 1.00 16.56 ? 96 ALA D N 1 ATOM 5699 C CA . ALA D 2 96 ? -4.101 0.729 -12.895 1.00 21.81 ? 96 ALA D CA 1 ATOM 5700 C C . ALA D 2 96 ? -4.635 0.719 -11.471 1.00 21.71 ? 96 ALA D C 1 ATOM 5701 O O . ALA D 2 96 ? -4.394 1.646 -10.692 1.00 18.89 ? 96 ALA D O 1 ATOM 5702 C CB . ALA D 2 96 ? -2.802 -0.084 -12.985 1.00 16.02 ? 96 ALA D CB 1 ATOM 5703 N N . ARG D 2 97 ? -5.363 -0.348 -11.138 1.00 24.17 ? 97 ARG D N 1 ATOM 5704 C CA . ARG D 2 97 ? -5.881 -0.542 -9.786 1.00 24.77 ? 97 ARG D CA 1 ATOM 5705 C C . ARG D 2 97 ? -5.472 -1.885 -9.205 1.00 25.44 ? 97 ARG D C 1 ATOM 5706 O O . ARG D 2 97 ? -5.470 -2.899 -9.906 1.00 27.31 ? 97 ARG D O 1 ATOM 5707 C CB . ARG D 2 97 ? -7.404 -0.448 -9.769 1.00 27.78 ? 97 ARG D CB 1 ATOM 5708 C CG . ARG D 2 97 ? -7.971 -0.023 -8.426 1.00 21.68 ? 97 ARG D CG 1 ATOM 5709 C CD . ARG D 2 97 ? -9.331 -0.639 -8.211 1.00 22.98 ? 97 ARG D CD 1 ATOM 5710 N NE . ARG D 2 97 ? -9.190 -1.937 -7.577 1.00 28.71 ? 97 ARG D NE 1 ATOM 5711 C CZ . ARG D 2 97 ? -10.209 -2.704 -7.226 1.00 28.00 ? 97 ARG D CZ 1 ATOM 5712 N NH1 . ARG D 2 97 ? -11.446 -2.297 -7.473 1.00 26.63 ? 97 ARG D NH1 1 ATOM 5713 N NH2 . ARG D 2 97 ? -9.985 -3.872 -6.633 1.00 21.55 ? 97 ARG D NH2 1 ATOM 5714 N N . ALA D 2 98 ? -5.151 -1.886 -7.916 1.00 22.82 ? 98 ALA D N 1 ATOM 5715 C CA . ALA D 2 98 ? -4.774 -3.102 -7.207 1.00 20.53 ? 98 ALA D CA 1 ATOM 5716 C C . ALA D 2 98 ? -5.993 -3.896 -6.738 1.00 27.27 ? 98 ALA D C 1 ATOM 5717 O O . ALA D 2 98 ? -7.123 -3.395 -6.744 1.00 27.51 ? 98 ALA D O 1 ATOM 5718 C CB . ALA D 2 98 ? -3.868 -2.756 -6.022 1.00 18.64 ? 98 ALA D CB 1 ATOM 5719 N N . LEU D 2 99 ? -5.755 -5.143 -6.336 1.00 28.19 ? 99 LEU D N 1 ATOM 5720 C CA . LEU D 2 99 ? -6.799 -5.994 -5.774 1.00 27.21 ? 99 LEU D CA 1 ATOM 5721 C C . LEU D 2 99 ? -7.287 -5.451 -4.430 1.00 35.82 ? 99 LEU D C 1 ATOM 5722 O O . LEU D 2 99 ? -8.489 -5.385 -4.166 1.00 37.78 ? 99 LEU D O 1 ATOM 5723 C CB . LEU D 2 99 ? -6.253 -7.399 -5.559 1.00 29.66 ? 99 LEU D CB 1 ATOM 5724 C CG . LEU D 2 99 ? -6.794 -8.571 -6.369 1.00 37.29 ? 99 LEU D CG 1 ATOM 5725 C CD1 . LEU D 2 99 ? -6.336 -9.882 -5.718 1.00 25.29 ? 99 LEU D CD1 1 ATOM 5726 C CD2 . LEU D 2 99 ? -8.312 -8.519 -6.489 1.00 40.00 ? 99 LEU D CD2 1 ATOM 5727 N N . THR D 2 100 ? -6.346 -5.086 -3.564 1.00 41.04 ? 100 THR D N 1 ATOM 5728 C CA . THR D 2 100 ? -6.697 -4.540 -2.254 1.00 42.31 ? 100 THR D CA 1 ATOM 5729 C C . THR D 2 100 ? -6.343 -3.061 -2.224 1.00 33.05 ? 100 THR D C 1 ATOM 5730 O O . THR D 2 100 ? -5.451 -2.625 -2.962 1.00 32.73 ? 100 THR D O 1 ATOM 5731 C CB . THR D 2 100 ? -5.956 -5.253 -1.121 1.00 44.28 ? 100 THR D CB 1 ATOM 5732 O OG1 . THR D 2 100 ? -4.713 -4.584 -0.888 1.00 55.20 ? 100 THR D OG1 1 ATOM 5733 C CG2 . THR D 2 100 ? -5.702 -6.723 -1.473 1.00 35.62 ? 100 THR D CG2 1 ATOM 5734 N N . TYR D 2 101 ? -7.035 -2.297 -1.378 1.00 25.88 ? 101 TYR D N 1 ATOM 5735 C CA . TYR D 2 101 ? -6.927 -0.832 -1.387 1.00 26.48 ? 101 TYR D CA 1 ATOM 5736 C C . TYR D 2 101 ? -5.513 -0.294 -1.162 1.00 30.34 ? 101 TYR D C 1 ATOM 5737 O O . TYR D 2 101 ? -5.162 0.789 -1.648 1.00 30.71 ? 101 TYR D O 1 ATOM 5738 C CB . TYR D 2 101 ? -7.898 -0.192 -0.386 1.00 25.68 ? 101 TYR D CB 1 ATOM 5739 C CG . TYR D 2 101 ? -7.527 -0.326 1.076 1.00 30.83 ? 101 TYR D CG 1 ATOM 5740 C CD1 . TYR D 2 101 ? -6.675 0.593 1.694 1.00 22.62 ? 101 TYR D CD1 1 ATOM 5741 C CD2 . TYR D 2 101 ? -8.048 -1.365 1.851 1.00 29.25 ? 101 TYR D CD2 1 ATOM 5742 C CE1 . TYR D 2 101 ? -6.344 0.472 3.042 1.00 23.62 ? 101 TYR D CE1 1 ATOM 5743 C CE2 . TYR D 2 101 ? -7.723 -1.493 3.192 1.00 26.85 ? 101 TYR D CE2 1 ATOM 5744 C CZ . TYR D 2 101 ? -6.874 -0.571 3.782 1.00 28.94 ? 101 TYR D CZ 1 ATOM 5745 O OH . TYR D 2 101 ? -6.552 -0.705 5.114 1.00 27.43 ? 101 TYR D OH 1 ATOM 5746 N N . TYR D 2 102 ? -4.707 -1.062 -0.436 1.00 26.00 ? 102 TYR D N 1 ATOM 5747 C CA . TYR D 2 102 ? -3.380 -0.621 -0.031 1.00 26.36 ? 102 TYR D CA 1 ATOM 5748 C C . TYR D 2 102 ? -2.234 -1.260 -0.825 1.00 27.42 ? 102 TYR D C 1 ATOM 5749 O O . TYR D 2 102 ? -1.075 -0.895 -0.626 1.00 31.89 ? 102 TYR D O 1 ATOM 5750 C CB . TYR D 2 102 ? -3.178 -0.940 1.453 1.00 27.52 ? 102 TYR D CB 1 ATOM 5751 C CG . TYR D 2 102 ? -3.380 -2.401 1.764 1.00 23.12 ? 102 TYR D CG 1 ATOM 5752 C CD1 . TYR D 2 102 ? -2.364 -3.319 1.563 1.00 23.51 ? 102 TYR D CD1 1 ATOM 5753 C CD2 . TYR D 2 102 ? -4.598 -2.865 2.237 1.00 30.17 ? 102 TYR D CD2 1 ATOM 5754 C CE1 . TYR D 2 102 ? -2.546 -4.651 1.831 1.00 24.57 ? 102 TYR D CE1 1 ATOM 5755 C CE2 . TYR D 2 102 ? -4.793 -4.207 2.516 1.00 34.03 ? 102 TYR D CE2 1 ATOM 5756 C CZ . TYR D 2 102 ? -3.761 -5.094 2.312 1.00 34.11 ? 102 TYR D CZ 1 ATOM 5757 O OH . TYR D 2 102 ? -3.942 -6.425 2.589 1.00 26.50 ? 102 TYR D OH 1 ATOM 5758 N N . ASP D 2 103 ? -2.541 -2.229 -1.684 1.00 20.54 ? 103 ASP D N 1 ATOM 5759 C CA . ASP D 2 103 ? -1.490 -3.081 -2.256 1.00 27.53 ? 103 ASP D CA 1 ATOM 5760 C C . ASP D 2 103 ? -1.033 -2.620 -3.639 1.00 24.50 ? 103 ASP D C 1 ATOM 5761 O O . ASP D 2 103 ? -1.452 -1.570 -4.131 1.00 26.98 ? 103 ASP D O 1 ATOM 5762 C CB . ASP D 2 103 ? -1.936 -4.552 -2.289 1.00 29.48 ? 103 ASP D CB 1 ATOM 5763 C CG . ASP D 2 103 ? -0.771 -5.548 -2.091 1.00 32.60 ? 103 ASP D CG 1 ATOM 5764 O OD1 . ASP D 2 103 ? 0.397 -5.204 -2.372 1.00 34.03 ? 103 ASP D OD1 1 ATOM 5765 O OD2 . ASP D 2 103 ? -1.038 -6.696 -1.658 1.00 29.08 ? 103 ASP D OD2 1 ATOM 5766 N N . TYR D 2 104 ? -0.164 -3.401 -4.265 1.00 25.66 ? 104 TYR D N 1 ATOM 5767 C CA . TYR D 2 104 ? 0.408 -3.000 -5.542 1.00 25.97 ? 104 TYR D CA 1 ATOM 5768 C C . TYR D 2 104 ? 0.325 -4.117 -6.564 1.00 28.14 ? 104 TYR D C 1 ATOM 5769 O O . TYR D 2 104 ? 1.133 -4.179 -7.486 1.00 32.05 ? 104 TYR D O 1 ATOM 5770 C CB . TYR D 2 104 ? 1.871 -2.617 -5.370 1.00 20.57 ? 104 TYR D CB 1 ATOM 5771 C CG . TYR D 2 104 ? 2.131 -1.372 -4.566 1.00 25.67 ? 104 TYR D CG 1 ATOM 5772 C CD1 . TYR D 2 104 ? 1.913 -1.340 -3.195 1.00 26.06 ? 104 TYR D CD1 1 ATOM 5773 C CD2 . TYR D 2 104 ? 2.653 -0.237 -5.173 1.00 25.23 ? 104 TYR D CD2 1 ATOM 5774 C CE1 . TYR D 2 104 ? 2.183 -0.204 -2.461 1.00 27.09 ? 104 TYR D CE1 1 ATOM 5775 C CE2 . TYR D 2 104 ? 2.926 0.899 -4.445 1.00 27.29 ? 104 TYR D CE2 1 ATOM 5776 C CZ . TYR D 2 104 ? 2.691 0.914 -3.090 1.00 28.50 ? 104 TYR D CZ 1 ATOM 5777 O OH . TYR D 2 104 ? 2.962 2.056 -2.368 1.00 30.10 ? 104 TYR D OH 1 ATOM 5778 N N . GLU D 2 105 ? -0.633 -5.014 -6.395 1.00 29.37 ? 105 GLU D N 1 ATOM 5779 C CA . GLU D 2 105 ? -0.794 -6.095 -7.357 1.00 27.60 ? 105 GLU D CA 1 ATOM 5780 C C . GLU D 2 105 ? -1.888 -5.705 -8.365 1.00 29.52 ? 105 GLU D C 1 ATOM 5781 O O . GLU D 2 105 ? -3.073 -5.660 -8.051 1.00 25.99 ? 105 GLU D O 1 ATOM 5782 C CB . GLU D 2 105 ? -1.005 -7.454 -6.660 1.00 31.63 ? 105 GLU D CB 1 ATOM 5783 C CG . GLU D 2 105 ? -2.399 -7.764 -6.116 1.00 39.45 ? 105 GLU D CG 1 ATOM 5784 C CD . GLU D 2 105 ? -2.751 -7.028 -4.838 1.00 33.91 ? 105 GLU D CD 1 ATOM 5785 O OE1 . GLU D 2 105 ? -2.877 -5.790 -4.873 1.00 36.45 ? 105 GLU D OE1 1 ATOM 5786 O OE2 . GLU D 2 105 ? -2.940 -7.697 -3.806 1.00 35.23 ? 105 GLU D OE2 1 ATOM 5787 N N . PHE D 2 106 ? -1.453 -5.376 -9.576 1.00 26.58 ? 106 PHE D N 1 ATOM 5788 C CA . PHE D 2 106 ? -2.288 -4.660 -10.518 1.00 20.02 ? 106 PHE D CA 1 ATOM 5789 C C . PHE D 2 106 ? -3.212 -5.557 -11.310 1.00 22.31 ? 106 PHE D C 1 ATOM 5790 O O . PHE D 2 106 ? -2.900 -5.964 -12.424 1.00 25.90 ? 106 PHE D O 1 ATOM 5791 C CB . PHE D 2 106 ? -1.409 -3.825 -11.432 1.00 20.25 ? 106 PHE D CB 1 ATOM 5792 C CG . PHE D 2 106 ? -0.550 -2.849 -10.686 1.00 20.73 ? 106 PHE D CG 1 ATOM 5793 C CD1 . PHE D 2 106 ? -1.104 -2.031 -9.719 1.00 26.67 ? 106 PHE D CD1 1 ATOM 5794 C CD2 . PHE D 2 106 ? 0.810 -2.766 -10.926 1.00 18.28 ? 106 PHE D CD2 1 ATOM 5795 C CE1 . PHE D 2 106 ? -0.319 -1.127 -9.020 1.00 29.14 ? 106 PHE D CE1 1 ATOM 5796 C CE2 . PHE D 2 106 ? 1.595 -1.872 -10.225 1.00 20.23 ? 106 PHE D CE2 1 ATOM 5797 C CZ . PHE D 2 106 ? 1.027 -1.051 -9.275 1.00 24.00 ? 106 PHE D CZ 1 ATOM 5798 N N . ALA D 2 107 ? -4.367 -5.835 -10.713 1.00 20.92 ? 107 ALA D N 1 ATOM 5799 C CA . ALA D 2 107 ? -5.364 -6.712 -11.291 1.00 24.13 ? 107 ALA D CA 1 ATOM 5800 C C . ALA D 2 107 ? -6.143 -6.039 -12.419 1.00 23.71 ? 107 ALA D C 1 ATOM 5801 O O . ALA D 2 107 ? -6.619 -6.712 -13.318 1.00 26.91 ? 107 ALA D O 1 ATOM 5802 C CB . ALA D 2 107 ? -6.317 -7.210 -10.209 1.00 24.47 ? 107 ALA D CB 1 ATOM 5803 N N . TYR D 2 108 ? -6.291 -4.721 -12.374 1.00 28.68 ? 108 TYR D N 1 ATOM 5804 C CA . TYR D 2 108 ? -7.065 -4.027 -13.406 1.00 26.24 ? 108 TYR D CA 1 ATOM 5805 C C . TYR D 2 108 ? -6.246 -2.914 -14.011 1.00 25.99 ? 108 TYR D C 1 ATOM 5806 O O . TYR D 2 108 ? -5.615 -2.141 -13.288 1.00 24.65 ? 108 TYR D O 1 ATOM 5807 C CB . TYR D 2 108 ? -8.370 -3.462 -12.831 1.00 26.83 ? 108 TYR D CB 1 ATOM 5808 C CG . TYR D 2 108 ? -9.146 -4.482 -12.054 1.00 27.49 ? 108 TYR D CG 1 ATOM 5809 C CD1 . TYR D 2 108 ? -8.906 -4.673 -10.692 1.00 25.62 ? 108 TYR D CD1 1 ATOM 5810 C CD2 . TYR D 2 108 ? -10.095 -5.286 -12.679 1.00 23.81 ? 108 TYR D CD2 1 ATOM 5811 C CE1 . TYR D 2 108 ? -9.593 -5.625 -9.971 1.00 25.87 ? 108 TYR D CE1 1 ATOM 5812 C CE2 . TYR D 2 108 ? -10.799 -6.242 -11.962 1.00 25.93 ? 108 TYR D CE2 1 ATOM 5813 C CZ . TYR D 2 108 ? -10.540 -6.408 -10.607 1.00 32.29 ? 108 TYR D CZ 1 ATOM 5814 O OH . TYR D 2 108 ? -11.223 -7.358 -9.875 1.00 39.06 ? 108 TYR D OH 1 ATOM 5815 N N . TRP D 2 109 ? -6.264 -2.831 -15.338 1.00 22.03 ? 109 TRP D N 1 ATOM 5816 C CA . TRP D 2 109 ? -5.493 -1.816 -16.047 1.00 16.90 ? 109 TRP D CA 1 ATOM 5817 C C . TRP D 2 109 ? -6.345 -1.012 -17.017 1.00 25.04 ? 109 TRP D C 1 ATOM 5818 O O . TRP D 2 109 ? -7.318 -1.535 -17.572 1.00 31.82 ? 109 TRP D O 1 ATOM 5819 C CB . TRP D 2 109 ? -4.407 -2.479 -16.865 1.00 14.22 ? 109 TRP D CB 1 ATOM 5820 C CG . TRP D 2 109 ? -3.354 -3.140 -16.093 1.00 15.35 ? 109 TRP D CG 1 ATOM 5821 C CD1 . TRP D 2 109 ? -3.467 -4.282 -15.356 1.00 13.81 ? 109 TRP D CD1 1 ATOM 5822 C CD2 . TRP D 2 109 ? -1.978 -2.750 -16.027 1.00 13.69 ? 109 TRP D CD2 1 ATOM 5823 N NE1 . TRP D 2 109 ? -2.248 -4.617 -14.819 1.00 17.81 ? 109 TRP D NE1 1 ATOM 5824 C CE2 . TRP D 2 109 ? -1.317 -3.692 -15.213 1.00 15.17 ? 109 TRP D CE2 1 ATOM 5825 C CE3 . TRP D 2 109 ? -1.243 -1.685 -16.566 1.00 20.56 ? 109 TRP D CE3 1 ATOM 5826 C CZ2 . TRP D 2 109 ? 0.044 -3.597 -14.913 1.00 20.58 ? 109 TRP D CZ2 1 ATOM 5827 C CZ3 . TRP D 2 109 ? 0.121 -1.596 -16.269 1.00 16.39 ? 109 TRP D CZ3 1 ATOM 5828 C CH2 . TRP D 2 109 ? 0.745 -2.546 -15.454 1.00 19.35 ? 109 TRP D CH2 1 ATOM 5829 N N . GLY D 2 110 ? -5.952 0.243 -17.249 1.00 18.70 ? 110 GLY D N 1 ATOM 5830 C CA . GLY D 2 110 ? -6.511 1.032 -18.335 1.00 16.66 ? 110 GLY D CA 1 ATOM 5831 C C . GLY D 2 110 ? -6.012 0.476 -19.653 1.00 19.25 ? 110 GLY D C 1 ATOM 5832 O O . GLY D 2 110 ? -5.087 -0.349 -19.663 1.00 18.31 ? 110 GLY D O 1 ATOM 5833 N N . GLN D 2 111 ? -6.606 0.905 -20.767 1.00 16.95 ? 111 GLN D N 1 ATOM 5834 C CA . GLN D 2 111 ? -6.198 0.364 -22.072 1.00 21.51 ? 111 GLN D CA 1 ATOM 5835 C C . GLN D 2 111 ? -4.852 0.914 -22.520 1.00 17.66 ? 111 GLN D C 1 ATOM 5836 O O . GLN D 2 111 ? -4.283 0.444 -23.495 1.00 21.17 ? 111 GLN D O 1 ATOM 5837 C CB . GLN D 2 111 ? -7.253 0.622 -23.159 1.00 14.24 ? 111 GLN D CB 1 ATOM 5838 C CG . GLN D 2 111 ? -7.243 2.036 -23.719 1.00 14.81 ? 111 GLN D CG 1 ATOM 5839 C CD . GLN D 2 111 ? -8.067 3.012 -22.883 1.00 28.12 ? 111 GLN D CD 1 ATOM 5840 O OE1 . GLN D 2 111 ? -8.170 2.891 -21.650 1.00 25.93 ? 111 GLN D OE1 1 ATOM 5841 N NE2 . GLN D 2 111 ? -8.667 3.983 -23.555 1.00 22.56 ? 111 GLN D NE2 1 ATOM 5842 N N . GLY D 2 112 ? -4.354 1.919 -21.811 1.00 23.39 ? 112 GLY D N 1 ATOM 5843 C CA . GLY D 2 112 ? -3.081 2.532 -22.138 1.00 19.23 ? 112 GLY D CA 1 ATOM 5844 C C . GLY D 2 112 ? -3.229 3.686 -23.109 1.00 25.46 ? 112 GLY D C 1 ATOM 5845 O O . GLY D 2 112 ? -4.106 3.670 -23.970 1.00 29.38 ? 112 GLY D O 1 ATOM 5846 N N . THR D 2 113 ? -2.375 4.697 -22.953 1.00 30.49 ? 113 THR D N 1 ATOM 5847 C CA . THR D 2 113 ? -2.340 5.846 -23.853 1.00 24.48 ? 113 THR D CA 1 ATOM 5848 C C . THR D 2 113 ? -0.957 6.010 -24.474 1.00 23.09 ? 113 THR D C 1 ATOM 5849 O O . THR D 2 113 ? 0.039 6.245 -23.762 1.00 26.58 ? 113 THR D O 1 ATOM 5850 C CB . THR D 2 113 ? -2.702 7.157 -23.130 1.00 24.85 ? 113 THR D CB 1 ATOM 5851 O OG1 . THR D 2 113 ? -3.993 7.029 -22.533 1.00 31.72 ? 113 THR D OG1 1 ATOM 5852 C CG2 . THR D 2 113 ? -2.714 8.318 -24.110 1.00 20.38 ? 113 THR D CG2 1 ATOM 5853 N N . LEU D 2 114 ? -0.895 5.886 -25.800 1.00 19.72 ? 114 LEU D N 1 ATOM 5854 C CA . LEU D 2 114 ? 0.364 6.065 -26.526 1.00 20.39 ? 114 LEU D CA 1 ATOM 5855 C C . LEU D 2 114 ? 0.680 7.546 -26.643 1.00 23.46 ? 114 LEU D C 1 ATOM 5856 O O . LEU D 2 114 ? -0.030 8.293 -27.313 1.00 20.02 ? 114 LEU D O 1 ATOM 5857 C CB . LEU D 2 114 ? 0.308 5.422 -27.919 1.00 20.66 ? 114 LEU D CB 1 ATOM 5858 C CG . LEU D 2 114 ? 1.592 5.551 -28.751 1.00 21.99 ? 114 LEU D CG 1 ATOM 5859 C CD1 . LEU D 2 114 ? 2.768 4.974 -28.013 1.00 32.05 ? 114 LEU D CD1 1 ATOM 5860 C CD2 . LEU D 2 114 ? 1.435 4.854 -30.060 1.00 19.06 ? 114 LEU D CD2 1 ATOM 5861 N N . VAL D 2 115 ? 1.741 7.970 -25.971 1.00 24.98 ? 115 VAL D N 1 ATOM 5862 C CA . VAL D 2 115 ? 2.159 9.357 -26.022 1.00 27.46 ? 115 VAL D CA 1 ATOM 5863 C C . VAL D 2 115 ? 3.456 9.481 -26.819 1.00 29.75 ? 115 VAL D C 1 ATOM 5864 O O . VAL D 2 115 ? 4.453 8.817 -26.518 1.00 29.15 ? 115 VAL D O 1 ATOM 5865 C CB . VAL D 2 115 ? 2.358 9.927 -24.609 1.00 31.67 ? 115 VAL D CB 1 ATOM 5866 C CG1 . VAL D 2 115 ? 2.848 11.373 -24.674 1.00 29.25 ? 115 VAL D CG1 1 ATOM 5867 C CG2 . VAL D 2 115 ? 1.065 9.827 -23.832 1.00 30.46 ? 115 VAL D CG2 1 ATOM 5868 N N . THR D 2 116 ? 3.431 10.318 -27.849 1.00 28.22 ? 116 THR D N 1 ATOM 5869 C CA . THR D 2 116 ? 4.622 10.561 -28.646 1.00 25.73 ? 116 THR D CA 1 ATOM 5870 C C . THR D 2 116 ? 5.170 11.938 -28.329 1.00 26.52 ? 116 THR D C 1 ATOM 5871 O O . THR D 2 116 ? 4.447 12.930 -28.388 1.00 25.93 ? 116 THR D O 1 ATOM 5872 C CB . THR D 2 116 ? 4.324 10.479 -30.149 1.00 23.97 ? 116 THR D CB 1 ATOM 5873 O OG1 . THR D 2 116 ? 3.799 9.187 -30.464 1.00 19.61 ? 116 THR D OG1 1 ATOM 5874 C CG2 . THR D 2 116 ? 5.596 10.733 -30.965 1.00 18.56 ? 116 THR D CG2 1 ATOM 5875 N N . VAL D 2 117 ? 6.445 11.998 -27.969 1.00 26.77 ? 117 VAL D N 1 ATOM 5876 C CA . VAL D 2 117 ? 7.098 13.282 -27.778 1.00 25.43 ? 117 VAL D CA 1 ATOM 5877 C C . VAL D 2 117 ? 7.922 13.593 -29.017 1.00 25.99 ? 117 VAL D C 1 ATOM 5878 O O . VAL D 2 117 ? 8.947 12.965 -29.270 1.00 24.77 ? 117 VAL D O 1 ATOM 5879 C CB . VAL D 2 117 ? 7.981 13.294 -26.533 1.00 31.73 ? 117 VAL D CB 1 ATOM 5880 C CG1 . VAL D 2 117 ? 8.384 14.744 -26.168 1.00 27.03 ? 117 VAL D CG1 1 ATOM 5881 C CG2 . VAL D 2 117 ? 7.241 12.643 -25.384 1.00 34.27 ? 117 VAL D CG2 1 ATOM 5882 N N . SER D 2 118 ? 7.443 14.554 -29.797 1.00 30.30 ? 118 SER D N 1 ATOM 5883 C CA . SER D 2 118 ? 8.094 14.952 -31.036 1.00 32.48 ? 118 SER D CA 1 ATOM 5884 C C . SER D 2 118 ? 7.754 16.403 -31.344 1.00 32.59 ? 118 SER D C 1 ATOM 5885 O O . SER D 2 118 ? 6.705 16.892 -30.939 1.00 34.75 ? 118 SER D O 1 ATOM 5886 C CB . SER D 2 118 ? 7.644 14.055 -32.191 1.00 30.83 ? 118 SER D CB 1 ATOM 5887 O OG . SER D 2 118 ? 8.147 14.524 -33.431 1.00 34.95 ? 118 SER D OG 1 ATOM 5888 N N . ALA D 2 119 ? 8.643 17.086 -32.058 1.00 31.69 ? 119 ALA D N 1 ATOM 5889 C CA . ALA D 2 119 ? 8.406 18.471 -32.451 1.00 36.00 ? 119 ALA D CA 1 ATOM 5890 C C . ALA D 2 119 ? 7.514 18.597 -33.708 1.00 43.04 ? 119 ALA D C 1 ATOM 5891 O O . ALA D 2 119 ? 7.078 19.692 -34.082 1.00 49.63 ? 119 ALA D O 1 ATOM 5892 C CB . ALA D 2 119 ? 9.730 19.177 -32.657 1.00 34.77 ? 119 ALA D CB 1 ATOM 5893 N N . ALA D 2 120 ? 7.191 17.472 -34.348 1.00 37.95 ? 120 ALA D N 1 ATOM 5894 C CA . ALA D 2 120 ? 6.500 17.463 -35.631 1.00 38.69 ? 120 ALA D CA 1 ATOM 5895 C C . ALA D 2 120 ? 5.006 17.776 -35.484 1.00 33.76 ? 120 ALA D C 1 ATOM 5896 O O . ALA D 2 120 ? 4.498 18.057 -34.397 1.00 29.33 ? 120 ALA D O 1 ATOM 5897 C CB . ALA D 2 120 ? 6.704 16.117 -36.323 1.00 32.35 ? 120 ALA D CB 1 ATOM 5898 N N . SER D 2 121 ? 4.297 17.729 -36.612 1.00 31.23 ? 121 SER D N 1 ATOM 5899 C CA . SER D 2 121 ? 2.885 18.066 -36.684 1.00 28.87 ? 121 SER D CA 1 ATOM 5900 C C . SER D 2 121 ? 2.063 16.800 -36.749 1.00 28.60 ? 121 SER D C 1 ATOM 5901 O O . SER D 2 121 ? 2.524 15.777 -37.261 1.00 29.46 ? 121 SER D O 1 ATOM 5902 C CB . SER D 2 121 ? 2.592 18.886 -37.945 1.00 33.66 ? 121 SER D CB 1 ATOM 5903 O OG . SER D 2 121 ? 3.318 20.101 -37.972 1.00 46.38 ? 121 SER D OG 1 ATOM 5904 N N . THR D 2 122 ? 0.842 16.866 -36.232 1.00 27.02 ? 122 THR D N 1 ATOM 5905 C CA . THR D 2 122 ? -0.086 15.761 -36.372 1.00 24.44 ? 122 THR D CA 1 ATOM 5906 C C . THR D 2 122 ? -0.584 15.790 -37.812 1.00 28.01 ? 122 THR D C 1 ATOM 5907 O O . THR D 2 122 ? -0.784 16.866 -38.375 1.00 24.69 ? 122 THR D O 1 ATOM 5908 C CB . THR D 2 122 ? -1.260 15.889 -35.394 1.00 26.92 ? 122 THR D CB 1 ATOM 5909 O OG1 . THR D 2 122 ? -0.758 15.859 -34.057 1.00 27.53 ? 122 THR D OG1 1 ATOM 5910 C CG2 . THR D 2 122 ? -2.241 14.742 -35.566 1.00 31.09 ? 122 THR D CG2 1 ATOM 5911 N N . LYS D 2 123 ? -0.749 14.611 -38.406 1.00 23.52 ? 123 LYS D N 1 ATOM 5912 C CA . LYS D 2 123 ? -1.274 14.500 -39.762 1.00 20.62 ? 123 LYS D CA 1 ATOM 5913 C C . LYS D 2 123 ? -2.109 13.226 -39.922 1.00 20.32 ? 123 LYS D C 1 ATOM 5914 O O . LYS D 2 123 ? -1.658 12.133 -39.576 1.00 17.18 ? 123 LYS D O 1 ATOM 5915 C CB . LYS D 2 123 ? -0.124 14.525 -40.754 1.00 21.15 ? 123 LYS D CB 1 ATOM 5916 C CG . LYS D 2 123 ? -0.545 14.547 -42.200 1.00 24.60 ? 123 LYS D CG 1 ATOM 5917 C CD . LYS D 2 123 ? 0.672 14.795 -43.084 1.00 33.37 ? 123 LYS D CD 1 ATOM 5918 C CE . LYS D 2 123 ? 0.353 14.562 -44.547 1.00 37.21 ? 123 LYS D CE 1 ATOM 5919 N NZ . LYS D 2 123 ? -0.161 13.179 -44.749 1.00 36.20 ? 123 LYS D NZ 1 ATOM 5920 N N . GLY D 2 124 ? -3.340 13.372 -40.410 1.00 23.23 ? 124 GLY D N 1 ATOM 5921 C CA . GLY D 2 124 ? -4.213 12.232 -40.645 1.00 16.33 ? 124 GLY D CA 1 ATOM 5922 C C . GLY D 2 124 ? -3.766 11.471 -41.878 1.00 15.53 ? 124 GLY D C 1 ATOM 5923 O O . GLY D 2 124 ? -3.104 12.038 -42.748 1.00 15.82 ? 124 GLY D O 1 ATOM 5924 N N . PRO D 2 125 ? -4.123 10.182 -41.963 1.00 21.08 ? 125 PRO D N 1 ATOM 5925 C CA . PRO D 2 125 ? -3.660 9.295 -43.038 1.00 14.01 ? 125 PRO D CA 1 ATOM 5926 C C . PRO D 2 125 ? -4.531 9.363 -44.293 1.00 20.18 ? 125 PRO D C 1 ATOM 5927 O O . PRO D 2 125 ? -5.682 9.803 -44.248 1.00 16.40 ? 125 PRO D O 1 ATOM 5928 C CB . PRO D 2 125 ? -3.804 7.905 -42.409 1.00 19.48 ? 125 PRO D CB 1 ATOM 5929 C CG . PRO D 2 125 ? -5.037 8.043 -41.539 1.00 17.30 ? 125 PRO D CG 1 ATOM 5930 C CD . PRO D 2 125 ? -4.995 9.476 -41.002 1.00 19.79 ? 125 PRO D CD 1 ATOM 5931 N N . SER D 2 126 ? -3.973 8.930 -45.415 1.00 21.55 ? 126 SER D N 1 ATOM 5932 C CA . SER D 2 126 ? -4.773 8.699 -46.606 1.00 20.78 ? 126 SER D CA 1 ATOM 5933 C C . SER D 2 126 ? -4.976 7.201 -46.652 1.00 20.86 ? 126 SER D C 1 ATOM 5934 O O . SER D 2 126 ? -4.055 6.434 -46.329 1.00 17.82 ? 126 SER D O 1 ATOM 5935 C CB . SER D 2 126 ? -4.048 9.166 -47.860 1.00 20.14 ? 126 SER D CB 1 ATOM 5936 O OG . SER D 2 126 ? -3.567 10.485 -47.697 1.00 28.17 ? 126 SER D OG 1 ATOM 5937 N N . VAL D 2 127 ? -6.182 6.786 -47.026 1.00 19.45 ? 127 VAL D N 1 ATOM 5938 C CA . VAL D 2 127 ? -6.518 5.369 -47.070 1.00 18.07 ? 127 VAL D CA 1 ATOM 5939 C C . VAL D 2 127 ? -6.801 4.932 -48.502 1.00 22.52 ? 127 VAL D C 1 ATOM 5940 O O . VAL D 2 127 ? -7.691 5.469 -49.160 1.00 27.07 ? 127 VAL D O 1 ATOM 5941 C CB . VAL D 2 127 ? -7.742 5.065 -46.207 1.00 18.63 ? 127 VAL D CB 1 ATOM 5942 C CG1 . VAL D 2 127 ? -8.061 3.565 -46.246 1.00 14.01 ? 127 VAL D CG1 1 ATOM 5943 C CG2 . VAL D 2 127 ? -7.502 5.543 -44.780 1.00 18.78 ? 127 VAL D CG2 1 ATOM 5944 N N . PHE D 2 128 ? -6.033 3.954 -48.970 1.00 16.36 ? 128 PHE D N 1 ATOM 5945 C CA . PHE D 2 128 ? -6.134 3.479 -50.335 1.00 15.88 ? 128 PHE D CA 1 ATOM 5946 C C . PHE D 2 128 ? -6.487 1.993 -50.326 1.00 22.62 ? 128 PHE D C 1 ATOM 5947 O O . PHE D 2 128 ? -6.141 1.289 -49.380 1.00 23.68 ? 128 PHE D O 1 ATOM 5948 C CB . PHE D 2 128 ? -4.808 3.706 -51.067 1.00 14.54 ? 128 PHE D CB 1 ATOM 5949 C CG . PHE D 2 128 ? -4.338 5.135 -51.050 1.00 16.77 ? 128 PHE D CG 1 ATOM 5950 C CD1 . PHE D 2 128 ? -5.090 6.140 -51.647 1.00 16.09 ? 128 PHE D CD1 1 ATOM 5951 C CD2 . PHE D 2 128 ? -3.133 5.473 -50.457 1.00 16.39 ? 128 PHE D CD2 1 ATOM 5952 C CE1 . PHE D 2 128 ? -4.654 7.466 -51.644 1.00 17.11 ? 128 PHE D CE1 1 ATOM 5953 C CE2 . PHE D 2 128 ? -2.684 6.796 -50.454 1.00 23.26 ? 128 PHE D CE2 1 ATOM 5954 C CZ . PHE D 2 128 ? -3.447 7.797 -51.049 1.00 18.12 ? 128 PHE D CZ 1 ATOM 5955 N N . PRO D 2 129 ? -7.176 1.513 -51.381 1.00 19.98 ? 129 PRO D N 1 ATOM 5956 C CA . PRO D 2 129 ? -7.586 0.107 -51.445 1.00 17.60 ? 129 PRO D CA 1 ATOM 5957 C C . PRO D 2 129 ? -6.436 -0.805 -51.851 1.00 21.42 ? 129 PRO D C 1 ATOM 5958 O O . PRO D 2 129 ? -5.641 -0.434 -52.722 1.00 17.78 ? 129 PRO D O 1 ATOM 5959 C CB . PRO D 2 129 ? -8.646 0.108 -52.563 1.00 16.89 ? 129 PRO D CB 1 ATOM 5960 C CG . PRO D 2 129 ? -8.219 1.221 -53.472 1.00 17.11 ? 129 PRO D CG 1 ATOM 5961 C CD . PRO D 2 129 ? -7.656 2.285 -52.550 1.00 16.67 ? 129 PRO D CD 1 ATOM 5962 N N . LEU D 2 130 ? -6.356 -1.979 -51.226 1.00 19.79 ? 130 LEU D N 1 ATOM 5963 C CA . LEU D 2 130 ? -5.507 -3.054 -51.719 1.00 22.85 ? 130 LEU D CA 1 ATOM 5964 C C . LEU D 2 130 ? -6.435 -4.070 -52.356 1.00 21.02 ? 130 LEU D C 1 ATOM 5965 O O . LEU D 2 130 ? -7.064 -4.871 -51.660 1.00 23.60 ? 130 LEU D O 1 ATOM 5966 C CB . LEU D 2 130 ? -4.714 -3.691 -50.584 1.00 21.66 ? 130 LEU D CB 1 ATOM 5967 C CG . LEU D 2 130 ? -3.711 -2.760 -49.892 1.00 21.40 ? 130 LEU D CG 1 ATOM 5968 C CD1 . LEU D 2 130 ? -3.190 -3.415 -48.627 1.00 15.14 ? 130 LEU D CD1 1 ATOM 5969 C CD2 . LEU D 2 130 ? -2.555 -2.400 -50.824 1.00 13.90 ? 130 LEU D CD2 1 ATOM 5970 N N . ALA D 2 131 ? -6.529 -4.046 -53.692 1.00 19.17 ? 131 ALA D N 1 ATOM 5971 C CA . ALA D 2 131 ? -7.616 -4.746 -54.374 1.00 26.28 ? 131 ALA D CA 1 ATOM 5972 C C . ALA D 2 131 ? -7.126 -5.940 -55.186 1.00 28.62 ? 131 ALA D C 1 ATOM 5973 O O . ALA D 2 131 ? -6.117 -5.839 -55.893 1.00 27.21 ? 131 ALA D O 1 ATOM 5974 C CB . ALA D 2 131 ? -8.366 -3.795 -55.309 1.00 24.60 ? 131 ALA D CB 1 ATOM 5975 N N . PRO D 2 132 ? -7.849 -7.058 -55.131 1.00 38.61 ? 132 PRO D N 1 ATOM 5976 C CA . PRO D 2 132 ? -7.494 -8.236 -55.935 1.00 40.45 ? 132 PRO D CA 1 ATOM 5977 C C . PRO D 2 132 ? -7.946 -8.091 -57.380 1.00 53.55 ? 132 PRO D C 1 ATOM 5978 O O . PRO D 2 132 ? -8.759 -7.231 -57.726 1.00 51.97 ? 132 PRO D O 1 ATOM 5979 C CB . PRO D 2 132 ? -8.266 -9.366 -55.249 1.00 42.05 ? 132 PRO D CB 1 ATOM 5980 C CG . PRO D 2 132 ? -9.482 -8.685 -54.692 1.00 40.87 ? 132 PRO D CG 1 ATOM 5981 C CD . PRO D 2 132 ? -9.014 -7.310 -54.263 1.00 42.22 ? 132 PRO D CD 1 ATOM 5982 N N . SER D 2 133 ? -7.424 -8.981 -58.224 1.00 66.83 ? 133 SER D N 1 ATOM 5983 C CA . SER D 2 133 ? -7.814 -9.007 -59.633 1.00 73.62 ? 133 SER D CA 1 ATOM 5984 C C . SER D 2 133 ? -8.380 -10.370 -60.006 1.00 80.59 ? 133 SER D C 1 ATOM 5985 O O . SER D 2 133 ? -8.322 -11.310 -59.215 1.00 87.03 ? 133 SER D O 1 ATOM 5986 C CB . SER D 2 133 ? -6.621 -8.682 -60.532 1.00 72.93 ? 133 SER D CB 1 ATOM 5987 O OG . SER D 2 133 ? -5.612 -9.668 -60.406 1.00 72.51 ? 133 SER D OG 1 ATOM 5988 N N . GLY D 2 140 ? -9.292 -20.457 -54.655 1.00 40.03 ? 140 GLY D N 1 ATOM 5989 C CA . GLY D 2 140 ? -10.430 -19.559 -54.686 1.00 33.21 ? 140 GLY D CA 1 ATOM 5990 C C . GLY D 2 140 ? -10.468 -18.624 -53.490 1.00 33.84 ? 140 GLY D C 1 ATOM 5991 O O . GLY D 2 140 ? -11.527 -18.129 -53.105 1.00 39.07 ? 140 GLY D O 1 ATOM 5992 N N . THR D 2 141 ? -9.309 -18.374 -52.894 1.00 19.86 ? 141 THR D N 1 ATOM 5993 C CA . THR D 2 141 ? -9.215 -17.415 -51.797 1.00 18.40 ? 141 THR D CA 1 ATOM 5994 C C . THR D 2 141 ? -8.624 -16.111 -52.295 1.00 21.28 ? 141 THR D C 1 ATOM 5995 O O . THR D 2 141 ? -7.590 -16.106 -52.941 1.00 23.72 ? 141 THR D O 1 ATOM 5996 C CB . THR D 2 141 ? -8.336 -17.942 -50.660 1.00 19.38 ? 141 THR D CB 1 ATOM 5997 O OG1 . THR D 2 141 ? -9.049 -18.955 -49.945 1.00 25.65 ? 141 THR D OG1 1 ATOM 5998 C CG2 . THR D 2 141 ? -7.970 -16.821 -49.698 1.00 20.80 ? 141 THR D CG2 1 ATOM 5999 N N . ALA D 2 142 ? -9.288 -15.007 -51.990 1.00 23.53 ? 142 ALA D N 1 ATOM 6000 C CA . ALA D 2 142 ? -8.815 -13.691 -52.388 1.00 23.43 ? 142 ALA D CA 1 ATOM 6001 C C . ALA D 2 142 ? -8.339 -12.894 -51.173 1.00 27.33 ? 142 ALA D C 1 ATOM 6002 O O . ALA D 2 142 ? -8.879 -13.011 -50.064 1.00 23.68 ? 142 ALA D O 1 ATOM 6003 C CB . ALA D 2 142 ? -9.912 -12.939 -53.089 1.00 19.66 ? 142 ALA D CB 1 ATOM 6004 N N . ALA D 2 143 ? -7.313 -12.088 -51.387 1.00 24.51 ? 143 ALA D N 1 ATOM 6005 C CA . ALA D 2 143 ? -6.844 -11.183 -50.355 1.00 18.27 ? 143 ALA D CA 1 ATOM 6006 C C . ALA D 2 143 ? -7.236 -9.775 -50.759 1.00 17.50 ? 143 ALA D C 1 ATOM 6007 O O . ALA D 2 143 ? -7.219 -9.421 -51.937 1.00 23.32 ? 143 ALA D O 1 ATOM 6008 C CB . ALA D 2 143 ? -5.331 -11.293 -50.200 1.00 19.49 ? 143 ALA D CB 1 ATOM 6009 N N . LEU D 2 144 ? -7.613 -8.972 -49.781 1.00 16.62 ? 144 LEU D N 1 ATOM 6010 C CA . LEU D 2 144 ? -7.828 -7.567 -50.037 1.00 24.20 ? 144 LEU D CA 1 ATOM 6011 C C . LEU D 2 144 ? -7.413 -6.818 -48.779 1.00 28.06 ? 144 LEU D C 1 ATOM 6012 O O . LEU D 2 144 ? -7.203 -7.431 -47.723 1.00 27.87 ? 144 LEU D O 1 ATOM 6013 C CB . LEU D 2 144 ? -9.281 -7.301 -50.457 1.00 26.05 ? 144 LEU D CB 1 ATOM 6014 C CG . LEU D 2 144 ? -10.385 -7.819 -49.538 1.00 26.36 ? 144 LEU D CG 1 ATOM 6015 C CD1 . LEU D 2 144 ? -10.721 -6.762 -48.522 1.00 30.21 ? 144 LEU D CD1 1 ATOM 6016 C CD2 . LEU D 2 144 ? -11.636 -8.226 -50.313 1.00 21.47 ? 144 LEU D CD2 1 ATOM 6017 N N . GLY D 2 145 ? -7.264 -5.504 -48.890 1.00 24.36 ? 145 GLY D N 1 ATOM 6018 C CA . GLY D 2 145 ? -6.829 -4.734 -47.752 1.00 12.08 ? 145 GLY D CA 1 ATOM 6019 C C . GLY D 2 145 ? -6.890 -3.237 -47.919 1.00 12.13 ? 145 GLY D C 1 ATOM 6020 O O . GLY D 2 145 ? -7.398 -2.723 -48.923 1.00 14.75 ? 145 GLY D O 1 ATOM 6021 N N . CYS D 2 146 ? -6.360 -2.543 -46.916 1.00 19.65 ? 146 CYS D N 1 ATOM 6022 C CA . CYS D 2 146 ? -6.294 -1.085 -46.893 1.00 20.30 ? 146 CYS D CA 1 ATOM 6023 C C . CYS D 2 146 ? -4.886 -0.592 -46.584 1.00 24.94 ? 146 CYS D C 1 ATOM 6024 O O . CYS D 2 146 ? -4.254 -1.030 -45.611 1.00 24.54 ? 146 CYS D O 1 ATOM 6025 C CB . CYS D 2 146 ? -7.274 -0.516 -45.859 1.00 20.41 ? 146 CYS D CB 1 ATOM 6026 S SG . CYS D 2 146 ? -8.979 -0.563 -46.434 1.00 32.44 ? 146 CYS D SG 1 ATOM 6027 N N . LEU D 2 147 ? -4.394 0.309 -47.429 1.00 27.28 ? 147 LEU D N 1 ATOM 6028 C CA . LEU D 2 147 ? -3.138 0.994 -47.176 1.00 22.78 ? 147 LEU D CA 1 ATOM 6029 C C . LEU D 2 147 ? -3.439 2.291 -46.431 1.00 23.61 ? 147 LEU D C 1 ATOM 6030 O O . LEU D 2 147 ? -4.090 3.196 -46.951 1.00 29.49 ? 147 LEU D O 1 ATOM 6031 C CB . LEU D 2 147 ? -2.407 1.277 -48.491 1.00 21.09 ? 147 LEU D CB 1 ATOM 6032 C CG . LEU D 2 147 ? -1.048 1.978 -48.410 1.00 18.45 ? 147 LEU D CG 1 ATOM 6033 C CD1 . LEU D 2 147 ? -0.059 1.128 -47.626 1.00 14.14 ? 147 LEU D CD1 1 ATOM 6034 C CD2 . LEU D 2 147 ? -0.517 2.266 -49.810 1.00 17.01 ? 147 LEU D CD2 1 ATOM 6035 N N . VAL D 2 148 ? -2.970 2.377 -45.198 1.00 19.35 ? 148 VAL D N 1 ATOM 6036 C CA . VAL D 2 148 ? -3.204 3.530 -44.343 1.00 19.22 ? 148 VAL D CA 1 ATOM 6037 C C . VAL D 2 148 ? -1.892 4.302 -44.291 1.00 22.63 ? 148 VAL D C 1 ATOM 6038 O O . VAL D 2 148 ? -0.975 3.941 -43.543 1.00 18.10 ? 148 VAL D O 1 ATOM 6039 C CB . VAL D 2 148 ? -3.683 3.103 -42.953 1.00 20.27 ? 148 VAL D CB 1 ATOM 6040 C CG1 . VAL D 2 148 ? -4.001 4.317 -42.062 1.00 12.53 ? 148 VAL D CG1 1 ATOM 6041 C CG2 . VAL D 2 148 ? -4.876 2.182 -43.094 1.00 11.99 ? 148 VAL D CG2 1 ATOM 6042 N N . LYS D 2 149 ? -1.801 5.378 -45.074 1.00 19.89 ? 149 LYS D N 1 ATOM 6043 C CA . LYS D 2 149 ? -0.517 5.965 -45.446 1.00 22.36 ? 149 LYS D CA 1 ATOM 6044 C C . LYS D 2 149 ? -0.361 7.406 -44.967 1.00 17.64 ? 149 LYS D C 1 ATOM 6045 O O . LYS D 2 149 ? -1.322 8.181 -44.942 1.00 18.17 ? 149 LYS D O 1 ATOM 6046 C CB . LYS D 2 149 ? -0.329 5.910 -46.969 1.00 23.50 ? 149 LYS D CB 1 ATOM 6047 C CG . LYS D 2 149 ? 1.065 6.284 -47.429 1.00 26.50 ? 149 LYS D CG 1 ATOM 6048 C CD . LYS D 2 149 ? 1.323 5.808 -48.840 1.00 30.03 ? 149 LYS D CD 1 ATOM 6049 C CE . LYS D 2 149 ? 2.800 5.897 -49.174 1.00 26.48 ? 149 LYS D CE 1 ATOM 6050 N NZ . LYS D 2 149 ? 3.268 7.294 -49.091 1.00 31.80 ? 149 LYS D NZ 1 ATOM 6051 N N . ASP D 2 150 ? 0.874 7.749 -44.592 1.00 18.45 ? 150 ASP D N 1 ATOM 6052 C CA . ASP D 2 150 ? 1.309 9.122 -44.341 1.00 16.22 ? 150 ASP D CA 1 ATOM 6053 C C . ASP D 2 150 ? 0.622 9.787 -43.136 1.00 19.51 ? 150 ASP D C 1 ATOM 6054 O O . ASP D 2 150 ? -0.011 10.835 -43.260 1.00 17.64 ? 150 ASP D O 1 ATOM 6055 C CB . ASP D 2 150 ? 1.185 9.972 -45.619 1.00 15.63 ? 150 ASP D CB 1 ATOM 6056 C CG . ASP D 2 150 ? 2.207 9.561 -46.710 1.00 21.63 ? 150 ASP D CG 1 ATOM 6057 O OD1 . ASP D 2 150 ? 3.187 8.863 -46.387 1.00 16.64 ? 150 ASP D OD1 1 ATOM 6058 O OD2 . ASP D 2 150 ? 2.038 9.945 -47.888 1.00 22.81 ? 150 ASP D OD2 1 ATOM 6059 N N . TYR D 2 151 ? 0.755 9.182 -41.963 1.00 19.11 ? 151 TYR D N 1 ATOM 6060 C CA . TYR D 2 151 ? 0.150 9.765 -40.765 1.00 14.70 ? 151 TYR D CA 1 ATOM 6061 C C . TYR D 2 151 ? 1.152 9.906 -39.637 1.00 17.82 ? 151 TYR D C 1 ATOM 6062 O O . TYR D 2 151 ? 2.177 9.214 -39.597 1.00 22.11 ? 151 TYR D O 1 ATOM 6063 C CB . TYR D 2 151 ? -1.052 8.946 -40.280 1.00 15.71 ? 151 TYR D CB 1 ATOM 6064 C CG . TYR D 2 151 ? -0.698 7.547 -39.802 1.00 13.74 ? 151 TYR D CG 1 ATOM 6065 C CD1 . TYR D 2 151 ? -0.686 6.475 -40.680 1.00 15.76 ? 151 TYR D CD1 1 ATOM 6066 C CD2 . TYR D 2 151 ? -0.381 7.303 -38.464 1.00 18.80 ? 151 TYR D CD2 1 ATOM 6067 C CE1 . TYR D 2 151 ? -0.370 5.189 -40.242 1.00 12.79 ? 151 TYR D CE1 1 ATOM 6068 C CE2 . TYR D 2 151 ? -0.066 6.028 -38.019 1.00 23.60 ? 151 TYR D CE2 1 ATOM 6069 C CZ . TYR D 2 151 ? -0.067 4.974 -38.917 1.00 24.42 ? 151 TYR D CZ 1 ATOM 6070 O OH . TYR D 2 151 ? 0.244 3.709 -38.482 1.00 22.39 ? 151 TYR D OH 1 ATOM 6071 N N . PHE D 2 152 ? 0.832 10.805 -38.717 1.00 17.49 ? 152 PHE D N 1 ATOM 6072 C CA . PHE D 2 152 ? 1.652 11.029 -37.547 1.00 16.43 ? 152 PHE D CA 1 ATOM 6073 C C . PHE D 2 152 ? 0.803 11.674 -36.451 1.00 22.09 ? 152 PHE D C 1 ATOM 6074 O O . PHE D 2 152 ? -0.053 12.509 -36.741 1.00 27.27 ? 152 PHE D O 1 ATOM 6075 C CB . PHE D 2 152 ? 2.847 11.919 -37.902 1.00 16.58 ? 152 PHE D CB 1 ATOM 6076 C CG . PHE D 2 152 ? 3.923 11.915 -36.856 1.00 20.43 ? 152 PHE D CG 1 ATOM 6077 C CD1 . PHE D 2 152 ? 4.892 10.921 -36.848 1.00 16.81 ? 152 PHE D CD1 1 ATOM 6078 C CD2 . PHE D 2 152 ? 3.944 12.880 -35.854 1.00 19.14 ? 152 PHE D CD2 1 ATOM 6079 C CE1 . PHE D 2 152 ? 5.883 10.895 -35.860 1.00 25.67 ? 152 PHE D CE1 1 ATOM 6080 C CE2 . PHE D 2 152 ? 4.937 12.868 -34.876 1.00 24.30 ? 152 PHE D CE2 1 ATOM 6081 C CZ . PHE D 2 152 ? 5.908 11.869 -34.879 1.00 18.40 ? 152 PHE D CZ 1 ATOM 6082 N N . PRO D 2 153 ? 1.012 11.270 -35.192 1.00 17.26 ? 153 PRO D N 1 ATOM 6083 C CA . PRO D 2 153 ? 1.890 10.182 -34.761 1.00 19.38 ? 153 PRO D CA 1 ATOM 6084 C C . PRO D 2 153 ? 1.095 8.885 -34.732 1.00 19.96 ? 153 PRO D C 1 ATOM 6085 O O . PRO D 2 153 ? -0.042 8.841 -35.205 1.00 16.39 ? 153 PRO D O 1 ATOM 6086 C CB . PRO D 2 153 ? 2.188 10.560 -33.320 1.00 19.13 ? 153 PRO D CB 1 ATOM 6087 C CG . PRO D 2 153 ? 0.847 11.084 -32.835 1.00 20.76 ? 153 PRO D CG 1 ATOM 6088 C CD . PRO D 2 153 ? 0.298 11.868 -34.046 1.00 22.86 ? 153 PRO D CD 1 ATOM 6089 N N . GLU D 2 154 ? 1.675 7.846 -34.151 1.00 19.41 ? 154 GLU D N 1 ATOM 6090 C CA . GLU D 2 154 ? 0.926 6.631 -33.880 1.00 20.58 ? 154 GLU D CA 1 ATOM 6091 C C . GLU D 2 154 ? -0.063 6.906 -32.746 1.00 23.60 ? 154 GLU D C 1 ATOM 6092 O O . GLU D 2 154 ? 0.091 7.886 -32.019 1.00 21.34 ? 154 GLU D O 1 ATOM 6093 C CB . GLU D 2 154 ? 1.883 5.518 -33.484 1.00 25.58 ? 154 GLU D CB 1 ATOM 6094 C CG . GLU D 2 154 ? 2.660 4.946 -34.633 1.00 33.93 ? 154 GLU D CG 1 ATOM 6095 C CD . GLU D 2 154 ? 2.988 3.489 -34.399 1.00 39.65 ? 154 GLU D CD 1 ATOM 6096 O OE1 . GLU D 2 154 ? 4.092 3.215 -33.855 1.00 43.64 ? 154 GLU D OE1 1 ATOM 6097 O OE2 . GLU D 2 154 ? 2.127 2.631 -34.741 1.00 29.21 ? 154 GLU D OE2 1 ATOM 6098 N N . PRO D 2 155 ? -1.084 6.050 -32.594 1.00 25.81 ? 155 PRO D N 1 ATOM 6099 C CA . PRO D 2 155 ? -1.400 4.899 -33.439 1.00 28.61 ? 155 PRO D CA 1 ATOM 6100 C C . PRO D 2 155 ? -2.609 5.171 -34.312 1.00 28.51 ? 155 PRO D C 1 ATOM 6101 O O . PRO D 2 155 ? -3.248 6.223 -34.231 1.00 25.77 ? 155 PRO D O 1 ATOM 6102 C CB . PRO D 2 155 ? -1.816 3.861 -32.407 1.00 24.18 ? 155 PRO D CB 1 ATOM 6103 C CG . PRO D 2 155 ? -2.651 4.692 -31.461 1.00 18.30 ? 155 PRO D CG 1 ATOM 6104 C CD . PRO D 2 155 ? -1.922 6.044 -31.382 1.00 27.74 ? 155 PRO D CD 1 ATOM 6105 N N . VAL D 2 156 ? -2.941 4.184 -35.127 1.00 27.14 ? 156 VAL D N 1 ATOM 6106 C CA . VAL D 2 156 ? -4.175 4.208 -35.873 1.00 28.73 ? 156 VAL D CA 1 ATOM 6107 C C . VAL D 2 156 ? -4.837 2.865 -35.618 1.00 24.18 ? 156 VAL D C 1 ATOM 6108 O O . VAL D 2 156 ? -4.158 1.876 -35.370 1.00 25.94 ? 156 VAL D O 1 ATOM 6109 C CB . VAL D 2 156 ? -3.907 4.423 -37.371 1.00 27.91 ? 156 VAL D CB 1 ATOM 6110 C CG1 . VAL D 2 156 ? -3.037 3.324 -37.897 1.00 25.20 ? 156 VAL D CG1 1 ATOM 6111 C CG2 . VAL D 2 156 ? -5.203 4.486 -38.143 1.00 30.69 ? 156 VAL D CG2 1 ATOM 6112 N N . THR D 2 157 ? -6.162 2.822 -35.629 1.00 28.02 ? 157 THR D N 1 ATOM 6113 C CA . THR D 2 157 ? -6.840 1.548 -35.453 1.00 30.72 ? 157 THR D CA 1 ATOM 6114 C C . THR D 2 157 ? -7.613 1.218 -36.706 1.00 29.92 ? 157 THR D C 1 ATOM 6115 O O . THR D 2 157 ? -8.162 2.103 -37.360 1.00 35.04 ? 157 THR D O 1 ATOM 6116 C CB . THR D 2 157 ? -7.804 1.571 -34.270 1.00 32.31 ? 157 THR D CB 1 ATOM 6117 O OG1 . THR D 2 157 ? -8.821 2.548 -34.512 1.00 36.23 ? 157 THR D OG1 1 ATOM 6118 C CG2 . THR D 2 157 ? -7.055 1.901 -32.977 1.00 23.84 ? 157 THR D CG2 1 ATOM 6119 N N . VAL D 2 158 ? -7.634 -0.061 -37.046 1.00 28.90 ? 158 VAL D N 1 ATOM 6120 C CA . VAL D 2 158 ? -8.345 -0.533 -38.216 1.00 23.53 ? 158 VAL D CA 1 ATOM 6121 C C . VAL D 2 158 ? -9.188 -1.728 -37.826 1.00 24.72 ? 158 VAL D C 1 ATOM 6122 O O . VAL D 2 158 ? -8.692 -2.657 -37.195 1.00 29.59 ? 158 VAL D O 1 ATOM 6123 C CB . VAL D 2 158 ? -7.376 -1.001 -39.316 1.00 23.61 ? 158 VAL D CB 1 ATOM 6124 C CG1 . VAL D 2 158 ? -8.148 -1.403 -40.557 1.00 17.28 ? 158 VAL D CG1 1 ATOM 6125 C CG2 . VAL D 2 158 ? -6.361 0.080 -39.625 1.00 23.25 ? 158 VAL D CG2 1 ATOM 6126 N N . SER D 2 159 ? -10.465 -1.702 -38.197 1.00 25.29 ? 159 SER D N 1 ATOM 6127 C CA . SER D 2 159 ? -11.301 -2.884 -38.101 1.00 15.96 ? 159 SER D CA 1 ATOM 6128 C C . SER D 2 159 ? -11.926 -3.116 -39.465 1.00 22.15 ? 159 SER D C 1 ATOM 6129 O O . SER D 2 159 ? -11.729 -2.318 -40.387 1.00 23.26 ? 159 SER D O 1 ATOM 6130 C CB . SER D 2 159 ? -12.384 -2.697 -37.043 1.00 19.47 ? 159 SER D CB 1 ATOM 6131 O OG . SER D 2 159 ? -13.315 -1.722 -37.455 1.00 22.38 ? 159 SER D OG 1 ATOM 6132 N N . TRP D 2 160 ? -12.670 -4.208 -39.597 1.00 17.12 ? 160 TRP D N 1 ATOM 6133 C CA . TRP D 2 160 ? -13.315 -4.544 -40.859 1.00 15.85 ? 160 TRP D CA 1 ATOM 6134 C C . TRP D 2 160 ? -14.791 -4.790 -40.640 1.00 21.75 ? 160 TRP D C 1 ATOM 6135 O O . TRP D 2 160 ? -15.166 -5.490 -39.693 1.00 23.11 ? 160 TRP D O 1 ATOM 6136 C CB . TRP D 2 160 ? -12.656 -5.772 -41.499 1.00 20.51 ? 160 TRP D CB 1 ATOM 6137 C CG . TRP D 2 160 ? -11.311 -5.457 -42.106 1.00 26.17 ? 160 TRP D CG 1 ATOM 6138 C CD1 . TRP D 2 160 ? -10.097 -5.435 -41.465 1.00 13.54 ? 160 TRP D CD1 1 ATOM 6139 C CD2 . TRP D 2 160 ? -11.047 -5.115 -43.473 1.00 21.45 ? 160 TRP D CD2 1 ATOM 6140 N NE1 . TRP D 2 160 ? -9.101 -5.101 -42.350 1.00 17.42 ? 160 TRP D NE1 1 ATOM 6141 C CE2 . TRP D 2 160 ? -9.655 -4.898 -43.589 1.00 22.90 ? 160 TRP D CE2 1 ATOM 6142 C CE3 . TRP D 2 160 ? -11.851 -4.965 -44.607 1.00 16.81 ? 160 TRP D CE3 1 ATOM 6143 C CZ2 . TRP D 2 160 ? -9.051 -4.539 -44.800 1.00 24.80 ? 160 TRP D CZ2 1 ATOM 6144 C CZ3 . TRP D 2 160 ? -11.251 -4.607 -45.808 1.00 17.57 ? 160 TRP D CZ3 1 ATOM 6145 C CH2 . TRP D 2 160 ? -9.865 -4.399 -45.895 1.00 23.92 ? 160 TRP D CH2 1 ATOM 6146 N N . ASN D 2 161 ? -15.620 -4.200 -41.505 1.00 17.66 ? 161 ASN D N 1 ATOM 6147 C CA . ASN D 2 161 ? -17.083 -4.319 -41.405 1.00 19.24 ? 161 ASN D CA 1 ATOM 6148 C C . ASN D 2 161 ? -17.590 -4.009 -40.001 1.00 25.02 ? 161 ASN D C 1 ATOM 6149 O O . ASN D 2 161 ? -18.407 -4.740 -39.441 1.00 21.89 ? 161 ASN D O 1 ATOM 6150 C CB . ASN D 2 161 ? -17.543 -5.700 -41.879 1.00 19.37 ? 161 ASN D CB 1 ATOM 6151 C CG . ASN D 2 161 ? -17.296 -5.908 -43.362 1.00 24.87 ? 161 ASN D CG 1 ATOM 6152 O OD1 . ASN D 2 161 ? -16.847 -4.996 -44.068 1.00 28.54 ? 161 ASN D OD1 1 ATOM 6153 N ND2 . ASN D 2 161 ? -17.581 -7.104 -43.846 1.00 20.93 ? 161 ASN D ND2 1 ATOM 6154 N N . SER D 2 162 ? -17.049 -2.931 -39.439 1.00 22.25 ? 162 SER D N 1 ATOM 6155 C CA . SER D 2 162 ? -17.413 -2.435 -38.119 1.00 27.09 ? 162 SER D CA 1 ATOM 6156 C C . SER D 2 162 ? -17.204 -3.444 -37.004 1.00 27.56 ? 162 SER D C 1 ATOM 6157 O O . SER D 2 162 ? -17.907 -3.413 -36.003 1.00 24.28 ? 162 SER D O 1 ATOM 6158 C CB . SER D 2 162 ? -18.859 -1.951 -38.111 1.00 25.29 ? 162 SER D CB 1 ATOM 6159 O OG . SER D 2 162 ? -19.026 -0.964 -39.111 1.00 29.47 ? 162 SER D OG 1 ATOM 6160 N N . GLY D 2 163 ? -16.242 -4.340 -37.173 1.00 22.20 ? 163 GLY D N 1 ATOM 6161 C CA . GLY D 2 163 ? -15.964 -5.312 -36.135 1.00 25.86 ? 163 GLY D CA 1 ATOM 6162 C C . GLY D 2 163 ? -16.511 -6.693 -36.424 1.00 32.34 ? 163 GLY D C 1 ATOM 6163 O O . GLY D 2 163 ? -16.050 -7.663 -35.836 1.00 42.78 ? 163 GLY D O 1 ATOM 6164 N N . ALA D 2 164 ? -17.478 -6.794 -37.336 1.00 28.29 ? 164 ALA D N 1 ATOM 6165 C CA . ALA D 2 164 ? -18.121 -8.081 -37.625 1.00 28.95 ? 164 ALA D CA 1 ATOM 6166 C C . ALA D 2 164 ? -17.199 -9.093 -38.304 1.00 29.22 ? 164 ALA D C 1 ATOM 6167 O O . ALA D 2 164 ? -17.469 -10.286 -38.291 1.00 36.12 ? 164 ALA D O 1 ATOM 6168 C CB . ALA D 2 164 ? -19.394 -7.886 -38.453 1.00 23.74 ? 164 ALA D CB 1 ATOM 6169 N N . LEU D 2 165 ? -16.119 -8.618 -38.907 1.00 29.54 ? 165 LEU D N 1 ATOM 6170 C CA . LEU D 2 165 ? -15.221 -9.497 -39.647 1.00 24.52 ? 165 LEU D CA 1 ATOM 6171 C C . LEU D 2 165 ? -13.842 -9.459 -39.012 1.00 29.37 ? 165 LEU D C 1 ATOM 6172 O O . LEU D 2 165 ? -13.149 -8.442 -39.072 1.00 34.41 ? 165 LEU D O 1 ATOM 6173 C CB . LEU D 2 165 ? -15.148 -9.068 -41.111 1.00 20.48 ? 165 LEU D CB 1 ATOM 6174 C CG . LEU D 2 165 ? -14.109 -9.767 -41.984 1.00 24.64 ? 165 LEU D CG 1 ATOM 6175 C CD1 . LEU D 2 165 ? -14.378 -11.271 -42.058 1.00 23.06 ? 165 LEU D CD1 1 ATOM 6176 C CD2 . LEU D 2 165 ? -14.105 -9.144 -43.367 1.00 15.82 ? 165 LEU D CD2 1 ATOM 6177 N N . THR D 2 166 ? -13.448 -10.569 -38.399 1.00 28.32 ? 166 THR D N 1 ATOM 6178 C CA . THR D 2 166 ? -12.193 -10.632 -37.648 1.00 29.10 ? 166 THR D CA 1 ATOM 6179 C C . THR D 2 166 ? -11.348 -11.800 -38.122 1.00 29.55 ? 166 THR D C 1 ATOM 6180 O O . THR D 2 166 ? -10.121 -11.764 -38.071 1.00 34.44 ? 166 THR D O 1 ATOM 6181 C CB . THR D 2 166 ? -12.472 -10.855 -36.159 1.00 25.27 ? 166 THR D CB 1 ATOM 6182 O OG1 . THR D 2 166 ? -13.293 -12.025 -36.013 1.00 23.62 ? 166 THR D OG1 1 ATOM 6183 C CG2 . THR D 2 166 ? -13.171 -9.637 -35.539 1.00 20.50 ? 166 THR D CG2 1 ATOM 6184 N N . SER D 2 167 ? -12.029 -12.845 -38.574 1.00 27.85 ? 167 SER D N 1 ATOM 6185 C CA . SER D 2 167 ? -11.375 -14.051 -39.035 1.00 34.05 ? 167 SER D CA 1 ATOM 6186 C C . SER D 2 167 ? -10.535 -13.776 -40.274 1.00 31.90 ? 167 SER D C 1 ATOM 6187 O O . SER D 2 167 ? -11.050 -13.316 -41.284 1.00 28.48 ? 167 SER D O 1 ATOM 6188 C CB . SER D 2 167 ? -12.420 -15.125 -39.334 1.00 39.93 ? 167 SER D CB 1 ATOM 6189 O OG . SER D 2 167 ? -11.786 -16.351 -39.644 1.00 51.63 ? 167 SER D OG 1 ATOM 6190 N N . GLY D 2 168 ? -9.236 -14.044 -40.179 1.00 32.49 ? 168 GLY D N 1 ATOM 6191 C CA . GLY D 2 168 ? -8.332 -13.866 -41.302 1.00 22.65 ? 168 GLY D CA 1 ATOM 6192 C C . GLY D 2 168 ? -7.821 -12.446 -41.483 1.00 23.37 ? 168 GLY D C 1 ATOM 6193 O O . GLY D 2 168 ? -7.177 -12.138 -42.479 1.00 25.31 ? 168 GLY D O 1 ATOM 6194 N N . VAL D 2 169 ? -8.111 -11.567 -40.530 1.00 21.74 ? 169 VAL D N 1 ATOM 6195 C CA . VAL D 2 169 ? -7.585 -10.209 -40.594 1.00 19.89 ? 169 VAL D CA 1 ATOM 6196 C C . VAL D 2 169 ? -6.163 -10.147 -40.029 1.00 22.32 ? 169 VAL D C 1 ATOM 6197 O O . VAL D 2 169 ? -5.888 -10.716 -38.975 1.00 29.38 ? 169 VAL D O 1 ATOM 6198 C CB . VAL D 2 169 ? -8.491 -9.247 -39.810 1.00 22.53 ? 169 VAL D CB 1 ATOM 6199 C CG1 . VAL D 2 169 ? -7.871 -7.854 -39.734 1.00 20.05 ? 169 VAL D CG1 1 ATOM 6200 C CG2 . VAL D 2 169 ? -9.877 -9.213 -40.429 1.00 17.52 ? 169 VAL D CG2 1 ATOM 6201 N N . HIS D 2 170 ? -5.256 -9.483 -40.737 1.00 13.84 ? 170 HIS D N 1 ATOM 6202 C CA . HIS D 2 170 ? -3.935 -9.169 -40.185 1.00 17.37 ? 170 HIS D CA 1 ATOM 6203 C C . HIS D 2 170 ? -3.714 -7.679 -40.332 1.00 20.03 ? 170 HIS D C 1 ATOM 6204 O O . HIS D 2 170 ? -3.692 -7.148 -41.449 1.00 20.35 ? 170 HIS D O 1 ATOM 6205 C CB . HIS D 2 170 ? -2.786 -9.900 -40.905 1.00 14.32 ? 170 HIS D CB 1 ATOM 6206 C CG . HIS D 2 170 ? -2.882 -11.397 -40.874 1.00 22.18 ? 170 HIS D CG 1 ATOM 6207 N ND1 . HIS D 2 170 ? -2.716 -12.138 -39.720 1.00 20.21 ? 170 HIS D ND1 1 ATOM 6208 C CD2 . HIS D 2 170 ? -3.100 -12.296 -41.865 1.00 20.81 ? 170 HIS D CD2 1 ATOM 6209 C CE1 . HIS D 2 170 ? -2.846 -13.423 -40.000 1.00 19.84 ? 170 HIS D CE1 1 ATOM 6210 N NE2 . HIS D 2 170 ? -3.083 -13.547 -41.295 1.00 22.78 ? 170 HIS D NE2 1 ATOM 6211 N N . THR D 2 171 ? -3.556 -6.988 -39.212 1.00 17.78 ? 171 THR D N 1 ATOM 6212 C CA . THR D 2 171 ? -3.199 -5.587 -39.292 1.00 19.95 ? 171 THR D CA 1 ATOM 6213 C C . THR D 2 171 ? -1.725 -5.429 -38.937 1.00 20.79 ? 171 THR D C 1 ATOM 6214 O O . THR D 2 171 ? -1.307 -5.751 -37.834 1.00 23.60 ? 171 THR D O 1 ATOM 6215 C CB . THR D 2 171 ? -4.105 -4.735 -38.409 1.00 17.73 ? 171 THR D CB 1 ATOM 6216 O OG1 . THR D 2 171 ? -5.448 -4.836 -38.901 1.00 19.67 ? 171 THR D OG1 1 ATOM 6217 C CG2 . THR D 2 171 ? -3.669 -3.280 -38.440 1.00 12.90 ? 171 THR D CG2 1 ATOM 6218 N N . PHE D 2 172 ? -0.930 -4.965 -39.889 1.00 21.67 ? 172 PHE D N 1 ATOM 6219 C CA . PHE D 2 172 ? 0.519 -4.988 -39.706 1.00 24.59 ? 172 PHE D CA 1 ATOM 6220 C C . PHE D 2 172 ? 1.009 -3.877 -38.780 1.00 25.68 ? 172 PHE D C 1 ATOM 6221 O O . PHE D 2 172 ? 0.357 -2.838 -38.639 1.00 26.57 ? 172 PHE D O 1 ATOM 6222 C CB . PHE D 2 172 ? 1.244 -4.959 -41.064 1.00 20.79 ? 172 PHE D CB 1 ATOM 6223 C CG . PHE D 2 172 ? 1.088 -6.233 -41.856 1.00 22.76 ? 172 PHE D CG 1 ATOM 6224 C CD1 . PHE D 2 172 ? 1.998 -7.279 -41.702 1.00 14.70 ? 172 PHE D CD1 1 ATOM 6225 C CD2 . PHE D 2 172 ? 0.014 -6.399 -42.722 1.00 21.88 ? 172 PHE D CD2 1 ATOM 6226 C CE1 . PHE D 2 172 ? 1.858 -8.448 -42.406 1.00 16.17 ? 172 PHE D CE1 1 ATOM 6227 C CE2 . PHE D 2 172 ? -0.135 -7.574 -43.446 1.00 24.29 ? 172 PHE D CE2 1 ATOM 6228 C CZ . PHE D 2 172 ? 0.793 -8.604 -43.288 1.00 23.75 ? 172 PHE D CZ 1 ATOM 6229 N N . PRO D 2 173 ? 2.148 -4.107 -38.117 1.00 21.83 ? 173 PRO D N 1 ATOM 6230 C CA . PRO D 2 173 ? 2.744 -3.013 -37.361 1.00 19.88 ? 173 PRO D CA 1 ATOM 6231 C C . PRO D 2 173 ? 3.074 -1.870 -38.314 1.00 23.09 ? 173 PRO D C 1 ATOM 6232 O O . PRO D 2 173 ? 3.554 -2.133 -39.421 1.00 27.78 ? 173 PRO D O 1 ATOM 6233 C CB . PRO D 2 173 ? 4.042 -3.632 -36.819 1.00 20.16 ? 173 PRO D CB 1 ATOM 6234 C CG . PRO D 2 173 ? 3.798 -5.075 -36.797 1.00 17.61 ? 173 PRO D CG 1 ATOM 6235 C CD . PRO D 2 173 ? 2.916 -5.357 -37.977 1.00 20.42 ? 173 PRO D CD 1 ATOM 6236 N N . ALA D 2 174 ? 2.817 -0.631 -37.899 1.00 21.61 ? 174 ALA D N 1 ATOM 6237 C CA . ALA D 2 174 ? 3.212 0.545 -38.679 1.00 19.96 ? 174 ALA D CA 1 ATOM 6238 C C . ALA D 2 174 ? 4.722 0.579 -38.985 1.00 18.58 ? 174 ALA D C 1 ATOM 6239 O O . ALA D 2 174 ? 5.539 0.123 -38.189 1.00 18.80 ? 174 ALA D O 1 ATOM 6240 C CB . ALA D 2 174 ? 2.811 1.808 -37.940 1.00 16.17 ? 174 ALA D CB 1 ATOM 6241 N N . VAL D 2 175 ? 5.093 1.133 -40.132 1.00 14.28 ? 175 VAL D N 1 ATOM 6242 C CA . VAL D 2 175 ? 6.505 1.359 -40.400 1.00 25.76 ? 175 VAL D CA 1 ATOM 6243 C C . VAL D 2 175 ? 6.725 2.840 -40.468 1.00 22.44 ? 175 VAL D C 1 ATOM 6244 O O . VAL D 2 175 ? 5.858 3.583 -40.957 1.00 22.78 ? 175 VAL D O 1 ATOM 6245 C CB . VAL D 2 175 ? 7.026 0.683 -41.709 1.00 34.16 ? 175 VAL D CB 1 ATOM 6246 C CG1 . VAL D 2 175 ? 6.766 -0.813 -41.678 1.00 37.22 ? 175 VAL D CG1 1 ATOM 6247 C CG2 . VAL D 2 175 ? 6.407 1.318 -42.958 1.00 40.28 ? 175 VAL D CG2 1 ATOM 6248 N N . LEU D 2 176 ? 7.868 3.274 -39.940 1.00 22.30 ? 176 LEU D N 1 ATOM 6249 C CA . LEU D 2 176 ? 8.266 4.659 -40.075 1.00 21.94 ? 176 LEU D CA 1 ATOM 6250 C C . LEU D 2 176 ? 8.962 4.830 -41.419 1.00 23.62 ? 176 LEU D C 1 ATOM 6251 O O . LEU D 2 176 ? 10.017 4.231 -41.666 1.00 20.54 ? 176 LEU D O 1 ATOM 6252 C CB . LEU D 2 176 ? 9.167 5.076 -38.923 1.00 23.83 ? 176 LEU D CB 1 ATOM 6253 C CG . LEU D 2 176 ? 9.588 6.547 -38.891 1.00 29.60 ? 176 LEU D CG 1 ATOM 6254 C CD1 . LEU D 2 176 ? 8.383 7.498 -39.012 1.00 25.27 ? 176 LEU D CD1 1 ATOM 6255 C CD2 . LEU D 2 176 ? 10.380 6.811 -37.618 1.00 18.77 ? 176 LEU D CD2 1 ATOM 6256 N N . GLN D 2 177 ? 8.340 5.618 -42.295 1.00 25.41 ? 177 GLN D N 1 ATOM 6257 C CA . GLN D 2 177 ? 8.897 5.914 -43.615 1.00 24.60 ? 177 GLN D CA 1 ATOM 6258 C C . GLN D 2 177 ? 9.977 6.962 -43.464 1.00 20.73 ? 177 GLN D C 1 ATOM 6259 O O . GLN D 2 177 ? 10.004 7.683 -42.473 1.00 25.81 ? 177 GLN D O 1 ATOM 6260 C CB . GLN D 2 177 ? 7.813 6.437 -44.555 1.00 16.88 ? 177 GLN D CB 1 ATOM 6261 C CG . GLN D 2 177 ? 6.807 5.401 -45.006 1.00 20.81 ? 177 GLN D CG 1 ATOM 6262 C CD . GLN D 2 177 ? 5.498 6.021 -45.481 1.00 25.97 ? 177 GLN D CD 1 ATOM 6263 O OE1 . GLN D 2 177 ? 4.972 5.654 -46.528 1.00 28.97 ? 177 GLN D OE1 1 ATOM 6264 N NE2 . GLN D 2 177 ? 4.960 6.957 -44.698 1.00 25.85 ? 177 GLN D NE2 1 ATOM 6265 N N . SER D 2 178 ? 10.854 7.062 -44.455 1.00 25.49 ? 178 SER D N 1 ATOM 6266 C CA . SER D 2 178 ? 11.984 7.989 -44.396 1.00 28.33 ? 178 SER D CA 1 ATOM 6267 C C . SER D 2 178 ? 11.531 9.446 -44.356 1.00 24.75 ? 178 SER D C 1 ATOM 6268 O O . SER D 2 178 ? 12.316 10.336 -44.039 1.00 25.26 ? 178 SER D O 1 ATOM 6269 C CB . SER D 2 178 ? 12.933 7.761 -45.577 1.00 34.42 ? 178 SER D CB 1 ATOM 6270 O OG . SER D 2 178 ? 12.231 7.784 -46.812 1.00 42.17 ? 178 SER D OG 1 ATOM 6271 N N . SER D 2 179 ? 10.261 9.672 -44.678 1.00 19.95 ? 179 SER D N 1 ATOM 6272 C CA . SER D 2 179 ? 9.657 10.995 -44.640 1.00 19.93 ? 179 SER D CA 1 ATOM 6273 C C . SER D 2 179 ? 9.273 11.377 -43.216 1.00 26.03 ? 179 SER D C 1 ATOM 6274 O O . SER D 2 179 ? 8.789 12.489 -42.982 1.00 24.39 ? 179 SER D O 1 ATOM 6275 C CB . SER D 2 179 ? 8.389 11.000 -45.489 1.00 19.33 ? 179 SER D CB 1 ATOM 6276 O OG . SER D 2 179 ? 7.335 10.321 -44.814 1.00 20.61 ? 179 SER D OG 1 ATOM 6277 N N . GLY D 2 180 ? 9.458 10.448 -42.274 1.00 23.68 ? 180 GLY D N 1 ATOM 6278 C CA . GLY D 2 180 ? 9.098 10.676 -40.883 1.00 18.37 ? 180 GLY D CA 1 ATOM 6279 C C . GLY D 2 180 ? 7.618 10.486 -40.587 1.00 27.26 ? 180 GLY D C 1 ATOM 6280 O O . GLY D 2 180 ? 7.158 10.732 -39.473 1.00 27.31 ? 180 GLY D O 1 ATOM 6281 N N . LEU D 2 181 ? 6.868 10.052 -41.596 1.00 25.89 ? 181 LEU D N 1 ATOM 6282 C CA . LEU D 2 181 ? 5.458 9.738 -41.419 1.00 23.40 ? 181 LEU D CA 1 ATOM 6283 C C . LEU D 2 181 ? 5.285 8.226 -41.340 1.00 20.83 ? 181 LEU D C 1 ATOM 6284 O O . LEU D 2 181 ? 6.093 7.473 -41.897 1.00 19.09 ? 181 LEU D O 1 ATOM 6285 C CB . LEU D 2 181 ? 4.638 10.291 -42.584 1.00 22.30 ? 181 LEU D CB 1 ATOM 6286 C CG . LEU D 2 181 ? 4.687 11.800 -42.835 1.00 22.16 ? 181 LEU D CG 1 ATOM 6287 C CD1 . LEU D 2 181 ? 3.937 12.128 -44.118 1.00 17.10 ? 181 LEU D CD1 1 ATOM 6288 C CD2 . LEU D 2 181 ? 4.107 12.562 -41.646 1.00 16.92 ? 181 LEU D CD2 1 ATOM 6289 N N . TYR D 2 182 ? 4.232 7.780 -40.660 1.00 14.57 ? 182 TYR D N 1 ATOM 6290 C CA . TYR D 2 182 ? 3.956 6.346 -40.560 1.00 16.33 ? 182 TYR D CA 1 ATOM 6291 C C . TYR D 2 182 ? 3.098 5.825 -41.700 1.00 23.08 ? 182 TYR D C 1 ATOM 6292 O O . TYR D 2 182 ? 2.400 6.578 -42.381 1.00 24.44 ? 182 TYR D O 1 ATOM 6293 C CB . TYR D 2 182 ? 3.289 6.007 -39.232 1.00 13.92 ? 182 TYR D CB 1 ATOM 6294 C CG . TYR D 2 182 ? 4.246 6.032 -38.071 1.00 25.52 ? 182 TYR D CG 1 ATOM 6295 C CD1 . TYR D 2 182 ? 5.077 4.950 -37.807 1.00 25.59 ? 182 TYR D CD1 1 ATOM 6296 C CD2 . TYR D 2 182 ? 4.328 7.140 -37.239 1.00 23.25 ? 182 TYR D CD2 1 ATOM 6297 C CE1 . TYR D 2 182 ? 5.961 4.977 -36.743 1.00 27.08 ? 182 TYR D CE1 1 ATOM 6298 C CE2 . TYR D 2 182 ? 5.209 7.172 -36.179 1.00 25.68 ? 182 TYR D CE2 1 ATOM 6299 C CZ . TYR D 2 182 ? 6.018 6.091 -35.935 1.00 32.74 ? 182 TYR D CZ 1 ATOM 6300 O OH . TYR D 2 182 ? 6.892 6.132 -34.879 1.00 45.81 ? 182 TYR D OH 1 ATOM 6301 N N . SER D 2 183 ? 3.149 4.515 -41.879 1.00 22.90 ? 183 SER D N 1 ATOM 6302 C CA . SER D 2 183 ? 2.338 3.842 -42.872 1.00 19.37 ? 183 SER D CA 1 ATOM 6303 C C . SER D 2 183 ? 2.065 2.435 -42.358 1.00 21.68 ? 183 SER D C 1 ATOM 6304 O O . SER D 2 183 ? 2.941 1.817 -41.750 1.00 13.65 ? 183 SER D O 1 ATOM 6305 C CB . SER D 2 183 ? 3.093 3.778 -44.196 1.00 21.98 ? 183 SER D CB 1 ATOM 6306 O OG . SER D 2 183 ? 2.220 3.483 -45.262 1.00 31.35 ? 183 SER D OG 1 ATOM 6307 N N . LEU D 2 184 ? 0.844 1.947 -42.567 1.00 22.16 ? 184 LEU D N 1 ATOM 6308 C CA . LEU D 2 184 ? 0.533 0.542 -42.319 1.00 24.06 ? 184 LEU D CA 1 ATOM 6309 C C . LEU D 2 184 ? -0.512 -0.029 -43.271 1.00 21.91 ? 184 LEU D C 1 ATOM 6310 O O . LEU D 2 184 ? -1.251 0.697 -43.935 1.00 25.02 ? 184 LEU D O 1 ATOM 6311 C CB . LEU D 2 184 ? 0.128 0.272 -40.861 1.00 20.71 ? 184 LEU D CB 1 ATOM 6312 C CG . LEU D 2 184 ? -1.210 0.657 -40.216 1.00 22.87 ? 184 LEU D CG 1 ATOM 6313 C CD1 . LEU D 2 184 ? -2.434 -0.134 -40.718 1.00 21.38 ? 184 LEU D CD1 1 ATOM 6314 C CD2 . LEU D 2 184 ? -1.070 0.460 -38.714 1.00 18.71 ? 184 LEU D CD2 1 ATOM 6315 N N . SER D 2 185 ? -0.561 -1.349 -43.307 1.00 20.32 ? 185 SER D N 1 ATOM 6316 C CA . SER D 2 185 ? -1.524 -2.067 -44.100 1.00 17.57 ? 185 SER D CA 1 ATOM 6317 C C . SER D 2 185 ? -2.281 -3.037 -43.225 1.00 18.15 ? 185 SER D C 1 ATOM 6318 O O . SER D 2 185 ? -1.739 -3.571 -42.247 1.00 14.86 ? 185 SER D O 1 ATOM 6319 C CB . SER D 2 185 ? -0.827 -2.822 -45.219 1.00 16.56 ? 185 SER D CB 1 ATOM 6320 O OG . SER D 2 185 ? -0.666 -1.971 -46.342 1.00 31.42 ? 185 SER D OG 1 ATOM 6321 N N . SER D 2 186 ? -3.547 -3.231 -43.580 1.00 13.50 ? 186 SER D N 1 ATOM 6322 C CA . SER D 2 186 ? -4.384 -4.241 -42.971 1.00 11.58 ? 186 SER D CA 1 ATOM 6323 C C . SER D 2 186 ? -5.006 -5.036 -44.098 1.00 22.72 ? 186 SER D C 1 ATOM 6324 O O . SER D 2 186 ? -5.518 -4.464 -45.058 1.00 11.98 ? 186 SER D O 1 ATOM 6325 C CB . SER D 2 186 ? -5.476 -3.588 -42.134 1.00 12.86 ? 186 SER D CB 1 ATOM 6326 O OG . SER D 2 186 ? -6.416 -4.541 -41.695 1.00 12.09 ? 186 SER D OG 1 ATOM 6327 N N . VAL D 2 187 ? -4.962 -6.357 -43.976 1.00 20.87 ? 187 VAL D N 1 ATOM 6328 C CA . VAL D 2 187 ? -5.440 -7.239 -45.029 1.00 16.53 ? 187 VAL D CA 1 ATOM 6329 C C . VAL D 2 187 ? -6.390 -8.280 -44.459 1.00 21.02 ? 187 VAL D C 1 ATOM 6330 O O . VAL D 2 187 ? -6.410 -8.533 -43.253 1.00 19.89 ? 187 VAL D O 1 ATOM 6331 C CB . VAL D 2 187 ? -4.261 -7.976 -45.707 1.00 16.53 ? 187 VAL D CB 1 ATOM 6332 C CG1 . VAL D 2 187 ? -3.337 -6.985 -46.412 1.00 12.33 ? 187 VAL D CG1 1 ATOM 6333 C CG2 . VAL D 2 187 ? -3.493 -8.807 -44.682 1.00 12.85 ? 187 VAL D CG2 1 ATOM 6334 N N . VAL D 2 188 ? -7.177 -8.892 -45.329 1.00 23.16 ? 188 VAL D N 1 ATOM 6335 C CA . VAL D 2 188 ? -8.045 -9.984 -44.912 1.00 21.22 ? 188 VAL D CA 1 ATOM 6336 C C . VAL D 2 188 ? -8.180 -10.927 -46.098 1.00 13.50 ? 188 VAL D C 1 ATOM 6337 O O . VAL D 2 188 ? -8.152 -10.494 -47.248 1.00 16.38 ? 188 VAL D O 1 ATOM 6338 C CB . VAL D 2 188 ? -9.435 -9.465 -44.409 1.00 22.00 ? 188 VAL D CB 1 ATOM 6339 C CG1 . VAL D 2 188 ? -10.102 -8.615 -45.461 1.00 13.20 ? 188 VAL D CG1 1 ATOM 6340 C CG2 . VAL D 2 188 ? -10.356 -10.620 -43.964 1.00 17.55 ? 188 VAL D CG2 1 ATOM 6341 N N . THR D 2 189 ? -8.265 -12.219 -45.824 1.00 14.11 ? 189 THR D N 1 ATOM 6342 C CA . THR D 2 189 ? -8.539 -13.187 -46.881 1.00 21.56 ? 189 THR D CA 1 ATOM 6343 C C . THR D 2 189 ? -10.007 -13.595 -46.845 1.00 21.31 ? 189 THR D C 1 ATOM 6344 O O . THR D 2 189 ? -10.576 -13.831 -45.780 1.00 25.00 ? 189 THR D O 1 ATOM 6345 C CB . THR D 2 189 ? -7.605 -14.426 -46.814 1.00 19.34 ? 189 THR D CB 1 ATOM 6346 O OG1 . THR D 2 189 ? -7.660 -15.004 -45.502 1.00 19.99 ? 189 THR D OG1 1 ATOM 6347 C CG2 . THR D 2 189 ? -6.177 -14.025 -47.139 1.00 15.24 ? 189 THR D CG2 1 ATOM 6348 N N . VAL D 2 190 ? -10.624 -13.637 -48.018 1.00 21.49 ? 190 VAL D N 1 ATOM 6349 C CA . VAL D 2 190 ? -12.034 -13.962 -48.133 1.00 18.13 ? 190 VAL D CA 1 ATOM 6350 C C . VAL D 2 190 ? -12.236 -14.924 -49.299 1.00 22.34 ? 190 VAL D C 1 ATOM 6351 O O . VAL D 2 190 ? -11.383 -15.011 -50.191 1.00 16.52 ? 190 VAL D O 1 ATOM 6352 C CB . VAL D 2 190 ? -12.890 -12.693 -48.377 1.00 15.62 ? 190 VAL D CB 1 ATOM 6353 C CG1 . VAL D 2 190 ? -12.708 -11.691 -47.255 1.00 15.11 ? 190 VAL D CG1 1 ATOM 6354 C CG2 . VAL D 2 190 ? -12.580 -12.084 -49.729 1.00 15.52 ? 190 VAL D CG2 1 ATOM 6355 N N . PRO D 2 191 ? -13.361 -15.662 -49.293 1.00 17.29 ? 191 PRO D N 1 ATOM 6356 C CA . PRO D 2 191 ? -13.694 -16.460 -50.477 1.00 25.57 ? 191 PRO D CA 1 ATOM 6357 C C . PRO D 2 191 ? -13.873 -15.534 -51.670 1.00 27.74 ? 191 PRO D C 1 ATOM 6358 O O . PRO D 2 191 ? -14.607 -14.543 -51.571 1.00 27.32 ? 191 PRO D O 1 ATOM 6359 C CB . PRO D 2 191 ? -15.028 -17.105 -50.105 1.00 18.94 ? 191 PRO D CB 1 ATOM 6360 C CG . PRO D 2 191 ? -15.075 -17.060 -48.617 1.00 22.01 ? 191 PRO D CG 1 ATOM 6361 C CD . PRO D 2 191 ? -14.339 -15.833 -48.209 1.00 17.71 ? 191 PRO D CD 1 ATOM 6362 N N . SER D 2 192 ? -13.193 -15.838 -52.771 1.00 26.80 ? 192 SER D N 1 ATOM 6363 C CA . SER D 2 192 ? -13.274 -14.998 -53.960 1.00 28.00 ? 192 SER D CA 1 ATOM 6364 C C . SER D 2 192 ? -14.683 -14.940 -54.533 1.00 26.14 ? 192 SER D C 1 ATOM 6365 O O . SER D 2 192 ? -15.054 -13.934 -55.127 1.00 24.25 ? 192 SER D O 1 ATOM 6366 C CB . SER D 2 192 ? -12.265 -15.428 -55.024 1.00 19.23 ? 192 SER D CB 1 ATOM 6367 O OG . SER D 2 192 ? -12.382 -16.795 -55.312 1.00 31.25 ? 192 SER D OG 1 ATOM 6368 N N . SER D 2 193 ? -15.484 -15.985 -54.317 1.00 23.56 ? 193 SER D N 1 ATOM 6369 C CA . SER D 2 193 ? -16.851 -15.989 -54.851 1.00 24.54 ? 193 SER D CA 1 ATOM 6370 C C . SER D 2 193 ? -17.803 -15.063 -54.095 1.00 26.85 ? 193 SER D C 1 ATOM 6371 O O . SER D 2 193 ? -18.985 -14.992 -54.418 1.00 22.12 ? 193 SER D O 1 ATOM 6372 C CB . SER D 2 193 ? -17.443 -17.408 -54.912 1.00 26.98 ? 193 SER D CB 1 ATOM 6373 O OG . SER D 2 193 ? -17.729 -17.934 -53.624 1.00 25.23 ? 193 SER D OG 1 ATOM 6374 N N . SER D 2 194 ? -17.291 -14.356 -53.092 1.00 27.67 ? 194 SER D N 1 ATOM 6375 C CA . SER D 2 194 ? -18.116 -13.452 -52.299 1.00 25.19 ? 194 SER D CA 1 ATOM 6376 C C . SER D 2 194 ? -17.804 -11.978 -52.591 1.00 26.06 ? 194 SER D C 1 ATOM 6377 O O . SER D 2 194 ? -18.505 -11.078 -52.124 1.00 28.69 ? 194 SER D O 1 ATOM 6378 C CB . SER D 2 194 ? -17.940 -13.749 -50.811 1.00 22.33 ? 194 SER D CB 1 ATOM 6379 O OG . SER D 2 194 ? -16.601 -13.511 -50.411 1.00 31.15 ? 194 SER D OG 1 ATOM 6380 N N . LEU D 2 195 ? -16.764 -11.739 -53.383 1.00 25.52 ? 195 LEU D N 1 ATOM 6381 C CA . LEU D 2 195 ? -16.360 -10.384 -53.757 1.00 28.17 ? 195 LEU D CA 1 ATOM 6382 C C . LEU D 2 195 ? -17.457 -9.574 -54.452 1.00 33.64 ? 195 LEU D C 1 ATOM 6383 O O . LEU D 2 195 ? -17.351 -8.352 -54.581 1.00 39.19 ? 195 LEU D O 1 ATOM 6384 C CB . LEU D 2 195 ? -15.121 -10.435 -54.651 1.00 26.15 ? 195 LEU D CB 1 ATOM 6385 C CG . LEU D 2 195 ? -13.853 -10.924 -53.953 1.00 26.78 ? 195 LEU D CG 1 ATOM 6386 C CD1 . LEU D 2 195 ? -12.652 -10.933 -54.902 1.00 17.77 ? 195 LEU D CD1 1 ATOM 6387 C CD2 . LEU D 2 195 ? -13.588 -10.062 -52.721 1.00 23.97 ? 195 LEU D CD2 1 ATOM 6388 N N . GLY D 2 196 ? -18.507 -10.255 -54.895 1.00 36.08 ? 196 GLY D N 1 ATOM 6389 C CA . GLY D 2 196 ? -19.542 -9.625 -55.687 1.00 39.97 ? 196 GLY D CA 1 ATOM 6390 C C . GLY D 2 196 ? -20.760 -9.191 -54.899 1.00 46.45 ? 196 GLY D C 1 ATOM 6391 O O . GLY D 2 196 ? -21.327 -8.133 -55.177 1.00 49.85 ? 196 GLY D O 1 ATOM 6392 N N . THR D 2 197 ? -21.153 -9.998 -53.914 1.00 46.02 ? 197 THR D N 1 ATOM 6393 C CA . THR D 2 197 ? -22.370 -9.751 -53.142 1.00 42.48 ? 197 THR D CA 1 ATOM 6394 C C . THR D 2 197 ? -22.138 -9.220 -51.726 1.00 32.93 ? 197 THR D C 1 ATOM 6395 O O . THR D 2 197 ? -23.025 -8.598 -51.138 1.00 28.92 ? 197 THR D O 1 ATOM 6396 C CB . THR D 2 197 ? -23.220 -11.023 -53.050 1.00 44.86 ? 197 THR D CB 1 ATOM 6397 O OG1 . THR D 2 197 ? -22.380 -12.131 -52.691 1.00 36.47 ? 197 THR D OG1 1 ATOM 6398 C CG2 . THR D 2 197 ? -23.895 -11.298 -54.392 1.00 47.22 ? 197 THR D CG2 1 ATOM 6399 N N . GLN D 2 198 ? -20.957 -9.475 -51.176 1.00 29.26 ? 198 GLN D N 1 ATOM 6400 C CA . GLN D 2 198 ? -20.651 -9.059 -49.809 1.00 31.24 ? 198 GLN D CA 1 ATOM 6401 C C . GLN D 2 198 ? -19.727 -7.850 -49.830 1.00 27.80 ? 198 GLN D C 1 ATOM 6402 O O . GLN D 2 198 ? -18.711 -7.872 -50.516 1.00 30.74 ? 198 GLN D O 1 ATOM 6403 C CB . GLN D 2 198 ? -19.991 -10.217 -49.050 1.00 32.90 ? 198 GLN D CB 1 ATOM 6404 C CG . GLN D 2 198 ? -19.405 -9.836 -47.696 1.00 39.54 ? 198 GLN D CG 1 ATOM 6405 C CD . GLN D 2 198 ? -20.474 -9.619 -46.635 1.00 45.77 ? 198 GLN D CD 1 ATOM 6406 O OE1 . GLN D 2 198 ? -20.603 -8.526 -46.074 1.00 42.75 ? 198 GLN D OE1 1 ATOM 6407 N NE2 . GLN D 2 198 ? -21.246 -10.665 -46.355 1.00 46.94 ? 198 GLN D NE2 1 ATOM 6408 N N . THR D 2 199 ? -20.068 -6.790 -49.100 1.00 25.26 ? 199 THR D N 1 ATOM 6409 C CA . THR D 2 199 ? -19.192 -5.624 -49.081 1.00 24.79 ? 199 THR D CA 1 ATOM 6410 C C . THR D 2 199 ? -18.150 -5.711 -47.978 1.00 26.70 ? 199 THR D C 1 ATOM 6411 O O . THR D 2 199 ? -18.448 -6.105 -46.850 1.00 24.23 ? 199 THR D O 1 ATOM 6412 C CB . THR D 2 199 ? -19.943 -4.295 -48.934 1.00 28.94 ? 199 THR D CB 1 ATOM 6413 O OG1 . THR D 2 199 ? -20.426 -4.156 -47.590 1.00 30.26 ? 199 THR D OG1 1 ATOM 6414 C CG2 . THR D 2 199 ? -21.087 -4.204 -49.939 1.00 27.62 ? 199 THR D CG2 1 ATOM 6415 N N . TYR D 2 200 ? -16.923 -5.336 -48.325 1.00 24.25 ? 200 TYR D N 1 ATOM 6416 C CA . TYR D 2 200 ? -15.813 -5.352 -47.388 1.00 22.41 ? 200 TYR D CA 1 ATOM 6417 C C . TYR D 2 200 ? -15.317 -3.938 -47.162 1.00 23.11 ? 200 TYR D C 1 ATOM 6418 O O . TYR D 2 200 ? -14.925 -3.232 -48.095 1.00 24.11 ? 200 TYR D O 1 ATOM 6419 C CB . TYR D 2 200 ? -14.697 -6.257 -47.897 1.00 15.64 ? 200 TYR D CB 1 ATOM 6420 C CG . TYR D 2 200 ? -15.114 -7.707 -47.967 1.00 17.95 ? 200 TYR D CG 1 ATOM 6421 C CD1 . TYR D 2 200 ? -15.225 -8.470 -46.806 1.00 16.28 ? 200 TYR D CD1 1 ATOM 6422 C CD2 . TYR D 2 200 ? -15.389 -8.313 -49.184 1.00 16.35 ? 200 TYR D CD2 1 ATOM 6423 C CE1 . TYR D 2 200 ? -15.607 -9.793 -46.852 1.00 23.08 ? 200 TYR D CE1 1 ATOM 6424 C CE2 . TYR D 2 200 ? -15.768 -9.636 -49.248 1.00 19.46 ? 200 TYR D CE2 1 ATOM 6425 C CZ . TYR D 2 200 ? -15.882 -10.370 -48.079 1.00 27.94 ? 200 TYR D CZ 1 ATOM 6426 O OH . TYR D 2 200 ? -16.268 -11.684 -48.133 1.00 25.75 ? 200 TYR D OH 1 ATOM 6427 N N . ILE D 2 201 ? -15.367 -3.518 -45.910 1.00 20.23 ? 201 ILE D N 1 ATOM 6428 C CA . ILE D 2 201 ? -15.054 -2.150 -45.566 1.00 21.56 ? 201 ILE D CA 1 ATOM 6429 C C . ILE D 2 201 ? -14.029 -2.119 -44.458 1.00 20.59 ? 201 ILE D C 1 ATOM 6430 O O . ILE D 2 201 ? -14.193 -2.780 -43.438 1.00 22.22 ? 201 ILE D O 1 ATOM 6431 C CB . ILE D 2 201 ? -16.317 -1.449 -45.078 1.00 27.37 ? 201 ILE D CB 1 ATOM 6432 C CG1 . ILE D 2 201 ? -17.352 -1.446 -46.195 1.00 19.20 ? 201 ILE D CG1 1 ATOM 6433 C CG2 . ILE D 2 201 ? -16.011 -0.018 -44.593 1.00 20.86 ? 201 ILE D CG2 1 ATOM 6434 C CD1 . ILE D 2 201 ? -18.561 -0.739 -45.796 1.00 24.87 ? 201 ILE D CD1 1 ATOM 6435 N N . CYS D 2 202 ? -12.960 -1.366 -44.647 1.00 24.16 ? 202 CYS D N 1 ATOM 6436 C CA . CYS D 2 202 ? -12.056 -1.167 -43.536 1.00 21.43 ? 202 CYS D CA 1 ATOM 6437 C C . CYS D 2 202 ? -12.426 0.134 -42.836 1.00 22.47 ? 202 CYS D C 1 ATOM 6438 O O . CYS D 2 202 ? -12.661 1.162 -43.483 1.00 19.73 ? 202 CYS D O 1 ATOM 6439 C CB . CYS D 2 202 ? -10.588 -1.178 -43.978 1.00 23.05 ? 202 CYS D CB 1 ATOM 6440 S SG . CYS D 2 202 ? -10.065 0.265 -44.926 1.00 27.35 ? 202 CYS D SG 1 ATOM 6441 N N . ASN D 2 203 ? -12.501 0.068 -41.512 1.00 15.71 ? 203 ASN D N 1 ATOM 6442 C CA . ASN D 2 203 ? -12.789 1.240 -40.693 1.00 23.88 ? 203 ASN D CA 1 ATOM 6443 C C . ASN D 2 203 ? -11.518 1.771 -40.071 1.00 24.07 ? 203 ASN D C 1 ATOM 6444 O O . ASN D 2 203 ? -10.971 1.174 -39.146 1.00 25.37 ? 203 ASN D O 1 ATOM 6445 C CB . ASN D 2 203 ? -13.809 0.890 -39.612 1.00 21.03 ? 203 ASN D CB 1 ATOM 6446 C CG . ASN D 2 203 ? -14.880 -0.050 -40.128 1.00 26.57 ? 203 ASN D CG 1 ATOM 6447 O OD1 . ASN D 2 203 ? -14.836 -1.261 -39.881 1.00 22.12 ? 203 ASN D OD1 1 ATOM 6448 N ND2 . ASN D 2 203 ? -15.832 0.497 -40.885 1.00 27.45 ? 203 ASN D ND2 1 ATOM 6449 N N . VAL D 2 204 ? -11.044 2.895 -40.585 1.00 22.57 ? 204 VAL D N 1 ATOM 6450 C CA . VAL D 2 204 ? -9.779 3.433 -40.136 1.00 19.04 ? 204 VAL D CA 1 ATOM 6451 C C . VAL D 2 204 ? -10.022 4.607 -39.208 1.00 23.94 ? 204 VAL D C 1 ATOM 6452 O O . VAL D 2 204 ? -10.798 5.502 -39.518 1.00 23.44 ? 204 VAL D O 1 ATOM 6453 C CB . VAL D 2 204 ? -8.913 3.863 -41.322 1.00 19.88 ? 204 VAL D CB 1 ATOM 6454 C CG1 . VAL D 2 204 ? -7.619 4.564 -40.841 1.00 17.68 ? 204 VAL D CG1 1 ATOM 6455 C CG2 . VAL D 2 204 ? -8.611 2.655 -42.202 1.00 13.69 ? 204 VAL D CG2 1 ATOM 6456 N N . ASN D 2 205 ? -9.350 4.601 -38.064 1.00 20.45 ? 205 ASN D N 1 ATOM 6457 C CA . ASN D 2 205 ? -9.518 5.670 -37.104 1.00 24.33 ? 205 ASN D CA 1 ATOM 6458 C C . ASN D 2 205 ? -8.153 6.114 -36.619 1.00 27.63 ? 205 ASN D C 1 ATOM 6459 O O . ASN D 2 205 ? -7.420 5.334 -36.003 1.00 32.64 ? 205 ASN D O 1 ATOM 6460 C CB . ASN D 2 205 ? -10.413 5.221 -35.935 1.00 23.26 ? 205 ASN D CB 1 ATOM 6461 C CG . ASN D 2 205 ? -10.807 6.374 -35.009 1.00 32.12 ? 205 ASN D CG 1 ATOM 6462 O OD1 . ASN D 2 205 ? -10.387 7.520 -35.195 1.00 28.67 ? 205 ASN D OD1 1 ATOM 6463 N ND2 . ASN D 2 205 ? -11.631 6.071 -34.014 1.00 38.47 ? 205 ASN D ND2 1 ATOM 6464 N N . HIS D 2 206 ? -7.806 7.357 -36.934 1.00 24.15 ? 206 HIS D N 1 ATOM 6465 C CA . HIS D 2 206 ? -6.593 7.969 -36.423 1.00 20.27 ? 206 HIS D CA 1 ATOM 6466 C C . HIS D 2 206 ? -7.012 9.015 -35.427 1.00 27.06 ? 206 HIS D C 1 ATOM 6467 O O . HIS D 2 206 ? -7.252 10.169 -35.790 1.00 29.03 ? 206 HIS D O 1 ATOM 6468 C CB . HIS D 2 206 ? -5.807 8.642 -37.537 1.00 19.72 ? 206 HIS D CB 1 ATOM 6469 C CG . HIS D 2 206 ? -4.496 9.212 -37.085 1.00 20.96 ? 206 HIS D CG 1 ATOM 6470 N ND1 . HIS D 2 206 ? -4.150 10.529 -37.282 1.00 19.16 ? 206 HIS D ND1 1 ATOM 6471 C CD2 . HIS D 2 206 ? -3.446 8.636 -36.449 1.00 16.67 ? 206 HIS D CD2 1 ATOM 6472 C CE1 . HIS D 2 206 ? -2.942 10.743 -36.785 1.00 18.74 ? 206 HIS D CE1 1 ATOM 6473 N NE2 . HIS D 2 206 ? -2.494 9.611 -36.274 1.00 16.72 ? 206 HIS D NE2 1 ATOM 6474 N N . LYS D 2 207 ? -7.118 8.607 -34.172 1.00 28.18 ? 207 LYS D N 1 ATOM 6475 C CA . LYS D 2 207 ? -7.594 9.502 -33.122 1.00 24.84 ? 207 LYS D CA 1 ATOM 6476 C C . LYS D 2 207 ? -6.819 10.819 -32.959 1.00 26.10 ? 207 LYS D C 1 ATOM 6477 O O . LYS D 2 207 ? -7.446 11.875 -32.877 1.00 32.68 ? 207 LYS D O 1 ATOM 6478 C CB . LYS D 2 207 ? -7.753 8.748 -31.800 1.00 23.69 ? 207 LYS D CB 1 ATOM 6479 C CG . LYS D 2 207 ? -8.909 7.784 -31.835 1.00 28.54 ? 207 LYS D CG 1 ATOM 6480 C CD . LYS D 2 207 ? -9.058 7.056 -30.527 1.00 41.77 ? 207 LYS D CD 1 ATOM 6481 C CE . LYS D 2 207 ? -10.364 6.288 -30.485 1.00 44.33 ? 207 LYS D CE 1 ATOM 6482 N NZ . LYS D 2 207 ? -10.521 5.632 -29.164 1.00 52.77 ? 207 LYS D NZ 1 ATOM 6483 N N . PRO D 2 208 ? -5.467 10.777 -32.958 1.00 24.39 ? 208 PRO D N 1 ATOM 6484 C CA . PRO D 2 208 ? -4.730 12.030 -32.741 1.00 22.37 ? 208 PRO D CA 1 ATOM 6485 C C . PRO D 2 208 ? -5.113 13.175 -33.672 1.00 23.10 ? 208 PRO D C 1 ATOM 6486 O O . PRO D 2 208 ? -4.970 14.333 -33.284 1.00 25.38 ? 208 PRO D O 1 ATOM 6487 C CB . PRO D 2 208 ? -3.277 11.617 -32.963 1.00 25.86 ? 208 PRO D CB 1 ATOM 6488 C CG . PRO D 2 208 ? -3.242 10.188 -32.538 1.00 25.78 ? 208 PRO D CG 1 ATOM 6489 C CD . PRO D 2 208 ? -4.550 9.623 -33.032 1.00 22.69 ? 208 PRO D CD 1 ATOM 6490 N N . SER D 2 209 ? -5.614 12.860 -34.863 1.00 26.17 ? 209 SER D N 1 ATOM 6491 C CA . SER D 2 209 ? -6.032 13.879 -35.827 1.00 27.42 ? 209 SER D CA 1 ATOM 6492 C C . SER D 2 209 ? -7.556 13.916 -35.998 1.00 30.30 ? 209 SER D C 1 ATOM 6493 O O . SER D 2 209 ? -8.069 14.582 -36.911 1.00 25.46 ? 209 SER D O 1 ATOM 6494 C CB . SER D 2 209 ? -5.416 13.579 -37.191 1.00 20.25 ? 209 SER D CB 1 ATOM 6495 O OG . SER D 2 209 ? -5.859 12.316 -37.664 1.00 24.17 ? 209 SER D OG 1 ATOM 6496 N N . ASN D 2 210 ? -8.270 13.185 -35.142 1.00 26.94 ? 210 ASN D N 1 ATOM 6497 C CA . ASN D 2 210 ? -9.709 12.947 -35.347 1.00 37.21 ? 210 ASN D CA 1 ATOM 6498 C C . ASN D 2 210 ? -10.093 12.617 -36.796 1.00 32.48 ? 210 ASN D C 1 ATOM 6499 O O . ASN D 2 210 ? -11.081 13.129 -37.318 1.00 37.57 ? 210 ASN D O 1 ATOM 6500 C CB . ASN D 2 210 ? -10.544 14.121 -34.830 1.00 42.23 ? 210 ASN D CB 1 ATOM 6501 C CG . ASN D 2 210 ? -10.181 14.505 -33.409 1.00 51.40 ? 210 ASN D CG 1 ATOM 6502 O OD1 . ASN D 2 210 ? -10.346 13.711 -32.477 1.00 52.34 ? 210 ASN D OD1 1 ATOM 6503 N ND2 . ASN D 2 210 ? -9.674 15.724 -33.235 1.00 54.10 ? 210 ASN D ND2 1 ATOM 6504 N N . THR D 2 211 ? -9.299 11.769 -37.442 1.00 22.40 ? 211 THR D N 1 ATOM 6505 C CA . THR D 2 211 ? -9.595 11.359 -38.806 1.00 26.49 ? 211 THR D CA 1 ATOM 6506 C C . THR D 2 211 ? -10.218 9.974 -38.814 1.00 26.59 ? 211 THR D C 1 ATOM 6507 O O . THR D 2 211 ? -9.595 9.004 -38.364 1.00 23.42 ? 211 THR D O 1 ATOM 6508 C CB . THR D 2 211 ? -8.331 11.341 -39.680 1.00 25.54 ? 211 THR D CB 1 ATOM 6509 O OG1 . THR D 2 211 ? -7.688 12.619 -39.623 1.00 27.33 ? 211 THR D OG1 1 ATOM 6510 C CG2 . THR D 2 211 ? -8.686 11.020 -41.119 1.00 19.90 ? 211 THR D CG2 1 ATOM 6511 N N . LYS D 2 212 ? -11.452 9.895 -39.311 1.00 23.60 ? 212 LYS D N 1 ATOM 6512 C CA . LYS D 2 212 ? -12.133 8.615 -39.502 1.00 22.56 ? 212 LYS D CA 1 ATOM 6513 C C . LYS D 2 212 ? -12.488 8.391 -40.968 1.00 24.15 ? 212 LYS D C 1 ATOM 6514 O O . LYS D 2 212 ? -13.117 9.229 -41.608 1.00 21.78 ? 212 LYS D O 1 ATOM 6515 C CB . LYS D 2 212 ? -13.400 8.520 -38.651 1.00 27.46 ? 212 LYS D CB 1 ATOM 6516 C CG . LYS D 2 212 ? -13.186 7.889 -37.286 1.00 34.21 ? 212 LYS D CG 1 ATOM 6517 C CD . LYS D 2 212 ? -14.509 7.711 -36.570 1.00 28.04 ? 212 LYS D CD 1 ATOM 6518 C CE . LYS D 2 212 ? -15.186 9.064 -36.375 1.00 29.26 ? 212 LYS D CE 1 ATOM 6519 N NZ . LYS D 2 212 ? -16.644 8.954 -36.028 1.00 35.29 ? 212 LYS D NZ 1 ATOM 6520 N N . VAL D 2 213 ? -12.068 7.250 -41.492 1.00 20.98 ? 213 VAL D N 1 ATOM 6521 C CA . VAL D 2 213 ? -12.354 6.879 -42.863 1.00 24.64 ? 213 VAL D CA 1 ATOM 6522 C C . VAL D 2 213 ? -12.876 5.445 -42.937 1.00 26.46 ? 213 VAL D C 1 ATOM 6523 O O . VAL D 2 213 ? -12.246 4.520 -42.420 1.00 20.48 ? 213 VAL D O 1 ATOM 6524 C CB . VAL D 2 213 ? -11.097 7.014 -43.755 1.00 22.28 ? 213 VAL D CB 1 ATOM 6525 C CG1 . VAL D 2 213 ? -11.441 6.716 -45.219 1.00 17.87 ? 213 VAL D CG1 1 ATOM 6526 C CG2 . VAL D 2 213 ? -10.494 8.413 -43.615 1.00 18.27 ? 213 VAL D CG2 1 ATOM 6527 N N . ASP D 2 214 ? -14.041 5.280 -43.564 1.00 19.36 ? 214 ASP D N 1 ATOM 6528 C CA . ASP D 2 214 ? -14.546 3.965 -43.943 1.00 18.99 ? 214 ASP D CA 1 ATOM 6529 C C . ASP D 2 214 ? -14.312 3.761 -45.433 1.00 21.22 ? 214 ASP D C 1 ATOM 6530 O O . ASP D 2 214 ? -14.868 4.487 -46.262 1.00 19.72 ? 214 ASP D O 1 ATOM 6531 C CB . ASP D 2 214 ? -16.044 3.836 -43.656 1.00 20.66 ? 214 ASP D CB 1 ATOM 6532 C CG . ASP D 2 214 ? -16.362 3.833 -42.172 1.00 26.92 ? 214 ASP D CG 1 ATOM 6533 O OD1 . ASP D 2 214 ? -15.665 3.123 -41.422 1.00 20.31 ? 214 ASP D OD1 1 ATOM 6534 O OD2 . ASP D 2 214 ? -17.316 4.529 -41.764 1.00 23.22 ? 214 ASP D OD2 1 ATOM 6535 N N . LYS D 2 215 ? -13.519 2.751 -45.769 1.00 17.21 ? 215 LYS D N 1 ATOM 6536 C CA . LYS D 2 215 ? -13.124 2.510 -47.151 1.00 20.87 ? 215 LYS D CA 1 ATOM 6537 C C . LYS D 2 215 ? -13.632 1.170 -47.667 1.00 19.54 ? 215 LYS D C 1 ATOM 6538 O O . LYS D 2 215 ? -13.293 0.116 -47.115 1.00 18.10 ? 215 LYS D O 1 ATOM 6539 C CB . LYS D 2 215 ? -11.592 2.538 -47.276 1.00 18.24 ? 215 LYS D CB 1 ATOM 6540 C CG . LYS D 2 215 ? -11.084 2.246 -48.688 1.00 22.26 ? 215 LYS D CG 1 ATOM 6541 C CD . LYS D 2 215 ? -11.221 3.470 -49.567 1.00 24.35 ? 215 LYS D CD 1 ATOM 6542 C CE . LYS D 2 215 ? -10.944 3.187 -51.027 1.00 24.61 ? 215 LYS D CE 1 ATOM 6543 N NZ . LYS D 2 215 ? -11.028 4.459 -51.821 1.00 30.04 ? 215 LYS D NZ 1 ATOM 6544 N N . ARG D 2 216 ? -14.416 1.200 -48.742 1.00 17.77 ? 216 ARG D N 1 ATOM 6545 C CA . ARG D 2 216 ? -14.779 -0.046 -49.405 1.00 20.41 ? 216 ARG D CA 1 ATOM 6546 C C . ARG D 2 216 ? -13.670 -0.511 -50.332 1.00 17.79 ? 216 ARG D C 1 ATOM 6547 O O . ARG D 2 216 ? -13.071 0.280 -51.062 1.00 26.54 ? 216 ARG D O 1 ATOM 6548 C CB . ARG D 2 216 ? -16.080 0.071 -50.195 1.00 26.79 ? 216 ARG D CB 1 ATOM 6549 C CG . ARG D 2 216 ? -16.596 -1.298 -50.586 1.00 19.32 ? 216 ARG D CG 1 ATOM 6550 C CD . ARG D 2 216 ? -17.619 -1.272 -51.670 1.00 26.92 ? 216 ARG D CD 1 ATOM 6551 N NE . ARG D 2 216 ? -17.909 -2.635 -52.106 1.00 33.74 ? 216 ARG D NE 1 ATOM 6552 C CZ . ARG D 2 216 ? -18.893 -2.964 -52.936 1.00 30.02 ? 216 ARG D CZ 1 ATOM 6553 N NH1 . ARG D 2 216 ? -19.694 -2.028 -53.418 1.00 29.02 ? 216 ARG D NH1 1 ATOM 6554 N NH2 . ARG D 2 216 ? -19.078 -4.231 -53.271 1.00 27.23 ? 216 ARG D NH2 1 ATOM 6555 N N . VAL D 2 217 ? -13.397 -1.805 -50.293 1.00 17.85 ? 217 VAL D N 1 ATOM 6556 C CA . VAL D 2 217 ? -12.326 -2.376 -51.080 1.00 15.67 ? 217 VAL D CA 1 ATOM 6557 C C . VAL D 2 217 ? -12.935 -3.485 -51.906 1.00 20.12 ? 217 VAL D C 1 ATOM 6558 O O . VAL D 2 217 ? -13.563 -4.387 -51.356 1.00 21.45 ? 217 VAL D O 1 ATOM 6559 C CB . VAL D 2 217 ? -11.241 -2.931 -50.164 1.00 17.08 ? 217 VAL D CB 1 ATOM 6560 C CG1 . VAL D 2 217 ? -10.174 -3.677 -50.962 1.00 14.24 ? 217 VAL D CG1 1 ATOM 6561 C CG2 . VAL D 2 217 ? -10.632 -1.791 -49.361 1.00 14.11 ? 217 VAL D CG2 1 ATOM 6562 N N . GLU D 2 218 ? -12.792 -3.419 -53.230 1.00 17.14 ? 218 GLU D N 1 ATOM 6563 C CA . GLU D 2 218 ? -13.431 -4.382 -54.105 1.00 26.47 ? 218 GLU D CA 1 ATOM 6564 C C . GLU D 2 218 ? -12.529 -4.573 -55.343 1.00 30.05 ? 218 GLU D C 1 ATOM 6565 O O . GLU D 2 218 ? -11.608 -3.793 -55.541 1.00 32.37 ? 218 GLU D O 1 ATOM 6566 C CB . GLU D 2 218 ? -14.828 -3.924 -54.528 1.00 25.47 ? 218 GLU D CB 1 ATOM 6567 C CG . GLU D 2 218 ? -14.842 -2.628 -55.296 1.00 31.51 ? 218 GLU D CG 1 ATOM 6568 C CD . GLU D 2 218 ? -16.252 -2.154 -55.584 1.00 40.55 ? 218 GLU D CD 1 ATOM 6569 O OE1 . GLU D 2 218 ? -16.527 -0.947 -55.428 1.00 43.97 ? 218 GLU D OE1 1 ATOM 6570 O OE2 . GLU D 2 218 ? -17.095 -2.995 -55.949 1.00 49.28 ? 218 GLU D OE2 1 ATOM 6571 N N . PRO D 2 219 ? -12.783 -5.615 -56.147 1.00 33.76 ? 219 PRO D N 1 ATOM 6572 C CA . PRO D 2 219 ? -11.929 -5.775 -57.330 1.00 36.67 ? 219 PRO D CA 1 ATOM 6573 C C . PRO D 2 219 ? -12.140 -4.673 -58.360 1.00 36.86 ? 219 PRO D C 1 ATOM 6574 O O . PRO D 2 219 ? -13.273 -4.237 -58.596 1.00 33.77 ? 219 PRO D O 1 ATOM 6575 C CB . PRO D 2 219 ? -12.365 -7.131 -57.910 1.00 32.37 ? 219 PRO D CB 1 ATOM 6576 C CG . PRO D 2 219 ? -13.707 -7.408 -57.315 1.00 31.63 ? 219 PRO D CG 1 ATOM 6577 C CD . PRO D 2 219 ? -13.667 -6.779 -55.950 1.00 36.89 ? 219 PRO D CD 1 ATOM 6578 N N . LYS D 2 220 ? -11.043 -4.224 -58.969 1.00 35.91 ? 220 LYS D N 1 ATOM 6579 C CA . LYS D 2 220 ? -11.089 -3.131 -59.945 1.00 42.73 ? 220 LYS D CA 1 ATOM 6580 C C . LYS D 2 220 ? -11.529 -3.567 -61.350 1.00 37.86 ? 220 LYS D C 1 ATOM 6581 O O . LYS D 2 220 ? -11.611 -4.760 -61.650 1.00 35.66 ? 220 LYS D O 1 ATOM 6582 C CB . LYS D 2 220 ? -9.730 -2.425 -60.017 1.00 48.15 ? 220 LYS D CB 1 ATOM 6583 C CG . LYS D 2 220 ? -9.740 -1.130 -60.819 1.00 50.07 ? 220 LYS D CG 1 ATOM 6584 C CD . LYS D 2 220 ? -8.416 -0.927 -61.550 1.00 53.14 ? 220 LYS D CD 1 ATOM 6585 C CE . LYS D 2 220 ? -8.003 0.534 -61.548 1.00 56.50 ? 220 LYS D CE 1 ATOM 6586 N NZ . LYS D 2 220 ? -7.742 1.018 -60.149 1.00 57.43 ? 220 LYS D NZ 1 ATOM 6587 N N . CYS E 3 1 ? 14.987 -32.259 -28.598 1.00 45.22 ? 1 CYS E N 1 ATOM 6588 C CA . CYS E 3 1 ? 16.328 -32.545 -29.108 1.00 44.10 ? 1 CYS E CA 1 ATOM 6589 C C . CYS E 3 1 ? 16.808 -33.926 -28.666 1.00 44.82 ? 1 CYS E C 1 ATOM 6590 O O . CYS E 3 1 ? 16.451 -34.400 -27.588 1.00 54.01 ? 1 CYS E O 1 ATOM 6591 C CB . CYS E 3 1 ? 17.341 -31.502 -28.627 1.00 47.18 ? 1 CYS E CB 1 ATOM 6592 S SG . CYS E 3 1 ? 17.017 -29.753 -28.963 1.00 50.36 ? 1 CYS E SG 1 ATOM 6593 N N . GLN E 3 2 ? 17.641 -34.558 -29.490 1.00 42.09 ? 2 GLN E N 1 ATOM 6594 C CA . GLN E 3 2 ? 18.242 -35.846 -29.171 1.00 37.47 ? 2 GLN E CA 1 ATOM 6595 C C . GLN E 3 2 ? 19.748 -35.787 -29.367 1.00 35.95 ? 2 GLN E C 1 ATOM 6596 O O . GLN E 3 2 ? 20.242 -35.180 -30.325 1.00 33.77 ? 2 GLN E O 1 ATOM 6597 C CB . GLN E 3 2 ? 17.672 -36.979 -30.030 1.00 32.62 ? 2 GLN E CB 1 ATOM 6598 C CG . GLN E 3 2 ? 16.427 -37.602 -29.450 1.00 47.25 ? 2 GLN E CG 1 ATOM 6599 C CD . GLN E 3 2 ? 16.252 -39.042 -29.881 1.00 59.10 ? 2 GLN E CD 1 ATOM 6600 O OE1 . GLN E 3 2 ? 16.930 -39.515 -30.799 1.00 56.21 ? 2 GLN E OE1 1 ATOM 6601 N NE2 . GLN E 3 2 ? 15.341 -39.753 -29.214 1.00 62.37 ? 2 GLN E NE2 1 ATOM 6602 N N . PHE E 3 3 ? 20.465 -36.428 -28.449 1.00 28.77 ? 3 PHE E N 1 ATOM 6603 C CA . PHE E 3 3 ? 21.902 -36.595 -28.590 1.00 26.80 ? 3 PHE E CA 1 ATOM 6604 C C . PHE E 3 3 ? 22.221 -37.365 -29.865 1.00 27.63 ? 3 PHE E C 1 ATOM 6605 O O . PHE E 3 3 ? 21.577 -38.371 -30.179 1.00 23.03 ? 3 PHE E O 1 ATOM 6606 C CB . PHE E 3 3 ? 22.458 -37.334 -27.373 1.00 23.55 ? 3 PHE E CB 1 ATOM 6607 C CG . PHE E 3 3 ? 23.941 -37.534 -27.408 1.00 24.24 ? 3 PHE E CG 1 ATOM 6608 C CD1 . PHE E 3 3 ? 24.808 -36.476 -27.131 1.00 22.76 ? 3 PHE E CD1 1 ATOM 6609 C CD2 . PHE E 3 3 ? 24.477 -38.787 -27.694 1.00 24.69 ? 3 PHE E CD2 1 ATOM 6610 C CE1 . PHE E 3 3 ? 26.188 -36.665 -27.146 1.00 20.53 ? 3 PHE E CE1 1 ATOM 6611 C CE2 . PHE E 3 3 ? 25.854 -38.988 -27.715 1.00 21.66 ? 3 PHE E CE2 1 ATOM 6612 C CZ . PHE E 3 3 ? 26.710 -37.929 -27.443 1.00 20.24 ? 3 PHE E CZ 1 ATOM 6613 N N . ASP E 3 4 ? 23.228 -36.887 -30.596 1.00 22.63 ? 4 ASP E N 1 ATOM 6614 C CA . ASP E 3 4 ? 23.652 -37.483 -31.859 1.00 22.46 ? 4 ASP E CA 1 ATOM 6615 C C . ASP E 3 4 ? 25.018 -38.132 -31.663 1.00 23.12 ? 4 ASP E C 1 ATOM 6616 O O . ASP E 3 4 ? 25.983 -37.449 -31.301 1.00 20.17 ? 4 ASP E O 1 ATOM 6617 C CB . ASP E 3 4 ? 23.696 -36.419 -32.956 1.00 26.01 ? 4 ASP E CB 1 ATOM 6618 C CG . ASP E 3 4 ? 24.143 -36.964 -34.295 1.00 29.62 ? 4 ASP E CG 1 ATOM 6619 O OD1 . ASP E 3 4 ? 24.255 -38.198 -34.450 1.00 37.52 ? 4 ASP E OD1 1 ATOM 6620 O OD2 . ASP E 3 4 ? 24.372 -36.144 -35.206 1.00 34.53 ? 4 ASP E OD2 1 ATOM 6621 N N . LEU E 3 5 ? 25.096 -39.444 -31.919 1.00 19.74 ? 5 LEU E N 1 ATOM 6622 C CA . LEU E 3 5 ? 26.344 -40.183 -31.731 1.00 18.59 ? 5 LEU E CA 1 ATOM 6623 C C . LEU E 3 5 ? 27.438 -39.714 -32.674 1.00 25.86 ? 5 LEU E C 1 ATOM 6624 O O . LEU E 3 5 ? 28.625 -39.796 -32.331 1.00 32.10 ? 5 LEU E O 1 ATOM 6625 C CB . LEU E 3 5 ? 26.104 -41.678 -31.929 1.00 19.88 ? 5 LEU E CB 1 ATOM 6626 C CG . LEU E 3 5 ? 25.198 -42.282 -30.864 1.00 21.74 ? 5 LEU E CG 1 ATOM 6627 C CD1 . LEU E 3 5 ? 24.673 -43.633 -31.303 1.00 28.19 ? 5 LEU E CD1 1 ATOM 6628 C CD2 . LEU E 3 5 ? 25.958 -42.388 -29.562 1.00 19.23 ? 5 LEU E CD2 1 ATOM 6629 N N . SER E 3 6 ? 27.064 -39.230 -33.861 1.00 22.39 ? 6 SER E N 1 ATOM 6630 C CA . SER E 3 6 ? 28.062 -38.815 -34.845 1.00 26.98 ? 6 SER E CA 1 ATOM 6631 C C . SER E 3 6 ? 28.838 -37.586 -34.380 1.00 32.55 ? 6 SER E C 1 ATOM 6632 O O . SER E 3 6 ? 30.062 -37.519 -34.542 1.00 38.51 ? 6 SER E O 1 ATOM 6633 C CB . SER E 3 6 ? 27.389 -38.531 -36.184 1.00 28.76 ? 6 SER E CB 1 ATOM 6634 O OG . SER E 3 6 ? 26.807 -39.705 -36.719 1.00 36.86 ? 6 SER E OG 1 ATOM 6635 N N . THR E 3 7 ? 28.142 -36.599 -33.813 1.00 29.89 ? 7 THR E N 1 ATOM 6636 C CA . THR E 3 7 ? 28.739 -35.317 -33.466 1.00 26.80 ? 7 THR E CA 1 ATOM 6637 C C . THR E 3 7 ? 28.901 -35.102 -31.970 1.00 18.43 ? 7 THR E C 1 ATOM 6638 O O . THR E 3 7 ? 29.531 -34.116 -31.573 1.00 18.97 ? 7 THR E O 1 ATOM 6639 C CB . THR E 3 7 ? 27.897 -34.163 -34.032 1.00 30.82 ? 7 THR E CB 1 ATOM 6640 O OG1 . THR E 3 7 ? 26.581 -34.199 -33.456 1.00 31.74 ? 7 THR E OG1 1 ATOM 6641 C CG2 . THR E 3 7 ? 27.796 -34.271 -35.556 1.00 31.33 ? 7 THR E CG2 1 ATOM 6642 N N . ARG E 3 8 ? 28.366 -36.001 -31.140 1.00 17.26 ? 8 ARG E N 1 ATOM 6643 C CA . ARG E 3 8 ? 28.305 -35.822 -29.686 1.00 25.16 ? 8 ARG E CA 1 ATOM 6644 C C . ARG E 3 8 ? 27.614 -34.514 -29.320 1.00 25.20 ? 8 ARG E C 1 ATOM 6645 O O . ARG E 3 8 ? 27.850 -33.937 -28.258 1.00 33.94 ? 8 ARG E O 1 ATOM 6646 C CB . ARG E 3 8 ? 29.692 -35.912 -29.049 1.00 30.08 ? 8 ARG E CB 1 ATOM 6647 C CG . ARG E 3 8 ? 30.390 -37.220 -29.348 1.00 29.23 ? 8 ARG E CG 1 ATOM 6648 C CD . ARG E 3 8 ? 31.561 -37.394 -28.434 1.00 30.53 ? 8 ARG E CD 1 ATOM 6649 N NE . ARG E 3 8 ? 32.345 -38.569 -28.791 1.00 33.12 ? 8 ARG E NE 1 ATOM 6650 C CZ . ARG E 3 8 ? 33.443 -38.955 -28.152 1.00 31.06 ? 8 ARG E CZ 1 ATOM 6651 N NH1 . ARG E 3 8 ? 33.877 -38.246 -27.120 1.00 28.68 ? 8 ARG E NH1 1 ATOM 6652 N NH2 . ARG E 3 8 ? 34.103 -40.042 -28.543 1.00 27.16 ? 8 ARG E NH2 1 ATOM 6653 N N . ARG E 3 9 ? 26.745 -34.048 -30.202 1.00 22.29 ? 9 ARG E N 1 ATOM 6654 C CA . ARG E 3 9 ? 25.993 -32.837 -29.978 1.00 20.92 ? 9 ARG E CA 1 ATOM 6655 C C . ARG E 3 9 ? 24.504 -33.145 -29.997 1.00 23.23 ? 9 ARG E C 1 ATOM 6656 O O . ARG E 3 9 ? 24.043 -34.142 -30.555 1.00 23.52 ? 9 ARG E O 1 ATOM 6657 C CB . ARG E 3 9 ? 26.335 -31.780 -31.027 1.00 22.85 ? 9 ARG E CB 1 ATOM 6658 C CG . ARG E 3 9 ? 27.729 -31.217 -30.866 1.00 26.05 ? 9 ARG E CG 1 ATOM 6659 C CD . ARG E 3 9 ? 27.903 -30.495 -29.528 1.00 24.01 ? 9 ARG E CD 1 ATOM 6660 N NE . ARG E 3 9 ? 26.835 -29.530 -29.277 1.00 28.10 ? 9 ARG E NE 1 ATOM 6661 C CZ . ARG E 3 9 ? 26.746 -28.328 -29.844 1.00 31.98 ? 9 ARG E CZ 1 ATOM 6662 N NH1 . ARG E 3 9 ? 27.667 -27.921 -30.711 1.00 31.75 ? 9 ARG E NH1 1 ATOM 6663 N NH2 . ARG E 3 9 ? 25.724 -27.533 -29.549 1.00 30.93 ? 9 ARG E NH2 1 ATOM 6664 N N . GLN E 3 10 ? 23.762 -32.261 -29.362 1.00 25.13 ? 10 GLN E N 1 ATOM 6665 C CA . GLN E 3 10 ? 22.309 -32.316 -29.345 1.00 27.03 ? 10 GLN E CA 1 ATOM 6666 C C . GLN E 3 10 ? 21.764 -31.898 -30.712 1.00 27.29 ? 10 GLN E C 1 ATOM 6667 O O . GLN E 3 10 ? 22.170 -30.872 -31.274 1.00 30.20 ? 10 GLN E O 1 ATOM 6668 C CB . GLN E 3 10 ? 21.792 -31.394 -28.232 1.00 26.17 ? 10 GLN E CB 1 ATOM 6669 C CG . GLN E 3 10 ? 20.503 -31.807 -27.596 1.00 34.59 ? 10 GLN E CG 1 ATOM 6670 C CD . GLN E 3 10 ? 20.595 -33.092 -26.810 1.00 36.46 ? 10 GLN E CD 1 ATOM 6671 O OE1 . GLN E 3 10 ? 19.662 -33.899 -26.825 1.00 47.09 ? 10 GLN E OE1 1 ATOM 6672 N NE2 . GLN E 3 10 ? 21.702 -33.290 -26.112 1.00 24.08 ? 10 GLN E NE2 1 ATOM 6673 N N . LYS E 3 11 ? 20.858 -32.704 -31.259 1.00 31.18 ? 11 LYS E N 1 ATOM 6674 C CA . LYS E 3 11 ? 20.297 -32.457 -32.582 1.00 33.51 ? 11 LYS E CA 1 ATOM 6675 C C . LYS E 3 11 ? 18.800 -32.255 -32.446 1.00 39.01 ? 11 LYS E C 1 ATOM 6676 O O . LYS E 3 11 ? 18.099 -33.123 -31.920 1.00 37.74 ? 11 LYS E O 1 ATOM 6677 C CB . LYS E 3 11 ? 20.585 -33.604 -33.548 1.00 28.75 ? 11 LYS E CB 1 ATOM 6678 C CG . LYS E 3 11 ? 19.744 -33.509 -34.816 1.00 40.36 ? 11 LYS E CG 1 ATOM 6679 C CD . LYS E 3 11 ? 20.342 -34.311 -35.958 1.00 40.24 ? 11 LYS E CD 1 ATOM 6680 C CE . LYS E 3 11 ? 21.647 -33.692 -36.450 1.00 44.76 ? 11 LYS E CE 1 ATOM 6681 N NZ . LYS E 3 11 ? 22.095 -34.266 -37.751 1.00 58.67 ? 11 LYS E NZ 1 ATOM 6682 N N . CYS E 3 12 ? 18.316 -31.119 -32.925 1.00 46.36 ? 12 CYS E N 1 ATOM 6683 C CA . CYS E 3 12 ? 16.933 -30.731 -32.724 1.00 57.84 ? 12 CYS E CA 1 ATOM 6684 C C . CYS E 3 12 ? 16.207 -30.641 -34.056 1.00 67.70 ? 12 CYS E C 1 ATOM 6685 O O . CYS E 3 12 ? 16.833 -30.404 -35.094 1.00 71.55 ? 12 CYS E O 1 ATOM 6686 C CB . CYS E 3 12 ? 16.866 -29.391 -31.988 1.00 59.20 ? 12 CYS E CB 1 ATOM 6687 S SG . CYS E 3 12 ? 18.074 -29.268 -30.637 1.00 58.90 ? 12 CYS E SG 1 ATOM 6688 O OXT . CYS E 3 12 ? 14.973 -30.808 -34.105 1.00 73.29 ? 12 CYS E OXT 1 ATOM 6689 N N . CYS F 3 1 ? 16.242 -8.054 -26.178 1.00 42.97 ? 1 CYS F N 1 ATOM 6690 C CA . CYS F 3 1 ? 15.067 -7.518 -26.873 1.00 47.95 ? 1 CYS F CA 1 ATOM 6691 C C . CYS F 3 1 ? 14.732 -6.094 -26.441 1.00 50.15 ? 1 CYS F C 1 ATOM 6692 O O . CYS F 3 1 ? 15.346 -5.538 -25.525 1.00 54.00 ? 1 CYS F O 1 ATOM 6693 C CB . CYS F 3 1 ? 13.840 -8.400 -26.626 1.00 43.35 ? 1 CYS F CB 1 ATOM 6694 S SG . CYS F 3 1 ? 14.019 -10.135 -27.071 1.00 49.45 ? 1 CYS F SG 1 ATOM 6695 N N . GLN F 3 2 ? 13.720 -5.523 -27.090 1.00 43.00 ? 2 GLN F N 1 ATOM 6696 C CA . GLN F 3 2 ? 13.263 -4.184 -26.758 1.00 40.21 ? 2 GLN F CA 1 ATOM 6697 C C . GLN F 3 2 ? 11.752 -4.096 -26.919 1.00 38.52 ? 2 GLN F C 1 ATOM 6698 O O . GLN F 3 2 ? 11.179 -4.679 -27.843 1.00 33.24 ? 2 GLN F O 1 ATOM 6699 C CB . GLN F 3 2 ? 13.938 -3.137 -27.640 1.00 43.22 ? 2 GLN F CB 1 ATOM 6700 C CG . GLN F 3 2 ? 14.774 -2.139 -26.878 1.00 51.86 ? 2 GLN F CG 1 ATOM 6701 C CD . GLN F 3 2 ? 14.894 -0.833 -27.623 1.00 62.15 ? 2 GLN F CD 1 ATOM 6702 O OE1 . GLN F 3 2 ? 14.352 -0.686 -28.722 1.00 66.54 ? 2 GLN F OE1 1 ATOM 6703 N NE2 . GLN F 3 2 ? 15.594 0.130 -27.029 1.00 64.50 ? 2 GLN F NE2 1 ATOM 6704 N N . PHE F 3 3 ? 11.122 -3.340 -26.024 1.00 37.70 ? 3 PHE F N 1 ATOM 6705 C CA . PHE F 3 3 ? 9.684 -3.127 -26.093 1.00 30.04 ? 3 PHE F CA 1 ATOM 6706 C C . PHE F 3 3 ? 9.327 -2.239 -27.283 1.00 31.80 ? 3 PHE F C 1 ATOM 6707 O O . PHE F 3 3 ? 9.976 -1.219 -27.533 1.00 27.91 ? 3 PHE F O 1 ATOM 6708 C CB . PHE F 3 3 ? 9.183 -2.503 -24.790 1.00 28.34 ? 3 PHE F CB 1 ATOM 6709 C CG . PHE F 3 3 ? 7.707 -2.226 -24.783 1.00 27.39 ? 3 PHE F CG 1 ATOM 6710 C CD1 . PHE F 3 3 ? 6.795 -3.250 -24.545 1.00 24.39 ? 3 PHE F CD1 1 ATOM 6711 C CD2 . PHE F 3 3 ? 7.230 -0.948 -25.021 1.00 22.11 ? 3 PHE F CD2 1 ATOM 6712 C CE1 . PHE F 3 3 ? 5.437 -3.000 -24.549 1.00 18.37 ? 3 PHE F CE1 1 ATOM 6713 C CE2 . PHE F 3 3 ? 5.876 -0.691 -25.019 1.00 20.86 ? 3 PHE F CE2 1 ATOM 6714 C CZ . PHE F 3 3 ? 4.976 -1.716 -24.780 1.00 19.53 ? 3 PHE F CZ 1 ATOM 6715 N N . ASP F 3 4 ? 8.276 -2.631 -28.008 1.00 24.81 ? 4 ASP F N 1 ATOM 6716 C CA . ASP F 3 4 ? 7.835 -1.973 -29.234 1.00 26.56 ? 4 ASP F CA 1 ATOM 6717 C C . ASP F 3 4 ? 6.490 -1.297 -28.982 1.00 25.59 ? 4 ASP F C 1 ATOM 6718 O O . ASP F 3 4 ? 5.507 -1.970 -28.646 1.00 30.81 ? 4 ASP F O 1 ATOM 6719 C CB . ASP F 3 4 ? 7.723 -2.992 -30.369 1.00 38.12 ? 4 ASP F CB 1 ATOM 6720 C CG . ASP F 3 4 ? 7.484 -2.354 -31.728 1.00 36.71 ? 4 ASP F CG 1 ATOM 6721 O OD1 . ASP F 3 4 ? 7.081 -1.177 -31.793 1.00 34.76 ? 4 ASP F OD1 1 ATOM 6722 O OD2 . ASP F 3 4 ? 7.700 -3.050 -32.740 1.00 44.29 ? 4 ASP F OD2 1 ATOM 6723 N N . LEU F 3 5 ? 6.442 0.025 -29.168 1.00 27.39 ? 5 LEU F N 1 ATOM 6724 C CA . LEU F 3 5 ? 5.214 0.771 -28.901 1.00 36.49 ? 5 LEU F CA 1 ATOM 6725 C C . LEU F 3 5 ? 4.103 0.423 -29.883 1.00 40.31 ? 5 LEU F C 1 ATOM 6726 O O . LEU F 3 5 ? 2.925 0.461 -29.512 1.00 40.34 ? 5 LEU F O 1 ATOM 6727 C CB . LEU F 3 5 ? 5.485 2.277 -28.939 1.00 31.72 ? 5 LEU F CB 1 ATOM 6728 C CG . LEU F 3 5 ? 6.343 2.792 -27.784 1.00 30.92 ? 5 LEU F CG 1 ATOM 6729 C CD1 . LEU F 3 5 ? 6.766 4.210 -28.008 1.00 32.29 ? 5 LEU F CD1 1 ATOM 6730 C CD2 . LEU F 3 5 ? 5.564 2.673 -26.500 1.00 27.85 ? 5 LEU F CD2 1 ATOM 6731 N N . SER F 3 6 ? 4.447 0.095 -31.131 1.00 36.79 ? 6 SER F N 1 ATOM 6732 C CA . SER F 3 6 ? 3.419 -0.206 -32.124 1.00 38.89 ? 6 SER F CA 1 ATOM 6733 C C . SER F 3 6 ? 2.673 -1.492 -31.794 1.00 40.38 ? 6 SER F C 1 ATOM 6734 O O . SER F 3 6 ? 1.480 -1.612 -32.095 1.00 37.91 ? 6 SER F O 1 ATOM 6735 C CB . SER F 3 6 ? 4.045 -0.314 -33.513 1.00 43.05 ? 6 SER F CB 1 ATOM 6736 O OG . SER F 3 6 ? 4.929 0.765 -33.752 1.00 50.46 ? 6 SER F OG 1 ATOM 6737 N N . THR F 3 7 ? 3.351 -2.457 -31.182 1.00 25.87 ? 7 THR F N 1 ATOM 6738 C CA . THR F 3 7 ? 2.783 -3.777 -30.971 1.00 31.93 ? 7 THR F CA 1 ATOM 6739 C C . THR F 3 7 ? 2.559 -4.108 -29.507 1.00 30.63 ? 7 THR F C 1 ATOM 6740 O O . THR F 3 7 ? 1.862 -5.085 -29.215 1.00 24.92 ? 7 THR F O 1 ATOM 6741 C CB . THR F 3 7 ? 3.690 -4.858 -31.584 1.00 24.79 ? 7 THR F CB 1 ATOM 6742 O OG1 . THR F 3 7 ? 4.995 -4.775 -30.995 1.00 24.46 ? 7 THR F OG1 1 ATOM 6743 C CG2 . THR F 3 7 ? 3.796 -4.700 -33.105 1.00 28.74 ? 7 THR F CG2 1 ATOM 6744 N N . ARG F 3 8 ? 3.118 -3.321 -28.587 1.00 27.61 ? 8 ARG F N 1 ATOM 6745 C CA . ARG F 3 8 ? 3.112 -3.649 -27.167 1.00 27.00 ? 8 ARG F CA 1 ATOM 6746 C C . ARG F 3 8 ? 3.735 -5.019 -26.924 1.00 29.09 ? 8 ARG F C 1 ATOM 6747 O O . ARG F 3 8 ? 3.342 -5.742 -26.008 1.00 32.71 ? 8 ARG F O 1 ATOM 6748 C CB . ARG F 3 8 ? 1.698 -3.581 -26.578 1.00 27.63 ? 8 ARG F CB 1 ATOM 6749 C CG . ARG F 3 8 ? 0.985 -2.256 -26.836 1.00 27.65 ? 8 ARG F CG 1 ATOM 6750 C CD . ARG F 3 8 ? -0.062 -1.960 -25.771 1.00 33.70 ? 8 ARG F CD 1 ATOM 6751 N NE . ARG F 3 8 ? -0.869 -0.779 -26.081 1.00 34.28 ? 8 ARG F NE 1 ATOM 6752 C CZ . ARG F 3 8 ? -1.896 -0.359 -25.346 1.00 29.98 ? 8 ARG F CZ 1 ATOM 6753 N NH1 . ARG F 3 8 ? -2.235 -1.019 -24.242 1.00 33.99 ? 8 ARG F NH1 1 ATOM 6754 N NH2 . ARG F 3 8 ? -2.584 0.717 -25.711 1.00 18.56 ? 8 ARG F NH2 1 ATOM 6755 N N . ARG F 3 9 ? 4.707 -5.383 -27.753 1.00 27.87 ? 9 ARG F N 1 ATOM 6756 C CA . ARG F 3 9 ? 5.394 -6.656 -27.641 1.00 27.92 ? 9 ARG F CA 1 ATOM 6757 C C . ARG F 3 9 ? 6.897 -6.430 -27.655 1.00 30.01 ? 9 ARG F C 1 ATOM 6758 O O . ARG F 3 9 ? 7.396 -5.457 -28.226 1.00 30.20 ? 9 ARG F O 1 ATOM 6759 C CB . ARG F 3 9 ? 5.005 -7.603 -28.778 1.00 20.28 ? 9 ARG F CB 1 ATOM 6760 C CG . ARG F 3 9 ? 3.588 -8.112 -28.682 1.00 20.28 ? 9 ARG F CG 1 ATOM 6761 C CD . ARG F 3 9 ? 3.349 -8.858 -27.366 1.00 20.84 ? 9 ARG F CD 1 ATOM 6762 N NE . ARG F 3 9 ? 4.333 -9.909 -27.116 1.00 18.60 ? 9 ARG F NE 1 ATOM 6763 C CZ . ARG F 3 9 ? 4.367 -11.072 -27.764 1.00 25.99 ? 9 ARG F CZ 1 ATOM 6764 N NH1 . ARG F 3 9 ? 3.478 -11.337 -28.717 1.00 22.79 ? 9 ARG F NH1 1 ATOM 6765 N NH2 . ARG F 3 9 ? 5.304 -11.965 -27.468 1.00 25.16 ? 9 ARG F NH2 1 ATOM 6766 N N . GLN F 3 10 ? 7.618 -7.348 -27.026 1.00 31.39 ? 10 GLN F N 1 ATOM 6767 C CA . GLN F 3 10 ? 9.066 -7.345 -27.158 1.00 30.75 ? 10 GLN F CA 1 ATOM 6768 C C . GLN F 3 10 ? 9.452 -7.603 -28.611 1.00 29.34 ? 10 GLN F C 1 ATOM 6769 O O . GLN F 3 10 ? 8.916 -8.501 -29.272 1.00 27.37 ? 10 GLN F O 1 ATOM 6770 C CB . GLN F 3 10 ? 9.692 -8.387 -26.229 1.00 29.76 ? 10 GLN F CB 1 ATOM 6771 C CG . GLN F 3 10 ? 9.564 -8.044 -24.744 1.00 30.10 ? 10 GLN F CG 1 ATOM 6772 C CD . GLN F 3 10 ? 10.416 -6.866 -24.330 1.00 22.28 ? 10 GLN F CD 1 ATOM 6773 O OE1 . GLN F 3 10 ? 11.471 -6.603 -24.914 1.00 24.71 ? 10 GLN F OE1 1 ATOM 6774 N NE2 . GLN F 3 10 ? 9.956 -6.141 -23.323 1.00 21.57 ? 10 GLN F NE2 1 ATOM 6775 N N . LYS F 3 11 ? 10.358 -6.785 -29.120 1.00 33.80 ? 11 LYS F N 1 ATOM 6776 C CA . LYS F 3 11 ? 10.794 -6.874 -30.508 1.00 32.96 ? 11 LYS F CA 1 ATOM 6777 C C . LYS F 3 11 ? 12.119 -7.616 -30.547 1.00 36.04 ? 11 LYS F C 1 ATOM 6778 O O . LYS F 3 11 ? 13.142 -7.115 -30.067 1.00 33.50 ? 11 LYS F O 1 ATOM 6779 C CB . LYS F 3 11 ? 10.915 -5.495 -31.141 1.00 35.81 ? 11 LYS F CB 1 ATOM 6780 C CG . LYS F 3 11 ? 11.348 -5.555 -32.603 1.00 40.14 ? 11 LYS F CG 1 ATOM 6781 C CD . LYS F 3 11 ? 10.806 -4.364 -33.386 1.00 45.09 ? 11 LYS F CD 1 ATOM 6782 C CE . LYS F 3 11 ? 10.798 -4.669 -34.862 1.00 51.93 ? 11 LYS F CE 1 ATOM 6783 N NZ . LYS F 3 11 ? 10.174 -6.004 -35.112 1.00 56.42 ? 11 LYS F NZ 1 ATOM 6784 N N . CYS F 3 12 ? 12.064 -8.842 -31.059 1.00 48.02 ? 12 CYS F N 1 ATOM 6785 C CA . CYS F 3 12 ? 13.237 -9.641 -31.360 1.00 57.82 ? 12 CYS F CA 1 ATOM 6786 C C . CYS F 3 12 ? 12.781 -10.750 -32.315 1.00 70.11 ? 12 CYS F C 1 ATOM 6787 O O . CYS F 3 12 ? 11.833 -11.500 -32.038 1.00 61.51 ? 12 CYS F O 1 ATOM 6788 C CB . CYS F 3 12 ? 13.890 -10.200 -30.083 1.00 49.26 ? 12 CYS F CB 1 ATOM 6789 S SG . CYS F 3 12 ? 12.791 -10.449 -28.669 1.00 48.75 ? 12 CYS F SG 1 ATOM 6790 O OXT . CYS F 3 12 ? 13.343 -10.900 -33.411 1.00 84.39 ? 12 CYS F OXT 1 HETATM 6791 P P . PO4 G 4 . ? 37.704 -21.610 -22.935 0.73 59.49 ? 301 PO4 A P 1 HETATM 6792 O O1 . PO4 G 4 . ? 37.863 -22.535 -24.125 0.73 60.28 ? 301 PO4 A O1 1 HETATM 6793 O O2 . PO4 G 4 . ? 37.851 -20.180 -23.406 0.73 56.56 ? 301 PO4 A O2 1 HETATM 6794 O O3 . PO4 G 4 . ? 38.779 -21.932 -21.916 0.73 57.41 ? 301 PO4 A O3 1 HETATM 6795 O O4 . PO4 G 4 . ? 36.345 -21.796 -22.292 0.73 50.05 ? 301 PO4 A O4 1 HETATM 6796 C C1 . NAG H 5 . ? 16.123 -50.391 -24.153 1.00 68.02 ? 301 NAG B C1 1 HETATM 6797 C C2 . NAG H 5 . ? 15.875 -49.110 -23.329 1.00 71.33 ? 301 NAG B C2 1 HETATM 6798 C C3 . NAG H 5 . ? 15.299 -49.455 -21.953 1.00 73.29 ? 301 NAG B C3 1 HETATM 6799 C C4 . NAG H 5 . ? 14.091 -50.368 -22.096 1.00 75.06 ? 301 NAG B C4 1 HETATM 6800 C C5 . NAG H 5 . ? 14.456 -51.588 -22.940 1.00 77.80 ? 301 NAG B C5 1 HETATM 6801 C C6 . NAG H 5 . ? 13.295 -52.515 -23.207 1.00 81.45 ? 301 NAG B C6 1 HETATM 6802 C C7 . NAG H 5 . ? 17.391 -47.238 -23.930 1.00 73.17 ? 301 NAG B C7 1 HETATM 6803 C C8 . NAG H 5 . ? 16.309 -46.752 -24.851 1.00 72.35 ? 301 NAG B C8 1 HETATM 6804 N N2 . NAG H 5 . ? 17.111 -48.341 -23.210 1.00 71.71 ? 301 NAG B N2 1 HETATM 6805 O O3 . NAG H 5 . ? 14.887 -48.265 -21.297 1.00 78.64 ? 301 NAG B O3 1 HETATM 6806 O O4 . NAG H 5 . ? 13.629 -50.761 -20.809 1.00 77.16 ? 301 NAG B O4 1 HETATM 6807 O O5 . NAG H 5 . ? 14.931 -51.156 -24.223 1.00 75.09 ? 301 NAG B O5 1 HETATM 6808 O O6 . NAG H 5 . ? 13.688 -53.571 -24.074 1.00 85.56 ? 301 NAG B O6 1 HETATM 6809 O O7 . NAG H 5 . ? 18.472 -46.649 -23.832 1.00 74.42 ? 301 NAG B O7 1 HETATM 6810 P P . PO4 I 4 . ? 34.072 -26.714 -37.954 0.80 46.27 ? 302 PO4 B P 1 HETATM 6811 O O1 . PO4 I 4 . ? 34.110 -27.778 -39.039 0.80 37.05 ? 302 PO4 B O1 1 HETATM 6812 O O2 . PO4 I 4 . ? 32.705 -26.724 -37.292 0.80 36.37 ? 302 PO4 B O2 1 HETATM 6813 O O3 . PO4 I 4 . ? 34.331 -25.351 -38.549 0.80 42.24 ? 302 PO4 B O3 1 HETATM 6814 O O4 . PO4 I 4 . ? 35.164 -26.989 -36.942 0.80 46.10 ? 302 PO4 B O4 1 HETATM 6815 P P . PO4 J 4 . ? 18.958 -4.507 -50.273 0.89 72.18 ? 301 PO4 C P 1 HETATM 6816 O O1 . PO4 J 4 . ? 18.374 -4.448 -51.663 0.89 71.46 ? 301 PO4 C O1 1 HETATM 6817 O O2 . PO4 J 4 . ? 18.053 -5.379 -49.426 0.89 72.47 ? 301 PO4 C O2 1 HETATM 6818 O O3 . PO4 J 4 . ? 20.351 -5.087 -50.369 0.89 65.34 ? 301 PO4 C O3 1 HETATM 6819 O O4 . PO4 J 4 . ? 19.035 -3.127 -49.642 0.89 74.40 ? 301 PO4 C O4 1 HETATM 6820 C C1 . NAG K 5 . ? 15.864 9.678 -20.575 1.00 75.91 ? 301 NAG D C1 1 HETATM 6821 C C2 . NAG K 5 . ? 15.910 8.324 -19.834 1.00 80.48 ? 301 NAG D C2 1 HETATM 6822 C C3 . NAG K 5 . ? 16.460 8.493 -18.409 1.00 83.10 ? 301 NAG D C3 1 HETATM 6823 C C4 . NAG K 5 . ? 17.739 9.327 -18.409 1.00 82.08 ? 301 NAG D C4 1 HETATM 6824 C C5 . NAG K 5 . ? 17.482 10.626 -19.159 1.00 80.52 ? 301 NAG D C5 1 HETATM 6825 C C6 . NAG K 5 . ? 18.667 11.562 -19.231 1.00 78.73 ? 301 NAG D C6 1 HETATM 6826 C C7 . NAG K 5 . ? 14.171 6.707 -20.591 1.00 80.84 ? 301 NAG D C7 1 HETATM 6827 C C8 . NAG K 5 . ? 15.213 6.091 -21.474 1.00 80.19 ? 301 NAG D C8 1 HETATM 6828 N N2 . NAG K 5 . ? 14.574 7.732 -19.814 1.00 83.07 ? 301 NAG D N2 1 HETATM 6829 O O3 . NAG K 5 . ? 16.708 7.205 -17.853 1.00 87.47 ? 301 NAG D O3 1 HETATM 6830 O O4 . NAG K 5 . ? 18.175 9.610 -17.083 1.00 88.73 ? 301 NAG D O4 1 HETATM 6831 O O5 . NAG K 5 . ? 17.117 10.306 -20.506 1.00 80.41 ? 301 NAG D O5 1 HETATM 6832 O O6 . NAG K 5 . ? 18.285 12.811 -19.796 1.00 72.23 ? 301 NAG D O6 1 HETATM 6833 O O7 . NAG K 5 . ? 13.012 6.278 -20.564 1.00 75.70 ? 301 NAG D O7 1 HETATM 6834 P P . PO4 L 4 . ? -2.702 -11.858 -36.374 0.78 52.89 ? 302 PO4 D P 1 HETATM 6835 O O1 . PO4 L 4 . ? -2.739 -10.716 -37.368 0.78 49.35 ? 302 PO4 D O1 1 HETATM 6836 O O2 . PO4 L 4 . ? -1.326 -11.957 -35.758 0.78 57.52 ? 302 PO4 D O2 1 HETATM 6837 O O3 . PO4 L 4 . ? -3.008 -13.131 -37.108 0.78 53.59 ? 302 PO4 D O3 1 HETATM 6838 O O4 . PO4 L 4 . ? -3.742 -11.663 -35.294 0.78 53.95 ? 302 PO4 D O4 1 HETATM 6839 P P . PO4 M 4 . ? -8.748 9.002 -48.667 0.73 28.26 ? 303 PO4 D P 1 HETATM 6840 O O1 . PO4 M 4 . ? -7.622 8.761 -49.652 0.73 25.55 ? 303 PO4 D O1 1 HETATM 6841 O O2 . PO4 M 4 . ? -9.213 10.425 -48.846 0.73 41.36 ? 303 PO4 D O2 1 HETATM 6842 O O3 . PO4 M 4 . ? -9.893 8.052 -48.939 0.73 29.69 ? 303 PO4 D O3 1 HETATM 6843 O O4 . PO4 M 4 . ? -8.291 8.805 -47.241 0.73 16.69 ? 303 PO4 D O4 1 HETATM 6844 P P . PO4 N 4 . ? 13.220 -2.994 -17.153 0.69 39.32 ? 304 PO4 D P 1 HETATM 6845 O O1 . PO4 N 4 . ? 12.755 -3.478 -18.507 0.69 39.98 ? 304 PO4 D O1 1 HETATM 6846 O O2 . PO4 N 4 . ? 12.044 -2.427 -16.376 0.69 33.98 ? 304 PO4 D O2 1 HETATM 6847 O O3 . PO4 N 4 . ? 13.835 -4.134 -16.376 0.69 35.68 ? 304 PO4 D O3 1 HETATM 6848 O O4 . PO4 N 4 . ? 14.270 -1.928 -17.361 0.69 45.26 ? 304 PO4 D O4 1 HETATM 6849 P P . PO4 O 4 . ? -2.555 13.698 -25.257 0.72 61.64 ? 305 PO4 D P 1 HETATM 6850 O O1 . PO4 O 4 . ? -1.882 14.442 -26.385 0.72 63.15 ? 305 PO4 D O1 1 HETATM 6851 O O2 . PO4 O 4 . ? -3.912 13.216 -25.724 0.72 58.93 ? 305 PO4 D O2 1 HETATM 6852 O O3 . PO4 O 4 . ? -1.701 12.517 -24.861 0.72 57.65 ? 305 PO4 D O3 1 HETATM 6853 O O4 . PO4 O 4 . ? -2.712 14.629 -24.072 0.72 57.71 ? 305 PO4 D O4 1 HETATM 6854 P P . PO4 P 4 . ? -12.167 10.265 -33.378 0.84 56.59 ? 