data_5HPM # _entry.id 5HPM # _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 5HPM WWPDB D_1000217498 # loop_ _pdbx_database_related.content_type _pdbx_database_related.db_id _pdbx_database_related.db_name _pdbx_database_related.details unspecified 5F88 PDB . unspecified 5FF6 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 5HPM _pdbx_database_status.recvd_initial_deposition_date 2016-01-20 _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 434 _citation.page_last 442 _citation.title 'Cyclization strategies of meditopes: affinity and diffraction studies of meditope-Fab complexes.' _citation.year 2016 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1107/S2053230X16007202 _citation.pdbx_database_id_PubMed 27303895 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Bzymek, K.P.' 1 primary 'Ma, Y.' 2 primary 'Avery, K.A.' 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 5HPM _cell.details ? _cell.formula_units_Z ? _cell.length_a 64.110 _cell.length_a_esd ? _cell.length_b 82.760 _cell.length_b_esd ? _cell.length_c 212.680 _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 5HPM _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 'Cyclic amidated, acetylated linked meditope' 1411.650 2 ? ? ? ? 4 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 5 non-polymer syn 2-AMINO-3-MERCAPTO-PROPIONAMIDE 120.173 2 ? ? ? ? 6 water nat water 18.015 279 ? ? ? ? # 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 yes '(SC2)QFDLSTRRLK' XQFDLSTRRLK 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 SC2 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 LEU n 3 11 LYS 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 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 sample 'Biological sequence' 1 221 'mouse, human' ? ? ? ? ? ? ? ? 'MUS MUSCULUS, HOMO SAPIENS' '10090, 9606' ? ? ? ? ? ? ? ? unidentified 32644 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? # _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 11 _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 5HPM 5HPM ? 1 ? 1 2 PDB 5HPM 5HPM ? 2 ? 1 3 PDB 5HPM 5HPM ? 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 5HPM A 1 ? 213 ? 5HPM 1 ? 213 ? 1 213 2 2 5HPM B 1 ? 221 ? 5HPM 1 ? 221 ? 1 221 3 1 5HPM C 1 ? 213 ? 5HPM 1 ? 213 ? 1 213 4 2 5HPM D 1 ? 221 ? 5HPM 1 ? 221 ? 1 221 5 3 5HPM E 1 ? 11 ? 5HPM 1 ? 11 ? 1 11 6 3 5HPM F 1 ? 11 ? 5HPM 1 ? 11 ? 1 11 # 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 CY3 'L-peptide linking' n 2-AMINO-3-MERCAPTO-PROPIONAMIDE ? 'C3 H8 N2 O S' 120.173 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 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SC2 peptide-like . N-ACETYL-L-CYSTEINE '(2R)-2-acetamido-3-sulfanyl-propanoic acid' 'C5 H9 N O3 S' 163.195 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 5HPM _exptl.crystals_number 1 _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 57.60 _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, HANGING DROP' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH ? _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 citrate, 0.1 M sodium phosphate dibasic, 0.5 M potassium phosphate dibasic, 1.6 M sodium phosphate monobasic' _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 2015-12-20 # _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 5HPM _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 2.67 _reflns.d_resolution_low 33.05 _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 32836 _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 99.5 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 4.4 _reflns.pdbx_Rmerge_I_obs 0.218 _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 8.85 _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 2.67 _reflns_shell.d_res_low 2.74 _reflns_shell.meanI_over_sigI_all ? _reflns_shell.meanI_over_sigI_obs 1.91 _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 100 _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 ? _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 4.4 _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 5HPM _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 2.670 _refine.ls_d_res_low 33.046 _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 32826 _refine.ls_number_reflns_R_free 1641 _refine.ls_number_reflns_R_work ? _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 99.58 _refine.ls_percent_reflns_R_free 5.00 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.1897 _refine.ls_R_factor_R_free 0.2323 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.1874 _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 ? _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 1.36 _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 ? _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 22.19 _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 0.32 _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 6764 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 0 _refine_hist.number_atoms_solvent 279 _refine_hist.number_atoms_total 7043 _refine_hist.d_res_high 2.670 _refine_hist.d_res_low 33.046 # 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' ? 0.003 ? 6949 ? f_bond_d ? ? 'X-RAY DIFFRACTION' ? 0.619 ? 9470 ? f_angle_d ? ? 'X-RAY DIFFRACTION' ? 11.736 ? 4154 ? f_dihedral_angle_d ? ? 'X-RAY DIFFRACTION' ? 0.045 ? 1074 ? f_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.004 ? 1214 ? 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' 2.6699 2.7484 . . 132 2518 100.00 . . . 0.3334 . 0.2547 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.7484 2.8370 . . 134 2550 100.00 . . . 0.3006 . 0.2519 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.8370 2.9384 . . 136 2577 100.00 . . . 0.3369 . 0.2562 . . . . . . . . . . 'X-RAY DIFFRACTION' 2.9384 3.0560 . . 136 2589 100.00 . . . 0.2864 . 0.2271 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.0560 3.1949 . . 136 2572 100.00 . . . 0.2677 . 0.2058 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.1949 3.3632 . . 136 2581 100.00 . . . 0.2253 . 0.1923 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.3632 3.5737 . . 136 2592 100.00 . . . 0.2026 . 0.1823 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.5737 3.8492 . . 137 2593 100.00 . . . 0.2136 . 0.1721 . . . . . . . . . . 'X-RAY DIFFRACTION' 3.8492 4.2359 . . 137 2612 100.00 . . . 0.2173 . 0.1514 . . . . . . . . . . 'X-RAY DIFFRACTION' 4.2359 4.8472 . . 138 2620 100.00 . . . 0.1760 . 0.1293 . . . . . . . . . . 'X-RAY DIFFRACTION' 4.8472 6.1007 . . 140 2662 100.00 . . . 0.1883 . 0.1625 . . . . . . . . . . 'X-RAY DIFFRACTION' 6.1007 33.0481 . . 143 2719 97.00 . . . 0.2314 . 0.2077 . . . . . . . . . . # _struct.entry_id 5HPM _struct.title 'Cetuximab Fab in complex with cyclic linked meditope' _struct.pdbx_descriptor 'Cetuximab Fab light chain, Cetuximab Fab heavy chain, Cyclic beta-alanine-linked 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 5HPM _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 4 ? I N N 5 ? J N N 5 ? K N N 6 ? L N N 6 ? M N N 6 ? N N N 6 ? O N N 6 ? P 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 ? GLY B 196 ? SER B 193 GLY B 196 5 ? 4 HELX_P HELX_P8 AA8 LYS B 207 ? ASN B 210 ? LYS B 207 ASN B 210 5 ? 4 HELX_P HELX_P9 AA9 TYR C 50 ? SER C 52 ? TYR C 50 SER C 52 5 ? 3 HELX_P HELX_P10 AB1 GLU C 79 ? ILE C 83 ? GLU C 79 ILE C 83 5 ? 5 HELX_P HELX_P11 AB2 SER C 121 ? LYS C 126 ? SER C 121 LYS C 126 1 ? 6 HELX_P HELX_P12 AB3 LYS C 183 ? LYS C 188 ? LYS C 183 LYS C 188 1 ? 6 HELX_P HELX_P13 AB4 THR D 61 ? THR D 64 ? THR D 61 THR D 64 5 ? 4 HELX_P HELX_P14 AB5 GLN D 86 ? THR D 90 ? GLN D 86 THR D 90 5 ? 5 HELX_P HELX_P15 AB6 SER D 162 ? ALA D 164 ? SER D 162 ALA D 164 5 ? 3 HELX_P HELX_P16 AB7 SER D 193 ? LEU D 195 ? SER D 193 LEU D 195 5 ? 3 HELX_P HELX_P17 AB8 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 ? ? ? ? ? ? ? 2.035 ? disulf2 disulf ? ? A CYS 134 SG ? ? ? 1_555 A CYS 194 SG ? ? A CYS 134 A CYS 194 1_555 ? ? ? ? ? ? ? 2.034 ? disulf3 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 95 SG ? ? B CYS 22 B CYS 95 1_555 ? ? ? ? ? ? ? 2.039 ? disulf4 disulf ? ? B CYS 146 SG ? ? ? 1_555 B CYS 202 SG ? ? B CYS 146 B CYS 202 1_555 ? ? ? ? ? ? ? 2.028 ? disulf5 disulf ? ? C CYS 23 SG ? ? ? 1_555 C CYS 88 SG ? ? C CYS 23 C CYS 88 1_555 ? ? ? ? ? ? ? 2.033 ? disulf6 disulf ? ? C CYS 134 SG ? ? ? 1_555 C CYS 194 SG ? ? C CYS 134 C CYS 194 1_555 ? ? ? ? ? ? ? 2.035 ? disulf7 disulf ? ? D CYS 22 SG ? ? ? 1_555 D CYS 95 SG ? ? D CYS 22 D CYS 95 1_555 ? ? ? ? ? ? ? 2.038 ? disulf8 disulf ? ? D CYS 146 SG ? ? ? 1_555 D CYS 202 SG ? ? D CYS 146 D CYS 202 1_555 ? ? ? ? ? ? ? 2.029 ? disulf9 disulf ? ? E SC2 1 SG ? ? ? 1_555 I CY3 . SG ? ? E SC2 1 E CY3 101 1_555 ? ? ? ? ? ? ? 2.011 ? disulf10 disulf ? ? F SC2 1 SG ? ? ? 1_555 J CY3 . SG ? ? F SC2 1 F CY3 101 1_555 ? ? ? ? ? ? ? 2.010 ? covale1 covale one ? B ASN 88 ND2 ? ? ? 1_555 G NAG . C1 ? ? B ASN 88 B NAG 301 1_555 ? ? ? ? ? ? ? 1.427 ? covale2 covale one ? D ASN 88 ND2 ? ? ? 1_555 H NAG . C1 ? ? D ASN 88 D NAG 301 1_555 ? ? ? ? ? ? ? 1.421 ? covale3 covale both ? E SC2 1 C ? ? ? 1_555 E GLN 2 N ? ? E SC2 1 E GLN 2 1_555 ? ? ? ? ? ? ? 1.329 ? covale4 covale both ? E LYS 11 C ? ? ? 1_555 I CY3 . N ? ? E LYS 11 E CY3 101 1_555 ? ? ? ? ? ? ? 1.327 ? covale5 covale both ? F SC2 1 C ? ? ? 1_555 F GLN 2 N ? ? F SC2 1 F GLN 2 1_555 ? ? ? ? ? ? ? 1.332 ? covale6 covale both ? F LYS 11 C ? ? ? 1_555 J CY3 . N ? ? F LYS 11 F CY3 101 1_555 ? ? ? ? ? ? ? 1.328 ? # 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 -3.37 2 TRP 94 A . ? TRP 94 A PRO 95 A ? PRO 95 A 1 1.30 3 TYR 140 A . ? TYR 140 A PRO 141 A ? PRO 141 A 1 3.96 4 PHE 152 B . ? PHE 152 B PRO 153 B ? PRO 153 B 1 -2.69 5 GLU 154 B . ? GLU 154 B PRO 155 B ? PRO 155 B 1 0.31 6 SER 7 C . ? SER 7 C PRO 8 C ? PRO 8 C 1 -1.22 7 TRP 94 C . ? TRP 94 C PRO 95 C ? PRO 95 C 1 -0.55 8 TYR 140 C . ? TYR 140 C PRO 141 C ? PRO 141 C 1 3.59 9 PHE 152 D . ? PHE 152 D PRO 153 D ? PRO 153 D 1 -2.45 10 GLU 154 D . ? GLU 154 D PRO 155 D ? PRO 155 D 1 -3.45 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 4 ? AA2 ? 5 ? 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 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 ASP A 85 ? GLN A 90 ? ASP A 85 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 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 ASP A 85 ? GLN A 90 ? ASP A 85 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 SER B 126 ? LEU B 130 ? SER B 126 LEU B 130 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 ALA C 144 ? VAL C 150 ? ALA C 144 VAL C 150 AB7 3 VAL C 191 ? HIS C 198 ? VAL C 191 HIS C 198 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 GLU A 105 ? O GLU A 105 AA2 2 3 O THR A 102 ? O THR A 102 N TYR A 86 ? N TYR A 86 AA2 3 4 O GLN A 89 ? O GLN A 89 N HIS A 34 ? N HIS A 34 AA2 4 5 N TRP A 35 ? N TRP A 35 O LEU A 47 ? O LEU A 47 AA3 1 2 N LEU A 11 ? N LEU A 11 O GLU A 105 ? O GLU A 105 AA3 2 3 O THR A 102 ? O THR A 102 N TYR A 86 ? N TYR A 86 AA3 3 4 N GLN A 90 ? N GLN A 90 O THR A 97 ? O THR A 97 AA4 1 2 N PHE A 116 ? N PHE A 116 O LEU A 135 ? O LEU A 135 AA4 2 3 N LEU A 136 ? N LEU A 136 O LEU A 175 ? O LEU A 175 AA4 3 4 O THR A 178 ? O THR A 178 N GLN A 160 ? N GLN A 160 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 VAL A 196 ? N VAL A 196 O VAL A 205 ? O VAL A 205 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 TYR B 94 ? O TYR B 94 N VAL B 37 ? N VAL B 37 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 TYR B 151 ? N TYR B 151 O TYR B 182 ? O TYR B 182 AA9 3 4 O VAL B 187 ? O VAL B 187 N HIS B 170 ? N HIS B 170 AB1 1 2 N PHE B 128 ? N PHE B 128 O LEU B 147 ? O LEU B 147 AB1 2 3 N TYR B 151 ? N TYR B 151 O TYR B 182 ? O TYR B 182 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 HIS B 206 ? N HIS B 206 O THR B 211 ? O THR B 211 AB3 1 2 N THR C 5 ? N THR C 5 O ARG C 24 ? O ARG C 24 AB3 2 3 N PHE C 21 ? N PHE C 21 O LEU C 73 ? O LEU C 73 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 GLN C 37 ? N GLN C 37 O ARG C 45 ? O ARG C 45 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 VAL C 196 ? N VAL C 196 O VAL C 205 ? O VAL C 205 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 TYR D 151 ? N TYR D 151 O TYR D 182 ? O TYR D 182 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 TYR D 151 ? N TYR D 151 O TYR D 182 ? O TYR D 182 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 B NAG 301 ? 4 'binding site for Mono-Saccharide NAG B 301 bound to ASN B 88' AC2 Software D NAG 301 ? 3 'binding site for Mono-Saccharide NAG D 301 bound to ASN D 88' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 4 ARG B 38 ? ARG B 38 . ? 1_555 ? 2 AC1 4 LYS B 43 ? LYS B 43 . ? 1_555 ? 3 AC1 4 ASN B 88 ? ASN B 88 . ? 1_555 ? 4 AC1 4 HOH L . ? HOH B 427 . ? 1_555 ? 5 AC2 3 SER D 40 ? SER D 40 . ? 1_555 ? 6 AC2 3 LYS D 43 ? LYS D 43 . ? 1_555 ? 7 AC2 3 ASN D 88 ? ASN D 88 . ? 1_555 ? # _atom_sites.entry_id 5HPM _atom_sites.fract_transf_matrix[1][1] 0.015598 _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] 0.012083 _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 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 ? -17.474 42.081 8.741 1.00 39.48 ? 1 ASP A N 1 ATOM 2 C CA . ASP A 1 1 ? -16.461 41.216 9.334 1.00 44.89 ? 1 ASP A CA 1 ATOM 3 C C . ASP A 1 1 ? -16.930 39.765 9.392 1.00 39.74 ? 1 ASP A C 1 ATOM 4 O O . ASP A 1 1 ? -18.106 39.491 9.629 1.00 38.32 ? 1 ASP A O 1 ATOM 5 C CB . ASP A 1 1 ? -16.095 41.698 10.739 1.00 52.86 ? 1 ASP A CB 1 ATOM 6 C CG . ASP A 1 1 ? -15.409 43.051 10.733 1.00 43.65 ? 1 ASP A CG 1 ATOM 7 O OD1 . ASP A 1 1 ? -15.412 43.711 9.669 1.00 47.03 ? 1 ASP A OD1 1 ATOM 8 O OD2 . ASP A 1 1 ? -14.877 43.455 11.793 1.00 24.25 ? 1 ASP A OD2 1 ATOM 9 N N . ILE A 1 2 ? -15.998 38.843 9.173 1.00 34.86 ? 2 ILE A N 1 ATOM 10 C CA . ILE A 1 2 ? -16.283 37.420 9.311 1.00 31.84 ? 2 ILE A CA 1 ATOM 11 C C . ILE A 1 2 ? -16.326 37.069 10.792 1.00 29.67 ? 2 ILE A C 1 ATOM 12 O O . ILE A 1 2 ? -15.374 37.335 11.536 1.00 18.59 ? 2 ILE A O 1 ATOM 13 C CB . ILE A 1 2 ? -15.228 36.581 8.573 1.00 33.54 ? 2 ILE A CB 1 ATOM 14 C CG1 . ILE A 1 2 ? -15.045 37.091 7.143 1.00 29.18 ? 2 ILE A CG1 1 ATOM 15 C CG2 . ILE A 1 2 ? -15.616 35.111 8.573 1.00 20.31 ? 2 ILE A CG2 1 ATOM 16 C CD1 . ILE A 1 2 ? -16.306 37.047 6.322 1.00 23.74 ? 2 ILE A CD1 1 ATOM 17 N N . LEU A 1 3 ? -17.436 36.482 11.229 1.00 23.35 ? 3 LEU A N 1 ATOM 18 C CA . LEU A 1 3 ? -17.575 36.020 12.603 1.00 26.70 ? 3 LEU A CA 1 ATOM 19 C C . LEU A 1 3 ? -17.143 34.562 12.680 1.00 29.76 ? 3 LEU A C 1 ATOM 20 O O . LEU A 1 3 ? -17.722 33.700 12.009 1.00 32.66 ? 3 LEU A O 1 ATOM 21 C CB . LEU A 1 3 ? -19.012 36.189 13.097 1.00 20.83 ? 3 LEU A CB 1 ATOM 22 C CG . LEU A 1 3 ? -19.342 35.536 14.444 1.00 40.40 ? 3 LEU A CG 1 ATOM 23 C CD1 . LEU A 1 3 ? -18.399 36.022 15.539 1.00 44.85 ? 3 LEU A CD1 1 ATOM 24 C CD2 . LEU A 1 3 ? -20.793 35.788 14.837 1.00 43.16 ? 3 LEU A CD2 1 ATOM 25 N N . LEU A 1 4 ? -16.121 34.292 13.487 1.00 22.38 ? 4 LEU A N 1 ATOM 26 C CA . LEU A 1 4 ? -15.620 32.942 13.702 1.00 24.52 ? 4 LEU A CA 1 ATOM 27 C C . LEU A 1 4 ? -16.149 32.430 15.033 1.00 30.20 ? 4 LEU A C 1 ATOM 28 O O . LEU A 1 4 ? -15.860 33.009 16.086 1.00 43.76 ? 4 LEU A O 1 ATOM 29 C CB . LEU A 1 4 ? -14.093 32.913 13.685 1.00 16.83 ? 4 LEU A CB 1 ATOM 30 C CG . LEU A 1 4 ? -13.421 33.297 12.368 1.00 24.30 ? 4 LEU A CG 1 ATOM 31 C CD1 . LEU A 1 4 ? -11.908 33.267 12.513 1.00 22.07 ? 4 LEU A CD1 1 ATOM 32 C CD2 . LEU A 1 4 ? -13.876 32.373 11.248 1.00 17.81 ? 4 LEU A CD2 1 ATOM 33 N N . THR A 1 5 ? -16.919 31.349 14.986 1.00 26.01 ? 5 THR A N 1 ATOM 34 C CA . THR A 1 5 ? -17.508 30.754 16.176 1.00 29.01 ? 5 THR A CA 1 ATOM 35 C C . THR A 1 5 ? -16.762 29.467 16.500 1.00 29.41 ? 5 THR A C 1 ATOM 36 O O . THR A 1 5 ? -16.747 28.532 15.691 1.00 25.42 ? 5 THR A O 1 ATOM 37 C CB . THR A 1 5 ? -19.001 30.490 15.977 1.00 28.11 ? 5 THR A CB 1 ATOM 38 O OG1 . THR A 1 5 ? -19.685 31.739 15.813 1.00 20.69 ? 5 THR A OG1 1 ATOM 39 C CG2 . THR A 1 5 ? -19.580 29.757 17.181 1.00 20.63 ? 5 THR A CG2 1 ATOM 40 N N . GLN A 1 6 ? -16.134 29.433 17.672 1.00 28.37 ? 6 GLN A N 1 ATOM 41 C CA . GLN A 1 6 ? -15.408 28.263 18.146 1.00 23.61 ? 6 GLN A CA 1 ATOM 42 C C . GLN A 1 6 ? -16.257 27.531 19.174 1.00 25.01 ? 6 GLN A C 1 ATOM 43 O O . GLN A 1 6 ? -16.731 28.136 20.140 1.00 35.04 ? 6 GLN A O 1 ATOM 44 C CB . GLN A 1 6 ? -14.062 28.657 18.757 1.00 16.52 ? 6 GLN A CB 1 ATOM 45 C CG . GLN A 1 6 ? -13.083 29.270 17.767 1.00 26.97 ? 6 GLN A CG 1 ATOM 46 C CD . GLN A 1 6 ? -11.700 29.464 18.359 1.00 24.89 ? 6 GLN A CD 1 ATOM 47 O OE1 . GLN A 1 6 ? -11.130 30.555 18.294 1.00 19.07 ? 6 GLN A OE1 1 ATOM 48 N NE2 . GLN A 1 6 ? -11.149 28.401 18.939 1.00 16.37 ? 6 GLN A NE2 1 ATOM 49 N N . SER A 1 7 ? -16.453 26.235 18.958 1.00 26.06 ? 7 SER A N 1 ATOM 50 C CA . SER A 1 7 ? -17.243 25.426 19.876 1.00 39.76 ? 7 SER A CA 1 ATOM 51 C C . SER A 1 7 ? -16.599 24.055 20.059 1.00 43.87 ? 7 SER A C 1 ATOM 52 O O . SER A 1 7 ? -16.023 23.508 19.118 1.00 51.29 ? 7 SER A O 1 ATOM 53 C CB . SER A 1 7 ? -18.681 25.275 19.371 1.00 43.37 ? 7 SER A CB 1 ATOM 54 O OG . SER A 1 7 ? -18.778 24.247 18.401 1.00 50.11 ? 7 SER A OG 1 ATOM 55 N N . PRO A 1 8 ? -16.680 23.502 21.278 1.00 45.52 ? 8 PRO A N 1 ATOM 56 C CA . PRO A 1 8 ? -17.275 24.143 22.456 1.00 40.46 ? 8 PRO A CA 1 ATOM 57 C C . PRO A 1 8 ? -16.342 25.176 23.078 1.00 39.37 ? 8 PRO A C 1 ATOM 58 O O . PRO A 1 8 ? -15.211 25.332 22.618 1.00 35.45 ? 8 PRO A O 1 ATOM 59 C CB . PRO A 1 8 ? -17.500 22.972 23.410 1.00 43.05 ? 8 PRO A CB 1 ATOM 60 C CG . PRO A 1 8 ? -16.424 22.007 23.055 1.00 42.83 ? 8 PRO A CG 1 ATOM 61 C CD . PRO A 1 8 ? -16.221 22.132 21.571 1.00 47.08 ? 8 PRO A CD 1 ATOM 62 N N . VAL A 1 9 ? -16.815 25.876 24.110 1.00 33.45 ? 9 VAL A N 1 ATOM 63 C CA . VAL A 1 9 ? -15.966 26.856 24.776 1.00 30.35 ? 9 VAL A CA 1 ATOM 64 C C . VAL A 1 9 ? -14.994 26.201 25.746 1.00 26.48 ? 9 VAL A C 1 ATOM 65 O O . VAL A 1 9 ? -13.955 26.793 26.061 1.00 17.66 ? 9 VAL A O 1 ATOM 66 C CB . VAL A 1 9 ? -16.812 27.915 25.503 1.00 30.07 ? 9 VAL A CB 1 ATOM 67 C CG1 . VAL A 1 9 ? -17.785 28.569 24.535 1.00 19.52 ? 9 VAL A CG1 1 ATOM 68 C CG2 . VAL A 1 9 ? -17.553 27.298 26.679 1.00 39.72 ? 9 VAL A CG2 1 ATOM 69 N N . ILE A 1 10 ? -15.296 24.996 26.228 1.00 28.44 ? 10 ILE A N 1 ATOM 70 C CA . ILE A 1 10 ? -14.415 24.262 27.130 1.00 25.69 ? 10 ILE A CA 1 ATOM 71 C C . ILE A 1 10 ? -14.328 22.819 26.657 1.00 24.69 ? 10 ILE A C 1 ATOM 72 O O . ILE A 1 10 ? -15.341 22.208 26.301 1.00 31.28 ? 10 ILE A O 1 ATOM 73 C CB . ILE A 1 10 ? -14.906 24.310 28.593 1.00 31.08 ? 10 ILE A CB 1 ATOM 74 C CG1 . ILE A 1 10 ? -15.201 25.744 29.029 1.00 37.09 ? 10 ILE A CG1 1 ATOM 75 C CG2 . ILE A 1 10 ? -13.876 23.688 29.520 1.00 20.27 ? 10 ILE A CG2 1 ATOM 76 C CD1 . ILE A 1 10 ? -16.211 25.827 30.152 1.00 46.39 ? 10 ILE A CD1 1 ATOM 77 N N . LEU A 1 11 ? -13.115 22.276 26.655 1.00 25.86 ? 11 LEU A N 1 ATOM 78 C CA . LEU A 1 11 ? -12.880 20.864 26.397 1.00 28.73 ? 11 LEU A CA 1 ATOM 79 C C . LEU A 1 11 ? -12.120 20.262 27.569 1.00 26.66 ? 11 LEU A C 1 ATOM 80 O O . LEU A 1 11 ? -11.244 20.910 28.154 1.00 21.56 ? 11 LEU A O 1 ATOM 81 C CB . LEU A 1 11 ? -12.098 20.654 25.096 1.00 32.63 ? 11 LEU A CB 1 ATOM 82 C CG . LEU A 1 11 ? -12.913 20.672 23.804 1.00 36.29 ? 11 LEU A CG 1 ATOM 83 C CD1 . LEU A 1 11 ? -11.998 20.651 22.589 1.00 37.66 ? 11 LEU A CD1 1 ATOM 84 C CD2 . LEU A 1 11 ? -13.868 19.492 23.774 1.00 36.81 ? 11 LEU A CD2 1 ATOM 85 N N . SER A 1 12 ? -12.465 19.024 27.914 1.00 34.65 ? 12 SER A N 1 ATOM 86 C CA . SER A 1 12 ? -11.840 18.321 29.032 1.00 30.96 ? 12 SER A CA 1 ATOM 87 C C . SER A 1 12 ? -11.621 16.874 28.621 1.00 28.13 ? 12 SER A C 1 ATOM 88 O O . SER A 1 12 ? -12.587 16.128 28.435 1.00 41.59 ? 12 SER A O 1 ATOM 89 C CB . SER A 1 12 ? -12.699 18.409 30.293 1.00 30.05 ? 12 SER A CB 1 ATOM 90 O OG . SER A 1 12 ? -12.067 17.755 31.379 1.00 33.77 ? 12 SER A OG 1 ATOM 91 N N . VAL A 1 13 ? -10.358 16.483 28.471 1.00 24.06 ? 13 VAL A N 1 ATOM 92 C CA . VAL A 1 13 ? -9.983 15.149 28.033 1.00 40.05 ? 13 VAL A CA 1 ATOM 93 C C . VAL A 1 13 ? -8.896 14.618 28.962 1.00 32.09 ? 13 VAL A C 1 ATOM 94 O O . VAL A 1 13 ? -8.450 15.299 29.884 1.00 32.22 ? 13 VAL A O 1 ATOM 95 C CB . VAL A 1 13 ? -9.503 15.125 26.566 1.00 40.21 ? 13 VAL A CB 1 ATOM 96 C CG1 . VAL A 1 13 ? -10.584 15.657 25.637 1.00 42.71 ? 13 VAL A CG1 1 ATOM 97 C CG2 . VAL A 1 13 ? -8.221 15.926 26.420 1.00 31.52 ? 13 VAL A CG2 1 ATOM 98 N N . SER A 1 14 ? -8.470 13.388 28.699 1.00 30.63 ? 14 SER A N 1 ATOM 99 C CA . SER A 1 14 ? -7.410 12.721 29.437 1.00 32.14 ? 14 SER A CA 1 ATOM 100 C C . SER A 1 14 ? -6.165 12.583 28.569 1.00 34.47 ? 14 SER A C 1 ATOM 101 O O . SER A 1 14 ? -6.249 12.621 27.336 1.00 37.63 ? 14 SER A O 1 ATOM 102 C CB . SER A 1 14 ? -7.878 11.336 29.904 1.00 34.57 ? 14 SER A CB 1 ATOM 103 O OG . SER A 1 14 ? -9.050 11.441 30.695 1.00 38.33 ? 14 SER A OG 1 ATOM 104 N N . PRO A 1 15 ? -4.987 12.429 29.180 1.00 43.06 ? 15 PRO A N 1 ATOM 105 C CA . PRO A 1 15 ? -3.760 12.284 28.387 1.00 42.56 ? 15 PRO A CA 1 ATOM 106 C C . PRO A 1 15 ? -3.817 11.068 27.474 1.00 37.69 ? 15 PRO A C 1 ATOM 107 O O . PRO A 1 15 ? -4.398 10.033 27.813 1.00 33.22 ? 15 PRO A O 1 ATOM 108 C CB . PRO A 1 15 ? -2.664 12.131 29.450 1.00 29.46 ? 15 PRO A CB 1 ATOM 109 C CG . PRO A 1 15 ? -3.233 12.771 30.672 1.00 29.20 ? 15 PRO A CG 1 ATOM 110 C CD . PRO A 1 15 ? -4.704 12.484 30.625 1.00 29.16 ? 15 PRO A CD 1 ATOM 111 N N . GLY A 1 16 ? -3.198 11.208 26.300 1.00 35.29 ? 16 GLY A N 1 ATOM 112 C CA . GLY A 1 16 ? -3.192 10.167 25.297 1.00 36.21 ? 16 GLY A CA 1 ATOM 113 C C . GLY A 1 16 ? -4.402 10.140 24.390 1.00 36.99 ? 16 GLY A C 1 ATOM 114 O O . GLY A 1 16 ? -4.331 9.549 23.303 1.00 41.38 ? 16 GLY A O 1 ATOM 115 N N . GLU A 1 17 ? -5.510 10.757 24.793 1.00 34.72 ? 17 GLU A N 1 ATOM 116 C CA . GLU A 1 17 ? -6.704 10.793 23.964 1.00 42.11 ? 17 GLU A CA 1 ATOM 117 C C . GLU A 1 17 ? -6.562 11.833 22.855 1.00 37.73 ? 17 GLU A C 1 ATOM 118 O O . GLU A 1 17 ? -5.764 12.770 22.937 1.00 33.24 ? 17 GLU A O 1 ATOM 119 C CB . GLU A 1 17 ? -7.941 11.110 24.805 1.00 42.25 ? 17 GLU A CB 1 ATOM 120 C CG . GLU A 1 17 ? -8.350 10.014 25.774 1.00 54.02 ? 17 GLU A CG 1 ATOM 121 C CD . GLU A 1 17 ? -9.532 10.421 26.638 1.00 55.46 ? 17 GLU A CD 1 ATOM 122 O OE1 . GLU A 1 17 ? -9.751 11.641 26.801 1.00 48.42 ? 17 GLU A OE1 1 ATOM 123 O OE2 . GLU A 1 17 ? -10.248 9.529 27.147 1.00 45.92 ? 17 GLU A OE2 1 ATOM 124 N N . ARG A 1 18 ? -7.350 11.650 21.804 1.00 37.76 ? 