306 PO4 D P 1 HETATM 6855 O O1 . PO4 P 4 . ? -11.116 9.944 -34.414 0.84 58.85 ? 306 PO4 D O1 1 HETATM 6856 O O2 . PO4 P 4 . ? -13.388 10.839 -34.066 0.84 49.40 ? 306 PO4 D O2 1 HETATM 6857 O O3 . PO4 P 4 . ? -12.533 9.010 -32.601 0.84 58.69 ? 306 PO4 D O3 1 HETATM 6858 O O4 . PO4 P 4 . ? -11.589 11.287 -32.417 0.84 57.27 ? 306 PO4 D O4 1 HETATM 6859 O O . HOH Q 6 . ? 17.432 -42.929 -13.220 1.00 33.23 ? 401 HOH A O 1 HETATM 6860 O O . HOH Q 6 . ? 30.940 -26.429 -33.295 1.00 32.14 ? 402 HOH A O 1 HETATM 6861 O O . HOH Q 6 . ? 20.376 -12.543 -25.516 1.00 32.27 ? 403 HOH A O 1 HETATM 6862 O O . HOH Q 6 . ? 23.040 -32.787 -0.888 1.00 35.61 ? 404 HOH A O 1 HETATM 6863 O O . HOH Q 6 . ? 17.468 -31.350 -56.581 1.00 31.48 ? 405 HOH A O 1 HETATM 6864 O O . HOH Q 6 . ? 43.843 -40.102 -57.024 1.00 43.28 ? 406 HOH A O 1 HETATM 6865 O O . HOH Q 6 . ? 21.277 -46.354 -66.406 1.00 38.29 ? 407 HOH A O 1 HETATM 6866 O O . HOH Q 6 . ? 21.040 -31.610 -51.274 1.00 39.72 ? 408 HOH A O 1 HETATM 6867 O O . HOH Q 6 . ? 38.375 -18.059 -22.461 1.00 40.82 ? 409 HOH A O 1 HETATM 6868 O O . HOH Q 6 . ? 32.853 -36.410 -56.390 1.00 32.27 ? 410 HOH A O 1 HETATM 6869 O O . HOH Q 6 . ? 19.635 -30.685 -52.664 1.00 35.87 ? 411 HOH A O 1 HETATM 6870 O O . HOH Q 6 . ? 14.062 -19.096 -11.161 1.00 17.24 ? 412 HOH A O 1 HETATM 6871 O O . HOH Q 6 . ? 25.649 -32.995 -26.536 1.00 36.93 ? 413 HOH A O 1 HETATM 6872 O O . HOH Q 6 . ? 24.120 -26.471 0.525 1.00 15.38 ? 414 HOH A O 1 HETATM 6873 O O . HOH Q 6 . ? 26.100 -22.653 -3.523 1.00 39.33 ? 415 HOH A O 1 HETATM 6874 O O . HOH Q 6 . ? 32.844 -37.744 -32.237 1.00 38.13 ? 416 HOH A O 1 HETATM 6875 O O . HOH Q 6 . ? 33.286 -12.066 -18.535 1.00 41.49 ? 417 HOH A O 1 HETATM 6876 O O . HOH Q 6 . ? 22.993 -48.857 -68.856 1.00 38.54 ? 418 HOH A O 1 HETATM 6877 O O . HOH Q 6 . ? 34.325 -19.752 -13.709 1.00 29.18 ? 419 HOH A O 1 HETATM 6878 O O . HOH Q 6 . ? 22.131 -12.313 -38.575 1.00 47.50 ? 420 HOH A O 1 HETATM 6879 O O . HOH Q 6 . ? 12.223 -20.865 -8.420 1.00 40.24 ? 421 HOH A O 1 HETATM 6880 O O . HOH Q 6 . ? 36.531 -33.054 -19.956 1.00 37.45 ? 422 HOH A O 1 HETATM 6881 O O . HOH Q 6 . ? 34.611 -39.515 -56.624 1.00 25.86 ? 423 HOH A O 1 HETATM 6882 O O . HOH Q 6 . ? 21.934 -19.327 -60.354 1.00 34.13 ? 424 HOH A O 1 HETATM 6883 O O . HOH Q 6 . ? 20.925 -41.294 -59.089 1.00 27.76 ? 425 HOH A O 1 HETATM 6884 O O . HOH Q 6 . ? 31.205 -25.162 -39.254 1.00 20.90 ? 426 HOH A O 1 HETATM 6885 O O . HOH Q 6 . ? 21.848 -20.888 -35.681 1.00 27.58 ? 427 HOH A O 1 HETATM 6886 O O . HOH Q 6 . ? 18.436 -28.088 -49.952 1.00 21.12 ? 428 HOH A O 1 HETATM 6887 O O . HOH Q 6 . ? 26.751 -26.140 -33.100 1.00 33.02 ? 429 HOH A O 1 HETATM 6888 O O . HOH Q 6 . ? 23.821 -21.859 -4.092 1.00 37.28 ? 430 HOH A O 1 HETATM 6889 O O . HOH Q 6 . ? 33.589 -31.088 -24.699 1.00 20.73 ? 431 HOH A O 1 HETATM 6890 O O . HOH Q 6 . ? 12.296 -32.314 -12.939 1.00 23.55 ? 432 HOH A O 1 HETATM 6891 O O . HOH Q 6 . ? 30.012 -19.758 -9.563 1.00 27.97 ? 433 HOH A O 1 HETATM 6892 O O . HOH Q 6 . ? 15.960 -19.992 -55.480 1.00 30.66 ? 434 HOH A O 1 HETATM 6893 O O . HOH Q 6 . ? 21.537 -41.764 -55.229 1.00 26.76 ? 435 HOH A O 1 HETATM 6894 O O . HOH Q 6 . ? 19.198 -18.588 -45.926 1.00 23.18 ? 436 HOH A O 1 HETATM 6895 O O . HOH Q 6 . ? 19.732 -25.863 -18.852 1.00 21.55 ? 437 HOH A O 1 HETATM 6896 O O . HOH Q 6 . ? 21.357 -43.311 -60.888 1.00 25.17 ? 438 HOH A O 1 HETATM 6897 O O . HOH Q 6 . ? 16.222 -39.347 -13.568 1.00 39.28 ? 439 HOH A O 1 HETATM 6898 O O . HOH Q 6 . ? 17.392 -36.379 -51.938 1.00 16.28 ? 440 HOH A O 1 HETATM 6899 O O . HOH Q 6 . ? 20.246 -19.946 -34.111 1.00 45.13 ? 441 HOH A O 1 HETATM 6900 O O . HOH Q 6 . ? 17.202 -36.494 -15.158 1.00 26.77 ? 442 HOH A O 1 HETATM 6901 O O . HOH Q 6 . ? 26.330 -34.990 -48.168 1.00 12.70 ? 443 HOH A O 1 HETATM 6902 O O . HOH Q 6 . ? 32.980 -24.358 -28.904 1.00 38.37 ? 444 HOH A O 1 HETATM 6903 O O . HOH Q 6 . ? 17.721 -23.463 -63.097 1.00 45.89 ? 445 HOH A O 1 HETATM 6904 O O . HOH Q 6 . ? 31.090 -26.974 -30.038 1.00 22.79 ? 446 HOH A O 1 HETATM 6905 O O . HOH Q 6 . ? 22.375 -19.073 -34.356 1.00 40.32 ? 447 HOH A O 1 HETATM 6906 O O . HOH Q 6 . ? 18.749 -23.491 -55.234 1.00 21.14 ? 448 HOH A O 1 HETATM 6907 O O . HOH Q 6 . ? 18.595 -34.869 -55.568 1.00 34.18 ? 449 HOH A O 1 HETATM 6908 O O . HOH Q 6 . ? 42.604 -24.284 -36.605 1.00 38.02 ? 450 HOH A O 1 HETATM 6909 O O . HOH Q 6 . ? 22.202 -41.756 -14.294 1.00 25.83 ? 451 HOH A O 1 HETATM 6910 O O . HOH Q 6 . ? 28.614 -15.509 -14.701 1.00 26.18 ? 452 HOH A O 1 HETATM 6911 O O . HOH Q 6 . ? 33.914 -22.308 -23.531 1.00 18.57 ? 453 HOH A O 1 HETATM 6912 O O . HOH Q 6 . ? 24.002 -39.057 -52.202 1.00 31.13 ? 454 HOH A O 1 HETATM 6913 O O . HOH Q 6 . ? 23.709 -24.034 -10.333 1.00 22.65 ? 455 HOH A O 1 HETATM 6914 O O . HOH Q 6 . ? 16.403 -30.376 -21.987 1.00 33.44 ? 456 HOH A O 1 HETATM 6915 O O . HOH Q 6 . ? 18.312 -20.670 -9.649 1.00 31.99 ? 457 HOH A O 1 HETATM 6916 O O . HOH Q 6 . ? 36.947 -29.147 -16.096 1.00 26.69 ? 458 HOH A O 1 HETATM 6917 O O . HOH Q 6 . ? 14.824 -20.038 -47.692 1.00 38.45 ? 459 HOH A O 1 HETATM 6918 O O . HOH Q 6 . ? 24.329 -27.839 -37.460 1.00 25.36 ? 460 HOH A O 1 HETATM 6919 O O . HOH Q 6 . ? 23.311 -29.839 -0.405 1.00 17.08 ? 461 HOH A O 1 HETATM 6920 O O . HOH Q 6 . ? 34.142 -12.616 -15.524 1.00 49.90 ? 462 HOH A O 1 HETATM 6921 O O . HOH Q 6 . ? 23.065 -26.715 -34.986 1.00 44.60 ? 463 HOH A O 1 HETATM 6922 O O . HOH Q 6 . ? 30.341 -20.468 -4.119 1.00 44.64 ? 464 HOH A O 1 HETATM 6923 O O . HOH Q 6 . ? 28.603 -12.627 -47.140 1.00 49.32 ? 465 HOH A O 1 HETATM 6924 O O . HOH Q 6 . ? 34.573 -22.345 -12.424 1.00 30.09 ? 466 HOH A O 1 HETATM 6925 O O . HOH Q 6 . ? 17.121 -21.942 -32.751 1.00 38.70 ? 467 HOH A O 1 HETATM 6926 O O . HOH Q 6 . ? 30.629 -30.190 -37.050 1.00 24.91 ? 468 HOH A O 1 HETATM 6927 O O . HOH Q 6 . ? 23.140 -24.800 -34.263 1.00 48.27 ? 469 HOH A O 1 HETATM 6928 O O . HOH Q 6 . ? 12.340 -25.141 -24.814 1.00 32.25 ? 470 HOH A O 1 HETATM 6929 O O . HOH Q 6 . ? 34.475 -28.477 -23.867 1.00 31.21 ? 471 HOH A O 1 HETATM 6930 O O . HOH Q 6 . ? 26.202 -9.236 -43.265 1.00 26.65 ? 472 HOH A O 1 HETATM 6931 O O . HOH Q 6 . ? 24.405 -14.558 -56.923 1.00 35.77 ? 473 HOH A O 1 HETATM 6932 O O . HOH Q 6 . ? 19.048 -16.943 -20.441 1.00 20.49 ? 474 HOH A O 1 HETATM 6933 O O . HOH Q 6 . ? 26.611 -48.273 -63.649 1.00 43.57 ? 475 HOH A O 1 HETATM 6934 O O . HOH Q 6 . ? 29.721 -35.251 -46.895 1.00 36.66 ? 476 HOH A O 1 HETATM 6935 O O . HOH Q 6 . ? 24.560 -24.104 -33.104 1.00 39.31 ? 477 HOH A O 1 HETATM 6936 O O . HOH Q 6 . ? 38.170 -21.718 -31.054 1.00 45.19 ? 478 HOH A O 1 HETATM 6937 O O . HOH Q 6 . ? 14.058 -26.034 -16.160 1.00 27.76 ? 479 HOH A O 1 HETATM 6938 O O . HOH Q 6 . ? 33.634 -38.808 -69.657 1.00 39.18 ? 480 HOH A O 1 HETATM 6939 O O . HOH Q 6 . ? 29.871 -7.754 -22.998 1.00 40.71 ? 481 HOH A O 1 HETATM 6940 O O . HOH Q 6 . ? 31.635 -23.539 -40.872 1.00 24.84 ? 482 HOH A O 1 HETATM 6941 O O . HOH Q 6 . ? 34.565 -16.787 -42.031 1.00 49.69 ? 483 HOH A O 1 HETATM 6942 O O . HOH Q 6 . ? 13.179 -29.043 -66.698 1.00 25.94 ? 484 HOH A O 1 HETATM 6943 O O . HOH Q 6 . ? 20.307 -14.310 -23.147 1.00 28.73 ? 485 HOH A O 1 HETATM 6944 O O . HOH Q 6 . ? 19.828 -35.390 -46.699 1.00 34.11 ? 486 HOH A O 1 HETATM 6945 O O . HOH Q 6 . ? 15.681 -32.259 -18.978 1.00 33.40 ? 487 HOH A O 1 HETATM 6946 O O . HOH Q 6 . ? 18.327 -40.461 -8.057 1.00 35.22 ? 488 HOH A O 1 HETATM 6947 O O . HOH Q 6 . ? 25.556 -39.794 -49.950 1.00 34.89 ? 489 HOH A O 1 HETATM 6948 O O . HOH Q 6 . ? 26.530 -36.602 -72.782 1.00 44.16 ? 490 HOH A O 1 HETATM 6949 O O . HOH Q 6 . ? 24.076 -32.968 -40.809 1.00 30.36 ? 491 HOH A O 1 HETATM 6950 O O . HOH Q 6 . ? 23.826 -17.951 -11.863 1.00 36.64 ? 492 HOH A O 1 HETATM 6951 O O . HOH Q 6 . ? 31.783 -17.846 -47.302 1.00 27.15 ? 493 HOH A O 1 HETATM 6952 O O . HOH Q 6 . ? 18.415 -30.120 -25.643 1.00 33.94 ? 494 HOH A O 1 HETATM 6953 O O . HOH Q 6 . ? 21.488 -27.484 -68.844 1.00 43.23 ? 495 HOH A O 1 HETATM 6954 O O . HOH Q 6 . ? 17.163 -17.667 -44.142 1.00 38.14 ? 496 HOH A O 1 HETATM 6955 O O . HOH Q 6 . ? 20.668 -41.841 -1.791 1.00 37.62 ? 497 HOH A O 1 HETATM 6956 O O . HOH Q 6 . ? 19.927 -25.985 -44.292 1.00 25.22 ? 498 HOH A O 1 HETATM 6957 O O . HOH Q 6 . ? 18.439 -43.485 -2.870 1.00 33.48 ? 499 HOH A O 1 HETATM 6958 O O . HOH Q 6 . ? 25.732 -16.522 -10.515 1.00 31.06 ? 500 HOH A O 1 HETATM 6959 O O . HOH Q 6 . ? 25.641 -18.001 -60.550 1.00 25.77 ? 501 HOH A O 1 HETATM 6960 O O . HOH Q 6 . ? 15.692 -20.835 -57.740 1.00 25.16 ? 502 HOH A O 1 HETATM 6961 O O . HOH Q 6 . ? 23.086 -9.176 -21.670 1.00 28.80 ? 503 HOH A O 1 HETATM 6962 O O . HOH Q 6 . ? 34.360 -36.851 -65.573 1.00 32.41 ? 504 HOH A O 1 HETATM 6963 O O . HOH Q 6 . ? 38.775 -27.630 -9.391 1.00 33.91 ? 505 HOH A O 1 HETATM 6964 O O . HOH Q 6 . ? 18.874 -42.033 -48.941 1.00 45.23 ? 506 HOH A O 1 HETATM 6965 O O . HOH Q 6 . ? 20.103 -14.829 -36.472 1.00 34.77 ? 507 HOH A O 1 HETATM 6966 O O . HOH Q 6 . ? 18.257 -20.793 -40.340 1.00 28.42 ? 508 HOH A O 1 HETATM 6967 O O . HOH Q 6 . ? 32.065 -15.573 -34.078 1.00 31.70 ? 509 HOH A O 1 HETATM 6968 O O . HOH Q 6 . ? 29.718 -24.823 -70.777 1.00 42.88 ? 510 HOH A O 1 HETATM 6969 O O . HOH Q 6 . ? 29.516 -14.827 -32.740 1.00 41.24 ? 511 HOH A O 1 HETATM 6970 O O . HOH Q 6 . ? 15.630 -34.036 -53.228 1.00 21.78 ? 512 HOH A O 1 HETATM 6971 O O . HOH Q 6 . ? 21.914 -28.915 -65.744 1.00 38.47 ? 513 HOH A O 1 HETATM 6972 O O . HOH Q 6 . ? 22.259 -30.312 -35.513 1.00 49.27 ? 514 HOH A O 1 HETATM 6973 O O . HOH Q 6 . ? 20.874 -20.301 -37.976 1.00 21.24 ? 515 HOH A O 1 HETATM 6974 O O . HOH Q 6 . ? 35.141 -21.907 -40.532 1.00 38.25 ? 516 HOH A O 1 HETATM 6975 O O . HOH Q 6 . ? 34.392 -21.398 -5.343 1.00 25.48 ? 517 HOH A O 1 HETATM 6976 O O . HOH Q 6 . ? 28.730 -17.453 -53.806 1.00 37.90 ? 518 HOH A O 1 HETATM 6977 O O . HOH Q 6 . ? 37.182 -22.240 -42.632 1.00 37.93 ? 519 HOH A O 1 HETATM 6978 O O . HOH Q 6 . ? 19.709 -15.241 -14.093 1.00 37.85 ? 520 HOH A O 1 HETATM 6979 O O . HOH Q 6 . ? 33.785 -14.392 -40.200 1.00 44.38 ? 521 HOH A O 1 HETATM 6980 O O . HOH Q 6 . ? 21.723 -26.158 -65.745 1.00 35.14 ? 522 HOH A O 1 HETATM 6981 O O . HOH Q 6 . ? 20.158 -26.550 -60.679 1.00 50.93 ? 523 HOH A O 1 HETATM 6982 O O . HOH Q 6 . ? 37.152 -33.428 -25.092 1.00 26.82 ? 524 HOH A O 1 HETATM 6983 O O . HOH Q 6 . ? 21.326 -40.443 -52.477 1.00 25.62 ? 525 HOH A O 1 HETATM 6984 O O . HOH Q 6 . ? 30.800 -22.869 -62.558 1.00 34.54 ? 526 HOH A O 1 HETATM 6985 O O . HOH Q 6 . ? 17.131 -16.239 -50.087 1.00 27.88 ? 527 HOH A O 1 HETATM 6986 O O . HOH Q 6 . ? 23.623 -19.319 -4.911 1.00 36.20 ? 528 HOH A O 1 HETATM 6987 O O . HOH Q 6 . ? 19.580 -32.874 1.772 1.00 46.98 ? 529 HOH A O 1 HETATM 6988 O O . HOH Q 6 . ? 17.823 -31.816 -53.894 1.00 31.64 ? 530 HOH A O 1 HETATM 6989 O O . HOH Q 6 . ? 18.525 -35.335 -48.017 1.00 36.51 ? 531 HOH A O 1 HETATM 6990 O O . HOH Q 6 . ? 18.478 -31.186 1.083 1.00 55.27 ? 532 HOH A O 1 HETATM 6991 O O . HOH Q 6 . ? 17.827 -23.909 -40.413 1.00 36.34 ? 533 HOH A O 1 HETATM 6992 O O . HOH Q 6 . ? 30.240 -20.255 -62.003 1.00 42.92 ? 534 HOH A O 1 HETATM 6993 O O . HOH Q 6 . ? 16.054 -18.327 -28.250 1.00 27.51 ? 535 HOH A O 1 HETATM 6994 O O . HOH Q 6 . ? 15.875 -20.597 -29.533 1.00 43.90 ? 536 HOH A O 1 HETATM 6995 O O . HOH Q 6 . ? 17.295 -18.992 -48.796 1.00 29.02 ? 537 HOH A O 1 HETATM 6996 O O . HOH Q 6 . ? 26.671 -36.964 -47.449 1.00 31.12 ? 538 HOH A O 1 HETATM 6997 O O . HOH Q 6 . ? 37.240 -29.275 -23.010 1.00 28.63 ? 539 HOH A O 1 HETATM 6998 O O . HOH Q 6 . ? 36.466 -18.942 -11.501 1.00 37.58 ? 540 HOH A O 1 HETATM 6999 O O . HOH Q 6 . ? 18.652 -40.056 -16.279 1.00 39.16 ? 541 HOH A O 1 HETATM 7000 O O . HOH Q 6 . ? 32.873 -22.073 -3.180 1.00 39.46 ? 542 HOH A O 1 HETATM 7001 O O . HOH Q 6 . ? 20.460 -24.826 -62.724 1.00 47.72 ? 543 HOH A O 1 HETATM 7002 O O . HOH Q 6 . ? 19.880 -14.425 -39.405 1.00 37.91 ? 544 HOH A O 1 HETATM 7003 O O . HOH Q 6 . ? 9.575 -33.288 -12.392 1.00 43.86 ? 545 HOH A O 1 HETATM 7004 O O . HOH Q 6 . ? 35.919 -30.804 -26.142 1.00 19.34 ? 546 HOH A O 1 HETATM 7005 O O . HOH Q 6 . ? 16.571 -18.870 -41.445 1.00 39.61 ? 547 HOH A O 1 HETATM 7006 O O . HOH R 6 . ? 31.855 -28.142 -35.713 1.00 54.39 ? 401 HOH B O 1 HETATM 7007 O O . HOH R 6 . ? 34.982 -30.041 -38.975 1.00 33.62 ? 402 HOH B O 1 HETATM 7008 O O . HOH R 6 . ? 48.759 -44.524 -12.823 1.00 35.34 ? 403 HOH B O 1 HETATM 7009 O O . HOH R 6 . ? 37.394 -23.805 -45.156 1.00 23.79 ? 404 HOH B O 1 HETATM 7010 O O . HOH R 6 . ? 26.849 -47.581 -50.530 1.00 31.23 ? 405 HOH B O 1 HETATM 7011 O O . HOH R 6 . ? 37.748 -35.583 -57.575 1.00 30.96 ? 406 HOH B O 1 HETATM 7012 O O . HOH R 6 . ? 27.671 -45.580 -6.049 1.00 23.55 ? 407 HOH B O 1 HETATM 7013 O O . HOH R 6 . ? 39.867 -17.090 -58.133 1.00 39.56 ? 408 HOH B O 1 HETATM 7014 O O . HOH R 6 . ? 41.383 -37.786 -19.943 1.00 20.36 ? 409 HOH B O 1 HETATM 7015 O O . HOH R 6 . ? 29.024 -54.820 -5.911 1.00 29.24 ? 410 HOH B O 1 HETATM 7016 O O . HOH R 6 . ? 22.413 -43.493 -22.240 1.00 20.47 ? 411 HOH B O 1 HETATM 7017 O O . HOH R 6 . ? 44.253 -32.037 -39.348 1.00 25.04 ? 412 HOH B O 1 HETATM 7018 O O . HOH R 6 . ? 30.950 -49.986 -51.900 1.00 45.18 ? 413 HOH B O 1 HETATM 7019 O O . HOH R 6 . ? 30.005 -36.121 -48.962 1.00 23.90 ? 414 HOH B O 1 HETATM 7020 O O . HOH R 6 . ? 26.344 -51.543 -4.345 1.00 35.25 ? 415 HOH B O 1 HETATM 7021 O O . HOH R 6 . ? 28.588 -35.171 -5.647 1.00 27.42 ? 416 HOH B O 1 HETATM 7022 O O . HOH R 6 . ? 38.522 -33.416 -38.890 1.00 27.63 ? 417 HOH B O 1 HETATM 7023 O O . HOH R 6 . ? 18.592 -46.261 -12.042 1.00 25.95 ? 418 HOH B O 1 HETATM 7024 O O . HOH R 6 . ? 29.894 -59.078 -30.916 1.00 37.29 ? 419 HOH B O 1 HETATM 7025 O O . HOH R 6 . ? 18.716 -55.820 -30.307 1.00 30.16 ? 420 HOH B O 1 HETATM 7026 O O . HOH R 6 . ? 21.008 -39.650 -15.850 1.00 22.33 ? 421 HOH B O 1 HETATM 7027 O O . HOH R 6 . ? 29.357 -58.773 -17.268 1.00 34.03 ? 422 HOH B O 1 HETATM 7028 O O . HOH R 6 . ? 30.865 -48.243 -33.032 1.00 19.98 ? 423 HOH B O 1 HETATM 7029 O O . HOH R 6 . ? 30.297 -38.219 -38.423 1.00 14.95 ? 424 HOH B O 1 HETATM 7030 O O . HOH R 6 . ? 48.339 -32.189 -53.144 1.00 19.17 ? 425 HOH B O 1 HETATM 7031 O O . HOH R 6 . ? 31.507 -58.939 -28.453 1.00 26.42 ? 426 HOH B O 1 HETATM 7032 O O . HOH R 6 . ? 35.033 -41.107 -7.037 1.00 25.11 ? 427 HOH B O 1 HETATM 7033 O O . HOH R 6 . ? 36.828 -50.884 -26.701 1.00 35.19 ? 428 HOH B O 1 HETATM 7034 O O . HOH R 6 . ? 19.132 -37.576 -26.155 1.00 25.49 ? 429 HOH B O 1 HETATM 7035 O O . HOH R 6 . ? 39.244 -47.881 -8.658 1.00 31.80 ? 430 HOH B O 1 HETATM 7036 O O . HOH R 6 . ? 24.988 -47.418 -36.878 1.00 28.37 ? 431 HOH B O 1 HETATM 7037 O O . HOH R 6 . ? 43.966 -23.658 -44.766 1.00 25.51 ? 432 HOH B O 1 HETATM 7038 O O . HOH R 6 . ? 38.826 -34.788 -18.961 1.00 23.92 ? 433 HOH B O 1 HETATM 7039 O O . HOH R 6 . ? 21.522 -36.461 -20.979 1.00 18.48 ? 434 HOH B O 1 HETATM 7040 O O . HOH R 6 . ? 42.032 -39.685 -23.566 1.00 25.60 ? 435 HOH B O 1 HETATM 7041 O O . HOH R 6 . ? 48.305 -24.555 -46.882 1.00 23.10 ? 436 HOH B O 1 HETATM 7042 O O . HOH R 6 . ? 26.521 -45.554 -53.339 1.00 30.39 ? 437 HOH B O 1 HETATM 7043 O O . HOH R 6 . ? 46.882 -47.448 -10.827 1.00 27.19 ? 438 HOH B O 1 HETATM 7044 O O . HOH R 6 . ? 33.556 -58.355 -25.255 1.00 35.36 ? 439 HOH B O 1 HETATM 7045 O O . HOH R 6 . ? 37.662 -44.590 -36.154 1.00 34.11 ? 440 HOH B O 1 HETATM 7046 O O . HOH R 6 . ? 34.380 -56.666 -9.618 1.00 38.19 ? 441 HOH B O 1 HETATM 7047 O O . HOH R 6 . ? 34.749 -43.934 -30.378 1.00 21.94 ? 442 HOH B O 1 HETATM 7048 O O . HOH R 6 . ? 41.047 -43.167 -54.691 1.00 30.79 ? 443 HOH B O 1 HETATM 7049 O O . HOH R 6 . ? 23.690 -61.113 -17.626 1.00 38.76 ? 444 HOH B O 1 HETATM 7050 O O . HOH R 6 . ? 23.372 -36.549 -23.386 1.00 24.83 ? 445 HOH B O 1 HETATM 7051 O O . HOH R 6 . ? 43.328 -48.103 -23.001 1.00 31.88 ? 446 HOH B O 1 HETATM 7052 O O . HOH R 6 . ? 43.140 -18.539 -49.088 1.00 34.88 ? 447 HOH B O 1 HETATM 7053 O O . HOH R 6 . ? 46.371 -42.938 -19.927 1.00 32.61 ? 448 HOH B O 1 HETATM 7054 O O . HOH R 6 . ? 42.628 -52.575 -4.878 1.00 37.62 ? 449 HOH B O 1 HETATM 7055 O O . HOH R 6 . ? 31.614 -54.849 -4.514 1.00 33.32 ? 450 HOH B O 1 HETATM 7056 O O . HOH R 6 . ? 53.338 -35.606 -48.877 1.00 18.87 ? 451 HOH B O 1 HETATM 7057 O O . HOH R 6 . ? 28.283 -37.158 -44.870 1.00 38.51 ? 452 HOH B O 1 HETATM 7058 O O . HOH R 6 . ? 50.982 -37.171 -58.885 1.00 50.29 ? 453 HOH B O 1 HETATM 7059 O O . HOH R 6 . ? 44.768 -49.931 -44.663 1.00 38.25 ? 454 HOH B O 1 HETATM 7060 O O . HOH R 6 . ? 34.635 -25.512 -34.561 1.00 34.49 ? 455 HOH B O 1 HETATM 7061 O O . HOH R 6 . ? 18.779 -47.897 -19.404 1.00 27.89 ? 456 HOH B O 1 HETATM 7062 O O . HOH R 6 . ? 41.892 -35.767 -18.411 1.00 42.70 ? 457 HOH B O 1 HETATM 7063 O O . HOH R 6 . ? 41.591 -44.184 -1.620 1.00 39.36 ? 458 HOH B O 1 HETATM 7064 O O . HOH R 6 . ? 19.405 -44.938 -27.671 1.00 38.32 ? 459 HOH B O 1 HETATM 7065 O O . HOH R 6 . ? 45.533 -57.480 -16.252 1.00 43.42 ? 460 HOH B O 1 HETATM 7066 O O . HOH R 6 . ? 31.657 -42.515 -1.483 1.00 28.39 ? 461 HOH B O 1 HETATM 7067 O O . HOH R 6 . ? 36.235 -32.037 -17.281 1.00 27.13 ? 462 HOH B O 1 HETATM 7068 O O . HOH R 6 . ? 37.640 -44.700 -3.573 1.00 32.52 ? 463 HOH B O 1 HETATM 7069 O O . HOH R 6 . ? 43.275 -21.086 -43.848 1.00 35.40 ? 464 HOH B O 1 HETATM 7070 O O . HOH R 6 . ? 38.469 -54.937 -21.927 1.00 41.19 ? 465 HOH B O 1 HETATM 7071 O O . HOH R 6 . ? 51.196 -39.537 -45.605 1.00 21.90 ? 466 HOH B O 1 HETATM 7072 O O . HOH R 6 . ? 26.345 -61.651 -23.849 1.00 36.18 ? 467 HOH B O 1 HETATM 7073 O O . HOH R 6 . ? 45.744 -42.902 -42.297 1.00 21.25 ? 468 HOH B O 1 HETATM 7074 O O . HOH R 6 . ? 27.723 -46.533 -36.221 1.00 25.93 ? 469 HOH B O 1 HETATM 7075 O O . HOH R 6 . ? 29.011 -38.206 -48.260 1.00 34.84 ? 470 HOH B O 1 HETATM 7076 O O . HOH R 6 . ? 36.908 -55.552 -20.094 1.00 47.72 ? 471 HOH B O 1 HETATM 7077 O O . HOH R 6 . ? 17.188 -47.120 -8.583 1.00 43.34 ? 472 HOH B O 1 HETATM 7078 O O . HOH R 6 . ? 45.868 -52.428 -40.256 1.00 33.56 ? 473 HOH B O 1 HETATM 7079 O O . HOH R 6 . ? 47.153 -37.961 -38.200 1.00 36.83 ? 474 HOH B O 1 HETATM 7080 O O . HOH R 6 . ? 47.327 -40.972 -6.951 1.00 35.30 ? 475 HOH B O 1 HETATM 7081 O O . HOH R 6 . ? 27.660 -53.494 -43.082 1.00 25.57 ? 476 HOH B O 1 HETATM 7082 O O . HOH R 6 . ? 22.729 -49.687 -33.993 1.00 34.57 ? 477 HOH B O 1 HETATM 7083 O O . HOH R 6 . ? 44.330 -36.896 -56.293 1.00 25.20 ? 478 HOH B O 1 HETATM 7084 O O . HOH R 6 . ? 21.488 -43.362 -50.132 1.00 50.74 ? 479 HOH B O 1 HETATM 7085 O O . HOH R 6 . ? 19.287 -50.208 -22.135 1.00 42.99 ? 480 HOH B O 1 HETATM 7086 O O . HOH R 6 . ? 39.803 -22.974 -38.838 1.00 48.58 ? 481 HOH B O 1 HETATM 7087 O O . HOH R 6 . ? 36.669 -50.308 -2.248 1.00 33.23 ? 482 HOH B O 1 HETATM 7088 O O . HOH R 6 . ? 40.437 -28.965 -37.914 1.00 28.49 ? 483 HOH B O 1 HETATM 7089 O O . HOH R 6 . ? 19.918 -43.270 -13.766 1.00 24.13 ? 484 HOH B O 1 HETATM 7090 O O . HOH R 6 . ? 23.062 -49.747 -40.786 1.00 49.52 ? 485 HOH B O 1 HETATM 7091 O O . HOH R 6 . ? 47.381 -57.131 -10.040 1.00 54.03 ? 486 HOH B O 1 HETATM 7092 O O . HOH R 6 . ? 32.350 -36.477 -38.479 1.00 26.36 ? 487 HOH B O 1 HETATM 7093 O O . HOH R 6 . ? 17.692 -41.430 -18.602 1.00 34.45 ? 488 HOH B O 1 HETATM 7094 O O . HOH R 6 . ? 25.521 -52.746 -6.901 1.00 21.71 ? 489 HOH B O 1 HETATM 7095 O O . HOH R 6 . ? 25.878 -52.374 -42.590 1.00 27.96 ? 490 HOH B O 1 HETATM 7096 O O . HOH R 6 . ? 47.312 -55.287 -8.928 1.00 46.46 ? 491 HOH B O 1 HETATM 7097 O O . HOH R 6 . ? 31.228 -32.002 -37.470 1.00 24.93 ? 492 HOH B O 1 HETATM 7098 O O . HOH R 6 . ? 46.910 -25.201 -39.982 1.00 36.27 ? 493 HOH B O 1 HETATM 7099 O O . HOH R 6 . ? 53.029 -29.618 -47.670 1.00 46.52 ? 494 HOH B O 1 HETATM 7100 O O . HOH R 6 . ? 37.577 -24.511 -39.580 1.00 42.11 ? 495 HOH B O 1 HETATM 7101 O O . HOH R 6 . ? 42.868 -39.595 -3.021 1.00 42.96 ? 496 HOH B O 1 HETATM 7102 O O . HOH R 6 . ? 41.468 -33.996 -36.682 1.00 41.50 ? 497 HOH B O 1 HETATM 7103 O O . HOH R 6 . ? 39.297 -50.614 -32.555 1.00 42.89 ? 498 HOH B O 1 HETATM 7104 O O . HOH R 6 . ? 34.102 -56.703 -27.113 1.00 49.13 ? 499 HOH B O 1 HETATM 7105 O O . HOH R 6 . ? 44.110 -55.185 -8.550 1.00 47.48 ? 500 HOH B O 1 HETATM 7106 O O . HOH R 6 . ? 11.073 -52.167 -25.849 1.00 51.45 ? 501 HOH B O 1 HETATM 7107 O O . HOH R 6 . ? 43.487 -20.318 -47.217 1.00 34.30 ? 502 HOH B O 1 HETATM 7108 O O . HOH R 6 . ? 46.040 -54.998 -6.103 1.00 50.97 ? 503 HOH B O 1 HETATM 7109 O O . HOH R 6 . ? 47.519 -24.210 -38.480 1.00 34.72 ? 504 HOH B O 1 HETATM 7110 O O . HOH R 6 . ? 42.930 -40.479 -26.307 1.00 43.42 ? 505 HOH B O 1 HETATM 7111 O O . HOH R 6 . ? 45.786 -42.088 -40.168 1.00 37.54 ? 506 HOH B O 1 HETATM 7112 O O . HOH R 6 . ? 23.342 -51.711 -40.369 1.00 51.40 ? 507 HOH B O 1 HETATM 7113 O O . HOH R 6 . ? 23.786 -46.621 -34.716 1.00 37.46 ? 508 HOH B O 1 HETATM 7114 O O . HOH R 6 . ? 41.349 -31.680 -38.542 1.00 33.41 ? 509 HOH B O 1 HETATM 7115 O O . HOH R 6 . ? 52.837 -30.098 -43.559 1.00 21.30 ? 510 HOH B O 1 HETATM 7116 O O . HOH R 6 . ? 9.632 -51.447 -24.387 1.00 52.53 ? 511 HOH B O 1 HETATM 7117 O O . HOH R 6 . ? 47.683 -20.797 -45.480 1.00 37.23 ? 512 HOH B O 1 HETATM 7118 O O . HOH R 6 . ? 47.016 -23.027 -44.792 1.00 31.02 ? 513 HOH B O 1 HETATM 7119 O O . HOH S 6 . ? 5.789 11.700 -57.523 1.00 27.37 ? 401 HOH C O 1 HETATM 7120 O O . HOH S 6 . ? 12.739 -9.555 -47.507 1.00 35.73 ? 402 HOH C O 1 HETATM 7121 O O . HOH S 6 . ? 17.611 -5.833 -53.005 1.00 37.32 ? 403 HOH C O 1 HETATM 7122 O O . HOH S 6 . ? 4.920 -12.835 -31.053 1.00 37.46 ? 404 HOH C O 1 HETATM 7123 O O . HOH S 6 . ? 0.377 -12.658 -31.501 1.00 38.44 ? 405 HOH C O 1 HETATM 7124 O O . HOH S 6 . ? 12.957 8.095 -59.236 1.00 24.08 ? 406 HOH C O 1 HETATM 7125 O O . HOH S 6 . ? 11.164 8.689 -63.906 1.00 28.55 ? 407 HOH C O 1 HETATM 7126 O O . HOH S 6 . ? 13.418 -2.407 -52.946 1.00 16.92 ? 408 HOH C O 1 HETATM 7127 O O . HOH S 6 . ? 7.478 -8.907 1.238 1.00 20.23 ? 409 HOH C O 1 HETATM 7128 O O . HOH S 6 . ? -2.877 -17.404 -22.351 1.00 29.16 ? 410 HOH C O 1 HETATM 7129 O O . HOH S 6 . ? -8.339 -5.157 -67.665 1.00 50.88 ? 411 HOH C O 1 HETATM 7130 O O . HOH S 6 . ? -3.628 -20.281 -12.507 1.00 18.03 ? 412 HOH C O 1 HETATM 7131 O O . HOH S 6 . ? 12.818 -1.102 -5.653 1.00 28.33 ? 413 HOH C O 1 HETATM 7132 O O . HOH S 6 . ? -7.418 -18.717 -10.937 1.00 32.88 ? 414 HOH C O 1 HETATM 7133 O O . HOH S 6 . ? 8.675 -8.921 -33.219 1.00 34.68 ? 415 HOH C O 1 HETATM 7134 O O . HOH S 6 . ? 5.924 -6.678 -24.012 1.00 18.23 ? 416 HOH C O 1 HETATM 7135 O O . HOH S 6 . ? 18.933 -9.772 -10.786 1.00 23.67 ? 417 HOH C O 1 HETATM 7136 O O . HOH S 6 . ? 14.376 -20.191 -26.114 1.00 18.90 ? 418 HOH C O 1 HETATM 7137 O O . HOH S 6 . ? 4.657 3.455 -49.755 1.00 23.74 ? 419 HOH C O 1 HETATM 7138 O O . HOH S 6 . ? 9.202 -26.339 -37.772 1.00 36.77 ? 420 HOH C O 1 HETATM 7139 O O . HOH S 6 . ? 0.350 -13.369 -37.632 1.00 22.92 ? 421 HOH C O 1 HETATM 7140 O O . HOH S 6 . ? 6.996 9.276 -54.589 1.00 22.08 ? 422 HOH C O 1 HETATM 7141 O O . HOH S 6 . ? 13.706 -5.807 -53.946 1.00 24.41 ? 423 HOH C O 1 HETATM 7142 O O . HOH S 6 . ? 4.280 4.374 -2.933 1.00 24.40 ? 424 HOH C O 1 HETATM 7143 O O . HOH S 6 . ? 14.730 -10.472 -19.853 1.00 30.55 ? 425 HOH C O 1 HETATM 7144 O O . HOH S 6 . ? 12.452 -19.610 -44.686 1.00 22.55 ? 426 HOH C O 1 HETATM 7145 O O . HOH S 6 . ? 6.987 -6.366 -31.967 1.00 25.92 ? 427 HOH C O 1 HETATM 7146 O O . HOH S 6 . ? -5.344 -6.482 -17.964 1.00 37.39 ? 428 HOH C O 1 HETATM 7147 O O . HOH S 6 . ? -4.711 -2.162 -55.045 1.00 18.99 ? 429 HOH C O 1 HETATM 7148 O O . HOH S 6 . ? -0.207 -20.552 -2.668 1.00 35.97 ? 430 HOH C O 1 HETATM 7149 O O . HOH S 6 . ? 17.060 -21.427 -5.788 1.00 28.60 ? 431 HOH C O 1 HETATM 7150 O O . HOH S 6 . ? 8.469 1.429 -49.287 1.00 18.04 ? 432 HOH C O 1 HETATM 7151 O O . HOH S 6 . ? -3.563 -11.129 -21.873 1.00 16.64 ? 433 HOH C O 1 HETATM 7152 O O . HOH S 6 . ? 9.305 -17.733 -59.304 1.00 29.16 ? 434 HOH C O 1 HETATM 7153 O O . HOH S 6 . ? 2.246 -10.048 -65.268 1.00 31.09 ? 435 HOH C O 1 HETATM 7154 O O . HOH S 6 . ? 9.933 -4.324 -18.491 1.00 18.23 ? 436 HOH C O 1 HETATM 7155 O O . HOH S 6 . ? 5.084 -3.068 -46.010 1.00 33.45 ? 437 HOH C O 1 HETATM 7156 O O . HOH S 6 . ? 10.238 -27.490 -19.342 1.00 33.14 ? 438 HOH C O 1 HETATM 7157 O O . HOH S 6 . ? 0.051 -12.190 -28.264 1.00 24.78 ? 439 HOH C O 1 HETATM 7158 O O . HOH S 6 . ? -1.339 -1.362 -29.854 1.00 28.12 ? 440 HOH C O 1 HETATM 7159 O O . HOH S 6 . ? -0.856 -0.936 -53.520 1.00 20.85 ? 441 HOH C O 1 HETATM 7160 O O . HOH S 6 . ? 15.073 -8.609 -50.399 1.00 33.80 ? 442 HOH C O 1 HETATM 7161 O O . HOH S 6 . ? 11.690 4.511 -55.595 1.00 20.72 ? 443 HOH C O 1 HETATM 7162 O O . HOH S 6 . ? -2.296 -8.752 -22.680 1.00 17.56 ? 444 HOH C O 1 HETATM 7163 O O . HOH S 6 . ? -2.418 2.691 -53.937 1.00 24.29 ? 445 HOH C O 1 HETATM 7164 O O . HOH S 6 . ? 7.151 -10.906 -35.637 1.00 27.36 ? 446 HOH C O 1 HETATM 7165 O O . HOH S 6 . ? -11.911 2.657 -54.312 1.00 45.22 ? 447 HOH C O 1 HETATM 7166 O O . HOH S 6 . ? 11.169 9.921 -60.292 1.00 24.03 ? 448 HOH C O 1 HETATM 7167 O O . HOH S 6 . ? 6.592 -16.866 -8.689 1.00 24.19 ? 449 HOH C O 1 HETATM 7168 O O . HOH S 6 . ? 14.330 -4.452 -12.509 1.00 31.44 ? 450 HOH C O 1 HETATM 7169 O O . HOH S 6 . ? 9.189 -6.122 -68.953 1.00 37.71 ? 451 HOH C O 1 HETATM 7170 O O . HOH S 6 . ? -2.186 -14.304 -55.539 1.00 33.54 ? 452 HOH C O 1 HETATM 7171 O O . HOH S 6 . ? 1.607 -24.794 -13.970 1.00 29.75 ? 453 HOH C O 1 HETATM 7172 O O . HOH S 6 . ? 10.922 -14.866 -17.131 1.00 23.03 ? 454 HOH C O 1 HETATM 7173 O O . HOH S 6 . ? 3.491 -16.538 -0.824 1.00 29.77 ? 455 HOH C O 1 HETATM 7174 O O . HOH S 6 . ? -2.659 -1.277 -63.638 1.00 40.41 ? 456 HOH C O 1 HETATM 7175 O O . HOH S 6 . ? -0.180 -15.017 -39.535 1.00 16.44 ? 457 HOH C O 1 HETATM 7176 O O . HOH S 6 . ? -4.594 -7.463 -26.884 1.00 23.33 ? 458 HOH C O 1 HETATM 7177 O O . HOH S 6 . ? 16.077 -3.361 -50.487 1.00 24.24 ? 459 HOH C O 1 HETATM 7178 O O . HOH S 6 . ? 12.716 -4.191 -47.803 1.00 37.86 ? 460 HOH C O 1 HETATM 7179 O O . HOH S 6 . ? 15.232 -8.941 -16.585 1.00 30.98 ? 461 HOH C O 1 HETATM 7180 O O . HOH S 6 . ? -2.005 1.202 -62.505 1.00 36.51 ? 462 HOH C O 1 HETATM 7181 O O . HOH S 6 . ? 20.300 -3.185 -6.756 1.00 38.36 ? 463 HOH C O 1 HETATM 7182 O O . HOH S 6 . ? 6.295 11.434 -60.249 1.00 28.14 ? 464 HOH C O 1 HETATM 7183 O O . HOH S 6 . ? 3.689 -23.463 -6.077 1.00 32.84 ? 465 HOH C O 1 HETATM 7184 O O . HOH S 6 . ? 8.557 -13.550 -33.115 1.00 57.73 ? 466 HOH C O 1 HETATM 7185 O O . HOH S 6 . ? 3.303 -25.520 -46.632 1.00 36.68 ? 467 HOH C O 1 HETATM 7186 O O . HOH S 6 . ? 6.077 -26.631 -47.351 1.00 37.78 ? 468 HOH C O 1 HETATM 7187 O O . HOH S 6 . ? 6.152 -19.927 -2.989 1.00 40.86 ? 469 HOH C O 1 HETATM 7188 O O . HOH S 6 . ? 13.574 -1.468 -65.051 1.00 39.67 ? 470 HOH C O 1 HETATM 7189 O O . HOH S 6 . ? 11.101 -30.316 -27.998 1.00 36.37 ? 471 HOH C O 1 HETATM 7190 O O . HOH S 6 . ? 7.174 -11.953 1.432 1.00 24.64 ? 472 HOH C O 1 HETATM 7191 O O . HOH S 6 . ? 14.837 -1.307 -49.210 1.00 19.97 ? 473 HOH C O 1 HETATM 7192 O O . HOH S 6 . ? 6.853 2.021 -46.965 1.00 35.40 ? 474 HOH C O 1 HETATM 7193 O O . HOH S 6 . ? 17.031 -16.134 -25.341 1.00 21.04 ? 475 HOH C O 1 HETATM 7194 O O . HOH S 6 . ? -1.770 -24.079 -40.213 1.00 44.55 ? 476 HOH C O 1 HETATM 7195 O O . HOH S 6 . ? 11.184 -27.121 -26.666 1.00 41.95 ? 477 HOH C O 1 HETATM 7196 O O . HOH S 6 . ? -4.129 -1.398 -28.585 1.00 42.92 ? 478 HOH C O 1 HETATM 7197 O O . HOH S 6 . ? 2.251 -23.992 -31.991 1.00 34.72 ? 479 HOH C O 1 HETATM 7198 O O . HOH S 6 . ? -3.809 -18.043 -11.567 1.00 24.47 ? 480 HOH C O 1 HETATM 7199 O O . HOH S 6 . ? -5.813 -15.795 -42.029 1.00 33.97 ? 481 HOH C O 1 HETATM 7200 O O . HOH S 6 . ? 15.689 -17.399 -54.821 1.00 30.93 ? 482 HOH C O 1 HETATM 7201 O O . HOH S 6 . ? 17.234 -8.083 -52.539 1.00 26.26 ? 483 HOH C O 1 HETATM 7202 O O . HOH S 6 . ? 13.585 -21.641 -50.431 1.00 44.68 ? 484 HOH C O 1 HETATM 7203 O O . HOH S 6 . ? 10.730 -22.447 -7.525 1.00 40.61 ? 485 HOH C O 1 HETATM 7204 O O . HOH S 6 . ? 6.641 8.824 -66.834 1.00 22.14 ? 486 HOH C O 1 HETATM 7205 O O . HOH S 6 . ? 18.170 -8.779 -64.420 1.00 36.32 ? 487 HOH C O 1 HETATM 7206 O O . HOH S 6 . ? 11.174 -12.056 -42.356 1.00 32.50 ? 488 HOH C O 1 HETATM 7207 O O . HOH S 6 . ? -0.610 -19.945 -46.152 1.00 22.24 ? 489 HOH C O 1 HETATM 7208 O O . HOH S 6 . ? 15.841 -18.623 -3.677 1.00 38.50 ? 490 HOH C O 1 HETATM 7209 O O . HOH S 6 . ? 11.380 -27.555 -57.346 1.00 41.57 ? 491 HOH C O 1 HETATM 7210 O O . HOH S 6 . ? -5.488 -6.252 -22.733 1.00 24.23 ? 492 HOH C O 1 HETATM 7211 O O . HOH S 6 . ? 6.419 -15.488 2.485 1.00 26.69 ? 493 HOH C O 1 HETATM 7212 O O . HOH S 6 . ? 10.751 -24.086 -20.318 1.00 38.42 ? 494 HOH C O 1 HETATM 7213 O O . HOH S 6 . ? 0.698 -8.541 -34.878 1.00 25.93 ? 495 HOH C O 1 HETATM 7214 O O . HOH S 6 . ? -4.253 -27.667 -15.416 1.00 36.65 ? 496 HOH C O 1 HETATM 7215 O O . HOH S 6 . ? 12.461 -9.992 -23.552 1.00 38.29 ? 497 HOH C O 1 HETATM 7216 O O . HOH S 6 . ? 1.009 -13.678 -60.830 1.00 25.07 ? 498 HOH C O 1 HETATM 7217 O O . HOH S 6 . ? 0.955 8.481 -51.406 1.00 27.29 ? 499 HOH C O 1 HETATM 7218 O O . HOH S 6 . ? 12.041 -3.035 -43.626 1.00 27.50 ? 500 HOH C O 1 HETATM 7219 O O . HOH S 6 . ? 8.943 -19.931 -32.779 1.00 47.97 ? 501 HOH C O 1 HETATM 7220 O O . HOH S 6 . ? 14.104 -20.508 -42.780 1.00 30.44 ? 502 HOH C O 1 HETATM 7221 O O . HOH S 6 . ? -1.763 -8.004 -65.473 1.00 30.30 ? 503 HOH C O 1 HETATM 7222 O O . HOH S 6 . ? 19.028 -7.714 -15.357 1.00 32.28 ? 504 HOH C O 1 HETATM 7223 O O . HOH S 6 . ? 10.793 -0.034 1.168 1.00 32.44 ? 505 HOH C O 1 HETATM 7224 O O . HOH S 6 . ? 0.123 -3.632 -34.008 1.00 28.97 ? 506 HOH C O 1 HETATM 7225 O O . HOH S 6 . ? 9.725 -8.156 -63.701 1.00 33.48 ? 507 HOH C O 1 HETATM 7226 O O . HOH S 6 . ? 5.996 -23.079 -10.792 1.00 42.82 ? 508 HOH C O 1 HETATM 7227 O O . HOH S 6 . ? 14.826 -10.431 -42.461 1.00 42.47 ? 509 HOH C O 1 HETATM 7228 O O . HOH S 6 . ? -1.736 -24.925 -29.607 1.00 40.33 ? 510 HOH C O 1 HETATM 7229 O O . HOH S 6 . ? -6.229 -10.622 -14.304 1.00 37.09 ? 511 HOH C O 1 HETATM 7230 O O . HOH S 6 . ? 9.205 12.456 -66.153 1.00 49.52 ? 512 HOH C O 1 HETATM 7231 O O . HOH S 6 . ? 14.290 3.664 -2.962 1.00 33.36 ? 513 HOH C O 1 HETATM 7232 O O . HOH S 6 . ? -9.472 7.881 -58.216 1.00 42.89 ? 514 HOH C O 1 HETATM 7233 O O . HOH S 6 . ? 5.689 -19.009 -59.170 1.00 41.34 ? 515 HOH C O 1 HETATM 7234 O O . HOH S 6 . ? -10.054 14.018 -56.978 1.00 40.04 ? 516 HOH C O 1 HETATM 7235 O O . HOH S 6 . ? 18.674 -15.706 -23.073 1.00 27.53 ? 517 HOH C O 1 HETATM 7236 O O . HOH S 6 . ? 13.060 2.241 -47.991 1.00 36.43 ? 518 HOH C O 1 HETATM 7237 O O . HOH S 6 . ? -4.102 -17.350 -47.550 1.00 36.09 ? 519 HOH C O 1 HETATM 7238 O O . HOH S 6 . ? 15.737 -22.994 -40.479 1.00 41.04 ? 520 HOH C O 1 HETATM 7239 O O . HOH S 6 . ? -5.447 -7.468 -20.327 1.00 39.95 ? 521 HOH C O 1 HETATM 7240 O O . HOH S 6 . ? 0.826 -12.904 -63.764 1.00 51.36 ? 522 HOH C O 1 HETATM 7241 O O . HOH S 6 . ? -4.611 -16.297 -39.165 1.00 45.77 ? 523 HOH C O 1 HETATM 7242 O O . HOH S 6 . ? 14.369 -5.561 -51.396 1.00 44.78 ? 524 HOH C O 1 HETATM 7243 O O . HOH S 6 . ? 10.916 2.517 -49.163 1.00 30.53 ? 525 HOH C O 1 HETATM 7244 O O . HOH S 6 . ? -2.606 -7.305 -34.698 1.00 34.24 ? 526 HOH C O 1 HETATM 7245 O O . HOH S 6 . ? 14.519 5.169 -5.027 1.00 37.59 ? 527 HOH C O 1 HETATM 7246 O O . HOH S 6 . ? -4.681 -18.450 -49.182 1.00 33.68 ? 528 HOH C O 1 HETATM 7247 O O . HOH S 6 . ? 9.703 -10.388 -64.084 1.00 39.12 ? 529 HOH C O 1 HETATM 7248 O O . HOH S 6 . ? 5.658 -1.081 -44.870 1.00 28.86 ? 530 HOH C O 1 HETATM 7249 O O . HOH S 6 . ? 4.459 12.405 -62.203 1.00 46.11 ? 531 HOH C O 1 HETATM 7250 O O . HOH S 6 . ? -3.272 -3.027 -63.018 1.00 44.43 ? 532 HOH C O 1 HETATM 7251 O O . HOH S 6 . ? 14.546 -17.869 -46.844 1.00 38.61 ? 533 HOH C O 1 HETATM 7252 O O . HOH S 6 . ? 7.922 9.332 -52.075 1.00 39.73 ? 534 HOH C O 1 HETATM 7253 O O . HOH S 6 . ? -1.541 -26.434 -41.749 1.00 39.44 ? 535 HOH C O 1 HETATM 7254 O O . HOH S 6 . ? 14.167 -21.354 -53.340 1.00 34.66 ? 536 HOH C O 1 HETATM 7255 O O . HOH S 6 . ? -5.399 -2.661 -31.146 1.00 47.64 ? 537 HOH C O 1 HETATM 7256 O O . HOH S 6 . ? 2.965 13.470 -60.209 1.00 43.90 ? 538 HOH C O 1 HETATM 7257 O O . HOH S 6 . ? -4.929 -8.389 -24.023 1.00 22.89 ? 539 HOH C O 1 HETATM 7258 O O . HOH S 6 . ? 16.894 0.106 -47.337 1.00 39.60 ? 540 HOH C O 1 HETATM 7259 O O . HOH T 6 . ? 4.800 9.605 -0.689 1.00 32.01 ? 401 HOH D O 1 HETATM 7260 O O . HOH T 6 . ? 0.199 2.927 -35.538 1.00 30.96 ? 402 HOH D O 1 HETATM 7261 O O . HOH T 6 . ? -1.781 11.970 -45.614 1.00 37.53 ? 403 HOH D O 1 HETATM 7262 O O . HOH T 6 . ? 5.272 9.532 -46.668 1.00 37.73 ? 404 HOH D O 1 HETATM 7263 O O . HOH T 6 . ? -1.577 16.241 -23.039 1.00 45.79 ? 405 HOH D O 1 HETATM 7264 O O . HOH T 6 . ? -0.492 -10.890 -33.911 1.00 49.02 ? 406 HOH D O 1 HETATM 7265 O O . HOH T 6 . ? 2.320 -6.058 -3.401 1.00 18.94 ? 407 HOH D O 1 HETATM 7266 O O . HOH T 6 . ? 10.722 6.407 -25.094 1.00 33.33 ? 408 HOH D O 1 HETATM 7267 O O . HOH T 6 . ? -17.011 5.115 -10.123 1.00 39.40 ? 409 HOH D O 1 HETATM 7268 O O . HOH T 6 . ? 9.321 2.938 -19.207 1.00 23.31 ? 410 HOH D O 1 HETATM 7269 O O . HOH T 6 . ? 14.152 -2.763 -20.507 1.00 45.55 ? 411 HOH D O 1 HETATM 7270 O O . HOH T 6 . ? -8.310 10.675 -45.498 1.00 34.34 ? 412 HOH D O 1 HETATM 7271 O O . HOH T 6 . ? 1.443 -0.269 -35.735 1.00 31.89 ? 413 HOH D O 1 HETATM 7272 O O . HOH T 6 . ? 8.410 4.180 -34.086 1.00 35.13 ? 414 HOH D O 1 HETATM 7273 O O . HOH T 6 . ? -5.703 0.232 -6.065 1.00 36.03 ? 415 HOH D O 1 HETATM 7274 O O . HOH T 6 . ? -9.930 -1.786 -17.526 1.00 25.33 ? 416 HOH D O 1 HETATM 7275 O O . HOH T 6 . ? -16.158 -4.684 -51.075 1.00 20.16 ? 417 HOH D O 1 HETATM 7276 O O . HOH T 6 . ? 12.367 11.526 -14.802 1.00 37.30 ? 418 HOH D O 1 HETATM 7277 O O . HOH T 6 . ? -3.153 -13.280 -33.295 1.00 29.22 ? 419 HOH D O 1 HETATM 7278 O O . HOH T 6 . ? -3.842 -8.291 -36.930 1.00 29.31 ? 420 HOH D O 1 HETATM 7279 O O . HOH T 6 . ? 2.894 13.650 -2.299 1.00 22.63 ? 421 HOH D O 1 HETATM 7280 O O . HOH T 6 . ? 12.821 9.487 -18.830 1.00 42.45 ? 422 HOH D O 1 HETATM 7281 O O . HOH T 6 . ? -5.114 -8.012 -15.106 1.00 29.91 ? 423 HOH D O 1 HETATM 7282 O O . HOH T 6 . ? -5.895 3.507 -0.640 1.00 40.89 ? 424 HOH D O 1 HETATM 7283 O O . HOH T 6 . ? -3.391 0.312 -4.235 1.00 24.76 ? 425 HOH D O 1 HETATM 7284 O O . HOH T 6 . ? -12.527 -6.335 -37.493 1.00 30.21 ? 426 HOH D O 1 HETATM 7285 O O . HOH T 6 . ? 10.580 -1.125 -13.116 1.00 13.83 ? 427 HOH D O 1 HETATM 7286 O O . HOH T 6 . ? -18.397 -1.056 -41.753 1.00 17.82 ? 428 HOH D O 1 HETATM 7287 O O . HOH T 6 . ? -6.395 15.260 -18.406 1.00 36.14 ? 429 HOH D O 1 HETATM 7288 O O . HOH T 6 . ? -15.122 7.318 -7.664 1.00 28.67 ? 430 HOH D O 1 HETATM 7289 O O . HOH T 6 . ? 1.156 9.135 -29.712 1.00 16.18 ? 431 HOH D O 1 HETATM 7290 O O . HOH T 6 . ? 9.277 0.884 -11.630 1.00 25.71 ? 432 HOH D O 1 HETATM 7291 O O . HOH T 6 . ? -11.120 9.154 -19.531 1.00 33.27 ? 433 HOH D O 1 HETATM 7292 O O . HOH T 6 . ? -11.007 1.497 -36.394 1.00 24.42 ? 434 HOH D O 1 HETATM 7293 O O . HOH T 6 . ? 13.775 15.648 -26.538 1.00 27.37 ? 435 HOH D O 1 HETATM 7294 O O . HOH T 6 . ? -3.010 4.919 -27.318 1.00 26.01 ? 436 HOH D O 1 HETATM 7295 O O . HOH T 6 . ? 4.220 7.836 -32.871 1.00 16.79 ? 437 HOH D O 1 HETATM 7296 O O . HOH T 6 . ? -19.753 -4.308 -44.881 1.00 33.21 ? 438 HOH D O 1 HETATM 7297 O O . HOH T 6 . ? -12.319 11.747 -42.558 1.00 43.84 ? 439 HOH D O 1 HETATM 7298 O O . HOH T 6 . ? 6.182 21.644 -19.277 1.00 39.96 ? 440 HOH D O 1 HETATM 7299 O O . HOH T 6 . ? 8.051 -3.776 -21.053 1.00 21.78 ? 441 HOH D O 1 HETATM 7300 O O . HOH T 6 . ? -12.938 14.745 -5.181 1.00 56.14 ? 442 HOH D O 1 HETATM 7301 O O . HOH T 6 . ? -5.806 6.166 -32.986 1.00 27.45 ? 443 HOH D O 1 HETATM 7302 O O . HOH T 6 . ? -15.722 0.911 -4.177 1.00 30.79 ? 444 HOH D O 1 HETATM 7303 O O . HOH T 6 . ? 2.357 2.419 0.411 1.00 33.18 ? 445 HOH D O 1 HETATM 7304 O O . HOH T 6 . ? -10.761 11.035 -51.185 1.00 42.12 ? 446 HOH D O 1 HETATM 7305 O O . HOH T 6 . ? -6.873 11.574 -29.033 1.00 42.36 ? 447 HOH D O 1 HETATM 7306 O O . HOH T 6 . ? -18.984 9.033 -11.092 1.00 37.94 ? 448 HOH D O 1 HETATM 7307 O O . HOH T 6 . ? -4.858 15.097 -4.010 1.00 36.90 ? 449 HOH D O 1 HETATM 7308 O O . HOH T 6 . ? 2.615 19.983 -26.712 1.00 33.75 ? 450 HOH D O 1 HETATM 7309 O O . HOH T 6 . ? 0.221 -6.239 -35.429 1.00 39.82 ? 451 HOH D O 1 HETATM 7310 O O . HOH T 6 . ? 12.466 4.888 -24.461 1.00 40.52 ? 452 HOH D O 1 HETATM 7311 O O . HOH T 6 . ? 13.505 4.910 -8.378 1.00 38.85 ? 453 HOH D O 1 HETATM 7312 O O . HOH T 6 . ? -7.405 -5.015 -16.874 1.00 39.14 ? 454 HOH D O 1 HETATM 7313 O O . HOH T 6 . ? -10.698 0.450 -20.952 1.00 29.77 ? 455 HOH D O 1 HETATM 7314 O O . HOH T 6 . ? 4.730 15.252 -39.090 1.00 41.47 ? 456 HOH D O 1 HETATM 7315 O O . HOH T 6 . ? 7.744 8.608 -33.596 1.00 44.88 ? 457 HOH D O 1 HETATM 7316 O O . HOH T 6 . ? -11.365 -1.123 -54.331 1.00 37.30 ? 458 HOH D O 1 HETATM 7317 O O . HOH T 6 . ? -5.604 -14.590 -43.470 1.00 30.86 ? 459 HOH D O 1 HETATM 7318 O O . HOH T 6 . ? 4.763 2.794 -47.131 1.00 23.53 ? 460 HOH D O 1 HETATM 7319 O O . HOH T 6 . ? -9.737 -17.075 -45.499 1.00 30.38 ? 461 HOH D O 1 HETATM 7320 O O . HOH T 6 . ? 0.563 13.659 -0.698 1.00 28.87 ? 462 HOH D O 1 HETATM 7321 O O . HOH T 6 . ? 13.322 7.067 -16.149 1.00 29.43 ? 463 HOH D O 1 HETATM 7322 O O . HOH T 6 . ? -13.016 3.505 -33.538 1.00 43.27 ? 464 HOH D O 1 HETATM 7323 O O . HOH T 6 . ? -12.852 -20.217 -51.487 1.00 42.44 ? 465 HOH D O 1 HETATM 7324 O O . HOH T 6 . ? -4.709 15.337 -16.476 1.00 36.48 ? 466 HOH D O 1 HETATM 7325 O O . HOH T 6 . ? -14.589 3.697 -16.991 1.00 38.52 ? 467 HOH D O 1 HETATM 7326 O O . HOH T 6 . ? -10.106 -5.303 -1.654 1.00 43.76 ? 468 HOH D O 1 HETATM 7327 O O . HOH T 6 . ? -1.246 1.186 -35.275 1.00 23.75 ? 469 HOH D O 1 HETATM 7328 O O . HOH T 6 . ? 9.581 1.014 -38.975 1.00 38.99 ? 470 HOH D O 1 HETATM 7329 O O . HOH T 6 . ? -2.924 0.783 -52.378 1.00 27.35 ? 471 HOH D O 1 HETATM 7330 O O . HOH T 6 . ? 11.616 2.339 -11.060 1.00 24.46 ? 472 HOH D O 1 HETATM 7331 O O . HOH T 6 . ? 6.826 13.662 -38.719 1.00 26.65 ? 473 HOH D O 1 HETATM 7332 O O . HOH T 6 . ? -10.917 15.271 -18.642 1.00 31.81 ? 474 HOH D O 1 HETATM 7333 O O . HOH T 6 . ? -13.977 4.979 -39.667 1.00 35.97 ? 475 HOH D O 1 HETATM 7334 O O . HOH T 6 . ? -12.863 -13.866 -43.699 1.00 29.21 ? 476 HOH D O 1 HETATM 7335 O O . HOH T 6 . ? 9.186 10.628 -37.138 1.00 34.81 ? 477 HOH D O 1 HETATM 7336 O O . HOH T 6 . ? -1.610 19.587 -37.151 1.00 45.99 ? 478 HOH D O 1 HETATM 7337 O O . HOH T 6 . ? -15.322 -13.018 -38.803 1.00 39.66 ? 479 HOH D O 1 HETATM 7338 O O . HOH T 6 . ? 17.319 7.173 -23.192 1.00 46.35 ? 480 HOH D O 1 HETATM 7339 O O . HOH T 6 . ? 6.151 11.723 -3.414 1.00 41.13 ? 481 HOH D O 1 HETATM 7340 O O . HOH T 6 . ? 10.422 4.789 -46.558 1.00 32.56 ? 482 HOH D O 1 HETATM 7341 O O . HOH T 6 . ? 6.075 17.859 -39.191 1.00 51.95 ? 483 HOH D O 1 HETATM 7342 O O . HOH T 6 . ? -10.086 2.739 1.469 1.00 36.40 ? 484 HOH D O 1 HETATM 7343 O O . HOH T 6 . ? -17.231 0.812 -37.207 1.00 48.68 ? 485 HOH D O 1 HETATM 7344 O O . HOH T 6 . ? -14.374 -7.007 -33.220 1.00 36.16 ? 486 HOH D O 1 HETATM 7345 O O . HOH T 6 . ? 6.230 8.122 -49.984 1.00 30.70 ? 487 HOH D O 1 HETATM 7346 O O . HOH T 6 . ? -7.113 15.431 -5.515 1.00 33.91 ? 488 HOH D O 1 HETATM 7347 O O . HOH T 6 . ? -9.092 -9.210 -36.263 1.00 33.86 ? 489 HOH D O 1 HETATM 7348 O O . HOH T 6 . ? -11.386 -1.126 -0.019 1.00 32.25 ? 490 HOH D O 1 HETATM 7349 O O . HOH T 6 . ? -18.280 7.774 -5.252 1.00 34.90 ? 491 HOH D O 1 HETATM 7350 O O . HOH T 6 . ? -6.144 -13.962 -38.151 1.00 35.22 ? 492 HOH D O 1 HETATM 7351 O O . HOH T 6 . ? -17.207 2.307 -38.399 1.00 54.76 ? 493 HOH D O 1 HETATM 7352 O O . HOH T 6 . ? -5.836 -8.729 -36.188 1.00 32.94 ? 494 HOH D O 1 HETATM 7353 O O . HOH T 6 . ? -11.617 -17.436 -46.830 1.00 21.68 ? 495 HOH D O 1 HETATM 7354 O O . HOH T 6 . ? 12.052 2.177 -39.505 1.00 45.95 ? 496 HOH D O 1 HETATM 7355 O O . HOH T 6 . ? -19.123 2.183 -7.572 1.00 42.04 ? 497 HOH D O 1 HETATM 7356 O O . HOH T 6 . ? -19.907 0.474 -8.614 1.00 48.86 ? 498 HOH D O 1 HETATM 7357 O O . HOH T 6 . ? 2.485 3.927 1.409 1.00 36.92 ? 499 HOH D O 1 HETATM 7358 O O . HOH T 6 . ? -23.115 -1.429 -54.841 1.00 46.42 ? 500 HOH D O 1 HETATM 7359 O O . HOH T 6 . ? -16.366 -13.822 -37.222 1.00 43.30 ? 501 HOH D O 1 HETATM 7360 O O . HOH T 6 . ? 8.244 6.706 -31.368 1.00 30.83 ? 502 HOH D O 1 HETATM 7361 O O . HOH T 6 . ? -18.553 5.357 -7.089 1.00 45.23 ? 503 HOH D O 1 HETATM 7362 O O . HOH T 6 . ? -9.679 -6.521 -36.664 1.00 30.40 ? 504 HOH D O 1 HETATM 7363 O O . HOH T 6 . ? 13.345 9.727 -16.218 1.00 29.70 ? 505 HOH D O 1 HETATM 7364 O O . HOH T 6 . ? -13.541 3.751 -36.884 1.00 38.55 ? 506 HOH D O 1 HETATM 7365 O O . HOH T 6 . ? -15.839 -17.173 -40.619 1.00 36.91 ? 507 HOH D O 1 HETATM 7366 O O . HOH T 6 . ? -11.555 11.556 -20.932 1.00 37.99 ? 508 HOH D O 1 HETATM 7367 O O . HOH T 6 . ? -9.950 12.314 -44.447 1.00 42.46 ? 509 HOH D O 1 HETATM 7368 O O . HOH T 6 . ? -15.159 -14.603 -44.433 1.00 39.57 ? 510 HOH D O 1 HETATM 7369 O O . HOH T 6 . ? -16.034 -14.525 -41.102 1.00 36.05 ? 511 HOH D O 1 HETATM 7370 O O . HOH T 6 . ? -15.072 -17.184 -44.844 1.00 46.63 ? 512 HOH D O 1 HETATM 7371 O O . HOH U 6 . ? 24.152 -33.424 -38.110 1.00 35.37 ? 101 HOH E O 1 HETATM 7372 O O . HOH U 6 . ? 17.835 -33.783 -25.099 1.00 18.55 ? 102 HOH E O 1 HETATM 7373 O O . HOH U 6 . ? 25.164 -25.195 -30.343 1.00 23.98 ? 103 HOH E O 1 HETATM 7374 O O . HOH U 6 . ? 31.201 -39.699 -31.670 1.00 26.89 ? 104 HOH E O 1 HETATM 7375 O O . HOH U 6 . ? 24.228 -36.596 -37.842 1.00 31.18 ? 105 HOH E O 1 HETATM 7376 O O . HOH U 6 . ? 32.076 -39.406 -35.388 1.00 36.77 ? 106 HOH E O 1 HETATM 7377 O O . HOH U 6 . ? 30.888 -35.237 -36.416 1.00 32.90 ? 107 HOH E O 1 HETATM 7378 O O . HOH U 6 . ? 16.364 -31.883 -25.443 1.00 34.19 ? 108 HOH E O 1 HETATM 7379 O O . HOH U 6 . ? 20.723 -35.932 -24.271 1.00 48.23 ? 109 HOH E O 1 HETATM 7380 O O . HOH V 6 . ? 7.511 -2.355 -35.140 1.00 32.36 ? 101 HOH F O 1 HETATM 7381 O O . HOH V 6 . ? 7.501 -5.690 -35.417 1.00 44.29 ? 102 HOH F O 1 HETATM 7382 O O . HOH V 6 . ? 12.180 -2.692 -23.525 1.00 35.03 ? 103 HOH F O 1 HETATM 7383 O O . HOH V 6 . ? 0.129 0.309 -29.129 1.00 24.24 ? 104 HOH F O 1 HETATM 7384 O O . HOH V 6 . ? 10.946 -0.124 -30.024 1.00 37.76 ? 105 HOH F O 1 HETATM 7385 O O . HOH V 6 . ? 13.563 -6.055 -22.719 1.00 33.44 ? 106 HOH F O 1 HETATM 7386 O O . HOH V 6 . ? 8.694 1.729 -30.527 1.00 34.15 ? 107 HOH F O 1 HETATM 7387 O O . HOH V 6 . ? 15.427 -8.513 -23.069 1.00 32.35 ? 108 HOH F O 1 HETATM 7388 O O . HOH V 6 . ? -1.937 2.308 -28.568 1.00 33.49 ? 109 HOH F O 1 HETATM 7389 O O . HOH V 6 . ? -1.241 0.420 -32.495 1.00 38.81 ? 110 HOH F O 1 HETATM 7390 O O . HOH V 6 . ? -4.459 1.557 -30.164 1.00 32.76 ? 111 HOH F O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . ASP A 1 ? 0.4171 0.5155 0.4341 -0.1128 -0.0675 0.1153 1 ASP A N 2 C CA . ASP A 1 ? 0.4106 0.4893 0.4173 -0.0924 -0.0602 0.0967 1 ASP A CA 3 C C . ASP A 1 ? 0.3936 0.5004 0.4065 -0.0764 -0.0424 0.0918 1 ASP A C 4 O O . ASP A 1 ? 0.4235 0.5606 0.4513 -0.0786 -0.0393 0.0997 1 ASP A O 5 C CB . ASP A 1 ? 0.4365 0.4810 0.4388 -0.0888 -0.0730 0.0832 1 ASP A CB 6 C CG . ASP A 1 ? 0.5210 0.5313 0.5154 -0.1016 -0.0917 0.0864 1 ASP A CG 7 O OD1 . ASP A 1 ? 0.5549 0.5631 0.5454 -0.1126 -0.0955 0.0987 1 ASP A OD1 8 O OD2 . ASP A 1 ? 0.5298 0.5125 0.5194 -0.0996 -0.1025 0.0761 1 ASP A OD2 9 N N . ILE A 2 ? 0.3822 0.4779 0.3839 -0.0607 -0.0320 0.0792 2 ILE A N 10 C CA . ILE A 2 ? 0.3509 0.4635 0.3540 -0.0443 -0.0161 0.0731 2 ILE A CA 11 C C . ILE A 2 ? 0.3250 0.4334 0.3348 -0.0377 -0.0198 0.0657 2 ILE A C 12 O O . ILE A 2 ? 0.2394 0.3206 0.2430 -0.0367 -0.0282 0.0553 2 ILE A O 13 C CB . ILE A 2 ? 0.3310 0.4261 0.3166 -0.0322 -0.0065 0.0612 2 ILE A CB 14 C CG1 . ILE A 2 ? 0.2992 0.3946 0.2730 -0.0391 -0.0047 0.0676 2 ILE A CG1 15 C CG2 . ILE A 2 ? 0.2188 0.3261 0.2022 -0.0159 0.0094 0.0559 2 ILE A CG2 16 C CD1 . ILE A 2 ? 0.2630 0.3912 0.2388 -0.0391 0.0084 0.0788 2 ILE A CD1 17 N N . LEU A 3 ? 0.3213 0.4585 0.3435 -0.0322 -0.0131 0.0716 3 LEU A N 18 C CA . LEU A 3 ? 0.2977 0.4326 0.3238 -0.0246 -0.0159 0.0659 3 LEU A CA 19 C C . LEU A 3 ? 0.3255 0.4522 0.3415 -0.0055 -0.0021 0.0555 3 LEU A C 20 O O . LEU A 3 ? 0.2649 0.4083 0.2810 0.0053 0.0118 0.0583 3 LEU A O 21 C CB . LEU A 3 ? 0.3108 0.4818 0.3573 -0.0292 -0.0193 0.0794 3 LEU A CB 22 C CG . LEU A 3 ? 0.3957 0.5690 0.4457 -0.0199 -0.0219 0.0758 3 LEU A CG 23 C CD1 . LEU A 3 ? 0.3672 0.5072 0.4052 -0.0274 -0.0368 0.0659 3 LEU A CD1 24 C CD2 . LEU A 3 ? 0.3343 0.5513 0.4081 -0.0224 -0.0244 0.0913 3 LEU A CD2 25 N N . LEU A 4 ? 0.2609 0.3603 0.2664 -0.0014 -0.0056 0.0435 4 LEU A N 26 C CA . LEU A 4 ? 0.2705 0.3581 0.2652 0.0135 0.0052 0.0347 4 LEU A CA 27 C C . LEU A 4 ? 0.3249 0.4179 0.3239 0.0199 0.0029 0.0359 4 LEU A C 28 O O . LEU A 4 ? 0.3477 0.4324 0.3466 0.0131 -0.0082 0.0337 4 LEU A O 29 C CB . LEU A 4 ? 0.2857 0.3432 0.2665 0.0128 0.0041 0.0224 4 LEU A CB 30 C CG . LEU A 4 ? 0.3057 0.3559 0.2803 0.0074 0.0048 0.0212 4 LEU A CG 31 C CD1 . LEU A 4 ? 0.3867 0.4133 0.3535 0.0064 0.0013 0.0105 4 LEU A CD1 32 C CD2 . LEU A 4 ? 0.2008 0.2582 0.1671 0.0150 0.0179 0.0225 4 LEU A CD2 33 N N . THR A 5 ? 0.3054 0.4103 0.3059 0.0340 0.0131 0.0390 5 THR A N 34 C CA . THR A 5 ? 0.3193 0.4306 0.3237 0.0419 0.0107 0.0423 5 THR A CA 35 C C . THR A 5 ? 0.3202 0.4042 0.3065 0.0540 0.0184 0.0336 5 THR A C 36 O O . THR A 5 ? 0.3251 0.4021 0.3032 0.0653 0.0302 0.0311 5 THR A O 37 C CB . THR A 5 ? 0.2784 0.4282 0.3025 0.0502 0.0144 0.0557 5 THR A CB 38 O OG1 . THR A 5 ? 0.2459 0.4224 0.2874 0.0351 0.0066 0.0656 5 THR A OG1 39 C CG2 . THR A 5 ? 0.2038 0.3617 0.2332 0.0585 0.0089 0.0609 5 THR A CG2 40 N N . GLN A 6 ? 0.3511 0.4182 0.3288 0.0507 0.0117 0.0290 6 GLN A N 41 C CA . GLN A 6 ? 0.3364 0.3774 0.2964 0.0584 0.0179 0.0226 6 GLN A CA 42 C C . GLN A 6 ? 0.4041 0.4495 0.3636 0.0689 0.0164 0.0296 6 GLN A C 43 O O . GLN A 6 ? 0.4430 0.5028 0.4098 0.0646 0.0059 0.0354 6 GLN A O 44 C CB . GLN A 6 ? 0.2271 0.2474 0.1762 0.0483 0.0140 0.0132 6 GLN A CB 45 C CG . GLN A 6 ? 0.2711 0.2806 0.2171 0.0423 0.0176 0.0056 6 GLN A CG 46 C CD . GLN A 6 ? 0.2617 0.2544 0.1992 0.0360 0.0163 -0.0030 6 GLN A CD 47 O OE1 . GLN A 6 ? 0.2573 0.2512 0.1996 0.0288 0.0099 -0.0067 6 GLN A OE1 48 N NE2 . GLN A 6 ? 0.2207 0.1974 0.1454 0.0391 0.0226 -0.0057 6 GLN A NE2 49 N N . SER A 7 ? 0.3828 0.4128 0.3313 0.0825 0.0256 0.0293 7 SER A N 50 C CA . SER A 7 ? 0.4910 0.5214 0.4375 0.0953 0.0242 0.0372 7 SER A CA 51 C C . SER A 7 ? 0.5224 0.5151 0.4447 0.1013 0.0306 0.0326 7 SER A C 52 O O . SER A 7 ? 0.5318 0.5022 0.4417 0.0992 0.0382 0.0242 7 SER A O 53 C CB . SER A 7 ? 0.5275 0.5859 0.4915 0.1111 0.0284 0.0468 7 SER A CB 54 O OG . SER A 7 ? 0.6147 0.6520 0.5654 0.1278 0.0407 0.0437 7 SER A OG 55 N N . PRO A 8 ? 0.4551 0.4394 0.3690 0.1064 0.0259 0.0389 8 PRO A N 56 C CA . PRO A 8 ? 0.4227 0.4318 0.3480 0.1045 0.0139 0.0479 8 PRO A CA 57 C C . PRO A 8 ? 0.4069 0.4134 0.3261 0.0858 0.0065 0.0416 8 PRO A C 58 O O . PRO A 8 ? 0.4224 0.4143 0.3345 0.0763 0.0114 0.0314 8 PRO A O 59 C CB . PRO A 8 ? 0.4546 0.4471 0.3661 0.1166 0.0122 0.0559 8 PRO A CB 60 C CG . PRO A 8 ? 0.5189 0.4709 0.4059 0.1148 0.0210 0.0485 8 PRO A CG 61 C CD . PRO A 8 ? 0.5176 0.4662 0.4086 0.1138 0.0305 0.0391 8 PRO A CD 62 N N . VAL A 9 ? 0.3916 0.4120 0.3127 0.0814 -0.0055 0.0475 9 VAL A N 63 C CA . VAL A 9 ? 0.4062 0.4223 0.3186 0.0659 -0.0125 0.0402 9 VAL A CA 64 C C . VAL A 9 ? 0.3473 0.3352 0.2335 0.0627 -0.0076 0.0347 9 VAL A C 65 O O . VAL A 9 ? 0.3227 0.3008 0.2011 0.0531 -0.0046 0.0245 9 VAL A O 66 C CB . VAL A 9 ? 0.4361 0.4751 0.3566 0.0602 -0.0285 0.0474 9 VAL A CB 67 C CG1 . VAL A 9 ? 0.4063 0.4308 0.3027 0.0530 -0.0362 0.0447 9 VAL A CG1 68 C CG2 . VAL A 9 ? 0.3793 0.4348 0.3168 0.0494 -0.0337 0.0443 9 VAL A CG2 69 N N . ILE A 10 ? 0.4465 0.4224 0.3201 0.0715 -0.0064 0.0427 10 ILE A N 70 C CA . ILE A 10 ? 0.4326 0.3821 0.2809 0.0677 -0.0007 0.0408 10 ILE A CA 71 C C . ILE A 10 ? 0.4611 0.3890 0.3022 0.0782 0.0074 0.0459 10 ILE A C 72 O O . ILE A 10 ? 0.5465 0.4788 0.3953 0.0925 0.0050 0.0548 10 ILE A O 73 C CB . ILE A 10 ? 0.4410 0.3895 0.2712 0.0655 -0.0102 0.0477 10 ILE A CB 74 C CG1 . ILE A 10 ? 0.4655 0.4298 0.2970 0.0553 -0.0204 0.0420 10 ILE A CG1 75 C CG2 . ILE A 10 ? 0.4815 0.4047 0.2845 0.0601 -0.0027 0.0471 10 ILE A CG2 76 C CD1 . ILE A 10 ? 0.5261 0.4858 0.3328 0.0512 -0.0297 0.0466 10 ILE A CD1 77 N N . LEU A 11 ? 0.3930 0.2974 0.2196 0.0711 0.0166 0.0404 11 LEU A N 78 C CA . LEU A 11 ? 0.4559 0.3303 0.2673 0.0771 0.0224 0.0454 11 LEU A CA 79 C C . LEU A 11 ? 0.5223 0.3763 0.3082 0.0677 0.0235 0.0501 11 LEU A C 80 O O . LEU A 11 ? 0.5041 0.3645 0.2849 0.0541 0.0264 0.0443 11 LEU A O 81 C CB . LEU A 11 ? 0.4310 0.2922 0.2455 0.0743 0.0313 0.0365 11 LEU A CB 82 C CG . LEU A 11 ? 0.4336 0.3043 0.2643 0.0879 0.0327 0.0351 11 LEU A CG 83 C CD1 . LEU A 11 ? 0.4755 0.3376 0.3077 0.0811 0.0398 0.0244 11 LEU A CD1 84 C CD2 . LEU A 11 ? 0.3988 0.2509 0.2208 0.1065 0.0328 0.0441 11 LEU A CD2 85 N N . SER A 12 ? 0.4895 0.3192 0.2586 0.0759 0.0218 0.0613 12 SER A N 86 C CA . SER A 12 ? 0.5171 0.3245 0.2590 0.0659 0.0230 0.0684 12 SER A CA 87 C C . SER A 12 ? 0.5730 0.3397 0.2981 0.0690 0.0270 0.0741 12 SER A C 88 O O . SER A 12 ? 0.6037 0.3550 0.3275 0.0867 0.0231 0.0809 12 SER A O 89 C CB . SER A 12 ? 0.4883 0.3035 0.2192 0.0705 0.0127 0.0798 12 SER A CB 90 O OG . SER A 12 ? 0.7120 0.5073 0.4141 0.0592 0.0149 0.0871 12 SER A OG 91 N N . VAL A 13 ? 0.5649 0.3142 0.2777 0.0517 0.0345 0.0710 13 VAL A N 92 C CA . VAL A 13 ? 0.6273 0.3333 0.3219 0.0498 0.0374 0.0748 13 VAL A CA 93 C C . VAL A 13 ? 0.6673 0.3548 0.3385 0.0291 0.0409 0.0825 13 VAL A C 94 O O . VAL A 13 ? 0.6331 0.3464 0.3059 0.0159 0.0445 0.0814 13 VAL A O 95 C CB . VAL A 13 ? 0.6413 0.3428 0.3479 0.0471 0.0427 0.0618 13 VAL A CB 96 C CG1 . VAL A 13 ? 0.6257 0.3468 0.3538 0.0670 0.0409 0.0554 13 VAL A CG1 97 C CG2 . VAL A 13 ? 0.5892 0.3158 0.3078 0.0266 0.0484 0.0526 13 VAL A CG2 98 N N . SER A 14 ? 0.7197 0.3612 0.3678 0.0263 0.0403 0.0905 14 SER A N 99 C CA . SER A 14 ? 0.7024 0.3237 0.3276 0.0034 0.0437 0.0999 14 SER A CA 100 C C . SER A 14 ? 0.6501 0.2694 0.2821 -0.0167 0.0502 0.0908 14 SER A C 101 O O . SER A 14 ? 0.6399 0.2515 0.2822 -0.0104 0.0498 0.0801 14 SER A O 102 C CB . SER A 14 ? 0.7634 0.3315 0.3574 0.0089 0.0374 0.1152 14 SER A CB 103 O OG . SER A 14 ? 0.8286 0.4052 0.4226 0.0290 0.0293 0.1233 14 SER A OG 104 N N . PRO A 15 ? 0.6571 0.2862 0.2835 -0.0413 0.0564 0.0957 15 PRO A N 105 C CA . PRO A 15 ? 0.7326 0.3649 0.3682 -0.0627 0.0612 0.0894 15 PRO A CA 106 C C . PRO A 15 ? 0.7530 0.3304 0.3695 -0.0670 0.0558 0.0909 15 PRO A C 107 O O . PRO A 15 ? 0.7386 0.2759 0.3317 -0.0623 0.0501 0.1008 15 PRO A O 108 C CB . PRO A 15 ? 0.6659 0.3148 0.2938 -0.0868 0.0687 0.1001 15 PRO A CB 109 C CG . PRO A 15 ? 0.6933 0.3289 0.2979 -0.0792 0.0659 0.1136 15 PRO A CG 110 C CD . PRO A 15 ? 0.6714 0.3129 0.2830 -0.0508 0.0594 0.1079 15 PRO A CD 111 N N . GLY A 16 ? 0.7496 0.3291 0.3792 -0.0739 0.0559 0.0788 16 GLY A N 112 C CA . GLY A 16 ? 0.7235 0.2489 0.3321 -0.0791 0.0501 0.0771 16 GLY A CA 113 C C . GLY A 16 ? 0.7843 0.2883 0.3908 -0.0509 0.0464 0.0665 16 GLY A C 114 O O . GLY A 16 ? 0.8959 0.3657 0.4903 -0.0519 0.0423 0.0587 16 GLY A O 115 N N . GLU A 17 ? 0.7444 0.2759 0.3656 -0.0258 0.0475 0.0651 17 GLU A N 116 C CA . GLU A 17 ? 0.7305 0.2509 0.3535 0.0028 0.0457 0.0571 17 GLU A CA 117 C C . GLU A 17 ? 0.7041 0.2567 0.3512 0.0043 0.0486 0.0413 17 GLU A C 118 O O . GLU A 17 ? 0.6711 0.2675 0.3413 -0.0089 0.0512 0.0376 17 GLU A O 119 C CB . GLU A 17 ? 0.7128 0.2547 0.3447 0.0268 0.0443 0.0642 17 GLU A CB 120 C CG . GLU A 17 ? 0.9265 0.4244 0.5309 0.0377 0.0391 0.0788 17 GLU A CG 121 C CD . GLU A 17 ? 0.9698 0.4963 0.5842 0.0559 0.0356 0.0885 17 GLU A CD 122 O OE1 . GLU A 17 ? 0.7972 0.3754 0.4394 0.0601 0.0372 0.0824 17 GLU A OE1 123 O OE2 . GLU A 17 ? 1.0278 0.5356 0.6299 0.0634 0.0294 0.0994 17 GLU A OE2 124 N N . ARG A 18 ? 0.7351 0.2652 0.3754 0.0218 0.0483 0.0325 18 ARG A N 125 C CA . ARG A 18 ? 0.7066 0.2692 0.3684 0.0274 0.0510 0.0195 18 ARG A CA 126 C C . ARG A 18 ? 0.6791 0.2900 0.3685 0.0457 0.0527 0.0212 18 ARG A C 127 O O . ARG A 18 ? 0.6555 0.2646 0.3426 0.0614 0.0511 0.0305 18 ARG A O 128 C CB . ARG A 18 ? 0.6597 0.1833 0.3017 0.0413 0.0517 0.0095 18 ARG A CB 129 N N . VAL A 19 ? 0.6332 0.2861 0.3479 0.0426 0.0543 0.0133 19 VAL A N 130 C CA . VAL A 19 ? 0.5752 0.2713 0.3150 0.0573 0.0544 0.0145 19 VAL A CA 131 C C . VAL A 19 ? 0.5035 0.2258 0.2613 0.0592 0.0563 0.0043 19 VAL A C 132 O O . VAL A 19 ? 0.5120 0.2343 0.2703 0.0433 0.0563 -0.0029 19 VAL A O 133 C CB . VAL A 19 ? 0.5825 0.3099 0.3353 0.0470 0.0525 0.0204 19 VAL A CB 134 C CG1 . VAL A 19 ? 0.5178 0.2729 0.2871 0.0288 0.0538 0.0129 19 VAL A CG1 135 C CG2 . VAL A 19 ? 0.5828 0.3405 0.3520 0.0634 0.0496 0.0250 19 VAL A CG2 136 N N . SER A 20 ? 0.5162 0.2622 0.2889 0.0776 0.0572 0.0051 20 SER A N 137 C CA . SER A 20 ? 0.4236 0.1948 0.2118 0.0798 0.0593 -0.0024 20 SER A CA 138 C C . SER A 20 ? 0.4366 0.2538 0.2528 0.0828 0.0564 0.0014 20 SER A C 139 O O . SER A 20 ? 0.4797 0.3089 0.3026 0.0929 0.0538 0.0097 20 SER A O 140 C CB . SER A 20 ? 0.4983 0.2508 0.2742 0.0986 0.0649 -0.0061 20 SER A CB 141 O OG . SER A 20 ? 0.6695 0.3765 0.4167 0.0920 0.0661 -0.0128 20 SER A OG 142 N N . PHE A 21 ? 0.4621 0.3028 0.2931 0.0732 0.0554 -0.0041 21 PHE A N 143 C CA . PHE A 21 ? 0.3919 0.2710 0.2470 0.0737 0.0515 -0.0013 21 PHE A CA 144 C C . PHE A 21 ? 0.4560 0.3516 0.3203 0.0813 0.0546 -0.0029 21 PHE A C 145 O O . PHE A 21 ? 0.4328 0.3161 0.2875 0.0783 0.0582 -0.0096 21 PHE A O 146 C CB . PHE A 21 ? 0.2980 0.1906 0.1628 0.0568 0.0471 -0.0054 21 PHE A CB 147 C CG . PHE A 21 ? 0.3307 0.2119 0.1865 0.0479 0.0465 -0.0045 21 PHE A CG 148 C CD1 . PHE A 21 ? 0.3369 0.1949 0.1787 0.0379 0.0495 -0.0075 21 PHE A CD1 149 C CD2 . PHE A 21 ? 0.3415 0.2361 0.2017 0.0477 0.0426 -0.0002 21 PHE A CD2 150 C CE1 . PHE A 21 ? 0.4223 0.2740 0.2568 0.0281 0.0502 -0.0049 21 PHE A CE1 151 C CE2 . PHE A 21 ? 0.3752 0.2612 0.2247 0.0395 0.0438 0.0010 21 PHE A CE2 152 C CZ . PHE A 21 ? 0.3706 0.2369 0.2084 0.0297 0.0484 -0.0007 21 PHE A CZ 153 N N . SER A 22 ? 0.4546 0.3797 0.3369 0.0895 0.0526 0.0041 22 SER A N 154 C CA . SER A 22 ? 0.4155 0.3614 0.3079 0.0964 0.0569 0.0051 22 SER A CA 155 C C . SER A 22 ? 0.4263 0.4008 0.3380 0.0832 0.0503 0.0064 22 SER A C 156 O O . SER A 22 ? 0.4124 0.4009 0.3358 0.0769 0.0420 0.0103 22 SER A O 157 C CB . SER A 22 ? 0.3031 0.2656 0.2045 0.1159 0.0603 0.0140 22 SER A CB 158 O OG . SER A 22 ? 0.6000 0.5931 0.5163 0.1206 0.0648 0.0173 22 SER A OG 159 N N . CYS A 23 ? 0.4618 0.4410 0.3732 0.0788 0.0532 0.0030 23 CYS A N 160 C CA . CYS A 23 ? 0.3672 0.3705 0.2951 0.0673 0.0468 0.0059 23 CYS A CA 161 C C . CYS A 23 ? 0.3915 0.4152 0.3244 0.0727 0.0534 0.0105 23 CYS A C 162 O O . CYS A 23 ? 0.3741 0.3849 0.2912 0.0751 0.0607 0.0050 23 CYS A O 163 C CB . CYS A 23 ? 0.3165 0.3058 0.2389 0.0531 0.0420 -0.0016 23 CYS A CB 164 S SG . CYS A 23 ? 0.3520 0.3620 0.2912 0.0398 0.0322 0.0021 23 CYS A SG 165 N N . ARG A 24 ? 0.2765 0.3330 0.2301 0.0736 0.0508 0.0209 24 ARG A N 166 C CA . ARG A 24 ? 0.3509 0.4344 0.3124 0.0778 0.0584 0.0276 24 ARG A CA 167 C C . ARG A 24 ? 0.3742 0.4782 0.3492 0.0603 0.0504 0.0342 24 ARG A C 168 O O . ARG A 24 ? 0.3558 0.4673 0.3442 0.0489 0.0379 0.0384 24 ARG A O 169 C CB . ARG A 24 ? 0.3098 0.4202 0.2857 0.0947 0.0646 0.0368 24 ARG A CB 170 C CG . ARG A 24 ? 0.4711 0.5562 0.4296 0.1151 0.0739 0.0308 24 ARG A CG 171 C CD . ARG A 24 ? 0.5154 0.6293 0.4908 0.1353 0.0796 0.0411 24 ARG A CD 172 N NE . ARG A 24 ? 0.5582 0.6466 0.5138 0.1587 0.0918 0.0350 24 ARG A NE 173 C CZ . ARG A 24 ? 0.5608 0.6166 0.5025 0.1674 0.0891 0.0317 24 ARG A CZ 174 N NH1 . ARG A 24 ? 0.5213 0.5697 0.4668 0.1549 0.0760 0.0340 24 ARG A NH1 175 N NH2 . ARG A 24 ? 0.5418 0.5695 0.4629 0.1888 0.0997 0.0262 24 ARG A NH2 176 N N . ALA A 25 ? 0.3263 0.4357 0.2942 0.0579 0.0570 0.0348 25 ALA A N 177 C CA . ALA A 25 ? 0.3425 0.4661 0.3190 0.0406 0.0494 0.0420 25 ALA A CA 178 C C . ALA A 25 ? 0.3370 0.5031 0.3308 0.0403 0.0554 0.0566 25 ALA A C 179 O O . ALA A 25 ? 0.2993 0.4824 0.2923 0.0561 0.0701 0.0584 25 ALA A O 180 C CB . ALA A 25 ? 0.3143 0.4150 0.2703 0.0341 0.0498 0.0349 25 ALA A CB 181 N N . SER A 26 ? 0.2952 0.4774 0.3040 0.0223 0.0440 0.0669 26 SER A N 182 C CA . SER A 26 ? 0.2572 0.4839 0.2873 0.0165 0.0466 0.0836 26 SER A CA 183 C C . SER A 26 ? 0.2993 0.5419 0.3201 0.0167 0.0602 0.0888 26 SER A C 184 O O . SER A 26 ? 0.3028 0.5879 0.3395 0.0185 0.0697 0.1017 26 SER A O 185 C CB . SER A 26 ? 0.3001 0.5316 0.3452 -0.0062 0.0276 0.0930 26 SER A CB 186 O OG . SER A 26 ? 0.3946 0.5914 0.4239 -0.0185 0.0175 0.0868 26 SER A OG 187 N N . GLN A 27 ? 0.2365 0.4474 0.2316 0.0140 0.0609 0.0795 27 GLN A N 188 C CA . GLN A 27 ? 0.3184 0.5364 0.2951 0.0175 0.0752 0.0806 27 GLN A CA 189 C C . GLN A 27 ? 0.3498 0.5241 0.2948 0.0241 0.0768 0.0635 27 GLN A C 190 O O . GLN A 27 ? 0.2959 0.4399 0.2381 0.0222 0.0657 0.0538 27 GLN A O 191 C CB . GLN A 27 ? 0.3689 0.6033 0.3491 -0.0040 0.0692 0.0954 27 GLN A CB 192 C CG . GLN A 27 ? 0.4576 0.6545 0.4209 -0.0185 0.0541 0.0908 27 GLN A CG 193 C CD . GLN A 27 ? 0.5267 0.7337 0.4981 -0.0418 0.0421 0.1074 27 GLN A CD 194 O OE1 . GLN A 27 ? 0.5011 0.7223 0.4953 -0.0530 0.0317 0.1173 27 GLN A OE1 195 N NE2 . GLN A 27 ? 0.5679 0.7645 0.5183 -0.0502 0.0419 0.1109 27 GLN A NE2 196 N N . SER A 28 ? 0.3399 0.5120 0.2604 0.0313 0.0906 0.0598 28 SER A N 197 C CA . SER A 28 ? 0.3800 0.5110 0.2687 0.0370 0.0916 0.0435 28 SER A CA 198 C C . SER A 28 ? 0.4220 0.5264 0.3055 0.0195 0.0732 0.0408 28 SER A C 199 O O . SER A 28 ? 0.3924 0.5068 0.2833 0.0038 0.0639 0.0516 28 SER A O 200 C CB . SER A 28 ? 0.4017 0.5338 0.2603 0.0452 0.1081 0.0404 28 SER A CB 201 O OG . SER A 28 ? 0.5384 0.6281 0.3640 0.0487 0.1070 0.0243 28 SER A OG 202 N N . ILE A 29 ? 0.4906 0.5619 0.3627 0.0223 0.0676 0.0273 29 ILE A N 203 C CA . ILE A 29 ? 0.4316 0.4821 0.3026 0.0085 0.0509 0.0247 29 ILE A CA 204 C C . ILE A 29 ? 0.3907 0.4108 0.2339 0.0093 0.0502 0.0119 29 ILE A C 205 O O . ILE A 29 ? 0.3703 0.3731 0.2163 0.0025 0.0381 0.0067 29 ILE A O 206 C CB . ILE A 29 ? 0.4396 0.4859 0.3346 0.0061 0.0396 0.0234 29 ILE A CB 207 C CG1 . ILE A 29 ? 0.4091 0.4462 0.3045 0.0196 0.0467 0.0146 29 ILE A CG1 208 C CG2 . ILE A 29 ? 0.5110 0.5814 0.4303 -0.0010 0.0339 0.0363 29 ILE A CG2 209 C CD1 . ILE A 29 ? 0.2708 0.2992 0.1819 0.0170 0.0367 0.0113 29 ILE A CD1 210 N N . GLY A 30 ? 0.3837 0.3985 0.1996 0.0174 0.0633 0.0071 30 GLY A N 211 C CA . GLY A 30 ? 0.3639 0.3461 0.1479 0.0178 0.0630 -0.0061 30 GLY A CA 212 C C . GLY A 30 ? 0.4942 0.4540 0.2833 0.0208 0.0587 -0.0158 30 GLY A C 213 O O . GLY A 30 ? 0.5274 0.4859 0.3222 0.0340 0.0675 -0.0185 30 GLY A O 214 N N . THR A 31 ? 0.3521 0.2965 0.1405 0.0084 0.0447 -0.0196 31 THR A N 215 C CA . THR A 31 ? 0.3606 0.2880 0.1559 0.0077 0.0400 -0.0267 31 THR A CA 216 C C . THR A 31 ? 0.3726 0.3120 0.1968 -0.0021 0.0263 -0.0219 31 THR A C 217 O O . THR A 31 ? 0.3679 0.2969 0.1975 -0.0070 0.0201 -0.0268 31 THR A O 218 C CB . THR A 31 ? 0.4133 0.3092 0.1779 0.0020 0.0370 -0.0376 31 THR A CB 219 O OG1 . THR A 31 ? 0.4001 0.2968 0.1511 -0.0097 0.0279 -0.0357 31 THR A OG1 220 C CG2 . THR A 31 ? 0.4119 0.2856 0.1455 0.0155 0.0513 -0.0458 31 THR A CG2 221 N N . ASN A 32 ? 0.3667 0.3273 0.2084 -0.0049 0.0219 -0.0120 32 ASN A N 222 C CA . ASN A 32 ? 0.3043 0.2727 0.1700 -0.0119 0.0087 -0.0079 32 ASN A CA 223 C C . ASN A 32 ? 0.2954 0.2697 0.1831 -0.0063 0.0101 -0.0084 32 ASN A C 224 O O . ASN A 32 ? 0.2659 0.2534 0.1701 -0.0061 0.0074 -0.0016 32 ASN A O 225 C CB . ASN A 32 ? 0.2743 0.2559 0.1455 -0.0179 0.0021 0.0031 32 ASN A CB 226 C CG . ASN A 32 ? 0.4092 0.3878 0.2889 -0.0260 -0.0138 0.0055 32 ASN A CG 227 O OD1 . ASN A 32 ? 0.3841 0.3622 0.2827 -0.0249 -0.0203 0.0027 32 ASN A OD1 228 N ND2 . ASN A 32 ? 0.3778 0.3552 0.2427 -0.0332 -0.0200 0.0112 32 ASN A ND2 229 N N . ILE A 33 ? 0.3571 0.3197 0.2424 -0.0034 0.0136 -0.0161 33 ILE A N 230 C CA . ILE A 33 ? 0.3399 0.3057 0.2400 0.0020 0.0158 -0.0169 33 ILE A CA 231 C C . ILE A 33 ? 0.3704 0.3278 0.2746 -0.0024 0.0120 -0.0230 33 ILE A C 232 O O . ILE A 33 ? 0.3314 0.2756 0.2216 -0.0072 0.0122 -0.0277 33 ILE A O 233 C CB . ILE A 33 ? 0.4163 0.3793 0.3074 0.0128 0.0278 -0.0172 33 ILE A CB 234 C CG1 . ILE A 33 ? 0.4832 0.4516 0.3885 0.0180 0.0286 -0.0158 33 ILE A CG1 235 C CG2 . ILE A 33 ? 0.4976 0.4374 0.3650 0.0148 0.0337 -0.0247 33 ILE A CG2 236 C CD1 . ILE A 33 ? 0.5739 0.5633 0.4938 0.0206 0.0276 -0.0075 33 ILE A CD1 237 N N . HIS A 34 ? 0.3973 0.3628 0.3196 -0.0017 0.0083 -0.0227 34 HIS A N 238 C CA . HIS A 34 ? 0.3162 0.2801 0.2453 -0.0047 0.0073 -0.0273 34 HIS A CA 239 C C . HIS A 34 ? 0.3485 0.3121 0.2808 0.0009 0.0132 -0.0282 34 HIS A C 240 O O . HIS A 34 ? 0.3151 0.2838 0.2515 0.0063 0.0135 -0.0252 34 HIS A O 241 C CB . HIS A 34 ? 0.2768 0.2521 0.2234 -0.0074 -0.0021 -0.0269 34 HIS A CB 242 C CG . HIS A 34 ? 0.3174 0.2941 0.2618 -0.0121 -0.0105 -0.0233 34 HIS A CG 243 N ND1 . HIS A 34 ? 0.2502 0.2195 0.1785 -0.0187 -0.0113 -0.0242 34 HIS A ND1 244 C CD2 . HIS A 34 ? 0.3466 0.3286 0.2996 -0.0118 -0.0194 -0.0185 34 HIS A CD2 245 C CE1 . HIS A 34 ? 0.2949 0.2675 0.2222 -0.0222 -0.0200 -0.0196 34 HIS A CE1 246 N NE2 . HIS A 34 ? 0.3094 0.2895 0.2523 -0.0180 -0.0252 -0.0154 34 HIS A NE2 247 N N . TRP A 35 ? 0.3134 0.2713 0.2428 -0.0020 0.0171 -0.0314 35 TRP A N 248 C CA . TRP A 35 ? 0.2751 0.2310 0.2034 0.0023 0.0226 -0.0313 35 TRP A CA 249 C C . TRP A 35 ? 0.3240 0.2904 0.2642 -0.0006 0.0225 -0.0337 35 TRP A C 250 O O . TRP A 35 ? 0.3883 0.3607 0.3351 -0.0076 0.0209 -0.0352 35 TRP A O 251 C CB . TRP A 35 ? 0.3353 0.2723 0.2454 0.0019 0.0292 -0.0312 35 TRP A CB 252 C CG . TRP A 35 ? 0.3550 0.2814 0.2520 0.0097 0.0325 -0.0294 35 TRP A CG 253 C CD1 . TRP A 35 ? 0.2603 0.1757 0.1439 0.0091 0.0333 -0.0313 35 TRP A CD1 254 C CD2 . TRP A 35 ? 0.3591 0.2867 0.2547 0.0205 0.0362 -0.0253 35 TRP A CD2 255 N NE1 . TRP A 35 ? 0.3715 0.2821 0.2461 0.0207 0.0392 -0.0291 35 TRP A NE1 256 C CE2 . TRP A 35 ? 0.3918 0.3119 0.2760 0.0279 0.0405 -0.0246 35 TRP A CE2 257 C CE3 . TRP A 35 ? 0.3546 0.2901 0.2568 0.0249 0.0358 -0.0219 35 TRP A CE3 258 C CZ2 . TRP A 35 ? 0.3541 0.2786 0.2381 0.0407 0.0449 -0.0197 35 TRP A CZ2 259 C CZ3 . TRP A 35 ? 0.3774 0.3156 0.2781 0.0355 0.0379 -0.0166 35 TRP A CZ3 260 C CH2 . TRP A 35 ? 0.4014 0.3361 0.2954 0.0439 0.0427 -0.0151 35 TRP A CH2 261 N N . TYR A 36 ? 0.2837 0.2540 0.2260 0.0048 0.0245 -0.0340 36 TYR A N 262 C CA . TYR A 36 ? 0.2401 0.2210 0.1907 0.0047 0.0268 -0.0371 36 TYR A CA 263 C C . TYR A 36 ? 0.2473 0.2233 0.1863 0.0060 0.0337 -0.0361 36 TYR A C 264 O O . TYR A 36 ? 0.2471 0.2138 0.1754 0.0102 0.0335 -0.0331 36 TYR A O 265 C CB . TYR A 36 ? 0.1995 0.1882 0.1611 0.0111 0.0209 -0.0403 36 TYR A CB 266 C CG . TYR A 36 ? 0.2631 0.2556 0.2357 0.0104 0.0127 -0.0398 36 TYR A CG 267 C CD1 . TYR A 36 ? 0.1920 0.1780 0.1603 0.0094 0.0073 -0.0357 36 TYR A CD1 268 C CD2 . TYR A 36 ? 0.2891 0.2942 0.2769 0.0111 0.0103 -0.0422 36 TYR A CD2 269 C CE1 . TYR A 36 ? 0.3068 0.2951 0.2822 0.0077 -0.0006 -0.0337 36 TYR A CE1 270 C CE2 . TYR A 36 ? 0.3109 0.3183 0.3078 0.0108 0.0010 -0.0403 36 TYR A CE2 271 C CZ . TYR A 36 ? 0.2923 0.2895 0.2811 0.0083 -0.0047 -0.0359 36 TYR A CZ 272 O OH . TYR A 36 ? 0.2639 0.2621 0.2585 0.0069 -0.0142 -0.0325 36 TYR A OH 273 N N . GLN A 37 ? 0.3199 0.3050 0.2619 0.0025 0.0396 -0.0376 37 GLN A N 274 C CA . GLN A 37 ? 0.2621 0.2450 0.1920 0.0027 0.0466 -0.0362 37 GLN A CA 275 C C . GLN A 37 ? 0.3222 0.3179 0.2572 0.0097 0.0481 -0.0421 37 GLN A C 276 O O . GLN A 37 ? 0.3022 0.3130 0.2534 0.0117 0.0480 -0.0464 37 GLN A O 277 C CB . GLN A 37 ? 0.2435 0.2280 0.1707 -0.0084 0.0537 -0.0325 37 GLN A CB 278 C CG . GLN A 37 ? 0.3167 0.3030 0.2317 -0.0102 0.0623 -0.0299 37 GLN A CG 279 C CD . GLN A 37 ? 0.3732 0.3641 0.2880 -0.0243 0.0690 -0.0245 37 GLN A CD 280 O OE1 . GLN A 37 ? 0.2676 0.2835 0.1998 -0.0289 0.0732 -0.0257 37 GLN A OE1 281 N NE2 . GLN A 37 ? 0.3040 0.2709 0.1997 -0.0313 0.0696 -0.0176 37 GLN A NE2 282 N N . GLN A 38 ? 0.3158 0.3047 0.2357 0.0143 0.0489 -0.0427 38 GLN A N 283 C CA . GLN A 38 ? 0.2730 0.2696 0.1903 0.0208 0.0521 -0.0498 38 GLN A CA 284 C C . GLN A 38 ? 0.3608 0.3565 0.2584 0.0187 0.0610 -0.0477 38 GLN A C 285 O O . GLN A 38 ? 0.3566 0.3388 0.2368 0.0182 0.0577 -0.0432 38 GLN A O 286 C CB . GLN A 38 ? 0.3209 0.3077 0.2347 0.0280 0.0418 -0.0548 38 GLN A CB 287 C CG . GLN A 38 ? 0.3327 0.3207 0.2390 0.0363 0.0445 -0.0649 38 GLN A CG 288 C CD . GLN A 38 ? 0.3427 0.3165 0.2470 0.0416 0.0321 -0.0706 38 GLN A CD 289 O OE1 . GLN A 38 ? 0.3437 0.3076 0.2449 0.0374 0.0219 -0.0657 38 GLN A OE1 290 N NE2 . GLN A 38 ? 0.2829 0.2558 0.1894 0.0510 0.0329 -0.0805 38 GLN A NE2 291 N N . ARG A 39 ? 0.2755 0.2883 0.1768 0.0176 0.0721 -0.0497 39 ARG A N 292 C CA . ARG A 39 ? 0.3503 0.3653 0.2317 0.0148 0.0823 -0.0471 39 ARG A CA 293 C C . ARG A 39 ? 0.4176 0.4329 0.2846 0.0255 0.0846 -0.0571 39 ARG A C 294 O O . ARG A 39 ? 0.3857 0.4017 0.2621 0.0352 0.0800 -0.0666 39 ARG A O 295 C CB . ARG A 39 ? 0.3134 0.3506 0.2062 0.0062 0.0948 -0.0428 39 ARG A CB 296 C CG . ARG A 39 ? 0.3612 0.3917 0.2589 -0.0076 0.0927 -0.0327 39 ARG A CG 297 C CD . ARG A 39 ? 0.3719 0.4277 0.2829 -0.0187 0.1036 -0.0280 39 ARG A CD 298 N NE . ARG A 39 ? 0.4260 0.4705 0.3371 -0.0350 0.1006 -0.0185 39 ARG A NE 299 C CZ . ARG A 39 ? 0.5550 0.6198 0.4814 -0.0492 0.1057 -0.0129 39 ARG A CZ 300 N NH1 . ARG A 39 ? 0.5210 0.6242 0.4679 -0.0472 0.1152 -0.0152 39 ARG A NH1 301 N NH2 . ARG A 39 ? 0.6569 0.7036 0.5779 -0.0653 0.1009 -0.0050 39 ARG A NH2 302 N N . THR A 40 ? 0.3858 0.3973 0.2268 0.0236 0.0911 -0.0548 40 THR A N 303 C CA . THR A 40 ? 0.3602 0.3681 0.1796 0.0329 0.0936 -0.0651 40 THR A CA 304 C C . THR A 40 ? 0.3972 0.4228 0.2308 0.0445 0.1023 -0.0772 40 THR A C 305 O O . THR A 40 ? 0.3604 0.4126 0.2102 0.0431 0.1158 -0.0750 40 THR A O 306 C CB . THR A 40 ? 0.3888 0.3959 0.1775 0.0276 0.1030 -0.0595 40 THR A CB 307 O OG1 . THR A 40 ? 0.4687 0.4575 0.2445 0.0196 0.0934 -0.0477 40 THR A OG1 308 C CG2 . THR A 40 ? 0.4191 0.4187 0.1793 0.0373 0.1048 -0.0716 40 THR A CG2 309 N N . ASN A 41 ? 0.4035 0.4141 0.2316 0.0558 0.0937 -0.0891 41 ASN A N 310 C CA . ASN A 41 ? 0.4679 0.4878 0.3075 0.0710 0.0993 -0.1019 41 ASN A CA 311 C C . ASN A 41 ? 0.3912 0.4300 0.2701 0.0730 0.0983 -0.0995 41 ASN A C 312 O O . ASN A 41 ? 0.3779 0.4329 0.2717 0.0861 0.1057 -0.1071 41 ASN A O 313 C CB . ASN A 41 ? 0.4060 0.4408 0.2364 0.0742 0.1168 -0.1053 41 ASN A CB 314 C CG . ASN A 41 ? 0.5381 0.5509 0.3316 0.0718 0.1144 -0.1100 41 ASN A CG 315 O OD1 . ASN A 41 ? 0.5335 0.5554 0.3100 0.0649 0.1255 -0.1056 41 ASN A OD1 316 N ND2 . ASN A 41 ? 0.5536 0.5381 0.3338 0.0757 0.0986 -0.1181 41 ASN A ND2 317 N N . GLY A 42 ? 0.3243 0.3609 0.2188 0.0612 0.0888 -0.0890 42 GLY A N 318 C CA . GLY A 42 ? 0.3208 0.3752 0.2487 0.0604 0.0869 -0.0854 42 GLY A CA 319 C C . GLY A 42 ? 0.3757 0.4133 0.3144 0.0644 0.0707 -0.0876 42 GLY A C 320 O O . GLY A 42 ? 0.4164 0.4279 0.3383 0.0655 0.0597 -0.0907 42 GLY A O 321 N N . SER A 43 ? 0.3728 0.4267 0.3395 0.0651 0.0683 -0.0849 43 SER A N 322 C CA . SER A 43 ? 0.2611 0.3008 0.2379 0.0652 0.0529 -0.0834 43 SER A CA 323 C C . SER A 43 ? 0.2416 0.2814 0.2220 0.0494 0.0490 -0.0724 43 SER A C 324 O O . SER A 43 ? 0.2706 0.3242 0.2528 0.0402 0.0576 -0.0669 43 SER A O 325 C CB . SER A 43 ? 0.2603 0.3164 0.2632 0.0763 0.0513 -0.0861 43 SER A CB 326 O OG . SER A 43 ? 0.3310 0.3829 0.3283 0.0945 0.0555 -0.0977 43 SER A OG 327 N N . PRO A 44 ? 0.3046 0.3273 0.2838 0.0458 0.0365 -0.0692 44 PRO A N 328 C CA . PRO A 44 ? 0.2400 0.2615 0.2206 0.0335 0.0339 -0.0604 44 PRO A CA 329 C C . PRO A 44 ? 0.2718 0.3136 0.2708 0.0273 0.0369 -0.0566 44 PRO A C 330 O O . PRO A 44 ? 0.3121 0.3696 0.3301 0.0333 0.0351 -0.0588 44 PRO A O 331 C CB . PRO A 44 ? 0.2455 0.2520 0.2265 0.0338 0.0210 -0.0585 44 PRO A CB 332 C CG . PRO A 44 ? 0.2688 0.2609 0.2390 0.0418 0.0164 -0.0647 44 PRO A CG 333 C CD . PRO A 44 ? 0.3103 0.3124 0.2837 0.0520 0.0247 -0.0730 44 PRO A CD 334 N N . ARG A 45 ? 0.3045 0.3449 0.2972 0.0153 0.0405 -0.0507 45 ARG A N 335 C CA . ARG A 45 ? 0.3134 0.3677 0.3190 0.0046 0.0404 -0.0462 45 ARG A CA 336 C C . ARG A 45 ? 0.2894 0.3249 0.2852 -0.0033 0.0326 -0.0423 45 ARG A C 337 O O . ARG A 45 ? 0.2737 0.2895 0.2506 -0.0052 0.0342 -0.0404 45 ARG A O 338 C CB . ARG A 45 ? 0.3250 0.3906 0.3281 -0.0049 0.0516 -0.0428 45 ARG A CB 339 C CG . ARG A 45 ? 0.3677 0.4486 0.3846 -0.0195 0.0499 -0.0374 45 ARG A CG 340 C CD . ARG A 45 ? 0.5018 0.5943 0.5166 -0.0325 0.0604 -0.0319 45 ARG A CD 341 N NE . ARG A 45 ? 0.6059 0.6681 0.5932 -0.0415 0.0624 -0.0278 45 ARG A NE 342 C CZ . ARG A 45 ? 0.5905 0.6517 0.5704 -0.0572 0.0680 -0.0208 45 ARG A CZ 343 N NH1 . ARG A 45 ? 0.6136 0.7069 0.6136 -0.0679 0.0726 -0.0165 45 ARG A NH1 344 N NH2 . ARG A 45 ? 0.5493 0.5777 0.5025 -0.0626 0.0686 -0.0170 45 ARG A NH2 345 N N . LEU A 46 ? 0.2561 0.2983 0.2641 -0.0064 0.0241 -0.0410 46 LEU A N 346 C CA . LEU A 46 ? 0.2391 0.2650 0.2358 -0.0133 0.0172 -0.0384 46 LEU A CA 347 C C . LEU A 46 ? 0.3028 0.3177 0.2857 -0.0264 0.0208 -0.0359 46 LEU A C 348 O O . LEU A 46 ? 0.3334 0.3623 0.3258 -0.0367 0.0213 -0.0340 46 LEU A O 349 C CB . LEU A 46 ? 0.1986 0.2361 0.2103 -0.0145 0.0065 -0.0370 46 LEU A CB 350 C CG . LEU A 46 ? 0.2950 0.3169 0.2921 -0.0221 -0.0008 -0.0347 46 LEU A CG 351 C CD1 . LEU A 46 ? 0.2442 0.2477 0.2257 -0.0152 -0.0003 -0.0346 46 LEU A CD1 352 C CD2 . LEU A 46 ? 0.2052 0.2407 0.2164 -0.0247 -0.0125 -0.0321 46 LEU A CD2 353 N N . LEU A 47 ? 0.2928 0.2829 0.2536 -0.0261 0.0227 -0.0355 47 LEU A N 354 C CA . LEU A 47 ? 0.3041 0.2748 0.2466 -0.0363 0.0261 -0.0339 47 LEU A CA 355 C C . LEU A 47 ? 0.3831 0.3360 0.3111 -0.0432 0.0198 -0.0348 47 LEU A C 356 O O . LEU A 47 ? 0.3816 0.3250 0.3012 -0.0572 0.0175 -0.0343 47 LEU A O 357 C CB . LEU A 47 ? 0.3009 0.2522 0.2256 -0.0291 0.0330 -0.0327 47 LEU A CB 358 C CG . LEU A 47 ? 0.3083 0.2688 0.2362 -0.0257 0.0400 -0.0311 47 LEU A CG 359 C CD1 . LEU A 47 ? 0.3162 0.2569 0.2258 -0.0175 0.0433 -0.0288 47 LEU A CD1 360 C CD2 . LEU A 47 ? 0.2599 0.2276 0.1902 -0.0391 0.0445 -0.0281 47 LEU A CD2 361 N N . ILE A 48 ? 0.3551 0.3026 0.2778 -0.0344 0.0170 -0.0360 48 ILE A N 362 C CA . ILE A 48 ? 0.3063 0.2350 0.2094 -0.0377 0.0133 -0.0378 48 ILE A CA 363 C C . ILE A 48 ? 0.3376 0.2794 0.2495 -0.0321 0.0074 -0.0368 48 ILE A C 364 O O . ILE A 48 ? 0.4427 0.3954 0.3660 -0.0224 0.0087 -0.0350 48 ILE A O 365 C CB . ILE A 48 ? 0.3222 0.2245 0.2014 -0.0292 0.0209 -0.0389 48 ILE A CB 366 C CG1 . ILE A 48 ? 0.3457 0.2280 0.2121 -0.0343 0.0259 -0.0385 48 ILE A CG1 367 C CG2 . ILE A 48 ? 0.3058 0.1900 0.1628 -0.0285 0.0194 -0.0420 48 ILE A CG2 368 C CD1 . ILE A 48 ? 0.3932 0.2531 0.2414 -0.0496 0.0215 -0.0410 48 ILE A CD1 369 N N . LYS A 49 ? 0.3198 0.2589 0.2243 -0.0396 -0.0004 -0.0373 49 LYS A N 370 C CA . LYS A 49 ? 0.3612 0.3083 0.2681 -0.0355 -0.0062 -0.0347 49 LYS A CA 371 C C . LYS A 49 ? 0.4358 0.3632 0.3134 -0.0362 -0.0047 -0.0366 49 LYS A C 372 O O . LYS A 49 ? 0.4149 0.3220 0.2707 -0.0435 -0.0045 -0.0411 49 LYS A O 373 C CB . LYS A 49 ? 0.3041 0.2704 0.2298 -0.0420 -0.0183 -0.0320 49 LYS A CB 374 C CG . LYS A 49 ? 0.2896 0.2505 0.2043 -0.0568 -0.0265 -0.0332 49 LYS A CG 375 C CD . LYS A 49 ? 0.3277 0.3148 0.2683 -0.0617 -0.0389 -0.0288 49 LYS A CD 376 C CE . LYS A 49 ? 0.2884 0.2748 0.2221 -0.0791 -0.0486 -0.0290 49 LYS A CE 377 N NZ . LYS A 49 ? 0.4522 0.4137 0.3509 -0.0857 -0.0534 -0.0313 49 LYS A NZ 378 N N . TYR A 50 ? 0.4964 0.4288 0.3718 -0.0291 -0.0035 -0.0331 50 TYR A N 379 C CA . TYR A 50 ? 0.5243 0.4426 0.3719 -0.0273 0.0007 -0.0345 50 TYR A CA 380 C C . TYR A 50 ? 0.4115 0.3064 0.2369 -0.0213 0.0119 -0.0406 50 TYR A C 381 O O . TYR A 50 ? 0.3894 0.2609 0.1867 -0.0257 0.0121 -0.0466 50 TYR A O 382 C CB . TYR A 50 ? 0.3213 0.2350 0.1540 -0.0387 -0.0098 -0.0350 50 TYR A CB 383 C CG . TYR A 50 ? 0.3604 0.2948 0.2121 -0.0413 -0.0208 -0.0271 50 TYR A CG 384 C CD1 . TYR A 50 ? 0.3871 0.3280 0.2345 -0.0373 -0.0194 -0.0206 50 TYR A CD1 385 C CD2 . TYR A 50 ? 0.3347 0.2828 0.2095 -0.0473 -0.0323 -0.0250 50 TYR A CD2 386 C CE1 . TYR A 50 ? 0.2961 0.2505 0.1587 -0.0400 -0.0308 -0.0122 50 TYR A CE1 387 C CE2 . TYR A 50 ? 0.3685 0.3316 0.2599 -0.0470 -0.0431 -0.0175 50 TYR A CE2 388 C CZ . TYR A 50 ? 0.3945 0.3577 0.2784 -0.0438 -0.0430 -0.0111 50 TYR A CZ 389 O OH . TYR A 50 ? 0.3569 0.3296 0.2550 -0.0439 -0.0549 -0.0028 50 TYR A OH 390 N N . ALA A 51 ? 0.3476 0.2466 0.1843 -0.0112 0.0198 -0.0390 51 ALA A N 391 C CA . ALA A 51 ? 0.4610 0.3396 0.2797 -0.0010 0.0306 -0.0426 51 ALA A CA 392 C C . ALA A 51 ? 0.4759 0.3269 0.2793 -0.0076 0.0300 -0.0482 51 ALA A C 393 O O . ALA A 51 ? 0.4118 0.2537 0.2161 -0.0015 0.0354 -0.0475 51 ALA A O 394 C CB . ALA A 51 ? 0.4364 0.3072 0.2315 0.0086 0.0388 -0.0444 51 ALA A CB 395 N N . SER A 52 ? 0.4232 0.2603 0.2118 -0.0216 0.0222 -0.0525 52 SER A N 396 C CA . SER A 52 ? 0.4917 0.2967 0.2595 -0.0307 0.0207 -0.0577 52 SER A CA 397 C C . SER A 52 ? 0.4860 0.2966 0.2625 -0.0518 0.0085 -0.0572 52 SER A C 398 O O . SER A 52 ? 0.4576 0.2448 0.2205 -0.0634 0.0058 -0.0595 52 SER A O 399 C CB . SER A 52 ? 0.5351 0.3031 0.2616 -0.0261 0.0247 -0.0660 52 SER A CB 400 O OG . SER A 52 ? 0.5209 0.2935 0.2355 -0.0323 0.0187 -0.0683 52 SER A OG 401 N N . GLU A 53 ? 0.4545 0.2960 0.2537 -0.0571 0.0003 -0.0532 53 GLU A N 402 C CA . GLU A 53 ? 0.4254 0.2785 0.2359 -0.0758 -0.0124 -0.0516 53 GLU A CA 403 C C . GLU A 53 ? 0.4602 0.3351 0.3010 -0.0807 -0.0116 -0.0468 53 GLU A C 404 O O . GLU A 53 ? 0.3939 0.2898 0.2577 -0.0691 -0.0056 -0.0435 53 GLU A O 405 C CB . GLU A 53 ? 0.3820 0.2587 0.2042 -0.0778 -0.0225 -0.0482 53 GLU A CB 406 C CG . GLU A 53 ? 0.5365 0.3954 0.3275 -0.0736 -0.0220 -0.0517 53 GLU A CG 407 C CD . GLU A 53 ? 0.5457 0.4251 0.3448 -0.0783 -0.0340 -0.0466 53 GLU A CD 408 O OE1 . GLU A 53 ? 0.5027 0.4111 0.3358 -0.0802 -0.0412 -0.0403 53 GLU A OE1 409 O OE2 . GLU A 53 ? 0.6296 0.4955 0.4001 -0.0791 -0.0358 -0.0487 53 GLU A OE2 410 N N . SER A 54 ? 0.4102 0.2804 0.2496 -0.0989 -0.0179 -0.0464 54 SER A N 411 C CA . SER A 54 ? 0.4368 0.3278 0.3017 -0.1047 -0.0148 -0.0413 54 SER A CA 412 C C . SER A 54 ? 0.4512 0.3888 0.3557 -0.1048 -0.0200 -0.0361 54 SER A C 413 O O . SER A 54 ? 0.4557 0.4073 0.3676 -0.1060 -0.0301 -0.0353 54 SER A O 414 C CB . SER A 54 ? 0.5014 0.3716 0.3512 -0.1261 -0.0188 -0.0408 54 SER A CB 415 O OG . SER A 54 ? 0.5932 0.4815 0.4537 -0.1447 -0.0327 -0.0385 54 SER A OG 416 N N . ILE A 55 ? 0.4319 0.3920 0.3598 -0.1023 -0.0125 -0.0324 55 ILE A N 417 C CA . ILE A 55 ? 0.3099 0.3133 0.2752 -0.0981 -0.0142 -0.0286 55 ILE A CA 418 C C . ILE A 55 ? 0.3651 0.3906 0.3477 -0.1148 -0.0139 -0.0234 55 ILE A C 419 O O . ILE A 55 ? 0.4564 0.4661 0.4260 -0.1229 -0.0064 -0.0221 55 ILE A O 420 C CB . ILE A 55 ? 0.3577 0.3697 0.3335 -0.0783 -0.0034 -0.0297 55 ILE A CB 421 C CG1 . ILE A 55 ? 0.3654 0.3592 0.3266 -0.0642 -0.0041 -0.0329 55 ILE A CG1 422 C CG2 . ILE A 55 ? 0.2405 0.2935 0.2521 -0.0717 -0.0028 -0.0274 55 ILE A CG2 423 C CD1 . ILE A 55 ? 0.3261 0.3276 0.2924 -0.0639 -0.0161 -0.0320 55 ILE A CD1 424 N N . SER A 56 ? 0.3338 0.3968 0.3461 -0.1206 -0.0224 -0.0191 56 SER A N 425 C CA . SER A 56 ? 0.3680 0.4626 0.4037 -0.1370 -0.0216 -0.0122 56 SER A CA 426 C C . SER A 56 ? 0.3713 0.4832 0.4199 -0.1287 -0.0047 -0.0106 56 SER A C 427 O O . SER A 56 ? 0.4333 0.5555 0.4920 -0.1072 0.0028 -0.0140 56 SER A O 428 C CB . SER A 56 ? 0.4369 0.5771 0.5088 -0.1391 -0.0331 -0.0071 56 SER A CB 429 O OG . SER A 56 ? 0.5462 0.7319 0.6524 -0.1435 -0.0260 -0.0004 56 SER A OG 430 N N . GLY A 57 ? 0.3384 0.4511 0.3837 -0.1470 0.0006 -0.0051 57 GLY A N 431 C CA . GLY A 57 ? 0.3065 0.4366 0.3608 -0.1419 0.0169 -0.0022 57 GLY A CA 432 C C . GLY A 57 ? 0.3743 0.4640 0.3962 -0.1323 0.0270 -0.0059 57 GLY A C 433 O O . GLY A 57 ? 0.4542 0.5528 0.4766 -0.1304 0.0398 -0.0029 57 GLY A O 434 N N . ILE A 58 ? 0.4188 0.4663 0.4126 -0.1258 0.0215 -0.0118 58 ILE A N 435 C CA . ILE A 58 ? 0.3566 0.3670 0.3213 -0.1161 0.0291 -0.0142 58 ILE A CA 436 C C . ILE A 58 ? 0.3715 0.3436 0.3073 -0.1347 0.0274 -0.0105 58 ILE A C 437 O O . ILE A 58 ? 0.4085 0.3605 0.3317 -0.1477 0.0169 -0.0120 58 ILE A O 438 C CB . ILE A 58 ? 0.3260 0.3145 0.2776 -0.0978 0.0253 -0.0215 58 ILE A CB 439 C CG1 . ILE A 58 ? 0.2885 0.3082 0.2656 -0.0808 0.0254 -0.0244 58 ILE A CG1 440 C CG2 . ILE A 58 ? 0.3432 0.2971 0.2676 -0.0876 0.0320 -0.0226 58 ILE A CG2 441 C CD1 . ILE A 58 ? 0.2545 0.2940 0.2427 -0.0703 0.0367 -0.0240 58 ILE A CD1 442 N N . PRO A 59 ? 0.3999 0.3588 0.3223 -0.1364 0.0369 -0.0057 59 PRO A N 443 C CA . PRO A 59 ? 0.4580 0.3753 0.3507 -0.1537 0.0351 -0.0008 59 PRO A CA 444 C C . PRO A 59 ? 0.5242 0.3910 0.3850 -0.1488 0.0275 -0.0078 59 PRO A C 445 O O . PRO A 59 ? 0.5672 0.4288 0.4249 -0.1276 0.0283 -0.0146 59 PRO A O 446 C CB . PRO A 59 ? 0.4886 0.3982 0.3702 -0.1459 0.0468 0.0044 59 PRO A CB 447 C CG . PRO A 59 ? 0.4733 0.4343 0.3856 -0.1364 0.0553 0.0047 59 PRO A CG 448 C CD . PRO A 59 ? 0.4166 0.3976 0.3489 -0.1227 0.0490 -0.0041 59 PRO A CD 449 N N . SER A 60 ? 0.5447 0.3742 0.3809 -0.1683 0.0205 -0.0061 60 SER A N 450 C CA . SER A 60 ? 0.5850 0.3649 0.3878 -0.1636 0.0136 -0.0145 60 SER A CA 451 C C . SER A 60 ? 0.6076 0.3511 0.3856 -0.1405 0.0211 -0.0169 60 SER A C 452 O O . SER A 60 ? 0.6056 0.3170 0.3607 -0.1276 0.0191 -0.0250 60 SER A O 453 C CB . SER A 60 ? 0.5427 0.2850 0.3205 -0.1912 0.0036 -0.0126 60 SER A CB 454 O OG . SER A 60 ? 0.6416 0.3519 0.3994 -0.1986 0.0081 -0.0048 60 SER A OG 455 N N . ARG A 61 ? 0.5884 0.3391 0.3708 -0.1348 0.0298 -0.0095 61 ARG A N 456 C CA . ARG A 61 ? 0.5079 0.2260 0.2682 -0.1144 0.0351 -0.0094 61 ARG A CA 457 C C . ARG A 61 ? 0.5367 0.2729 0.3082 -0.0880 0.0384 -0.0158 61 ARG A C 458 O O . ARG A 61 ? 0.4848 0.1962 0.2397 -0.0692 0.0412 -0.0171 61 ARG A O 459 C CB . ARG A 61 ? 0.5140 0.2344 0.2733 -0.1171 0.0418 0.0017 61 ARG A CB 460 C CG . ARG A 61 ? 0.5910 0.3637 0.3802 -0.1094 0.0490 0.0041 61 ARG A CG 461 C CD . ARG A 61 ? 0.6429 0.4132 0.4237 -0.1144 0.0556 0.0154 61 ARG A CD 462 N NE . ARG A 61 ? 0.5898 0.4089 0.3954 -0.1093 0.0631 0.0165 61 ARG A NE 463 C CZ . ARG A 61 ? 0.5373 0.3936 0.3633 -0.1248 0.0675 0.0201 61 ARG A CZ 464 N NH1 . ARG A 61 ? 0.4797 0.3327 0.3065 -0.1491 0.0640 0.0248 61 ARG A NH1 465 N NH2 . ARG A 61 ? 0.5125 0.4095 0.3576 -0.1160 0.0753 0.0189 61 ARG A NH2 466 N N . PHE A 62 ? 0.4393 0.2194 0.2399 -0.0868 0.0375 -0.0190 62 PHE A N 467 C CA . PHE A 62 ? 0.4142 0.2111 0.2255 -0.0663 0.0386 -0.0244 62 PHE A CA 468 C C . PHE A 62 ? 0.4874 0.2668 0.2853 -0.0645 0.0332 -0.0321 62 PHE A C 469 O O . PHE A 62 ? 0.5103 0.2913 0.3087 -0.0807 0.0261 -0.0345 62 PHE A O 470 C CB . PHE A 62 ? 0.3991 0.2447 0.2440 -0.0654 0.0391 -0.0241 62 PHE A CB 471 C CG . PHE A 62 ? 0.3701 0.2339 0.2248 -0.0620 0.0459 -0.0188 62 PHE A CG 472 C CD1 . PHE A 62 ? 0.3574 0.2267 0.2138 -0.0442 0.0490 -0.0189 62 PHE A CD1 473 C CD2 . PHE A 62 ? 0.4066 0.2831 0.2677 -0.0776 0.0489 -0.0132 62 PHE A CD2 474 C CE1 . PHE A 62 ? 0.4279 0.3111 0.2883 -0.0416 0.0544 -0.0147 62 PHE A CE1 475 C CE2 . PHE A 62 ? 0.4138 0.3064 0.2795 -0.0742 0.0565 -0.0086 62 PHE A CE2 476 C CZ . PHE A 62 ? 0.4186 0.3124 0.2819 -0.0559 0.0588 -0.0100 62 PHE A CZ 477 N N . SER A 63 ? 0.4192 0.1843 0.2049 -0.0450 0.0366 -0.0355 63 SER A N 478 C CA . SER A 63 ? 0.4274 0.1833 0.2013 -0.0397 0.0341 -0.0429 63 SER A CA 479 C C . SER A 63 ? 0.5277 0.3004 0.3100 -0.0178 0.0396 -0.0431 63 SER A C 480 O O . SER A 63 ? 0.5099 0.2942 0.3031 -0.0062 0.0442 -0.0380 63 SER A O 481 C CB . SER A 63 ? 0.4805 0.1843 0.2156 -0.0425 0.0329 -0.0484 63 SER A CB 482 O OG . SER A 63 ? 0.5325 0.2080 0.2499 -0.0248 0.0400 -0.0472 63 SER A OG 483 N N . GLY A 64 ? 0.4753 0.2506 0.2521 -0.0137 0.0385 -0.0481 64 GLY A N 484 C CA . GLY A 64 ? 0.3932 0.1855 0.1770 0.0046 0.0441 -0.0470 64 GLY A CA 485 C C . GLY A 64 ? 0.4728 0.2448 0.2304 0.0130 0.0478 -0.0534 64 GLY A C 486 O O . GLY A 64 ? 0.5297 0.2814 0.2668 0.0016 0.0430 -0.0597 64 GLY A O 487 N N . SER A 65 ? 0.5075 0.2863 0.2650 0.0328 0.0565 -0.0518 65 SER A N 488 C CA . SER A 65 ? 0.5286 0.2954 0.2630 0.0436 0.0630 -0.0576 65 SER A CA 489 C C . SER A 65 ? 0.4896 0.2948 0.2441 0.0571 0.0695 -0.0515 65 SER A C 490 O O . SER A 65 ? 0.5286 0.3655 0.3133 0.0567 0.0670 -0.0433 65 SER A O 491 C CB . SER A 65 ? 0.4878 0.2188 0.1997 0.0547 0.0672 -0.0605 65 SER A CB 492 O OG . SER A 65 ? 0.6933 0.4275 0.4157 0.0708 0.0726 -0.0543 65 SER A OG 493 N N . GLY A 66 ? 0.5098 0.3151 0.2501 0.0667 0.0764 -0.0543 66 GLY A N 494 C CA . GLY A 66 ? 0.5631 0.4053 0.3199 0.0786 0.0843 -0.0475 66 GLY A CA 495 C C . GLY A 66 ? 0.5845 0.4437 0.3363 0.0698 0.0835 -0.0473 66 GLY A C 496 O O . GLY A 66 ? 0.5302 0.3805 0.2751 0.0522 0.0732 -0.0504 66 GLY A O 497 N N . SER A 67 ? 0.5802 0.4685 0.3405 0.0807 0.0928 -0.0413 67 SER A N 498 C CA . SER A 67 ? 0.5652 0.4752 0.3233 0.0723 0.0929 -0.0373 67 SER A CA 499 C C . SER A 67 ? 0.5939 0.5457 0.3730 0.0836 0.1034 -0.0262 67 SER A C 500 O O . SER A 67 ? 0.6629 0.6230 0.4531 0.1000 0.1114 -0.0244 67 SER A O 501 C CB . SER A 67 ? 0.5226 0.4091 0.2483 0.0695 0.0939 -0.0466 67 SER A CB 502 O OG . SER A 67 ? 0.6359 0.5118 0.3545 0.0861 0.1034 -0.0512 67 SER A OG 503 N N . GLY A 68 ? 0.5168 0.4968 0.3081 0.0715 0.0995 -0.0169 68 GLY A N 504 C CA . GLY A 68 ? 0.3666 0.3901 0.1808 0.0770 0.1076 -0.0038 68 GLY A CA 505 C C . GLY A 68 ? 0.4751 0.5207 0.3271 0.0734 0.0988 0.0056 68 GLY A C 506 O O . GLY A 68 ? 0.4409 0.4924 0.3087 0.0565 0.0850 0.0110 68 GLY A O 507 N N . THR A 69 ? 0.3294 0.3846 0.1942 0.0900 0.1059 0.0072 69 THR A N 508 C CA . THR A 69 ? 0.4291 0.5067 0.3271 0.0862 0.0969 0.0167 69 THR A CA 509 C C . THR A 69 ? 0.4395 0.4934 0.3382 0.0936 0.0924 0.0108 69 THR A C 510 O O . THR A 69 ? 0.4421 0.5041 0.3608 0.0862 0.0816 0.0156 69 THR A O 511 C CB . THR A 69 ? 0.3809 0.5057 0.3036 0.0952 0.1054 0.0302 69 THR A CB 512 O OG1 . THR A 69 ? 0.4444 0.5684 0.3579 0.1205 0.1211 0.0264 69 THR A OG1 513 C CG2 . THR A 69 ? 0.2966 0.4487 0.2209 0.0839 0.1090 0.0392 69 THR A CG2 514 N N . ASP A 70 ? 0.4380 0.4600 0.3116 0.1074 0.1004 0.0005 70 ASP A N 515 C CA . ASP A 70 ? 0.3954 0.3944 0.2670 0.1160 0.0979 -0.0028 70 ASP A CA 516 C C . ASP A 70 ? 0.3679 0.3232 0.2164 0.1047 0.0911 -0.0141 70 ASP A C 517 O O . ASP A 70 ? 0.4750 0.4028 0.2954 0.1048 0.0952 -0.0234 70 ASP A O 518 C CB . ASP A 70 ? 0.4326 0.4280 0.2959 0.1420 0.1114 -0.0036 70 ASP A CB 519 C CG . ASP A 70 ? 0.5818 0.5598 0.4472 0.1526 0.1080 -0.0025 70 ASP A CG 520 O OD1 . ASP A 70 ? 0.6883 0.6656 0.5656 0.1391 0.0959 0.0005 70 ASP A OD1 521 O OD2 . ASP A 70 ? 0.5308 0.4953 0.3890 0.1689 0.1126 -0.0032 70 ASP A OD2 522 N N . PHE A 71 ? 0.3844 0.3354 0.2447 0.0940 0.0803 -0.0127 71 PHE A N 523 C CA . PHE A 71 ? 0.3878 0.3087 0.2342 0.0798 0.0730 -0.0206 71 PHE A CA 524 C C . PHE A 71 ? 0.4646 0.3679 0.3105 0.0812 0.0700 -0.0204 71 PHE A C 525 O O . PHE A 71 ? 0.5031 0.4236 0.3658 0.0873 0.0684 -0.0130 71 PHE A O 526 C CB . PHE A 71 ? 0.3573 0.2946 0.2190 0.0615 0.0627 -0.0190 71 PHE A CB 527 C CG . PHE A 71 ? 0.3891 0.3396 0.2481 0.0568 0.0636 -0.0179 71 PHE A CG 528 C CD1 . PHE A 71 ? 0.3561 0.2855 0.1917 0.0504 0.0632 -0.0255 71 PHE A CD1 529 C CD2 . PHE A 71 ? 0.3175 0.3011 0.1954 0.0573 0.0639 -0.0084 71 PHE A CD2 530 C CE1 . PHE A 71 ? 0.3541 0.2948 0.1838 0.0455 0.0635 -0.0235 71 PHE A CE1 531 C CE2 . PHE A 71 ? 0.3372 0.3324 0.2106 0.0516 0.0650 -0.0057 71 PHE A CE2 532 C CZ . PHE A 71 ? 0.3776 0.3512 0.2260 0.0464 0.0650 -0.0132 71 PHE A CZ 533 N N . THR A 72 ? 0.4831 0.3524 0.3086 0.0737 0.0682 -0.0276 72 THR A N 534 C CA . THR A 72 ? 0.4308 0.2793 0.2508 0.0739 0.0664 -0.0264 72 THR A CA 535 C C . THR A 72 ? 0.4269 0.2623 0.2433 0.0541 0.0596 -0.0301 72 THR A C 536 O O . THR A 72 ? 0.4884 0.3064 0.2898 0.0442 0.0579 -0.0367 72 THR A O 537 C CB . THR A 72 ? 0.5086 0.3216 0.3028 0.0898 0.0736 -0.0291 72 THR A CB 538 O OG1 . THR A 72 ? 0.4020 0.2338 0.2031 0.1109 0.0815 -0.0252 72 THR A OG1 539 C CG2 . THR A 72 ? 0.4119 0.2035 0.2004 0.0899 0.0708 -0.0248 72 THR A CG2 540 N N . LEU A 73 ? 0.4414 0.2884 0.2720 0.0483 0.0556 -0.0256 73 LEU A N 541 C CA . LEU A 73 ? 0.4255 0.2632 0.2541 0.0319 0.0517 -0.0272 73 LEU A CA 542 C C . LEU A 73 ? 0.4541 0.2621 0.2647 0.0344 0.0541 -0.0243 73 LEU A C 543 O O . LEU A 73 ? 0.4921 0.3022 0.3043 0.0467 0.0559 -0.0183 73 LEU A O 544 C CB . LEU A 73 ? 0.4458 0.3137 0.2980 0.0257 0.0476 -0.0245 73 LEU A CB 545 C CG . LEU A 73 ? 0.4094 0.2756 0.2630 0.0116 0.0461 -0.0248 73 LEU A CG 546 C CD1 . LEU A 73 ? 0.3671 0.2305 0.2201 -0.0023 0.0429 -0.0296 73 LEU A CD1 547 C CD2 . LEU A 73 ? 0.3677 0.2607 0.2401 0.0112 0.0442 -0.0231 73 LEU A CD2 548 N N . SER A 74 ? 0.4747 0.2543 0.2675 0.0216 0.0529 -0.0273 74 SER A N 549 C CA . SER A 74 ? 0.4528 0.1979 0.2248 0.0213 0.0541 -0.0234 74 SER A CA 550 C C . SER A 74 ? 0.4926 0.2353 0.2649 -0.0001 0.0514 -0.0204 74 SER A C 551 O O . SER A 74 ? 0.4983 0.2532 0.2790 -0.0161 0.0482 -0.0240 74 SER A O 552 C CB . SER A 74 ? 0.5564 0.2573 0.2980 0.0272 0.0557 -0.0290 74 SER A CB 553 O OG . SER A 74 ? 0.6767 0.3800 0.4169 0.0510 0.0610 -0.0299 74 SER A OG 554 N N . ILE A 75 ? 0.4465 0.1757 0.2101 -0.0002 0.0528 -0.0126 75 ILE A N 555 C CA . ILE A 75 ? 0.5579 0.2795 0.3163 -0.0212 0.0519 -0.0077 75 ILE A CA 556 C C . ILE A 75 ? 0.5815 0.2510 0.3077 -0.0225 0.0511 -0.0031 75 ILE A C 557 O O . ILE A 75 ? 0.6410 0.2960 0.3572 -0.0084 0.0525 0.0035 75 ILE A O 558 C CB . ILE A 75 ? 0.5364 0.2894 0.3105 -0.0232 0.0546 -0.0009 75 ILE A CB 559 C CG1 . ILE A 75 ? 0.3925 0.1900 0.1950 -0.0183 0.0545 -0.0060 75 ILE A CG1 560 C CG2 . ILE A 75 ? 0.5047 0.2575 0.2759 -0.0459 0.0559 0.0048 75 ILE A CG2 561 C CD1 . ILE A 75 ? 0.3909 0.2145 0.2036 -0.0174 0.0571 -0.0018 75 ILE A CD1 562 N N . ASN A 76 ? 0.6697 0.2619 0.3904 -0.1242 0.0884 -0.0646 76 ASN A N 563 C CA . ASN A 76 ? 0.8178 0.3303 0.4914 -0.1251 0.1036 -0.0643 76 ASN A CA 564 C C . ASN A 76 ? 0.8671 0.3765 0.5586 -0.1320 0.1039 -0.0500 76 ASN A C 565 O O . ASN A 76 ? 1.0108 0.4684 0.6780 -0.1178 0.1207 -0.0452 76 ASN A O 566 C CB . ASN A 76 ? 0.9996 0.4682 0.6116 -0.1516 0.0928 -0.0743 76 ASN A CB 567 C CG . ASN A 76 ? 1.1490 0.6544 0.7691 -0.1973 0.0589 -0.0709 76 ASN A CG 568 O OD1 . ASN A 76 ? 1.1848 0.7394 0.8521 -0.2100 0.0483 -0.0593 76 ASN A OD1 569 N ND2 . ASN A 76 ? 1.2232 0.7078 0.7988 -0.2219 0.0425 -0.0763 76 ASN A ND2 570 N N . SER A 77 ? 0.7231 0.3046 0.4629 -0.1475 0.0856 -0.0394 77 SER A N 571 C CA . SER A 77 ? 0.6562 0.2473 0.4168 -0.1511 0.0865 -0.0224 77 SER A CA 572 C C . SER A 77 ? 0.7496 0.4352 0.5701 -0.1446 0.0757 -0.0094 77 SER A C 573 O O . SER A 77 ? 0.7467 0.4768 0.5861 -0.1707 0.0614 -0.0036 77 SER A O 574 C CB . SER A 77 ? 0.7205 0.2736 0.4488 -0.1922 0.0752 -0.0216 77 SER A CB 575 O OG . SER A 77 ? 0.9228 0.4656 0.6606 -0.1903 0.0825 -0.0056 77 SER A OG 576 N N . VAL A 78 ? 0.6595 0.3718 0.5066 -0.1101 0.0834 -0.0020 78 VAL A N 577 C CA . VAL A 78 ? 0.5419 0.3266 0.4278 -0.1003 0.0750 0.0063 78 VAL A CA 578 C C . VAL A 78 ? 0.5485 0.3579 0.4458 -0.1166 0.0724 0.0206 78 VAL A C 579 O O . VAL A 78 ? 0.6163 0.3914 0.5011 -0.1230 0.0786 0.0306 78 VAL A O 580 C CB . VAL A 78 ? 0.5682 0.3636 0.4703 -0.0670 0.0792 0.0147 78 VAL A CB 581 C CG1 . VAL A 78 ? 0.5820 0.4273 0.5029 -0.0617 0.0705 0.0244 78 VAL A CG1 582 C CG2 . VAL A 78 ? 0.4215 0.2185 0.3265 -0.0514 0.0813 0.0045 78 VAL A CG2 583 N N . GLU A 79 ? 0.5198 0.3868 0.4404 -0.1217 0.0664 0.0235 79 GLU A N 584 C CA . GLU A 79 ? 0.5085 0.4060 0.4432 -0.1299 0.0706 0.0406 79 GLU A CA 585 C C . GLU A 79 ? 0.4619 0.3904 0.4022 -0.1043 0.0747 0.0449 79 GLU A C 586 O O . GLU A 79 ? 0.3805 0.3170 0.3207 -0.0874 0.0696 0.0345 79 GLU A O 587 C CB . GLU A 79 ? 0.5642 0.5003 0.5207 -0.1574 0.0646 0.0470 79 GLU A CB 588 C CG . GLU A 79 ? 0.7479 0.6429 0.6872 -0.1928 0.0564 0.0468 79 GLU A CG 589 C CD . GLU A 79 ? 0.8619 0.7968 0.8233 -0.2261 0.0410 0.0545 79 GLU A CD 590 O OE1 . GLU A 79 ? 0.8508 0.8544 0.8511 -0.2175 0.0416 0.0653 79 GLU A OE1 591 O OE2 . GLU A 79 ? 0.9734 0.8675 0.9103 -0.2617 0.0276 0.0520 79 GLU A OE2 592 N N . SER A 80 ? 0.3934 0.3316 0.3309 -0.1029 0.0843 0.0606 80 SER A N 593 C CA . SER A 80 ? 0.4158 0.3632 0.3379 -0.0812 0.0889 0.0641 80 SER A CA 594 C C . SER A 80 ? 0.4465 0.4302 0.3788 -0.0711 0.0910 0.0578 80 SER A C 595 O O . SER A 80 ? 0.5857 0.5628 0.4968 -0.0538 0.0892 0.0527 80 SER A O 596 C CB . SER A 80 ? 0.4765 0.4196 0.3831 -0.0824 0.1032 0.0826 80 SER A CB 597 O OG . SER A 80 ? 0.4729 0.4537 0.4049 -0.0939 0.1171 0.0950 80 SER A OG 598 N N . GLU A 81 ? 0.3791 0.3988 0.3424 -0.0837 0.0928 0.0604 81 GLU A N 599 C CA A GLU A 81 ? 0.3438 0.4012 0.3227 -0.0721 0.0962 0.0589 81 GLU A CA 600 C CA B GLU A 81 ? 0.3377 0.3951 0.3166 -0.0721 0.0963 0.0589 81 GLU A CA 601 C C . GLU A 81 ? 0.3575 0.4047 0.3306 -0.0647 0.0811 0.0391 81 GLU A C 602 O O . GLU A 81 ? 0.4360 0.5051 0.4152 -0.0525 0.0822 0.0358 81 GLU A O 603 C CB A GLU A 81 ? 0.3640 0.4712 0.3865 -0.0905 0.0977 0.0739 81 GLU A CB 604 C CB B GLU A 81 ? 0.3634 0.4708 0.3859 -0.0903 0.0983 0.0744 81 GLU A CB 605 C CG A GLU A 81 ? 0.4017 0.5013 0.4339 -0.1186 0.0762 0.0650 81 GLU A CG 606 C CG B GLU A 81 ? 0.4120 0.5441 0.4520 -0.0961 0.1177 0.1011 81 GLU A CG 607 C CD A GLU A 81 ? 0.4367 0.5854 0.5101 -0.1460 0.0697 0.0850 81 GLU A CD 608 C CD B GLU A 81 ? 0.4947 0.5977 0.5276 -0.1215 0.1126 0.1063 81 GLU A CD 609 O OE1 A GLU A 81 ? 0.4832 0.6866 0.5917 -0.1366 0.0840 0.1078 81 GLU A OE1 610 O OE1 B GLU A 81 ? 0.4644 0.5288 0.4818 -0.1364 0.0946 0.0903 81 GLU A OE1 611 O OE2 A GLU A 81 ? 0.4858 0.6161 0.5543 -0.1777 0.0506 0.0806 81 GLU A OE2 612 O OE2 B GLU A 81 ? 0.5562 0.6704 0.5958 -0.1248 0.1299 0.1280 81 GLU A OE2 613 N N . ASP A 82 ? 0.3380 0.3506 0.2999 -0.0697 0.0699 0.0286 82 ASP A N 614 C CA . ASP A 82 ? 0.3145 0.3182 0.2734 -0.0615 0.0595 0.0135 82 ASP A CA 615 C C . ASP A 82 ? 0.2878 0.2789 0.2286 -0.0428 0.0561 0.0121 82 ASP A C 616 O O . ASP A 82 ? 0.3700 0.3601 0.3125 -0.0356 0.0481 0.0037 82 ASP A O 617 C CB . ASP A 82 ? 0.3292 0.2987 0.2831 -0.0706 0.0549 0.0060 82 ASP A CB 618 C CG . ASP A 82 ? 0.3751 0.3429 0.3322 -0.0964 0.0519 0.0043 82 ASP A CG 619 O OD1 . ASP A 82 ? 0.3140 0.3218 0.2897 -0.1061 0.0478 0.0085 82 ASP A OD1 620 O OD2 . ASP A 82 ? 0.4157 0.3390 0.3545 -0.1078 0.0530 0.0012 82 ASP A OD2 621 N N . ILE A 83 ? 0.2985 0.2767 0.2185 -0.0382 0.0605 0.0223 83 ILE A N 622 C CA . ILE A 83 ? 0.3623 0.3229 0.2537 -0.0275 0.0523 0.0235 83 ILE A CA 623 C C . ILE A 83 ? 0.3135 0.2846 0.1975 -0.0186 0.0516 0.0144 83 ILE A C 624 O O . ILE A 83 ? 0.3636 0.3462 0.2415 -0.0123 0.0662 0.0154 83 ILE A O 625 C CB . ILE A 83 ? 0.4543 0.3930 0.3095 -0.0266 0.0588 0.0355 83 ILE A CB 626 C CG1 . ILE A 83 ? 0.5567 0.4800 0.4173 -0.0341 0.0558 0.0467 83 ILE A CG1 627 C CG2 . ILE A 83 ? 0.4980 0.4091 0.3079 -0.0214 0.0468 0.0357 83 ILE A CG2 628 C CD1 . ILE A 83 ? 0.5460 0.4504 0.3747 -0.0363 0.0662 0.0605 83 ILE A CD1 629 N N . ALA A 84 ? 0.3062 0.2741 0.1938 -0.0166 0.0368 0.0087 84 ALA A N 630 C CA . ALA A 84 ? 0.3017 0.2766 0.1850 -0.0101 0.0346 -0.0002 84 ALA A CA 631 C C . ALA A 84 ? 0.3307 0.3028 0.2228 -0.0115 0.0171 -0.0013 84 ALA A C 632 O O . ALA A 84 ? 0.2684 0.2394 0.1777 -0.0146 0.0094 0.0069 84 ALA A O 633 C CB . ALA A 84 ? 0.2459 0.2525 0.1591 -0.0098 0.0443 -0.0060 84 ALA A CB 634 N N . ASP A 85 ? 0.2546 0.2275 0.1388 -0.0077 0.0131 -0.0079 85 ASP A N 635 C CA . ASP A 85 ? 0.2365 0.2176 0.1408 -0.0095 0.0006 -0.0074 85 ASP A CA 636 C C . ASP A 85 ? 0.2617 0.2658 0.1940 -0.0058 0.0097 -0.0171 85 ASP A C 637 O O . ASP A 85 ? 0.2337 0.2493 0.1666 -0.0039 0.0196 -0.0233 85 ASP A O 638 C CB . ASP A 85 ? 0.2611 0.2218 0.1341 -0.0125 -0.0133 -0.0066 85 ASP A CB 639 C CG . ASP A 85 ? 0.4216 0.3473 0.2495 -0.0213 -0.0257 0.0022 85 ASP A CG 640 O OD1 . ASP A 85 ? 0.4530 0.3819 0.2923 -0.0271 -0.0339 0.0149 85 ASP A OD1 641 O OD2 . ASP A 85 ? 0.4549 0.3437 0.2297 -0.0218 -0.0265 -0.0029 85 ASP A OD2 642 N N . TYR A 86 ? 0.3326 0.3439 0.2877 -0.0052 0.0066 -0.0149 86 TYR A N 643 C CA . TYR A 86 ? 0.2549 0.2764 0.2230 -0.0034 0.0151 -0.0243 86 TYR A CA 644 C C . TYR A 86 ? 0.2934 0.3210 0.2702 0.0002 0.0109 -0.0227 86 TYR A C 645 O O . TYR A 86 ? 0.3075 0.3373 0.3001 0.0015 0.0059 -0.0095 86 TYR A O 646 C CB . TYR A 86 ? 0.2398 0.2510 0.2170 -0.0045 0.0254 -0.0244 86 TYR A CB 647 C CG . TYR A 86 ? 0.2783 0.2842 0.2474 -0.0124 0.0292 -0.0258 86 TYR A CG 648 C CD1 . TYR A 86 ? 0.2770 0.2742 0.2430 -0.0125 0.0278 -0.0156 86 TYR A CD1 649 C CD2 . TYR A 86 ? 0.2639 0.2757 0.2291 -0.0224 0.0320 -0.0338 86 TYR A CD2 650 C CE1 . TYR A 86 ? 0.3043 0.2976 0.2638 -0.0203 0.0331 -0.0146 86 TYR A CE1 651 C CE2 . TYR A 86 ? 