18 ARG A N 1 ATOM 125 C CA . ARG A 1 18 ? -7.396 12.593 20.700 1.00 38.31 ? 18 ARG A CA 1 ATOM 126 C C . ARG A 1 18 ? -8.456 13.652 20.977 1.00 36.07 ? 18 ARG A C 1 ATOM 127 O O . ARG A 1 18 ? -9.491 13.373 21.589 1.00 35.28 ? 18 ARG A O 1 ATOM 128 C CB . ARG A 1 18 ? -7.696 11.863 19.391 1.00 39.68 ? 18 ARG A CB 1 ATOM 129 C CG . ARG A 1 18 ? -7.705 12.736 18.149 1.00 47.73 ? 18 ARG A CG 1 ATOM 130 C CD . ARG A 1 18 ? -7.596 11.871 16.904 1.00 58.06 ? 18 ARG A CD 1 ATOM 131 N NE . ARG A 1 18 ? -8.061 12.554 15.701 1.00 68.08 ? 18 ARG A NE 1 ATOM 132 C CZ . ARG A 1 18 ? -7.271 13.197 14.847 1.00 71.51 ? 18 ARG A CZ 1 ATOM 133 N NH1 . ARG A 1 18 ? -5.964 13.257 15.062 1.00 74.01 ? 18 ARG A NH1 1 ATOM 134 N NH2 . ARG A 1 18 ? -7.793 13.783 13.777 1.00 65.14 ? 18 ARG A NH2 1 ATOM 135 N N . VAL A 1 19 ? -8.183 14.876 20.532 1.00 36.58 ? 19 VAL A N 1 ATOM 136 C CA . VAL A 1 19 ? -9.103 15.983 20.762 1.00 33.95 ? 19 VAL A CA 1 ATOM 137 C C . VAL A 1 19 ? -9.186 16.834 19.503 1.00 29.01 ? 19 VAL A C 1 ATOM 138 O O . VAL A 1 19 ? -8.223 16.956 18.740 1.00 24.01 ? 19 VAL A O 1 ATOM 139 C CB . VAL A 1 19 ? -8.683 16.827 21.987 1.00 23.91 ? 19 VAL A CB 1 ATOM 140 C CG1 . VAL A 1 19 ? -7.497 17.713 21.646 1.00 22.13 ? 19 VAL A CG1 1 ATOM 141 C CG2 . VAL A 1 19 ? -9.860 17.639 22.505 1.00 21.52 ? 19 VAL A CG2 1 ATOM 142 N N . SER A 1 20 ? -10.361 17.416 19.286 1.00 30.71 ? 20 SER A N 1 ATOM 143 C CA . SER A 1 20 ? -10.669 18.209 18.102 1.00 30.25 ? 20 SER A CA 1 ATOM 144 C C . SER A 1 20 ? -11.284 19.544 18.498 1.00 31.40 ? 20 SER A C 1 ATOM 145 O O . SER A 1 20 ? -12.178 19.596 19.349 1.00 26.74 ? 20 SER A O 1 ATOM 146 C CB . SER A 1 20 ? -11.644 17.476 17.168 1.00 30.85 ? 20 SER A CB 1 ATOM 147 O OG . SER A 1 20 ? -11.005 16.405 16.503 1.00 44.03 ? 20 SER A OG 1 ATOM 148 N N . PHE A 1 21 ? -10.821 20.621 17.865 1.00 28.69 ? 21 PHE A N 1 ATOM 149 C CA . PHE A 1 21 ? -11.391 21.952 18.045 1.00 27.50 ? 21 PHE A CA 1 ATOM 150 C C . PHE A 1 21 ? -12.144 22.358 16.784 1.00 27.52 ? 21 PHE A C 1 ATOM 151 O O . PHE A 1 21 ? -11.663 22.132 15.671 1.00 29.92 ? 21 PHE A O 1 ATOM 152 C CB . PHE A 1 21 ? -10.303 22.987 18.345 1.00 27.49 ? 21 PHE A CB 1 ATOM 153 C CG . PHE A 1 21 ? -9.450 22.647 19.529 1.00 17.51 ? 21 PHE A CG 1 ATOM 154 C CD1 . PHE A 1 21 ? -9.809 23.070 20.796 1.00 24.07 ? 21 PHE A CD1 1 ATOM 155 C CD2 . PHE A 1 21 ? -8.289 21.905 19.377 1.00 24.25 ? 21 PHE A CD2 1 ATOM 156 C CE1 . PHE A 1 21 ? -9.028 22.761 21.894 1.00 29.02 ? 21 PHE A CE1 1 ATOM 157 C CE2 . PHE A 1 21 ? -7.502 21.591 20.474 1.00 29.13 ? 21 PHE A CE2 1 ATOM 158 C CZ . PHE A 1 21 ? -7.874 22.020 21.734 1.00 23.57 ? 21 PHE A CZ 1 ATOM 159 N N . SER A 1 22 ? -13.320 22.959 16.951 1.00 27.67 ? 22 SER A N 1 ATOM 160 C CA . SER A 1 22 ? -14.118 23.422 15.823 1.00 28.61 ? 22 SER A CA 1 ATOM 161 C C . SER A 1 22 ? -14.086 24.942 15.736 1.00 31.56 ? 22 SER A C 1 ATOM 162 O O . SER A 1 22 ? -14.147 25.635 16.756 1.00 28.88 ? 22 SER A O 1 ATOM 163 C CB . SER A 1 22 ? -15.568 22.935 15.923 1.00 28.73 ? 22 SER A CB 1 ATOM 164 O OG . SER A 1 22 ? -15.736 21.699 15.247 1.00 41.70 ? 22 SER A OG 1 ATOM 165 N N . CYS A 1 23 ? -13.979 25.450 14.509 1.00 38.16 ? 23 CYS A N 1 ATOM 166 C CA . CYS A 1 23 ? -14.035 26.882 14.229 1.00 27.76 ? 23 CYS A CA 1 ATOM 167 C C . CYS A 1 23 ? -14.845 27.071 12.959 1.00 29.82 ? 23 CYS A C 1 ATOM 168 O O . CYS A 1 23 ? -14.457 26.572 11.898 1.00 29.80 ? 23 CYS A O 1 ATOM 169 C CB . CYS A 1 23 ? -12.632 27.476 14.067 1.00 19.70 ? 23 CYS A CB 1 ATOM 170 S SG . CYS A 1 23 ? -12.561 29.165 13.406 1.00 38.63 ? 23 CYS A SG 1 ATOM 171 N N . ARG A 1 24 ? -15.964 27.782 13.065 1.00 35.73 ? 24 ARG A N 1 ATOM 172 C CA . ARG A 1 24 ? -16.895 27.943 11.958 1.00 36.02 ? 24 ARG A CA 1 ATOM 173 C C . ARG A 1 24 ? -17.004 29.411 11.573 1.00 35.84 ? 24 ARG A C 1 ATOM 174 O O . ARG A 1 24 ? -17.118 30.283 12.442 1.00 43.21 ? 24 ARG A O 1 ATOM 175 C CB . ARG A 1 24 ? -18.271 27.373 12.313 1.00 34.01 ? 24 ARG A CB 1 ATOM 176 C CG . ARG A 1 24 ? -18.273 25.856 12.437 1.00 33.85 ? 24 ARG A CG 1 ATOM 177 C CD . ARG A 1 24 ? -19.640 25.313 12.816 1.00 37.54 ? 24 ARG A CD 1 ATOM 178 N NE . ARG A 1 24 ? -19.748 23.883 12.527 1.00 39.15 ? 24 ARG A NE 1 ATOM 179 C CZ . ARG A 1 24 ? -19.411 22.915 13.375 1.00 40.00 ? 24 ARG A CZ 1 ATOM 180 N NH1 . ARG A 1 24 ? -18.943 23.216 14.578 1.00 43.14 ? 24 ARG A NH1 1 ATOM 181 N NH2 . ARG A 1 24 ? -19.541 21.643 13.020 1.00 39.28 ? 24 ARG A NH2 1 ATOM 182 N N . ALA A 1 25 ? -16.966 29.675 10.271 1.00 32.88 ? 25 ALA A N 1 ATOM 183 C CA . ALA A 1 25 ? -17.025 31.023 9.727 1.00 33.11 ? 25 ALA A CA 1 ATOM 184 C C . ALA A 1 25 ? -18.447 31.370 9.301 1.00 32.89 ? 25 ALA A C 1 ATOM 185 O O . ALA A 1 25 ? -19.224 30.503 8.893 1.00 23.95 ? 25 ALA A O 1 ATOM 186 C CB . ALA A 1 25 ? -16.076 31.166 8.535 1.00 30.27 ? 25 ALA A CB 1 ATOM 187 N N . SER A 1 26 ? -18.779 32.660 9.397 1.00 39.16 ? 26 SER A N 1 ATOM 188 C CA . SER A 1 26 ? -20.105 33.132 9.015 1.00 31.34 ? 26 SER A CA 1 ATOM 189 C C . SER A 1 26 ? -20.323 33.130 7.507 1.00 26.79 ? 26 SER A C 1 ATOM 190 O O . SER A 1 26 ? -21.464 33.302 7.064 1.00 27.20 ? 26 SER A O 1 ATOM 191 C CB . SER A 1 26 ? -20.338 34.537 9.573 1.00 35.84 ? 26 SER A CB 1 ATOM 192 O OG . SER A 1 26 ? -19.319 35.429 9.157 1.00 37.58 ? 26 SER A OG 1 ATOM 193 N N . GLN A 1 27 ? -19.267 32.959 6.717 1.00 29.84 ? 27 GLN A N 1 ATOM 194 C CA . GLN A 1 27 ? -19.386 32.744 5.281 1.00 36.56 ? 27 GLN A CA 1 ATOM 195 C C . GLN A 1 27 ? -18.112 32.055 4.811 1.00 32.23 ? 27 GLN A C 1 ATOM 196 O O . GLN A 1 27 ? -17.129 31.957 5.549 1.00 29.64 ? 27 GLN A O 1 ATOM 197 C CB . GLN A 1 27 ? -19.635 34.055 4.526 1.00 43.13 ? 27 GLN A CB 1 ATOM 198 C CG . GLN A 1 27 ? -18.406 34.924 4.342 1.00 50.37 ? 27 GLN A CG 1 ATOM 199 C CD . GLN A 1 27 ? -18.758 36.349 3.953 1.00 58.91 ? 27 GLN A CD 1 ATOM 200 O OE1 . GLN A 1 27 ? -19.575 36.998 4.608 1.00 62.72 ? 27 GLN A OE1 1 ATOM 201 N NE2 . GLN A 1 27 ? -18.145 36.841 2.883 1.00 61.30 ? 27 GLN A NE2 1 ATOM 202 N N . SER A 1 28 ? -18.146 31.566 3.574 1.00 31.62 ? 28 SER A N 1 ATOM 203 C CA . SER A 1 28 ? -17.031 30.787 3.053 1.00 33.31 ? 28 SER A CA 1 ATOM 204 C C . SER A 1 28 ? -15.751 31.613 3.048 1.00 33.29 ? 28 SER A C 1 ATOM 205 O O . SER A 1 28 ? -15.746 32.780 2.647 1.00 43.17 ? 28 SER A O 1 ATOM 206 C CB . SER A 1 28 ? -17.348 30.291 1.641 1.00 34.48 ? 28 SER A CB 1 ATOM 207 O OG . SER A 1 28 ? -16.303 29.478 1.136 1.00 33.80 ? 28 SER A OG 1 ATOM 208 N N . ILE A 1 29 ? -14.662 31.005 3.516 1.00 29.58 ? 29 ILE A N 1 ATOM 209 C CA . ILE A 1 29 ? -13.365 31.674 3.551 1.00 34.10 ? 29 ILE A CA 1 ATOM 210 C C . ILE A 1 29 ? -12.310 30.765 2.938 1.00 35.20 ? 29 ILE A C 1 ATOM 211 O O . ILE A 1 29 ? -11.106 30.995 3.105 1.00 28.47 ? 29 ILE A O 1 ATOM 212 C CB . ILE A 1 29 ? -12.968 32.075 4.984 1.00 22.46 ? 29 ILE A CB 1 ATOM 213 C CG1 . ILE A 1 29 ? -12.903 30.842 5.888 1.00 20.91 ? 29 ILE A CG1 1 ATOM 214 C CG2 . ILE A 1 29 ? -13.924 33.123 5.538 1.00 21.39 ? 29 ILE A CG2 1 ATOM 215 C CD1 . ILE A 1 29 ? -12.323 31.118 7.256 1.00 19.49 ? 29 ILE A CD1 1 ATOM 216 N N . GLY A 1 30 ? -12.751 29.732 2.229 1.00 33.46 ? 30 GLY A N 1 ATOM 217 C CA . GLY A 1 30 ? -11.810 28.821 1.597 1.00 34.65 ? 30 GLY A CA 1 ATOM 218 C C . GLY A 1 30 ? -11.015 28.064 2.640 1.00 31.35 ? 30 GLY A C 1 ATOM 219 O O . GLY A 1 30 ? -11.574 27.379 3.505 1.00 38.27 ? 30 GLY A O 1 ATOM 220 N N . THR A 1 31 ? -9.689 28.179 2.566 1.00 22.91 ? 31 THR A N 1 ATOM 221 C CA . THR A 1 31 ? -8.795 27.585 3.553 1.00 25.57 ? 31 THR A CA 1 ATOM 222 C C . THR A 1 31 ? -7.964 28.642 4.267 1.00 25.35 ? 31 THR A C 1 ATOM 223 O O . THR A 1 31 ? -6.885 28.337 4.784 1.00 31.72 ? 31 THR A O 1 ATOM 224 C CB . THR A 1 31 ? -7.879 26.546 2.899 1.00 26.99 ? 31 THR A CB 1 ATOM 225 O OG1 . THR A 1 31 ? -7.293 27.099 1.714 1.00 27.59 ? 31 THR A OG1 1 ATOM 226 C CG2 . THR A 1 31 ? -8.664 25.295 2.540 1.00 23.95 ? 31 THR A CG2 1 ATOM 227 N N . ASN A 1 32 ? -8.448 29.882 4.310 1.00 24.91 ? 32 ASN A N 1 ATOM 228 C CA . ASN A 1 32 ? -7.685 30.995 4.873 1.00 19.26 ? 32 ASN A CA 1 ATOM 229 C C . ASN A 1 32 ? -7.972 31.108 6.371 1.00 24.60 ? 32 ASN A C 1 ATOM 230 O O . ASN A 1 32 ? -8.613 32.041 6.857 1.00 19.73 ? 32 ASN A O 1 ATOM 231 C CB . ASN A 1 32 ? -8.017 32.287 4.139 1.00 19.65 ? 32 ASN A CB 1 ATOM 232 C CG . ASN A 1 32 ? -6.826 33.208 4.021 1.00 27.40 ? 32 ASN A CG 1 ATOM 233 O OD1 . ASN A 1 32 ? -6.108 33.444 4.992 1.00 31.70 ? 32 ASN A OD1 1 ATOM 234 N ND2 . ASN A 1 32 ? -6.599 33.726 2.819 1.00 20.11 ? 32 ASN A ND2 1 ATOM 235 N N . ILE A 1 33 ? -7.470 30.122 7.109 1.00 24.83 ? 33 ILE A N 1 ATOM 236 C CA . ILE A 1 33 ? -7.637 30.072 8.555 1.00 25.33 ? 33 ILE A CA 1 ATOM 237 C C . ILE A 1 33 ? -6.308 29.690 9.192 1.00 20.58 ? 33 ILE A C 1 ATOM 238 O O . ILE A 1 33 ? -5.553 28.878 8.647 1.00 23.32 ? 33 ILE A O 1 ATOM 239 C CB . ILE A 1 33 ? -8.760 29.093 8.960 1.00 28.30 ? 33 ILE A CB 1 ATOM 240 C CG1 . ILE A 1 33 ? -8.991 29.135 10.470 1.00 36.89 ? 33 ILE A CG1 1 ATOM 241 C CG2 . ILE A 1 33 ? -8.444 27.682 8.495 1.00 31.60 ? 33 ILE A CG2 1 ATOM 242 C CD1 . ILE A 1 33 ? -10.132 28.269 10.928 1.00 49.80 ? 33 ILE A CD1 1 ATOM 243 N N . HIS A 1 34 ? -6.014 30.296 10.341 1.00 30.67 ? 34 HIS A N 1 ATOM 244 C CA . HIS A 1 34 ? -4.801 30.018 11.095 1.00 28.25 ? 34 HIS A CA 1 ATOM 245 C C . HIS A 1 34 ? -5.171 29.683 12.533 1.00 29.85 ? 34 HIS A C 1 ATOM 246 O O . HIS A 1 34 ? -6.172 30.172 13.062 1.00 27.96 ? 34 HIS A O 1 ATOM 247 C CB . HIS A 1 34 ? -3.840 31.210 11.059 1.00 16.03 ? 34 HIS A CB 1 ATOM 248 C CG . HIS A 1 34 ? -3.566 31.719 9.679 1.00 19.00 ? 34 HIS A CG 1 ATOM 249 N ND1 . HIS A 1 34 ? -3.442 30.883 8.590 1.00 16.32 ? 34 HIS A ND1 1 ATOM 250 C CD2 . HIS A 1 34 ? -3.403 32.977 9.207 1.00 23.15 ? 34 HIS A CD2 1 ATOM 251 C CE1 . HIS A 1 34 ? -3.208 31.604 7.508 1.00 23.31 ? 34 HIS A CE1 1 ATOM 252 N NE2 . HIS A 1 34 ? -3.181 32.878 7.855 1.00 18.52 ? 34 HIS A NE2 1 ATOM 253 N N . TRP A 1 35 ? -4.357 28.840 13.163 1.00 25.17 ? 35 TRP A N 1 ATOM 254 C CA . TRP A 1 35 ? -4.602 28.387 14.525 1.00 14.78 ? 35 TRP A CA 1 ATOM 255 C C . TRP A 1 35 ? -3.466 28.826 15.436 1.00 19.05 ? 35 TRP A C 1 ATOM 256 O O . TRP A 1 35 ? -2.292 28.748 15.064 1.00 33.22 ? 35 TRP A O 1 ATOM 257 C CB . TRP A 1 35 ? -4.755 26.867 14.584 1.00 29.44 ? 35 TRP A CB 1 ATOM 258 C CG . TRP A 1 35 ? -6.026 26.357 13.980 1.00 24.29 ? 35 TRP A CG 1 ATOM 259 C CD1 . TRP A 1 35 ? -6.207 25.921 12.701 1.00 21.07 ? 35 TRP A CD1 1 ATOM 260 C CD2 . TRP A 1 35 ? -7.292 26.219 14.635 1.00 24.25 ? 35 TRP A CD2 1 ATOM 261 N NE1 . TRP A 1 35 ? -7.510 25.521 12.517 1.00 21.70 ? 35 TRP A NE1 1 ATOM 262 C CE2 . TRP A 1 35 ? -8.196 25.694 13.690 1.00 25.89 ? 35 TRP A CE2 1 ATOM 263 C CE3 . TRP A 1 35 ? -7.749 26.489 15.929 1.00 24.17 ? 35 TRP A CE3 1 ATOM 264 C CZ2 . TRP A 1 35 ? -9.531 25.434 13.997 1.00 25.14 ? 35 TRP A CZ2 1 ATOM 265 C CZ3 . TRP A 1 35 ? -9.075 26.228 16.232 1.00 26.06 ? 35 TRP A CZ3 1 ATOM 266 C CH2 . TRP A 1 35 ? -9.949 25.705 15.271 1.00 25.38 ? 35 TRP A CH2 1 ATOM 267 N N . TYR A 1 36 ? -3.821 29.272 16.639 1.00 17.18 ? 36 TYR A N 1 ATOM 268 C CA . TYR A 1 36 ? -2.855 29.758 17.612 1.00 14.05 ? 36 TYR A CA 1 ATOM 269 C C . TYR A 1 36 ? -3.072 29.086 18.961 1.00 16.97 ? 36 TYR A C 1 ATOM 270 O O . TYR A 1 36 ? -4.194 28.711 19.316 1.00 14.17 ? 36 TYR A O 1 ATOM 271 C CB . TYR A 1 36 ? -2.950 31.280 17.780 1.00 13.68 ? 36 TYR A CB 1 ATOM 272 C CG . TYR A 1 36 ? -2.614 32.063 16.533 1.00 13.68 ? 36 TYR A CG 1 ATOM 273 C CD1 . TYR A 1 36 ? -3.589 32.353 15.587 1.00 13.63 ? 36 TYR A CD1 1 ATOM 274 C CD2 . TYR A 1 36 ? -1.322 32.520 16.304 1.00 29.06 ? 36 TYR A CD2 1 ATOM 275 C CE1 . TYR A 1 36 ? -3.288 33.071 14.448 1.00 13.86 ? 36 TYR A CE1 1 ATOM 276 C CE2 . TYR A 1 36 ? -1.011 33.240 15.165 1.00 22.67 ? 36 TYR A CE2 1 ATOM 277 C CZ . TYR A 1 36 ? -1.999 33.513 14.241 1.00 22.11 ? 36 TYR A CZ 1 ATOM 278 O OH . TYR A 1 36 ? -1.696 34.229 13.106 1.00 31.40 ? 36 TYR A OH 1 ATOM 279 N N . GLN A 1 37 ? -1.980 28.945 19.713 1.00 18.67 ? 37 GLN A N 1 ATOM 280 C CA . GLN A 1 37 ? -1.998 28.417 21.070 1.00 14.77 ? 37 GLN A CA 1 ATOM 281 C C . GLN A 1 37 ? -1.532 29.500 22.034 1.00 23.61 ? 37 GLN A C 1 ATOM 282 O O . GLN A 1 37 ? -0.592 30.242 21.736 1.00 26.86 ? 37 GLN A O 1 ATOM 283 C CB . GLN A 1 37 ? -1.096 27.183 21.203 1.00 15.50 ? 37 GLN A CB 1 ATOM 284 C CG . GLN A 1 37 ? -1.101 26.552 22.589 1.00 27.22 ? 37 GLN A CG 1 ATOM 285 C CD . GLN A 1 37 ? 0.056 25.596 22.808 1.00 30.52 ? 37 GLN A CD 1 ATOM 286 O OE1 . GLN A 1 37 ? 1.219 26.001 22.803 1.00 21.93 ? 37 GLN A OE1 1 ATOM 287 N NE2 . GLN A 1 37 ? -0.258 24.321 23.007 1.00 37.84 ? 37 GLN A NE2 1 ATOM 288 N N . GLN A 1 38 ? -2.192 29.594 23.188 1.00 14.78 ? 38 GLN A N 1 ATOM 289 C CA . GLN A 1 38 ? -1.827 30.565 24.215 1.00 23.03 ? 38 GLN A CA 1 ATOM 290 C C . GLN A 1 38 ? -1.793 29.870 25.569 1.00 26.50 ? 38 GLN A C 1 ATOM 291 O O . GLN A 1 38 ? -2.845 29.577 26.146 1.00 15.57 ? 38 GLN A O 1 ATOM 292 C CB . GLN A 1 38 ? -2.795 31.749 24.234 1.00 25.44 ? 38 GLN A CB 1 ATOM 293 C CG . GLN A 1 38 ? -2.434 32.807 25.267 1.00 14.82 ? 38 GLN A CG 1 ATOM 294 C CD . GLN A 1 38 ? -3.209 34.098 25.086 1.00 31.23 ? 38 GLN A CD 1 ATOM 295 O OE1 . GLN A 1 38 ? -4.419 34.086 24.849 1.00 30.62 ? 38 GLN A OE1 1 ATOM 296 N NE2 . GLN A 1 38 ? -2.511 35.222 25.194 1.00 27.79 ? 38 GLN A NE2 1 ATOM 297 N N . ARG A 1 39 ? -0.588 29.612 26.070 1.00 25.67 ? 39 ARG A N 1 ATOM 298 C CA . ARG A 1 39 ? -0.402 29.068 27.404 1.00 23.22 ? 39 ARG A CA 1 ATOM 299 C C . ARG A 1 39 ? -0.516 30.176 28.446 1.00 28.51 ? 39 ARG A C 1 ATOM 300 O O . ARG A 1 39 ? -0.589 31.365 28.124 1.00 44.30 ? 39 ARG A O 1 ATOM 301 C CB . ARG A 1 39 ? 0.953 28.373 27.517 1.00 26.81 ? 39 ARG A CB 1 ATOM 302 C CG . ARG A 1 39 ? 1.070 27.083 26.726 1.00 18.10 ? 39 ARG A CG 1 ATOM 303 C CD . ARG A 1 39 ? 2.498 26.575 26.748 1.00 24.01 ? 39 ARG A CD 1 ATOM 304 N NE . ARG A 1 39 ? 2.635 25.290 26.071 1.00 32.23 ? 39 ARG A NE 1 ATOM 305 C CZ . ARG A 1 39 ? 3.800 24.727 25.772 1.00 43.76 ? 39 ARG A CZ 1 ATOM 306 N NH1 . ARG A 1 39 ? 4.934 25.340 26.084 1.00 47.50 ? 39 ARG A NH1 1 ATOM 307 N NH2 . ARG A 1 39 ? 3.831 23.555 25.156 1.00 53.98 ? 39 ARG A NH2 1 ATOM 308 N N . THR A 1 40 ? -0.526 29.770 29.715 1.00 21.23 ? 40 THR A N 1 ATOM 309 C CA . THR A 1 40 ? -0.659 30.721 30.812 1.00 24.70 ? 40 THR A CA 1 ATOM 310 C C . THR A 1 40 ? 0.465 31.750 30.774 1.00 27.88 ? 40 THR A C 1 ATOM 311 O O . THR A 1 40 ? 1.646 31.397 30.691 1.00 26.99 ? 40 THR A O 1 ATOM 312 C CB . THR A 1 40 ? -0.656 29.984 32.153 1.00 22.88 ? 40 THR A CB 1 ATOM 313 O OG1 . THR A 1 40 ? -1.765 29.075 32.201 1.00 29.65 ? 40 THR A OG1 1 ATOM 314 C CG2 . THR A 1 40 ? -0.768 30.969 33.309 1.00 20.33 ? 40 THR A CG2 1 ATOM 315 N N . ASN A 1 41 ? 0.084 33.029 30.822 1.00 26.22 ? 41 ASN A N 1 ATOM 316 C CA . ASN A 1 41 ? 1.009 34.164 30.808 1.00 24.19 ? 41 ASN A CA 1 ATOM 317 C C . ASN A 1 41 ? 1.810 34.257 29.512 1.00 18.75 ? 41 ASN A C 1 ATOM 318 O O . ASN A 1 41 ? 2.855 34.913 29.469 1.00 19.40 ? 41 ASN A O 1 ATOM 319 C CB . ASN A 1 41 ? 1.958 34.124 32.014 1.00 27.24 ? 41 ASN A CB 1 ATOM 320 C CG . ASN A 1 41 ? 1.276 34.525 33.308 1.00 34.32 ? 41 ASN A CG 1 ATOM 321 O OD1 . ASN A 1 41 ? 1.400 33.846 34.328 1.00 27.24 ? 41 ASN A OD1 1 ATOM 322 N ND2 . ASN A 1 41 ? 0.550 35.638 33.272 1.00 35.60 ? 41 ASN A ND2 1 ATOM 323 N N . GLY A 1 42 ? 1.334 33.627 28.440 1.00 18.53 ? 42 GLY A N 1 ATOM 324 C CA . GLY A 1 42 ? 2.051 33.583 27.188 1.00 20.76 ? 42 GLY A CA 1 ATOM 325 C C . GLY A 1 42 ? 1.412 34.441 26.105 1.00 28.51 ? 42 GLY A C 1 ATOM 326 O O . GLY A 1 42 ? 0.295 34.940 26.228 1.00 37.42 ? 42 GLY A O 1 ATOM 327 N N . SER A 1 43 ? 2.166 34.620 25.037 1.00 23.89 ? 43 SER A N 1 ATOM 328 C CA . SER A 1 43 ? 1.656 35.214 23.814 1.00 24.24 ? 43 SER A CA 1 ATOM 329 C C . SER A 1 43 ? 1.188 34.117 22.870 1.00 21.59 ? 43 SER A C 1 ATOM 330 O O . SER A 1 43 ? 1.560 32.951 23.031 1.00 21.75 ? 43 SER A O 1 ATOM 331 C CB . SER A 1 43 ? 2.741 36.063 23.152 1.00 17.48 ? 43 SER A CB 1 ATOM 332 O OG . SER A 1 43 ? 3.176 37.101 24.015 1.00 18.20 ? 43 SER A OG 1 ATOM 333 N N . PRO A 1 44 ? 0.348 34.446 21.889 1.00 26.49 ? 44 PRO A N 1 ATOM 334 C CA . PRO A 1 44 ? -0.097 33.426 20.931 1.00 14.37 ? 44 PRO A CA 1 ATOM 335 C C . PRO A 1 44 ? 1.072 32.747 20.228 1.00 19.67 ? 44 PRO A C 1 ATOM 336 O O . PRO A 1 44 ? 2.100 33.364 19.940 1.00 23.01 ? 44 PRO A O 1 ATOM 337 C CB . PRO A 1 44 ? -0.958 34.222 19.945 1.00 13.90 ? 44 PRO A CB 1 ATOM 338 C CG . PRO A 1 44 ? -1.480 35.357 20.750 1.00 13.87 ? 44 PRO A CG 1 ATOM 339 C CD . PRO A 1 44 ? -0.379 35.718 21.714 1.00 23.46 ? 44 PRO A CD 1 ATOM 340 N N . ARG A 1 45 ? 0.898 31.454 19.953 1.00 20.04 ? 45 ARG A N 1 ATOM 341 C CA . ARG A 1 45 ? 1.903 30.630 19.289 1.00 27.43 ? 45 ARG A CA 1 ATOM 342 C C . ARG A 1 45 ? 1.267 30.001 18.057 1.00 28.28 ? 45 ARG A C 1 ATOM 343 O O . ARG A 1 45 ? 0.314 29.225 18.178 1.00 26.16 ? 45 ARG A O 1 ATOM 344 C CB . ARG A 1 45 ? 2.439 29.552 20.241 1.00 25.22 ? 45 ARG A CB 1 ATOM 345 C CG . ARG A 1 45 ? 3.376 28.511 19.625 1.00 33.62 ? 45 ARG A CG 1 ATOM 346 C CD . ARG A 1 45 ? 3.527 27.324 20.583 1.00 47.84 ? 45 ARG A CD 1 ATOM 347 N NE . ARG A 1 45 ? 4.412 26.267 20.097 1.00 50.89 ? 45 ARG A NE 1 ATOM 348 C CZ . ARG A 1 45 ? 4.548 25.081 20.687 1.00 47.51 ? 45 ARG A CZ 1 ATOM 349 N NH1 . ARG A 1 45 ? 3.854 24.799 21.781 1.00 22.78 ? 45 ARG A NH1 1 ATOM 350 N NH2 . ARG A 1 45 ? 5.374 24.172 20.185 1.00 55.96 ? 45 ARG A NH2 1 ATOM 351 N N . LEU A 1 46 ? 1.790 30.338 16.879 1.00 29.64 ? 46 LEU A N 1 ATOM 352 C CA . LEU A 1 46 ? 1.216 29.863 15.625 1.00 26.99 ? 46 LEU A CA 1 ATOM 353 C C . LEU A 1 46 ? 1.416 28.357 15.486 1.00 25.85 ? 46 LEU A C 1 ATOM 354 O O . LEU A 1 46 ? 2.552 27.870 15.490 1.00 23.25 ? 46 LEU A O 1 ATOM 355 C CB . LEU A 1 46 ? 1.850 30.602 14.450 1.00 23.96 ? 46 LEU A CB 1 ATOM 356 C CG . LEU A 1 46 ? 1.366 30.217 13.050 1.00 25.52 ? 46 LEU A CG 1 ATOM 357 C CD1 . LEU A 1 46 ? -0.117 30.517 12.878 1.00 23.80 ? 46 LEU A CD1 1 ATOM 358 C CD2 . LEU A 1 46 ? 2.188 30.932 11.991 1.00 17.69 ? 46 LEU A CD2 1 ATOM 359 N N . LEU A 1 47 ? 0.310 27.623 15.357 1.00 23.91 ? 47 LEU A N 1 ATOM 360 C CA . LEU A 1 47 ? 0.325 26.168 15.250 1.00 25.34 ? 47 LEU A CA 1 ATOM 361 C C . LEU A 1 47 ? 0.129 25.679 13.820 1.00 27.09 ? 47 LEU A C 1 ATOM 362 O O . LEU A 1 47 ? 0.904 24.850 13.335 1.00 26.58 ? 47 LEU A O 1 ATOM 363 C CB . LEU A 1 47 ? -0.761 25.561 16.145 1.00 28.60 ? 47 LEU A CB 1 ATOM 364 C CG . LEU A 1 47 ? -0.661 25.752 17.657 1.00 28.48 ? 47 LEU A CG 1 ATOM 365 C CD1 . LEU A 1 47 ? -1.902 25.183 18.326 1.00 32.77 ? 47 LEU A CD1 1 ATOM 366 C CD2 . LEU A 1 47 ? 0.595 25.093 18.201 1.00 17.16 ? 47 LEU A CD2 1 ATOM 367 N N . ILE A 1 48 ? -0.912 26.160 13.145 1.00 23.66 ? 48 ILE A N 1 ATOM 368 C CA . ILE A 1 48 ? -1.242 25.748 11.787 1.00 24.58 ? 48 ILE A CA 1 ATOM 369 C C . ILE A 1 48 ? -1.532 26.997 10.969 1.00 25.98 ? 48 ILE A C 1 ATOM 370 O O . ILE A 1 48 ? -2.150 27.945 11.465 1.00 22.96 ? 48 ILE A O 1 ATOM 371 C CB . ILE A 1 48 ? -2.454 24.788 11.759 1.00 20.67 ? 48 ILE A CB 1 ATOM 372 C CG1 . ILE A 1 48 ? -2.215 23.574 12.660 1.00 22.08 ? 48 ILE A CG1 1 ATOM 373 C CG2 . ILE A 1 48 ? -2.746 24.325 10.344 1.00 18.29 ? 48 ILE A CG2 1 ATOM 374 C CD1 . ILE A 1 48 ? -1.135 22.641 12.163 1.00 18.88 ? 48 ILE A CD1 1 ATOM 375 N N . LYS A 1 49 ? -1.076 27.004 9.720 1.00 17.40 ? 49 LYS A N 1 ATOM 376 C CA . LYS A 1 49 ? -1.392 28.066 8.776 1.00 26.25 ? 49 LYS A CA 1 ATOM 377 C C . LYS A 1 49 ? -2.145 27.476 7.593 1.00 31.59 ? 49 LYS A C 1 ATOM 378 O O . LYS A 1 49 ? -1.841 26.367 7.143 1.00 37.50 ? 49 LYS A O 1 ATOM 379 C CB . LYS A 1 49 ? -0.124 28.794 8.297 1.00 24.45 ? 49 LYS A CB 1 ATOM 380 C CG . LYS A 1 49 ? 0.788 27.974 7.397 1.00 23.81 ? 49 LYS A CG 1 ATOM 381 C CD . LYS A 1 49 ? 1.989 28.788 6.939 1.00 26.28 ? 49 LYS A CD 1 ATOM 382 C CE . LYS A 1 49 ? 2.877 27.987 5.999 1.00 26.98 ? 49 LYS A CE 1 ATOM 383 N NZ . LYS A 1 49 ? 4.050 28.780 5.540 1.00 38.39 ? 49 LYS A NZ 1 ATOM 384 N N . TYR A 1 50 ? -3.140 28.217 7.107 1.00 34.22 ? 50 TYR A N 1 ATOM 385 C CA . TYR A 1 50 ? -3.958 27.817 5.960 1.00 33.53 ? 50 TYR A CA 1 ATOM 386 C C . TYR A 1 50 ? -4.526 26.407 6.143 1.00 34.61 ? 50 TYR A C 1 ATOM 387 O O . TYR A 1 50 ? -4.217 25.476 5.397 1.00 29.06 ? 50 TYR A O 1 ATOM 388 C CB . TYR A 1 50 ? -3.162 27.932 4.656 1.00 19.83 ? 50 TYR A CB 1 ATOM 389 C CG . TYR A 1 50 ? -2.790 29.353 4.288 1.00 22.80 ? 50 TYR A CG 1 ATOM 390 C CD1 . TYR A 1 50 ? -3.741 30.233 3.783 1.00 23.23 ? 50 TYR A CD1 1 ATOM 391 C CD2 . TYR A 1 50 ? -1.488 29.813 4.443 1.00 33.42 ? 50 TYR A CD2 1 ATOM 392 C CE1 . TYR A 1 50 ? -3.404 31.535 3.446 1.00 24.59 ? 50 TYR A CE1 1 ATOM 393 C CE2 . TYR A 1 50 ? -1.141 31.112 4.108 1.00 26.84 ? 50 TYR A CE2 1 ATOM 394 C CZ . TYR A 1 50 ? -2.102 31.968 3.611 1.00 28.11 ? 50 TYR A CZ 1 ATOM 395 O OH . TYR A 1 50 ? -1.757 33.259 3.277 1.00 25.26 ? 50 TYR A OH 1 ATOM 396 N N . ALA A 1 51 ? -5.354 26.271 7.182 1.00 26.54 ? 51 ALA A N 1 ATOM 397 C CA . ALA A 1 51 ? -6.138 25.069 7.458 1.00 21.69 ? 51 ALA A CA 1 ATOM 398 C C . ALA A 1 51 ? -5.303 23.860 7.865 1.00 26.99 ? 51 ALA A C 1 ATOM 399 O O . ALA A 1 51 ? -5.595 23.231 8.887 1.00 22.12 ? 51 ALA A O 1 ATOM 400 C CB . ALA A 1 51 ? -7.011 24.705 6.252 1.00 29.01 ? 51 ALA A CB 1 ATOM 401 N N . SER A 1 52 ? -4.273 23.515 7.085 1.00 20.56 ? 52 SER A N 1 ATOM 402 C CA . SER A 1 52 ? -3.590 22.240 7.297 1.00 21.29 ? 52 SER A CA 1 ATOM 403 C C . SER A 1 52 ? -2.071 22.292 7.242 1.00 21.37 ? 52 SER A C 1 ATOM 404 O O . SER A 1 52 ? -1.444 21.266 7.527 1.00 22.04 ? 52 SER A O 1 ATOM 405 C CB . SER A 1 52 ? -4.073 21.203 6.268 1.00 28.18 ? 52 SER A CB 1 ATOM 406 O OG . SER A 1 52 ? -3.711 21.570 4.946 1.00 23.43 ? 52 SER A OG 1 ATOM 407 N N . GLU A 1 53 ? -1.454 23.414 6.884 1.00 20.89 ? 53 GLU A N 1 ATOM 408 C CA . GLU A 1 53 ? -0.021 23.441 6.635 1.00 26.21 ? 53 GLU A CA 1 ATOM 409 C C . GLU A 1 53 ? 0.762 23.522 7.940 1.00 31.46 ? 53 GLU A C 1 ATOM 410 O O . GLU A 1 53 ? 0.404 24.274 8.854 1.00 27.48 ? 53 GLU A O 1 ATOM 411 C CB . GLU A 1 53 ? 0.330 24.619 5.728 1.00 24.14 ? 53 GLU A CB 1 ATOM 412 C CG . GLU A 1 53 ? -0.477 24.654 4.439 1.00 30.81 ? 53 GLU A CG 1 ATOM 413 C CD . GLU A 1 53 ? -0.136 25.843 3.562 1.00 42.00 ? 53 GLU A CD 1 ATOM 414 O OE1 . GLU A 1 53 ? -0.528 25.845 2.372 1.00 44.67 ? 53 GLU A OE1 1 ATOM 415 O OE2 . GLU A 1 53 ? 0.526 26.776 4.065 1.00 42.75 ? 53 GLU A OE2 1 ATOM 416 N N . SER A 1 54 ? 1.839 22.741 8.016 1.00 37.52 ? 54 SER A N 1 ATOM 417 C CA . SER A 1 54 ? 