0.2859 0.2986 0.2501 -0.0329 0.0345 -0.0304 86 TYR A CE2 652 C CZ . TYR A 86 ? 0.3058 0.3089 0.2673 -0.0308 0.0371 -0.0214 86 TYR A CZ 653 O OH . TYR A 86 ? 0.2716 0.2767 0.2333 -0.0418 0.0416 -0.0158 86 TYR A OH 654 N N . TYR A 87 ? 0.2678 0.3024 0.2385 0.0011 0.0126 -0.0320 87 TYR A N 655 C CA . TYR A 87 ? 0.1999 0.2389 0.1748 0.0037 0.0092 -0.0300 87 TYR A CA 656 C C . TYR A 87 ? 0.2554 0.2967 0.2313 0.0055 0.0189 -0.0376 87 TYR A C 657 O O . TYR A 87 ? 0.2012 0.2422 0.1667 0.0010 0.0217 -0.0465 87 TYR A O 658 C CB . TYR A 87 ? 0.1850 0.2200 0.1403 0.0042 0.0015 -0.0325 87 TYR A CB 659 C CG . TYR A 87 ? 0.2833 0.2984 0.2168 0.0005 -0.0084 -0.0267 87 TYR A CG 660 C CD1 . TYR A 87 ? 0.2671 0.2711 0.1958 -0.0083 -0.0238 -0.0162 87 TYR A CD1 661 C CD2 . TYR A 87 ? 0.2548 0.2593 0.1681 0.0032 -0.0029 -0.0296 87 TYR A CD2 662 C CE1 . TYR A 87 ? 0.3356 0.3101 0.2298 -0.0173 -0.0372 -0.0113 87 TYR A CE1 663 C CE2 . TYR A 87 ? 0.2697 0.2434 0.1473 -0.0006 -0.0101 -0.0256 87 TYR A CE2 664 C CZ . TYR A 87 ? 0.3310 0.2854 0.1939 -0.0124 -0.0291 -0.0178 87 TYR A CZ 665 O OH . TYR A 87 ? 0.3896 0.3025 0.2031 -0.0215 -0.0404 -0.0142 87 TYR A OH 666 N N . CYS A 88 ? 0.2488 0.2916 0.2348 0.0098 0.0231 -0.0313 88 CYS A N 667 C CA . CYS A 88 ? 0.2175 0.2548 0.1921 0.0119 0.0330 -0.0384 88 CYS A CA 668 C C . CYS A 88 ? 0.2292 0.2761 0.2003 0.0119 0.0253 -0.0371 88 CYS A C 669 O O . CYS A 88 ? 0.3216 0.3734 0.2998 0.0104 0.0146 -0.0292 88 CYS A O 670 C CB . CYS A 88 ? 0.2432 0.2684 0.2258 0.0213 0.0524 -0.0310 88 CYS A CB 671 S SG . CYS A 88 ? 0.4283 0.4774 0.4553 0.0289 0.0528 -0.0039 88 CYS A SG 672 N N . GLN A 89 ? 0.2596 0.3023 0.2125 0.0113 0.0291 -0.0445 89 GLN A N 673 C CA . GLN A 89 ? 0.1926 0.2416 0.1388 0.0123 0.0232 -0.0428 89 GLN A CA 674 C C . GLN A 89 ? 0.2376 0.2749 0.1662 0.0136 0.0351 -0.0449 89 GLN A C 675 O O . GLN A 89 ? 0.2595 0.2800 0.1642 0.0091 0.0405 -0.0540 89 GLN A O 676 C CB . GLN A 89 ? 0.2591 0.3176 0.1955 0.0106 0.0126 -0.0474 89 GLN A CB 677 C CG . GLN A 89 ? 0.2466 0.3086 0.1741 0.0147 0.0076 -0.0437 89 GLN A CG 678 C CD . GLN A 89 ? 0.2579 0.3367 0.1813 0.0149 0.0006 -0.0427 89 GLN A CD 679 O OE1 . GLN A 89 ? 0.2667 0.3575 0.1959 0.0086 -0.0021 -0.0441 89 GLN A OE1 680 N NE2 . GLN A 89 ? 0.2371 0.3197 0.1544 0.0214 -0.0031 -0.0362 89 GLN A NE2 681 N N . GLN A 90 ? 0.2587 0.2986 0.1925 0.0178 0.0397 -0.0357 90 GLN A N 682 C CA . GLN A 90 ? 0.2706 0.2951 0.1791 0.0203 0.0535 -0.0370 90 GLN A CA 683 C C . GLN A 90 ? 0.3116 0.3407 0.2035 0.0172 0.0414 -0.0372 90 GLN A C 684 O O . GLN A 90 ? 0.3190 0.3602 0.2259 0.0177 0.0299 -0.0308 90 GLN A O 685 C CB . GLN A 90 ? 0.2312 0.2562 0.1591 0.0302 0.0749 -0.0216 90 GLN A CB 686 C CG . GLN A 90 ? 0.2700 0.3179 0.2289 0.0283 0.0670 -0.0037 90 GLN A CG 687 C CD . GLN A 90 ? 0.2873 0.3297 0.2235 0.0264 0.0653 -0.0031 90 GLN A CD 688 O OE1 . GLN A 90 ? 0.2563 0.2797 0.1571 0.0298 0.0781 -0.0098 90 GLN A OE1 689 N NE2 . GLN A 90 ? 0.3011 0.3525 0.2494 0.0195 0.0487 0.0053 90 GLN A NE2 690 N N . ASN A 91 ? 0.3116 0.3243 0.1658 0.0133 0.0437 -0.0435 91 ASN A N 691 C CA . ASN A 91 ? 0.3139 0.3314 0.1524 0.0117 0.0330 -0.0394 91 ASN A CA 692 C C . ASN A 91 ? 0.4203 0.4111 0.2161 0.0107 0.0461 -0.0396 91 ASN A C 693 O O . ASN A 91 ? 0.4258 0.4106 0.1886 0.0033 0.0340 -0.0403 91 ASN A O 694 C CB . ASN A 91 ? 0.3345 0.3688 0.1705 0.0051 0.0113 -0.0414 91 ASN A CB 695 C CG . ASN A 91 ? 0.4489 0.4946 0.2826 0.0094 0.0006 -0.0310 91 ASN A CG 696 O OD1 . ASN A 91 ? 0.4588 0.5024 0.3037 0.0177 0.0052 -0.0240 91 ASN A OD1 697 N ND2 . ASN A 91 ? 0.4317 0.4880 0.2495 0.0018 -0.0151 -0.0272 91 ASN A ND2 698 N N . ASN A 92 ? 0.4017 0.3764 0.1973 0.0193 0.0723 -0.0359 92 ASN A N 699 C CA . ASN A 92 ? 0.4188 0.3685 0.1816 0.0215 0.0885 -0.0330 92 ASN A CA 700 C C . ASN A 92 ? 0.4456 0.4083 0.2173 0.0275 0.0943 -0.0174 92 ASN A C 701 O O . ASN A 92 ? 0.4009 0.3494 0.1445 0.0257 0.0977 -0.0141 92 ASN A O 702 C CB . ASN A 92 ? 0.4458 0.3740 0.2127 0.0316 0.1155 -0.0312 92 ASN A CB 703 C CG . ASN A 92 ? 0.5300 0.4271 0.2628 0.0362 0.1338 -0.0273 92 ASN A CG 704 O OD1 . ASN A 92 ? 0.5809 0.4446 0.2641 0.0268 0.1264 -0.0380 92 ASN A OD1 705 N ND2 . ASN A 92 ? 0.5648 0.4726 0.3249 0.0501 0.1576 -0.0091 92 ASN A ND2 706 N N . ASN A 93 ? 0.4618 0.4564 0.2880 0.0286 0.0853 -0.0066 93 ASN A N 707 C CA . ASN A 93 ? 0.4280 0.4365 0.2765 0.0283 0.0840 0.0111 93 ASN A CA 708 C C . ASN A 93 ? 0.3471 0.3677 0.2134 0.0221 0.0569 0.0110 93 ASN A C 709 O O . ASN A 93 ? 0.3050 0.3351 0.1957 0.0198 0.0470 0.0077 93 ASN A O 710 C CB . ASN A 93 ? 0.4316 0.4590 0.3271 0.0324 0.1022 0.0314 93 ASN A CB 711 C CG . ASN A 93 ? 0.6557 0.6698 0.5368 0.0454 0.1393 0.0402 93 ASN A CG 712 O OD1 . ASN A 93 ? 0.7573 0.7517 0.6212 0.0541 0.1559 0.0302 93 ASN A OD1 713 N ND2 . ASN A 93 ? 0.7472 0.7666 0.6332 0.0470 0.1535 0.0596 93 ASN A ND2 714 N N . TRP A 94 ? 0.3889 0.4025 0.2376 0.0208 0.0475 0.0158 94 TRP A N 715 C CA . TRP A 94 ? 0.3756 0.3868 0.2316 0.0190 0.0285 0.0183 94 TRP A CA 716 C C . TRP A 94 ? 0.3738 0.3853 0.2581 0.0096 0.0268 0.0322 94 TRP A C 717 O O . TRP A 94 ? 0.3254 0.3433 0.2230 0.0050 0.0385 0.0481 94 TRP A O 718 C CB . TRP A 94 ? 0.3361 0.3351 0.1642 0.0227 0.0227 0.0240 94 TRP A CB 719 C CG . TRP A 94 ? 0.3697 0.3565 0.1948 0.0280 0.0084 0.0254 94 TRP A CG 720 C CD1 . TRP A 94 ? 0.3672 0.3600 0.1862 0.0390 -0.0001 0.0215 94 TRP A CD1 721 C CD2 . TRP A 94 ? 0.4333 0.3945 0.2576 0.0233 0.0036 0.0337 94 TRP A CD2 722 N NE1 . TRP A 94 ? 0.3486 0.3176 0.1612 0.0474 -0.0039 0.0265 94 TRP A NE1 723 C CE2 . TRP A 94 ? 0.4017 0.3438 0.2099 0.0360 -0.0031 0.0315 94 TRP A CE2 724 C CE3 . TRP A 94 ? 0.3740 0.3247 0.2083 0.0078 0.0041 0.0457 94 TRP A CE3 725 C CZ2 . TRP A 94 ? 0.3842 0.2821 0.1718 0.0347 -0.0072 0.0361 94 TRP A CZ2 726 C CZ3 . TRP A 94 ? 0.4271 0.3394 0.2448 -0.0001 -0.0069 0.0514 94 TRP A CZ3 727 C CH2 . TRP A 94 ? 0.3881 0.2671 0.1756 0.0138 -0.0114 0.0442 94 TRP A CH2 728 N N . PRO A 95 ? 0.3465 0.3501 0.2378 0.0046 0.0118 0.0288 95 PRO A N 729 C CA . PRO A 95 ? 0.3228 0.3203 0.2008 0.0131 0.0036 0.0137 95 PRO A CA 730 C C . PRO A 95 ? 0.2358 0.2515 0.1320 0.0136 0.0068 0.0043 95 PRO A C 731 O O . PRO A 95 ? 0.3310 0.3585 0.2518 0.0074 0.0119 0.0110 95 PRO A O 732 C CB . PRO A 95 ? 0.3871 0.3527 0.2518 0.0069 -0.0091 0.0167 95 PRO A CB 733 C CG . PRO A 95 ? 0.2836 0.2530 0.1708 -0.0131 -0.0144 0.0314 95 PRO A CG 734 C CD . PRO A 95 ? 0.2777 0.2724 0.1841 -0.0121 0.0007 0.0430 95 PRO A CD 735 N N . THR A 96 ? 0.2727 0.2932 0.1607 0.0213 0.0042 -0.0071 96 THR A N 736 C CA . THR A 96 ? 0.2303 0.2633 0.1316 0.0204 0.0064 -0.0158 96 THR A CA 737 C C . THR A 96 ? 0.2589 0.2855 0.1739 0.0143 0.0006 -0.0130 96 THR A C 738 O O . THR A 96 ? 0.2877 0.2926 0.1883 0.0124 -0.0084 -0.0108 96 THR A O 739 C CB . THR A 96 ? 0.2588 0.3020 0.1533 0.0263 0.0021 -0.0234 96 THR A CB 740 O OG1 . THR A 96 ? 0.3328 0.3850 0.2371 0.0220 0.0049 -0.0311 96 THR A OG1 741 C CG2 . THR A 96 ? 0.2108 0.2443 0.1005 0.0353 -0.0025 -0.0210 96 THR A CG2 742 N N . THR A 97 ? 0.2989 0.3380 0.2356 0.0108 0.0059 -0.0113 97 THR A N 743 C CA . THR A 97 ? 0.2971 0.3345 0.2491 0.0021 -0.0033 -0.0036 97 THR A CA 744 C C . THR A 97 ? 0.2626 0.3082 0.2246 0.0050 0.0001 -0.0103 97 THR A C 745 O O . THR A 97 ? 0.2737 0.3264 0.2372 0.0113 0.0125 -0.0177 97 THR A O 746 C CB . THR A 97 ? 0.2977 0.3498 0.2806 -0.0069 -0.0028 0.0177 97 THR A CB 747 O OG1 . THR A 97 ? 0.3766 0.4462 0.3776 0.0036 0.0194 0.0213 97 THR A OG1 748 C CG2 . THR A 97 ? 0.2081 0.2476 0.1804 -0.0160 -0.0109 0.0276 97 THR A CG2 749 N N . PHE A 98 ? 0.2535 0.2905 0.2142 -0.0019 -0.0120 -0.0075 98 PHE A N 750 C CA . PHE A 98 ? 0.2031 0.2450 0.1712 -0.0001 -0.0099 -0.0117 98 PHE A CA 751 C C . PHE A 98 ? 0.2701 0.3239 0.2673 -0.0078 -0.0160 0.0063 98 PHE A C 752 O O . PHE A 98 ? 0.2804 0.3356 0.2867 -0.0203 -0.0299 0.0228 98 PHE A O 753 C CB . PHE A 98 ? 0.1964 0.2173 0.1349 0.0003 -0.0168 -0.0205 98 PHE A CB 754 C CG . PHE A 98 ? 0.2801 0.2991 0.2014 0.0114 -0.0092 -0.0308 98 PHE A CG 755 C CD1 . PHE A 98 ? 0.2856 0.2873 0.1860 0.0153 -0.0112 -0.0299 98 PHE A CD1 756 C CD2 . PHE A 98 ? 0.2856 0.3212 0.2141 0.0169 -0.0014 -0.0375 98 PHE A CD2 757 C CE1 . PHE A 98 ? 0.3236 0.3300 0.2159 0.0286 -0.0039 -0.0330 98 PHE A CE1 758 C CE2 . PHE A 98 ? 0.3507 0.3960 0.2742 0.0256 0.0026 -0.0393 98 PHE A CE2 759 C CZ . PHE A 98 ? 0.3528 0.3863 0.2609 0.0336 0.0022 -0.0358 98 PHE A CZ 760 N N . GLY A 99 ? 0.2519 0.3146 0.2650 -0.0020 -0.0073 0.0065 99 GLY A N 761 C CA . GLY A 99 ? 0.2682 0.3448 0.3116 -0.0070 -0.0145 0.0274 99 GLY A CA 762 C C . GLY A 99 ? 0.2254 0.2840 0.2448 -0.0207 -0.0371 0.0283 99 GLY A C 763 O O . GLY A 99 ? 0.2731 0.3050 0.2512 -0.0216 -0.0403 0.0113 99 GLY A O 764 N N . ALA A 100 ? 0.1920 0.2632 0.2349 -0.0301 -0.0513 0.0508 100 ALA A N 765 C CA . ALA A 100 ? 0.2108 0.2571 0.2205 -0.0475 -0.0763 0.0543 100 ALA A CA 766 C C . ALA A 100 ? 0.2949 0.3287 0.2874 -0.0401 -0.0695 0.0440 100 ALA A C 767 O O . ALA A 100 ? 0.3730 0.3809 0.3302 -0.0525 -0.0866 0.0463 100 ALA A O 768 C CB . ALA A 100 ? 0.2257 0.2928 0.2661 -0.0680 -0.1030 0.0886 100 ALA A CB 769 N N . GLY A 101 ? 0.2655 0.3117 0.2765 -0.0222 -0.0449 0.0335 101 GLY A N 770 C CA . GLY A 101 ? 0.2924 0.3275 0.2897 -0.0167 -0.0366 0.0243 101 GLY A CA 771 C C . GLY A 101 ? 0.2803 0.3268 0.3056 -0.0151 -0.0382 0.0439 101 GLY A C 772 O O . GLY A 101 ? 0.3440 0.4072 0.3949 -0.0229 -0.0549 0.0698 101 GLY A O 773 N N . THR A 102 ? 0.3665 0.1400 0.1826 0.0736 0.0729 -0.0122 102 THR A N 774 C CA . THR A 102 ? 0.3608 0.1377 0.1835 0.0726 0.0707 -0.0134 102 THR A CA 775 C C . THR A 102 ? 0.4665 0.2467 0.2916 0.0702 0.0669 -0.0155 102 THR A C 776 O O . THR A 102 ? 0.4229 0.2033 0.2446 0.0716 0.0649 -0.0155 102 THR A O 777 C CB . THR A 102 ? 0.4698 0.2421 0.2880 0.0767 0.0702 -0.0118 102 THR A CB 778 O OG1 . THR A 102 ? 0.4732 0.2432 0.2895 0.0808 0.0751 -0.0087 102 THR A OG1 779 C CG2 . THR A 102 ? 0.3672 0.1395 0.1879 0.0769 0.0685 -0.0121 102 THR A CG2 780 N N . LYS A 103 ? 0.4658 0.2490 0.2968 0.0670 0.0663 -0.0169 103 LYS A N 781 C CA . LYS A 103 ? 0.4128 0.1991 0.2459 0.0651 0.0633 -0.0186 103 LYS A CA 782 C C . LYS A 103 ? 0.4575 0.2452 0.2940 0.0654 0.0589 -0.0196 103 LYS A C 783 O O . LYS A 103 ? 0.4327 0.2188 0.2710 0.0665 0.0594 -0.0188 103 LYS A O 784 C CB . LYS A 103 ? 0.3425 0.1278 0.1763 0.0606 0.0646 -0.0198 103 LYS A CB 785 C CG . LYS A 103 ? 0.3383 0.1264 0.1737 0.0590 0.0621 -0.0212 103 LYS A CG 786 C CD . LYS A 103 ? 0.4852 0.2639 0.3106 0.0546 0.0653 -0.0215 103 LYS A CD 787 C CE . LYS A 103 ? 0.5619 0.3395 0.3839 0.0545 0.0647 -0.0216 103 LYS A CE 788 N NZ . LYS A 103 ? 0.6074 0.3675 0.4091 0.0514 0.0697 -0.0204 103 LYS A NZ 789 N N . LEU A 104 ? 0.4502 0.2389 0.2850 0.0654 0.0554 -0.0206 104 LEU A N 790 C CA . LEU A 104 ? 0.4191 0.2039 0.2521 0.0639 0.0505 -0.0218 104 LEU A CA 791 C C . LEU A 104 ? 0.4312 0.2161 0.2639 0.0625 0.0492 -0.0224 104 LEU A C 792 O O . LEU A 104 ? 0.4452 0.2290 0.2717 0.0647 0.0500 -0.0215 104 LEU A O 793 C CB . LEU A 104 ? 0.3565 0.1281 0.1725 0.0655 0.0484 -0.0209 104 LEU A CB 794 C CG . LEU A 104 ? 0.4793 0.2312 0.2761 0.0631 0.0437 -0.0210 104 LEU A CG 795 C CD1 . LEU A 104 ? 0.3849 0.1287 0.1775 0.0631 0.0440 -0.0203 104 LEU A CD1 796 C CD2 . LEU A 104 ? 0.4703 0.1986 0.2376 0.0625 0.0398 -0.0198 104 LEU A CD2 797 N N . GLU A 105 ? 0.4466 0.2315 0.2840 0.0606 0.0485 -0.0229 105 GLU A N 798 C CA . GLU A 105 ? 0.4794 0.2635 0.3165 0.0586 0.0468 -0.0237 105 GLU A CA 799 C C . GLU A 105 ? 0.5210 0.2915 0.3459 0.0575 0.0422 -0.0235 105 GLU A C 800 O O . GLU A 105 ? 0.5281 0.2894 0.3458 0.0585 0.0419 -0.0224 105 GLU A O 801 C CB . GLU A 105 ? 0.4593 0.2475 0.3045 0.0569 0.0494 -0.0238 105 GLU A CB 802 C CG . GLU A 105 ? 0.5538 0.3445 0.4002 0.0558 0.0538 -0.0237 105 GLU A CG 803 C CD . GLU A 105 ? 0.6445 0.4292 0.4889 0.0535 0.0574 -0.0227 105 GLU A CD 804 O OE1 . GLU A 105 ? 0.6825 0.4649 0.5290 0.0563 0.0582 -0.0206 105 GLU A OE1 805 O OE2 . GLU A 105 ? 0.7095 0.4867 0.5450 0.0494 0.0608 -0.0231 105 GLU A OE2 806 N N . LEU A 106 ? 0.4385 0.2033 0.2558 0.0558 0.0391 -0.0239 106 LEU A N 807 C CA . LEU A 106 ? 0.4212 0.1669 0.2207 0.0520 0.0329 -0.0236 106 LEU A CA 808 C C . LEU A 106 ? 0.4356 0.1843 0.2426 0.0499 0.0318 -0.0240 106 LEU A C 809 O O . LEU A 106 ? 0.3897 0.1490 0.2067 0.0498 0.0334 -0.0249 106 LEU A O 810 C CB . LEU A 106 ? 0.5400 0.2677 0.3158 0.0500 0.0275 -0.0228 106 LEU A CB 811 C CG . LEU A 106 ? 0.6461 0.3485 0.3939 0.0457 0.0220 -0.0216 106 LEU A CG 812 C CD1 . LEU A 106 ? 0.7386 0.4520 0.4942 0.0527 0.0285 -0.0212 106 LEU A CD1 813 C CD2 . LEU A 106 ? 0.6423 0.3283 0.3634 0.0336 0.0094 -0.0167 106 LEU A CD2 814 N N . LYS A 107 ? 0.5294 0.2656 0.3272 0.0491 0.0302 -0.0227 107 LYS A N 815 C CA . LYS A 107 ? 0.5430 0.2766 0.3421 0.0474 0.0286 -0.0222 107 LYS A CA 816 C C . LYS A 107 ? 0.5645 0.2821 0.3455 0.0391 0.0192 -0.0226 107 LYS A C 817 O O . LYS A 107 ? 0.6112 0.3100 0.3688 0.0332 0.0126 -0.0220 107 LYS A O 818 C CB . LYS A 107 ? 0.5686 0.2897 0.3574 0.0523 0.0321 -0.0191 107 LYS A CB 819 C CG . LYS A 107 ? 0.6224 0.3571 0.4274 0.0613 0.0415 -0.0162 107 LYS A CG 820 C CD . LYS A 107 ? 0.6923 0.4098 0.4791 0.0702 0.0477 -0.0111 107 LYS A CD 821 C CE . LYS A 107 ? 0.7285 0.4574 0.5281 0.0814 0.0583 -0.0047 107 LYS A CE 822 N NZ . LYS A 107 ? 0.7078 0.4541 0.5250 0.0802 0.0601 -0.0059 107 LYS A NZ 823 N N . ARG A 108 ? 0.4471 0.1685 0.2351 0.0367 0.0174 -0.0228 108 ARG A N 824 C CA . ARG A 108 ? 0.4285 0.1324 0.1976 0.0263 0.0065 -0.0219 108 ARG A CA 825 C C . ARG A 108 ? 0.4632 0.1722 0.2426 0.0256 0.0065 -0.0215 108 ARG A C 826 O O . ARG A 108 ? 0.5227 0.2458 0.3207 0.0333 0.0149 -0.0214 108 ARG A O 827 C CB . ARG A 108 ? 0.3974 0.1205 0.1731 0.0219 0.0022 -0.0190 108 ARG A CB 828 C CG . ARG A 108 ? 0.4192 0.1674 0.2191 0.0304 0.0116 -0.0207 108 ARG A CG 829 C CD . ARG A 108 ? 0.4605 0.2401 0.2712 0.0256 0.0069 -0.0122 108 ARG A CD 830 N NE . ARG A 108 ? 0.4723 0.2577 0.2854 0.0148 -0.0026 -0.0088 108 ARG A NE 831 C CZ . ARG A 108 ? 0.3568 0.1681 0.1750 0.0062 -0.0113 0.0019 108 ARG A CZ 832 N NH1 . ARG A 108 ? 0.3543 0.1919 0.1769 0.0084 -0.0111 0.0126 108 ARG A NH1 833 N NH2 . ARG A 108 ? 0.3575 0.1712 0.1768 -0.0041 -0.0199 0.0041 108 ARG A NH2 834 N N . THR A 109 ? 0.4125 0.1111 0.1791 0.0140 -0.0044 -0.0194 109 THR A N 835 C CA . THR A 109 ? 0.4630 0.1674 0.2393 0.0125 -0.0053 -0.0184 109 THR A CA 836 C C . THR A 109 ? 0.4851 0.2250 0.2930 0.0153 -0.0005 -0.0188 109 THR A C 837 O O . THR A 109 ? 0.4356 0.1948 0.2532 0.0163 0.0015 -0.0185 109 THR A O 838 C CB . THR A 109 ? 0.4965 0.1974 0.2588 -0.0041 -0.0197 -0.0133 109 THR A CB 839 O OG1 . THR A 109 ? 0.5292 0.2640 0.3045 -0.0138 -0.0275 -0.0071 109 THR A OG1 840 C CG2 . THR A 109 ? 0.4663 0.1203 0.1851 -0.0107 -0.0254 -0.0128 109 THR A CG2 841 N N . VAL A 110 ? 0.5253 0.2704 0.3446 0.0169 0.0023 -0.0183 110 VAL A N 842 C CA . VAL A 110 ? 0.5272 0.2984 0.3684 0.0160 0.0058 -0.0183 110 VAL A CA 843 C C . VAL A 110 ? 0.4504 0.2417 0.2974 0.0082 -0.0009 -0.0158 110 VAL A C 844 O O . VAL A 110 ? 0.3362 0.1288 0.1786 0.0000 -0.0104 -0.0120 110 VAL A O 845 C CB . VAL A 110 ? 0.4431 0.2193 0.2949 0.0160 0.0079 -0.0153 110 VAL A CB 846 C CG1 . VAL A 110 ? 0.3176 0.1163 0.1849 0.0095 0.0082 -0.0150 110 VAL A CG1 847 C CG2 . VAL A 110 ? 0.3424 0.1097 0.1935 0.0266 0.0172 -0.0127 110 VAL A CG2 848 N N . ALA A 111 ? 0.3517 0.1563 0.2047 0.0114 0.0049 -0.0164 111 ALA A N 849 C CA . ALA A 111 ? 0.3529 0.1781 0.2101 0.0095 0.0028 -0.0112 111 ALA A CA 850 C C . ALA A 111 ? 0.3967 0.2242 0.2559 0.0112 0.0104 -0.0133 111 ALA A C 851 O O . ALA A 111 ? 0.4150 0.2302 0.2660 0.0158 0.0192 -0.0173 111 ALA A O 852 C CB . ALA A 111 ? 0.3197 0.1536 0.1717 0.0152 0.0046 -0.0060 111 ALA A CB 853 N N . ALA A 112 ? 0.3195 0.1590 0.1850 0.0055 0.0063 -0.0103 112 ALA A N 854 C CA . ALA A 112 ? 0.3411 0.1771 0.2013 0.0045 0.0125 -0.0119 112 ALA A CA 855 C C . ALA A 112 ? 0.3408 0.1755 0.1864 0.0159 0.0227 -0.0086 112 ALA A C 856 O O . ALA A 112 ? 0.3697 0.2229 0.2194 0.0227 0.0219 -0.0004 112 ALA A O 857 C CB . ALA A 112 ? 0.3019 0.1504 0.1719 -0.0043 0.0054 -0.0091 112 ALA A CB 858 N N . PRO A 113 ? 0.3609 0.1722 0.1856 0.0178 0.0326 -0.0129 113 PRO A N 859 C CA . PRO A 113 ? 0.4548 0.2547 0.2558 0.0325 0.0461 -0.0091 113 PRO A CA 860 C C . PRO A 113 ? 0.4790 0.2917 0.2775 0.0377 0.0486 -0.0010 113 PRO A C 861 O O . PRO A 113 ? 0.4554 0.2718 0.2607 0.0260 0.0415 -0.0026 113 PRO A O 862 C CB . PRO A 113 ? 0.3925 0.1533 0.1627 0.0273 0.0539 -0.0168 113 PRO A CB 863 C CG . PRO A 113 ? 0.3809 0.1445 0.1636 0.0069 0.0426 -0.0205 113 PRO A CG 864 C CD . PRO A 113 ? 0.3485 0.1411 0.1659 0.0057 0.0320 -0.0190 113 PRO A CD 865 N N . SER A 114 ? 0.2702 0.2856 0.3562 0.0074 -0.0224 0.0119 114 SER A N 866 C CA . SER A 114 ? 0.1934 0.2044 0.2702 -0.0095 -0.0169 0.0153 114 SER A CA 867 C C . SER A 114 ? 0.1562 0.1797 0.2369 -0.0061 -0.0097 0.0191 114 SER A C 868 O O . SER A 114 ? 0.2222 0.2640 0.3136 0.0045 -0.0047 0.0169 114 SER A O 869 C CB . SER A 114 ? 0.1543 0.1831 0.2393 -0.0187 -0.0105 0.0070 114 SER A CB 870 O OG . SER A 114 ? 0.3647 0.3802 0.4464 -0.0242 -0.0172 0.0024 114 SER A OG 871 N N . VAL A 115 ? 0.1619 0.1698 0.2287 -0.0150 -0.0105 0.0247 115 VAL A N 872 C CA . VAL A 115 ? 0.1430 0.1580 0.2121 -0.0117 -0.0064 0.0276 115 VAL A CA 873 C C . VAL A 115 ? 0.1960 0.2182 0.2584 -0.0235 0.0037 0.0263 115 VAL A C 874 O O . VAL A 115 ? 0.2259 0.2346 0.2711 -0.0392 0.0060 0.0271 115 VAL A O 875 C CB . VAL A 115 ? 0.2413 0.2348 0.3002 -0.0097 -0.0176 0.0319 115 VAL A CB 876 C CG1 . VAL A 115 ? 0.1883 0.1910 0.2531 -0.0070 -0.0140 0.0327 115 VAL A CG1 877 C CG2 . VAL A 115 ? 0.1582 0.1486 0.2279 0.0030 -0.0287 0.0283 115 VAL A CG2 878 N N . PHE A 116 ? 0.2427 0.2840 0.3161 -0.0165 0.0102 0.0233 116 PHE A N 879 C CA . PHE A 116 ? 0.2620 0.3148 0.3331 -0.0237 0.0191 0.0182 116 PHE A CA 880 C C . PHE A 116 ? 0.2929 0.3433 0.3626 -0.0165 0.0191 0.0208 116 PHE A C 881 O O . PHE A 116 ? 0.2979 0.3470 0.3747 -0.0054 0.0160 0.0235 116 PHE A O 882 C CB . PHE A 116 ? 0.1975 0.2780 0.2865 -0.0187 0.0238 0.0063 116 PHE A CB 883 C CG . PHE A 116 ? 0.1890 0.2754 0.2850 -0.0248 0.0226 0.0010 116 PHE A CG 884 C CD1 . PHE A 116 ? 0.1181 0.2008 0.2191 -0.0133 0.0146 0.0026 116 PHE A CD1 885 C CD2 . PHE A 116 ? 0.1618 0.2582 0.2590 -0.0438 0.0311 -0.0074 116 PHE A CD2 886 C CE1 . PHE A 116 ? 0.1430 0.2298 0.2502 -0.0184 0.0118 -0.0037 116 PHE A CE1 887 C CE2 . PHE A 116 ? 0.1669 0.2684 0.2722 -0.0522 0.0302 -0.0140 116 PHE A CE2 888 C CZ . PHE A 116 ? 0.1732 0.2690 0.2838 -0.0382 0.0189 -0.0121 116 PHE A CZ 889 N N . ILE A 117 ? 0.2329 0.2811 0.2912 -0.0246 0.0238 0.0191 117 ILE A N 890 C CA . ILE A 117 ? 0.1550 0.1995 0.2112 -0.0184 0.0230 0.0196 117 ILE A CA 891 C C . ILE A 117 ? 0.1721 0.2335 0.2307 -0.0172 0.0311 0.0088 117 ILE A C 892 O O . ILE A 117 ? 0.2207 0.2944 0.2766 -0.0279 0.0396 0.0012 117 ILE A O 893 C CB . ILE A 117 ? 0.1948 0.2164 0.2330 -0.0247 0.0160 0.0260 117 ILE A CB 894 C CG1 . ILE A 117 ? 0.1525 0.1709 0.1941 -0.0181 0.0131 0.0254 117 ILE A CG1 895 C CG2 . ILE A 117 ? 0.2481 0.2592 0.2603 -0.0400 0.0212 0.0252 117 ILE A CG2 896 C CD1 . ILE A 117 ? 0.1719 0.1702 0.1972 -0.0225 0.0032 0.0282 117 ILE A CD1 897 N N . PHE A 118 ? 0.1897 0.2508 0.2530 -0.0047 0.0289 0.0064 118 PHE A N 898 C CA . PHE A 118 ? 0.1405 0.2162 0.2078 0.0026 0.0327 -0.0068 118 PHE A CA 899 C C . PHE A 118 ? 0.2068 0.2665 0.2629 0.0056 0.0303 -0.0063 118 PHE A C 900 O O . PHE A 118 ? 0.1527 0.1938 0.2063 0.0116 0.0244 0.0006 118 PHE A O 901 C CB . PHE A 118 ? 0.1357 0.2181 0.2140 0.0202 0.0275 -0.0126 118 PHE A CB 902 C CG . PHE A 118 ? 0.1789 0.2789 0.2703 0.0203 0.0273 -0.0164 118 PHE A CG 903 C CD1 . PHE A 118 ? 0.1253 0.2572 0.2338 0.0199 0.0314 -0.0341 118 PHE A CD1 904 C CD2 . PHE A 118 ? 0.1200 0.2079 0.2094 0.0210 0.0233 -0.0055 118 PHE A CD2 905 C CE1 . PHE A 118 ? 0.1236 0.2728 0.2470 0.0194 0.0298 -0.0400 118 PHE A CE1 906 C CE2 . PHE A 118 ? 0.1142 0.2160 0.2141 0.0221 0.0216 -0.0103 118 PHE A CE2 907 C CZ . PHE A 118 ? 0.1133 0.2450 0.2303 0.0210 0.0240 -0.0272 118 PHE A CZ 908 N N . PRO A 119 ? 0.2093 0.2754 0.2571 -0.0004 0.0361 -0.0148 119 PRO A N 909 C CA . PRO A 119 ? 0.2737 0.3248 0.3107 0.0042 0.0325 -0.0173 119 PRO A CA 910 C C . PRO A 119 ? 0.2634 0.3139 0.3076 0.0229 0.0275 -0.0263 119 PRO A C 911 O O . PRO A 119 ? 0.2970 0.3634 0.3540 0.0330 0.0268 -0.0334 119 PRO A O 912 C CB . PRO A 119 ? 0.2366 0.2984 0.2607 -0.0061 0.0422 -0.0273 119 PRO A CB 913 C CG . PRO A 119 ? 0.1925 0.2794 0.2250 -0.0161 0.0533 -0.0332 119 PRO A CG 914 C CD . PRO A 119 ? 0.2071 0.2898 0.2502 -0.0156 0.0474 -0.0215 119 PRO A CD 915 N N . PRO A 120 ? 0.2880 0.3161 0.3214 0.0284 0.0218 -0.0268 120 PRO A N 916 C CA . PRO A 120 ? 0.3090 0.3267 0.3407 0.0475 0.0146 -0.0364 120 PRO A CA 917 C C . PRO A 120 ? 0.2933 0.3402 0.3345 0.0582 0.0174 -0.0588 120 PRO A C 918 O O . PRO A 120 ? 0.3200 0.3847 0.3602 0.0483 0.0267 -0.0670 120 PRO A O 919 C CB . PRO A 120 ? 0.2328 0.2177 0.2487 0.0456 0.0090 -0.0326 120 PRO A CB 920 C CG . PRO A 120 ? 0.3781 0.3697 0.3908 0.0295 0.0136 -0.0298 120 PRO A CG 921 C CD . PRO A 120 ? 0.3427 0.3507 0.3637 0.0184 0.0189 -0.0202 120 PRO A CD 922 N N . SER A 121 ? 0.2261 0.2777 0.2750 0.0789 0.0090 -0.0705 121 SER A N 923 C CA . SER A 121 ? 0.3441 0.4280 0.4089 0.0941 0.0087 -0.0978 121 SER A CA 924 C C . SER A 121 ? 0.2858 0.3530 0.3371 0.1025 0.0046 -0.1085 121 SER A C 925 O O . SER A 121 ? 0.3182 0.3404 0.3469 0.1038 -0.0040 -0.0957 121 SER A O 926 C CB . SER A 121 ? 0.3507 0.4368 0.4246 0.1196 -0.0063 -0.1091 121 SER A CB 927 O OG . SER A 121 ? 0.3621 0.3935 0.4072 0.1340 -0.0222 -0.0978 121 SER A OG 928 N N . ASP A 122 ? 0.2642 0.3685 0.3299 0.1069 0.0121 -0.1338 122 ASP A N 929 C CA . ASP A 122 ? 0.3683 0.4598 0.4223 0.1185 0.0073 -0.1486 122 ASP A CA 930 C C . ASP A 122 ? 0.3210 0.3793 0.3668 0.1497 -0.0160 -0.1568 122 ASP A C 931 O O . ASP A 122 ? 0.3506 0.3727 0.3755 0.1588 -0.0257 -0.1593 122 ASP A O 932 C CB . ASP A 122 ? 0.4033 0.5471 0.4757 0.1165 0.0229 -0.1777 122 ASP A CB 933 C CG . ASP A 122 ? 0.4980 0.6604 0.5637 0.0834 0.0460 -0.1677 122 ASP A CG 934 O OD1 . ASP A 122 ? 0.5218 0.6489 0.5619 0.0668 0.0457 -0.1424 122 ASP A OD1 935 O OD2 . ASP A 122 ? 0.5649 0.7742 0.6494 0.0726 0.0632 -0.1847 122 ASP A OD2 936 N N . GLU A 123 ? 0.3596 0.4235 0.4156 0.1615 -0.0266 -0.1568 123 GLU A N 937 C CA . GLU A 123 ? 0.4239 0.4447 0.4587 0.1822 -0.0509 -0.1537 123 GLU A CA 938 C C . GLU A 123 ? 0.3810 0.3318 0.3777 0.1810 -0.0574 -0.1311 123 GLU A C 939 O O . GLU A 123 ? 0.4221 0.3293 0.3927 0.1894 -0.0702 -0.1310 123 GLU A O 940 C CB . GLU A 123 ? 0.4492 0.4846 0.4939 0.1894 -0.0607 -0.1538 123 GLU A CB 941 C CG . GLU A 123 ? 0.4745 0.5712 0.5548 0.1917 -0.0602 -0.1790 123 GLU A CG 942 C CD . GLU A 123 ? 0.5830 0.7324 0.6939 0.1674 -0.0352 -0.1818 123 GLU A CD 943 O OE1 . GLU A 123 ? 0.5922 0.7347 0.6967 0.1505 -0.0183 -0.1669 123 GLU A OE1 944 O OE2 . GLU A 123 ? 0.6224 0.8182 0.7616 0.1642 -0.0335 -0.2001 123 GLU A OE2 945 N N . GLN A 124 ? 0.3569 0.2991 0.3502 0.1624 -0.0472 -0.1088 124 GLN A N 946 C CA . GLN A 124 ? 0.5395 0.4237 0.5007 0.1486 -0.0487 -0.0835 124 GLN A CA 947 C C . GLN A 124 ? 0.4938 0.3603 0.4457 0.1361 -0.0451 -0.0827 124 GLN A C 948 O O . GLN A 124 ? 0.5272 0.3386 0.4502 0.1356 -0.0534 -0.0751 124 GLN A O 949 C CB . GLN A 124 ? 0.3452 0.2375 0.3121 0.1253 -0.0358 -0.0606 124 GLN A CB 950 C CG . GLN A 124 ? 0.3709 0.2082 0.3081 0.1114 -0.0356 -0.0390 124 GLN A CG 951 C CD . GLN A 124 ? 0.3587 0.2099 0.3069 0.0874 -0.0214 -0.0208 124 GLN A CD 952 O OE1 . GLN A 124 ? 0.4097 0.3059 0.3845 0.0799 -0.0131 -0.0217 124 GLN A OE1 953 N NE2 . GLN A 124 ? 0.4261 0.2369 0.3526 0.0745 -0.0182 -0.0056 124 GLN A NE2 954 N N . LEU A 125 ? 0.4033 0.3131 0.3760 0.1249 -0.0328 -0.0912 125 LEU A N 955 C CA . LEU A 125 ? 0.3690 0.2664 0.3325 0.1136 -0.0304 -0.0924 125 LEU A CA 956 C C . LEU A 125 ? 0.4687 0.3334 0.4142 0.1346 -0.0451 -0.1096 125 LEU A C 957 O O . LEU A 125 ? 0.5460 0.3785 0.4750 0.1265 -0.0485 -0.1068 125 LEU A O 958 C CB . LEU A 125 ? 0.3415 0.2870 0.3211 0.1006 -0.0154 -0.1002 125 LEU A CB 959 C CG . LEU A 125 ? 0.4204 0.3838 0.4090 0.0776 -0.0039 -0.0813 125 LEU A CG 960 C CD1 . LEU A 125 ? 0.4435 0.4396 0.4342 0.0637 0.0094 -0.0876 125 LEU A CD1 961 C CD2 . LEU A 125 ? 0.3536 0.2815 0.3317 0.0628 -0.0079 -0.0614 125 LEU A CD2 962 N N . LYS A 126 ? 0.5148 0.3871 0.4644 0.1630 -0.0561 -0.1293 126 LYS A N 963 C CA . LYS A 126 ? 0.6149 0.4556 0.5465 0.1826 -0.0732 -0.1427 126 LYS A CA 964 C C . LYS A 126 ? 0.6015 0.3677 0.4946 0.1794 -0.0864 -0.1230 126 LYS A C 965 O O . LYS A 126 ? 0.6496 0.3809 0.5221 0.1836 -0.0972 -0.1268 126 LYS A O 966 C CB . LYS A 126 ? 0.6344 0.5140 0.5847 0.2028 -0.0823 -0.1605 126 LYS A CB 967 C CG . LYS A 126 ? 0.6023 0.5531 0.5883 0.2009 -0.0673 -0.1832 126 LYS A CG 968 C CD . LYS A 126 ? 0.6260 0.6219 0.6385 0.2151 -0.0748 -0.2000 126 LYS A CD 969 C CE . LYS A 126 ? 0.7074 0.7077 0.7210 0.2350 -0.0904 -0.2221 126 LYS A CE 970 N NZ . LYS A 126 ? 0.7423 0.8051 0.7928 0.2431 -0.0919 -0.2457 126 LYS A NZ 971 N N . SER A 127 ? 0.5700 0.3128 0.4521 0.1693 -0.0835 -0.1021 127 SER A N 972 C CA . SER A 127 ? 0.6858 0.3609 0.5290 0.1581 -0.0894 -0.0818 127 SER A CA 973 C C . SER A 127 ? 0.7488 0.3944 0.5851 0.1298 -0.0786 -0.0689 127 SER A C 974 O O . SER A 127 ? 0.7951 0.3907 0.6038 0.1131 -0.0786 -0.0537 127 SER A O 975 C CB . SER A 127 ? 0.7326 0.3969 0.5631 0.1578 -0.0896 -0.0663 127 SER A CB 976 O OG . SER A 127 ? 0.6733 0.3581 0.5221 0.1417 -0.0734 -0.0546 127 SER A OG 977 N N . GLY A 128 ? 0.6793 0.3763 0.5475 0.1152 -0.0657 -0.0719 128 GLY A N 978 C CA . GLY A 128 ? 0.7148 0.4038 0.5865 0.0862 -0.0574 -0.0619 128 GLY A CA 979 C C . GLY A 128 ? 0.7085 0.4124 0.5943 0.0614 -0.0434 -0.0421 128 GLY A C 980 O O . GLY A 128 ? 0.6816 0.3785 0.5736 0.0374 -0.0376 -0.0352 128 GLY A O 981 N N . THR A 129 ? 0.6415 0.3691 0.5355 0.0682 -0.0388 -0.0360 129 THR A N 982 C CA . THR A 129 ? 0.6315 0.3777 0.5405 0.0480 -0.0258 -0.0201 129 THR A CA 983 C C . THR A 129 ? 0.5362 0.3411 0.4740 0.0519 -0.0195 -0.0222 129 THR A C 984 O O . THR A 129 ? 0.4371 0.2636 0.3794 0.0711 -0.0236 -0.0337 129 THR A O 985 C CB . THR A 129 ? 0.6244 0.3274 0.5054 0.0467 -0.0248 -0.0070 129 THR A CB 986 O OG1 . THR A 129 ? 0.6685 0.3105 0.5178 0.0368 -0.0281 -0.0040 129 THR A OG1 987 C CG2 . THR A 129 ? 0.5575 0.2839 0.4556 0.0266 -0.0097 0.0065 129 THR A CG2 988 N N . ALA A 130 ? 0.4991 0.3298 0.4572 0.0332 -0.0101 -0.0131 130 ALA A N 989 C CA . ALA A 130 ? 0.4706 0.3473 0.4499 0.0335 -0.0047 -0.0133 130 ALA A CA 990 C C . ALA A 130 ? 0.3972 0.2826 0.3863 0.0240 0.0024 -0.0004 130 ALA A C 991 O O . ALA A 130 ? 0.3985 0.2805 0.3956 0.0077 0.0065 0.0060 130 ALA A O 992 C CB . ALA A 130 ? 0.3714 0.2696 0.3610 0.0237 -0.0039 -0.0179 130 ALA A CB 993 N N . SER A 131 ? 0.3856 0.2851 0.3765 0.0347 0.0034 0.0004 131 SER A N 994 C CA . SER A 131 ? 0.2995 0.2106 0.2995 0.0275 0.0098 0.0104 131 SER A CA 995 C C . SER A 131 ? 0.2315 0.1817 0.2517 0.0252 0.0123 0.0084 131 SER A C 996 O O . SER A 131 ? 0.2669 0.2360 0.2905 0.0342 0.0113 -0.0007 131 SER A O 997 C CB . SER A 131 ? 0.2672 0.1596 0.2494 0.0403 0.0075 0.0134 131 SER A CB 998 O OG . SER A 131 ? 0.3296 0.1738 0.2823 0.0396 0.0056 0.0181 131 SER A OG 999 N N . VAL A 132 ? 0.1959 0.1572 0.2291 0.0126 0.0157 0.0150 132 VAL A N 1000 C CA . VAL A 132 ? 0.2280 0.2148 0.2724 0.0095 0.0165 0.0151 132 VAL A CA 1001 C C . VAL A 132 ? 0.3161 0.3095 0.3680 0.0097 0.0193 0.0213 132 VAL A C 1002 O O . VAL A 132 ? 0.3146 0.3019 0.3717 0.0037 0.0217 0.0260 132 VAL A O 1003 C CB . VAL A 132 ? 0.2106 0.1999 0.2589 -0.0011 0.0127 0.0157 132 VAL A CB 1004 C CG1 . VAL A 132 ? 0.1741 0.1773 0.2213 -0.0044 0.0124 0.0165 132 VAL A CG1 1005 C CG2 . VAL A 132 ? 0.1879 0.1661 0.2257 -0.0015 0.0092 0.0093 132 VAL A CG2 1006 N N . VAL A 133 ? 0.2841 0.2922 0.3383 0.0158 0.0199 0.0189 133 VAL A N 1007 C CA . VAL A 133 ? 0.1774 0.1891 0.2354 0.0184 0.0213 0.0231 133 VAL A CA 1008 C C . VAL A 133 ? 0.2447 0.2723 0.3137 0.0119 0.0207 0.0245 133 VAL A C 1009 O O . VAL A 133 ? 0.2645 0.3025 0.3339 0.0078 0.0205 0.0207 133 VAL A O 1010 C CB . VAL A 133 ? 0.1629 0.1743 0.2137 0.0327 0.0187 0.0181 133 VAL A CB 1011 C CG1 . VAL A 133 ? 0.1488 0.1641 0.2008 0.0359 0.0190 0.0212 133 VAL A CG1 1012 C CG2 . VAL A 133 ? 0.1923 0.1745 0.2227 0.0411 0.0161 0.0185 133 VAL A CG2 1013 N N . CYS A 134 ? 0.2116 0.2384 0.2870 0.0099 0.0210 0.0289 134 CYS A N 1014 C CA . CYS A 134 ? 0.1957 0.2309 0.2784 0.0070 0.0176 0.0295 134 CYS A CA 1015 C C . CYS A 134 ? 0.2522 0.2920 0.3368 0.0137 0.0193 0.0293 134 CYS A C 1016 O O . CYS A 134 ? 0.2290 0.2637 0.3118 0.0165 0.0238 0.0309 134 CYS A O 1017 C CB . CYS A 134 ? 0.2412 0.2743 0.3331 0.0024 0.0129 0.0302 134 CYS A CB 1018 S SG . CYS A 134 ? 0.3982 0.4298 0.4909 0.0014 0.0027 0.0301 134 CYS A SG 1019 N N . LEU A 135 ? 0.2011 0.2490 0.2868 0.0144 0.0167 0.0263 135 LEU A N 1020 C CA . LEU A 135 ? 0.2331 0.2853 0.3196 0.0216 0.0158 0.0241 135 LEU A CA 1021 C C . LEU A 135 ? 0.2334 0.2861 0.3261 0.0183 0.0113 0.0242 135 LEU A C 1022 O O . LEU A 135 ? 0.2502 0.2999 0.3421 0.0101 0.0074 0.0242 135 LEU A O 1023 C CB . LEU A 135 ? 0.1080 0.1717 0.1955 0.0263 0.0141 0.0163 135 LEU A CB 1024 C CG . LEU A 135 ? 0.2789 0.3493 0.3688 0.0335 0.0097 0.0109 135 LEU A CG 1025 C CD1 . LEU A 135 ? 0.2120 0.2691 0.2866 0.0462 0.0093 0.0134 135 LEU A CD1 1026 C CD2 . LEU A 135 ? 0.3217 0.4119 0.4221 0.0352 0.0069 -0.0017 135 LEU A CD2 1027 N N . LEU A 136 ? 0.1564 0.2088 0.2510 0.0245 0.0121 0.0237 136 LEU A N 1028 C CA . LEU A 136 ? 0.1983 0.2506 0.2985 0.0259 0.0060 0.0208 136 LEU A CA 1029 C C . LEU A 136 ? 0.2397 0.2956 0.3352 0.0333 0.0057 0.0165 136 LEU A C 1030 O O . LEU A 136 ? 0.1929 0.2480 0.2804 0.0408 0.0110 0.0161 136 LEU A O 1031 C CB . LEU A 136 ? 0.1071 0.1623 0.2173 0.0289 0.0074 0.0184 136 LEU A CB 1032 C CG . LEU A 136 ? 0.2038 0.2585 0.3245 0.0248 0.0028 0.0179 136 LEU A CG 1033 C CD1 . LEU A 136 ? 0.1047 0.1575 0.2217 0.0182 0.0085 0.0224 136 LEU A CD1 1034 C CD2 . LEU A 136 ? 0.1441 0.2122 0.2833 0.0297 0.0046 0.0089 136 LEU A CD2 1035 N N . ASN A 137 ? 0.2339 0.2911 0.3310 0.0300 -0.0005 0.0127 137 ASN A N 1036 C CA . ASN A 137 ? 0.1950 0.2590 0.2903 0.0371 -0.0032 0.0058 137 ASN A CA 1037 C C . ASN A 137 ? 0.1748 0.2347 0.2710 0.0403 -0.0098 0.0007 137 ASN A C 1038 O O . ASN A 137 ? 0.1534 0.2039 0.2524 0.0327 -0.0154 0.0008 137 ASN A O 1039 C CB . ASN A 137 ? 0.1125 0.1887 0.2149 0.0307 -0.0043 -0.0003 137 ASN A CB 1040 C CG . ASN A 137 ? 0.1327 0.2202 0.2353 0.0434 -0.0088 -0.0098 137 ASN A CG 1041 O OD1 . ASN A 137 ? 0.1739 0.2530 0.2618 0.0568 -0.0090 -0.0073 137 ASN A OD1 1042 N ND2 . ASN A 137 ? 0.1170 0.2211 0.2340 0.0388 -0.0134 -0.0220 137 ASN A ND2 1043 N N . ASN A 138 ? 0.1820 0.2430 0.2701 0.0526 -0.0104 -0.0036 138 ASN A N 1044 C CA . ASN A 138 ? 0.1682 0.2267 0.2550 0.0583 -0.0177 -0.0115 138 ASN A CA 1045 C C . ASN A 138 ? 0.2097 0.2598 0.3019 0.0571 -0.0207 -0.0120 138 ASN A C 1046 O O . ASN A 138 ? 0.2072 0.2474 0.3029 0.0512 -0.0300 -0.0150 138 ASN A O 1047 C CB . ASN A 138 ? 0.1407 0.2056 0.2361 0.0525 -0.0262 -0.0199 138 ASN A CB 1048 C CG . ASN A 138 ? 0.1978 0.2764 0.2931 0.0594 -0.0279 -0.0258 138 ASN A CG 1049 O OD1 . ASN A 138 ? 0.2533 0.3273 0.3332 0.0712 -0.0252 -0.0223 138 ASN A OD1 1050 N ND2 . ASN A 138 ? 0.2842 0.3778 0.3957 0.0520 -0.0331 -0.0366 138 ASN A ND2 1051 N N . PHE A 139 ? 0.1900 0.2428 0.2820 0.0629 -0.0132 -0.0111 139 PHE A N 1052 C CA . PHE A 139 ? 0.1982 0.2488 0.3005 0.0665 -0.0179 -0.0166 139 PHE A CA 1053 C C . PHE A 139 ? 0.1943 0.2544 0.2948 0.0777 -0.0105 -0.0259 139 PHE A C 1054 O O . PHE A 139 ? 0.1939 0.2572 0.2789 0.0799 0.0009 -0.0245 139 PHE A O 1055 C CB . PHE A 139 ? 0.1377 0.1903 0.2513 0.0610 -0.0164 -0.0119 139 PHE A CB 1056 C CG . PHE A 139 ? 0.2279 0.2932 0.3427 0.0586 -0.0006 -0.0083 139 PHE A CG 1057 C CD1 . PHE A 139 ? 0.2523 0.3145 0.3572 0.0519 0.0052 0.0010 139 PHE A CD1 1058 C CD2 . PHE A 139 ? 0.1329 0.2129 0.2590 0.0619 0.0090 -0.0162 139 PHE A CD2 1059 C CE1 . PHE A 139 ? 0.2508 0.3158 0.3513 0.0485 0.0185 0.0048 139 PHE A CE1 1060 C CE2 . PHE A 139 ? 0.1605 0.2478 0.2847 0.0548 0.0256 -0.0130 139 PHE A CE2 1061 C CZ . PHE A 139 ? 0.1877 0.2633 0.2963 0.0480 0.0295 -0.0012 139 PHE A CZ 1062 N N . TYR A 140 ? 0.1619 0.2237 0.2749 0.0852 -0.0178 -0.0365 140 TYR A N 1063 C CA . TYR A 140 ? 0.1724 0.2488 0.2885 0.0955 -0.0093 -0.0499 140 TYR A CA 1064 C C . TYR A 140 ? 0.1750 0.2587 0.3158 0.1038 -0.0194 -0.0629 140 TYR A C 1065 O O . TYR A 140 ? 0.3319 0.3953 0.4735 0.1073 -0.0398 -0.0637 140 TYR A O 1066 C CB . TYR A 140 ? 0.2627 0.3308 0.3614 0.1042 -0.0140 -0.0568 140 TYR A CB 1067 C CG . TYR A 140 ? 0.3214 0.4047 0.4175 0.1139 -0.0015 -0.0712 140 TYR A CG 1068 C CD1 . TYR A 140 ? 0.2693 0.3568 0.3425 0.1105 0.0192 -0.0681 140 TYR A CD1 1069 C CD2 . TYR A 140 ? 0.2140 0.3045 0.3270 0.1262 -0.0099 -0.0889 140 TYR A CD2 1070 C CE1 . TYR A 140 ? 0.2755 0.3761 0.3413 0.1155 0.0352 -0.0818 140 TYR A CE1 1071 C CE2 . TYR A 140 ? 0.2784 0.3879 0.3910 0.1336 0.0045 -0.1049 140 TYR A CE2 1072 C CZ . TYR A 140 ? 0.3102 0.4264 0.3991 0.1272 0.0291 -0.1016 140 TYR A CZ 1073 O OH . TYR A 140 ? 0.2643 0.3989 0.3483 0.1317 0.0475 -0.1186 140 TYR A OH 1074 N N . PRO A 141 ? 0.2310 0.3423 0.3907 0.1071 -0.0059 -0.0753 141 PRO A N 1075 C CA . PRO A 141 ? 0.2372 0.3665 0.3887 0.1000 0.0211 -0.0761 141 PRO A CA 1076 C C . PRO A 141 ? 0.1935 0.3254 0.3458 0.0846 0.0335 -0.0632 141 PRO A C 1077 O O . PRO A 141 ? 0.2059 0.3278 0.3647 0.0807 0.0209 -0.0537 141 PRO A O 1078 C CB . PRO A 141 ? 0.1894 0.3456 0.3633 0.1052 0.0284 -0.0969 141 PRO A CB 1079 C CG . PRO A 141 ? 0.1856 0.3385 0.3809 0.1072 0.0066 -0.0993 141 PRO A CG 1080 C CD . PRO A 141 ? 0.1830 0.3012 0.3624 0.1108 -0.0165 -0.0868 141 PRO A CD 1081 N N . ARG A 142 ? 0.2215 0.3637 0.3639 0.0748 0.0586 -0.0638 142 ARG A N 1082 C CA . ARG A 142 ? 0.2056 0.3396 0.3364 0.0591 0.0717 -0.0497 142 ARG A CA 1083 C C . ARG A 142 ? 0.1879 0.3402 0.3539 0.0518 0.0697 -0.0535 142 ARG A C 1084 O O . ARG A 142 ? 0.1939 0.3329 0.3533 0.0429 0.0683 -0.0401 142 ARG A O 1085 C CB . ARG A 142 ? 0.3151 0.4465 0.4180 0.0484 0.0998 -0.0501 142 ARG A CB 1086 C CG . ARG A 142 ? 0.3737 0.4763 0.4426 0.0354 0.1095 -0.0315 142 ARG A CG 1087 C CD . ARG A 142 ? 0.4456 0.5380 0.4801 0.0215 0.1390 -0.0324 142 ARG A CD 1088 N NE . ARG A 142 ? 0.5944 0.6467 0.5850 0.0109 0.1457 -0.0142 142 ARG A NE 1089 C CZ . ARG A 142 ? 0.7014 0.7508 0.6976 -0.0075 0.1584 -0.0100 142 ARG A CZ 1090 N NH1 . ARG A 142 ? 0.6511 0.7406 0.6991 -0.0174 0.1654 -0.0240 142 ARG A NH1 1091 N NH2 . ARG A 142 ? 0.8006 0.8053 0.7504 -0.0144 0.1614 0.0064 142 ARG A NH2 1092 N N . GLU A 143 ? 0.1714 0.3550 0.3759 0.0573 0.0677 -0.0742 143 GLU A N 1093 C CA . GLU A 143 ? 0.1484 0.3454 0.3805 0.0513 0.0606 -0.0785 143 GLU A CA 1094 C C . GLU A 143 ? 0.1600 0.3372 0.3933 0.0570 0.0359 -0.0676 143 GLU A C 1095 O O . GLU A 143 ? 0.2290 0.3884 0.4544 0.0694 0.0149 -0.0657 143 GLU A O 1096 C CB . GLU A 143 ? 0.1606 0.3797 0.4167 0.0580 0.0533 -0.0990 143 GLU A CB 1097 C CG . GLU A 143 ? 0.3360 0.5594 0.6157 0.0620 0.0311 -0.1066 143 GLU A CG 1098 C CD . GLU A 143 ? 0.3707 0.6084 0.6661 0.0457 0.0420 -0.1073 143 GLU A CD 1099 O OE1 . GLU A 143 ? 0.4071 0.6432 0.7163 0.0496 0.0227 -0.1112 143 GLU A OE1 1100 O OE2 . GLU A 143 ? 0.3746 0.6207 0.6643 0.0284 0.0689 -0.1044 143 GLU A OE2 1101 N N . ALA A 144 ? 0.1216 0.2974 0.3596 0.0455 0.0393 -0.0598 144 ALA A N 1102 C CA . ALA A 144 ? 0.2229 0.3787 0.4567 0.0475 0.0181 -0.0497 144 ALA A CA 1103 C C . ALA A 144 ? 0.2180 0.3863 0.4707 0.0364 0.0223 -0.0525 144 ALA A C 1104 O O . ALA A 144 ? 0.3005 0.4823 0.5579 0.0223 0.0447 -0.0549 144 ALA A O 1105 C CB . ALA A 144 ? 0.1132 0.2368 0.3095 0.0439 0.0165 -0.0286 144 ALA A CB 1106 N N . LYS A 145 ? 0.1614 0.3205 0.4196 0.0415 0.0004 -0.0523 145 LYS A N 1107 C CA . LYS A 145 ? 0.1654 0.3316 0.4370 0.0322 -0.0001 -0.0548 145 LYS A CA 1108 C C . LYS A 145 ? 0.1699 0.3034 0.4110 0.0284 -0.0090 -0.0358 145 LYS A C 1109 O O . LYS A 145 ? 0.1895 0.2981 0.4085 0.0361 -0.0253 -0.0276 145 LYS A O 1110 C CB . LYS A 145 ? 0.2563 0.4321 0.5455 0.0413 -0.0200 -0.0726 145 LYS A CB 1111 C CG . LYS A 145 ? 0.3206 0.5259 0.6322 0.0412 -0.0100 -0.0927 145 LYS A CG 1112 C CD . LYS A 145 ? 0.3932 0.6192 0.7152 0.0206 0.0192 -0.0948 145 LYS A CD 1113 C CE . LYS A 145 ? 0.3975 0.6544 0.7428 0.0180 0.0302 -0.1168 145 LYS A CE 1114 N NZ . LYS A 145 ? 0.4236 0.6946 0.7956 0.0292 0.0077 -0.1382 145 LYS A NZ 1115 N N . VAL A 146 ? 0.1637 0.2946 0.3999 0.0150 0.0031 -0.0294 146 VAL A N 1116 C CA . VAL A 146 ? 0.1475 0.2522 0.3578 0.0120 -0.0048 -0.0158 146 VAL A CA 1117 C C . VAL A 146 ? 0.1652 0.2778 0.3935 0.0072 -0.0120 -0.0245 146 VAL A C 1118 O O . VAL A 146 ? 0.1425 0.2730 0.3913 -0.0037 0.0020 -0.0323 146 VAL A O 1119 C CB . VAL A 146 ? 0.1612 0.2499 0.3443 0.0040 0.0119 -0.0011 146 VAL A CB 1120 C CG1 . VAL A 146 ? 0.2138 0.2830 0.3770 0.0008 0.0055 0.0076 146 VAL A CG1 1121 C CG2 . VAL A 146 ? 0.1955 0.2769 0.3616 0.0105 0.0142 0.0052 146 VAL A CG2 1122 N N . GLN A 147 ? 0.1666 0.2631 0.3844 0.0142 -0.0341 -0.0240 147 GLN A N 1123 C CA . GLN A 147 ? 0.1688 0.2688 0.3987 0.0117 -0.0450 -0.0326 147 GLN A CA 1124 C C . GLN A 147 ? 0.2756 0.3459 0.4693 0.0066 -0.0473 -0.0186 147 GLN A C 1125 O O . GLN A 147 ? 0.2444 0.2890 0.4050 0.0104 -0.0551 -0.0078 147 GLN A O 1126 C CB . GLN A 147 ? 0.2742 0.3791 0.5204 0.0271 -0.0730 -0.0483 147 GLN A CB 1127 C CG . GLN A 147 ? 0.4102 0.5186 0.6688 0.0273 -0.0892 -0.0599 147 GLN A CG 1128 C CD . GLN A 147 ? 0.4641 0.5703 0.7306 0.0465 -0.1205 -0.0767 147 GLN A CD 1129 O OE1 . GLN A 147 ? 0.4060 0.4737 0.6346 0.0570 -0.1446 -0.0693 147 GLN A OE1 1130 N NE2 . GLN A 147 ? 0.4556 0.5915 0.7544 0.0492 -0.1154 -0.0974 147 GLN A NE2 1131 N N . TRP A 148 ? 0.1387 0.2124 0.3382 -0.0037 -0.0390 -0.0203 148 TRP A N 1132 C CA . TRP A 148 ? 0.1490 0.1982 0.3172 -0.0076 -0.0401 -0.0107 148 TRP A CA 1133 C C . TRP A 148 ? 0.1672 0.2106 0.3361 -0.0043 -0.0615 -0.0203 148 TRP A C 1134 O O . TRP A 148 ? 0.1675 0.2322 0.3708 -0.0039 -0.0697 -0.0366 148 TRP A O 1135 C CB . TRP A 148 ? 0.1453 0.1928 0.3115 -0.0188 -0.0202 -0.0064 148 TRP A CB 1136 C CG . TRP A 148 ? 0.1838 0.2247 0.3333 -0.0187 -0.0042 0.0050 148 TRP A CG 1137 C CD1 . TRP A 148 ? 0.2169 0.2661 0.3751 -0.0222 0.0110 0.0058 148 TRP A CD1 1138 C CD2 . TRP A 148 ? 0.2293 0.2549 0.3501 -0.0147 -0.0025 0.0149 148 TRP A CD2 1139 N NE1 . TRP A 148 ? 0.2311 0.2677 0.3655 -0.0178 0.0183 0.0161 148 TRP A NE1 1140 C CE2 . TRP A 148 ? 0.2717 0.2978 0.3878 -0.0131 0.0103 0.0202 148 TRP A CE2 1141 C CE3 . TRP A 148 ? 0.2571 0.2700 0.3552 -0.0130 -0.0096 0.0177 148 TRP A CE3 1142 C CZ2 . TRP A 148 ? 0.2773 0.2965 0.3741 -0.0080 0.0133 0.0258 148 TRP A CZ2 1143 C CZ3 . TRP A 148 ? 0.2315 0.2404 0.3118 -0.0111 -0.0022 0.0229 148 TRP A CZ3 1144 C CH2 . TRP A 148 ? 0.2645 0.2789 0.3478 -0.0077 0.0079 0.0258 148 TRP A CH2 1145 N N . LYS A 149 ? 0.2874 0.3028 0.4177 -0.0025 -0.0700 -0.0122 149 LYS A N 1146 C CA . LYS A 149 ? 0.2726 0.2741 0.3913 0.0012 -0.0912 -0.0198 149 LYS A CA 1147 C C . LYS A 149 ? 0.2524 0.2305 0.3326 -0.0046 -0.0852 -0.0112 149 LYS A C 1148 O O . LYS A 149 ? 0.3077 0.2712 0.3574 -0.0071 -0.0752 0.0005 149 LYS A O 1149 C CB . LYS A 149 ? 0.2780 0.2605 0.3785 0.0144 -0.1174 -0.0222 149 LYS A CB 1150 C CG . LYS A 149 ? 0.3393 0.3477 0.4839 0.0255 -0.1345 -0.0410 149 LYS A CG 1151 C CD . LYS A 149 ? 0.4114 0.3908 0.5305 0.0427 -0.1687 -0.0460 149 LYS A CD 1152 C CE . LYS A 149 ? 0.4657 0.4760 0.6341 0.0582 -0.1872 -0.0686 149 LYS A CE 1153 N NZ . LYS A 149 ? 0.5849 0.5547 0.7162 0.0763 -0.2142 -0.0725 149 LYS A NZ 1154 N N . VAL A 150 ? 0.2604 0.2376 0.3448 -0.0073 -0.0912 -0.0199 150 VAL A N 1155 C CA . VAL A 150 ? 0.3305 0.2863 0.3789 -0.0108 -0.0878 -0.0158 150 VAL A CA 1156 C C . VAL A 150 ? 0.3631 0.2990 0.3896 -0.0046 -0.1139 -0.0241 150 VAL A C 1157 O O . VAL A 150 ? 0.3254 0.2738 0.3811 -0.0019 -0.1293 -0.0388 150 VAL A O 1158 C CB . VAL A 150 ? 0.2920 0.2565 0.3573 -0.0186 -0.0729 -0.0192 150 VAL A CB 1159 C CG1 . VAL A 150 ? 0.2638 0.2086 0.2937 -0.0193 -0.0696 -0.0179 150 VAL A CG1 1160 C CG2 . VAL A 150 ? 0.2172 0.1947 0.2986 -0.0222 -0.0516 -0.0116 150 VAL A CG2 1161 N N . ASP A 151 ? 0.4032 0.5355 0.3406 -0.1555 -0.0594 0.0436 151 ASP A N 1162 C CA . ASP A 151 ? 0.4056 0.5255 0.3090 -0.1673 -0.0747 0.0555 151 ASP A CA 1163 C C . ASP A 151 ? 0.4087 0.4748 0.3065 -0.1404 -0.1019 0.0591 151 ASP A C 1164 O O . ASP A 151 ? 0.4036 0.4783 0.3092 -0.1247 -0.1074 0.0525 151 ASP A O 1165 C CB . ASP A 151 ? 0.4126 0.5908 0.3360 -0.1646 -0.0588 0.0403 151 ASP A CB 1166 C CG . ASP A 151 ? 0.4416 0.6821 0.3655 -0.1908 -0.0388 0.0304 151 ASP A CG 1167 O OD1 . ASP A 151 ? 0.4540 0.6962 0.3449 -0.2255 -0.0388 0.0421 151 ASP A OD1 1168 O OD2 . ASP A 151 ? 0.3915 0.6821 0.3482 -0.1770 -0.0254 0.0079 151 ASP A OD2 1169 N N . ASN A 152 ? 0.4529 0.4708 0.3439 -0.1306 -0.1192 0.0639 152 ASN A N 1170 C CA . ASN A 152 ? 0.5588 0.5291 0.4474 -0.0999 -0.1507 0.0593 152 ASN A CA 1171 C C . ASN A 152 ? 0.4827 0.4920 0.4233 -0.0634 -0.1406 0.0330 152 ASN A C 1172 O O . ASN A 152 ? 0.5284 0.5172 0.4731 -0.0355 -0.1659 0.0210 152 ASN A O 1173 C CB . ASN A 152 ? 0.6600 0.5808 0.4974 -0.1083 -0.1855 0.0746 152 ASN A CB 1174 C CG . ASN A 152 ? 0.9147 0.7535 0.6952 -0.1252 -0.2230 0.0959 152 ASN A CG 1175 O OD1 . ASN A 152 ? 0.9182 0.7448 0.6966 -0.1372 -0.2179 0.1015 152 ASN A OD1 1176 N ND2 . ASN A 152 ? 1.0923 0.8681 0.8223 -0.1268 -0.2651 0.1081 152 ASN A ND2 1177 N N . ALA A 153 ? 0.3461 0.4109 0.3237 -0.0641 -0.1081 0.0214 153 ALA A N 1178 C CA . ALA A 153 ? 0.3032 0.4027 0.3230 -0.0397 -0.0983 -0.0008 153 ALA A CA 1179 C C . ALA A 153 ? 0.3467 0.4466 0.3869 -0.0313 -0.0914 -0.0093 153 ALA A C 1180 O O . ALA A 153 ? 0.3152 0.4155 0.3551 -0.0461 -0.0763 -0.0023 153 ALA A O 1181 C CB . ALA A 153 ? 0.2615 0.4071 0.3016 -0.0475 -0.0742 -0.0074 153 ALA A CB 1182 N N . LEU A 154 ? 0.3104 0.4164 0.3693 -0.0069 -0.1032 -0.0277 154 LEU A N 1183 C CA . LEU A 154 ? 0.3420 0.4597 0.4221 0.0007 -0.0954 -0.0394 154 LEU A CA 1184 C C . LEU A 154 ? 0.2786 0.4338 0.3788 -0.0142 -0.0649 -0.0421 154 LEU A C 1185 O O . LEU A 154 ? 0.2122 0.4004 0.3255 -0.0170 -0.0553 -0.0504 154 LEU A O 1186 C CB . LEU A 154 ? 0.2729 0.4101 0.3734 0.0296 -0.1132 -0.0669 154 LEU A CB 1187 C CG . LEU A 154 ? 0.2827 0.4452 0.4061 0.0366 -0.1044 -0.0839 154 LEU A CG 1188 C CD1 . LEU A 154 ? 0.2790 0.3925 0.3848 0.0360 -0.1147 -0.0709 154 LEU A CD1 1189 C CD2 . LEU A 154 ? 0.3009 0.5066 0.4502 0.0644 -0.1195 -0.1200 154 LEU A CD2 1190 N N . GLN A 155 ? 0.2707 0.4151 0.3693 -0.0245 -0.0537 -0.0351 155 GLN A N 1191 C CA . GLN A 155 ? 0.2397 0.4062 0.3508 -0.0363 -0.0333 -0.0388 155 GLN A CA 1192 C C . GLN A 155 ? 0.2359 0.4254 0.3634 -0.0309 -0.0297 -0.0544 155 GLN A C 1193 O O . GLN A 155 ? 0.2773 0.4579 0.4072 -0.0199 -0.0372 -0.0594 155 GLN A O 1194 C CB . GLN A 155 ? 0.1736 0.3210 0.2753 -0.0484 -0.0255 -0.0279 155 GLN A CB 1195 C CG . GLN A 155 ? 0.2428 0.3862 0.3298 -0.0590 -0.0257 -0.0180 155 GLN A CG 1196 C CD . GLN A 155 ? 0.1716 0.3385 0.2633 -0.0613 -0.0219 -0.0231 155 GLN A CD 1197 O OE1 . GLN A 155 ? 0.1564 0.3341 0.2560 -0.0649 -0.0150 -0.0302 155 GLN A OE1 1198 N NE2 . GLN A 155 ? 0.1862 0.3551 0.2700 -0.0585 -0.0307 -0.0198 155 GLN A NE2 1199 N N . SER A 156 ? 0.1992 0.4203 0.3352 -0.0416 -0.0194 -0.0630 156 SER A N 1200 C CA . SER A 156 ? 0.2222 0.4763 0.3688 -0.0461 -0.0133 -0.0784 156 SER A CA 1201 C C . SER A 156 ? 0.2526 0.5112 0.3892 -0.0735 -0.0011 -0.0743 156 SER A C 1202 O O . SER A 156 ? 0.2388 0.5022 0.3698 -0.0868 0.0003 -0.0719 156 SER A O 1203 C CB . SER A 156 ? 0.1532 0.4560 0.3176 -0.0343 -0.0195 -0.1016 156 SER A CB 1204 O OG . SER A 156 ? 0.1507 0.4995 0.3242 -0.0438 -0.0108 -0.1200 156 SER A OG 1205 N N . GLY A 157 ? 0.2260 0.4776 0.3562 -0.0828 0.0039 -0.0733 157 GLY A N 1206 C CA . GLY A 157 ? 0.1739 0.4177 0.2834 -0.1109 0.0092 -0.0680 157 GLY A CA 1207 C C . GLY A 157 ? 0.1724 0.3643 0.2644 -0.1170 0.0036 -0.0533 157 GLY A C 1208 O O . GLY A 157 ? 0.2406 0.4083 0.3080 -0.1372 0.0001 -0.0476 157 GLY A O 1209 N N . ASN A 158 ? 0.1872 0.3581 0.2861 -0.0978 -0.0002 -0.0481 158 ASN A N 1210 C CA . ASN A 158 ? 0.2571 0.3914 0.3445 -0.0975 -0.0069 -0.0426 158 ASN A CA 1211 C C . ASN A 158 ? 0.3131 0.4302 0.4033 -0.0869 -0.0059 -0.0404 158 ASN A C 1212 O O . ASN A 158 ? 0.3659 0.4697 0.4557 -0.0803 -0.0100 -0.0412 158 ASN A O 1213 C CB . ASN A 158 ? 0.1611 0.2977 0.2526 -0.0902 -0.0115 -0.0433 158 ASN A CB 1214 C CG . ASN A 158 ? 0.2448 0.4007 0.3491 -0.0773 -0.0076 -0.0414 158 ASN A CG 1215 O OD1 . ASN A 158 ? 0.2586 0.4223 0.3691 -0.0708 -0.0056 -0.0412 158 ASN A OD1 1216 N ND2 . ASN A 158 ? 0.2077 0.3692 0.3125 -0.0736 -0.0104 -0.0414 158 ASN A ND2 1217 N N . SER A 159 ? 0.2294 0.3538 0.3238 -0.0853 -0.0008 -0.0413 159 SER A N 1218 C CA . SER A 159 ? 0.2559 0.3624 0.3516 -0.0773 -0.0007 -0.0393 159 SER A CA 1219 C C . SER A 159 ? 0.2072 0.3112 0.2955 -0.0857 0.0017 -0.0418 159 SER A C 1220 O O . SER A 159 ? 0.1676 0.2966 0.2536 -0.0971 0.0056 -0.0468 159 SER A O 1221 C CB . SER A 159 ? 0.1493 0.2611 0.2560 -0.0634 -0.0015 -0.0374 159 SER A CB 1222 O OG . SER A 159 ? 0.1507 0.2837 0.2663 -0.0563 -0.0028 -0.0450 159 SER A OG 1223 N N . GLN A 160 ? 0.1838 0.2637 0.2677 -0.0823 -0.0003 -0.0402 160 GLN A N 1224 C CA . GLN A 160 ? 0.1740 0.2497 0.2490 -0.0896 0.0013 -0.0420 160 GLN A CA 1225 C C . GLN A 160 ? 0.2686 0.3364 0.3546 -0.0746 0.0022 -0.0430 160 GLN A C 1226 O O . GLN A 160 ? 0.1596 0.2130 0.2509 -0.0658 -0.0004 -0.0405 160 GLN A O 1227 C CB . GLN A 160 ? 0.2002 0.2415 0.2475 -0.1057 -0.0083 -0.0387 160 GLN A CB 1228 C CG . GLN A 160 ? 0.4169 0.4593 0.4443 -0.1282 -0.0128 -0.0359 160 GLN A CG 1229 C CD . GLN A 160 ? 0.4717 0.4627 0.4606 -0.1463 -0.0316 -0.0307 160 GLN A CD 1230 O OE1 . GLN A 160 ? 0.5057 0.4586 0.4898 -0.1324 -0.0476 -0.0339 160 GLN A OE1 1231 N NE2 . GLN A 160 ? 0.4526 0.4437 0.4122 -0.1676 -0.0308 -0.0231 160 GLN A NE2 1232 N N . GLU A 161 ? 0.1897 0.2727 0.2787 -0.0739 0.0056 -0.0488 161 GLU A N 1233 C CA . GLU A 161 ? 0.2111 0.2849 0.3095 -0.0597 0.0039 -0.0510 161 GLU A CA 1234 C C . GLU A 161 ? 0.2640 0.3233 0.3495 -0.0672 0.0045 -0.0519 161 GLU A C 1235 O O . GLU A 161 ? 0.2021 0.2726 0.2718 -0.0845 0.0071 -0.0539 161 GLU A O 1236 C CB . GLU A 161 ? 0.2359 0.3390 0.3507 -0.0458 0.0016 -0.0627 161 GLU A CB 1237 C CG . GLU A 161 ? 0.4345 0.5414 0.5585 -0.0343 -0.0057 -0.0623 161 GLU A CG 1238 C CD . GLU A 161 ? 0.4972 0.6204 0.6355 -0.0129 -0.0182 -0.0781 161 GLU A CD 1239 O OE1 . GLU A 161 ? 0.4764 0.6160 0.6214 -0.0064 -0.0187 -0.0918 161 GLU A OE1 1240 O OE2 . GLU A 161 ? 0.5164 0.6347 0.6578 -0.0011 -0.0309 -0.0791 161 GLU A OE2 1241 N N . SER A 162 ? 0.2680 0.3030 0.3566 -0.0575 0.0012 -0.0502 162 SER A N 1242 C CA . SER A 162 ? 0.2204 0.2428 0.3003 -0.0593 0.0004 -0.0530 162 SER A CA 1243 C C . SER A 162 ? 0.2292 0.2524 0.3261 -0.0426 -0.0012 -0.0574 162 SER A C 1244 O O . SER A 162 ? 0.3099 0.3239 0.4165 -0.0345 -0.0050 -0.0535 162 SER A O 1245 C CB . SER A 162 ? 0.2819 0.2689 0.3471 -0.0624 -0.0072 -0.0503 162 SER A CB 1246 O OG . SER A 162 ? 0.3389 0.3084 0.3881 -0.0670 -0.0110 -0.0521 162 SER A OG 1247 N N . VAL A 163 ? 0.1749 0.2082 0.2715 -0.0405 -0.0003 -0.0654 163 VAL A N 1248 C CA . VAL A 163 ? 0.2115 0.2414 0.3223 -0.0232 -0.0060 -0.0720 163 VAL A CA 1249 C C . VAL A 163 ? 0.2575 0.2717 0.3602 -0.0247 -0.0057 -0.0738 163 VAL A C 1250 O O . VAL A 163 ? 0.2476 0.2701 0.3337 -0.0381 -0.0015 -0.0758 163 VAL A O 1251 C CB . VAL A 163 ? 0.2102 0.2789 0.3351 -0.0110 -0.0094 -0.0891 163 VAL A CB 1252 C CG1 . VAL A 163 ? 0.2369 0.2918 0.3741 0.0104 -0.0229 -0.0976 163 VAL A CG1 1253 C CG2 . VAL A 163 ? 0.2059 0.2910 0.3381 -0.0073 -0.0126 -0.0904 163 VAL A CG2 1254 N N . THR A 164 ? 0.2602 0.2029 0.1921 -0.0233 0.0243 -0.0411 164 THR A N 1255 C CA . THR A 164 ? 0.3277 0.2452 0.2274 -0.0126 0.0137 -0.0418 164 THR A CA 1256 C C . THR A 164 ? 0.3844 0.3008 0.2709 -0.0209 0.0254 -0.0454 164 THR A C 1257 O O . THR A 164 ? 0.3325 0.2773 0.2468 -0.0319 0.0399 -0.0496 164 THR A O 1258 C CB . THR A 164 ? 0.2912 0.2317 0.2214 0.0051 -0.0034 -0.0465 164 THR A CB 1259 O OG1 . THR A 164 ? 0.2769 0.2559 0.2515 0.0015 0.0022 -0.0501 164 THR A OG1 1260 C CG2 . THR A 164 ? 0.2779 0.2239 0.2216 0.0144 -0.0127 -0.0455 164 THR A CG2 1261 N N . GLU A 165 ? 0.4656 0.3470 0.3058 -0.0140 0.0183 -0.0453 165 GLU A N 1262 C CA . GLU A 165 ? 0.3672 0.2491 0.1935 -0.0168 0.0263 -0.0510 165 GLU A CA 1263 C C . GLU A 165 ? 0.3255 0.2435 0.1976 -0.0043 0.0138 -0.0598 165 GLU A C 1264 O O . GLU A 165 ? 0.3458 0.2833 0.2533 0.0051 0.0002 -0.0601 165 GLU A O 1265 C CB . GLU A 165 ? 0.4372 0.2645 0.1918 -0.0113 0.0201 -0.0480 165 GLU A CB 1266 C CG . GLU A 165 ? 0.5718 0.3543 0.2729 -0.0281 0.0359 -0.0379 165 GLU A CG 1267 C CD . GLU A 165 ? 0.6721 0.4725 0.3800 -0.0533 0.0680 -0.0401 165 GLU A CD 1268 O OE1 . GLU A 165 ? 0.6558 0.4846 0.3813 -0.0532 0.0764 -0.0497 165 GLU A OE1 1269 O OE2 . GLU A 165 ? 0.7995 0.5875 0.4983 -0.0731 0.0844 -0.0344 165 GLU A OE2 1270 N N . GLN A 166 ? 0.3307 0.2572 0.2021 -0.0052 0.0197 -0.0679 166 GLN A N 1271 C CA . GLN A 166 ? 0.3298 0.2858 0.2444 0.0047 0.0075 -0.0767 166 GLN A CA 1272 C C . GLN A 166 ? 0.3397 0.2855 0.2519 0.0212 -0.0177 -0.0797 166 GLN A C 1273 O O . GLN A 166 ? 0.3856 0.2965 0.2497 0.0302 -0.0284 -0.0803 166 GLN A O 1274 C CB . GLN A 166 ? 0.3989 0.3618 0.3094 0.0032 0.0162 -0.0873 166 GLN A CB 1275 C CG . GLN A 166 ? 0.3838 0.3846 0.3447 -0.0023 0.0258 -0.0928 166 GLN A CG 1276 C CD . GLN A 166 ? 0.4254 0.4338 0.3830 -0.0004 0.0328 -0.1067 166 GLN A CD 1277 O OE1 . GLN A 166 ? 0.4227 0.4130 0.3364 -0.0043 0.0454 -0.1101 166 GLN A OE1 1278 N NE2 . GLN A 166 ? 0.3556 0.3873 0.3560 0.0057 0.0249 -0.1150 166 GLN A NE2 1279 N N . ASP A 167 ? 0.3080 0.2838 0.2717 0.0252 -0.0274 -0.0824 167 ASP A N 1280 C CA . ASP A 167 ? 0.2662 0.2432 0.2412 0.0388 -0.0500 -0.0892 167 ASP A CA 1281 C C . ASP A 167 ? 0.3419 0.3079 0.3010 0.0474 -0.0626 -0.1015 167 ASP A C 1282 O O . ASP A 167 ? 0.2921 0.2666 0.2604 0.0425 -0.0550 -0.1065 167 ASP A O 1283 C CB . ASP A 167 ? 0.2301 0.2435 0.2653 0.0360 -0.0521 -0.0897 167 ASP A CB 1284 C CG . ASP A 167 ? 0.2989 0.3228 0.3567 0.0473 -0.0731 -0.1004 167 ASP A CG 1285 O OD1 . ASP A 167 ? 0.2289 0.2515 0.2832 0.0558 -0.0814 -0.1006 167 ASP A OD1 1286 O OD2 . ASP A 167 ? 0.3178 0.3517 0.3982 0.0483 -0.0825 -0.1109 167 ASP A OD2 1287 N N . SER A 168 ? 0.4099 0.3556 0.3437 0.0627 -0.0842 -0.1085 168 SER A N 1288 C CA . SER A 168 ? 0.4553 0.3840 0.3631 0.0731 -0.0988 -0.1212 168 SER A CA 1289 C C . SER A 168 ? 0.4477 0.4080 0.4127 0.0746 -0.1119 -0.1351 168 SER A C 1290 O O . SER A 168 ? 0.3570 0.3086 0.3102 0.0811 -0.1224 -0.1475 168 SER A O 1291 C CB . SER A 168 ? 0.4673 0.3578 0.3223 0.0918 -0.1216 -0.1252 168 SER A CB 1292 O OG . SER A 168 ? 0.5415 0.4535 0.4379 0.1044 -0.1457 -0.1358 168 SER A OG 1293 N N . LYS A 169 ? 0.3066 0.3010 0.3307 0.0675 -0.1103 -0.1331 169 LYS A N 1294 C CA . LYS A 169 ? 0.3234 0.3444 0.4021 0.0647 -0.1209 -0.1450 169 LYS A CA 1295 C C . LYS A 169 ? 0.2385 0.2729 0.3462 0.0495 -0.1037 -0.1393 169 LYS A C 1296 O O . LYS A 169 ? 0.4141 0.4465 0.5313 0.0493 -0.1098 -0.1494 169 LYS A O 1297 C CB . LYS A 169 ? 0.3676 0.4170 0.4934 0.0657 -0.1309 -0.1496 169 LYS A CB 1298 C CG . LYS A 169 ? 0.4966 0.5383 0.6079 0.0858 -0.1582 -0.1645 169 LYS A CG 1299 C CD . LYS A 169 ? 0.6381 0.7107 0.7960 0.0869 -0.1589 -0.1675 169 LYS A CD 1300 C CE . LYS A 169 ? 0.7786 0.8332 0.9069 0.1100 -0.1783 -0.1753 169 LYS A CE 1301 N NZ . LYS A 169 ? 0.8439 0.9247 1.0073 0.1103 -0.1730 -0.1782 169 LYS A NZ 1302 N N . ASP A 170 ? 0.2654 0.3104 0.3845 0.0390 -0.0846 -0.1245 170 ASP A N 1303 C CA . ASP A 170 ? 0.2494 0.3044 0.3952 0.0274 -0.0718 -0.1190 170 ASP A CA 1304 C C . ASP A 170 ? 0.2361 0.2831 0.3564 0.0247 -0.0547 -0.1123 170 ASP A C 1305 O O . ASP A 170 ? 0.1838 0.2380 0.3242 0.0187 -0.0468 -0.1090 170 ASP A O 1306 C CB . ASP A 170 ? 0.2341 0.3099 0.4196 0.0171 -0.0651 -0.1096 170 ASP A CB 1307 C CG . ASP A 170 ? 0.3330 0.4124 0.5049 0.0166 -0.0535 -0.0974 170 ASP A CG 1308 O OD1 . ASP A 170 ? 0.3231 0.3884 0.4595 0.0194 -0.0464 -0.0929 170 ASP A OD1 1309 O OD2 . ASP A 170 ? 0.4220 0.5186 0.6194 0.0121 -0.0504 -0.0930 170 ASP A OD2 1310 N N . SER A 171 ? 0.2361 0.2673 0.3127 0.0287 -0.0492 -0.1107 171 SER A N 1311 C CA . SER A 171 ? 0.2415 0.2688 0.2955 0.0238 -0.0307 -0.1079 171 SER A CA 1312 C C . SER A 171 ? 0.2101 0.2521 0.2819 0.0144 -0.0160 -0.0969 171 SER A C 1313 O O . SER A 171 ? 0.3382 0.3864 0.4074 0.0098 -0.0024 -0.0985 171 SER A O 1314 C CB . SER A 171 ? 0.2245 0.2541 0.2827 0.0264 -0.0298 -0.1205 171 SER A CB 1315 O OG . SER A 171 ? 0.2684 0.2800 0.2966 0.0357 -0.0408 -0.1319 171 SER A OG 1316 N N . THR A 172 ? 0.1872 0.2370 0.2780 0.0125 -0.0192 -0.0881 172 THR A N 1317 C CA . THR A 172 ? 0.2264 0.2876 0.3304 0.0057 -0.0081 -0.0787 172 THR A CA 1318 C C . THR A 172 ? 0.2511 0.3015 0.3263 0.0029 -0.0004 -0.0722 172 THR A C 1319 O O . THR A 172 ? 0.2105 0.2413 0.2548 0.0071 -0.0054 -0.0725 172 THR A O 1320 C CB . THR A 172 ? 0.2307 0.3043 0.3656 0.0042 -0.0126 -0.0720 172 THR A CB 1321 O OG1 . THR A 172 ? 0.2416 0.3139 0.3717 0.0082 -0.0192 -0.0710 172 THR A OG1 1322 C CG2 . THR A 172 ? 0.1228 0.2001 0.2848 0.0035 -0.0200 -0.0766 172 THR A CG2 1323 N N . TYR A 173 ? 0.1437 0.2032 0.2272 -0.0036 0.0097 -0.0671 173 TYR A N 1324 C CA . TYR A 173 ? 0.2050 0.2537 0.2669 -0.0078 0.0155 -0.0610 173 TYR A CA 1325 C C . TYR A 173 ? 0.2006 0.2590 0.2810 -0.0053 0.0112 -0.0541 173 TYR A C 1326 O O . TYR A 173 ? 0.2086 0.2826 0.3168 -0.0040 0.0087 -0.0527 173 TYR A O 1327 C CB . TYR A 173 ? 0.1556 0.2099 0.2153 -0.0183 0.0302 -0.0634 173 TYR A CB 1328 C CG . TYR A 173 ? 0.2571 0.3075 0.3003 -0.0227 0.0400 -0.0720 173 TYR A CG 1329 C CD1 . TYR A 173 ? 0.2472 0.3169 0.3140 -0.0195 0.0408 -0.0821 173 TYR A CD1 1330 C CD2 . TYR A 173 ? 0.2696 0.2936 0.2693 -0.0298 0.0489 -0.0704 173 TYR A CD2 1331 C CE1 . TYR A 173 ? 0.2559 0.3255 0.3076 -0.0224 0.0515 -0.0925 173 TYR A CE1 1332 C CE2 . TYR A 173 ? 0.3214 0.3415 0.3009 -0.0352 0.0616 -0.0784 173 TYR A CE2 1333 C CZ . TYR A 173 ? 0.3425 0.3890 0.3503 -0.0311 0.0635 -0.0904 173 TYR A CZ 1334 O OH . TYR A 173 ? 0.4155 0.4615 0.4036 -0.0352 0.0777 -0.1007 173 TYR A OH 1335 N N . SER A 174 ? 0.2089 0.2541 0.2696 -0.0047 0.0109 -0.0499 174 SER A N 1336 C CA . SER A 174 ? 0.2176 0.2721 0.2908 -0.0028 0.0104 -0.0451 174 SER A CA 1337 C C . SER A 174 ? 0.2235 0.2654 0.2777 -0.0093 0.0166 -0.0432 174 SER A C 1338 O O . SER A 174 ? 0.2794 0.2993 0.3055 -0.0150 0.0204 -0.0439 174 SER A O 1339 C CB . SER A 174 ? 0.1328 0.1881 0.2083 0.0075 0.0007 -0.0457 174 SER A CB 1340 O OG . SER A 174 ? 0.1178 0.1920 0.2222 0.0092 -0.0027 -0.0482 174 SER A OG 1341 N N . LEU A 175 ? 0.2572 0.3101 0.3239 -0.0097 0.0180 -0.0409 175 LEU A N 1342 C CA . LEU A 175 ? 0.1796 0.2227 0.2340 -0.0170 0.0223 -0.0415 175 LEU A CA 1343 C C . LEU A 175 ? 0.2451 0.2864 0.2966 -0.0099 0.0171 -0.0394 175 LEU A C 1344 O O . LEU A 175 ? 0.2214 0.2795 0.2886 -0.0025 0.0150 -0.0373 175 LEU A O 1345 C CB . LEU A 175 ? 0.1547 0.2165 0.2300 -0.0250 0.0283 -0.0464 175 LEU A CB 1346 C CG . LEU A 175 ? 0.2505 0.3107 0.3245 -0.0351 0.0324 -0.0511 175 LEU A CG 1347 C CD1 . LEU A 175 ? 0.1330 0.2136 0.2286 -0.0447 0.0403 -0.0611 175 LEU A CD1 1348 C CD2 . LEU A 175 ? 0.1302 0.1968 0.2113 -0.0279 0.0248 -0.0503 175 LEU A CD2 1349 N N . SER A 176 ? 0.2367 0.2552 0.2652 -0.0129 0.0161 -0.0401 176 SER A N 1350 C CA . SER A 176 ? 0.2037 0.2187 0.2273 -0.0057 0.0107 -0.0408 176 SER A CA 1351 C C . SER A 176 ? 0.3219 0.3318 0.3441 -0.0165 0.0130 -0.0446 176 SER A C 1352 O O . SER A 176 ? 0.3544 0.3453 0.3632 -0.0302 0.0179 -0.0463 176 SER A O 1353 C CB . SER A 176 ? 0.2344 0.2230 0.2319 0.0045 0.0023 -0.0412 176 SER A CB 1354 O OG . SER A 176 ? 0.3703 0.3213 0.3363 -0.0047 0.0021 -0.0408 176 SER A OG 1355 N N . SER A 177 ? 0.3243 0.3506 0.3593 -0.0113 0.0099 -0.0467 177 SER A N 1356 C CA . SER A 177 ? 0.3187 0.3406 0.3534 -0.0183 0.0074 -0.0535 177 SER A CA 1357 C C . SER A 177 ? 0.3484 0.3559 0.3651 -0.0070 -0.0008 -0.0553 177 SER A C 1358 O O . SER A 177 ? 0.3508 0.3719 0.3692 0.0067 -0.0032 -0.0538 177 SER A O 1359 C CB . SER A 177 ? 0.2859 0.3351 0.3463 -0.0189 0.0063 -0.0579 177 SER A CB 1360 O OG . SER A 177 ? 0.2422 0.2909 0.3084 -0.0270 0.0023 -0.0681 177 SER A OG 1361 N N . THR A 178 ? 0.2231 0.2006 0.2197 -0.0134 -0.0041 -0.0590 178 THR A N 1362 C CA . THR A 178 ? 0.2870 0.2462 0.2642 -0.0015 -0.0138 -0.0634 178 THR A CA 1363 C C . THR A 178 ? 0.3109 0.2653 0.2904 -0.0089 -0.0196 -0.0731 178 THR A C 1364 O O . THR A 178 ? 0.3625 0.3027 0.3436 -0.0281 -0.0172 -0.0771 178 THR A O 1365 C CB . THR A 178 ? 0.3475 0.2664 0.2940 0.0014 -0.0185 -0.0620 178 THR A CB 1366 O OG1 . THR A 178 ? 0.3183 0.2422 0.2646 0.0079 -0.0158 -0.0556 178 THR A OG1 1367 C CG2 . THR A 178 ? 0.3005 0.2047 0.2295 0.0199 -0.0301 -0.0687 178 THR A CG2 1368 N N . LEU A 179 ? 0.3009 0.2676 0.2801 0.0056 -0.0268 -0.0778 179 LEU A N 1369 C CA . LEU A 179 ? 0.3228 0.2851 0.3026 0.0027 -0.0365 -0.0895 179 LEU A CA 1370 C C . LEU A 179 ? 0.3791 0.3093 0.3306 0.0127 -0.0463 -0.0957 179 LEU A C 1371 O O . LEU A 179 ? 0.4394 0.3706 0.3765 0.0322 -0.0473 -0.0941 179 LEU A O 1372 C CB . LEU A 179 ? 0.2579 0.2484 0.2470 0.0149 -0.0407 -0.0914 179 LEU A CB 1373 C CG . LEU A 179 ? 0.2780 0.2663 0.2628 0.0198 -0.0551 -0.1050 179 LEU A CG 1374 C CD1 . LEU A 179 ? 0.2785 0.2742 0.2909 0.0010 -0.0601 -0.1166 179 LEU A CD1 1375 C CD2 . LEU A 179 ? 0.2734 0.2797 0.2498 0.0379 -0.0579 -0.1019 179 LEU A CD2 1376 N N . THR A 180 ? 0.3377 0.2400 0.2828 -0.0008 -0.0531 -0.1044 180 THR A N 1377 C CA . THR A 180 ? 0.3785 0.2410 0.2935 0.0080 -0.0644 -0.1110 180 THR A CA 1378 C C . THR A 180 ? 0.4016 0.2566 0.3150 0.0086 -0.0785 -0.1268 180 THR A C 1379 O O . THR A 180 ? 0.4547 0.3123 0.3875 -0.0117 -0.0802 -0.1344 180 THR A O 1380 C CB . THR A 180 ? 0.4673 0.2832 0.3614 -0.0073 -0.0625 -0.1059 180 THR A CB 1381 O OG1 . THR A 180 ? 0.5325 0.3535 0.4231 -0.0025 -0.0535 -0.0933 180 THR A OG1 1382 C CG2 . THR A 180 ? 0.4619 0.2298 0.3210 0.0055 -0.0778 -0.1133 180 THR A CG2 1383 N N . LEU A 181 ? 0.4187 0.2665 0.3104 0.0327 -0.0886 -0.1339 181 LEU A N 1384 C CA . LEU A 181 ? 0.4499 0.2919 0.3343 0.0400 -0.1040 -0.1502 181 LEU A CA 1385 C C . LEU A 181 ? 0.5386 0.3435 0.3916 0.0561 -0.1144 -0.1571 181 LEU A C 1386 O O . LEU A 181 ? 0.5835 0.3820 0.4222 0.0711 -0.1103 -0.1512 181 LEU A O 1387 C CB . LEU A 181 ? 0.5334 0.4122 0.4179 0.0601 -0.1036 -0.1511 181 LEU A CB 1388 C CG . LEU A 181 ? 0.6722 0.5899 0.5803 0.0554 -0.0950 -0.1422 181 LEU A CG 1389 C CD1 . LEU A 181 ? 0.7457 0.6820 0.6342 0.0791 -0.0918 -0.1391 181 LEU A CD1 1390 C CD2 . LEU A 181 ? 0.7577 0.6839 0.6882 0.0420 -0.1066 -0.1540 181 LEU A CD2 1391 N N . SER A 182 ? 0.5614 0.3506 0.4106 0.0534 -0.1260 -0.1665 182 SER A N 1392 C CA . SER A 182 ? 0.5751 0.3395 0.4004 0.0711 -0.1350 -0.1705 182 SER A CA 1393 C C . SER A 182 ? 0.5675 0.3635 0.3839 0.1006 -0.1325 -0.1720 182 SER A C 1394 O O . SER A 182 ? 0.5407 0.3698 0.3650 0.1042 -0.1275 -0.1717 182 SER A O 1395 C CB . SER A 182 ? 0.6081 0.3523 0.4339 0.0609 -0.1481 -0.1819 182 SER A CB 1396 O OG . SER A 182 ? 0.5824 0.3573 0.4187 0.0676 -0.1537 -0.1904 182 SER A OG 1397 N N . LYS A 183 ? 0.5814 0.3677 0.3810 0.1212 -0.1351 -0.1734 183 LYS A N 1398 C CA . LYS A 183 ? 0.5798 0.3978 0.3722 0.1464 -0.1298 -0.1765 183 LYS A CA 1399 C C . LYS A 183 ? 0.6091 0.4364 0.3949 0.1510 -0.1365 -0.1846 183 LYS A C 1400 O O . LYS A 183 ? 0.6528 0.5100 0.4330 0.1626 -0.1276 -0.1832 183 LYS A O 1401 C CB . LYS A 183 ? 0.5865 0.3938 0.3663 0.1674 -0.1350 -0.1814 183 LYS A CB 1402 C CG . LYS A 183 ? 0.6101 0.4553 0.3860 0.1903 -0.1253 -0.1857 183 LYS A CG 1403 C CD . LYS A 183 ? 0.6992 0.5342 0.4638 0.2116 -0.1352 -0.1961 183 LYS A CD 1404 C CE . LYS A 183 ? 0.8029 0.6785 0.5648 0.2312 -0.1227 -0.2023 183 LYS A CE 1405 N NZ . LYS A 183 ? 0.9440 0.8126 0.6960 0.2532 -0.1339 -0.2160 183 LYS A NZ 1406 N N . ALA A 184 ? 0.6014 0.4011 0.3860 0.1409 -0.1519 -0.1927 184 ALA A N 1407 C CA . ALA A 184 ? 0.7088 0.5142 0.4872 0.1470 -0.1623 -0.2024 184 ALA A CA 1408 C C . ALA A 184 ? 0.7394 0.5726 0.5300 0.1393 -0.1583 -0.1989 184 ALA A C 1409 O O . ALA A 184 ? 0.5974 0.4492 0.3735 0.1550 -0.1570 -0.1995 184 ALA A O 1410 C CB . ALA A 184 ? 0.6589 0.4305 0.4394 0.1347 -0.1797 -0.2130 184 ALA A CB 1411 N N . ASP A 185 ? 0.7439 0.5781 0.5591 0.1156 -0.1561 -0.1951 185 ASP A N 1412 C CA . ASP A 185 ? 0.7045 0.5662 0.5361 0.1086 -0.1543 -0.1925 185 ASP A CA 1413 C C . ASP A 185 ? 0.6053 0.4920 0.4240 0.1232 -0.1391 -0.1812 185 ASP A C 1414 O O . ASP A 185 ? 0.6263 0.5296 0.4360 0.1324 -0.1404 -0.1797 185 ASP A O 1415 C CB . ASP A 185 ? 0.7752 0.6372 0.6398 0.0796 -0.1522 -0.1915 185 ASP A CB 1416 C CG . ASP A 185 ? 0.8222 0.6702 0.7059 0.0604 -0.1649 -0.2040 185 ASP A CG 1417 O OD1 . ASP A 185 ? 0.9088 0.7521 0.7831 0.0716 -0.1788 -0.2143 185 ASP A OD1 1418 O OD2 . ASP A 185 ? 0.7171 0.5595 0.6253 0.0330 -0.1597 -0.2039 185 ASP A OD2 1419 N N . TYR A 186 ? 0.5665 0.4539 0.3829 0.1254 -0.1251 -0.1732 186 TYR A N 1420 C CA . TYR A 186 ? 0.4929 0.4060 0.3013 0.1360 -0.1075 -0.1629 186 TYR A CA 1421 C C . TYR A 186 ? 0.5447 0.4686 0.3255 0.1562 -0.1034 -0.1632 186 TYR A C 1422 O O . TYR A 186 ? 0.5942 0.5350 0.3636 0.1601 -0.0941 -0.1553 186 TYR A O 1423 C CB . TYR A 186 ? 0.4871 0.4004 0.3012 0.1376 -0.0953 -0.1576 186 TYR A CB 1424 C CG . TYR A 186 ? 0.4599 0.4044 0.2727 0.1465 -0.0747 -0.1483 186 TYR A CG 1425 C CD1 . TYR A 186 ? 0.4354 0.3993 0.2660 0.1337 -0.0636 -0.1344 186 TYR A CD1 1426 C CD2 . TYR A 186 ? 0.4556 0.4141 0.2590 0.1628 -0.0642 -0.1495 186 TYR A CD2 1427 C CE1 . TYR A 186 ? 0.3913 0.3828 0.2258 0.1369 -0.0432 -0.1229 186 TYR A CE1 1428 C CE2 . TYR A 186 ? 0.4592 0.4494 0.2674 0.1661 -0.0425 -0.1413 186 TYR A CE2 1429 C CZ . TYR A 186 ? 0.4850 0.4895 0.3047 0.1543 -0.0319 -0.1295 186 TYR A CZ 1430 O OH . TYR A 186 ? 0.4610 0.4956 0.2891 0.1536 -0.0091 -0.1197 186 TYR A OH 1431 N N . GLU A 187 ? 0.5671 0.4781 0.3341 0.1686 -0.1099 -0.1720 187 GLU A N 1432 C CA . GLU A 187 ? 0.6125 0.5321 0.3510 0.1872 -0.1048 -0.1740 187 GLU A CA 1433 C C . GLU A 187 ? 0.6089 0.5231 0.3301 0.1904 -0.1171 -0.1765 187 GLU A C 1434 O O . GLU A 187 ? 0.6508 0.5706 0.3425 0.2034 -0.1100 -0.1740 187 GLU A O 1435 C CB . GLU A 187 ? 0.6173 0.5259 0.3465 0.2015 -0.1099 -0.1850 187 GLU A CB 1436 C CG . GLU A 187 ? 0.6683 0.5851 0.4112 0.2051 -0.0993 -0.1840 187 GLU A CG 1437 C CD . GLU A 187 ? 0.7350 0.6874 0.4785 0.2101 -0.0737 -0.1763 187 GLU A CD 1438 O OE1 . GLU A 187 ? 0.7368 0.7027 0.4618 0.2119 -0.0620 -0.1708 187 GLU A OE1 1439 O OE2 . GLU A 187 ? 0.7166 0.6818 0.4789 0.2115 -0.0655 -0.1757 187 GLU A OE2 1440 N N . LYS A 188 ? 0.5833 0.4867 0.3232 0.1782 -0.1352 -0.1820 188 LYS A N 1441 C CA . LYS A 188 ? 0.6792 0.5793 0.4089 0.1828 -0.1509 -0.1868 188 LYS A CA 1442 C C . LYS A 188 ? 0.6675 0.5813 0.3947 0.1803 -0.1461 -0.1756 188 LYS A C 1443 O O . LYS A 188 ? 0.7541 0.6645 0.4754 0.1851 -0.1612 -0.1791 188 LYS A O 1444 C CB . LYS A 188 ? 0.7190 0.6064 0.4758 0.1707 -0.1731 -0.2007 188 LYS A CB 1445 C CG . LYS A 188 ? 0.8346 0.7015 0.5799 0.1796 -0.1856 -0.2140 188 LYS A CG 1446 C CD . LYS A 188 ? 0.8787 0.7302 0.6552 0.1595 -0.1994 -0.2247 188 LYS A CD 1447 C CE . LYS A 188 ? 0.8959 0.7215 0.6589 0.1667 -0.2069 -0.2342 188 LYS A CE 1448 N NZ . LYS A 188 ? 0.7905 0.5935 0.5774 0.1431 -0.2131 -0.2395 188 LYS A NZ 1449 N N . HIS A 189 ? 0.6315 0.5592 0.3629 0.1742 -0.1266 -0.1626 189 HIS A N 1450 C CA . HIS A 189 ? 0.6453 0.5827 0.3751 0.1707 -0.1230 -0.1513 189 HIS A CA 1451 C C . HIS A 189 ? 0.6268 0.5745 0.3339 0.1740 -0.0965 -0.1350 189 HIS A C 1452 O O . HIS A 189 ? 0.6507 0.6066 0.3587 0.1753 -0.0793 -0.1338 189 HIS A O 1453 C CB . HIS A 189 ? 0.6238 0.5705 0.3968 0.1519 -0.1297 -0.1537 189 HIS A CB 1454 C CG . HIS A 189 ? 0.7189 0.6610 0.5214 0.1432 -0.1518 -0.1694 189 HIS A CG 1455 N ND1 . HIS A 189 ? 0.7202 0.6550 0.5485 0.1285 -0.1543 -0.1782 189 HIS A ND1 1456 C CD2 . HIS A 189 ? 0.6980 0.6414 0.5093 0.1463 -0.1713 -0.1779 189 HIS A CD2 1457 C CE1 . HIS A 189 ? 0.6713 0.6058 0.5246 0.1200 -0.1716 -0.1910 189 HIS A CE1 1458 N NE2 . HIS A 189 ? 0.6907 0.6335 0.5375 0.1317 -0.1828 -0.1923 189 HIS A NE2 1459 N N . LYS A 190 ? 0.6026 0.5497 0.2919 0.1749 -0.0935 -0.1227 190 LYS A N 1460 C CA . LYS A 190 ? 0.6142 0.5670 0.2771 0.1757 -0.0664 -0.1054 190 LYS A CA 1461 C C . LYS A 190 ? 0.5920 0.5572 0.2773 0.1620 -0.0544 -0.0906 190 LYS A C 1462 O O . LYS A 190 ? 0.6582 0.6410 0.3611 0.1532 -0.0302 -0.0816 190 LYS A O 1463 C CB . LYS A 190 ? 0.6902 0.6228 0.3030 0.1868 -0.0666 -0.0975 190 LYS A CB 1464 C CG . LYS A 190 ? 0.8128 0.7462 0.3953 0.1825 -0.0362 -0.0777 190 LYS A CG 1465 C CD . LYS A 190 ? 0.9233 0.8279 0.4498 0.1915 -0.0376 -0.0690 190 LYS A CD 1466 C CE . LYS A 190 ? 0.9442 0.8435 0.4415 0.1809 -0.0075 -0.0467 190 LYS A CE 1467 N NZ . LYS A 190 ? 1.0091 0.8736 0.4461 0.1876 -0.0082 -0.0366 190 LYS A NZ 1468 N N . VAL A 191 ? 0.5402 0.4992 0.2380 0.1578 -0.0712 -0.0871 191 VAL A N 1469 C CA . VAL A 191 ? 0.4811 0.4483 0.2043 0.1438 -0.0602 -0.0698 191 VAL A CA 1470 C C . VAL A 191 ? 0.4912 0.4773 0.2755 0.1280 -0.0646 -0.0748 191 VAL A C 1471 O O . VAL A 191 ? 0.4166 0.4038 0.2235 0.1267 -0.0860 -0.0880 191 VAL A O 1472 C CB . VAL A 191 ? 0.5149 0.4605 0.2095 0.1515 -0.0750 -0.0618 191 VAL A CB 1473 C CG1 . VAL A 191 ? 0.4890 0.4391 0.2078 0.1381 -0.0639 -0.0449 191 VAL A CG1 1474 C CG2 . VAL A 191 ? 0.5816 0.5004 0.2045 0.1660 -0.0686 -0.0541 191 VAL A CG2 1475 N N . TYR A 192 ? 0.3958 0.3974 0.2061 0.1157 -0.0438 -0.0653 192 TYR A N 1476 C CA . TYR A 192 ? 0.3451 0.3606 0.2043 0.1007 -0.0445 -0.0679 192 TYR A CA 1477 C C . TYR A 192 ? 0.4039 0.4271 0.2836 0.0903 -0.0356 -0.0535 192 TYR A C 1478 O O . TYR A 192 ? 0.3188 0.3469 0.1948 0.0866 -0.0168 -0.0411 192 TYR A O 1479 C CB . TYR A 192 ? 0.3563 0.3787 0.2272 0.0978 -0.0335 -0.0721 192 TYR A CB 1480 C CG . TYR A 192 ? 0.3852 0.3952 0.2403 0.1072 -0.0464 -0.0888 192 TYR A CG 1481 C CD1 . TYR A 192 ? 0.3914 0.3944 0.2072 0.1237 -0.0452 -0.0937 192 TYR A CD1 1482 C CD2 . TYR A 192 ? 0.3440 0.3465 0.2206 0.0986 -0.0592 -0.1002 192 TYR A CD2 1483 C CE1 . TYR A 192 ? 0.4621 0.4512 0.2622 0.1338 -0.0592 -0.1109 192 TYR A CE1 1484 C CE2 . TYR A 192 ? 0.4643 0.4502 0.3258 0.1059 -0.0726 -0.1161 192 TYR A CE2 1485 C CZ . TYR A 192 ? 0.4608 0.4403 0.2849 0.1248 -0.0740 -0.1221 192 TYR A CZ 1486 O OH . TYR A 192 ? 0.4626 0.4234 0.2706 0.1335 -0.0893 -0.1399 192 TYR A OH 1487 N N . ALA A 193 ? 0.3528 0.3787 0.2565 0.0856 -0.0494 -0.0576 193 ALA A N 1488 C CA . ALA A 193 ? 0.3350 0.3653 0.2559 0.0787 -0.0444 -0.0465 193 ALA A CA 1489 C C . ALA A 193 ? 0.2865 0.3334 0.2530 0.0651 -0.0445 -0.0522 193 ALA A C 1490 O O . ALA A 193 ? 0.2437 0.2978 0.2311 0.0612 -0.0558 -0.0666 193 ALA A O 1491 C CB . ALA A 193 ? 0.3228 0.3372 0.2214 0.0901 -0.0596 -0.0439 193 ALA A CB 1492 N N . CYS A 194 ? 0.2422 0.2950 0.2227 0.0567 -0.0305 -0.0413 194 CYS A N 1493 C CA . CYS A 194 ? 0.2185 0.2841 0.2342 0.0451 -0.0283 -0.0444 194 CYS A CA 1494 C C . CYS A 194 ? 0.2871 0.3516 0.3100 0.0473 -0.0328 -0.0394 194 CYS A C 1495 O O . CYS A 194 ? 0.3346 0.3886 0.3420 0.0487 -0.0253 -0.0258 194 CYS A O 1496 C CB . CYS A 194 ? 0.2542 0.3241 0.2766 0.0373 -0.0123 -0.0376 194 CYS A CB 1497 S SG . CYS A 194 ? 0.4492 0.5291 0.5031 0.0248 -0.0077 -0.0386 194 CYS A SG 1498 N N . GLU A 195 ? 0.2220 0.2969 0.2689 0.0474 -0.0450 -0.0516 195 GLU A N 1499 C CA . GLU A 195 ? 0.2557 0.3295 0.3127 0.0523 -0.0522 -0.0504 195 GLU A CA 1500 C C . GLU A 195 ? 0.2938 0.3861 0.3866 0.0412 -0.0445 -0.0559 195 GLU A C 1501 O O . GLU A 195 ? 0.2118 0.3225 0.3292 0.0325 -0.0427 -0.0691 195 GLU A O 1502 C CB . GLU A 195 ? 0.3497 0.4226 0.4062 0.0669 -0.0754 -0.0632 195 GLU A CB 1503 C CG . GLU A 195 ? 0.3920 0.4510 0.4437 0.0785 -0.0870 -0.0594 195 GLU A CG 1504 C CD . GLU A 195 ? 0.4802 0.5488 0.5485 0.0939 -0.1131 -0.0795 195 GLU A CD 1505 O OE1 . GLU A 195 ? 0.4457 0.5473 0.5606 0.0883 -0.1142 -0.0982 195 GLU A OE1 1506 O OE2 . GLU A 195 ? 0.5571 0.6007 0.5913 0.1119 -0.1323 -0.0780 195 GLU A OE2 1507 N N . VAL A 196 ? 0.2702 0.3549 0.3632 0.0406 -0.0393 -0.0460 196 VAL A N 1508 C CA . VAL A 196 ? 0.2006 0.2987 0.3196 0.0312 -0.0305 -0.0496 196 VAL A CA 1509 C C . VAL A 196 ? 0.2429 0.3426 0.3778 0.0392 -0.0412 -0.0564 196 VAL A C 1510 O O . VAL A 196 ? 0.2611 0.3388 0.3788 0.0485 -0.0494 -0.0475 196 VAL A O 1511 C CB . VAL A 196 ? 0.2220 0.3121 0.3323 0.0232 -0.0160 -0.0358 196 VAL A CB 1512 C CG1 . VAL A 196 ? 0.1159 0.2140 0.2469 0.0170 -0.0109 -0.0395 196 VAL A CG1 1513 C CG2 . VAL A 196 ? 0.1464 0.2384 0.2467 0.0177 -0.0073 -0.0341 196 VAL A CG2 1514 N N . THR A 197 ? 0.1995 0.3238 0.3655 0.0356 -0.0406 -0.0730 197 THR A N 1515 C CA . THR A 197 ? 0.1329 0.2650 0.3199 0.0449 -0.0504 -0.0846 197 THR A CA 1516 C C . THR A 197 ? 0.1423 0.2840 0.3440 0.0350 -0.0364 -0.0867 197 THR A C 1517 O O . THR A 197 ? 0.2250 0.3809 0.4336 0.0212 -0.0218 -0.0904 197 THR A O 1518 C CB . THR A 197 ? 0.1960 0.3564 0.4123 0.0507 -0.0615 -0.1083 197 THR A CB 1519 O OG1 . THR A 197 ? 0.1980 0.3472 0.3985 0.0639 -0.0798 -0.1085 197 THR A OG1 1520 C CG2 . THR A 197 ? 0.1591 0.3218 0.3877 0.0584 -0.0669 -0.1205 197 THR A CG2 1521 N N . HIS A 198 ? 0.1237 0.2523 0.3251 0.0422 -0.0417 -0.0841 198 HIS A N 1522 C CA . HIS A 198 ? 0.1587 0.2939 0.3709 0.0353 -0.0311 -0.0876 198 HIS A CA 1523 C C . HIS A 198 ? 0.1629 0.2886 0.3835 0.0485 -0.0436 -0.0942 198 HIS A C 1524 O O . HIS A 198 ? 0.1843 0.2834 0.3901 0.0596 -0.0584 -0.0863 198 HIS A O 1525 C CB . HIS A 198 ? 0.1183 0.2371 0.3109 0.0241 -0.0194 -0.0703 198 HIS A CB 1526 C CG . HIS A 198 ? 0.1889 0.3120 0.3875 0.0179 -0.0107 -0.0747 198 HIS A CG 1527 N ND1 . HIS A 198 ? 0.1260 0.2352 0.3260 0.0220 -0.0160 -0.0733 198 HIS A ND1 1528 C CD2 . HIS A 198 ? 0.0892 0.2242 0.2875 0.0082 0.0021 -0.0803 198 HIS A CD2 1529 C CE1 . HIS A 198 ? 0.1396 0.2552 0.3417 0.0168 -0.0081 -0.0796 198 HIS A CE1 1530 N NE2 . HIS A 198 ? 0.0976 0.2273 0.2957 0.0086 0.0034 -0.0830 198 HIS A NE2 1531 N N . GLN A 199 ? 0.1531 0.2914 0.3859 0.0460 -0.0370 -0.1067 199 GLN A N 1532 C CA . GLN A 199 ? 0.2550 0.3838 0.4946 0.0589 -0.0490 -0.1160 199 GLN A CA 1533 C C . GLN A 199 ? 0.2723 0.3649 0.4985 0.0636 -0.0588 -0.1007 199 GLN A C 1534 O O . GLN A 199 ? 0.3051 0.3760 0.5297 0.0779 -0.0758 -0.1043 199 GLN A O 1535 C CB . GLN A 199 ? 0.2857 0.4296 0.5307 0.0520 -0.0363 -0.1289 199 GLN A CB 1536 C CG . GLN A 199 ? 0.3099 0.4466 0.5621 0.0650 -0.0481 -0.1416 199 GLN A CG 1537 C CD . GLN A 199 ? 0.3817 0.5366 0.6379 0.0588 -0.0347 -0.1555 199 GLN A CD 1538 O OE1 . GLN A 199 ? 0.3796 0.5539 0.6336 0.0454 -0.0171 -0.1581 199 GLN A OE1 1539 N NE2 . GLN A 199 ? 0.3534 0.4988 0.6128 0.0688 -0.0437 -0.1645 199 GLN A NE2 1540 N N . GLY A 200 ? 0.1928 0.2729 0.4022 0.0488 -0.0473 -0.0826 200 GLY A N 1541 C CA . GLY A 200 ? 0.1903 0.2356 0.3837 0.0451 -0.0511 -0.0668 200 GLY A CA 1542 C C . GLY A 200 ? 0.2652 0.2817 0.4338 0.0464 -0.0570 -0.0494 200 GLY A C 1543 O O . GLY A 200 ? 0.3650 0.3512 0.5184 0.0395 -0.0565 -0.0350 200 GLY A O 1544 N N . LEU A 201 ? 0.2948 0.3198 0.4578 0.0541 -0.0618 -0.0515 201 LEU A N 1545 C CA . LEU A 201 ? 0.3098 0.3048 0.4414 0.0582 -0.0687 -0.0362 201 LEU A CA 1546 C C . LEU A 201 ? 0.3614 0.3390 0.4864 0.0803 -0.0931 -0.0456 201 LEU A C 1547 O O . LEU A 201 ? 0.4324 0.4407 0.5832 0.0917 -0.1016 -0.0666 201 LEU A O 1548 C CB . LEU A 201 ? 0.2289 0.2421 0.3527 0.0524 -0.0586 -0.0317 201 LEU A CB 1549 C CG . LEU A 201 ? 0.1838 0.2111 0.3102 0.0349 -0.0380 -0.0233 201 LEU A CG 1550 C CD1 . LEU A 201 ? 0.1682 0.2144 0.2902 0.0328 -0.0316 -0.0244 201 LEU A CD1 1551 C CD2 . LEU A 201 ? 0.2069 0.2070 0.3136 0.0252 -0.0303 -0.0049 201 LEU A CD2 1552 N N . SER A 202 ? 0.3104 0.2382 0.4010 0.0862 -0.1046 -0.0314 202 SER A N 1553 C CA . SER A 202 ? 0.3528 0.2556 0.4296 0.1111 -0.1326 -0.0398 202 SER A CA 1554 C C . SER A 202 ? 0.3606 0.2714 0.4228 0.1218 -0.1415 -0.0422 202 SER A C 1555 O O . SER A 202 ? 0.5205 0.4349 0.5891 0.1447 -0.1658 -0.0596 202 SER A O 1556 C CB . SER A 202 ? 0.4167 0.2524 0.4523 0.1145 -0.1442 -0.0226 202 SER A CB 1557 O OG . SER A 202 ? 0.6331 0.4386 0.6305 0.0958 -0.1271 0.0040 202 SER A OG 1558 N N . SER A 203 ? 0.3488 0.2646 0.3939 0.1066 -0.1233 -0.0276 203 SER A N 1559 C CA . SER A 203 ? 0.4017 0.3258 0.4320 0.1150 -0.1303 -0.0304 203 SER A CA 1560 C C . SER A 203 ? 0.3653 0.3285 0.4137 0.0964 -0.1065 -0.0299 203 SER A C 1561 O O . SER A 203 ? 0.3572 0.3251 0.4107 0.0780 -0.0851 -0.0192 203 SER A O 1562 C CB . SER A 203 ? 0.4596 0.3277 0.4263 0.1201 -0.1362 -0.0085 203 SER A CB 1563 O OG . SER A 203 ? 0.4761 0.2941 0.4149 0.1360 -0.1583 -0.0046 203 SER A OG 1564 N N . PRO A 204 ? 0.3476 0.3371 0.4060 0.1020 -0.1124 -0.0431 204 PRO A N 1565 C CA . PRO A 204 ? 0.3030 0.3190 0.3702 0.0857 -0.0922 -0.0412 204 PRO A CA 1566 C C . PRO A 204 ? 0.3273 0.3161 0.3537 0.0769 -0.0773 -0.0180 204 PRO A C 1567 O O . PRO A 204 ? 0.4209 0.3723 0.4049 0.0855 -0.0853 -0.0059 204 PRO A O 1568 C CB . PRO A 204 ? 0.2766 0.3121 0.3518 0.0958 -0.1068 -0.0584 204 PRO A CB 1569 C CG . PRO A 204 ? 0.2825 0.3237 0.3786 0.1146 -0.1314 -0.0775 204 PRO A CG 1570 C CD . PRO A 204 ? 0.3211 0.3174 0.3860 0.1236 -0.1394 -0.0624 204 PRO A CD 1571 N N . VAL A 205 ? 0.2471 0.2538 0.2851 0.0603 -0.0557 -0.0129 205 VAL A N 1572 C CA . VAL A 205 ? 0.2617 0.2540 0.2713 0.0513 -0.0389 0.0044 205 VAL A CA 1573 C C . VAL A 205 ? 0.2698 0.2785 0.2732 0.0518 -0.0346 -0.0006 205 VAL A C 1574 O O . VAL A 205 ? 0.2350 0.2706 0.2661 0.0475 -0.0326 -0.0127 205 VAL A O 1575 C CB . VAL A 205 ? 0.2743 0.2771 0.3048 0.0348 -0.0204 0.0103 205 VAL A CB 1576 C CG1 . VAL A 205 ? 0.3120 0.3185 0.3286 0.0254 -0.0012 0.0202 205 VAL A CG1 1577 C CG2 . VAL A 205 ? 0.3078 0.2853 0.3358 0.0326 -0.0236 0.0181 205 VAL A CG2 1578 N N . THR A 206 ? 0.2880 0.2765 0.2508 0.0570 -0.0330 0.0086 206 THR A N 1579 C CA . THR A 206 ? 0.2855 0.2854 0.2378 0.0599 -0.0305 0.0028 206 THR A CA 1580 C C . THR A 206 ? 0.3140 0.3158 0.2506 0.0511 -0.0074 0.0135 206 THR A C 1581 O O . THR A 206 ? 0.3575 0.3384 0.2654 0.0477 0.0034 0.0280 206 THR A O 1582 C CB . THR A 206 ? 0.3416 0.3210 0.2582 0.0770 -0.0497 -0.0008 206 THR A CB 1583 O OG1 . THR A 206 ? 0.3200 0.3069 0.2609 0.0865 -0.0726 -0.0161 206 THR A OG1 1584 C CG2 . THR A 206 ? 0.3282 0.3175 0.2325 0.0803 -0.0479 -0.0085 206 THR A CG2 1585 N N . LYS A 207 ? 0.2611 0.2871 0.2171 0.0470 0.0004 0.0052 207 LYS A N 1586 C CA . LYS A 207 ? 0.3158 0.3496 0.2610 0.0432 0.0193 0.0095 207 LYS A CA 1587 C C . LYS A 207 ? 0.3975 0.4324 0.3230 0.0540 0.0135 -0.0003 207 LYS A C 1588 O O . LYS A 207 ? 0.3875 0.4285 0.3280 0.0572 -0.0002 -0.0127 207 LYS A O 1589 C CB . LYS A 207 ? 0.2276 0.2854 0.2099 0.0334 0.0297 0.0057 207 LYS A CB 1590 C CG . LYS A 207 ? 0.3416 0.3997 0.3432 0.0223 0.0367 0.0137 207 LYS A CG 1591 C CD . LYS A 207 ? 0.2499 0.3006 0.2341 0.0148 0.0544 0.0261 207 LYS A CD 1592 C CE . LYS A 207 ? 0.3396 0.3864 0.3447 0.0017 0.0592 0.0330 207 LYS A CE 1593 N NZ . LYS A 207 ? 0.4712 0.5139 0.4652 -0.0113 0.0808 0.0440 207 LYS A NZ 1594 N N . SER A 208 ? 0.4105 0.4389 0.3020 0.0585 0.0251 0.0044 208 SER A N 1595 C CA . SER A 208 ? 0.3779 0.4039 0.2455 0.0711 0.0182 -0.0062 208 SER A CA 1596 C C . SER A 208 ? 0.4364 0.4694 0.2812 0.0736 0.0386 -0.0050 208 SER A C 1597 O O . SER A 208 ? 0.5259 0.5626 0.3664 0.0645 0.0596 0.0060 208 SER A O 1598 C CB . SER A 208 ? 0.3667 0.3669 0.1992 0.0834 -0.0016 -0.0068 208 SER A CB 1599 O OG . SER A 208 ? 0.4365 0.4121 0.2327 0.0830 0.0056 0.0096 208 SER A OG 1600 N N . PHE A 209 ? 0.4458 0.4813 0.2776 0.0853 0.0328 -0.0183 209 PHE A N 1601 C CA . PHE A 209 ? 0.3984 0.4415 0.2047 0.0920 0.0504 -0.0215 209 PHE A CA 1602 C C . PHE A 209 ? 0.5253 0.5514 0.2924 0.1091 0.0356 -0.0325 209 PHE A C 1603 O O . PHE A 209 ? 0.5942 0.6100 0.3681 0.1141 0.0111 -0.0418 209 PHE A O 1604 C CB . PHE A 209 ? 0.3769 0.4498 0.2196 0.0908 0.0607 -0.0322 209 PHE A CB 1605 C CG . PHE A 209 ? 0.3961 0.4670 0.2562 0.0979 0.0405 -0.0472 209 PHE A CG 1606 C CD1 . PHE A 209 ? 0.4079 0.4737 0.2469 0.1130 0.0336 -0.0621 209 PHE A CD1 1607 C CD2 . PHE A 209 ? 0.3268 0.3977 0.2212 0.0884 0.0294 -0.0467 209 PHE A CD2 1608 C CE1 . PHE A 209 ? 0.3800 0.4365 0.2318 0.1170 0.0149 -0.0751 209 PHE A CE1 1609 C CE2 . PHE A 209 ? 0.3010 0.3639 0.2058 0.0912 0.0137 -0.0586 209 PHE A CE2 1610 C CZ . PHE A 209 ? 0.3667 0.4204 0.2504 0.1047 0.0060 -0.0723 209 PHE A CZ 1611 N N . ASN A 210 ? 0.5168 0.5411 0.2437 0.1172 0.0514 -0.0329 210 ASN A N 1612 C CA . ASN A 210 ? 0.5564 0.5674 0.2450 0.1356 0.0392 -0.0469 210 ASN A CA 1613 C C . ASN A 210 ? 0.5549 0.5893 0.2621 0.1431 0.0463 -0.0642 210 ASN A C 1614 O O . ASN A 210 ? 0.6301 0.6906 0.3512 0.1388 0.0716 -0.0635 210 ASN A O 1615 C CB . ASN A 210 ? 0.6948 0.6852 0.3182 0.1423 0.0526 -0.0376 210 ASN A CB 1616 C CG . ASN A 210 ? 0.7195 0.6772 0.3148 0.1389 0.0417 -0.0206 210 ASN A CG 1617 O OD1 . ASN A 210 ? 0.7558 0.7044 0.3717 0.1403 0.0146 -0.0236 210 ASN A OD1 1618 N ND2 . ASN A 210 ? 0.6585 0.5975 0.2094 0.1331 0.0626 -0.0035 210 ASN A ND2 1619 N N . ARG A 211 ? 0.5395 0.5646 0.2487 0.1543 0.0231 -0.0813 211 ARG A N 1620 C CA . ARG A 211 ? 0.5633 0.6007 0.2907 0.1615 0.0238 -0.0967 211 ARG A CA 1621 C C . ARG A 211 ? 0.7085 0.7573 0.4160 0.1664 0.0447 -0.0978 211 ARG A C 1622 O O . ARG A 211 ? 0.8105 0.8421 0.4797 0.1747 0.0402 -0.0999 211 ARG A O 1623 C CB . ARG A 211 ? 0.5091 0.5244 0.2357 0.1695 -0.0055 -0.1116 211 ARG A CB 1624 C CG . ARG A 211 ? 0.5180 0.5375 0.2617 0.1771 -0.0089 -0.1256 211 ARG A CG 1625 C CD . ARG A 211 ? 0.5304 0.5230 0.2686 0.1829 -0.0361 -0.1387 211 ARG A CD 1626 N NE . ARG A 211 ? 0.6290 0.6054 0.3372 0.1873 -0.0479 -0.1388 211 ARG A NE 1627 C CZ . ARG A 211 ? 0.6966 0.6699 0.3719 0.1993 -0.0435 -0.1409 211 ARG A CZ 1628 N NH1 . ARG A 211 ? 0.6002 0.5894 0.2708 0.2064 -0.0254 -0.1441 211 ARG A NH1 1629 N NH2 . ARG A 211 ? 0.7511 0.7063 0.3993 0.2043 -0.0577 -0.1412 211 ARG A NH2 1630 N N . GLY A 212 ? 0.6842 0.7634 0.4201 0.1605 0.0672 -0.0981 212 GLY A N 1631 C CA . GLY A 212 ? 0.7961 0.8919 0.5185 0.1588 0.0936 -0.0985 212 GLY A CA 1632 C C . GLY A 212 ? 0.9443 1.0539 0.6718 0.1395 0.1211 -0.0816 212 GLY A C 1633 O O . GLY A 212 ? 0.9250 1.0623 0.6976 0.1298 0.1327 -0.0817 212 GLY A O 1634 N N . ALA A 213 ? 1.0820 1.1684 0.7624 0.1337 0.1291 -0.0668 213 ALA A N 1635 C CA . ALA A 213 ? 1.1612 1.2481 0.8381 0.1134 0.1513 -0.0469 213 ALA A CA 1636 C C . ALA A 213 ? 1.2348 1.2779 0.8508 0.1124 0.1452 -0.0285 213 ALA A C 1637 O O . ALA A 213 ? 1.2550 1.2721 0.8279 0.1262 0.1298 -0.0325 213 ALA A O 1638 C CB . ALA A 213 ? 1.2030 1.3209 0.8968 0.0979 0.1870 -0.0502 213 ALA A CB 1639 O OXT . ALA A 213 ? 1.2262 1.2557 0.8350 0.0985 0.1529 -0.0094 213 ALA A OXT 1640 N N . GLN B 1 ? 0.4095 0.5895 0.5400 -0.1632 -0.1208 0.0566 1 GLN B N 1641 C CA . GLN B 1 ? 0.4612 0.5650 0.5505 -0.1453 -0.1364 0.0531 1 GLN B CA 1642 C C . GLN B 1 ? 0.4252 0.5407 0.5279 -0.1006 -0.1183 0.0408 1 GLN B C 1643 O O . GLN B 1 ? 0.4743 0.6414 0.6060 -0.0901 -0.0913 0.0401 1 GLN B O 1644 C CB . GLN B 1 ? 0.4615 0.5238 0.5081 -0.1794 -0.1400 0.0680 1 GLN B CB 1645 N N . VAL B 2 ? 0.3564 0.4269 0.4400 -0.0753 -0.1348 0.0283 2 VAL B N 1646 C CA . VAL B 2 ? 0.3053 0.3872 0.3958 -0.0415 -0.1188 0.0183 2 VAL B CA 1647 C C . VAL B 2 ? 0.3811 0.4414 0.4528 -0.0408 -0.1067 0.0220 2 VAL B C 1648 O O . VAL B 2 ? 0.4218 0.4292 0.4620 -0.0506 -0.1261 0.0232 2 VAL B O 1649 C CB . VAL B 2 ? 0.3225 0.3836 0.4030 -0.0180 -0.1367 -0.0021 2 VAL B CB 1650 C CG1 . VAL B 2 ? 0.2456 0.3130 0.3242 0.0066 -0.1216 -0.0111 2 VAL B CG1 1651 C CG2 . VAL B 2 ? 0.2764 0.3719 0.3737 -0.0158 -0.1417 -0.0065 2 VAL B CG2 1652 N N . GLN B 3 ? 0.3260 0.4220 0.4158 -0.0287 -0.0797 0.0231 3 GLN B N 1653 C CA . GLN B 3 ? 0.3277 0.4099 0.4003 -0.0296 -0.0658 0.0251 3 GLN B CA 1654 C C . GLN B 3 ? 0.3102 0.4089 0.3964 -0.0019 -0.0486 0.0176 3 GLN B C 1655 O O . GLN B 3 ? 0.3070 0.4380 0.4210 0.0117 -0.0420 0.0162 3 GLN B O 1656 C CB . GLN B 3 ? 0.3829 0.4949 0.4578 -0.0588 -0.0478 0.0344 3 GLN B CB 1657 C CG . GLN B 3 ? 0.5801 0.6634 0.6241 -0.0990 -0.0661 0.0479 3 GLN B CG 1658 C CD . GLN B 3 ? 0.7119 0.8427 0.7567 -0.1366 -0.0435 0.0553 3 GLN B CD 1659 O OE1 . GLN B 3 ? 0.7318 0.9292 0.8152 -0.1263 -0.0146 0.0440 3 GLN B OE1 1660 N NE2 . GLN B 3 ? 0.7789 0.8767 0.7804 -0.1822 -0.0590 0.0725 3 GLN B NE2 1661 N N . LEU B 4 ? 0.2938 0.3651 0.3576 0.0036 -0.0461 0.0146 4 LEU B N 1662 C CA . LEU B 4 ? 0.2673 0.3485 0.3384 0.0229 -0.0306 0.0090 4 LEU B CA 1663 C C . LEU B 4 ? 0.2725 0.3442 0.3254 0.0132 -0.0172 0.0104 4 LEU B C 1664 O O . LEU B 4 ? 0.3351 0.3706 0.3561 0.0015 -0.0298 0.0134 4 LEU B O 1665 C CB . LEU B 4 ? 0.2852 0.3495 0.3465 0.0394 -0.0424 -0.0012 4 LEU B CB 1666 C CG . LEU B 4 ? 0.3086 0.3876 0.3793 0.0460 -0.0547 -0.0079 4 LEU B CG 1667 C CD1 . LEU B 4 ? 0.3385 0.3927 0.3977 0.0419 -0.0787 -0.0168 4 LEU B CD1 1668 C CD2 . LEU B 4 ? 0.2313 0.3242 0.3001 0.0577 -0.0516 -0.0176 4 LEU B CD2 1669 N N . LYS B 5 ? 0.2339 0.3364 0.3063 0.0179 0.0046 0.0064 5 LYS B N 1670 C CA . LYS B 5 ? 0.2377 0.3406 0.2922 0.0075 0.0208 0.0025 5 LYS B CA 1671 C C . LYS B 5 ? 0.3026 0.3995 0.3629 0.0298 0.0289 -0.0071 5 LYS B C 1672 O O . LYS B 5 ? 0.2775 0.3926 0.3694 0.0482 0.0328 -0.0125 5 LYS B O 1673 C CB . LYS B 5 ? 0.3024 0.4568 0.3774 -0.0077 0.0413 -0.0034 5 LYS B CB 1674 C CG . LYS B 5 ? 0.3993 0.5760 0.4827 -0.0311 0.0351 0.0054 5 LYS B CG 1675 C CD . LYS B 5 ? 0.5463 0.6925 0.5800 -0.0705 0.0250 0.0206 5 LYS B CD 1676 C CE . LYS B 5 ? 0.6031 0.7825 0.6452 -0.1037 0.0238 0.0286 5 LYS B CE 1677 N NZ . LYS B 5 ? 0.6587 0.9208 0.7311 -0.1184 0.0558 0.0138 5 LYS B NZ 1678 N N . GLN B 6 ? 0.3693 0.4359 0.3977 0.0266 0.0270 -0.0080 6 GLN B N 1679 C CA . GLN B 6 ? 0.2744 0.3302 0.3035 0.0432 0.0316 -0.0162 6 GLN B CA 1680 C C . GLN B 6 ? 0.2481 0.3165 0.2734 0.0402 0.0513 -0.0287 6 GLN B C 1681 O O . GLN B 6 ? 0.2945 0.3793 0.3044 0.0196 0.0620 -0.0302 6 GLN B O 1682 C CB . GLN B 6 ? 0.2134 0.2361 0.2158 0.0435 0.0157 -0.0145 6 GLN B CB 1683 C CG . GLN B 6 ? 0.2963 0.3148 0.3044 0.0479 -0.0035 -0.0117 6 GLN B CG 1684 C CD . GLN B 6 ? 0.3432 0.3445 0.3391 0.0549 -0.0193 -0.0195 6 GLN B CD 1685 O OE1 . GLN B 6 ? 0.3987 0.3909 0.3932 0.0582 -0.0396 -0.0244 6 GLN B OE1 1686 N NE2 . GLN B 6 ? 0.2846 0.2840 0.2755 0.0585 -0.0123 -0.0246 6 GLN B NE2 1687 N N . SER B 7 ? 0.2638 0.3255 0.3005 0.0576 0.0550 -0.0390 7 SER B N 1688 C CA . SER B 7 ? 0.3154 0.3854 0.3477 0.0587 0.0714 -0.0577 7 SER B CA 1689 C C . SER B 7 ? 0.4119 0.4587 0.3959 0.0397 0.0718 -0.0556 7 SER B C 1690 O O . SER B 7 ? 0.3532 0.3705 0.3152 0.0346 0.0543 -0.0418 7 SER B O 1691 C CB . SER B 7 ? 0.2788 0.3320 0.3319 0.0821 0.0666 -0.0681 7 SER B CB 1692 O OG . SER B 7 ? 0.3127 0.3339 0.3543 0.0829 0.0493 -0.0524 7 SER B OG 1693 N N . GLY B 8 ? 0.4493 0.5131 0.4184 0.0302 0.0898 -0.0725 8 GLY B N 1694 C CA . GLY B 8 ? 0.4976 0.5419 0.4139 0.0064 0.0891 -0.0691 8 GLY B CA 1695 C C . GLY B 8 ? 0.4470 0.4481 0.3427 0.0139 0.0733 -0.0666 8 GLY B C 1696 O O . GLY B 8 ? 0.3794 0.3691 0.2990 0.0350 0.0691 -0.0728 8 GLY B O 1697 N N . PRO B 9 ? 0.4408 0.4167 0.2896 -0.0069 0.0611 -0.0564 9 PRO B N 1698 C CA . PRO B 9 ? 0.4267 0.3681 0.2577 -0.0018 0.0428 -0.0552 9 PRO B CA 1699 C C . PRO B 9 ? 0.4989 0.4398 0.3185 0.0001 0.0562 -0.0757 9 PRO B C 1700 O O . PRO B 9 ? 0.5619 0.5280 0.3746 -0.0073 0.0788 -0.0929 9 PRO B O 1701 C CB . PRO B 9 ? 0.4562 0.3700 0.2398 -0.0257 0.0206 -0.0381 9 PRO B CB 1702 C CG . PRO B 9 ? 0.5560 0.4926 0.3121 -0.0551 0.0395 -0.0362 9 PRO B CG 1703 C CD . PRO B 9 ? 0.5201 0.4992 0.3267 -0.0410 0.0612 -0.0448 9 PRO B CD 1704 N N . GLY B 10 ? 0.4640 0.3812 0.2832 0.0089 0.0423 -0.0778 10 GLY B N 1705 C CA . GLY B 10 ? 0.4910 0.4000 0.2948 0.0083 0.0508 -0.0975 10 GLY B CA 1706 C C . GLY B 10 ? 0.4858 0.3699 0.2863 0.0113 0.0323 -0.0972 10 GLY B C 1707 O O . GLY B 10 ? 0.4810 0.3619 0.2925 0.0139 0.0132 -0.0843 10 GLY B O 1708 N N . LEU B 11 ? 0.5317 0.4036 0.3192 0.0105 0.0383 -0.1162 11 LEU B N 1709 C CA . LEU B 11 ? 0.4511 0.3010 0.2310 0.0075 0.0227 -0.1192 11 LEU B CA 1710 C C . LEU B 11 ? 0.5317 0.3724 0.3471 0.0193 0.0203 -0.1207 11 LEU B C 1711 O O . LEU B 11 ? 0.5574 0.3959 0.3932 0.0325 0.0306 -0.1301 11 LEU B O 1712 C CB . LEU B 11 ? 0.5008 0.3379 0.2427 -0.0027 0.0292 -0.1405 11 LEU B CB 1713 C CG . LEU B 11 ? 0.6248 0.4407 0.3404 -0.0150 0.0103 -0.1427 11 LEU B CG 1714 C CD1 . LEU B 11 ? 0.6546 0.4740 0.3604 -0.0231 -0.0130 -0.1219 11 LEU B CD1 1715 C CD2 . LEU B 11 ? 0.6432 0.4580 0.3223 -0.0260 0.0193 -0.1624 11 LEU B CD2 1716 N N . VAL B 12 ? 0.5560 0.3933 0.3787 0.0124 0.0038 -0.1116 12 VAL B N 1717 C CA . VAL B 12 ? 0.5338 0.3537 0.3732 0.0105 -0.0028 -0.1106 12 VAL B CA 1718 C C . VAL B 12 ? 0.5118 0.3195 0.3339 -0.0072 -0.0169 -0.1154 12 VAL B C 1719 O O . VAL B 12 ? 0.4610 0.2916 0.2786 -0.0155 -0.0263 -0.1123 12 VAL B O 1720 C CB . VAL B 12 ? 0.5557 0.3967 0.4240 0.0102 -0.0068 -0.0919 12 VAL B CB 1721 C CG1 . VAL B 12 ? 0.5915 0.4420 0.4778 0.0269 0.0045 -0.0877 12 VAL B CG1 1722 C CG2 . VAL B 12 ? 0.5504 0.4287 0.4246 0.0027 -0.0148 -0.0858 12 VAL B CG2 1723 N N . GLN B 13 ? 0.4967 0.2664 0.3112 -0.0119 -0.0222 -0.1252 13 GLN B N 1724 C CA A GLN B 13 ? 0.5760 0.3306 0.3730 -0.0326 -0.0369 -0.1301 13 GLN B CA 1725 C CA B GLN B 13 ? 0.5760 0.3301 0.3730 -0.0327 -0.0369 -0.1302 13 GLN B CA 1726 C C . GLN B 13 ? 0.5742 0.3562 0.3883 -0.0543 -0.0483 -0.1127 13 GLN B C 1727 O O . GLN B 13 ? 0.5321 0.3224 0.3646 -0.0567 -0.0474 -0.0975 13 GLN B O 1728 C CB A GLN B 13 ? 0.6146 0.3129 0.3981 -0.0321 -0.0436 -0.1470 13 GLN B CB 1729 C CB B GLN B 13 ? 0.6157 0.3132 0.3997 -0.0323 -0.0440 -0.1466 13 GLN B CB 1730 C CG A GLN B 13 ? 0.6506 0.3377 0.4196 -0.0117 -0.0291 -0.1749 13 GLN B CG 1731 C CG B GLN B 13 ? 0.6551 0.3394 0.4213 -0.0140 -0.0308 -0.1756 13 GLN B CG 1732 C CD A GLN B 13 ? 0.6521 0.3614 0.3920 -0.0217 -0.0247 -0.1838 13 GLN B CD 1733 C CD B GLN B 13 ? 0.7034 0.3485 0.4821 -0.0024 -0.0365 -0.1948 13 GLN B CD 1734 O OE1 A GLN B 13 ? 0.6019 0.3409 0.3321 -0.0164 -0.0105 -0.1849 13 GLN B OE1 1735 O OE1 B GLN B 13 ? 0.7044 0.3162 0.4758 -0.0166 -0.0539 -0.1969 13 GLN B OE1 1736 N NE2 A GLN B 13 ? 0.6683 0.3656 0.3954 -0.0394 -0.0397 -0.1865 13 GLN B NE2 1737 N NE2 B GLN B 13 ? 0.6618 0.3165 0.4649 0.0228 -0.0226 -0.2086 13 GLN B NE2 1738 N N . PRO B 14 ? 0.5797 0.3842 0.3882 -0.0721 -0.0589 -0.1167 14 PRO B N 1739 C CA . PRO B 14 ? 0.5193 0.3688 0.3484 -0.0962 -0.0666 -0.1070 14 PRO B CA 1740 C C . PRO B 14 ? 0.5805 0.3992 0.4042 -0.1224 -0.0733 -0.0932 14 PRO B C 1741 O O . PRO B 14 ? 0.6356 0.3912 0.4369 -0.1278 -0.0829 -0.0971 14 PRO B O 1742 C CB . PRO B 14 ? 0.5445 0.4168 0.3684 -0.1099 -0.0799 -0.1199 14 PRO B CB 1743 C CG . PRO B 14 ? 0.5579 0.3812 0.3479 -0.0974 -0.0810 -0.1326 14 PRO B CG 1744 C CD . PRO B 14 ? 0.5393 0.3415 0.3247 -0.0712 -0.0647 -0.1312 14 PRO B CD 1745 N N . SER B 15 ? 0.5434 0.4041 0.3844 -0.1394 -0.0709 -0.0782 15 SER B N 1746 C CA . SER B 15 ? 0.6147 0.4481 0.4436 -0.1717 -0.0807 -0.0571 15 SER B CA 1747 C C . SER B 15 ? 0.6619 0.4317 0.4847 -0.1504 -0.0837 -0.0459 15 SER B C 1748 O O . SER B 15 ? 0.7159 0.4443 0.5236 -0.1743 -0.1002 -0.0256 15 SER B O 1749 C CB . SER B 15 ? 0.6520 0.4488 0.4563 -0.2101 -0.0996 -0.0552 15 SER B CB 1750 O OG . SER B 15 ? 0.7560 0.4638 0.5394 -0.1921 -0.1114 -0.0628 15 SER B OG 1751 N N . GLN B 16 ? 0.6490 0.4125 0.4831 -0.1083 -0.0710 -0.0589 16 GLN B N 1752 C CA . GLN B 16 ? 0.6116 0.3352 0.4522 -0.0832 -0.0719 -0.0539 16 GLN B CA 1753 C C . GLN B 16 ? 0.5811 0.3540 0.4423 -0.0746 -0.0597 -0.0414 16 GLN B C 1754 O O . GLN B 16 ? 0.5897 0.4265 0.4609 -0.0844 -0.0502 -0.0408 16 GLN B O 1755 C CB . GLN B 16 ? 0.6141 0.3134 0.4565 -0.0468 -0.0624 -0.0790 16 GLN B CB 1756 C CG . GLN B 16 ? 0.7303 0.3794 0.5517 -0.0501 -0.0737 -0.0981 16 GLN B CG 1757 C CD . GLN B 16 ? 0.9248 0.4989 0.7432 -0.0468 -0.0980 -0.0981 16 GLN B CD 1758 O OE1 . GLN B 16 ? 0.9757 0.5229 0.7866 -0.0737 -0.1194 -0.0725 16 GLN B OE1 1759 N NE2 . GLN B 16 ? 1.0123 0.5522 0.8354 -0.0149 -0.0977 -0.1287 16 GLN B NE2 1760 N N . SER B 17 ? 0.5373 0.2825 0.4086 -0.0528 -0.0619 -0.0363 17 SER B N 1761 C CA . SER B 17 ? 0.5160 0.2996 0.4040 -0.0468 -0.0542 -0.0231 17 SER B CA 1762 C C . SER B 17 ? 0.5725 0.3801 0.4812 -0.0114 -0.0359 -0.0367 17 SER B C 1763 O O . SER B 17 ? 0.5780 0.3633 0.4895 0.0111 -0.0306 -0.0545 17 SER B O 1764 C CB . SER B 17 ? 0.5322 0.2735 0.4152 -0.0564 -0.0756 -0.0006 17 SER B CB 1765 O OG . SER B 17 ? 0.5921 0.2854 0.4896 -0.0223 -0.0842 -0.0111 17 SER B OG 1766 N N . LEU B 18 ? 0.5230 0.3796 0.4443 -0.0106 -0.0269 -0.0298 18 LEU B N 1767 C CA . LEU B 18 ? 0.4209 0.3015 0.3578 0.0139 -0.0130 -0.0377 18 LEU B CA 1768 C C . LEU B 18 ? 0.4015 0.2809 0.3554 0.0250 -0.0152 -0.0264 18 LEU B C 1769 O O . LEU B 18 ? 0.4404 0.3283 0.3929 0.0095 -0.0241 -0.0098 18 LEU B O 1770 C CB . LEU B 18 ? 0.3692 0.2993 0.3097 0.0088 -0.0084 -0.0411 18 LEU B CB 1771 C CG . LEU B 18 ? 0.3351 0.2886 0.2879 0.0260 -0.0017 -0.0437 18 LEU B CG 1772 C CD1 . LEU B 18 ? 0.2799 0.2116 0.2244 0.0393 0.0060 -0.0519 18 LEU B CD1 1773 C CD2 . LEU B 18 ? 0.3141 0.3061 0.2723 0.0234 -0.0070 -0.0525 18 LEU B CD2 1774 N N . SER B 19 ? 0.3699 0.2448 0.3390 0.0485 -0.0074 -0.0362 19 SER B N 1775 C CA . SER B 19 ? 0.3878 0.2700 0.3791 0.0607 -0.0106 -0.0280 19 SER B CA 1776 C C . SER B 19 ? 0.3627 0.2811 0.3673 0.0725 0.0057 -0.0353 19 SER B C 1777 O O . SER B 19 ? 0.3892 0.3118 0.3922 0.0801 0.0186 -0.0514 19 SER B O 1778 C CB . SER B 19 ? 0.4455 0.2886 0.4526 0.0784 -0.0240 -0.0348 19 SER B CB 1779 O OG . SER B 19 ? 0.5572 0.3525 0.5471 0.0634 -0.0476 -0.0224 19 SER B OG 1780 N N . ILE B 20 ? 0.2886 0.2328 0.3016 0.0695 0.0041 -0.0234 20 ILE B N 1781 C CA . ILE B 20 ? 0.2335 0.2052 0.2576 0.0763 0.0144 -0.0269 20 ILE B CA 1782 C C . ILE B 20 ? 0.2686 0.2532 0.3168 0.0835 0.0084 -0.0181 20 ILE B C 1783 O O . ILE B 20 ? 0.3018 0.2833 0.3489 0.0768 -0.0049 -0.0042 20 ILE B O 1784 C CB . ILE B 20 ? 0.3021 0.2912 0.3126 0.0668 0.0138 -0.0254 20 ILE B CB 1785 C CG1 . ILE B 20 ? 0.2761 0.2532 0.2651 0.0608 0.0141 -0.0340 20 ILE B CG1 1786 C CG2 . ILE B 20 ? 0.2801 0.2839 0.2953 0.0689 0.0181 -0.0258 20 ILE B CG2 1787 C CD1 . ILE B 20 ? 0.2312 0.2234 0.2144 0.0573 0.0051 -0.0372 20 ILE B CD1 1788 N N . THR B 21 ? 0.2556 0.2595 0.3238 0.0932 0.0176 -0.0264 21 THR B N 1789 C CA . THR B 21 ? 0.2539 0.2773 0.3500 0.1005 0.0112 -0.0204 21 THR B CA 1790 C C . THR B 21 ? 0.3158 0.3658 0.4090 0.0905 0.0170 -0.0163 21 THR B C 1791 O O . THR B 21 ? 0.3080 0.3661 0.3899 0.0827 0.0289 -0.0230 21 THR B O 1792 C CB . THR B 21 ? 0.2914 0.3275 0.4226 0.1198 0.0149 -0.0380 21 THR B CB 1793 O OG1 . THR B 21 ? 0.3214 0.3204 0.4586 0.1332 -0.0011 -0.0420 21 THR B OG1 1794 C CG2 . THR B 21 ? 0.2182 0.2861 0.3836 0.1266 0.0087 -0.0345 21 THR B CG2 1795 N N . CYS B 22 ? 0.3316 0.3904 0.4297 0.0873 0.0052 -0.0044 22 CYS B N 1796 C CA . CYS B 22 ? 0.2405 0.3182 0.3379 0.0789 0.0048 -0.0018 22 CYS B CA 1797 C C . CYS B 22 ? 0.2280 0.3298 0.3572 0.0844 0.0004 0.0012 22 CYS B C 1798 O O . CYS B 22 ? 0.2759 0.3752 0.4165 0.0907 -0.0135 0.0092 22 CYS B O 1799 C CB . CYS B 22 ? 0.2239 0.2998 0.3033 0.0718 -0.0061 0.0022 22 CYS B CB 1800 S SG . CYS B 22 ? 0.2835 0.3707 0.3605 0.0651 -0.0145 -0.0004 22 CYS B SG 1801 N N . THR B 23 ? 0.2785 0.4047 0.4204 0.0784 0.0099 -0.0042 23 THR B N 1802 C CA . THR B 23 ? 0.2509 0.4119 0.4298 0.0821 0.0064 -0.0049 23 THR B CA 1803 C C . THR B 23 ? 0.3051 0.4757 0.4759 0.0645 0.0000 0.0031 23 THR B C 1804 O O . THR B 23 ? 0.4763 0.6410 0.6254 0.0467 0.0055 0.0032 23 THR B O 1805 C CB . THR B 23 ? 0.2335 0.4324 0.4418 0.0854 0.0242 -0.0230 23 THR B CB 1806 O OG1 . THR B 23 ? 0.2822 0.4673 0.4978 0.1045 0.0279 -0.0364 23 THR B OG1 1807 C CG2 . THR B 23 ? 0.1631 0.4098 0.4203 0.0918 0.0188 -0.0284 23 THR B CG2 1808 N N . VAL B 24 ? 0.2199 0.3993 0.4042 0.0674 -0.0159 0.0105 24 VAL B N 1809 C CA . VAL B 24 ? 0.2121 0.3938 0.3856 0.0519 -0.0259 0.0154 24 VAL B CA 1810 C C . VAL B 24 ? 0.2065 0.4283 0.4146 0.0452 -0.0287 0.0158 24 VAL B C 1811 O O . VAL B 24 ? 0.1843 0.4361 0.4310 0.0588 -0.0279 0.0113 24 VAL B O 1812 C CB . VAL B 24 ? 0.2197 0.3866 0.3743 0.0542 -0.0423 0.0200 24 VAL B CB 1813 C CG1 . VAL B 24 ? 0.2327 0.3748 0.3592 0.0581 -0.0383 0.0161 24 VAL B CG1 1814 C CG2 . VAL B 24 ? 