2.637 22.648 9.229 1.00 37.31 ? 54 SER A CA 1 ATOM 418 C C . SER A 1 54 ? 3.467 23.911 9.445 1.00 38.48 ? 54 SER A C 1 ATOM 419 O O . SER A 1 54 ? 3.767 24.664 8.515 1.00 47.61 ? 54 SER A O 1 ATOM 420 C CB . SER A 1 54 ? 3.566 21.434 9.176 1.00 48.41 ? 54 SER A CB 1 ATOM 421 O OG . SER A 1 54 ? 2.835 20.225 9.261 1.00 64.13 ? 54 SER A OG 1 ATOM 422 N N . ILE A 1 55 ? 3.847 24.129 10.702 1.00 32.17 ? 55 ILE A N 1 ATOM 423 C CA . ILE A 1 55 ? 4.709 25.232 11.103 1.00 24.89 ? 55 ILE A CA 1 ATOM 424 C C . ILE A 1 55 ? 5.966 24.640 11.725 1.00 32.55 ? 55 ILE A C 1 ATOM 425 O O . ILE A 1 55 ? 5.899 23.623 12.423 1.00 37.86 ? 55 ILE A O 1 ATOM 426 C CB . ILE A 1 55 ? 3.999 26.179 12.096 1.00 26.29 ? 55 ILE A CB 1 ATOM 427 C CG1 . ILE A 1 55 ? 2.685 26.691 11.505 1.00 18.07 ? 55 ILE A CG1 1 ATOM 428 C CG2 . ILE A 1 55 ? 4.898 27.351 12.472 1.00 25.95 ? 55 ILE A CG2 1 ATOM 429 C CD1 . ILE A 1 55 ? 2.868 27.614 10.328 1.00 18.16 ? 55 ILE A CD1 1 ATOM 430 N N . SER A 1 56 ? 7.110 25.269 11.461 1.00 39.87 ? 56 SER A N 1 ATOM 431 C CA . SER A 1 56 ? 8.366 24.797 12.026 1.00 41.95 ? 56 SER A CA 1 ATOM 432 C C . SER A 1 56 ? 8.326 24.856 13.548 1.00 40.15 ? 56 SER A C 1 ATOM 433 O O . SER A 1 56 ? 7.722 25.756 14.140 1.00 39.63 ? 56 SER A O 1 ATOM 434 C CB . SER A 1 56 ? 9.533 25.635 11.505 1.00 47.01 ? 56 SER A CB 1 ATOM 435 O OG . SER A 1 56 ? 10.686 25.456 12.311 1.00 48.38 ? 56 SER A OG 1 ATOM 436 N N . GLY A 1 57 ? 8.976 23.881 14.184 1.00 37.14 ? 57 GLY A N 1 ATOM 437 C CA . GLY A 1 57 ? 9.059 23.824 15.627 1.00 32.96 ? 57 GLY A CA 1 ATOM 438 C C . GLY A 1 57 ? 7.799 23.392 16.341 1.00 31.89 ? 57 GLY A C 1 ATOM 439 O O . GLY A 1 57 ? 7.834 23.224 17.566 1.00 38.05 ? 57 GLY A O 1 ATOM 440 N N . ILE A 1 58 ? 6.689 23.212 15.633 1.00 31.72 ? 58 ILE A N 1 ATOM 441 C CA . ILE A 1 58 ? 5.442 22.769 16.251 1.00 31.78 ? 58 ILE A CA 1 ATOM 442 C C . ILE A 1 58 ? 5.423 21.246 16.264 1.00 27.32 ? 58 ILE A C 1 ATOM 443 O O . ILE A 1 58 ? 5.702 20.619 15.232 1.00 31.02 ? 58 ILE A O 1 ATOM 444 C CB . ILE A 1 58 ? 4.219 23.339 15.516 1.00 35.52 ? 58 ILE A CB 1 ATOM 445 C CG1 . ILE A 1 58 ? 4.244 24.866 15.564 1.00 31.12 ? 58 ILE A CG1 1 ATOM 446 C CG2 . ILE A 1 58 ? 2.928 22.810 16.127 1.00 26.76 ? 58 ILE A CG2 1 ATOM 447 C CD1 . ILE A 1 58 ? 4.361 25.416 16.962 1.00 22.25 ? 58 ILE A CD1 1 ATOM 448 N N . PRO A 1 59 ? 5.115 20.616 17.399 1.00 32.13 ? 59 PRO A N 1 ATOM 449 C CA . PRO A 1 59 ? 5.089 19.149 17.447 1.00 27.48 ? 59 PRO A CA 1 ATOM 450 C C . PRO A 1 59 ? 4.131 18.572 16.416 1.00 23.32 ? 59 PRO A C 1 ATOM 451 O O . PRO A 1 59 ? 3.114 19.176 16.070 1.00 22.60 ? 59 PRO A O 1 ATOM 452 C CB . PRO A 1 59 ? 4.620 18.850 18.875 1.00 34.12 ? 59 PRO A CB 1 ATOM 453 C CG . PRO A 1 59 ? 5.007 20.060 19.657 1.00 38.90 ? 59 PRO A CG 1 ATOM 454 C CD . PRO A 1 59 ? 4.857 21.221 18.717 1.00 31.84 ? 59 PRO A CD 1 ATOM 455 N N . SER A 1 60 ? 4.472 17.379 15.927 1.00 30.07 ? 60 SER A N 1 ATOM 456 C CA . SER A 1 60 ? 3.714 16.769 14.843 1.00 34.85 ? 60 SER A CA 1 ATOM 457 C C . SER A 1 60 ? 2.316 16.339 15.269 1.00 37.45 ? 60 SER A C 1 ATOM 458 O O . SER A 1 60 ? 1.468 16.105 14.402 1.00 24.64 ? 60 SER A O 1 ATOM 459 C CB . SER A 1 60 ? 4.473 15.567 14.283 1.00 26.77 ? 60 SER A CB 1 ATOM 460 O OG . SER A 1 60 ? 4.521 14.514 15.229 1.00 31.75 ? 60 SER A OG 1 ATOM 461 N N . ARG A 1 61 ? 2.051 16.228 16.573 1.00 31.55 ? 61 ARG A N 1 ATOM 462 C CA . ARG A 1 61 ? 0.722 15.821 17.013 1.00 27.55 ? 61 ARG A CA 1 ATOM 463 C C . ARG A 1 61 ? -0.338 16.878 16.735 1.00 32.12 ? 61 ARG A C 1 ATOM 464 O O . ARG A 1 61 ? -1.527 16.600 16.922 1.00 30.03 ? 61 ARG A O 1 ATOM 465 C CB . ARG A 1 61 ? 0.738 15.474 18.503 1.00 31.85 ? 61 ARG A CB 1 ATOM 466 C CG . ARG A 1 61 ? 0.921 16.654 19.436 1.00 37.61 ? 61 ARG A CG 1 ATOM 467 C CD . ARG A 1 61 ? 0.912 16.193 20.886 1.00 40.09 ? 61 ARG A CD 1 ATOM 468 N NE . ARG A 1 61 ? 1.140 17.297 21.811 1.00 35.39 ? 61 ARG A NE 1 ATOM 469 C CZ . ARG A 1 61 ? 2.344 17.742 22.156 1.00 32.97 ? 61 ARG A CZ 1 ATOM 470 N NH1 . ARG A 1 61 ? 3.431 17.176 21.648 1.00 34.94 ? 61 ARG A NH1 1 ATOM 471 N NH2 . ARG A 1 61 ? 2.463 18.753 23.005 1.00 34.73 ? 61 ARG A NH2 1 ATOM 472 N N . PHE A 1 62 ? 0.061 18.069 16.293 1.00 32.03 ? 62 PHE A N 1 ATOM 473 C CA . PHE A 1 62 ? -0.874 19.111 15.890 1.00 32.46 ? 62 PHE A CA 1 ATOM 474 C C . PHE A 1 62 ? -1.104 19.041 14.385 1.00 38.23 ? 62 PHE A C 1 ATOM 475 O O . PHE A 1 62 ? -0.147 18.979 13.607 1.00 50.65 ? 62 PHE A O 1 ATOM 476 C CB . PHE A 1 62 ? -0.342 20.492 16.273 1.00 29.00 ? 62 PHE A CB 1 ATOM 477 C CG . PHE A 1 62 ? -0.292 20.739 17.752 1.00 27.54 ? 62 PHE A CG 1 ATOM 478 C CD1 . PHE A 1 62 ? 0.832 20.402 18.489 1.00 38.89 ? 62 PHE A CD1 1 ATOM 479 C CD2 . PHE A 1 62 ? -1.364 21.322 18.404 1.00 18.56 ? 62 PHE A CD2 1 ATOM 480 C CE1 . PHE A 1 62 ? 0.883 20.633 19.853 1.00 29.70 ? 62 PHE A CE1 1 ATOM 481 C CE2 . PHE A 1 62 ? -1.320 21.556 19.765 1.00 21.66 ? 62 PHE A CE2 1 ATOM 482 C CZ . PHE A 1 62 ? -0.195 21.210 20.492 1.00 23.84 ? 62 PHE A CZ 1 ATOM 483 N N . SER A 1 63 ? -2.372 19.052 13.981 1.00 40.46 ? 63 SER A N 1 ATOM 484 C CA . SER A 1 63 ? -2.729 19.077 12.569 1.00 39.02 ? 63 SER A CA 1 ATOM 485 C C . SER A 1 63 ? -4.075 19.770 12.420 1.00 32.63 ? 63 SER A C 1 ATOM 486 O O . SER A 1 63 ? -4.789 20.006 13.398 1.00 32.53 ? 63 SER A O 1 ATOM 487 C CB . SER A 1 63 ? -2.771 17.667 11.967 1.00 36.11 ? 63 SER A CB 1 ATOM 488 O OG . SER A 1 63 ? -3.856 16.919 12.487 1.00 23.18 ? 63 SER A OG 1 ATOM 489 N N . GLY A 1 64 ? -4.418 20.096 11.176 1.00 24.96 ? 64 GLY A N 1 ATOM 490 C CA . GLY A 1 64 ? -5.658 20.786 10.897 1.00 20.48 ? 64 GLY A CA 1 ATOM 491 C C . GLY A 1 64 ? -6.250 20.339 9.577 1.00 28.24 ? 64 GLY A C 1 ATOM 492 O O . GLY A 1 64 ? -5.565 19.786 8.715 1.00 33.99 ? 64 GLY A O 1 ATOM 493 N N . SER A 1 65 ? -7.548 20.593 9.436 1.00 21.69 ? 65 SER A N 1 ATOM 494 C CA . SER A 1 65 ? -8.272 20.239 8.224 1.00 31.15 ? 65 SER A CA 1 ATOM 495 C C . SER A 1 65 ? -9.501 21.131 8.122 1.00 32.32 ? 65 SER A C 1 ATOM 496 O O . SER A 1 65 ? -9.836 21.869 9.051 1.00 30.59 ? 65 SER A O 1 ATOM 497 C CB . SER A 1 65 ? -8.662 18.756 8.216 1.00 28.24 ? 65 SER A CB 1 ATOM 498 O OG . SER A 1 65 ? -9.550 18.457 9.280 1.00 30.26 ? 65 SER A OG 1 ATOM 499 N N . GLY A 1 66 ? -10.165 21.057 6.978 1.00 33.13 ? 66 GLY A N 1 ATOM 500 C CA . GLY A 1 66 ? -11.378 21.809 6.730 1.00 27.67 ? 66 GLY A CA 1 ATOM 501 C C . GLY A 1 66 ? -11.253 22.721 5.523 1.00 28.23 ? 66 GLY A C 1 ATOM 502 O O . GLY A 1 66 ? -10.168 22.978 5.002 1.00 24.14 ? 66 GLY A O 1 ATOM 503 N N . SER A 1 67 ? -12.414 23.209 5.091 1.00 33.09 ? 67 SER A N 1 ATOM 504 C CA . SER A 1 67 ? -12.526 24.121 3.959 1.00 41.03 ? 67 SER A CA 1 ATOM 505 C C . SER A 1 67 ? -13.934 24.697 3.937 1.00 41.61 ? 67 SER A C 1 ATOM 506 O O . SER A 1 67 ? -14.882 24.069 4.419 1.00 46.23 ? 67 SER A O 1 ATOM 507 C CB . SER A 1 67 ? -12.218 23.419 2.630 1.00 43.59 ? 67 SER A CB 1 ATOM 508 O OG . SER A 1 67 ? -13.190 22.431 2.338 1.00 49.94 ? 67 SER A OG 1 ATOM 509 N N . GLY A 1 68 ? -14.057 25.897 3.374 1.00 25.81 ? 68 GLY A N 1 ATOM 510 C CA . GLY A 1 68 ? -15.343 26.563 3.301 1.00 30.22 ? 68 GLY A CA 1 ATOM 511 C C . GLY A 1 68 ? -15.698 27.314 4.567 1.00 29.63 ? 68 GLY A C 1 ATOM 512 O O . GLY A 1 68 ? -15.298 28.469 4.744 1.00 29.45 ? 68 GLY A O 1 ATOM 513 N N . THR A 1 69 ? -16.456 26.669 5.458 1.00 30.83 ? 69 THR A N 1 ATOM 514 C CA . THR A 1 69 ? -16.840 27.282 6.722 1.00 28.83 ? 69 THR A CA 1 ATOM 515 C C . THR A 1 69 ? -16.528 26.437 7.949 1.00 29.54 ? 69 THR A C 1 ATOM 516 O O . THR A 1 69 ? -16.560 26.977 9.059 1.00 33.18 ? 69 THR A O 1 ATOM 517 C CB . THR A 1 69 ? -18.342 27.616 6.733 1.00 28.22 ? 69 THR A CB 1 ATOM 518 O OG1 . THR A 1 69 ? -19.103 26.442 6.425 1.00 31.59 ? 69 THR A OG1 1 ATOM 519 C CG2 . THR A 1 69 ? -18.664 28.705 5.721 1.00 26.40 ? 69 THR A CG2 1 ATOM 520 N N . ASP A 1 70 ? -16.220 25.151 7.798 1.00 30.71 ? 70 ASP A N 1 ATOM 521 C CA . ASP A 1 70 ? -16.045 24.241 8.925 1.00 29.89 ? 70 ASP A CA 1 ATOM 522 C C . ASP A 1 70 ? -14.593 23.777 8.979 1.00 29.21 ? 70 ASP A C 1 ATOM 523 O O . ASP A 1 70 ? -14.122 23.092 8.064 1.00 34.94 ? 70 ASP A O 1 ATOM 524 C CB . ASP A 1 70 ? -16.997 23.049 8.804 1.00 31.86 ? 70 ASP A CB 1 ATOM 525 C CG . ASP A 1 70 ? -17.026 22.193 10.054 1.00 45.78 ? 70 ASP A CG 1 ATOM 526 O OD1 . ASP A 1 70 ? -16.501 22.640 11.094 1.00 49.17 ? 70 ASP A OD1 1 ATOM 527 O OD2 . ASP A 1 70 ? -17.588 21.078 9.998 1.00 49.84 ? 70 ASP A OD2 1 ATOM 528 N N . PHE A 1 71 ? -13.894 24.136 10.055 1.00 26.35 ? 71 PHE A N 1 ATOM 529 C CA . PHE A 1 71 ? -12.475 23.840 10.199 1.00 28.10 ? 71 PHE A CA 1 ATOM 530 C C . PHE A 1 71 ? -12.217 23.165 11.537 1.00 28.59 ? 71 PHE A C 1 ATOM 531 O O . PHE A 1 71 ? -12.907 23.426 12.527 1.00 31.77 ? 71 PHE A O 1 ATOM 532 C CB . PHE A 1 71 ? -11.630 25.112 10.081 1.00 28.35 ? 71 PHE A CB 1 ATOM 533 C CG . PHE A 1 71 ? -11.908 25.903 8.837 1.00 29.87 ? 71 PHE A CG 1 ATOM 534 C CD1 . PHE A 1 71 ? -11.211 25.647 7.668 1.00 20.74 ? 71 PHE A CD1 1 ATOM 535 C CD2 . PHE A 1 71 ? -12.877 26.892 8.832 1.00 26.34 ? 71 PHE A CD2 1 ATOM 536 C CE1 . PHE A 1 71 ? -11.468 26.370 6.520 1.00 27.73 ? 71 PHE A CE1 1 ATOM 537 C CE2 . PHE A 1 71 ? -13.141 27.617 7.687 1.00 34.24 ? 71 PHE A CE2 1 ATOM 538 C CZ . PHE A 1 71 ? -12.435 27.357 6.530 1.00 33.49 ? 71 PHE A CZ 1 ATOM 539 N N . THR A 1 72 ? -11.206 22.298 11.563 1.00 29.71 ? 72 THR A N 1 ATOM 540 C CA . THR A 1 72 ? -10.938 21.475 12.736 1.00 31.79 ? 72 THR A CA 1 ATOM 541 C C . THR A 1 72 ? -9.445 21.440 13.022 1.00 23.14 ? 72 THR A C 1 ATOM 542 O O . THR A 1 72 ? -8.648 21.087 12.146 1.00 22.14 ? 72 THR A O 1 ATOM 543 C CB . THR A 1 72 ? -11.480 20.054 12.547 1.00 33.57 ? 72 THR A CB 1 ATOM 544 O OG1 . THR A 1 72 ? -12.912 20.093 12.495 1.00 34.58 ? 72 THR A OG1 1 ATOM 545 C CG2 . THR A 1 72 ? -11.044 19.160 13.696 1.00 21.95 ? 72 THR A CG2 1 ATOM 546 N N . LEU A 1 73 ? -9.077 21.809 14.246 1.00 21.14 ? 73 LEU A N 1 ATOM 547 C CA . LEU A 1 73 ? -7.729 21.631 14.768 1.00 23.90 ? 73 LEU A CA 1 ATOM 548 C C . LEU A 1 73 ? -7.710 20.380 15.635 1.00 23.62 ? 73 LEU A C 1 ATOM 549 O O . LEU A 1 73 ? -8.588 20.199 16.485 1.00 26.30 ? 73 LEU A O 1 ATOM 550 C CB . LEU A 1 73 ? -7.295 22.849 15.585 1.00 24.37 ? 73 LEU A CB 1 ATOM 551 C CG . LEU A 1 73 ? -6.009 22.709 16.401 1.00 19.91 ? 73 LEU A CG 1 ATOM 552 C CD1 . LEU A 1 73 ? -4.794 22.649 15.490 1.00 20.20 ? 73 LEU A CD1 1 ATOM 553 C CD2 . LEU A 1 73 ? -5.881 23.843 17.405 1.00 21.14 ? 73 LEU A CD2 1 ATOM 554 N N . SER A 1 74 ? -6.720 19.519 15.421 1.00 28.44 ? 74 SER A N 1 ATOM 555 C CA . SER A 1 74 ? -6.687 18.221 16.079 1.00 27.17 ? 74 SER A CA 1 ATOM 556 C C . SER A 1 74 ? -5.354 17.989 16.775 1.00 30.02 ? 74 SER A C 1 ATOM 557 O O . SER A 1 74 ? -4.296 18.375 16.269 1.00 31.70 ? 74 SER A O 1 ATOM 558 C CB . SER A 1 74 ? -6.949 17.091 15.077 1.00 29.01 ? 74 SER A CB 1 ATOM 559 O OG . SER A 1 74 ? -8.279 17.145 14.593 1.00 40.81 ? 74 SER A OG 1 ATOM 560 N N . ILE A 1 75 ? -5.426 17.359 17.945 1.00 21.34 ? 75 ILE A N 1 ATOM 561 C CA . ILE A 1 75 ? -4.270 16.821 18.653 1.00 30.46 ? 75 ILE A CA 1 ATOM 562 C C . ILE A 1 75 ? -4.536 15.338 18.859 1.00 31.02 ? 75 ILE A C 1 ATOM 563 O O . ILE A 1 75 ? -5.504 14.969 19.533 1.00 42.02 ? 75 ILE A O 1 ATOM 564 C CB . ILE A 1 75 ? -4.034 17.526 20.000 1.00 25.85 ? 75 ILE A CB 1 ATOM 565 C CG1 . ILE A 1 75 ? -4.120 19.044 19.842 1.00 19.80 ? 75 ILE A CG1 1 ATOM 566 C CG2 . ILE A 1 75 ? -2.682 17.132 20.577 1.00 21.75 ? 75 ILE A CG2 1 ATOM 567 C CD1 . ILE A 1 75 ? -4.053 19.791 21.153 1.00 19.25 ? 75 ILE A CD1 1 ATOM 568 N N . ASN A 1 76 ? -3.689 14.488 18.278 1.00 43.56 ? 76 ASN A N 1 ATOM 569 C CA . ASN A 1 76 ? -3.961 13.055 18.262 1.00 49.30 ? 76 ASN A CA 1 ATOM 570 C C . ASN A 1 76 ? -3.521 12.332 19.530 1.00 52.31 ? 76 ASN A C 1 ATOM 571 O O . ASN A 1 76 ? -3.848 11.151 19.690 1.00 69.06 ? 76 ASN A O 1 ATOM 572 C CB . ASN A 1 76 ? -3.300 12.398 17.042 1.00 58.63 ? 76 ASN A CB 1 ATOM 573 C CG . ASN A 1 76 ? -1.817 12.700 16.941 1.00 71.53 ? 76 ASN A CG 1 ATOM 574 O OD1 . ASN A 1 76 ? -1.181 13.088 17.918 1.00 79.86 ? 76 ASN A OD1 1 ATOM 575 N ND2 . ASN A 1 76 ? -1.259 12.519 15.748 1.00 72.10 ? 76 ASN A ND2 1 ATOM 576 N N . SER A 1 77 ? -2.796 13.000 20.430 1.00 43.80 ? 77 SER A N 1 ATOM 577 C CA . SER A 1 77 ? -2.375 12.369 21.685 1.00 40.40 ? 77 SER A CA 1 ATOM 578 C C . SER A 1 77 ? -2.019 13.500 22.657 1.00 39.54 ? 77 SER A C 1 ATOM 579 O O . SER A 1 77 ? -0.874 13.951 22.702 1.00 38.78 ? 77 SER A O 1 ATOM 580 C CB . SER A 1 77 ? -1.210 11.421 21.478 1.00 42.64 ? 77 SER A CB 1 ATOM 581 O OG . SER A 1 77 ? -1.012 10.598 22.614 1.00 46.07 ? 77 SER A OG 1 ATOM 582 N N . VAL A 1 78 ? -3.015 13.937 23.430 1.00 32.32 ? 78 VAL A N 1 ATOM 583 C CA . VAL A 1 78 ? -2.855 15.116 24.272 1.00 38.40 ? 78 VAL A CA 1 ATOM 584 C C . VAL A 1 78 ? -1.837 14.847 25.371 1.00 38.36 ? 78 VAL A C 1 ATOM 585 O O . VAL A 1 78 ? -1.853 13.792 26.021 1.00 41.28 ? 78 VAL A O 1 ATOM 586 C CB . VAL A 1 78 ? -4.211 15.539 24.863 1.00 32.78 ? 78 VAL A CB 1 ATOM 587 C CG1 . VAL A 1 78 ? -4.040 16.699 25.827 1.00 26.26 ? 78 VAL A CG1 1 ATOM 588 C CG2 . VAL A 1 78 ? -5.174 15.911 23.756 1.00 34.38 ? 78 VAL A CG2 1 ATOM 589 N N . GLU A 1 79 ? -0.940 15.804 25.579 1.00 29.81 ? 79 GLU A N 1 ATOM 590 C CA . GLU A 1 79 ? 0.022 15.782 26.668 1.00 34.48 ? 79 GLU A CA 1 ATOM 591 C C . GLU A 1 79 ? -0.287 16.905 27.651 1.00 36.06 ? 79 GLU A C 1 ATOM 592 O O . GLU A 1 79 ? -1.045 17.834 27.355 1.00 26.41 ? 79 GLU A O 1 ATOM 593 C CB . GLU A 1 79 ? 1.452 15.905 26.133 1.00 38.08 ? 79 GLU A CB 1 ATOM 594 C CG . GLU A 1 79 ? 1.910 14.684 25.350 1.00 55.35 ? 79 GLU A CG 1 ATOM 595 C CD . GLU A 1 79 ? 3.192 14.928 24.580 1.00 71.70 ? 79 GLU A CD 1 ATOM 596 O OE1 . GLU A 1 79 ? 3.742 16.046 24.674 1.00 70.53 ? 79 GLU A OE1 1 ATOM 597 O OE2 . GLU A 1 79 ? 3.648 14.000 23.878 1.00 80.67 ? 79 GLU A OE2 1 ATOM 598 N N . SER A 1 80 ? 0.312 16.802 28.841 1.00 33.18 ? 80 SER A N 1 ATOM 599 C CA . SER A 1 80 ? 0.042 17.775 29.896 1.00 28.28 ? 80 SER A CA 1 ATOM 600 C C . SER A 1 80 ? 0.448 19.185 29.482 1.00 28.23 ? 80 SER A C 1 ATOM 601 O O . SER A 1 80 ? -0.215 20.158 29.857 1.00 26.28 ? 80 SER A O 1 ATOM 602 C CB . SER A 1 80 ? 0.760 17.368 31.184 1.00 43.18 ? 80 SER A CB 1 ATOM 603 O OG . SER A 1 80 ? 2.164 17.315 30.995 1.00 61.57 ? 80 SER A OG 1 ATOM 604 N N . GLU A 1 81 ? 1.519 19.316 28.700 1.00 27.18 ? 81 GLU A N 1 ATOM 605 C CA . GLU A 1 81 ? 1.982 20.627 28.263 1.00 26.26 ? 81 GLU A CA 1 ATOM 606 C C . GLU A 1 81 ? 1.061 21.268 27.229 1.00 33.88 ? 81 GLU A C 1 ATOM 607 O O . GLU A 1 81 ? 1.362 22.374 26.769 1.00 41.91 ? 81 GLU A O 1 ATOM 608 C CB . GLU A 1 81 ? 3.402 20.519 27.699 1.00 36.74 ? 81 GLU A CB 1 ATOM 609 C CG . GLU A 1 81 ? 4.462 20.051 28.704 1.00 52.68 ? 81 GLU A CG 1 ATOM 610 C CD . GLU A 1 81 ? 4.484 18.541 28.904 1.00 60.15 ? 81 GLU A CD 1 ATOM 611 O OE1 . GLU A 1 81 ? 3.686 17.835 28.249 1.00 61.36 ? 81 GLU A OE1 1 ATOM 612 O OE2 . GLU A 1 81 ? 5.303 18.060 29.717 1.00 57.10 ? 81 GLU A OE2 1 ATOM 613 N N . ASP A 1 82 ? -0.038 20.614 26.853 1.00 25.22 ? 82 ASP A N 1 ATOM 614 C CA . ASP A 1 82 ? -0.983 21.156 25.887 1.00 22.54 ? 82 ASP A CA 1 ATOM 615 C C . ASP A 1 82 ? -2.113 21.941 26.538 1.00 20.76 ? 82 ASP A C 1 ATOM 616 O O . ASP A 1 82 ? -3.012 22.410 25.828 1.00 24.93 ? 82 ASP A O 1 ATOM 617 C CB . ASP A 1 82 ? -1.572 20.030 25.032 1.00 23.46 ? 82 ASP A CB 1 ATOM 618 C CG . ASP A 1 82 ? -0.542 19.387 24.126 1.00 25.41 ? 82 ASP A CG 1 ATOM 619 O OD1 . ASP A 1 82 ? 0.417 20.083 23.730 1.00 31.90 ? 82 ASP A OD1 1 ATOM 620 O OD2 . ASP A 1 82 ? -0.691 18.189 23.806 1.00 27.01 ? 82 ASP A OD2 1 ATOM 621 N N . ILE A 1 83 ? -2.095 22.086 27.861 1.00 21.03 ? 83 ILE A N 1 ATOM 622 C CA . ILE A 1 83 ? -3.090 22.896 28.554 1.00 26.15 ? 83 ILE A CA 1 ATOM 623 C C . ILE A 1 83 ? -2.917 24.350 28.132 1.00 22.48 ? 83 ILE A C 1 ATOM 624 O O . ILE A 1 83 ? -1.885 24.973 28.411 1.00 30.06 ? 83 ILE A O 1 ATOM 625 C CB . ILE A 1 83 ? -2.957 22.735 30.073 1.00 31.14 ? 83 ILE A CB 1 ATOM 626 C CG1 . ILE A 1 83 ? -3.244 21.284 30.476 1.00 40.51 ? 83 ILE A CG1 1 ATOM 627 C CG2 . ILE A 1 83 ? -3.875 23.710 30.800 1.00 19.04 ? 83 ILE A CG2 1 ATOM 628 C CD1 . ILE A 1 83 ? -2.965 20.977 31.932 1.00 43.09 ? 83 ILE A CD1 1 ATOM 629 N N . ALA A 1 84 ? -3.922 24.892 27.457 1.00 17.18 ? 84 ALA A N 1 ATOM 630 C CA . ALA A 1 84 ? -3.881 26.261 26.949 1.00 24.68 ? 84 ALA A CA 1 ATOM 631 C C . ALA A 1 84 ? -5.270 26.614 26.429 1.00 26.68 ? 84 ALA A C 1 ATOM 632 O O . ALA A 1 84 ? -6.230 25.853 26.597 1.00 28.45 ? 84 ALA A O 1 ATOM 633 C CB . ALA A 1 84 ? -2.821 26.417 25.856 1.00 27.57 ? 84 ALA A CB 1 ATOM 634 N N . ASP A 1 85 ? -5.375 27.785 25.810 1.00 29.42 ? 85 ASP A N 1 ATOM 635 C CA . ASP A 1 85 ? -6.512 28.160 24.989 1.00 24.01 ? 85 ASP A CA 1 ATOM 636 C C . ASP A 1 85 ? -6.077 28.140 23.531 1.00 24.80 ? 85 ASP A C 1 ATOM 637 O O . ASP A 1 85 ? -4.907 28.374 23.215 1.00 29.14 ? 85 ASP A O 1 ATOM 638 C CB . ASP A 1 85 ? -7.039 29.549 25.361 1.00 25.41 ? 85 ASP A CB 1 ATOM 639 C CG . ASP A 1 85 ? -7.188 29.736 26.857 1.00 28.60 ? 85 ASP A CG 1 ATOM 640 O OD1 . ASP A 1 85 ? -7.527 28.754 27.550 1.00 30.19 ? 85 ASP A OD1 1 ATOM 641 O OD2 . ASP A 1 85 ? -6.962 30.865 27.342 1.00 35.11 ? 85 ASP A OD2 1 ATOM 642 N N . TYR A 1 86 ? -7.019 27.851 22.640 1.00 24.39 ? 86 TYR A N 1 ATOM 643 C CA . TYR A 1 86 ? -6.719 27.733 21.221 1.00 23.67 ? 86 TYR A CA 1 ATOM 644 C C . TYR A 1 86 ? -7.665 28.620 20.430 1.00 23.49 ? 86 TYR A C 1 ATOM 645 O O . TYR A 1 86 ? -8.883 28.575 20.635 1.00 25.06 ? 86 TYR A O 1 ATOM 646 C CB . TYR A 1 86 ? -6.815 26.276 20.761 1.00 22.09 ? 86 TYR A CB 1 ATOM 647 C CG . TYR A 1 86 ? -5.788 25.381 21.420 1.00 22.01 ? 86 TYR A CG 1 ATOM 648 C CD1 . TYR A 1 86 ? -6.042 24.784 22.648 1.00 21.34 ? 86 TYR A CD1 1 ATOM 649 C CD2 . TYR A 1 86 ? -4.558 25.147 20.821 1.00 17.29 ? 86 TYR A CD2 1 ATOM 650 C CE1 . TYR A 1 86 ? -5.101 23.971 23.255 1.00 24.68 ? 86 TYR A CE1 1 ATOM 651 C CE2 . TYR A 1 86 ? -3.613 24.335 21.420 1.00 20.77 ? 86 TYR A CE2 1 ATOM 652 C CZ . TYR A 1 86 ? -3.888 23.751 22.636 1.00 24.36 ? 86 TYR A CZ 1 ATOM 653 O OH . TYR A 1 86 ? -2.946 22.945 23.234 1.00 23.65 ? 86 TYR A OH 1 ATOM 654 N N . TYR A 1 87 ? -7.099 29.424 19.532 1.00 13.80 ? 87 TYR A N 1 ATOM 655 C CA . TYR A 1 87 ? -7.845 30.391 18.744 1.00 19.72 ? 87 TYR A CA 1 ATOM 656 C C . TYR A 1 87 ? -7.676 30.109 17.259 1.00 14.24 ? 87 TYR A C 1 ATOM 657 O O . TYR A 1 87 ? -6.637 29.605 16.822 1.00 14.95 ? 87 TYR A O 1 ATOM 658 C CB . TYR A 1 87 ? -7.378 31.819 19.034 1.00 23.72 ? 87 TYR A CB 1 ATOM 659 C CG . TYR A 1 87 ? -7.612 32.263 20.456 1.00 27.91 ? 87 TYR A CG 1 ATOM 660 C CD1 . TYR A 1 87 ? -6.669 32.018 21.446 1.00 25.75 ? 87 TYR A CD1 1 ATOM 661 C CD2 . TYR A 1 87 ? -8.776 32.928 20.811 1.00 24.64 ? 87 TYR A CD2 1 ATOM 662 C CE1 . TYR A 1 87 ? -6.880 32.424 22.752 1.00 20.52 ? 87 TYR A CE1 1 ATOM 663 C CE2 . TYR A 1 87 ? -8.997 33.338 22.113 1.00 29.51 ? 87 TYR A CE2 1 ATOM 664 C CZ . TYR A 1 87 ? -8.045 33.084 23.081 1.00 25.07 ? 87 TYR A CZ 1 ATOM 665 O OH . TYR A 1 87 ? -8.257 33.491 24.381 1.00 27.59 ? 87 TYR A OH 1 ATOM 666 N N . CYS A 1 88 ? -8.703 30.448 16.488 1.00 22.06 ? 88 CYS A N 1 ATOM 667 C CA . CYS A 1 88 ? -8.622 30.453 15.036 1.00 19.66 ? 88 CYS A CA 1 ATOM 668 C C . CYS A 1 88 ? -8.670 31.885 14.521 1.00 14.78 ? 88 CYS A C 1 ATOM 669 O O . CYS A 1 88 ? -9.202 32.789 15.170 1.00 24.29 ? 88 CYS A O 1 ATOM 670 C CB . CYS A 1 88 ? -9.747 29.626 14.405 1.00 16.32 ? 88 CYS A CB 1 ATOM 671 S SG . CYS A 1 88 ? -11.430 30.180 14.760 1.00 24.75 ? 88 CYS A SG 1 ATOM 672 N N . GLN A 1 89 ? -8.096 32.080 13.337 1.00 22.94 ? 89 GLN A N 1 ATOM 673 C CA . GLN A 1 89 ? -8.008 33.392 12.709 1.00 15.39 ? 89 GLN A CA 1 ATOM 674 C C . GLN A 1 89 ? -8.269 33.243 11.221 1.00 24.76 ? 89 GLN A C 1 ATOM 675 O O . GLN A 1 89 ? -7.676 32.375 10.577 1.00 33.11 ? 89 GLN A O 1 ATOM 676 C CB . GLN A 1 89 ? -6.628 34.016 12.938 1.00 15.24 ? 89 GLN A CB 1 ATOM 677 C CG . GLN A 1 89 ? -6.379 35.283 12.141 1.00 20.89 ? 89 GLN A CG 1 ATOM 678 C CD . GLN A 1 89 ? -4.917 35.462 11.778 1.00 16.36 ? 89 GLN A CD 1 ATOM 679 O OE1 . GLN A 1 89 ? -4.124 34.527 11.874 1.00 17.00 ? 89 GLN A OE1 1 ATOM 680 N NE2 . GLN A 1 89 ? -4.555 36.666 11.354 1.00 18.32 ? 89 GLN A NE2 1 ATOM 681 N N . GLN A 1 90 ? -9.148 34.081 10.675 1.00 25.01 ? 90 GLN A N 1 ATOM 682 C CA . GLN A 1 90 ? -9.412 34.094 9.243 1.00 18.25 ? 90 GLN A CA 1 ATOM 683 C C . GLN A 1 90 ? -8.758 35.316 8.613 1.00 19.12 ? 90 GLN A C 1 ATOM 684 O O . GLN A 1 90 ? -8.680 36.380 9.232 1.00 28.30 ? 90 GLN A O 1 ATOM 685 C CB . GLN A 1 90 ? -10.918 34.082 8.948 1.00 19.43 ? 90 GLN A CB 1 ATOM 686 C CG . GLN A 1 90 ? -11.663 35.384 9.244 1.00 26.40 ? 90 GLN A CG 1 ATOM 687 C CD . GLN A 1 90 ? -11.625 36.372 8.086 1.00 31.25 ? 90 GLN A CD 1 ATOM 688 O OE1 . GLN A 1 90 ? -11.314 36.008 6.950 1.00 21.54 ? 90 GLN A OE1 1 ATOM 689 N NE2 . GLN A 1 90 ? -11.931 37.631 8.374 1.00 32.61 ? 90 GLN A NE2 1 ATOM 690 N N . ASN A 1 91 ? -8.281 35.153 7.377 1.00 24.09 ? 91 ASN A N 1 ATOM 691 C CA . ASN A 1 91 ? -7.706 36.263 6.628 1.00 27.62 ? 91 ASN A CA 1 ATOM 692 C C . ASN A 1 91 ? -8.122 36.204 5.162 1.00 32.84 ? 91 ASN A C 1 ATOM 693 O O . ASN A 1 91 ? -7.371 36.627 4.276 1.00 36.28 ? 91 ASN A O 1 ATOM 694 C CB . ASN A 1 91 ? -6.180 36.288 6.756 1.00 26.17 ? 91 ASN A CB 1 ATOM 695 C CG . ASN A 1 91 ? -5.573 37.592 6.266 1.00 38.05 ? 91 ASN A CG 1 ATOM 696 O OD1 . ASN A 1 91 ? -4.575 37.591 5.549 1.00 45.93 ? 91 ASN A OD1 1 ATOM 697 N ND2 . ASN A 1 91 ? -6.194 38.711 6.629 1.00 17.84 ? 91 ASN A ND2 1 ATOM 698 N N . ASN A 1 92 ? -9.312 35.666 4.886 1.00 31.83 ? 92 ASN A N 1 ATOM 699 C CA . ASN A 1 92 ? -9.868 35.697 3.540 1.00 31.38 ? 92 ASN A CA 1 ATOM 700 C C . ASN A 1 92 ? -10.597 36.999 3.243 1.00 30.28 ? 92 ASN A C 1 ATOM 701 O O . ASN A 1 92 ? -10.810 37.320 2.068 1.00 25.43 ? 92 ASN A O 1 ATOM 702 C CB . ASN A 1 92 ? -10.826 34.518 3.328 1.00 31.08 ? 92 ASN A CB 1 ATOM 703 C CG . ASN A 1 92 ? -11.302 34.402 1.887 1.00 33.62 ? 92 ASN A CG 1 ATOM 704 O OD1 . ASN A 1 92 ? -12.424 34.785 1.557 1.00 30.86 ? 92 ASN A OD1 1 ATOM 705 N ND2 . ASN A 1 92 ? -10.441 33.881 1.021 1.00 36.93 ? 92 ASN A ND2 1 ATOM 706 N N . ASN A 1 93 ? -10.976 37.754 4.274 1.00 33.79 ? 93 ASN A N 1 ATOM 707 C CA A ASN A 1 93 ? -11.680 39.017 4.099 0.62 31.35 ? 93 ASN A CA 1 ATOM 708 C CA B ASN A 1 93 ? -11.685 39.016 4.102 0.38 31.66 ? 93 ASN A CA 1 ATOM 709 C C . ASN A 1 93 ? -11.162 40.022 5.116 1.00 28.61 ? 93 ASN A C 1 ATOM 710 O O . ASN A 1 93 ? -11.098 39.725 6.312 1.00 27.21 ? 