0.1916 0.3732 0.3665 0.0624 -0.0555 0.0289 24 VAL B CG2 1815 N N . SER B 25 ? 0.2177 0.4390 0.4141 0.0248 -0.0357 0.0190 25 SER B N 1816 C CA . SER B 25 ? 0.2137 0.4745 0.4401 0.0124 -0.0413 0.0204 25 SER B CA 1817 C C . SER B 25 ? 0.2834 0.5201 0.4843 -0.0055 -0.0602 0.0253 25 SER B C 1818 O O . SER B 25 ? 0.1895 0.3815 0.3534 -0.0075 -0.0672 0.0237 25 SER B O 1819 C CB . SER B 25 ? 0.1921 0.4941 0.4380 -0.0051 -0.0215 0.0141 25 SER B CB 1820 O OG . SER B 25 ? 0.2903 0.5598 0.4932 -0.0278 -0.0146 0.0182 25 SER B OG 1821 N N . GLY B 26 ? 0.2466 0.5134 0.4708 -0.0161 -0.0715 0.0277 26 GLY B N 1822 C CA . GLY B 26 ? 0.2518 0.4953 0.4548 -0.0307 -0.0935 0.0291 26 GLY B CA 1823 C C . GLY B 26 ? 0.2627 0.4927 0.4523 -0.0133 -0.1086 0.0254 26 GLY B C 1824 O O . GLY B 26 ? 0.3200 0.5317 0.4902 -0.0212 -0.1266 0.0194 26 GLY B O 1825 N N . PHE B 27 ? 0.2388 0.4773 0.4351 0.0070 -0.1026 0.0278 27 PHE B N 1826 C CA . PHE B 27 ? 0.1858 0.4216 0.3650 0.0142 -0.1160 0.0286 27 PHE B CA 1827 C C . PHE B 27 ? 0.2671 0.5095 0.4575 0.0292 -0.1146 0.0392 27 PHE B C 1828 O O . PHE B 27 ? 0.1906 0.4356 0.4031 0.0400 -0.1021 0.0400 27 PHE B O 1829 C CB . PHE B 27 ? 0.2227 0.4315 0.3626 0.0146 -0.1167 0.0143 27 PHE B CB 1830 C CG . PHE B 27 ? 0.1817 0.3727 0.3097 0.0250 -0.1005 0.0110 27 PHE B CG 1831 C CD1 . PHE B 27 ? 0.2298 0.3991 0.3565 0.0242 -0.0917 0.0078 27 PHE B CD1 1832 C CD2 . PHE B 27 ? 0.1794 0.3746 0.2926 0.0305 -0.0966 0.0131 27 PHE B CD2 1833 C CE1 . PHE B 27 ? 0.2024 0.3558 0.3175 0.0333 -0.0792 0.0043 27 PHE B CE1 1834 C CE2 . PHE B 27 ? 0.1709 0.3521 0.2742 0.0375 -0.0829 0.0095 27 PHE B CE2 1835 C CZ . PHE B 27 ? 0.2140 0.3748 0.3203 0.0412 -0.0743 0.0039 27 PHE B CZ 1836 N N . SER B 28 ? 0.3194 0.5613 0.4903 0.0274 -0.1302 0.0467 28 SER B N 1837 C CA . SER B 28 ? 0.3015 0.5322 0.4717 0.0364 -0.1373 0.0602 28 SER B CA 1838 C C . SER B 28 ? 0.3379 0.5511 0.4668 0.0297 -0.1333 0.0641 28 SER B C 1839 O O . SER B 28 ? 0.3699 0.5906 0.4644 0.0156 -0.1320 0.0552 28 SER B O 1840 C CB . SER B 28 ? 0.2809 0.5142 0.4496 0.0331 -0.1592 0.0686 28 SER B CB 1841 O OG . SER B 28 ? 0.2732 0.4825 0.4292 0.0374 -0.1730 0.0844 28 SER B OG 1842 N N . LEU B 29 ? 0.3371 0.5292 0.4692 0.0389 -0.1306 0.0724 29 LEU B N 1843 C CA . LEU B 29 ? 0.3025 0.4778 0.3942 0.0273 -0.1256 0.0766 29 LEU B CA 1844 C C . LEU B 29 ? 0.4054 0.5828 0.4573 0.0034 -0.1467 0.0939 29 LEU B C 1845 O O . LEU B 29 ? 0.4070 0.5857 0.4184 -0.0171 -0.1413 0.0959 29 LEU B O 1846 C CB . LEU B 29 ? 0.2635 0.4088 0.3671 0.0404 -0.1234 0.0831 29 LEU B CB 1847 C CG . LEU B 29 ? 0.2848 0.4294 0.4106 0.0560 -0.0981 0.0648 29 LEU B CG 1848 C CD1 . LEU B 29 ? 0.2227 0.3389 0.3612 0.0703 -0.0986 0.0673 29 LEU B CD1 1849 C CD2 . LEU B 29 ? 0.1926 0.3434 0.2912 0.0462 -0.0798 0.0503 29 LEU B CD2 1850 N N . THR B 30 ? 0.3495 0.5292 0.4102 0.0026 -0.1687 0.1041 30 THR B N 1851 C CA . THR B 30 ? 0.3500 0.5248 0.3661 -0.0229 -0.1854 0.1179 30 THR B CA 1852 C C . THR B 30 ? 0.4017 0.6140 0.3908 -0.0408 -0.1747 0.0990 30 THR B C 1853 O O . THR B 30 ? 0.4256 0.6449 0.3702 -0.0676 -0.1788 0.1039 30 THR B O 1854 C CB . THR B 30 ? 0.3847 0.5408 0.4194 -0.0140 -0.2104 0.1303 30 THR B CB 1855 O OG1 . THR B 30 ? 0.3536 0.5371 0.4273 0.0011 -0.2058 0.1135 30 THR B OG1 1856 C CG2 . THR B 30 ? 0.4032 0.5215 0.4650 0.0069 -0.2231 0.1404 30 THR B CG2 1857 N N . ASN B 31 ? 0.3780 0.6116 0.3937 -0.0268 -0.1609 0.0750 31 ASN B N 1858 C CA . ASN B 31 ? 0.3876 0.6483 0.3837 -0.0367 -0.1534 0.0484 31 ASN B CA 1859 C C . ASN B 31 ? 0.3523 0.6322 0.3393 -0.0345 -0.1324 0.0198 31 ASN B C 1860 O O . ASN B 31 ? 0.3936 0.6951 0.3607 -0.0421 -0.1253 -0.0073 31 ASN B O 1861 C CB . ASN B 31 ? 0.3367 0.5979 0.3640 -0.0254 -0.1603 0.0373 31 ASN B CB 1862 C CG . ASN B 31 ? 0.3285 0.5822 0.3664 -0.0271 -0.1801 0.0556 31 ASN B CG 1863 O OD1 . ASN B 31 ? 0.3001 0.5542 0.3768 -0.0154 -0.1844 0.0550 31 ASN B OD1 1864 N ND2 . ASN B 31 ? 0.3580 0.6074 0.3609 -0.0437 -0.1921 0.0712 31 ASN B ND2 1865 N N . TYR B 32 ? 0.2556 0.5192 0.2608 -0.0201 -0.1197 0.0211 32 TYR B N 1866 C CA . TYR B 32 ? 0.2388 0.5123 0.2420 -0.0127 -0.1016 -0.0080 32 TYR B CA 1867 C C . TYR B 32 ? 0.2703 0.5376 0.2640 -0.0168 -0.0890 0.0011 32 TYR B C 1868 O O . TYR B 32 ? 0.3318 0.5685 0.3333 -0.0142 -0.0927 0.0280 32 TYR B O 1869 C CB . TYR B 32 ? 0.2663 0.5152 0.3006 0.0096 -0.0996 -0.0220 32 TYR B CB 1870 C CG . TYR B 32 ? 0.3082 0.5611 0.3467 0.0107 -0.1133 -0.0401 32 TYR B CG 1871 C CD1 . TYR B 32 ? 0.3110 0.5587 0.3623 0.0055 -0.1268 -0.0228 32 TYR B CD1 1872 C CD2 . TYR B 32 ? 0.2358 0.4948 0.2680 0.0176 -0.1146 -0.0770 32 TYR B CD2 1873 C CE1 . TYR B 32 ? 0.3118 0.5595 0.3642 0.0028 -0.1416 -0.0389 32 TYR B CE1 1874 C CE2 . TYR B 32 ? 0.2577 0.5036 0.2909 0.0184 -0.1282 -0.0929 32 TYR B CE2 1875 C CZ . TYR B 32 ? 0.3910 0.6304 0.4314 0.0085 -0.1419 -0.0726 32 TYR B CZ 1876 O OH . TYR B 32 ? 0.5433 0.7680 0.5821 0.0057 -0.1572 -0.0875 32 TYR B OH 1877 N N . GLY B 33 ? 0.2746 0.5734 0.2552 -0.0220 -0.0758 -0.0253 33 GLY B N 1878 C CA . GLY B 33 ? 0.2744 0.5708 0.2501 -0.0261 -0.0632 -0.0218 33 GLY B CA 1879 C C . GLY B 33 ? 0.3009 0.5662 0.3067 0.0017 -0.0567 -0.0315 33 GLY B C 1880 O O . GLY B 33 ? 0.2820 0.5409 0.3055 0.0197 -0.0609 -0.0518 33 GLY B O 1881 N N . VAL B 34 ? 0.2470 0.2347 0.3201 0.0614 -0.0591 0.0348 34 VAL B N 1882 C CA . VAL B 34 ? 0.2226 0.2207 0.3103 0.0585 -0.0452 0.0416 34 VAL B CA 1883 C C . VAL B 34 ? 0.3078 0.2920 0.3597 0.0559 -0.0309 0.0233 34 VAL B C 1884 O O . VAL B 34 ? 0.3462 0.3171 0.3658 0.0570 -0.0192 0.0189 34 VAL B O 1885 C CB . VAL B 34 ? 0.2509 0.2693 0.3533 0.0701 -0.0254 0.0654 34 VAL B CB 1886 C CG1 . VAL B 34 ? 0.1789 0.2031 0.2745 0.0739 -0.0076 0.0679 34 VAL B CG1 1887 C CG2 . VAL B 34 ? 0.2439 0.2967 0.4021 0.0684 -0.0404 0.0950 34 VAL B CG2 1888 N N . HIS B 35 ? 0.2428 0.2301 0.3054 0.0503 -0.0367 0.0170 35 HIS B N 1889 C CA . HIS B 35 ? 0.3015 0.2839 0.3402 0.0468 -0.0274 0.0030 35 HIS B CA 1890 C C . HIS B 35 ? 0.3118 0.2918 0.3493 0.0451 -0.0134 0.0105 35 HIS B C 1891 O O . HIS B 35 ? 0.2699 0.2615 0.3287 0.0495 -0.0107 0.0266 35 HIS B O 1892 C CB . HIS B 35 ? 0.2699 0.2549 0.3147 0.0484 -0.0454 -0.0124 35 HIS B CB 1893 C CG . HIS B 35 ? 0.3083 0.2902 0.3379 0.0601 -0.0626 -0.0257 35 HIS B CG 1894 N ND1 . HIS B 35 ? 0.2128 0.2079 0.2119 0.0726 -0.0580 -0.0401 35 HIS B ND1 1895 C CD2 . HIS B 35 ? 0.2853 0.2555 0.3231 0.0645 -0.0860 -0.0249 35 HIS B CD2 1896 C CE1 . HIS B 35 ? 0.2766 0.2654 0.2561 0.0893 -0.0760 -0.0513 35 HIS B CE1 1897 N NE2 . HIS B 35 ? 0.3155 0.2829 0.3175 0.0827 -0.0966 -0.0442 35 HIS B NE2 1898 N N . TRP B 36 ? 0.2753 0.2446 0.2879 0.0397 -0.0065 0.0025 36 TRP B N 1899 C CA . TRP B 36 ? 0.2559 0.2138 0.2566 0.0397 -0.0001 0.0043 36 TRP B CA 1900 C C . TRP B 36 ? 0.2943 0.2588 0.2986 0.0291 -0.0056 -0.0043 36 TRP B C 1901 O O . TRP B 36 ? 0.2688 0.2427 0.2694 0.0218 -0.0079 -0.0087 36 TRP B O 1902 C CB . TRP B 36 ? 0.2868 0.2114 0.2497 0.0445 0.0037 0.0046 36 TRP B CB 1903 C CG . TRP B 36 ? 0.3187 0.2390 0.2755 0.0638 0.0106 0.0127 36 TRP B CG 1904 C CD1 . TRP B 36 ? 0.2753 0.1981 0.2377 0.0657 0.0090 0.0166 36 TRP B CD1 1905 C CD2 . TRP B 36 ? 0.3250 0.2461 0.2687 0.0894 0.0215 0.0205 36 TRP B CD2 1906 N NE1 . TRP B 36 ? 0.2571 0.1814 0.2158 0.0891 0.0170 0.0263 36 TRP B NE1 1907 C CE2 . TRP B 36 ? 0.3499 0.2777 0.2965 0.1067 0.0268 0.0297 36 TRP B CE2 1908 C CE3 . TRP B 36 ? 0.3367 0.2586 0.2632 0.1035 0.0283 0.0225 36 TRP B CE3 1909 C CZ2 . TRP B 36 ? 0.4194 0.3622 0.3554 0.1411 0.0413 0.0422 36 TRP B CZ2 1910 C CZ3 . TRP B 36 ? 0.3750 0.3108 0.2847 0.1389 0.0435 0.0345 36 TRP B CZ3 1911 C CH2 . TRP B 36 ? 0.4261 0.3759 0.3420 0.1591 0.0512 0.0449 36 TRP B CH2 1912 N N . VAL B 37 ? 0.2908 0.2585 0.3054 0.0301 -0.0068 -0.0018 37 VAL B N 1913 C CA . VAL B 37 ? 0.2372 0.2120 0.2595 0.0229 -0.0138 -0.0085 37 VAL B CA 1914 C C . VAL B 37 ? 0.2693 0.2283 0.2728 0.0237 -0.0108 -0.0038 37 VAL B C 1915 O O . VAL B 37 ? 0.3701 0.3271 0.3661 0.0356 -0.0029 0.0069 37 VAL B O 1916 C CB . VAL B 37 ? 0.2032 0.1913 0.2577 0.0256 -0.0275 -0.0095 37 VAL B CB 1917 C CG1 . VAL B 37 ? 0.1978 0.1901 0.2594 0.0230 -0.0362 -0.0163 37 VAL B CG1 1918 C CG2 . VAL B 37 ? 0.1535 0.1463 0.2139 0.0324 -0.0378 -0.0195 37 VAL B CG2 1919 N N . ARG B 38 ? 0.2461 0.1985 0.2404 0.0142 -0.0177 -0.0092 38 ARG B N 1920 C CA . ARG B 38 ? 0.2070 0.1399 0.1783 0.0172 -0.0207 -0.0074 38 ARG B CA 1921 C C . ARG B 38 ? 0.3037 0.2531 0.2972 0.0097 -0.0297 -0.0083 38 ARG B C 1922 O O . ARG B 38 ? 0.2490 0.2223 0.2712 0.0049 -0.0346 -0.0132 38 ARG B O 1923 C CB . ARG B 38 ? 0.2497 0.1417 0.1798 0.0131 -0.0310 -0.0121 38 ARG B CB 1924 C CG . ARG B 38 ? 0.2500 0.1463 0.1937 -0.0099 -0.0475 -0.0112 38 ARG B CG 1925 C CD . ARG B 38 ? 0.3530 0.1976 0.2598 -0.0194 -0.0698 -0.0107 38 ARG B CD 1926 N NE . ARG B 38 ? 0.4458 0.3059 0.3796 -0.0477 -0.0891 0.0015 38 ARG B NE 1927 C CZ . ARG B 38 ? 0.4962 0.3115 0.4111 -0.0666 -0.1213 0.0089 38 ARG B CZ 1928 N NH1 . ARG B 38 ? 0.6131 0.3527 0.4695 -0.0536 -0.1395 -0.0030 38 ARG B NH1 1929 N NH2 . ARG B 38 ? 0.3585 0.2049 0.3134 -0.0962 -0.1390 0.0301 38 ARG B NH2 1930 N N . GLN B 39 ? 0.2985 0.2350 0.2730 0.0144 -0.0325 -0.0041 39 GLN B N 1931 C CA . GLN B 39 ? 0.2568 0.2052 0.2504 0.0086 -0.0429 -0.0026 39 GLN B CA 1932 C C . GLN B 39 ? 0.2926 0.2127 0.2467 0.0087 -0.0526 -0.0041 39 GLN B C 1933 O O . GLN B 39 ? 0.3368 0.2361 0.2488 0.0254 -0.0469 -0.0008 39 GLN B O 1934 C CB . GLN B 39 ? 0.1917 0.1584 0.2111 0.0146 -0.0406 0.0124 39 GLN B CB 1935 C CG . GLN B 39 ? 0.1819 0.1579 0.2311 0.0085 -0.0573 0.0135 39 GLN B CG 1936 C CD . GLN B 39 ? 0.2880 0.2752 0.3730 0.0080 -0.0657 0.0324 39 GLN B CD 1937 O OE1 . GLN B 39 ? 0.2474 0.2462 0.3376 0.0108 -0.0555 0.0519 39 GLN B OE1 1938 N NE2 . GLN B 39 ? 0.3019 0.2859 0.4149 0.0045 -0.0885 0.0300 39 GLN B NE2 1939 N N . SER B 40 ? 0.3031 0.2247 0.2685 -0.0060 -0.0690 -0.0083 40 SER B N 1940 C CA . SER B 40 ? 0.4013 0.2884 0.3301 -0.0105 -0.0886 -0.0104 40 SER B CA 1941 C C . SER B 40 ? 0.3959 0.3024 0.3516 -0.0198 -0.1027 -0.0069 40 SER B C 1942 O O . SER B 40 ? 0.3866 0.3328 0.3899 -0.0226 -0.0990 -0.0054 40 SER B O 1943 C CB . SER B 40 ? 0.3703 0.2314 0.2869 -0.0266 -0.1058 -0.0127 40 SER B CB 1944 O OG . SER B 40 ? 0.3287 0.2354 0.2989 -0.0462 -0.1083 -0.0040 40 SER B OG 1945 N N . PRO B 41 ? 0.4147 0.2893 0.3341 -0.0197 -0.1218 -0.0074 41 PRO B N 1946 C CA . PRO B 41 ? 0.4297 0.3223 0.3758 -0.0292 -0.1384 -0.0026 41 PRO B CA 1947 C C . PRO B 41 ? 0.3772 0.3051 0.3741 -0.0497 -0.1498 0.0023 41 PRO B C 1948 O O . PRO B 41 ? 0.3099 0.2830 0.3533 -0.0474 -0.1464 0.0054 41 PRO B O 1949 C CB . PRO B 41 ? 0.4528 0.2942 0.3380 -0.0249 -0.1620 -0.0057 41 PRO B CB 1950 C CG . PRO B 41 ? 0.4185 0.2273 0.2424 0.0012 -0.1462 -0.0114 41 PRO B CG 1951 C CD . PRO B 41 ? 0.3883 0.2078 0.2339 -0.0029 -0.1300 -0.0141 41 PRO B CD 1952 N N . GLY B 42 ? 0.3162 0.2268 0.3054 -0.0668 -0.1647 0.0063 42 GLY B N 1953 C CA . GLY B 42 ? 0.2990 0.2582 0.3416 -0.0857 -0.1699 0.0237 42 GLY B CA 1954 C C . GLY B 42 ? 0.3425 0.3691 0.4337 -0.0809 -0.1471 0.0287 42 GLY B C 1955 O O . GLY B 42 ? 0.3213 0.4111 0.4605 -0.0817 -0.1444 0.0424 42 GLY B O 1956 N N . LYS B 43 ? 0.3127 0.3279 0.3855 -0.0675 -0.1248 0.0178 43 LYS B N 1957 C CA . LYS B 43 ? 0.2859 0.3553 0.3901 -0.0580 -0.1032 0.0209 43 LYS B CA 1958 C C . LYS B 43 ? 0.2709 0.3408 0.3702 -0.0310 -0.0844 0.0022 43 LYS B C 1959 O O . LYS B 43 ? 0.3207 0.4233 0.4327 -0.0178 -0.0706 -0.0005 43 LYS B O 1960 C CB . LYS B 43 ? 0.2989 0.3620 0.3963 -0.0743 -0.1028 0.0336 43 LYS B CB 1961 C CG . LYS B 43 ? 0.4023 0.5083 0.5388 -0.1018 -0.1195 0.0661 43 LYS B CG 1962 C CD . LYS B 43 ? 0.5382 0.7163 0.7062 -0.0966 -0.0970 0.0844 43 LYS B CD 1963 C CE . LYS B 43 ? 0.6524 0.8763 0.8572 -0.1223 -0.1073 0.1268 43 LYS B CE 1964 N NZ . LYS B 43 ? 0.6954 0.8505 0.8746 -0.1510 -0.1327 0.1405 43 LYS B NZ 1965 N N . GLY B 44 ? 0.2476 0.2821 0.3289 -0.0235 -0.0879 -0.0068 44 GLY B N 1966 C CA . GLY B 44 ? 0.2084 0.2380 0.2933 -0.0059 -0.0808 -0.0161 44 GLY B CA 1967 C C . GLY B 44 ? 0.2303 0.2521 0.3041 -0.0019 -0.0669 -0.0189 44 GLY B C 1968 O O . GLY B 44 ? 0.2705 0.2714 0.3197 -0.0104 -0.0611 -0.0146 44 GLY B O 1969 N N . LEU B 45 ? 0.2153 0.2472 0.3035 0.0134 -0.0669 -0.0276 45 LEU B N 1970 C CA . LEU B 45 ? 0.2263 0.2524 0.3067 0.0177 -0.0579 -0.0300 45 LEU B CA 1971 C C . LEU B 45 ? 0.2530 0.3074 0.3295 0.0179 -0.0467 -0.0298 45 LEU B C 1972 O O . LEU B 45 ? 0.2523 0.3458 0.3410 0.0307 -0.0463 -0.0331 45 LEU B O 1973 C CB . LEU B 45 ? 0.1761 0.1935 0.2704 0.0330 -0.0723 -0.0391 45 LEU B CB 1974 C CG . LEU B 45 ? 0.1875 0.1810 0.2950 0.0259 -0.0854 -0.0261 45 LEU B CG 1975 C CD1 . LEU B 45 ? 0.2298 0.2066 0.3574 0.0372 -0.1161 -0.0341 45 LEU B CD1 1976 C CD2 . LEU B 45 ? 0.1892 0.1771 0.2931 0.0186 -0.0736 -0.0101 45 LEU B CD2 1977 N N . GLU B 46 ? 0.2206 0.2594 0.2797 0.0068 -0.0380 -0.0223 46 GLU B N 1978 C CA . GLU B 46 ? 0.2245 0.2872 0.2816 0.0028 -0.0298 -0.0147 46 GLU B CA 1979 C C . GLU B 46 ? 0.2535 0.2983 0.2961 0.0086 -0.0233 -0.0177 46 GLU B C 1980 O O . GLU B 46 ? 0.2595 0.2689 0.2881 0.0055 -0.0226 -0.0167 46 GLU B O 1981 C CB . GLU B 46 ? 0.2716 0.3203 0.3206 -0.0215 -0.0355 0.0016 46 GLU B CB 1982 C CG . GLU B 46 ? 0.3769 0.4498 0.4462 -0.0345 -0.0466 0.0129 46 GLU B CG 1983 C CD . GLU B 46 ? 0.4401 0.4841 0.5001 -0.0626 -0.0647 0.0307 46 GLU B CD 1984 O OE1 . GLU B 46 ? 0.4646 0.4451 0.4888 -0.0647 -0.0772 0.0212 46 GLU B OE1 1985 O OE2 . GLU B 46 ? 0.4156 0.5000 0.5022 -0.0804 -0.0695 0.0565 46 GLU B OE2 1986 N N . TRP B 47 ? 0.1994 0.2730 0.2427 0.0210 -0.0180 -0.0199 47 TRP B N 1987 C CA . TRP B 47 ? 0.2922 0.3511 0.3214 0.0240 -0.0138 -0.0196 47 TRP B CA 1988 C C . TRP B 47 ? 0.3011 0.3554 0.3207 0.0044 -0.0091 -0.0007 47 TRP B C 1989 O O . TRP B 47 ? 0.2444 0.3336 0.2738 -0.0061 -0.0076 0.0161 47 TRP B O 1990 C CB . TRP B 47 ? 0.2755 0.3611 0.2993 0.0485 -0.0146 -0.0306 47 TRP B CB 1991 C CG . TRP B 47 ? 0.2329 0.3059 0.2415 0.0528 -0.0138 -0.0303 47 TRP B CG 1992 C CD1 . TRP B 47 ? 0.2280 0.2677 0.2377 0.0561 -0.0253 -0.0376 47 TRP B CD1 1993 C CD2 . TRP B 47 ? 0.2470 0.3462 0.2415 0.0533 -0.0032 -0.0171 47 TRP B CD2 1994 N NE1 . TRP B 47 ? 0.2932 0.3326 0.2880 0.0599 -0.0230 -0.0337 47 TRP B NE1 1995 C CE2 . TRP B 47 ? 0.2963 0.3696 0.2785 0.0589 -0.0091 -0.0221 47 TRP B CE2 1996 C CE3 . TRP B 47 ? 0.3150 0.4632 0.3117 0.0473 0.0092 0.0051 47 TRP B CE3 1997 C CZ2 . TRP B 47 ? 0.3326 0.4207 0.2974 0.0610 -0.0026 -0.0104 47 TRP B CZ2 1998 C CZ3 . TRP B 47 ? 0.3233 0.4913 0.3062 0.0473 0.0164 0.0221 47 TRP B CZ3 1999 C CH2 . TRP B 47 ? 0.3347 0.4691 0.2983 0.0551 0.0106 0.0119 47 TRP B CH2 2000 N N . LEU B 48 ? 0.2863 0.2988 0.2891 0.0002 -0.0102 0.0003 48 LEU B N 2001 C CA . LEU B 48 ? 0.3174 0.3059 0.3048 -0.0163 -0.0155 0.0155 48 LEU B CA 2002 C C . LEU B 48 ? 0.3227 0.3203 0.3040 -0.0149 -0.0112 0.0251 48 LEU B C 2003 O O . LEU B 48 ? 0.3098 0.3211 0.2939 -0.0317 -0.0156 0.0472 48 LEU B O 2004 C CB . LEU B 48 ? 0.3303 0.2614 0.2914 -0.0133 -0.0226 0.0091 48 LEU B CB 2005 C CG . LEU B 48 ? 0.3224 0.2415 0.2805 -0.0148 -0.0291 0.0029 48 LEU B CG 2006 C CD1 . LEU B 48 ? 0.3654 0.2375 0.2875 0.0025 -0.0306 -0.0051 48 LEU B CD1 2007 C CD2 . LEU B 48 ? 0.2539 0.1730 0.2182 -0.0392 -0.0469 0.0156 48 LEU B CD2 2008 N N . GLY B 49 ? 0.3384 0.3311 0.3153 0.0026 -0.0058 0.0137 49 GLY B N 2009 C CA . GLY B 49 ? 0.2142 0.2136 0.1824 0.0065 -0.0037 0.0211 49 GLY B CA 2010 C C . GLY B 49 ? 0.2398 0.2270 0.2081 0.0236 -0.0043 0.0093 49 GLY B C 2011 O O . GLY B 49 ? 0.2094 0.1926 0.1913 0.0311 -0.0067 -0.0007 49 GLY B O 2012 N N . VAL B 50 ? 0.2552 0.2389 0.2129 0.0271 -0.0053 0.0160 50 VAL B N 2013 C CA . VAL B 50 ? 0.2460 0.2241 0.2095 0.0410 -0.0109 0.0096 50 VAL B CA 2014 C C . VAL B 50 ? 0.2854 0.2468 0.2356 0.0422 -0.0123 0.0211 50 VAL B C 2015 O O . VAL B 50 ? 0.3136 0.2777 0.2478 0.0338 -0.0113 0.0335 50 VAL B O 2016 C CB . VAL B 50 ? 0.3073 0.3091 0.2704 0.0543 -0.0200 -0.0035 50 VAL B CB 2017 C CG1 . VAL B 50 ? 0.2341 0.2684 0.1747 0.0581 -0.0124 0.0026 50 VAL B CG1 2018 C CG2 . VAL B 50 ? 0.2254 0.2148 0.1950 0.0643 -0.0368 -0.0070 50 VAL B CG2 2019 N N . ILE B 51 ? 0.3742 0.3235 0.3359 0.0522 -0.0156 0.0223 51 ILE B N 2020 C CA . ILE B 51 ? 0.4036 0.3432 0.3567 0.0580 -0.0205 0.0314 51 ILE B CA 2021 C C . ILE B 51 ? 0.4271 0.3832 0.3962 0.0660 -0.0347 0.0276 51 ILE B C 2022 O O . ILE B 51 ? 0.3302 0.2943 0.3302 0.0687 -0.0426 0.0273 51 ILE B O 2023 C CB . ILE B 51 ? 0.4199 0.3325 0.3691 0.0686 -0.0166 0.0390 51 ILE B CB 2024 C CG1 . ILE B 51 ? 0.4690 0.3661 0.4050 0.0743 -0.0238 0.0491 51 ILE B CG1 2025 C CG2 . ILE B 51 ? 0.3754 0.3066 0.3549 0.0825 -0.0116 0.0420 51 ILE B CG2 2026 C CD1 . ILE B 51 ? 0.3337 0.1926 0.2515 0.0919 -0.0234 0.0531 51 ILE B CD1 2027 N N . TRP B 52 ? 0.4736 0.4858 0.3740 -0.0043 -0.0118 -0.0162 52 TRP B N 2028 C CA . TRP B 52 ? 0.3652 0.4190 0.2891 0.0049 -0.0245 -0.0366 52 TRP B CA 2029 C C . TRP B 52 ? 0.3837 0.4467 0.3113 0.0217 -0.0328 -0.0338 52 TRP B C 2030 O O . TRP B 52 ? 0.4253 0.4617 0.3329 0.0288 -0.0276 -0.0156 52 TRP B O 2031 C CB . TRP B 52 ? 0.3480 0.4270 0.2436 0.0068 -0.0265 -0.0431 52 TRP B CB 2032 C CG . TRP B 52 ? 0.3100 0.3914 0.2095 -0.0075 -0.0187 -0.0496 52 TRP B CG 2033 C CD1 . TRP B 52 ? 0.3246 0.3919 0.1925 -0.0180 -0.0067 -0.0326 52 TRP B CD1 2034 C CD2 . TRP B 52 ? 0.4520 0.5511 0.3961 -0.0129 -0.0235 -0.0747 52 TRP B CD2 2035 N NE1 . TRP B 52 ? 0.3077 0.3886 0.1967 -0.0286 -0.0028 -0.0465 52 TRP B NE1 2036 C CE2 . TRP B 52 ? 0.4117 0.5100 0.3469 -0.0242 -0.0135 -0.0727 52 TRP B CE2 2037 C CE3 . TRP B 52 ? 0.3442 0.4586 0.3399 -0.0097 -0.0367 -0.0980 52 TRP B CE3 2038 C CZ2 . TRP B 52 ? 0.4092 0.5217 0.3832 -0.0288 -0.0165 -0.0944 52 TRP B CZ2 2039 C CZ3 . TRP B 52 ? 0.3538 0.4763 0.3886 -0.0159 -0.0406 -0.1182 52 TRP B CZ3 2040 C CH2 . TRP B 52 ? 0.3841 0.5056 0.4070 -0.0237 -0.0306 -0.1168 52 TRP B CH2 2041 N N . SER B 53 ? 0.4053 0.5072 0.3612 0.0294 -0.0474 -0.0545 53 SER B N 2042 C CA . SER B 53 ? 0.4729 0.5930 0.4398 0.0459 -0.0582 -0.0544 53 SER B CA 2043 C C . SER B 53 ? 0.4489 0.5529 0.3655 0.0612 -0.0570 -0.0321 53 SER B C 2044 O O . SER B 53 ? 0.3968 0.4862 0.3154 0.0720 -0.0552 -0.0194 53 SER B O 2045 C CB . SER B 53 ? 0.5053 0.6727 0.5004 0.0521 -0.0779 -0.0830 53 SER B CB 2046 O OG . SER B 53 ? 0.4940 0.6706 0.5460 0.0387 -0.0824 -0.1033 53 SER B OG 2047 N N . GLY B 54 ? 0.3753 0.4829 0.2485 0.0625 -0.0576 -0.0260 54 GLY B N 2048 C CA . GLY B 54 ? 0.4169 0.5101 0.2442 0.0765 -0.0595 -0.0008 54 GLY B CA 2049 C C . GLY B 54 ? 0.5105 0.5476 0.3073 0.0695 -0.0455 0.0268 54 GLY B C 2050 O O . GLY B 54 ? 0.4778 0.4964 0.2369 0.0778 -0.0475 0.0513 54 GLY B O 2051 N N . GLY B 55 ? 0.4114 0.4211 0.2251 0.0541 -0.0335 0.0238 55 GLY B N 2052 C CA . GLY B 55 ? 0.4320 0.3879 0.2217 0.0476 -0.0234 0.0440 55 GLY B CA 2053 C C . GLY B 55 ? 0.4384 0.3767 0.2076 0.0258 -0.0134 0.0532 55 GLY B C 2054 O O . GLY B 55 ? 0.4801 0.3748 0.2398 0.0164 -0.0065 0.0636 55 GLY B O 2055 N N . ASN B 56 ? 0.5089 0.4842 0.2726 0.0184 -0.0130 0.0475 56 ASN B N 2056 C CA . ASN B 56 ? 0.4929 0.4628 0.2447 -0.0025 -0.0021 0.0548 56 ASN B CA 2057 C C . ASN B 56 ? 0.4604 0.4152 0.2404 -0.0178 0.0045 0.0416 56 ASN B C 2058 O O . ASN B 56 ? 0.3996 0.3675 0.2128 -0.0141 0.0011 0.0223 56 ASN B O 2059 C CB . ASN B 56 ? 0.5069 0.5317 0.2518 -0.0036 -0.0018 0.0449 56 ASN B CB 2060 C CG . ASN B 56 ? 0.5513 0.5921 0.2558 0.0068 -0.0052 0.0672 56 ASN B CG 2061 O OD1 . ASN B 56 ? 0.6139 0.6156 0.2934 0.0068 -0.0045 0.0985 56 ASN B OD1 2062 N ND2 . ASN B 56 ? 0.5624 0.6609 0.2603 0.0167 -0.0106 0.0511 56 ASN B ND2 2063 N N . THR B 57 ? 0.4508 0.3799 0.2199 -0.0357 0.0128 0.0541 57 THR B N 2064 C CA . THR B 57 ? 0.4085 0.3279 0.2013 -0.0497 0.0170 0.0430 57 THR B CA 2065 C C . THR B 57 ? 0.4150 0.3560 0.2122 -0.0679 0.0240 0.0419 57 THR B C 2066 O O . THR B 57 ? 0.5068 0.4537 0.2819 -0.0757 0.0294 0.0587 57 THR B O 2067 C CB . THR B 57 ? 0.4790 0.3457 0.2624 -0.0533 0.0177 0.0524 57 THR B CB 2068 O OG1 . THR B 57 ? 0.5164 0.3506 0.2714 -0.0598 0.0186 0.0747 57 THR B OG1 2069 C CG2 . THR B 57 ? 0.3991 0.2552 0.1880 -0.0335 0.0131 0.0470 57 THR B CG2 2070 N N . ASP B 58 ? 0.4025 0.3587 0.2312 -0.0739 0.0240 0.0241 58 ASP B N 2071 C CA . ASP B 58 ? 0.3845 0.3605 0.2256 -0.0898 0.0298 0.0206 58 ASP B CA 2072 C C . ASP B 58 ? 0.4410 0.3900 0.2981 -0.1004 0.0281 0.0195 58 ASP B C 2073 O O . ASP B 58 ? 0.4114 0.3527 0.2862 -0.0931 0.0229 0.0110 58 ASP B O 2074 C CB . ASP B 58 ? 0.3410 0.3669 0.2107 -0.0829 0.0278 -0.0042 58 ASP B CB 2075 C CG . ASP B 58 ? 0.3295 0.3922 0.1817 -0.0700 0.0274 -0.0095 58 ASP B CG 2076 O OD1 . ASP B 58 ? 0.3603 0.4294 0.1796 -0.0746 0.0350 0.0102 58 ASP B OD1 2077 O OD2 . ASP B 58 ? 0.4442 0.5301 0.3166 -0.0559 0.0184 -0.0324 58 ASP B OD2 2078 N N . TYR B 59 ? 0.3368 0.2757 0.1889 -0.1183 0.0322 0.0294 59 TYR B N 2079 C CA . TYR B 59 ? 0.4147 0.3336 0.2795 -0.1289 0.0284 0.0271 59 TYR B CA 2080 C C . TYR B 59 ? 0.4076 0.3611 0.2999 -0.1410 0.0301 0.0198 59 TYR B C 2081 O O . TYR B 59 ? 0.3237 0.3030 0.2145 -0.1503 0.0377 0.0252 59 TYR B O 2082 C CB . TYR B 59 ? 0.4561 0.3285 0.2955 -0.1396 0.0271 0.0417 59 TYR B CB 2083 C CG . TYR B 59 ? 0.4575 0.2943 0.2719 -0.1248 0.0248 0.0475 59 TYR B CG 2084 C CD1 . TYR B 59 ? 0.4406 0.2769 0.2596 -0.1070 0.0220 0.0378 59 TYR B CD1 2085 C CD2 . TYR B 59 ? 0.5062 0.3143 0.2987 -0.1268 0.0248 0.0637 59 TYR B CD2 2086 C CE1 . TYR B 59 ? 0.4281 0.2389 0.2286 -0.0912 0.0204 0.0415 59 TYR B CE1 2087 C CE2 . TYR B 59 ? 0.5116 0.2849 0.2826 -0.1112 0.0214 0.0689 59 TYR B CE2 2088 C CZ . TYR B 59 ? 0.5309 0.3092 0.3071 -0.0918 0.0194 0.0556 59 TYR B CZ 2089 O OH . TYR B 59 ? 0.6228 0.3748 0.3838 -0.0728 0.0161 0.0583 59 TYR B OH 2090 N N . ASN B 60 ? 0.3528 0.3107 0.2714 -0.1400 0.0234 0.0095 60 ASN B N 2091 C CA . ASN B 60 ? 0.3726 0.3614 0.3215 -0.1493 0.0224 0.0024 60 ASN B CA 2092 C C . ASN B 60 ? 0.4169 0.3981 0.3555 -0.1688 0.0251 0.0145 60 ASN B C 2093 O O . ASN B 60 ? 0.3947 0.3384 0.3138 -0.1667 0.0196 0.0219 60 ASN B O 2094 C CB . ASN B 60 ? 0.3498 0.3358 0.3254 -0.1452 0.0117 -0.0040 60 ASN B CB 2095 C CG . ASN B 60 ? 0.3398 0.3654 0.3578 -0.1453 0.0083 -0.0162 60 ASN B CG 2096 O OD1 . ASN B 60 ? 0.3274 0.3850 0.3535 -0.1513 0.0154 -0.0206 60 ASN B OD1 2097 N ND2 . ASN B 60 ? 0.2805 0.3058 0.3273 -0.1379 -0.0023 -0.0200 60 ASN B ND2 2098 N N . THR B 61 ? 0.2978 0.3208 0.2561 -0.1790 0.0318 0.0128 61 THR B N 2099 C CA . THR B 61 ? 0.3624 0.3857 0.3177 -0.1907 0.0345 0.0258 61 THR B CA 2100 C C . THR B 61 ? 0.4102 0.3962 0.3637 -0.1922 0.0224 0.0291 61 THR B C 2101 O O . THR B 61 ? 0.4804 0.4390 0.4180 -0.1985 0.0223 0.0410 61 THR B O 2102 C CB . THR B 61 ? 0.3913 0.4751 0.3801 -0.1984 0.0422 0.0192 61 THR B CB 2103 O OG1 . THR B 61 ? 0.4848 0.6136 0.4709 -0.1948 0.0562 0.0138 61 THR B OG1 2104 C CG2 . THR B 61 ? 0.3406 0.4269 0.3339 -0.2122 0.0446 0.0340 61 THR B CG2 2105 N N . PRO B 62 ? 0.3913 0.3752 0.3603 -0.1870 0.0116 0.0195 62 PRO B N 2106 C CA . PRO B 62 ? 0.4219 0.3782 0.3854 -0.1908 0.0009 0.0203 62 PRO B CA 2107 C C . PRO B 62 ? 0.4691 0.3800 0.3994 -0.1830 -0.0037 0.0207 62 PRO B C 2108 O O . PRO B 62 ? 0.5600 0.4496 0.4825 -0.1858 -0.0136 0.0166 62 PRO B O 2109 C CB . PRO B 62 ? 0.3574 0.3329 0.3448 -0.1865 -0.0087 0.0113 62 PRO B CB 2110 C CG . PRO B 62 ? 0.2956 0.2856 0.2917 -0.1742 -0.0058 0.0066 62 PRO B CG 2111 C CD . PRO B 62 ? 0.2929 0.3020 0.2882 -0.1779 0.0074 0.0079 62 PRO B CD 2112 N N . PHE B 63 ? 0.4240 0.3224 0.3352 -0.1743 0.0028 0.0239 63 PHE B N 2113 C CA . PHE B 63 ? 0.4558 0.3156 0.3385 -0.1650 -0.0006 0.0227 63 PHE B CA 2114 C C . PHE B 63 ? 0.5104 0.3434 0.3725 -0.1642 0.0043 0.0322 63 PHE B C 2115 O O . PHE B 63 ? 0.6055 0.4022 0.4447 -0.1566 0.0011 0.0307 63 PHE B O 2116 C CB . PHE B 63 ? 0.4404 0.3069 0.3222 -0.1521 0.0003 0.0181 63 PHE B CB 2117 C CG . PHE B 63 ? 0.4761 0.3618 0.3768 -0.1519 -0.0068 0.0133 63 PHE B CG 2118 C CD1 . PHE B 63 ? 0.5744 0.4423 0.4590 -0.1548 -0.0158 0.0105 63 PHE B CD1 2119 C CD2 . PHE B 63 ? 0.4701 0.3898 0.4031 -0.1500 -0.0060 0.0112 63 PHE B CD2 2120 C CE1 . PHE B 63 ? 0.5419 0.4277 0.4403 -0.1570 -0.0242 0.0101 63 PHE B CE1 2121 C CE2 . PHE B 63 ? 0.4527 0.3871 0.4060 -0.1492 -0.0146 0.0100 63 PHE B CE2 2122 C CZ . PHE B 63 ? 0.4730 0.3915 0.4078 -0.1533 -0.0237 0.0118 63 PHE B CZ 2123 N N . THR B 64 ? 0.4617 0.3129 0.3308 -0.1719 0.0119 0.0430 64 THR B N 2124 C CA . THR B 64 ? 0.5617 0.3910 0.4124 -0.1706 0.0161 0.0576 64 THR B CA 2125 C C . THR B 64 ? 0.6340 0.4163 0.4755 -0.1731 0.0081 0.0615 64 THR B C 2126 O O . THR B 64 ? 0.7229 0.4734 0.5458 -0.1644 0.0074 0.0692 64 THR B O 2127 C CB . THR B 64 ? 0.6465 0.5095 0.5057 -0.1814 0.0266 0.0726 64 THR B CB 2128 O OG1 . THR B 64 ? 0.6669 0.5516 0.5519 -0.1968 0.0264 0.0725 64 THR B OG1 2129 C CG2 . THR B 64 ? 0.6796 0.5832 0.5377 -0.1760 0.0352 0.0677 64 THR B CG2 2130 N N . SER B 65 ? 0.6177 0.3950 0.4740 -0.1842 0.0007 0.0552 65 SER B N 2131 C CA . SER B 65 ? 0.6732 0.4061 0.5273 -0.1898 -0.0086 0.0557 65 SER B CA 2132 C C . SER B 65 ? 0.6299 0.3239 0.4604 -0.1766 -0.0178 0.0390 65 SER B C 2133 O O . SER B 65 ? 0.7385 0.3888 0.5629 -0.1760 -0.0260 0.0363 65 SER B O 2134 C CB . SER B 65 ? 0.7208 0.4645 0.6022 -0.2081 -0.0143 0.0526 65 SER B CB 2135 O OG . SER B 65 ? 0.8843 0.6693 0.7880 -0.2202 -0.0041 0.0663 65 SER B OG 2136 N N . ARG B 66 ? 0.5445 0.2536 0.3631 -0.1659 -0.0165 0.0275 66 ARG B N 2137 C CA . ARG B 66 ? 0.6323 0.3088 0.4259 -0.1551 -0.0238 0.0111 66 ARG B CA 2138 C C . ARG B 66 ? 0.6111 0.2901 0.3849 -0.1386 -0.0164 0.0092 66 ARG B C 2139 O O . ARG B 66 ? 0.6828 0.3431 0.4339 -0.1295 -0.0193 -0.0045 66 ARG B O 2140 C CB . ARG B 66 ? 0.6173 0.3026 0.4152 -0.1633 -0.0339 -0.0037 66 ARG B CB 2141 C CG . ARG B 66 ? 0.6112 0.3445 0.4247 -0.1671 -0.0305 -0.0018 66 ARG B CG 2142 C CD . ARG B 66 ? 0.6807 0.4211 0.5002 -0.1767 -0.0436 -0.0137 66 ARG B CD 2143 N NE . ARG B 66 ? 0.6412 0.4212 0.4729 -0.1778 -0.0438 -0.0121 66 ARG B NE 2144 C CZ . ARG B 66 ? 0.6227 0.4040 0.4348 -0.1754 -0.0518 -0.0204 66 ARG B CZ 2145 N NH1 . ARG B 66 ? 0.5122 0.2608 0.2872 -0.1692 -0.0590 -0.0355 66 ARG B NH1 2146 N NH2 . ARG B 66 ? 0.5364 0.3532 0.3654 -0.1777 -0.0539 -0.0146 66 ARG B NH2 2147 N N . LEU B 67 ? 0.4877 0.1892 0.2692 -0.1347 -0.0067 0.0217 67 LEU B N 2148 C CA . LEU B 67 ? 0.5373 0.2452 0.3085 -0.1207 0.0002 0.0210 67 LEU B CA 2149 C C . LEU B 67 ? 0.6011 0.2881 0.3585 -0.1076 0.0042 0.0308 67 LEU B C 2150 O O . LEU B 67 ? 0.6402 0.3350 0.4045 -0.1122 0.0057 0.0439 67 LEU B O 2151 C CB . LEU B 67 ? 0.5285 0.2873 0.3261 -0.1252 0.0054 0.0235 67 LEU B CB 2152 C CG . LEU B 67 ? 0.5897 0.3715 0.3951 -0.1114 0.0106 0.0220 67 LEU B CG 2153 C CD1 . LEU B 67 ? 0.6386 0.4131 0.4324 -0.1009 0.0087 0.0146 67 LEU B CD1 2154 C CD2 . LEU B 67 ? 0.5492 0.3724 0.3865 -0.1190 0.0116 0.0217 67 LEU B CD2 2155 N N . SER B 68 ? 0.5693 0.2491 0.3160 -0.0847 0.0053 0.0233 68 SER B N 2156 C CA . SER B 68 ? 0.5633 0.2374 0.3044 -0.0659 0.0074 0.0308 68 SER B CA 2157 C C . SER B 68 ? 0.5609 0.2750 0.3150 -0.0481 0.0135 0.0253 68 SER B C 2158 O O . SER B 68 ? 0.5640 0.2866 0.3180 -0.0399 0.0157 0.0148 68 SER B O 2159 C CB . SER B 68 ? 0.6215 0.2433 0.3429 -0.0517 0.0006 0.0259 68 SER B CB 2160 O OG . SER B 68 ? 0.8414 0.4202 0.5567 -0.0707 -0.0078 0.0283 68 SER B OG 2161 N N . ILE B 69 ? 0.4622 0.2041 0.2283 -0.0426 0.0157 0.0329 69 ILE B N 2162 C CA . ILE B 69 ? 0.4829 0.2603 0.2676 -0.0266 0.0191 0.0280 69 ILE B CA 2163 C C . ILE B 69 ? 0.5250 0.2995 0.3045 -0.0057 0.0165 0.0323 69 ILE B C 2164 O O . ILE B 69 ? 0.5202 0.2924 0.2920 -0.0066 0.0126 0.0425 69 ILE B O 2165 C CB . ILE B 69 ? 0.4455 0.2665 0.2593 -0.0367 0.0203 0.0268 69 ILE B CB 2166 C CG1 . ILE B 69 ? 0.4066 0.2317 0.2293 -0.0549 0.0210 0.0241 69 ILE B CG1 2167 C CG2 . ILE B 69 ? 0.3652 0.2196 0.2056 -0.0233 0.0218 0.0227 69 ILE B CG2 2168 C CD1 . ILE B 69 ? 0.3574 0.2192 0.2123 -0.0638 0.0199 0.0208 69 ILE B CD1 2169 N N . ASN B 70 ? 0.5479 0.3274 0.3317 0.0144 0.0187 0.0257 70 ASN B N 2170 C CA . ASN B 70 ? 0.5272 0.3110 0.3126 0.0376 0.0149 0.0284 70 ASN B CA 2171 C C . ASN B 70 ? 0.5382 0.3695 0.3544 0.0501 0.0196 0.0220 70 ASN B C 2172 O O . ASN B 70 ? 0.5552 0.4092 0.3875 0.0421 0.0270 0.0180 70 ASN B O 2173 C CB . ASN B 70 ? 0.5181 0.2541 0.2804 0.0549 0.0112 0.0265 70 ASN B CB 2174 C CG . ASN B 70 ? 0.6891 0.3746 0.4282 0.0411 0.0044 0.0369 70 ASN B CG 2175 O OD1 . ASN B 70 ? 0.8560 0.5268 0.5866 0.0447 -0.0024 0.0529 70 ASN B OD1 2176 N ND2 . ASN B 70 ? 0.7723 0.4339 0.5023 0.0240 0.0054 0.0303 70 ASN B ND2 2177 N N . LYS B 71 ? 0.4859 0.3340 0.3123 0.0692 0.0145 0.0237 71 LYS B N 2178 C CA . LYS B 71 ? 0.4034 0.3005 0.2659 0.0799 0.0180 0.0187 71 LYS B CA 2179 C C . LYS B 71 ? 0.4265 0.3311 0.2937 0.1086 0.0127 0.0181 71 LYS B C 2180 O O . LYS B 71 ? 0.4601 0.3336 0.3041 0.1200 0.0032 0.0243 71 LYS B O 2181 C CB . LYS B 71 ? 0.3927 0.3295 0.2871 0.0650 0.0135 0.0180 71 LYS B CB 2182 C CG . LYS B 71 ? 0.4374 0.3799 0.3252 0.0704 0.0004 0.0198 71 LYS B CG 2183 C CD . LYS B 71 ? 0.3949 0.3786 0.3161 0.0582 -0.0060 0.0112 71 LYS B CD 2184 C CE . LYS B 71 ? 0.3792 0.3765 0.2878 0.0664 -0.0196 0.0101 71 LYS B CE 2185 N NZ . LYS B 71 ? 0.3633 0.4084 0.3137 0.0630 -0.0297 -0.0057 71 LYS B NZ 2186 N N . ASP B 72 ? 0.4101 0.3593 0.3113 0.1195 0.0189 0.0132 72 ASP B N 2187 C CA . ASP B 72 ? 0.4241 0.3975 0.3433 0.1471 0.0141 0.0110 72 ASP B CA 2188 C C . ASP B 72 ? 0.3906 0.4246 0.3596 0.1390 0.0112 0.0101 72 ASP B C 2189 O O . ASP B 72 ? 0.3950 0.4660 0.3973 0.1308 0.0226 0.0098 72 ASP B O 2190 C CB . ASP B 72 ? 0.4695 0.4478 0.3892 0.1680 0.0270 0.0030 72 ASP B CB 2191 C CG . ASP B 72 ? 0.5420 0.5449 0.4818 0.2012 0.0222 -0.0010 72 ASP B CG 2192 O OD1 . ASP B 72 ? 0.5509 0.5880 0.5189 0.2047 0.0109 0.0028 72 ASP B OD1 2193 O OD2 . ASP B 72 ? 0.6044 0.5946 0.5330 0.2258 0.0285 -0.0107 72 ASP B OD2 2194 N N . ASN B 73 ? 0.6142 0.4427 0.4129 0.1425 -0.1660 -0.0357 73 ASN B N 2195 C CA . ASN B 73 ? 0.4903 0.3646 0.3016 0.1374 -0.1607 -0.0403 73 ASN B CA 2196 C C . ASN B 73 ? 0.6008 0.5310 0.4605 0.1601 -0.1685 -0.0610 73 ASN B C 2197 O O . ASN B 73 ? 0.5582 0.5411 0.4458 0.1492 -0.1520 -0.0690 73 ASN B O 2198 C CB . ASN B 73 ? 0.5823 0.4291 0.3521 0.1294 -0.1798 -0.0236 73 ASN B CB 2199 C CG . ASN B 73 ? 0.6166 0.4477 0.3448 0.0992 -0.1614 -0.0091 73 ASN B CG 2200 O OD1 . ASN B 73 ? 0.5037 0.3546 0.2439 0.0866 -0.1341 -0.0163 73 ASN B OD1 2201 N ND2 . ASN B 73 ? 0.5993 0.4007 0.2782 0.0869 -0.1777 0.0104 73 ASN B ND2 2202 N N . SER B 74 ? 0.6236 0.5445 0.4946 0.1905 -0.1967 -0.0701 74 SER B N 2203 C CA . SER B 74 ? 0.6090 0.5983 0.5308 0.2155 -0.2055 -0.0945 74 SER B CA 2204 C C . SER B 74 ? 0.5211 0.5771 0.4818 0.2119 -0.1769 -0.1128 74 SER B C 2205 O O . SER B 74 ? 0.4631 0.5950 0.4589 0.2044 -0.1673 -0.1219 74 SER B O 2206 C CB . SER B 74 ? 0.7241 0.6853 0.6531 0.2464 -0.2351 -0.1070 74 SER B CB 2207 O OG . SER B 74 ? 0.8344 0.7244 0.7356 0.2489 -0.2432 -0.1015 74 SER B OG 2208 N N . LYS B 75 ? 0.4586 0.4871 0.4096 0.2119 -0.1648 -0.1154 75 LYS B N 2209 C CA . LYS B 75 ? 0.4131 0.5017 0.3924 0.2064 -0.1391 -0.1310 75 LYS B CA 2210 C C . LYS B 75 ? 0.3815 0.4776 0.3507 0.1659 -0.1117 -0.1124 75 LYS B C 2211 O O . LYS B 75 ? 0.3303 0.4714 0.3160 0.1531 -0.0924 -0.1180 75 LYS B O 2212 C CB . LYS B 75 ? 0.4625 0.5176 0.4355 0.2262 -0.1423 -0.1454 75 LYS B CB 2213 C CG . LYS B 75 ? 0.5141 0.5677 0.5041 0.2673 -0.1714 -0.1728 75 LYS B CG 2214 C CD . LYS B 75 ? 0.6902 0.7082 0.6689 0.2734 -0.1734 -0.1856 75 LYS B CD 2215 C CE . LYS B 75 ? 0.8120 0.8208 0.8001 0.3010 -0.2035 -0.2113 75 LYS B CE 2216 N NZ . LYS B 75 ? 0.8960 0.8766 0.8763 0.3069 -0.2103 -0.2249 75 LYS B NZ 2217 N N . SER B 76 ? 0.4173 0.4699 0.3583 0.1468 -0.1132 -0.0920 76 SER B N 2218 C CA . SER B 76 ? 0.3859 0.4357 0.3185 0.1150 -0.0953 -0.0791 76 SER B CA 2219 C C . SER B 76 ? 0.4158 0.4451 0.3399 0.1053 -0.0780 -0.0766 76 SER B C 2220 O O . SER B 76 ? 0.4551 0.5013 0.3871 0.0838 -0.0656 -0.0720 76 SER B O 2221 C CB . SER B 76 ? 0.3085 0.4221 0.2718 0.0971 -0.0916 -0.0806 76 SER B CB 2222 O OG . SER B 76 ? 0.3256 0.4489 0.2920 0.0957 -0.1074 -0.0786 76 SER B OG 2223 N N . GLN B 77 ? 0.4252 0.4140 0.3329 0.1197 -0.0819 -0.0786 77 GLN B N 2224 C CA . GLN B 77 ? 0.4727 0.4430 0.3734 0.1107 -0.0681 -0.0774 77 GLN B CA 2225 C C . GLN B 77 ? 0.4768 0.3908 0.3454 0.0974 -0.0662 -0.0618 77 GLN B C 2226 O O . GLN B 77 ? 0.5045 0.3823 0.3488 0.1010 -0.0801 -0.0528 77 GLN B O 2227 C CB . GLN B 77 ? 0.5233 0.4986 0.4340 0.1344 -0.0743 -0.0959 77 GLN B CB 2228 C CG . GLN B 77 ? 0.5250 0.5790 0.4706 0.1469 -0.0714 -0.1167 77 GLN B CG 2229 C CD . GLN B 77 ? 0.5106 0.5799 0.4676 0.1753 -0.0769 -0.1446 77 GLN B CD 2230 O OE1 . GLN B 77 ? 0.5987 0.6284 0.5515 0.2053 -0.1008 -0.1571 77 GLN B OE1 2231 N NE2 . GLN B 77 ? 0.4035 0.5286 0.3726 0.1659 -0.0586 -0.1555 77 GLN B NE2 2232 N N . VAL B 78 ? 0.4304 0.3428 0.2987 0.0796 -0.0504 -0.0578 78 VAL B N 2233 C CA . VAL B 78 ? 0.4272 0.3031 0.2717 0.0659 -0.0457 -0.0467 78 VAL B CA 2234 C C . VAL B 78 ? 0.4768 0.3366 0.3225 0.0640 -0.0419 -0.0490 78 VAL B C 2235 O O . VAL B 78 ? 0.5135 0.3989 0.3781 0.0631 -0.0337 -0.0572 78 VAL B O 2236 C CB . VAL B 78 ? 0.4436 0.3345 0.2905 0.0496 -0.0339 -0.0451 78 VAL B CB 2237 C CG1 . VAL B 78 ? 0.3422 0.2158 0.1704 0.0353 -0.0259 -0.0379 78 VAL B CG1 2238 C CG2 . VAL B 78 ? 0.3317 0.2351 0.1746 0.0519 -0.0407 -0.0466 78 VAL B CG2 2239 N N . PHE B 79 ? 0.4377 0.2542 0.2602 0.0598 -0.0508 -0.0397 79 PHE B N 2240 C CA . PHE B 79 ? 0.4504 0.2440 0.2721 0.0577 -0.0527 -0.0427 79 PHE B CA 2241 C C . PHE B 79 ? 0.4511 0.2345 0.2627 0.0309 -0.0423 -0.0297 79 PHE B C 2242 O O . PHE B 79 ? 0.5086 0.2727 0.2967 0.0137 -0.0458 -0.0130 79 PHE B O 2243 C CB . PHE B 79 ? 0.4782 0.2246 0.2865 0.0752 -0.0794 -0.0461 79 PHE B CB 2244 C CG . PHE B 79 ? 0.5859 0.3511 0.4095 0.1060 -0.0922 -0.0636 79 PHE B CG 2245 C CD1 . PHE B 79 ? 0.5637 0.3807 0.4158 0.1228 -0.0829 -0.0875 79 PHE B CD1 2246 C CD2 . PHE B 79 ? 0.6111 0.3493 0.4205 0.1162 -0.1146 -0.0558 79 PHE B CD2 2247 C CE1 . PHE B 79 ? 0.5216 0.3729 0.3933 0.1504 -0.0930 -0.1066 79 PHE B CE1 2248 C CE2 . PHE B 79 ? 0.5732 0.3360 0.4031 0.1474 -0.1287 -0.0749 79 PHE B CE2 2249 C CZ . PHE B 79 ? 0.5466 0.3709 0.4106 0.1651 -0.1165 -0.1020 79 PHE B CZ 2250 N N . PHE B 80 ? 0.4314 0.2348 0.2609 0.0254 -0.0305 -0.0369 80 PHE B N 2251 C CA . PHE B 80 ? 0.4688 0.2756 0.2988 0.0031 -0.0209 -0.0294 80 PHE B CA 2252 C C . PHE B 80 ? 0.4593 0.2325 0.2827 -0.0020 -0.0312 -0.0291 80 PHE B C 2253 O O . PHE B 80 ? 0.4913 0.2598 0.3213 0.0139 -0.0374 -0.0433 80 PHE B O 2254 C CB . PHE B 80 ? 0.4446 0.2909 0.3007 0.0022 -0.0081 -0.0381 80 PHE B CB 2255 C CG . PHE B 80 ? 0.4209 0.2809 0.2880 -0.0144 -0.0006 -0.0369 80 PHE B CG 2256 C CD1 . PHE B 80 ? 0.3212 0.1738 0.1957 -0.0199 -0.0033 -0.0388 80 PHE B CD1 2257 C CD2 . PHE B 80 ? 0.4210 0.3096 0.2934 -0.0223 0.0085 -0.0382 80 PHE B CD2 2258 C CE1 . PHE B 80 ? 0.3424 0.2138 0.2323 -0.0341 0.0015 -0.0391 80 PHE B CE1 2259 C CE2 . PHE B 80 ? 0.3386 0.2534 0.2287 -0.0338 0.0150 -0.0425 80 PHE B CE2 2260 C CZ . PHE B 80 ? 0.3592 0.2646 0.2597 -0.0402 0.0107 -0.0416 80 PHE B CZ 2261 N N . LYS B 81 ? 0.4560 0.2102 0.2652 -0.0261 -0.0342 -0.0141 81 LYS B N 2262 C CA . LYS B 81 ? 0.5084 0.2251 0.3107 -0.0358 -0.0483 -0.0123 81 LYS B CA 2263 C C . LYS B 81 ? 0.5804 0.3145 0.3849 -0.0697 -0.0396 0.0017 81 LYS B C 2264 O O . LYS B 81 ? 0.6256 0.3766 0.4182 -0.0915 -0.0331 0.0179 81 LYS B O 2265 C CB . LYS B 81 ? 0.5222 0.1736 0.2977 -0.0298 -0.0780 -0.0061 81 LYS B CB 2266 C CG . LYS B 81 ? 0.7497 0.3492 0.5169 -0.0350 -0.1012 -0.0095 81 LYS B CG 2267 C CD . LYS B 81 ? 0.8102 0.3540 0.5615 -0.0169 -0.1359 -0.0103 81 LYS B CD 2268 C CE . LYS B 81 ? 0.8107 0.3345 0.5695 -0.0085 -0.1564 -0.0228 81 LYS B CE 2269 N NZ . LYS B 81 ? 0.8551 0.3437 0.5967 -0.0455 -0.1737 0.0030 81 LYS B NZ 2270 N N . MET B 82 ? 0.5425 0.2825 0.3630 -0.0749 -0.0389 -0.0061 82 MET B N 2271 C CA . MET B 82 ? 0.5575 0.3231 0.3880 -0.1062 -0.0322 0.0037 82 MET B CA 2272 C C . MET B 82 ? 0.5912 0.3118 0.4139 -0.1202 -0.0528 0.0064 82 MET B C 2273 O O . MET B 82 ? 0.5366 0.2366 0.3628 -0.0998 -0.0618 -0.0110 82 MET B O 2274 C CB . MET B 82 ? 0.5293 0.3564 0.3954 -0.0990 -0.0134 -0.0107 82 MET B CB 2275 C CG . MET B 82 ? 0.5534 0.4296 0.4397 -0.1258 -0.0036 -0.0067 82 MET B CG 2276 S SD . MET B 82 ? 0.5273 0.4688 0.4601 -0.1070 0.0088 -0.0296 82 MET B SD 2277 C CE . MET B 82 ? 0.6754 0.6546 0.6063 -0.0962 0.0238 -0.0359 82 MET B CE 2278 N N . ASN B 83 ? 0.5632 0.2719 0.3729 -0.1579 -0.0613 0.0283 83 ASN B N 2279 C CA . ASN B 83 ? 0.6557 0.3140 0.4553 -0.1760 -0.0870 0.0342 83 ASN B CA 2280 C C . ASN B 83 ? 0.6535 0.3540 0.4819 -0.1931 -0.0788 0.0286 83 ASN B C 2281 O O . ASN B 83 ? 0.5198 0.2929 0.3761 -0.1995 -0.0547 0.0256 83 ASN B O 2282 C CB . ASN B 83 ? 0.7393 0.3752 0.5140 -0.2056 -0.1042 0.0639 83 ASN B CB 2283 C CG . ASN B 83 ? 0.9820 0.5707 0.7283 -0.1878 -0.1211 0.0703 83 ASN B CG 2284 O OD1 . ASN B 83 ? 1.0750 0.6271 0.8210 -0.1484 -0.1350 0.0500 83 ASN B OD1 2285 N ND2 . ASN B 83 ? 1.0657 0.6662 0.7900 -0.2160 -0.1197 0.0966 83 ASN B ND2 2286 N N . SER B 84 ? 0.6481 0.3186 0.4770 -0.1878 -0.0984 0.0234 84 SER B N 2287 C CA . SER B 84 ? 0.6628 0.3633 0.5153 -0.2055 -0.0981 0.0211 84 SER B CA 2288 C C . SER B 84 ? 0.6198 0.3800 0.5046 -0.2019 -0.0777 0.0058 84 SER B C 2289 O O . SER B 84 ? 0.6123 0.4331 0.5227 -0.2278 -0.0646 0.0119 84 SER B O 2290 C CB . SER B 84 ? 0.7764 0.4967 0.6277 -0.2489 -0.1014 0.0478 84 SER B CB 2291 O OG . SER B 84 ? 0.7901 0.5727 0.6501 -0.2699 -0.0771 0.0584 84 SER B OG 2292 N N . LEU B 85 ? 0.6147 0.3657 0.4998 -0.1693 -0.0768 -0.0151 85 LEU B N 2293 C CA . LEU B 85 ? 0.5179 0.3258 0.4347 -0.1557 -0.0626 -0.0272 85 LEU B CA 2294 C C . LEU B 85 ? 0.5553 0.3774 0.4912 -0.1708 -0.0741 -0.0316 85 LEU B C 2295 O O . LEU B 85 ? 0.6984 0.4849 0.6205 -0.1725 -0.0901 -0.0329 85 LEU B O 2296 C CB . LEU B 85 ? 0.4898 0.2891 0.3972 -0.1214 -0.0596 -0.0415 85 LEU B CB 2297 C CG . LEU B 85 ? 0.5058 0.3240 0.4145 -0.1047 -0.0434 -0.0398 85 LEU B CG 2298 C CD1 . LEU B 85 ? 0.5102 0.2906 0.3919 -0.1057 -0.0462 -0.0311 85 LEU B CD1 2299 C CD2 . LEU B 85 ? 0.5728 0.3986 0.4802 -0.0801 -0.0413 -0.0506 85 LEU B CD2 2300 N N . GLN B 86 ? 0.4225 0.3064 0.3968 -0.1714 -0.0652 -0.0355 86 GLN B N 2301 C CA . GLN B 86 ? 0.4336 0.3361 0.4306 -0.1797 -0.0788 -0.0418 86 GLN B CA 2302 C C . GLN B 86 ? 0.4589 0.3816 0.4716 -0.1524 -0.0803 -0.0530 86 GLN B C 2303 O O . GLN B 86 ? 0.5184 0.4402 0.5247 -0.1314 -0.0706 -0.0547 86 GLN B O 2304 C CB . GLN B 86 ? 0.4413 0.4042 0.4762 -0.2084 -0.0749 -0.0365 86 GLN B CB 2305 C CG . GLN B 86 ? 0.5392 0.4866 0.5559 -0.2425 -0.0747 -0.0172 86 GLN B CG 2306 C CD . GLN B 86 ? 0.6617 0.5434 0.6501 -0.2432 -0.0951 -0.0121 86 GLN B CD 2307 O OE1 . GLN B 86 ? 0.6784 0.5552 0.6749 -0.2359 -0.1076 -0.0226 86 GLN B OE1 2308 N NE2 . GLN B 86 ? 0.7098 0.5422 0.6645 -0.2512 -0.1011 0.0026 86 GLN B NE2 2309 N N . SER B 87 ? 0.4438 0.3807 0.4748 -0.1556 -0.0967 -0.0581 87 SER B N 2310 C CA . SER B 87 ? 0.4372 0.3802 0.4750 -0.1353 -0.1075 -0.0629 87 SER B CA 2311 C C . SER B 87 ? 0.3285 0.3044 0.3958 -0.1159 -0.1004 -0.0667 87 SER B C 2312 O O . SER B 87 ? 0.3676 0.3255 0.4203 -0.1000 -0.1035 -0.0646 87 SER B O 2313 C CB . SER B 87 ? 0.4859 0.4429 0.5431 -0.1440 -0.1309 -0.0661 87 SER B CB 2314 O OG . SER B 87 ? 0.6110 0.5314 0.6275 -0.1449 -0.1371 -0.0652 87 SER B OG 2315 N N . ASN B 88 ? 0.3845 0.4110 0.4916 -0.1187 -0.0919 -0.0737 88 ASN B N 2316 C CA . ASN B 88 ? 0.3856 0.4442 0.5238 -0.0951 -0.0906 -0.0855 88 ASN B CA 2317 C C . ASN B 88 ? 0.3621 0.4053 0.4757 -0.0861 -0.0708 -0.0827 88 ASN B C 2318 O O . ASN B 88 ? 0.4253 0.4919 0.5607 -0.0665 -0.0692 -0.0948 88 ASN B O 2319 C CB . ASN B 88 ? 0.3512 0.4858 0.5455 -0.0969 -0.0887 -0.1021 88 ASN B CB 2320 C CG . ASN B 88 ? 0.4519 0.6269 0.6450 -0.1189 -0.0612 -0.0997 88 ASN B CG 2321 O OD1 . ASN B 88 ? 0.4796 0.6154 0.6290 -0.1319 -0.0471 -0.0839 88 ASN B OD1 2322 N ND2 . ASN B 88 ? 0.4956 0.7554 0.7381 -0.1243 -0.0555 -0.1157 88 ASN B ND2 2323 N N . ASP B 89 ? 0.3768 0.3791 0.4467 -0.0973 -0.0600 -0.0697 89 ASP B N 2324 C CA . ASP B 89 ? 0.3971 0.3778 0.4407 -0.0868 -0.0467 -0.0659 89 ASP B CA 2325 C C . ASP B 89 ? 0.3995 0.3461 0.4220 -0.0729 -0.0572 -0.0624 89 ASP B C 2326 O O . ASP B 89 ? 0.2867 0.2198 0.2916 -0.0635 -0.0494 -0.0599 89 ASP B O 2327 C CB . ASP B 89 ? 0.3306 0.2839 0.3405 -0.1030 -0.0356 -0.0551 89 ASP B CB 2328 C CG . ASP B 89 ? 0.4037 0.3960 0.4268 -0.1241 -0.0233 -0.0515 89 ASP B CG 2329 O OD1 . ASP B 89 ? 0.4202 0.4614 0.4661 -0.1160 -0.0116 -0.0609 89 ASP B OD1 2330 O OD2 . ASP B 89 ? 0.3729 0.3497 0.3826 -0.1507 -0.0272 -0.0400 89 ASP B OD2 2331 N N . THR B 90 ? 0.3907 0.3287 0.4139 -0.0755 -0.0759 -0.0607 90 THR B N 2332 C CA . THR B 90 ? 0.3839 0.3026 0.3884 -0.0700 -0.0888 -0.0535 90 THR B CA 2333 C C . THR B 90 ? 0.3351 0.2614 0.3629 -0.0556 -0.0968 -0.0555 90 THR B C 2334 O O . THR B 90 ? 0.2882 0.2340 0.3542 -0.0466 -0.1102 -0.0657 90 THR B O 2335 C CB . THR B 90 ? 0.3199 0.2330 0.3208 -0.0792 -0.1119 -0.0489 90 THR B CB 2336 O OG1 . THR B 90 ? 0.4210 0.3233 0.3968 -0.0909 -0.1072 -0.0513 90 THR B OG1 2337 C CG2 . THR B 90 ? 0.3333 0.2325 0.3108 -0.0816 -0.1271 -0.0356 90 THR B CG2 2338 N N . ALA B 91 ? 0.2554 0.3385 0.2189 -0.0472 0.0278 0.0054 91 ALA B N 2339 C CA . ALA B 91 ? 0.2989 0.3891 0.2779 -0.0270 0.0259 0.0085 91 ALA B CA 2340 C C . ALA B 91 ? 0.2854 0.3408 0.2712 -0.0118 0.0231 0.0088 91 ALA B C 2341 O O . ALA B 91 ? 0.3287 0.3548 0.3069 -0.0150 0.0222 0.0071 91 ALA B O 2342 C CB . ALA B 91 ? 0.3055 0.3980 0.2763 -0.0331 0.0253 0.0100 91 ALA B CB 2343 N N . ILE B 92 ? 0.2578 0.3177 0.2552 0.0045 0.0224 0.0108 92 ILE B N 2344 C CA . ILE B 92 ? 0.2269 0.2595 0.2283 0.0153 0.0199 0.0109 92 ILE B CA 2345 C C . ILE B 92 ? 0.2549 0.2718 0.2487 0.0130 0.0178 0.0125 92 ILE B C 2346 O O . ILE B 92 ? 0.2143 0.2449 0.2074 0.0129 0.0186 0.0144 92 ILE B O 2347 C CB . ILE B 92 ? 0.2194 0.2598 0.2309 0.0304 0.0212 0.0116 92 ILE B CB 2348 C CG1 . ILE B 92 ? 0.2493 0.3025 0.2666 0.0336 0.0233 0.0102 92 ILE B CG1 2349 C CG2 . ILE B 92 ? 0.1602 0.1775 0.1738 0.0370 0.0189 0.0110 92 ILE B CG2 2350 C CD1 . ILE B 92 ? 0.3551 0.4180 0.3743 0.0476 0.0264 0.0115 92 ILE B CD1 2351 N N . TYR B 93 ? 0.2854 0.2743 0.2722 0.0129 0.0152 0.0120 93 TYR B N 2352 C CA . TYR B 93 ? 0.2542 0.2265 0.2321 0.0123 0.0130 0.0139 93 TYR B CA 2353 C C . TYR B 93 ? 0.3279 0.2948 0.3149 0.0251 0.0106 0.0144 93 TYR B C 2354 O O . TYR B 93 ? 0.3205 0.2835 0.3133 0.0323 0.0096 0.0128 93 TYR B O 2355 C CB . TYR B 93 ? 0.2579 0.2010 0.2144 0.0043 0.0125 0.0135 93 TYR B CB 2356 C CG . TYR B 93 ? 0.2951 0.2422 0.2362 -0.0145 0.0155 0.0125 93 TYR B CG 2357 C CD1 . TYR B 93 ? 0.2728 0.2341 0.2149 -0.0226 0.0183 0.0101 93 TYR B CD1 2358 C CD2 . TYR B 93 ? 0.3043 0.2436 0.2286 -0.0263 0.0158 0.0136 93 TYR B CD2 2359 C CE1 . TYR B 93 ? 0.3483 0.3191 0.2747 -0.0432 0.0214 0.0086 93 TYR B CE1 2360 C CE2 . TYR B 93 ? 0.3055 0.2520 0.2130 -0.0474 0.0191 0.0119 93 TYR B CE2 2361 C CZ . TYR B 93 ? 0.3774 0.3415 0.2860 -0.0565 0.0219 0.0093 93 TYR B CZ 2362 O OH . TYR B 93 ? 0.4438 0.4206 0.3342 -0.0806 0.0255 0.0071 93 TYR B OH 2363 N N . TYR B 94 ? 0.2533 0.2232 0.2408 0.0265 0.0099 0.0164 94 TYR B N 2364 C CA . TYR B 94 ? 0.2695 0.2373 0.2629 0.0348 0.0083 0.0166 94 TYR B CA 2365 C C . TYR B 94 ? 0.3001 0.2565 0.2852 0.0343 0.0054 0.0188 94 TYR B C 2366 O O . TYR B 94 ? 0.2854 0.2394 0.2626 0.0274 0.0058 0.0205 94 TYR B O 2367 C CB . TYR B 94 ? 0.1781 0.1583 0.1767 0.0376 0.0112 0.0167 94 TYR B CB 2368 C CG . TYR B 94 ? 0.2163 0.2085 0.2189 0.0405 0.0151 0.0157 94 TYR B CG 2369 C CD1 . TYR B 94 ? 0.2389 0.2461 0.2399 0.0382 0.0175 0.0169 94 TYR B CD1 2370 C CD2 . TYR B 94 ? 0.2031 0.1937 0.2087 0.0457 0.0168 0.0137 94 TYR B CD2 2371 C CE1 . TYR B 94 ? 0.2800 0.3013 0.2830 0.0441 0.0212 0.0166 94 TYR B CE1 2372 C CE2 . TYR B 94 ? 0.2001 0.1982 0.2056 0.0504 0.0208 0.0133 94 TYR B CE2 2373 C CZ . TYR B 94 ? 0.2330 0.2469 0.2375 0.0512 0.0229 0.0151 94 TYR B CZ 2374 O OH . TYR B 94 ? 0.2632 0.2875 0.2662 0.0588 0.0269 0.0153 94 TYR B OH 2375 N N . CYS B 95 ? 0.2317 0.1851 0.2186 0.0415 0.0028 0.0186 95 CYS B N 2376 C CA . CYS B 95 ? 0.2530 0.2027 0.2347 0.0431 0.0003 0.0209 95 CYS B CA 2377 C C . CYS B 95 ? 0.2618 0.2252 0.2512 0.0422 0.0016 0.0203 95 CYS B C 2378 O O . CYS B 95 ? 0.2830 0.2546 0.2787 0.0427 0.0039 0.0178 95 CYS B O 2379 C CB . CYS B 95 ? 0.2945 0.2365 0.2698 0.0528 -0.0033 0.0217 95 CYS B CB 2380 S SG . CYS B 95 ? 0.3968 0.3579 0.3839 0.0617 -0.0045 0.0186 95 CYS B SG 2381 N N . ALA B 96 ? 0.2927 0.2553 0.2778 0.0396 0.0009 0.0224 96 ALA B N 2382 C CA . ALA B 96 ? 0.2555 0.2256 0.2421 0.0365 0.0034 0.0216 96 ALA B CA 2383 C C . ALA B 96 ? 0.2773 0.2484 0.2597 0.0348 0.0011 0.0236 96 ALA B C 2384 O O . ALA B 96 ? 0.2895 0.2529 0.2666 0.0356 -0.0017 0.0263 96 ALA B O 2385 C CB . ALA B 96 ? 0.2724 0.2417 0.2568 0.0340 0.0081 0.0219 96 ALA B CB 2386 N N . ARG B 97 ? 0.3010 0.2797 0.2824 0.0310 0.0028 0.0220 97 ARG B N 2387 C CA . ARG B 97 ? 0.2696 0.2527 0.2467 0.0274 0.0012 0.0236 97 ARG B CA 2388 C C . ARG B 97 ? 0.3304 0.3075 0.2994 0.0196 0.0066 0.0229 97 ARG B C 2389 O O . ARG B 97 ? 0.3523 0.3247 0.3159 0.0169 0.0118 0.0202 97 ARG B O 2390 C CB . ARG B 97 ? 0.2387 0.2406 0.2181 0.0281 -0.0015 0.0219 97 ARG B CB 2391 C CG . ARG B 97 ? 0.2412 0.2528 0.2178 0.0289 -0.0053 0.0246 97 ARG B CG 2392 C CD . ARG B 97 ? 0.2658 0.3032 0.2421 0.0225 -0.0053 0.0218 97 ARG B CD 2393 N NE . ARG B 97 ? 0.3532 0.3851 0.3205 0.0076 0.0002 0.0198 97 ARG B NE 2394 C CZ . ARG B 97 ? 0.3635 0.4136 0.3244 -0.0047 0.0022 0.0166 97 ARG B CZ 2395 N NH1 . ARG B 97 ? 0.3143 0.3970 0.2808 -0.0030 -0.0014 0.0149 97 ARG B NH1 2396 N NH2 . ARG B 97 ? 0.3373 0.3738 0.2836 -0.0190 0.0084 0.0148 97 ARG B NH2 2397 N N . ALA B 98 ? 0.3311 0.3049 0.2955 0.0167 0.0059 0.0255 98 ALA B N 2398 C CA . ALA B 98 ? 0.2753 0.2406 0.2287 0.0106 0.0115 0.0252 98 ALA B CA 2399 C C . ALA B 98 ? 0.3161 0.2858 0.2607 0.0009 0.0138 0.0226 98 ALA B C 2400 O O . ALA B 98 ? 0.3643 0.3513 0.3144 -0.0009 0.0100 0.0213 98 ALA B O 2401 C CB . ALA B 98 ? 0.2472 0.2088 0.1987 0.0099 0.0101 0.0286 98 ALA B CB 2402 N N . LEU B 99 ? 0.3503 0.3053 0.2783 -0.0055 0.0204 0.0217 99 LEU B N 2403 C CA . LEU B 99 ? 0.3899 0.3459 0.3036 -0.0193 0.0237 0.0189 99 LEU B CA 2404 C C . LEU B 99 ? 0.3643 0.3385 0.2841 -0.0241 0.0183 0.0209 99 LEU B C 2405 O O . LEU B 99 ? 0.3683 0.3634 0.2882 -0.0325 0.0163 0.0189 99 LEU B O 2406 C CB . LEU B 99 ? 0.3937 0.3214 0.2814 -0.0244 0.0333 0.0178 99 LEU B CB 2407 C CG . LEU B 99 ? 0.4962 0.4052 0.3615 -0.0313 0.0413 0.0134 99 LEU B CG 2408 C CD1 . LEU B 99 ? 0.5534 0.4304 0.3844 -0.0390 0.0512 0.0124 99 LEU B CD1 2409 C CD2 . LEU B 99 ? 0.5221 0.4529 0.3908 -0.0445 0.0387 0.0093 99 LEU B CD2 2410 N N . THR B 100 ? 0.3508 0.3199 0.2743 -0.0192 0.0160 0.0248 100 THR B N 2411 C CA . THR B 100 ? 0.4575 0.4409 0.3850 -0.0220 0.0108 0.0273 100 THR B CA 2412 C C . THR B 100 ? 0.4174 0.4054 0.3583 -0.0098 0.0035 0.0311 100 THR B C 2413 O O . THR B 100 ? 0.4162 0.3939 0.3616 -0.0025 0.0035 0.0318 100 THR B O 2414 C CB . THR B 100 ? 0.5995 0.5701 0.5142 -0.0297 0.0148 0.0283 100 THR B CB 2415 O OG1 . THR B 100 ? 0.7170 0.6748 0.6344 -0.0216 0.0148 0.0312 100 THR B OG1 2416 C CG2 . THR B 100 ? 0.7012 0.6540 0.5939 -0.0403 0.0243 0.0245 100 THR B CG2 2417 N N . TYR B 101 ? 0.3597 0.3619 0.3034 -0.0079 -0.0022 0.0337 101 TYR B N 2418 C CA . TYR B 101 ? 0.4044 0.4047 0.3528 0.0045 -0.0083 0.0373 101 TYR B CA 2419 C C . TYR B 101 ? 0.4690 0.4473 0.4143 0.0060 -0.0083 0.0397 101 TYR B C 2420 O O . TYR B 101 ? 0.5107 0.4792 0.4550 0.0134 -0.0110 0.0413 101 TYR B O 2421 C CB . TYR B 101 ? 0.3294 0.3477 0.2762 0.0090 -0.0137 0.0403 101 TYR B CB 2422 C CG . TYR B 101 ? 0.3528 0.3661 0.2932 0.0034 -0.0145 0.0432 101 TYR B CG 2423 C CD1 . TYR B 101 ? 0.2822 0.2760 0.2167 0.0089 -0.0174 0.0471 101 TYR B CD1 2424 C CD2 . TYR B 101 ? 0.3330 0.3598 0.2704 -0.0093 -0.0119 0.0417 101 TYR B CD2 2425 C CE1 . TYR B 101 ? 0.3256 0.3151 0.2540 0.0033 -0.0182 0.0496 101 TYR B CE1 2426 C CE2 . TYR B 101 ? 0.3241 0.3467 0.2558 -0.0146 -0.0127 0.0443 101 TYR B CE2 2427 C CZ . TYR B 101 ? 0.3273 0.3322 0.2558 -0.0075 -0.0161 0.0484 101 TYR B CZ 2428 O OH . TYR B 101 ? 0.3383 0.3389 0.2608 -0.0133 -0.0168 0.0509 101 TYR B OH 2429 N N . TYR B 102 ? 0.4113 0.3824 0.3523 -0.0021 -0.0046 0.0397 102 TYR B N 2430 C CA . TYR B 102 ? 0.3774 0.3354 0.3147 -0.0030 -0.0047 0.0417 102 TYR B CA 2431 C C . TYR B 102 ? 0.3365 0.2906 0.2750 -0.0033 0.0005 0.0397 102 TYR B C 2432 O O . TYR B 102 ? 0.3224 0.2731 0.2584 -0.0051 0.0009 0.0407 102 TYR B O 2433 C CB . TYR B 102 ? 0.2443 0.2014 0.1757 -0.0099 -0.0046 0.0436 102 TYR B CB 2434 C CG . TYR B 102 ? 0.3291 0.2887 0.2568 -0.0166 0.0013 0.0412 102 TYR B CG 2435 C CD1 . TYR B 102 ? 0.3272 0.2786 0.2498 -0.0175 0.0074 0.0400 102 TYR B CD1 2436 C CD2 . TYR B 102 ? 0.2965 0.2664 0.2220 -0.0219 0.0014 0.0401 102 TYR B CD2 2437 C CE1 . TYR B 102 ? 0.3546 0.2994 0.2660 -0.0222 0.0141 0.0380 102 TYR B CE1 2438 C CE2 . TYR B 102 ? 0.3686 0.3341 0.2835 -0.0311 0.0082 0.0374 102 TYR B CE2 2439 C CZ . TYR B 102 ? 0.3941 0.3427 0.3000 -0.0305 0.0148 0.0366 102 TYR B CZ 2440 O OH . TYR B 102 ? 0.4243 0.3597 0.3121 -0.0381 0.0228 0.0341 102 TYR B OH 2441 N N . ASP B 103 ? 0.3640 0.3202 0.3038 -0.0019 0.0048 0.0369 103 ASP B N 2442 C CA . ASP B 103 ? 0.3235 0.2760 0.2598 0.0005 0.0110 0.0356 103 ASP B CA 2443 C C . ASP B 103 ? 0.3189 0.2742 0.2618 0.0066 0.0110 0.0345 103 ASP B C 2444 O O . ASP B 103 ? 0.3592 0.3159 0.3082 0.0080 0.0063 0.0347 103 ASP B O 2445 C CB . ASP B 103 ? 0.3129 0.2580 0.2380 -0.0021 0.0175 0.0333 103 ASP B CB 2446 C CG . ASP B 103 ? 0.3450 0.2809 0.2573 0.0016 0.0246 0.0336 103 ASP B CG 2447 O OD1 . ASP B 103 ? 0.4083 0.3508 0.3240 0.0087 0.0253 0.0346 103 ASP B OD1 2448 O OD2 . ASP B 103 ? 0.3367 0.2598 0.2329 -0.0026 0.0301 0.0327 103 ASP B OD2 2449 N N . TYR B 104 ? 0.2933 0.2487 0.2323 0.0115 0.0167 0.0335 104 TYR B N 2450 C CA . TYR B 104 ? 0.2843 0.2466 0.2291 0.0170 0.0172 0.0328 104 TYR B CA 2451 C C . TYR B 104 ? 0.3373 0.2945 0.2757 0.0242 0.0234 0.0310 104 TYR B C 2452 O O . TYR B 104 ? 0.3232 0.2880 0.2635 0.0311 0.0255 0.0308 104 TYR B O 2453 C CB . TYR B 104 ? 0.2439 0.2192 0.1887 0.0170 0.0177 0.0342 104 TYR B CB 2454 C CG . TYR B 104 ? 0.3518 0.3281 0.2978 0.0077 0.0123 0.0355 104 TYR B CG 2455 C CD1 . TYR B 104 ? 0.3305 0.3004 0.2719 0.0022 0.0103 0.0370 104 TYR B CD1 2456 C CD2 . TYR B 104 ? 0.3001 0.2805 0.2476 0.0032 0.0098 0.0350 104 TYR B CD2 2457 C CE1 . TYR B 104 ? 0.2695 0.2354 0.2071 -0.0059 0.0059 0.0384 104 TYR B CE1 2458 C CE2 . TYR B 104 ? 0.3355 0.3087 0.2760 -0.0066 0.0061 0.0360 104 TYR B CE2 2459 C CZ . TYR B 104 ? 0.3364 0.3014 0.2715 -0.0105 0.0041 0.0379 104 TYR B CZ 2460 O OH . TYR B 104 ? 0.3643 0.3171 0.2876 -0.0199 0.0009 0.0391 104 TYR B OH 2461 N N . GLU B 105 ? 0.3306 0.2741 0.2581 0.0218 0.0269 0.0296 105 GLU B N 2462 C CA . GLU B 105 ? 0.3291 0.2597 0.2435 0.0269 0.0336 0.0276 105 GLU B CA 2463 C C . GLU B 105 ? 0.4261 0.3589 0.3489 0.0232 0.0307 0.0250 105 GLU B C 2464 O O . GLU B 105 ? 0.5278 0.4610 0.4506 0.0142 0.0285 0.0233 105 GLU B O 2465 C CB . GLU B 105 ? 0.4065 0.3151 0.2958 0.0248 0.0412 0.0270 105 GLU B CB 2466 C CG . GLU B 105 ? 0.4934 0.3933 0.3746 0.0102 0.0412 0.0245 105 GLU B CG 2467 C CD . GLU B 105 ? 0.4946 0.4063 0.3853 0.0019 0.0356 0.0260 105 GLU B CD 2468 O OE1 . GLU B 105 ? 0.4664 0.3963 0.3776 0.0021 0.0277 0.0273 105 GLU B OE1 2469 O OE2 . GLU B 105 ? 0.6095 0.5093 0.4839 -0.0046 0.0397 0.0260 105 GLU B OE2 2470 N N . PHE B 106 ? 0.3975 0.3363 0.3280 0.0302 0.0303 0.0246 106 PHE B N 2471 C CA . PHE B 106 ? 0.2956 0.2411 0.2382 0.0280 0.0261 0.0225 106 PHE B CA 2472 C C . PHE B 106 ? 0.3535 0.2881 0.2850 0.0253 0.0306 0.0190 106 PHE B C 2473 O O . PHE B 106 ? 0.2790 0.2066 0.2043 0.0318 0.0348 0.0182 106 PHE B O 2474 C CB . PHE B 106 ? 0.2784 0.2356 0.2341 0.0339 0.0233 0.0234 106 PHE B CB 2475 C CG . PHE B 106 ? 0.3162 0.2823 0.2776 0.0322 0.0196 0.0261 106 PHE B CG 2476 C CD1 . PHE B 106 ? 0.3305 0.2955 0.2949 0.0265 0.0144 0.0271 106 PHE B CD1 2477 C CD2 . PHE B 106 ? 0.2884 0.2654 0.2494 0.0361 0.0218 0.0274 106 PHE B CD2 2478 C CE1 . PHE B 106 ? 0.3898 0.3579 0.3544 0.0230 0.0117 0.0292 106 PHE B CE1 2479 C CE2 . PHE B 106 ? 0.3482 0.3346 0.3114 0.0307 0.0190 0.0290 106 PHE B CE2 2480 C CZ . PHE B 106 ? 0.3959 0.3743 0.3595 0.0233 0.0141 0.0298 106 PHE B CZ 2481 N N . ALA B 107 ? 0.3342 0.2693 0.2616 0.0147 0.0297 0.0169 107 ALA B N 2482 C CA . ALA B 107 ? 0.3786 0.3042 0.2907 0.0065 0.0344 0.0127 107 ALA B CA 2483 C C . ALA B 107 ? 0.3665 0.3087 0.2934 0.0058 0.0301 0.0101 107 ALA B C 2484 O O . ALA B 107 ? 0.3994 0.3349 0.3151 0.0000 0.0341 0.0064 107 ALA B O 2485 C CB . ALA B 107 ? 0.4176 0.3412 0.3157 -0.0081 0.0363 0.0109 107 ALA B CB 2486 N N . TYR B 108 ? 0.3800 0.3412 0.3285 0.0115 0.0224 0.0120 108 TYR B N 2487 C CA . TYR B 108 ? 0.3278 0.3049 0.2891 0.0133 0.0183 0.0098 108 TYR B CA 2488 C C . TYR B 108 ? 0.3106 0.2889 0.2859 0.0243 0.0148 0.0120 108 TYR B C 2489 O O . TYR B 108 ? 0.3474 0.3257 0.3279 0.0284 0.0113 0.0154 108 TYR B O 2490 C CB . TYR B 108 ? 0.2602 0.2600 0.2277 0.0095 0.0130 0.0092 108 TYR B CB 2491 C CG . TYR B 108 ? 0.2944 0.2975 0.2471 -0.0050 0.0166 0.0067 108 TYR B CG 2492 C CD1 . TYR B 108 ? 0.3603 0.3674 0.3012 -0.0176 0.0208 0.0015 108 TYR B CD1 2493 C CD2 . TYR B 108 ? 0.2854 0.2866 0.2328 -0.0087 0.0163 0.0092 108 TYR B CD2 2494 C CE1 . TYR B 108 ? 0.3850 0.3934 0.3069 -0.0352 0.0251 -0.0015 108 TYR B CE1 2495 C CE2 . TYR B 108 ? 0.2881 0.2912 0.2191 -0.0244 0.0203 0.0066 108 TYR B CE2 2496 C CZ . TYR B 108 ? 0.4292 0.4354 0.3463 -0.0385 0.0249 0.0011 108 TYR B CZ 2497 O OH . TYR B 108 ? 0.5268 0.5335 0.4228 -0.0581 0.0298 -0.0021 108 TYR B OH 2498 N N . TRP B 109 ? 0.2815 0.2591 0.2598 0.0271 0.0162 0.0099 109 TRP B N 2499 C CA . TRP B 109 ? 0.2973 0.2758 0.2862 0.0348 0.0138 0.0113 109 TRP B CA 2500 C C . TRP B 109 ? 0.3123 0.3006 0.3105 0.0378 0.0104 0.0090 109 TRP B C 2501 O O . TRP B 109 ? 0.3223 0.3180 0.3196 0.0340 0.0114 0.0055 109 TRP B O 2502 C CB . TRP B 109 ? 0.2287 0.1986 0.2125 0.0381 0.0190 0.0115 109 TRP B CB 2503 C CG . TRP B 109 ? 0.2955 0.2585 0.2699 0.0397 0.0226 0.0143 109 TRP B CG 2504 C CD1 . TRP B 109 ? 0.3021 0.2534 0.2607 0.0370 0.0271 0.0142 109 TRP B CD1 2505 C CD2 . TRP B 109 ? 0.2706 0.2394 0.2481 0.0441 0.0225 0.0172 109 TRP B CD2 2506 N NE1 . TRP B 109 ? 0.3272 0.2763 0.2799 0.0422 0.0297 0.0173 109 TRP B NE1 2507 C CE2 . TRP B 109 ? 0.2711 0.2344 0.2364 0.0463 0.0268 0.0191 109 TRP B CE2 2508 C CE3 . TRP B 109 ? 0.2656 0.2446 0.2524 0.0448 0.0198 0.0180 109 TRP B CE3 2509 C CZ2 . TRP B 109 ? 0.2416 0.2151 0.2066 0.0504 0.0277 0.0218 109 TRP B CZ2 2510 C CZ3 . TRP B 109 ? 0.2250 0.2139 0.2102 0.0456 0.0210 0.0204 109 TRP B CZ3 2511 C CH2 . TRP B 109 ? 0.2368 0.2258 0.2126 0.0492 0.0247 0.0223 109 TRP B CH2 2512 N N . GLY B 110 ? 0.2367 0.2240 0.2409 0.0435 0.0070 0.0108 110 GLY B N 2513 C CA . GLY B 110 ? 0.2137 0.2053 0.2239 0.0483 0.0049 0.0090 110 GLY B CA 2514 C C . GLY B 110 ? 0.2825 0.2720 0.2952 0.0472 0.0086 0.0069 110 GLY B C 2515 O O . GLY B 110 ? 0.2061 0.1903 0.2144 0.0453 0.0126 0.0078 110 GLY B O 2516 N N . GLN B 111 ? 0.2546 0.2487 0.2728 0.0502 0.0076 0.0044 111 GLN B N 2517 C CA . GLN B 111 ? 0.2540 0.2474 0.2742 0.0490 0.0110 0.0022 111 GLN B CA 2518 C C . GLN B 111 ? 0.2008 0.1893 0.2222 0.0503 0.0121 0.0042 111 GLN B C 2519 O O . GLN B 111 ? 0.1897 0.1799 0.2127 0.0507 0.0148 0.0031 111 GLN B O 2520 C CB . GLN B 111 ? 0.1556 0.1584 0.1814 0.0502 0.0098 -0.0017 111 GLN B CB 2521 C CG . GLN B 111 ? 0.1636 0.1651 0.1943 0.0564 0.0071 -0.0016 111 GLN B CG 2522 C CD . GLN B 111 ? 0.2530 0.2552 0.2809 0.0636 0.0030 0.0001 111 GLN B CD 2523 O OE1 . GLN B 111 ? 0.3216 0.3251 0.3457 0.0635 0.0016 0.0022 111 GLN B OE1 2524 N NE2 . GLN B 111 ? 0.2598 0.2596 0.2870 0.0712 0.0014 -0.0007 111 GLN B NE2 2525 N N . GLY B 112 ? 0.2434 0.2270 0.2618 0.0496 0.0102 0.0070 112 GLY B N 2526 C CA . GLY B 112 ? 0.2034 0.1860 0.2198 0.0464 0.0115 0.0083 112 GLY B CA 2527 C C . GLY B 112 ? 0.2474 0.2233 0.2628 0.0462 0.0102 0.0068 112 GLY B C 2528 O O . GLY B 112 ? 0.3108 0.2879 0.3311 0.0507 0.0094 0.0044 112 GLY B O 2529 N N . THR B 113 ? 0.2767 0.2447 0.2829 0.0399 0.0106 0.0079 113 THR B N 2530 C CA . THR B 113 ? 0.2238 0.1794 0.2224 0.0375 0.0109 0.0064 113 THR B CA 2531 C C . THR B 113 ? 0.2731 0.2371 0.2681 0.0259 0.0140 0.0061 113 THR B C 2532 O O . THR B 113 ? 0.3443 0.3085 0.3292 0.0163 0.0150 0.0075 113 THR B O 2533 C CB . THR B 113 ? 0.3220 0.2513 0.3016 0.0387 0.0093 0.0078 113 THR B CB 2534 O OG1 . THR B 113 ? 0.4093 0.3383 0.3923 0.0507 0.0061 0.0086 113 THR B OG1 2535 C CG2 . THR B 113 ? 0.3460 0.2554 0.3117 0.0378 0.0108 0.0061 113 THR B CG2 2536 N N . LEU B 114 ? 0.2825 0.2567 0.2849 0.0257 0.0157 0.0040 114 LEU B N 2537 C CA . LEU B 114 ? 0.2119 0.2012 0.2115 0.0144 0.0187 0.0034 114 LEU B CA 2538 C C . LEU B 114 ? 0.2110 0.1791 0.1898 0.0013 0.0201 0.0022 114 LEU B C 2539 O O . LEU B 114 ? 0.2534 0.2006 0.2250 0.0035 0.0202 0.0004 114 LEU B O 2540 C CB . LEU B 114 ? 0.2302 0.2378 0.2429 0.0186 0.0203 0.0019 114 LEU B CB 2541 C CG . LEU B 114 ? 0.3155 0.3459 0.3262 0.0076 0.0234 0.0013 114 LEU B CG 2542 C CD1 . LEU B 114 ? 0.2981 0.3533 0.3068 0.0032 0.0247 0.0037 114 LEU B CD1 2543 C CD2 . LEU B 114 ? 0.2961 0.3436 0.3193 0.0148 0.0247 0.0004 114 LEU B CD2 2544 N N . VAL B 115 ? 0.2851 0.2572 0.2506 -0.0131 0.0218 0.0029 115 VAL B N 2545 C CA . VAL B 115 ? 0.3651 0.3118 0.3029 -0.0297 0.0245 0.0013 115 VAL B CA 2546 C C . VAL B 115 ? 0.3902 0.3650 0.3251 -0.0482 0.0282 -0.0007 115 VAL B C 2547 O O . VAL B 115 ? 0.3500 0.3605 0.2922 -0.0541 0.0288 0.0003 115 VAL B O 2548 C CB . VAL B 115 ? 0.3929 0.3162 0.3093 -0.0362 0.0241 0.0029 115 VAL B CB 2549 C CG1 . VAL B 115 ? 0.4393 0.3293 0.3181 -0.0564 0.0284 0.0009 115 VAL B CG1 2550 C CG2 . VAL B 115 ? 0.3898 0.2899 0.3089 -0.0168 0.0204 0.0051 115 VAL B CG2 2551 N N . THR B 116 ? 0.4056 0.3676 0.3294 -0.0564 0.0308 -0.0035 116 THR B N 2552 C CA . THR B 116 ? 0.3316 0.3213 0.2496 -0.0768 0.0347 -0.0058 116 THR B CA 2553 C C . THR B 116 ? 0.3599 0.3177 0.2377 -0.1029 0.0392 -0.0083 116 THR B C 2554 O O . THR B 116 ? 0.3997 0.3070 0.2525 -0.1030 0.0409 -0.0094 116 THR B O 2555 C CB . THR B 116 ? 0.3895 0.3893 0.3207 -0.0718 0.0355 -0.0077 116 THR B CB 2556 O OG1 . THR B 116 ? 0.2951 0.3158 0.2572 -0.0485 0.0321 -0.0057 116 THR B OG1 2557 C CG2 . THR B 116 ? 0.3570 0.3946 0.2844 -0.0928 0.0394 -0.0099 116 THR B CG2 2558 N N . VAL B 117 ? 0.3909 0.3766 0.2585 -0.1247 0.0416 -0.0091 117 VAL B N 2559 C CA . VAL B 117 ? 0.3695 0.3259 0.1936 -0.1552 0.0470 -0.0123 117 VAL B CA 2560 C C . VAL B 117 ? 0.4893 0.4700 0.3051 -0.1778 0.0517 -0.0163 117 VAL B C 2561 O O . VAL B 117 ? 0.4788 0.5219 0.3127 -0.1860 0.0519 -0.0167 117 VAL B O 2562 C CB . VAL B 117 ? 0.4552 0.4294 0.2673 -0.1723 0.0476 -0.0121 117 VAL B CB 2563 C CG1 . VAL B 117 ? 0.4339 0.3736 0.1941 -0.2086 0.0544 -0.0162 117 VAL B CG1 2564 C CG2 . VAL B 117 ? 0.4343 0.3861 0.2542 -0.1513 0.0431 -0.0081 117 VAL B CG2 2565 N N . SER B 118 ? 0.5376 0.4701 0.3242 -0.1868 0.0558 -0.0191 118 SER B N 2566 C CA . SER B 118 ? 0.4687 0.4203 0.2474 -0.2076 0.0605 -0.0230 118 SER B CA 2567 C C . SER B 118 ? 0.5260 0.4086 0.2541 -0.2252 0.0672 -0.0266 118 SER B C 2568 O O . SER B 118 ? 0.6777 0.4984 0.3868 -0.2088 0.0670 -0.0251 118 SER B O 2569 C CB . SER B 118 ? 0.4320 0.4173 0.2529 -0.1835 0.0567 -0.0216 118 SER B CB 2570 O OG . SER B 118 ? 0.5268 0.5162 0.3359 -0.2012 0.0613 -0.0254 118 SER B OG 2571 N N . ALA B 119 ? 0.4984 0.3954 0.2108 -0.2482 0.0676 -0.0345 119 ALA B N 2572 C CA . ALA B 119 ? 0.6100 0.4446 0.2725 -0.2614 0.0720 -0.0411 119 ALA B CA 2573 C C . ALA B 119 ? 0.6823 0.4996 0.3512 -0.2488 0.0752 -0.0397 119 ALA B C 2574 O O . ALA B 119 ? 0.7258 0.4850 0.3539 -0.2503 0.0802 -0.0429 119 ALA B O 2575 C CB . ALA B 119 ? 0.5983 0.4546 0.2383 -0.2932 0.0699 -0.0521 119 ALA B CB 2576 N N . ALA B 120 ? 0.6170 0.4852 0.3355 -0.2343 0.0729 -0.0347 120 ALA B N 2577 C CA . ALA B 120 ? 0.5845 0.4461 0.3165 -0.2231 0.0747 -0.0341 120 ALA B CA 2578 C C . ALA B 120 ? 0.6242 0.4229 0.3475 -0.1937 0.0733 -0.0323 120 ALA B C 2579 O O . ALA B 120 ? 0.7304 0.4865 0.4327 -0.1842 0.0729 -0.0302 120 ALA B O 2580 C CB . ALA B 120 ? 0.5338 0.4682 0.3239 -0.2042 0.0682 -0.0317 120 ALA B CB 2581 N N . SER B 121 ? 0.5494 0.3469 0.2894 -0.1784 0.0724 -0.0331 121 SER B N 2582 C CA . SER B 121 ? 0.5731 0.3209 0.3066 -0.1496 0.0712 -0.0319 121 SER B CA 2583 C C . SER B 121 ? 0.5491 0.3360 0.3373 -0.1170 0.0626 -0.0288 121 SER B C 2584 O O . SER B 121 ? 0.5054 0.3489 0.3320 -0.1170 0.0592 -0.0286 121 SER B O 2585 C CB . SER B 121 ? 0.5204 0.2342 0.2277 -0.1572 0.0774 -0.0357 121 SER B CB 2586 O OG . SER B 121 ? 0.7750 0.4608 0.4311 -0.1891 0.0857 -0.0390 121 SER B OG 2587 N N . THR B 122 ? 0.5315 0.2877 0.3192 -0.0895 0.0595 -0.0265 122 THR B N 2588 C CA . THR B 122 ? 0.4983 0.2861 0.3309 -0.0614 0.0524 -0.0246 122 THR B CA 2589 C C . THR B 122 ? 0.5036 0.2969 0.3473 -0.0566 0.0533 -0.0275 122 THR B C 2590 O O . THR B 122 ? 0.6129 0.3645 0.4239 -0.0602 0.0586 -0.0298 122 THR B O 2591 C CB . THR B 122 ? 0.5525 0.3115 0.3792 -0.0350 0.0491 -0.0218 122 THR B CB 2592 O OG1 . THR B 122 ? 0.6409 0.3912 0.4540 -0.0411 0.0487 -0.0192 122 THR B OG1 2593 C CG2 . THR B 122 ? 0.5282 0.3257 0.3997 -0.0119 0.0422 -0.0206 122 THR B CG2 2594 N N . LYS B 123 ? 0.4577 0.2998 0.3440 -0.0491 0.0488 -0.0274 123 LYS B N 2595 C CA . LYS B 123 ? 0.4543 0.3060 0.3549 -0.0441 0.0490 -0.0300 123 LYS B CA 2596 C C . LYS B 123 ? 0.4203 0.3052 0.3610 -0.0227 0.0427 -0.0290 123 LYS B C 2597 O O . LYS B 123 ? 0.3906 0.3113 0.3556 -0.0220 0.0396 -0.0270 123 LYS B O 2598 C CB . LYS B 123 ? 0.4490 0.3276 0.3515 -0.0679 0.0525 -0.0322 123 LYS B CB 2599 C CG . LYS B 123 ? 0.4513 0.3323 0.3619 -0.0654 0.0537 -0.0353 123 LYS B CG 2600 C CD . LYS B 123 ? 0.5455 0.4589 0.4596 -0.0884 0.0570 -0.0371 123 LYS B CD 2601 C CE . LYS B 123 ? 0.5604 0.4799 0.4876 -0.0835 0.0573 -0.0398 123 LYS B CE 2602 N NZ . LYS B 123 ? 0.5118 0.4512 0.4744 -0.0577 0.0511 -0.0386 123 LYS B NZ 2603 N N . GLY B 124 ? 0.3732 0.2455 0.3175 -0.0057 0.0415 -0.0307 124 GLY B N 2604 C CA . GLY B 124 ? 0.3253 0.2270 0.3025 0.0110 0.0363 -0.0307 124 GLY B CA 2605 C C . GLY B 124 ? 0.3195 0.2539 0.3197 0.0042 0.0362 -0.0324 124 GLY B C 2606 O O . GLY B 124 ? 0.3679 0.3009 0.3596 -0.0097 0.0400 -0.0342 124 GLY B O 2607 N N . PRO B 125 ? 0.2466 0.2084 0.2725 0.0135 0.0325 -0.0318 125 PRO B N 2608 C CA . PRO B 125 ? 0.3033 0.2926 0.3473 0.0097 0.0327 -0.0328 125 PRO B CA 2609 C C . PRO B 125 ? 0.3167 0.3040 0.3670 0.0150 0.0326 -0.0368 125 PRO B C 2610 O O . PRO B 125 ? 0.2269 0.2004 0.2738 0.0259 0.0312 -0.0387 125 PRO B O 2611 C CB . PRO B 125 ? 0.2571 0.2660 0.3170 0.0182 0.0297 -0.0305 125 PRO B CB 2612 C CG . PRO B 125 ? 0.2066 0.2010 0.2640 0.0295 0.0269 -0.0308 125 PRO B CG 2613 C CD . PRO B 125 ? 0.2119 0.1785 0.2473 0.0270 0.0285 -0.0303 125 PRO B CD 2614 N N . SER B 126 ? 0.2691 0.2739 0.3282 0.0077 0.0341 -0.0379 126 SER B N 2615 C CA . SER B 126 ? 0.2218 0.2337 0.2926 0.0126 0.0334 -0.0414 126 SER B CA 2616 C C . SER B 126 ? 0.2259 0.2578 0.3123 0.0190 0.0311 -0.0404 126 SER B C 2617 O O . SER B 126 ? 0.2002 0.2450 0.2885 0.0177 0.0316 -0.0369 126 SER B O 2618 C CB . SER B 126 ? 0.2731 0.2908 0.3422 0.0007 0.0366 -0.0430 126 SER B CB 2619 O OG . SER B 126 ? 0.3126 0.3057 0.3605 -0.0081 0.0401 -0.0444 126 SER B OG 2620 N N . VAL B 127 ? 0.1246 0.1584 0.2186 0.0258 0.0293 -0.0438 127 VAL B N 2621 C CA . VAL B 127 ? 0.0905 0.1359 0.1917 0.0290 0.0284 -0.0438 127 VAL B CA 2622 C C . VAL B 127 ? 0.1703 0.2236 0.2771 0.0260 0.0296 -0.0469 127 VAL B C 2623 O O . VAL B 127 ? 0.1557 0.2076 0.2651 0.0258 0.0289 -0.0509 127 VAL B O 2624 C CB . VAL B 127 ? 0.2043 0.2483 0.3062 0.0354 0.0257 -0.0457 127 VAL B CB 2625 C CG1 . VAL B 127 ? 0.1782 0.2271 0.2787 0.0344 0.0260 -0.0453 127 VAL B CG1 2626 C CG2 . VAL B 127 ? 0.1549 0.1898 0.2504 0.0394 0.0244 -0.0426 127 VAL B CG2 2627 N N . PHE B 128 ? 0.2098 0.2708 0.3158 0.0251 0.0313 -0.0443 128 PHE B N 2628 C CA . PHE B 128 ? 0.2189 0.2832 0.3237 0.0222 0.0316 -0.0451 128 PHE B CA 2629 C C . PHE B 128 ? 0.2267 0.2863 0.3235 0.0251 0.0323 -0.0448 128 PHE B C 2630 O O . PHE B 128 ? 0.1751 0.2316 0.2650 0.0305 0.0342 -0.0418 128 PHE B O 2631 C CB . PHE B 128 ? 0.1142 0.1914 0.2207 0.0190 0.0343 -0.0427 128 PHE B CB 2632 C CG . PHE B 128 ? 0.1117 0.1909 0.2214 0.0115 0.0355 -0.0445 128 PHE B CG 2633 C CD1 . PHE B 128 ? 0.0794 0.1490 0.1905 0.0078 0.0353 -0.0492 128 PHE B CD1 2634 C CD2 . PHE B 128 ? 0.0804 0.1675 0.1851 0.0070 0.0368 -0.0406 128 PHE B CD2 2635 C CE1 . PHE B 128 ? 0.1121 0.1726 0.2154 -0.0002 0.0371 -0.0499 128 PHE B CE1 2636 C CE2 . PHE B 128 ? 0.1357 0.2169 0.2335 -0.0042 0.0384 -0.0417 128 PHE B CE2 2637 C CZ . PHE B 128 ? 0.1156 0.1799 0.2105 -0.0077 0.0389 -0.0462 128 PHE B CZ 2638 N N . PRO B 129 ? 0.1453 0.2032 0.2417 0.0214 0.0323 -0.0491 129 PRO B N 2639 C CA . PRO B 129 ? 0.0872 0.1370 0.1737 0.0222 0.0358 -0.0522 129 PRO B CA 2640 C C . PRO B 129 ? 0.1801 0.2253 0.2547 0.0285 0.0400 -0.0479 129 PRO B C 2641 O O . PRO B 129 ? 0.1315 0.1866 0.2100 0.0291 0.0397 -0.0450 129 PRO B O 2642 C CB . PRO B 129 ? 0.0852 0.1382 0.1752 0.0145 0.0354 -0.0593 129 PRO B CB 2643 C CG . PRO B 129 ? 0.0960 0.1562 0.1944 0.0128 0.0324 -0.0568 129 PRO B CG 2644 C CD . PRO B 129 ? 0.1504 0.2121 0.2530 0.0160 0.0305 -0.0525 129 PRO B CD 2645 N N . LEU B 130 ? 0.1792 0.2078 0.2339 0.0335 0.0429 -0.0453 130 LEU B N 2646 C CA . LEU B 130 ? 0.2481 0.2649 0.2819 0.0426 0.0476 -0.0411 130 LEU B CA 2647 C C . LEU B 130 ? 0.1833 0.1759 0.1958 0.0352 0.0506 -0.0461 130 LEU B C 2648 O O . LEU B 130 ? 0.2150 0.1839 0.2045 0.0329 0.0535 -0.0470 130 LEU B O 2649 C CB . LEU B 130 ? 0.2374 0.2466 0.2562 0.0548 0.0501 -0.0348 130 LEU B CB 2650 C CG . LEU B 130 ? 0.2324 0.2683 0.2697 0.0597 0.0475 -0.0303 130 LEU B CG 2651 C CD1 . LEU B 130 ? 0.1773 0.2058 0.2008 0.0674 0.0478 -0.0247 130 LEU B CD1 2652 C CD2 . LEU B 130 ? 0.1964 0.2540 0.2413 0.0604 0.0464 -0.0266 130 LEU B CD2 2653 N N . ALA B 131 ? 0.2554 0.2768 0.2031 -0.0280 -0.0263 0.0331 131 ALA B N 2654 C CA . ALA B 131 ? 0.3306 0.3435 0.2506 -0.0423 -0.0090 0.0362 131 ALA B CA 2655 C C . ALA B 131 ? 0.3824 0.3671 0.3080 -0.0533 -0.0230 0.0485 131 ALA B C 2656 O O . ALA B 131 ? 0.4898 0.4391 0.4090 -0.0522 -0.0525 0.0596 131 ALA B O 2657 C CB . ALA B 131 ? 0.3355 0.3218 0.1912 -0.0515 -0.0036 0.0397 131 ALA B CB 2658 N N . PRO B 132 ? 0.3464 0.3449 0.2837 -0.0635 -0.0032 0.0450 132 PRO B N 2659 C CA . PRO B 132 ? 0.3430 0.3059 0.2797 -0.0766 -0.0152 0.0575 132 PRO B CA 2660 C C . PRO B 132 ? 0.4236 0.3276 0.2850 -0.0959 -0.0219 0.0771 132 PRO B C 2661 O O . PRO B 132 ? 0.5452 0.4527 0.3609 -0.1054 -0.0021 0.0745 132 PRO B O 2662 C CB . PRO B 132 ? 0.3191 0.3185 0.2839 -0.0849 0.0151 0.0447 132 PRO B CB 2663 C CG . PRO B 132 ? 0.3954 0.4320 0.3429 -0.0836 0.0440 0.0300 132 PRO B CG 2664 C CD . PRO B 132 ? 0.2782 0.3235 0.2272 -0.0640 0.0307 0.0277 132 PRO B CD 2665 N N . SER B 133 ? 0.5481 0.3989 0.3957 -0.1013 -0.0508 0.0953 133 SER B N 2666 C CA . SER B 133 ? 0.7990 0.5873 0.5684 -0.1235 -0.0578 0.1177 133 SER B CA 2667 C C . SER B 133 ? 0.8851 0.6227 0.6566 -0.1328 -0.0787 0.1342 133 SER B C 2668 O O . SER B 133 ? 0.8549 0.6160 0.6856 -0.1287 -0.0729 0.1237 133 SER B O 2669 C CB . SER B 133 ? 0.8631 0.6205 0.5893 -0.1162 -0.0849 0.1278 133 SER B CB 2670 O OG . SER B 133 ? 0.9024 0.6326 0.6558 -0.1001 -0.1263 0.1344 133 SER B OG 2671 N N . SER B 134 ? 0.9913 0.6580 0.6977 -0.1447 -0.1045 0.1595 134 SER B N 2672 C CA . SER B 134 ? 1.0495 0.6580 0.7578 -0.1476 -0.1344 0.1761 134 SER B CA 2673 C C . SER B 134 ? 1.1303 0.7366 0.8936 -0.1164 -0.1788 0.1697 134 SER B C 2674 O O . SER B 134 ? 1.1339 0.7224 0.9372 -0.1084 -0.2007 0.1680 134 SER B O 2675 C CB . SER B 134 ? 1.0357 0.5963 0.6706 -0.1642 -0.1385 0.1910 134 SER B CB 2676 O OG . SER B 134 ? 1.0598 0.6279 0.6580 -0.1938 -0.0976 0.1914 134 SER B OG 2677 N N . LYS B 135 ? 1.1936 0.8247 0.9629 -0.0990 -0.1901 0.1612 135 LYS B N 2678 C CA . LYS B 135 ? 1.1846 0.8318 1.0139 -0.0710 -0.2257 0.1461 135 LYS B CA 2679 C C . LYS B 135 ? 1.1006 0.8194 1.0194 -0.0571 -0.2099 0.1197 135 LYS B C 2680 O O . LYS B 135 ? 0.9660 0.7144 0.9408 -0.0370 -0.2313 0.1019 135 LYS B O 2681 C CB . LYS B 135 ? 1.1049 0.7598 0.9092 -0.0612 -0.2369 0.1398 135 LYS B CB 2682 C CG . LYS B 135 ? 1.1570 0.7636 0.8938 -0.0706 -0.2491 0.1524 135 LYS B CG 2683 C CD . LYS B 135 ? 1.1621 0.7804 0.8712 -0.0661 -0.2487 0.1461 135 LYS B CD 2684 C CE . LYS B 135 ? 1.2942 0.8697 0.9293 -0.0803 -0.2519 0.1606 135 LYS B CE 2685 N NZ . LYS B 135 ? 1.3075 0.8910 0.8905 -0.1017 -0.2150 0.1671 135 LYS B NZ 2686 N N . SER B 136 ? 1.0498 0.8024 0.9812 -0.0695 -0.1699 0.1135 136 SER B N 2687 C CA . SER B 136 ? 0.9310 0.7517 0.9435 -0.0592 -0.1521 0.0885 136 SER B CA 2688 C C . SER B 136 ? 0.9614 0.7887 0.9897 -0.0741 -0.1263 0.0868 136 SER B C 2689 O O . SER B 136 ? 0.8528 0.7428 0.9303 -0.0710 -0.0988 0.0669 136 SER B O 2690 C CB . SER B 136 ? 0.6877 0.5695 0.7136 -0.0514 -0.1274 0.0729 136 SER B CB 2691 O OG . SER B 136 ? 0.5118 0.4249 0.5263 -0.0621 -0.0866 0.0682 136 SER B OG 2692 N N . THR B 137 ? 1.0518 0.8127 1.0366 -0.0911 -0.1366 0.1076 137 THR B N 2693 C CA . THR B 137 ? 1.1115 0.8677 1.1078 -0.1094 -0.1146 0.1070 137 THR B CA 2694 C C . THR B 137 ? 1.2047 0.8905 1.2020 -0.1130 -0.1490 0.1215 137 THR B C 2695 O O . THR B 137 ? 1.3224 0.9299 1.2458 -0.1286 -0.1660 0.1499 137 THR B O 2696 C CB . THR B 137 ? 1.0659 0.8103 0.9922 -0.1393 -0.0763 0.1179 137 THR B CB 2697 O OG1 . THR B 137 ? 0.9717 0.7847 0.9061 -0.1341 -0.0434 0.0995 137 THR B OG1 2698 C CG2 . THR B 137 ? 1.0131 0.7478 0.9514 -0.1618 -0.0550 0.1163 137 THR B CG2 2699 N N . SER B 138 ? 1.1193 0.8315 1.1982 -0.0991 -0.1600 0.1017 138 SER B N 2700 C CA . SER B 138 ? 1.1638 0.8105 1.2545 -0.0995 -0.1945 0.1111 138 SER B CA 2701 C C . SER B 138 ? 1.0077 0.6773 1.1549 -0.1091 -0.1732 0.0946 138 SER B C 2702 O O . SER B 138 ? 0.8818 0.6338 1.1046 -0.0972 -0.1540 0.0640 138 SER B O 2703 C CB . SER B 138 ? 1.1879 0.8400 1.3257 -0.0672 -0.2414 0.0979 138 SER B CB 2704 O OG . SER B 138 ? 1.2505 0.8545 1.3802 -0.0625 -0.2714 0.1040 138 SER B OG 2705 N N . GLY B 139 ? 0.9791 0.5857 1.0836 -0.1283 -0.1726 0.1123 139 GLY B N 2706 C CA . GLY B 139 ? 0.8769 0.4957 1.0276 -0.1397 -0.1530 0.0976 139 GLY B CA 2707 C C . GLY B 139 ? 0.7468 0.4326 0.9191 -0.1596 -0.1008 0.0811 139 GLY B C 2708 O O . GLY B 139 ? 0.6961 0.4432 0.9459 -0.1539 -0.0840 0.0518 139 GLY B O 2709 N N . GLY B 140 ? 0.6582 0.3475 0.7595 -0.1772 -0.0721 0.0940 140 GLY B N 2710 C CA . GLY B 140 ? 0.5621 0.3266 0.6741 -0.1894 -0.0202 0.0733 140 GLY B CA 2711 C C . GLY B 140 ? 0.5101 0.3711 0.6773 -0.1617 -0.0077 0.0460 140 GLY B C 2712 O O . GLY B 140 ? 0.5225 0.4458 0.6957 -0.1670 0.0309 0.0286 140 GLY B O 2713 N N . THR B 141 ? 0.4186 0.2920 0.6244 -0.1330 -0.0406 0.0412 141 THR B N 2714 C CA . THR B 141 ? 0.3466 0.3044 0.5991 -0.1101 -0.0303 0.0182 141 THR B CA 2715 C C . THR B 141 ? 0.3302 0.2795 0.5334 -0.1007 -0.0402 0.0314 141 THR B C 2716 O O . THR B 141 ? 0.3712 0.2690 0.5506 -0.0938 -0.0756 0.0474 141 THR B O 2717 C CB . THR B 141 ? 0.2964 0.2923 0.6365 -0.0874 -0.0538 -0.0043 141 THR B CB 2718 O OG1 . THR B 141 ? 0.2535 0.2777 0.6487 -0.0945 -0.0375 -0.0239 141 THR B OG1 2719 C CG2 . THR B 141 ? 0.1932 0.2654 0.5670 -0.0674 -0.0469 -0.0226 141 THR B CG2 2720 N N . ALA B 142 ? 0.2895 0.2891 0.4793 -0.0992 -0.0105 0.0226 142 ALA B N 2721 C CA . ALA B 142 ? 0.2899 0.2851 0.4376 -0.0901 -0.0175 0.0316 142 ALA B CA 2722 C C . ALA B 142 ? 0.2144 0.2721 0.4143 -0.0667 -0.0207 0.0131 142 ALA B C 2723 O O . ALA B 142 ? 0.2520 0.3727 0.5018 -0.0604 -0.0007 -0.0077 142 ALA B O 2724 C CB . ALA B 142 ? 0.3109 0.3090 0.3984 -0.1053 0.0143 0.0355 142 ALA B CB 2725 N N . ALA B 143 ? 0.2199 0.2600 0.4059 -0.0555 -0.0456 0.0204 143 ALA B N 2726 C CA . ALA B 143 ? 0.1600 0.2527 0.3813 -0.0390 -0.0458 0.0057 143 ALA B CA 2727 C C . ALA B 143 ? 0.1637 0.2573 0.3339 -0.0381 -0.0316 0.0119 143 ALA B C 2728 O O . ALA B 143 ? 0.2814 0.3271 0.3925 -0.0452 -0.0386 0.0282 143 ALA B O 2729 C CB . ALA B 143 ? 0.1585 0.2409 0.4103 -0.0280 -0.0816 0.0027 143 ALA B CB 2730 N N . LEU B 144 ? 0.1133 0.2602 0.3051 -0.0291 -0.0131 -0.0018 144 LEU B N 2731 C CA . LEU B 144 ? 0.1173 0.2639 0.2673 -0.0249 -0.0033 0.0015 144 LEU B CA 2732 C C . LEU B 144 ? 0.1505 0.3427 0.3349 -0.0120 -0.0015 -0.0101 144 LEU B C 2733 O O . LEU B 144 ? 0.1326 0.3145 0.3156 -0.0067 -0.0006 -0.0050 144 LEU B O 2734 C CB . LEU B 144 ? 0.1389 0.2926 0.2562 -0.0317 0.0257 -0.0013 144 LEU B CB 2735 C CG . LEU B 144 ? 0.1544 0.3553 0.3050 -0.0271 0.0494 -0.0179 144 LEU B CG 2736 C CD1 . LEU B 144 ? 0.1302 0.3162 0.2618 -0.0072 0.0474 -0.0182 144 LEU B CD1 2737 C CD2 . LEU B 144 ? 0.2246 0.4216 0.3476 -0.0410 0.0723 -0.0215 144 LEU B CD2 2738 N N . GLY B 145 ? 0.1283 0.3122 0.2812 -0.0067 -0.0015 -0.0064 145 GLY B N 2739 C CA . GLY B 145 ? 0.1317 0.3098 0.2862 0.0014 -0.0012 -0.0080 145 GLY B CA 2740 C C . GLY B 145 ? 0.1409 0.3278 0.2695 0.0069 0.0015 -0.0082 145 GLY B C 2741 O O . GLY B 145 ? 0.1350 0.3079 0.2270 0.0069 0.0067 -0.0043 145 GLY B O 2742 N N . CYS B 146 ? 0.1067 0.2810 0.2342 0.0090 -0.0011 -0.0083 146 CYS B N 2743 C CA . CYS B 146 ? 0.1290 0.3121 0.2373 0.0149 -0.0013 -0.0070 146 CYS B CA 2744 C C . CYS B 146 ? 0.1584 0.3362 0.2775 0.0086 -0.0159 -0.0056 146 CYS B C 2745 O O . CYS B 146 ? 0.1374 0.3029 0.2726 0.0026 -0.0159 -0.0066 146 CYS B O 2746 C CB . CYS B 146 ? 0.1517 0.3280 0.2448 0.0208 0.0109 -0.0098 146 CYS B CB 2747 S SG . CYS B 146 ? 0.2555 0.4316 0.3275 0.0282 0.0237 -0.0152 146 CYS B SG 2748 N N . LEU B 147 ? 0.1601 0.3138 0.2516 0.0080 -0.0262 -0.0006 147 LEU B N 2749 C CA . LEU B 147 ? 0.1372 0.2834 0.2346 -0.0004 -0.0385 -0.0017 147 LEU B CA 2750 C C . LEU B 147 ? 0.1798 0.3210 0.2569 0.0022 -0.0297 0.0016 147 LEU B C 2751 O O . LEU B 147 ? 0.2432 0.3553 0.2834 0.0107 -0.0267 0.0058 147 LEU B O 2752 C CB . LEU B 147 ? 0.1612 0.2671 0.2333 -0.0039 -0.0553 0.0009 147 LEU B CB 2753 C CG . LEU B 147 ? 0.2132 0.3101 0.2897 -0.0138 -0.0678 -0.0038 147 LEU B CG 2754 C CD1 . LEU B 147 ? 0.1838 0.3183 0.3121 -0.0228 -0.0755 -0.0156 147 LEU B CD1 2755 C CD2 . LEU B 147 ? 0.2407 0.2983 0.2872 -0.0145 -0.0838 -0.0026 147 LEU B CD2 2756 N N . VAL B 148 ? 0.2332 0.4027 0.3338 -0.0054 -0.0262 -0.0010 148 VAL B N 2757 C CA . VAL B 148 ? 0.1037 0.2623 0.1805 -0.0053 -0.0204 0.0055 148 VAL B CA 2758 C C . VAL B 148 ? 0.1988 0.3369 0.2693 -0.0229 -0.0290 0.0056 148 VAL B C 2759 O O . VAL B 148 ? 0.2250 0.3930 0.3257 -0.0392 -0.0298 -0.0019 148 VAL B O 2760 C CB . VAL B 148 ? 0.1818 0.3845 0.2799 -0.0045 -0.0091 0.0040 148 VAL B CB 2761 C CG1 . VAL B 148 ? 0.1778 0.3614 0.2429 -0.0039 -0.0062 0.0144 148 VAL B CG1 2762 C CG2 . VAL B 148 ? 0.0902 0.2903 0.1868 0.0103 -0.0001 -0.0004 148 VAL B CG2 2763 N N . LYS B 149 ? 0.2149 0.3050 0.2484 -0.0212 -0.0347 0.0108 149 LYS B N 2764 C CA . LYS B 149 ? 0.1865 0.2556 0.2172 -0.0382 -0.0446 0.0067 149 LYS B CA 2765 C C . LYS B 149 ? 0.2504 0.2821 0.2481 -0.0463 -0.0427 0.0146 149 LYS B C 2766 O O . LYS B 149 ? 0.2902 0.2905 0.2552 -0.0315 -0.0407 0.0232 149 LYS B O 2767 C CB . LYS B 149 ? 0.2021 0.2456 0.2214 -0.0322 -0.0567 0.0026 149 LYS B CB 2768 C CG . LYS B 149 ? 0.2706 0.3067 0.3003 -0.0483 -0.0697 -0.0075 149 LYS B CG 2769 C CD . LYS B 149 ? 0.3049 0.3196 0.3216 -0.0405 -0.0839 -0.0109 149 LYS B CD 2770 C CE . LYS B 149 ? 0.3238 0.3383 0.3564 -0.0541 -0.0996 -0.0246 149 LYS B CE 2771 N NZ . LYS B 149 ? 0.3532 0.3474 0.3724 -0.0690 -0.0954 -0.0274 149 LYS B NZ 2772 N N . ASP B 150 ? 0.2715 0.3067 0.2793 -0.0708 -0.0441 0.0095 150 ASP B N 2773 C CA . ASP B 150 ? 0.3218 0.3141 0.2982 -0.0861 -0.0439 0.0154 150 ASP B CA 2774 C C . ASP B 150 ? 0.3145 0.2897 0.2616 -0.0867 -0.0356 0.0321 150 ASP B C 2775 O O . ASP B 150 ? 0.3607 0.2828 0.2689 -0.0789 -0.0392 0.0425 150 ASP B O 2776 C CB . ASP B 150 ? 0.3742 0.3158 0.3224 -0.0757 -0.0536 0.0145 150 ASP B CB 2777 C CG . ASP B 150 ? 0.4121 0.3629 0.3811 -0.0826 -0.0646 -0.0015 150 ASP B CG 2778 O OD1 . ASP B 150 ? 0.3569 0.3464 0.3619 -0.0986 -0.0661 -0.0133 150 ASP B OD1 2779 O OD2 . ASP B 150 ? 0.5415 0.4629 0.4915 -0.0714 -0.0730 -0.0044 150 ASP B OD2 2780 N N . TYR B 151 ? 0.2904 0.3097 0.2557 -0.0954 -0.0264 0.0336 151 TYR B N 2781 C CA . TYR B 151 ? 0.3555 0.3592 0.2885 -0.0976 -0.0207 0.0507 151 TYR B CA 2782 C C . TYR B 151 ? 0.4367 0.4555 0.3692 -0.1351 -0.0122 0.0514 151 TYR B C 2783 O O . TYR B 151 ? 0.3699 0.4301 0.3401 -0.1568 -0.0087 0.0334 151 TYR B O 2784 C CB . TYR B 151 ? 0.2889 0.3302 0.2330 -0.0746 -0.0160 0.0534 151 TYR B CB 2785 C CG . TYR B 151 ? 0.2840 0.3979 0.2787 -0.0838 -0.0083 0.0390 151 TYR B CG 2786 C CD1 . TYR B 151 ? 0.1855 0.3280 0.2194 -0.0731 -0.0115 0.0241 151 TYR B CD1 2787 C CD2 . TYR B 151 ? 0.2272 0.3797 0.2293 -0.1038 0.0012 0.0396 151 TYR B CD2 2788 C CE1 . TYR B 151 ? 0.2371 0.4418 0.3204 -0.0795 -0.0072 0.0092 151 TYR B CE1 2789 C CE2 . TYR B 151 ? 0.1739 0.3966 0.2276 -0.1111 0.0077 0.0220 151 TYR B CE2 2790 C CZ . TYR B 151 ? 0.2767 0.5138 0.3682 -0.0936 0.0024 0.0060 151 TYR B CZ 2791 O OH . TYR B 151 ? 0.2182 0.4542 0.3307 -0.0778 0.0047 -0.0100 151 TYR B OH 2792 N N . PHE B 152 ? 0.2789 0.3579 0.3404 -0.0491 0.0461 -0.0270 152 PHE B N 2793 C CA . PHE B 152 ? 0.2268 0.3434 0.3083 -0.0316 0.0319 -0.0128 152 PHE B CA 2794 C C . PHE B 152 ? 0.2364 0.3768 0.3688 -0.0173 0.0416 0.0043 152 PHE B C 2795 O O . PHE B 152 ? 0.2581 0.3808 0.4304 -0.0220 0.0682 0.0083 152 PHE B O 2796 C CB . PHE B 152 ? 0.1734 0.2825 0.2412 -0.0468 0.0347 -0.0129 152 PHE B CB 2797 C CG . PHE B 152 ? 0.1495 0.2946 0.2350 -0.0307 0.0205 -0.0001 152 PHE B CG 2798 C CD1 . PHE B 152 ? 0.1375 0.3015 0.2565 -0.0213 0.0320 0.0116 152 PHE B CD1 2799 C CD2 . PHE B 152 ? 0.2226 0.3829 0.3028 -0.0268 -0.0013 0.0030 152 PHE B CD2 2800 C CE1 . PHE B 152 ? 0.1634 0.3593 0.2914 -0.0115 0.0216 0.0218 152 PHE B CE1 2801 C CE2 . PHE B 152 ? 0.2396 0.4284 0.3411 -0.0145 -0.0050 0.0102 152 PHE B CE2 2802 C CZ . PHE B 152 ? 0.1906 0.3964 0.3063 -0.0085 0.0063 0.0172 152 PHE B CZ 2803 N N . PRO B 153 ? 0.1348 0.3154 0.2720 -0.0062 0.0225 0.0172 153 PRO B N 2804 C CA . PRO B 153 ? 0.1764 0.3709 0.2828 -0.0029 0.0061 0.0062 153 PRO B CA 2805 C C . PRO B 153 ? 0.1387 0.3328 0.2326 -0.0018 -0.0008 -0.0035 153 PRO B C 2806 O O . PRO B 153 ? 0.1206 0.3015 0.2232 -0.0032 0.0031 -0.0011 153 PRO B O 2807 C CB . PRO B 153 ? 0.1507 0.3835 0.2653 -0.0025 0.0022 0.0199 153 PRO B CB 2808 C CG . PRO B 153 ? 0.1355 0.3867 0.2811 -0.0071 0.0003 0.0462 153 PRO B CG 2809 C CD . PRO B 153 ? 0.1129 0.3287 0.2918 -0.0040 0.0188 0.0463 153 PRO B CD 2810 N N . GLU B 154 ? 0.1271 0.3323 0.2094 -0.0005 -0.0050 -0.0162 154 GLU B N 2811 C CA . GLU B 154 ? 0.1298 0.3386 0.2013 -0.0037 -0.0059 -0.0290 154 GLU B CA 2812 C C . GLU B 154 ? 0.1899 0.4282 0.2540 -0.0172 -0.0110 -0.0140 154 GLU B C 2813 O O . GLU B 154 ? 0.2100 0.4712 0.2806 -0.0232 -0.0135 0.0051 154 GLU B O 2814 C CB . GLU B 154 ? 0.1538 0.3657 0.2300 -0.0042 0.0046 -0.0493 154 GLU B CB 2815 C CG . GLU B 154 ? 0.1971 0.3869 0.3033 0.0053 0.0021 -0.0520 154 GLU B CG 2816 C CD . GLU B 154 ? 0.3538 0.5312 0.4684 0.0057 0.0057 -0.0663 154 GLU B CD 2817 O OE1 . GLU B 154 ? 0.4068 0.5834 0.5563 0.0064 0.0239 -0.0819 154 GLU B OE1 2818 O OE2 . GLU B 154 ? 0.3325 0.4985 0.4278 0.0047 -0.0041 -0.0632 154 GLU B OE2 2819 N N . PRO B 155 ? 0.2506 0.4926 0.3044 -0.0265 -0.0165 -0.0166 155 PRO B N 2820 C CA . PRO B 155 ? 0.2591 0.4779 0.3070 -0.0218 -0.0135 -0.0378 155 PRO B CA 2821 C C . PRO B 155 ? 0.2842 0.4852 0.3509 -0.0145 -0.0184 -0.0252 155 PRO B C 2822 O O . PRO B 155 ? 0.3270 0.5352 0.4218 -0.0148 -0.0198 -0.0002 155 PRO B O 2823 C CB . PRO B 155 ? 0.1799 0.4206 0.1979 -0.0473 -0.0140 -0.0473 155 PRO B CB 2824 C CG . PRO B 155 ? 0.1864 0.4628 0.2057 -0.0659 -0.0322 -0.0101 155 PRO B CG 2825 C CD . PRO B 155 ? 0.2060 0.4846 0.2527 -0.0507 -0.0305 0.0082 155 PRO B CD 2826 N N . VAL B 156 ? 0.2174 0.3942 0.2792 -0.0093 -0.0165 -0.0417 156 VAL B N 2827 C CA . VAL B 156 ? 0.1608 0.3197 0.2360 -0.0073 -0.0163 -0.0351 156 VAL B CA 2828 C C . VAL B 156 ? 0.1670 0.3291 0.2307 -0.0127 -0.0214 -0.0477 156 VAL B C 2829 O O . VAL B 156 ? 0.2298 0.3876 0.2813 -0.0128 -0.0173 -0.0692 156 VAL B O 2830 C CB . VAL B 156 ? 0.2198 0.3404 0.2912 -0.0040 -0.0075 -0.0421 156 VAL B CB 2831 C CG1 . VAL B 156 ? 0.2735 0.3836 0.3311 -0.0030 -0.0148 -0.0548 156 VAL B CG1 2832 C CG2 . VAL B 156 ? 0.1910 0.2878 0.2751 -0.0070 0.0033 -0.0406 156 VAL B CG2 2833 N N . THR B 157 ? 0.1457 0.3168 0.2246 -0.0191 -0.0279 -0.0326 157 THR B N 2834 C CA . THR B 157 ? 0.2078 0.3797 0.2727 -0.0275 -0.0327 -0.0456 157 THR B CA 2835 C C . THR B 157 ? 0.2646 0.4024 0.3446 -0.0151 -0.0263 -0.0508 157 THR B C 2836 O O . THR B 157 ? 0.2405 0.3614 0.3466 -0.0096 -0.0172 -0.0377 157 THR B O 2837 C CB . THR B 157 ? 0.1740 0.3834 0.2412 -0.0522 -0.0505 -0.0215 157 THR B CB 2838 O OG1 . THR B 157 ? 0.3253 0.5295 0.4394 -0.0462 -0.0550 0.0028 157 THR B OG1 2839 C CG2 . THR B 157 ? 0.2123 0.4576 0.2825 -0.0672 -0.0613 0.0063 157 THR B CG2 2840 N N . VAL B 158 ? 0.2876 0.4119 0.3539 -0.0143 -0.0250 -0.0723 158 VAL B N 2841 C CA . VAL B 158 ? 0.2073 0.3010 0.2811 -0.0074 -0.0209 -0.0766 158 VAL B CA 2842 C C . VAL B 158 ? 0.2361 0.3346 0.3094 -0.0135 -0.0252 -0.0862 158 VAL B C 2843 O O . VAL B 158 ? 0.2870 0.3959 0.3473 -0.0219 -0.0233 -0.1047 158 VAL B O 2844 C CB . VAL B 158 ? 0.2085 0.2781 0.2747 -0.0023 -0.0187 -0.0855 158 VAL B CB 2845 C CG1 . VAL B 158 ? 0.1637 0.2032 0.2270 -0.0050 -0.0171 -0.0859 158 VAL B CG1 2846 C CG2 . VAL B 158 ? 0.2388 0.3053 0.2978 -0.0039 -0.0168 -0.0761 158 VAL B CG2 2847 N N . SER B 159 ? 0.2128 0.3005 0.3039 -0.0127 -0.0253 -0.0765 159 SER B N 2848 C CA . SER B 159 ? 0.2042 0.2930 0.2957 -0.0188 -0.0300 -0.0851 159 SER B CA 2849 C C . SER B 159 ? 0.2160 0.2704 0.3207 -0.0098 -0.0212 -0.0864 159 SER B C 2850 O O . SER B 159 ? 0.2206 0.2514 0.3289 -0.0067 -0.0089 -0.0810 159 SER B O 2851 C CB . SER B 159 ? 0.2356 0.3598 0.3392 -0.0376 -0.0457 -0.0626 159 SER B CB 2852 O OG . SER B 159 ? 0.2958 0.4182 0.4511 -0.0317 -0.0447 -0.0321 159 SER B OG 2853 N N . TRP B 160 ? 0.1894 0.2388 0.2960 -0.0119 -0.0239 -0.0964 160 TRP B N 2854 C CA . TRP B 160 ? 0.2143 0.2320 0.3292 -0.0071 -0.0156 -0.0983 160 TRP B CA 2855 C C . TRP B 160 ? 0.2191 0.2424 0.3630 -0.0110 -0.0176 -0.0884 160 TRP B C 2856 O O . TRP B 160 ? 0.3192 0.3677 0.4628 -0.0213 -0.0313 -0.0892 160 TRP B O 2857 C CB . TRP B 160 ? 0.1773 0.1793 0.2823 -0.0040 -0.0168 -0.1138 160 TRP B CB 2858 C CG . TRP B 160 ? 0.2412 0.2339 0.3348 -0.0038 -0.0182 -0.1090 160 TRP B CG 2859 C CD1 . TRP B 160 ? 0.1766 0.1854 0.2751 -0.0007 -0.0212 -0.1113 160 TRP B CD1 2860 C CD2 . TRP B 160 ? 0.2424 0.2084 0.3161 -0.0148 -0.0169 -0.0985 160 TRP B CD2 2861 N NE1 . TRP B 160 ? 0.1830 0.1811 0.2758 -0.0055 -0.0276 -0.0969 160 TRP B NE1 2862 C CE2 . TRP B 160 ? 0.2120 0.1846 0.2812 -0.0189 -0.0270 -0.0888 160 TRP B CE2 2863 C CE3 . TRP B 160 ? 0.2168 0.1530 0.2725 -0.0287 -0.0060 -0.0971 160 TRP B CE3 2864 C CZ2 . TRP B 160 ? 0.2800 0.2346 0.3196 -0.0421 -0.0337 -0.0731 160 TRP B CZ2 2865 C CZ3 . TRP B 160 ? 0.3626 0.2758 0.3798 -0.0547 -0.0053 -0.0890 160 TRP B CZ3 2866 C CH2 . TRP B 160 ? 0.4020 0.3267 0.4076 -0.0639 -0.0228 -0.0748 160 TRP B CH2 2867 N N . ASN B 161 ? 0.1741 0.1723 0.3433 -0.0087 -0.0006 -0.0796 161 ASN B N 2868 C CA . ASN B 161 ? 0.2089 0.2096 0.4258 -0.0105 0.0018 -0.0649 161 ASN B CA 2869 C C . ASN B 161 ? 0.2041 0.2525 0.4578 -0.0200 -0.0215 -0.0351 161 ASN B C 2870 O O . ASN B 161 ? 0.1743 0.2440 0.4361 -0.0314 -0.0404 -0.0272 161 ASN B O 2871 C CB . ASN B 161 ? 0.1795 0.1648 0.3814 -0.0101 -0.0014 -0.0814 161 ASN B CB 2872 C CG . ASN B 161 ? 0.2788 0.2207 0.4524 -0.0100 0.0182 -0.0959 161 ASN B CG 2873 O OD1 . ASN B 161 ? 0.3119 0.2383 0.4674 -0.0156 0.0364 -0.0917 161 ASN B OD1 2874 N ND2 . ASN B 161 ? 0.1991 0.1368 0.3529 -0.0093 0.0126 -0.0990 161 ASN B ND2 2875 N N . SER B 162 ? 0.2437 0.3105 0.5156 -0.0211 -0.0225 -0.0157 162 SER B N 2876 C CA . SER B 162 ? 0.2504 0.3684 0.5635 -0.0373 -0.0493 0.0260 162 SER B CA 2877 C C . SER B 162 ? 0.2362 0.3905 0.4915 -0.0638 -0.0814 0.0205 162 SER B C 2878 O O . SER B 162 ? 0.2496 0.4460 0.5300 -0.0911 -0.1107 0.0572 162 SER B O 2879 C CB . SER B 162 ? 0.2555 0.3814 0.6701 -0.0381 -0.0471 0.0680 162 SER B CB 2880 O OG . SER B 162 ? 0.2385 0.3223 0.7024 -0.0196 -0.0060 0.0710 162 SER B OG 2881 N N . GLY B 163 ? 0.2533 0.3908 0.4374 -0.0621 -0.0733 -0.0235 163 GLY B N 2882 C CA . GLY B 163 ? 0.2235 0.3832 0.3512 -0.0931 -0.0864 -0.0429 163 GLY B CA 2883 C C . GLY B 163 ? 0.3122 0.4523 0.4249 -0.0970 -0.0799 -0.0717 163 GLY B C 2884 O O . GLY B 163 ? 0.3410 0.4808 0.4071 -0.1184 -0.0722 -0.1060 163 GLY B O 2885 N N . ALA B 164 ? 0.1649 0.2776 0.2511 0.0096 -0.0271 -0.0223 164 ALA B N 2886 C CA . ALA B 164 ? 0.1604 0.2770 0.2594 0.0003 -0.0364 -0.0203 164 ALA B CA 2887 C C . ALA B 164 ? 0.2063 0.3102 0.3007 -0.0054 -0.0373 -0.0220 164 ALA B C 2888 O O . ALA B 164 ? 0.2263 0.3259 0.3245 -0.0120 -0.0466 -0.0224 164 ALA B O 2889 C CB . ALA B 164 ? 0.1554 0.2917 0.2735 -0.0044 -0.0337 -0.0130 164 ALA B CB 2890 N N . LEU B 165 ? 0.1561 0.2535 0.2423 -0.0029 -0.0284 -0.0229 165 LEU B N 2891 C CA . LEU B 165 ? 0.1573 0.2434 0.2399 -0.0073 -0.0295 -0.0244 165 LEU B CA 2892 C C . LEU B 165 ? 0.2662 0.3388 0.3356 -0.0014 -0.0280 -0.0307 165 LEU B C 2893 O O . LEU B 165 ? 0.3033 0.3755 0.3670 0.0039 -0.0196 -0.0316 165 LEU B O 2894 C CB . LEU B 165 ? 0.1518 0.2414 0.2378 -0.0106 -0.0218 -0.0196 165 LEU B CB 2895 C CG . LEU B 165 ? 0.2221 0.2986 0.3023 -0.0136 -0.0227 -0.0215 165 LEU B CG 2896 C CD1 . LEU B 165 ? 0.1623 0.2317 0.2447 -0.0202 -0.0328 -0.0222 165 LEU B CD1 2897 C CD2 . LEU B 165 ? 0.2177 0.2947 0.2974 -0.0154 -0.0152 -0.0170 165 LEU B CD2 2898 N N . THR B 166 ? 0.2075 0.2687 0.2720 -0.0023 -0.0358 -0.0347 166 THR B N 2899 C CA . THR B 166 ? 0.2285 0.2775 0.2816 0.0040 -0.0341 -0.0406 166 THR B CA 2900 C C . THR B 166 ? 0.2429 0.2808 0.2939 0.0015 -0.0388 -0.0429 166 THR B C 2901 O O . THR B 166 ? 0.3147 0.3463 0.3613 0.0057 -0.0348 -0.0463 166 THR B O 2902 C CB . THR B 166 ? 0.2191 0.2613 0.2628 0.0093 -0.0390 -0.0443 166 THR B CB 2903 O OG1 . THR B 166 ? 0.2495 0.2878 0.2949 0.0043 -0.0511 -0.0442 166 THR B OG1 2904 C CG2 . THR B 166 ? 0.1999 0.2509 0.2432 0.0135 -0.0348 -0.0427 166 THR B CG2 2905 N N . SER B 167 ? 0.2114 0.2470 0.2661 -0.0054 -0.0475 -0.0410 167 SER B N 2906 C CA . SER B 167 ? 0.2824 0.3054 0.3332 -0.0078 -0.0532 -0.0429 167 SER B CA 2907 C C . SER B 167 ? 0.3132 0.3367 0.3669 -0.0089 -0.0476 -0.0416 167 SER B C 2908 O O . SER B 167 ? 0.2747 0.3059 0.3347 -0.0136 -0.0440 -0.0366 167 SER B O 2909 C CB . SER B 167 ? 0.3285 0.3483 0.3822 -0.0164 -0.0635 -0.0403 167 SER B CB 2910 O OG . SER B 167 ? 0.4494 0.4571 0.4993 -0.0200 -0.0679 -0.0407 167 SER B OG 2911 N N . GLY B 168 ? 0.3055 0.3202 0.3541 -0.0038 -0.0470 -0.0460 168 GLY B N 2912 C CA . GLY B 168 ? 0.1822 0.1956 0.2331 -0.0045 -0.0443 -0.0453 168 GLY B CA 2913 C C . GLY B 168 ? 0.2606 0.2834 0.3155 -0.0014 -0.0347 -0.0447 168 GLY B C 2914 O O . GLY B 168 ? 0.2751 0.2973 0.3320 -0.0024 -0.0329 -0.0437 168 GLY B O 2915 N N . VAL B 169 ? 0.1665 0.1958 0.2208 0.0023 -0.0293 -0.0453 169 VAL B N 2916 C CA . VAL B 169 ? 0.1671 0.2029 0.2230 0.0055 -0.0201 -0.0451 169 VAL B CA 2917 C C . VAL B 169 ? 0.2858 0.3184 0.3419 0.0110 -0.0166 -0.0499 169 VAL B C 2918 O O . VAL B 169 ? 0.2818 0.3092 0.3340 0.0156 -0.0178 -0.0537 169 VAL B O 2919 C CB . VAL B 169 ? 0.1559 0.1982 0.2094 0.0076 -0.0155 -0.0437 169 VAL B CB 2920 C CG1 . VAL B 169 ? 0.1504 0.1961 0.2027 0.0110 -0.0061 -0.0439 169 VAL B CG1 2921 C CG2 . VAL B 169 ? 0.1816 0.2309 0.2388 0.0026 -0.0177 -0.0384 169 VAL B CG2 2922 N N . HIS B 170 ? 0.2576 0.2928 0.3181 0.0106 -0.0124 -0.0494 170 HIS B N 2923 C CA . HIS B 170 ? 0.2555 0.2916 0.3202 0.0150 -0.0077 -0.0531 170 HIS B CA 2924 C C . HIS B 170 ? 0.2853 0.3266 0.3513 0.0144 0.0004 -0.0515 170 HIS B C 2925 O O . HIS B 170 ? 0.2598 0.3017 0.3273 0.0108 -0.0001 -0.0489 170 HIS B O 2926 C CB . HIS B 170 ? 0.1544 0.1876 0.2257 0.0151 -0.0128 -0.0551 170 HIS B CB 2927 C CG . HIS B 170 ? 0.2061 0.2314 0.2743 0.0169 -0.0204 -0.0574 170 HIS B CG 2928 N ND1 . HIS B 170 ? 0.1702 0.1915 0.2337 0.0223 -0.0198 -0.0608 170 HIS B ND1 2929 C CD2 . HIS B 170 ? 0.1682 0.1864 0.2350 0.0143 -0.0290 -0.0570 170 HIS B CD2 2930 C CE1 . HIS B 170 ? 0.1794 0.1915 0.2388 0.0230 -0.0280 -0.0623 170 HIS B CE1 2931 N NE2 . HIS B 170 ? 0.2236 0.2338 0.2852 0.0180 -0.0337 -0.0601 170 HIS B NE2 2932 N N . THR B 171 ? 0.2223 0.2649 0.2852 0.0182 0.0077 -0.0529 171 THR B N 2933 C CA . THR B 171 ? 0.2295 0.2748 0.2924 0.0175 0.0155 -0.0516 171 THR B CA 2934 C C . THR B 171 ? 0.2765 0.3239 0.3486 0.0191 0.0199 -0.0546 171 THR B C 2935 O O . THR B 171 ? 0.3542 0.4008 0.4257 0.0238 0.0243 -0.0574 171 THR B O 2936 C CB . THR B 171 ? 0.1994 0.2438 0.2516 0.0200 0.0213 -0.0504 171 THR B CB 2937 O OG1 . THR B 171 ? 0.2625 0.3081 0.3104 0.0184 0.0170 -0.0472 171 THR B OG1 2938 C CG2 . THR B 171 ? 0.1477 0.1921 0.1976 0.0192 0.0294 -0.0492 171 THR B CG2 2939 N N . PHE B 172 ? 0.2468 0.2966 0.3275 0.0154 0.0185 -0.0540 172 PHE B N 2940 C CA . PHE B 172 ? 0.2231 0.2776 0.3174 0.0161 0.0210 -0.0566 172 PHE B CA 2941 C C . PHE B 172 ? 0.2181 0.2746 0.3124 0.0165 0.0321 -0.0566 172 PHE B C 2942 O O . PHE B 172 ? 0.2704 0.3233 0.3539 0.0149 0.0364 -0.0542 172 PHE B O 2943 C CB . PHE B 172 ? 0.2331 0.2888 0.3370 0.0118 0.0138 -0.0561 172 PHE B CB 2944 C CG . PHE B 172 ? 0.2090 0.2615 0.3140 0.0126 0.0035 -0.0570 172 PHE B CG 2945 C CD1 . PHE B 172 ? 0.1610 0.2162 0.2760 0.0168 0.0004 -0.0605 172 PHE B CD1 2946 C CD2 . PHE B 172 ? 0.1423 0.1881 0.2372 0.0095 -0.0024 -0.0541 172 PHE B CD2 2947 C CE1 . PHE B 172 ? 0.1473 0.1969 0.2607 0.0178 -0.0093 -0.0613 172 PHE B CE1 2948 C CE2 . PHE B 172 ? 0.1456 0.1863 0.2396 0.0097 -0.0114 -0.0546 172 PHE B CE2 2949 C CZ . PHE B 172 ? 0.1835 0.2253 0.2859 0.0137 -0.0153 -0.0583 172 PHE B CZ 2950 N N . PRO B 173 ? 0.2030 0.2647 0.3087 0.0191 0.0374 -0.0591 173 PRO B N 2951 C CA . PRO B 173 ? 0.2109 0.2744 0.3183 0.0182 0.0488 -0.0585 173 PRO B CA 2952 C C . PRO B 173 ? 0.2443 0.3085 0.3561 0.0108 0.0477 -0.0562 173 PRO B C 2953 O O . PRO B 173 ? 0.1912 0.2582 0.3131 0.0074 0.0389 -0.0563 173 PRO B O 2954 C CB . PRO B 173 ? 0.1539 0.2257 0.2783 0.0217 0.0533 -0.0612 173 PRO B CB 2955 C CG . PRO B 173 ? 0.1551 0.2245 0.2766 0.0277 0.0469 -0.0636 173 PRO B CG 2956 C CD . PRO B 173 ? 0.2204 0.2854 0.3355 0.0243 0.0348 -0.0623 173 PRO B CD 2957 N N . ALA B 174 ? 0.2341 0.2934 0.3360 0.0086 0.0557 -0.0543 174 ALA B N 2958 C CA . ALA B 174 ? 0.2687 0.3258 0.3723 0.0015 0.0551 -0.0522 174 ALA B CA 2959 C C . ALA B 174 ? 0.2279 0.2947 0.3552 -0.0029 0.0550 -0.0533 174 ALA B C 2960 O O . ALA B 174 ? 0.2403 0.3160 0.3814 0.0000 0.0608 -0.0551 174 ALA B O 2961 C CB . ALA B 174 ? 0.2743 0.3225 0.3614 0.0009 0.0646 -0.0501 174 ALA B CB 2962 N N . VAL B 175 ? 0.2380 0.3030 0.3700 -0.0095 0.0481 -0.0522 175 VAL B N 2963 C CA . VAL B 175 ? 0.2339 0.3082 0.3893 -0.0151 0.0469 -0.0528 175 VAL B CA 2964 C C . VAL B 175 ? 0.2083 0.2744 0.3579 -0.0233 0.0488 -0.0504 175 VAL B C 2965 O O . VAL B 175 ? 0.2262 0.2785 0.3553 -0.0247 0.0450 -0.0485 175 VAL B O 2966 C CB . VAL B 175 ? 0.2320 0.3121 0.4029 -0.0156 0.0329 -0.0546 175 VAL B CB 2967 C CG1 . VAL B 175 ? 0.1636 0.2469 0.3340 -0.0076 0.0296 -0.0568 175 VAL B CG1 2968 C CG2 . VAL B 175 ? 0.2625 0.3300 0.4204 -0.0202 0.0220 -0.0530 175 VAL B CG2 2969 N N . LEU B 176 ? 0.2148 0.2888 0.3821 -0.0284 0.0553 -0.0502 176 LEU B N 2970 C CA . LEU B 176 ? 0.2305 0.2962 0.3938 -0.0373 0.0574 -0.0479 176 LEU B CA 2971 C C . LEU B 176 ? 0.2265 0.2919 0.4015 -0.0441 0.0426 -0.0482 176 LEU B C 2972 O O . LEU B 176 ? 0.2618 0.3421 0.4642 -0.0457 0.0370 -0.0499 176 LEU B O 2973 C CB . LEU B 176 ? 0.2279 0.3029 0.4074 -0.0409 0.0710 -0.0472 176 LEU B CB 2974 C CG . LEU B 176 ? 0.3011 0.3663 0.4751 -0.0505 0.0772 -0.0444 176 LEU B CG 2975 C CD1 . LEU B 176 ? 0.2074 0.2506 0.3450 -0.0485 0.0800 -0.0425 176 LEU B CD1 2976 C CD2 . LEU B 176 ? 0.2787 0.3546 0.4687 -0.0522 0.0931 -0.0435 176 LEU B CD2 2977 N N . GLN B 177 ? 0.1898 0.2373 0.3428 -0.0471 0.0357 -0.0466 177 GLN B N 2978 C CA . GLN B 177 ? 0.1964 0.2383 0.3548 -0.0536 0.0211 -0.0468 177 GLN B CA 2979 C C . GLN B 177 ? 