93 ASN A O 1 ATOM 711 C CB A ASN A 1 93 ? -13.197 38.843 4.259 0.62 35.88 ? 93 ASN A CB 1 ATOM 712 C CB B ASN A 1 93 ? -13.199 38.826 4.270 0.38 36.42 ? 93 ASN A CB 1 ATOM 713 C CG A ASN A 1 93 ? -13.805 37.960 3.183 0.62 42.09 ? 93 ASN A CG 1 ATOM 714 C CG B ASN A 1 93 ? -14.003 39.978 3.694 0.38 40.98 ? 93 ASN A CG 1 ATOM 715 O OD1 A ASN A 1 93 ? -14.101 38.421 2.078 0.62 46.23 ? 93 ASN A OD1 1 ATOM 716 O OD1 B ASN A 1 93 ? -13.565 41.128 3.706 0.38 41.75 ? 93 ASN A OD1 1 ATOM 717 N ND2 A ASN A 1 93 ? -14.008 36.687 3.507 0.62 26.49 ? 93 ASN A ND2 1 ATOM 718 N ND2 B ASN A 1 93 ? -15.189 39.670 3.181 0.38 45.66 ? 93 ASN A ND2 1 ATOM 719 N N . TRP A 1 94 ? -10.795 41.205 4.635 1.00 33.59 ? 94 TRP A N 1 ATOM 720 C CA . TRP A 1 94 ? -10.302 42.283 5.484 1.00 26.22 ? 94 TRP A CA 1 ATOM 721 C C . TRP A 1 94 ? -11.456 42.893 6.276 1.00 30.13 ? 94 TRP A C 1 ATOM 722 O O . TRP A 1 94 ? -12.515 43.161 5.713 1.00 28.49 ? 94 TRP A O 1 ATOM 723 C CB . TRP A 1 94 ? -9.608 43.350 4.628 1.00 32.07 ? 94 TRP A CB 1 ATOM 724 C CG . TRP A 1 94 ? -8.869 44.393 5.410 1.00 28.52 ? 94 TRP A CG 1 ATOM 725 C CD1 . TRP A 1 94 ? -7.529 44.431 5.659 1.00 25.03 ? 94 TRP A CD1 1 ATOM 726 C CD2 . TRP A 1 94 ? -9.429 45.557 6.036 1.00 32.97 ? 94 TRP A CD2 1 ATOM 727 N NE1 . TRP A 1 94 ? -7.219 45.542 6.401 1.00 27.92 ? 94 TRP A NE1 1 ATOM 728 C CE2 . TRP A 1 94 ? -8.364 46.247 6.648 1.00 30.86 ? 94 TRP A CE2 1 ATOM 729 C CE3 . TRP A 1 94 ? -10.722 46.077 6.139 1.00 26.86 ? 94 TRP A CE3 1 ATOM 730 C CZ2 . TRP A 1 94 ? -8.557 47.433 7.355 1.00 25.86 ? 94 TRP A CZ2 1 ATOM 731 C CZ3 . TRP A 1 94 ? -10.910 47.253 6.843 1.00 20.15 ? 94 TRP A CZ3 1 ATOM 732 C CH2 . TRP A 1 94 ? -9.833 47.917 7.443 1.00 22.46 ? 94 TRP A CH2 1 ATOM 733 N N . PRO A 1 95 ? -11.253 43.126 7.585 1.00 32.40 ? 95 PRO A N 1 ATOM 734 C CA . PRO A 1 95 ? -9.997 42.860 8.289 1.00 28.77 ? 95 PRO A CA 1 ATOM 735 C C . PRO A 1 95 ? -9.932 41.443 8.845 1.00 20.82 ? 95 PRO A C 1 ATOM 736 O O . PRO A 1 95 ? -10.971 40.807 9.020 1.00 19.61 ? 95 PRO A O 1 ATOM 737 C CB . PRO A 1 95 ? -10.026 43.880 9.423 1.00 32.87 ? 95 PRO A CB 1 ATOM 738 C CG . PRO A 1 95 ? -11.482 43.958 9.773 1.00 18.13 ? 95 PRO A CG 1 ATOM 739 C CD . PRO A 1 95 ? -12.242 43.767 8.474 1.00 19.89 ? 95 PRO A CD 1 ATOM 740 N N . THR A 1 96 ? -8.723 40.962 9.120 1.00 22.30 ? 96 THR A N 1 ATOM 741 C CA . THR A 1 96 ? -8.560 39.649 9.726 1.00 22.95 ? 96 THR A CA 1 ATOM 742 C C . THR A 1 96 ? -9.173 39.640 11.125 1.00 15.81 ? 96 THR A C 1 ATOM 743 O O . THR A 1 96 ? -9.081 40.620 11.869 1.00 18.10 ? 96 THR A O 1 ATOM 744 C CB . THR A 1 96 ? -7.076 39.271 9.773 1.00 15.57 ? 96 THR A CB 1 ATOM 745 O OG1 . THR A 1 96 ? -6.923 37.963 10.335 1.00 20.37 ? 96 THR A OG1 1 ATOM 746 C CG2 . THR A 1 96 ? -6.275 40.276 10.595 1.00 14.26 ? 96 THR A CG2 1 ATOM 747 N N . THR A 1 97 ? -9.833 38.536 11.469 1.00 16.16 ? 97 THR A N 1 ATOM 748 C CA . THR A 1 97 ? -10.569 38.427 12.721 1.00 23.08 ? 97 THR A CA 1 ATOM 749 C C . THR A 1 97 ? -10.286 37.084 13.380 1.00 16.46 ? 97 THR A C 1 ATOM 750 O O . THR A 1 97 ? -10.066 36.074 12.705 1.00 19.55 ? 97 THR A O 1 ATOM 751 C CB . THR A 1 97 ? -12.086 38.580 12.509 1.00 31.81 ? 97 THR A CB 1 ATOM 752 O OG1 . THR A 1 97 ? -12.522 37.699 11.465 1.00 34.53 ? 97 THR A OG1 1 ATOM 753 C CG2 . THR A 1 97 ? -12.437 40.011 12.139 1.00 17.39 ? 97 THR A CG2 1 ATOM 754 N N . PHE A 1 98 ? -10.302 37.084 14.709 1.00 17.12 ? 98 PHE A N 1 ATOM 755 C CA . PHE A 1 98 ? -10.044 35.892 15.501 1.00 17.28 ? 98 PHE A CA 1 ATOM 756 C C . PHE A 1 98 ? -11.339 35.376 16.113 1.00 21.98 ? 98 PHE A C 1 ATOM 757 O O . PHE A 1 98 ? -12.294 36.132 16.315 1.00 23.92 ? 98 PHE A O 1 ATOM 758 C CB . PHE A 1 98 ? -9.036 36.175 16.623 1.00 17.77 ? 98 PHE A CB 1 ATOM 759 C CG . PHE A 1 98 ? -7.689 36.632 16.136 1.00 23.31 ? 98 PHE A CG 1 ATOM 760 C CD1 . PHE A 1 98 ? -7.462 37.965 15.836 1.00 21.63 ? 98 PHE A CD1 1 ATOM 761 C CD2 . PHE A 1 98 ? -6.647 35.731 15.994 1.00 24.14 ? 98 PHE A CD2 1 ATOM 762 C CE1 . PHE A 1 98 ? -6.227 38.389 15.393 1.00 17.44 ? 98 PHE A CE1 1 ATOM 763 C CE2 . PHE A 1 98 ? -5.407 36.150 15.551 1.00 27.25 ? 98 PHE A CE2 1 ATOM 764 C CZ . PHE A 1 98 ? -5.197 37.481 15.251 1.00 21.94 ? 98 PHE A CZ 1 ATOM 765 N N . GLY A 1 99 ? -11.362 34.077 16.406 1.00 21.26 ? 99 GLY A N 1 ATOM 766 C CA . GLY A 1 99 ? -12.436 33.498 17.181 1.00 29.59 ? 99 GLY A CA 1 ATOM 767 C C . GLY A 1 99 ? -12.295 33.829 18.656 1.00 27.13 ? 99 GLY A C 1 ATOM 768 O O . GLY A 1 99 ? -11.372 34.517 19.088 1.00 24.14 ? 99 GLY A O 1 ATOM 769 N N . ALA A 1 100 ? -13.240 33.319 19.444 1.00 24.66 ? 100 ALA A N 1 ATOM 770 C CA . ALA A 1 100 ? -13.256 33.572 20.879 1.00 19.04 ? 100 ALA A CA 1 ATOM 771 C C . ALA A 1 100 ? -12.479 32.534 21.678 1.00 24.57 ? 100 ALA A C 1 ATOM 772 O O . ALA A 1 100 ? -12.225 32.751 22.869 1.00 14.95 ? 100 ALA A O 1 ATOM 773 C CB . ALA A 1 100 ? -14.698 33.641 21.385 1.00 14.82 ? 100 ALA A CB 1 ATOM 774 N N . GLY A 1 101 ? -12.105 31.417 21.064 1.00 25.05 ? 101 GLY A N 1 ATOM 775 C CA . GLY A 1 101 ? -11.192 30.483 21.682 1.00 23.40 ? 101 GLY A CA 1 ATOM 776 C C . GLY A 1 101 ? -11.903 29.332 22.377 1.00 24.98 ? 101 GLY A C 1 ATOM 777 O O . GLY A 1 101 ? -13.102 29.375 22.663 1.00 33.08 ? 101 GLY A O 1 ATOM 778 N N . THR A 1 102 ? -11.131 28.283 22.646 1.00 20.53 ? 102 THR A N 1 ATOM 779 C CA . THR A 1 102 ? -11.594 27.107 23.369 1.00 26.53 ? 102 THR A CA 1 ATOM 780 C C . THR A 1 102 ? -10.557 26.749 24.423 1.00 26.26 ? 102 THR A C 1 ATOM 781 O O . THR A 1 102 ? -9.356 26.746 24.138 1.00 21.90 ? 102 THR A O 1 ATOM 782 C CB . THR A 1 102 ? -11.828 25.927 22.411 1.00 29.53 ? 102 THR A CB 1 ATOM 783 O OG1 . THR A 1 102 ? -12.996 26.179 21.621 1.00 22.20 ? 102 THR A OG1 1 ATOM 784 C CG2 . THR A 1 102 ? -12.016 24.628 23.176 1.00 39.80 ? 102 THR A CG2 1 ATOM 785 N N . LYS A 1 103 ? -11.020 26.469 25.639 1.00 27.68 ? 103 LYS A N 1 ATOM 786 C CA . LYS A 1 103 ? -10.144 26.118 26.749 1.00 23.32 ? 103 LYS A CA 1 ATOM 787 C C . LYS A 1 103 ? -9.965 24.604 26.799 1.00 22.63 ? 103 LYS A C 1 ATOM 788 O O . LYS A 1 103 ? -10.949 23.859 26.764 1.00 27.27 ? 103 LYS A O 1 ATOM 789 C CB . LYS A 1 103 ? -10.733 26.637 28.063 1.00 24.42 ? 103 LYS A CB 1 ATOM 790 C CG . LYS A 1 103 ? -9.832 26.528 29.284 1.00 27.94 ? 103 LYS A CG 1 ATOM 791 C CD . LYS A 1 103 ? -10.522 27.129 30.507 1.00 30.29 ? 103 LYS A CD 1 ATOM 792 C CE . LYS A 1 103 ? -9.679 27.009 31.769 1.00 35.95 ? 103 LYS A CE 1 ATOM 793 N NZ . LYS A 1 103 ? -8.536 27.961 31.787 1.00 43.95 ? 103 LYS A NZ 1 ATOM 794 N N . LEU A 1 104 ? -8.709 24.152 26.865 1.00 22.45 ? 104 LEU A N 1 ATOM 795 C CA . LEU A 1 104 ? -8.392 22.729 26.964 1.00 22.94 ? 104 LEU A CA 1 ATOM 796 C C . LEU A 1 104 ? -7.980 22.402 28.396 1.00 21.64 ? 104 LEU A C 1 ATOM 797 O O . LEU A 1 104 ? -6.883 22.765 28.835 1.00 22.88 ? 104 LEU A O 1 ATOM 798 C CB . LEU A 1 104 ? -7.287 22.331 25.988 1.00 20.51 ? 104 LEU A CB 1 ATOM 799 C CG . LEU A 1 104 ? -6.897 20.851 26.089 1.00 21.21 ? 104 LEU A CG 1 ATOM 800 C CD1 . LEU A 1 104 ? -8.038 19.961 25.618 1.00 22.80 ? 104 LEU A CD1 1 ATOM 801 C CD2 . LEU A 1 104 ? -5.621 20.543 25.323 1.00 27.63 ? 104 LEU A CD2 1 ATOM 802 N N . GLU A 1 105 ? -8.851 21.705 29.114 1.00 21.80 ? 105 GLU A N 1 ATOM 803 C CA . GLU A 1 105 ? -8.552 21.208 30.446 1.00 22.56 ? 105 GLU A CA 1 ATOM 804 C C . GLU A 1 105 ? -8.202 19.728 30.380 1.00 26.47 ? 105 GLU A C 1 ATOM 805 O O . GLU A 1 105 ? -8.664 19.001 29.495 1.00 33.32 ? 105 GLU A O 1 ATOM 806 C CB . GLU A 1 105 ? -9.738 21.421 31.389 1.00 25.45 ? 105 GLU A CB 1 ATOM 807 C CG . GLU A 1 105 ? -10.169 22.870 31.532 1.00 26.72 ? 105 GLU A CG 1 ATOM 808 C CD . GLU A 1 105 ? -11.385 23.026 32.423 1.00 37.78 ? 105 GLU A CD 1 ATOM 809 O OE1 . GLU A 1 105 ? -12.043 22.002 32.709 1.00 43.80 ? 105 GLU A OE1 1 ATOM 810 O OE2 . GLU A 1 105 ? -11.681 24.169 32.837 1.00 40.40 ? 105 GLU A OE2 1 ATOM 811 N N . LEU A 1 106 ? -7.386 19.284 31.331 1.00 18.95 ? 106 LEU A N 1 ATOM 812 C CA . LEU A 1 106 ? -6.908 17.910 31.369 1.00 19.72 ? 106 LEU A CA 1 ATOM 813 C C . LEU A 1 106 ? -7.379 17.225 32.641 1.00 27.23 ? 106 LEU A C 1 ATOM 814 O O . LEU A 1 106 ? -7.275 17.792 33.734 1.00 25.95 ? 106 LEU A O 1 ATOM 815 C CB . LEU A 1 106 ? -5.384 17.855 31.271 1.00 19.89 ? 106 LEU A CB 1 ATOM 816 C CG . LEU A 1 106 ? -4.901 17.453 29.880 1.00 39.76 ? 106 LEU A CG 1 ATOM 817 C CD1 . LEU A 1 106 ? -3.413 17.636 29.759 1.00 36.34 ? 106 LEU A CD1 1 ATOM 818 C CD2 . LEU A 1 106 ? -5.281 16.011 29.599 1.00 43.76 ? 106 LEU A CD2 1 ATOM 819 N N . LYS A 1 107 ? -7.902 16.013 32.488 1.00 24.66 ? 107 LYS A N 1 ATOM 820 C CA . LYS A 1 107 ? -8.245 15.175 33.623 1.00 29.81 ? 107 LYS A CA 1 ATOM 821 C C . LYS A 1 107 ? -7.011 14.434 34.127 1.00 27.43 ? 107 LYS A C 1 ATOM 822 O O . LYS A 1 107 ? -6.023 14.251 33.409 1.00 28.74 ? 107 LYS A O 1 ATOM 823 C CB . LYS A 1 107 ? -9.334 14.171 33.242 1.00 33.37 ? 107 LYS A CB 1 ATOM 824 C CG . LYS A 1 107 ? -10.696 14.781 32.957 1.00 43.89 ? 107 LYS A CG 1 ATOM 825 C CD . LYS A 1 107 ? -11.672 13.721 32.461 1.00 49.91 ? 107 LYS A CD 1 ATOM 826 C CE . LYS A 1 107 ? -13.116 14.136 32.700 1.00 51.89 ? 107 LYS A CE 1 ATOM 827 N NZ . LYS A 1 107 ? -13.443 15.444 32.070 1.00 48.50 ? 107 LYS A NZ 1 ATOM 828 N N . ARG A 1 108 ? -7.078 14.007 35.383 1.00 20.15 ? 108 ARG A N 1 ATOM 829 C CA . ARG A 1 108 ? -6.031 13.185 35.974 1.00 20.46 ? 108 ARG A CA 1 ATOM 830 C C . ARG A 1 108 ? -6.600 12.529 37.224 1.00 28.87 ? 108 ARG A C 1 ATOM 831 O O . ARG A 1 108 ? -7.752 12.763 37.602 1.00 32.57 ? 108 ARG A O 1 ATOM 832 C CB . ARG A 1 108 ? -4.780 14.008 36.290 1.00 25.71 ? 108 ARG A CB 1 ATOM 833 C CG . ARG A 1 108 ? -5.007 15.155 37.256 1.00 20.25 ? 108 ARG A CG 1 ATOM 834 C CD . ARG A 1 108 ? -3.760 15.393 38.089 1.00 18.16 ? 108 ARG A CD 1 ATOM 835 N NE . ARG A 1 108 ? -3.500 14.267 38.982 1.00 18.51 ? 108 ARG A NE 1 ATOM 836 C CZ . ARG A 1 108 ? -2.350 14.060 39.616 1.00 21.74 ? 108 ARG A CZ 1 ATOM 837 N NH1 . ARG A 1 108 ? -1.336 14.899 39.451 1.00 24.81 ? 108 ARG A NH1 1 ATOM 838 N NH2 . ARG A 1 108 ? -2.212 13.008 40.412 1.00 18.96 ? 108 ARG A NH2 1 ATOM 839 N N . THR A 1 109 ? -5.782 11.697 37.861 1.00 28.31 ? 109 THR A N 1 ATOM 840 C CA . THR A 1 109 ? -6.198 11.046 39.093 1.00 20.57 ? 109 THR A CA 1 ATOM 841 C C . THR A 1 109 ? -6.409 12.081 40.191 1.00 29.10 ? 109 THR A C 1 ATOM 842 O O . THR A 1 109 ? -5.825 13.168 40.173 1.00 31.11 ? 109 THR A O 1 ATOM 843 C CB . THR A 1 109 ? -5.157 10.021 39.539 1.00 21.23 ? 109 THR A CB 1 ATOM 844 O OG1 . THR A 1 109 ? -3.957 10.698 39.938 1.00 22.11 ? 109 THR A OG1 1 ATOM 845 C CG2 . THR A 1 109 ? -4.834 9.065 38.406 1.00 22.65 ? 109 THR A CG2 1 ATOM 846 N N . VAL A 1 110 ? -7.268 11.733 41.152 1.00 28.14 ? 110 VAL A N 1 ATOM 847 C CA . VAL A 1 110 ? -7.492 12.608 42.294 1.00 25.34 ? 110 VAL A CA 1 ATOM 848 C C . VAL A 1 110 ? -6.195 12.758 43.082 1.00 18.66 ? 110 VAL A C 1 ATOM 849 O O . VAL A 1 110 ? -5.444 11.792 43.280 1.00 19.31 ? 110 VAL A O 1 ATOM 850 C CB . VAL A 1 110 ? -8.628 12.059 43.172 1.00 21.75 ? 110 VAL A CB 1 ATOM 851 C CG1 . VAL A 1 110 ? -8.590 12.679 44.554 1.00 22.86 ? 110 VAL A CG1 1 ATOM 852 C CG2 . VAL A 1 110 ? -9.972 12.328 42.518 1.00 23.93 ? 110 VAL A CG2 1 ATOM 853 N N . ALA A 1 111 ? -5.913 13.986 43.514 1.00 21.88 ? 