0.2493 0.2915 0.4209 -0.0646 0.0227 -0.0456 177 GLN B C 2980 O O . GLN B 177 ? 0.2279 0.2711 0.3989 -0.0671 0.0361 -0.0441 177 GLN B O 2981 C CB . GLN B 177 ? 0.2044 0.2244 0.3310 -0.0517 0.0142 -0.0453 177 GLN B CB 2982 C CG . GLN B 177 ? 0.2344 0.2542 0.3483 -0.0421 0.0137 -0.0457 177 GLN B CG 2983 C CD . GLN B 177 ? 0.2675 0.2675 0.3492 -0.0393 0.0124 -0.0432 177 GLN B CD 2984 O OE1 . GLN B 177 ? 0.3420 0.3318 0.4140 -0.0387 0.0020 -0.0429 177 GLN B OE1 2985 N NE2 . GLN B 177 ? 0.2600 0.2537 0.3241 -0.0367 0.0233 -0.0414 177 GLN B NE2 2986 N N . SER B 178 ? 0.3751 0.4151 0.5578 -0.0715 0.0085 -0.0463 178 SER B N 2987 C CA . SER B 178 ? 0.3673 0.4087 0.5662 -0.0835 0.0075 -0.0452 178 SER B CA 2988 C C . SER B 178 ? 0.3521 0.3704 0.5211 -0.0881 0.0139 -0.0423 178 SER B C 2989 O O . SER B 178 ? 0.3649 0.3830 0.5423 -0.0975 0.0199 -0.0406 178 SER B O 2990 C CB . SER B 178 ? 0.3968 0.4368 0.6095 -0.0894 -0.0121 -0.0467 178 SER B CB 2991 O OG . SER B 178 ? 0.4513 0.4649 0.6309 -0.0882 -0.0230 -0.0462 178 SER B OG 2992 N N . SER B 179 ? 0.3007 0.2994 0.4349 -0.0814 0.0130 -0.0415 179 SER B N 2993 C CA . SER B 179 ? 0.3105 0.2863 0.4128 -0.0829 0.0195 -0.0389 179 SER B CA 2994 C C . SER B 179 ? 0.3115 0.2920 0.4106 -0.0807 0.0380 -0.0376 179 SER B C 2995 O O . SER B 179 ? 0.2739 0.2363 0.3494 -0.0827 0.0447 -0.0354 179 SER B O 2996 C CB . SER B 179 ? 0.2648 0.2220 0.3334 -0.0742 0.0152 -0.0383 179 SER B CB 2997 O OG . SER B 179 ? 0.2547 0.2229 0.3213 -0.0636 0.0225 -0.0389 179 SER B OG 2998 N N . GLY B 180 ? 0.2428 0.2450 0.3628 -0.0758 0.0459 -0.0389 180 GLY B N 2999 C CA . GLY B 180 ? 0.2426 0.2471 0.3567 -0.0722 0.0630 -0.0379 180 GLY B CA 3000 C C . GLY B 180 ? 0.3300 0.3241 0.4143 -0.0609 0.0672 -0.0377 180 GLY B C 3001 O O . GLY B 180 ? 0.3138 0.3026 0.3837 -0.0571 0.0796 -0.0367 180 GLY B O 3002 N N . LEU B 181 ? 0.2888 0.2797 0.3641 -0.0555 0.0565 -0.0386 181 LEU B N 3003 C CA . LEU B 181 ? 0.2906 0.2757 0.3433 -0.0451 0.0589 -0.0382 181 LEU B CA 3004 C C . LEU B 181 ? 0.2483 0.2502 0.3165 -0.0387 0.0554 -0.0405 181 LEU B C 3005 O O . LEU B 181 ? 0.2846 0.2971 0.3742 -0.0416 0.0469 -0.0421 181 LEU B O 3006 C CB . LEU B 181 ? 0.3265 0.2926 0.3537 -0.0438 0.0509 -0.0367 181 LEU B CB 3007 C CG . LEU B 181 ? 0.2878 0.2321 0.2937 -0.0491 0.0528 -0.0345 181 LEU B CG 3008 C CD1 . LEU B 181 ? 0.2706 0.1960 0.2515 -0.0464 0.0443 -0.0331 181 LEU B CD1 3009 C CD2 . LEU B 181 ? 0.2971 0.2350 0.2861 -0.0450 0.0664 -0.0332 181 LEU B CD2 3010 N N . TYR B 182 ? 0.2194 0.2228 0.2762 -0.0301 0.0609 -0.0406 182 TYR B N 3011 C CA . TYR B 182 ? 0.2141 0.2314 0.2834 -0.0242 0.0579 -0.0427 182 TYR B CA 3012 C C . TYR B 182 ? 0.1864 0.1997 0.2465 -0.0209 0.0480 -0.0422 182 TYR B C 3013 O O . TYR B 182 ? 0.1938 0.1939 0.2334 -0.0201 0.0464 -0.0400 182 TYR B O 3014 C CB . TYR B 182 ? 0.1883 0.2086 0.2509 -0.0170 0.0678 -0.0433 182 TYR B CB 3015 C CG . TYR B 182 ? 0.2829 0.3091 0.3570 -0.0186 0.0787 -0.0440 182 TYR B CG 3016 C CD1 . TYR B 182 ? 0.2576 0.2991 0.3550 -0.0174 0.0796 -0.0463 182 TYR B CD1 3017 C CD2 . TYR B 182 ? 0.2054 0.2208 0.2658 -0.0208 0.0889 -0.0423 182 TYR B CD2 3018 C CE1 . TYR B 182 ? 0.1898 0.2369 0.2977 -0.0182 0.0913 -0.0466 182 TYR B CE1 3019 C CE2 . TYR B 182 ? 0.2111 0.2307 0.2808 -0.0224 0.1003 -0.0424 182 TYR B CE2 3020 C CZ . TYR B 182 ? 0.2298 0.2659 0.3238 -0.0211 0.1020 -0.0445 182 TYR B CZ 3021 O OH . TYR B 182 ? 0.2569 0.2971 0.3597 -0.0221 0.1152 -0.0442 182 TYR B OH 3022 N N . SER B 183 ? 0.2599 0.2841 0.3343 -0.0184 0.0421 -0.0441 183 SER B N 3023 C CA . SER B 183 ? 0.3300 0.3512 0.3969 -0.0153 0.0338 -0.0435 183 SER B CA 3024 C C . SER B 183 ? 0.3518 0.3841 0.4283 -0.0101 0.0331 -0.0455 183 SER B C 3025 O O . SER B 183 ? 0.3854 0.4281 0.4794 -0.0098 0.0348 -0.0480 183 SER B O 3026 C CB . SER B 183 ? 0.3542 0.3712 0.4270 -0.0201 0.0225 -0.0437 183 SER B CB 3027 O OG . SER B 183 ? 0.4177 0.4296 0.4810 -0.0171 0.0155 -0.0428 183 SER B OG 3028 N N . LEU B 184 ? 0.3126 0.3425 0.3778 -0.0060 0.0308 -0.0442 184 LEU B N 3029 C CA . LEU B 184 ? 0.2480 0.2853 0.3208 -0.0023 0.0272 -0.0459 184 LEU B CA 3030 C C . LEU B 184 ? 0.2550 0.2879 0.3187 -0.0013 0.0208 -0.0438 184 LEU B C 3031 O O . LEU B 184 ? 0.2027 0.2276 0.2525 -0.0019 0.0211 -0.0407 184 LEU B O 3032 C CB . LEU B 184 ? 0.2114 0.2534 0.2830 0.0025 0.0348 -0.0472 184 LEU B CB 3033 C CG . LEU B 184 ? 0.2198 0.2579 0.2748 0.0064 0.0398 -0.0454 184 LEU B CG 3034 C CD1 . LEU B 184 ? 0.2321 0.2709 0.2824 0.0083 0.0337 -0.0439 184 LEU B CD1 3035 C CD2 . LEU B 184 ? 0.1539 0.1938 0.2080 0.0106 0.0473 -0.0474 184 LEU B CD2 3036 N N . SER B 185 ? 0.2072 0.2445 0.2780 0.0004 0.0156 -0.0453 185 SER B N 3037 C CA . SER B 185 ? 0.2144 0.2484 0.2774 0.0010 0.0109 -0.0431 185 SER B CA 3038 C C . SER B 185 ? 0.2205 0.2597 0.2844 0.0043 0.0119 -0.0439 185 SER B C 3039 O O . SER B 185 ? 0.2039 0.2476 0.2755 0.0067 0.0134 -0.0472 185 SER B O 3040 C CB . SER B 185 ? 0.2714 0.3011 0.3386 -0.0011 0.0014 -0.0436 185 SER B CB 3041 O OG . SER B 185 ? 0.3817 0.4029 0.4430 -0.0040 -0.0012 -0.0421 185 SER B OG 3042 N N . SER B 186 ? 0.2251 0.2632 0.2810 0.0045 0.0111 -0.0408 186 SER B N 3043 C CA . SER B 186 ? 0.1408 0.1825 0.1974 0.0062 0.0093 -0.0412 186 SER B CA 3044 C C . SER B 186 ? 0.2184 0.2572 0.2739 0.0032 0.0029 -0.0386 186 SER B C 3045 O O . SER B 186 ? 0.2337 0.2694 0.2828 0.0015 0.0040 -0.0347 186 SER B O 3046 C CB . SER B 186 ? 0.1701 0.2148 0.2194 0.0089 0.0150 -0.0393 186 SER B CB 3047 O OG . SER B 186 ? 0.1409 0.1887 0.1909 0.0097 0.0114 -0.0392 186 SER B OG 3048 N N . VAL B 187 ? 0.1792 0.2170 0.2391 0.0029 -0.0033 -0.0406 187 VAL B N 3049 C CA . VAL B 187 ? 0.1687 0.2016 0.2264 -0.0006 -0.0093 -0.0380 187 VAL B CA 3050 C C . VAL B 187 ? 0.1491 0.1841 0.2074 -0.0015 -0.0123 -0.0374 187 VAL B C 3051 O O . VAL B 187 ? 0.1929 0.2314 0.2525 0.0014 -0.0115 -0.0399 187 VAL B O 3052 C CB . VAL B 187 ? 0.1521 0.1781 0.2130 -0.0010 -0.0163 -0.0407 187 VAL B CB 3053 C CG1 . VAL B 187 ? 0.1526 0.1761 0.2138 -0.0010 -0.0152 -0.0411 187 VAL B CG1 3054 C CG2 . VAL B 187 ? 0.1994 0.2272 0.2670 0.0027 -0.0188 -0.0457 187 VAL B CG2 3055 N N . VAL B 188 ? 0.1538 0.1851 0.2100 -0.0058 -0.0162 -0.0340 188 VAL B N 3056 C CA . VAL B 188 ? 0.1571 0.1890 0.2148 -0.0083 -0.0208 -0.0333 188 VAL B CA 3057 C C . VAL B 188 ? 0.2032 0.2261 0.2579 -0.0134 -0.0262 -0.0307 188 VAL B C 3058 O O . VAL B 188 ? 0.1768 0.1955 0.2272 -0.0151 -0.0240 -0.0275 188 VAL B O 3059 C CB . VAL B 188 ? 0.2487 0.2909 0.3085 -0.0090 -0.0167 -0.0297 188 VAL B CB 3060 C CG1 . VAL B 188 ? 0.1532 0.1986 0.2114 -0.0112 -0.0109 -0.0238 188 VAL B CG1 3061 C CG2 . VAL B 188 ? 0.2264 0.2695 0.2893 -0.0124 -0.0232 -0.0293 188 VAL B CG2 3062 N N . THR B 189 ? 0.1721 0.1892 0.2267 -0.0155 -0.0335 -0.0322 189 THR B N 3063 C CA . THR B 189 ? 0.1827 0.1894 0.2327 -0.0211 -0.0386 -0.0294 189 THR B CA 3064 C C . THR B 189 ? 0.2363 0.2479 0.2898 -0.0276 -0.0393 -0.0247 189 THR B C 3065 O O . THR B 189 ? 0.2923 0.3101 0.3503 -0.0272 -0.0413 -0.0261 189 THR B O 3066 C CB . THR B 189 ? 0.2500 0.2433 0.2956 -0.0192 -0.0473 -0.0341 189 THR B CB 3067 O OG1 . THR B 189 ? 0.2513 0.2458 0.2987 -0.0156 -0.0504 -0.0385 189 THR B OG1 3068 C CG2 . THR B 189 ? 0.1904 0.1800 0.2352 -0.0141 -0.0472 -0.0373 189 THR B CG2 3069 N N . VAL B 190 ? 0.2421 0.2508 0.2936 -0.0334 -0.0373 -0.0189 190 VAL B N 3070 C CA . VAL B 190 ? 0.2692 0.2855 0.3275 -0.0405 -0.0365 -0.0134 190 VAL B CA 3071 C C . VAL B 190 ? 0.3080 0.3112 0.3600 -0.0477 -0.0388 -0.0092 190 VAL B C 3072 O O . VAL B 190 ? 0.3371 0.3264 0.3782 -0.0459 -0.0394 -0.0100 190 VAL B O 3073 C CB . VAL B 190 ? 0.2516 0.2838 0.3165 -0.0395 -0.0262 -0.0084 190 VAL B CB 3074 C CG1 . VAL B 190 ? 0.1742 0.2173 0.2432 -0.0324 -0.0239 -0.0122 190 VAL B CG1 3075 C CG2 . VAL B 190 ? 0.1896 0.2153 0.2455 -0.0381 -0.0188 -0.0049 190 VAL B CG2 3076 N N . PRO B 191 ? 0.3238 0.3302 0.3822 -0.0561 -0.0407 -0.0047 191 PRO B N 3077 C CA . PRO B 191 ? 0.3407 0.3339 0.3923 -0.0639 -0.0412 0.0003 191 PRO B CA 3078 C C . PRO B 191 ? 0.3477 0.3423 0.3953 -0.0633 -0.0299 0.0061 191 PRO B C 3079 O O . PRO B 191 ? 0.3658 0.3776 0.4230 -0.0621 -0.0213 0.0099 191 PRO B O 3080 C CB . PRO B 191 ? 0.2358 0.2379 0.2999 -0.0736 -0.0438 0.0047 191 PRO B CB 3081 C CG . PRO B 191 ? 0.2269 0.2377 0.2984 -0.0699 -0.0504 -0.0008 191 PRO B CG 3082 C CD . PRO B 191 ? 0.3273 0.3473 0.3986 -0.0593 -0.0440 -0.0043 191 PRO B CD 3083 N N . SER B 192 ? 0.2462 0.2212 0.2779 -0.0634 -0.0303 0.0069 192 SER B N 3084 C CA . SER B 192 ? 0.3593 0.3310 0.3824 -0.0615 -0.0202 0.0118 192 SER B CA 3085 C C . SER B 192 ? 0.3100 0.2905 0.3400 -0.0687 -0.0104 0.0211 192 SER B C 3086 O O . SER B 192 ? 0.3425 0.3284 0.3706 -0.0656 0.0006 0.0256 192 SER B O 3087 C CB . SER B 192 ? 0.3733 0.3194 0.3758 -0.0594 -0.0243 0.0102 192 SER B CB 3088 O OG . SER B 192 ? 0.4162 0.3465 0.4118 -0.0666 -0.0303 0.0119 192 SER B OG 3089 N N . SER B 193 ? 0.2837 0.2662 0.3225 -0.0782 -0.0142 0.0239 193 SER B N 3090 C CA . SER B 193 ? 0.2682 0.2640 0.3197 -0.0863 -0.0050 0.0330 193 SER B CA 3091 C C . SER B 193 ? 0.2805 0.3052 0.3526 -0.0832 0.0014 0.0348 193 SER B C 3092 O O . SER B 193 ? 0.3295 0.3689 0.4140 -0.0873 0.0112 0.0426 193 SER B O 3093 C CB . SER B 193 ? 0.2799 0.2716 0.3380 -0.0984 -0.0124 0.0353 193 SER B CB 3094 O OG . SER B 193 ? 0.3383 0.3357 0.4056 -0.0988 -0.0246 0.0290 193 SER B OG 3095 N N . SER B 194 ? 0.2640 0.2966 0.3397 -0.0756 -0.0038 0.0278 194 SER B N 3096 C CA . SER B 194 ? 0.2909 0.3482 0.3835 -0.0716 0.0008 0.0286 194 SER B CA 3097 C C . SER B 194 ? 0.3243 0.3849 0.4094 -0.0617 0.0118 0.0296 194 SER B C 3098 O O . SER B 194 ? 0.2970 0.3766 0.3935 -0.0571 0.0174 0.0310 194 SER B O 3099 C CB . SER B 194 ? 0.2337 0.2965 0.3328 -0.0689 -0.0103 0.0210 194 SER B CB 3100 O OG . SER B 194 ? 0.3752 0.4304 0.4623 -0.0592 -0.0112 0.0143 194 SER B OG 3101 N N . LEU B 195 ? 0.3887 0.3750 0.3649 0.0161 0.1177 0.0113 195 LEU B N 3102 C CA . LEU B 195 ? 0.3364 0.3570 0.3443 0.0461 0.0957 0.0150 195 LEU B CA 3103 C C . LEU B 195 ? 0.3984 0.4658 0.4051 0.0536 0.0819 0.0221 195 LEU B C 3104 O O . LEU B 195 ? 0.4580 0.5418 0.4741 0.0731 0.0743 0.0238 195 LEU B O 3105 C CB . LEU B 195 ? 0.2809 0.2861 0.3145 0.0682 0.0935 0.0228 195 LEU B CB 3106 C CG . LEU B 195 ? 0.2755 0.2479 0.3299 0.0736 0.1112 0.0296 195 LEU B CG 3107 C CD1 . LEU B 195 ? 0.2514 0.2369 0.3421 0.0905 0.1027 0.0546 195 LEU B CD1 3108 C CD2 . LEU B 195 ? 0.2537 0.2282 0.3101 0.0728 0.1056 0.0205 195 LEU B CD2 3109 N N . GLY B 196 ? 0.4084 0.4905 0.4010 0.0393 0.0848 0.0285 196 GLY B N 3110 C CA . GLY B 196 ? 0.3361 0.4652 0.3323 0.0505 0.0788 0.0417 196 GLY B CA 3111 C C . GLY B 196 ? 0.4002 0.5876 0.4018 0.0364 0.0764 0.0624 196 GLY B C 3112 O O . GLY B 196 ? 0.3632 0.5962 0.3826 0.0582 0.0790 0.0830 196 GLY B O 3113 N N . THR B 197 ? 0.4651 0.6512 0.4497 -0.0018 0.0751 0.0623 197 THR B N 3114 C CA . THR B 197 ? 0.4178 0.6750 0.4046 -0.0321 0.0663 0.0928 197 THR B CA 3115 C C . THR B 197 ? 0.3821 0.6538 0.3821 -0.0347 0.0618 0.0983 197 THR B C 3116 O O . THR B 197 ? 0.3638 0.7048 0.3958 -0.0288 0.0530 0.1327 197 THR B O 3117 C CB . THR B 197 ? 0.4311 0.6797 0.3689 -0.0953 0.0626 0.0939 197 THR B CB 3118 O OG1 . THR B 197 ? 0.5795 0.7614 0.4728 -0.1310 0.0716 0.0697 197 THR B OG1 3119 C CG2 . THR B 197 ? 0.3151 0.5298 0.2332 -0.0944 0.0731 0.0833 197 THR B CG2 3120 N N . GLN B 198 ? 0.3310 0.5351 0.3121 -0.0393 0.0679 0.0680 198 GLN B N 3121 C CA . GLN B 198 ? 0.2729 0.4841 0.2592 -0.0485 0.0639 0.0701 198 GLN B CA 3122 C C . GLN B 198 ? 0.2479 0.4468 0.2726 0.0049 0.0643 0.0639 198 GLN B C 3123 O O . GLN B 198 ? 0.2402 0.3933 0.2681 0.0344 0.0692 0.0447 198 GLN B O 3124 C CB . GLN B 198 ? 0.3564 0.4928 0.2935 -0.0853 0.0779 0.0419 198 GLN B CB 3125 C CG . GLN B 198 ? 0.5396 0.6946 0.4372 -0.1456 0.0721 0.0518 198 GLN B CG 3126 C CD . GLN B 198 ? 0.6636 0.8450 0.5359 -0.1862 0.0513 0.0648 198 GLN B CD 3127 O OE1 . GLN B 198 ? 0.7391 0.8901 0.5888 -0.1929 0.0595 0.0558 198 GLN B OE1 3128 N NE2 . GLN B 198 ? 0.7006 0.9459 0.5789 -0.2149 0.0223 0.0888 198 GLN B NE2 3129 N N . THR B 199 ? 0.1938 0.4332 0.2432 0.0118 0.0588 0.0838 199 THR B N 3130 C CA . THR B 199 ? 0.2022 0.4117 0.2729 0.0530 0.0621 0.0741 199 THR B CA 3131 C C . THR B 199 ? 0.1805 0.3491 0.2397 0.0372 0.0595 0.0526 199 THR B C 3132 O O . THR B 199 ? 0.1955 0.3765 0.2367 -0.0025 0.0573 0.0558 199 THR B O 3133 C CB . THR B 199 ? 0.1788 0.4414 0.2870 0.0820 0.0675 0.1107 199 THR B CB 3134 O OG1 . THR B 199 ? 0.1680 0.4925 0.2915 0.0514 0.0570 0.1402 199 THR B OG1 3135 C CG2 . THR B 199 ? 0.1873 0.4736 0.3003 0.0985 0.0742 0.1348 199 THR B CG2 3136 N N . TYR B 200 ? 0.2209 0.3410 0.2849 0.0628 0.0607 0.0336 200 TYR B N 3137 C CA . TYR B 200 ? 0.1750 0.2643 0.2374 0.0537 0.0606 0.0203 200 TYR B CA 3138 C C . TYR B 200 ? 0.2370 0.3224 0.3174 0.0769 0.0540 0.0235 200 TYR B C 3139 O O . TYR B 200 ? 0.2887 0.3474 0.3669 0.0997 0.0525 0.0186 200 TYR B O 3140 C CB . TYR B 200 ? 0.1847 0.2259 0.2401 0.0543 0.0698 0.0049 200 TYR B CB 3141 C CG . TYR B 200 ? 0.2518 0.2773 0.2798 0.0279 0.0861 0.0005 200 TYR B CG 3142 C CD1 . TYR B 200 ? 0.2496 0.2506 0.2444 -0.0075 0.1027 -0.0065 200 TYR B CD1 3143 C CD2 . TYR B 200 ? 0.2417 0.2672 0.2651 0.0329 0.0877 0.0022 200 TYR B CD2 3144 C CE1 . TYR B 200 ? 0.2997 0.2651 0.2492 -0.0397 0.1238 -0.0136 200 TYR B CE1 3145 C CE2 . TYR B 200 ? 0.3209 0.3221 0.3116 0.0055 0.1051 -0.0019 200 TYR B CE2 3146 C CZ . TYR B 200 ? 0.3211 0.2866 0.2706 -0.0322 0.1247 -0.0108 200 TYR B CZ 3147 O OH . TYR B 200 ? 0.3607 0.2804 0.2578 -0.0673 0.1484 -0.0182 200 TYR B OH 3148 N N . ILE B 201 ? 0.1923 0.3005 0.2810 0.0644 0.0508 0.0328 201 ILE B N 3149 C CA . ILE B 201 ? 0.1572 0.2610 0.2620 0.0839 0.0469 0.0390 201 ILE B CA 3150 C C . ILE B 201 ? 0.2289 0.3190 0.3342 0.0670 0.0426 0.0299 201 ILE B C 3151 O O . ILE B 201 ? 0.2714 0.3798 0.3667 0.0360 0.0447 0.0321 201 ILE B O 3152 C CB . ILE B 201 ? 0.1565 0.3153 0.2851 0.0934 0.0499 0.0732 201 ILE B CB 3153 C CG1 . ILE B 201 ? 0.1757 0.3323 0.2986 0.1137 0.0604 0.0839 201 ILE B CG1 3154 C CG2 . ILE B 201 ? 0.1662 0.3043 0.3023 0.1073 0.0494 0.0781 201 ILE B CG2 3155 C CD1 . ILE B 201 ? 0.1982 0.3857 0.3364 0.1243 0.0698 0.1219 201 ILE B CD1 3156 N N . CYS B 202 ? 0.1539 0.2093 0.2631 0.0812 0.0378 0.0213 202 CYS B N 3157 C CA . CYS B 202 ? 0.2055 0.2556 0.3223 0.0701 0.0346 0.0192 202 CYS B CA 3158 C C . CYS B 202 ? 0.1489 0.2162 0.2777 0.0784 0.0287 0.0338 202 CYS B C 3159 O O . CYS B 202 ? 0.2645 0.3108 0.3901 0.1006 0.0300 0.0379 202 CYS B O 3160 C CB . CYS B 202 ? 0.2321 0.2507 0.3542 0.0758 0.0303 0.0131 202 CYS B CB 3161 S SG . CYS B 202 ? 0.3021 0.2904 0.4104 0.0879 0.0148 0.0145 202 CYS B SG 3162 N N . ASN B 203 ? 0.1985 0.2970 0.3342 0.0577 0.0269 0.0432 203 ASN B N 3163 C CA . ASN B 203 ? 0.1662 0.2912 0.3219 0.0644 0.0219 0.0655 203 ASN B CA 3164 C C . ASN B 203 ? 0.1716 0.2699 0.3284 0.0604 0.0155 0.0552 203 ASN B C 3165 O O . ASN B 203 ? 0.1488 0.2489 0.2982 0.0360 0.0171 0.0465 203 ASN B O 3166 C CB . ASN B 203 ? 0.1390 0.3314 0.3015 0.0340 0.0183 0.0915 203 ASN B CB 3167 C CG . ASN B 203 ? 0.2241 0.4502 0.3788 0.0219 0.0213 0.1021 203 ASN B CG 3168 O OD1 . ASN B 203 ? 0.2081 0.4271 0.3284 -0.0148 0.0233 0.0867 203 ASN B OD1 3169 N ND2 . ASN B 203 ? 0.1410 0.3946 0.3228 0.0535 0.0273 0.1291 203 ASN B ND2 3170 N N . VAL B 204 ? 0.1534 0.2188 0.3119 0.0818 0.0128 0.0566 204 VAL B N 3171 C CA . VAL B 204 ? 0.1561 0.1980 0.3147 0.0753 0.0031 0.0506 204 VAL B CA 3172 C C . VAL B 204 ? 0.2728 0.3267 0.4457 0.0799 0.0015 0.0701 204 VAL B C 3173 O O . VAL B 204 ? 0.3573 0.4021 0.5252 0.0973 0.0123 0.0829 204 VAL B O 3174 C CB . VAL B 204 ? 0.1820 0.1713 0.3173 0.0808 -0.0027 0.0390 204 VAL B CB 3175 C CG1 . VAL B 204 ? 0.1920 0.1646 0.3264 0.0683 -0.0166 0.0414 204 VAL B CG1 3176 C CG2 . VAL B 204 ? 0.1708 0.1628 0.3042 0.0756 -0.0024 0.0297 204 VAL B CG2 3177 N N . ASN B 205 ? 0.1946 0.2652 0.3778 0.0617 -0.0071 0.0717 205 ASN B N 3178 C CA . ASN B 205 ? 0.1787 0.2646 0.3785 0.0639 -0.0104 0.0931 205 ASN B CA 3179 C C . ASN B 205 ? 0.2477 0.3102 0.4449 0.0531 -0.0219 0.0858 205 ASN B C 3180 O O . ASN B 205 ? 0.2837 0.3610 0.4840 0.0341 -0.0249 0.0773 205 ASN B O 3181 C CB . ASN B 205 ? 0.1666 0.3234 0.3847 0.0421 -0.0122 0.1155 205 ASN B CB 3182 C CG . ASN B 205 ? 0.2594 0.4392 0.4944 0.0463 -0.0122 0.1469 205 ASN B CG 3183 O OD1 . ASN B 205 ? 0.3334 0.4705 0.5659 0.0628 -0.0092 0.1456 205 ASN B OD1 3184 N ND2 . ASN B 205 ? 0.2713 0.5123 0.5129 0.0249 -0.0141 0.1760 205 ASN B ND2 3185 N N . HIS B 206 ? 0.3385 0.3580 0.5253 0.0645 -0.0232 0.0913 206 HIS B N 3186 C CA . HIS B 206 ? 0.2560 0.2584 0.4393 0.0492 -0.0375 0.0904 206 HIS B CA 3187 C C . HIS B 206 ? 0.2299 0.2426 0.4295 0.0550 -0.0348 0.1132 206 HIS B C 3188 O O . HIS B 206 ? 0.2857 0.2436 0.4662 0.0696 -0.0244 0.1207 206 HIS B O 3189 C CB . HIS B 206 ? 0.2470 0.1823 0.3890 0.0428 -0.0444 0.0790 206 HIS B CB 3190 C CG . HIS B 206 ? 0.2560 0.1867 0.3951 0.0181 -0.0644 0.0843 206 HIS B CG 3191 N ND1 . HIS B 206 ? 0.3153 0.1877 0.4179 0.0072 -0.0683 0.0880 206 HIS B ND1 3192 C CD2 . HIS B 206 ? 0.2213 0.1972 0.3891 0.0022 -0.0775 0.0910 206 HIS B CD2 3193 C CE1 . HIS B 206 ? 0.3097 0.2014 0.4198 -0.0195 -0.0907 0.0972 206 HIS B CE1 3194 N NE2 . HIS B 206 ? 0.2569 0.2161 0.4124 -0.0193 -0.0951 0.1021 206 HIS B NE2 3195 N N . LYS B 207 ? 0.2260 0.3031 0.4546 0.0406 -0.0400 0.1260 207 LYS B N 3196 C CA . LYS B 207 ? 0.2491 0.3532 0.4949 0.0389 -0.0388 0.1522 207 LYS B CA 3197 C C . LYS B 207 ? 0.2177 0.2752 0.4565 0.0423 -0.0435 0.1572 207 LYS B C 3198 O O . LYS B 207 ? 0.3147 0.3581 0.5550 0.0579 -0.0282 0.1752 207 LYS B O 3199 C CB . LYS B 207 ? 0.3289 0.4991 0.5851 0.0075 -0.0462 0.1604 207 LYS B CB 3200 C CG . LYS B 207 ? 0.3773 0.5860 0.6259 -0.0046 -0.0405 0.1620 207 LYS B CG 3201 C CD . LYS B 207 ? 0.4586 0.7106 0.6855 -0.0445 -0.0456 0.1703 207 LYS B CD 3202 C CE . LYS B 207 ? 0.5075 0.7921 0.7128 -0.0629 -0.0438 0.1781 207 LYS B CE 3203 N NZ . LYS B 207 ? 0.5814 0.8946 0.7428 -0.1063 -0.0524 0.1849 207 LYS B NZ 3204 N N . PRO B 208 ? 0.2266 0.2597 0.4524 0.0246 -0.0605 0.1418 208 PRO B N 3205 C CA . PRO B 208 ? 0.2542 0.2400 0.4630 0.0181 -0.0676 0.1484 208 PRO B CA 3206 C C . PRO B 208 ? 0.3330 0.2239 0.4960 0.0346 -0.0487 0.1466 208 PRO B C 3207 O O . PRO B 208 ? 0.3864 0.2258 0.5291 0.0330 -0.0429 0.1569 208 PRO B O 3208 C CB . PRO B 208 ? 0.2613 0.2481 0.4600 -0.0087 -0.0881 0.1351 208 PRO B CB 3209 C CG . PRO B 208 ? 0.1908 0.2368 0.4167 -0.0108 -0.0845 0.1280 208 PRO B CG 3210 C CD . PRO B 208 ? 0.1848 0.2342 0.4086 0.0079 -0.0687 0.1225 208 PRO B CD 3211 N N . SER B 209 ? 0.4201 0.2779 0.5584 0.0485 -0.0337 0.1325 209 SER B N 3212 C CA . SER B 209 ? 0.5316 0.2825 0.6102 0.0626 -0.0046 0.1269 209 SER B CA 3213 C C . SER B 209 ? 0.5654 0.3401 0.6579 0.0991 0.0276 0.1346 209 SER B C 3214 O O . SER B 209 ? 0.5320 0.2348 0.5795 0.1127 0.0573 0.1263 209 SER B O 3215 C CB . SER B 209 ? 0.4881 0.1809 0.5030 0.0367 -0.0137 0.0976 209 SER B CB 3216 O OG . SER B 209 ? 0.5155 0.2642 0.5579 0.0469 -0.0170 0.0894 209 SER B OG 3217 N N . ASN B 210 ? 0.5667 0.4142 0.6509 0.1118 0.1352 0.1390 210 ASN B N 3218 C CA . ASN B 210 ? 0.5150 0.4229 0.6354 0.1298 0.1252 0.1871 210 ASN B CA 3219 C C . ASN B 210 ? 0.4636 0.3571 0.5980 0.1419 0.1324 0.1631 210 ASN B C 3220 O O . ASN B 210 ? 0.5331 0.4405 0.6980 0.1609 0.1504 0.1846 210 ASN B O 3221 C CB . ASN B 210 ? 0.4919 0.4146 0.6536 0.1595 0.1500 0.2480 210 ASN B CB 3222 C CG . ASN B 210 ? 0.6173 0.5538 0.7670 0.1508 0.1451 0.2816 210 ASN B CG 3223 O OD1 . ASN B 210 ? 0.6591 0.6645 0.7915 0.1265 0.1092 0.3040 210 ASN B OD1 3224 N ND2 . ASN B 210 ? 0.6629 0.5466 0.8146 0.1589 0.1779 0.2711 210 ASN B ND2 3225 N N . THR B 211 ? 0.4930 0.3706 0.5966 0.1182 0.1156 0.1085 211 THR B N 3226 C CA . THR B 211 ? 0.5185 0.3846 0.6284 0.1246 0.1196 0.0837 211 THR B CA 3227 C C . THR B 211 ? 0.4067 0.3328 0.5148 0.1064 0.0817 0.0861 211 THR B C 3228 O O . THR B 211 ? 0.3533 0.2868 0.4323 0.0773 0.0561 0.0578 211 THR B O 3229 C CB . THR B 211 ? 0.5199 0.3440 0.5927 0.1005 0.1202 0.0233 211 THR B CB 3230 O OG1 . THR B 211 ? 0.5873 0.3844 0.6521 0.0975 0.1413 0.0199 211 THR B OG1 3231 C CG2 . THR B 211 ? 0.4189 0.2541 0.4873 0.0945 0.1116 0.0024 211 THR B CG2 3232 N N . LYS B 212 ? 0.3901 0.3586 0.5319 0.1232 0.0811 0.1216 212 LYS B N 3233 C CA . LYS B 212 ? 0.3790 0.4027 0.5220 0.1043 0.0483 0.1247 212 LYS B CA 3234 C C . LYS B 212 ? 0.2840 0.2958 0.4403 0.1170 0.0594 0.1100 212 LYS B C 3235 O O . LYS B 212 ? 0.3013 0.3081 0.4858 0.1450 0.0874 0.1313 212 LYS B O 3236 C CB . LYS B 212 ? 0.3549 0.4590 0.5255 0.1042 0.0305 0.1843 212 LYS B CB 3237 C CG . LYS B 212 ? 0.3537 0.4912 0.4941 0.0702 0.0018 0.1885 212 LYS B CG 3238 C CD . LYS B 212 ? 0.3817 0.6116 0.5471 0.0641 -0.0194 0.2505 212 LYS B CD 3239 C CE . LYS B 212 ? 0.4289 0.7105 0.6157 0.0561 -0.0372 0.2610 212 LYS B CE 3240 N NZ . LYS B 212 ? 0.4938 0.8619 0.7071 0.0460 -0.0493 0.3135 212 LYS B NZ 3241 N N . VAL B 213 ? 0.2597 0.2650 0.3932 0.0945 0.0399 0.0727 213 VAL B N 3242 C CA . VAL B 213 ? 0.2480 0.2455 0.3880 0.1012 0.0466 0.0577 213 VAL B CA 3243 C C . VAL B 213 ? 0.2238 0.2625 0.3629 0.0777 0.0148 0.0572 213 VAL B C 3244 O O . VAL B 213 ? 0.2481 0.2846 0.3641 0.0509 -0.0073 0.0365 213 VAL B O 3245 C CB . VAL B 213 ? 0.2495 0.1874 0.3610 0.0969 0.0595 0.0091 213 VAL B CB 3246 C CG1 . VAL B 213 ? 0.2400 0.1792 0.3530 0.0986 0.0620 -0.0039 213 VAL B CG1 3247 C CG2 . VAL B 213 ? 0.2815 0.1825 0.3792 0.1033 0.0842 0.0028 213 VAL B CG2 3248 N N . ASP B 214 ? 0.2271 0.3004 0.3923 0.0871 0.0160 0.0795 214 ASP B N 3249 C CA . ASP B 214 ? 0.1992 0.3028 0.3642 0.0642 -0.0094 0.0761 214 ASP B CA 3250 C C . ASP B 214 ? 0.2851 0.3610 0.4450 0.0709 0.0018 0.0525 214 ASP B C 3251 O O . ASP B 214 ? 0.2455 0.3234 0.4224 0.0939 0.0255 0.0647 214 ASP B O 3252 C CB . ASP B 214 ? 0.1981 0.3738 0.3980 0.0639 -0.0203 0.1229 214 ASP B CB 3253 C CG . ASP B 214 ? 0.2993 0.5207 0.4998 0.0456 -0.0410 0.1495 214 ASP B CG 3254 O OD1 . ASP B 214 ? 0.2129 0.4077 0.3795 0.0251 -0.0513 0.1239 214 ASP B OD1 3255 O OD2 . ASP B 214 ? 0.2217 0.5106 0.4565 0.0502 -0.0464 0.1974 214 ASP B OD2 3256 N N . LYS B 215 ? 0.1818 0.2332 0.3190 0.0511 -0.0127 0.0206 215 LYS B N 3257 C CA . LYS B 215 ? 0.1776 0.2101 0.3083 0.0546 -0.0054 0.0024 215 LYS B CA 3258 C C . LYS B 215 ? 0.1967 0.2561 0.3372 0.0384 -0.0244 0.0107 215 LYS B C 3259 O O . LYS B 215 ? 0.1628 0.2176 0.2963 0.0160 -0.0439 0.0003 215 LYS B O 3260 C CB . LYS B 215 ? 0.2324 0.2202 0.3369 0.0481 -0.0044 -0.0343 215 LYS B CB 3261 C CG . LYS B 215 ? 0.2374 0.2168 0.3337 0.0476 -0.0012 -0.0488 215 LYS B CG 3262 C CD . LYS B 215 ? 0.1971 0.1573 0.2806 0.0619 0.0269 -0.0591 215 LYS B CD 3263 C CE . LYS B 215 ? 0.2044 0.1827 0.2889 0.0659 0.0360 -0.0516 215 LYS B CE 3264 N NZ . LYS B 215 ? 0.2709 0.2266 0.3388 0.0772 0.0706 -0.0644 215 LYS B NZ 3265 N N . ARG B 216 ? 0.1672 0.2510 0.3240 0.0493 -0.0148 0.0287 216 ARG B N 3266 C CA . ARG B 216 ? 0.1603 0.2669 0.3268 0.0349 -0.0288 0.0378 216 ARG B CA 3267 C C . ARG B 216 ? 0.1591 0.2344 0.3069 0.0294 -0.0309 0.0136 216 ARG B C 3268 O O . ARG B 216 ? 0.1993 0.2547 0.3312 0.0414 -0.0149 -0.0015 216 ARG B O 3269 C CB . ARG B 216 ? 0.1637 0.3107 0.3553 0.0497 -0.0146 0.0674 216 ARG B CB 3270 C CG . ARG B 216 ? 0.1603 0.3286 0.3603 0.0375 -0.0230 0.0771 216 ARG B CG 3271 C CD . ARG B 216 ? 0.1560 0.3549 0.3719 0.0104 -0.0482 0.0931 216 ARG B CD 3272 N NE . ARG B 216 ? 0.2871 0.5033 0.5134 -0.0004 -0.0522 0.1048 216 ARG B NE 3273 C CZ . ARG B 216 ? 0.2884 0.5533 0.5413 0.0045 -0.0452 0.1348 216 ARG B CZ 3274 N NH1 . ARG B 216 ? 0.2662 0.5637 0.5374 0.0215 -0.0325 0.1564 216 ARG B NH1 3275 N NH2 . ARG B 216 ? 0.2547 0.5318 0.5144 -0.0073 -0.0485 0.1446 216 ARG B NH2 3276 N N . VAL B 217 ? 0.1560 0.2277 0.3063 0.0096 -0.0492 0.0109 217 VAL B N 3277 C CA . VAL B 217 ? 0.2324 0.2808 0.3738 0.0065 -0.0523 -0.0034 217 VAL B CA 3278 C C . VAL B 217 ? 0.3014 0.3694 0.4572 -0.0017 -0.0586 0.0160 217 VAL B C 3279 O O . VAL B 217 ? 0.2918 0.3641 0.4608 -0.0193 -0.0699 0.0248 217 VAL B O 3280 C CB . VAL B 217 ? 0.2009 0.2164 0.3375 -0.0057 -0.0622 -0.0235 217 VAL B CB 3281 C CG1 . VAL B 217 ? 0.1609 0.1616 0.3007 -0.0057 -0.0651 -0.0280 217 VAL B CG1 3282 C CG2 . VAL B 217 ? 0.2010 0.1979 0.3222 0.0013 -0.0553 -0.0423 217 VAL B CG2 3283 N N . GLU B 218 ? 0.3675 0.4476 0.5179 0.0074 -0.0501 0.0223 218 GLU B N 3284 C CA . GLU B 218 ? 0.3293 0.4336 0.4926 0.0008 -0.0532 0.0455 218 GLU B CA 3285 C C . GLU B 218 ? 0.2987 0.3931 0.4564 -0.0015 -0.0587 0.0452 218 GLU B C 3286 O O . GLU B 218 ? 0.3402 0.4214 0.4813 0.0043 -0.0567 0.0282 218 GLU B O 3287 C CB . GLU B 218 ? 0.3220 0.4594 0.4844 0.0127 -0.0357 0.0598 218 GLU B CB 3288 C CG . GLU B 218 ? 0.4625 0.6300 0.6490 0.0129 -0.0337 0.0794 218 GLU B CG 3289 C CD . GLU B 218 ? 0.5906 0.7871 0.7816 0.0310 -0.0089 0.0926 218 GLU B CD 3290 O OE1 . GLU B 218 ? 0.6678 0.8986 0.8860 0.0363 -0.0039 0.1149 218 GLU B OE1 3291 O OE2 . GLU B 218 ? 0.5790 0.7664 0.7466 0.0389 0.0075 0.0812 218 GLU B OE2 3292 N N . PRO B 219 ? 0.3584 0.4627 0.5321 -0.0109 -0.0657 0.0673 219 PRO B N 3293 C CA . PRO B 219 ? 0.3306 0.4373 0.5024 -0.0100 -0.0699 0.0771 219 PRO B CA 3294 C C . PRO B 219 ? 0.3420 0.4785 0.4865 -0.0035 -0.0595 0.0773 219 PRO B C 3295 O O . PRO B 219 ? 0.3441 0.5026 0.4828 -0.0013 -0.0471 0.0838 219 PRO B O 3296 C CB . PRO B 219 ? 0.2068 0.3185 0.4035 -0.0213 -0.0756 0.1057 219 PRO B CB 3297 C CG . PRO B 219 ? 0.2032 0.3257 0.4093 -0.0304 -0.0735 0.1096 219 PRO B CG 3298 C CD . PRO B 219 ? 0.1890 0.3021 0.3853 -0.0258 -0.0712 0.0856 219 PRO B CD 3299 N N . LYS B 220 ? 0.4129 0.5521 0.5404 -0.0025 -0.0624 0.0694 220 LYS B N 3300 C CA . LYS B 220 ? 0.4789 0.6461 0.5716 -0.0047 -0.0520 0.0651 220 LYS B CA 3301 C C . LYS B 220 ? 0.4485 0.6517 0.5408 -0.0130 -0.0599 0.0965 220 LYS B C 3302 O O . LYS B 220 ? 0.5226 0.7524 0.5983 -0.0170 -0.0486 0.1066 220 LYS B O 3303 C CB . LYS B 220 ? 0.4965 0.6548 0.5651 -0.0063 -0.0514 0.0381 220 LYS B CB 3304 C CG . LYS B 220 ? 0.5605 0.7424 0.5842 -0.0162 -0.0377 0.0254 220 LYS B CG 3305 C CD . LYS B 220 ? 0.6060 0.7780 0.6081 -0.0233 -0.0384 -0.0026 220 LYS B CD 3306 C CE . LYS B 220 ? 0.6899 0.8811 0.6396 -0.0411 -0.0225 -0.0219 220 LYS B CE 3307 N NZ . LYS B 220 ? 0.7433 0.9223 0.6728 -0.0522 -0.0223 -0.0517 220 LYS B NZ 3308 N N . ASP C 1 ? 0.4340 0.3453 0.4368 -0.0939 0.0878 -0.1408 1 ASP C N 3309 C CA . ASP C 1 ? 0.4420 0.3515 0.4323 -0.0677 0.0856 -0.1226 1 ASP C CA 3310 C C . ASP C 1 ? 0.3733 0.3293 0.3808 -0.0599 0.0771 -0.1130 1 ASP C C 3311 O O . ASP C 1 ? 0.3935 0.3768 0.4226 -0.0716 0.0771 -0.1164 1 ASP C O 3312 C CB . ASP C 1 ? 0.5621 0.4262 0.5364 -0.0625 0.0985 -0.1068 1 ASP C CB 3313 C CG . ASP C 1 ? 0.6905 0.4980 0.6424 -0.0639 0.1052 -0.1139 1 ASP C CG 3314 O OD1 . ASP C 1 ? 0.7200 0.5207 0.6720 -0.0762 0.1025 -0.1340 1 ASP C OD1 3315 O OD2 . ASP C 1 ? 0.7672 0.5352 0.7002 -0.0515 0.1120 -0.1000 1 ASP C OD2 3316 N N . ILE C 2 ? 0.3242 0.2893 0.3220 -0.0401 0.0699 -0.1019 2 ILE C N 3317 C CA . ILE C 2 ? 0.3098 0.3054 0.3182 -0.0314 0.0617 -0.0910 2 ILE C CA 3318 C C . ILE C 2 ? 0.3702 0.3553 0.3825 -0.0306 0.0713 -0.0789 2 ILE C C 3319 O O . ILE C 2 ? 0.3603 0.3162 0.3568 -0.0240 0.0794 -0.0685 2 ILE C O 3320 C CB . ILE C 2 ? 0.3325 0.3342 0.3260 -0.0150 0.0531 -0.0805 2 ILE C CB 3321 C CG1 . ILE C 2 ? 0.3619 0.3753 0.3458 -0.0152 0.0454 -0.0916 2 ILE C CG1 3322 C CG2 . ILE C 2 ? 0.2268 0.2501 0.2278 -0.0079 0.0433 -0.0698 2 ILE C CG2 3323 C CD1 . ILE C 2 ? 0.2882 0.3332 0.2843 -0.0224 0.0331 -0.1019 2 ILE C CD1 3324 N N . LEU C 3 ? 0.3149 0.3268 0.3475 -0.0356 0.0701 -0.0813 3 LEU C N 3325 C CA . LEU C 3 ? 0.3482 0.3568 0.3829 -0.0330 0.0786 -0.0713 3 LEU C CA 3326 C C . LEU C 3 ? 0.3675 0.3853 0.3982 -0.0148 0.0681 -0.0608 3 LEU C C 3327 O O . LEU C 3 ? 0.4511 0.4900 0.4884 -0.0080 0.0540 -0.0633 3 LEU C O 3328 C CB . LEU C 3 ? 0.4037 0.4405 0.4629 -0.0469 0.0847 -0.0811 3 LEU C CB 3329 C CG . LEU C 3 ? 0.5016 0.5365 0.5604 -0.0470 0.0973 -0.0728 3 LEU C CG 3330 C CD1 . LEU C 3 ? 0.5162 0.5073 0.5521 -0.0566 0.1130 -0.0631 3 LEU C CD1 3331 C CD2 . LEU C 3 ? 0.3708 0.4500 0.4586 -0.0565 0.1020 -0.0845 3 LEU C CD2 3332 N N . LEU C 4 ? 0.2941 0.2930 0.3112 -0.0077 0.0740 -0.0487 4 LEU C N 3333 C CA . LEU C 4 ? 0.2821 0.2857 0.2944 0.0058 0.0649 -0.0401 4 LEU C CA 3334 C C . LEU C 4 ? 0.3274 0.3372 0.3455 0.0078 0.0711 -0.0394 4 LEU C C 3335 O O . LEU C 4 ? 0.4013 0.3975 0.4109 0.0032 0.0843 -0.0351 4 LEU C O 3336 C CB . LEU C 4 ? 0.2900 0.2739 0.2817 0.0131 0.0644 -0.0288 4 LEU C CB 3337 C CG . LEU C 4 ? 0.2763 0.2574 0.2595 0.0139 0.0603 -0.0298 4 LEU C CG 3338 C CD1 . LEU C 4 ? 0.2790 0.2490 0.2460 0.0225 0.0620 -0.0200 4 LEU C CD1 3339 C CD2 . LEU C 4 ? 0.1983 0.1990 0.1857 0.0146 0.0464 -0.0320 4 LEU C CD2 3340 N N . THR C 5 ? 0.2772 0.3059 0.3068 0.0160 0.0613 -0.0437 5 THR C N 3341 C CA . THR C 5 ? 0.2397 0.2773 0.2744 0.0209 0.0667 -0.0463 5 THR C CA 3342 C C . THR C 5 ? 0.2896 0.3120 0.3092 0.0333 0.0575 -0.0389 5 THR C C 3343 O O . THR C 5 ? 0.3392 0.3594 0.3583 0.0411 0.0422 -0.0380 5 THR C O 3344 C CB . THR C 5 ? 0.2117 0.2841 0.2729 0.0241 0.0628 -0.0606 5 THR C CB 3345 O OG1 . THR C 5 ? 0.1954 0.2859 0.2723 0.0081 0.0714 -0.0690 5 THR C OG1 3346 C CG2 . THR C 5 ? 0.1966 0.2825 0.2631 0.0313 0.0700 -0.0663 5 THR C CG2 3347 N N . GLN C 6 ? 0.2912 0.3010 0.2959 0.0335 0.0663 -0.0331 6 GLN C N 3348 C CA . GLN C 6 ? 0.3013 0.2992 0.2922 0.0424 0.0582 -0.0291 6 GLN C CA 3349 C C . GLN C 6 ? 0.2724 0.2816 0.2687 0.0502 0.0609 -0.0393 6 GLN C C 3350 O O . GLN C 6 ? 0.3005 0.3254 0.3031 0.0461 0.0751 -0.0447 6 GLN C O 3351 C CB . GLN C 6 ? 0.2321 0.2139 0.2021 0.0402 0.0630 -0.0179 6 GLN C CB 3352 C CG . GLN C 6 ? 0.2907 0.2650 0.2557 0.0369 0.0594 -0.0101 6 GLN C CG 3353 C CD . GLN C 6 ? 0.3754 0.3405 0.3227 0.0393 0.0614 -0.0005 6 GLN C CD 3354 O OE1 . GLN C 6 ? 0.2135 0.1709 0.1543 0.0390 0.0692 0.0041 6 GLN C OE1 3355 N NE2 . GLN C 6 ? 0.3537 0.3191 0.2928 0.0423 0.0532 0.0015 6 GLN C NE2 3356 N N . SER C 7 ? 0.2705 0.2708 0.2630 0.0607 0.0476 -0.0428 7 SER C N 3357 C CA . SER C 7 ? 0.3054 0.3130 0.2995 0.0714 0.0492 -0.0551 7 SER C CA 3358 C C . SER C 7 ? 0.3213 0.3021 0.2968 0.0773 0.0361 -0.0539 7 SER C C 3359 O O . SER C 7 ? 0.3462 0.3075 0.3147 0.0739 0.0232 -0.0451 7 SER C O 3360 C CB . SER C 7 ? 0.2878 0.3176 0.3062 0.0825 0.0445 -0.0690 7 SER C CB 3361 O OG . SER C 7 ? 0.3667 0.3771 0.3833 0.0928 0.0242 -0.0681 7 SER C OG 3362 N N . PRO C 8 ? 0.3171 0.2976 0.2829 0.0838 0.0400 -0.0631 8 PRO C N 3363 C CA . PRO C 8 ? 0.3468 0.3538 0.3169 0.0856 0.0575 -0.0723 8 PRO C CA 3364 C C . PRO C 8 ? 0.2924 0.3009 0.2476 0.0722 0.0717 -0.0592 8 PRO C C 3365 O O . PRO C 8 ? 0.3013 0.2924 0.2440 0.0660 0.0663 -0.0462 8 PRO C O 3366 C CB . PRO C 8 ? 0.2859 0.2858 0.2438 0.0981 0.0532 -0.0865 8 PRO C CB 3367 C CG . PRO C 8 ? 0.3093 0.2756 0.2477 0.0940 0.0383 -0.0786 8 PRO C CG 3368 C CD . PRO C 8 ? 0.2796 0.2337 0.2268 0.0878 0.0276 -0.0661 8 PRO C CD 3369 N N . VAL C 9 ? 0.3087 0.3388 0.2651 0.0681 0.0898 -0.0623 9 VAL C N 3370 C CA . VAL C 9 ? 0.3565 0.3813 0.2929 0.0571 0.1031 -0.0483 9 VAL C CA 3371 C C . VAL C 9 ? 0.4101 0.4210 0.3181 0.0620 0.0977 -0.0449 9 VAL C C 3372 O O . VAL C 9 ? 0.4102 0.4062 0.3011 0.0583 0.0955 -0.0304 9 VAL C O 3373 C CB . VAL C 9 ? 0.3780 0.4283 0.3181 0.0493 0.1243 -0.0523 9 VAL C CB 3374 C CG1 . VAL C 9 ? 0.3466 0.3841 0.2565 0.0399 0.1372 -0.0363 9 VAL C CG1 3375 C CG2 . VAL C 9 ? 0.3281 0.3949 0.2973 0.0398 0.1293 -0.0553 9 VAL C CG2 3376 N N . ILE C 10 ? 0.4094 0.4271 0.3131 0.0719 0.0944 -0.0603 10 ILE C N 3377 C CA . ILE C 10 ? 0.4157 0.4223 0.2933 0.0759 0.0868 -0.0618 10 ILE C CA 3378 C C . ILE C 10 ? 0.3842 0.3757 0.2670 0.0847 0.0685 -0.0758 10 ILE C C 3379 O O . ILE C 10 ? 0.4124 0.4096 0.3089 0.0951 0.0673 -0.0921 10 ILE C O 3380 C CB . ILE C 10 ? 0.4124 0.4371 0.2704 0.0784 0.1012 -0.0692 10 ILE C CB 3381 C CG1 . ILE C 10 ? 0.4186 0.4494 0.2668 0.0651 0.1170 -0.0511 10 ILE C CG1 3382 C CG2 . ILE C 10 ? 0.3611 0.3764 0.1929 0.0830 0.0904 -0.0748 10 ILE C CG2 3383 C CD1 . ILE C 10 ? 0.4436 0.4866 0.2682 0.0606 0.1256 -0.0514 10 ILE C CD1 3384 N N . LEU C 11 ? 0.4446 0.4163 0.3163 0.0802 0.0539 -0.0693 11 LEU C N 3385 C CA . LEU C 11 ? 0.4142 0.3626 0.2861 0.0833 0.0357 -0.0796 11 LEU C CA 3386 C C . LEU C 11 ? 0.3964 0.3373 0.2433 0.0827 0.0288 -0.0891 11 LEU C C 3387 O O . LEU C 11 ? 0.4567 0.3984 0.2910 0.0732 0.0235 -0.0793 11 LEU C O 3388 C CB . LEU C 11 ? 0.4342 0.3674 0.3149 0.0736 0.0240 -0.0655 11 LEU C CB 3389 C CG . LEU C 11 ? 0.5788 0.4815 0.4563 0.0703 0.0051 -0.0695 11 LEU C CG 3390 C CD1 . LEU C 11 ? 0.6239 0.5091 0.5045 0.0853 -0.0008 -0.0875 11 LEU C CD1 3391 C CD2 . LEU C 11 ? 0.6448 0.5415 0.5336 0.0611 -0.0009 -0.0539 11 LEU C CD2 3392 N N . SER C 12 ? 0.3873 0.3247 0.2279 0.0942 0.0284 -0.1101 12 SER C N 3393 C CA . SER C 12 ? 0.5132 0.4435 0.3285 0.0944 0.0217 -0.1240 12 SER C CA 3394 C C . SER C 12 ? 0.5133 0.4043 0.3256 0.0930 0.0014 -0.1357 12 SER C C 3395 O O . SER C 12 ? 0.4991 0.3703 0.3206 0.1058 -0.0035 -0.1487 12 SER C O 3396 C CB . SER C 12 ? 0.4382 0.3895 0.2465 0.1060 0.0351 -0.1408 12 SER C CB 3397 O OG . SER C 12 ? 0.5713 0.5203 0.3548 0.1031 0.0296 -0.1513 12 SER C OG 3398 N N . VAL C 13 ? 0.4536 0.3331 0.2526 0.0773 -0.0111 -0.1311 13 VAL C N 3399 C CA . VAL C 13 ? 0.5579 0.3955 0.3510 0.0692 -0.0302 -0.1397 13 VAL C CA 3400 C C . VAL C 13 ? 0.5177 0.3499 0.2866 0.0584 -0.0403 -0.1532 13 VAL C C 3401 O O . VAL C 13 ? 0.6751 0.5405 0.4324 0.0564 -0.0342 -0.1517 13 VAL C O 3402 C CB . VAL C 13 ? 0.5920 0.4171 0.3981 0.0522 -0.0386 -0.1184 13 VAL C CB 3403 C CG1 . VAL C 13 ? 0.5681 0.4011 0.3964 0.0618 -0.0300 -0.1058 13 VAL C CG1 3404 C CG2 . VAL C 13 ? 0.6214 0.4761 0.4253 0.0348 -0.0382 -0.1036 13 VAL C CG2 3405 N N . SER C 14 ? 0.5949 0.3825 0.3545 0.0509 -0.0570 -0.1661 14 SER C N 3406 C CA . SER C 14 ? 0.6230 0.4000 0.3609 0.0349 -0.0698 -0.1805 14 SER C CA 3407 C C . SER C 14 ? 0.6101 0.3853 0.3537 0.0055 -0.0807 -0.1631 14 SER C C 3408 O O . SER C 14 ? 0.6680 0.4248 0.4255 -0.0016 -0.0830 -0.1467 14 SER C O 3409 C CB . SER C 14 ? 0.7243 0.4558 0.4545 0.0405 -0.0784 -0.2024 14 SER C CB 3410 O OG . SER C 14 ? 0.7424 0.4904 0.4795 0.0656 -0.0642 -0.2132 14 SER C OG 3411 N N . PRO C 15 ? 0.5965 0.3956 0.3292 -0.0120 -0.0876 -0.1672 15 PRO C N 3412 C CA . PRO C 15 ? 0.5888 0.3990 0.3306 -0.0412 -0.0967 -0.1524 15 PRO C CA 3413 C C . PRO C 15 ? 0.6511 0.4026 0.3880 -0.0620 -0.1109 -0.1561 15 PRO C C 3414 O O . PRO C 15 ? 0.6834 0.3854 0.4025 -0.0572 -0.1192 -0.1774 15 PRO C O 3415 C CB . PRO C 15 ? 0.6303 0.4784 0.3590 -0.0520 -0.1035 -0.1637 15 PRO C CB 3416 C CG . PRO C 15 ? 0.6366 0.4677 0.3413 -0.0350 -0.1037 -0.1903 15 PRO C CG 3417 C CD . PRO C 15 ? 0.6530 0.4733 0.3639 -0.0060 -0.0882 -0.1874 15 PRO C CD 3418 N N . GLY C 16 ? 0.6291 0.3845 0.3796 -0.0843 -0.1132 -0.1355 16 GLY C N 3419 C CA . GLY C 16 ? 0.6646 0.3624 0.4074 -0.1077 -0.1254 -0.1329 16 GLY C CA 3420 C C . GLY C 16 ? 0.6646 0.3207 0.4111 -0.0907 -0.1224 -0.1210 16 GLY C C 3421 O O . GLY C 16 ? 0.6938 0.3082 0.4352 -0.1089 -0.1301 -0.1089 16 GLY C O 3422 N N . GLU C 17 ? 0.6422 0.3113 0.3964 -0.0566 -0.1113 -0.1237 17 GLU C N 3423 C CA . GLU C 17 ? 0.6345 0.2723 0.3948 -0.0376 -0.1096 -0.1150 17 GLU C CA 3424 C C . GLU C 17 ? 0.6482 0.3135 0.4263 -0.0457 -0.1025 -0.0873 17 GLU C C 3425 O O . GLU C 17 ? 0.5505 0.2684 0.3406 -0.0575 -0.0947 -0.0766 17 GLU C O 3426 C CB . GLU C 17 ? 0.6175 0.2698 0.3837 -0.0012 -0.0992 -0.1289 17 GLU C CB 3427 C CG . GLU C 17 ? 0.8337 0.4554 0.5850 0.0132 -0.1047 -0.1561 17 GLU C CG 3428 C CD . GLU C 17 ? 0.9085 0.5593 0.6718 0.0467 -0.0905 -0.1673 17 GLU C CD 3429 O OE1 . GLU C 17 ? 0.8360 0.5297 0.6091 0.0549 -0.0775 -0.1600 17 GLU C OE1 3430 O OE2 . GLU C 17 ? 1.0252 0.6605 0.7900 0.0629 -0.0907 -0.1816 17 GLU C OE2 3431 N N . ARG C 18 ? 0.6514 0.2814 0.4300 -0.0373 -0.1062 -0.0770 18 ARG C N 3432 C CA . ARG C 18 ? 0.5816 0.2372 0.3751 -0.0406 -0.0992 -0.0536 18 ARG C CA 3433 C C . ARG C 18 ? 0.5345 0.2266 0.3469 -0.0108 -0.0857 -0.0558 18 ARG C C 3434 O O . ARG C 18 ? 0.6712 0.3467 0.4841 0.0143 -0.0862 -0.0696 18 ARG C O 3435 C CB . ARG C 18 ? 0.6748 0.2758 0.4555 -0.0479 -0.1111 -0.0397 18 ARG C CB 3436 C CG . ARG C 18 ? 0.8048 0.4326 0.5968 -0.0522 -0.1046 -0.0162 18 ARG C CG 3437 C CD . ARG C 18 ? 0.9408 0.5155 0.7124 -0.0683 -0.1172 0.0017 18 ARG C CD 3438 N NE . ARG C 18 ? 1.1183 0.6751 0.8736 -0.1076 -0.1231 0.0084 18 ARG C NE 3439 C CZ . ARG C 18 ? 1.2141 0.7248 0.9524 -0.1170 -0.1335 0.0005 18 ARG C CZ 3440 N NH1 . ARG C 18 ? 1.1932 0.6693 0.9276 -0.0880 -0.1396 -0.0145 18 ARG C NH1 3441 N NH2 . ARG C 18 ? 1.2525 0.7644 0.9827 -0.1535 -0.1350 0.0072 18 ARG C NH2 3442 N N . VAL C 19 ? 0.5040 0.2468 0.3324 -0.0143 -0.0733 -0.0432 19 VAL C N 3443 C CA . VAL C 19 ? 0.4252 0.2048 0.2700 0.0074 -0.0588 -0.0450 19 VAL C CA 3444 C C . VAL C 19 ? 0.4420 0.2353 0.3008 0.0100 -0.0539 -0.0291 19 VAL C C 3445 O O . VAL C 19 ? 0.4647 0.2668 0.3236 -0.0077 -0.0550 -0.0141 19 VAL C O 3446 C CB . VAL C 19 ? 0.4507 0.2745 0.2983 0.0038 -0.0487 -0.0459 19 VAL C CB 3447 C CG1 . VAL C 19 ? 0.4157 0.2737 0.2778 0.0190 -0.0329 -0.0413 19 VAL C CG1 3448 C CG2 . VAL C 19 ? 0.5654 0.3811 0.3983 0.0068 -0.0523 -0.0647 19 VAL C CG2 3449 N N . SER C 20 ? 0.4186 0.2183 0.2894 0.0310 -0.0483 -0.0339 20 SER C N 3450 C CA . SER C 20 ? 0.4396 0.2536 0.3232 0.0337 -0.0449 -0.0220 20 SER C CA 3451 C C . SER C 20 ? 0.4305 0.2824 0.3320 0.0456 -0.0292 -0.0255 20 SER C C 3452 O O . SER C 20 ? 0.5456 0.4034 0.4538 0.0612 -0.0241 -0.0388 20 SER C O 3453 C CB . SER C 20 ? 0.4623 0.2419 0.3426 0.0442 -0.0582 -0.0217 20 SER C CB 3454 O OG . SER C 20 ? 0.6085 0.3497 0.4690 0.0271 -0.0717 -0.0111 20 SER C OG 3455 N N . PHE C 21 ? 0.3922 0.2691 0.3006 0.0374 -0.0211 -0.0142 21 PHE C N 3456 C CA . PHE C 21 ? 0.3490 0.2544 0.2718 0.0447 -0.0066 -0.0158 21 PHE C CA 3457 C C . PHE C 21 ? 0.3851 0.2960 0.3197 0.0473 -0.0082 -0.0119 21 PHE C C 3458 O O . PHE C 21 ? 0.4110 0.3171 0.3406 0.0385 -0.0149 -0.0016 21 PHE C O 3459 C CB . PHE C 21 ? 0.3318 0.2578 0.2525 0.0368 0.0030 -0.0078 21 PHE C CB 3460 C CG . PHE C 21 ? 0.3055 0.2332 0.2138 0.0334 0.0025 -0.0097 21 PHE C CG 3461 C CD1 . PHE C 21 ? 0.3225 0.2583 0.2266 0.0415 0.0116 -0.0161 21 PHE C CD1 3462 C CD2 . PHE C 21 ? 0.3386 0.2640 0.2386 0.0204 -0.0066 -0.0047 21 PHE C CD2 3463 C CE1 . PHE C 21 ? 0.3755 0.3160 0.2657 0.0393 0.0098 -0.0180 21 PHE C CE1 3464 C CE2 . PHE C 21 ? 0.3708 0.3039 0.2608 0.0166 -0.0086 -0.0081 21 PHE C CE2 3465 C CZ . PHE C 21 ? 0.3620 0.3023 0.2463 0.0274 -0.0012 -0.0148 21 PHE C CZ 3466 N N . SER C 22 ? 0.3674 0.2930 0.3171 0.0578 -0.0015 -0.0207 22 SER C N 3467 C CA . SER C 22 ? 0.3025 0.2383 0.2646 0.0602 -0.0045 -0.0197 22 SER C CA 3468 C C . SER C 22 ? 0.2622 0.2213 0.2339 0.0534 0.0091 -0.0180 22 SER C C 3469 O O . SER C 22 ? 0.2800 0.2495 0.2554 0.0526 0.0228 -0.0220 22 SER C O 3470 C CB . SER C 22 ? 0.2924 0.2323 0.2680 0.0766 -0.0099 -0.0325 22 SER C CB 3471 O OG . SER C 22 ? 0.3904 0.3535 0.3828 0.0784 -0.0094 -0.0348 22 SER C OG 3472 N N . CYS C 23 ? 0.2243 0.1876 0.1963 0.0479 0.0050 -0.0120 23 CYS C N 3473 C CA . CYS C 23 ? 0.2863 0.2664 0.2665 0.0422 0.0156 -0.0134 23 CYS C CA 3474 C C . CYS C 23 ? 0.3484 0.3406 0.3383 0.0435 0.0075 -0.0173 23 CYS C C 3475 O O . CYS C 23 ? 0.3174 0.3037 0.2968 0.0421 -0.0039 -0.0099 23 CYS C O 3476 C CB . CYS C 23 ? 0.2757 0.2535 0.2436 0.0344 0.0202 -0.0044 23 CYS C CB 3477 S SG . CYS C 23 ? 0.4356 0.4235 0.4085 0.0297 0.0320 -0.0080 23 CYS C SG 3478 N N . ARG C 24 ? 0.2912 0.3027 0.2999 0.0450 0.0132 -0.0287 24 ARG C N 3479 C CA . ARG C 24 ? 0.2710 0.3014 0.2919 0.0464 0.0046 -0.0351 24 ARG C CA 3480 C C . ARG C 24 ? 0.2831 0.3251 0.3088 0.0340 0.0143 -0.0401 24 ARG C C 3481 O O . ARG C 24 ? 0.1995 0.2433 0.2320 0.0264 0.0294 -0.0450 24 ARG C O 3482 C CB . ARG C 24 ? 0.2000 0.2519 0.2429 0.0570 0.0017 -0.0479 24 ARG C CB 3483 N N . ALA C 25 ? 0.2593 0.3057 0.2781 0.0313 0.0057 -0.0387 25 ALA C N 3484 C CA . ALA C 25 ? 0.2999 0.3550 0.3217 0.0203 0.0129 -0.0469 25 ALA C CA 3485 C C . ALA C 25 ? 0.3479 0.4324 0.3914 0.0174 0.0082 -0.0618 25 ALA C C 3486 O O . ALA C 25 ? 0.3412 0.4425 0.3915 0.0273 -0.0069 -0.0633 25 ALA C O 3487 C CB . ALA C 25 ? 0.2399 0.2891 0.2415 0.0180 0.0082 -0.0407 25 ALA C CB 3488 N N . SER C 26 ? 0.3359 0.4258 0.3894 0.0037 0.0202 -0.0730 26 SER C N 3489 C CA . SER C 26 ? 0.3435 0.4669 0.4214 -0.0040 0.0177 -0.0895 26 SER C CA 3490 C C . SER C 26 ? 0.4323 0.5754 0.5076 -0.0029 0.0011 -0.0960 26 SER C C 3491 O O . SER C 26 ? 0.4504 0.6292 0.5469 -0.0059 -0.0065 -0.1099 26 SER C O 3492 C CB . SER C 26 ? 0.2972 0.4146 0.3830 -0.0241 0.0358 -0.0988 26 SER C CB 3493 O OG . SER C 26 ? 0.3836 0.4693 0.4479 -0.0305 0.0418 -0.0968 26 SER C OG 3494 N N . GLN C 27 ? 0.4044 0.5289 0.4536 0.0010 -0.0043 -0.0864 27 GLN C N 3495 C CA . GLN C 27 ? 0.3709 0.5121 0.4092 0.0046 -0.0212 -0.0881 27 GLN C CA 3496 C C . GLN C 27 ? 0.3744 0.4932 0.3825 0.0110 -0.0248 -0.0703 27 GLN C C 3497 O O . GLN C 27 ? 0.4226 0.5172 0.4219 0.0108 -0.0134 -0.0609 27 GLN C O 3498 C CB . GLN C 27 ? 0.3971 0.5500 0.4365 -0.0101 -0.0185 -0.1058 27 GLN C CB 3499 C CG . GLN C 27 ? 0.4954 0.6213 0.5107 -0.0149 -0.0082 -0.1041 27 GLN C CG 3500 C CD . GLN C 27 ? 0.6194 0.7477 0.6355 -0.0294 -0.0036 -0.1251 27 GLN C CD 3501 O OE1 . GLN C 27 ? 0.6118 0.7443 0.6484 -0.0428 0.0028 -0.1386 27 GLN C OE1 3502 N NE2 . GLN C 27 ? 0.7116 0.8373 0.7042 -0.0284 -0.0063 -0.1290 27 GLN C NE2 3503 N N . SER C 28 ? 0.3780 0.5075 0.3693 0.0157 -0.0405 -0.0654 28 SER C N 3504 C CA . SER C 28 ? 0.3590 0.4710 0.3203 0.0180 -0.0435 -0.0471 28 SER C CA 3505 C C . SER C 28 ? 0.3627 0.4639 0.3107 0.0098 -0.0274 -0.0476 28 SER C C 3506 O O . SER C 28 ? 0.3679 0.4758 0.3182 0.0033 -0.0198 -0.0634 28 SER C O 3507 C CB . SER C 28 ? 0.4138 0.5396 0.3543 0.0218 -0.0621 -0.0411 28 SER C CB 3508 O OG . SER C 28 ? 0.5027 0.6108 0.4133 0.0202 -0.0632 -0.0210 28 SER C OG 3509 N N . ILE C 29 ? 0.3823 0.4670 0.3169 0.0107 -0.0230 -0.0316 29 ILE C N 3510 C CA . ILE C 29 ? 0.3222 0.4030 0.2468 0.0067 -0.0089 -0.0317 29 ILE C CA 3511 C C . ILE C 29 ? 0.3061 0.3889 0.2070 0.0036 -0.0113 -0.0146 29 ILE C C 3512 O O . ILE C 29 ? 0.3512 0.4344 0.2483 0.0020 -0.0001 -0.0117 29 ILE C O 3513 C CB . ILE C 29 ? 0.2927 0.3559 0.2318 0.0088 0.0046 -0.0327 29 ILE C CB 3514 C CG1 . ILE C 29 ? 0.2800 0.3302 0.2233 0.0122 0.0003 -0.0192 29 ILE C CG1 3515 C CG2 . ILE C 29 ? 0.2936 0.3532 0.2512 0.0068 0.0114 -0.0490 29 ILE C CG2 3516 C CD1 . ILE C 29 ? 0.2826 0.3188 0.2334 0.0142 0.0125 -0.0179 29 ILE C CD1 3517 N N . GLY C 30 ? 0.2739 0.3593 0.1583 0.0024 -0.0259 -0.0032 30 GLY C N 3518 C CA . GLY C 30 ? 0.2918 0.3765 0.1504 -0.0053 -0.0283 0.0156 30 GLY C CA 3519 C C . GLY C 30 ? 0.3839 0.4500 0.2464 -0.0085 -0.0236 0.0278 30 GLY C C 3520 O O . GLY C 30 ? 0.3601 0.4040 0.2325 -0.0032 -0.0306 0.0318 30 GLY C O 3521 N N . THR C 31 ? 0.2808 0.3598 0.1368 -0.0165 -0.0120 0.0315 31 THR C N 3522 C CA . THR C 31 ? 0.3479 0.4164 0.2112 -0.0203 -0.0069 0.0391 31 THR C CA 3523 C C . THR C 31 ? 0.3403 0.4241 0.2199 -0.0144 0.0082 0.0268 31 THR C C 3524 O O . THR C 31 ? 0.3149 0.4055 0.1971 -0.0187 0.0139 0.0321 31 THR C O 3525 C CB . THR C 31 ? 0.4156 0.4862 0.2573 -0.0374 -0.0090 0.0581 31 THR C CB 3526 O OG1 . THR C 31 ? 0.3342 0.4405 0.1635 -0.0449 0.0003 0.0567 31 THR C OG1 3527 C CG2 . THR C 31 ? 0.3687 0.4094 0.1897 -0.0417 -0.0263 0.0742 31 THR C CG2 3528 N N . ASN C 32 ? 0.2878 0.3752 0.1774 -0.0046 0.0137 0.0102 32 ASN C N 3529 C CA . ASN C 32 ? 0.3035 0.3978 0.2035 0.0038 0.0267 -0.0011 32 ASN C CA 3530 C C . ASN C 32 ? 0.2668 0.3397 0.1825 0.0108 0.0299 -0.0017 32 ASN C C 3531 O O . ASN C 32 ? 0.2534 0.3132 0.1780 0.0181 0.0354 -0.0127 32 ASN C O 3532 C CB . ASN C 32 ? 0.2602 0.3601 0.1593 0.0096 0.0313 -0.0190 32 ASN C CB 3533 C CG . ASN C 32 ? 0.3497 0.4674 0.2465 0.0178 0.0430 -0.0287 32 ASN C CG 3534 O OD1 . ASN C 32 ? 0.3819 0.4952 0.2876 0.0265 0.0496 -0.0286 32 ASN C OD1 3535 N ND2 . ASN C 32 ? 0.3555 0.4953 0.2391 0.0170 0.0451 -0.0380 32 ASN C ND2 3536 N N . ILE C 33 ? 0.2459 0.3143 0.1623 0.0067 0.0267 0.0101 33 ILE C N 3537 C CA . ILE C 33 ? 0.2665 0.3171 0.1936 0.0128 0.0289 0.0101 33 ILE C CA 3538 C C . ILE C 33 ? 0.2541 0.3171 0.1811 0.0124 0.0318 0.0163 33 ILE C C 3539 O O . ILE C 33 ? 0.2022 0.2805 0.1223 0.0013 0.0282 0.0247 33 ILE C O 3540 C CB . ILE C 33 ? 0.3820 0.4120 0.3119 0.0105 0.0196 0.0141 33 ILE C CB 3541 C CG1 . ILE C 33 ? 0.4736 0.4889 0.4130 0.0171 0.0239 0.0115 33 ILE C CG1 3542 C CG2 . ILE C 33 ? 0.4446 0.4713 0.3632 0.0005 0.0097 0.0267 33 ILE C CG2 3543 C CD1 . ILE C 33 ? 0.5502 0.5571 0.5004 0.0216 0.0279 0.0015 33 ILE C CD1 3544 N N . HIS C 34 ? 0.2508 0.3084 0.1840 0.0233 0.0380 0.0127 34 HIS C N 3545 C CA . HIS C 34 ? 0.2259 0.3000 0.1602 0.0253 0.0389 0.0171 34 HIS C CA 3546 C C . HIS C 34 ? 0.2498 0.3038 0.1858 0.0295 0.0375 0.0193 34 HIS C C 3547 O O . HIS C 34 ? 0.2672 0.2981 0.2045 0.0355 0.0410 0.0156 34 HIS C O 3548 C CB . HIS C 34 ? 0.2067 0.3009 0.1432 0.0395 0.0467 0.0107 34 HIS C CB 3549 C CG . HIS C 34 ? 0.2603 0.3732 0.1938 0.0388 0.0504 0.0041 34 HIS C CG 3550 N ND1 . HIS C 34 ? 0.2259 0.3644 0.1544 0.0236 0.0478 0.0090 34 HIS C ND1 3551 C CD2 . HIS C 34 ? 0.3559 0.4642 0.2876 0.0507 0.0566 -0.0076 34 HIS C CD2 3552 C CE1 . HIS C 34 ? 0.3718 0.5255 0.2956 0.0271 0.0527 0.0003 34 HIS C CE1 3553 N NE2 . HIS C 34 ? 0.4059 0.5411 0.3322 0.0441 0.0577 -0.0113 34 HIS C NE2 3554 N N . TRP C 35 ? 0.2623 0.3280 0.1976 0.0246 0.0329 0.0243 35 TRP C N 3555 C CA . TRP C 35 ? 0.2202 0.2702 0.1536 0.0277 0.0306 0.0252 35 TRP C CA 3556 C C . TRP C 35 ? 0.2068 0.2758 0.1398 0.0378 0.0318 0.0260 35 TRP C C 3557 O O . TRP C 35 ? 0.2129 0.3154 0.1503 0.0360 0.0303 0.0267 35 TRP C O 3558 C CB . TRP C 35 ? 0.2407 0.2812 0.1704 0.0131 0.0209 0.0283 35 TRP C CB 3559 C CG . TRP C 35 ? 0.3085 0.3249 0.2370 0.0090 0.0169 0.0278 35 TRP C CG 3560 C CD1 . TRP C 35 ? 0.3111 0.3272 0.2360 -0.0002 0.0122 0.0319 35 TRP C CD1 3561 C CD2 . TRP C 35 ? 0.3293 0.3224 0.2595 0.0156 0.0165 0.0228 35 TRP C CD2 3562 N NE1 . TRP C 35 ? 0.2873 0.2799 0.2120 0.0026 0.0068 0.0300 35 TRP C NE1 3563 C CE2 . TRP C 35 ? 0.2690 0.2502 0.1993 0.0124 0.0099 0.0231 35 TRP C CE2 3564 C CE3 . TRP C 35 ? 0.2433 0.2280 0.1741 0.0242 0.0213 0.0180 35 TRP C CE3 3565 C CZ2 . TRP C 35 ? 0.3256 0.2913 0.2610 0.0195 0.0075 0.0170 35 TRP C CZ2 3566 C CZ3 . TRP C 35 ? 0.2407 0.2109 0.1755 0.0285 0.0212 0.0119 35 TRP C CZ3 3567 C CH2 . TRP C 35 ? 0.3265 0.2892 0.2657 0.0271 0.0141 0.0105 35 TRP C CH2 3568 N N . TYR C 36 ? 0.1968 0.2478 0.1242 0.0482 0.0342 0.0260 36 TYR C N 3569 C CA . TYR C 36 ? 0.2049 0.2695 0.1276 0.0613 0.0336 0.0281 36 TYR C CA 3570 C C . TYR C 36 ? 0.2578 0.3124 0.1710 0.0603 0.0297 0.0293 36 TYR C C 3571 O O . TYR C 36 ? 0.2524 0.2818 0.1611 0.0560 0.0321 0.0276 36 TYR C O 3572 C CB . TYR C 36 ? 0.2172 0.2656 0.1344 0.0799 0.0417 0.0289 36 TYR C CB 3573 C CG . TYR C 36 ? 0.2916 0.3482 0.2155 0.0850 0.0459 0.0244 36 TYR C CG 3574 C CD1 . TYR C 36 ? 0.2804 0.3177 0.2066 0.0775 0.0508 0.0200 36 TYR C CD1 3575 C CD2 . TYR C 36 ? 0.2208 0.3087 0.1490 0.0986 0.0446 0.0225 36 TYR C CD2 3576 C CE1 . TYR C 36 ? 0.2886 0.3340 0.2181 0.0820 0.0543 0.0136 36 TYR C CE1 3577 C CE2 . TYR C 36 ? 0.2413 0.3386 0.1744 0.1052 0.0494 0.0155 36 TYR C CE2 3578 C CZ . TYR C 36 ? 0.2433 0.3174 0.1754 0.0962 0.0543 0.0110 36 TYR C CZ 3579 O OH . TYR C 36 ? 0.2450 0.3285 0.1791 0.1026 0.0588 0.0018 36 TYR C OH 3580 N N . GLN C 37 ? 0.2886 0.3679 0.1989 0.0655 0.0236 0.0305 37 GLN C N 3581 C CA . GLN C 37 ? 0.2937 0.3672 0.1911 0.0669 0.0194 0.0305 37 GLN C CA 3582 C C . GLN C 37 ? 0.3561 0.4281 0.2405 0.0884 0.0219 0.0367 37 GLN C C 3583 O O . GLN C 37 ? 0.4186 0.5115 0.3078 0.1018 0.0204 0.0388 37 GLN C O 3584 C CB . GLN C 37 ? 0.2451 0.3489 0.1466 0.0541 0.0077 0.0266 37 GLN C CB 3585 C CG . GLN C 37 ? 0.2480 0.3507 0.1345 0.0553 0.0014 0.0237 37 GLN C CG 3586 C CD . GLN C 37 ? 0.3029 0.4427 0.1949 0.0432 -0.0110 0.0187 37 GLN C CD 3587 O OE1 . GLN C 37 ? 0.2490 0.4284 0.1486 0.0514 -0.0150 0.0204 37 GLN C OE1 3588 N NE2 . GLN C 37 ? 0.2574 0.3856 0.1466 0.0235 -0.0177 0.0112 37 GLN C NE2 3589 N N . GLN C 38 ? 0.3154 0.3621 0.1818 0.0930 0.0262 0.0398 38 GLN C N 3590 C CA . GLN C 38 ? 0.3454 0.3870 0.1923 0.1124 0.0266 0.0487 38 GLN C CA 3591 C C . GLN C 38 ? 0.3874 0.4356 0.2154 0.1121 0.0207 0.0487 38 GLN C C 3592 O O . GLN C 38 ? 0.3998 0.4281 0.2172 0.1038 0.0267 0.0464 38 GLN C O 3593 C CB . GLN C 38 ? 0.3445 0.3449 0.1796 0.1196 0.0395 0.0561 38 GLN C CB 3594 C CG . GLN C 38 ? 0.4104 0.3960 0.2195 0.1405 0.0391 0.0686 38 GLN C CG 3595 C CD . GLN C 38 ? 0.4936 0.4330 0.2905 0.1461 0.0510 0.0766 38 GLN C CD 3596 O OE1 . GLN C 38 ? 0.5115 0.4261 0.3085 0.1306 0.0626 0.0754 38 GLN C OE1 3597 N NE2 . GLN C 38 ? 0.4005 0.3284 0.1870 0.1686 0.0476 0.0839 38 GLN C NE2 3598 N N . ARG C 39 ? 0.3166 0.1648 0.1815 -0.0062 -0.0632 0.0077 39 ARG C N 3599 C CA . ARG C 39 ? 0.3673 0.1824 0.1966 -0.0185 -0.0753 0.0063 39 ARG C CA 3600 C C . ARG C 39 ? 0.3694 0.1716 0.1798 -0.0065 -0.0728 0.0044 39 ARG C C 3601 O O . ARG C 39 ? 0.4274 0.2545 0.2573 0.0096 -0.0646 0.0072 39 ARG C O 3602 C CB . ARG C 39 ? 0.3688 0.2087 0.2050 -0.0369 -0.0977 0.0178 39 ARG C CB 3603 C CG . ARG C 39 ? 0.4728 0.3167 0.3197 -0.0522 -0.1001 0.0195 39 ARG C CG 3604 C CD . ARG C 39 ? 0.4754 0.3570 0.3416 -0.0690 -0.1203 0.0323 39 ARG C CD 3605 N NE . ARG C 39 ? 0.6624 0.5384 0.5306 -0.0874 -0.1224 0.0330 39 ARG C NE 3606 C CZ . ARG C 39 ? 0.7941 0.7010 0.6823 -0.1053 -0.1369 0.0429 39 ARG C CZ 3607 N NH1 . ARG C 39 ? 0.8267 0.7769 0.7388 -0.1060 -0.1519 0.0541 39 ARG C NH1 3608 N NH2 . ARG C 39 ? 0.7961 0.6910 0.6819 -0.1220 -0.1353 0.0423 39 ARG C NH2 3609 N N . THR C 40 ? 0.4112 0.1706 0.1797 -0.0147 -0.0789 -0.0001 40 THR C N 3610 C CA . THR C 40 ? 0.4863 0.2241 0.2281 -0.0038 -0.0761 -0.0020 40 THR C CA 3611 C C . THR C 40 ? 0.4877 0.2711 0.2518 0.0066 -0.0860 0.0115 40 THR C C 3612 O O . THR C 40 ? 0.4188 0.2379 0.1995 -0.0037 -0.1070 0.0242 40 THR C O 3613 C CB . THR C 40 ? 0.5366 0.2227 0.2250 -0.0186 -0.0866 -0.0060 40 THR C CB 3614 O OG1 . THR C 40 ? 0.5502 0.1949 0.2220 -0.0248 -0.0713 -0.0165 40 THR C OG1 3615 C CG2 . THR C 40 ? 0.5164 0.1739 0.1711 -0.0063 -0.0823 -0.0079 40 THR C CG2 3616 N N . ASN C 41 ? 0.4309 0.2130 0.1974 0.0270 -0.0689 0.0092 41 ASN C N 3617 C CA . ASN C 41 ? 0.4155 0.2358 0.2027 0.0419 -0.0711 0.0222 41 ASN C CA 3618 C C . ASN C 41 ? 0.4524 0.3294 0.2902 0.0455 -0.0706 0.0327 41 ASN C C 3619 O O . ASN C 41 ? 0.5215 0.4291 0.3788 0.0597 -0.0682 0.0442 41 ASN C O 3620 C CB . ASN C 41 ? 0.4873 0.3104 0.2539 0.0376 -0.0952 0.0344 41 ASN C CB 3621 C CG . ASN C 41 ? 0.6017 0.3644 0.3113 0.0364 -0.0942 0.0254 41 ASN C CG 3622 O OD1 . ASN C 41 ? 0.6620 0.4046 0.3402 0.0192 -0.1150 0.0268 41 ASN C OD1 3623 N ND2 . ASN C 41 ? 0.5792 0.3097 0.2726 0.0533 -0.0689 0.0155 41 ASN C ND2 3624 N N . GLY C 42 ? 0.4176 0.3057 0.2745 0.0339 -0.0708 0.0295 42 GLY C N 3625 C CA . GLY C 42 ? 0.3778 0.3146 0.2777 0.0358 -0.0698 0.0397 42 GLY C CA 3626 C C . GLY C 42 ? 0.3673 0.3100 0.2838 0.0497 -0.0459 0.0333 42 GLY C C 3627 O O . GLY C 42 ? 0.3792 0.2909 0.2784 0.0567 -0.0301 0.0197 42 GLY C O 3628 N N . SER C 43 ? 0.3508 0.3329 0.3008 0.0526 -0.0428 0.0431 43 SER C N 3629 C CA . SER C 43 ? 0.2926 0.2796 0.2550 0.0615 -0.0225 0.0372 43 SER C CA 3630 C C . SER C 43 ? 0.3534 0.3386 0.3211 0.0480 -0.0264 0.0322 43 SER C C 3631 O O . SER C 43 ? 0.3387 0.3273 0.3076 0.0334 -0.0425 0.0370 43 SER C O 3632 C CB . SER C 43 ? 0.2170 0.2412 0.2071 0.0726 -0.0143 0.0512 43 SER C CB 3633 O OG . SER C 43 ? 0.2669 0.2917 0.2520 0.0874 -0.0095 0.0578 43 SER C OG 3634 N N . PRO C 44 ? 0.3544 0.3325 0.3231 0.0523 -0.0121 0.0226 44 PRO C N 3635 C CA . PRO C 44 ? 0.2545 0.2315 0.2275 0.0421 -0.0159 0.0200 44 PRO C CA 3636 C C . PRO C 44 ? 0.3354 0.3434 0.3303 0.0347 -0.0232 0.0339 44 PRO C C 3637 O O . PRO C 44 ? 0.3167 0.3515 0.3294 0.0414 -0.0185 0.0442 44 PRO C O 3638 C CB . PRO C 44 ? 0.1943 0.1678 0.1681 0.0504 -0.0002 0.0105 44 PRO C CB 3639 C CG . PRO C 44 ? 0.3296 0.2857 0.2905 0.0606 0.0110 0.0018 44 PRO C CG 3640 C CD . PRO C 44 ? 0.4036 0.3705 0.3658 0.0653 0.0070 0.0128 44 PRO C CD 3641 N N . ARG C 45 ? 0.2644 0.2667 0.2580 0.0214 -0.0325 0.0347 45 ARG C N 3642 C CA . ARG C 45 ? 0.2336 0.2609 0.2467 0.0116 -0.0384 0.0469 45 ARG C CA 3643 C C . ARG C 45 ? 0.3534 0.3724 0.3641 0.0089 -0.0329 0.0438 45 ARG C C 3644 O O . ARG C 45 ? 0.3543 0.3461 0.3480 0.0053 -0.0349 0.0357 45 ARG C O 3645 C CB . ARG C 45 ? 0.2836 0.3089 0.2936 -0.0052 -0.0564 0.0520 45 ARG C CB 3646 C CG . ARG C 45 ? 0.4604 0.5036 0.4875 -0.0201 -0.0620 0.0617 45 ARG C CG 3647 C CD . ARG C 45 ? 0.5825 0.6324 0.6116 -0.0390 -0.0809 0.0681 45 ARG C CD 3648 N NE . ARG C 45 ? 0.6231 0.6355 0.6240 -0.0552 -0.0881 0.0602 45 ARG C NE 3649 C CZ . ARG C 45 ? 0.5840 0.5970 0.5854 -0.0772 -0.0998 0.0647 45 ARG C CZ 3650 N NH1 . ARG C 45 ? 0.6221 0.6764 0.6559 -0.0859 -0.1069 0.0775 45 ARG C NH1 3651 N NH2 . ARG C 45 ? 0.5656 0.5370 0.5359 -0.0910 -0.1026 0.0567 45 ARG C NH2 3652 N N . LEU C 46 ? 0.3057 0.3461 0.3319 0.0120 -0.0247 0.0512 46 LEU C N 3653 C CA . LEU C 46 ? 0.2738 0.3064 0.2944 0.0112 -0.0195 0.0497 46 LEU C CA 3654 C C . LEU C 46 ? 0.2893 0.3131 0.3078 -0.0037 -0.0281 0.0543 46 LEU C C 3655 O O . LEU C 46 ? 0.3170 0.3567 0.3498 -0.0146 -0.0337 0.0638 46 LEU C O 3656 C CB . LEU C 46 ? 0.2045 0.2576 0.2369 0.0180 -0.0066 0.0568 46 LEU C CB 3657 C CG . LEU C 46 ? 0.2989 0.3453 0.3222 0.0183 -0.0002 0.0574 46 LEU C CG 3658 C CD1 . LEU C 46 ? 0.1848 0.2131 0.1893 0.0260 0.0014 0.0448 46 LEU C CD1 3659 C CD2 . LEU C 46 ? 0.1868 0.2517 0.2210 0.0225 0.0137 0.0670 46 LEU C CD2 3660 N N . LEU C 47 ? 0.2932 0.2918 0.2949 -0.0042 -0.0284 0.0482 47 LEU C N 3661 C CA . LEU C 47 ? 0.3499 0.3319 0.3439 -0.0170 -0.0333 0.0519 47 LEU C CA 3662 C C . LEU C 47 ? 0.4419 0.4226 0.4336 -0.0152 -0.0265 0.0573 47 LEU C C 3663 O O . LEU C 47 ? 0.4102 0.3902 0.4041 -0.0264 -0.0264 0.0653 47 LEU C O 3664 C CB . LEU C 47 ? 0.2685 0.2164 0.2421 -0.0175 -0.0363 0.0430 47 LEU C CB 3665 C CG . LEU C 47 ? 0.2746 0.2122 0.2408 -0.0203 -0.0422 0.0367 47 LEU C CG 3666 C CD1 . LEU C 47 ? 0.2683 0.1684 0.2139 -0.0173 -0.0395 0.0275 47 LEU C CD1 3667 C CD2 . LEU C 47 ? 0.2668 0.2099 0.2351 -0.0382 -0.0527 0.0432 47 LEU C CD2 3668 N N . ILE C 48 ? 0.3792 0.3573 0.3642 -0.0020 -0.0213 0.0528 48 ILE C N 3669 C CA . ILE C 48 ? 0.2856 0.2573 0.2613 0.0018 -0.0170 0.0572 48 ILE C CA 3670 C C . ILE C 48 ? 0.3749 0.3598 0.3494 0.0134 -0.0113 0.0543 48 ILE C C 3671 O O . ILE C 48 ? 0.4053 0.3932 0.3809 0.0202 -0.0116 0.0451 48 ILE C O 3672 C CB . ILE C 48 ? 0.2668 0.2116 0.2278 0.0051 -0.0204 0.0538 48 ILE C CB 3673 C CG1 . ILE C 48 ? 0.2792 0.2020 0.2336 -0.0078 -0.0228 0.0565 48 ILE C CG1 3674 C CG2 . ILE C 48 ? 0.2957 0.2362 0.2460 0.0131 -0.0180 0.0586 48 ILE C CG2 3675 C CD1 . ILE C 48 ? 0.2851 0.2063 0.2382 -0.0187 -0.0195 0.0668 48 ILE C CD1 3676 N N . LYS C 49 ? 0.2352 0.2246 0.2045 0.0144 -0.0048 0.0615 49 LYS C N 3677 C CA . LYS C 49 ? 0.2347 0.2295 0.1943 0.0233 0.0006 0.0580 49 LYS C CA 3678 C C . LYS C 49 ? 0.3341 0.3155 0.2734 0.0270 -0.0016 0.0613 49 LYS C C 3679 O O . LYS C 49 ? 0.4180 0.3881 0.3518 0.0229 -0.0015 0.0699 49 LYS C O 3680 C CB . LYS C 49 ? 0.2359 0.2460 0.2026 0.0231 0.0133 0.0636 49 LYS C CB 3681 C CG . LYS C 49 ? 0.2506 0.2600 0.2165 0.0177 0.0214 0.0762 49 LYS C CG 3682 C CD . LYS C 49 ? 0.2749 0.3027 0.2574 0.0178 0.0357 0.0831 49 LYS C CD 3683 C CE . LYS C 49 ? 0.2611 0.2924 0.2536 0.0097 0.0443 0.0964 49 LYS C CE 3684 N NZ . LYS C 49 ? 0.3261 0.3376 0.2912 0.0121 0.0538 0.1007 49 LYS C NZ 3685 N N . TYR C 50 ? 0.3016 0.2836 0.2287 0.0341 -0.0038 0.0547 50 TYR C N 3686 C CA . TYR C 50 ? 0.2787 0.2508 0.1846 0.0387 -0.0091 0.0581 50 TYR C CA 3687 C C . TYR C 50 ? 0.3712 0.3300 0.2770 0.0405 -0.0171 0.0636 50 TYR C C 3688 O O . TYR C 50 ? 0.4295 0.3753 0.3207 0.0408 -0.0156 0.0737 50 TYR C O 3689 C CB . TYR C 50 ? 0.3012 0.2681 0.1878 0.0373 0.0009 0.0665 50 TYR C CB 3690 C CG . TYR C 50 ? 0.3616 0.3351 0.2405 0.0378 0.0105 0.0607 50 TYR C CG 3691 C CD1 . TYR C 50 ? 0.3635 0.3349 0.2221 0.0408 0.0052 0.0526 50 TYR C CD1 3692 C CD2 . TYR C 50 ? 0.3368 0.3186 0.2291 0.0350 0.0253 0.0636 50 TYR C CD2 3693 C CE1 . TYR C 50 ? 0.4401 0.4113 0.2863 0.0398 0.0165 0.0462 50 TYR C CE1 3694 C CE2 . TYR C 50 ? 0.2973 0.2805 0.1804 0.0370 0.0379 0.0591 50 TYR C CE2 3695 C CZ . TYR C 50 ? 0.4436 0.4185 0.3010 0.0388 0.0344 0.0497 50 TYR C CZ 3696 O OH . TYR C 50 ? 0.3764 0.3466 0.2195 0.0393 0.0491 0.0444 50 TYR C OH 3697 N N . ALA C 51 ? 0.3512 0.3096 0.2715 0.0422 -0.0229 0.0570 51 ALA C N 3698 C CA . ALA C 51 ? 0.4380 0.3804 0.3583 0.0458 -0.0278 0.0614 51 ALA C CA 3699 C C . ALA C 51 ? 0.4237 0.3481 0.3423 0.0375 -0.0223 0.0689 51 ALA C C 3700 O O . ALA C 51 ? 0.2963 0.2068 0.2200 0.0357 -0.0227 0.0668 51 ALA C O 3701 C CB . ALA C 51 ? 0.3055 0.2447 0.2115 0.0559 -0.0350 0.0679 51 ALA C CB 3702 N N . SER C 52 ? 0.3204 0.2426 0.2303 0.0313 -0.0158 0.0772 52 SER C N 3703 C CA . SER C 52 ? 0.3787 0.2812 0.2841 0.0223 -0.0106 0.0849 52 SER C CA 3704 C C . SER C 52 ? 0.4249 0.3363 0.3385 0.0089 -0.0028 0.0890 52 SER C C 3705 O O . SER C 52 ? 0.5098 0.4067 0.4215 -0.0020 0.0016 0.0946 52 SER C O 3706 C CB . SER C 52 ? 0.3584 0.2402 0.2424 0.0297 -0.0088 0.0953 52 SER C CB 3707 O OG . SER C 52 ? 0.3700 0.2570 0.2409 0.0313 -0.0044 0.1012 52 SER C OG 3708 N N . GLU C 53 ? 0.3769 0.3114 0.3003 0.0093 0.0000 0.0867 53 GLU C N 3709 C CA . GLU C 53 ? 0.3503 0.2973 0.2855 -0.0005 0.0095 0.0933 53 GLU C CA 3710 C C . GLU C 53 ? 0.3488 0.3123 0.3091 -0.0111 0.0061 0.0904 53 GLU C C 3711 O O . GLU C 53 ? 0.3206 0.2937 0.2888 -0.0070 -0.0002 0.0821 53 GLU C O 3712 C CB . GLU C 53 ? 0.3087 0.2686 0.2399 0.0066 0.0179 0.0945 53 GLU C CB 3713 C CG . GLU C 53 ? 0.3986 0.3417 0.2997 0.0158 0.0191 0.0974 53 GLU C CG 3714 C CD . GLU C 53 ? 0.4593 0.4090 0.3494 0.0207 0.0283 0.0970 53 GLU C CD 3715 O OE1 . GLU C 53 ? 0.4407 0.4086 0.3485 0.0197 0.0340 0.0935 53 GLU C OE1 3716 O OE2 . GLU C 53 ? 0.4864 0.4203 0.3471 0.0260 0.0305 0.1008 53 GLU C OE2 3717 N N . SER C 54 ? 0.3545 0.3216 0.3271 -0.0254 0.0099 0.0977 54 SER C N 3718 C CA . SER C 54 ? 0.3670 0.3486 0.3608 -0.0377 0.0024 0.0958 54 SER C CA 3719 C C . SER C 54 ? 0.4263 0.4428 0.4468 -0.0357 0.0053 0.0986 54 SER C C 3720 O O . SER C 54 ? 0.4842 0.5117 0.5083 -0.0281 0.0173 0.1037 54 SER C O 3721 C CB . SER C 54 ? 0.3475 0.3186 0.3438 -0.0571 0.0024 0.1013 54 SER C CB 3722 O OG . SER C 54 ? 0.5257 0.5067 0.5323 -0.0621 0.0148 0.1116 54 SER C OG 3723 N N . ILE C 55 ? 0.3568 0.3876 0.3932 -0.0420 -0.0049 0.0960 55 ILE C N 3724 C CA . ILE C 55 ? 0.2945 0.3581 0.3566 -0.0376 -0.0035 0.0995 55 ILE C CA 3725 C C . ILE C 55 ? 0.3738 0.4607 0.4639 -0.0548 -0.0102 0.1081 55 ILE C C 3726 O O . ILE C 55 ? 0.4493 0.5238 0.5330 -0.0701 -0.0225 0.1051 55 ILE C O 3727 C CB . ILE C 55 ? 0.2994 0.3604 0.3546 -0.0280 -0.0115 0.0893 55 ILE C CB 3728 C CG1 . ILE C 55 ? 0.2215 0.2618 0.2522 -0.0137 -0.0067 0.0799 55 ILE C CG1 3729 C CG2 . ILE C 55 ? 0.2316 0.3245 0.3120 -0.0221 -0.0097 0.0945 55 ILE C CG2 3730 C CD1 . ILE C 55 ? 0.2207 0.2685 0.2495 -0.0031 0.0078 0.0834 55 ILE C CD1 3731 N N . SER C 56 ? 0.3158 0.4361 0.4371 -0.0531 -0.0018 0.1190 56 SER C N 3732 C CA . SER C 56 ? 0.2665 0.4162 0.4216 -0.0703 -0.0088 0.1291 56 SER C CA 3733 C C . SER C 56 ? 0.3326 0.4917 0.4923 -0.0779 -0.0301 0.1255 56 SER C C 3734 O O . SER C 56 ? 0.3323 0.5004 0.4930 -0.0641 -0.0333 0.1231 56 SER C O 3735 C CB . SER C 56 ? 0.2982 0.4853 0.4910 -0.0634 0.0062 0.1432 56 SER C CB 3736 O OG . SER C 56 ? 0.3996 0.6208 0.6317 -0.0811 -0.0010 0.1543 56 SER C OG 3737 N N . GLY C 57 ? 0.4125 0.5652 0.5705 -0.1007 -0.0438 0.1247 57 GLY C N 3738 C CA . GLY C 57 ? 0.3506 0.5095 0.5084 -0.1116 -0.0654 0.1219 57 GLY C CA 3739 C C . GLY C 57 ? 0.3817 0.4937 0.4945 -0.1134 -0.0736 0.1070 57 GLY C C 3740 O O . GLY C 57 ? 0.2869 0.3930 0.3894 -0.1256 -0.0909 0.1032 57 GLY C O 3741 N N . ILE C 58 ? 0.3492 0.4279 0.4351 -0.1011 -0.0611 0.0993 58 ILE C N 3742 C CA . ILE C 58 ? 0.3821 0.4160 0.4291 -0.1009 -0.0651 0.0866 58 ILE C CA 3743 C C . ILE C 58 ? 0.4420 0.4448 0.4700 -0.1216 -0.0658 0.0852 58 ILE C C 3744 O O . ILE C 58 ? 0.4593 0.4607 0.4923 -0.1253 -0.0550 0.0908 58 ILE C O 3745 C CB . ILE C 58 ? 0.3686 0.3836 0.3987 -0.0781 -0.0527 0.0798 58 ILE C CB 3746 C CG1 . ILE C 58 ? 0.3540 0.3920 0.3965 -0.0594 -0.0503 0.0789 58 ILE C CG1 3747 C CG2 . ILE C 58 ? 0.2885 0.2588 0.2846 -0.0780 -0.0541 0.0691 58 ILE C CG2 3748 C CD1 . ILE C 58 ? 0.2457 0.2916 0.2901 -0.0619 -0.0634 0.0769 58 ILE C CD1 3749 N N . PRO C 59 ? 0.4420 0.4154 0.4443 -0.1355 -0.0769 0.0776 59 PRO C N 3750 C CA . PRO C 59 ? 0.4496 0.3844 0.4264 -0.1565 -0.0759 0.0747 59 PRO C CA 3751 C C . PRO C 59 ? 0.4798 0.3837 0.4394 -0.1457 -0.0581 0.0743 59 PRO C C 3752 O O . PRO C 59 ? 0.4828 0.3797 0.4361 -0.1226 -0.0506 0.0713 59 PRO C O 3753 C CB . PRO C 59 ? 0.5316 0.4300 0.4741 -0.1623 -0.0853 0.0641 59 PRO C CB 3754 C CG . PRO C 59 ? 0.4768 0.4092 0.4366 -0.1557 -0.0987 0.0651 59 PRO C CG 3755 C CD . PRO C 59 ? 0.3946 0.3664 0.3872 -0.1326 -0.0896 0.0716 59 PRO C CD 3756 N N . SER C 60 ? 0.4623 0.3479 0.4141 -0.1631 -0.0519 0.0778 60 SER C N 3757 C CA . SER C 60 ? 0.4285 0.2844 0.3631 -0.1532 -0.0349 0.0801 60 SER C CA 3758 C C . SER C 60 ? 0.4872 0.2942 0.3858 -0.1427 -0.0296 0.0725 60 SER C C 3759 O O . SER C 60 ? 0.4713 0.2559 0.3566 -0.1287 -0.0170 0.0753 60 SER C O 3760 C CB . SER C 60 ? 0.4610 0.3043 0.3933 -0.1762 -0.0276 0.0857 60 SER C CB 3761 O OG . SER C 60 ? 0.5347 0.3406 0.4397 -0.2002 -0.0322 0.0792 60 SER C OG 3762 N N . ARG C 61 ? 0.4858 0.2752 0.3682 -0.1487 -0.0385 0.0639 61 ARG C N 3763 C CA . ARG C 61 ? 0.5288 0.2689 0.3781 -0.1395 -0.0305 0.0573 61 ARG C CA 3764 C C . ARG C 61 ? 0.5398 0.2925 0.3990 -0.1097 -0.0274 0.0554 61 ARG C C 3765 O O . ARG C 61 ? 0.5626 0.2831 0.4042 -0.0961 -0.0182 0.0526 61 ARG C O 3766 C CB . ARG C 61 ? 0.6427 0.3549 0.4665 -0.1562 -0.0381 0.0478 61 ARG C CB 3767 C CG . ARG C 61 ? 0.6136 0.3507 0.4476 -0.1565 -0.0541 0.0439 61 ARG C CG 3768 C CD . ARG C 61 ? 0.5971 0.3067 0.4001 -0.1678 -0.0594 0.0339 61 ARG C CD 3769 N NE . ARG C 61 ? 0.5531 0.2772 0.3590 -0.1664 -0.0738 0.0310 61 ARG C NE 3770 C CZ . ARG C 61 ? 0.6239 0.3833 0.4477 -0.1822 -0.0935 0.0353 61 ARG C CZ 3771 N NH1 . ARG C 61 ? 0.6080 0.3933 0.4511 -0.2024 -0.1007 0.0424 61 ARG C NH1 3772 N NH2 . ARG C 61 ? 0.5889 0.3639 0.4152 -0.1737 -0.1040 0.0328 61 ARG C NH2 3773 N N . PHE C 62 ? 0.4054 0.2054 0.2940 -0.1002 -0.0340 0.0574 62 PHE C N 3774 C CA . PHE C 62 ? 0.4204 0.2356 0.3195 -0.0748 -0.0308 0.0555 62 PHE C CA 3775 C C . PHE C 62 ? 0.4352 0.2600 0.3412 -0.0627 -0.0224 0.0634 62 PHE C C 3776 O O . PHE C 62 ? 0.4516 0.2958 0.3694 -0.0701 -0.0211 0.0708 62 PHE C O 3777 C CB . PHE C 62 ? 0.3418 0.1974 0.2638 -0.0701 -0.0393 0.0535 62 PHE C CB 3778 C CG . PHE C 62 ? 0.3474 0.1936 0.2599 -0.0768 -0.0480 0.0460 62 PHE C CG 3779 C CD1 . PHE C 62 ? 0.3792 0.2057 0.2796 -0.0635 -0.0447 0.0373 62 PHE C CD1 3780 C CD2 . PHE C 62 ? 0.4754 0.3336 0.3916 -0.0964 -0.0598 0.0482 62 PHE C CD2 3781 C CE1 . PHE C 62 ? 0.4703 0.2830 0.3568 -0.0690 -0.0511 0.0305 62 PHE C CE1 3782 C CE2 . PHE C 62 ? 0.4783 0.3256 0.3804 -0.1024 -0.0696 0.0419 62 PHE C CE2 3783 C CZ . PHE C 62 ? 0.4764 0.2981 0.3610 -0.0883 -0.0644 0.0329 62 PHE C CZ 3784 N N . SER C 63 ? 0.4161 0.2274 0.3148 -0.0441 -0.0168 0.0626 63 SER C N 3785 C CA . SER C 63 ? 0.4665 0.2892 0.3690 -0.0304 -0.0120 0.0698 63 SER C CA 3786 C C . SER C 63 ? 0.4414 0.2686 0.3472 -0.0092 -0.0128 0.0660 63 SER C C 3787 O O . SER C 63 ? 0.4055 0.2217 0.3105 -0.0052 -0.0137 0.0583 63 SER C O 3788 C CB . SER C 63 ? 0.4106 0.2029 0.2945 -0.0347 -0.0030 0.0786 63 SER C CB 3789 O OG . SER C 63 ? 0.4579 0.2140 0.3244 -0.0261 0.0028 0.0780 63 SER C OG 3790 N N . GLY C 64 ? 0.3879 0.2304 0.2965 0.0031 -0.0124 0.0713 64 GLY C N 3791 C CA . GLY C 64 ? 0.3832 0.2342 0.2968 0.0210 -0.0153 0.0684 64 GLY C CA 3792 C C . GLY C 64 ? 0.3768 0.2253 0.2815 0.0335 -0.0149 0.0780 64 GLY C C 3793 O O . GLY C 64 ? 0.4448 0.2896 0.3386 0.0298 -0.0114 0.0865 64 GLY C O 3794 N N . SER C 65 ? 0.3990 0.2503 0.3089 0.0487 -0.0186 0.0773 65 SER C N 3795 C CA . SER C 65 ? 0.4144 0.2666 0.3161 0.0621 -0.0217 0.0876 65 SER C CA 3796 C C . SER C 65 ? 0.3740 0.2497 0.2906 0.0756 -0.0313 0.0838 65 SER C C 3797 O O . SER C 65 ? 0.3792 0.2671 0.3129 0.0746 -0.0328 0.0726 65 SER C O 3798 C CB . SER C 65 ? 0.3946 0.2120 0.2823 0.0672 -0.0137 0.0984 65 SER C CB 3799 O OG . SER C 65 ? 0.4910 0.2943 0.3885 0.0729 -0.0100 0.0947 65 SER C OG 3800 N N . GLY C 66 ? 0.4296 0.3114 0.3391 0.0874 -0.0380 0.0934 66 GLY C N 3801 C CA . GLY C 66 ? 0.3737 0.2811 0.2983 0.0988 -0.0500 0.0913 66 GLY C CA 3802 C C . GLY C 66 ? 0.3773 0.3073 0.2911 0.0968 -0.0602 0.0895 66 GLY C C 3803 O O . GLY C 66 ? 0.3860 0.3145 0.2853 0.0863 -0.0554 0.0868 66 GLY C O 3804 N N . SER C 67 ? 0.4199 0.3706 0.3409 0.1065 -0.0739 0.0914 67 SER C N 3805 C CA . SER C 67 ? 0.4538 0.4248 0.3617 0.1032 -0.0855 0.0876 67 SER C CA 3806 C C . SER C 67 ? 0.4665 0.4654 0.3956 0.1110 -0.1016 0.0857 67 SER C C 3807 O O . SER C 67 ? 0.5397 0.5409 0.4876 0.1239 -0.1052 0.0948 67 SER C O 3808 C CB . SER C 67 ? 0.3959 0.3526 0.2687 0.1059 -0.0877 0.1007 67 SER C CB 3809 O OG . SER C 67 ? 0.5362 0.4906 0.4079 0.1214 -0.0969 0.1154 67 SER C OG 3810 N N . GLY C 68 ? 0.4268 0.4468 0.3536 0.1028 -0.1103 0.0745 68 GLY C N 3811 C CA . GLY C 68 ? 0.3498 0.4003 0.2998 0.1060 -0.1264 0.0706 68 GLY C CA 3812 C C . GLY C 68 ? 0.4874 0.5489 0.4708 0.1009 -0.1186 0.0553 68 GLY C C 3813 O O . GLY C 68 ? 0.4726 0.5378 0.4508 0.0885 -0.1139 0.0406 68 GLY C O 3814 N N . THR C 69 ? 0.3078 0.3704 0.3231 0.1110 -0.1145 0.0593 69 THR C N 3815 C CA . THR C 69 ? 0.3866 0.4557 0.4324 0.1073 -0.1051 0.0456 69 THR C CA 3816 C C . THR C 69 ? 0.3326 0.3725 0.3846 0.1106 -0.0862 0.0462 69 THR C C 3817 O O . THR C 69 ? 0.3989 0.4322 0.4587 0.1036 -0.0748 0.0333 69 THR C O 3818 C CB . THR C 69 ? 0.2795 0.3815 0.3642 0.1138 -0.1168 0.0455 69 THR C CB 3819 O OG1 . THR C 69 ? 0.2934 0.3936 0.3954 0.1314 -0.1181 0.0630 69 THR C OG1 3820 C CG2 . THR C 69 ? 0.2927 0.4240 0.3691 0.1068 -0.1381 0.0431 69 THR C CG2 3821 N N . ASP C 70 ? 0.3332 0.3525 0.3776 0.1205 -0.0824 0.0611 70 ASP C N 3822 C CA . ASP C 70 ? 0.2898 0.2768 0.3353 0.1223 -0.0648 0.0620 70 ASP C CA 3823 C C . ASP C 70 ? 0.2945 0.2535 0.3081 0.1119 -0.0563 0.0624 70 ASP C C 3824 O O . ASP C 70 ? 0.3829 0.3328 0.3746 0.1131 -0.0592 0.0734 70 ASP C O 3825 C CB . ASP C 70 ? 0.3805 0.3572 0.4391 0.1395 -0.0617 0.0777 70 ASP C CB 3826 C CG . ASP C 70 ? 0.3846 0.3929 0.4839 0.1505 -0.0687 0.0788 70 ASP C CG 3827 O OD1 . ASP C 70 ? 0.3662 0.3967 0.4846 0.1427 -0.0712 0.0643 70 ASP C OD1 3828 O OD2 . ASP C 70 ? 0.3264 0.3358 0.4380 0.1629 -0.0708 0.0915 70 ASP C OD2 3829 N N . PHE C 71 ? 0.3122 0.2580 0.3240 0.1016 -0.0460 0.0510 71 PHE C N 3830 C CA . PHE C 71 ? 0.3468 0.2733 0.3345 0.0901 -0.0401 0.0513 71 PHE C CA 3831 C C . PHE C 71 ? 0.4504 0.3447 0.4340 0.0858 -0.0276 0.0492 71 PHE C C 3832 O O . PHE C 71 ? 0.4576 0.3445 0.4551 0.0894 -0.0213 0.0430 71 PHE C O 3833 C CB . PHE C 71 ? 0.2624 0.2065 0.2458 0.0795 -0.0423 0.0409 71 PHE C CB 3834 C CG . PHE C 71 ? 0.3426 0.3115 0.3223 0.0812 -0.0529 0.0415 71 PHE C CG 3835 C CD1 . PHE C 71 ? 0.3189 0.3107 0.3156 0.0842 -0.0598 0.0335 71 PHE C CD1 3836 C CD2 . PHE C 71 ? 0.3694 0.3364 0.3267 0.0788 -0.0555 0.0499 71 PHE C CD2 3837 C CE1 . PHE C 71 ? 0.3406 0.3523 0.3287 0.0832 -0.0711 0.0334 71 PHE C CE1 3838 C CE2 . PHE C 71 ? 0.3616 0.3455 0.3081 0.0796 -0.0650 0.0503 71 PHE C CE2 3839 C CZ . PHE C 71 ? 0.3426 0.3486 0.3030 0.0811 -0.0738 0.0417 71 PHE C CZ 3840 N N . THR C 72 ? 0.4026 0.2759 0.3655 0.0768 -0.0235 0.0545 72 THR C N 3841 C CA . THR C 72 ? 0.3770 0.2157 0.3290 0.0695 -0.0132 0.0530 72 THR C CA 3842 C C . THR C 72 ? 0.3840 0.2193 0.3228 0.0521 -0.0136 0.0496 72 THR C C 3843 O O . THR C 72 ? 0.3754 0.2201 0.3070 0.0467 -0.0167 0.0557 72 THR C O 3844 C CB . THR C 72 ? 0.3507 0.1585 0.2896 0.0752 -0.0059 0.0654 72 THR C CB 3845 O OG1 . THR C 72 ? 0.3558 0.1700 0.3113 0.0937 -0.0058 0.0714 72 THR C OG1 3846 C CG2 . THR C 72 ? 0.4420 0.2082 0.3640 0.0652 0.0059 0.0622 72 THR C CG2 3847 N N . LEU C 73 ? 0.4036 0.2263 0.3399 0.0438 -0.0103 0.0406 73 LEU C N 3848 C CA . LEU C 73 ? 0.3969 0.2137 0.3214 0.0266 -0.0118 0.0392 73 LEU C CA 3849 C C . LEU C 73 ? 0.4471 0.2206 0.3502 0.0177 -0.0047 0.0412 73 LEU C C 3850 O O . LEU C 73 ? 0.4803 0.2270 0.3778 0.0229 0.0030 0.0372 73 LEU C O 3851 C CB . LEU C 73 ? 0.3639 0.1943 0.2951 0.0227 -0.0147 0.0287 73 LEU C CB 3852 C CG . LEU C 73 ? 0.4018 0.2310 0.3244 0.0057 -0.0190 0.0290 73 LEU C CG 3853 C CD1 . LEU C 73 ? 0.4056 0.2604 0.3353 0.0003 -0.0229 0.0374 73 LEU C CD1 3854 C CD2 . LEU C 73 ? 0.3116 0.1488 0.2371 0.0041 -0.0215 0.0203 73 LEU C CD2 3855 N N . SER C 74 ? 0.4423 0.2067 0.3327 0.0037 -0.0053 0.0472 74 SER C N 3856 C CA . SER C 74 ? 0.4887 0.2080 0.3540 -0.0076 0.0025 0.0490 74 SER C CA 3857 C C . SER C 74 ? 0.4715 0.1846 0.3249 -0.0315 -0.0034 0.0453 74 SER C C 3858 O O . SER C 74 ? 0.4759 0.2193 0.3413 -0.0409 -0.0113 0.0482 74 SER C O 3859 C CB . SER C 74 ? 0.6059 0.3092 0.4614 -0.0043 0.0096 0.0605 74 SER C CB 3860 O OG . SER C 74 ? 0.6405 0.3366 0.5016 0.0150 0.0174 0.0636 74 SER C OG 3861 N N . ILE C 75 ? 0.4381 0.1244 0.2747 -0.0398 0.0008 0.0378 75 ILE C N 3862 C CA . ILE C 75 ? 0.5912 0.2689 0.4125 -0.0636 -0.0052 0.0345 75 ILE C CA 3863 C C . ILE C 75 ? 0.5770 0.2281 0.3806 -0.0687 0.0063 0.0339 75 ILE C C 3864 O O . ILE C 75 ? 0.5632 0.1993 0.3602 -0.0588 0.0163 0.0290 75 ILE C O 3865 C CB . ILE C 75 ? 0.5952 0.2741 0.4107 -0.0673 -0.0115 0.0246 75 ILE C CB 3866 C CG1 . ILE C 75 ? 0.5112 0.2111 0.3447 -0.0530 -0.0162 0.0232 75 ILE C CG1 3867 C CG2 . ILE C 75 ? 0.6502 0.3299 0.4537 -0.0930 -0.0249 0.0240 75 ILE C CG2 3868 C CD1 . ILE C 75 ? 0.4926 0.1949 0.3201 -0.0559 -0.0223 0.0147 75 ILE C CD1 3869 N N . ASN C 76 ? 0.6155 0.2486 0.3643 -0.0425 0.0047 0.0131 76 ASN C N 3870 C CA . ASN C 76 ? 0.8543 0.4133 0.5557 -0.0448 0.0027 0.0155 76 ASN C CA 3871 C C . ASN C 76 ? 0.8732 0.4385 0.5981 -0.0457 -0.0045 0.0004 76 ASN C C 3872 O O . ASN C 76 ? 1.0374 0.5466 0.7259 -0.0360 -0.0138 0.0015 76 ASN C O 3873 C CB . ASN C 76 ? 0.9548 0.4483 0.6072 -0.0777 0.0261 0.0219 76 ASN C CB 3874 C CG . ASN C 76 ? 0.9940 0.5223 0.6871 -0.1184 0.0509 0.0048 76 ASN C CG 3875 O OD1 . ASN C 76 ? 0.9878 0.5829 0.7428 -0.1184 0.0459 -0.0126 76 ASN C OD1 3876 N ND2 . ASN C 76 ? 1.0428 0.5252 0.6989 -0.1533 0.0779 0.0072 76 ASN C ND2 3877 N N . SER C 77 ? 0.6710 0.3011 0.4527 -0.0547 -0.0023 -0.0150 77 SER C N 3878 C CA . SER C 77 ? 0.6077 0.2522 0.4140 -0.0520 -0.0120 -0.0313 77 SER C CA 3879 C C . SER C 77 ? 0.5578 0.2779 0.4158 -0.0420 -0.0198 -0.0419 77 SER C C 3880 O O . SER C 77 ? 0.5721 0.3306 0.4660 -0.0598 -0.0123 -0.0567 77 SER C O 3881 C CB . SER C 77 ? 0.6551 0.2730 0.4622 -0.0874 0.0036 -0.0459 77 SER C CB 3882 O OG . SER C 77 ? 0.6543 0.2965 0.4922 -0.0845 -0.0074 -0.0652 77 SER C OG 3883 N N . VAL C 78 ? 0.5053 0.2443 0.3636 -0.0130 -0.0348 -0.0363 78 VAL C N 3884 C CA . VAL C 78 ? 0.4791 0.2736 0.3683 -0.0019 -0.0415 -0.0416 78 VAL C CA 3885 C C . VAL C 78 ? 0.4537 0.2705 0.3678 -0.0038 -0.0495 -0.0614 78 VAL C C 3886 O O . VAL C 78 ? 0.4623 0.2566 0.3685 -0.0027 -0.0551 -0.0693 78 VAL C O 3887 C CB . VAL C 78 ? 0.4773 0.2799 0.3544 0.0239 -0.0508 -0.0327 78 VAL C CB 3888 C CG1 . VAL C 78 ? 0.4985 0.2811 0.3623 0.0385 -0.0610 -0.0391 78 VAL C CG1 3889 C CG2 . VAL C 78 ? 0.3721 0.2170 0.2672 0.0312 -0.0538 -0.0350 78 VAL C CG2 3890 N N . GLU C 79 ? 0.4407 0.3001 0.3825 -0.0037 -0.0526 -0.0712 79 GLU C N 3891 C CA . GLU C 79 ? 0.4536 0.3369 0.4165 0.0007 -0.0654 -0.0924 79 GLU C CA 3892 C C . GLU C 79 ? 0.4269 0.3332 0.3854 0.0235 -0.0783 -0.0910 79 GLU C C 3893 O O . GLU C 79 ? 0.4391 0.3485 0.3863 0.0303 -0.0743 -0.0759 79 GLU C O 3894 C CB . GLU C 79 ? 0.4464 0.3563 0.4465 -0.0212 -0.0601 -0.1151 79 GLU C CB 3895 C CG . GLU C 79 ? 0.5117 0.4257 0.5196 -0.0420 -0.0404 -0.1095 79 GLU C CG 3896 C CD . GLU C 79 ? 0.6408 0.5773 0.6850 -0.0721 -0.0280 -0.1363 79 GLU C CD 3897 O OE1 . GLU C 79 ? 0.6134 0.5956 0.6912 -0.0763 -0.0252 -0.1515 79 GLU C OE1 3898 O OE2 . GLU C 79 ? 0.7525 0.6615 0.7925 -0.0926 -0.0202 -0.1449 79 GLU C OE2 3899 N N . SER C 80 ? 0.4957 0.4123 0.4577 0.0348 -0.0942 -0.1076 80 SER C N 3900 C CA . SER C 80 ? 0.4781 0.3999 0.4194 0.0569 -0.1070 -0.1059 80 SER C CA 3901 C C . SER C 80 ? 0.4424 0.3826 0.3891 0.0619 -0.1085 -0.1033 80 SER C C 3902 O O . SER C 80 ? 0.4678 0.3960 0.3849 0.0738 -0.1093 -0.0901 80 SER C O 3903 C CB . SER C 80 ? 0.5116 0.4377 0.4516 0.0692 -0.1265 -0.1272 80 SER C CB 3904 O OG . SER C 80 ? 0.5533 0.5104 0.5334 0.0621 -0.1344 -0.1521 80 SER C OG 3905 N N . GLU C 81 ? 0.3352 0.3036 0.3187 0.0513 -0.1072 -0.1179 81 GLU C N 3906 C CA . GLU C 81 ? 0.3312 0.3182 0.3213 0.0586 -0.1098 -0.1184 81 GLU C CA 3907 C C . GLU C 81 ? 0.3313 0.3068 0.3084 0.0506 -0.0920 -0.0939 81 GLU C C 3908 O O . GLU C 81 ? 0.3637 0.3500 0.3421 0.0566 -0.0930 -0.0924 81 GLU C O 3909 C CB . GLU C 81 ? 0.3491 0.3793 0.3883 0.0502 -0.1125 -0.1468 81 GLU C CB 3910 C CG . GLU C 81 ? 0.5770 0.6154 0.6424 0.0183 -0.0874 -0.1464 81 GLU C CG 3911 C CD . GLU C 81 ? 0.8229 0.8648 0.9110 -0.0018 -0.0831 -0.1657 81 GLU C CD 3912 O OE1 . GLU C 81 ? 0.8781 0.8984 0.9480 0.0070 -0.0940 -0.1649 81 GLU C OE1 3913 O OE2 . GLU C 81 ? 0.8558 0.9216 0.9787 -0.0282 -0.0672 -0.1834 81 GLU C OE2 3914 N N . ASP C 82 ? 0.3565 0.3096 0.3198 0.0401 -0.0784 -0.0771 82 ASP C N 3915 C CA . ASP C 82 ? 0.3676 0.3107 0.3168 0.0363 -0.0654 -0.0567 82 ASP C CA 3916 C C . ASP C 82 ? 0.3421 0.2710 0.2597 0.0503 -0.0683 -0.0444 82 ASP C C 3917 O O . ASP C 82 ? 0.3352 0.2599 0.2426 0.0482 -0.0591 -0.0309 82 ASP C O 3918 C CB . ASP C 82 ? 0.3495 0.2724 0.2941 0.0225 -0.0526 -0.0471 82 ASP C CB 3919 C CG . ASP C 82 ? 0.3862 0.3126 0.3520 0.0010 -0.0427 -0.0576 82 ASP C CG 3920 O OD1 . ASP C 82 ? 0.3634 0.3182 0.3537 -0.0060 -0.0395 -0.0690 82 ASP C OD1 3921 O OD2 . ASP C 82 ? 0.4457 0.3442 0.4015 -0.0098 -0.0371 -0.0563 82 ASP C OD2 3922 N N . ILE C 83 ? 0.3711 0.2918 0.2712 0.0626 -0.0797 -0.0509 83 ILE C N 3923 C CA . ILE C 83 ? 0.3248 0.2277 0.1884 0.0709 -0.0783 -0.0418 83 ILE C CA 3924 C C . ILE C 83 ? 0.3242 0.2253 0.1771 0.0734 -0.0774 -0.0358 83 ILE C C 3925 O O . ILE C 83 ? 0.3341 0.2374 0.1876 0.0832 -0.0904 -0.0449 83 ILE C O 3926 C CB . ILE C 83 ? 0.4336 0.3203 0.2702 0.0834 -0.0907 -0.0509 83 ILE C CB 3927 C CG1 . ILE C 83 ? 0.4896 0.3745 0.3309 0.0813 -0.0891 -0.0558 83 ILE C CG1 3928 C CG2 . ILE C 83 ? 0.4295 0.2900 0.2187 0.0877 -0.0856 -0.0422 83 ILE C CG2 3929 C CD1 . ILE C 83 ? 0.5883 0.4611 0.4092 0.0935 -0.1039 -0.0689 83 ILE C CD1 3930 N N . ALA C 84 ? 0.3604 0.2585 0.2044 0.0661 -0.0637 -0.0233 84 ALA C N 3931 C CA . ALA C 84 ? 0.3148 0.2097 0.1504 0.0652 -0.0605 -0.0171 84 ALA C CA 3932 C C . ALA C 84 ? 0.3850 0.2810 0.2146 0.0550 -0.0448 -0.0073 84 ALA C C 3933 O O . ALA C 84 ? 0.3515 0.2547 0.1868 0.0513 -0.0382 -0.0074 84 ALA C O 3934 C CB . ALA C 84 ? 0.2950 0.2121 0.1636 0.0631 -0.0629 -0.0214 84 ALA C CB 3935 N N . ASP C 85 ? 0.3558 0.2467 0.1759 0.0520 -0.0405 -0.0023 85 ASP C N 3936 C CA . ASP C 85 ? 0.3171 0.2185 0.1424 0.0417 -0.0274 0.0028 85 ASP C CA 3937 C C . ASP C 85 ? 0.3480 0.2682 0.2003 0.0401 -0.0277 0.0055 85 ASP C C 3938 O O . ASP C 85 ? 0.3936 0.3165 0.2553 0.0438 -0.0339 0.0033 85 ASP C O 3939 C CB . ASP C 85 ? 0.3420 0.2213 0.1350 0.0356 -0.0200 0.0052 85 ASP C CB 3940 C CG . ASP C 85 ? 0.4170 0.2680 0.1710 0.0336 -0.0158 0.0033 85 ASP C CG 3941 O OD1 . ASP C 85 ? 0.5146 0.3783 0.2763 0.0318 -0.0113 -0.0014 85 ASP C OD1 3942 O OD2 . ASP C 85 ? 0.4083 0.2196 0.1190 0.0350 -0.0174 0.0058 85 ASP C OD2 3943 N N . TYR C 86 ? 0.3812 0.3151 0.2444 0.0358 -0.0213 0.0076 86 TYR C N 3944 C CA . TYR C 86 ? 0.2883 0.2317 0.1658 0.0344 -0.0207 0.0113 86 TYR C CA 3945 C C . TYR C 86 ? 0.3300 0.2819 0.2055 0.0308 -0.0154 0.0126 86 TYR C C 3946 O O . TYR C 86 ? 0.4055 0.3670 0.2809 0.0296 -0.0121 0.0078 86 TYR C O 3947 C CB . TYR C 86 ? 0.2861 0.2278 0.1707 0.0369 -0.0232 0.0119 86 TYR C CB 3948 C CG . TYR C 86 ? 0.3636 0.2982 0.2541 0.0363 -0.0272 0.0084 86 TYR C CG 3949 C CD1 . TYR C 86 ? 0.3039 0.2338 0.1905 0.0409 -0.0318 0.0031 86 TYR C CD1 3950 C CD2 . TYR C 86 ? 0.2739 0.2098 0.1753 0.0296 -0.0253 0.0069 86 TYR C CD2 3951 C CE1 . TYR C 86 ? 0.3338 0.2601 0.2278 0.0408 -0.0373 -0.0034 86 TYR C CE1 3952 C CE2 . TYR C 86 ? 0.2787 0.2155 0.1921 0.0267 -0.0284 -0.0019 86 TYR C CE2 3953 C CZ . TYR C 86 ? 0.3612 0.2930 0.2713 0.0333 -0.0360 -0.0070 86 TYR C CZ 3954 O OH . TYR C 86 ? 0.3837 0.3189 0.3077 0.0308 -0.0411 -0.0188 86 TYR C OH 3955 N N . TYR C 87 ? 0.3126 0.2652 0.1893 0.0289 -0.0145 0.0153 87 TYR C N 3956 C CA . TYR C 87 ? 0.2979 0.2572 0.1715 0.0252 -0.0105 0.0147 87 TYR C CA 3957 C C . TYR C 87 ? 0.3583 0.3233 0.2357 0.0268 -0.0111 0.0180 87 TYR C C 3958 O O . TYR C 87 ? 0.4264 0.3868 0.3058 0.0262 -0.0103 0.0210 87 TYR C O 3959 C CB . TYR C 87 ? 0.2480 0.1946 0.1090 0.0223 -0.0090 0.0140 87 TYR C CB 3960 C CG . TYR C 87 ? 0.2680 0.1947 0.1079 0.0192 -0.0068 0.0121 87 TYR C CG 3961 C CD1 . TYR C 87 ? 0.3861 0.3113 0.2154 0.0076 0.0033 0.0077 87 TYR C CD1 3962 C CD2 . TYR C 87 ? 0.3156 0.2235 0.1430 0.0270 -0.0141 0.0123 87 TYR C CD2 3963 C CE1 . TYR C 87 ? 0.4248 0.3232 0.2245 0.0003 0.0099 0.0064 87 TYR C CE1 3964 C CE2 . TYR C 87 ? 0.4015 0.2802 0.1964 0.0252 -0.0125 0.0118 87 TYR C CE2 3965 C CZ . TYR C 87 ? 0.4134 0.2837 0.1908 0.0102 0.0014 0.0102 87 TYR C CZ 3966 O OH . TYR C 87 ? 0.3726 0.2059 0.1082 0.0042 0.0075 0.0102 87 TYR C OH 3967 N N . CYS C 88 ? 0.3602 0.3356 0.2371 0.0278 -0.0117 0.0148 88 CYS C N 3968 C CA . CYS C 88 ? 0.3868 0.3613 0.2570 0.0306 -0.0133 0.0178 88 CYS C CA 3969 C C . CYS C 88 ? 0.4046 0.3864 0.2741 0.0258 -0.0102 0.0139 88 CYS C C 3970 O O . CYS C 88 ? 0.3794 0.3660 0.2518 0.0196 -0.0072 0.0076 88 CYS C O 3971 C CB . CYS C 88 ? 0.3209 0.2964 0.1848 0.0416 -0.0219 0.0155 88 CYS C CB 3972 S SG . CYS C 88 ? 0.4238 0.4311 0.3041 0.0462 -0.0274 -0.0021 88 CYS C SG 3973 N N . GLN C 89 ? 0.3706 0.3484 0.2318 0.0266 -0.0091 0.0170 89 GLN C N 3974 C CA . GLN C 89 ? 0.3489 0.3312 0.2073 0.0236 -0.0072 0.0127 89 GLN C CA 3975 C C . GLN C 89 ? 0.3338 0.3153 0.1779 0.0290 -0.0102 0.0138 89 GLN C C 3976 O O . GLN C 89 ? 0.3615 0.3288 0.1914 0.0307 -0.0082 0.0211 89 GLN C O 3977 C CB . GLN C 89 ? 0.3413 0.3172 0.2013 0.0211 -0.0025 0.0131 89 GLN C CB 3978 C CG . GLN C 89 ? 0.2551 0.2326 0.1089 0.0210 -0.0003 0.0091 89 GLN C CG 3979 C CD . GLN C 89 ? 0.3302 0.3092 0.1901 0.0227 0.0037 0.0056 89 GLN C CD 3980 O OE1 . GLN C 89 ? 0.2997 0.2824 0.1696 0.0221 0.0060 0.0060 89 GLN C OE1 3981 N NE2 . GLN C 89 ? 0.2744 0.2536 0.1310 0.0252 0.0039 -0.0014 89 GLN C NE2 3982 N N . GLN C 90 ? 0.2853 0.2781 0.1286 0.0304 -0.0147 0.0054 90 GLN C N 3983 C CA . GLN C 90 ? 0.2906 0.2794 0.1138 0.0381 -0.0201 0.0048 90 GLN C CA 3984 C C . GLN C 90 ? 0.2905 0.2798 0.1098 0.0326 -0.0140 0.0019 90 GLN C C 3985 O O . GLN C 90 ? 0.2790 0.2748 0.1116 0.0255 -0.0111 -0.0046 90 GLN C O 3986 C CB . GLN C 90 ? 0.2955 0.3020 0.1223 0.0481 -0.0340 -0.0079 90 GLN C CB 3987 C CG . GLN C 90 ? 0.3134 0.3454 0.1621 0.0389 -0.0330 -0.0243 90 GLN C CG 3988 C CD . GLN C 90 ? 0.3159 0.3474 0.1532 0.0381 -0.0339 -0.0294 90 GLN C CD 3989 O OE1 . GLN C 90 ? 0.3168 0.3375 0.1292 0.0496 -0.0409 -0.0260 90 GLN C OE1 3990 N NE2 . GLN C 90 ? 0.3008 0.3370 0.1494 0.0239 -0.0262 -0.0373 90 GLN C NE2 3991 N N . ASN C 91 ? 0.3832 0.3603 0.1786 0.0356 -0.0114 0.0061 91 ASN C N 3992 C CA . ASN C 91 ? 0.3689 0.3490 0.1590 0.0329 -0.0068 0.0003 91 ASN C CA 3993 C C . ASN C 91 ? 0.4109 0.3818 0.1688 0.0408 -0.0120 -0.0009 91 ASN C C 3994 O O . ASN C 91 ? 0.4015 0.3659 0.1423 0.0383 -0.0034 -0.0013 91 ASN C O 3995 C CB . ASN C 91 ? 0.3571 0.3357 0.1538 0.0263 0.0066 0.0018 91 ASN C CB 3996 C CG . ASN C 91 ? 0.4446 0.4290 0.2418 0.0263 0.0093 -0.0082 91 ASN C CG 3997 O OD1 . ASN C 91 ? 0.4115 0.3983 0.2143 0.0268 0.0024 -0.0155 91 ASN C OD1 3998 N ND2 . ASN C 91 ? 0.4923 0.4785 0.2829 0.0242 0.0207 -0.0107 91 ASN C ND2 3999 N N . ASN C 92 ? 0.3645 0.3352 0.1122 0.0524 -0.0273 -0.0037 92 ASN C N 4000 C CA . ASN C 92 ? 0.4332 0.3949 0.1510 0.0636 -0.0378 -0.0083 92 ASN C CA 4001 C C . ASN C 92 ? 0.3897 0.3777 0.1228 0.0641 -0.0455 -0.0264 92 ASN C C 4002 O O . ASN C 92 ? 0.4132 0.3970 0.1307 0.0680 -0.0495 -0.0313 92 ASN C O 4003 C CB . ASN C 92 ? 0.4247 0.3749 0.1320 0.0786 -0.0540 -0.0075 92 ASN C CB 4004 C CG . ASN C 92 ? 0.4691 0.4034 0.1482 0.0907 -0.0648 -0.0109 92 ASN C CG 4005 O OD1 . ASN C 92 ? 0.5035 0.4070 0.1488 0.0862 -0.0547 0.0000 92 ASN C OD1 4006 N ND2 . ASN C 92 ? 0.4723 0.4292 0.1657 0.1056 -0.0846 -0.0283 92 ASN C ND2 4007 N N . ASN C 93 ? 0.3955 0.4077 0.1684 0.0540 -0.0438 -0.0357 93 ASN C N 4008 C CA . ASN C 93 ? 0.4073 0.4410 0.1985 0.0478 -0.0476 -0.0547 93 ASN C CA 4009 C C . ASN C 93 ? 0.3716 0.4022 0.1816 0.0298 -0.0337 -0.0554 93 ASN C C 4010 O O . ASN C 93 ? 0.4231 0.4489 0.2461 0.0223 -0.0261 -0.0482 93 ASN C O 4011 C CB . ASN C 93 ? 0.4288 0.4937 0.2423 0.0530 -0.0625 -0.0742 93 ASN C CB 4012 C CG . ASN C 93 ? 0.5960 0.6598 0.3858 0.0767 -0.0829 -0.0790 93 ASN C CG 4013 O OD1 . ASN C 93 ? 0.6553 0.7096 0.4390 0.0900 -0.0906 -0.0716 93 ASN C OD1 4014 N ND2 . ASN C 93 ? 0.5872 0.6510 0.3678 0.0801 -0.0886 -0.0872 93 ASN C ND2 4015 N N . TRP C 94 ? 0.3703 0.3977 0.1755 0.0248 -0.0319 -0.0647 94 TRP C N 4016 C CA . TRP C 94 ? 0.3870 0.3990 0.1984 0.0111 -0.0217 -0.0664 94 TRP C CA 4017 C C . TRP C 94 ? 0.3802 0.4017 0.2105 -0.0059 -0.0197 -0.0808 94 TRP C C 4018 O O . TRP C 94 ? 0.4268 0.4744 0.2695 -0.0085 -0.0270 -0.0991 94 TRP C O 4019 C CB . TRP C 94 ? 0.4033 0.4036 0.1988 0.0132 -0.0210 -0.0728 94 TRP C CB 4020 C CG . TRP C 94 ? 0.4696 0.4425 0.2608 0.0073 -0.0135 -0.0719 94 TRP C CG 4021 C CD1 . TRP C 94 ? 0.4561 0.4155 0.2415 0.0161 -0.0091 -0.0634 94 TRP C CD1 4022 C CD2 . TRP C 94 ? 0.4803 0.4321 0.2688 -0.0076 -0.0107 -0.0821 94 TRP C CD2 4023 N NE1 . TRP C 94 ? 0.3837 0.3129 0.1606 0.0133 -0.0082 -0.0678 94 TRP C NE1 4024 C CE2 . TRP C 94 ? 0.4646 0.3817 0.2375 -0.0026 -0.0080 -0.0770 94 TRP C CE2 4025 C CE3 . TRP C 94 ? 0.4346 0.3922 0.2307 -0.0258 -0.0097 -0.0979 94 TRP C CE3 4026 C CZ2 . TRP C 94 ? 0.5099 0.3849 0.2633 -0.0134 -0.0054 -0.0830 94 TRP C CZ2 4027 C CZ3 . TRP C 94 ? 0.4624 0.3820 0.2432 -0.0430 -0.0021 -0.1044 94 TRP C CZ3 4028 C CH2 . TRP C 94 ? 0.4967 0.3690 0.2507 -0.0360 -0.0006 -0.0951 94 TRP C CH2 4029 N N . PRO C 95 ? 0.3600 0.3604 0.1908 -0.0182 -0.0094 -0.0750 95 PRO C N 4030 C CA . PRO C 95 ? 0.3728 0.3463 0.1917 -0.0118 -0.0049 -0.0576 95 PRO C CA 4031 C C . PRO C 95 ? 0.3608 0.3464 0.1898 -0.0046 -0.0058 -0.0454 95 PRO C C 4032 O O . PRO C 95 ? 0.3608 0.3692 0.2042 -0.0062 -0.0086 -0.0501 95 PRO C O 4033 C CB . PRO C 95 ? 0.4666 0.4061 0.2731 -0.0280 0.0035 -0.0600 95 PRO C CB 4034 C CG . PRO C 95 ? 0.4441 0.4049 0.2666 -0.0476 0.0089 -0.0749 95 PRO C CG 4035 C CD . PRO C 95 ? 0.3701 0.3685 0.2089 -0.0416 -0.0007 -0.0892 95 PRO C CD 4036 N N . THR C 96 ? 0.3081 0.2806 0.1316 0.0042 -0.0042 -0.0331 96 THR C N 4037 C CA . THR C 96 ? 0.3209 0.2999 0.1526 0.0087 -0.0041 -0.0226 96 THR C CA 4038 C C . THR C 96 ? 0.3120 0.2858 0.1489 -0.0016 -0.0008 -0.0237 96 THR C C 4039 O O . THR C 96 ? 0.3642 0.3133 0.1888 -0.0107 0.0038 -0.0265 96 THR C O 4040 C CB . THR C 96 ? 0.3191 0.2894 0.1490 0.0167 -0.0017 -0.0149 96 THR C CB 4041 O OG1 . THR C 96 ? 0.2765 0.2522 0.1144 0.0186 -0.0011 -0.0064 96 THR C OG1 4042 C CG2 . THR C 96 ? 0.3016 0.2479 0.1240 0.0177 -0.0022 -0.0179 96 THR C CG2 4043 N N . THR C 97 ? 0.2983 0.2900 0.1477 -0.0003 -0.0026 -0.0227 97 THR C N 4044 C CA . THR C 97 ? 0.3036 0.2949 0.1584 -0.0116 0.0032 -0.0267 97 THR C CA 4045 C C . THR C 97 ? 0.3363 0.3290 0.1964 -0.0038 0.0014 -0.0170 97 THR C C 4046 O O . THR C 97 ? 0.3230 0.3202 0.1846 0.0083 -0.0044 -0.0094 97 THR C O 4047 C CB . THR C 97 ? 0.3243 0.3465 0.1970 -0.0209 0.0039 -0.0453 97 THR C CB 4048 O OG1 . THR C 97 ? 0.3463 0.3961 0.2315 -0.0044 -0.0087 -0.0484 97 THR C OG1 4049 C CG2 . THR C 97 ? 0.2956 0.3151 0.1638 -0.0323 0.0068 -0.0577 97 THR C CG2 4050 N N . PHE C 98 ? 0.3191 0.3030 0.1769 -0.0125 0.0079 -0.0178 98 PHE C N 4051 C CA . PHE C 98 ? 0.3039 0.2863 0.1649 -0.0054 0.0059 -0.0099 98 PHE C CA 4052 C C . PHE C 98 ? 0.3395 0.3447 0.2152 -0.0099 0.0089 -0.0200 98 PHE C C 4053 O O . PHE C 98 ? 0.3618 0.3815 0.2441 -0.0238 0.0170 -0.0347 98 PHE C O 4054 C CB . PHE C 98 ? 0.2918 0.2403 0.1322 -0.0064 0.0083 -0.0024 98 PHE C CB 4055 C CG . PHE C 98 ? 0.3431 0.2778 0.1769 0.0041 0.0021 0.0030 98 PHE C CG 4056 C CD1 . PHE C 98 ? 0.3126 0.2323 0.1334 0.0025 0.0023 -0.0005 98 PHE C CD1 4057 C CD2 . PHE C 98 ? 0.3459 0.2852 0.1890 0.0149 -0.0034 0.0079 98 PHE C CD2 4058 C CE1 . PHE C 98 ? 0.3072 0.2205 0.1262 0.0146 -0.0038 -0.0002 98 PHE C CE1 4059 C CE2 . PHE C 98 ? 0.3024 0.2396 0.1473 0.0235 -0.0075 0.0064 98 PHE C CE2 4060 C CZ . PHE C 98 ? 0.2822 0.2084 0.1161 0.0249 -0.0082 0.0018 98 PHE C CZ 4061 N N . GLY C 99 ? 0.2784 0.2884 0.1606 0.0008 0.0036 -0.0152 99 GLY C N 4062 C CA . GLY C 99 ? 0.2806 0.3104 0.1757 -0.0013 0.0066 -0.0262 99 GLY C CA 4063 C C . GLY C 99 ? 0.3237 0.3331 0.2028 -0.0153 0.0193 -0.0256 99 GLY C C 4064 O O . GLY C 99 ? 0.4135 0.3879 0.2677 -0.0186 0.0215 -0.0150 99 GLY C O 4065 N N . ALA C 100 ? 0.3768 0.4061 0.2663 -0.0216 0.0269 -0.0387 100 ALA C N 4066 C CA . ALA C 100 ? 0.4015 0.4059 0.2665 -0.0369 0.0417 -0.0386 100 ALA C CA 4067 C C . ALA C 100 ? 0.3869 0.3716 0.2403 -0.0235 0.0341 -0.0267 100 ALA C C 4068 O O . ALA C 100 ? 0.3826 0.3394 0.2077 -0.0312 0.0425 -0.0244 100 ALA C O 4069 C CB . ALA C 100 ? 0.2982 0.3348 0.1785 -0.0546 0.0584 -0.0618 100 ALA C CB 4070 N N . GLY C 101 ? 0.3157 0.3105 0.1860 -0.0045 0.0186 -0.0201 101 GLY C N 4071 C CA . GLY C 101 ? 0.2636 0.2414 0.1268 0.0062 0.0110 -0.0112 101 GLY C CA 4072 C C . GLY C 101 ? 0.2809 0.2758 0.1558 0.0117 0.0107 -0.0205 101 GLY C C 4073 O O . GLY C 101 ? 0.3073 0.3270 0.1925 0.0044 0.0202 -0.0363 101 GLY C O 4074 N N . THR C 102 ? 0.3052 0.2893 0.1807 0.0240 0.0003 -0.0138 102 THR C N 4075 C CA . THR C 102 ? 0.2604 0.2522 0.1421 0.0317 -0.0023 -0.0216 102 THR C CA 4076 C C . THR C 102 ? 0.3060 0.2706 0.1690 0.0323 -0.0046 -0.0147 102 THR C C 4077 O O . THR C 102 ? 0.3134 0.2621 0.1736 0.0354 -0.0122 -0.0052 102 THR C O 4078 C CB . THR C 102 ? 0.3449 0.3401 0.2397 0.0479 -0.0161 -0.0209 102 THR C CB 4079 O OG1 . THR C 102 ? 0.4078 0.4291 0.3173 0.0543 -0.0193 -0.0320 102 THR C OG1 4080 C CG2 . THR C 102 ? 0.2640 0.2536 0.1586 0.0576 -0.0214 -0.0263 102 THR C CG2 4081 N N . LYS C 103 ? 0.4641 0.2472 0.3258 0.1231 -0.0981 -0.1141 103 LYS C N 4082 C CA . LYS C 103 ? 0.4131 0.2318 0.3096 0.0995 -0.0707 -0.0992 103 LYS C CA 4083 C C . LYS C 103 ? 0.4850 0.2568 0.3215 0.0981 -0.0694 -0.0930 103 LYS C C 4084 O O . LYS C 103 ? 0.4903 0.2435 0.3057 0.1198 -0.0959 -0.1005 103 LYS C O 4085 C CB . LYS C 103 ? 0.4292 0.3246 0.4151 0.0988 -0.0724 -0.1000 103 LYS C CB 4086 C CG . LYS C 103 ? 0.4203 0.3429 0.4333 0.0794 -0.0522 -0.0857 103 LYS C CG 4087 C CD . LYS C 103 ? 0.3464 0.3268 0.4300 0.0740 -0.0510 -0.0857 103 LYS C CD 4088 C CE . LYS C 103 ? 0.3067 0.3033 0.4095 0.0555 -0.0342 -0.0713 103 LYS C CE 4089 N NZ . LYS C 103 ? 0.3020 0.3338 0.4523 0.0480 -0.0335 -0.0700 103 LYS C NZ 4090 N N . LEU C 104 ? 0.4689 0.2229 0.2813 0.0728 -0.0390 -0.0834 104 LEU C N 4091 C CA . LEU C 104 ? 0.5142 0.2208 0.2667 0.0667 -0.0323 -0.0777 104 LEU C CA 4092 C C . LEU C 104 ? 0.4475 0.2139 0.2640 0.0577 -0.0226 -0.0693 104 LEU C C 4093 O O . LEU C 104 ? 0.4147 0.2294 0.2888 0.0403 -0.0029 -0.0663 104 LEU C O 4094 C CB . LEU C 104 ? 0.5806 0.2237 0.2608 0.0400 0.0000 -0.0785 104 LEU C CB 4095 C CG . LEU C 104 ? 0.7083 0.2920 0.3151 0.0274 0.0133 -0.0732 104 LEU C CG 4096 C CD1 . LEU C 104 ? 0.7449 0.2826 0.2940 0.0529 -0.0226 -0.0639 104 LEU C CD1 4097 C CD2 . LEU C 104 ? 0.7866 0.3346 0.3505 -0.0076 0.0524 -0.0730 104 LEU C CD2 4098 N N . GLU C 105 ? 0.5291 0.2892 0.3341 0.0717 -0.0402 -0.0679 105 GLU C N 4099 C CA . GLU C 105 ? 0.4931 0.2978 0.3440 0.0630 -0.0317 -0.0597 105 GLU C CA 4100 C C . GLU C 105 ? 0.5288 0.2794 0.3124 0.0575 -0.0247 -0.0548 105 GLU C C 4101 O O . GLU C 105 ? 0.5635 0.2480 0.2725 0.0730 -0.0430 -0.0593 105 GLU C O 4102 C CB . GLU C 105 ? 0.5001 0.3523 0.4056 0.0802 -0.0540 -0.0659 105 GLU C CB 4103 C CG . GLU C 105 ? 0.5714 0.4720 0.5388 0.0829 -0.0585 -0.0733 105 GLU C CG 4104 C CD . GLU C 105 ? 0.5997 0.5457 0.6207 0.0920 -0.0717 -0.0860 105 GLU C CD 4105 O OE1 . GLU C 105 ? 0.6091 0.5451 0.6168 0.1057 -0.0872 -0.0960 105 GLU C OE1 4106 O OE2 . GLU C 105 ? 0.5754 0.5636 0.6498 0.0836 -0.0652 -0.0891 105 GLU C OE2 4107 N N . LEU C 106 ? 0.4742 0.2470 0.2799 0.0368 -0.0010 -0.0475 106 LEU C N 4108 C CA . LEU C 106 ? 0.5014 0.2284 0.2496 0.0292 0.0082 -0.0435 106 LEU C CA 4109 C C . LEU C 106 ? 0.4340 0.1963 0.2169 0.0380 -0.0040 -0.0376 106 LEU C C 4110 O O . LEU C 106 ? 0.4198 0.2451 0.2745 0.0329 -0.0006 -0.0337 106 LEU C O 4111 C CB . LEU C 106 ? 0.5152 0.2362 0.2582 -0.0020 0.0460 -0.0461 106 LEU C CB 4112 C CG . LEU C 106 ? 0.7312 0.3680 0.3810 -0.0161 0.0642 -0.0542 106 LEU C CG 4113 C CD1 . LEU C 106 ? 0.8567 0.4989 0.5188 -0.0138 0.0624 -0.0612 106 LEU C CD1 4114 C CD2 . LEU C 106 ? 0.8317 0.4511 0.4634 -0.0511 0.1063 -0.0636 106 LEU C CD2 4115 N N . LYS C 107 ? 0.6111 0.3251 0.3360 0.0512 -0.0196 -0.0382 107 LYS C N 4116 C CA . LYS C 107 ? 0.5565 0.2981 0.3076 0.0565 -0.0274 -0.0347 107 LYS C CA 4117 C C . LYS C 107 ? 0.5377 0.2794 0.2841 0.0318 0.0015 -0.0255 107 LYS C C 4118 O O . LYS C 107 ? 0.6269 0.3276 0.3282 0.0128 0.0253 -0.0266 107 LYS C O 4119 C CB . LYS C 107 ? 0.6348 0.3229 0.3270 0.0820 -0.0579 -0.0427 107 LYS C CB 4120 C CG . LYS C 107 ? 0.7200 0.4013 0.4135 0.1113 -0.0928 -0.0601 107 LYS C CG 4121 C CD . LYS C 107 ? 0.7948 0.4615 0.4729 0.1379 -0.1281 -0.0703 107 LYS C CD 4122 C CE . LYS C 107 ? 0.9194 0.5912 0.6063 0.1636 -0.1637 -0.0839 107 LYS C CE 4123 N NZ . LYS C 107 ? 0.9956 0.5867 0.5941 0.1684 -0.1719 -0.0707 107 LYS C NZ 4124 N N . ARG C 108 ? 0.4496 0.2374 0.2439 0.0301 0.0012 -0.0201 108 ARG C N 4125 C CA . ARG C 108 ? 0.4256 0.2159 0.2192 0.0109 0.0231 -0.0142 108 ARG C CA 4126 C C . ARG C 108 ? 0.4398 0.2602 0.2619 0.0189 0.0109 -0.0094 108 ARG C C 4127 O O . ARG C 108 ? 0.4455 0.2881 0.2928 0.0353 -0.0096 -0.0141 108 ARG C O 4128 C CB . ARG C 108 ? 0.3930 0.2265 0.2420 -0.0082 0.0435 -0.0158 108 ARG C CB 4129 C CG . ARG C 108 ? 0.3374 0.2299 0.2581 -0.0023 0.0313 -0.0130 108 ARG C CG 4130 C CD . ARG C 108 ? 0.3192 0.2461 0.2865 -0.0157 0.0415 -0.0138 108 ARG C CD 4131 N NE . ARG C 108 ? 0.3077 0.2355 0.2703 -0.0200 0.0445 -0.0086 108 ARG C NE 4132 C CZ . ARG C 108 ? 0.3002 0.2404 0.2831 -0.0323 0.0563 -0.0147 108 ARG C CZ 4133 N NH1 . ARG C 108 ? 0.3242 0.2800 0.3389 -0.0413 0.0659 -0.0301 108 ARG C NH1 4134 N NH2 . ARG C 108 ? 0.2764 0.2160 0.2524 -0.0349 0.0574 -0.0095 108 ARG C NH2 4135 N N . THR C 109 ? 0.4192 0.2415 0.2395 0.0058 0.0252 -0.0040 109 THR C N 4136 C CA . THR C 109 ? 0.4853 0.3326 0.3280 0.0108 0.0163 0.0005 109 THR C CA 4137 C C . THR C 109 ? 0.4280 0.3328 0.3384 0.0081 0.0132 0.0028 109 THR C C 4138 O O . THR C 109 ? 0.4131 0.3371 0.3526 0.0004 0.0195 0.0032 109 THR C O 4139 C CB . THR C 109 ? 0.4586 0.2942 0.2840 -0.0040 0.0334 0.0055 109 THR C CB 4140 O OG1 . THR C 109 ? 0.3922 0.2533 0.2529 -0.0219 0.0522 0.0035 109 THR C OG1 4141 C CG2 . THR C 109 ? 0.4124 0.1764 0.1552 -0.0055 0.0395 0.0031 109 THR C CG2 4142 N N . VAL C 110 ? 0.3833 0.3087 0.3128 0.0133 0.0039 0.0020 110 VAL C N 4143 C CA . VAL C 110 ? 0.3256 0.2889 0.3007 0.0053 0.0050 0.0040 110 VAL C CA 4144 C C . VAL C 110 ? 0.3654 0.3354 0.3520 -0.0089 0.0148 0.0143 110 VAL C C 4145 O O . VAL C 110 ? 0.4008 0.3617 0.3732 -0.0135 0.0210 0.0182 110 VAL C O 4146 C CB . VAL C 110 ? 0.2090 0.1877 0.1963 0.0073 0.0001 -0.0032 110 VAL C CB 4147 C CG1 . VAL C 110 ? 0.1885 0.1893 0.2040 -0.0086 0.0077 -0.0004 110 VAL C CG1 4148 C CG2 . VAL C 110 ? 0.2208 0.2025 0.2134 0.0245 -0.0148 -0.0234 110 VAL C CG2 4149 N N . ALA C 111 ? 0.3235 0.3066 0.3353 -0.0139 0.0131 0.0157 111 ALA C N 4150 C CA . ALA C 111 ? 0.2526 0.2387 0.2775 -0.0217 0.0127 0.0204 111 ALA C CA 4151 C C . ALA C 111 ? 0.2584 0.2437 0.2905 -0.0272 0.0049 0.0248 111 ALA C C 4152 O O . ALA C 111 ? 0.2788 0.2651 0.3179 -0.0273 0.0024 0.0223 111 ALA C O 4153 C CB . ALA C 111 ? 0.2127 0.2011 0.2522 -0.0217 0.0149 0.0128 111 ALA C CB 4154 N N . ALA C 112 ? 0.3100 0.2857 0.3325 -0.0334 0.0021 0.0309 112 ALA C N 4155 C CA . ALA C 112 ? 0.3191 0.2739 0.3269 -0.0425 -0.0037 0.0357 112 ALA C CA 4156 C C . ALA C 112 ? 0.3108 0.2490 0.3221 -0.0380 -0.0204 0.0352 112 ALA C C 4157 O O . ALA C 112 ? 0.3263 0.2743 0.3586 -0.0289 -0.0291 0.0288 112 ALA C O 4158 C CB . ALA C 112 ? 0.3206 0.2597 0.3064 -0.0502 -0.0033 0.0420 112 ALA C CB 4159 N N . PRO C 113 ? 0.2650 0.1762 0.2560 -0.0454 -0.0245 0.0378 113 PRO C N 4160 C CA . PRO C 113 ? 0.3111 0.1945 0.2958 -0.0388 -0.0465 0.0368 113 PRO C CA 4161 C C . PRO C 113 ? 0.3490 0.1934 0.3052 -0.0356 -0.0681 0.0399 113 PRO C C 4162 O O . PRO C 113 ? 0.4846 0.3037 0.4044 -0.0474 -0.0619 0.0478 113 PRO C O 4163 C CB . PRO C 113 ? 0.3551 0.2093 0.3115 -0.0521 -0.0401 0.0392 113 PRO C CB 4164 C CG . PRO C 113 ? 0.3151 0.1707 0.2542 -0.0707 -0.0161 0.0398 113 PRO C CG 4165 C CD . PRO C 113 ? 0.2656 0.1705 0.2408 -0.0610 -0.0077 0.0364 113 PRO C CD 4166 N N . SER C 114 ? 0.2843 0.2659 0.4239 -0.0715 -0.0897 -0.0570 114 SER C N 4167 C CA . SER C 114 ? 0.2101 0.2170 0.3409 -0.0763 -0.0751 -0.0675 114 SER C CA 4168 C C . SER C 114 ? 0.2014 0.2322 0.3292 -0.0723 -0.0797 -0.0583 114 SER C C 4169 O O . SER C 114 ? 0.2010 0.2277 0.3169 -0.0695 -0.0870 -0.0477 114 SER C O 4170 C CB . SER C 114 ? 0.2171 0.2157 0.3177 -0.0840 -0.0664 -0.0723 114 SER C CB 4171 O OG . SER C 114 ? 0.3014 0.2703 0.4009 -0.0876 -0.0602 -0.0788 114 SER C OG 4172 N N . VAL C 115 ? 0.1903 0.2428 0.3283 -0.0719 -0.0734 -0.0636 115 VAL C N 4173 C CA . VAL C 115 ? 0.1949 0.2652 0.3344 -0.0682 -0.0760 -0.0550 115 VAL C CA 4174 C C . VAL C 115 ? 0.2023 0.2859 0.3202 -0.0712 -0.0715 -0.0559 115 VAL C C 4175 O O . VAL C 115 ? 0.1669 0.2551 0.2810 -0.0727 -0.0655 -0.0670 115 VAL C O 4176 C CB . VAL C 115 ? 0.2172 0.2987 0.3932 -0.0635 -0.0750 -0.0566 115 VAL C CB 4177 C CG1 . VAL C 115 ? 0.1540 0.2502 0.3327 -0.0607 -0.0758 -0.0479 115 VAL C CG1 4178 C CG2 . VAL C 115 ? 0.1720 0.2391 0.3752 -0.0587 -0.0832 -0.0521 115 VAL C CG2 4179 N N . PHE C 116 ? 0.2046 0.2939 0.3103 -0.0703 -0.0739 -0.0456 116 PHE C N 4180 C CA . PHE C 116 ? 0.1631 0.2577 0.2541 -0.0702 -0.0748 -0.0418 116 PHE C CA 4181 C C . PHE C 116 ? 0.2294 0.3362 0.3257 -0.0671 -0.0752 -0.0343 116 PHE C C 4182 O O . PHE C 116 ? 0.1378 0.2484 0.2383 -0.0651 -0.0727 -0.0338 116 PHE C O 4183 C CB . PHE C 116 ? 0.1705 0.2491 0.2397 -0.0708 -0.0747 -0.0360 116 PHE C CB 4184 C CG . PHE C 116 ? 0.1651 0.2309 0.2310 -0.0746 -0.0739 -0.0444 116 PHE C CG 4185 C CD1 . PHE C 116 ? 0.1686 0.2399 0.2355 -0.0726 -0.0703 -0.0565 116 PHE C CD1 4186 C CD2 . PHE C 116 ? 0.1709 0.2278 0.2325 -0.0796 -0.0698 -0.0468 116 PHE C CD2 4187 C CE1 . PHE C 116 ? 0.1786 0.2406 0.2435 -0.0764 -0.0649 -0.0658 116 PHE C CE1 4188 C CE2 . PHE C 116 ? 0.2202 0.2591 0.2786 -0.0840 -0.0691 -0.0535 116 PHE C CE2 4189 C CZ . PHE C 116 ? 0.1868 0.2286 0.2490 -0.0816 -0.0658 -0.0633 116 PHE C CZ 4190 N N . ILE C 117 ? 0.1424 0.2613 0.2438 -0.0624 -0.0750 -0.0401 117 ILE C N 4191 C CA . ILE C 117 ? 0.2625 0.3933 0.3721 -0.0595 -0.0751 -0.0350 117 ILE C CA 4192 C C . ILE C 117 ? 0.2426 0.3766 0.3340 -0.0545 -0.0756 -0.0345 117 ILE C C 4193 O O . ILE C 117 ? 0.2277 0.3664 0.3029 -0.0532 -0.0742 -0.0410 117 ILE C O 4194 C CB . ILE C 117 ? 0.2461 0.4030 0.3745 -0.0601 -0.0664 -0.0443 117 ILE C CB 4195 C CG1 . ILE C 117 ? 0.1310 0.2953 0.2688 -0.0581 -0.0625 -0.0347 117 ILE C CG1 4196 C CG2 . ILE C 117 ? 0.1445 0.3188 0.2545 -0.0598 -0.0603 -0.0581 117 ILE C CG2 4197 C CD1 . ILE C 117 ? 0.1419 0.3074 0.2918 -0.0541 -0.0461 -0.0342 117 ILE C CD1 4198 N N . PHE C 118 ? 0.1311 0.2642 0.2265 -0.0520 -0.0768 -0.0276 118 PHE C N 4199 C CA . PHE C 118 ? 0.1325 0.2709 0.2116 -0.0483 -0.0764 -0.0239 118 PHE C CA 4200 C C . PHE C 118 ? 0.2576 0.4185 0.3399 -0.0496 -0.0729 -0.0149 118 PHE C C 4201 O O . PHE C 118 ? 0.1646 0.3205 0.2645 -0.0534 -0.0716 -0.0082 118 PHE C O 4202 C CB . PHE C 118 ? 0.1412 0.2594 0.2192 -0.0455 -0.0777 -0.0240 118 PHE C CB 4203 C CG . PHE C 118 ? 0.2043 0.3045 0.2802 -0.0438 -0.0774 -0.0314 118 PHE C CG 4204 C CD1 . PHE C 118 ? 0.1356 0.2312 0.2012 -0.0449 -0.0802 -0.0313 118 PHE C CD1 4205 C CD2 . PHE C 118 ? 0.2343 0.3341 0.3126 -0.0458 -0.0703 -0.0368 118 PHE C CD2 4206 C CE1 . PHE C 118 ? 0.1394 0.2185 0.2025 -0.0466 -0.0795 -0.0334 118 PHE C CE1 4207 C CE2 . PHE C 118 ? 0.2201 0.3131 0.2917 -0.0477 -0.0663 -0.0421 118 PHE C CE2 4208 C CZ . PHE C 118 ? 0.2261 0.2999 0.2979 -0.0431 -0.0741 -0.0417 118 PHE C CZ 4209 N N . PRO C 119 ? 0.2711 0.4529 0.3352 -0.0443 -0.0701 -0.0138 119 PRO C N 4210 C CA . PRO C 119 ? 0.2824 0.4607 0.3380 -0.0364 -0.0584 -0.0012 119 PRO C CA 4211 C C . PRO C 119 ? 0.2763 0.4484 0.3307 -0.0355 -0.0608 0.0091 119 PRO C C 4212 O O . PRO C 119 ? 0.1402 0.3150 0.1935 -0.0387 -0.0714 0.0056 119 PRO C O 4213 C CB . PRO C 119 ? 0.2567 0.4475 0.2826 -0.0263 -0.0559 -0.0035 119 PRO C CB 4214 C CG . PRO C 119 ? 0.1669 0.3718 0.1887 -0.0293 -0.0704 -0.0161 119 PRO C CG 4215 C CD . PRO C 119 ? 0.2169 0.4083 0.2619 -0.0401 -0.0732 -0.0240 119 PRO C CD 4216 N N . PRO C 120 ? 0.2810 0.4430 0.3363 -0.0318 -0.0484 0.0211 120 PRO C N 4217 C CA . PRO C 120 ? 0.2110 0.3646 0.2646 -0.0307 -0.0475 0.0309 120 PRO C CA 4218 C C . PRO C 120 ? 0.2107 0.3748 0.2402 -0.0196 -0.0515 0.0343 120 PRO C C 4219 O O . PRO C 120 ? 0.1841 0.3605 0.1948 -0.0109 -0.0521 0.0319 120 PRO C O 4220 C CB . PRO C 120 ? 0.2450 0.3853 0.3034 -0.0281 -0.0292 0.0417 120 PRO C CB 4221 C CG . PRO C 120 ? 0.2738 0.4185 0.3226 -0.0221 -0.0193 0.0398 120 PRO C CG 4222 C CD . PRO C 120 ? 0.2785 0.4341 0.3373 -0.0287 -0.0316 0.0256 120 PRO C CD 4223 N N . SER C 121 ? 0.2087 0.3685 0.2398 -0.0198 -0.0547 0.0391 121 SER C N 4224 C CA . SER C 121 ? 0.2241 0.3954 0.2393 -0.0081 -0.0589 0.0431 121 SER C CA 4225 C C . SER C 121 ? 0.2094 0.3719 0.2082 0.0057 -0.0450 0.0597 121 SER C C 4226 O O . SER C 121 ? 0.2518 0.3953 0.2572 0.0026 -0.0305 0.0677 121 SER C O 4227 C CB . SER C 121 ? 0.2450 0.4122 0.2715 -0.0139 -0.0645 0.0417 121 SER C CB 4228 O OG . SER C 121 ? 0.2516 0.3969 0.2853 -0.0181 -0.0536 0.0512 121 SER C OG 4229 N N . ASP C 122 ? 0.2190 0.3949 0.1970 0.0212 -0.0493 0.0646 122 ASP C N 4230 C CA . ASP C 122 ? 0.3708 0.5354 0.3288 0.0372 -0.0365 0.0829 122 ASP C CA 4231 C C . ASP C 122 ? 0.3558 0.5017 0.3281 0.0350 -0.0265 0.0930 122 ASP C C 4232 O O . ASP C 122 ? 0.3588 0.4841 0.3236 0.0413 -0.0084 0.1074 122 ASP C O 4233 C CB . ASP C 122 ? 0.3921 0.5774 0.3260 0.0557 -0.0483 0.0859 122 ASP C CB 4234 C CG . ASP C 122 ? 0.4392 0.6382 0.3505 0.0593 -0.0547 0.0773 122 ASP C CG 4235 O OD1 . ASP C 122 ? 0.5196 0.7045 0.4245 0.0545 -0.0415 0.0773 122 ASP C OD1 4236 O OD2 . ASP C 122 ? 0.4875 0.7090 0.3903 0.0655 -0.0713 0.0683 122 ASP C OD2 4237 N N A GLU C 123 ? 0.3370 0.4873 0.3289 0.0253 -0.0361 0.0847 123 GLU C N 4238 N N B GLU C 123 ? 0.3357 0.4865 0.3274 0.0253 -0.0364 0.0844 123 GLU C N 4239 C CA A GLU C 123 ? 0.3178 0.4490 0.3214 0.0219 -0.0262 0.0921 123 GLU C CA 4240 C CA B GLU C 123 ? 0.3150 0.4475 0.3194 0.0211 -0.0276 0.0908 123 GLU C CA 4241 C C A GLU C 123 ? 0.3385 0.4449 0.3529 0.0088 -0.0116 0.0939 123 GLU C C 4242 C C B GLU C 123 ? 0.3372 0.4444 0.3517 0.0088 -0.0123 0.0935 123 GLU C C 4243 O O A GLU C 123 ? 0.3648 0.4509 0.3790 0.0118 0.0052 0.1055 123 GLU C O 4244 O O B GLU C 123 ? 0.3650 0.4522 0.3788 0.0123 0.0043 0.1053 123 GLU C O 4245 C CB A GLU C 123 ? 0.2848 0.4223 0.3046 0.0124 -0.0374 0.0812 123 GLU C CB 4246 C CB B GLU C 123 ? 0.2845 0.4242 0.3054 0.0100 -0.0399 0.0781 123 GLU C CB 4247 C CG A GLU C 123 ? 0.3037 0.4211 0.3319 0.0107 -0.0260 0.0885 123 GLU C CG 4248 C CG B GLU C 123 ? 0.3287 0.4935 0.3489 0.0215 -0.0524 0.0750 123 GLU C CG 4249 C CD A GLU C 123 ? 0.3675 0.4895 0.4090 0.0028 -0.0340 0.0780 123 GLU C CD 4250 C CD B GLU C 123 ? 0.3138 0.5042 0.3329 0.0189 -0.0688 0.0595 123 GLU C CD 4251 O OE1 A GLU C 123 ? 0.3622 0.4886 0.4096 -0.0109 -0.0445 0.0635 123 GLU C OE1 4252 O OE1 B GLU C 123 ? 0.2186 0.4128 0.2253 0.0198 -0.0696 0.0577 123 GLU C OE1 4253 O OE2 A GLU C 123 ? 0.3465 0.4655 0.3929 0.0109 -0.0278 0.0847 123 GLU C OE2 4254 O OE2 B GLU C 123 ? 0.2946 0.5004 0.3267 0.0154 -0.0789 0.0482 123 GLU C OE2 4255 N N . GLN C 124 ? 0.2450 0.3535 0.2711 -0.0052 -0.0177 0.0820 124 GLN C N 4256 C CA . GLN C 124 ? 0.2346 0.3247 0.2767 -0.0179 -0.0071 0.0816 124 GLN C CA 4257 C C . GLN C 124 ? 0.2873 0.3671 0.3227 -0.0096 0.0130 0.0927 124 GLN C C 4258 O O . GLN C 124 ? 0.2949 0.3550 0.3409 -0.0148 0.0292 0.0980 124 GLN C O 4259 C CB . GLN C 124 ? 0.2306 0.3269 0.2892 -0.0325 -0.0197 0.0673 124 GLN C CB 4260 C CG . GLN C 124 ? 0.1791 0.2606 0.2598 -0.0456 -0.0126 0.0652 124 GLN C CG 4261 C CD . GLN C 124 ? 0.1764 0.2659 0.2748 -0.0560 -0.0253 0.0534 124 GLN C CD 4262 O OE1 . GLN C 124 ? 0.2039 0.3080 0.2974 -0.0522 -0.0338 0.0480 124 GLN C OE1 4263 N NE2 . GLN C 124 ? 0.2045 0.2847 0.3247 -0.0688 -0.0269 0.0488 124 GLN C NE2 4264 N N . LEU C 125 ? 0.3423 0.4333 0.3586 0.0026 0.0132 0.0954 125 LEU C N 4265 C CA . LEU C 125 ? 0.4096 0.4878 0.4139 0.0108 0.0342 0.1057 125 LEU C CA 4266 C C . LEU C 125 ? 0.4607 0.5164 0.4548 0.0204 0.0545 0.1226 125 LEU C C 4267 O O . LEU C 125 ? 0.4777 0.5131 0.4764 0.0186 0.0773 0.1288 125 LEU C O 4268 C CB . LEU C 125 ? 0.3233 0.4152 0.2989 0.0242 0.0300 0.1062 125 LEU C CB 4269 C CG . LEU C 125 ? 0.3103 0.4194 0.2960 0.0148 0.0170 0.0898 125 LEU C CG 4270 C CD1 . LEU C 125 ? 0.2851 0.4042 0.2388 0.0272 0.0156 0.0895 125 LEU C CD1 4271 C CD2 . LEU C 125 ? 0.2526 0.3517 0.2680 0.0007 0.0283 0.0841 125 LEU C CD2 4272 N N . LYS C 126 ? 0.4781 0.5364 0.4614 0.0303 0.0477 0.1293 126 LYS C N 4273 C CA . LYS C 126 ? 0.5018 0.5374 0.4775 0.0401 0.0666 0.1457 126 LYS C CA 4274 C C . LYS C 126 ? 0.4340 0.4452 0.4353 0.0236 0.0852 0.1440 126 LYS C C 4275 O O . LYS C 126 ? 0.5080 0.4942 0.5040 0.0296 0.1092 0.1570 126 LYS C O 4276 C CB . LYS C 126 ? 0.4956 0.5403 0.4695 0.0483 0.0542 0.1486 126 LYS C CB 4277 C CG . LYS C 126 ? 0.5334 0.6045 0.4868 0.0655 0.0350 0.1498 126 LYS C CG 4278 C CD . LYS C 126 ? 0.6939 0.7745 0.6569 0.0710 0.0248 0.1507 126 LYS C CD 4279 C CE . LYS C 126 ? 0.8030 0.9150 0.7528 0.0874 0.0032 0.1494 126 LYS C CE 4280 N NZ . LYS C 126 ? 0.7905 0.9151 0.7590 0.0903 -0.0065 0.1468 126 LYS C NZ 4281 N N . SER C 127 ? 0.3119 0.3297 0.3402 0.0030 0.0737 0.1275 127 SER C N 4282 C CA . SER C 127 ? 0.3997 0.3984 0.4539 -0.0145 0.0861 0.1224 127 SER C CA 4283 C C . SER C 127 ? 0.4004 0.3939 0.4730 -0.0234 0.0998 0.1181 127 SER C C 4284 O O . SER C 127 ? 0.4959 0.4763 0.5942 -0.0386 0.1100 0.1121 127 SER C O 4285 C CB . SER C 127 ? 0.3610 0.3667 0.4324 -0.0317 0.0656 0.1073 127 SER C CB 4286 O OG . SER C 127 ? 0.3596 0.3852 0.4406 -0.0395 0.0462 0.0946 127 SER C OG 4287 N N . GLY C 128 ? 0.3200 0.3239 0.3814 -0.0149 0.1004 0.1197 128 GLY C N 4288 C CA . GLY C 128 ? 0.3076 0.3052 0.3874 -0.0215 0.1178 0.1165 128 GLY C CA 4289 C C . GLY C 128 ? 0.3421 0.3591 0.4525 -0.0362 0.1010 0.0994 128 GLY C C 4290 O O . GLY C 128 ? 0.4556 0.4702 0.5917 -0.0438 0.1143 0.0943 128 GLY C O 4291 N N . THR C 129 ? 0.3020 0.1854 0.3574 -0.0409 0.0755 0.0264 129 THR C N 4292 C CA . THR C 129 ? 0.2934 0.1768 0.3285 -0.0509 0.0541 0.0021 129 THR C CA 4293 C C . THR C 129 ? 0.2774 0.2118 0.3527 -0.0532 0.0459 0.0220 129 THR C C 4294 O O . THR C 129 ? 0.3221 0.2750 0.4291 -0.0384 0.0635 0.0581 129 THR C O 4295 C CB . THR C 129 ? 0.3968 0.2101 0.3657 -0.0359 0.0686 -0.0127 129 THR C CB 4296 O OG1 . THR C 129 ? 0.4936 0.2510 0.4135 -0.0453 0.0642 -0.0338 129 THR C OG1 4297 C CG2 . THR C 129 ? 0.3481 0.1677 0.3034 -0.0441 0.0474 -0.0299 129 THR C CG2 4298 N N . ALA C 130 ? 0.2691 0.2237 0.3453 -0.0719 0.0204 0.0033 130 ALA C N 4299 C CA . ALA C 130 ? 0.1773 0.1636 0.2743 -0.0776 0.0102 0.0164 130 ALA C CA 4300 C C . ALA C 130 ? 0.3025 0.2732 0.3744 -0.0722 0.0067 -0.0034 130 ALA C C 4301 O O . ALA C 130 ? 0.2712 0.2282 0.3228 -0.0801 -0.0045 -0.0294 130 ALA C O 4302 C CB . ALA C 130 ? 0.2987 0.3078 0.3973 -0.0950 -0.0078 0.0106 130 ALA C CB 4303 N N . SER C 131 ? 0.3153 0.2923 0.3956 -0.0589 0.0160 0.0147 131 SER C N 4304 C CA . SER C 131 ? 0.2202 0.1893 0.2818 -0.0555 0.0108 0.0002 131 SER C CA 4305 C C . SER C 131 ? 0.1597 0.1628 0.2465 -0.0705 -0.0048 0.0106 131 SER C C 4306 O O . SER C 131 ? 0.2265 0.2548 0.3453 -0.0732 -0.0051 0.0429 131 SER C O 4307 C CB . SER C 131 ? 0.2251 0.1642 0.2658 -0.0282 0.0359 0.0115 131 SER C CB 4308 O OG . SER C 131 ? 0.2757 0.1580 0.2649 -0.0186 0.0485 -0.0043 131 SER C OG 4309 N N . VAL C 132 ? 0.2310 0.2315 0.3034 -0.0820 -0.0181 -0.0121 132 VAL C N 4310 C CA . VAL C 132 ? 0.1432 0.1561 0.2177 -0.0856 -0.0245 -0.0079 132 VAL C CA 4311 C C . VAL C 132 ? 0.1790 0.1880 0.2490 -0.0832 -0.0257 -0.0135 132 VAL C C 4312 O O . VAL C 132 ? 0.2157 0.2113 0.2700 -0.0766 -0.0248 -0.0333 132 VAL C O 4313 C CB . VAL C 132 ? 0.2253 0.2289 0.2868 -0.0812 -0.0267 -0.0214 132 VAL C CB 4314 C CG1 . VAL C 132 ? 0.2326 0.2321 0.2789 -0.0896 -0.0314 -0.0123 132 VAL C CG1 4315 C CG2 . VAL C 132 ? 0.1981 0.2004 0.2612 -0.0823 -0.0257 -0.0213 132 VAL C CG2 4316 N N . VAL C 133 ? 0.1542 0.1761 0.2385 -0.0841 -0.0277 0.0068 133 VAL C N 4317 C CA . VAL C 133 ? 0.1426 0.1613 0.2219 -0.0685 -0.0211 0.0039 133 VAL C CA 4318 C C . VAL C 133 ? 0.1877 0.2100 0.2666 -0.0825 -0.0316 0.0054 133 VAL C C 4319 O O . VAL C 133 ? 0.2687 0.2941 0.3462 -0.0896 -0.0375 0.0199 133 VAL C O 4320 C CB . VAL C 133 ? 0.2574 0.2799 0.3518 -0.0451 -0.0026 0.0304 133 VAL C CB 4321 C CG1 . VAL C 133 ? 0.1606 0.1781 0.2477 -0.0295 0.0050 0.0315 133 VAL C CG1 4322 C CG2 . VAL C 133 ? 0.2005 0.1952 0.2721 -0.0284 0.0142 0.0231 133 VAL C CG2 4323 N N . CYS C 134 ? 0.2428 0.2560 0.3078 -0.0743 -0.0284 -0.0125 134 CYS C N 4324 C CA . CYS C 134 ? 0.2851 0.2932 0.3442 -0.0821 -0.0318 -0.0128 134 CYS C CA 4325 C C . CYS C 134 ? 0.2760 0.2918 0.3426 -0.0639 -0.0254 -0.0070 134 CYS C C 4326 O O . CYS C 134 ? 0.1823 0.1936 0.2401 -0.0470 -0.0193 -0.0177 134 CYS C O 4327 C CB . CYS C 134 ? 0.4028 0.3930 0.4452 -0.0778 -0.0268 -0.0311 134 CYS C CB 4328 S SG . CYS C 134 ? 0.5368 0.5046 0.5591 -0.0853 -0.0228 -0.0304 134 CYS C SG 4329 N N . LEU C 135 ? 0.1815 0.2042 0.2598 -0.0701 -0.0293 0.0121 135 LEU C N 4330 C CA . LEU C 135 ? 0.1435 0.1750 0.2325 -0.0515 -0.0208 0.0226 135 LEU C CA 4331 C C . LEU C 135 ? 0.2823 0.3033 0.3604 -0.0577 -0.0231 0.0140 135 LEU C C 4332 O O . LEU C 135 ? 0.3084 0.3155 0.3772 -0.0809 -0.0331 0.0190 135 LEU C O 4333 C CB . LEU C 135 ? 0.1415 0.1953 0.2661 -0.0500 -0.0199 0.0615 135 LEU C CB 4334 C CG . LEU C 135 ? 0.1707 0.2348 0.3128 -0.0329 -0.0097 0.0805 135 LEU C CG 4335 C CD1 . LEU C 135 ? 0.2255 0.2734 0.3440 -0.0002 0.0124 0.0677 135 LEU C CD1 4336 C CD2 . LEU C 135 ? 0.1425 0.2370 0.3366 -0.0352 -0.0101 0.1305 135 LEU C CD2 4337 N N . LEU C 136 ? 0.2323 0.2523 0.3044 -0.0390 -0.0145 0.0027 136 LEU C N 4338 C CA . LEU C 136 ? 0.2502 0.2642 0.3196 -0.0386 -0.0116 0.0006 136 LEU C CA 4339 C C . LEU C 136 ? 0.2350 0.2624 0.3184 -0.0216 -0.0059 0.0180 136 LEU C C 4340 O O . LEU C 136 ? 0.2284 0.2562 0.3040 -0.0009 0.0015 0.0160 136 LEU C O 4341 C CB . LEU C 136 ? 0.1479 0.1573 0.2106 -0.0302 -0.0063 -0.0164 136 LEU C CB 4342 C CG . LEU C 136 ? 0.1557 0.1504 0.2114 -0.0406 -0.0020 -0.0279 136 LEU C CG 4343 C CD1 . LEU C 136 ? 0.1527 0.1465 0.2040 -0.0505 -0.0087 -0.0330 136 LEU C CD1 4344 C CD2 . LEU C 136 ? 0.1631 0.1695 0.2343 -0.0280 0.0023 -0.0297 136 LEU C CD2 4345 N N . ASN C 137 ? 0.2218 0.2527 0.3192 -0.0319 -0.0098 0.0370 137 ASN C N 4346 C CA . ASN C 137 ? 0.1677 0.2165 0.2896 -0.0154 -0.0020 0.0628 137 ASN C CA 4347 C C . ASN C 137 ? 0.2003 0.2455 0.3206 -0.0086 0.0027 0.0618 137 ASN C C 4348 O O . ASN C 137 ? 0.1952 0.2236 0.3050 -0.0274 -0.0041 0.0560 137 ASN C O 4349 C CB . ASN C 137 ? 0.2093 0.2764 0.3664 -0.0322 -0.0123 0.0993 137 ASN C CB 4350 C CG . ASN C 137 ? 0.2400 0.3307 0.4331 -0.0052 0.0063 0.1334 137 ASN C CG 4351 O OD1 . ASN C 137 ? 0.2675 0.3478 0.4427 0.0240 0.0280 0.1252 137 ASN C OD1 4352 N ND2 . ASN C 137 ? 0.1983 0.3133 0.4372 -0.0148 -0.0005 0.1751 137 ASN C ND2 4353 N N . ASN C 138 ? 0.1821 0.2339 0.3042 0.0189 0.0171 0.0684 138 ASN C N 4354 C CA . ASN C 138 ? 0.2201 0.2741 0.3473 0.0300 0.0239 0.0751 138 ASN C CA 4355 C C . ASN C 138 ? 0.1974 0.2391 0.3111 0.0218 0.0206 0.0555 138 ASN C C 4356 O O . ASN C 138 ? 0.2614 0.2957 0.3813 0.0091 0.0186 0.0628 138 ASN C O 4357 C CB . ASN C 138 ? 0.2288 0.2997 0.3941 0.0228 0.0224 0.1104 138 ASN C CB 4358 C CG . ASN C 138 ? 0.2867 0.3760 0.4811 0.0394 0.0354 0.1431 138 ASN C CG 4359 O OD1 . ASN C 138 ? 0.3699 0.4472 0.5419 0.0599 0.0504 0.1346 138 ASN C OD1 4360 N ND2 . ASN C 138 ? 0.2965 0.4110 0.5408 0.0305 0.0312 0.1852 138 ASN C ND2 4361 N N . PHE C 139 ? 0.2339 0.2707 0.3305 0.0288 0.0210 0.0358 139 PHE C N 4362 C CA . PHE C 139 ? 0.2196 0.2489 0.3152 0.0255 0.0245 0.0258 139 PHE C CA 4363 C C . PHE C 139 ? 0.1595 0.2002 0.2565 0.0436 0.0257 0.0271 139 PHE C C 4364 O O . PHE C 139 ? 0.2587 0.3008 0.3395 0.0540 0.0197 0.0283 139 PHE C O 4365 C CB . PHE C 139 ? 0.2459 0.2640 0.3342 0.0121 0.0227 0.0116 139 PHE C CB 4366 C CG . PHE C 139 ? 0.1738 0.2029 0.2589 0.0161 0.0132 0.0042 139 PHE C CG 4367 C CD1 . PHE C 139 ? 0.1512 0.1786 0.2269 0.0112 0.0066 0.0021 139 PHE C CD1 4368 C CD2 . PHE C 139 ? 0.1539 0.1938 0.2467 0.0225 0.0091 0.0042 139 PHE C CD2 4369 C CE1 . PHE C 139 ? 0.1917 0.2178 0.2544 0.0130 -0.0016 -0.0056 139 PHE C CE1 4370 C CE2 . PHE C 139 ? 0.2089 0.2513 0.2918 0.0192 -0.0063 -0.0003 139 PHE C CE2 4371 C CZ . PHE C 139 ? 0.2319 0.2623 0.2940 0.0146 -0.0105 -0.0082 139 PHE C CZ 4372 N N . TYR C 140 ? 0.1996 0.2409 0.3100 0.0462 0.0344 0.0297 140 TYR C N 4373 C CA . TYR C 140 ? 0.1638 0.2219 0.2848 0.0593 0.0316 0.0385 140 TYR C CA 4374 C C . TYR C 140 ? 0.2450 0.3065 0.3930 0.0602 0.0453 0.0451 140 TYR C C 4375 O O . TYR C 140 ? 0.3316 0.3687 0.4771 0.0575 0.0658 0.0434 140 TYR C O 4376 C CB . TYR C 140 ? 0.1690 0.2302 0.2879 0.0733 0.0364 0.0497 140 TYR C CB 4377 C CG . TYR C 140 ? 0.2113 0.2869 0.3330 0.0835 0.0277 0.0612 140 TYR C CG 4378 C CD1 . TYR C 140 ? 0.1991 0.2899 0.3540 0.0889 0.0366 0.0750 140 TYR C CD1 4379 C CD2 . TYR C 140 ? 0.2902 0.3565 0.3749 0.0861 0.0105 0.0615 140 TYR C CD2 4380 C CE1 . TYR C 140 ? 0.2530 0.3634 0.4176 0.0942 0.0228 0.0931 140 TYR C CE1 4381 C CE2 . TYR C 140 ? 0.2275 0.2992 0.3036 0.0879 -0.0057 0.0749 140 TYR C CE2 4382 C CZ . TYR C 140 ? 0.2577 0.3583 0.3803 0.0906 -0.0027 0.0927 140 TYR C CZ 4383 O OH . TYR C 140 ? 0.2389 0.3508 0.3596 0.0886 -0.0244 0.1132 140 TYR C OH 4384 N N . PRO C 141 ? 0.1912 0.2768 0.3626 0.0630 0.0353 0.0576 141 PRO C N 4385 C CA . PRO C 141 ? 0.2331 0.3319 0.3917 0.0585 0.0050 0.0614 141 PRO C CA 4386 C C . PRO C 141 ? 0.1733 0.2631 0.3123 0.0444 -0.0103 0.0475 141 PRO C C 4387 O O . PRO C 141 ? 0.1621 0.2418 0.3026 0.0393 0.0023 0.0354 141 PRO C O 4388 C CB . PRO C 141 ? 0.2202 0.3508 0.4243 0.0602 -0.0018 0.0898 141 PRO C CB 4389 C CG . PRO C 141 ? 0.1647 0.2975 0.4086 0.0656 0.0295 0.0965 141 PRO C CG 4390 C CD . PRO C 141 ? 0.1677 0.2637 0.3808 0.0701 0.0555 0.0762 141 PRO C CD 4391 N N . ARG C 142 ? 0.2430 0.3285 0.3558 0.0359 -0.0387 0.0502 142 ARG C N 4392 C CA . ARG C 142 ? 0.3052 0.3707 0.3852 0.0229 -0.0539 0.0361 142 ARG C CA 4393 C C . ARG C 142 ? 0.2789 0.3625 0.3975 0.0117 -0.0544 0.0377 142 ARG C C 4394 O O . ARG C 142 ? 0.3761 0.4445 0.4762 0.0049 -0.0543 0.0218 142 ARG C O 4395 C CB . ARG C 142 ? 0.3730 0.4117 0.3992 0.0119 -0.0860 0.0405 142 ARG C CB 4396 C CG . ARG C 142 ? 0.4378 0.4369 0.4105 -0.0005 -0.0987 0.0244 142 ARG C CG 4397 C CD . ARG C 142 ? 0.5878 0.5323 0.4773 -0.0122 -0.1266 0.0262 142 ARG C CD 4398 N NE . ARG C 142 ? 0.7986 0.7647 0.7087 -0.0348 -0.1656 0.0516 142 ARG C NE 4399 C CZ . ARG C 142 ? 0.9811 0.9003 0.8190 -0.0554 -0.2025 0.0610 142 ARG C CZ 4400 N NH1 . ARG C 142 ? 1.1197 0.9542 0.8461 -0.0516 -0.1974 0.0425 142 ARG C NH1 4401 N NH2 . ARG C 142 ? 0.9583 0.9098 0.8343 -0.0797 -0.2397 0.0922 142 ARG C NH2 4402 N N . GLU C 143 ? 0.2016 0.3178 0.3769 0.0122 -0.0512 0.0611 143 GLU C N 4403 C CA . GLU C 143 ? 0.2814 0.4149 0.4985 0.0052 -0.0470 0.0705 143 GLU C CA 4404 C C . GLU C 143 ? 0.2692 0.3845 0.4857 0.0129 -0.0113 0.0538 143 GLU C C 4405 O O . GLU C 143 ? 0.2724 0.3737 0.4865 0.0248 0.0164 0.0510 143 GLU C O 4406 C CB . GLU C 143 ? 0.3378 0.5142 0.6267 0.0067 -0.0492 0.1122 143 GLU C CB 4407 C CG . GLU C 143 ? 0.5003 0.6972 0.8429 0.0040 -0.0380 0.1306 143 GLU C CG 4408 C CD . GLU C 143 ? 0.6739 0.8605 0.9901 -0.0181 -0.0679 0.1161 143 GLU C CD 4409 O OE1 . GLU C 143 ? 0.7187 0.8947 0.9958 -0.0378 -0.1101 0.1127 143 GLU C OE1 4410 O OE2 . GLU C 143 ? 0.6938 0.8741 1.0200 -0.0161 -0.0474 0.1081 143 GLU C OE2 4411 N N . ALA C 144 ? 0.2371 0.3458 0.4489 0.0027 -0.0146 0.0440 144 ALA C N 4412 C CA . ALA C 144 ? 0.1970 0.2790 0.3925 0.0037 0.0119 0.0273 144 ALA C CA 4413 C C . ALA C 144 ? 0.1640 0.2520 0.3734 -0.0063 0.0058 0.0282 144 ALA C C 4414 O O . ALA C 144 ? 0.2089 0.3083 0.4152 -0.0186 -0.0250 0.0282 144 ALA C O 4415 C CB . ALA C 144 ? 0.1490 0.2049 0.2946 -0.0004 0.0080 0.0033 144 ALA C CB 4416 N N . LYS C 145 ? 0.1564 0.2268 0.3719 -0.0018 0.0363 0.0293 145 LYS C N 4417 C CA . LYS C 145 ? 0.1813 0.2548 0.4103 -0.0090 0.0362 0.0311 145 LYS C CA 4418 C C . LYS C 145 ? 0.2178 0.2519 0.3929 -0.0182 0.0423 0.0031 145 LYS C C 4419 O O . LYS C 145 ? 0.1886 0.1822 0.3263 -0.0166 0.0651 -0.0064 145 LYS C O 4420 C CB . LYS C 145 ? 0.1708 0.2505 0.4492 0.0059 0.0721 0.0612 145 LYS C CB 4421 C CG . LYS C 145 ? 0.3014 0.4066 0.6244 0.0005 0.0669 0.0799 145 LYS C CG 4422 C CD . LYS C 145 ? 0.3536 0.4520 0.7178 0.0226 0.1162 0.1127 145 LYS C CD 4423 C CE . LYS C 145 ? 0.3950 0.5167 0.7993 0.0195 0.1038 0.1376 145 LYS C CE 4424 N NZ . LYS C 145 ? 0.3147 0.4821 0.7693 0.0124 0.0661 0.1742 145 LYS C NZ 4425 N N . VAL C 146 ? 0.2498 0.2911 0.4167 -0.0307 0.0193 -0.0074 146 VAL C N 4426 C CA . VAL C 146 ? 0.1591 0.1719 0.2874 -0.0405 0.0230 -0.0258 146 VAL C CA 4427 C C . VAL C 146 ? 0.2287 0.2453 0.3772 -0.0435 0.0297 -0.0198 146 VAL C C 4428 O O . VAL C 146 ? 0.1658 0.2115 0.3462 -0.0479 0.0096 -0.0107 146 VAL C O 4429 C CB . VAL C 146 ? 0.1978 0.2140 0.3026 -0.0490 -0.0028 -0.0391 146 VAL C CB 4430 C CG1 . VAL C 146 ? 0.1856 0.1813 0.2641 -0.0603 -0.0005 -0.0493 146 VAL C CG1 4431 C CG2 . VAL C 146 ? 0.1446 0.1595 0.2349 -0.0435 -0.0068 -0.0401 146 VAL C CG2 4432 N N . GLN C 147 ? 0.2575 0.2371 0.3805 -0.0434 0.0569 -0.0235 147 GLN C N 4433 C CA . GLN C 147 ? 0.2378 0.2148 0.3731 -0.0450 0.0674 -0.0184 147 GLN C CA 4434 C C . GLN C 147 ? 0.2254 0.1689 0.3079 -0.0605 0.0623 -0.0380 147 GLN C C 4435 O O . GLN C 147 ? 0.2478 0.1497 0.2773 -0.0686 0.0675 -0.0481 147 GLN C O 4436 C CB . GLN C 147 ? 0.2710 0.2265 0.4222 -0.0272 0.1125 0.0026 147 GLN C CB 4437 C CG . GLN C 147 ? 0.3585 0.3627 0.5861 -0.0123 0.1159 0.0355 147 GLN C CG 4438 C CD . GLN C 147 ? 0.4084 0.3981 0.6690 0.0110 0.1684 0.0675 147 GLN C CD 4439 O OE1 . GLN C 147 ? 0.5110 0.4359 0.7191 0.0239 0.2125 0.0630 147 GLN C OE1 4440 N NE2 . GLN C 147 ? 0.3167 0.3550 0.6514 0.0170 0.1603 0.1016 147 GLN C NE2 4441 N N . TRP C 148 ? 0.2188 0.1808 0.3172 -0.0675 0.0485 -0.0396 148 TRP C N 4442 C CA . TRP C 148 ? 0.2041 0.1428 0.2645 -0.0818 0.0430 -0.0520 148 TRP C CA 4443 C C . TRP C 148 ? 0.3028 0.2112 0.3521 -0.0791 0.0718 -0.0465 148 TRP C C 4444 O O . TRP C 148 ? 0.2876 0.2198 0.3851 -0.0687 0.0828 -0.0312 148 TRP C O 4445 C CB . TRP C 148 ? 0.1946 0.1676 0.2667 -0.0805 0.0122 -0.0502 148 TRP C CB 4446 C CG . TRP C 148 ? 0.2989 0.2818 0.3578 -0.0751 -0.0080 -0.0485 148 TRP C CG 4447 C CD1 . TRP C 148 ? 0.2848 0.2835 0.3564 -0.0720 -0.0194 -0.0472 148 TRP C CD1 4448 C CD2 . TRP C 148 ? 0.2837 0.2586 0.3208 -0.0733 -0.0159 -0.0449 148 TRP C CD2 4449 N NE1 . TRP C 148 ? 0.2580 0.2521 0.3103 -0.0678 -0.0266 -0.0468 148 TRP C NE1 4450 C CE2 . TRP C 148 ? 0.3162 0.3011 0.3570 -0.0688 -0.0246 -0.0433 148 TRP C CE2 4451 C CE3 . TRP C 148 ? 0.2608 0.2230 0.2817 -0.0778 -0.0157 -0.0423 148 TRP C CE3 4452 C CZ2 . TRP C 148 ? 0.3379 0.3249 0.3784 -0.0691 -0.0287 -0.0386 148 TRP C CZ2 4453 C CZ3 . TRP C 148 ? 0.2896 0.2597 0.3143 -0.0785 -0.0237 -0.0363 148 TRP C CZ3 4454 C CH2 . TRP C 148 ? 0.2189 0.2036 0.2593 -0.0741 -0.0279 -0.0342 148 TRP C CH2 4455 N N . LYS C 149 ? 0.3227 0.1799 0.3057 -0.0873 0.0808 -0.0535 149 LYS C N 4456 C CA . LYS C 149 ? 0.4343 0.2501 0.3875 -0.0860 0.1083 -0.0507 149 LYS C CA 4457 C C . LYS C 149 ? 0.4393 0.2588 0.3558 -0.0982 0.0809 -0.0545 149 LYS C C 4458 O O . LYS C 149 ? 0.4876 0.3073 0.3734 -0.1060 0.0574 -0.0532 149 LYS C O 4459 C CB . LYS C 149 ? 0.4578 0.2039 0.3506 -0.0761 0.1490 -0.0471 149 LYS C CB 4460 C CG . LYS C 149 ? 0.4706 0.2159 0.4160 -0.0499 0.1924 -0.0271 149 LYS C CG 4461 C CD . LYS C 149 ? 0.6600 0.3450 0.5431 -0.0380 0.2260 -0.0257 149 LYS C CD 4462 C CE . LYS C 149 ? 0.6940 0.3954 0.6453 -0.0054 0.2664 0.0018 149 LYS C CE 4463 N NZ . LYS C 149 ? 0.7581 0.4152 0.6554 0.0023 0.2880 0.0019 149 LYS C NZ 4464 N N . VAL C 150 ? 0.3627 0.1898 0.2962 -0.0986 0.0852 -0.0530 150 VAL C N 4465 C CA . VAL C 150 ? 0.3896 0.2193 0.2968 -0.1077 0.0648 -0.0524 150 VAL C CA 4466 C C . VAL C 150 ? 0.4255 0.1939 0.2772 -0.1102 0.0979 -0.0524 150 VAL C C 4467 O O . VAL C 150 ? 0.4862 0.2472 0.3666 -0.0998 0.1278 -0.0486 150 VAL C O 4468 C CB . VAL C 150 ? 0.2713 0.1547 0.2357 -0.1036 0.0430 -0.0497 150 VAL C CB 4469 C CG1 . VAL C 150 ? 0.2768 0.1606 0.2225 -0.1094 0.0291 -0.0459 150 VAL C CG1 4470 C CG2 . VAL C 150 ? 0.2241 0.1480 0.2238 -0.0953 0.0187 -0.0473 150 VAL C CG2 4471 N N . ASP C 151 ? 0.2371 0.5151 0.2038 -0.1664 0.0342 -0.0175 151 ASP C N 4472 C CA . ASP C 151 ? 0.2952 0.5774 0.2408 -0.1814 0.0415 -0.0275 151 ASP C CA 4473 C C . ASP C 151 ? 0.2733 0.5125 0.2129 -0.1808 0.0604 -0.0466 151 ASP C C 4474 O O . ASP C 151 ? 0.2753 0.5118 0.2196 -0.1721 0.0704 -0.0472 151 ASP C O 4475 C CB . ASP C 151 ? 0.2476 0.5616 0.2133 -0.1658 0.0376 -0.0092 151 ASP C CB 4476 C CG . ASP C 151 ? 0.2805 0.6377 0.2428 -0.1708 0.0222 0.0088 151 ASP C CG 4477 O OD1 . ASP C 151 ? 0.2917 0.6614 0.2268 -0.1950 0.0146 0.0038 151 ASP C OD1 4478 O OD2 . ASP C 151 ? 0.2333 0.6106 0.2189 -0.1512 0.0185 0.0285 151 ASP C OD2 4479 N N . ASN C 152 ? 0.3142 0.5186 0.2443 -0.1872 0.0664 -0.0601 152 ASN C N 4480 C CA . ASN C 152 ? 0.3491 0.5026 0.2701 -0.1815 0.0848 -0.0770 152 ASN C CA 4481 C C . ASN C 152 ? 0.3396 0.4818 0.3013 -0.1490 0.0873 -0.0687 152 ASN C C 4482 O O . ASN C 152 ? 0.3710 0.4740 0.3296 -0.1370 0.0998 -0.0776 152 ASN C O 4483 C CB . ASN C 152 ? 0.4089 0.5393 0.2854 -0.1979 0.1000 -0.0938 152 ASN C CB 4484 C CG . ASN C 152 ? 0.6696 0.7701 0.4999 -0.2273 0.1021 -0.1115 152 ASN C CG 4485 O OD1 . ASN C 152 ? 0.7914 0.9136 0.6031 -0.2525 0.0930 -0.1108 152 ASN C OD1 4486 N ND2 . ASN C 152 ? 0.7217 0.7717 0.5452 -0.2218 0.1101 -0.1232 152 ASN C ND2 4487 N N . ALA C 153 ? 0.2264 0.4025 0.2258 -0.1352 0.0762 -0.0506 153 ALA C N 4488 C CA . ALA C 153 ? 0.2147 0.3775 0.2497 -0.1095 0.0760 -0.0436 153 ALA C CA 4489 C C . ALA C 153 ? 0.2512 0.3936 0.2945 -0.1050 0.0684 -0.0454 153 ALA C C 4490 O O . ALA C 153 ? 0.1783 0.3404 0.2222 -0.1122 0.0593 -0.0396 153 ALA C O 4491 C CB . ALA C 153 ? 0.1694 0.3691 0.2363 -0.0965 0.0696 -0.0241 153 ALA C CB 4492 N N . LEU C 154 ? 0.2380 0.3432 0.2869 -0.0929 0.0731 -0.0517 154 LEU C N 4493 C CA . LEU C 154 ? 0.2285 0.3139 0.2849 -0.0877 0.0662 -0.0527 154 LEU C CA 4494 C C . LEU C 154 ? 0.2484 0.3539 0.3359 -0.0756 0.0545 -0.0389 154 LEU C C 4495 O O . LEU C 154 ? 0.2900 0.4025 0.4009 -0.0634 0.0543 -0.0307 154 LEU C O 4496 C CB . LEU C 154 ? 0.2268 0.2739 0.2854 -0.0762 0.0746 -0.0584 154 LEU C CB 4497 C CG . LEU C 154 ? 0.2167 0.2442 0.2851 -0.0690 0.0675 -0.0575 154 LEU C CG 4498 C CD1 . LEU C 154 ? 0.2388 0.2575 0.2831 -0.0840 0.0647 -0.0654 154 LEU C CD1 4499 C CD2 . LEU C 154 ? 0.2074 0.2054 0.2813 -0.0563 0.0773 -0.0582 154 LEU C CD2 4500 N N . GLN C 155 ? 0.1434 0.2562 0.2296 -0.0795 0.0464 -0.0359 155 GLN C N 4501 C CA . GLN C 155 ? 0.1203 0.2433 0.2296 -0.0679 0.0386 -0.0244 155 GLN C CA 4502 C C . GLN C 155 ? 0.2093 0.3026 0.3274 -0.0581 0.0342 -0.0275 155 GLN C C 4503 O O . GLN C 155 ? 0.1968 0.2678 0.3017 -0.0613 0.0347 -0.0359 155 GLN C O 4504 C CB . GLN C 155 ? 0.1148 0.2588 0.2190 -0.0734 0.0344 -0.0174 155 GLN C CB 4505 C CG . GLN C 155 ? 0.1757 0.3493 0.2677 -0.0814 0.0349 -0.0097 155 GLN C CG 4506 C CD . GLN C 155 ? 0.2180 0.4067 0.3238 -0.0712 0.0365 0.0014 155 GLN C CD 4507 O OE1 . GLN C 155 ? 0.1981 0.3894 0.3218 -0.0578 0.0355 0.0126 155 GLN C OE1 4508 N NE2 . GLN C 155 ? 0.2212 0.4173 0.3167 -0.0786 0.0409 -0.0030 155 GLN C NE2 4509 N N . SER C 156 ? 0.2154 0.3087 0.3547 -0.0475 0.0299 -0.0199 156 SER C N 4510 C CA . SER C 156 ? 0.1366 0.2068 0.2835 -0.0411 0.0233 -0.0210 156 SER C CA 4511 C C . SER C 156 ? 0.1620 0.2327 0.3200 -0.0358 0.0174 -0.0137 156 SER C C 4512 O O . SER C 156 ? 0.1653 0.2480 0.3381 -0.0325 0.0189 -0.0061 156 SER C O 4513 C CB . SER C 156 ? 0.1090 0.1707 0.2687 -0.0360 0.0254 -0.0204 156 SER C CB 4514 O OG . SER C 156 ? 0.1099 0.1560 0.2779 -0.0320 0.0172 -0.0186 156 SER C OG 4515 N N . GLY C 157 ? 0.1981 0.2526 0.3470 -0.0354 0.0121 -0.0163 157 GLY C N 4516 C CA . GLY C 157 ? 0.1061 0.1504 0.2580 -0.0313 0.0084 -0.0122 157 GLY C CA 4517 C C . GLY C 157 ? 0.2110 0.2647 0.3564 -0.0280 0.0146 -0.0063 157 GLY C C 4518 O O . GLY C 157 ? 0.2216 0.2610 0.3654 -0.0232 0.0155 -0.0032 157 GLY C O 4519 N N . ASN C 158 ? 0.1008 0.1784 0.2413 -0.0311 0.0197 -0.0035 158 ASN C N 4520 C CA . ASN C 158 ? 0.1002 0.1961 0.2392 -0.0269 0.0263 0.0075 158 ASN C CA 4521 C C . ASN C 158 ? 0.2482 0.3512 0.3719 -0.0315 0.0264 0.0067 158 ASN C C 4522 O O . ASN C 158 ? 0.1638 0.2959 0.2878 -0.0319 0.0316 0.0183 158 ASN C O 4523 C CB . ASN C 158 ? 0.0906 0.2209 0.2422 -0.0271 0.0321 0.0187 158 ASN C CB 4524 C CG . ASN C 158 ? 0.0873 0.2343 0.2337 -0.0389 0.0307 0.0124 158 ASN C CG 4525 O OD1 . ASN C 158 ? 0.1749 0.3052 0.3088 -0.0459 0.0271 0.0002 158 ASN C OD1 4526 N ND2 . ASN C 158 ? 0.0851 0.2568 0.2351 -0.0400 0.0343 0.0197 158 ASN C ND2 4527 N N . SER C 159 ? 0.1098 0.1893 0.2220 -0.0354 0.0207 -0.0047 159 SER C N 4528 C CA . SER C 159 ? 0.2045 0.2873 0.3024 -0.0405 0.0204 -0.0056 159 SER C CA 4529 C C . SER C 159 ? 0.2211 0.2737 0.3087 -0.0353 0.0168 -0.0111 159 SER C C 4530 O O . SER C 159 ? 0.2166 0.2452 0.3056 -0.0327 0.0117 -0.0174 159 SER C O 4531 C CB . SER C 159 ? 0.1334 0.2220 0.2232 -0.0544 0.0190 -0.0135 159 SER C CB 4532 O OG . SER C 159 ? 0.1935 0.2544 0.2819 -0.0545 0.0157 -0.0245 159 SER C OG 4533 N N . GLN C 160 ? 0.2035 0.2607 0.2807 -0.0347 0.0193 -0.0067 160 GLN C N 4534 C CA . GLN C 160 ? 0.2266 0.2574 0.2903 -0.0306 0.0166 -0.0115 160 GLN C CA 4535 C C . GLN C 160 ? 0.2338 0.2737 0.2878 -0.0380 0.0164 -0.0110 160 GLN C C 4536 O O . GLN C 160 ? 0.1754 0.2447 0.2315 -0.0433 0.0204 -0.0021 160 GLN C O 4537 C CB . GLN C 160 ? 0.2108 0.2309 0.2688 -0.0179 0.0235 -0.0047 160 GLN C CB 4538 C CG . GLN C 160 ? 0.2730 0.2701 0.3336 -0.0130 0.0230 -0.0083 160 GLN C CG 4539 C CD . GLN C 160 ? 0.3751 0.3487 0.4213 -0.0018 0.0322 -0.0050 160 GLN C CD 4540 O OE1 . GLN C 160 ? 0.4288 0.4160 0.4773 0.0081 0.0451 0.0078 160 GLN C OE1 4541 N NE2 . GLN C 160 ? 0.3316 0.2697 0.3612 -0.0037 0.0267 -0.0154 160 GLN C NE2 4542 N N . GLU C 161 ? 0.2057 0.2229 0.2496 -0.0395 0.0113 -0.0186 161 GLU C N 4543 C CA . GLU C 161 ? 0.2547 0.2763 0.2891 -0.0470 0.0115 -0.0180 161 GLU C CA 4544 C C . GLU C 161 ? 0.2565 0.2671 0.2789 -0.0389 0.0128 -0.0142 161 GLU C C 4545 O O . GLU C 161 ? 0.2906 0.2815 0.3075 -0.0295 0.0120 -0.0164 161 GLU C O 4546 C CB . GLU C 161 ? 0.2655 0.2692 0.2973 -0.0546 0.0075 -0.0277 161 GLU C CB 4547 C CG . GLU C 161 ? 0.3875 0.3973 0.4254 -0.0634 0.0093 -0.0325 161 GLU C CG 4548 C CD . GLU C 161 ? 0.4809 0.4684 0.5133 -0.0686 0.0100 -0.0401 161 GLU C CD 4549 O OE1 . GLU C 161 ? 0.4604 0.4326 0.4871 -0.0652 0.0078 -0.0397 161 GLU C OE1 4550 O OE2 . GLU C 161 ? 0.5074 0.4918 0.5403 -0.0749 0.0144 -0.0455 161 GLU C OE2 4551 N N . SER C 162 ? 0.2863 0.3088 0.3027 -0.0444 0.0149 -0.0089 162 SER C N 4552 C CA . SER C 162 ? 0.1839 0.1972 0.1879 -0.0372 0.0170 -0.0046 162 SER C CA 4553 C C . SER C 162 ? 0.2232 0.2417 0.2224 -0.0488 0.0156 -0.0035 162 SER C C 4554 O O . SER C 162 ? 0.2360 0.2761 0.2399 -0.0624 0.0164 -0.0003 162 SER C O 4555 C CB . SER C 162 ? 0.1864 0.2171 0.1906 -0.0259 0.0268 0.0091 162 SER C CB 4556 O OG . SER C 162 ? 0.3178 0.3390 0.3080 -0.0176 0.0312 0.0138 162 SER C OG 4557 N N . VAL C 163 ? 0.1990 0.1969 0.1874 -0.0453 0.0133 -0.0060 163 VAL C N 4558 C CA . VAL C 163 ? 0.2058 0.2016 0.1898 -0.0557 0.0125 -0.0055 163 VAL C CA 4559 C C . VAL C 163 ? 0.2834 0.2812 0.2571 -0.0486 0.0157 0.0037 163 VAL C C 4560 O O . VAL C 163 ? 0.2304 0.2125 0.1941 -0.0358 0.0157 0.0027 163 VAL C O 4561 C CB . VAL C 163 ? 0.2708 0.2390 0.2538 -0.0573 0.0076 -0.0152 163 VAL C CB 4562 C CG1 . VAL C 163 ? 0.2232 0.1848 0.2020 -0.0690 0.0099 -0.0147 163 VAL C CG1 4563 C CG2 . VAL C 163 ? 0.2679 0.2319 0.2610 -0.0592 0.0058 -0.0231 163 VAL C CG2 4564 N N . THR C 164 ? 0.2276 0.2291 0.1754 0.0064 0.0245 0.0015 164 THR C N 4565 C CA . THR C 164 ? 0.2429 0.2278 0.1669 0.0117 0.0359 0.0030 164 THR C CA 4566 C C . THR C 164 ? 0.2783 0.2522 0.1900 -0.0007 0.0260 0.0063 164 THR C C 4567 O O . THR C 164 ? 0.2655 0.2543 0.1986 -0.0106 0.0121 0.0097 164 THR C O 4568 C CB . THR C 164 ? 0.2409 0.2572 0.1939 0.0216 0.0485 0.0065 164 THR C CB 4569 O OG1 . THR C 164 ? 0.2755 0.3206 0.2639 0.0137 0.0395 0.0069 164 THR C OG1 4570 C CG2 . THR C 164 ? 0.2164 0.2451 0.1793 0.0350 0.0596 0.0082 164 THR C CG2 4571 N N . GLU C 165 ? 0.3456 0.2930 0.2220 0.0014 0.0348 0.0072 165 GLU C N 4572 C CA . GLU C 165 ? 0.3220 0.2632 0.1887 -0.0092 0.0273 0.0121 165 GLU C CA 4573 C C . GLU C 165 ? 0.3260 0.3036 0.2342 -0.0052 0.0322 0.0157 165 GLU C C 4574 O O . GLU C 165 ? 0.3006 0.3025 0.2350 0.0047 0.0429 0.0148 165 GLU C O 4575 C CB . GLU C 165 ? 0.3640 0.2606 0.1732 -0.0085 0.0373 0.0115 165 GLU C CB 4576 C CG . GLU C 165 ? 0.5051 0.3537 0.2605 -0.0213 0.0265 0.0086 165 GLU C CG 4577 C CD . GLU C 165 ? 0.5715 0.4281 0.3355 -0.0438 -0.0014 0.0159 165 GLU C CD 4578 O OE1 . GLU C 165 ? 0.6219 0.5079 0.4183 -0.0478 -0.0088 0.0236 165 GLU C OE1 4579 O OE2 . GLU C 165 ? 0.5219 0.3562 0.2616 -0.0576 -0.0157 0.0163 165 GLU C OE2 4580 N N . GLN C 166 ? 0.3717 0.3524 0.2852 -0.0145 0.0231 0.0215 166 GLN C N 4581 C CA . GLN C 166 ? 0.3888 0.3962 0.3362 -0.0129 0.0269 0.0249 166 GLN C CA 4582 C C . GLN C 166 ? 0.3240 0.3378 0.2693 -0.0039 0.0450 0.0260 166 GLN C C 4583 O O . GLN C 166 ? 0.3339 0.3256 0.2452 -0.0003 0.0548 0.0278 166 GLN C O 4584 C CB . GLN C 166 ? 0.4078 0.4113 0.3550 -0.0226 0.0164 0.0332 166 GLN C CB 4585 C CG . GLN C 166 ? 0.3967 0.4223 0.3827 -0.0227 0.0142 0.0361 166 GLN C CG 4586 C CD . GLN C 166 ? 0.3912 0.4130 0.3797 -0.0292 0.0055 0.0472 166 GLN C CD 4587 O OE1 . GLN C 166 ? 0.4340 0.4398 0.3953 -0.0360 -0.0011 0.0535 166 GLN C OE1 4588 N NE2 . GLN C 166 ? 0.3278 0.3607 0.3455 -0.0272 0.0060 0.0506 166 GLN C NE2 4589 N N . ASP C 167 ? 0.2765 0.3200 0.2562 -0.0010 0.0497 0.0266 167 ASP C N 4590 C CA . ASP C 167 ? 0.2498 0.3107 0.2377 0.0060 0.0653 0.0329 167 ASP C CA 4591 C C . ASP C 167 ? 0.2364 0.2938 0.2161 0.0023 0.0707 0.0405 167 ASP C C 4592 O O . ASP C 167 ? 0.2964 0.3547 0.2858 -0.0080 0.0614 0.0420 167 ASP C O 4593 C CB . ASP C 167 ? 0.2459 0.3406 0.2715 0.0030 0.0635 0.0346 167 ASP C CB 4594 C CG . ASP C 167 ? 0.3377 0.4601 0.3797 0.0066 0.0764 0.0469 167 ASP C CG 4595 O OD1 . ASP C 167 ? 0.3576 0.4892 0.4087 -0.0020 0.0766 0.0538 167 ASP C OD1 4596 O OD2 . ASP C 167 ? 0.4247 0.5614 0.4725 0.0184 0.0867 0.0522 167 ASP C OD2 4597 N N . SER C 168 ? 0.2953 0.3476 0.2566 0.0122 0.0882 0.0467 168 SER C N 4598 C CA . SER C 168 ? 0.3368 0.3823 0.2844 0.0092 0.0951 0.0545 168 SER C CA 4599 C C . SER C 168 ? 0.2841 0.3642 0.2691 0.0013 0.0955 0.0644 168 SER C C 4600 O O . SER C 168 ? 0.3237 0.4001 0.3018 -0.0040 0.0988 0.0716 168 SER C O 4601 C CB . SER C 168 ? 0.3244 0.3490 0.2356 0.0240 0.1179 0.0591 168 SER C CB 4602 O OG . SER C 168 ? 0.3323 0.3883 0.2694 0.0382 0.1361 0.0690 168 SER C OG 4603 N N . LYS C 169 ? 0.2571 0.3678 0.2778 -0.0022 0.0909 0.0655 169 LYS C N 4604 C CA . LYS C 169 ? 0.2844 0.4238 0.3348 -0.0144 0.0891 0.0759 169 LYS C CA 4605 C C . LYS C 169 ? 0.2421 0.3732 0.3020 -0.0307 0.0715 0.0686 169 LYS C C 4606 O O . LYS C 169 ? 0.3098 0.4381 0.3727 -0.0423 0.0687 0.0740 169 LYS C O 4607 C CB . LYS C 169 ? 0.2244 0.4051 0.3050 -0.0111 0.0966 0.0880 169 LYS C CB 4608 N N . ASP C 170 ? 0.2217 0.3448 0.2832 -0.0302 0.0620 0.0571 170 ASP C N 4609 C CA . ASP C 170 ? 0.2317 0.3422 0.2989 -0.0416 0.0502 0.0505 170 ASP C CA 4610 C C . ASP C 170 ? 0.2596 0.3450 0.3149 -0.0359 0.0436 0.0418 170 ASP C C 4611 O O . ASP C 170 ? 0.2368 0.3094 0.2963 -0.0401 0.0380 0.0374 170 ASP C O 4612 C CB . ASP C 170 ? 0.1884 0.3151 0.2712 -0.0496 0.0452 0.0481 170 ASP C CB 4613 C CG . ASP C 170 ? 0.2887 0.4238 0.3734 -0.0384 0.0455 0.0421 170 ASP C CG 4614 O OD1 . ASP C 170 ? 0.2710 0.3911 0.3422 -0.0267 0.0469 0.0364 170 ASP C OD1 4615 O OD2 . ASP C 170 ? 0.2911 0.4471 0.3891 -0.0436 0.0429 0.0444 170 ASP C OD2 4616 N N . SER C 171 ? 0.2350 0.3122 0.2738 -0.0267 0.0452 0.0410 171 SER C N 4617 C CA . SER C 171 ? 0.2394 0.2984 0.2682 -0.0244 0.0364 0.0381 171 SER C CA 4618 C C . SER C 171 ? 0.2411 0.3025 0.2814 -0.0219 0.0307 0.0309 171 SER C C 4619 O O . SER C 171 ? 0.2205 0.2736 0.2631 -0.0213 0.0235 0.0326 171 SER C O 4620 C CB . SER C 171 ? 0.2192 0.2658 0.2483 -0.0296 0.0314 0.0450 171 SER C CB 4621 O OG . SER C 171 ? 0.2704 0.3142 0.2872 -0.0328 0.0367 0.0522 171 SER C OG 4622 N N . THR C 172 ? 0.1690 0.2444 0.2182 -0.0202 0.0342 0.0258 172 THR C N 4623 C CA . THR C 172 ? 0.1832 0.2601 0.2403 -0.0179 0.0300 0.0191 172 THR C CA 4624 C C . THR C 172 ? 0.2156 0.2906 0.2619 -0.0113 0.0286 0.0165 172 THR C C 4625 O O . THR C 172 ? 0.2720 0.3406 0.3002 -0.0076 0.0329 0.0183 172 THR C O 4626 C CB . THR C 172 ? 0.2080 0.2983 0.2768 -0.0225 0.0318 0.0156 172 THR C CB 4627 O OG1 . THR C 172 ? 0.1773 0.2871 0.2486 -0.0201 0.0367 0.0194 172 THR C OG1 4628 C CG2 . THR C 172 ? 0.1586 0.2420 0.2303 -0.0332 0.0318 0.0172 172 THR C CG2 4629 N N . TYR C 173 ? 0.2166 0.2926 0.2700 -0.0099 0.0242 0.0123 173 TYR C N 4630 C CA . TYR C 173 ? 0.2120 0.2851 0.2556 -0.0057 0.0223 0.0096 173 TYR C CA 4631 C C . TYR C 173 ? 0.1745 0.2617 0.2286 -0.0029 0.0255 0.0050 173 TYR C C 4632 O O . TYR C 173 ? 0.1454 0.2413 0.2124 -0.0069 0.0260 0.0031 173 TYR C O 4633 C CB . TYR C 173 ? 0.1741 0.2407 0.2188 -0.0080 0.0129 0.0124 173 TYR C CB 4634 C CG . TYR C 173 ? 0.2506 0.3066 0.2857 -0.0134 0.0058 0.0209 173 TYR C CG 4635 C CD1 . TYR C 173 ? 0.2971 0.3570 0.3481 -0.0144 0.0046 0.0279 173 TYR C CD1 4636 C CD2 . TYR C 173 ? 0.3125 0.3506 0.3181 -0.0181 0.0002 0.0229 173 TYR C CD2 4637 C CE1 . TYR C 173 ? 0.3280 0.3816 0.3723 -0.0198 -0.0035 0.0389 173 TYR C CE1 4638 C CE2 . TYR C 173 ? 0.3084 0.3359 0.3007 -0.0266 -0.0093 0.0323 173 TYR C CE2 4639 C CZ . TYR C 173 ? 0.3324 0.3717 0.3475 -0.0273 -0.0119 0.0413 173 TYR C CZ 4640 O OH . TYR C 173 ? 0.4330 0.4654 0.4373 -0.0361 -0.0227 0.0537 173 TYR C OH 4641 N N . SER C 174 ? 0.1946 0.2797 0.2387 0.0028 0.0274 0.0037 174 SER C N 4642 C CA . SER C 174 ? 0.1244 0.2221 0.1780 0.0055 0.0280 0.0011 174 SER C CA 4643 C C . SER C 174 ? 0.1495 0.2338 0.1909 0.0079 0.0240 -0.0010 174 SER C C 4644 O O . SER C 174 ? 0.2193 0.2830 0.2394 0.0075 0.0220 0.0000 174 SER C O 4645 C CB . SER C 174 ? 0.1254 0.2395 0.1836 0.0114 0.0362 0.0061 174 SER C CB 4646 O OG . SER C 174 ? 0.2042 0.3356 0.2769 0.0046 0.0371 0.0105 174 SER C OG 4647 N N . LEU C 175 ? 0.1357 0.2291 0.1869 0.0080 0.0219 -0.0035 175 LEU C N 4648 C CA . LEU C 175 ? 0.1569 0.2408 0.2009 0.0078 0.0170 -0.0041 175 LEU C CA 4649 C C . LEU C 175 ? 0.2100 0.3035 0.2576 0.0126 0.0197 -0.0053 175 LEU C C 4650 O O . LEU C 175 ? 0.1054 0.2163 0.1665 0.0113 0.0210 -0.0059 175 LEU C O 4651 C CB . LEU C 175 ? 0.1136 0.2011 0.1708 0.0023 0.0115 -0.0025 175 LEU C CB 4652 C CG . LEU C 175 ? 0.2884 0.3731 0.3450 -0.0005 0.0053 0.0009 175 LEU C CG 4653 C CD1 . LEU C 175 ? 0.1732 0.2633 0.2441 -0.0053 -0.0002 0.0100 175 LEU C CD1 4654 C CD2 . LEU C 175 ? 0.2680 0.3628 0.3325 0.0024 0.0086 -0.0021 175 LEU C CD2 4655 N N . SER C 176 ? 0.2205 0.2989 0.2518 0.0164 0.0198 -0.0046 176 SER C N 4656 C CA . SER C 176 ? 0.2091 0.2940 0.2429 0.0210 0.0212 -0.0039 176 SER C CA 4657 C C . SER C 176 ? 0.2319 0.3046 0.2588 0.0151 0.0141 -0.0043 176 SER C C 4658 O O . SER C 176 ? 0.2427 0.2922 0.2501 0.0103 0.0096 -0.0032 176 SER C O 4659 C CB . SER C 176 ? 0.1784 0.2528 0.1977 0.0332 0.0305 0.0001 176 SER C CB 4660 O OG . SER C 176 ? 0.3540 0.3911 0.3412 0.0331 0.0309 -0.0016 176 SER C OG 4661 N N . SER C 177 ? 0.1337 0.2213 0.1741 0.0134 0.0124 -0.0045 177 SER C N 4662 C CA . SER C 177 ? 0.1513 0.2323 0.1882 0.0087 0.0073 -0.0022 177 SER C CA 4663 C C . SER C 177 ? 0.2202 0.2999 0.2506 0.0146 0.0099 -0.0012 177 SER C C 4664 O O . SER C 177 ? 0.2073 0.3053 0.2482 0.0186 0.0132 -0.0012 177 SER C O 4665 C CB . SER C 177 ? 0.1477 0.2453 0.2040 0.0043 0.0067 -0.0010 177 SER C CB 4666 O OG . SER C 177 ? 0.1917 0.2896 0.2490 0.0007 0.0037 0.0038 177 SER C OG 4667 N N . THR C 178 ? 0.2042 0.2603 0.2147 0.0136 0.0075 0.0011 178 THR C N 4668 C CA . THR C 178 ? 0.2130 0.2640 0.2160 0.0201 0.0105 0.0038 178 THR C CA 4669 C C . THR C 178 ? 0.2125 0.2621 0.2158 0.0114 0.0042 0.0069 178 THR C C 4670 O O . THR C 178 ? 0.2672 0.2998 0.2593 0.0005 -0.0030 0.0094 178 THR C O 4671 C CB . THR C 178 ? 0.1955 0.2117 0.1687 0.0288 0.0168 0.0051 178 THR C CB 4672 O OG1 . THR C 178 ? 0.2661 0.2861 0.2406 0.0389 0.0256 0.0048 178 THR C OG1 4673 C CG2 . THR C 178 ? 0.2500 0.2618 0.2183 0.0389 0.0219 0.0105 178 THR C CG2 4674 N N . LEU C 179 ? 0.1581 0.2264 0.1731 0.0142 0.0060 0.0085 179 LEU C N 4675 C CA . LEU C 179 ? 0.1770 0.2459 0.1925 0.0075 0.0023 0.0129 179 LEU C CA 4676 C C . LEU C 179 ? 0.1757 0.2255 0.1732 0.0134 0.0037 0.0169 179 LEU C C 4677 O O . LEU C 179 ? 0.2231 0.2807 0.2226 0.0247 0.0089 0.0188 179 LEU C O 4678 C CB . LEU C 179 ? 0.1347 0.2306 0.1677 0.0065 0.0052 0.0121 179 LEU C CB 4679 C CG . LEU C 179 ? 0.2117 0.3111 0.2447 0.0020 0.0047 0.0176 179 LEU C CG 4680 C CD1 . LEU C 179 ? 0.1395 0.2408 0.1817 -0.0072 0.0022 0.0240 179 LEU C CD1 4681 C CD2 . LEU C 179 ? 0.1503 0.2668 0.1870 0.0034 0.0097 0.0154 179 LEU C CD2 4682 N N . THR C 180 ? 0.2137 0.2386 0.1938 0.0050 -0.0014 0.0208 180 THR C N 4683 C CA . THR C 180 ? 0.2292 0.2250 0.1853 0.0105 0.0010 0.0248 180 THR C CA 4684 C C . THR C 180 ? 0.3049 0.3070 0.2646 0.0029 -0.0031 0.0315 180 THR C C 4685 O O . THR C 180 ? 0.2908 0.2950 0.2542 -0.0125 -0.0106 0.0353 180 THR C O 4686 C CB . THR C 180 ? 0.3506 0.2960 0.2688 0.0052 -0.0009 0.0236 180 THR C CB 4687 O OG1 . THR C 180 ? 0.3523 0.2906 0.2644 0.0129 0.0048 0.0180 180 THR C OG1 4688 C CG2 . THR C 180 ? 0.3131 0.2191 0.2006 0.0142 0.0054 0.0275 180 THR C CG2 4689 N N . LEU C 181 ? 0.2673 0.2757 0.2282 0.0134 0.0016 0.0356 181 LEU C N 4690 C CA . LEU C 181 ? 0.2337 0.2491 0.1967 0.0076 -0.0011 0.0424 181 LEU C CA 4691 C C . LEU C 181 ? 0.2925 0.2806 0.2347 0.0178 0.0026 0.0492 181 LEU C C 4692 O O . LEU C 181 ? 0.3404 0.3202 0.2775 0.0342 0.0101 0.0503 181 LEU C O 4693 C CB . LEU C 181 ? 0.3134 0.3685 0.2986 0.0096 0.0009 0.0421 181 LEU C CB 4694 C CG . LEU C 181 ? 0.3508 0.4307 0.3542 0.0032 0.0017 0.0361 181 LEU C CG 4695 C CD1 . LEU C 181 ? 0.2667 0.3708 0.2765 0.0053 0.0046 0.0346 181 LEU C CD1 4696 C CD2 . LEU C 181 ? 0.3198 0.4011 0.3292 -0.0091 -0.0003 0.0409 181 LEU C CD2 4697 N N . SER C 182 ? 0.2969 0.2723 0.2288 0.0094 -0.0010 0.0560 182 SER C N 4698 C CA . SER C 182 ? 0.3483 0.2994 0.2621 0.0203 0.0033 0.0646 182 SER C CA 4699 C C . SER C 182 ? 0.2900 0.2795 0.2258 0.0335 0.0067 0.0701 182 SER C C 4700 O O . SER C 182 ? 0.2581 0.2858 0.2151 0.0275 0.0036 0.0667 182 SER C O 4701 C CB . SER C 182 ? 0.4203 0.3550 0.3213 0.0054 -0.0027 0.0718 182 SER C CB 4702 O OG . SER C 182 ? 0.3671 0.3429 0.2915 -0.0009 -0.0050 0.0756 182 SER C OG 4703 N N . LYS C 183 ? 0.3118 0.2898 0.2405 0.0507 0.0130 0.0805 183 LYS C N 4704 C CA . LYS C 183 ? 0.3309 0.3498 0.2815 0.0591 0.0121 0.0908 183 LYS C CA 4705 C C . LYS C 183 ? 0.3590 0.3987 0.3135 0.0441 0.0043 0.0927 183 LYS C C 4706 O O . LYS C 183 ? 0.3643 0.4405 0.3334 0.0384 -0.0002 0.0921 183 LYS C O 4707 C CB . LYS C 183 ? 0.3556 0.3614 0.3014 0.0810 0.0204 0.1075 183 LYS C CB 4708 C CG . LYS C 183 ? 0.3465 0.4007 0.3177 0.0867 0.0158 0.1233 183 LYS C CG 4709 C CD . LYS C 183 ? 0.4725 0.5175 0.4439 0.1105 0.0247 0.1454 183 LYS C CD 4710 C CE . LYS C 183 ? 0.5127 0.6135 0.5134 0.1134 0.0165 0.1660 183 LYS C CE 4711 N NZ . LYS C 183 ? 0.5981 0.6945 0.6033 0.1374 0.0249 0.1924 183 LYS C NZ 4712 N N . ALA C 184 ? 0.3053 0.3176 0.2422 0.0362 0.0032 0.0954 184 ALA C N 4713 C CA . ALA C 184 ? 0.4025 0.4309 0.3406 0.0226 -0.0015 0.0989 184 ALA C CA 4714 C C . ALA C 184 ? 0.3438 0.4009 0.2956 0.0099 -0.0027 0.0886 184 ALA C C 4715 O O . ALA C 184 ? 0.3933 0.4750 0.3483 0.0059 -0.0035 0.0901 184 ALA C O 4716 C CB . ALA C 184 ? 0.3297 0.3231 0.2482 0.0132 -0.0026 0.1039 184 ALA C CB 4717 N N . ASP C 185 ? 0.3082 0.3588 0.2646 0.0039 -0.0021 0.0793 185 ASP C N 4718 C CA . ASP C 185 ? 0.3330 0.4081 0.3036 -0.0042 -0.0001 0.0716 185 ASP C CA 4719 C C . ASP C 185 ? 0.3076 0.4053 0.2850 0.0014 0.0010 0.0654 185 ASP C C 4720 O O . ASP C 185 ? 0.2162 0.3300 0.1928 -0.0041 0.0038 0.0626 185 ASP C O 4721 C CB . ASP C 185 ? 0.3544 0.4214 0.3319 -0.0106 -0.0010 0.0663 185 ASP C CB 4722 C CG . ASP C 185 ? 0.4768 0.5339 0.4525 -0.0247 -0.0043 0.0752 185 ASP C CG 4723 O OD1 . ASP C 185 ? 0.4815 0.5399 0.4523 -0.0287 -0.0035 0.0841 185 ASP C OD1 4724 O OD2 . ASP C 185 ? 0.5087 0.5584 0.4882 -0.0336 -0.0088 0.0753 185 ASP C OD2 4725 N N . TYR C 186 ? 0.2177 0.3135 0.1985 0.0113 -0.0005 0.0643 186 TYR C N 4726 C CA . TYR C 186 ? 0.2047 0.3236 0.1936 0.0136 -0.0020 0.0615 186 TYR C CA 4727 C C . TYR C 186 ? 0.2808 0.4176 0.2635 0.0093 -0.0066 0.0694 186 TYR C C 4728 O O . TYR C 186 ? 0.2450 0.3955 0.2233 0.0003 -0.0085 0.0642 186 TYR C O 4729 C CB . TYR C 186 ? 0.2043 0.3216 0.2007 0.0268 -0.0013 0.0650 186 TYR C CB 4730 C CG . TYR C 186 ? 0.2681 0.4143 0.2771 0.0267 -0.0049 0.0662 186 TYR C CG 4731 C CD1 . TYR C 186 ? 0.2618 0.4150 0.2748 0.0187 -0.0048 0.0541 186 TYR C CD1 4732 C CD2 . TYR C 186 ? 0.2336 0.4010 0.2512 0.0333 -0.0091 0.0821 186 TYR C CD2 4733 C CE1 . TYR C 186 ? 0.1703 0.3466 0.1914 0.0146 -0.0098 0.0560 186 TYR C CE1 4734 C CE2 . TYR C 186 ? 0.2213 0.4190 0.2518 0.0286 -0.0154 0.0868 186 TYR C CE2 4735 C CZ . TYR C 186 ? 0.2399 0.4398 0.2701 0.0179 -0.0161 0.0728 186 TYR C CZ 4736 O OH . TYR C 186 ? 0.2648 0.4913 0.3045 0.0095 -0.0240 0.0781 186 TYR C OH 4737 N N . GLU C 187 ? 0.3161 0.4482 0.2935 0.0143 -0.0087 0.0824 187 GLU C N 4738 C CA . GLU C 187 ? 0.3202 0.4701 0.2908 0.0097 -0.0155 0.0934 187 GLU C CA 4739 C C . GLU C 187 ? 0.3438 0.4913 0.2963 -0.0043 -0.0136 0.0879 187 GLU C C 4740 O O . GLU C 187 ? 0.3915 0.5500 0.3296 -0.0130 -0.0193 0.0933 187 GLU C O 4741 C CB . GLU C 187 ? 0.3379 0.4819 0.3087 0.0212 -0.0168 0.1112 187 GLU C CB 4742 C CG . GLU C 187 ? 0.4288 0.5751 0.4154 0.0397 -0.0144 0.1215 187 GLU C CG 4743 C CD . GLU C 187 ? 0.5884 0.7725 0.5930 0.0391 -0.0216 0.1293 187 GLU C CD 4744 O OE1 . GLU C 187 ? 0.5631 0.7681 0.5617 0.0223 -0.0316 0.1290 187 GLU C OE1 4745 O OE2 . GLU C 187 ? 0.6844 0.8752 0.7065 0.0545 -0.0167 0.1367 187 GLU C OE2 4746 N N . LYS C 188 ? 0.3731 0.5064 0.3253 -0.0068 -0.0051 0.0792 188 LYS C N 4747 C CA A LYS C 188 ? 0.3604 0.4910 0.2985 -0.0160 0.0019 0.0772 188 LYS C CA 4748 C CA B LYS C 188 ? 0.3636 0.4942 0.3017 -0.0160 0.0019 0.0772 188 LYS C CA 4749 C C . LYS C 188 ? 0.3097 0.4429 0.2396 -0.0217 0.0087 0.0645 188 LYS C C 4750 O O . LYS C 188 ? 0.2725 0.4004 0.1851 -0.0270 0.0185 0.0625 188 LYS C O 4751 C CB A LYS C 188 ? 0.3625 0.4817 0.3092 -0.0162 0.0079 0.0799 188 LYS C CB 4752 C CB B LYS C 188 ? 0.3616 0.4810 0.3083 -0.0163 0.0081 0.0797 188 LYS C CB 4753 C CG A LYS C 188 ? 0.3979 0.5178 0.3345 -0.0231 0.0161 0.0858 188 LYS C CG 4754 C CG B LYS C 188 ? 0.4020 0.5188 0.3369 -0.0220 0.0118 0.0899 188 LYS C CG 4755 C CD A LYS C 188 ? 0.4073 0.5257 0.3258 -0.0252 0.0109 0.0967 188 LYS C CD 4756 C CD B LYS C 188 ? 0.4012 0.5052 0.3331 -0.0194 0.0043 0.1023 188 LYS C CD 4757 C CE A LYS C 188 ? 0.3502 0.4676 0.2591 -0.0318 0.0204 0.1042 188 LYS C CE 4758 C CE B LYS C 188 ? 0.3370 0.4225 0.2784 -0.0198 0.0029 0.1032 188 LYS C CE 4759 N NZ A LYS C 188 ? 0.3105 0.4329 0.2154 -0.0334 0.0358 0.0963 188 LYS C NZ 4760 N NZ B LYS C 188 ? 0.3087 0.3691 0.2387 -0.0161 -0.0024 0.1138 188 LYS C NZ 4761 N N . HIS C 189 ? 0.2412 0.3785 0.1804 -0.0197 0.0057 0.0566 189 HIS C N 4762 C CA . HIS C 189 ? 0.2449 0.3774 0.1742 -0.0243 0.0135 0.0442 189 HIS C CA 4763 C C . HIS C 189 ? 0.3082 0.4457 0.2268 -0.0316 0.0039 0.0404 189 HIS C C 4764 O O . HIS C 189 ? 0.2432 0.3963 0.1739 -0.0302 -0.0086 0.0490 189 HIS C O 4765 C CB . HIS C 189 ? 0.2779 0.4080 0.2293 -0.0177 0.0214 0.0382 189 HIS C CB 4766 C CG . HIS C 189 ? 0.3603 0.4894 0.3226 -0.0156 0.0295 0.0449 189 HIS C CG 4767 N ND1 . HIS C 189 ? 0.4175 0.5444 0.3706 -0.0167 0.0441 0.0467 189 HIS C ND1 4768 C CD2 . HIS C 189 ? 0.3956 0.5246 0.3753 -0.0142 0.0251 0.0522 189 HIS C CD2 4769 C CE1 . HIS C 189 ? 0.3811 0.5144 0.3526 -0.0162 0.0472 0.0572 189 HIS C CE1 4770 N NE2 . HIS C 189 ? 0.3884 0.5209 0.3738 -0.0169 0.0341 0.0600 189 HIS C NE2 4771 N N . LYS C 190 ? 0.2901 0.4133 0.1854 -0.0393 0.0107 0.0293 190 LYS C N 4772 C CA . LYS C 190 ? 0.3069 0.4299 0.1831 -0.0528 -0.0005 0.0267 190 LYS C CA 4773 C C . LYS C 190 ? 0.2773 0.3958 0.1617 -0.0528 0.0016 0.0164 190 LYS C C 4774 O O . LYS C 190 ? 0.3246 0.4607 0.2250 -0.0558 -0.0110 0.0209 190 LYS C O 4775 C CB . LYS C 190 ? 0.3367 0.4368 0.1626 -0.0685 0.0015 0.0231 190 LYS C CB 4776 C CG . LYS C 190 ? 0.5086 0.6069 0.3082 -0.0896 -0.0156 0.0234 190 LYS C CG 4777 C CD . LYS C 190 ? 0.6368 0.7007 0.3738 -0.1083 -0.0133 0.0179 190 LYS C CD 4778 C CE . LYS C 190 ? 0.7272 0.7799 0.4298 -0.1347 -0.0308 0.0163 190 LYS C CE 4779 N NZ . LYS C 190 ? 0.7415 0.7526 0.3871 -0.1515 -0.0297 0.0110 190 LYS C NZ 4780 N N . VAL C 191 ? 0.3366 0.4328 0.2114 -0.0485 0.0187 0.0051 191 VAL C N 4781 C CA . VAL C 191 ? 0.2849 0.3705 0.1601 -0.0498 0.0218 -0.0047 191 VAL C CA 4782 C C . VAL C 191 ? 0.2439 0.3442 0.1608 -0.0353 0.0248 -0.0040 191 VAL C C 4783 O O . VAL C 191 ? 0.2840 0.3835 0.2159 -0.0244 0.0366 -0.0028 191 VAL C O 4784 C CB . VAL C 191 ? 0.4205 0.4680 0.2583 -0.0512 0.0413 -0.0161 191 VAL C CB 4785 C CG1 . VAL C 191 ? 0.3250 0.3590 0.1654 -0.0502 0.0459 -0.0251 191 VAL C CG1 4786 C CG2 . VAL C 191 ? 0.3803 0.4015 0.1622 -0.0694 0.0383 -0.0191 191 VAL C CG2 4787 N N . TYR C 192 ? 0.2253 0.3396 0.1596 -0.0369 0.0137 -0.0029 192 TYR C N 4788 C CA . TYR C 192 ? 0.2330 0.3562 0.1990 -0.0253 0.0158 -0.0029 192 TYR C CA 4789 C C . TYR C 192 ? 0.3216 0.4338 0.2856 -0.0276 0.0198 -0.0116 192 TYR C C 4790 O O . TYR C 192 ? 0.3194 0.4319 0.2729 -0.0388 0.0116 -0.0131 192 TYR C O 4791 C CB . TYR C 192 ? 0.2160 0.3607 0.2040 -0.0203 0.0046 0.0068 192 TYR C CB 4792 C CG . TYR C 192 ? 0.2087 0.3568 0.1994 -0.0147 0.0038 0.0152 192 TYR C CG 4793 C CD1 . TYR C 192 ? 0.1883 0.3428 0.1651 -0.0208 -0.0027 0.0227 192 TYR C CD1 4794 C CD2 . TYR C 192 ? 0.1692 0.3117 0.1728 -0.0060 0.0083 0.0168 192 TYR C CD2 4795 C CE1 . TYR C 192 ? 0.3028 0.4578 0.2807 -0.0157 -0.0028 0.0310 192 TYR C CE1 4796 C CE2 . TYR C 192 ? 0.2032 0.3436 0.2053 -0.0033 0.0073 0.0246 192 TYR C CE2 4797 C CZ . TYR C 192 ? 0.2733 0.4196 0.2634 -0.0068 0.0027 0.0314 192 TYR C CZ 4798 O OH . TYR C 192 ? 0.2702 0.4124 0.2580 -0.0040 0.0021 0.0401 192 TYR C OH 4799 N N . ALA C 193 ? 0.3101 0.4143 0.2856 -0.0182 0.0316 -0.0146 193 ALA C N 4800 C CA . ALA C 193 ? 0.2616 0.3499 0.2320 -0.0183 0.0392 -0.0219 193 ALA C CA 4801 C C . ALA C 193 ? 0.2568 0.3543 0.2572 -0.0087 0.0406 -0.0192 193 ALA C C 4802 O O . ALA C 193 ? 0.2848 0.3917 0.3045 -0.0011 0.0431 -0.0125 193 ALA C O 4803 C CB . ALA C 193 ? 0.2322 0.2925 0.1758 -0.0166 0.0570 -0.0270 193 ALA C CB 4804 N N . CYS C 194 ? 0.2237 0.3178 0.2253 -0.0118 0.0376 -0.0233 194 CYS C N 4805 C CA . CYS C 194 ? 0.2114 0.3102 0.2352 -0.0048 0.0386 -0.0212 194 CYS C CA 4806 C C . CYS C 194 ? 0.2077 0.2847 0.2211 -0.0034 0.0507 -0.0262 194 CYS C C 4807 O O . CYS C 194 ? 0.2921 0.3523 0.2833 -0.0126 0.0501 -0.0331 194 CYS C O 4808 C CB . CYS C 194 ? 0.2400 0.3520 0.2731 -0.0080 0.0269 -0.0201 194 CYS C CB 4809 S SG . CYS C 194 ? 0.4219 0.5326 0.4704 -0.0036 0.0279 -0.0197 194 CYS C SG 4810 N N . GLU C 195 ? 0.1853 0.2614 0.2137 0.0075 0.0619 -0.0205 195 GLU C N 4811 C CA . GLU C 195 ? 0.2633 0.3162 0.2827 0.0136 0.0775 -0.0224 195 GLU C CA 4812 C C . GLU C 195 ? 0.2489 0.3119 0.2940 0.0185 0.0743 -0.0162 195 GLU C C 4813 O O . GLU C 195 ? 0.2575 0.3439 0.3292 0.0213 0.0670 -0.0063 195 GLU C O 4814 C CB . GLU C 195 ? 0.2726 0.3176 0.2907 0.0259 0.0975 -0.0160 195 GLU C CB 4815 C CG . GLU C 195 ? 0.3746 0.3878 0.3776 0.0361 0.1188 -0.0172 195 GLU C CG 4816 C CD . GLU C 195 ? 0.4534 0.4613 0.4595 0.0533 0.1437 -0.0068 195 GLU C CD 4817 O OE1 . GLU C 195 ? 0.5003 0.5364 0.5278 0.0558 0.1418 0.0035 195 GLU C OE1 4818 O OE2 . GLU C 195 ? 0.4740 0.4474 0.4598 0.0650 0.1668 -0.0077 195 GLU C OE2 4819 N N . VAL C 196 ? 0.2388 0.2813 0.2718 0.0170 0.0785 -0.0215 196 VAL C N 4820 C CA . VAL C 196 ? 0.2566 0.3083 0.3103 0.0190 0.0729 -0.0163 196 VAL C CA 4821 C C . VAL C 196 ? 0.2693 0.2998 0.3225 0.0299 0.0898 -0.0120 196 VAL C C 4822 O O . VAL C 196 ? 0.3890 0.3841 0.4114 0.0291 0.1019 -0.0205 196 VAL C O 4823 C CB . VAL C 196 ? 0.1651 0.2187 0.2108 0.0062 0.0587 -0.0234 196 VAL C CB 4824 C CG1 . VAL C 196 ? 0.1579 0.2146 0.2185 0.0083 0.0559 -0.0185 196 VAL C CG1 4825 C CG2 . VAL C 196 ? 0.1421 0.2188 0.1946 0.0013 0.0454 -0.0228 196 VAL C CG2 4826 N N . THR C 197 ? 0.1814 0.2312 0.2661 0.0392 0.0901 0.0027 197 THR C N 4827 C CA . THR C 197 ? 0.2167 0.2534 0.3100 0.0531 0.1062 0.0125 197 THR C CA 4828 C C . THR C 197 ? 0.2253 0.2728 0.3353 0.0496 0.0941 0.0186 197 THR C C 4829 O O . THR C 197 ? 0.3189 0.3941 0.4477 0.0430 0.0769 0.0250 197 THR C O 4830 C CB . THR C 197 ? 0.1980 0.2560 0.3209 0.0687 0.1187 0.0323 197 THR C CB 4831 O OG1 . THR C 197 ? 0.3669 0.4042 0.4672 0.0757 0.1375 0.0267 197 THR C OG1 4832 C CG2 . THR C 197 ? 0.2112 0.2684 0.3546 0.0836 0.1302 0.0498 197 THR C CG2 4833 N N . HIS C 198 ? 0.2077 0.2281 0.3054 0.0529 0.1031 0.0163 198 HIS C N 4834 C CA . HIS C 198 ? 0.3337 0.3609 0.4426 0.0486 0.0921 0.0213 198 HIS C CA 4835 C C . HIS C 198 ? 0.3754 0.3713 0.4764 0.0588 0.1084 0.0253 198 HIS C C 4836 O O . HIS C 198 ? 0.3861 0.3421 0.4564 0.0622 0.1252 0.0156 198 HIS C O 4837 C CB . HIS C 198 ? 0.2743 0.3023 0.3664 0.0306 0.0754 0.0070 198 HIS C CB 4838 C CG . HIS C 198 ? 0.2885 0.3199 0.3866 0.0257 0.0665 0.0111 198 HIS C CG 4839 N ND1 . HIS C 198 ? 0.4005 0.4056 0.4817 0.0217 0.0713 0.0062 198 HIS C ND1 4840 C CD2 . HIS C 198 ? 0.2053 0.2593 0.3191 0.0225 0.0529 0.0196 198 HIS C CD2 4841 C CE1 . HIS C 198 ? 0.3624 0.3782 0.4532 0.0178 0.0619 0.0123 198 HIS C CE1 4842 N NE2 . HIS C 198 ? 0.2949 0.3389 0.4033 0.0183 0.0510 0.0200 198 HIS C NE2 4843 N N . GLN C 199 ? 0.3918 0.4012 0.5155 0.0625 0.1032 0.0399 199 GLN C N 4844 C CA . GLN C 199 ? 0.3841 0.3652 0.5040 0.0740 0.1183 0.0472 199 GLN C CA 4845 C C . GLN C 199 ? 0.3602 0.2903 0.4351 0.0651 0.1262 0.0277 199 GLN C C 4846 O O . GLN C 199 ? 0.4437 0.3312 0.4976 0.0771 0.1482 0.0278 199 GLN C O 4847 C CB . GLN C 199 ? 0.3432 0.3475 0.4882 0.0720 0.1046 0.0630 199 GLN C CB 4848 C CG . GLN C 199 ? 0.3919 0.3681 0.5347 0.0839 0.1189 0.0726 199 GLN C CG 4849 C CD . GLN C 199 ? 0.4596 0.4627 0.6292 0.0823 0.1044 0.0918 199 GLN C CD 4850 O OE1 . GLN C 199 ? 0.5119 0.5546 0.7034 0.0743 0.0855 0.1015 199 GLN C OE1 4851 N NE2 . GLN C 199 ? 0.5155 0.4931 0.6787 0.0878 0.1123 0.0977 199 GLN C NE2 4852 N N . GLY C 200 ? 0.3042 0.2372 0.3624 0.0438 0.1090 0.0128 200 GLY C N 4853 C CA . GLY C 200 ? 0.3136 0.2051 0.3312 0.0290 0.1110 -0.0025 200 GLY C CA 4854 C C . GLY C 200 ? 0.4413 0.3004 0.4215 0.0239 0.1204 -0.0166 200 GLY C C 4855 O O . GLY C 200 ? 0.4484 0.2685 0.3883 0.0072 0.1201 -0.0285 200 GLY C O 4856 N N . LEU C 201 ? 0.4048 0.2789 0.3952 0.0352 0.1272 -0.0143 201 LEU C N 4857 C CA . LEU C 201 ? 0.5294 0.3690 0.4795 0.0311 0.1378 -0.0269 201 LEU C CA 4858 C C . LEU C 201 ? 0.6115 0.4127 0.5473 0.0552 0.1690 -0.0213 201 LEU C C 4859 O O . LEU C 201 ? 0.6179 0.4487 0.5924 0.0770 0.1791 -0.0046 201 LEU C O 4860 C CB . LEU C 201 ? 0.4622 0.3402 0.4248 0.0243 0.1244 -0.0300 201 LEU C CB 4861 C CG . LEU C 201 ? 0.3731 0.2825 0.3434 0.0030 0.0985 -0.0349 201 LEU C CG 4862 C CD1 . LEU C 201 ? 0.2832 0.2296 0.2699 0.0017 0.0881 -0.0345 201 LEU C CD1 4863 C CD2 . LEU C 201 ? 0.3930 0.2700 0.3221 -0.0204 0.0919 -0.0464 201 LEU C CD2 4864 N N . SER C 202 ? 0.6835 0.4170 0.5621 0.0510 0.1852 -0.0334 202 SER C N 4865 C CA . SER C 202 ? 0.7699 0.4628 0.6275 0.0737 0.2158 -0.0268 202 SER C CA 4866 C C . SER C 202 ? 0.7176 0.4280 0.5765 0.0792 0.2204 -0.0248 202 SER C C 4867 O O . SER C 202 ? 0.7016 0.4247 0.5819 0.1002 0.2353 -0.0071 202 SER C O 4868 C CB . SER C 202 ? 0.8224 0.4409 0.6129 0.0612 0.2248 -0.0376 202 SER C CB 4869 O OG . SER C 202 ? 0.8879 0.4825 0.6323 0.0295 0.2079 -0.0579 202 SER C OG 4870 N N . SER C 203 ? 0.6916 0.4037 0.5275 0.0589 0.2068 -0.0415 203 SER C N 4871 C CA . SER C 203 ? 0.6485 0.3834 0.4895 0.0618 0.2074 -0.0401 203 SER C CA 4872 C C . SER C 203 ? 0.5339 0.3282 0.4111 0.0491 0.1821 -0.0420 203 SER C C 4873 O O . SER C 203 ? 0.5782 0.3864 0.4592 0.0292 0.1584 -0.0473 203 SER C O 4874 C CB . SER C 203 ? 0.5856 0.2664 0.3590 0.0450 0.2104 -0.0546 203 SER C CB 4875 O OG . SER C 203 ? 0.7534 0.3812 0.4932 0.0560 0.2325 -0.0493 203 SER C OG 4876 N N . PRO C 204 ? 0.4484 0.2817 0.3540 0.0580 0.1824 -0.0339 204 PRO C N 4877 C CA . PRO C 204 ? 0.3589 0.2463 0.2959 0.0439 0.1539 -0.0331 204 PRO C CA 4878 C C . PRO C 204 ? 0.4226 0.2973 0.3228 0.0174 0.1355 -0.0487 204 PRO C C 4879 O O . PRO C 204 ? 0.4371 0.2647 0.2845 0.0086 0.1445 -0.0597 204 PRO C O 4880 C CB . PRO C 204 ? 0.3642 0.2787 0.3230 0.0568 0.1623 -0.0230 204 PRO C CB 4881 C CG . PRO C 204 ? 0.3806 0.2726 0.3385 0.0792 0.1890 -0.0110 204 PRO C CG 4882 C CD . PRO C 204 ? 0.4408 0.2707 0.3487 0.0760 0.2009 -0.0225 204 PRO C CD 4883 N N . VAL C 205 ? 0.3520 0.2674 0.2779 0.0046 0.1105 -0.0477 205 VAL C N 4884 C CA . VAL C 205 ? 0.3528 0.2699 0.2554 -0.0185 0.0923 -0.0558 205 VAL C CA 4885 C C . VAL C 205 ? 0.3861 0.3384 0.3053 -0.0183 0.0830 -0.0520 205 VAL C C 4886 O O . VAL C 205 ? 0.2528 0.2434 0.2121 -0.0092 0.0766 -0.0436 205 VAL C O 4887 C CB . VAL C 205 ? 0.3982 0.3339 0.3150 -0.0323 0.0736 -0.0547 205 VAL C CB 4888 C CG1 . VAL C 205 ? 0.2990 0.2568 0.2103 -0.0526 0.0531 -0.0550 205 VAL C CG1 4889 C CG2 . VAL C 205 ? 0.3496 0.2422 0.2383 -0.0389 0.0807 -0.0598 205 VAL C CG2 4890 N N . THR C 206 ? 0.4207 0.3555 0.3043 -0.0296 0.0822 -0.0579 206 THR C N 4891 C CA . THR C 206 ? 0.3767 0.3430 0.2732 -0.0310 0.0722 -0.0536 206 THR C CA 4892 C C . THR C 206 ? 0.4319 0.4152 0.3210 -0.0526 0.0493 -0.0531 206 THR C C 4893 O O . THR C 206 ? 0.3427 0.2990 0.1925 -0.0724 0.0437 -0.0586 206 THR C O 4894 C CB . THR C 206 ? 0.3820 0.3241 0.2489 -0.0260 0.0881 -0.0562 206 THR C CB 4895 O OG1 . THR C 206 ? 0.4363 0.3730 0.3200 -0.0033 0.1107 -0.0507 206 THR C OG1 4896 C CG2 . THR C 206 ? 0.3137 0.2878 0.1938 -0.0284 0.0767 -0.0506 206 THR C CG2 4897 N N . LYS C 207 ? 0.3420 0.3687 0.2679 -0.0490 0.0364 -0.0445 207 LYS C N 4898 C CA . LYS C 207 ? 0.2494 0.3010 0.1770 -0.0641 0.0174 -0.0383 207 LYS C CA 4899 C C . LYS C 207 ? 0.3067 0.3766 0.2408 -0.0587 0.0147 -0.0327 207 LYS C C 4900 O O . LYS C 207 ? 0.2983 0.3772 0.2533 -0.0422 0.0224 -0.0307 207 LYS C O 4901 C CB . LYS C 207 ? 0.2144 0.2986 0.1774 -0.0619 0.0078 -0.0302 207 LYS C CB 4902 C CG . LYS C 207 ? 0.3029 0.3741 0.2587 -0.0727 0.0060 -0.0328 207 LYS C CG 4903 C CD . LYS C 207 ? 0.3539 0.4064 0.2722 -0.0998 -0.0045 -0.0341 207 LYS C CD 4904 C CE . LYS C 207 ? 0.3896 0.4225 0.2974 -0.1117 -0.0054 -0.0369 207 LYS C CE 4905 N NZ . LYS C 207 ? 0.3957 0.4153 0.2696 -0.1437 -0.0209 -0.0345 207 LYS C NZ 4906 N N . SER C 208 ? 0.2818 0.3584 0.1982 -0.0746 0.0020 -0.0282 208 SER C N 4907 C CA . SER C 208 ? 0.2685 0.3505 0.1785 -0.0716 0.0020 -0.0246 208 SER C CA 4908 C C . SER C 208 ? 0.3103 0.4199 0.2214 -0.0857 -0.0174 -0.0118 208 SER C C 4909 O O . SER C 208 ? 0.3627 0.4778 0.2640 -0.1052 -0.0312 -0.0070 208 SER C O 4910 C CB . SER C 208 ? 0.3409 0.3796 0.2058 -0.0754 0.0161 -0.0354 208 SER C CB 4911 O OG . SER C 208 ? 0.5027 0.5421 0.3485 -0.0807 0.0127 -0.0317 208 SER C OG 4912 N N . PHE C 209 ? 0.2450 0.3738 0.1700 -0.0764 -0.0191 -0.0034 209 PHE C N 4913 C CA . PHE C 209 ? 0.2530 0.4070 0.1774 -0.0879 -0.0359 0.0116 209 PHE C CA 4914 C C . PHE C 209 ? 0.2638 0.4107 0.1729 -0.0841 -0.0323 0.0128 209 PHE C C 4915 O O . PHE C 209 ? 0.3810 0.5153 0.2950 -0.0683 -0.0176 0.0061 209 PHE C O 4916 C CB . PHE C 209 ? 0.2236 0.4205 0.1932 -0.0772 -0.0435 0.0287 209 PHE C CB 4917 C CG . PHE C 209 ? 0.2288 0.4321 0.2241 -0.0522 -0.0332 0.0311 209 PHE C CG 4918 C CD1 . PHE C 209 ? 0.1907 0.4018 0.1867 -0.0462 -0.0351 0.0405 209 PHE C CD1 4919 C CD2 . PHE C 209 ? 0.2514 0.4496 0.2659 -0.0368 -0.0229 0.0250 209 PHE C CD2 4920 C CE1 . PHE C 209 ? 0.2545 0.4637 0.2673 -0.0262 -0.0264 0.0426 209 PHE C CE1 4921 C CE2 . PHE C 209 ? 0.2328 0.4291 0.2616 -0.0185 -0.0155 0.0271 209 PHE C CE2 4922 C CZ . PHE C 209 ? 0.2219 0.4216 0.2487 -0.0135 -0.0170 0.0355 209 PHE C CZ 4923 N N . ASN C 210 ? 0.2881 0.4451 0.1794 -0.1004 -0.0472 0.0237 210 ASN C N 4924 C CA . ASN C 210 ? 0.4011 0.5572 0.2808 -0.0973 -0.0463 0.0289 210 ASN C CA 4925 C C . ASN C 210 ? 0.3841 0.5816 0.3017 -0.0870 -0.0567 0.0502 210 ASN C C 4926 O O . ASN C 210 ? 0.3338 0.5622 0.2647 -0.0974 -0.0734 0.0674 210 ASN C O 4927 C CB . ASN C 210 ? 0.4566 0.5899 0.2825 -0.1232 -0.0553 0.0276 210 ASN C CB 4928 C CG . ASN C 210 ? 0.5146 0.5950 0.2928 -0.1295 -0.0390 0.0063 210 ASN C CG 4929 O OD1 . ASN C 210 ? 0.5482 0.6130 0.3375 -0.1104 -0.0183 -0.0051 210 ASN C OD1 4930 N ND2 . ASN C 210 ? 0.5201 0.5705 0.2423 -0.1567 -0.0479 0.0027 210 ASN C ND2 4931 N N . ARG C 211 ? 0.2877 0.4849 0.2220 -0.0669 -0.0462 0.0512 211 ARG C N 4932 C CA . ARG C 211 ? 0.3028 0.5279 0.2669 -0.0531 -0.0512 0.0705 211 ARG C CA 4933 C C . ARG C 211 ? 0.4177 0.6643 0.3718 -0.0678 -0.0685 0.0894 211 ARG C C 4934 O O . ARG C 211 ? 0.4337 0.6632 0.3523 -0.0818 -0.0713 0.0857 211 ARG C O 4935 C CB . ARG C 211 ? 0.2553 0.4643 0.2236 -0.0359 -0.0385 0.0672 211 ARG C CB 4936 C CG . ARG C 211 ? 0.2283 0.4545 0.2186 -0.0205 -0.0410 0.0866 211 ARG C CG 4937 C CD . ARG C 211 ? 0.2780 0.4825 0.2623 -0.0103 -0.0317 0.0844 211 ARG C CD 4938 N NE . ARG C 211 ? 0.3432 0.5355 0.2992 -0.0233 -0.0316 0.0796 211 ARG C NE 4939 C CZ . ARG C 211 ? 0.3489 0.5512 0.2896 -0.0330 -0.0415 0.0918 211 ARG C CZ 4940 N NH1 . ARG C 211 ? 0.2986 0.5288 0.2552 -0.0312 -0.0539 0.1121 211 ARG C NH1 4941 N NH2 . ARG C 211 ? 0.2848 0.4706 0.1943 -0.0442 -0.0384 0.0859 211 ARG C NH2 4942 N N . GLY C 212 ? 0.4532 0.7384 0.4385 -0.0645 -0.0794 0.1120 212 GLY C N 4943 C CA . GLY C 212 ? 0.5218 0.8281 0.5078 -0.0767 -0.0937 0.1329 212 GLY C CA 4944 C C . GLY C 212 ? 0.6288 0.9258 0.5870 -0.1082 -0.1061 0.1290 212 GLY C C 4945 O O . GLY C 212 ? 0.7524 1.0404 0.6846 -0.1254 -0.1148 0.1330 212 GLY C O 4946 N N . ALA C 213 ? 0.5645 0.8595 0.5249 -0.1164 -0.1066 0.1212 213 ALA C N 4947 C CA . ALA C 213 ? 0.5600 0.8409 0.4924 -0.1472 -0.1181 0.1189 213 ALA C CA 4948 C C . ALA C 213 ? 0.6497 0.9514 0.6112 -0.1492 -0.1200 0.1268 213 ALA C C 4949 O O . ALA C 213 ? 0.6371 0.9390 0.6150 -0.1333 -0.1098 0.1168 213 ALA C O 4950 C CB . ALA C 213 ? 0.5615 0.7904 0.4369 -0.1608 -0.1125 0.0914 213 ALA C CB 4951 O OXT . ALA C 213 ? 0.7516 1.0711 0.7207 -0.1670 -0.1315 0.1449 213 ALA C OXT 4952 N N . GLN D 1 ? 0.3253 0.8100 0.7991 -0.1572 0.1079 0.1498 1 GLN D N 4953 C CA . GLN D 1 ? 0.3377 0.7125 0.7750 -0.1425 0.1334 0.1411 1 GLN D CA 4954 C C . GLN D 1 ? 0.3943 0.7562 0.8099 -0.0767 0.1248 0.1353 1 GLN D C 4955 O O . GLN D 1 ? 0.3079 0.7270 0.7304 -0.0494 0.1001 0.1313 1 GLN D O 4956 C CB . GLN D 1 ? 0.4040 0.6828 0.7976 -0.1974 0.1379 0.1096 1 GLN D CB 4957 N N . VAL D 2 ? 0.3944 0.6820 0.7878 -0.0530 0.1461 0.1389 2 VAL D N 4958 C CA . VAL D 2 ? 0.3029 0.5773 0.6723 -0.0026 0.1370 0.1344 2 VAL D CA 4959 C C . VAL D 2 ? 0.3116 0.5296 0.6477 -0.0077 0.1226 0.1045 2 VAL D C 4960 O O . VAL D 2 ? 0.3837 0.5256 0.7042 -0.0341 0.1407 0.0926 2 VAL D O 4961 C CB . VAL D 2 ? 0.2959 0.5362 0.6631 0.0219 0.1606 0.1613 2 VAL D CB 4962 C CG1 . VAL D 2 ? 0.2354 0.4617 0.5700 0.0598 0.1443 0.1540 2 VAL D CG1 4963 C CG2 . VAL D 2 ? 0.2762 0.5609 0.6441 0.0278 0.1642 0.1853 2 VAL D CG2 4964 N N . GLN D 3 ? 0.2613 0.5097 0.5845 0.0176 0.0960 0.0926 3 GLN D N 4965 C CA . GLN D 3 ? 0.2853 0.4898 0.5746 0.0107 0.0803 0.0681 3 GLN D CA 4966 C C . GLN D 3 ? 0.2555 0.4635 0.5266 0.0536 0.0649 0.0642 3 GLN D C 4967 O O . GLN D 3 ? 0.1882 0.4450 0.4703 0.0828 0.0577 0.0719 3 GLN D O 4968 C CB . GLN D 3 ? 0.2917 0.5317 0.5803 -0.0274 0.0552 0.0577 3 GLN D CB 4969 C CG . GLN D 3 ? 0.4833 0.7125 0.7746 -0.0887 0.0664 0.0531 3 GLN D CG 4970 C CD . GLN D 3 ? 0.5524 0.8340 0.8370 -0.1357 0.0327 0.0473 3 GLN D CD 4971 O OE1 . GLN D 3 ? 0.6636 0.9075 0.9006 -0.1615 0.0200 0.0259 3 GLN D OE1 4972 N NE2 . GLN D 3 ? 0.5341 0.9128 0.8678 -0.1488 0.0175 0.0709 3 GLN D NE2 4973 N N . LEU D 4 ? 0.2047 0.3554 0.4460 0.0543 0.0652 0.0505 4 LEU D N 4974 C CA . LEU D 4 ? 0.2372 0.3821 0.4555 0.0820 0.0487 0.0437 4 LEU D CA 4975 C C . LEU D 4 ? 0.2869 0.4058 0.4770 0.0616 0.0319 0.0257 4 LEU D C 4976 O O . LEU D 4 ? 0.3042 0.3750 0.4756 0.0337 0.0459 0.0129 4 LEU D O 4977 C CB . LEU D 4 ? 0.2837 0.3991 0.4958 0.0992 0.0630 0.0524 4 LEU D CB 4978 C CG . LEU D 4 ? 0.3295 0.4646 0.5383 0.1045 0.0680 0.0707 4 LEU D CG 4979 C CD1 . LEU D 4 ? 0.1949 0.3218 0.4436 0.0957 0.0978 0.0935 4 LEU D CD1 4980 C CD2 . LEU D 4 ? 0.3638 0.4900 0.5429 0.1106 0.0593 0.0754 4 LEU D CD2 4981 N N . LYS D 5 ? 0.2728 0.4199 0.4580 0.0752 0.0066 0.0264 5 LYS D N 4982 C CA . LYS D 5 ? 0.2828 0.4185 0.4405 0.0549 -0.0148 0.0191 5 LYS D CA 4983 C C . LYS D 5 ? 0.2575 0.3678 0.3922 0.0820 -0.0257 0.0176 5 LYS D C 4984 O O . LYS D 5 ? 0.2373 0.3658 0.3852 0.1151 -0.0317 0.0260 5 LYS D O 4985 C CB . LYS D 5 ? 0.2923 0.4951 0.4747 0.0414 -0.0390 0.0348 5 LYS D CB 4986 C CG . LYS D 5 ? 0.4742 0.7000 0.6689 -0.0046 -0.0329 0.0333 5 LYS D CG 4987 C CD . LYS D 5 ? 0.5841 0.9046 0.8209 -0.0166 -0.0596 0.0588 5 LYS D CD 4988 C CE . LYS D 5 ? 0.6115 0.9527 0.8502 -0.0793 -0.0573 0.0543 5 LYS D CE 4989 N NZ . LYS D 5 ? 0.6847 0.9594 0.8540 -0.1364 -0.0561 0.0251 5 LYS D NZ 4990 N N . GLN D 6 ? 0.2203 0.2824 0.3190 0.0659 -0.0225 0.0053 6 GLN D N 4991 C CA . GLN D 6 ? 0.2264 0.2593 0.3022 0.0842 -0.0296 0.0042 6 GLN D CA 4992 C C . GLN D 6 ? 0.2626 0.2942 0.3141 0.0742 -0.0545 0.0109 6 GLN D C 4993 O O . GLN D 6 ? 0.2912 0.3412 0.3316 0.0427 -0.0656 0.0129 6 GLN D O 4994 C CB . GLN D 6 ? 0.2463 0.2390 0.3075 0.0754 -0.0082 -0.0053 6 GLN D CB 4995 C CG . GLN D 6 ? 0.3000 0.2996 0.3928 0.0815 0.0172 -0.0003 6 GLN D CG 4996 C CD . GLN D 6 ? 0.3439 0.3169 0.4417 0.0816 0.0411 0.0024 6 GLN D CD 4997 O OE1 . GLN D 6 ? 0.3500 0.3216 0.4786 0.0863 0.0669 0.0134 6 GLN D OE1 4998 N NE2 . GLN D 6 ? 0.3327 0.2881 0.4074 0.0783 0.0350 -0.0017 6 GLN D NE2 4999 N N . SER D 7 ? 0.2916 0.3005 0.3302 0.0955 -0.0637 0.0166 7 SER D N 5000 C CA . SER D 7 ? 0.4079 0.4091 0.4224 0.0871 -0.0861 0.0311 7 SER D CA 5001 C C . SER D 7 ? 0.4487 0.4184 0.4158 0.0484 -0.0820 0.0193 7 SER D C 5002 O O . SER D 7 ? 0.4104 0.3534 0.3700 0.0396 -0.0571 0.0006 7 SER D O 5003 C CB . SER D 7 ? 0.3091 0.2767 0.3206 0.1191 -0.0894 0.0399 7 SER D CB 5004 O OG . SER D 7 ? 0.3070 0.2381 0.3051 0.1229 -0.0714 0.0199 7 SER D OG 5005 N N . GLY D 8 ? 0.4579 0.4342 0.3951 0.0274 -0.1042 0.0351 8 GLY D N 5006 C CA . GLY D 8 ? 0.5178 0.4716 0.3993 -0.0176 -0.0980 0.0222 8 GLY D CA 5007 C C . GLY D 8 ? 0.5178 0.4195 0.3714 -0.0197 -0.0766 0.0100 8 GLY D C 5008 O O . GLY D 8 ? 0.4254 0.3072 0.2952 0.0082 -0.0761 0.0162 8 GLY D O 5009 N N . PRO D 9 ? 0.5370 0.4159 0.3447 -0.0580 -0.0557 -0.0085 9 PRO D N 5010 C CA . PRO D 9 ? 0.5245 0.3656 0.3131 -0.0619 -0.0299 -0.0167 9 PRO D CA 5011 C C . PRO D 9 ? 0.5905 0.4206 0.3458 -0.0673 -0.0532 0.0068 9 PRO D C 5012 O O . PRO D 9 ? 0.6502 0.4989 0.3851 -0.0751 -0.0866 0.0309 9 PRO D O 5013 C CB . PRO D 9 ? 0.6134 0.4306 0.3585 -0.1018 0.0066 -0.0448 9 PRO D CB 5014 C CG . PRO D 9 ? 0.6314 0.4727 0.3365 -0.1382 -0.0204 -0.0442 9 PRO D CG 5015 C CD . PRO D 9 ? 0.5281 0.4142 0.2941 -0.1051 -0.0513 -0.0245 9 PRO D CD 5016 N N . GLY D 10 ? 0.6314 0.4359 0.3856 -0.0649 -0.0349 0.0057 10 GLY D N 5017 C CA . GLY D 10 ? 0.6831 0.4678 0.4033 -0.0748 -0.0518 0.0287 10 GLY D CA 5018 C C . GLY D 10 ? 0.6003 0.3651 0.3271 -0.0783 -0.0284 0.0260 10 GLY D C 5019 O O . GLY D 10 ? 0.5004 0.2770 0.2669 -0.0687 -0.0017 0.0114 10 GLY D O 5020 N N . LEU D 11 ? 0.5734 0.3144 0.2661 -0.0930 -0.0410 0.0476 11 LEU D N 5021 C CA . LEU D 11 ? 0.6595 0.3852 0.3494 -0.1083 -0.0231 0.0518 11 LEU D CA 5022 C C . LEU D 11 ? 0.7125 0.4159 0.4308 -0.0913 -0.0402 0.0609 11 LEU D C 5023 O O . LEU D 11 ? 0.7752 0.4521 0.4907 -0.0718 -0.0652 0.0732 11 LEU D O 5024 C CB . LEU D 11 ? 0.6621 0.3688 0.2880 -0.1416 -0.0268 0.0722 11 LEU D CB 5025 C CG . LEU D 11 ? 0.7110 0.4060 0.3226 -0.1683 -0.0049 0.0808 11 LEU D CG 5026 C CD1 . LEU D 11 ? 0.7550 0.4811 0.3934 -0.1747 0.0430 0.0567 11 LEU D CD1 5027 C CD2 . LEU D 11 ? 0.7767 0.4537 0.3152 -0.2015 -0.0134 0.1063 11 LEU D CD2 5028 N N . VAL D 12 ? 0.6327 0.3489 0.3791 -0.1004 -0.0239 0.0552 12 VAL D N 5029 C CA . VAL D 12 ? 0.5785 0.2678 0.3322 -0.1041 -0.0377 0.0595 12 VAL D CA 5030 C C . VAL D 12 ? 0.6197 0.3067 0.3622 -0.1424 -0.0259 0.0726 12 VAL D C 5031 O O . VAL D 12 ? 0.6482 0.3839 0.4136 -0.1551 0.0003 0.0730 12 VAL D O 5032 C CB . VAL D 12 ? 0.5668 0.2916 0.3661 -0.0897 -0.0373 0.0442 12 VAL D CB 5033 C CG1 . VAL D 12 ? 0.5905 0.2826 0.3785 -0.1080 -0.0506 0.0420 12 VAL D CG1 5034 C CG2 . VAL D 12 ? 0.5959 0.3263 0.4079 -0.0542 -0.0452 0.0330 12 VAL D CG2 5035 N N . GLN D 13 ? 0.6728 0.3009 0.3838 -0.1603 -0.0400 0.0850 13 GLN D N 5036 C CA . GLN D 13 ? 0.7163 0.3408 0.4164 -0.2035 -0.0303 0.0996 13 GLN D CA 5037 C C . GLN D 13 ? 0.6868 0.3614 0.4310 -0.2232 -0.0273 0.0912 13 GLN D C 5038 O O . GLN D 13 ? 0.6697 0.3414 0.4254 -0.2117 -0.0412 0.0751 13 GLN D O 5039 C CB . GLN D 13 ? 0.7983 0.3447 0.4589 -0.2135 -0.0440 0.1131 13 GLN D CB 5040 C CG . GLN D 13 ? 0.9517 0.4688 0.5827 -0.1906 -0.0530 0.1326 13 GLN D CG 5041 C CD . GLN D 13 ? 1.0703 0.6221 0.6765 -0.2130 -0.0402 0.1487 13 GLN D CD 5042 O OE1 . GLN D 13 ? 1.1475 0.7211 0.7339 -0.2042 -0.0409 0.1516 13 GLN D OE1 5043 N NE2 . GLN D 13 ? 1.0659 0.6253 0.6687 -0.2460 -0.0266 0.1569 13 GLN D NE2 5044 N N . PRO D 14 ? 0.7854 0.5155 0.5554 -0.2552 -0.0090 0.1057 14 PRO D N 5045 C CA . PRO D 14 ? 0.6686 0.4637 0.4861 -0.2829 -0.0128 0.1100 14 PRO D CA 5046 C C . PRO D 14 ? 0.8363 0.5689 0.6156 -0.3134 -0.0403 0.0983 14 PRO D C 5047 O O . PRO D 14 ? 0.7967 0.4510 0.5286 -0.3168 -0.0444 0.0945 14 PRO D O 5048 C CB . PRO D 14 ? 0.6902 0.5336 0.5287 -0.3189 0.0103 0.1349 14 PRO D CB 5049 C CG . PRO D 14 ? 0.6879 0.5206 0.5072 -0.2954 0.0396 0.1361 14 PRO D CG 5050 C CD . PRO D 14 ? 0.7854 0.5308 0.5432 -0.2694 0.0181 0.1218 14 PRO D CD 5051 N N . SER D 15 ? 0.8183 0.5986 0.6233 -0.3205 -0.0548 0.0884 15 SER D N 5052 C CA . SER D 15 ? 0.8341 0.5630 0.5952 -0.3491 -0.0750 0.0662 15 SER D CA 5053 C C . SER D 15 ? 0.8486 0.4796 0.5626 -0.3109 -0.0780 0.0379 15 SER D C 5054 O O . SER D 15 ? 0.9292 0.5190 0.6071 -0.3215 -0.0833 0.0134 15 SER D O 5055 C CB . SER D 15 ? 0.8538 0.5480 0.5838 -0.3872 -0.0741 0.0683 15 SER D CB 5056 O OG . SER D 15 ? 0.9569 0.7551 0.7369 -0.4219 -0.0728 0.0939 15 SER D OG 5057 N N . GLN D 16 ? 0.7560 0.3618 0.4738 -0.2616 -0.0702 0.0420 16 GLN D N 5058 C CA . GLN D 16 ? 0.8359 0.3656 0.5253 -0.2190 -0.0714 0.0235 16 GLN D CA 5059 C C . GLN D 16 ? 0.7318 0.3192 0.4511 -0.1855 -0.0742 0.0081 16 GLN D C 5060 O O . GLN D 16 ? 0.6843 0.3666 0.4463 -0.1934 -0.0764 0.0147 16 GLN D O 5061 C CB . GLN D 16 ? 0.8364 0.3287 0.5193 -0.1809 -0.0664 0.0418 16 GLN D CB 5062 C CG . GLN D 16 ? 0.9237 0.3644 0.5819 -0.1943 -0.0613 0.0564 16 GLN D CG 5063 C CD . GLN D 16 ? 1.1106 0.4970 0.7450 -0.2175 -0.0567 0.0369 16 GLN D CD 5064 O OE1 . GLN D 16 ? 1.2384 0.5818 0.8634 -0.1948 -0.0511 0.0153 16 GLN D OE1 5065 N NE2 . GLN D 16 ? 1.1346 0.5250 0.7583 -0.2654 -0.0554 0.0430 16 GLN D NE2 5066 N N . SER D 17 ? 0.7485 0.2812 0.4515 -0.1453 -0.0715 -0.0064 17 SER D N 5067 C CA . SER D 17 ? 0.6894 0.2634 0.4109 -0.1177 -0.0718 -0.0227 17 SER D CA 5068 C C . SER D 17 ? 0.6884 0.3122 0.4525 -0.0701 -0.0692 -0.0114 17 SER D C 5069 O O . SER D 17 ? 0.7920 0.3883 0.5546 -0.0479 -0.0686 0.0018 17 SER D O 5070 C CB . SER D 17 ? 0.8088 0.2932 0.4853 -0.1072 -0.0627 -0.0499 17 SER D CB 5071 O OG . SER D 17 ? 0.9406 0.4696 0.6214 -0.0994 -0.0620 -0.0685 17 SER D OG 5072 N N . LEU D 18 ? 0.5454 0.2127 0.3765 0.0077 0.0453 0.0614 18 LEU D N 5073 C CA . LEU D 18 ? 0.4996 0.2058 0.3463 0.0191 0.0341 0.0688 18 LEU D CA 5074 C C . LEU D 18 ? 0.5235 0.2386 0.3818 0.0386 0.0318 0.0694 18 LEU D C 5075 O O . LEU D 18 ? 0.6219 0.3380 0.4860 0.0372 0.0343 0.0559 18 LEU D O 5076 C CB . LEU D 18 ? 0.4246 0.1658 0.2833 0.0052 0.0286 0.0572 18 LEU D CB 5077 C CG . LEU D 18 ? 0.4332 0.2105 0.3065 0.0131 0.0192 0.0594 18 LEU D CG 5078 C CD1 . LEU D 18 ? 0.4602 0.2450 0.3289 0.0203 0.0144 0.0761 18 LEU D CD1 5079 C CD2 . LEU D 18 ? 0.4253 0.2266 0.3063 0.0005 0.0169 0.0483 18 LEU D CD2 5080 N N . SER D 19 ? 0.5027 0.2286 0.3643 0.0560 0.0271 0.0849 19 SER D N 5081 C CA . SER D 19 ? 0.5108 0.2534 0.3856 0.0739 0.0250 0.0855 19 SER D CA 5082 C C . SER D 19 ? 0.4926 0.2804 0.3805 0.0774 0.0140 0.0926 19 SER D C 5083 O O . SER D 19 ? 0.5268 0.3259 0.4108 0.0790 0.0090 0.1064 19 SER D O 5084 C CB . SER D 19 ? 0.5214 0.2352 0.3893 0.0954 0.0321 0.0968 19 SER D CB 5085 O OG . SER D 19 ? 0.6023 0.2748 0.4576 0.0879 0.0434 0.0867 19 SER D OG 5086 N N . ILE D 20 ? 0.4443 0.2573 0.3451 0.0767 0.0108 0.0829 20 ILE D N 5087 C CA . ILE D 20 ? 0.4123 0.2656 0.3233 0.0769 0.0022 0.0873 20 ILE D CA 5088 C C . ILE D 20 ? 0.4547 0.3263 0.3778 0.0900 0.0024 0.0858 20 ILE D C 5089 O O . ILE D 20 ? 0.4396 0.3005 0.3648 0.0905 0.0074 0.0742 20 ILE D O 5090 C CB . ILE D 20 ? 0.3596 0.2263 0.2719 0.0587 -0.0014 0.0765 20 ILE D CB 5091 C CG1 . ILE D 20 ? 0.4336 0.2875 0.3354 0.0455 -0.0006 0.0767 20 ILE D CG1 5092 C CG2 . ILE D 20 ? 0.3140 0.2158 0.2330 0.0561 -0.0080 0.0789 20 ILE D CG2 5093 C CD1 . ILE D 20 ? 0.4527 0.3124 0.3562 0.0312 -0.0007 0.0638 20 ILE D CD1 5094 N N . THR D 21 ? 0.4489 0.3526 0.3797 0.0991 -0.0029 0.0970 21 THR D N 5095 C CA . THR D 21 ? 0.3836 0.3127 0.3273 0.1098 -0.0025 0.0955 21 THR D CA 5096 C C . THR D 21 ? 0.4225 0.3862 0.3714 0.0948 -0.0088 0.0906 21 THR D C 5097 O O . THR D 21 ? 0.4306 0.4141 0.3767 0.0847 -0.0151 0.0964 21 THR D O 5098 C CB . THR D 21 ? 0.4342 0.3805 0.3850 0.1323 -0.0028 0.1112 21 THR D CB 5099 O OG1 . THR D 21 ? 0.5198 0.4245 0.4634 0.1482 0.0061 0.1141 21 THR D OG1 5100 C CG2 . THR D 21 ? 0.4308 0.4140 0.3973 0.1413 -0.0026 0.1090 21 THR D CG2 5101 N N . CYS D 22 ? 0.4555 0.4237 0.4090 0.0920 -0.0061 0.0798 22 CYS D N 5102 C CA . CYS D 22 ? 0.3713 0.3666 0.3270 0.0783 -0.0099 0.0753 22 CYS D CA 5103 C C . CYS D 22 ? 0.3837 0.4117 0.3515 0.0882 -0.0087 0.0777 22 CYS D C 5104 O O . CYS D 22 ? 0.4740 0.4942 0.4457 0.0980 -0.0026 0.0718 22 CYS D O 5105 C CB . CYS D 22 ? 0.2837 0.2588 0.2330 0.0665 -0.0077 0.0626 22 CYS D CB 5106 S SG . CYS D 22 ? 0.3713 0.3662 0.3174 0.0496 -0.0099 0.0576 22 CYS D SG 5107 N N . THR D 23 ? 0.3488 0.4163 0.3220 0.0845 -0.0140 0.0855 23 THR D N 5108 C CA . THR D 23 ? 0.3425 0.4518 0.3292 0.0918 -0.0133 0.0881 23 THR D CA 5109 C C . THR D 23 ? 0.3873 0.5147 0.3698 0.0695 -0.0141 0.0801 23 THR D C 5110 O O . THR D 23 ? 0.3961 0.5255 0.3687 0.0503 -0.0183 0.0796 23 THR D O 5111 C CB . THR D 23 ? 0.3232 0.4727 0.3193 0.1018 -0.0190 0.1031 23 THR D CB 5112 O OG1 . THR D 23 ? 0.3773 0.5015 0.3720 0.1215 -0.0180 0.1128 23 THR D OG1 5113 C CG2 . THR D 23 ? 0.2823 0.4797 0.2959 0.1135 -0.0172 0.1061 23 THR D CG2 5114 N N . VAL D 24 ? 0.3929 0.5303 0.3804 0.0709 -0.0090 0.0737 24 VAL D N 5115 C CA . VAL D 24 ? 0.3237 0.4707 0.3033 0.0488 -0.0084 0.0667 24 VAL D CA 5116 C C . VAL D 24 ? 0.3801 0.5810 0.3707 0.0451 -0.0080 0.0692 24 VAL D C 5117 O O . VAL D 24 ? 0.4162 0.6478 0.4238 0.0644 -0.0070 0.0750 24 VAL D O 5118 C CB . VAL D 24 ? 0.2867 0.4007 0.2575 0.0466 -0.0030 0.0568 24 VAL D CB 5119 C CG1 . VAL D 24 ? 0.2554 0.3254 0.2198 0.0538 -0.0030 0.0543 24 VAL D CG1 5120 C CG2 . VAL D 24 ? 0.2953 0.4271 0.2762 0.0589 0.0034 0.0535 24 VAL D CG2 5121 N N . SER D 25 ? 0.3497 0.5620 0.3300 0.0200 -0.0079 0.0648 25 SER D N 5122 C CA . SER D 25 ? 0.3361 0.6012 0.3244 0.0097 -0.0065 0.0650 25 SER D CA 5123 C C . SER D 25 ? 0.3443 0.5969 0.3136 -0.0183 -0.0023 0.0571 25 SER D C 5124 O O . SER D 25 ? 0.4378 0.6477 0.3878 -0.0313 -0.0024 0.0537 25 SER D O 5125 C CB . SER D 25 ? 0.3029 0.6166 0.2997 0.0049 -0.0134 0.0735 25 SER D CB 5126 O OG . SER D 25 ? 0.3910 0.6830 0.3704 -0.0144 -0.0177 0.0728 25 SER D OG 5127 N N . GLY D 26 ? 0.2921 0.5805 0.2659 -0.0269 0.0023 0.0545 26 GLY D N 5128 C CA . GLY D 26 ? 0.2758 0.5506 0.2290 -0.0541 0.0076 0.0482 26 GLY D CA 5129 C C . GLY D 26 ? 0.2784 0.5186 0.2237 -0.0468 0.0135 0.0438 26 GLY D C 5130 O O . GLY D 26 ? 0.3713 0.5917 0.2967 -0.0660 0.0182 0.0404 26 GLY D O 5131 N N . PHE D 27 ? 0.3142 0.5456 0.2728 -0.0198 0.0135 0.0440 27 PHE D N 5132 C CA . PHE D 27 ? 0.2933 0.4968 0.2452 -0.0120 0.0186 0.0390 27 PHE D CA 5133 C C . PHE D 27 ? 0.3390 0.5430 0.3082 0.0166 0.0196 0.0385 27 PHE D C 5134 O O . PHE D 27 ? 0.3966 0.6100 0.3792 0.0306 0.0157 0.0436 27 PHE D O 5135 C CB . PHE D 27 ? 0.2779 0.4264 0.2079 -0.0191 0.0169 0.0378 27 PHE D CB 5136 C CG . PHE D 27 ? 0.3357 0.4544 0.2688 -0.0050 0.0115 0.0394 27 PHE D CG 5137 C CD1 . PHE D 27 ? 0.3138 0.4278 0.2448 -0.0118 0.0067 0.0429 27 PHE D CD1 5138 C CD2 . PHE D 27 ? 0.3241 0.4197 0.2600 0.0120 0.0120 0.0364 27 PHE D CD2 5139 C CE1 . PHE D 27 ? 0.2777 0.3652 0.2103 -0.0006 0.0026 0.0442 27 PHE D CE1 5140 C CE2 . PHE D 27 ? 0.2853 0.3549 0.2228 0.0217 0.0080 0.0373 27 PHE D CE2 5141 C CZ . PHE D 27 ? 0.2597 0.3255 0.1960 0.0158 0.0034 0.0416 27 PHE D CZ 5142 N N . SER D 28 ? 0.3494 0.5403 0.3156 0.0244 0.0254 0.0323 28 SER D N 5143 C CA . SER D 28 ? 0.3904 0.5772 0.3694 0.0496 0.0294 0.0293 28 SER D CA 5144 C C . SER D 28 ? 0.3711 0.5083 0.3386 0.0555 0.0285 0.0249 28 SER D C 5145 O O . SER D 28 ? 0.2764 0.3912 0.2272 0.0435 0.0279 0.0215 28 SER D O 5146 C CB . SER D 28 ? 0.4341 0.6502 0.4201 0.0551 0.0391 0.0231 28 SER D CB 5147 O OG . SER D 28 ? 0.4814 0.6793 0.4722 0.0768 0.0454 0.0171 28 SER D OG 5148 N N . LEU D 29 ? 0.2922 0.4143 0.2682 0.0740 0.0289 0.0255 29 LEU D N 5149 C CA . LEU D 29 ? 0.3107 0.3901 0.2766 0.0776 0.0289 0.0202 29 LEU D CA 5150 C C . LEU D 29 ? 0.3695 0.4405 0.3262 0.0765 0.0359 0.0095 29 LEU D C 5151 O O . LEU D 29 ? 0.3431 0.3851 0.2881 0.0729 0.0349 0.0040 29 LEU D O 5152 C CB . LEU D 29 ? 0.3041 0.3675 0.2783 0.0963 0.0304 0.0225 29 LEU D CB 5153 C CG . LEU D 29 ? 0.3798 0.4407 0.3570 0.0949 0.0221 0.0328 29 LEU D CG 5154 C CD1 . LEU D 29 ? 0.4003 0.4393 0.3815 0.1128 0.0246 0.0361 29 LEU D CD1 5155 C CD2 . LEU D 29 ? 0.2717 0.3114 0.2356 0.0772 0.0155 0.0320 29 LEU D CD2 5156 N N . THR D 30 ? 0.3833 0.4836 0.3452 0.0786 0.0431 0.0061 30 THR D N 5157 C CA . THR D 30 ? 0.3994 0.4957 0.3505 0.0755 0.0506 -0.0046 30 THR D CA 5158 C C . THR D 30 ? 0.3413 0.4357 0.2746 0.0546 0.0460 -0.0035 30 THR D C 5159 O O . THR D 30 ? 0.3367 0.4253 0.2568 0.0493 0.0498 -0.0106 30 THR D O 5160 C CB . THR D 30 ? 0.3916 0.5202 0.3542 0.0866 0.0622 -0.0101 30 THR D CB 5161 O OG1 . THR D 30 ? 0.3509 0.5212 0.3216 0.0779 0.0608 -0.0036 30 THR D OG1 5162 C CG2 . THR D 30 ? 0.3785 0.5029 0.3566 0.1117 0.0682 -0.0103 30 THR D CG2 5163 N N . ASN D 31 ? 0.3805 0.4775 0.3111 0.0428 0.0386 0.0057 31 ASN D N 5164 C CA . ASN D 31 ? 0.4732 0.5616 0.3843 0.0249 0.0355 0.0088 31 ASN D CA 5165 C C . ASN D 31 ? 0.5674 0.6235 0.4676 0.0202 0.0269 0.0141 31 ASN D C 5166 O O . ASN D 31 ? 0.6006 0.6435 0.4832 0.0105 0.0248 0.0170 31 ASN D O 5167 C CB . ASN D 31 ? 0.4070 0.5224 0.3166 0.0104 0.0375 0.0136 31 ASN D CB 5168 C CG . ASN D 31 ? 0.4050 0.5583 0.3244 0.0133 0.0469 0.0080 31 ASN D CG 5169 O OD1 . ASN D 31 ? 0.4078 0.5957 0.3382 0.0086 0.0490 0.0107 31 ASN D OD1 5170 N ND2 . ASN D 31 ? 0.4236 0.5737 0.3391 0.0204 0.0531 -0.0006 31 ASN D ND2 5171 N N . TYR D 32 ? 0.5541 0.5985 0.4642 0.0279 0.0224 0.0161 32 TYR D N 5172 C CA . TYR D 32 ? 0.4630 0.4805 0.3651 0.0248 0.0156 0.0201 32 TYR D CA 5173 C C . TYR D 32 ? 0.4259 0.4277 0.3358 0.0358 0.0135 0.0165 32 TYR D C 5174 O O . TYR D 32 ? 0.4391 0.4467 0.3616 0.0455 0.0161 0.0148 32 TYR D O 5175 C CB . TYR D 32 ? 0.4022 0.4196 0.3034 0.0158 0.0126 0.0272 32 TYR D CB 5176 C CG . TYR D 32 ? 0.3681 0.3936 0.2565 0.0002 0.0155 0.0306 32 TYR D CG 5177 C CD1 . TYR D 32 ? 0.3292 0.3875 0.2247 -0.0053 0.0200 0.0299 32 TYR D CD1 5178 C CD2 . TYR D 32 ? 0.3245 0.3249 0.1928 -0.0088 0.0145 0.0350 32 TYR D CD2 5179 C CE1 . TYR D 32 ? 0.3777 0.4437 0.2595 -0.0232 0.0237 0.0322 32 TYR D CE1 5180 C CE2 . TYR D 32 ? 0.3605 0.3616 0.2128 -0.0249 0.0186 0.0386 32 TYR D CE2 5181 C CZ . TYR D 32 ? 0.3831 0.4171 0.2416 -0.0341 0.0234 0.0366 32 TYR D CZ 5182 O OH . TYR D 32 ? 0.4553 0.4913 0.2964 -0.0537 0.0287 0.0393 32 TYR D OH 5183 N N . GLY D 33 ? 0.4339 0.4168 0.3359 0.0344 0.0092 0.0159 33 GLY D N 5184 C CA . GLY D 33 ? 0.3477 0.3165 0.2557 0.0406 0.0073 0.0127 33 GLY D CA 5185 C C . GLY D 33 ? 0.3255 0.2892 0.2397 0.0405 0.0041 0.0189 33 GLY D C 5186 O O . GLY D 33 ? 0.3507 0.3166 0.2607 0.0337 0.0023 0.0246 33 GLY D O 5187 N N . VAL D 34 ? 0.3409 0.2958 0.2625 0.0464 0.0042 0.0175 34 VAL D N 5188 C CA . VAL D 34 ? 0.2865 0.2358 0.2112 0.0447 0.0007 0.0230 34 VAL D CA 5189 C C . VAL D 34 ? 0.3067 0.2398 0.2295 0.0440 -0.0013 0.0199 34 VAL D C 5190 O O . VAL D 34 ? 0.3270 0.2524 0.2507 0.0468 0.0010 0.0140 34 VAL D O 5191 C CB . VAL D 34 ? 0.3566 0.3139 0.2907 0.0515 0.0022 0.0272 34 VAL D CB 5192 C CG1 . VAL D 34 ? 0.3332 0.2831 0.2679 0.0489 -0.0013 0.0321 34 VAL D CG1 5193 C CG2 . VAL D 34 ? 0.3905 0.3734 0.3285 0.0504 0.0032 0.0310 34 VAL D CG2 5194 N N . HIS D 35 ? 0.2974 0.2255 0.2165 0.0392 -0.0045 0.0229 35 HIS D N 5195 C CA . HIS D 35 ? 0.3429 0.2623 0.2623 0.0388 -0.0062 0.0201 35 HIS D CA 5196 C C . HIS D 35 ? 0.3755 0.2887 0.2987 0.0375 -0.0060 0.0222 35 HIS D C 5197 O O . HIS D 35 ? 0.3472 0.2635 0.2710 0.0364 -0.0060 0.0271 35 HIS D O 5198 C CB . HIS D 35 ? 0.3612 0.2787 0.2744 0.0376 -0.0084 0.0224 35 HIS D CB 5199 C CG . HIS D 35 ? 0.3675 0.2903 0.2736 0.0385 -0.0093 0.0229 35 HIS D CG 5200 N ND1 . HIS D 35 ? 0.3454 0.2727 0.2488 0.0413 -0.0121 0.0219 35 HIS D ND1 5201 C CD2 . HIS D 35 ? 0.3177 0.2453 0.2182 0.0364 -0.0076 0.0249 35 HIS D CD2 5202 C CE1 . HIS D 35 ? 0.3118 0.2438 0.2065 0.0411 -0.0126 0.0241 35 HIS D CE1 5203 N NE2 . HIS D 35 ? 0.3063 0.2373 0.1987 0.0374 -0.0093 0.0254 35 HIS D NE2 5204 N N . TRP D 36 ? 0.2982 0.2059 0.2232 0.0363 -0.0060 0.0183 36 TRP D N 5205 C CA . TRP D 36 ? 0.2573 0.1591 0.1836 0.0334 -0.0053 0.0202 36 TRP D CA 5206 C C . TRP D 36 ? 0.4022 0.3051 0.3289 0.0308 -0.0058 0.0176 36 TRP D C 5207 O O . TRP D 36 ? 0.3663 0.2753 0.2954 0.0311 -0.0065 0.0127 36 TRP D O 5208 C CB . TRP D 36 ? 0.2813 0.1737 0.2085 0.0336 -0.0024 0.0186 36 TRP D CB 5209 C CG . TRP D 36 ? 0.3835 0.2745 0.3115 0.0402 -0.0008 0.0228 36 TRP D CG 5210 C CD1 . TRP D 36 ? 0.3041 0.1971 0.2326 0.0454 0.0014 0.0196 36 TRP D CD1 5211 C CD2 . TRP D 36 ? 0.3860 0.2773 0.3148 0.0439 -0.0010 0.0315 36 TRP D CD2 5212 N NE1 . TRP D 36 ? 0.2946 0.1891 0.2259 0.0538 0.0034 0.0253 36 TRP D NE1 5213 C CE2 . TRP D 36 ? 0.3091 0.2041 0.2410 0.0536 0.0013 0.0336 36 TRP D CE2 5214 C CE3 . TRP D 36 ? 0.3699 0.2614 0.2966 0.0402 -0.0028 0.0378 36 TRP D CE3 5215 C CZ2 . TRP D 36 ? 0.3585 0.2602 0.2935 0.0618 0.0010 0.0433 36 TRP D CZ2 5216 C CZ3 . TRP D 36 ? 0.4182 0.3157 0.3458 0.0461 -0.0038 0.0476 36 TRP D CZ3 5217 C CH2 . TRP D 36 ? 0.4359 0.3397 0.3686 0.0579 -0.0023 0.0509 36 TRP D CH2 5218 N N . VAL D 37 ? 0.4119 0.3118 0.3362 0.0281 -0.0051 0.0205 37 VAL D N 5219 C CA . VAL D 37 ? 0.3118 0.2122 0.2367 0.0277 -0.0036 0.0179 37 VAL D CA 5220 C C . VAL D 37 ? 0.4396 0.3365 0.3633 0.0213 -0.0011 0.0180 37 VAL D C 5221 O O . VAL D 37 ? 0.5073 0.4011 0.4270 0.0178 -0.0016 0.0226 37 VAL D O 5222 C CB . VAL D 37 ? 0.3076 0.2019 0.2256 0.0302 -0.0025 0.0202 37 VAL D CB 5223 C CG1 . VAL D 37 ? 0.2665 0.1581 0.1847 0.0328 0.0012 0.0175 37 VAL D CG1 5224 C CG2 . VAL D 37 ? 0.2888 0.1855 0.2051 0.0359 -0.0049 0.0220 37 VAL D CG2 5225 N N . ARG D 38 ? 0.4167 0.3179 0.3440 0.0197 0.0014 0.0135 38 ARG D N 5226 C CA . ARG D 38 ? 0.3360 0.2347 0.2602 0.0124 0.0047 0.0133 38 ARG D CA 5227 C C . ARG D 38 ? 0.3346 0.2362 0.2591 0.0136 0.0092 0.0089 38 ARG D C 5228 O O . ARG D 38 ? 0.4160 0.3231 0.3455 0.0223 0.0096 0.0066 38 ARG D O 5229 C CB . ARG D 38 ? 0.3141 0.2133 0.2402 0.0062 0.0059 0.0118 38 ARG D CB 5230 C CG . ARG D 38 ? 0.2778 0.1906 0.2118 0.0047 0.0078 0.0043 38 ARG D CG 5231 C CD . ARG D 38 ? 0.2954 0.2047 0.2272 -0.0060 0.0107 0.0022 38 ARG D CD 5232 N NE . ARG D 38 ? 0.3603 0.2896 0.3002 -0.0111 0.0131 -0.0060 38 ARG D NE 5233 C CZ . ARG D 38 ? 0.3837 0.3133 0.3214 -0.0241 0.0167 -0.0104 38 ARG D CZ 5234 N NH1 . ARG D 38 ? 0.4007 0.3050 0.3265 -0.0310 0.0190 -0.0063 38 ARG D NH1 5235 N NH2 . ARG D 38 ? 0.3699 0.3257 0.3167 -0.0300 0.0186 -0.0185 38 ARG D NH2 5236 N N . GLN D 39 ? 0.3728 0.2711 0.2911 0.0060 0.0132 0.0082 39 GLN D N 5237 C CA . GLN D 39 ? 0.2814 0.1794 0.1978 0.0070 0.0198 0.0028 39 GLN D CA 5238 C C . GLN D 39 ? 0.3574 0.2615 0.2723 -0.0028 0.0244 -0.0005 39 GLN D C 5239 O O . GLN D 39 ? 0.4194 0.3185 0.3246 -0.0128 0.0237 0.0034 39 GLN D O 5240 C CB . GLN D 39 ? 0.2914 0.1742 0.1949 0.0049 0.0219 0.0038 39 GLN D CB 5241 C CG . GLN D 39 ? 0.3752 0.2484 0.2743 0.0103 0.0303 -0.0021 39 GLN D CG 5242 C CD . GLN D 39 ? 0.4458 0.2980 0.3286 0.0059 0.0333 -0.0019 39 GLN D CD 5243 O OE1 . GLN D 39 ? 0.3994 0.2514 0.2742 -0.0053 0.0294 0.0017 39 GLN D OE1 5244 N NE2 . GLN D 39 ? 0.3405 0.1755 0.2177 0.0147 0.0410 -0.0055 39 GLN D NE2 5245 N N . SER D 40 ? 0.3541 0.2724 0.2786 0.0001 0.0290 -0.0069 40 SER D N 5246 C CA . SER D 40 ? 0.3395 0.2673 0.2634 -0.0108 0.0343 -0.0108 40 SER D CA 5247 C C . SER D 40 ? 0.3472 0.2866 0.2765 -0.0056 0.0434 -0.0193 40 SER D C 5248 O O . SER D 40 ? 0.2994 0.2424 0.2366 0.0095 0.0446 -0.0214 40 SER D O 5249 C CB . SER D 40 ? 0.2879 0.2278 0.2199 -0.0162 0.0318 -0.0111 40 SER D CB 5250 O OG . SER D 40 ? 0.2807 0.2430 0.2282 -0.0077 0.0321 -0.0167 40 SER D OG 5251 N N . PRO D 41 ? 0.3605 0.3062 0.2852 -0.0168 0.0504 -0.0238 41 PRO D N 5252 C CA . PRO D 41 ? 0.3366 0.2970 0.2682 -0.0110 0.0609 -0.0333 41 PRO D CA 5253 C C . PRO D 41 ? 0.3128 0.3031 0.2662 0.0004 0.0606 -0.0367 41 PRO D C 5254 O O . PRO D 41 ? 0.3563 0.3545 0.3189 0.0179 0.0651 -0.0401 41 PRO D O 5255 C CB . PRO D 41 ? 0.3493 0.3153 0.2718 -0.0293 0.0670 -0.0364 41 PRO D CB 5256 C CG . PRO D 41 ? 0.3388 0.2830 0.2431 -0.0409 0.0607 -0.0274 41 PRO D CG 5257 C CD . PRO D 41 ? 0.3343 0.2725 0.2449 -0.0341 0.0500 -0.0195 41 PRO D CD 5258 N N . GLY D 42 ? 0.3232 0.3297 0.2836 -0.0091 0.0555 -0.0355 42 GLY D N 5259 C CA . GLY D 42 ? 0.3165 0.3592 0.2968 -0.0032 0.0548 -0.0398 42 GLY D CA 5260 C C . GLY D 42 ? 0.3838 0.4327 0.3742 0.0156 0.0475 -0.0359 42 GLY D C 5261 O O . GLY D 42 ? 0.4257 0.5063 0.4329 0.0292 0.0487 -0.0386 42 GLY D O 5262 N N . LYS D 43 ? 0.3611 0.3831 0.3414 0.0171 0.0399 -0.0288 43 LYS D N 5263 C CA . LYS D 43 ? 0.4457 0.4749 0.4333 0.0312 0.0324 -0.0245 43 LYS D CA 5264 C C . LYS D 43 ? 0.3754 0.3746 0.3526 0.0446 0.0310 -0.0181 43 LYS D C 5265 O O . LYS D 43 ? 0.4361 0.4377 0.4159 0.0557 0.0249 -0.0131 43 LYS D O 5266 C CB . LYS D 43 ? 0.5322 0.5645 0.5189 0.0193 0.0246 -0.0233 43 LYS D CB 5267 C CG . LYS D 43 ? 0.5837 0.6485 0.5802 0.0052 0.0259 -0.0306 43 LYS D CG 5268 C CD . LYS D 43 ? 0.6477 0.7574 0.6631 0.0170 0.0236 -0.0332 43 LYS D CD 5269 C CE . LYS D 43 ? 0.7077 0.8198 0.7234 0.0265 0.0140 -0.0281 43 LYS D CE 5270 N NZ . LYS D 43 ? 0.6832 0.8013 0.6951 0.0081 0.0096 -0.0323 43 LYS D NZ 5271 N N . GLY D 44 ? 0.3924 0.3647 0.3562 0.0415 0.0370 -0.0185 44 GLY D N 5272 C CA . GLY D 44 ? 0.2986 0.2403 0.2491 0.0487 0.0370 -0.0137 44 GLY D CA 5273 C C . GLY D 44 ? 0.3081 0.2392 0.2530 0.0436 0.0277 -0.0071 44 GLY D C 5274 O O . GLY D 44 ? 0.3083 0.2434 0.2533 0.0313 0.0234 -0.0065 44 GLY D O 5275 N N . LEU D 45 ? 0.2950 0.2112 0.2339 0.0537 0.0257 -0.0019 45 LEU D N 5276 C CA . LEU D 45 ? 0.3011 0.2113 0.2359 0.0507 0.0178 0.0038 45 LEU D CA 5277 C C . LEU D 45 ? 0.3433 0.2781 0.2901 0.0545 0.0108 0.0046 45 LEU D C 5278 O O . LEU D 45 ? 0.3407 0.2920 0.2955 0.0673 0.0099 0.0056 45 LEU D O 5279 C CB . LEU D 45 ? 0.3628 0.2491 0.2848 0.0577 0.0193 0.0088 45 LEU D CB 5280 C CG . LEU D 45 ? 0.3706 0.2308 0.2762 0.0477 0.0255 0.0072 45 LEU D CG 5281 C CD1 . LEU D 45 ? 0.3638 0.1965 0.2550 0.0557 0.0310 0.0102 45 LEU D CD1 5282 C CD2 . LEU D 45 ? 0.3038 0.1642 0.2047 0.0332 0.0202 0.0096 45 LEU D CD2 5283 N N . GLU D 46 ? 0.3163 0.2536 0.2632 0.0437 0.0063 0.0041 46 GLU D N 5284 C CA . GLU D 46 ? 0.3598 0.3156 0.3135 0.0429 0.0007 0.0029 46 GLU D CA 5285 C C . GLU D 46 ? 0.3840 0.3266 0.3300 0.0397 -0.0031 0.0061 46 GLU D C 5286 O O . GLU D 46 ? 0.3455 0.2728 0.2857 0.0327 -0.0019 0.0073 46 GLU D O 5287 C CB . GLU D 46 ? 0.3004 0.2701 0.2601 0.0306 0.0019 -0.0037 46 GLU D CB 5288 C CG . GLU D 46 ? 0.3831 0.3769 0.3536 0.0309 0.0056 -0.0088 46 GLU D CG 5289 C CD . GLU D 46 ? 0.4273 0.4302 0.3997 0.0138 0.0079 -0.0153 46 GLU D CD 5290 O OE1 . GLU D 46 ? 0.3941 0.3766 0.3579 0.0040 0.0116 -0.0146 46 GLU D OE1 5291 O OE2 . GLU D 46 ? 0.4119 0.4420 0.3922 0.0088 0.0060 -0.0206 46 GLU D OE2 5292 N N . TRP D 47 ? 0.3220 0.2741 0.2683 0.0452 -0.0076 0.0077 47 TRP D N 5293 C CA . TRP D 47 ? 0.2546 0.1991 0.1947 0.0419 -0.0101 0.0088 47 TRP D CA 5294 C C . TRP D 47 ? 0.3061 0.2571 0.2488 0.0319 -0.0100 0.0017 47 TRP D C 5295 O O . TRP D 47 ? 0.3635 0.3351 0.3116 0.0287 -0.0114 -0.0036 47 TRP D O 5296 C CB . TRP D 47 ? 0.3544 0.3060 0.2907 0.0503 -0.0141 0.0132 47 TRP D CB 5297 C CG . TRP D 47 ? 0.2946 0.2425 0.2244 0.0468 -0.0157 0.0131 47 TRP D CG 5298 C CD1 . TRP D 47 ? 0.3212 0.2535 0.2436 0.0459 -0.0142 0.0170 47 TRP D CD1 5299 C CD2 . TRP D 47 ? 0.3083 0.2713 0.2381 0.0426 -0.0184 0.0079 47 TRP D CD2 5300 N NE1 . TRP D 47 ? 0.3091 0.2460 0.2281 0.0434 -0.0152 0.0147 47 TRP D NE1 5301 C CE2 . TRP D 47 ? 0.3064 0.2596 0.2284 0.0411 -0.0174 0.0087 47 TRP D CE2 5302 C CE3 . TRP D 47 ? 0.3136 0.2999 0.2483 0.0384 -0.0209 0.0016 47 TRP D CE3 5303 C CZ2 . TRP D 47 ? 0.3338 0.2958 0.2517 0.0364 -0.0180 0.0028 47 TRP D CZ2 5304 C CZ3 . TRP D 47 ? 0.3060 0.3015 0.2353 0.0316 -0.0221 -0.0044 47 TRP D CZ3 5305 C CH2 . TRP D 47 ? 0.2713 0.2526 0.1918 0.0311 -0.0202 -0.0041 47 TRP D CH2 5306 N N . LEU D 48 ? 0.3252 0.2590 0.2632 0.0269 -0.0076 0.0016 48 LEU D N 5307 C CA . LEU D 48 ? 0.3465 0.2759 0.2830 0.0178 -0.0049 -0.0049 48 LEU D CA 5308 C C . LEU D 48 ? 0.3918 0.3208 0.3235 0.0172 -0.0052 -0.0089 48 LEU D C 5309 O O . LEU D 48 ? 0.4002 0.3363 0.3302 0.0087 -0.0040 -0.0174 48 LEU D O 5310 C CB . LEU D 48 ? 0.3647 0.2730 0.2974 0.0151 -0.0009 -0.0014 48 LEU D CB 5311 C CG . LEU D 48 ? 0.3234 0.2317 0.2579 0.0128 0.0003 0.0015 48 LEU D CG 5312 C CD1 . LEU D 48 ? 0.3216 0.2112 0.2499 0.0096 0.0033 0.0064 48 LEU D CD1 5313 C CD2 . LEU D 48 ? 0.2666 0.1913 0.2065 0.0057 0.0017 -0.0054 48 LEU D CD2 5314 N N . GLY D 49 ? 0.3018 0.2243 0.2304 0.0242 -0.0059 -0.0040 49 GLY D N 5315 C CA . GLY D 49 ? 0.3115 0.2339 0.2348 0.0240 -0.0049 -0.0083 49 GLY D CA 5316 C C . GLY D 49 ? 0.3696 0.2877 0.2907 0.0312 -0.0046 -0.0024 49 GLY D C 5317 O O . GLY D 49 ? 0.4238 0.3400 0.3467 0.0349 -0.0060 0.0053 49 GLY D O 5318 N N . VAL D 50 ? 0.3503 0.2683 0.2668 0.0313 -0.0019 -0.0072 50 VAL D N 5319 C CA . VAL D 50 ? 0.2978 0.2179 0.2127 0.0368 -0.0007 -0.0032 50 VAL D CA 5320 C C . VAL D 50 ? 0.3228 0.2364 0.2344 0.0381 0.0062 -0.0107 50 VAL D C 5321 O O . VAL D 50 ? 0.3634 0.2728 0.2693 0.0322 0.0093 -0.0207 50 VAL D O 5322 C CB . VAL D 50 ? 0.3639 0.2982 0.2737 0.0365 -0.0053 0.0002 50 VAL D CB 5323 C CG1 . VAL D 50 ? 0.2825 0.2278 0.1864 0.0317 -0.0068 -0.0072 50 VAL D CG1 5324 C CG2 . VAL D 50 ? 0.3157 0.2535 0.2224 0.0389 -0.0033 0.0044 50 VAL D CG2 5325 N N . ILE D 51 ? 0.3186 0.2324 0.2334 0.0455 0.0096 -0.0067 51 ILE D N 5326 C CA . ILE D 51 ? 0.3785 0.2905 0.2906 0.0497 0.0172 -0.0134 51 ILE D CA 5327 C C . ILE D 51 ? 0.3931 0.3250 0.3042 0.0503 0.0162 -0.0105 51 ILE D C 5328 O O . ILE D 51 ? 0.4357 0.3780 0.3516 0.0519 0.0131 -0.0015 51 ILE D O 5329 C CB . ILE D 51 ? 0.4315 0.3288 0.3489 0.0604 0.0239 -0.0114 51 ILE D CB 5330 C CG1 . ILE D 51 ? 0.4651 0.3565 0.3788 0.0671 0.0344 -0.0203 51 ILE D CG1 5331 C CG2 . ILE D 51 ? 0.3483 0.2592 0.2757 0.0673 0.0200 0.0012 51 ILE D CG2 5332 C CD1 . ILE D 51 ? 0.4166 0.2868 0.3334 0.0809 0.0427 -0.0182 51 ILE D CD1 5333 N N . TRP D 52 ? 0.3544 0.2922 0.2568 0.0463 0.0191 -0.0186 52 TRP D N 5334 C CA . TRP D 52 ? 0.3582 0.3142 0.2560 0.0440 0.0184 -0.0156 52 TRP D CA 5335 C C . TRP D 52 ? 0.4226 0.3876 0.3254 0.0512 0.0269 -0.0179 52 TRP D C 5336 O O . TRP D 52 ? 0.4278 0.3824 0.3362 0.0601 0.0341 -0.0228 52 TRP D O 5337 C CB . TRP D 52 ? 0.3969 0.3594 0.2813 0.0354 0.0167 -0.0219 52 TRP D CB 5338 C CG . TRP D 52 ? 0.3933 0.3560 0.2747 0.0306 0.0077 -0.0183 52 TRP D CG 5339 C CD1 . TRP D 52 ? 0.3617 0.3216 0.2412 0.0255 0.0064 -0.0259 52 TRP D CD1 5340 C CD2 . TRP D 52 ? 0.4735 0.4406 0.3536 0.0309 0.0000 -0.0063 52 TRP D CD2 5341 N NE1 . TRP D 52 ? 0.3985 0.3668 0.2786 0.0243 -0.0025 -0.0189 52 TRP D NE1 5342 C CE2 . TRP D 52 ? 0.4552 0.4249 0.3351 0.0291 -0.0060 -0.0066 52 TRP D CE2 5343 C CE3 . TRP D 52 ? 0.4906 0.4583 0.3684 0.0318 -0.0012 0.0041 52 TRP D CE3 5344 C CZ2 . TRP D 52 ? 0.4716 0.4439 0.3504 0.0322 -0.0128 0.0039 52 TRP D CZ2 5345 C CZ3 . TRP D 52 ? 0.4998 0.4635 0.3730 0.0325 -0.0071 0.0138 52 TRP D CZ3 5346 C CH2 . TRP D 52 ? 0.4714 0.4370 0.3458 0.0347 -0.0127 0.0140 52 TRP D CH2 5347 N N . SER D 53 ? 0.4174 0.4014 0.3175 0.0476 0.0268 -0.0138 53 SER D N 5348 C CA . SER D 53 ? 0.3937 0.3957 0.2997 0.0530 0.0349 -0.0158 53 SER D CA 5349 C C . SER D 53 ? 0.4106 0.4049 0.3179 0.0624 0.0458 -0.0279 53 SER D C 5350 O O . SER D 53 ? 0.3973 0.3943 0.3171 0.0760 0.0521 -0.0273 53 SER D O 5351 C CB . SER D 53 ? 0.4365 0.4568 0.3315 0.0427 0.0354 -0.0147 53 SER D CB 5352 O OG . SER D 53 ? 0.5527 0.5738 0.4431 0.0341 0.0277 -0.0035 53 SER D OG 5353 N N . GLY D 54 ? 0.4131 0.3976 0.3063 0.0553 0.0485 -0.0388 54 GLY D N 5354 C CA . GLY D 54 ? 0.3711 0.3441 0.2599 0.0607 0.0612 -0.0534 54 GLY D CA 5355 C C . GLY D 54 ? 0.4308 0.3711 0.3187 0.0651 0.0652 -0.0596 54 GLY D C 5356 O O . GLY D 54 ? 0.4999 0.4225 0.3788 0.0665 0.0769 -0.0736 54 GLY D O 5357 N N . GLY D 55 ? 0.3722 0.3021 0.2668 0.0659 0.0569 -0.0501 55 GLY D N 5358 C CA . GLY D 55 ? 0.4086 0.3064 0.3018 0.0699 0.0616 -0.0539 55 GLY D CA 5359 C C . GLY D 55 ? 0.4351 0.3183 0.3174 0.0543 0.0571 -0.0601 55 GLY D C 5360 O O . GLY D 55 ? 0.5292 0.3861 0.4099 0.0548 0.0601 -0.0613 55 GLY D O 5361 N N . ASN D 56 ? 0.3851 0.2867 0.2591 0.0406 0.0503 -0.0634 56 ASN D N 5362 C CA . ASN D 56 ? 0.4524 0.3521 0.3187 0.0258 0.0443 -0.0681 56 ASN D CA 5363 C C . ASN D 56 ? 0.4800 0.3782 0.3571 0.0275 0.0351 -0.0560 56 ASN D C 5364 O O . ASN D 56 ? 0.4138 0.3194 0.3020 0.0368 0.0303 -0.0431 56 ASN D O 5365 C CB . ASN D 56 ? 0.4873 0.4150 0.3448 0.0148 0.0366 -0.0693 56 ASN D CB 5366 C CG . ASN D 56 ? 0.5310 0.4604 0.3722 0.0060 0.0455 -0.0854 56 ASN D CG 5367 O OD1 . ASN D 56 ? 0.5584 0.4633 0.3924 0.0048 0.0581 -0.0990 56 ASN D OD1 5368 N ND2 . ASN D 56 ? 0.4960 0.4517 0.3286 -0.0005 0.0399 -0.0839 56 ASN D ND2 5369 N N . THR D 57 ? 0.3718 0.2626 0.2450 0.0167 0.0333 -0.0612 57 THR D N 5370 C CA . THR D 57 ? 0.3540 0.2465 0.2367 0.0168 0.0255 -0.0514 57 THR D CA 5371 C C . THR D 57 ? 0.4222 0.3356 0.3028 0.0042 0.0175 -0.0543 57 THR D C 5372 O O . THR D 57 ? 0.4277 0.3455 0.2979 -0.0088 0.0200 -0.0668 57 THR D O 5373 C CB . THR D 57 ? 0.4141 0.2761 0.2972 0.0185 0.0324 -0.0521 57 THR D CB 5374 O OG1 . THR D 57 ? 0.5059 0.3483 0.3751 0.0064 0.0417 -0.0674 57 THR D OG1 5375 C CG2 . THR D 57 ? 0.3714 0.2198 0.2603 0.0355 0.0379 -0.0445 57 THR D CG2 5376 N N . ASP D 58 ? 0.4021 0.3301 0.2922 0.0083 0.0083 -0.0429 58 ASP D N 5377 C CA . ASP D 58 ? 0.4074 0.3570 0.3000 0.0008 0.0010 -0.0433 58 ASP D CA 5378 C C . ASP D 58 ? 0.4973 0.4374 0.3991 0.0018 0.0008 -0.0387 58 ASP D C 5379 O O . ASP D 58 ? 0.4799 0.4083 0.3875 0.0115 0.0007 -0.0292 58 ASP D O 5380 C CB . ASP D 58 ? 0.4355 0.4095 0.3302 0.0079 -0.0083 -0.0328 58 ASP D CB 5381 C CG . ASP D 58 ? 0.4918 0.4797 0.3752 0.0054 -0.0093 -0.0358 58 ASP D CG 5382 O OD1 . ASP D 58 ? 0.4868 0.4824 0.3614 -0.0065 -0.0067 -0.0482 58 ASP D OD1 5383 O OD2 . ASP D 58 ? 0.5349 0.5259 0.4161 0.0135 -0.0121 -0.0259 58 ASP D OD2 5384 N N . TYR D 59 ? 0.4174 0.3654 0.3196 -0.0102 0.0008 -0.0458 59 TYR D N 5385 C CA . TYR D 59 ? 0.3931 0.3370 0.3033 -0.0109 0.0007 -0.0418 59 TYR D CA 5386 C C . TYR D 59 ? 0.4131 0.3924 0.3321 -0.0135 -0.0065 -0.0409 59 TYR D C 5387 O O . TYR D 59 ? 0.3082 0.3136 0.2249 -0.0226 -0.0095 -0.0481 59 TYR D O 5388 C CB . TYR D 59 ? 0.4056 0.3235 0.3083 -0.0234 0.0099 -0.0504 59 TYR D CB 5389 C CG . TYR D 59 ? 0.4779 0.3598 0.3717 -0.0178 0.0185 -0.0511 59 TYR D CG 5390 C CD1 . TYR D 59 ? 0.4727 0.3441 0.3718 -0.0015 0.0177 -0.0394 59 TYR D CD1 5391 C CD2 . TYR D 59 ? 0.4517 0.3116 0.3312 -0.0287 0.0282 -0.0639 59 TYR D CD2 5392 C CE1 . TYR D 59 ? 0.4062 0.2510 0.2997 0.0067 0.0255 -0.0389 59 TYR D CE1 5393 C CE2 . TYR D 59 ? 0.4466 0.2724 0.3184 -0.0198 0.0376 -0.0641 59 TYR D CE2 5394 C CZ . TYR D 59 ? 0.4114 0.2325 0.2919 -0.0005 0.0357 -0.0508 59 TYR D CZ 5395 O OH . TYR D 59 ? 0.4442 0.2377 0.3195 0.0112 0.0449 -0.0501 59 TYR D OH 5396 N N . ASN D 60 ? 0.3465 0.3289 0.2752 -0.0053 -0.0090 -0.0323 60 ASN D N 5397 C CA . ASN D 60 ? 0.3450 0.3608 0.2840 -0.0049 -0.0140 -0.0315 60 ASN D CA 5398 C C . ASN D 60 ? 0.3335 0.3631 0.2726 -0.0239 -0.0107 -0.0434 60 ASN D C 5399 O O . ASN D 60 ? 0.3810 0.3843 0.3141 -0.0345 -0.0033 -0.0483 60 ASN D O 5400 C CB . ASN D 60 ? 0.2688 0.2798 0.2162 0.0062 -0.0141 -0.0226 60 ASN D CB 5401 C CG . ASN D 60 ? 0.3216 0.3665 0.2800 0.0154 -0.0191 -0.0187 60 ASN D CG 5402 O OD1 . ASN D 60 ? 0.2662 0.3447 0.2282 0.0118 -0.0235 -0.0225 60 ASN D OD1 5403 N ND2 . ASN D 60 ? 0.2841 0.3212 0.2471 0.0277 -0.0181 -0.0111 60 ASN D ND2 5404 N N . THR D 61 ? 0.3530 0.4245 0.2975 -0.0289 -0.0161 -0.0475 61 THR D N 5405 C CA . THR D 61 ? 0.4340 0.5266 0.3768 -0.0515 -0.0134 -0.0610 61 THR D CA 5406 C C . THR D 61 ? 0.4658 0.5401 0.4080 -0.0656 -0.0048 -0.0663 61 THR D C 5407 O O . THR D 61 ? 0.4770 0.5284 0.4055 -0.0848 0.0030 -0.0769 61 THR D O 5408 C CB . THR D 61 ? 0.4172 0.5708 0.3719 -0.0513 -0.0223 -0.0613 61 THR D CB 5409 O OG1 . THR D 61 ? 0.4265 0.5937 0.3757 -0.0430 -0.0295 -0.0572 61 THR D OG1 5410 C CG2 . THR D 61 ? 0.3680 0.5497 0.3210 -0.0788 -0.0194 -0.0765 61 THR D CG2 5411 N N . PRO D 62 ? 0.4953 0.5751 0.4496 -0.0563 -0.0049 -0.0591 62 PRO D N 5412 C CA . PRO D 62 ? 0.4598 0.5227 0.4110 -0.0713 0.0036 -0.0636 62 PRO D CA 5413 C C . PRO D 62 ? 0.4587 0.4640 0.3935 -0.0747 0.0116 -0.0619 62 PRO D C 5414 O O . PRO D 62 ? 0.5371 0.5254 0.4664 -0.0869 0.0187 -0.0636 62 PRO D O 5415 C CB . PRO D 62 ? 0.4372 0.5171 0.4037 -0.0573 0.0020 -0.0554 62 PRO D CB 5416 C CG . PRO D 62 ? 0.4384 0.5182 0.4098 -0.0328 -0.0049 -0.0446 62 PRO D CG 5417 C CD . PRO D 62 ? 0.4654 0.5642 0.4337 -0.0336 -0.0109 -0.0476 62 PRO D CD 5418 N N . PHE D 63 ? 0.4346 0.4125 0.3617 -0.0634 0.0109 -0.0576 63 PHE D N 5419 C CA . PHE D 63 ? 0.3426 0.2716 0.2571 -0.0616 0.0179 -0.0536 63 PHE D CA 5420 C C . PHE D 63 ? 0.5357 0.4383 0.4348 -0.0681 0.0238 -0.0617 63 PHE D C 5421 O O . PHE D 63 ? 0.5825 0.4430 0.4700 -0.0654 0.0312 -0.0590 63 PHE D O 5422 C CB . PHE D 63 ? 0.4077 0.3260 0.3278 -0.0401 0.0137 -0.0400 63 PHE D CB 5423 C CG . PHE D 63 ? 0.3984 0.3356 0.3301 -0.0339 0.0103 -0.0335 63 PHE D CG 5424 C CD1 . PHE D 63 ? 0.4076 0.3300 0.3363 -0.0390 0.0149 -0.0300 63 PHE D CD1 5425 C CD2 . PHE D 63 ? 0.3935 0.3611 0.3369 -0.0230 0.0035 -0.0309 63 PHE D CD2 5426 C CE1 . PHE D 63 ? 0.3983 0.3375 0.3359 -0.0345 0.0134 -0.0261 63 PHE D CE1 5427 C CE2 . PHE D 63 ? 0.3861 0.3667 0.3384 -0.0165 0.0027 -0.0264 63 PHE D CE2 5428 C CZ . PHE D 63 ? 0.2805 0.2478 0.2302 -0.0229 0.0080 -0.0251 63 PHE D CZ 5429 N N . THR D 64 ? 0.4772 0.4055 0.3755 -0.0764 0.0211 -0.0716 64 THR D N 5430 C CA . THR D 64 ? 0.4808 0.3882 0.3642 -0.0812 0.0265 -0.0806 64 THR D CA 5431 C C . THR D 64 ? 0.5036 0.3630 0.3674 -0.0956 0.0405 -0.0888 64 THR D C 5432 O O . THR D 64 ? 0.5532 0.3759 0.4054 -0.0884 0.0478 -0.0899 64 THR D O 5433 C CB . THR D 64 ? 0.5945 0.5427 0.4775 -0.0927 0.0213 -0.0914 64 THR D CB 5434 O OG1 . THR D 64 ? 0.6421 0.6231 0.5292 -0.1123 0.0201 -0.0990 64 THR D OG1 5435 C CG2 . THR D 64 ? 0.6088 0.5902 0.5050 -0.0734 0.0093 -0.0809 64 THR D CG2 5436 N N . SER D 65 ? 0.5541 0.4122 0.4136 -0.1148 0.0451 -0.0938 65 SER D N 5437 C CA A SER D 65 ? 0.6350 0.4434 0.4716 -0.1319 0.0598 -0.1019 65 SER D CA 5438 C CA B SER D 65 ? 0.6346 0.4435 0.4714 -0.1322 0.0598 -0.1019 65 SER D CA 5439 C C . SER D 65 ? 0.7113 0.4743 0.5427 -0.1189 0.0655 -0.0879 65 SER D C 5440 O O . SER D 65 ? 0.7906 0.5042 0.6009 -0.1288 0.0784 -0.0909 65 SER D O 5441 C CB A SER D 65 ? 0.6443 0.4719 0.4745 -0.1641 0.0639 -0.1155 65 SER D CB 5442 C CB B SER D 65 ? 0.6351 0.4645 0.4670 -0.1632 0.0633 -0.1141 65 SER D CB 5443 O OG A SER D 65 ? 0.6618 0.5262 0.4910 -0.1792 0.0607 -0.1302 65 SER D OG 5444 O OG B SER D 65 ? 0.6268 0.4751 0.4720 -0.1616 0.0592 -0.1046 65 SER D OG 5445 N N . ARG D 66 ? 0.7116 0.4896 0.5598 -0.0973 0.0563 -0.0722 66 ARG D N 5446 C CA . ARG D 66 ? 0.7121 0.4536 0.5548 -0.0858 0.0603 -0.0580 66 ARG D CA 5447 C C . ARG D 66 ? 0.6075 0.3499 0.4612 -0.0579 0.0536 -0.0437 66 ARG D C 5448 O O . ARG D 66 ? 0.5092 0.2331 0.3612 -0.0472 0.0541 -0.0302 66 ARG D O 5449 C CB . ARG D 66 ? 0.6582 0.4112 0.5038 -0.0969 0.0593 -0.0534 66 ARG D CB 5450 C CG . ARG D 66 ? 0.5114 0.3139 0.3796 -0.0886 0.0474 -0.0482 66 ARG D CG 5451 C CD . ARG D 66 ? 0.5396 0.3524 0.4077 -0.1044 0.0502 -0.0481 66 ARG D CD 5452 N NE . ARG D 66 ? 0.5058 0.3602 0.3935 -0.0955 0.0416 -0.0436 66 ARG D NE 5453 C CZ . ARG D 66 ? 0.5343 0.3847 0.4238 -0.0882 0.0406 -0.0328 66 ARG D CZ 5454 N NH1 . ARG D 66 ? 0.5227 0.3334 0.3964 -0.0881 0.0459 -0.0236 66 ARG D NH1 5455 N NH2 . ARG D 66 ? 0.4913 0.3768 0.3970 -0.0805 0.0347 -0.0312 66 ARG D NH2 5456 N N . LEU D 67 ? 0.5485 0.3136 0.4116 -0.0478 0.0477 -0.0465 67 LEU D N 5457 C CA . LEU D 67 ? 0.5441 0.3167 0.4180 -0.0250 0.0413 -0.0344 67 LEU D CA 5458 C C . LEU D 67 ? 0.5687 0.3248 0.4374 -0.0140 0.0463 -0.0376 67 LEU D C 5459 O O . LEU D 67 ? 0.7256 0.4865 0.5890 -0.0225 0.0490 -0.0506 67 LEU D O 5460 C CB . LEU D 67 ? 0.5429 0.3598 0.4332 -0.0216 0.0297 -0.0325 67 LEU D CB 5461 C CG . LEU D 67 ? 0.5771 0.4053 0.4775 -0.0033 0.0230 -0.0208 67 LEU D CG 5462 C CD1 . LEU D 67 ? 0.6374 0.4493 0.5368 0.0033 0.0240 -0.0086 67 LEU D CD1 5463 C CD2 . LEU D 67 ? 0.5680 0.4310 0.4799 -0.0026 0.0142 -0.0198 67 LEU D CD2 5464 N N . SER D 68 ? 0.5041 0.2440 0.3743 0.0048 0.0479 -0.0260 68 SER D N 5465 C CA . SER D 68 ? 0.5578 0.2882 0.4266 0.0189 0.0530 -0.0280 68 SER D CA 5466 C C . SER D 68 ? 0.6047 0.3587 0.4883 0.0376 0.0454 -0.0149 68 SER D C 5467 O O . SER D 68 ? 0.6240 0.3790 0.5123 0.0453 0.0415 -0.0014 68 SER D O 5468 C CB . SER D 68 ? 0.6784 0.3599 0.5314 0.0251 0.0669 -0.0282 68 SER D CB 5469 O OG . SER D 68 ? 0.8759 0.5319 0.7114 0.0042 0.0763 -0.0432 68 SER D OG 5470 N N . ILE D 69 ? 0.5373 0.3117 0.4265 0.0427 0.0435 -0.0193 69 ILE D N 5471 C CA . ILE D 69 ? 0.3786 0.1770 0.2803 0.0570 0.0376 -0.0088 69 ILE D CA 5472 C C . ILE D 69 ? 0.3946 0.1881 0.2957 0.0701 0.0457 -0.0125 69 ILE D C 5473 O O . ILE D 69 ? 0.5007 0.2940 0.3955 0.0641 0.0502 -0.0254 69 ILE D O 5474 C CB . ILE D 69 ? 0.4186 0.2508 0.3279 0.0500 0.0272 -0.0087 69 ILE D CB 5475 C CG1 . ILE D 69 ? 0.3333 0.1700 0.2441 0.0400 0.0211 -0.0054 69 ILE D CG1 5476 C CG2 . ILE D 69 ? 0.3659 0.2209 0.2848 0.0605 0.0228 0.0005 69 ILE D CG2 5477 C CD1 . ILE D 69 ? 0.3081 0.1718 0.2247 0.0358 0.0126 -0.0045 69 ILE D CD1 5478 N N . ASN D 70 ? 0.5139 0.3059 0.4214 0.0881 0.0479 -0.0013 70 ASN D N 5479 C CA . ASN D 70 ? 0.5664 0.3608 0.4775 0.1046 0.0559 -0.0030 70 ASN D CA 5480 C C . ASN D 70 ? 0.5438 0.3756 0.4712 0.1168 0.0489 0.0098 70 ASN D C 5481 O O . ASN D 70 ? 0.5296 0.3785 0.4627 0.1122 0.0389 0.0201 70 ASN D O 5482 C CB . ASN D 70 ? 0.6419 0.3955 0.5441 0.1190 0.0690 -0.0022 70 ASN D CB 5483 C CG . ASN D 70 ? 0.7606 0.4741 0.6432 0.1047 0.0793 -0.0181 70 ASN D CG 5484 O OD1 . ASN D 70 ? 0.8882 0.5960 0.7636 0.1013 0.0876 -0.0331 70 ASN D OD1 5485 N ND2 . ASN D 70 ? 0.6613 0.3480 0.5334 0.0939 0.0795 -0.0159 70 ASN D ND2 5486 N N . LYS D 71 ? 0.4695 0.3153 0.4037 0.1310 0.0552 0.0084 71 LYS D N 5487 C CA . LYS D 71 ? 0.4382 0.3256 0.3886 0.1406 0.0494 0.0196 71 LYS D CA 5488 C C . LYS D 71 ? 0.4349 0.3319 0.3943 0.1639 0.0593 0.0212 71 LYS D C 5489 O O . LYS D 71 ? 0.5074 0.3758 0.4591 0.1727 0.0721 0.0116 71 LYS D O 5490 C CB . LYS D 71 ? 0.4554 0.3744 0.4083 0.1244 0.0419 0.0155 71 LYS D CB 5491 C CG . LYS D 71 ? 0.4374 0.3603 0.3857 0.1215 0.0492 0.0020 71 LYS D CG 5492 C CD . LYS D 71 ? 0.3312 0.2775 0.2773 0.1042 0.0412 0.0004 71 LYS D CD 5493 C CE . LYS D 71 ? 0.3621 0.3114 0.2997 0.0987 0.0475 -0.0123 71 LYS D CE 5494 N NZ . LYS D 71 ? 0.3322 0.3171 0.2749 0.0958 0.0465 -0.0097 71 LYS D NZ 5495 N N . ASP D 72 ? 0.4765 0.4157 0.4522 0.1735 0.0540 0.0329 72 ASP D N 5496 C CA . ASP D 72 ? 0.5009 0.4638 0.4898 0.1963 0.0623 0.0352 72 ASP D CA 5497 C C . ASP D 72 ? 0.4887 0.5077 0.4905 0.1871 0.0558 0.0364 72 ASP D C 5498 O O . ASP D 72 ? 0.4247 0.4758 0.4349 0.1820 0.0452 0.0480 72 ASP D O 5499 C CB . ASP D 72 ? 0.5609 0.5239 0.5580 0.2209 0.0626 0.0523 72 ASP D CB 5500 C CG . ASP D 72 ? 0.6649 0.6493 0.6766 0.2502 0.0733 0.0550 72 ASP D CG 5501 O OD1 . ASP D 72 ? 0.6539 0.6860 0.6794 0.2492 0.0734 0.0513 72 ASP D OD1 5502 O OD2 . ASP D 72 ? 0.7270 0.6815 0.7348 0.2640 0.0796 0.0590 72 ASP D OD2 5503 N N . ASN D 73 ? 0.5163 0.5458 0.5171 0.1826 0.0628 0.0238 73 ASN D N 5504 C CA . ASN D 73 ? 0.4649 0.5423 0.4733 0.1695 0.0584 0.0233 73 ASN D CA 5505 C C . ASN D 73 ? 0.4325 0.5635 0.4623 0.1831 0.0568 0.0349 73 ASN D C 5506 O O . ASN D 73 ? 0.4029 0.5711 0.4377 0.1677 0.0477 0.0409 73 ASN D O 5507 C CB . ASN D 73 ? 0.4375 0.5147 0.4387 0.1636 0.0681 0.0079 73 ASN D CB 5508 C CG . ASN D 73 ? 0.4576 0.4957 0.4381 0.1455 0.0668 -0.0026 73 ASN D CG 5509 O OD1 . ASN D 73 ? 0.4392 0.4686 0.4124 0.1290 0.0560 0.0015 73 ASN D OD1 5510 N ND2 . ASN D 73 ? 0.3749 0.3910 0.3454 0.1485 0.0782 -0.0166 73 ASN D ND2 5511 N N . SER D 74 ? 0.4750 0.6100 0.5164 0.2120 0.0663 0.0380 74 SER D N 5512 C CA . SER D 74 ? 0.4604 0.6533 0.5251 0.2296 0.0652 0.0499 74 SER D CA 5513 C C . SER D 74 ? 0.4101 0.6210 0.4799 0.2273 0.0511 0.0671 74 SER D C 5514 O O . SER D 74 ? 0.4106 0.6806 0.4952 0.2232 0.0442 0.0753 74 SER D O 5515 C CB . SER D 74 ? 0.4690 0.6572 0.5445 0.2661 0.0795 0.0508 74 SER D CB 5516 O OG . SER D 74 ? 0.5475 0.6763 0.6103 0.2778 0.0814 0.0553 74 SER D OG 5517 N N . LYS D 75 ? 0.4130 0.5753 0.4694 0.2276 0.0473 0.0718 75 LYS D N 5518 C CA . LYS D 75 ? 0.3977 0.5729 0.4551 0.2235 0.0344 0.0874 75 LYS D CA 5519 C C . LYS D 75 ? 0.3544 0.5279 0.3996 0.1889 0.0237 0.0833 75 LYS D C 5520 O O . LYS D 75 ? 0.3539 0.5373 0.3971 0.1808 0.0136 0.0936 75 LYS D O 5521 C CB . LYS D 75 ? 0.3783 0.5043 0.4265 0.2419 0.0365 0.0965 75 LYS D CB 5522 C CG . LYS D 75 ? 0.4157 0.5376 0.4712 0.2694 0.0455 0.1017 75 LYS D CG 5523 C CD . LYS D 75 ? 0.5827 0.6522 0.6234 0.2758 0.0463 0.1095 75 LYS D CD 5524 C CE . LYS D 75 ? 0.6564 0.6595 0.6755 0.2635 0.0521 0.0976 75 LYS D CE 5525 N NZ . LYS D 75 ? 0.6960 0.6441 0.6994 0.2685 0.0569 0.1016 75 LYS D NZ 5526 N N . SER D 76 ? 0.3161 0.4769 0.3519 0.1696 0.0267 0.0689 76 SER D N 5527 C CA . SER D 76 ? 0.3566 0.5063 0.3785 0.1403 0.0189 0.0646 76 SER D CA 5528 C C . SER D 76 ? 0.3736 0.4843 0.3836 0.1359 0.0133 0.0688 76 SER D C 5529 O O . SER D 76 ? 0.3156 0.4322 0.3198 0.1182 0.0052 0.0720 76 SER D O 5530 C CB . SER D 76 ? 0.3348 0.5348 0.3623 0.1231 0.0118 0.0693 76 SER D CB 5531 O OG . SER D 76 ? 0.3932 0.6261 0.4274 0.1188 0.0174 0.0628 76 SER D OG 5532 N N . GLN D 77 ? 0.3137 0.3838 0.3188 0.1508 0.0190 0.0679 77 GLN D N 5533 C CA . GLN D 77 ? 0.3964 0.4298 0.3899 0.1461 0.0152 0.0715 77 GLN D CA 5534 C C . GLN D 77 ? 0.4005 0.3885 0.3798 0.1366 0.0198 0.0585 77 GLN D C 5535 O O . GLN D 77 ? 0.3761 0.3473 0.3531 0.1434 0.0288 0.0489 77 GLN D O 5536 C CB . GLN D 77 ? 0.4380 0.4620 0.4347 0.1692 0.0172 0.0847 77 GLN D CB 5537 C CG . GLN D 77 ? 0.4705 0.5452 0.4805 0.1770 0.0097 0.1000 77 GLN D CG 5538 C CD . GLN D 77 ? 0.4925 0.5598 0.5048 0.2025 0.0107 0.1165 77 GLN D CD 5539 O OE1 . GLN D 77 ? 0.4989 0.5342 0.5095 0.2240 0.0212 0.1163 77 GLN D OE1 5540 N NE2 . GLN D 77 ? 0.4191 0.5143 0.4328 0.2000 0.0004 0.1312 77 GLN D NE2 5541 N N . VAL D 78 ? 0.4134 0.3851 0.3832 0.1201 0.0140 0.0576 78 VAL D N 5542 C CA . VAL D 78 ? 0.3675 0.3028 0.3253 0.1107 0.0170 0.0468 78 VAL D CA 5543 C C . VAL D 78 ? 0.4100 0.3165 0.3603 0.1115 0.0168 0.0523 78 VAL D C 5544 O O . VAL D 78 ? 0.4691 0.3864 0.4202 0.1090 0.0104 0.0625 78 VAL D O 5545 C CB . VAL D 78 ? 0.3417 0.2841 0.2949 0.0914 0.0113 0.0407 78 VAL D CB 5546 C CG1 . VAL D 78 ? 0.2989 0.2124 0.2422 0.0825 0.0127 0.0316 78 VAL D CG1 5547 C CG2 . VAL D 78 ? 0.2868 0.2529 0.2433 0.0888 0.0125 0.0359 78 VAL D CG2 5548 N N . PHE D 79 ? 0.4180 0.2882 0.3591 0.1130 0.0246 0.0450 79 PHE D N 5549 C CA . PHE D 79 ? 0.4637 0.3017 0.3947 0.1126 0.0268 0.0498 79 PHE D CA 5550 C C . PHE D 79 ? 0.5025 0.3211 0.4235 0.0930 0.0268 0.0392 79 PHE D C 5551 O O . PHE D 79 ? 0.5441 0.3486 0.4595 0.0867 0.0322 0.0260 79 PHE D O 5552 C CB . PHE D 79 ? 0.4367 0.2430 0.3620 0.1305 0.0383 0.0515 79 PHE D CB 5553 C CG . PHE D 79 ? 0.4599 0.2893 0.3977 0.1535 0.0398 0.0612 79 PHE D CG 5554 C CD1 . PHE D 79 ? 0.4907 0.3449 0.4362 0.1640 0.0325 0.0790 79 PHE D CD1 5555 C CD2 . PHE D 79 ? 0.4378 0.2693 0.3798 0.1643 0.0484 0.0522 79 PHE D CD2 5556 C CE1 . PHE D 79 ? 0.4749 0.3591 0.4343 0.1860 0.0333 0.0885 79 PHE D CE1 5557 C CE2 . PHE D 79 ? 0.4680 0.3269 0.4240 0.1868 0.0505 0.0608 79 PHE D CE2 5558 C CZ . PHE D 79 ? 0.4276 0.3148 0.3935 0.1983 0.0426 0.0794 79 PHE D CZ 5559 N N . PHE D 80 ? 0.4895 0.3112 0.4084 0.0831 0.0208 0.0447 80 PHE D N 5560 C CA . PHE D 80 ? 0.5185 0.3293 0.4308 0.0656 0.0206 0.0358 80 PHE D CA 5561 C C . PHE D 80 ? 0.5583 0.3357 0.4581 0.0626 0.0266 0.0388 80 PHE D C 5562 O O . PHE D 80 ? 0.5914 0.3627 0.4882 0.0703 0.0260 0.0523 80 PHE D O 5563 C CB . PHE D 80 ? 0.5099 0.3457 0.4272 0.0563 0.0120 0.0383 80 PHE D CB 5564 C CG . PHE D 80 ? 0.4700 0.3010 0.3833 0.0414 0.0118 0.0311 80 PHE D CG 5565 C CD1 . PHE D 80 ? 0.4754 0.2933 0.3817 0.0348 0.0133 0.0354 80 PHE D CD1 5566 C CD2 . PHE D 80 ? 0.4285 0.2716 0.3452 0.0345 0.0100 0.0210 80 PHE D CD2 5567 C CE1 . PHE D 80 ? 0.4506 0.2699 0.3551 0.0208 0.0140 0.0281 80 PHE D CE1 5568 C CE2 . PHE D 80 ? 0.4246 0.2706 0.3406 0.0230 0.0097 0.0150 80 PHE D CE2 5569 C CZ . PHE D 80 ? 0.3939 0.2293 0.3047 0.0158 0.0120 0.0177 80 PHE D CZ 5570 N N . LYS D 81 ? 0.5755 0.3327 0.4665 0.0499 0.0326 0.0268 81 LYS D N 5571 C CA . LYS D 81 ? 0.5929 0.3149 0.4688 0.0425 0.0400 0.0282 81 LYS D CA 5572 C C . LYS D 81 ? 0.6100 0.3326 0.4813 0.0201 0.0415 0.0146 81 LYS D C 5573 O O . LYS D 81 ? 0.6026 0.3333 0.4754 0.0128 0.0426 0.0011 81 LYS D O 5574 C CB . LYS D 81 ? 0.5514 0.2343 0.4157 0.0538 0.0516 0.0281 81 LYS D CB 5575 C CG . LYS D 81 ? 0.5999 0.2386 0.4448 0.0497 0.0605 0.0339 81 LYS D CG 5576 C CD . LYS D 81 ? 0.6330 0.2420 0.4716 0.0691 0.0697 0.0396 81 LYS D CD 5577 C CE . LYS D 81 ? 0.7486 0.3256 0.5720 0.0640 0.0763 0.0461 81 LYS D CE 5578 N NZ . LYS D 81 ? 0.8400 0.3853 0.6459 0.0415 0.0873 0.0293 81 LYS D NZ 5579 N N A MET D 82 ? 0.5826 0.3018 0.4486 0.0084 0.0412 0.0184 82 MET D N 5580 N N B MET D 82 ? 0.5814 0.3005 0.4474 0.0085 0.0412 0.0185 82 MET D N 5581 C CA A MET D 82 ? 0.5733 0.3005 0.4373 -0.0131 0.0427 0.0063 82 MET D CA 5582 C CA B MET D 82 ? 0.5733 0.3005 0.4372 -0.0131 0.0427 0.0064 82 MET D CA 5583 C C A MET D 82 ? 0.5953 0.2886 0.4410 -0.0264 0.0517 0.0084 82 MET D C 5584 C C B MET D 82 ? 0.5950 0.2882 0.4407 -0.0264 0.0517 0.0084 82 MET D C 5585 O O A MET D 82 ? 0.6295 0.3085 0.4685 -0.0204 0.0518 0.0227 82 MET D O 5586 O O B MET D 82 ? 0.6347 0.3134 0.4735 -0.0203 0.0519 0.0227 82 MET D O 5587 C CB A MET D 82 ? 0.5415 0.3086 0.4198 -0.0164 0.0335 0.0067 82 MET D CB 5588 C CB B MET D 82 ? 0.5382 0.3049 0.4163 -0.0163 0.0336 0.0071 82 MET D CB 5589 C CG A MET D 82 ? 0.5677 0.3538 0.4488 -0.0348 0.0344 -0.0057 82 MET D CG 5590 C CG B MET D 82 ? 0.5644 0.3518 0.4463 -0.0339 0.0339 -0.0058 82 MET D CG 5591 S SD A MET D 82 ? 0.5653 0.3951 0.4639 -0.0322 0.0256 -0.0050 82 MET D SD 5592 S SD B MET D 82 ? 0.5675 0.3975 0.4665 -0.0309 0.0251 -0.0045 82 MET D SD 5593 C CE A MET D 82 ? 0.5570 0.4053 0.4663 -0.0181 0.0187 -0.0071 82 MET D CE 5594 C CE B MET D 82 ? 0.5640 0.3828 0.4552 -0.0347 0.0272 0.0064 82 MET D CE 5595 N N . ASN D 83 ? 0.5599 0.2417 0.3959 -0.0462 0.0592 -0.0056 83 ASN D N 5596 C CA . ASN D 83 ? 0.5940 0.2347 0.4075 -0.0621 0.0708 -0.0058 83 ASN D CA 5597 C C . ASN D 83 ? 0.6166 0.2756 0.4294 -0.0843 0.0710 -0.0090 83 ASN D C 5598 O O . ASN D 83 ? 0.5807 0.2856 0.4106 -0.0910 0.0641 -0.0172 83 ASN D O 5599 C CB . ASN D 83 ? 0.7148 0.3256 0.5130 -0.0747 0.0821 -0.0212 83 ASN D CB 5600 C CG . ASN D 83 ? 0.9398 0.5208 0.7332 -0.0532 0.0867 -0.0183 83 ASN D CG 5601 O OD1 . ASN D 83 ? 0.9685 0.5362 0.7632 -0.0302 0.0850 -0.0017 83 ASN D OD1 5602 N ND2 . ASN D 83 ? 1.0645 0.6384 0.8523 -0.0607 0.0928 -0.0348 83 ASN D ND2 5603 N N . SER D 84 ? 0.6719 0.2936 0.4637 -0.0948 0.0799 -0.0022 84 SER D N 5604 C CA . SER D 84 ? 0.7064 0.3394 0.4929 -0.1185 0.0830 -0.0049 84 SER D CA 5605 C C . SER D 84 ? 0.7068 0.3966 0.5169 -0.1165 0.0723 -0.0051 84 SER D C 5606 O O . SER D 84 ? 0.7020 0.4312 0.5258 -0.1288 0.0702 -0.0188 84 SER D O 5607 C CB . SER D 84 ? 0.7835 0.4113 0.5594 -0.1479 0.0928 -0.0237 84 SER D CB 5608 O OG . SER D 84 ? 0.8310 0.4966 0.6247 -0.1477 0.0868 -0.0381 84 SER D OG 5609 N N . LEU D 85 ? 0.6514 0.3457 0.4652 -0.1003 0.0660 0.0100 85 LEU D N 5610 C CA . LEU D 85 ? 0.6454 0.3852 0.4776 -0.0973 0.0579 0.0097 85 LEU D CA 5611 C C . LEU D 85 ? 0.6469 0.3975 0.4731 -0.1186 0.0635 0.0069 85 LEU D C 5612 O O . LEU D 85 ? 0.6495 0.3668 0.4538 -0.1318 0.0719 0.0124 85 LEU D O 5613 C CB . LEU D 85 ? 0.6872 0.4285 0.5224 -0.0767 0.0502 0.0251 85 LEU D CB 5614 C CG . LEU D 85 ? 0.6838 0.4410 0.5351 -0.0567 0.0419 0.0248 85 LEU D CG 5615 C CD1 . LEU D 85 ? 0.6596 0.3847 0.5032 -0.0461 0.0448 0.0278 85 LEU D CD1 5616 C CD2 . LEU D 85 ? 0.6983 0.4731 0.5554 -0.0445 0.0342 0.0355 85 LEU D CD2 5617 N N . GLN D 86 ? 0.4513 0.2473 0.2959 -0.1210 0.0598 -0.0012 86 GLN D N 5618 C CA . GLN D 86 ? 0.5617 0.3753 0.4038 -0.1383 0.0653 -0.0040 86 GLN D CA 5619 C C . GLN D 86 ? 0.5389 0.3768 0.3907 -0.1263 0.0599 0.0012 86 GLN D C 5620 O O . GLN D 86 ? 0.5115 0.3517 0.3714 -0.1066 0.0520 0.0064 86 GLN D O 5621 C CB . GLN D 86 ? 0.6168 0.4654 0.4709 -0.1556 0.0691 -0.0210 86 GLN D CB 5622 C CG . GLN D 86 ? 0.7276 0.5523 0.5689 -0.1724 0.0755 -0.0288 86 GLN D CG 5623 C CD . GLN D 86 ? 0.8699 0.6462 0.6809 -0.1913 0.0866 -0.0224 86 GLN D CD 5624 O OE1 . GLN D 86 ? 0.8827 0.6539 0.6841 -0.1965 0.0896 -0.0137 86 GLN D OE1 5625 N NE2 . GLN D 86 ? 0.8818 0.6199 0.6752 -0.2023 0.0936 -0.0267 86 GLN D NE2 5626 N N . SER D 87 ? 0.4355 0.2901 0.2846 -0.1399 0.0655 -0.0012 87 SER D N 5627 C CA . SER D 87 ? 0.4177 0.2932 0.2725 -0.1322 0.0632 0.0010 87 SER D CA 5628 C C . SER D 87 ? 0.4057 0.3053 0.2819 -0.1125 0.0561 -0.0044 87 SER D C 5629 O O . SER D 87 ? 0.4737 0.3676 0.3490 -0.0990 0.0506 0.0026 87 SER D O 5630 C CB . SER D 87 ? 0.4614 0.3637 0.3174 -0.1497 0.0719 -0.0076 87 SER D CB 5631 O OG . SER D 87 ? 0.7397 0.6173 0.5719 -0.1696 0.0792 -0.0010 87 SER D OG 5632 N N . ASN D 88 ? 0.3728 0.2986 0.2666 -0.1117 0.0561 -0.0158 88 ASN D N 5633 C CA . ASN D 88 ? 0.4454 0.3935 0.3573 -0.0928 0.0507 -0.0196 88 ASN D CA 5634 C C . ASN D 88 ? 0.4207 0.3510 0.3337 -0.0773 0.0422 -0.0138 88 ASN D C 5635 O O . ASN D 88 ? 0.5457 0.4917 0.4721 -0.0631 0.0378 -0.0168 88 ASN D O 5636 C CB . ASN D 88 ? 0.3899 0.3796 0.3212 -0.0950 0.0534 -0.0321 88 ASN D CB 5637 C CG . ASN D 88 ? 0.5579 0.5539 0.4944 -0.0994 0.0504 -0.0369 88 ASN D CG 5638 O OD1 . ASN D 88 ? 0.6171 0.5821 0.5416 -0.1018 0.0480 -0.0324 88 ASN D OD1 5639 N ND2 . ASN D 88 ? 0.6698 0.7090 0.6244 -0.0999 0.0509 -0.0465 88 ASN D ND2 5640 N N . ASP D 89 ? 0.3625 0.2604 0.2612 -0.0789 0.0408 -0.0053 89 ASP D N 5641 C CA . ASP D 89 ? 0.3722 0.2549 0.2714 -0.0634 0.0338 0.0010 89 ASP D CA 5642 C C . ASP D 89 ? 0.4612 0.3348 0.3531 -0.0558 0.0306 0.0117 89 ASP D C 5643 O O . ASP D 89 ? 0.4260 0.2924 0.3187 -0.0435 0.0249 0.0178 89 ASP D O 5644 C CB . ASP D 89 ? 0.4248 0.2793 0.3139 -0.0664 0.0351 0.0036 89 ASP D CB 5645 C CG . ASP D 89 ? 0.5194 0.3853 0.4153 -0.0739 0.0369 -0.0086 89 ASP D CG 5646 O OD1 . ASP D 89 ? 0.4580 0.3498 0.3688 -0.0655 0.0320 -0.0144 89 ASP D OD1 5647 O OD2 . ASP D 89 ? 0.6537 0.5022 0.5379 -0.0894 0.0435 -0.0122 89 ASP D OD2 5648 N N . THR D 90 ? 0.3466 0.2238 0.2307 -0.0649 0.0346 0.0133 90 THR D N 5649 C CA . THR D 90 ? 0.3454 0.2218 0.2221 -0.0613 0.0318 0.0208 90 THR D CA 5650 C C . THR D 90 ? 0.3577 0.2482 0.2459 -0.0498 0.0285 0.0154 90 THR D C 5651 O O . THR D 90 ? 0.3177 0.2246 0.2157 -0.0487 0.0322 0.0054 90 THR D O 5652 C CB . THR D 90 ? 0.4040 0.2863 0.2699 -0.0753 0.0380 0.0202 90 THR D CB 5653 O OG1 . THR D 90 ? 0.4361 0.2981 0.2849 -0.0849 0.0399 0.0306 90 THR D OG1 5654 C CG2 . THR D 90 ? 0.3552 0.2446 0.2154 -0.0735 0.0363 0.0222 90 THR D CG2 5655 N N . ALA D 91 ? 0.3367 0.2210 0.2231 -0.0409 0.0223 0.0225 91 ALA D N 5656 C CA . ALA D 91 ? 0.3760 0.2678 0.2697 -0.0318 0.0200 0.0183 91 ALA D CA 5657 C C . ALA D 91 ? 0.3526 0.2407 0.2411 -0.0273 0.0140 0.0268 91 ALA D C 5658 O O . ALA D 91 ? 0.3622 0.2456 0.2436 -0.0281 0.0108 0.0370 91 ALA D O 5659 C CB . ALA D 91 ? 0.3718 0.2686 0.2792 -0.0232 0.0189 0.0121 91 ALA D CB 5660 N N . ILE D 92 ? 0.2951 0.1865 0.1867 -0.0222 0.0130 0.0230 92 ILE D N 5661 C CA . ILE D 92 ? 0.3679 0.2606 0.2572 -0.0189 0.0077 0.0292 92 ILE D CA 5662 C C . ILE D 92 ? 0.3717 0.2628 0.2712 -0.0081 0.0046 0.0291 92 ILE D C 5663 O O . ILE D 92 ? 0.3738 0.2644 0.2793 -0.0034 0.0063 0.0226 92 ILE D O 5664 C CB . ILE D 92 ? 0.3563 0.2501 0.2377 -0.0244 0.0100 0.0247 92 ILE D CB 5665 C CG1 . ILE D 92 ? 0.4500 0.3471 0.3186 -0.0372 0.0132 0.0242 92 ILE D CG1 5666 C CG2 . ILE D 92 ? 0.2936 0.1930 0.1734 -0.0236 0.0049 0.0301 92 ILE D CG2 5667 C CD1 . ILE D 92 ? 0.5286 0.4235 0.3852 -0.0463 0.0174 0.0179 92 ILE D CD1 5668 N N . TYR D 93 ? 0.2990 0.1902 0.1997 -0.0033 0.0005 0.0369 93 TYR D N 5669 C CA . TYR D 93 ? 0.3050 0.1947 0.2137 0.0059 -0.0012 0.0360 93 TYR D CA 5670 C C . TYR D 93 ? 0.3689 0.2679 0.2779 0.0088 -0.0045 0.0394 93 TYR D C 5671 O O . TYR D 93 ? 0.3505 0.2590 0.2564 0.0074 -0.0072 0.0470 93 TYR D O 5672 C CB . TYR D 93 ? 0.2850 0.1648 0.1941 0.0104 -0.0008 0.0404 93 TYR D CB 5673 C CG . TYR D 93 ? 0.2925 0.1621 0.2002 0.0043 0.0036 0.0350 93 TYR D CG 5674 C CD1 . TYR D 93 ? 0.3283 0.1955 0.2290 -0.0046 0.0062 0.0368 93 TYR D CD1 5675 C CD2 . TYR D 93 ? 0.3277 0.1934 0.2401 0.0052 0.0056 0.0272 93 TYR D CD2 5676 C CE1 . TYR D 93 ? 0.4003 0.2614 0.2995 -0.0128 0.0110 0.0312 93 TYR D CE1 5677 C CE2 . TYR D 93 ? 0.3005 0.1619 0.2115 -0.0038 0.0099 0.0212 93 TYR D CE2 5678 C CZ . TYR D 93 ? 0.4243 0.2834 0.3291 -0.0128 0.0128 0.0232 93 TYR D CZ 5679 O OH . TYR D 93 ? 0.4469 0.3046 0.3500 -0.0242 0.0179 0.0168 93 TYR D OH 5680 N N . TYR D 94 ? 0.2646 0.1638 0.1766 0.0119 -0.0043 0.0346 94 TYR D N 5681 C CA . TYR D 94 ? 0.3299 0.2375 0.2409 0.0121 -0.0062 0.0369 94 TYR D CA 5682 C C . TYR D 94 ? 0.3916 0.3015 0.3092 0.0209 -0.0071 0.0367 94 TYR D C 5683 O O . TYR D 94 ? 0.3547 0.2578 0.2755 0.0249 -0.0061 0.0319 94 TYR D O 5684 C CB . TYR D 94 ? 0.2655 0.1668 0.1696 0.0072 -0.0036 0.0322 94 TYR D CB 5685 C CG . TYR D 94 ? 0.3246 0.2187 0.2203 -0.0009 0.0001 0.0289 94 TYR D CG 5686 C CD1 . TYR D 94 ? 0.3301 0.2166 0.2280 0.0019 0.0035 0.0239 94 TYR D CD1 5687 C CD2 . TYR D 94 ? 0.3649 0.2621 0.2498 -0.0126 0.0012 0.0294 94 TYR D CD2 5688 C CE1 . TYR D 94 ? 0.3614 0.2413 0.2513 -0.0045 0.0087 0.0195 94 TYR D CE1 5689 C CE2 . TYR D 94 ? 0.2955 0.1837 0.1700 -0.0213 0.0064 0.0243 94 TYR D CE2 5690 C CZ . TYR D 94 ? 0.3086 0.1869 0.1858 -0.0162 0.0106 0.0193 94 TYR D CZ 5691 O OH . TYR D 94 ? 0.3171 0.1869 0.1842 -0.0238 0.0174 0.0131 94 TYR D OH 5692 N N . CYS D 95 ? 0.3577 0.2808 0.2773 0.0227 -0.0087 0.0413 95 CYS D N 5693 C CA . CYS D 95 ? 0.3737 0.3014 0.2968 0.0281 -0.0082 0.0394 95 CYS D CA 5694 C C . CYS D 95 ? 0.3528 0.2835 0.2690 0.0203 -0.0078 0.0382 95 CYS D C 5695 O O . CYS D 95 ? 0.3733 0.3056 0.2826 0.0107 -0.0076 0.0393 95 CYS D O 5696 C CB . CYS D 95 ? 0.3483 0.2905 0.2786 0.0363 -0.0085 0.0444 95 CYS D CB 5697 S SG . CYS D 95 ? 0.3933 0.3646 0.3253 0.0319 -0.0116 0.0529 95 CYS D SG 5698 N N . ALA D 96 ? 0.2617 0.1906 0.1768 0.0230 -0.0068 0.0356 96 ALA D N 5699 C CA . ALA D 96 ? 0.3333 0.2575 0.2380 0.0157 -0.0052 0.0355 96 ALA D CA 5700 C C . ALA D 96 ? 0.3298 0.2611 0.2340 0.0182 -0.0045 0.0352 96 ALA D C 5701 O O . ALA D 96 ? 0.2909 0.2254 0.2014 0.0263 -0.0049 0.0327 96 ALA D O 5702 C CB . ALA D 96 ? 0.2690 0.1729 0.1666 0.0163 -0.0039 0.0333 96 ALA D CB 5703 N N . ARG D 97 ? 0.3640 0.2962 0.2580 0.0089 -0.0023 0.0369 97 ARG D N 5704 C CA . ARG D 97 ? 0.3708 0.3093 0.2608 0.0085 -0.0007 0.0371 97 ARG D CA 5705 C C . ARG D 97 ? 0.3923 0.3097 0.2646 0.0031 0.0016 0.0394 97 ARG D C 5706 O O . ARG D 97 ? 0.4252 0.3266 0.2860 -0.0057 0.0043 0.0406 97 ARG D O 5707 C CB . ARG D 97 ? 0.3990 0.3636 0.2929 0.0016 0.0010 0.0382 97 ARG D CB 5708 C CG . ARG D 97 ? 0.3160 0.2952 0.2125 0.0055 0.0032 0.0366 97 ARG D CG 5709 C CD . ARG D 97 ? 0.3263 0.3275 0.2192 -0.0071 0.0066 0.0379 97 ARG D CD 5710 N NE . ARG D 97 ? 0.4121 0.3942 0.2845 -0.0194 0.0095 0.0397 97 ARG D NE 5711 C CZ . ARG D 97 ? 0.4024 0.3961 0.2652 -0.0350 0.0139 0.0407 97 ARG D CZ 5712 N NH1 . ARG D 97 ? 0.3683 0.4000 0.2435 -0.0396 0.0151 0.0395 97 ARG D NH1 5713 N NH2 . ARG D 97 ? 0.3368 0.3049 0.1770 -0.0455 0.0176 0.0435 97 ARG D NH2 5714 N N . ALA D 98 ? 0.3611 0.2769 0.2290 0.0081 0.0012 0.0401 98 ALA D N 5715 C CA . ALA D 98 ? 0.3453 0.2404 0.1946 0.0058 0.0032 0.0451 98 ALA D CA 5716 C C . ALA D 98 ? 0.4349 0.3312 0.2701 -0.0086 0.0081 0.0478 98 ALA D C 5717 O O . ALA D 98 ? 0.4268 0.3483 0.2700 -0.0152 0.0093 0.0450 98 ALA D O 5718 C CB . ALA D 98 ? 0.3206 0.2178 0.1697 0.0167 -0.0004 0.0461 98 ALA D CB 5719 N N . LEU D 99 ? 0.4628 0.3318 0.2764 -0.0130 0.0118 0.0536 99 LEU D N 5720 C CA . LEU D 99 ? 0.4580 0.3226 0.2531 -0.0293 0.0177 0.0567 99 LEU D CA 5721 C C . LEU D 99 ? 0.5588 0.4467 0.3555 -0.0286 0.0168 0.0571 99 LEU D C 5722 O O . LEU D 99 ? 0.5765 0.4858 0.3732 -0.0413 0.0206 0.0548 99 LEU D O 5723 C CB . LEU D 99 ? 0.5124 0.3339 0.2805 -0.0312 0.0227 0.0644 99 LEU D CB 5724 C CG . LEU D 99 ? 0.6254 0.4182 0.3730 -0.0496 0.0315 0.0641 99 LEU D CG 5725 C CD1 . LEU D 99 ? 0.4995 0.2453 0.2161 -0.0490 0.0380 0.0738 99 LEU D CD1 5726 C CD2 . LEU D 99 ? 0.6510 0.4704 0.3985 -0.0727 0.0350 0.0593 99 LEU D CD2 5727 N N . THR D 100 ? 0.6251 0.5118 0.4225 -0.0147 0.0124 0.0594 100 THR D N 5728 C CA . THR D 100 ? 0.6343 0.5423 0.4308 -0.0145 0.0120 0.0583 100 THR D CA 5729 C C . THR D 100 ? 0.5017 0.4335 0.3207 -0.0029 0.0077 0.0497 100 THR D C 5730 O O . THR D 100 ? 0.4956 0.4219 0.3262 0.0066 0.0035 0.0476 100 THR D O 5731 C CB . THR D 100 ? 0.6720 0.5630 0.4474 -0.0102 0.0105 0.0678 100 THR D CB 5732 O OG1 . THR D 100 ? 0.8047 0.7024 0.5903 0.0055 0.0032 0.0667 100 THR D OG1 5733 C CG2 . THR D 100 ? 0.5832 0.4344 0.3359 -0.0137 0.0143 0.0780 100 THR D CG2 5734 N N . TYR D 101 ? 0.4014 0.3572 0.2248 -0.0046 0.0101 0.0441 101 TYR D N 5735 C CA . TYR D 101 ? 0.3968 0.3702 0.2391 0.0047 0.0092 0.0343 101 TYR D CA 5736 C C . TYR D 101 ? 0.4473 0.4138 0.2916 0.0144 0.0035 0.0321 101 TYR D C 5737 O O . TYR D 101 ? 0.4460 0.4160 0.3049 0.0209 0.0027 0.0249 101 TYR D O 5738 C CB . TYR D 101 ? 0.3783 0.3756 0.2217 0.0019 0.0151 0.0278 101 TYR D CB 5739 C CG . TYR D 101 ? 0.4484 0.4479 0.2749 -0.0008 0.0151 0.0278 101 TYR D CG 5740 C CD1 . TYR D 101 ? 0.3429 0.3458 0.1708 0.0057 0.0128 0.0206 101 TYR D CD1 5741 C CD2 . TYR D 101 ? 0.4353 0.4342 0.2418 -0.0121 0.0180 0.0350 101 TYR D CD2 5742 C CE1 . TYR D 101 ? 0.3591 0.3686 0.1698 0.0015 0.0122 0.0206 101 TYR D CE1 5743 C CE2 . TYR D 101 ? 0.4096 0.4121 0.1983 -0.0150 0.0177 0.0366 101 TYR D CE2 5744 C CZ . TYR D 101 ? 0.4327 0.4427 0.2240 -0.0079 0.0142 0.0293 101 TYR D CZ 5745 O OH . TYR D 101 ? 0.4175 0.4353 0.1895 -0.0124 0.0132 0.0309 101 TYR D OH 5746 N N . TYR D 102 ? 0.4005 0.3582 0.2293 0.0148 -0.0003 0.0390 102 TYR D N 5747 C CA . TYR D 102 ? 0.4035 0.3645 0.2335 0.0222 -0.0063 0.0374 102 TYR D CA 5748 C C . TYR D 102 ? 0.4212 0.3675 0.2532 0.0301 -0.0114 0.0442 102 TYR D C 5749 O O . TYR D 102 ? 0.4736 0.4284 0.3097 0.0362 -0.0168 0.0428 102 TYR D O 5750 C CB . TYR D 102 ? 0.4213 0.3915 0.2331 0.0195 -0.0081 0.0412 102 TYR D CB 5751 C CG . TYR D 102 ? 0.3777 0.3315 0.1693 0.0171 -0.0078 0.0557 102 TYR D CG 5752 C CD1 . TYR D 102 ? 0.3905 0.3280 0.1746 0.0261 -0.0127 0.0673 102 TYR D CD1 5753 C CD2 . TYR D 102 ? 0.4714 0.4245 0.2504 0.0059 -0.0012 0.0578 102 TYR D CD2 5754 C CE1 . TYR D 102 ? 0.4189 0.3332 0.1812 0.0250 -0.0106 0.0813 102 TYR D CE1 5755 C CE2 . TYR D 102 ? 0.5349 0.4669 0.2913 0.0011 0.0007 0.0712 102 TYR D CE2 5756 C CZ . TYR D 102 ? 0.5467 0.4559 0.2936 0.0112 -0.0037 0.0833 102 TYR D CZ 5757 O OH . TYR D 102 ? 0.4684 0.3490 0.1896 0.0077 -0.0002 0.0974 102 TYR D OH 5758 N N . ASP D 103 ? 0.3420 0.2683 0.1702 0.0290 -0.0090 0.0509 103 ASP D N 5759 C CA . ASP D 103 ? 0.4373 0.3461 0.2627 0.0377 -0.0116 0.0584 103 ASP D CA 5760 C C . ASP D 103 ? 0.3941 0.3002 0.2366 0.0411 -0.0118 0.0525 103 ASP D C 5761 O O . ASP D 103 ? 0.4173 0.3344 0.2734 0.0375 -0.0110 0.0438 103 ASP D O 5762 C CB . ASP D 103 ? 0.4783 0.3589 0.2830 0.0342 -0.0070 0.0691 103 ASP D CB 5763 C CG . ASP D 103 ? 0.5274 0.3902 0.3210 0.0479 -0.0093 0.0807 103 ASP D CG 5764 O OD1 . ASP D 103 ? 0.5375 0.4112 0.3442 0.0601 -0.0143 0.0795 103 ASP D OD1 5765 O OD2 . ASP D 103 ? 0.4989 0.3365 0.2697 0.0468 -0.0054 0.0917 103 ASP D OD2 5766 N N . TYR D 104 ? 0.4145 0.3051 0.2553 0.0490 -0.0122 0.0577 104 TYR D N 5767 C CA . TYR D 104 ? 0.4138 0.3036 0.2694 0.0518 -0.0120 0.0521 104 TYR D CA 5768 C C . TYR D 104 ? 0.4532 0.3155 0.3006 0.0514 -0.0065 0.0557 104 TYR D C 5769 O O . TYR D 104 ? 0.5015 0.3596 0.3566 0.0572 -0.0057 0.0536 104 TYR D O 5770 C CB . TYR D 104 ? 0.3365 0.2427 0.2024 0.0626 -0.0173 0.0512 104 TYR D CB 5771 C CG . TYR D 104 ? 0.3895 0.3224 0.2634 0.0597 -0.0218 0.0440 104 TYR D CG 5772 C CD1 . TYR D 104 ? 0.3939 0.3383 0.2578 0.0581 -0.0244 0.0463 104 TYR D CD1 5773 C CD2 . TYR D 104 ? 0.3751 0.3199 0.2638 0.0570 -0.0225 0.0345 104 TYR D CD2 5774 C CE1 . TYR D 104 ? 0.3980 0.3650 0.2664 0.0533 -0.0271 0.0377 104 TYR D CE1 5775 C CE2 . TYR D 104 ? 0.3935 0.3574 0.2860 0.0519 -0.0247 0.0264 104 TYR D CE2 5776 C CZ . TYR D 104 ? 0.4085 0.3836 0.2909 0.0499 -0.0268 0.0272 104 TYR D CZ 5777 O OH . TYR D 104 ? 0.4228 0.4149 0.3061 0.0426 -0.0276 0.0169 104 TYR D OH 5778 N N . GLU D 105 ? 0.4809 0.3240 0.3110 0.0429 -0.0014 0.0603 105 GLU D N 5779 C CA . GLU D 105 ? 0.4727 0.2854 0.2906 0.0386 0.0058 0.0618 105 GLU D CA 5780 C C . GLU D 105 ? 0.4932 0.3123 0.3161 0.0226 0.0084 0.0543 105 GLU D C 5781 O O . GLU D 105 ? 0.4473 0.2746 0.2655 0.0100 0.0098 0.0539 105 GLU D O 5782 C CB . GLU D 105 ? 0.5430 0.3243 0.3346 0.0380 0.0112 0.0717 105 GLU D CB 5783 C CG . GLU D 105 ? 0.6482 0.4262 0.4246 0.0198 0.0151 0.0730 105 GLU D CG 5784 C CD . GLU D 105 ? 0.5672 0.3735 0.3478 0.0196 0.0095 0.0743 105 GLU D CD 5785 O OE1 . GLU D 105 ? 0.5821 0.4198 0.3831 0.0202 0.0047 0.0666 105 GLU D OE1 5786 O OE2 . GLU D 105 ? 0.5942 0.3889 0.3554 0.0181 0.0112 0.0830 105 GLU D OE2 5787 N N . PHE D 106 ? 0.2924 0.4132 0.3044 -0.0651 -0.0282 -0.0081 106 PHE D N 5788 C CA . PHE D 106 ? 0.2050 0.3371 0.2187 -0.0503 -0.0181 -0.0119 106 PHE D CA 5789 C C . PHE D 106 ? 0.2077 0.3847 0.2551 -0.0492 -0.0077 -0.0084 106 PHE D C 5790 O O . PHE D 106 ? 0.2386 0.4297 0.3157 -0.0563 -0.0098 -0.0078 106 PHE D O 5791 C CB . PHE D 106 ? 0.2137 0.3253 0.2305 -0.0531 -0.0264 -0.0151 106 PHE D CB 5792 C CG . PHE D 106 ? 0.2472 0.3126 0.2278 -0.0561 -0.0384 -0.0175 106 PHE D CG 5793 C CD1 . PHE D 106 ? 0.3473 0.3846 0.2814 -0.0430 -0.0352 -0.0213 106 PHE D CD1 5794 C CD2 . PHE D 106 ? 0.2180 0.2675 0.2090 -0.0722 -0.0533 -0.0147 106 PHE D CD2 5795 C CE1 . PHE D 106 ? 0.4080 0.3966 0.3027 -0.0474 -0.0481 -0.0236 106 PHE D CE1 5796 C CE2 . PHE D 106 ? 0.2685 0.2752 0.2251 -0.0780 -0.0666 -0.0154 106 PHE D CE2 5797 C CZ . PHE D 106 ? 0.3439 0.3175 0.2504 -0.0664 -0.0648 -0.0203 106 PHE D CZ 5798 N N . ALA D 107 ? 0.1855 0.3839 0.2255 -0.0405 0.0034 -0.0055 107 ALA D N 5799 C CA . ALA D 107 ? 0.2018 0.4444 0.2706 -0.0417 0.0121 0.0000 107 ALA D CA 5800 C C . ALA D 107 ? 0.1888 0.4468 0.2654 -0.0284 0.0194 -0.0016 107 ALA D C 5801 O O . ALA D 107 ? 0.2309 0.4759 0.3156 -0.0288 0.0174 0.0016 107 ALA D O 5802 C CB . ALA D 107 ? 0.2029 0.4654 0.2614 -0.0380 0.0211 0.0060 107 ALA D CB 5803 N N . TYR D 108 ? 0.2667 0.5056 0.3175 -0.0113 0.0230 -0.0067 108 TYR D N 5804 C CA . TYR D 108 ? 0.2283 0.4832 0.2855 0.0031 0.0303 -0.0076 108 TYR D CA 5805 C C . TYR D 108 ? 0.2424 0.4602 0.2850 0.0069 0.0233 -0.0150 108 TYR D C 5806 O O . TYR D 108 ? 0.2500 0.4270 0.2595 0.0100 0.0180 -0.0195 108 TYR D O 5807 C CB . TYR D 108 ? 0.2367 0.5084 0.2745 0.0258 0.0447 -0.0044 108 TYR D CB 5808 C CG . TYR D 108 ? 0.2363 0.5275 0.2806 0.0205 0.0476 0.0044 108 TYR D CG 5809 C CD1 . TYR D 108 ? 0.2202 0.5094 0.2438 0.0202 0.0521 0.0049 108 TYR D CD1 5810 C CD2 . TYR D 108 ? 0.1808 0.4802 0.2436 0.0143 0.0438 0.0116 108 TYR D CD2 5811 C CE1 . TYR D 108 ? 0.2154 0.5219 0.2456 0.0145 0.0541 0.0134 108 TYR D CE1 5812 C CE2 . TYR D 108 ? 0.2022 0.5152 0.2680 0.0087 0.0450 0.0192 108 TYR D CE2 5813 C CZ . TYR D 108 ? 0.2853 0.6037 0.3379 0.0088 0.0498 0.0204 108 TYR D CZ 5814 O OH . TYR D 108 ? 0.3653 0.6977 0.4211 0.0028 0.0509 0.0284 108 TYR D OH 5815 N N . TRP D 109 ? 0.1805 0.4109 0.2456 0.0055 0.0225 -0.0157 109 TRP D N 5816 C CA . TRP D 109 ? 0.1298 0.3280 0.1842 0.0074 0.0159 -0.0215 109 TRP D CA 5817 C C . TRP D 109 ? 0.2295 0.4386 0.2834 0.0242 0.0231 -0.0225 109 TRP D C 5818 O O . TRP D 109 ? 0.2987 0.5385 0.3717 0.0264 0.0287 -0.0171 109 TRP D O 5819 C CB . TRP D 109 ? 0.0866 0.2846 0.1691 -0.0123 0.0065 -0.0211 109 TRP D CB 5820 C CG . TRP D 109 ? 0.1048 0.2889 0.1894 -0.0284 -0.0025 -0.0196 109 TRP D CG 5821 C CD1 . TRP D 109 ? 0.0778 0.2756 0.1712 -0.0366 -0.0021 -0.0151 109 TRP D CD1 5822 C CD2 . TRP D 109 ? 0.0964 0.2490 0.1749 -0.0390 -0.0143 -0.0207 109 TRP D CD2 5823 N NE1 . TRP D 109 ? 0.1372 0.3108 0.2287 -0.0490 -0.0123 -0.0137 109 TRP D NE1 5824 C CE2 . TRP D 109 ? 0.1124 0.2654 0.1987 -0.0527 -0.0205 -0.0169 109 TRP D CE2 5825 C CE3 . TRP D 109 ? 0.1964 0.3212 0.2635 -0.0391 -0.0209 -0.0234 109 TRP D CE3 5826 C CZ2 . TRP D 109 ? 0.1913 0.3162 0.2745 -0.0631 -0.0322 -0.0145 109 TRP D CZ2 5827 C CZ3 . TRP D 109 ? 0.1515 0.2536 0.2177 -0.0538 -0.0336 -0.0210 109 TRP D CZ3 5828 C CH2 . TRP D 109 ? 0.1841 0.2905 0.2605 -0.0665 -0.0395 -0.0165 109 TRP D CH2 5829 N N . GLY D 110 ? 0.1701 0.3426 0.1976 0.0333 0.0198 -0.0278 110 GLY D N 5830 C CA . GLY D 110 ? 0.1427 0.3197 0.1706 0.0469 0.0240 -0.0290 110 GLY D CA 5831 C C . GLY D 110 ? 0.1587 0.3514 0.2212 0.0316 0.0189 -0.0281 110 GLY D C 5832 O O . GLY D 110 ? 0.1409 0.3331 0.2216 0.0123 0.0119 -0.0272 110 GLY D O 5833 N N . GLN D 111 ? 0.1226 0.3285 0.1930 0.0409 0.0226 -0.0278 111 GLN D N 5834 C CA . GLN D 111 ? 0.1751 0.3762 0.2659 0.0250 0.0169 -0.0248 111 GLN D CA 5835 C C . GLN D 111 ? 0.1315 0.3150 0.2246 0.0175 0.0097 -0.0305 111 GLN D C 5836 O O . GLN D 111 ? 0.1745 0.3493 0.2806 0.0052 0.0061 -0.0271 111 GLN D O 5837 C CB . GLN D 111 ? 0.0832 0.2850 0.1727 0.0320 0.0197 -0.0204 111 GLN D CB 5838 C CG . GLN D 111 ? 0.0960 0.2935 0.1734 0.0488 0.0214 -0.0258 111 GLN D CG 5839 C CD . GLN D 111 ? 0.2740 0.4698 0.3247 0.0738 0.0288 -0.0273 111 GLN D CD 5840 O OE1 . GLN D 111 ? 0.2500 0.4470 0.2883 0.0798 0.0327 -0.0281 111 GLN D OE1 5841 N NE2 . GLN D 111 ? 0.2109 0.3980 0.2481 0.0887 0.0308 -0.0267 111 GLN D NE2 5842 N N . GLY D 112 ? 0.2277 0.3724 0.2884 0.0222 0.0054 -0.0338 112 GLY D N 5843 C CA . GLY D 112 ? 0.1892 0.2999 0.2416 0.0111 -0.0045 -0.0353 112 GLY D CA 5844 C C . GLY D 112 ? 0.2791 0.3716 0.3167 0.0211 -0.0044 -0.0375 112 GLY D C 5845 O O . GLY D 112 ? 0.3172 0.4330 0.3662 0.0313 0.0024 -0.0370 112 GLY D O 5846 N N . THR D 113 ? 0.3659 0.4158 0.3768 0.0171 -0.0132 -0.0391 113 THR D N 5847 C CA . THR D 113 ? 0.3036 0.3294 0.2969 0.0238 -0.0151 -0.0406 113 THR D CA 5848 C C . THR D 113 ? 0.2880 0.2981 0.2912 0.0036 -0.0250 -0.0374 113 THR D C 5849 O O . THR D 113 ? 0.3453 0.3292 0.3357 -0.0100 -0.0352 -0.0356 113 THR D O 5850 C CB . THR D 113 ? 0.3404 0.3213 0.2825 0.0401 -0.0168 -0.0448 113 THR D CB 5851 O OG1 . THR D 113 ? 0.4245 0.4230 0.3577 0.0615 -0.0056 -0.0463 113 THR D OG1 5852 C CG2 . THR D 113 ? 0.2990 0.2536 0.2218 0.0474 -0.0189 -0.0461 113 THR D CG2 5853 N N . LEU D 114 ? 0.2321 0.2594 0.2577 0.0012 -0.0221 -0.0356 114 LEU D N 5854 C CA . LEU D 114 ? 0.2402 0.2574 0.2770 -0.0161 -0.0292 -0.0311 114 LEU D CA 5855 C C . LEU D 114 ? 0.3066 0.2785 0.3064 -0.0147 -0.0369 -0.0317 114 LEU D C 5856 O O . LEU D 114 ? 0.2717 0.2337 0.2553 -0.0005 -0.0332 -0.0345 114 LEU D O 5857 C CB . LEU D 114 ? 0.2226 0.2707 0.2916 -0.0181 -0.0225 -0.0290 114 LEU D CB 5858 C CG . LEU D 114 ? 0.2367 0.2794 0.3195 -0.0340 -0.0270 -0.0230 114 LEU D CG 5859 C CD1 . LEU D 114 ? 0.3582 0.4036 0.4560 -0.0509 -0.0334 -0.0172 114 LEU D CD1 5860 C CD2 . LEU D 114 ? 0.1815 0.2519 0.2907 -0.0333 -0.0190 -0.0218 114 LEU D CD2 5861 N N . VAL D 115 ? 0.3404 0.2834 0.3254 -0.0300 -0.0487 -0.0282 115 VAL D N 5862 C CA . VAL D 115 ? 0.4006 0.2954 0.3472 -0.0330 -0.0588 -0.0276 115 VAL D CA 5863 C C . VAL D 115 ? 0.4229 0.3187 0.3890 -0.0547 -0.0662 -0.0186 115 VAL D C 5864 O O . VAL D 115 ? 0.4012 0.3136 0.3928 -0.0726 -0.0712 -0.0115 115 VAL D O 5865 C CB . VAL D 115 ? 0.4815 0.3345 0.3872 -0.0353 -0.0691 -0.0296 115 VAL D CB 5866 C CG1 . VAL D 115 ? 0.4848 0.2811 0.3456 -0.0411 -0.0818 -0.0285 115 VAL D CG1 5867 C CG2 . VAL D 115 ? 0.4728 0.3263 0.3583 -0.0116 -0.0596 -0.0375 115 VAL D CG2 5868 N N . THR D 116 ? 0.4122 0.2927 0.3673 -0.0524 -0.0663 -0.0177 116 THR D N 5869 C CA . THR D 116 ? 0.3755 0.2562 0.3461 -0.0724 -0.0725 -0.0079 116 THR D CA 5870 C C . THR D 116 ? 0.4180 0.2445 0.3451 -0.0828 -0.0877 -0.0048 116 THR D C 5871 O O . THR D 116 ? 0.4367 0.2258 0.3229 -0.0688 -0.0887 -0.0110 116 THR D O 5872 C CB . THR D 116 ? 0.3395 0.2418 0.3295 -0.0656 -0.0623 -0.0074 116 THR D CB 5873 O OG1 . THR D 116 ? 0.2571 0.2051 0.2830 -0.0574 -0.0498 -0.0102 116 THR D OG1 5874 C CG2 . THR D 116 ? 0.2649 0.1694 0.2709 -0.0859 -0.0673 0.0043 116 THR D CG2 5875 N N . VAL D 117 ? 0.4149 0.2498 0.3525 -0.0986 -0.0934 0.0064 117 VAL D N 5876 C CA . VAL D 117 ? 0.4216 0.2201 0.3243 -0.1064 -0.1047 0.0126 117 VAL D CA 5877 C C . VAL D 117 ? 0.4164 0.2320 0.3389 -0.1151 -0.1026 0.0221 117 VAL D C 5878 O O . VAL D 117 ? 0.3760 0.2304 0.3347 -0.1223 -0.0982 0.0309 117 VAL D O 5879 C CB . VAL D 117 ? 0.5048 0.3004 0.4005 -0.1160 -0.1136 0.0193 117 VAL D CB 5880 C CG1 . VAL D 117 ? 0.4776 0.2248 0.3246 -0.1230 -0.1282 0.0237 117 VAL D CG1 5881 C CG2 . VAL D 117 ? 0.5410 0.3324 0.4287 -0.1078 -0.1123 0.0108 117 VAL D CG2 5882 N N . SER D 118 ? 0.4904 0.2750 0.3859 -0.1114 -0.1048 0.0194 118 SER D N 5883 C CA . SER D 118 ? 0.5097 0.3056 0.4187 -0.1191 -0.1030 0.0277 118 SER D CA 5884 C C . SER D 118 ? 0.5445 0.2890 0.4046 -0.1172 -0.1117 0.0261 118 SER D C 5885 O O . SER D 118 ? 0.5980 0.3033 0.4191 -0.1028 -0.1136 0.0158 118 SER D O 5886 C CB . SER D 118 ? 0.4652 0.2956 0.4105 -0.1128 -0.0890 0.0253 118 SER D CB 5887 O OG . SER D 118 ? 0.5136 0.3489 0.4656 -0.1185 -0.0866 0.0325 118 SER D OG 5888 N N . ALA D 119 ? 0.5329 0.2777 0.3934 -0.1294 -0.1161 0.0361 119 ALA D N 5889 C CA . ALA D 119 ? 0.6184 0.3163 0.4331 -0.1287 -0.1245 0.0355 119 ALA D CA 5890 C C . ALA D 119 ? 0.7106 0.4015 0.5231 -0.1165 -0.1155 0.0300 119 ALA D C 5891 O O . ALA D 119 ? 0.8212 0.4713 0.5933 -0.1103 -0.1202 0.0274 119 ALA D O 5892 C CB . ALA D 119 ? 0.6024 0.3023 0.4163 -0.1482 -0.1346 0.0488 119 ALA D CB 5893 N N . ALA D 120 ? 0.6200 0.3489 0.4730 -0.1117 -0.1027 0.0280 120 ALA D N 5894 C CA . ALA D 120 ? 0.6289 0.3565 0.4847 -0.1026 -0.0945 0.0252 120 ALA D CA 5895 C C . ALA D 120 ? 0.5900 0.2827 0.4101 -0.0772 -0.0925 0.0114 120 ALA D C 5896 O O . ALA D 120 ? 0.5534 0.2179 0.3431 -0.0669 -0.0973 0.0039 120 ALA D O 5897 C CB . ALA D 120 ? 0.5129 0.2941 0.4223 -0.1061 -0.0820 0.0285 120 ALA D CB 5898 N N . SER D 121 ? 0.5501 0.2585 0.3779 -0.0617 -0.0818 0.0085 121 SER D N 5899 C CA . SER D 121 ? 0.5328 0.2282 0.3358 -0.0321 -0.0761 -0.0023 121 SER D CA 5900 C C . SER D 121 ? 0.4983 0.2483 0.3401 -0.0166 -0.0621 -0.0083 121 SER D C 5901 O O . SER D 121 ? 0.4802 0.2740 0.3650 -0.0270 -0.0552 -0.0043 121 SER D O 5902 C CB . SER D 121 ? 0.6060 0.2824 0.3906 -0.0256 -0.0753 -0.0003 121 SER D CB 5903 O OG . SER D 121 ? 0.7979 0.4207 0.5435 -0.0409 -0.0889 0.0061 121 SER D OG 5904 N N . THR D 122 ? 0.4850 0.2315 0.3101 0.0083 -0.0578 -0.0171 122 THR D N 5905 C CA . THR D 122 ? 0.4242 0.2214 0.2830 0.0230 -0.0457 -0.0216 122 THR D CA 5906 C C . THR D 122 ? 0.4609 0.2742 0.3294 0.0307 -0.0397 -0.0202 122 THR D C 5907 O O . THR D 122 ? 0.4406 0.2198 0.2778 0.0378 -0.0437 -0.0194 122 THR D O 5908 C CB . THR D 122 ? 0.4643 0.2560 0.3026 0.0477 -0.0426 -0.0290 122 THR D CB 5909 O OG1 . THR D 122 ? 0.4823 0.2555 0.3081 0.0397 -0.0484 -0.0304 122 THR D OG1 5910 C CG2 . THR D 122 ? 0.4865 0.3337 0.3611 0.0602 -0.0312 -0.0315 122 THR D CG2 5911 N N . LYS D 123 ? 0.3744 0.2361 0.2832 0.0284 -0.0312 -0.0197 123 LYS D N 5912 C CA . LYS D 123 ? 0.3288 0.2078 0.2469 0.0351 -0.0260 -0.0186 123 LYS D CA 5913 C C . LYS D 123 ? 0.2977 0.2259 0.2485 0.0424 -0.0177 -0.0214 123 LYS D C 5914 O O . LYS D 123 ? 0.2395 0.1945 0.2188 0.0310 -0.0144 -0.0211 123 LYS D O 5915 C CB . LYS D 123 ? 0.3334 0.2092 0.2612 0.0151 -0.0265 -0.0116 123 LYS D CB 5916 C CG . LYS D 123 ? 0.3731 0.2582 0.3033 0.0205 -0.0221 -0.0100 123 LYS D CG 5917 C CD . LYS D 123 ? 0.4867 0.3617 0.4194 0.0014 -0.0225 -0.0019 123 LYS D CD 5918 C CE . LYS D 123 ? 0.5289 0.4176 0.4674 0.0049 -0.0165 -0.0004 123 LYS D CE 5919 N NZ . LYS D 123 ? 0.4923 0.4227 0.4605 0.0088 -0.0086 -0.0041 123 LYS D NZ 5920 N N . GLY D 124 ? 0.3325 0.2718 0.2782 0.0613 -0.0151 -0.0232 124 GLY D N 5921 C CA . GLY D 124 ? 0.2204 0.2053 0.1946 0.0664 -0.0094 -0.0242 124 GLY D CA 5922 C C . GLY D 124 ? 0.1976 0.2002 0.1922 0.0528 -0.0066 -0.0215 124 GLY D C 5923 O O . GLY D 124 ? 0.2120 0.1934 0.1956 0.0458 -0.0079 -0.0186 124 GLY D O 5924 N N . PRO D 125 ? 0.2468 0.2859 0.2684 0.0489 -0.0025 -0.0223 125 PRO D N 5925 C CA . PRO D 125 ? 0.1473 0.2001 0.1851 0.0362 0.0009 -0.0205 125 PRO D CA 5926 C C . PRO D 125 ? 0.2248 0.2850 0.2568 0.0434 0.0002 -0.0193 125 PRO D C 5927 O O . PRO D 125 ? 0.1769 0.2446 0.2014 0.0585 -0.0027 -0.0191 125 PRO D O 5928 C CB . PRO D 125 ? 0.1979 0.2813 0.2610 0.0303 0.0039 -0.0223 125 PRO D CB 5929 C CG . PRO D 125 ? 0.1656 0.2643 0.2275 0.0448 0.0019 -0.0238 125 PRO D CG 5930 C CD . PRO D 125 ? 0.2163 0.2837 0.2518 0.0561 -0.0011 -0.0244 125 PRO D CD 5931 N N . SER D 126 ? 0.2418 0.3004 0.2767 0.0333 0.0029 -0.0176 126 SER D N 5932 C CA . SER D 126 ? 0.2303 0.2983 0.2611 0.0369 0.0016 -0.0165 126 SER D CA 5933 C C . SER D 126 ? 0.2161 0.3102 0.2662 0.0285 0.0038 -0.0179 126 SER D C 5934 O O . SER D 126 ? 0.1733 0.2683 0.2354 0.0178 0.0087 -0.0189 126 SER D O 5935 C CB . SER D 126 ? 0.2347 0.2799 0.2506 0.0313 0.0035 -0.0138 126 SER D CB 5936 O OG . SER D 126 ? 0.3520 0.3685 0.3498 0.0344 0.0014 -0.0118 126 SER D OG 5937 N N . VAL D 127 ? 0.1906 0.3055 0.2431 0.0331 -0.0007 -0.0171 127 VAL D N 5938 C CA . VAL D 127 ? 0.1609 0.2978 0.2277 0.0238 -0.0010 -0.0178 127 VAL D CA 5939 C C . VAL D 127 ? 0.2223 0.3555 0.2779 0.0184 -0.0036 -0.0165 127 VAL D C 5940 O O . VAL D 127 ? 0.2818 0.4189 0.3279 0.0254 -0.0097 -0.0134 127 VAL D O 5941 C CB . VAL D 127 ? 0.1530 0.3214 0.2334 0.0298 -0.0057 -0.0162 127 VAL D CB 5942 C CG1 . VAL D 127 ? 0.0838 0.2719 0.1767 0.0170 -0.0075 -0.0161 127 VAL D CG1 5943 C CG2 . VAL D 127 ? 0.1530 0.3214 0.2393 0.0366 -0.0028 -0.0178 127 VAL D CG2 5944 N N . PHE D 128 ? 0.1476 0.2717 0.2023 0.0070 0.0011 -0.0184 128 PHE D N 5945 C CA . PHE D 128 ? 0.1508 0.2638 0.1889 0.0014 -0.0002 -0.0179 128 PHE D CA 5946 C C . PHE D 128 ? 0.2314 0.3546 0.2735 -0.0091 -0.0029 -0.0193 128 PHE D C 5947 O O . PHE D 128 ? 0.2371 0.3686 0.2941 -0.0132 0.0004 -0.0212 128 PHE D O 5948 C CB . PHE D 128 ? 0.1471 0.2325 0.1728 -0.0012 0.0094 -0.0183 128 PHE D CB 5949 C CG . PHE D 128 ? 0.1817 0.2536 0.2019 0.0058 0.0113 -0.0160 128 PHE D CG 5950 C CD1 . PHE D 128 ? 0.1796 0.2462 0.1853 0.0138 0.0047 -0.0137 128 PHE D CD1 5951 C CD2 . PHE D 128 ? 0.1772 0.2404 0.2052 0.0034 0.0185 -0.0152 128 PHE D CD2 5952 C CE1 . PHE D 128 ? 0.2018 0.2504 0.1978 0.0196 0.0056 -0.0115 128 PHE D CE1 5953 C CE2 . PHE D 128 ? 0.2725 0.3193 0.2918 0.0071 0.0185 -0.0122 128 PHE D CE2 5954 C CZ . PHE D 128 ? 0.2165 0.2538 0.2182 0.0153 0.0121 -0.0108 128 PHE D CZ 5955 N N . PRO D 129 ? 0.2043 0.3242 0.2305 -0.0144 -0.0099 -0.0181 129 PRO D N 5956 C CA . PRO D 129 ? 0.1735 0.2977 0.1974 -0.0265 -0.0149 -0.0188 129 PRO D CA 5957 C C . PRO D 129 ? 0.2358 0.3320 0.2461 -0.0324 -0.0053 -0.0231 129 PRO D C 5958 O O . PRO D 129 ? 0.2033 0.2754 0.1968 -0.0290 0.0023 -0.0239 129 PRO D O 5959 C CB . PRO D 129 ? 0.1702 0.2950 0.1764 -0.0303 -0.0270 -0.0151 129 PRO D CB 5960 C CG . PRO D 129 ? 0.1852 0.2899 0.1752 -0.0216 -0.0229 -0.0148 129 PRO D CG 5961 C CD . PRO D 129 ? 0.1720 0.2823 0.1791 -0.0103 -0.0152 -0.0152 129 PRO D CD 5962 N N . LEU D 130 ? 0.2119 0.3113 0.2285 -0.0402 -0.0053 -0.0250 130 LEU D N 5963 C CA . LEU D 130 ? 0.2664 0.3374 0.2645 -0.0450 0.0020 -0.0285 130 LEU D CA 5964 C C . LEU D 130 ? 0.2534 0.3156 0.2297 -0.0570 -0.0101 -0.0284 130 LEU D C 5965 O O . LEU D 130 ? 0.2783 0.3549 0.2637 -0.0661 -0.0181 -0.0274 130 LEU D O 5966 C CB . LEU D 130 ? 0.2435 0.3193 0.2602 -0.0451 0.0099 -0.0303 130 LEU D CB 5967 C CG . LEU D 130 ? 0.2307 0.3140 0.2683 -0.0361 0.0202 -0.0293 130 LEU D CG 5968 C CD1 . LEU D 130 ? 0.1411 0.2348 0.1993 -0.0378 0.0240 -0.0300 130 LEU D CD1 5969 C CD2 . LEU D 130 ? 0.1481 0.2082 0.1717 -0.0305 0.0323 -0.0287 130 LEU D CD2 5970 N N . ALA D 131 ? 0.2488 0.2857 0.1940 -0.0585 -0.0124 -0.0287 131 ALA D N 5971 C CA . ALA D 131 ? 0.3484 0.3787 0.2713 -0.0716 -0.0282 -0.0270 131 ALA D CA 5972 C C . ALA D 131 ? 0.4058 0.3919 0.2895 -0.0782 -0.0258 -0.0314 131 ALA D C 5973 O O . ALA D 131 ? 0.4045 0.3613 0.2681 -0.0695 -0.0123 -0.0347 131 ALA D O 5974 C CB . ALA D 131 ? 0.3290 0.3638 0.2419 -0.0698 -0.0371 -0.0229 131 ALA D CB 5975 N N . PRO D 132 ? 0.5393 0.5187 0.4090 -0.0933 -0.0388 -0.0309 132 PRO D N 5976 C CA . PRO D 132 ? 0.5942 0.5242 0.4184 -0.1000 -0.0387 -0.0354 132 PRO D CA 5977 C C . PRO D 132 ? 0.7828 0.6848 0.5669 -0.1048 -0.0475 -0.0348 132 PRO D C 5978 O O . PRO D 132 ? 0.7522 0.6771 0.5454 -0.1067 -0.0579 -0.0297 132 PRO D O 5979 C CB . PRO D 132 ? 0.6122 0.5481 0.4375 -0.1173 -0.0531 -0.0334 132 PRO D CB 5980 C CG . PRO D 132 ? 0.5682 0.5561 0.4287 -0.1237 -0.0671 -0.0253 132 PRO D CG 5981 C CD . PRO D 132 ? 0.5644 0.5810 0.4587 -0.1052 -0.0542 -0.0252 132 PRO D CD 5982 N N . SER D 133 ? 0.9843 0.8341 0.7209 -0.1063 -0.0434 -0.0399 133 SER D N 5983 C CA . SER D 133 ? 1.0978 0.9121 0.7874 -0.1122 -0.0523 -0.0401 133 SER D CA 5984 C C . SER D 133 ? 1.2101 0.9891 0.8627 -0.1285 -0.0666 -0.0399 133 SER D C 5985 O O . SER D 133 ? 1.2897 1.0672 0.9497 -0.1335 -0.0670 -0.0404 133 SER D O 5986 C CB . SER D 133 ? 1.1098 0.8889 0.7723 -0.0949 -0.0317 -0.0448 133 SER D CB 5987 O OG . SER D 133 ? 1.1230 0.8675 0.7647 -0.0874 -0.0165 -0.0503 133 SER D OG 5988 N N . GLY D 140 ? 0.7446 0.4199 0.3564 -0.1913 -0.0986 -0.0196 140 GLY D N 5989 C CA . GLY D 140 ? 0.6298 0.3556 0.2763 -0.2013 -0.1092 -0.0119 140 GLY D CA 5990 C C . GLY D 140 ? 0.5971 0.3860 0.3027 -0.1952 -0.1035 -0.0120 140 GLY D C 5991 O O . GLY D 140 ? 0.6359 0.4725 0.3760 -0.2023 -0.1115 -0.0031 140 GLY D O 5992 N N . THR D 141 ? 0.2381 0.2332 0.2835 -0.0247 -0.0036 -0.0414 141 THR D N 5993 C CA . THR D 141 ? 0.2124 0.2213 0.2653 -0.0219 -0.0024 -0.0294 141 THR D CA 5994 C C . THR D 141 ? 0.2474 0.2674 0.2935 -0.0170 0.0069 -0.0310 141 THR D C 5995 O O . THR D 141 ? 0.2797 0.2960 0.3254 -0.0129 0.0150 -0.0410 141 THR D O 5996 C CB . THR D 141 ? 0.2220 0.2227 0.2916 -0.0178 -0.0055 -0.0258 141 THR D CB 5997 O OG1 . THR D 141 ? 0.3045 0.2941 0.3759 -0.0256 -0.0159 -0.0192 141 THR D OG1 5998 C CG2 . THR D 141 ? 0.2346 0.2480 0.3078 -0.0147 -0.0024 -0.0163 141 THR D CG2 5999 N N . ALA D 142 ? 0.2728 0.3063 0.3148 -0.0181 0.0060 -0.0221 142 ALA D N 6000 C CA . ALA D 142 ? 0.2715 0.3128 0.3057 -0.0147 0.0123 -0.0214 142 ALA D CA 6001 C C . ALA D 142 ? 0.3140 0.3643 0.3600 -0.0099 0.0146 -0.0136 142 ALA D C 6002 O O . ALA D 142 ? 0.2635 0.3181 0.3180 -0.0116 0.0106 -0.0065 142 ALA D O 6003 C CB . ALA D 142 ? 0.2265 0.2729 0.2476 -0.0188 0.0065 -0.0181 142 ALA D CB 6004 N N . ALA D 143 ? 0.2780 0.3305 0.3226 -0.0058 0.0219 -0.0154 143 ALA D N 6005 C CA . ALA D 143 ? 0.1938 0.2538 0.2466 -0.0020 0.0234 -0.0085 143 ALA D CA 6006 C C . ALA D 143 ? 0.1856 0.2519 0.2273 -0.0022 0.0241 -0.0045 143 ALA D C 6007 O O . ALA D 143 ? 0.2658 0.3280 0.2921 -0.0049 0.0256 -0.0078 143 ALA D O 6008 C CB . ALA D 143 ? 0.2060 0.2641 0.2706 0.0025 0.0293 -0.0132 143 ALA D CB 6009 N N . LEU D 144 ? 0.1699 0.2438 0.2178 -0.0004 0.0220 0.0022 144 LEU D N 6010 C CA . LEU D 144 ? 0.2668 0.3443 0.3085 0.0011 0.0212 0.0056 144 LEU D CA 6011 C C . LEU D 144 ? 0.3109 0.3936 0.3616 0.0043 0.0234 0.0096 144 LEU D C 6012 O O . LEU D 144 ? 0.3056 0.3891 0.3643 0.0036 0.0240 0.0107 144 LEU D O 6013 C CB . LEU D 144 ? 0.2894 0.3705 0.3300 -0.0004 0.0127 0.0070 144 LEU D CB 6014 C CG . LEU D 144 ? 0.2847 0.3761 0.3408 -0.0018 0.0101 0.0074 144 LEU D CG 6015 C CD1 . LEU D 144 ? 0.3263 0.4277 0.3937 0.0015 0.0117 0.0093 144 LEU D CD1 6016 C CD2 . LEU D 144 ? 0.2214 0.3152 0.2792 -0.0052 0.0015 0.0057 144 LEU D CD2 6017 N N . GLY D 145 ? 0.2653 0.3483 0.3120 0.0064 0.0233 0.0121 145 GLY D N 6018 C CA . GLY D 145 ? 0.1066 0.1928 0.1597 0.0088 0.0254 0.0147 145 GLY D CA 6019 C C . GLY D 145 ? 0.1090 0.1935 0.1584 0.0112 0.0233 0.0170 145 GLY D C 6020 O O . GLY D 145 ? 0.1463 0.2262 0.1880 0.0109 0.0179 0.0181 145 GLY D O 6021 N N . CYS D 146 ? 0.2026 0.2879 0.2561 0.0127 0.0255 0.0183 146 CYS D N 6022 C CA . CYS D 146 ? 0.2129 0.2942 0.2642 0.0150 0.0231 0.0201 146 CYS D CA 6023 C C . CYS D 146 ? 0.2741 0.3509 0.3225 0.0134 0.0269 0.0220 146 CYS D C 6024 O O . CYS D 146 ? 0.2662 0.3458 0.3203 0.0126 0.0294 0.0217 146 CYS D O 6025 C CB . CYS D 146 ? 0.2086 0.2962 0.2706 0.0183 0.0219 0.0171 146 CYS D CB 6026 S SG . CYS D 146 ? 0.3547 0.4495 0.4283 0.0214 0.0151 0.0136 146 CYS D SG 6027 N N . LEU D 147 ? 0.3095 0.3784 0.3486 0.0115 0.0259 0.0246 147 LEU D N 6028 C CA . LEU D 147 ? 0.2538 0.3195 0.2922 0.0087 0.0292 0.0263 147 LEU D CA 6029 C C . LEU D 147 ? 0.2659 0.3261 0.3052 0.0115 0.0242 0.0278 147 LEU D C 6030 O O . LEU D 147 ? 0.3451 0.3966 0.3789 0.0130 0.0176 0.0298 147 LEU D O 6031 C CB . LEU D 147 ? 0.2389 0.2982 0.2643 0.0018 0.0329 0.0279 147 LEU D CB 6032 C CG . LEU D 147 ? 0.2055 0.2636 0.2320 -0.0037 0.0380 0.0290 147 LEU D CG 6033 C CD1 . LEU D 147 ? 0.1402 0.2102 0.1868 -0.0022 0.0432 0.0246 147 LEU D CD1 6034 C CD2 . LEU D 147 ? 0.1954 0.2468 0.2042 -0.0140 0.0438 0.0298 147 LEU D CD2 6035 N N . VAL D 148 ? 0.2087 0.2718 0.2547 0.0120 0.0257 0.0264 148 VAL D N 6036 C CA . VAL D 148 ? 0.2088 0.2662 0.2552 0.0141 0.0225 0.0252 148 VAL D CA 6037 C C . VAL D 148 ? 0.2552 0.3059 0.2986 0.0095 0.0225 0.0284 148 VAL D C 6038 O O . VAL D 148 ? 0.1951 0.2495 0.2432 0.0066 0.0240 0.0283 148 VAL D O 6039 C CB . VAL D 148 ? 0.2187 0.2823 0.2692 0.0149 0.0246 0.0204 148 VAL D CB 6040 C CG1 . VAL D 148 ? 0.1228 0.1805 0.1729 0.0167 0.0235 0.0157 148 VAL D CG1 6041 C CG2 . VAL D 148 ? 0.1093 0.1818 0.1643 0.0168 0.0263 0.0175 148 VAL D CG2 6042 N N . LYS D 149 ? 0.2269 0.2662 0.2628 0.0077 0.0189 0.0318 149 LYS D N 6043 C CA . LYS D 149 ? 0.2613 0.2953 0.2930 0.0000 0.0207 0.0357 149 LYS D CA 6044 C C . LYS D 149 ? 0.2074 0.2273 0.2355 -0.0009 0.0145 0.0371 149 LYS D C 6045 O O . LYS D 149 ? 0.2185 0.2277 0.2443 0.0044 0.0073 0.0362 149 LYS D O 6046 C CB . LYS D 149 ? 0.2814 0.3110 0.3007 -0.0068 0.0232 0.0397 149 LYS D CB 6047 C CG . LYS D 149 ? 0.3203 0.3495 0.3370 -0.0178 0.0297 0.0418 149 LYS D CG 6048 C CD . LYS D 149 ? 0.3691 0.3989 0.3729 -0.0267 0.0376 0.0422 149 LYS D CD 6049 C CE . LYS D 149 ? 0.3199 0.3574 0.3289 -0.0383 0.0493 0.0402 149 LYS D CE 6050 N NZ . LYS D 149 ? 0.3949 0.4185 0.3949 -0.0464 0.0448 0.0465 149 LYS D NZ 6051 N N . ASP D 150 ? 0.2167 0.2367 0.2476 -0.0075 0.0164 0.0384 150 ASP D N 6052 C CA . ASP D 150 ? 0.1952 0.2000 0.2210 -0.0117 0.0109 0.0408 150 ASP D CA 6053 C C . ASP D 150 ? 0.2391 0.2359 0.2664 -0.0047 0.0049 0.0352 150 ASP D C 6054 O O . ASP D 150 ? 0.2222 0.2029 0.2453 -0.0014 -0.0021 0.0347 150 ASP D O 6055 C CB . ASP D 150 ? 0.1984 0.1865 0.2090 -0.0176 0.0069 0.0476 150 ASP D CB 6056 C CG . ASP D 150 ? 0.2741 0.2687 0.2789 -0.0301 0.0164 0.0515 150 ASP D CG 6057 O OD1 . ASP D 150 ? 0.2002 0.2122 0.2198 -0.0331 0.0249 0.0479 150 ASP D OD1 6058 O OD2 . ASP D 150 ? 0.2996 0.2813 0.2856 -0.0378 0.0149 0.0574 150 ASP D OD2 6059 N N . TYR D 151 ? 0.2291 0.2353 0.2618 -0.0032 0.0073 0.0302 151 TYR D N 6060 C CA . TYR D 151 ? 0.1763 0.1755 0.2066 0.0006 0.0048 0.0226 151 TYR D CA 6061 C C . TYR D 151 ? 0.2175 0.2146 0.2449 -0.0062 0.0028 0.0216 151 TYR D C 6062 O O . TYR D 151 ? 0.2672 0.2730 0.2999 -0.0117 0.0027 0.0263 151 TYR D O 6063 C CB . TYR D 151 ? 0.1849 0.1944 0.2176 0.0068 0.0096 0.0157 151 TYR D CB 6064 C CG . TYR D 151 ? 0.1556 0.1784 0.1882 0.0032 0.0133 0.0174 151 TYR D CG 6065 C CD1 . TYR D 151 ? 0.1756 0.2091 0.2140 0.0041 0.0159 0.0219 151 TYR D CD1 6066 C CD2 . TYR D 151 ? 0.2226 0.2442 0.2475 -0.0021 0.0127 0.0146 151 TYR D CD2 6067 C CE1 . TYR D 151 ? 0.1345 0.1768 0.1749 0.0015 0.0170 0.0234 151 TYR D CE1 6068 C CE2 . TYR D 151 ? 0.2814 0.3102 0.3049 -0.0061 0.0122 0.0179 151 TYR D CE2 6069 C CZ . TYR D 151 ? 0.2851 0.3243 0.3186 -0.0034 0.0140 0.0222 151 TYR D CZ 6070 O OH . TYR D 151 ? 0.2577 0.3011 0.2920 -0.0067 0.0114 0.0254 151 TYR D OH 6071 N N . PHE D 152 ? 0.2197 0.2046 0.2403 -0.0057 0.0002 0.0144 152 PHE D N 6072 C CA . PHE D 152 ? 0.2107 0.1898 0.2237 -0.0132 -0.0035 0.0126 152 PHE D CA 6073 C C . PHE D 152 ? 0.2895 0.2582 0.2916 -0.0114 -0.0017 0.0000 152 PHE D C 6074 O O . PHE D 152 ? 0.3562 0.3172 0.3628 -0.0041 -0.0007 -0.0069 152 PHE D O 6075 C CB . PHE D 152 ? 0.2148 0.1846 0.2305 -0.0201 -0.0100 0.0186 152 PHE D CB 6076 C CG . PHE D 152 ? 0.2654 0.2330 0.2778 -0.0292 -0.0164 0.0192 152 PHE D CG 6077 C CD1 . PHE D 152 ? 0.2110 0.1927 0.2348 -0.0338 -0.0190 0.0255 152 PHE D CD1 6078 C CD2 . PHE D 152 ? 0.2592 0.2097 0.2584 -0.0330 -0.0214 0.0125 152 PHE D CD2 6079 C CE1 . PHE D 152 ? 0.3244 0.3032 0.3477 -0.0422 -0.0290 0.0267 152 PHE D CE1 6080 C CE2 . PHE D 152 ? 0.3278 0.2742 0.3214 -0.0428 -0.0300 0.0136 152 PHE D CE2 6081 C CZ . PHE D 152 ? 0.2441 0.2047 0.2503 -0.0475 -0.0350 0.0216 152 PHE D CZ 6082 N N . PRO D 153 ? 0.2333 0.2012 0.2213 -0.0186 -0.0015 -0.0039 153 PRO D N 6083 C CA . PRO D 153 ? 0.2591 0.2340 0.2432 -0.0265 -0.0063 0.0043 153 PRO D CA 6084 C C . PRO D 153 ? 0.2626 0.2503 0.2456 -0.0245 0.0001 0.0045 153 PRO D C 6085 O O . PRO D 153 ? 0.2134 0.2076 0.2019 -0.0170 0.0087 -0.0010 153 PRO D O 6086 C CB . PRO D 153 ? 0.2680 0.2288 0.2299 -0.0365 -0.0110 -0.0014 153 PRO D CB 6087 C CG . PRO D 153 ? 0.2937 0.2500 0.2452 -0.0330 0.0003 -0.0166 153 PRO D CG 6088 C CD . PRO D 153 ? 0.3127 0.2704 0.2857 -0.0204 0.0030 -0.0184 153 PRO D CD 6089 N N . GLU D 154 ? 0.2570 0.2468 0.2336 -0.0317 -0.0059 0.0108 154 GLU D N 6090 C CA . GLU D 154 ? 0.2719 0.2687 0.2414 -0.0330 -0.0013 0.0111 154 GLU D CA 6091 C C . GLU D 154 ? 0.3207 0.3104 0.2656 -0.0396 0.0069 -0.0003 154 GLU D C 6092 O O . GLU D 154 ? 0.3008 0.2781 0.2319 -0.0443 0.0063 -0.0074 154 GLU D O 6093 C CB . GLU D 154 ? 0.3359 0.3315 0.3046 -0.0399 -0.0137 0.0215 154 GLU D CB 6094 C CG . GLU D 154 ? 0.4280 0.4357 0.4257 -0.0330 -0.0174 0.0289 154 GLU D CG 6095 C CD . GLU D 154 ? 0.4985 0.5078 0.5001 -0.0357 -0.0261 0.0361 154 GLU D CD 6096 O OE1 . GLU D 154 ? 0.5494 0.5528 0.5560 -0.0410 -0.0414 0.0420 154 GLU D OE1 6097 O OE2 . GLU D 154 ? 0.3647 0.3799 0.3654 -0.0327 -0.0194 0.0357 154 GLU D OE2 6098 N N . PRO D 155 ? 0.3478 0.3456 0.2871 -0.0411 0.0160 -0.0033 155 PRO D N 6099 C CA . PRO D 155 ? 0.3740 0.3848 0.3282 -0.0359 0.0171 0.0036 155 PRO D CA 6100 C C . PRO D 155 ? 0.3624 0.3864 0.3345 -0.0251 0.0287 -0.0044 155 PRO D C 6101 O O . PRO D 155 ? 0.3265 0.3500 0.3025 -0.0207 0.0354 -0.0158 155 PRO D O 6102 C CB . PRO D 155 ? 0.3274 0.3341 0.2571 -0.0492 0.0184 0.0047 155 PRO D CB 6103 C CG . PRO D 155 ? 0.2608 0.2635 0.1712 -0.0559 0.0309 -0.0103 155 PRO D CG 6104 C CD . PRO D 155 ? 0.3831 0.3757 0.2954 -0.0523 0.0257 -0.0141 155 PRO D CD 6105 N N . VAL D 156 ? 0.3373 0.3722 0.3217 -0.0209 0.0295 0.0009 156 VAL D N 6106 C CA . VAL D 156 ? 0.3479 0.3956 0.3482 -0.0127 0.0381 -0.0057 156 VAL D CA 6107 C C . VAL D 156 ? 0.2895 0.3449 0.2843 -0.0192 0.0425 -0.0041 156 VAL D C 6108 O O . VAL D 156 ? 0.3169 0.3667 0.3019 -0.0258 0.0354 0.0054 156 VAL D O 6109 C CB . VAL D 156 ? 0.3300 0.3810 0.3495 -0.0019 0.0331 0.0002 156 VAL D CB 6110 C CG1 . VAL D 156 ? 0.2945 0.3470 0.3160 -0.0037 0.0273 0.0110 156 VAL D CG1 6111 C CG2 . VAL D 156 ? 0.3564 0.4180 0.3917 0.0061 0.0378 -0.0057 156 VAL D CG2 6112 N N . THR D 157 ? 0.3314 0.3989 0.3344 -0.0180 0.0531 -0.0140 157 THR D N 6113 C CA . THR D 157 ? 0.3644 0.4397 0.3630 -0.0257 0.0577 -0.0123 157 THR D CA 6114 C C . THR D 157 ? 0.3416 0.4305 0.3649 -0.0156 0.0581 -0.0126 157 THR D C 6115 O O . THR D 157 ? 0.3976 0.4931 0.4406 -0.0049 0.0590 -0.0194 157 THR D O 6116 C CB . THR D 157 ? 0.3873 0.4675 0.3727 -0.0378 0.0719 -0.0245 157 THR D CB 6117 O OG1 . THR D 157 ? 0.4244 0.5184 0.4336 -0.0286 0.0819 -0.0402 157 THR D OG1 6118 C CG2 . THR D 157 ? 0.2964 0.3594 0.2498 -0.0507 0.0708 -0.0245 157 THR D CG2 6119 N N . VAL D 158 ? 0.3287 0.4193 0.3503 -0.0194 0.0550 -0.0048 158 VAL D N 6120 C CA . VAL D 158 ? 0.2505 0.3522 0.2914 -0.0122 0.0541 -0.0045 158 VAL D CA 6121 C C . VAL D 158 ? 0.2645 0.3732 0.3015 -0.0227 0.0596 -0.0051 158 VAL D C 6122 O O . VAL D 158 ? 0.3360 0.4342 0.3539 -0.0334 0.0565 0.0024 158 VAL D O 6123 C CB . VAL D 158 ? 0.2530 0.3477 0.2965 -0.0062 0.0439 0.0058 158 VAL D CB 6124 C CG1 . VAL D 158 ? 0.1649 0.2684 0.2234 -0.0002 0.0425 0.0052 158 VAL D CG1 6125 C CG2 . VAL D 158 ? 0.2510 0.3375 0.2949 0.0001 0.0392 0.0080 158 VAL D CG2 6126 N N . SER D 159 ? 0.2597 0.3851 0.3160 -0.0203 0.0660 -0.0137 159 SER D N 6127 C CA . SER D 159 ? 0.1385 0.2723 0.1955 -0.0301 0.0703 -0.0136 159 SER D CA 6128 C C . SER D 159 ? 0.2058 0.3495 0.2864 -0.0203 0.0644 -0.0136 159 SER D C 6129 O O . SER D 159 ? 0.2163 0.3587 0.3087 -0.0075 0.0573 -0.0135 159 SER D O 6130 C CB . SER D 159 ? 0.1777 0.3258 0.2364 -0.0412 0.0864 -0.0266 159 SER D CB 6131 O OG . SER D 159 ? 0.1979 0.3641 0.2885 -0.0302 0.0913 -0.0402 159 SER D OG 6132 N N . TRP D 160 ? 0.1384 0.2893 0.2228 -0.0280 0.0660 -0.0130 160 TRP D N 6133 C CA . TRP D 160 ? 0.1131 0.2720 0.2171 -0.0211 0.0589 -0.0130 160 TRP D CA 6134 C C . TRP D 160 ? 0.1733 0.3542 0.2990 -0.0273 0.0671 -0.0231 160 TRP D C 6135 O O . TRP D 160 ? 0.1924 0.3773 0.3085 -0.0427 0.0772 -0.0248 160 TRP D O 6136 C CB . TRP D 160 ? 0.1815 0.3260 0.2717 -0.0235 0.0500 -0.0023 160 TRP D CB 6137 C CG . TRP D 160 ? 0.2617 0.3905 0.3420 -0.0146 0.0421 0.0044 160 TRP D CG 6138 C CD1 . TRP D 160 ? 0.1115 0.2268 0.1760 -0.0163 0.0410 0.0099 160 TRP D CD1 6139 C CD2 . TRP D 160 ? 0.2013 0.3269 0.2867 -0.0046 0.0346 0.0058 160 TRP D CD2 6140 N NE1 . TRP D 160 ? 0.1634 0.2707 0.2278 -0.0075 0.0352 0.0132 160 TRP D NE1 6141 C CE2 . TRP D 160 ? 0.2279 0.3404 0.3019 -0.0013 0.0323 0.0109 160 TRP D CE2 6142 C CE3 . TRP D 160 ? 0.1365 0.2682 0.2339 0.0002 0.0289 0.0034 160 TRP D CE3 6143 C CZ2 . TRP D 160 ? 0.2547 0.3610 0.3268 0.0051 0.0277 0.0126 160 TRP D CZ2 6144 C CZ3 . TRP D 160 ? 0.1518 0.2735 0.2423 0.0063 0.0218 0.0068 160 TRP D CZ3 6145 C CH2 . TRP D 160 ? 0.2407 0.3503 0.3177 0.0079 0.0229 0.0109 160 TRP D CH2 6146 N N . ASN D 161 ? 0.1071 0.3016 0.2623 -0.0168 0.0619 -0.0296 161 ASN D N 6147 C CA . ASN D 161 ? 0.1126 0.3252 0.2933 -0.0196 0.0660 -0.0390 161 ASN D CA 6148 C C . ASN D 161 ? 0.1866 0.4020 0.3621 -0.0277 0.0808 -0.0478 161 ASN D C 6149 O O . ASN D 161 ? 0.1445 0.3672 0.3202 -0.0396 0.0887 -0.0512 161 ASN D O 6150 C CB . ASN D 161 ? 0.1123 0.3296 0.2941 -0.0294 0.0630 -0.0346 161 ASN D CB 6151 C CG . ASN D 161 ? 0.1831 0.3935 0.3681 -0.0204 0.0461 -0.0278 161 ASN D CG 6152 O OD1 . ASN D 161 ? 0.2323 0.4341 0.4180 -0.0077 0.0365 -0.0256 161 ASN D OD1 6153 N ND2 . ASN D 161 ? 0.1354 0.3435 0.3162 -0.0281 0.0413 -0.0233 161 ASN D ND2 6154 N N . SER D 162 ? 0.1558 0.3648 0.3249 -0.0222 0.0844 -0.0519 162 SER D N 6155 C CA . SER D 162 ? 0.2187 0.4293 0.3811 -0.0293 0.0982 -0.0626 162 SER D CA 6156 C C . SER D 162 ? 0.2382 0.4411 0.3679 -0.0492 0.1081 -0.0588 162 SER D C 6157 O O . SER D 162 ? 0.1961 0.4042 0.3221 -0.0596 0.1203 -0.0687 162 SER D O 6158 C CB . SER D 162 ? 0.1787 0.4073 0.3749 -0.0251 0.1021 -0.0769 162 SER D CB 6159 O OG . SER D 162 ? 0.2213 0.4526 0.4458 -0.0073 0.0894 -0.0792 162 SER D OG 6160 N N . GLY D 163 ? 0.1829 0.3723 0.2885 -0.0556 0.1021 -0.0448 163 GLY D N 6161 C CA . GLY D 163 ? 0.2449 0.4214 0.3163 -0.0753 0.1071 -0.0387 163 GLY D CA 6162 C C . GLY D 163 ? 0.3267 0.5046 0.3973 -0.0861 0.1048 -0.0325 163 GLY D C 6163 O O . GLY D 163 ? 0.4745 0.6359 0.5150 -0.1015 0.1030 -0.0228 163 GLY D O 6164 N N . ALA D 164 ? 0.2589 0.4541 0.3617 -0.0786 0.1028 -0.0374 164 ALA D N 6165 C CA . ALA D 164 ? 0.2657 0.4638 0.3704 -0.0897 0.1010 -0.0331 164 ALA D CA 6166 C C . ALA D 164 ? 0.2789 0.4622 0.3691 -0.0926 0.0891 -0.0187 164 ALA D C 6167 O O . ALA D 164 ? 0.3713 0.5486 0.4524 -0.1058 0.0868 -0.0128 164 ALA D O 6168 C CB . ALA D 164 ? 0.1789 0.3997 0.3236 -0.0813 0.1000 -0.0422 164 ALA D CB 6169 N N . LEU D 165 ? 0.2854 0.4627 0.3742 -0.0810 0.0813 -0.0138 165 LEU D N 6170 C CA . LEU D 165 ? 0.2328 0.3899 0.3091 -0.0778 0.0666 -0.0014 165 LEU D CA 6171 C C . LEU D 165 ? 0.3115 0.4445 0.3600 -0.0780 0.0613 0.0079 165 LEU D C 6172 O O . LEU D 165 ? 0.3755 0.5069 0.4250 -0.0662 0.0603 0.0064 165 LEU D O 6173 C CB . LEU D 165 ? 0.1735 0.3346 0.2702 -0.0590 0.0564 -0.0028 165 LEU D CB 6174 C CG . LEU D 165 ? 0.2375 0.3768 0.3221 -0.0523 0.0431 0.0064 165 LEU D CG 6175 C CD1 . LEU D 165 ? 0.2230 0.3525 0.3005 -0.0640 0.0383 0.0113 165 LEU D CD1 6176 C CD2 . LEU D 165 ? 0.1197 0.2632 0.2184 -0.0372 0.0359 0.0036 165 LEU D CD2 6177 N N . THR D 166 ? 0.3128 0.4256 0.3375 -0.0921 0.0558 0.0178 166 THR D N 6178 C CA . THR D 166 ? 0.3391 0.4277 0.3387 -0.0947 0.0476 0.0273 166 THR D CA 6179 C C . THR D 166 ? 0.3542 0.4193 0.3493 -0.0922 0.0305 0.0378 166 THR D C 6180 O O . THR D 166 ? 0.4231 0.4719 0.4135 -0.0848 0.0197 0.0437 166 THR D O 6181 C CB . THR D 166 ? 0.3034 0.3838 0.2731 -0.1179 0.0547 0.0300 166 THR D CB 6182 O OG1 . THR D 166 ? 0.2857 0.3633 0.2484 -0.1353 0.0558 0.0334 166 THR D OG1 6183 C CG2 . THR D 166 ? 0.2344 0.3368 0.2079 -0.1206 0.0737 0.0163 166 THR D CG2 6184 N N . SER D 167 ? 0.3314 0.3954 0.3312 -0.0985 0.0280 0.0390 167 SER D N 6185 C CA . SER D 167 ? 0.4181 0.4591 0.4164 -0.0968 0.0122 0.0466 167 SER D CA 6186 C C . SER D 167 ? 0.3840 0.4262 0.4019 -0.0752 0.0066 0.0424 167 SER D C 6187 O O . SER D 167 ? 0.3294 0.3892 0.3635 -0.0659 0.0124 0.0345 167 SER D O 6188 C CB . SER D 167 ? 0.4918 0.5331 0.4921 -0.1085 0.0121 0.0467 167 SER D CB 6189 O OG . SER D 167 ? 0.6499 0.6647 0.6472 -0.1082 -0.0042 0.0537 167 SER D OG 6190 N N . GLY D 168 ? 0.3981 0.4216 0.4147 -0.0687 -0.0050 0.0475 168 GLY D N 6191 C CA . GLY D 168 ? 0.2669 0.2917 0.3020 -0.0510 -0.0079 0.0420 168 GLY D CA 6192 C C . GLY D 168 ? 0.2693 0.3085 0.3102 -0.0402 -0.0005 0.0378 168 GLY D C 6193 O O . GLY D 168 ? 0.2882 0.3315 0.3420 -0.0280 0.0005 0.0324 168 GLY D O 6194 N N . VAL D 169 ? 0.2501 0.2961 0.2799 -0.0462 0.0057 0.0393 169 VAL D N 6195 C CA . VAL D 169 ? 0.2219 0.2777 0.2561 -0.0370 0.0110 0.0359 169 VAL D CA 6196 C C . VAL D 169 ? 0.2580 0.2997 0.2903 -0.0346 0.0014 0.0412 169 VAL D C 6197 O O . VAL D 169 ? 0.3574 0.3831 0.3758 -0.0448 -0.0076 0.0489 169 VAL D O 6198 C CB . VAL D 169 ? 0.2538 0.3226 0.2797 -0.0436 0.0219 0.0325 169 VAL D CB 6199 C CG1 . VAL D 169 ? 0.2199 0.2938 0.2483 -0.0351 0.0252 0.0296 169 VAL D CG1 6200 C CG2 . VAL D 169 ? 0.1807 0.2671 0.2177 -0.0441 0.0300 0.0256 169 VAL D CG2 6201 N N . HIS D 170 ? 0.1443 0.1911 0.1905 -0.0226 0.0021 0.0376 170 HIS D N 6202 C CA . HIS D 170 ? 0.1905 0.2292 0.2402 -0.0201 -0.0059 0.0412 170 HIS D CA 6203 C C . HIS D 170 ? 0.2198 0.2704 0.2707 -0.0148 0.0023 0.0374 170 HIS D C 6204 O O . HIS D 170 ? 0.2171 0.2780 0.2783 -0.0067 0.0094 0.0318 170 HIS D O 6205 C CB . HIS D 170 ? 0.1461 0.1795 0.2184 -0.0113 -0.0136 0.0390 170 HIS D CB 6206 C CG . HIS D 170 ? 0.2494 0.2680 0.3251 -0.0143 -0.0241 0.0416 170 HIS D CG 6207 N ND1 . HIS D 170 ? 0.2348 0.2332 0.2998 -0.0237 -0.0395 0.0515 170 HIS D ND1 6208 C CD2 . HIS D 170 ? 0.2286 0.2464 0.3156 -0.0100 -0.0230 0.0357 170 HIS D CD2 6209 C CE1 . HIS D 170 ? 0.2324 0.2178 0.3037 -0.0244 -0.0480 0.0521 170 HIS D CE1 6210 N NE2 . HIS D 170 ? 0.2608 0.2584 0.3464 -0.0158 -0.0375 0.0417 170 HIS D NE2 6211 N N . THR D 171 ? 0.1972 0.2436 0.2347 -0.0208 0.0008 0.0406 171 THR D N 6212 C CA . THR D 171 ? 0.2216 0.2755 0.2611 -0.0159 0.0063 0.0372 171 THR D CA 6213 C C . THR D 171 ? 0.2320 0.2784 0.2795 -0.0142 -0.0039 0.0408 171 THR D C 6214 O O . THR D 171 ? 0.2755 0.3089 0.3124 -0.0219 -0.0148 0.0470 171 THR D O 6215 C CB . THR D 171 ? 0.1983 0.2549 0.2204 -0.0226 0.0138 0.0345 171 THR D CB 6216 O OG1 . THR D 171 ? 0.2182 0.2862 0.2429 -0.0222 0.0231 0.0292 171 THR D OG1 6217 C CG2 . THR D 171 ? 0.1352 0.1953 0.1596 -0.0174 0.0171 0.0310 171 THR D CG2 6218 N N . PHE D 172 ? 0.2343 0.2886 0.3004 -0.0057 -0.0011 0.0371 172 PHE D N 6219 C CA . PHE D 172 ? 0.2665 0.3180 0.3498 -0.0035 -0.0104 0.0388 172 PHE D CA 6220 C C . PHE D 172 ? 0.2847 0.3324 0.3586 -0.0078 -0.0143 0.0415 172 PHE D C 6221 O O . PHE D 172 ? 0.3003 0.3504 0.3590 -0.0094 -0.0060 0.0393 172 PHE D O 6222 C CB . PHE D 172 ? 0.2064 0.2696 0.3140 0.0045 -0.0032 0.0319 172 PHE D CB 6223 C CG . PHE D 172 ? 0.2272 0.2909 0.3469 0.0082 -0.0024 0.0278 172 PHE D CG 6224 C CD1 . PHE D 172 ? 0.1188 0.1776 0.2621 0.0112 -0.0132 0.0268 172 PHE D CD1 6225 C CD2 . PHE D 172 ? 0.2183 0.2857 0.3272 0.0088 0.0072 0.0244 172 PHE D CD2 6226 C CE1 . PHE D 172 ? 0.1339 0.1911 0.2892 0.0150 -0.0127 0.0214 172 PHE D CE1 6227 C CE2 . PHE D 172 ? 0.2465 0.3124 0.3642 0.0114 0.0076 0.0198 172 PHE D CE2 6228 C CZ . PHE D 172 ? 0.2338 0.2943 0.3745 0.0146 -0.0015 0.0177 172 PHE D CZ 6229 N N . PRO D 173 ? 0.2348 0.2753 0.3193 -0.0097 -0.0286 0.0457 173 PRO D N 6230 C CA . PRO D 173 ? 0.2136 0.2506 0.2911 -0.0140 -0.0331 0.0475 173 PRO D CA 6231 C C . PRO D 173 ? 0.2457 0.2961 0.3355 -0.0085 -0.0210 0.0415 173 PRO D C 6232 O O . PRO D 173 ? 0.2936 0.3552 0.4067 -0.0025 -0.0151 0.0372 173 PRO D O 6233 C CB . PRO D 173 ? 0.2127 0.2427 0.3106 -0.0147 -0.0528 0.0523 173 PRO D CB 6234 C CG . PRO D 173 ? 0.1818 0.2035 0.2839 -0.0142 -0.0615 0.0555 173 PRO D CG 6235 C CD . PRO D 173 ? 0.2125 0.2460 0.3172 -0.0080 -0.0438 0.0487 173 PRO D CD 6236 N N . ALA D 174 ? 0.2335 0.2810 0.3064 -0.0119 -0.0171 0.0408 174 ALA D N 6237 C CA . ALA D 174 ? 0.2075 0.2623 0.2887 -0.0091 -0.0090 0.0373 174 ALA D CA 6238 C C . ALA D 174 ? 0.1781 0.2402 0.2877 -0.0088 -0.0141 0.0372 174 ALA D C 6239 O O . ALA D 174 ? 0.1785 0.2367 0.2991 -0.0113 -0.0282 0.0404 174 ALA D O 6240 C CB . ALA D 174 ? 0.1694 0.2155 0.2294 -0.0132 -0.0081 0.0364 174 ALA D CB 6241 N N . VAL D 175 ? 0.1162 0.1885 0.2380 -0.0071 -0.0033 0.0333 175 VAL D N 6242 C CA . VAL D 175 ? 0.2489 0.3310 0.3988 -0.0091 -0.0048 0.0312 175 VAL D CA 6243 C C . VAL D 175 ? 0.2113 0.2901 0.3512 -0.0146 -0.0012 0.0321 175 VAL D C 6244 O O . VAL D 175 ? 0.2249 0.2976 0.3431 -0.0146 0.0067 0.0324 175 VAL D O 6245 C CB . VAL D 175 ? 0.3412 0.4396 0.5171 -0.0062 0.0068 0.0241 175 VAL D CB 6246 C CG1 . VAL D 175 ? 0.3761 0.4750 0.5629 0.0000 0.0023 0.0222 175 VAL D CG1 6247 C CG2 . VAL D 175 ? 0.4243 0.5239 0.5821 -0.0082 0.0229 0.0219 175 VAL D CG2 6248 N N . LEU D 176 ? 0.2031 0.2842 0.3600 -0.0193 -0.0095 0.0329 176 LEU D N 6249 C CA . LEU D 176 ? 0.2015 0.2795 0.3528 -0.0260 -0.0066 0.0336 176 LEU D CA 6250 C C . LEU D 176 ? 0.2112 0.3045 0.3818 -0.0296 0.0076 0.0293 176 LEU D C 6251 O O . LEU D 176 ? 0.1548 0.2652 0.3603 -0.0304 0.0088 0.0244 176 LEU D O 6252 C CB . LEU D 176 ? 0.2241 0.2974 0.3837 -0.0315 -0.0221 0.0361 176 LEU D CB 6253 C CG . LEU D 176 ? 0.3018 0.3685 0.4542 -0.0396 -0.0216 0.0370 176 LEU D CG 6254 C CD1 . LEU D 176 ? 0.2646 0.3141 0.3815 -0.0386 -0.0155 0.0377 176 LEU D CD1 6255 C CD2 . LEU D 176 ? 0.1652 0.2251 0.3228 -0.0452 -0.0399 0.0394 176 LEU D CD2 6256 N N . GLN D 177 ? 0.2437 0.3302 0.3917 -0.0325 0.0182 0.0304 177 GLN D N 6257 C CA . GLN D 177 ? 0.2280 0.3240 0.3825 -0.0403 0.0329 0.0274 177 GLN D CA 6258 C C . GLN D 177 ? 0.1748 0.2725 0.3403 -0.0513 0.0317 0.0285 177 GLN D C 6259 O O . GLN D 177 ? 0.2456 0.3312 0.4038 -0.0521 0.0194 0.0326 177 GLN D O 6260 C CB . GLN D 177 ? 0.1460 0.2283 0.2672 -0.0416 0.0398 0.0307 177 GLN D CB 6261 C CG . GLN D 177 ? 0.1982 0.2816 0.3108 -0.0333 0.0432 0.0287 177 GLN D CG 6262 C CD . GLN D 177 ? 0.2801 0.3458 0.3608 -0.0317 0.0416 0.0336 177 GLN D CD 6263 O OE1 . GLN D 177 ? 0.3223 0.3873 0.3910 -0.0326 0.0481 0.0330 177 GLN D OE1 6264 N NE2 . GLN D 177 ? 0.2876 0.3384 0.3561 -0.0292 0.0318 0.0375 177 GLN D NE2 6265 N N . SER D 178 ? 0.2249 0.3373 0.4063 -0.0613 0.0457 0.0239 178 SER D N 6266 C CA . SER D 178 ? 0.2540 0.3717 0.4505 -0.0742 0.0465 0.0240 178 SER D CA 6267 C C . SER D 178 ? 0.2289 0.3211 0.3905 -0.0818 0.0415 0.0330 178 SER D C 6268 O O . SER D 178 ? 0.2335 0.3238 0.4024 -0.0920 0.0376 0.0349 178 SER D O 6269 C CB . SER D 178 ? 0.3160 0.4565 0.5352 -0.0858 0.0669 0.0153 178 SER D CB 6270 O OG . SER D 178 ? 0.4276 0.5599 0.6146 -0.0910 0.0812 0.0160 178 SER D OG 6271 N N . SER D 179 ? 0.1864 0.2586 0.3128 -0.0766 0.0403 0.0378 179 SER D N 6272 C CA . SER D 179 ? 0.2056 0.2504 0.3012 -0.0805 0.0328 0.0454 179 SER D CA 6273 C C . SER D 179 ? 0.2881 0.3202 0.3805 -0.0719 0.0170 0.0461 179 SER D C 6274 O O . SER D 179 ? 0.2820 0.2908 0.3538 -0.0731 0.0093 0.0498 179 SER D O 6275 C CB . SER D 179 ? 0.2130 0.2426 0.2788 -0.0762 0.0348 0.0490 179 SER D CB 6276 O OG . SER D 179 ? 0.2302 0.2587 0.2940 -0.0602 0.0282 0.0468 179 SER D OG 6277 N N . GLY D 180 ? 0.2480 0.2928 0.3589 -0.0639 0.0116 0.0421 180 GLY D N 6278 C CA . GLY D 180 ? 0.1877 0.2200 0.2903 -0.0584 -0.0021 0.0419 180 GLY D CA 6279 C C . GLY D 180 ? 0.3119 0.3322 0.3916 -0.0473 -0.0033 0.0407 180 GLY D C 6280 O O . GLY D 180 ? 0.3203 0.3291 0.3881 -0.0441 -0.0113 0.0386 180 GLY D O 6281 N N . LEU D 181 ? 0.2956 0.3190 0.3691 -0.0428 0.0053 0.0412 181 LEU D N 6282 C CA . LEU D 181 ? 0.2711 0.2881 0.3299 -0.0324 0.0048 0.0392 181 LEU D CA 6283 C C . LEU D 181 ? 0.2297 0.2629 0.2989 -0.0267 0.0081 0.0371 181 LEU D C 6284 O O . LEU D 181 ? 0.1967 0.2450 0.2838 -0.0292 0.0130 0.0369 181 LEU D O 6285 C CB . LEU D 181 ? 0.2654 0.2719 0.3099 -0.0314 0.0081 0.0419 181 LEU D CB 6286 C CG . LEU D 181 ? 0.2750 0.2599 0.3070 -0.0371 0.0024 0.0455 181 LEU D CG 6287 C CD1 . LEU D 181 ? 0.2197 0.1930 0.2371 -0.0375 0.0026 0.0503 181 LEU D CD1 6288 C CD2 . LEU D 181 ? 0.2154 0.1855 0.2419 -0.0313 -0.0061 0.0404 181 LEU D CD2 6289 N N . TYR D 182 ? 0.1547 0.1848 0.2142 -0.0197 0.0061 0.0346 182 TYR D N 6290 C CA . TYR D 182 ? 0.1709 0.2125 0.2372 -0.0154 0.0078 0.0336 182 TYR D CA 6291 C C . TYR D 182 ? 0.2557 0.3021 0.3194 -0.0106 0.0154 0.0332 182 TYR D C 6292 O O . TYR D 182 ? 0.2790 0.3176 0.3321 -0.0093 0.0171 0.0337 182 TYR D O 6293 C CB . TYR D 182 ? 0.1461 0.1821 0.2006 -0.0140 0.0027 0.0315 182 TYR D CB 6294 C CG . TYR D 182 ? 0.2941 0.3257 0.3498 -0.0203 -0.0075 0.0330 182 TYR D CG 6295 C CD1 . TYR D 182 ? 0.2873 0.3263 0.3587 -0.0219 -0.0146 0.0361 182 TYR D CD1 6296 C CD2 . TYR D 182 ? 0.2743 0.2926 0.3164 -0.0248 -0.0122 0.0310 182 TYR D CD2 6297 C CE1 . TYR D 182 ? 0.3077 0.3406 0.3807 -0.0282 -0.0281 0.0387 182 TYR D CE1 6298 C CE2 . TYR D 182 ? 0.3077 0.3200 0.3481 -0.0321 -0.0237 0.0329 182 TYR D CE2 6299 C CZ . TYR D 182 ? 0.3897 0.4092 0.4452 -0.0340 -0.0326 0.0374 182 TYR D CZ 6300 O OH . TYR D 182 ? 0.5583 0.5698 0.6124 -0.0418 -0.0480 0.0403 182 TYR D OH 6301 N N . SER D 183 ? 0.2464 0.3036 0.3200 -0.0083 0.0176 0.0323 183 SER D N 6302 C CA . SER D 183 ? 0.2014 0.2628 0.2718 -0.0045 0.0237 0.0311 183 SER D CA 6303 C C . SER D 183 ? 0.2266 0.2940 0.3033 -0.0013 0.0217 0.0299 183 SER D C 6304 O O . SER D 183 ? 0.1193 0.1900 0.2095 -0.0026 0.0166 0.0303 183 SER D O 6305 C CB . SER D 183 ? 0.2301 0.2978 0.3071 -0.0088 0.0316 0.0305 183 SER D CB 6306 O OG . SER D 183 ? 0.3531 0.4194 0.4185 -0.0074 0.0361 0.0301 183 SER D OG 6307 N N . LEU D 184 ? 0.2355 0.3028 0.3037 0.0023 0.0236 0.0288 184 LEU D N 6308 C CA . LEU D 184 ? 0.2568 0.3281 0.3294 0.0038 0.0223 0.0282 184 LEU D CA 6309 C C . LEU D 184 ? 0.2299 0.3043 0.2984 0.0067 0.0269 0.0262 184 LEU D C 6310 O O . LEU D 184 ? 0.2727 0.3451 0.3329 0.0081 0.0290 0.0259 184 LEU D O 6311 C CB . LEU D 184 ? 0.2191 0.2849 0.2830 0.0012 0.0163 0.0297 184 LEU D CB 6312 C CG . LEU D 184 ? 0.2522 0.3155 0.3011 0.0005 0.0190 0.0271 184 LEU D CG 6313 C CD1 . LEU D 184 ? 0.2315 0.3008 0.2802 0.0025 0.0233 0.0250 184 LEU D CD1 6314 C CD2 . LEU D 184 ? 0.2062 0.2619 0.2428 -0.0068 0.0138 0.0285 184 LEU D CD2 6315 N N . SER D 185 ? 0.2067 0.2839 0.2816 0.0073 0.0261 0.0253 185 SER D N 6316 C CA . SER D 185 ? 0.1723 0.2517 0.2436 0.0089 0.0289 0.0233 185 SER D CA 6317 C C . SER D 185 ? 0.1809 0.2588 0.2498 0.0074 0.0251 0.0244 185 SER D C 6318 O O . SER D 185 ? 0.1399 0.2133 0.2113 0.0047 0.0192 0.0272 185 SER D O 6319 C CB . SER D 185 ? 0.1554 0.2379 0.2358 0.0094 0.0333 0.0193 185 SER D CB 6320 O OG . SER D 185 ? 0.3462 0.4287 0.4188 0.0075 0.0393 0.0181 185 SER D OG 6321 N N . SER D 186 ? 0.1229 0.2036 0.1864 0.0077 0.0271 0.0229 186 SER D N 6322 C CA . SER D 186 ? 0.0994 0.1802 0.1604 0.0040 0.0254 0.0234 186 SER D CA 6323 C C . SER D 186 ? 0.2388 0.3220 0.3023 0.0054 0.0264 0.0208 186 SER D C 6324 O O . SER D 186 ? 0.1022 0.1888 0.1642 0.0081 0.0282 0.0188 186 SER D O 6325 C CB . SER D 186 ? 0.1163 0.2012 0.1710 0.0012 0.0284 0.0217 186 SER D CB 6326 O OG . SER D 186 ? 0.1068 0.1940 0.1588 -0.0047 0.0293 0.0213 186 SER D OG 6327 N N . VAL D 187 ? 0.2159 0.2949 0.2820 0.0027 0.0232 0.0215 187 VAL D N 6328 C CA . VAL D 187 ? 0.1605 0.2394 0.2282 0.0032 0.0234 0.0181 187 VAL D CA 6329 C C . VAL D 187 ? 0.2187 0.2957 0.2841 -0.0030 0.0203 0.0198 187 VAL D C 6330 O O . VAL D 187 ? 0.2074 0.2801 0.2684 -0.0089 0.0176 0.0242 187 VAL D O 6331 C CB . VAL D 187 ? 0.1592 0.2329 0.2360 0.0063 0.0232 0.0144 187 VAL D CB 6332 C CG1 . VAL D 187 ? 0.1042 0.1817 0.1827 0.0094 0.0292 0.0115 187 VAL D CG1 6333 C CG2 . VAL D 187 ? 0.1125 0.1777 0.1982 0.0053 0.0156 0.0176 187 VAL D CG2 6334 N N . VAL D 188 ? 0.2451 0.3237 0.3110 -0.0038 0.0201 0.0167 188 VAL D N 6335 C CA . VAL D 188 ? 0.2218 0.2980 0.2865 -0.0113 0.0170 0.0182 188 VAL D CA 6336 C C . VAL D 188 ? 0.1251 0.1962 0.1916 -0.0103 0.0145 0.0137 188 VAL D C 6337 O O . VAL D 188 ? 0.1612 0.2350 0.2260 -0.0060 0.0166 0.0093 188 VAL D O 6338 C CB . VAL D 188 ? 0.2272 0.3166 0.2920 -0.0166 0.0209 0.0177 188 VAL D CB 6339 C CG1 . VAL D 188 ? 0.1103 0.2102 0.1811 -0.0106 0.0217 0.0133 188 VAL D CG1 6340 C CG2 . VAL D 188 ? 0.1716 0.2600 0.2351 -0.0275 0.0194 0.0191 188 VAL D CG2 6341 N N . THR D 189 ? 0.1362 0.1966 0.2032 -0.0155 0.0092 0.0149 189 THR D N 6342 C CA . THR D 189 ? 0.2323 0.2865 0.3002 -0.0159 0.0066 0.0094 189 THR D CA 6343 C C . THR D 189 ? 0.2281 0.2878 0.2939 -0.0246 0.0047 0.0106 189 THR D C 6344 O O . THR D 189 ? 0.2748 0.3360 0.3393 -0.0332 0.0042 0.0160 189 THR D O 6345 C CB . THR D 189 ? 0.2080 0.2444 0.2824 -0.0145 0.0004 0.0076 189 THR D CB 6346 O OG1 . THR D 189 ? 0.2203 0.2465 0.2927 -0.0218 -0.0071 0.0165 189 THR D OG1 6347 C CG2 . THR D 189 ? 0.1531 0.1889 0.2371 -0.0051 0.0038 0.0026 189 THR D CG2 6348 N N . VAL D 190 ? 0.2296 0.2928 0.2942 -0.0239 0.0039 0.0053 190 VAL D N 6349 C CA . VAL D 190 ? 0.1833 0.2545 0.2509 -0.0318 0.0008 0.0053 190 VAL D CA 6350 C C . VAL D 190 ? 0.2418 0.3022 0.3047 -0.0337 -0.0048 -0.0004 190 VAL D C 6351 O O . VAL D 190 ? 0.1739 0.2243 0.2296 -0.0282 -0.0038 -0.0061 190 VAL D O 6352 C CB . VAL D 190 ? 0.1432 0.2332 0.2172 -0.0291 0.0022 0.0045 190 VAL D CB 6353 C CG1 . VAL D 190 ? 0.1319 0.2317 0.2104 -0.0269 0.0088 0.0076 190 VAL D CG1 6354 C CG2 . VAL D 190 ? 0.1459 0.2322 0.2115 -0.0225 -0.0006 0.0011 190 VAL D CG2 6355 N N . PRO D 191 ? 0.1758 0.2385 0.2425 -0.0431 -0.0098 -0.0002 191 PRO D N 6356 C CA . PRO D 191 ? 0.2861 0.3387 0.3468 -0.0458 -0.0163 -0.0063 191 PRO D CA 6357 C C . PRO D 191 ? 0.3141 0.3724 0.3675 -0.0411 -0.0181 -0.0101 191 PRO D C 6358 O O . PRO D 191 ? 0.3005 0.3753 0.3622 -0.0400 -0.0197 -0.0071 191 PRO D O 6359 C CB . PRO D 191 ? 0.1966 0.2565 0.2664 -0.0579 -0.0212 -0.0040 191 PRO D CB 6360 C CG . PRO D 191 ? 0.2315 0.2976 0.3074 -0.0633 -0.0156 0.0030 191 PRO D CG 6361 C CD . PRO D 191 ? 0.1744 0.2483 0.2501 -0.0534 -0.0086 0.0047 191 PRO D CD 6362 N N . SER D 192 ? 0.3125 0.3559 0.3501 -0.0391 -0.0180 -0.0171 192 SER D N 6363 C CA . SER D 192 ? 0.3330 0.3760 0.3549 -0.0380 -0.0206 -0.0195 192 SER D CA 6364 C C . SER D 192 ? 0.3070 0.3560 0.3301 -0.0445 -0.0335 -0.0181 192 SER D C 6365 O O . SER D 192 ? 0.2837 0.3368 0.3010 -0.0434 -0.0401 -0.0154 192 SER D O 6366 C CB . SER D 192 ? 0.2347 0.2601 0.2358 -0.0380 -0.0151 -0.0295 192 SER D CB 6367 O OG . SER D 192 ? 0.3919 0.4040 0.3915 -0.0428 -0.0178 -0.0369 192 SER D OG 6368 N N . SER D 193 ? 0.2711 0.3201 0.3038 -0.0518 -0.0391 -0.0191 193 SER D N 6369 C CA . SER D 193 ? 0.2787 0.3356 0.3180 -0.0587 -0.0528 -0.0184 193 SER D CA 6370 C C . SER D 193 ? 0.2900 0.3727 0.3575 -0.0566 -0.0553 -0.0130 193 SER D C 6371 O O . SER D 193 ? 0.2213 0.3153 0.3040 -0.0612 -0.0672 -0.0131 193 SER D O 6372 C CB . SER D 193 ? 0.3112 0.3604 0.3533 -0.0689 -0.0583 -0.0220 193 SER D CB 6373 O OG . SER D 193 ? 0.2792 0.3378 0.3415 -0.0729 -0.0529 -0.0180 193 SER D OG 6374 N N . SER D 194 ? 0.2940 0.3865 0.3708 -0.0499 -0.0443 -0.0097 194 SER D N 6375 C CA . SER D 194 ? 0.2452 0.3622 0.3499 -0.0475 -0.0434 -0.0077 194 SER D CA 6376 C C . SER D 194 ? 0.2559 0.3752 0.3590 -0.0371 -0.0457 -0.0057 194 SER D C 6377 O O . SER D 194 ? 0.2746 0.4127 0.4029 -0.0330 -0.0473 -0.0059 194 SER D O 6378 C CB . SER D 194 ? 0.2024 0.3282 0.3177 -0.0505 -0.0295 -0.0062 194 SER D CB 6379 O OG . SER D 194 ? 0.3239 0.4372 0.4227 -0.0442 -0.0207 -0.0037 194 SER D OG 6380 N N . LEU D 195 ? 0.2651 0.3650 0.3397 -0.0338 -0.0456 -0.0047 195 LEU D N 6381 C CA . LEU D 195 ? 0.3022 0.3989 0.3690 -0.0266 -0.0485 -0.0014 195 LEU D CA 6382 C C . LEU D 195 ? 0.3662 0.4679 0.4442 -0.0256 -0.0674 0.0006 195 LEU D C 6383 O O . LEU D 195 ? 0.4368 0.5369 0.5154 -0.0193 -0.0728 0.0042 195 LEU D O 6384 C CB . LEU D 195 ? 0.2958 0.3704 0.3274 -0.0277 -0.0443 -0.0019 195 LEU D CB 6385 C CG . LEU D 195 ? 0.3065 0.3772 0.3339 -0.0253 -0.0275 -0.0042 195 LEU D CG 6386 C CD1 . LEU D 195 ? 0.2077 0.2610 0.2066 -0.0268 -0.0212 -0.0079 195 LEU D CD1 6387 C CD2 . LEU D 195 ? 0.2608 0.3444 0.3057 -0.0184 -0.0201 -0.0003 195 LEU D CD2 6388 N N . GLY D 196 ? 0.3922 0.4983 0.4805 -0.0319 -0.0794 -0.0015 196 GLY D N 6389 C CA . GLY D 196 ? 0.4370 0.5450 0.5366 -0.0317 -0.1019 0.0005 196 GLY D CA 6390 C C . GLY D 196 ? 0.4923 0.6297 0.6430 -0.0270 -0.1063 -0.0028 196 GLY D C 6391 O O . GLY D 196 ? 0.5277 0.6693 0.6972 -0.0203 -0.1220 -0.0012 196 GLY D O 6392 N N . THR D 197 ? 0.4727 0.6295 0.6463 -0.0313 -0.0925 -0.0080 197 THR D N 6393 C CA . THR D 197 ? 0.4004 0.5891 0.6247 -0.0302 -0.0924 -0.0144 197 THR D CA 6394 C C . THR D 197 ? 0.2672 0.4738 0.5101 -0.0255 -0.0711 -0.0186 197 THR D C 6395 O O . THR D 197 ? 0.1935 0.4262 0.4790 -0.0217 -0.0697 -0.0260 197 THR D O 6396 C CB . THR D 197 ? 0.4216 0.6222 0.6607 -0.0428 -0.0923 -0.0183 197 THR D CB 6397 O OG1 . THR D 197 ? 0.3307 0.5162 0.5387 -0.0508 -0.0774 -0.0162 197 THR D OG1 6398 C CG2 . THR D 197 ? 0.4558 0.6467 0.6917 -0.0470 -0.1182 -0.0167 197 THR D CG2 6399 N N . GLN D 198 ? 0.2355 0.4282 0.4479 -0.0264 -0.0549 -0.0151 198 GLN D N 6400 C CA . GLN D 198 ? 0.2533 0.4585 0.4752 -0.0246 -0.0356 -0.0182 198 GLN D CA 6401 C C . GLN D 198 ? 0.2183 0.4114 0.4264 -0.0131 -0.0351 -0.0150 198 GLN D C 6402 O O . GLN D 198 ? 0.2744 0.4441 0.4493 -0.0113 -0.0387 -0.0084 198 GLN D O 6403 C CB . GLN D 198 ? 0.2848 0.4814 0.4839 -0.0350 -0.0207 -0.0155 198 GLN D CB 6404 C CG . GLN D 198 ? 0.3687 0.5694 0.5641 -0.0351 -0.0029 -0.0162 198 GLN D CG 6405 C CD . GLN D 198 ? 0.4272 0.6568 0.6549 -0.0414 0.0089 -0.0253 198 GLN D CD 6406 O OE1 . GLN D 198 ? 0.3791 0.6216 0.6237 -0.0345 0.0156 -0.0315 198 GLN D OE1 6407 N NE2 . GLN D 198 ? 0.4357 0.6755 0.6723 -0.0557 0.0128 -0.0274 198 GLN D NE2 6408 N N . THR D 199 ? 0.1720 0.3812 0.4065 -0.0060 -0.0300 -0.0208 199 THR D N 6409 C CA . THR D 199 ? 0.1749 0.3710 0.3962 0.0040 -0.0303 -0.0176 199 THR D CA 6410 C C . THR D 199 ? 0.2073 0.3986 0.4086 0.0015 -0.0112 -0.0165 199 THR D C 6411 O O . THR D 199 ? 0.1679 0.3737 0.3789 -0.0054 0.0035 -0.0219 199 THR D O 6412 C CB . THR D 199 ? 0.2107 0.4204 0.4686 0.0149 -0.0374 -0.0247 199 THR D CB 6413 O OG1 . THR D 199 ? 0.2101 0.4443 0.4953 0.0133 -0.0188 -0.0363 199 THR D OG1 6414 C CG2 . THR D 199 ? 0.1828 0.3988 0.4679 0.0176 -0.0600 -0.0260 199 THR D CG2 6415 N N . TYR D 200 ? 0.1931 0.3631 0.3652 0.0054 -0.0123 -0.0094 200 TYR D N 6416 C CA . TYR D 200 ? 0.1782 0.3413 0.3320 0.0038 0.0015 -0.0073 200 TYR D CA 6417 C C . TYR D 200 ? 0.1883 0.3470 0.3428 0.0126 0.0015 -0.0075 200 TYR D C 6418 O O . TYR D 200 ? 0.2088 0.3537 0.3534 0.0181 -0.0093 -0.0027 200 TYR D O 6419 C CB . TYR D 200 ? 0.1088 0.2528 0.2327 -0.0002 0.0018 -0.0005 200 TYR D CB 6420 C CG . TYR D 200 ? 0.1382 0.2833 0.2607 -0.0093 0.0022 -0.0008 200 TYR D CG 6421 C CD1 . TYR D 200 ? 0.1145 0.2652 0.2390 -0.0177 0.0120 -0.0016 200 TYR D CD1 6422 C CD2 . TYR D 200 ? 0.1227 0.2601 0.2384 -0.0112 -0.0082 0.0000 200 TYR D CD2 6423 C CE1 . TYR D 200 ? 0.2021 0.3506 0.3242 -0.0273 0.0110 -0.0009 200 TYR D CE1 6424 C CE2 . TYR D 200 ? 0.1628 0.2992 0.2774 -0.0198 -0.0087 -0.0009 200 TYR D CE2 6425 C CZ . TYR D 200 ? 0.2669 0.4087 0.3860 -0.0276 0.0006 -0.0010 200 TYR D CZ 6426 O OH . TYR D 200 ? 0.2411 0.3790 0.3582 -0.0373 -0.0013 -0.0009 200 TYR D OH 6427 N N . ILE D 201 ? 0.1452 0.3141 0.3094 0.0123 0.0135 -0.0133 201 ILE D N 6428 C CA . ILE D 201 ? 0.1615 0.3272 0.3304 0.0204 0.0137 -0.0159 201 ILE D CA 6429 C C . ILE D 201 ? 0.1578 0.3172 0.3075 0.0162 0.0263 -0.0146 201 ILE D C 6430 O O . ILE D 201 ? 0.1767 0.3440 0.3238 0.0073 0.0377 -0.0179 201 ILE D O 6431 C CB . ILE D 201 ? 0.2157 0.4021 0.4222 0.0251 0.0155 -0.0287 201 ILE D CB 6432 C CG1 . ILE D 201 ? 0.1023 0.2947 0.3325 0.0299 -0.0013 -0.0294 201 ILE D CG1 6433 C CG2 . ILE D 201 ? 0.1325 0.3142 0.3457 0.0338 0.0165 -0.0337 201 ILE D CG2 6434 C CD1 . ILE D 201 ? 0.1548 0.3654 0.4247 0.0357 -0.0014 -0.0421 201 ILE D CD1 6435 N N . CYS D 202 ? 0.2134 0.3571 0.3475 0.0207 0.0231 -0.0093 202 CYS D N 6436 C CA . CYS D 202 ? 0.1853 0.3237 0.3051 0.0172 0.0325 -0.0089 202 CYS D CA 6437 C C . CYS D 202 ? 0.1923 0.3354 0.3262 0.0225 0.0359 -0.0181 202 CYS D C 6438 O O . CYS D 202 ? 0.1547 0.2938 0.3009 0.0317 0.0267 -0.0194 202 CYS D O 6439 C CB . CYS D 202 ? 0.2189 0.3400 0.3169 0.0173 0.0289 0.0006 202 CYS D CB 6440 S SG . CYS D 202 ? 0.2787 0.3865 0.3740 0.0254 0.0194 0.0041 202 CYS D SG 6441 N N . ASN D 203 ? 0.1057 0.2551 0.2362 0.0156 0.0486 -0.0248 203 ASN D N 6442 C CA . ASN D 203 ? 0.2042 0.3574 0.3456 0.0190 0.0550 -0.0365 203 ASN D CA 6443 C C . ASN D 203 ? 0.2204 0.3566 0.3375 0.0168 0.0559 -0.0319 203 ASN D C 6444 O O . ASN D 203 ? 0.2455 0.3776 0.3409 0.0060 0.0626 -0.0293 203 ASN D O 6445 C CB . ASN D 203 ? 0.1581 0.3306 0.3104 0.0102 0.0710 -0.0501 203 ASN D CB 6446 C CG . ASN D 203 ? 0.2182 0.4048 0.3868 0.0074 0.0699 -0.0505 203 ASN D CG 6447 O OD1 . ASN D 203 ? 0.1666 0.3540 0.3198 -0.0045 0.0742 -0.0448 203 ASN D OD1 6448 N ND2 . ASN D 203 ? 0.2169 0.4108 0.4152 0.0179 0.0611 -0.0557 203 ASN D ND2 6449 N N . VAL D 204 ? 0.2044 0.3290 0.3244 0.0260 0.0472 -0.0301 204 VAL D N 6450 C CA . VAL D 204 ? 0.1719 0.2804 0.2712 0.0237 0.0461 -0.0249 204 VAL D CA 6451 C C . VAL D 204 ? 0.2324 0.3394 0.3376 0.0259 0.0517 -0.0377 204 VAL D C 6452 O O . VAL D 204 ? 0.2172 0.3272 0.3462 0.0356 0.0486 -0.0468 204 VAL D O 6453 C CB . VAL D 204 ? 0.1890 0.2832 0.2829 0.0290 0.0338 -0.0136 204 VAL D CB 6454 C CG1 . VAL D 204 ? 0.1714 0.2510 0.2492 0.0262 0.0327 -0.0095 204 VAL D CG1 6455 C CG2 . VAL D 204 ? 0.1126 0.2082 0.1992 0.0258 0.0309 -0.0039 204 VAL D CG2 6456 N N . ASN D 205 ? 0.1975 0.2980 0.2812 0.0167 0.0586 -0.0390 205 ASN D N 6457 C CA . ASN D 205 ? 0.2477 0.3448 0.3321 0.0167 0.0654 -0.0528 205 ASN D CA 6458 C C . ASN D 205 ? 0.3041 0.3821 0.3635 0.0117 0.0604 -0.0456 205 ASN D C 6459 O O . ASN D 205 ? 0.3771 0.4503 0.4129 0.0004 0.0609 -0.0379 205 ASN D O 6460 C CB . ASN D 205 ? 0.2302 0.3416 0.3121 0.0063 0.0829 -0.0673 205 ASN D CB 6461 C CG . ASN D 205 ? 0.3407 0.4515 0.4282 0.0071 0.0932 -0.0870 205 ASN D CG 6462 O OD1 . ASN D 205 ? 0.2995 0.3970 0.3927 0.0161 0.0854 -0.0891 205 ASN D OD1 6463 N ND2 . ASN D 205 ? 0.4173 0.5419 0.5027 -0.0036 0.1116 -0.1026 205 ASN D ND2 6464 N N . HIS D 206 ? 0.2618 0.3277 0.3281 0.0196 0.0531 -0.0472 206 HIS D N 6465 C CA . HIS D 206 ? 0.2251 0.2735 0.2716 0.0146 0.0483 -0.0427 206 HIS D CA 6466 C C . HIS D 206 ? 0.3128 0.3559 0.3596 0.0146 0.0555 -0.0603 206 HIS D C 6467 O O . HIS D 206 ? 0.3347 0.3699 0.3982 0.0246 0.0504 -0.0669 206 HIS D O 6468 C CB . HIS D 206 ? 0.2207 0.2566 0.2721 0.0210 0.0350 -0.0314 206 HIS D CB 6469 C CG . HIS D 206 ? 0.2472 0.2675 0.2818 0.0146 0.0296 -0.0260 206 HIS D CG 6470 N ND1 . HIS D 206 ? 0.2287 0.2330 0.2663 0.0184 0.0226 -0.0274 206 HIS D ND1 6471 C CD2 . HIS D 206 ? 0.1997 0.2172 0.2165 0.0044 0.0283 -0.0189 206 HIS D CD2 6472 C CE1 . HIS D 206 ? 0.2320 0.2261 0.2541 0.0100 0.0187 -0.0219 206 HIS D CE1 6473 N NE2 . HIS D 206 ? 0.2074 0.2098 0.2182 0.0019 0.0214 -0.0168 206 HIS D NE2 6474 N N . LYS D 207 ? 0.3329 0.3783 0.3595 0.0023 0.0669 -0.0683 207 LYS D N 6475 C CA . LYS D 207 ? 0.2928 0.3346 0.3163 -0.0003 0.0779 -0.0887 207 LYS D CA 6476 C C . LYS D 207 ? 0.3175 0.3379 0.3362 0.0030 0.0693 -0.0912 207 LYS D C 6477 O O . LYS D 207 ? 0.3954 0.4130 0.4332 0.0119 0.0726 -0.1079 207 LYS D O 6478 C CB . LYS D 207 ? 0.2874 0.3323 0.2804 -0.0189 0.0919 -0.0952 207 LYS D CB 6479 C CG . LYS D 207 ? 0.3374 0.4048 0.3421 -0.0220 0.1050 -0.1009 207 LYS D CG 6480 C CD . LYS D 207 ? 0.5171 0.5841 0.4857 -0.0439 0.1188 -0.1061 207 LYS D CD 6481 C CE . LYS D 207 ? 0.5365 0.6277 0.5200 -0.0486 0.1356 -0.1161 207 LYS D CE 6482 N NZ . LYS D 207 ? 0.6585 0.7431 0.6034 -0.0721 0.1446 -0.1172 207 LYS D NZ 6483 N N . PRO D 208 ? 0.3079 0.3133 0.3053 -0.0035 0.0573 -0.0752 208 PRO D N 6484 C CA . PRO D 208 ? 0.2911 0.2759 0.2831 -0.0027 0.0492 -0.0778 208 PRO D CA 6485 C C . PRO D 208 ? 0.2931 0.2710 0.3136 0.0128 0.0420 -0.0818 208 PRO D C 6486 O O . PRO D 208 ? 0.3277 0.2889 0.3480 0.0146 0.0393 -0.0919 208 PRO D O 6487 C CB . PRO D 208 ? 0.3432 0.3199 0.3197 -0.0101 0.0360 -0.0573 208 PRO D CB 6488 C CG . PRO D 208 ? 0.3436 0.3312 0.3049 -0.0200 0.0398 -0.0503 208 PRO D CG 6489 C CD . PRO D 208 ? 0.2919 0.2984 0.2720 -0.0126 0.0504 -0.0564 208 PRO D CD 6490 N N . SER D 209 ? 0.3212 0.3091 0.3643 0.0229 0.0373 -0.0741 209 SER D N 6491 C CA . SER D 209 ? 0.3319 0.3099 0.3999 0.0364 0.0263 -0.0751 209 SER D CA 6492 C C . SER D 209 ? 0.3527 0.3456 0.4530 0.0483 0.0320 -0.0909 209 SER D C 6493 O O . SER D 209 ? 0.2855 0.2715 0.4106 0.0606 0.0196 -0.0903 209 SER D O 6494 C CB . SER D 209 ? 0.2425 0.2171 0.3099 0.0373 0.0135 -0.0533 209 SER D CB 6495 O OG . SER D 209 ? 0.2841 0.2789 0.3555 0.0371 0.0184 -0.0474 209 SER D OG 6496 N N . ASN D 210 ? 0.3034 0.3163 0.4039 0.0434 0.0494 -0.1043 210 ASN D N 6497 C CA . ASN D 210 ? 0.4149 0.4492 0.5498 0.0526 0.0568 -0.1184 210 ASN D CA 6498 C C . ASN D 210 ? 0.3463 0.3856 0.5024 0.0624 0.0422 -0.1043 210 ASN D C 6499 O O . ASN D 210 ? 0.3972 0.4407 0.5896 0.0757 0.0356 -0.1136 210 ASN D O 6500 C CB . ASN D 210 ? 0.4694 0.5016 0.6334 0.0628 0.0617 -0.1445 210 ASN D CB 6501 C CG . ASN D 210 ? 0.5963 0.6212 0.7354 0.0516 0.0769 -0.1606 210 ASN D CG 6502 O OD1 . ASN D 210 ? 0.6105 0.6493 0.7291 0.0376 0.0953 -0.1678 210 ASN D OD1 6503 N ND2 . ASN D 210 ? 0.6394 0.6397 0.7763 0.0558 0.0682 -0.1657 210 ASN D ND2 6504 N N . THR D 211 ? 0.2265 0.2642 0.3605 0.0556 0.0362 -0.0827 211 THR D N 6505 C CA . THR D 211 ? 0.2734 0.3139 0.4194 0.0616 0.0237 -0.0694 211 THR D CA 6506 C C . THR D 211 ? 0.2655 0.3303 0.4146 0.0571 0.0336 -0.0691 211 THR D C 6507 O O . THR D 211 ? 0.2321 0.3014 0.3563 0.0456 0.0418 -0.0620 211 THR D O 6508 C CB . THR D 211 ? 0.2754 0.2984 0.3967 0.0564 0.0116 -0.0476 211 THR D CB 6509 O OG1 . THR D 211 ? 0.3076 0.3071 0.4236 0.0578 0.0027 -0.0470 211 THR D OG1 6510 C CG2 . THR D 211 ? 0.2015 0.2242 0.3304 0.0608 -0.0010 -0.0356 211 THR D CG2 6511 N N . LYS D 212 ? 0.2120 0.2910 0.3936 0.0660 0.0310 -0.0768 212 LYS D N 6512 C CA . LYS D 212 ? 0.1894 0.2906 0.3773 0.0619 0.0378 -0.0757 212 LYS D CA 6513 C C . LYS D 212 ? 0.2061 0.3053 0.4060 0.0686 0.0202 -0.0636 212 LYS D C 6514 O O . LYS D 212 ? 0.1694 0.2626 0.3955 0.0800 0.0056 -0.0669 212 LYS D O 6515 C CB . LYS D 212 ? 0.2335 0.3592 0.4506 0.0627 0.0538 -0.0983 212 LYS D CB 6516 C CG . LYS D 212 ? 0.3244 0.4587 0.5167 0.0471 0.0756 -0.1058 212 LYS D CG 6517 C CD . LYS D 212 ? 0.2365 0.3867 0.4424 0.0418 0.0875 -0.1200 212 LYS D CD 6518 C CE . LYS D 212 ? 0.2435 0.3905 0.4776 0.0523 0.0847 -0.1362 212 LYS D CE 6519 N NZ . LYS D 212 ? 0.3049 0.4706 0.5653 0.0504 0.0925 -0.1503 212 LYS D NZ 6520 N N . VAL D 213 ? 0.1720 0.2736 0.3514 0.0608 0.0202 -0.0498 213 VAL D N 6521 C CA . VAL D 213 ? 0.2181 0.3170 0.4012 0.0638 0.0053 -0.0386 213 VAL D CA 6522 C C . VAL D 213 ? 0.2342 0.3524 0.4186 0.0575 0.0128 -0.0379 213 VAL D C 6523 O O . VAL D 213 ? 0.1649 0.2861 0.3270 0.0476 0.0240 -0.0337 213 VAL D O 6524 C CB . VAL D 213 ? 0.2063 0.2824 0.3579 0.0595 -0.0045 -0.0207 213 VAL D CB 6525 C CG1 . VAL D 213 ? 0.1530 0.2228 0.3029 0.0605 -0.0200 -0.0103 213 VAL D CG1 6526 C CG2 . VAL D 213 ? 0.1639 0.2191 0.3113 0.0630 -0.0115 -0.0203 213 VAL D CG2 6527 N N . ASP D 214 ? 0.1312 0.2610 0.3433 0.0630 0.0046 -0.0420 214 ASP D N 6528 C CA . ASP D 214 ? 0.1215 0.2656 0.3344 0.0569 0.0068 -0.0390 214 ASP D CA 6529 C C . ASP D 214 ? 0.1596 0.2882 0.3583 0.0575 -0.0114 -0.0244 214 ASP D C 6530 O O . ASP D 214 ? 0.1381 0.2588 0.3523 0.0651 -0.0296 -0.0230 214 ASP D O 6531 C CB . ASP D 214 ? 0.1218 0.2896 0.3734 0.0598 0.0099 -0.0534 214 ASP D CB 6532 C CG . ASP D 214 ? 0.1979 0.3763 0.4485 0.0529 0.0311 -0.0663 214 ASP D CG 6533 O OD1 . ASP D 214 ? 0.1220 0.3018 0.3480 0.0423 0.0450 -0.0639 214 ASP D OD1 6534 O OD2 . ASP D 214 ? 0.1415 0.3256 0.4151 0.0570 0.0328 -0.0789 214 ASP D OD2 6535 N N . LYS D 215 ? 0.1205 0.2437 0.2897 0.0486 -0.0071 -0.0143 215 LYS D N 6536 C CA . LYS D 215 ? 0.1792 0.2863 0.3274 0.0461 -0.0201 -0.0021 215 LYS D CA 6537 C C . LYS D 215 ? 0.1597 0.2761 0.3066 0.0405 -0.0202 -0.0008 215 LYS D C 6538 O O . LYS D 215 ? 0.1417 0.2658 0.2800 0.0339 -0.0072 -0.0016 215 LYS D O 6539 C CB . LYS D 215 ? 0.1623 0.2531 0.2775 0.0404 -0.0147 0.0069 215 LYS D CB 6540 C CG . LYS D 215 ? 0.2270 0.3020 0.3167 0.0348 -0.0232 0.0171 215 LYS D CG 6541 C CD . LYS D 215 ? 0.2620 0.3173 0.3461 0.0371 -0.0408 0.0232 215 LYS D CD 6542 C CE . LYS D 215 ? 0.2808 0.3190 0.3353 0.0285 -0.0501 0.0327 215 LYS D CE 6543 N NZ . LYS D 215 ? 0.3614 0.3752 0.4048 0.0282 -0.0694 0.0409 215 LYS D NZ 6544 N N . ARG D 216 ? 0.1360 0.2490 0.2901 0.0423 -0.0370 0.0018 216 ARG D N 6545 C CA . ARG D 216 ? 0.1704 0.2874 0.3175 0.0356 -0.0391 0.0040 216 ARG D CA 6546 C C . ARG D 216 ? 0.1569 0.2543 0.2646 0.0281 -0.0391 0.0133 216 ARG D C 6547 O O . ARG D 216 ? 0.2810 0.3590 0.3683 0.0273 -0.0471 0.0203 216 ARG D O 6548 C CB . ARG D 216 ? 0.2422 0.3635 0.4122 0.0389 -0.0585 0.0026 216 ARG D CB 6549 C CG . ARG D 216 ? 0.1452 0.2753 0.3138 0.0313 -0.0581 0.0020 216 ARG D CG 6550 C CD . ARG D 216 ? 0.2385 0.3658 0.4185 0.0318 -0.0813 0.0040 216 ARG D CD 6551 N NE . ARG D 216 ? 0.3265 0.4579 0.4974 0.0226 -0.0802 0.0041 216 ARG D NE 6552 C CZ . ARG D 216 ? 0.2753 0.4080 0.4572 0.0203 -0.0987 0.0045 216 ARG D CZ 6553 N NH1 . ARG D 216 ? 0.2556 0.3864 0.4606 0.0272 -0.1214 0.0053 216 ARG D NH1 6554 N NH2 . ARG D 216 ? 0.2427 0.3775 0.4142 0.0112 -0.0964 0.0039 216 ARG D NH2 6555 N N . VAL D 217 ? 0.1596 0.2616 0.2572 0.0215 -0.0294 0.0125 217 VAL D N 6556 C CA . VAL D 217 ? 0.1474 0.2345 0.2134 0.0148 -0.0256 0.0171 217 VAL D CA 6557 C C . VAL D 217 ? 0.2059 0.2925 0.2662 0.0091 -0.0314 0.0161 217 VAL D C 6558 O O . VAL D 217 ? 0.2126 0.3129 0.2894 0.0080 -0.0275 0.0116 217 VAL D O 6559 C CB . VAL D 217 ? 0.1655 0.2561 0.2274 0.0133 -0.0089 0.0155 217 VAL D CB 6560 C CG1 . VAL D 217 ? 0.1412 0.2204 0.1795 0.0073 -0.0035 0.0165 217 VAL D CG1 6561 C CG2 . VAL D 217 ? 0.1270 0.2166 0.1925 0.0178 -0.0047 0.0164 217 VAL D CG2 6562 N N . GLU D 218 ? 0.1824 0.2517 0.2171 0.0036 -0.0412 0.0202 218 GLU D N 6563 C CA . GLU D 218 ? 0.3045 0.3705 0.3307 -0.0028 -0.0492 0.0188 218 GLU D CA 6564 C C . GLU D 218 ? 0.3708 0.4152 0.3559 -0.0124 -0.0477 0.0206 218 GLU D C 6565 O O . GLU D 218 ? 0.4094 0.4434 0.3769 -0.0141 -0.0429 0.0240 218 GLU D O 6566 C CB . GLU D 218 ? 0.2852 0.3538 0.3288 -0.0006 -0.0706 0.0206 218 GLU D CB 6567 C CG . GLU D 218 ? 0.3726 0.4226 0.4022 -0.0001 -0.0879 0.0284 218 GLU D CG 6568 C CD . GLU D 218 ? 0.4767 0.5306 0.5332 0.0045 -0.1123 0.0296 218 GLU D CD 6569 O OE1 . GLU D 218 ? 0.5160 0.5663 0.5885 0.0121 -0.1244 0.0325 218 GLU D OE1 6570 O OE2 . GLU D 218 ? 0.5822 0.6429 0.6475 0.0009 -0.1205 0.0268 218 GLU D OE2 6571 N N . PRO D 219 ? 0.4249 0.4631 0.3947 -0.0201 -0.0502 0.0172 219 PRO D N 6572 C CA . PRO D 219 ? 0.4822 0.5002 0.4108 -0.0310 -0.0458 0.0161 219 PRO D CA 6573 C C . PRO D 219 ? 0.5010 0.4986 0.4009 -0.0381 -0.0626 0.0250 219 PRO D C 6574 O O . PRO D 219 ? 0.4599 0.4548 0.3686 -0.0364 -0.0848 0.0307 219 PRO D O 6575 C CB . PRO D 219 ? 0.4314 0.4466 0.3519 -0.0375 -0.0472 0.0091 219 PRO D CB 6576 C CG . PRO D 219 ? 0.4058 0.4363 0.3597 -0.0318 -0.0599 0.0103 219 PRO D CG 6577 C CD . PRO D 219 ? 0.4552 0.5040 0.4423 -0.0208 -0.0530 0.0122 219 PRO D CD 6578 N N . LYS D 220 ? 0.5051 0.4876 0.3716 -0.0470 -0.0529 0.0261 220 LYS D N 6579 C CA . LYS D 220 ? 0.6115 0.5694 0.4427 -0.0573 -0.0684 0.0364 220 LYS D CA 6580 C C . LYS D 220 ? 0.5715 0.5068 0.3602 -0.0733 -0.0813 0.0373 220 LYS D C 6581 O O . LYS D 220 ? 0.5443 0.4829 0.3278 -0.0771 -0.0740 0.0276 220 LYS D O 6582 C CB . LYS D 220 ? 0.6895 0.6401 0.4998 -0.0638 -0.0516 0.0375 220 LYS D CB 6583 C CG . LYS D 220 ? 0.7346 0.6579 0.5098 -0.0749 -0.0683 0.0507 220 LYS D CG 6584 C CD . LYS D 220 ? 0.7921 0.7020 0.5250 -0.0928 -0.0490 0.0487 220 LYS D CD 6585 C CE . LYS D 220 ? 0.8446 0.7384 0.5639 -0.0976 -0.0562 0.0612 220 LYS D CE 6586 N NZ . LYS D 220 ? 0.8333 0.7485 0.6002 -0.0793 -0.0498 0.0604 220 LYS D NZ 6587 N N . CYS E 1 ? 0.4096 0.7615 0.5473 0.1899 -0.1211 -0.1940 1 CYS E N 6588 C CA . CYS E 1 ? 0.4236 0.7071 0.5448 0.1723 -0.1139 -0.1827 1 CYS E CA 6589 C C . CYS E 1 ? 0.4028 0.7246 0.5756 0.1238 -0.0920 -0.1628 1 CYS E C 6590 O O . CYS E 1 ? 0.4864 0.8695 0.6964 0.1054 -0.0748 -0.1497 1 CYS E O 6591 C CB . CYS E 1 ? 0.5002 0.7131 0.5794 0.1808 -0.1015 -0.1818 1 CYS E CB 6592 S SG . CYS E 1 ? 0.5848 0.7252 0.6035 0.2362 -0.1224 -0.2011 1 CYS E SG 6593 N N . GLN E 2 ? 0.3977 0.6526 0.5489 0.0991 -0.0853 -0.1509 2 GLN E N 6594 C CA . GLN E 2 ? 0.3205 0.5906 0.5125 0.0574 -0.0646 -0.1312 2 GLN E CA 6595 C C . GLN E 2 ? 0.3428 0.5318 0.4914 0.0435 -0.0450 -0.1163 2 GLN E C 6596 O O . GLN E 2 ? 0.3610 0.4720 0.4503 0.0567 -0.0507 -0.1192 2 GLN E O 6597 C CB . GLN E 2 ? 0.2449 0.5266 0.4678 0.0391 -0.0783 -0.1365 2 GLN E CB 6598 C CG . GLN E 2 ? 0.3765 0.7499 0.6688 0.0276 -0.0824 -0.1357 2 GLN E CG 6599 C CD . GLN E 2 ? 0.5132 0.8840 0.8485 -0.0086 -0.0823 -0.1288 2 GLN E CD 6600 O OE1 . GLN E 2 ? 0.4976 0.8169 0.8214 -0.0180 -0.0904 -0.1415 2 GLN E OE1 6601 N NE2 . GLN E 2 ? 0.5237 0.9414 0.9046 -0.0279 -0.0744 -0.1067 2 GLN E NE2 6602 N N . PHE E 3 ? 0.2325 0.4478 0.4127 0.0185 -0.0205 -0.0973 3 PHE E N 6603 C CA . PHE E 3 ? 0.2368 0.3932 0.3882 0.0023 -0.0007 -0.0822 3 PHE E CA 6604 C C . PHE E 3 ? 0.2732 0.3729 0.4036 -0.0075 -0.0047 -0.0805 3 PHE E C 6605 O O . PHE E 3 ? 0.1954 0.3179 0.3617 -0.0188 -0.0134 -0.0840 3 PHE E O 6606 C CB . PHE E 3 ? 0.1631 0.3736 0.3581 -0.0183 0.0238 -0.0611 3 PHE E CB 6607 C CG . PHE E 3 ? 0.1945 0.3606 0.3660 -0.0323 0.0442 -0.0463 3 PHE E CG 6608 C CD1 . PHE E 3 ? 0.1954 0.3357 0.3336 -0.0260 0.0501 -0.0518 3 PHE E CD1 6609 C CD2 . PHE E 3 ? 0.1993 0.3518 0.3868 -0.0518 0.0568 -0.0285 3 PHE E CD2 6610 C CE1 . PHE E 3 ? 0.1810 0.2941 0.3050 -0.0406 0.0691 -0.0386 3 PHE E CE1 6611 C CE2 . PHE E 3 ? 0.1830 0.2992 0.3408 -0.0571 0.0713 -0.0132 3 PHE E CE2 6612 C CZ . PHE E 3 ? 0.1783 0.2820 0.3088 -0.0531 0.0785 -0.0179 3 PHE E CZ 6613 N N . ASP E 4 ? 0.2523 0.2806 0.3268 -0.0033 0.0019 -0.0765 4 ASP E N 6614 C CA . ASP E 4 ? 0.2785 0.2546 0.3202 -0.0047 -0.0005 -0.0766 4 ASP E CA 6615 C C . ASP E 4 ? 0.2929 0.2509 0.3346 -0.0245 0.0261 -0.0575 4 ASP E C 6616 O O . ASP E 4 ? 0.2675 0.2094 0.2896 -0.0275 0.0430 -0.0459 4 ASP E O 6617 C CB . ASP E 4 ? 0.3659 0.2829 0.3394 0.0215 -0.0116 -0.0815 4 ASP E CB 6618 C CG . ASP E 4 ? 0.4405 0.3135 0.3712 0.0273 -0.0135 -0.0819 4 ASP E CG 6619 O OD1 . ASP E 4 ? 0.5282 0.4130 0.4846 0.0130 -0.0123 -0.0870 4 ASP E OD1 6620 O OD2 . ASP E 4 ? 0.5389 0.3643 0.4087 0.0490 -0.0161 -0.0767 4 ASP E OD2 6621 N N . LEU E 5 ? 0.2411 0.2015 0.3076 -0.0372 0.0283 -0.0564 5 LEU E N 6622 C CA . LEU E 5 ? 0.2301 0.1772 0.2988 -0.0504 0.0525 -0.0387 5 LEU E CA 6623 C C . LEU E 5 ? 0.3604 0.2551 0.3669 -0.0403 0.0625 -0.0345 5 LEU E C 6624 O O . LEU E 5 ? 0.4409 0.3350 0.4438 -0.0484 0.0857 -0.0176 5 LEU E O 6625 C CB . LEU E 5 ? 0.2338 0.1810 0.3405 -0.0616 0.0493 -0.0417 5 LEU E CB 6626 C CG . LEU E 5 ? 0.2142 0.2184 0.3936 -0.0785 0.0482 -0.0339 5 LEU E CG 6627 C CD1 . LEU E 5 ? 0.2864 0.2774 0.5074 -0.0919 0.0373 -0.0432 5 LEU E CD1 6628 C CD2 . LEU E 5 ? 0.1691 0.2075 0.3541 -0.0797 0.0684 -0.0035 5 LEU E CD2 6629 N N . SER E 6 ? 0.3449 0.2031 0.3028 -0.0210 0.0462 -0.0474 6 SER E N 6630 C CA . SER E 6 ? 0.4380 0.2522 0.3350 -0.0095 0.0585 -0.0376 6 SER E CA 6631 C C . SER E 6 ? 0.5169 0.3209 0.3988 -0.0160 0.0766 -0.0181 6 SER E C 6632 O O . SER E 6 ? 0.6019 0.3945 0.4667 -0.0232 0.0997 -0.0009 6 SER E O 6633 C CB . SER E 6 ? 0.4872 0.2728 0.3326 0.0178 0.0365 -0.0526 6 SER E CB 6634 O OG . SER E 6 ? 0.5824 0.3759 0.4421 0.0225 0.0177 -0.0776 6 SER E OG 6635 N N . THR E 7 ? 0.4784 0.2877 0.3695 -0.0133 0.0655 -0.0229 7 THR E N 6636 C CA . THR E 7 ? 0.4514 0.2381 0.3290 -0.0185 0.0767 -0.0114 7 THR E CA 6637 C C . THR E 7 ? 0.3139 0.1449 0.2413 -0.0356 0.0827 -0.0157 7 THR E C 6638 O O . THR E 7 ? 0.3267 0.1420 0.2519 -0.0445 0.0912 -0.0121 7 THR E O 6639 C CB . THR E 7 ? 0.5279 0.2742 0.3690 0.0052 0.0581 -0.0159 7 THR E CB 6640 O OG1 . THR E 7 ? 0.5173 0.3005 0.3883 0.0167 0.0347 -0.0375 7 THR E OG1 6641 C CG2 . THR E 7 ? 0.5665 0.2748 0.3490 0.0282 0.0527 -0.0090 7 THR E CG2 6642 N N . ARG E 8 ? 0.2651 0.1526 0.2383 -0.0403 0.0786 -0.0229 8 ARG E N 6643 C CA . ARG E 8 ? 0.3317 0.2759 0.3484 -0.0482 0.0819 -0.0276 8 ARG E CA 6644 C C . ARG E 8 ? 0.3369 0.2737 0.3468 -0.0340 0.0660 -0.0449 8 ARG E C 6645 O O . ARG E 8 ? 0.4306 0.3981 0.4610 -0.0371 0.0686 -0.0540 8 ARG E O 6646 C CB . ARG E 8 ? 0.3832 0.3473 0.4126 -0.0662 0.1048 -0.0158 8 ARG E CB 6647 C CG . ARG E 8 ? 0.3689 0.3446 0.3972 -0.0591 0.0980 -0.0006 8 ARG E CG 6648 C CD . ARG E 8 ? 0.3685 0.3842 0.4073 -0.0552 0.0883 0.0099 8 ARG E CD 6649 N NE . ARG E 8 ? 0.4021 0.4186 0.4377 -0.0514 0.0890 0.0189 8 ARG E NE 6650 C CZ . ARG E 8 ? 0.3660 0.4060 0.4082 -0.0507 0.0913 0.0247 8 ARG E CZ 6651 N NH1 . ARG E 8 ? 0.3224 0.3917 0.3754 -0.0526 0.0902 0.0247 8 ARG E NH1 6652 N NH2 . ARG E 8 ? 0.3189 0.3549 0.3581 -0.0472 0.0959 0.0303 8 ARG E NH2 6653 N N . ARG E 9 ? 0.3231 0.2209 0.3028 -0.0140 0.0477 -0.0522 9 ARG E N 6654 C CA . ARG E 9 ? 0.3141 0.1973 0.2833 0.0072 0.0305 -0.0687 9 ARG E CA 6655 C C . ARG E 9 ? 0.3241 0.2494 0.3091 0.0283 0.0086 -0.0829 9 ARG E C 6656 O O . ARG E 9 ? 0.3186 0.2623 0.3126 0.0259 0.0034 -0.0803 9 ARG E O 6657 C CB . ARG E 9 ? 0.3859 0.1810 0.3013 0.0176 0.0289 -0.0603 9 ARG E CB 6658 C CG . ARG E 9 ? 0.4399 0.1988 0.3510 -0.0065 0.0498 -0.0481 9 ARG E CG 6659 C CD . ARG E 9 ? 0.3941 0.1786 0.3395 -0.0132 0.0477 -0.0692 9 ARG E CD 6660 N NE . ARG E 9 ? 0.4538 0.2217 0.3923 0.0162 0.0249 -0.0913 9 ARG E NE 6661 C CZ . ARG E 9 ? 0.5416 0.2266 0.4471 0.0305 0.0169 -0.0904 9 ARG E CZ 6662 N NH1 . ARG E 9 ? 0.5719 0.1849 0.4496 0.0142 0.0322 -0.0643 9 ARG E NH1 6663 N NH2 . ARG E 9 ? 0.5332 0.2083 0.4338 0.0634 -0.0051 -0.1129 9 ARG E NH2 6664 N N . GLN E 10 ? 0.3397 0.2834 0.3317 0.0494 -0.0053 -0.1011 10 GLN E N 6665 C CA . GLN E 10 ? 0.3426 0.3340 0.3504 0.0742 -0.0270 -0.1164 10 GLN E CA 6666 C C . GLN E 10 ? 0.3808 0.3152 0.3409 0.0995 -0.0456 -0.1174 10 GLN E C 6667 O O . GLN E 10 ? 0.4595 0.3161 0.3718 0.1137 -0.0466 -0.1121 10 GLN E O 6668 C CB . GLN E 10 ? 0.3138 0.3429 0.3376 0.0959 -0.0350 -0.1377 10 GLN E CB 6669 C CG . GLN E 10 ? 0.3732 0.5006 0.4405 0.1111 -0.0461 -0.1495 10 GLN E CG 6670 C CD . GLN E 10 ? 0.3511 0.5612 0.4731 0.0825 -0.0285 -0.1340 10 GLN E CD 6671 O OE1 . GLN E 10 ? 0.4514 0.7251 0.6126 0.0793 -0.0337 -0.1305 10 GLN E OE1 6672 N NE2 . GLN E 10 ? 0.1914 0.4035 0.3200 0.0616 -0.0077 -0.1233 10 GLN E NE2 6673 N N . LYS E 11 ? 0.4119 0.3864 0.3866 0.1049 -0.0603 -0.1231 11 LYS E N 6674 C CA . LYS E 11 ? 0.4688 0.4062 0.3984 0.1324 -0.0808 -0.1268 11 LYS E CA 6675 C C . LYS E 11 ? 0.5095 0.5107 0.4620 0.1622 -0.1075 -0.1488 11 LYS E C 6676 O O . LYS E 11 ? 0.4455 0.5305 0.4578 0.1478 -0.1117 -0.1581 11 LYS E O 6677 C CB . LYS E 11 ? 0.4131 0.3433 0.3359 0.1159 -0.0799 -0.1219 11 LYS E CB 6678 C CG . LYS E 11 ? 0.5753 0.4977 0.4603 0.1488 -0.1073 -0.1342 11 LYS E CG 6679 C CD . LYS E 11 ? 0.5953 0.4858 0.4478 0.1417 -0.1049 -0.1303 11 LYS E CD 6680 C CE . LYS E 11 ? 0.6995 0.5102 0.4910 0.1425 -0.0810 -0.1021 11 LYS E CE 6681 N NZ . LYS E 11 ? 0.9003 0.6850 0.6440 0.1512 -0.0816 -0.0992 11 LYS E NZ 6682 N N . CYS E 12 ? 0.6303 0.5934 0.5377 0.2041 -0.1244 -0.1543 12 CYS E N 6683 C CA . CYS E 12 ? 0.7488 0.7744 0.6744 0.2405 -0.1497 -0.1760 12 CYS E CA 6684 C C . CYS E 12 ? 0.8906 0.9061 0.7757 0.2752 -0.1760 -0.1818 12 CYS E C 6685 O O . CYS E 12 ? 0.9856 0.9235 0.8095 0.2836 -0.1733 -0.1653 12 CYS E O 6686 C CB . CYS E 12 ? 0.7807 0.7782 0.6905 0.2708 -0.1507 -0.1829 12 CYS E CB 6687 S SG . CYS E 12 ? 0.7726 0.7572 0.7081 0.2338 -0.1209 -0.1780 12 CYS E SG 6688 O OXT . CYS E 12 ? 0.9255 1.0197 0.8396 0.2972 -0.2003 -0.2028 12 CYS E OXT 6689 N N . CYS F 1 ? 0.3350 0.6928 0.6048 0.0303 0.0975 -0.0733 1 CYS F N 6690 C CA . CYS F 1 ? 0.4403 0.7237 0.6578 0.0168 0.1014 -0.0443 1 CYS F CA 6691 C C . CYS F 1 ? 0.4732 0.7416 0.6905 -0.0050 0.1092 -0.0438 1 CYS F C 6692 O O . CYS F 1 ? 0.4903 0.8091 0.7525 -0.0104 0.1103 -0.0673 1 CYS F O 6693 C CB . CYS F 1 ? 0.4010 0.6531 0.5930 0.0414 0.0738 -0.0168 1 CYS F CB 6694 S SG . CYS F 1 ? 0.4750 0.7334 0.6704 0.0683 0.0653 -0.0154 1 CYS F SG 6695 N N . GLN F 2 ? 0.4219 0.6225 0.5893 -0.0139 0.1125 -0.0195 2 GLN F N 6696 C CA . GLN F 2 ? 0.3974 0.5719 0.5585 -0.0320 0.1194 -0.0153 2 GLN F CA 6697 C C . GLN F 2 ? 0.4115 0.5280 0.5239 -0.0211 0.0984 0.0139 2 GLN F C 6698 O O . GLN F 2 ? 0.3713 0.4497 0.4421 -0.0095 0.0932 0.0284 2 GLN F O 6699 C CB . GLN F 2 ? 0.4491 0.5937 0.5995 -0.0616 0.1620 -0.0238 2 GLN F CB 6700 C CG . GLN F 2 ? 0.5254 0.7110 0.7341 -0.0851 0.1821 -0.0539 2 GLN F CG 6701 C CD . GLN F 2 ? 0.6834 0.8087 0.8695 -0.1153 0.2254 -0.0506 2 GLN F CD 6702 O OE1 . GLN F 2 ? 0.7869 0.8380 0.9034 -0.1137 0.2384 -0.0222 2 GLN F OE1 6703 N NE2 . GLN F 2 ? 0.6904 0.8375 0.9228 -0.1343 0.2382 -0.0781 2 GLN F NE2 6704 N N . PHE F 3 ? 0.3985 0.5135 0.5206 -0.0241 0.0860 0.0171 3 PHE F N 6705 C CA . PHE F 3 ? 0.3307 0.3963 0.4145 -0.0149 0.0660 0.0387 3 PHE F CA 6706 C C . PHE F 3 ? 0.3950 0.3907 0.4225 -0.0241 0.0841 0.0514 3 PHE F C 6707 O O . PHE F 3 ? 0.3515 0.3308 0.3781 -0.0453 0.1144 0.0461 3 PHE F O 6708 C CB . PHE F 3 ? 0.2928 0.3795 0.4045 -0.0162 0.0499 0.0357 3 PHE F CB 6709 C CG . PHE F 3 ? 0.3062 0.3481 0.3863 -0.0078 0.0294 0.0527 3 PHE F CG 6710 C CD1 . PHE F 3 ? 0.2690 0.3116 0.3461 0.0123 0.0058 0.0613 3 PHE F CD1 6711 C CD2 . PHE F 3 ? 0.2618 0.2596 0.3185 -0.0196 0.0361 0.0575 3 PHE F CD2 6712 C CE1 . PHE F 3 ? 0.2111 0.2192 0.2678 0.0192 -0.0124 0.0695 3 PHE F CE1 6713 C CE2 . PHE F 3 ? 0.2670 0.2283 0.2972 -0.0088 0.0145 0.0686 3 PHE F CE2 6714 C CZ . PHE F 3 ? 0.2462 0.2168 0.2791 0.0100 -0.0106 0.0722 3 PHE F CZ 6715 N N . ASP F 4 ? 0.3361 0.2898 0.3167 -0.0058 0.0669 0.0665 4 ASP F N 6716 C CA . ASP F 4 ? 0.4037 0.2895 0.3161 -0.0019 0.0782 0.0802 4 ASP F CA 6717 C C . ASP F 4 ? 0.4115 0.2611 0.2997 0.0088 0.0547 0.0899 4 ASP F C 6718 O O . ASP F 4 ? 0.4701 0.3323 0.3684 0.0255 0.0233 0.0878 4 ASP F O 6719 C CB . ASP F 4 ? 0.5655 0.4405 0.4425 0.0172 0.0735 0.0816 4 ASP F CB 6720 C CG . ASP F 4 ? 0.5966 0.4051 0.3931 0.0269 0.0888 0.0949 4 ASP F CG 6721 O OD1 . ASP F 4 ? 0.6001 0.3599 0.3608 0.0250 0.0965 0.1074 4 ASP F OD1 6722 O OD2 . ASP F 4 ? 0.7045 0.5082 0.4703 0.0397 0.0934 0.0930 4 ASP F OD2 6723 N N . LEU F 5 ? 0.4601 0.2622 0.3184 -0.0007 0.0725 0.0987 5 LEU F N 6724 C CA . LEU F 5 ? 0.5939 0.3617 0.4309 0.0105 0.0502 0.1059 5 LEU F CA 6725 C C . LEU F 5 ? 0.6754 0.4045 0.4518 0.0428 0.0257 0.1124 5 LEU F C 6726 O O . LEU F 5 ? 0.6752 0.4031 0.4546 0.0577 -0.0060 0.1081 5 LEU F O 6727 C CB . LEU F 5 ? 0.5565 0.2750 0.3739 -0.0055 0.0790 0.1141 5 LEU F CB 6728 C CG . LEU F 5 ? 0.5066 0.2711 0.3970 -0.0363 0.0966 0.0978 5 LEU F CG 6729 C CD1 . LEU F 5 ? 0.5466 0.2575 0.4228 -0.0558 0.1354 0.1024 5 LEU F CD1 6730 C CD2 . LEU F 5 ? 0.4373 0.2466 0.3745 -0.0322 0.0610 0.0879 5 LEU F CD2 6731 N N . SER F 6 ? 0.6577 0.3594 0.3809 0.0554 0.0395 0.1184 6 SER F N 6732 C CA . SER F 6 ? 0.7062 0.3894 0.3820 0.0881 0.0137 0.1137 6 SER F CA 6733 C C . SER F 6 ? 0.6974 0.4248 0.4121 0.1022 -0.0212 0.0959 6 SER F C 6734 O O . SER F 6 ? 0.6639 0.3988 0.3779 0.1202 -0.0481 0.0789 6 SER F O 6735 C CB . SER F 6 ? 0.7897 0.4424 0.4036 0.0993 0.0375 0.1204 6 SER F CB 6736 O OG . SER F 6 ? 0.9029 0.5190 0.4954 0.0801 0.0789 0.1343 6 SER F OG 6737 N N . THR F 7 ? 0.4784 0.2544 0.2502 0.0870 -0.0161 0.0894 7 THR F N 6738 C CA . THR F 7 ? 0.5276 0.3434 0.3421 0.0977 -0.0397 0.0718 7 THR F CA 6739 C C . THR F 7 ? 0.4749 0.3304 0.3585 0.0839 -0.0486 0.0678 7 THR F C 6740 O O . THR F 7 ? 0.3833 0.2610 0.3026 0.0925 -0.0652 0.0546 7 THR F O 6741 C CB . THR F 7 ? 0.4268 0.2659 0.2493 0.0977 -0.0255 0.0659 7 THR F CB 6742 O OG1 . THR F 7 ? 0.4041 0.2678 0.2575 0.0733 0.0009 0.0728 7 THR F OG1 6743 C CG2 . THR F 7 ? 0.5132 0.3162 0.2626 0.1168 -0.0183 0.0672 7 THR F CG2 6744 N N . ARG F 8 ? 0.4270 0.2916 0.3305 0.0639 -0.0358 0.0769 8 ARG F N 6745 C CA . ARG F 8 ? 0.3856 0.2926 0.3478 0.0542 -0.0411 0.0742 8 ARG F CA 6746 C C . ARG F 8 ? 0.3872 0.3326 0.3854 0.0567 -0.0359 0.0701 8 ARG F C 6747 O O . ARG F 8 ? 0.4124 0.3819 0.4484 0.0609 -0.0441 0.0682 8 ARG F O 6748 C CB . ARG F 8 ? 0.3901 0.2934 0.3663 0.0626 -0.0658 0.0681 8 ARG F CB 6749 C CG . ARG F 8 ? 0.4120 0.2830 0.3554 0.0630 -0.0710 0.0682 8 ARG F CG 6750 C CD . ARG F 8 ? 0.4695 0.3651 0.4459 0.0568 -0.0785 0.0562 8 ARG F CD 6751 N NE . ARG F 8 ? 0.4942 0.3639 0.4445 0.0597 -0.0852 0.0522 8 ARG F NE 6752 C CZ . ARG F 8 ? 0.4296 0.3113 0.3982 0.0559 -0.0939 0.0398 8 ARG F CZ 6753 N NH1 . ARG F 8 ? 0.4562 0.3712 0.4639 0.0474 -0.0932 0.0318 8 ARG F NH1 6754 N NH2 . ARG F 8 ? 0.3020 0.1581 0.2451 0.0615 -0.1015 0.0360 8 ARG F NH2 6755 N N . ARG F 9 ? 0.3758 0.3231 0.3600 0.0557 -0.0196 0.0694 9 ARG F N 6756 C CA . ARG F 9 ? 0.3549 0.3355 0.3705 0.0605 -0.0140 0.0645 9 ARG F CA 6757 C C . ARG F 9 ? 0.3704 0.3759 0.3940 0.0477 0.0088 0.0628 9 ARG F C 6758 O O . ARG F 9 ? 0.3883 0.3745 0.3847 0.0349 0.0259 0.0642 9 ARG F O 6759 C CB . ARG F 9 ? 0.2682 0.2343 0.2682 0.0755 -0.0194 0.0557 9 ARG F CB 6760 C CG . ARG F 9 ? 0.2673 0.2228 0.2804 0.0882 -0.0403 0.0467 9 ARG F CG 6761 C CD . ARG F 9 ? 0.2495 0.2282 0.3142 0.0878 -0.0412 0.0494 9 ARG F CD 6762 N NE . ARG F 9 ? 0.2041 0.2076 0.2950 0.0912 -0.0277 0.0518 9 ARG F NE 6763 C CZ . ARG F 9 ? 0.2932 0.2965 0.3979 0.1011 -0.0246 0.0412 9 ARG F CZ 6764 N NH1 . ARG F 9 ? 0.2610 0.2464 0.3584 0.1082 -0.0347 0.0238 9 ARG F NH1 6765 N NH2 . ARG F 9 ? 0.2682 0.2921 0.3955 0.1065 -0.0127 0.0445 9 ARG F NH2 6766 N N . GLN F 10 ? 0.3612 0.4082 0.4232 0.0528 0.0110 0.0583 10 GLN F N 6767 C CA . GLN F 10 ? 0.3375 0.4166 0.4142 0.0445 0.0305 0.0485 10 GLN F CA 6768 C C . GLN F 10 ? 0.3369 0.3950 0.3830 0.0433 0.0447 0.0444 10 GLN F C 6769 O O . GLN F 10 ? 0.3206 0.3641 0.3552 0.0577 0.0354 0.0440 10 GLN F O 6770 C CB . GLN F 10 ? 0.2950 0.4220 0.4137 0.0593 0.0255 0.0434 10 GLN F CB 6771 C CG . GLN F 10 ? 0.2817 0.4373 0.4247 0.0638 0.0149 0.0458 10 GLN F CG 6772 C CD . GLN F 10 ? 0.1666 0.3535 0.3265 0.0466 0.0252 0.0309 10 GLN F CD 6773 O OE1 . GLN F 10 ? 0.1890 0.3924 0.3576 0.0339 0.0439 0.0152 10 GLN F OE1 6774 N NE2 . GLN F 10 ? 0.1512 0.3478 0.3206 0.0446 0.0155 0.0323 10 GLN F NE2 6775 N N . LYS F 11 ? 0.3982 0.4540 0.4322 0.0256 0.0699 0.0390 11 LYS F N 6776 C CA . LYS F 11 ? 0.4077 0.4403 0.4044 0.0235 0.0896 0.0366 11 LYS F CA 6777 C C . LYS F 11 ? 0.4178 0.4991 0.4524 0.0206 0.1044 0.0185 11 LYS F C 6778 O O . LYS F 11 ? 0.3631 0.4783 0.4315 0.0044 0.1224 0.0045 11 LYS F O 6779 C CB . LYS F 11 ? 0.4737 0.4611 0.4260 0.0064 0.1159 0.0444 11 LYS F CB 6780 C CG . LYS F 11 ? 0.5557 0.5126 0.4571 0.0074 0.1408 0.0454 11 LYS F CG 6781 C CD . LYS F 11 ? 0.6666 0.5520 0.4946 0.0070 0.1566 0.0643 11 LYS F CD 6782 C CE . LYS F 11 ? 0.7872 0.6381 0.5476 0.0232 0.1685 0.0691 11 LYS F CE 6783 N NZ . LYS F 11 ? 0.8322 0.7096 0.6017 0.0489 0.1332 0.0587 11 LYS F NZ 6784 N N . CYS F 12 ? 0.5663 0.6556 0.6027 0.0378 0.0948 0.0141 12 CYS F N 6785 C CA . CYS F 12 ? 0.6678 0.7969 0.7323 0.0391 0.1077 -0.0040 12 CYS F CA 6786 C C . CYS F 12 ? 0.8344 0.9488 0.8806 0.0574 0.0982 -0.0057 12 CYS F C 6787 O O . CYS F 12 ? 0.7257 0.8310 0.7804 0.0745 0.0748 -0.0006 12 CYS F O 6788 C CB . CYS F 12 ? 0.5206 0.7062 0.6449 0.0475 0.0971 -0.0147 12 CYS F CB 6789 S SG . CYS F 12 ? 0.5099 0.6930 0.6493 0.0649 0.0667 0.0027 12 CYS F SG 6790 O OXT . CYS F 12 ? 1.0234 1.1351 1.0481 0.0547 0.1161 -0.0152 12 CYS F OXT 6796 C C1 . NAG H . ? 0.9735 0.8053 0.8056 -0.2849 0.3176 -0.2442 301 NAG B C1 6797 C C2 . NAG H . ? 1.0106 0.8613 0.8382 -0.2878 0.3203 -0.2580 301 NAG B C2 6798 C C3 . NAG H . ? 1.0499 0.8981 0.8369 -0.3116 0.3413 -0.2675 301 NAG B C3 6799 C C4 . NAG H . ? 1.0667 0.9096 0.8755 -0.3170 0.3596 -0.2726 301 NAG B C4 6800 C C5 . NAG H . ? 1.1083 0.9286 0.9191 -0.3137 0.3547 -0.2584 301 NAG B C5 6801 C C6 . NAG H . ? 1.1496 0.9622 0.9828 -0.3207 0.3721 -0.2654 301 NAG B C6 6802 C C7 . NAG H . ? 1.0256 0.8925 0.8621 -0.2615 0.2880 -0.2517 301 NAG B C7 6803 C C8 . NAG H . ? 0.9906 0.8704 0.8881 -0.2433 0.2911 -0.2574 301 NAG B C8 6804 N N2 . NAG H . ? 1.0219 0.8769 0.8259 -0.2824 0.3022 -0.2518 301 NAG B N2 6805 O O3 . NAG H . ? 1.1122 0.9733 0.9024 -0.3150 0.3504 -0.2842 301 NAG B O3 6806 O O4 . NAG H . ? 1.1060 0.9519 0.8739 -0.3357 0.3784 -0.2752 301 NAG B O4 6807 O O5 . NAG H . ? 1.0585 0.8842 0.9103 -0.2953 0.3363 -0.2529 301 NAG B O5 6808 O O6 . NAG H . ? 1.2110 0.9944 1.0455 -0.3176 0.3698 -0.2562 301 NAG B O6 6809 O O7 . NAG H . ? 1.0481 0.9166 0.8628 -0.2591 0.2732 -0.2472 301 NAG B O7 6820 C C1 . NAG K . ? 1.0933 0.8621 0.9288 -0.1885 -0.2959 0.0907 301 NAG D C1 6821 C C2 . NAG K . ? 1.1633 0.9116 0.9831 -0.1939 -0.3122 0.1044 301 NAG D C2 6822 C C3 . NAG K . ? 1.2216 0.9340 1.0020 -0.2113 -0.3332 0.1126 301 NAG D C3 6823 C C4 . NAG K . ? 1.1954 0.9140 1.0093 -0.2092 -0.3490 0.1132 301 NAG D C4 6824 C C5 . NAG K . ? 1.1653 0.9050 0.9892 -0.2040 -0.3285 0.0982 301 NAG D C5 6825 C C6 . NAG K . ? 1.1292 0.8767 0.9854 -0.2035 -0.3405 0.0973 301 NAG D C6 6826 C C7 . NAG K . ? 1.1678 0.9273 0.9764 -0.1864 -0.2886 0.1039 301 NAG D C7 6827 C C8 . NAG K . ? 1.1283 0.9113 1.0072 -0.1700 -0.3011 0.1095 301 NAG D C8 6828 N N2 . NAG K . ? 1.2100 0.9531 0.9933 -0.1972 -0.2945 0.1014 301 NAG D N2 6829 O O3 . NAG K . ? 1.2845 0.9773 1.0616 -0.2159 -0.3524 0.1269 301 NAG D O3 6830 O O4 . NAG K . ? 1.3050 0.9889 1.0775 -0.2266 -0.3679 0.1199 301 NAG D O4 6831 O O5 . NAG K . ? 1.1387 0.9114 1.0051 -0.1882 -0.3116 0.0931 301 NAG D O5 6832 O O6 . NAG K . ? 1.0436 0.8023 0.8985 -0.2023 -0.3211 0.0834 301 NAG D O6 6833 O O7 . NAG K . ? 1.1146 0.8705 0.8913 -0.1902 -0.2728 0.1006 301 NAG D O7 # 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 ASP 1 1 1 ASP ASP A . n A 1 2 ILE 2 2 2 ILE ILE A . n A 1 3 LEU 3 3 3 LEU LEU A . n A 1 4 LEU 4 4 4 LEU LEU A . n A 1 5 THR 5 5 5 THR THR A . n A 1 6 GLN 6 6 6 GLN GLN A . n A 1 7 SER 7 7 7 SER SER A . n A 1 8 PRO 8 8 8 PRO PRO A . n A 1 9 VAL 9 9 9 VAL VAL A . n A 1 10 ILE 10 10 10 ILE ILE A . n A 1 11 LEU 11 11 11 LEU LEU A . n A 1 12 SER 12 12 12 SER SER A . n A 1 13 VAL 13 13 13 VAL VAL A . n A 1 14 SER 14 14 14 SER SER A . n A 1 15 PRO 15 15 15 PRO PRO A . n A 1 16 GLY 16 16 16 GLY GLY A . n A 1 17 GLU 17 17 17 GLU GLU A . n A 1 18 ARG 18 18 18 ARG ARG A . n A 1 19 VAL 19 19 19 VAL VAL A . n A 1 20 SER 20 20 20 SER SER A . n A 1 21 PHE 21 21 21 PHE PHE A . n A 1 22 SER 22 22 22 SER SER A . n A 1 23 CYS 23 23 23 CYS CYS A . n A 1 24 ARG 24 24 24 ARG ARG A . n A 1 25 ALA 25 25 25 ALA ALA A . n A 1 26 SER 26 26 26 SER SER A . n A 1 27 GLN 27 27 27 GLN GLN A . n A 1 28 SER 28 28 28 SER SER A . n A 1 29 ILE 29 29 29 ILE ILE A . n A 1 30 GLY 30 30 30 GLY GLY A . n A 1 31 THR 31 31 31 THR THR A . n A 1 32 ASN 32 32 32 ASN ASN A . n A 1 33 ILE 33 33 33 ILE ILE A . n A 1 34 HIS 34 34 34 HIS HIS A . n A 1 35 TRP 35 35 35 TRP TRP A . n A 1 36 TYR 36 36 36 TYR TYR A . n A 1 37 GLN 37 37 37 GLN GLN A . n A 1 38 GLN 38 38 38 GLN GLN A . n A 1 39 ARG 39 39 39 ARG ARG A . n A 1 40 THR 40 40 40 THR THR A . n A 1 41 ASN 41 41 41 ASN ASN A . n A 1 42 GLY 42 42 42 GLY GLY A . n A 1 43 SER 43 43 43 SER SER A . n A 1 44 PRO 44 44 44 PRO PRO A . n A 1 45 ARG 45 45 45 ARG ARG A . n A 1 46 LEU 46 46 46 LEU LEU A . n A 1 47 LEU 47 47 47 LEU LEU A . n A 1 48 ILE 48 48 48 ILE ILE A . n A 1 49 LYS 49 49 49 LYS LYS A . n A 1 50 TYR 50 50 50 TYR TYR A . n A 1 51 ALA 51 51 51 ALA ALA A . n A 1 52 SER 52 52 52 SER SER A . n A 1 53 GLU 53 53 53 GLU GLU A . n A 1 54 SER 54 54 54 SER SER A . n A 1 55 ILE 55 55 55 ILE ILE A . n A 1 56 SER 56 56 56 SER SER A . n A 1 57 GLY 57 57 57 GLY GLY A . n A 1 58 ILE 58 58 58 ILE ILE A . n A 1 59 PRO 59 59 59 PRO PRO A . n A 1 60 SER 60 60 60 SER SER A . n A 1 61 ARG 61 61 61 ARG ARG A . n A 1 62 PHE 62 62 62 PHE PHE A . n A 1 63 SER 63 63 63 SER SER A . n A 1 64 GLY 64 64 64 GLY GLY A . n A 1 65 SER 65 65 65 SER SER A . n A 1 66 GLY 66 66 66 GLY GLY A . n A 1 67 SER 67 67 67 SER SER A . n A 1 68 GLY 68 68 68 GLY GLY A . n A 1 69 THR 69 69 69 THR THR A . n A 1 70 ASP 70 70 70 ASP ASP A . n A 1 71 PHE 71 71 71 PHE PHE A . n A 1 72 THR 72 72 72 THR THR A . n A 1 73 LEU 73 73 73 LEU LEU A . n A 1 74 SER 74 74 74 SER SER A . n A 1 75 ILE 75 75 75 ILE ILE A . n A 1 76 ASN 76 76 76 ASN ASN A . n A 1 77 SER 77 77 77 SER SER A . n A 1 78 VAL 78 78 78 VAL VAL A . n A 1 79 GLU 79 79 79 GLU GLU A . n A 1 80 SER 80 80 80 SER SER A . n A 1 81 GLU 81 81 81 GLU GLU A . n A 1 82 ASP 82 82 82 ASP ASP A . n A 1 83 ILE 83 83 83 ILE ILE A . n A 1 84 ALA 84 84 84 ALA ALA A . n A 1 85 ASP 85 85 85 ASP ASP A . n A 1 86 TYR 86 86 86 TYR TYR A . n A 1 87 TYR 87 87 87 TYR TYR A . n A 1 88 CYS 88 88 88 CYS CYS A . n A 1 89 GLN 89 89 89 GLN GLN A . n A 1 90 GLN 90 90 90 GLN GLN A . n A 1 91 ASN 91 91 91 ASN ASN A . n A 1 92 ASN 92 92 92 ASN ASN A . n A 1 93 ASN 93 93 93 ASN ASN A . n A 1 94 TRP 94 94 94 TRP TRP A . n A 1 95 PRO 95 95 95 PRO PRO A . n A 1 96 THR 96 96 96 THR THR A . n A 1 97 THR 97 97 97 THR THR A . n A 1 98 PHE 98 98 98 PHE PHE A . n A 1 99 GLY 99 99 99 GLY GLY A . n A 1 100 ALA 100 100 100 ALA ALA A . n A 1 101 GLY 101 101 101 GLY GLY A . n A 1 102 THR 102 102 102 THR THR A . n A 1 103 LYS 103 103 103 LYS LYS A . n A 1 104 LEU 104 104 104 LEU LEU A . n A 1 105 GLU 105 105 105 GLU GLU A . n A 1 106 LEU 106 106 106 LEU LEU A . n A 1 107 LYS 107 107 107 LYS LYS A . n A 1 108 ARG 108 108 108 ARG ARG A . n A 1 109 THR 109 109 109 THR THR A . n A 1 110 VAL 110 110 110 VAL VAL A . n A 1 111 ALA 111 111 111 ALA ALA A . n A 1 112 ALA 112 112 112 ALA ALA A . n A 1 113 PRO 113 113 113 PRO PRO A . n A 1 114 SER 114 114 114 SER SER A . n A 1 115 VAL 115 115 115 VAL VAL A . n A 1 116 PHE 116 116 116 PHE PHE A . n A 1 117 ILE 117 117 117 ILE ILE A . n A 1 118 PHE 118 118 118 PHE PHE A . n A 1 119 PRO 119 119 119 PRO PRO A . n A 1 120 PRO 120 120 120 PRO PRO A . n A 1 121 SER 121 121 121 SER SER A . n A 1 122 ASP 122 122 122 ASP ASP A . n A 1 123 GLU 123 123 123 GLU GLU A . n A 1 124 GLN 124 124 124 GLN GLN A . n A 1 125 LEU 125 125 125 LEU LEU A . n A 1 126 LYS 126 126 126 LYS LYS A . n A 1 127 SER 127 127 127 SER SER A . n A 1 128 GLY 128 128 128 GLY GLY A . n A 1 129 THR 129 129 129 THR THR A . n A 1 130 ALA 130 130 130 ALA ALA A . n A 1 131 SER 131 131 131 SER SER A . n A 1 132 VAL 132 132 132 VAL VAL A . n A 1 133 VAL 133 133 133 VAL VAL A . n A 1 134 CYS 134 134 134 CYS CYS A . n A 1 135 LEU 135 135 135 LEU LEU A . n A 1 136 LEU 136 136 136 LEU LEU A . n A 1 137 ASN 137 137 137 ASN ASN A . n A 1 138 ASN 138 138 138 ASN ASN A . n A 1 139 PHE 139 139 139 PHE PHE A . n A 1 140 TYR 140 140 140 TYR TYR A . n A 1 141 PRO 141 141 141 PRO PRO A . n A 1 142 ARG 142 142 142 ARG ARG A . n A 1 143 GLU 143 143 143 GLU GLU A . n A 1 144 ALA 144 144 144 ALA ALA A . n A 1 145 LYS 145 145 145 LYS LYS A . n A 1 146 VAL 146 146 146 VAL VAL A . n A 1 147 GLN 147 147 147 GLN GLN A . n A 1 148 TRP 148 148 148 TRP TRP A . n A 1 149 LYS 149 149 149 LYS LYS A . n A 1 150 VAL 150 150 150 VAL VAL A . n A 1 151 ASP 151 151 151 ASP ASP A . n A 1 152 ASN 152 152 152 ASN ASN A . n A 1 153 ALA 153 153 153 ALA ALA A . n A 1 154 LEU 154 154 154 LEU LEU A . n A 1 155 GLN 155 155 155 GLN GLN A . n A 1 156 SER 156 156 156 SER SER A . n A 1 157 GLY 157 157 157 GLY GLY A . n A 1 158 ASN 158 158 158 ASN ASN A . n A 1 159 SER 159 159 159 SER SER A . n A 1 160 GLN 160 160 160 GLN GLN A . n A 1 161 GLU 161 161 161 GLU GLU A . n A 1 162 SER 162 162 162 SER SER A . n A 1 163 VAL 163 163 163 VAL VAL A . n A 1 164 THR 164 164 164 THR THR A . n A 1 165 GLU 165 165 165 GLU GLU A . n A 1 166 GLN 166 166 166 GLN GLN A . n A 1 167 ASP 167 167 167 ASP ASP A . n A 1 168 SER 168 168 168 SER SER A . n A 1 169 LYS 169 169 169 LYS LYS A . n A 1 170 ASP 170 170 170 ASP ASP A . n A 1 171 SER 171 171 171 SER SER A . n A 1 172 THR 172 172 172 THR THR A . n A 1 173 TYR 173 173 173 TYR TYR A . n A 1 174 SER 174 174 174 SER SER A . n A 1 175 LEU 175 175 175 LEU LEU A . n A 1 176 SER 176 176 176 SER SER A . n A 1 177 SER 177 177 177 SER SER A . n A 1 178 THR 178 178 178 THR THR A . n A 1 179 LEU 179 179 179 LEU LEU A . n A 1 180 THR 180 180 180 THR THR A . n A 1 181 LEU 181 181 181 LEU LEU A . n A 1 182 SER 182 182 182 SER SER A . n A 1 183 LYS 183 183 183 LYS LYS A . n A 1 184 ALA 184 184 184 ALA ALA A . n A 1 185 ASP 185 185 185 ASP ASP A . n A 1 186 TYR 186 186 186 TYR TYR A . n A 1 187 GLU 187 187 187 GLU GLU A . n A 1 188 LYS 188 188 188 LYS LYS A . n A 1 189 HIS 189 189 189 HIS HIS A . n A 1 190 LYS 190 190 190 LYS LYS A . n A 1 191 VAL 191 191 191 VAL VAL A . n A 1 192 TYR 192 192 192 TYR TYR A . n A 1 193 ALA 193 193 193 ALA ALA A . n A 1 194 CYS 194 194 194 CYS CYS A . n A 1 195 GLU 195 195 195 GLU GLU A . n A 1 196 VAL 196 196 196 VAL VAL A . n A 1 197 THR 197 197 197 THR THR A . n A 1 198 HIS 198 198 198 HIS HIS A . n A 1 199 GLN 199 199 199 GLN GLN A . n A 1 200 GLY 200 200 200 GLY GLY A . n A 1 201 LEU 201 201 201 LEU LEU A . n A 1 202 SER 202 202 202 SER SER A . n A 1 203 SER 203 203 203 SER SER A . n A 1 204 PRO 204 204 204 PRO PRO A . n A 1 205 VAL 205 205 205 VAL VAL A . n A 1 206 THR 206 206 206 THR THR A . n A 1 207 LYS 207 207 207 LYS LYS A . n A 1 208 SER 208 208 208 SER SER A . n A 1 209 PHE 209 209 209 PHE PHE A . n A 1 210 ASN 210 210 210 ASN ASN A . n A 1 211 ARG 211 211 211 ARG ARG A . n A 1 212 GLY 212 212 212 GLY GLY A . n A 1 213 ALA 213 213 213 ALA ALA A . n B 2 1 GLN 1 1 1 GLN GLN B . n B 2 2 VAL 2 2 2 VAL VAL B . n B 2 3 GLN 3 3 3 GLN GLN B . n B 2 4 LEU 4 4 4 LEU LEU B . n B 2 5 LYS 5 5 5 LYS LYS B . n B 2 6 GLN 6 6 6 GLN GLN B . n B 2 7 SER 7 7 7 SER SER B . n B 2 8 GLY 8 8 8 GLY GLY B . n B 2 9 PRO 9 9 9 PRO PRO B . n B 2 10 GLY 10 10 10 GLY GLY B . n B 2 11 LEU 11 11 11 LEU LEU B . n B 2 12 VAL 12 12 12 VAL VAL B . n B 2 13 GLN 13 13 13 GLN GLN B . n B 2 14 PRO 14 14 14 PRO PRO B . n B 2 15 SER 15 15 15 SER SER B . n B 2 16 GLN 16 16 16 GLN GLN B . n B 2 17 SER 17 17 17 SER SER B . n B 2 18 LEU 18 18 18 LEU LEU B . n B 2 19 SER 19 19 19 SER SER B . n B 2 20 ILE 20 20 20 ILE ILE B . n B 2 21 THR 21 21 21 THR THR B . n B 2 22 CYS 22 22 22 CYS CYS B . n B 2 23 THR 23 23 23 THR THR B . n B 2 24 VAL 24 24 24 VAL VAL B . n B 2 25 SER 25 25 25 SER SER B . n B 2 26 GLY 26 26 26 GLY GLY B . n B 2 27 PHE 27 27 27 PHE PHE B . n B 2 28 SER 28 28 28 SER SER B . n B 2 29 LEU 29 29 29 LEU LEU B . n B 2 30 THR 30 30 30 THR THR B . n B 2 31 ASN 31 31 31 ASN ASN B . n B 2 32 TYR 32 32 32 TYR TYR B . n B 2 33 GLY 33 33 33 GLY GLY B . n B 2 34 VAL 34 34 34 VAL VAL B . n B 2 35 HIS 35 35 35 HIS HIS B . n B 2 36 TRP 36 36 36 TRP TRP B . n B 2 37 VAL 37 37 37 VAL VAL B . n B 2 38 ARG 38 38 38 ARG ARG B . n B 2 39 GLN 39 39 39 GLN GLN B . n B 2 40 SER 40 40 40 SER SER B . n B 2 41 PRO 41 41 41 PRO PRO B . n B 2 42 GLY 42 42 42 GLY GLY B . n B 2 43 LYS 43 43 43 LYS LYS B . n B 2 44 GLY 44 44 44 GLY GLY B . n B 2 45 LEU 45 45 45 LEU LEU B . n B 2 46 GLU 46 46 46 GLU GLU B . n B 2 47 TRP 47 47 47 TRP TRP B . n B 2 48 LEU 48 48 48 LEU LEU B . n B 2 49 GLY 49 49 49 GLY GLY B . n B 2 50 VAL 50 50 50 VAL VAL B . n B 2 51 ILE 51 51 51 ILE ILE B . n B 2 52 TRP 52 52 52 TRP TRP B . n B 2 53 SER 53 53 53 SER SER B . n B 2 54 GLY 54 54 54 GLY GLY B . n B 2 55 GLY 55 55 55 GLY GLY B . n B 2 56 ASN 56 56 56 ASN ASN B . n B 2 57 THR 57 57 57 THR THR B . n B 2 58 ASP 58 58 58 ASP ASP B . n B 2 59 TYR 59 59 59 TYR TYR B . n B 2 60 ASN 60 60 60 ASN ASN B . n B 2 61 THR 61 61 61 THR THR B . n B 2 62 PRO 62 62 62 PRO PRO B . n B 2 63 PHE 63 63 63 PHE PHE B . n B 2 64 THR 64 64 64 THR THR B . n B 2 65 SER 65 65 65 SER SER B . n B 2 66 ARG 66 66 66 ARG ARG B . n B 2 67 LEU 67 67 67 LEU LEU B . n B 2 68 SER 68 68 68 SER SER B . n B 2 69 ILE 69 69 69 ILE ILE B . n B 2 70 ASN 70 70 70 ASN ASN B . n B 2 71 LYS 71 71 71 LYS LYS B . n B 2 72 ASP 72 72 72 ASP ASP B . n B 2 73 ASN 73 73 73 ASN ASN B . n B 2 74 SER 74 74 74 SER SER B . n B 2 75 LYS 75 75 75 LYS LYS B . n B 2 76 SER 76 76 76 SER SER B . n B 2 77 GLN 77 77 77 GLN GLN B . n B 2 78 VAL 78 78 78 VAL VAL B . n B 2 79 PHE 79 79 79 PHE PHE B . n B 2 80 PHE 80 80 80 PHE PHE B . n B 2 81 LYS 81 81 81 LYS LYS B . n B 2 82 MET 82 82 82 MET MET B . n B 2 83 ASN 83 83 83 ASN ASN B . n B 2 84 SER 84 84 84 SER SER B . n B 2 85 LEU 85 85 85 LEU LEU B . n B 2 86 GLN 86 86 86 GLN GLN B . n B 2 87 SER 87 87 87 SER SER B . n B 2 88 ASN 88 88 88 ASN ASN B . n B 2 89 ASP 89 89 89 ASP ASP B . n B 2 90 THR 90 90 90 THR THR B . n B 2 91 ALA 91 91 91 ALA ALA B . n B 2 92 ILE 92 92 92 ILE ILE B . n B 2 93 TYR 93 93 93 TYR TYR B . n B 2 94 TYR 94 94 94 TYR TYR B . n B 2 95 CYS 95 95 95 CYS CYS B . n B 2 96 ALA 96 96 96 ALA ALA B . n B 2 97 ARG 97 97 97 ARG ARG B . n B 2 98 ALA 98 98 98 ALA ALA B . n B 2 99 LEU 99 99 99 LEU LEU B . n B 2 100 THR 100 100 100 THR THR B . n B 2 101 TYR 101 101 101 TYR TYR B . n B 2 102 TYR 102 102 102 TYR TYR B . n B 2 103 ASP 103 103 103 ASP ASP B . n B 2 104 TYR 104 104 104 TYR TYR B . n B 2 105 GLU 105 105 105 GLU GLU B . n B 2 106 PHE 106 106 106 PHE PHE B . n B 2 107 ALA 107 107 107 ALA ALA B . n B 2 108 TYR 108 108 108 TYR TYR B . n B 2 109 TRP 109 109 109 TRP TRP B . n B 2 110 GLY 110 110 110 GLY GLY B . n B 2 111 GLN 111 111 111 GLN GLN B . n B 2 112 GLY 112 112 112 GLY GLY B . n B 2 113 THR 113 113 113 THR THR B . n B 2 114 LEU 114 114 114 LEU LEU B . n B 2 115 VAL 115 115 115 VAL VAL B . n B 2 116 THR 116 116 116 THR THR B . n B 2 117 VAL 117 117 117 VAL VAL B . n B 2 118 SER 118 118 118 SER SER B . n B 2 119 ALA 119 119 119 ALA ALA B . n B 2 120 ALA 120 120 120 ALA ALA B . n B 2 121 SER 121 121 121 SER SER B . n B 2 122 THR 122 122 122 THR THR B . n B 2 123 LYS 123 123 123 LYS LYS B . n B 2 124 GLY 124 124 124 GLY GLY B . n B 2 125 PRO 125 125 125 PRO PRO B . n B 2 126 SER 126 126 126 SER SER B . n B 2 127 VAL 127 127 127 VAL VAL B . n B 2 128 PHE 128 128 128 PHE PHE B . n B 2 129 PRO 129 129 129 PRO PRO B . n B 2 130 LEU 130 130 130 LEU LEU B . n B 2 131 ALA 131 131 131 ALA ALA B . n B 2 132 PRO 132 132 132 PRO PRO B . n B 2 133 SER 133 133 133 SER SER B . n B 2 134 SER 134 134 134 SER SER B . n B 2 135 LYS 135 135 135 LYS LYS B . n B 2 136 SER 136 136 136 SER SER B . n B 2 137 THR 137 137 137 THR THR B . n B 2 138 SER 138 138 138 SER SER B . n B 2 139 GLY 139 139 139 GLY GLY B . n B 2 140 GLY 140 140 140 GLY GLY B . n B 2 141 THR 141 141 141 THR THR B . n B 2 142 ALA 142 142 142 ALA ALA B . n B 2 143 ALA 143 143 143 ALA ALA B . n B 2 144 LEU 144 144 144 LEU LEU B . n B 2 145 GLY 145 145 145 GLY GLY B . n B 2 146 CYS 146 146 146 CYS CYS B . n B 2 147 LEU 147 147 147 LEU LEU B . n B 2 148 VAL 148 148 148 VAL VAL B . n B 2 149 LYS 149 149 149 LYS LYS B . n B 2 150 ASP 150 150 150 ASP ASP B . n B 2 151 TYR 151 151 151 TYR TYR B . n B 2 152 PHE 152 152 152 PHE PHE B . n B 2 153 PRO 153 153 153 PRO PRO B . n B 2 154 GLU 154 154 154 GLU GLU B . n B 2 155 PRO 155 155 155 PRO PRO B . n B 2 156 VAL 156 156 156 VAL VAL B . n B 2 157 THR 157 157 157 THR THR B . n B 2 158 VAL 158 158 158 VAL VAL B . n B 2 159 SER 159 159 159 SER SER B . n B 2 160 TRP 160 160 160 TRP TRP B . n B 2 161 ASN 161 161 161 ASN ASN B . n B 2 162 SER 162 162 162 SER SER B . n B 2 163 GLY 163 163 163 GLY GLY B . n B 2 164 ALA 164 164 164 ALA ALA B . n B 2 165 LEU 165 165 165 LEU LEU B . n B 2 166 THR 166 166 166 THR THR B . n B 2 167 SER 167 167 167 SER SER B . n B 2 168 GLY 168 168 168 GLY GLY B . n B 2 169 VAL 169 169 169 VAL VAL B . n B 2 170 HIS 170 170 170 HIS HIS B . n B 2 171 THR 171 171 171 THR THR B . n B 2 172 PHE 172 172 172 PHE PHE B . n B 2 173 PRO 173 173 173 PRO PRO B . n B 2 174 ALA 174 174 174 ALA ALA B . n B 2 175 VAL 175 175 175 VAL VAL B . n B 2 176 LEU 176 176 176 LEU LEU B . n B 2 177 GLN 177 177 177 GLN GLN B . n B 2 178 SER 178 178 178 SER SER B . n B 2 179 SER 179 179 179 SER SER B . n B 2 180 GLY 180 180 180 GLY GLY B . n B 2 181 LEU 181 181 181 LEU LEU B . n B 2 182 TYR 182 182 182 TYR TYR B . n B 2 183 SER 183 183 183 SER SER B . n B 2 184 LEU 184 184 184 LEU LEU B . n B 2 185 SER 185 185 185 SER SER B . n B 2 186 SER 186 186 186 SER SER B . n B 2 187 VAL 187 187 187 VAL VAL B . n B 2 188 VAL 188 188 188 VAL VAL B . n B 2 189 THR 189 189 189 THR THR B . n B 2 190 VAL 190 190 190 VAL VAL B . n B 2 191 PRO 191 191 191 PRO PRO B . n B 2 192 SER 192 192 192 SER SER B . n B 2 193 SER 193 193 193 SER SER B . n B 2 194 SER 194 194 194 SER SER B . n B 2 195 LEU 195 195 195 LEU LEU B . n B 2 196 GLY 196 196 196 GLY GLY B . n B 2 197 THR 197 197 197 THR THR B . n B 2 198 GLN 198 198 198 GLN GLN B . n B 2 199 THR 199 199 199 THR THR B . n B 2 200 TYR 200 200 200 TYR TYR B . n B 2 201 ILE 201 201 201 ILE ILE B . n B 2 202 CYS 202 202 202 CYS CYS B . n B 2 203 ASN 203 203 203 ASN ASN B . n B 2 204 VAL 204 204 204 VAL VAL B . n B 2 205 ASN 205 205 205 ASN ASN B . n B 2 206 HIS 206 206 206 HIS HIS B . n B 2 207 LYS 207 207 207 LYS LYS B . n B 2 208 PRO 208 208 208 PRO PRO B . n B 2 209 SER 209 209 209 SER SER B . n B 2 210 ASN 210 210 210 ASN ASN B . n B 2 211 THR 211 211 211 THR THR B . n B 2 212 LYS 212 212 212 LYS LYS B . n B 2 213 VAL 213 213 213 VAL VAL B . n B 2 214 ASP 214 214 214 ASP ASP B . n B 2 215 LYS 215 215 215 LYS LYS B . n B 2 216 ARG 216 216 216 ARG ARG B . n B 2 217 VAL 217 217 217 VAL VAL B . n B 2 218 GLU 218 218 218 GLU GLU B . n B 2 219 PRO 219 219 219 PRO PRO B . n B 2 220 LYS 220 220 220 LYS LYS B . n B 2 221 SER 221 221 ? ? ? B . n C 1 1 ASP 1 1 1 ASP ASP C . n C 1 2 ILE 2 2 2 ILE ILE C . n C 1 3 LEU 3 3 3 LEU LEU C . n C 1 4 LEU 4 4 4 LEU LEU C . n C 1 5 THR 5 5 5 THR THR C . n C 1 6 GLN 6 6 6 GLN GLN C . n C 1 7 SER 7 7 7 SER SER C . n C 1 8 PRO 8 8 8 PRO PRO C . n C 1 9 VAL 9 9 9 VAL VAL C . n C 1 10 ILE 10 10 10 ILE ILE C . n C 1 11 LEU 11 11 11 LEU LEU C . n C 1 12 SER 12 12 12 SER SER C . n C 1 13 VAL 13 13 13 VAL VAL C . n C 1 14 SER 14 14 14 SER SER C . n C 1 15 PRO 15 15 15 PRO PRO C . n C 1 16 GLY 16 16 16 GLY GLY C . n C 1 17 GLU 17 17 17 GLU GLU C . n C 1 18 ARG 18 18 18 ARG ARG C . n C 1 19 VAL 19 19 19 VAL VAL C . n C 1 20 SER 20 20 20 SER SER C . n C 1 21 PHE 21 21 21 PHE PHE C . n C 1 22 SER 22 22 22 SER SER C . n C 1 23 CYS 23 23 23 CYS CYS C . n C 1 24 ARG 24 24 24 ARG ARG C . n C 1 25 ALA 25 25 25 ALA ALA C . n C 1 26 SER 26 26 26 SER SER C . n C 1 27 GLN 27 27 27 GLN GLN C . n C 1 28 SER 28 28 28 SER SER C . n C 1 29 ILE 29 29 29 ILE ILE C . n C 1 30 GLY 30 30 30 GLY GLY C . n C 1 31 THR 31 31 31 THR THR C . n C 1 32 ASN 32 32 32 ASN ASN C . n C 1 33 ILE 33 33 33 ILE ILE C . n C 1 34 HIS 34 34 34 HIS HIS C . n C 1 35 TRP 35 35 35 TRP TRP C . n C 1 36 TYR 36 36 36 TYR TYR C . n C 1 37 GLN 37 37 37 GLN GLN C . n C 1 38 GLN 38 38 38 GLN GLN C . n C 1 39 ARG 39 39 39 ARG ARG C . n C 1 40 THR 40 40 40 THR THR C . n C 1 41 ASN 41 41 41 ASN ASN C . n C 1 42 GLY 42 42 42 GLY GLY C . n C 1 43 SER 43 43 43 SER SER C . n C 1 44 PRO 44 44 44 PRO PRO C . n C 1 45 ARG 45 45 45 ARG ARG C . n C 1 46 LEU 46 46 46 LEU LEU C . n C 1 47 LEU 47 47 47 LEU LEU C . n C 1 48 ILE 48 48 48 ILE ILE C . n C 1 49 LYS 49 49 49 LYS LYS C . n C 1 50 TYR 50 50 50 TYR TYR C . n C 1 51 ALA 51 51 51 ALA ALA C . n C 1 52 SER 52 52 52 SER SER C . n C 1 53 GLU 53 53 53 GLU GLU C . n C 1 54 SER 54 54 54 SER SER C . n C 1 55 ILE 55 55 55 ILE ILE C . n C 1 56 SER 56 56 56 SER SER C . n C 1 57 GLY 57 57 57 GLY GLY C . n C 1 58 ILE 58 58 58 ILE ILE C . n C 1 59 PRO 59 59 59 PRO PRO C . n C 1 60 SER 60 60 60 SER SER C . n C 1 61 ARG 61 61 61 ARG ARG C . n C 1 62 PHE 62 62 62 PHE PHE C . n C 1 63 SER 63 63 63 SER SER C . n C 1 64 GLY 64 64 64 GLY GLY C . n C 1 65 SER 65 65 65 SER SER C . n C 1 66 GLY 66 66 66 GLY GLY C . n C 1 67 SER 67 67 67 SER SER C . n C 1 68 GLY 68 68 68 GLY GLY C . n C 1 69 THR 69 69 69 THR THR C . n C 1 70 ASP 70 70 70 ASP ASP C . n C 1 71 PHE 71 71 71 PHE PHE C . n C 1 72 THR 72 72 72 THR THR C . n C 1 73 LEU 73 73 73 LEU LEU C . n C 1 74 SER 74 74 74 SER SER C . n C 1 75 ILE 75 75 75 ILE ILE C . n C 1 76 ASN 76 76 76 ASN ASN C . n C 1 77 SER 77 77 77 SER SER C . n C 1 78 VAL 78 78 78 VAL VAL C . n C 1 79 GLU 79 79 79 GLU GLU C . n C 1 80 SER 80 80 80 SER SER C . n C 1 81 GLU 81 81 81 GLU GLU C . n C 1 82 ASP 82 82 82 ASP ASP C . n C 1 83 ILE 83 83 83 ILE ILE C . n C 1 84 ALA 84 84 84 ALA ALA C . n C 1 85 ASP 85 85 85 ASP ASP C . n C 1 86 TYR 86 86 86 TYR TYR C . n C 1 87 TYR 87 87 87 TYR TYR C . n C 1 88 CYS 88 88 88 CYS CYS C . n C 1 89 GLN 89 89 89 GLN GLN C . n C 1 90 GLN 90 90 90 GLN GLN C . n C 1 91 ASN 91 91 91 ASN ASN C . n C 1 92 ASN 92 92 92 ASN ASN C . n C 1 93 ASN 93 93 93 ASN ASN C . n C 1 94 TRP 94 94 94 TRP TRP C . n C 1 95 PRO 95 95 95 PRO PRO C . n C 1 96 THR 96 96 96 THR THR C . n C 1 97 THR 97 97 97 THR THR C . n C 1 98 PHE 98 98 98 PHE PHE C . n C 1 99 GLY 99 99 99 GLY GLY C . n C 1 100 ALA 100 100 100 ALA ALA C . n C 1 101 GLY 101 101 101 GLY GLY C . n C 1 102 THR 102 102 102 THR THR C . n C 1 103 LYS 103 103 103 LYS LYS C . n C 1 104 LEU 104 104 104 LEU LEU C . n C 1 105 GLU 105 105 105 GLU GLU C . n C 1 106 LEU 106 106 106 LEU LEU C . n C 1 107 LYS 107 107 107 LYS LYS C . n C 1 108 ARG 108 108 108 ARG ARG C . n C 1 109 THR 109 109 109 THR THR C . n C 1 110 VAL 110 110 110 VAL VAL C . n C 1 111 ALA 111 111 111 ALA ALA C . n C 1 112 ALA 112 112 112 ALA ALA C . n C 1 113 PRO 113 113 113 PRO PRO C . n C 1 114 SER 114 114 114 SER SER C . n C 1 115 VAL 115 115 115 VAL VAL C . n C 1 116 PHE 116 116 116 PHE PHE C . n C 1 117 ILE 117 117 117 ILE ILE C . n C 1 118 PHE 118 118 118 PHE PHE C . n C 1 119 PRO 119 119 119 PRO PRO C . n C 1 120 PRO 120 120 120 PRO PRO C . n C 1 121 SER 121 121 121 SER SER C . n C 1 122 ASP 122 122 122 ASP ASP C . n C 1 123 GLU 123 123 123 GLU GLU C . n C 1 124 GLN 124 124 124 GLN GLN C . n C 1 125 LEU 125 125 125 LEU LEU C . n C 1 126 LYS 126 126 126 LYS LYS C . n C 1 127 SER 127 127 127 SER SER C . n C 1 128 GLY 128 128 128 GLY GLY C . n C 1 129 THR 129 129 129 THR THR C . n C 1 130 ALA 130 130 130 ALA ALA C . n C 1 131 SER 131 131 131 SER SER C . n C 1 132 VAL 132 132 132 VAL VAL C . n C 1 133 VAL 133 133 133 VAL VAL C . n C 1 134 CYS 134 134 134 CYS CYS C . n C 1 135 LEU 135 135 135 LEU LEU C . n C 1 136 LEU 136 136 136 LEU LEU C . n C 1 137 ASN 137 137 137 ASN ASN C . n C 1 138 ASN 138 138 138 ASN ASN C . n C 1 139 PHE 139 139 139 PHE PHE C . n C 1 140 TYR 140 140 140 TYR TYR C . n C 1 141 PRO 141 141 141 PRO PRO C . n C 1 142 ARG 142 142 142 ARG ARG C . n C 1 143 GLU 143 143 143 GLU GLU C . n C 1 144 ALA 144 144 144 ALA ALA C . n C 1 145 LYS 145 145 145 LYS LYS C . n C 1 146 VAL 146 146 146 VAL VAL C . n C 1 147 GLN 147 147 147 GLN GLN C . n C 1 148 TRP 148 148 148 TRP TRP C . n C 1 149 LYS 149 149 149 LYS LYS C . n C 1 150 VAL 150 150 150 VAL VAL C . n C 1 151 ASP 151 151 151 ASP ASP C . n C 1 152 ASN 152 152 152 ASN ASN C . n C 1 153 ALA 153 153 153 ALA ALA C . n C 1 154 LEU 154 154 154 LEU LEU C . n C 1 155 GLN 155 155 155 GLN GLN C . n C 1 156 SER 156 156 156 SER SER C . n C 1 157 GLY 157 157 157 GLY GLY C . n C 1 158 ASN 158 158 158 ASN ASN C . n C 1 159 SER 159 159 159 SER SER C . n C 1 160 GLN 160 160 160 GLN GLN C . n C 1 161 GLU 161 161 161 GLU GLU C . n C 1 162 SER 162 162 162 SER SER C . n C 1 163 VAL 163 163 163 VAL VAL C . n C 1 164 THR 164 164 164 THR THR C . n C 1 165 GLU 165 165 165 GLU GLU C . n C 1 166 GLN 166 166 166 GLN GLN C . n C 1 167 ASP 167 167 167 ASP ASP C . n C 1 168 SER 168 168 168 SER SER C . n C 1 169 LYS 169 169 169 LYS LYS C . n C 1 170 ASP 170 170 170 ASP ASP C . n C 1 171 SER 171 171 171 SER SER C . n C 1 172 THR 172 172 172 THR THR C . n C 1 173 TYR 173 173 173 TYR TYR C . n C 1 174 SER 174 174 174 SER SER C . n C 1 175 LEU 175 175 175 LEU LEU C . n C 1 176 SER 176 176 176 SER SER C . n C 1 177 SER 177 177 177 SER SER C . n C 1 178 THR 178 178 178 THR THR C . n C 1 179 LEU 179 179 179 LEU LEU C . n C 1 180 THR 180 180 180 THR THR C . n C 1 181 LEU 181 181 181 LEU LEU C . n C 1 182 SER 182 182 182 SER SER C . n C 1 183 LYS 183 183 183 LYS LYS C . n C 1 184 ALA 184 184 184 ALA ALA C . n C 1 185 ASP 185 185 185 ASP ASP C . n C 1 186 TYR 186 186 186 TYR TYR C . n C 1 187 GLU 187 187 187 GLU GLU C . n C 1 188 LYS 188 188 188 LYS LYS C . n C 1 189 HIS 189 189 189 HIS HIS C . n C 1 190 LYS 190 190 190 LYS LYS C . n C 1 191 VAL 191 191 191 VAL VAL C . n C 1 192 TYR 192 192 192 TYR TYR C . n C 1 193 ALA 193 193 193 ALA ALA C . n C 1 194 CYS 194 194 194 CYS CYS C . n C 1 195 GLU 195 195 195 GLU GLU C . n C 1 196 VAL 196 196 196 VAL VAL C . n C 1 197 THR 197 197 197 THR THR C . n C 1 198 HIS 198 198 198 HIS HIS C . n C 1 199 GLN 199 199 199 GLN GLN C . n C 1 200 GLY 200 200 200 GLY GLY C . n C 1 201 LEU 201 201 201 LEU LEU C . n C 1 202 SER 202 202 202 SER SER C . n C 1 203 SER 203 203 203 SER SER C . n C 1 204 PRO 204 204 204 PRO PRO C . n C 1 205 VAL 205 205 205 VAL VAL C . n C 1 206 THR 206 206 206 THR THR C . n C 1 207 LYS 207 207 207 LYS LYS C . n C 1 208 SER 208 208 208 SER SER C . n C 1 209 PHE 209 209 209 PHE PHE C . n C 1 210 ASN 210 210 210 ASN ASN C . n C 1 211 ARG 211 211 211 ARG ARG C . n C 1 212 GLY 212 212 212 GLY GLY C . n C 1 213 ALA 213 213 213 ALA ALA C . n D 2 1 GLN 1 1 1 GLN GLN D . n D 2 2 VAL 2 2 2 VAL VAL D . n D 2 3 GLN 3 3 3 GLN GLN D . n D 2 4 LEU 4 4 4 LEU LEU D . n D 2 5 LYS 5 5 5 LYS LYS D . n D 2 6 GLN 6 6 6 GLN GLN D . n D 2 7 SER 7 7 7 SER SER D . n D 2 8 GLY 8 8 8 GLY GLY D . n D 2 9 PRO 9 9 9 PRO PRO D . n D 2 10 GLY 10 10 10 GLY GLY D . n D 2 11 LEU 11 11 11 LEU LEU D . n D 2 12 VAL 12 12 12 VAL VAL D . n D 2 13 GLN 13 13 13 GLN GLN D . n D 2 14 PRO 14 14 14 PRO PRO D . n D 2 15 SER 15 15 15 SER SER D . n D 2 16 GLN 16 16 16 GLN GLN D . n D 2 17 SER 17 17 17 SER SER D . n D 2 18 LEU 18 18 18 LEU LEU D . n D 2 19 SER 19 19 19 SER SER D . n D 2 20 ILE 20 20 20 ILE ILE D . n D 2 21 THR 21 21 21 THR THR D . n D 2 22 CYS 22 22 22 CYS CYS D . n D 2 23 THR 23 23 23 THR THR D . n D 2 24 VAL 24 24 24 VAL VAL D . n D 2 25 SER 25 25 25 SER SER D . n D 2 26 GLY 26 26 26 GLY GLY D . n D 2 27 PHE 27 27 27 PHE PHE D . n D 2 28 SER 28 28 28 SER SER D . n D 2 29 LEU 29 29 29 LEU LEU D . n D 2 30 THR 30 30 30 THR THR D . n D 2 31 ASN 31 31 31 ASN ASN D . n D 2 32 TYR 32 32 32 TYR TYR D . n D 2 33 GLY 33 33 33 GLY GLY D . n D 2 34 VAL 34 34 34 VAL VAL D . n D 2 35 HIS 35 35 35 HIS HIS D . n D 2 36 TRP 36 36 36 TRP TRP D . n D 2 37 VAL 37 37 37 VAL VAL D . n D 2 38 ARG 38 38 38 ARG ARG D . n D 2 39 GLN 39 39 39 GLN GLN D . n D 2 40 SER 40 40 40 SER SER D . n D 2 41 PRO 41 41 41 PRO PRO D . n D 2 42 GLY 42 42 42 GLY GLY D . n D 2 43 LYS 43 43 43 LYS LYS D . n D 2 44 GLY 44 44 44 GLY GLY D . n D 2 45 LEU 45 45 45 LEU LEU D . n D 2 46 GLU 46 46 46 GLU GLU D . n D 2 47 TRP 47 47 47 TRP TRP D . n D 2 48 LEU 48 48 48 LEU LEU D . n D 2 49 GLY 49 49 49 GLY GLY D . n D 2 50 VAL 50 50 50 VAL VAL D . n D 2 51 ILE 51 51 51 ILE ILE D . n D 2 52 TRP 52 52 52 TRP TRP D . n D 2 53 SER 53 53 53 SER SER D . n D 2 54 GLY 54 54 54 GLY GLY D . n D 2 55 GLY 55 55 55 GLY GLY D . n D 2 56 ASN 56 56 56 ASN ASN D . n D 2 57 THR 57 57 57 THR THR D . n D 2 58 ASP 58 58 58 ASP ASP D . n D 2 59 TYR 59 59 59 TYR TYR D . n D 2 60 ASN 60 60 60 ASN ASN D . n D 2 61 THR 61 61 61 THR THR D . n D 2 62 PRO 62 62 62 PRO PRO D . n D 2 63 PHE 63 63 63 PHE PHE D . n D 2 64 THR 64 64 64 THR THR D . n D 2 65 SER 65 65 65 SER SER D . n D 2 66 ARG 66 66 66 ARG ARG D . n D 2 67 LEU 67 67 67 LEU LEU D . n D 2 68 SER 68 68 68 SER SER D . n D 2 69 ILE 69 69 69 ILE ILE D . n D 2 70 ASN 70 70 70 ASN ASN D . n D 2 71 LYS 71 71 71 LYS LYS D . n D 2 72 ASP 72 72 72 ASP ASP D . n D 2 73 ASN 73 73 73 ASN ASN D . n D 2 74 SER 74 74 74 SER SER D . n D 2 75 LYS 75 75 75 LYS LYS D . n D 2 76 SER 76 76 76 SER SER D . n D 2 77 GLN 77 77 77 GLN GLN D . n D 2 78 VAL 78 78 78 VAL VAL D . n D 2 79 PHE 79 79 79 PHE PHE D . n D 2 80 PHE 80 80 80 PHE PHE D . n D 2 81 LYS 81 81 81 LYS LYS D . n D 2 82 MET 82 82 82 MET MET D . n D 2 83 ASN 83 83 83 ASN ASN D . n D 2 84 SER 84 84 84 SER SER D . n D 2 85 LEU 85 85 85 LEU LEU D . n D 2 86 GLN 86 86 86 GLN GLN D . n D 2 87 SER 87 87 87 SER SER D . n D 2 88 ASN 88 88 88 ASN ASN D . n D 2 89 ASP 89 89 89 ASP ASP D . n D 2 90 THR 90 90 90 THR THR D . n D 2 91 ALA 91 91 91 ALA ALA D . n D 2 92 ILE 92 92 92 ILE ILE D . n D 2 93 TYR 93 93 93 TYR TYR D . n D 2 94 TYR 94 94 94 TYR TYR D . n D 2 95 CYS 95 95 95 CYS CYS D . n D 2 96 ALA 96 96 96 ALA ALA D . n D 2 97 ARG 97 97 97 ARG ARG D . n D 2 98 ALA 98 98 98 ALA ALA D . n D 2 99 LEU 99 99 99 LEU LEU D . n D 2 100 THR 100 100 100 THR THR D . n D 2 101 TYR 101 101 101 TYR TYR D . n D 2 102 TYR 102 102 102 TYR TYR D . n D 2 103 ASP 103 103 103 ASP ASP D . n D 2 104 TYR 104 104 104 TYR TYR D . n D 2 105 GLU 105 105 105 GLU GLU D . n D 2 106 PHE 106 106 106 PHE PHE D . n D 2 107 ALA 107 107 107 ALA ALA D . n D 2 108 TYR 108 108 108 TYR TYR D . n D 2 109 TRP 109 109 109 TRP TRP D . n D 2 110 GLY 110 110 110 GLY GLY D . n D 2 111 GLN 111 111 111 GLN GLN D . n D 2 112 GLY 112 112 112 GLY GLY D . n D 2 113 THR 113 113 113 THR THR D . n D 2 114 LEU 114 114 114 LEU LEU D . n D 2 115 VAL 115 115 115 VAL VAL D . n D 2 116 THR 116 116 116 THR THR D . n D 2 117 VAL 117 117 117 VAL VAL D . n D 2 118 SER 118 118 118 SER SER D . n D 2 119 ALA 119 119 119 ALA ALA D . n D 2 120 ALA 120 120 120 ALA ALA D . n D 2 121 SER 121 121 121 SER SER D . n D 2 122 THR 122 122 122 THR THR D . n D 2 123 LYS 123 123 123 LYS LYS D . n D 2 124 GLY 124 124 124 GLY GLY D . n D 2 125 PRO 125 125 125 PRO PRO D . n D 2 126 SER 126 126 126 SER SER D . n D 2 127 VAL 127 127 127 VAL VAL D . n D 2 128 PHE 128 128 128 PHE PHE D . n D 2 129 PRO 129 129 129 PRO PRO D . n D 2 130 LEU 130 130 130 LEU LEU D . n D 2 131 ALA 131 131 131 ALA ALA D . n D 2 132 PRO 132 132 132 PRO PRO D . n D 2 133 SER 133 133 133 SER SER D . n D 2 134 SER 134 134 ? ? ? D . n D 2 135 LYS 135 135 ? ? ? D . n D 2 136 SER 136 136 ? ? ? D . n D 2 137 THR 137 137 ? ? ? D . n D 2 138 SER 138 138 ? ? ? D . n D 2 139 GLY 139 139 ? ? ? D . n D 2 140 GLY 140 140 140 GLY GLY D . n D 2 141 THR 141 141 141 THR THR D . n D 2 142 ALA 142 142 142 ALA ALA D . n D 2 143 ALA 143 143 143 ALA ALA D . n D 2 144 LEU 144 144 144 LEU LEU D . n D 2 145 GLY 145 145 145 GLY GLY D . n D 2 146 CYS 146 146 146 CYS CYS D . n D 2 147 LEU 147 147 147 LEU LEU D . n D 2 148 VAL 148 148 148 VAL VAL D . n D 2 149 LYS 149 149 149 LYS LYS D . n D 2 150 ASP 150 150 150 ASP ASP D . n D 2 151 TYR 151 151 151 TYR TYR D . n D 2 152 PHE 152 152 152 PHE PHE D . n D 2 153 PRO 153 153 153 PRO PRO D . n D 2 154 GLU 154 154 154 GLU GLU D . n D 2 155 PRO 155 155 155 PRO PRO D . n D 2 156 VAL 156 156 156 VAL VAL D . n D 2 157 THR 157 157 157 THR THR D . n D 2 158 VAL 158 158 158 VAL VAL D . n D 2 159 SER 159 159 159 SER SER D . n D 2 160 TRP 160 160 160 TRP TRP D . n D 2 161 ASN 161 161 161 ASN ASN D . n D 2 162 SER 162 162 162 SER SER D . n D 2 163 GLY 163 163 163 GLY GLY D . n D 2 164 ALA 164 164 164 ALA ALA D . n D 2 165 LEU 165 165 165 LEU LEU D . n D 2 166 THR 166 166 166 THR THR D . n D 2 167 SER 167 167 167 SER SER D . n D 2 168 GLY 168 168 168 GLY GLY D . n D 2 169 VAL 169 169 169 VAL VAL D . n D 2 170 HIS 170 170 170 HIS HIS D . n D 2 171 THR 171 171 171 THR THR D . n D 2 172 PHE 172 172 172 PHE PHE D . n D 2 173 PRO 173 173 173 PRO PRO D . n D 2 174 ALA 174 174 174 ALA ALA D . n D 2 175 VAL 175 175 175 VAL VAL D . n D 2 176 LEU 176 176 176 LEU LEU D . n D 2 177 GLN 177 177 177 GLN GLN D . n D 2 178 SER 178 178 178 SER SER D . n D 2 179 SER 179 179 179 SER SER D . n D 2 180 GLY 180 180 180 GLY GLY D . n D 2 181 LEU 181 181 181 LEU LEU D . n D 2 182 TYR 182 182 182 TYR TYR D . n D 2 183 SER 183 183 183 SER SER D . n D 2 184 LEU 184 184 184 LEU LEU D . n D 2 185 SER 185 185 185 SER SER D . n D 2 186 SER 186 186 186 SER SER D . n D 2 187 VAL 187 187 187 VAL VAL D . n D 2 188 VAL 188 188 188 VAL VAL D . n D 2 189 THR 189 189 189 THR THR D . n D 2 190 VAL 190 190 190 VAL VAL D . n D 2 191 PRO 191 191 191 PRO PRO D . n D 2 192 SER 192 192 192 SER SER D . n D 2 193 SER 193 193 193 SER SER D . n D 2 194 SER 194 194 194 SER SER D . n D 2 195 LEU 195 195 195 LEU LEU D . n D 2 196 GLY 196 196 196 GLY GLY D . n D 2 197 THR 197 197 197 THR THR D . n D 2 198 GLN 198 198 198 GLN GLN D . n D 2 199 THR 199 199 199 THR THR D . n D 2 200 TYR 200 200 200 TYR TYR D . n D 2 201 ILE 201 201 201 ILE ILE D . n D 2 202 CYS 202 202 202 CYS CYS D . n D 2 203 ASN 203 203 203 ASN ASN D . n D 2 204 VAL 204 204 204 VAL VAL D . n D 2 205 ASN 205 205 205 ASN ASN D . n D 2 206 HIS 206 206 206 HIS HIS D . n D 2 207 LYS 207 207 207 LYS LYS D . n D 2 208 PRO 208 208 208 PRO PRO D . n D 2 209 SER 209 209 209 SER SER D . n D 2 210 ASN 210 210 210 ASN ASN D . n D 2 211 THR 211 211 211 THR THR D . n D 2 212 LYS 212 212 212 LYS LYS D . n D 2 213 VAL 213 213 213 VAL VAL D . n D 2 214 ASP 214 214 214 ASP ASP D . n D 2 215 LYS 215 215 215 LYS LYS D . n D 2 216 ARG 216 216 216 ARG ARG D . n D 2 217 VAL 217 217 217 VAL VAL D . n D 2 218 GLU 218 218 218 GLU GLU D . n D 2 219 PRO 219 219 219 PRO PRO D . n D 2 220 LYS 220 220 220 LYS LYS D . n D 2 221 SER 221 221 ? ? ? D . n E 3 1 CYS 1 1 1 CYS CYS E . n E 3 2 GLN 2 2 2 GLN GLN E . n E 3 3 PHE 3 3 3 PHE PHE E . n E 3 4 ASP 4 4 4 ASP ASP E . n E 3 5 LEU 5 5 5 LEU LEU E . n E 3 6 SER 6 6 6 SER SER E . n E 3 7 THR 7 7 7 THR THR E . n E 3 8 ARG 8 8 8 ARG ARG E . n E 3 9 ARG 9 9 9 ARG ARG E . n E 3 10 GLN 10 10 10 GLN GLN E . n E 3 11 LYS 11 11 11 LYS LYS E . n E 3 12 CYS 12 12 12 CYS CYS E . n F 3 1 CYS 1 1 1 CYS CYS F . n F 3 2 GLN 2 2 2 GLN GLN F . n F 3 3 PHE 3 3 3 PHE PHE F . n F 3 4 ASP 4 4 4 ASP ASP F . n F 3 5 LEU 5 5 5 LEU LEU F . n F 3 6 SER 6 6 6 SER SER F . n F 3 7 THR 7 7 7 THR THR F . n F 3 8 ARG 8 8 8 ARG ARG F . n F 3 9 ARG 9 9 9 ARG ARG F . n F 3 10 GLN 10 10 10 GLN GLN F . n F 3 11 LYS 11 11 11 LYS LYS F . n F 3 12 CYS 12 12 12 CYS CYS F . 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 G 4 PO4 1 301 4 PO4 PO4 A . H 5 NAG 1 301 222 NAG NAG B . I 4 PO4 1 302 2 PO4 PO4 B . J 4 PO4 1 301 6 PO4 PO4 C . K 5 NAG 1 301 222 NAG NAG D . L 4 PO4 1 302 1 PO4 PO4 D . M 4 PO4 1 303 3 PO4 PO4 D . N 4 PO4 1 304 5 PO4 PO4 D . O 4 PO4 1 305 7 PO4 PO4 D . P 4 PO4 1 306 8 PO4 PO4 D . Q 6 HOH 1 401 366 HOH HOH A . Q 6 HOH 2 402 43 HOH HOH A . Q 6 HOH 3 403 178 HOH HOH A . Q 6 HOH 4 404 65 HOH HOH A . Q 6 HOH 5 405 25 HOH HOH A . Q 6 HOH 6 406 115 HOH HOH A . Q 6 HOH 7 407 210 HOH HOH A . Q 6 HOH 8 408 390 HOH HOH A . Q 6 HOH 9 409 406 HOH HOH A . Q 6 HOH 10 410 32 HOH HOH A . Q 6 HOH 11 411 371 HOH HOH A . Q 6 HOH 12 412 49 HOH HOH A . Q 6 HOH 13 413 24 HOH HOH A . Q 6 HOH 14 414 68 HOH HOH A . Q 6 HOH 15 415 446 HOH HOH A . Q 6 HOH 16 416 335 HOH HOH A . Q 6 HOH 17 417 241 HOH HOH A . Q 6 HOH 18 418 276 HOH HOH A . Q 6 HOH 19 419 94 HOH HOH A . Q 6 HOH 20 420 270 HOH HOH A . Q 6 HOH 21 421 442 HOH HOH A . Q 6 HOH 22 422 156 HOH HOH A . Q 6 HOH 23 423 188 HOH HOH A . Q 6 HOH 24 424 168 HOH HOH A . Q 6 HOH 25 425 69 HOH HOH A . Q 6 HOH 26 426 441 HOH HOH A . Q 6 HOH 27 427 360 HOH HOH A . Q 6 HOH 28 428 44 HOH HOH A . Q 6 HOH 29 429 81 HOH HOH A . Q 6 HOH 30 430 355 HOH HOH A . Q 6 HOH 31 431 31 HOH HOH A . Q 6 HOH 32 432 102 HOH HOH A . Q 6 HOH 33 433 103 HOH HOH A . Q 6 HOH 34 434 214 HOH HOH A . Q 6 HOH 35 435 93 HOH HOH A . Q 6 HOH 36 436 2 HOH HOH A . Q 6 HOH 37 437 4 HOH HOH A . Q 6 HOH 38 438 196 HOH HOH A . Q 6 HOH 39 439 299 HOH HOH A . Q 6 HOH 40 440 50 HOH HOH A . Q 6 HOH 41 441 450 HOH HOH A . Q 6 HOH 42 442 212 HOH HOH A . Q 6 HOH 43 443 48 HOH HOH A . Q 6 HOH 44 444 291 HOH HOH A . Q 6 HOH 45 445 409 HOH HOH A . Q 6 HOH 46 446 52 HOH HOH A . Q 6 HOH 47 447 402 HOH HOH A . Q 6 HOH 48 448 67 HOH HOH A . Q 6 HOH 49 449 167 HOH HOH A . Q 6 HOH 50 450 394 HOH HOH A . Q 6 HOH 51 451 134 HOH HOH A . Q 6 HOH 52 452 90 HOH HOH A . Q 6 HOH 53 453 18 HOH HOH A . Q 6 HOH 54 454 120 HOH HOH A . Q 6 HOH 55 455 73 HOH HOH A . Q 6 HOH 56 456 235 HOH HOH A . Q 6 HOH 57 457 206 HOH HOH A . Q 6 HOH 58 458 151 HOH HOH A . Q 6 HOH 59 459 267 HOH HOH A . Q 6 HOH 60 460 22 HOH HOH A . Q 6 HOH 61 461 78 HOH HOH A . Q 6 HOH 62 462 493 HOH HOH A . Q 6 HOH 63 463 304 HOH HOH A . Q 6 HOH 64 464 404 HOH HOH A . Q 6 HOH 65 465 236 HOH HOH A . Q 6 HOH 66 466 132 HOH HOH A . Q 6 HOH 67 467 314 HOH HOH A . Q 6 HOH 68 468 389 HOH HOH A . Q 6 HOH 69 469 508 HOH HOH A . Q 6 HOH 70 470 194 HOH HOH A . Q 6 HOH 71 471 152 HOH HOH A . Q 6 HOH 72 472 146 HOH HOH A . Q 6 HOH 73 473 257 HOH HOH A . Q 6 HOH 74 474 155 HOH HOH A . Q 6 HOH 75 475 482 HOH HOH A . Q 6 HOH 76 476 202 HOH HOH A . Q 6 HOH 77 477 506 HOH HOH A . Q 6 HOH 78 478 281 HOH HOH A . Q 6 HOH 79 479 294 HOH HOH A . Q 6 HOH 80 480 239 HOH HOH A . Q 6 HOH 81 481 163 HOH HOH A . Q 6 HOH 82 482 440 HOH HOH A . Q 6 HOH 83 483 494 HOH HOH A . Q 6 HOH 84 484 95 HOH HOH A . Q 6 HOH 85 485 306 HOH HOH A . Q 6 HOH 86 486 273 HOH HOH A . Q 6 HOH 87 487 279 HOH HOH A . Q 6 HOH 88 488 254 HOH HOH A . Q 6 HOH 89 489 144 HOH HOH A . Q 6 HOH 90 490 490 HOH HOH A . Q 6 HOH 91 491 147 HOH HOH A . Q 6 HOH 92 492 247 HOH HOH A . Q 6 HOH 93 493 248 HOH HOH A . Q 6 HOH 94 494 289 HOH HOH A . Q 6 HOH 95 495 271 HOH HOH A . Q 6 HOH 96 496 150 HOH HOH A . Q 6 HOH 97 497 218 HOH HOH A . Q 6 HOH 98 498 89 HOH HOH A . Q 6 HOH 99 499 515 HOH HOH A . Q 6 HOH 100 500 223 HOH HOH A . Q 6 HOH 101 501 164 HOH HOH A . Q 6 HOH 102 502 186 HOH HOH A . Q 6 HOH 103 503 326 HOH HOH A . Q 6 HOH 104 504 170 HOH HOH A . Q 6 HOH 105 505 453 HOH HOH A . Q 6 HOH 106 506 348 HOH HOH A . Q 6 HOH 107 507 232 HOH HOH A . Q 6 HOH 108 508 274 HOH HOH A . Q 6 HOH 109 509 286 HOH HOH A . Q 6 HOH 110 510 436 HOH HOH A . Q 6 HOH 111 511 410 HOH HOH A . Q 6 HOH 112 512 62 HOH HOH A . Q 6 HOH 113 513 284 HOH HOH A . Q 6 HOH 114 514 476 HOH HOH A . Q 6 HOH 115 515 242 HOH HOH A . Q 6 HOH 116 516 376 HOH HOH A . Q 6 HOH 117 517 365 HOH HOH A . Q 6 HOH 118 518 481 HOH HOH A . Q 6 HOH 119 519 221 HOH HOH A . Q 6 HOH 120 520 427 HOH HOH A . Q 6 HOH 121 521 535 HOH HOH A . Q 6 HOH 122 522 303 HOH HOH A . Q 6 HOH 123 523 491 HOH HOH A . Q 6 HOH 124 524 307 HOH HOH A . Q 6 HOH 125 525 200 HOH HOH A . Q 6 HOH 126 526 500 HOH HOH A . Q 6 HOH 127 527 308 HOH HOH A . Q 6 HOH 128 528 403 HOH HOH A . Q 6 HOH 129 529 538 HOH HOH A . Q 6 HOH 130 530 142 HOH HOH A . Q 6 HOH 131 531 375 HOH HOH A . Q 6 HOH 132 532 534 HOH HOH A . Q 6 HOH 133 533 148 HOH HOH A . Q 6 HOH 134 534 520 HOH HOH A . Q 6 HOH 135 535 108 HOH HOH A . Q 6 HOH 136 536 145 HOH HOH A . Q 6 HOH 137 537 143 HOH HOH A . Q 6 HOH 138 538 191 HOH HOH A . Q 6 HOH 139 539 287 HOH HOH A . Q 6 HOH 140 540 484 HOH HOH A . Q 6 HOH 141 541 240 HOH HOH A . Q 6 HOH 142 542 399 HOH HOH A . Q 6 HOH 143 543 488 HOH HOH A . Q 6 HOH 144 544 501 HOH HOH A . Q 6 HOH 145 545 266 HOH HOH A . Q 6 HOH 146 546 75 HOH HOH A . Q 6 HOH 147 547 285 HOH HOH A . R 6 HOH 1 401 518 HOH HOH B . R 6 HOH 2 402 180 HOH HOH B . R 6 HOH 3 403 262 HOH HOH B . R 6 HOH 4 404 36 HOH HOH B . R 6 HOH 5 405 46 HOH HOH B . R 6 HOH 6 406 174 HOH HOH B . R 6 HOH 7 407 12 HOH HOH B . R 6 HOH 8 408 448 HOH HOH B . R 6 HOH 9 409 29 HOH HOH B . R 6 HOH 10 410 412 HOH HOH B . R 6 HOH 11 411 19 HOH HOH B . R 6 HOH 12 412 60 HOH HOH B . R 6 HOH 13 413 408 HOH HOH B . R 6 HOH 14 414 327 HOH HOH B . R 6 HOH 15 415 253 HOH HOH B . R 6 HOH 16 416 20 HOH HOH B . R 6 HOH 17 417 362 HOH HOH B . R 6 HOH 18 418 66 HOH HOH B . R 6 HOH 19 419 310 HOH HOH B . R 6 HOH 20 420 260 HOH HOH B . R 6 HOH 21 421 26 HOH HOH B . R 6 HOH 22 422 228 HOH HOH B . R 6 HOH 23 423 41 HOH HOH B . R 6 HOH 24 424 47 HOH HOH B . R 6 HOH 25 425 15 HOH HOH B . R 6 HOH 26 426 109 HOH HOH B . R 6 HOH 27 427 91 HOH HOH B . R 6 HOH 28 428 213 HOH HOH B . R 6 HOH 29 429 157 HOH HOH B . R 6 HOH 30 430 207 HOH HOH B . R 6 HOH 31 431 421 HOH HOH B . R 6 HOH 32 432 56 HOH HOH B . R 6 HOH 33 433 23 HOH HOH B . R 6 HOH 34 434 172 HOH HOH B . R 6 HOH 35 435 116 HOH HOH B . R 6 HOH 36 436 176 HOH HOH B . R 6 HOH 37 437 182 HOH HOH B . R 6 HOH 38 438 104 HOH HOH B . R 6 HOH 39 439 387 HOH HOH B . R 6 HOH 40 440 369 HOH HOH B . R 6 HOH 41 441 533 HOH HOH B . R 6 HOH 42 442 96 HOH HOH B . R 6 HOH 43 443 183 HOH HOH B . R 6 HOH 44 444 216 HOH HOH B . R 6 HOH 45 445 110 HOH HOH B . R 6 HOH 46 446 336 HOH HOH B . R 6 HOH 47 447 357 HOH HOH B . R 6 HOH 48 448 263 HOH HOH B . R 6 HOH 49 449 378 HOH HOH B . R 6 HOH 50 450 277 HOH HOH B . R 6 HOH 51 451 30 HOH HOH B . R 6 HOH 52 452 249 HOH HOH B . R 6 HOH 53 453 516 HOH HOH B . R 6 HOH 54 454 165 HOH HOH B . R 6 HOH 55 455 407 HOH HOH B . R 6 HOH 56 456 153 HOH HOH B . R 6 HOH 57 457 231 HOH HOH B . R 6 HOH 58 458 269 HOH HOH B . R 6 HOH 59 459 268 HOH HOH B . R 6 HOH 60 460 438 HOH HOH B . R 6 HOH 61 461 27 HOH HOH B . R 6 HOH 62 462 84 HOH HOH B . R 6 HOH 63 463 97 HOH HOH B . R 6 HOH 64 464 258 HOH HOH B . R 6 HOH 65 465 177 HOH HOH B . R 6 HOH 66 466 187 HOH HOH B . R 6 HOH 67 467 324 HOH HOH B . R 6 HOH 68 468 160 HOH HOH B . R 6 HOH 69 469 88 HOH HOH B . R 6 HOH 70 470 330 HOH HOH B . R 6 HOH 71 471 379 HOH HOH B . R 6 HOH 72 472 301 HOH HOH B . R 6 HOH 73 473 238 HOH HOH B . R 6 HOH 74 474 98 HOH HOH B . R 6 HOH 75 475 122 HOH HOH B . R 6 HOH 76 476 154 HOH HOH B . R 6 HOH 77 477 381 HOH HOH B . R 6 HOH 78 478 198 HOH HOH B . R 6 HOH 79 479 332 HOH HOH B . R 6 HOH 80 480 347 HOH HOH B . R 6 HOH 81 481 473 HOH HOH B . R 6 HOH 82 482 418 HOH HOH B . R 6 HOH 83 483 125 HOH HOH B . R 6 HOH 84 484 346 HOH HOH B . R 6 HOH 85 485 495 HOH HOH B . R 6 HOH 86 486 496 HOH HOH B . R 6 HOH 87 487 161 HOH HOH B . R 6 HOH 88 488 428 HOH HOH B . R 6 HOH 89 489 251 HOH HOH B . R 6 HOH 90 490 392 HOH HOH B . R 6 HOH 91 491 466 HOH HOH B . R 6 HOH 92 492 393 HOH HOH B . R 6 HOH 93 493 510 HOH HOH B . R 6 HOH 94 494 420 HOH HOH B . R 6 HOH 95 495 455 HOH HOH B . R 6 HOH 96 496 405 HOH HOH B . R 6 HOH 97 497 334 HOH HOH B . R 6 HOH 98 498 529 HOH HOH B . R 6 HOH 99 499 489 HOH HOH B . R 6 HOH 100 500 528 HOH HOH B . R 6 HOH 101 501 532 HOH HOH B . R 6 HOH 102 502 350 HOH HOH B . R 6 HOH 103 503 526 HOH HOH B . R 6 HOH 104 504 512 HOH HOH B . R 6 HOH 105 505 523 HOH HOH B . R 6 HOH 106 506 434 HOH HOH B . R 6 HOH 107 507 487 HOH HOH B . R 6 HOH 108 508 454 HOH HOH B . R 6 HOH 109 509 278 HOH HOH B . R 6 HOH 110 510 363 HOH HOH B . R 6 HOH 111 511 531 HOH HOH B . R 6 HOH 112 512 217 HOH HOH B . R 6 HOH 113 513 137 HOH HOH B . S 6 HOH 1 401 74 HOH HOH C . S 6 HOH 2 402 61 HOH HOH C . S 6 HOH 3 403 280 HOH HOH C . S 6 HOH 4 404 179 HOH HOH C . S 6 HOH 5 405 169 HOH HOH C . S 6 HOH 6 406 58 HOH HOH C . S 6 HOH 7 407 37 HOH HOH C . S 6 HOH 8 408 6 HOH HOH C . S 6 HOH 9 409 83 HOH HOH C . S 6 HOH 10 410 55 HOH HOH C . S 6 HOH 11 411 452 HOH HOH C . S 6 HOH 12 412 70 HOH HOH C . S 6 HOH 13 413 226 HOH HOH C . S 6 HOH 14 414 99 HOH HOH C . S 6 HOH 15 415 224 HOH HOH C . S 6 HOH 16 416 5 HOH HOH C . S 6 HOH 17 417 72 HOH HOH C . S 6 HOH 18 418 131 HOH HOH C . S 6 HOH 19 419 35 HOH HOH C . S 6 HOH 20 420 171 HOH HOH C . S 6 HOH 21 421 21 HOH HOH C . S 6 HOH 22 422 105 HOH HOH C . S 6 HOH 23 423 10 HOH HOH C . S 6 HOH 24 424 80 HOH HOH C . S 6 HOH 25 425 140 HOH HOH C . S 6 HOH 26 426 9 HOH HOH C . S 6 HOH 27 427 139 HOH HOH C . S 6 HOH 28 428 345 HOH HOH C . S 6 HOH 29 429 38 HOH HOH C . S 6 HOH 30 430 321 HOH HOH C . S 6 HOH 31 431 199 HOH HOH C . S 6 HOH 32 432 7 HOH HOH C . S 6 HOH 33 433 3 HOH HOH C . S 6 HOH 34 434 136 HOH HOH C . S 6 HOH 35 435 117 HOH HOH C . S 6 HOH 36 436 123 HOH HOH C . S 6 HOH 37 437 331 HOH HOH C . S 6 HOH 38 438 244 HOH HOH C . S 6 HOH 39 439 101 HOH HOH C . S 6 HOH 40 440 465 HOH HOH C . S 6 HOH 41 441 54 HOH HOH C . S 6 HOH 42 442 300 HOH HOH C . S 6 HOH 43 443 42 HOH HOH C . S 6 HOH 44 444 158 HOH HOH C . S 6 HOH 45 445 1 HOH HOH C . S 6 HOH 46 446 124 HOH HOH C . S 6 HOH 47 447 530 HOH HOH C . S 6 HOH 48 448 33 HOH HOH C . S 6 HOH 49 449 126 HOH HOH C . S 6 HOH 50 450 444 HOH HOH C . S 6 HOH 51 451 298 HOH HOH C . S 6 HOH 52 452 505 HOH HOH C . S 6 HOH 53 453 311 HOH HOH C . S 6 HOH 54 454 40 HOH HOH C . S 6 HOH 55 455 414 HOH HOH C . S 6 HOH 56 456 458 HOH HOH C . S 6 HOH 57 457 14 HOH HOH C . S 6 HOH 58 458 209 HOH HOH C . S 6 HOH 59 459 17 HOH HOH C . S 6 HOH 60 460 333 HOH HOH C . S 6 HOH 61 461 328 HOH HOH C . S 6 HOH 62 462 302 HOH HOH C . S 6 HOH 63 463 342 HOH HOH C . S 6 HOH 64 464 201 HOH HOH C . S 6 HOH 65 465 419 HOH HOH C . S 6 HOH 66 466 536 HOH HOH C . S 6 HOH 67 467 282 HOH HOH C . S 6 HOH 68 468 398 HOH HOH C . S 6 HOH 69 469 318 HOH HOH C . S 6 HOH 70 470 525 HOH HOH C . S 6 HOH 71 471 313 HOH HOH C . S 6 HOH 72 472 130 HOH HOH C . S 6 HOH 73 473 135 HOH HOH C . S 6 HOH 74 474 513 HOH HOH C . S 6 HOH 75 475 159 HOH HOH C . S 6 HOH 76 476 480 HOH HOH C . S 6 HOH 77 477 250 HOH HOH C . S 6 HOH 78 478 388 HOH HOH C . S 6 HOH 79 479 245 HOH HOH C . S 6 HOH 80 480 190 HOH HOH C . S 6 HOH 81 481 401 HOH HOH C . S 6 HOH 82 482 368 HOH HOH C . S 6 HOH 83 483 283 HOH HOH C . S 6 HOH 84 484 343 HOH HOH C . S 6 HOH 85 485 290 HOH HOH C . S 6 HOH 86 486 92 HOH HOH C . S 6 HOH 87 487 204 HOH HOH C . S 6 HOH 88 488 111 HOH HOH C . S 6 HOH 89 489 359 HOH HOH C . S 6 HOH 90 490 175 HOH HOH C . S 6 HOH 91 491 439 HOH HOH C . S 6 HOH 92 492 118 HOH HOH C . S 6 HOH 93 493 82 HOH HOH C . S 6 HOH 94 494 374 HOH HOH C . S 6 HOH 95 495 272 HOH HOH C . S 6 HOH 96 496 341 HOH HOH C . S 6 HOH 97 497 256 HOH HOH C . S 6 HOH 98 498 107 HOH HOH C . S 6 HOH 99 499 361 HOH HOH C . S 6 HOH 100 500 85 HOH HOH C . S 6 HOH 101 501 353 HOH HOH C . S 6 HOH 102 502 296 HOH HOH C . S 6 HOH 103 503 246 HOH HOH C . S 6 HOH 104 504 293 HOH HOH C . S 6 HOH 105 505 380 HOH HOH C . S 6 HOH 106 506 297 HOH HOH C . S 6 HOH 107 507 423 HOH HOH C . S 6 HOH 108 508 449 HOH HOH C . S 6 HOH 109 509 356 HOH HOH C . S 6 HOH 110 510 433 HOH HOH C . S 6 HOH 111 511 114 HOH HOH C . S 6 HOH 112 512 486 HOH HOH C . S 6 HOH 113 513 429 HOH HOH C . S 6 HOH 114 514 479 HOH HOH C . S 6 HOH 115 515 485 HOH HOH C . S 6 HOH 116 516 385 HOH HOH C . S 6 HOH 117 517 305 HOH HOH C . S 6 HOH 118 518 416 HOH HOH C . S 6 HOH 119 519 215 HOH HOH C . S 6 HOH 120 520 261 HOH HOH C . S 6 HOH 121 521 323 HOH HOH C . S 6 HOH 122 522 432 HOH HOH C . S 6 HOH 123 523 339 HOH HOH C . S 6 HOH 124 524 474 HOH HOH C . S 6 HOH 125 525 87 HOH HOH C . S 6 HOH 126 526 337 HOH HOH C . S 6 HOH 127 527 426 HOH HOH C . S 6 HOH 128 528 252 HOH HOH C . S 6 HOH 129 529 451 HOH HOH C . S 6 HOH 130 530 354 HOH HOH C . S 6 HOH 131 531 373 HOH HOH C . S 6 HOH 132 532 470 HOH HOH C . S 6 HOH 133 533 325 HOH HOH C . S 6 HOH 134 534 315 HOH HOH C . S 6 HOH 135 535 462 HOH HOH C . S 6 HOH 136 536 309 HOH HOH C . S 6 HOH 137 537 437 HOH HOH C . S 6 HOH 138 538 527 HOH HOH C . S 6 HOH 139 539 119 HOH HOH C . S 6 HOH 140 540 519 HOH HOH C . T 6 HOH 1 401 509 HOH HOH D . T 6 HOH 2 402 499 HOH HOH D . T 6 HOH 3 403 220 HOH HOH D . T 6 HOH 4 404 121 HOH HOH D . T 6 HOH 5 405 233 HOH HOH D . T 6 HOH 6 406 517 HOH HOH D . T 6 HOH 7 407 16 HOH HOH D . T 6 HOH 8 408 417 HOH HOH D . T 6 HOH 9 409 205 HOH HOH D . T 6 HOH 10 410 13 HOH HOH D . T 6 HOH 11 411 425 HOH HOH D . T 6 HOH 12 412 316 HOH HOH D . T 6 HOH 13 413 193 HOH HOH D . T 6 HOH 14 414 259 HOH HOH D . T 6 HOH 15 415 39 HOH HOH D . T 6 HOH 16 416 413 HOH HOH D . T 6 HOH 17 417 11 HOH HOH D . T 6 HOH 18 418 181 HOH HOH D . T 6 HOH 19 419 243 HOH HOH D . T 6 HOH 20 420 456 HOH HOH D . T 6 HOH 21 421 411 HOH HOH D . T 6 HOH 22 422 338 HOH HOH D . T 6 HOH 23 423 100 HOH HOH D . T 6 HOH 24 424 149 HOH HOH D . T 6 HOH 25 425 63 HOH HOH D . T 6 HOH 26 426 45 HOH HOH D . T 6 HOH 27 427 64 HOH HOH D . T 6 HOH 28 428 57 HOH HOH D . T 6 HOH 29 429 211 HOH HOH D . T 6 HOH 30 430 76 HOH HOH D . T 6 HOH 31 431 8 HOH HOH D . T 6 HOH 32 432 189 HOH HOH D . T 6 HOH 33 433 86 HOH HOH D . T 6 HOH 34 434 77 HOH HOH D . T 6 HOH 35 435 185 HOH HOH D . T 6 HOH 36 436 53 HOH HOH D . T 6 HOH 37 437 34 HOH HOH D . T 6 HOH 38 438 173 HOH HOH D . T 6 HOH 39 439 227 HOH HOH D . T 6 HOH 40 440 230 HOH HOH D . T 6 HOH 41 441 79 HOH HOH D . T 6 HOH 42 442 541 HOH HOH D . T 6 HOH 43 443 106 HOH HOH D . T 6 HOH 44 444 208 HOH HOH D . T 6 HOH 45 445 503 HOH HOH D . T 6 HOH 46 446 386 HOH HOH D . T 6 HOH 47 447 292 HOH HOH D . T 6 HOH 48 448 255 HOH HOH D . T 6 HOH 49 449 234 HOH HOH D . T 6 HOH 50 450 127 HOH HOH D . T 6 HOH 51 451 51 HOH HOH D . T 6 HOH 52 452 445 HOH HOH D . T 6 HOH 53 453 166 HOH HOH D . T 6 HOH 54 454 129 HOH HOH D . T 6 HOH 55 455 59 HOH HOH D . T 6 HOH 56 456 524 HOH HOH D . T 6 HOH 57 457 424 HOH HOH D . T 6 HOH 58 458 112 HOH HOH D . T 6 HOH 59 459 391 HOH HOH D . T 6 HOH 60 460 502 HOH HOH D . T 6 HOH 61 461 344 HOH HOH D . T 6 HOH 62 462 197 HOH HOH D . T 6 HOH 63 463 203 HOH HOH D . T 6 HOH 64 464 382 HOH HOH D . T 6 HOH 65 465 400 HOH HOH D . T 6 HOH 66 466 237 HOH HOH D . T 6 HOH 67 467 133 HOH HOH D . T 6 HOH 68 468 472 HOH HOH D . T 6 HOH 69 469 141 HOH HOH D . T 6 HOH 70 470 351 HOH HOH D . T 6 HOH 71 471 358 HOH HOH D . T 6 HOH 72 472 162 HOH HOH D . T 6 HOH 73 473 504 HOH HOH D . T 6 HOH 74 474 184 HOH HOH D . T 6 HOH 75 475 492 HOH HOH D . T 6 HOH 76 476 367 HOH HOH D . T 6 HOH 77 477 370 HOH HOH D . T 6 HOH 78 478 435 HOH HOH D . T 6 HOH 79 479 460 HOH HOH D . T 6 HOH 80 480 537 HOH HOH D . T 6 HOH 81 481 372 HOH HOH D . T 6 HOH 82 482 128 HOH HOH D . T 6 HOH 83 483 540 HOH HOH D . T 6 HOH 84 484 322 HOH HOH D . T 6 HOH 85 485 395 HOH HOH D . T 6 HOH 86 486 464 HOH HOH D . T 6 HOH 87 487 312 HOH HOH D . T 6 HOH 88 488 384 HOH HOH D . T 6 HOH 89 489 265 HOH HOH D . T 6 HOH 90 490 138 HOH HOH D . T 6 HOH 91 491 377 HOH HOH D . T 6 HOH 92 492 340 HOH HOH D . T 6 HOH 93 493 430 HOH HOH D . T 6 HOH 94 494 468 HOH HOH D . T 6 HOH 95 495 329 HOH HOH D . T 6 HOH 96 496 542 HOH HOH D . T 6 HOH 97 497 483 HOH HOH D . T 6 HOH 98 498 475 HOH HOH D . T 6 HOH 99 499 522 HOH HOH D . T 6 HOH 100 500 447 HOH HOH D . T 6 HOH 101 501 477 HOH HOH D . T 6 HOH 102 502 415 HOH HOH D . T 6 HOH 103 503 383 HOH HOH D . T 6 HOH 104 504 317 HOH HOH D . T 6 HOH 105 505 222 HOH HOH D . T 6 HOH 106 506 469 HOH HOH D . T 6 HOH 107 507 352 HOH HOH D . T 6 HOH 108 508 422 HOH HOH D . T 6 HOH 109 509 320 HOH HOH D . T 6 HOH 110 510 471 HOH HOH D . T 6 HOH 111 511 349 HOH HOH D . T 6 HOH 112 512 539 HOH HOH D . U 6 HOH 1 101 295 HOH HOH E . U 6 HOH 2 102 364 HOH HOH E . U 6 HOH 3 103 28 HOH HOH E . U 6 HOH 4 104 195 HOH HOH E . U 6 HOH 5 105 71 HOH HOH E . U 6 HOH 6 106 288 HOH HOH E . U 6 HOH 7 107 192 HOH HOH E . U 6 HOH 8 108 431 HOH HOH E . U 6 HOH 9 109 225 HOH HOH E . V 6 HOH 1 101 219 HOH HOH F . V 6 HOH 2 102 264 HOH HOH F . V 6 HOH 3 103 113 HOH HOH F . V 6 HOH 4 104 457 HOH HOH F . V 6 HOH 5 105 319 HOH HOH F . V 6 HOH 6 106 397 HOH HOH F . V 6 HOH 7 107 443 HOH HOH F . V 6 HOH 8 108 507 HOH HOH F . V 6 HOH 9 109 275 HOH HOH F . V 6 HOH 10 110 229 HOH HOH F . V 6 HOH 11 111 396 HOH HOH F . # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PISA trimeric 3 2 author_and_software_defined_assembly PISA trimeric 3 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,B,E,G,H,I,Q,R,U 2 1 C,D,F,J,K,L,M,N,O,P,S,T,V # 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)' 5930 ? 1 MORE -37 ? 1 'SSA (A^2)' 18830 ? 2 'ABSA (A^2)' 6520 ? 2 MORE -59 ? 2 'SSA (A^2)' 18630 ? # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2016-10-26 2 'Structure model' 1 1 2016-11-09 3 'Structure model' 1 2 2017-12-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Database references' 2 3 'Structure model' 'Database references' 3 3 'Structure model' 'Derived calculations' # loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 3 'Structure model' citation 2 3 'Structure model' pdbx_struct_oper_list # 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' '_citation.journal_abbrev' 2 3 'Structure model' '_citation.page_first' 3 3 'Structure model' '_citation.page_last' 4 3 'Structure model' '_citation.pdbx_database_id_DOI' 5 3 'Structure model' '_citation.pdbx_database_id_PubMed' 6 3 'Structure model' '_citation.title' 7 3 'Structure model' '_pdbx_struct_oper_list.symmetry_operation' # loop_ _pdbx_refine_tls.id _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[1][1]_esd _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][2]_esd _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[1][3]_esd _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[2][2]_esd _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.T[2][3]_esd _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[3][3]_esd _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[1][1]_esd _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][2]_esd _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[1][3]_esd _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[2][2]_esd _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.L[2][3]_esd _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[3][3]_esd _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][1]_esd _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][2]_esd _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[1][3]_esd _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][1]_esd _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][2]_esd _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][3]_esd _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][1]_esd _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][2]_esd _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[3][3]_esd 1 'X-RAY DIFFRACTION' ? refined 24.9734 -25.6832 -15.4461 0.2538 ? 0.0193 ? 0.0384 ? 0.1721 ? -0.0254 ? 0.1439 ? 1.8545 ? 0.2423 ? 0.6388 ? 2.2930 ? -0.7979 ? 3.5196 ? 0.0880 ? -0.0121 ? 0.0972 ? 0.0785 ? 0.0363 ? -0.0239 ? -0.4721 ? -0.0575 ? -0.1595 ? 2 'X-RAY DIFFRACTION' ? refined 25.7950 -29.4694 -17.4563 0.1614 ? -0.0011 ? 0.0200 ? 0.2040 ? -0.0457 ? 0.1273 ? 1.8679 ? 0.7131 ? -0.7704 ? 6.2931 ? -4.1416 ? 5.9372 ? 0.1095 ? -0.0684 ? 0.2465 ? 0.0884 ? 0.0560 ? 0.1504 ? -0.2245 ? 0.1915 ? -0.1629 ? 3 'X-RAY DIFFRACTION' ? refined 24.6980 -18.3622 -35.4042 0.3673 ? 0.0586 ? 0.0422 ? 0.0906 ? -0.0346 ? 0.1682 ? 0.1636 ? 0.2882 ? -0.4861 ? 1.5996 ? -2.7810 ? 4.8583 ? -0.1777 ? 0.0768 ? 0.0583 ? 0.2317 ? 0.0338 ? 0.0621 ? -0.1331 ? 0.1987 ? -0.1002 ? 4 'X-RAY DIFFRACTION' ? refined 28.4467 -30.9209 -53.8020 0.1236 ? 0.0088 ? 0.0211 ? 0.1499 ? 0.0296 ? 0.2007 ? 1.6485 ? 0.0147 ? 0.9619 ? 4.1530 ? 2.7259 ? 4.3520 ? -0.1220 ? 0.0065 ? -0.0631 ? 0.0138 ? 0.1175 ? 0.1470 ? 0.2300 ? 0.0856 ? 0.0167 ? 5 'X-RAY DIFFRACTION' ? refined 19.8044 -33.7641 -55.7809 0.1606 ? -0.0476 ? -0.0148 ? 0.2885 ? -0.0347 ? 0.2726 ? 3.2617 ? 1.4674 ? 4.1487 ? 1.8285 ? 3.1736 ? 6.6414 ? -0.1549 ? 0.0806 ? 0.2652 ? -0.1235 ? -0.1225 ? 0.1852 ? -0.2989 ? -0.4595 ? 0.2924 ? 6 'X-RAY DIFFRACTION' ? refined 26.7397 -28.4682 -54.9543 0.1495 ? 0.0221 ? 0.0021 ? 0.2249 ? -0.0382 ? 0.1962 ? 2.0793 ? -0.5777 ? 0.9117 ? 4.2154 ? 2.1377 ? 3.9210 ? 0.1622 ? 0.2884 ? 0.0255 ? -0.3231 ? -0.2081 ? 0.1410 ? 0.1742 ? 0.0188 ? 0.0247 ? 7 'X-RAY DIFFRACTION' ? refined 38.2586 -48.2507 -20.4852 0.1749 ? 0.0747 ? 0.0083 ? 0.2195 ? -0.0086 ? 0.2346 ? 5.6629 ? 2.7387 ? 4.1102 ? 4.0464 ? 2.4245 ? 6.7939 ? -0.0033 ? -0.0419 ? -0.3527 ? -0.1615 ? -0.0298 ? -0.4452 ? 0.2282 ? 0.2382 ? 0.0248 ? 8 'X-RAY DIFFRACTION' ? refined 27.1407 -44.1063 -17.6624 0.1712 ? 0.0077 ? -0.0165 ? 0.1476 ? -0.0124 ? 0.1777 ? 5.8835 ? -3.0811 ? 5.0726 ? 5.1056 ? -3.9166 ? 7.0544 ? -0.0500 ? -0.2446 ? 0.0531 ? -0.2125 ? 0.0196 ? 0.1044 ? 0.4357 ? -0.3030 ? -0.0225 ? 9 'X-RAY DIFFRACTION' ? refined 30.2966 -52.3551 -10.9235 0.3704 ? -0.0806 ? 0.0210 ? 0.2098 ? 0.0379 ? 0.1810 ? 6.6461 ? -0.8839 ? 1.4505 ? 2.9590 ? 0.0684 ? 3.5158 ? -0.0211 ? -0.5173 ? -0.2179 ? 0.0838 ? 0.0557 ? 0.0547 ? 0.8120 ? -0.0515 ? -0.0232 ? 10 'X-RAY DIFFRACTION' ? refined 32.6249 -53.1310 -20.3775 0.3643 ? -0.0135 ? -0.0201 ? 0.1633 ? -0.0361 ? 0.2108 ? 6.3478 ? 1.4168 ? 4.6998 ? 3.1808 ? 1.3122 ? 6.8240 ? 0.2878 ? -0.1890 ? -0.4717 ? 0.2177 ? 0.0063 ? 0.0983 ? 0.8911 ? -0.1093 ? -0.3740 ? 11 'X-RAY DIFFRACTION' ? refined 33.8496 -42.6517 -24.7576 0.1708 ? 0.0417 ? 0.0114 ? 0.1506 ? 0.0100 ? 0.1815 ? 0.2139 ? 0.2085 ? -0.7143 ? 0.0358 ? 0.1161 ? 4.6560 ? 0.0376 ? -0.0128 ? -0.0913 ? 0.1001 ? 0.0094 ? -0.0550 ? 0.2318 ? -0.1477 ? -0.0366 ? 12 'X-RAY DIFFRACTION' ? refined 37.1352 -31.1493 -53.0062 0.1518 ? -0.0156 ? -0.0551 ? 0.2416 ? 0.0157 ? 0.2657 ? 3.5158 ? 0.9231 ? 0.9770 ? 2.4513 ? 2.9141 ? 3.4687 ? -0.1851 ? 0.0547 ? 0.6068 ? -1.1366 ? 0.0735 ? 0.4184 ? -0.1593 ? 0.2001 ? -0.0160 ? 13 'X-RAY DIFFRACTION' ? refined 38.9032 -39.8811 -40.1516 0.1445 ? -0.0069 ? -0.0176 ? 0.2582 ? -0.0550 ? 0.2240 ? 8.9722 ? 7.8543 ? -3.0244 ? 8.9752 ? -3.0324 ? 1.1482 ? 0.0192 ? -0.7561 ? -0.2367 ? 0.0090 ? -0.2324 ? -0.4127 ? -0.1119 ? 0.0024 ? 0.1765 ? 14 'X-RAY DIFFRACTION' ? refined 35.0033 -33.7441 -45.2315 0.1408 ? 0.0063 ? 0.0091 ? 0.1823 ? -0.0440 ? 0.2038 ? 0.1431 ? -0.3770 ? 0.2009 ? 1.8358 ? -0.1474 ? 1.4088 ? -0.1399 ? -0.0591 ? 0.0947 ? -0.0284 ? 0.0037 ? 0.1789 ? 0.0042 ? -0.0056 ? 0.1466 ? 15 'X-RAY DIFFRACTION' ? refined 45.0359 -37.5856 -45.4301 0.1481 ? 0.0761 ? 0.0323 ? 0.2379 ? 0.0411 ? 0.2768 ? 4.4888 ? 4.4483 ? -4.4551 ? 5.9490 ? -7.0326 ? 9.2302 ? 0.3566 ? -0.4679 ? -0.3474 ? -0.1610 ? -0.5816 ? -0.1342 ? 0.0764 ? 0.8616 ? 0.2567 ? 16 'X-RAY DIFFRACTION' ? refined 40.8510 -41.4482 -46.5187 0.1979 ? 0.0296 ? -0.0041 ? 0.1219 ? -0.0720 ? 0.2595 ? 5.9306 ? 2.3755 ? -2.9337 ? 3.3835 ? -2.1414 ? 4.8872 ? -0.1361 ? -0.2951 ? -0.2811 ? 0.1256 ? -0.5882 ? -0.3526 ? 0.2834 ? 0.7150 ? 0.4980 ? 17 'X-RAY DIFFRACTION' ? refined 9.9188 -14.6500 -14.6571 0.2047 ? 0.0362 ? 0.0225 ? 0.1658 ? 0.0010 ? 0.1520 ? 3.2169 ? 0.0484 ? 0.4853 ? 2.1334 ? 0.9372 ? 5.1177 ? 0.2228 ? 0.0236 ? -0.1418 ? -0.0786 ? 0.0556 ? -0.2262 ? 0.2284 ? -0.0095 ? -0.2744 ? 18 'X-RAY DIFFRACTION' ? refined 1.1080 -15.6924 -12.9788 0.2489 ? -0.0057 ? -0.0280 ? 0.1757 ? 0.0435 ? 0.2096 ? 0.8712 ? 0.2516 ? -1.5120 ? 3.4301 ? -0.6840 ? 2.6067 ? -0.0761 ? -0.1895 ? -0.2317 ? -0.0867 ? 0.1784 ? 0.1744 ? 0.4624 ? -0.3355 ? -0.1077 ? 19 'X-RAY DIFFRACTION' ? refined 5.7528 -10.8797 -15.4628 0.2367 ? 0.0270 ? -0.0116 ? 0.1961 ? 0.0198 ? 0.1170 ? 1.5360 ? -0.3340 ? 0.2297 ? 4.3215 ? 3.6413 ? 5.6085 ? 0.0379 ? -0.0976 ? -0.1162 ? 0.0388 ? -0.0071 ? 0.0933 ? 0.0746 ? 0.0803 ? -0.0042 ? 20 'X-RAY DIFFRACTION' ? refined 6.1611 -21.2847 -35.3805 0.2697 ? 0.0239 ? 0.0005 ? 0.1851 ? -0.0213 ? 0.2229 ? 0.3885 ? 0.7716 ? 0.5550 ? 6.6029 ? 5.1442 ? 4.0320 ? -0.0885 ? -0.0675 ? 0.2541 ? 0.7912 ? 0.1374 ? -0.0328 ? 0.6873 ? 0.0804 ? 0.0063 ? 21 'X-RAY DIFFRACTION' ? refined -2.5187 0.4113 -55.5011 0.1421 ? -0.0375 ? -0.0652 ? 0.3009 ? 0.0219 ? 0.1975 ? 1.7960 ? -0.1104 ? -1.3917 ? 3.6129 ? 0.6882 ? 1.6224 ? 0.2720 ? 0.5214 ? 0.1018 ? -0.3019 ? -0.1768 ? -0.2836 ? -0.1846 ? -0.1999 ? -0.1168 ? 22 'X-RAY DIFFRACTION' ? refined 7.0599 -10.2926 -48.9275 0.1420 ? -0.0445 ? -0.0159 ? 0.1506 ? -0.0434 ? 0.2058 ? 1.3689 ? 1.0013 ? -1.3511 ? 8.5799 ? -6.1518 ? 4.7646 ? -0.2950 ? -0.1733 ? -0.1314 ? -0.0458 ? 0.1911 ? -0.2868 ? 0.0602 ? 0.1139 ? 0.1581 ? 23 'X-RAY DIFFRACTION' ? refined 12.0165 -3.7701 -53.1229 0.1228 ? -0.0727 ? 0.0241 ? 0.2236 ? -0.0247 ? 0.2080 ? 2.2120 ? 0.5642 ? -1.4294 ? 1.7572 ? -2.0787 ? 3.3309 ? -0.1224 ? 0.4545 ? 0.0486 ? -0.0128 ? 0.1932 ? -0.1677 ? 0.3138 ? -0.4688 ? -0.0405 ? 24 'X-RAY DIFFRACTION' ? refined 5.2541 -8.5515 -53.3574 0.1072 ? -0.0010 ? 0.0178 ? 0.2353 ? -0.0135 ? 0.1625 ? 1.2914 ? 0.7943 ? -0.6541 ? 3.5607 ? -2.8716 ? 4.2051 ? -0.1071 ? 0.2056 ? -0.0617 ? -0.1996 ? 0.0720 ? -0.0359 ? 0.1233 ? -0.1972 ? -0.0091 ? 25 'X-RAY DIFFRACTION' ? refined -3.1298 10.2643 -22.4685 0.2989 ? 0.0601 ? -0.0402 ? 0.1752 ? -0.0026 ? 0.2437 ? 8.5829 ? 3.8902 ? -3.7627 ? 6.9597 ? -3.9470 ? 9.1211 ? -0.5316 ? 0.2564 ? 0.0679 ? -0.5658 ? 0.3221 ? 0.0992 ? -0.5012 ? -0.2478 ? 0.1976 ? 26 'X-RAY DIFFRACTION' ? refined -0.7054 7.1811 -11.7279 0.2705 ? 0.0404 ? 0.0002 ? 0.1637 ? 0.0156 ? 0.1977 ? 2.1809 ? 0.7714 ? -1.0963 ? 1.2017 ? 0.0325 ? 4.1404 ? 0.0465 ? -0.1153 ? 0.2483 ? 0.0238 ? 0.0897 ? 0.0330 ? -0.2661 ? -0.0817 ? -0.1297 ? 27 'X-RAY DIFFRACTION' ? refined -2.4930 4.0873 -33.7087 0.0489 ? 0.0046 ? 0.0034 ? 0.1867 ? -0.0296 ? 0.1756 ? 0.4833 ? -0.0425 ? 0.4014 ? 1.7511 ? -1.3092 ? 3.0038 ? -0.0544 ? -0.0371 ? 0.0440 ? 0.1019 ? -0.0103 ? -0.0759 ? -0.5446 ? -0.3448 ? 0.0746 ? 28 'X-RAY DIFFRACTION' ? refined -6.6933 -0.7698 -42.7986 0.0996 ? 0.0117 ? 0.0317 ? 0.1917 ? 0.0138 ? 0.1613 ? 2.0636 ? 1.6178 ? 0.9659 ? 3.5992 ? 0.8387 ? 1.7804 ? 0.0503 ? -0.0858 ? 0.0841 ? 0.0664 ? -0.1293 ? 0.1492 ? -0.0497 ? -0.1763 ? 0.0544 ? 29 'X-RAY DIFFRACTION' ? refined 23.4400 -35.0605 -30.9042 0.2790 ? 0.0237 ? -0.0047 ? 0.2495 ? -0.0829 ? 0.2916 ? 8.1959 ? -3.0677 ? 0.3199 ? 2.9640 ? 0.3030 ? 6.4601 ? 0.0687 ? -0.2302 ? -0.0154 ? -0.9386 ? -0.3743 ? 0.4032 ? -0.7128 ? -0.8327 ? 0.2544 ? 30 'X-RAY DIFFRACTION' ? refined 7.8562 -4.5494 -28.5088 0.3128 ? 0.0216 ? 0.0434 ? 0.2837 ? 0.0656 ? 0.2923 ? 4.8036 ? -2.6583 ? -2.0722 ? 4.2479 ? 3.8345 ? 3.5303 ? 0.2356 ? 0.2147 ? 0.1615 ? -1.0266 ? 0.0588 ? -0.4536 ? -0.5860 ? 0.6156 ? -0.3224 ? # loop_ _pdbx_refine_tls_group.id _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 1 'X-RAY DIFFRACTION' 1 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 1:75 ) ; 2 'X-RAY DIFFRACTION' 2 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 76:101 ) ; 3 'X-RAY DIFFRACTION' 3 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 102:113 ) ; 4 'X-RAY DIFFRACTION' 4 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 114:150 ) ; 5 'X-RAY DIFFRACTION' 5 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 151:163 ) ; 6 'X-RAY DIFFRACTION' 6 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 164:213 ) ; 7 'X-RAY DIFFRACTION' 7 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 1:33 ) ; 8 'X-RAY DIFFRACTION' 8 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 34:51 ) ; 9 'X-RAY DIFFRACTION' 9 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 52:72 ) ; 10 'X-RAY DIFFRACTION' 10 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 73:90 ) ; 11 'X-RAY DIFFRACTION' 11 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 91:130 ) ; 12 'X-RAY DIFFRACTION' 12 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 131:151 ) ; 13 'X-RAY DIFFRACTION' 13 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 152:163 ) ; 14 'X-RAY DIFFRACTION' 14 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 164:194 ) ; 15 'X-RAY DIFFRACTION' 15 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 195:209 ) ; 16 'X-RAY DIFFRACTION' 16 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 210:220) ; 17 'X-RAY DIFFRACTION' 17 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 1:38 ) ; 18 'X-RAY DIFFRACTION' 18 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 39:75 ) ; 19 'X-RAY DIFFRACTION' 19 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 76:102 ) ; 20 'X-RAY DIFFRACTION' 20 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 103:113 ) ; 21 'X-RAY DIFFRACTION' 21 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 114:128 ) ; 22 'X-RAY DIFFRACTION' 22 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 129:150 ) ; 23 'X-RAY DIFFRACTION' 23 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 151:163 ) ; 24 'X-RAY DIFFRACTION' 24 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 164:213 ) ; 25 'X-RAY DIFFRACTION' 25 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 1:17 ) ; 26 'X-RAY DIFFRACTION' 26 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 18:105 ) ; 27 'X-RAY DIFFRACTION' 27 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 106:140 ) ; 28 'X-RAY DIFFRACTION' 28 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 141:220 ) ; 29 'X-RAY DIFFRACTION' 29 ? ? ? ? ? ? ? ? ? ;chain 'E' and (resid 1:12 ) ; 30 'X-RAY DIFFRACTION' 30 ? ? ? ? ? ? ? ? ? ;chain 'F' and (resid 1:12 ) ; # loop_ _software.citation_id _software.classification _software.compiler_name _software.compiler_version _software.contact_author _software.contact_author_email _software.date _software.description _software.dependencies _software.hardware _software.language _software.location _software.mods _software.name _software.os _software.os_version _software.type _software.version _software.pdbx_ordinal ? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? '(1.10_2155)' 1 ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? XSCALE ? ? ? . 3 ? phasing ? ? ? ? ? ? ? ? ? ? ? MOLREP ? ? ? . 4 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O D HOH 445 ? ? O D HOH 499 ? ? 1.81 2 1 OD1 D ASP 58 ? ? O D HOH 401 ? ? 1.82 3 1 O C GLY 128 ? ? O C HOH 401 ? ? 1.82 4 1 O A HOH 486 ? ? O A HOH 531 ? ? 1.85 5 1 O C HOH 481 ? ? O D HOH 459 ? ? 1.89 6 1 O B HOH 493 ? ? O B HOH 504 ? ? 1.90 7 1 O D HOH 485 ? ? O D HOH 493 ? ? 1.91 8 1 O A HOH 468 ? ? O B HOH 492 ? ? 1.95 9 1 O C HOH 456 ? ? O C HOH 532 ? ? 1.96 10 1 O A HOH 469 ? ? O A HOH 477 ? ? 1.96 11 1 OE2 C GLU 161 ? ? O C HOH 402 ? ? 2.02 12 1 O B HOH 485 ? ? O B HOH 507 ? ? 2.03 13 1 O A HOH 463 ? ? O A HOH 469 ? ? 2.05 14 1 O C HOH 519 ? ? O C HOH 528 ? ? 2.05 15 1 O D HOH 479 ? ? O D HOH 501 ? ? 2.06 16 1 OD2 A ASP 1 ? ? O A HOH 401 ? ? 2.07 17 1 O1 C PO4 301 ? ? O C HOH 403 ? ? 2.07 18 1 OE2 D GLU 154 ? ? O D HOH 402 ? ? 2.11 19 1 O A HOH 443 ? ? O A HOH 538 ? ? 2.13 20 1 O A HOH 529 ? ? O A HOH 532 ? ? 2.13 21 1 O A GLN 166 ? ? O A HOH 402 ? ? 2.15 22 1 O A HOH 485 ? ? O C HOH 517 ? ? 2.15 23 1 O D HOH 497 ? ? O D HOH 498 ? ? 2.15 24 1 O B HOH 486 ? ? O B HOH 491 ? ? 2.15 25 1 O B HOH 476 ? ? O B HOH 490 ? ? 2.16 26 1 O D HOH 420 ? ? O D HOH 494 ? ? 2.17 27 1 O B HOH 501 ? ? O B HOH 511 ? ? 2.18 28 1 O A HOH 408 ? ? O A HOH 411 ? ? 2.18 # loop_ _pdbx_validate_symm_contact.id _pdbx_validate_symm_contact.PDB_model_num _pdbx_validate_symm_contact.auth_atom_id_1 _pdbx_validate_symm_contact.auth_asym_id_1 _pdbx_validate_symm_contact.auth_comp_id_1 _pdbx_validate_symm_contact.auth_seq_id_1 _pdbx_validate_symm_contact.PDB_ins_code_1 _pdbx_validate_symm_contact.label_alt_id_1 _pdbx_validate_symm_contact.site_symmetry_1 _pdbx_validate_symm_contact.auth_atom_id_2 _pdbx_validate_symm_contact.auth_asym_id_2 _pdbx_validate_symm_contact.auth_comp_id_2 _pdbx_validate_symm_contact.auth_seq_id_2 _pdbx_validate_symm_contact.PDB_ins_code_2 _pdbx_validate_symm_contact.label_alt_id_2 _pdbx_validate_symm_contact.site_symmetry_2 _pdbx_validate_symm_contact.dist 1 1 O B HOH 479 ? ? 1_555 O D HOH 500 ? ? 3_544 2.16 2 1 O B HOH 453 ? ? 1_555 O C HOH 518 ? ? 3_644 2.18 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 ALA A 51 ? ? 70.83 -48.38 2 1 SER A 77 ? ? -155.45 88.84 3 1 ARG A 211 ? ? -53.64 107.81 4 1 ALA B 120 ? ? -66.14 -177.30 5 1 SER B 133 ? ? -146.56 -153.06 6 1 SER B 136 ? ? -141.91 26.33 7 1 THR B 166 ? ? -134.25 -32.02 8 1 ASN C 41 ? ? 66.49 -2.97 9 1 ALA C 51 ? ? 72.23 -48.46 10 1 SER D 15 ? ? 78.51 -7.76 11 1 SER D 84 ? ? 38.34 74.19 # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 1 A ARG 18 ? CG ? A ARG 18 CG 2 1 Y 1 A ARG 18 ? CD ? A ARG 18 CD 3 1 Y 1 A ARG 18 ? NE ? A ARG 18 NE 4 1 Y 1 A ARG 18 ? CZ ? A ARG 18 CZ 5 1 Y 1 A ARG 18 ? NH1 ? A ARG 18 NH1 6 1 Y 1 A ARG 18 ? NH2 ? A ARG 18 NH2 7 1 Y 1 B GLN 1 ? CG ? B GLN 1 CG 8 1 Y 1 B GLN 1 ? CD ? B GLN 1 CD 9 1 Y 1 B GLN 1 ? OE1 ? B GLN 1 OE1 10 1 Y 1 B GLN 1 ? NE2 ? B GLN 1 NE2 11 1 Y 1 C ARG 24 ? CG ? C ARG 24 CG 12 1 Y 1 C ARG 24 ? CD ? C ARG 24 CD 13 1 Y 1 C ARG 24 ? NE ? C ARG 24 NE 14 1 Y 1 C ARG 24 ? CZ ? C ARG 24 CZ 15 1 Y 1 C ARG 24 ? NH1 ? C ARG 24 NH1 16 1 Y 1 C ARG 24 ? NH2 ? C ARG 24 NH2 17 1 Y 1 C LYS 169 ? CG ? C LYS 169 CG 18 1 Y 1 C LYS 169 ? CD ? C LYS 169 CD 19 1 Y 1 C LYS 169 ? CE ? C LYS 169 CE 20 1 Y 1 C LYS 169 ? NZ ? C LYS 169 NZ 21 1 Y 1 D GLN 1 ? CG ? D GLN 1 CG 22 1 Y 1 D GLN 1 ? CD ? D GLN 1 CD 23 1 Y 1 D GLN 1 ? OE1 ? D GLN 1 OE1 24 1 Y 1 D GLN 1 ? NE2 ? D GLN 1 NE2 # 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 B SER 221 ? B SER 221 2 1 Y 1 D SER 134 ? D SER 134 3 1 Y 1 D LYS 135 ? D LYS 135 4 1 Y 1 D SER 136 ? D SER 136 5 1 Y 1 D THR 137 ? D THR 137 6 1 Y 1 D SER 138 ? D SER 138 7 1 Y 1 D GLY 139 ? D GLY 139 8 1 Y 1 D SER 221 ? D SER 221 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 4 'PHOSPHATE ION' PO4 5 N-ACETYL-D-GLUCOSAMINE NAG 6 water HOH #