111 ALA A N 1 ATOM 854 C CA . ALA A 1 111 ? -4.730 14.284 44.314 1.00 26.59 ? 111 ALA A CA 1 ATOM 855 C C . ALA A 1 111 ? -5.145 15.198 45.455 1.00 27.42 ? 111 ALA A C 1 ATOM 856 O O . ALA A 1 111 ? -5.723 16.263 45.217 1.00 24.50 ? 111 ALA A O 1 ATOM 857 C CB . ALA A 1 111 ? -3.634 14.942 43.469 1.00 16.43 ? 111 ALA A CB 1 ATOM 858 N N . ALA A 1 112 ? -4.860 14.783 46.684 1.00 21.37 ? 112 ALA A N 1 ATOM 859 C CA . ALA A 1 112 ? -5.247 15.579 47.835 1.00 17.55 ? 112 ALA A CA 1 ATOM 860 C C . ALA A 1 112 ? -4.294 16.758 48.016 1.00 22.58 ? 112 ALA A C 1 ATOM 861 O O . ALA A 1 112 ? -3.104 16.658 47.704 1.00 21.28 ? 112 ALA A O 1 ATOM 862 C CB . ALA A 1 112 ? -5.256 14.723 49.096 1.00 14.99 ? 112 ALA A CB 1 ATOM 863 N N . PRO A 1 113 ? -4.794 17.889 48.507 1.00 16.31 ? 113 PRO A N 1 ATOM 864 C CA . PRO A 1 113 ? -3.918 19.043 48.717 1.00 15.11 ? 113 PRO A CA 1 ATOM 865 C C . PRO A 1 113 ? -3.025 18.860 49.932 1.00 24.39 ? 113 PRO A C 1 ATOM 866 O O . PRO A 1 113 ? -3.408 18.248 50.932 1.00 31.11 ? 113 PRO A O 1 ATOM 867 C CB . PRO A 1 113 ? -4.901 20.200 48.926 1.00 18.34 ? 113 PRO A CB 1 ATOM 868 C CG . PRO A 1 113 ? -6.123 19.550 49.472 1.00 13.11 ? 113 PRO A CG 1 ATOM 869 C CD . PRO A 1 113 ? -6.203 18.206 48.796 1.00 13.57 ? 113 PRO A CD 1 ATOM 870 N N . SER A 1 114 ? -1.810 19.390 49.823 1.00 24.48 ? 114 SER A N 1 ATOM 871 C CA . SER A 1 114 ? -0.945 19.593 50.976 1.00 13.97 ? 114 SER A CA 1 ATOM 872 C C . SER A 1 114 ? -1.202 20.994 51.512 1.00 19.39 ? 114 SER A C 1 ATOM 873 O O . SER A 1 114 ? -1.167 21.968 50.753 1.00 21.74 ? 114 SER A O 1 ATOM 874 C CB . SER A 1 114 ? 0.526 19.423 50.597 1.00 18.34 ? 114 SER A CB 1 ATOM 875 O OG . SER A 1 114 ? 0.762 18.149 50.024 1.00 32.10 ? 114 SER A OG 1 ATOM 876 N N . VAL A 1 115 ? -1.472 21.095 52.810 1.00 21.24 ? 115 VAL A N 1 ATOM 877 C CA . VAL A 1 115 ? -1.958 22.327 53.419 1.00 13.35 ? 115 VAL A CA 1 ATOM 878 C C . VAL A 1 115 ? -0.861 22.926 54.286 1.00 13.73 ? 115 VAL A C 1 ATOM 879 O O . VAL A 1 115 ? -0.233 22.220 55.085 1.00 16.90 ? 115 VAL A O 1 ATOM 880 C CB . VAL A 1 115 ? -3.234 22.079 54.241 1.00 13.40 ? 115 VAL A CB 1 ATOM 881 C CG1 . VAL A 1 115 ? -3.785 23.394 54.770 1.00 12.98 ? 115 VAL A CG1 1 ATOM 882 C CG2 . VAL A 1 115 ? -4.275 21.363 53.395 1.00 12.88 ? 115 VAL A CG2 1 ATOM 883 N N . PHE A 1 116 ? -0.640 24.229 54.130 1.00 20.44 ? 116 PHE A N 1 ATOM 884 C CA . PHE A 1 116 ? 0.280 24.992 54.960 1.00 20.29 ? 116 PHE A CA 1 ATOM 885 C C . PHE A 1 116 ? -0.395 26.293 55.367 1.00 22.87 ? 116 PHE A C 1 ATOM 886 O O . PHE A 1 116 ? -1.155 26.875 54.587 1.00 26.05 ? 116 PHE A O 1 ATOM 887 C CB . PHE A 1 116 ? 1.592 25.301 54.221 1.00 18.36 ? 116 PHE A CB 1 ATOM 888 C CG . PHE A 1 116 ? 2.213 24.108 53.550 1.00 21.70 ? 116 PHE A CG 1 ATOM 889 C CD1 . PHE A 1 116 ? 1.850 23.755 52.260 1.00 18.65 ? 116 PHE A CD1 1 ATOM 890 C CD2 . PHE A 1 116 ? 3.170 23.347 54.204 1.00 28.34 ? 116 PHE A CD2 1 ATOM 891 C CE1 . PHE A 1 116 ? 2.419 22.664 51.639 1.00 19.52 ? 116 PHE A CE1 1 ATOM 892 C CE2 . PHE A 1 116 ? 3.745 22.254 53.584 1.00 31.65 ? 116 PHE A CE2 1 ATOM 893 C CZ . PHE A 1 116 ? 3.368 21.913 52.299 1.00 25.65 ? 116 PHE A CZ 1 ATOM 894 N N . ILE A 1 117 ? -0.114 26.752 56.585 1.00 21.65 ? 117 ILE A N 1 ATOM 895 C CA . ILE A 1 117 ? -0.669 27.996 57.104 1.00 21.31 ? 117 ILE A CA 1 ATOM 896 C C . ILE A 1 117 ? 0.477 28.911 57.510 1.00 25.18 ? 117 ILE A C 1 ATOM 897 O O . ILE A 1 117 ? 1.462 28.464 58.107 1.00 30.14 ? 117 ILE A O 1 ATOM 898 C CB . ILE A 1 117 ? -1.635 27.744 58.285 1.00 22.77 ? 117 ILE A CB 1 ATOM 899 C CG1 . ILE A 1 117 ? -2.259 29.056 58.763 1.00 15.20 ? 117 ILE A CG1 1 ATOM 900 C CG2 . ILE A 1 117 ? -0.929 27.027 59.429 1.00 21.13 ? 117 ILE A CG2 1 ATOM 901 C CD1 . ILE A 1 117 ? -3.365 28.869 59.775 1.00 15.10 ? 117 ILE A CD1 1 ATOM 902 N N . PHE A 1 118 ? 0.354 30.190 57.164 1.00 21.56 ? 118 PHE A N 1 ATOM 903 C CA . PHE A 1 118 ? 1.381 31.183 57.447 1.00 20.06 ? 118 PHE A CA 1 ATOM 904 C C . PHE A 1 118 ? 0.807 32.290 58.318 1.00 23.30 ? 118 PHE A C 1 ATOM 905 O O . PHE A 1 118 ? -0.183 32.929 57.923 1.00 18.65 ? 118 PHE A O 1 ATOM 906 C CB . PHE A 1 118 ? 1.940 31.778 56.152 1.00 17.44 ? 118 PHE A CB 1 ATOM 907 C CG . PHE A 1 118 ? 2.553 30.767 55.233 1.00 17.10 ? 118 PHE A CG 1 ATOM 908 C CD1 . PHE A 1 118 ? 3.875 30.384 55.387 1.00 17.74 ? 118 PHE A CD1 1 ATOM 909 C CD2 . PHE A 1 118 ? 1.812 30.208 54.206 1.00 16.28 ? 118 PHE A CD2 1 ATOM 910 C CE1 . PHE A 1 118 ? 4.445 29.454 54.535 1.00 17.56 ? 118 PHE A CE1 1 ATOM 911 C CE2 . PHE A 1 118 ? 2.375 29.280 53.350 1.00 27.34 ? 118 PHE A CE2 1 ATOM 912 C CZ . PHE A 1 118 ? 3.694 28.903 53.513 1.00 16.76 ? 118 PHE A CZ 1 ATOM 913 N N . PRO A 1 119 ? 1.376 32.555 59.487 1.00 28.88 ? 119 PRO A N 1 ATOM 914 C CA . PRO A 1 119 ? 0.955 33.715 60.271 1.00 28.62 ? 119 PRO A CA 1 ATOM 915 C C . PRO A 1 119 ? 1.359 34.998 59.571 1.00 27.66 ? 119 PRO A C 1 ATOM 916 O O . PRO A 1 119 ? 2.167 34.968 58.631 1.00 27.14 ? 119 PRO A O 1 ATOM 917 C CB . PRO A 1 119 ? 1.711 33.540 61.600 1.00 23.21 ? 119 PRO A CB 1 ATOM 918 C CG . PRO A 1 119 ? 2.155 32.103 61.618 1.00 19.47 ? 119 PRO A CG 1 ATOM 919 C CD . PRO A 1 119 ? 2.393 31.755 60.186 1.00 29.10 ? 119 PRO A CD 1 ATOM 920 N N . PRO A 1 120 ? 0.813 36.142 59.980 1.00 20.77 ? 120 PRO A N 1 ATOM 921 C CA . PRO A 1 120 ? 1.310 37.414 59.446 1.00 22.37 ? 120 PRO A CA 1 ATOM 922 C C . PRO A 1 120 ? 2.714 37.693 59.957 1.00 23.02 ? 120 PRO A C 1 ATOM 923 O O . PRO A 1 120 ? 3.065 37.349 61.088 1.00 23.46 ? 120 PRO A O 1 ATOM 924 C CB . PRO A 1 120 ? 0.305 38.443 59.974 1.00 22.32 ? 120 PRO A CB 1 ATOM 925 C CG . PRO A 1 120 ? -0.275 37.807 61.187 1.00 24.74 ? 120 PRO A CG 1 ATOM 926 C CD . PRO A 1 120 ? -0.328 36.336 60.891 1.00 24.42 ? 120 PRO A CD 1 ATOM 927 N N . SER A 1 121 ? 3.525 38.306 59.102 1.00 28.35 ? 121 SER A N 1 ATOM 928 C CA . SER A 1 121 ? 4.878 38.661 59.497 1.00 29.32 ? 121 SER A CA 1 ATOM 929 C C . SER A 1 121 ? 4.859 39.855 60.441 1.00 32.67 ? 121 SER A C 1 ATOM 930 O O . SER A 1 121 ? 3.981 40.718 60.369 1.00 34.80 ? 121 SER A O 1 ATOM 931 C CB . SER A 1 121 ? 5.728 38.983 58.270 1.00 31.20 ? 121 SER A CB 1 ATOM 932 O OG . SER A 1 121 ? 5.186 40.085 57.565 1.00 35.77 ? 121 SER A OG 1 ATOM 933 N N . ASP A 1 122 ? 5.846 39.897 61.339 1.00 32.41 ? 122 ASP A N 1 ATOM 934 C CA . ASP A 1 122 ? 6.019 41.070 62.186 1.00 40.00 ? 122 ASP A CA 1 ATOM 935 C C . ASP A 1 122 ? 6.288 42.319 61.361 1.00 30.63 ? 122 ASP A C 1 ATOM 936 O O . ASP A 1 122 ? 5.992 43.429 61.819 1.00 31.88 ? 122 ASP A O 1 ATOM 937 C CB . ASP A 1 122 ? 7.155 40.841 63.185 1.00 45.78 ? 122 ASP A CB 1 ATOM 938 C CG . ASP A 1 122 ? 6.877 39.684 64.125 1.00 51.24 ? 122 ASP A CG 1 ATOM 939 O OD1 . ASP A 1 122 ? 5.691 39.398 64.387 1.00 50.43 ? 122 ASP A OD1 1 ATOM 940 O OD2 . ASP A 1 122 ? 7.845 39.057 64.600 1.00 56.41 ? 122 ASP A OD2 1 ATOM 941 N N . GLU A 1 123 ? 6.836 42.161 60.153 1.00 34.52 ? 123 GLU A N 1 ATOM 942 C CA . GLU A 1 123 ? 7.022 43.305 59.269 1.00 42.16 ? 123 GLU A CA 1 ATOM 943 C C . GLU A 1 123 ? 5.683 43.907 58.861 1.00 39.48 ? 123 GLU A C 1 ATOM 944 O O . GLU A 1 123 ? 5.521 45.133 58.858 1.00 36.86 ? 123 GLU A O 1 ATOM 945 C CB . GLU A 1 123 ? 7.823 42.892 58.032 1.00 41.19 ? 123 GLU A CB 1 ATOM 946 C CG . GLU A 1 123 ? 9.270 42.498 58.307 1.00 45.30 ? 123 GLU A CG 1 ATOM 947 C CD . GLU A 1 123 ? 9.427 41.050 58.749 1.00 52.83 ? 123 GLU A CD 1 ATOM 948 O OE1 . GLU A 1 123 ? 8.459 40.474 59.293 1.00 50.17 ? 123 GLU A OE1 1 ATOM 949 O OE2 . GLU A 1 123 ? 10.523 40.484 58.546 1.00 63.68 ? 123 GLU A OE2 1 ATOM 950 N N . GLN A 1 124 ? 4.707 43.060 58.519 1.00 28.77 ? 124 GLN A N 1 ATOM 951 C CA . GLN A 1 124 ? 3.413 43.578 58.088 1.00 38.39 ? 124 GLN A CA 1 ATOM 952 C C . GLN A 1 124 ? 2.647 44.205 59.245 1.00 36.59 ? 124 GLN A C 1 ATOM 953 O O . GLN A 1 124 ? 1.946 45.205 59.055 1.00 41.73 ? 124 GLN A O 1 ATOM 954 C CB . GLN A 1 124 ? 2.577 42.469 57.444 1.00 26.21 ? 124 GLN A CB 1 ATOM 955 C CG . GLN A 1 124 ? 1.285 42.981 56.817 1.00 35.51 ? 124 GLN A CG 1 ATOM 956 C CD . GLN A 1 124 ? 0.319 41.869 56.445 1.00 34.22 ? 124 GLN A CD 1 ATOM 957 O OE1 . GLN A 1 124 ? 0.614 40.686 56.614 1.00 39.79 ? 124 GLN A OE1 1 ATOM 958 N NE2 . GLN A 1 124 ? -0.847 42.250 55.937 1.00 23.48 ? 124 GLN A NE2 1 ATOM 959 N N . LEU A 1 125 ? 2.773 43.638 60.448 1.00 29.04 ? 125 LEU A N 1 ATOM 960 C CA . LEU A 1 125 ? 2.051 44.155 61.605 1.00 37.41 ? 125 LEU A CA 1 ATOM 961 C C . LEU A 1 125 ? 2.434 45.592 61.936 1.00 44.10 ? 125 LEU A C 1 ATOM 962 O O . LEU A 1 125 ? 1.636 46.310 62.550 1.00 53.85 ? 125 LEU A O 1 ATOM 963 C CB . LEU A 1 125 ? 2.298 43.255 62.812 1.00 29.62 ? 125 LEU A CB 1 ATOM 964 C CG . LEU A 1 125 ? 1.733 41.846 62.654 1.00 27.66 ? 125 LEU A CG 1 ATOM 965 C CD1 . LEU A 1 125 ? 2.212 40.944 63.779 1.00 27.64 ? 125 LEU A CD1 1 ATOM 966 C CD2 . LEU A 1 125 ? 0.216 41.901 62.612 1.00 31.81 ? 125 LEU A CD2 1 ATOM 967 N N . LYS A 1 126 ? 3.631 46.031 61.540 1.00 38.63 ? 126 LYS A N 1 ATOM 968 C CA . LYS A 1 126 ? 4.025 47.417 61.758 1.00 42.61 ? 126 LYS A CA 1 ATOM 969 C C . LYS A 1 126 ? 3.191 48.402 60.947 1.00 39.29 ? 126 LYS A C 1 ATOM 970 O O . LYS A 1 126 ? 3.259 49.607 61.215 1.00 42.71 ? 126 LYS A O 1 ATOM 971 C CB . LYS A 1 126 ? 5.506 47.608 61.426 1.00 49.20 ? 126 LYS A CB 1 ATOM 972 C CG . LYS A 1 126 ? 6.463 46.892 62.367 1.00 48.68 ? 126 LYS A CG 1 ATOM 973 C CD . LYS A 1 126 ? 7.912 47.203 62.018 1.00 52.78 ? 126 LYS A CD 1 ATOM 974 C CE . LYS A 1 126 ? 8.872 46.545 62.998 1.00 58.05 ? 126 LYS A CE 1 ATOM 975 N NZ . LYS A 1 126 ? 10.295 46.843 62.670 1.00 60.77 ? 126 LYS A NZ 1 ATOM 976 N N . SER A 1 127 ? 2.413 47.927 59.974 1.00 40.31 ? 127 SER A N 1 ATOM 977 C CA . SER A 1 127 ? 1.583 48.786 59.139 1.00 49.21 ? 127 SER A CA 1 ATOM 978 C C . SER A 1 127 ? 0.103 48.704 59.496 1.00 54.89 ? 127 SER A C 1 ATOM 979 O O . SER A 1 127 ? -0.722 49.325 58.819 1.00 56.49 ? 127 SER A O 1 ATOM 980 C CB . SER A 1 127 ? 1.788 48.448 57.660 1.00 53.31 ? 127 SER A CB 1 ATOM 981 O OG . SER A 1 127 ? 1.333 47.139 57.360 1.00 53.53 ? 127 SER A OG 1 ATOM 982 N N . GLY A 1 128 ? -0.255 47.953 60.535 1.00 55.38 ? 128 GLY A N 1 ATOM 983 C CA . GLY A 1 128 ? -1.620 47.926 61.023 1.00 59.31 ? 128 GLY A CA 1 ATOM 984 C C . GLY A 1 128 ? -2.545 46.934 60.355 1.00 53.84 ? 128 GLY A C 1 ATOM 985 O O . GLY A 1 128 ? -3.758 46.988 60.595 1.00 49.72 ? 128 GLY A O 1 ATOM 986 N N . THR A 1 129 ? -2.020 46.029 59.531 1.00 47.21 ? 129 THR A N 1 ATOM 987 C CA . THR A 1 129 ? -2.826 45.034 58.838 1.00 46.49 ? 129 THR A CA 1 ATOM 988 C C . THR A 1 129 ? -2.186 43.665 59.009 1.00 37.73 ? 129 THR A C 1 ATOM 989 O O . THR A 1 129 ? -0.957 43.541 59.000 1.00 27.13 ? 129 THR A O 1 ATOM 990 C CB . THR A 1 129 ? -2.969 45.376 57.344 1.00 52.72 ? 129 THR A CB 1 ATOM 991 O OG1 . THR A 1 129 ? -3.620 46.644 57.208 1.00 57.95 ? 129 THR A OG1 1 ATOM 992 C CG2 . THR A 1 129 ? -3.794 44.325 56.621 1.00 51.18 ? 129 THR A CG2 1 ATOM 993 N N . ALA A 1 130 ? -3.020 42.642 59.182 1.00 30.08 ? 130 ALA A N 1 ATOM 994 C CA . ALA A 1 130 ? -2.560 41.269 59.328 1.00 32.16 ? 130 ALA A CA 1 ATOM 995 C C . ALA A 1 130 ? -3.120 40.427 58.192 1.00 24.00 ? 130 ALA A C 1 ATOM 996 O O . ALA A 1 130 ? -4.326 40.456 57.929 1.00 23.35 ? 130 ALA A O 1 ATOM 997 C CB . ALA A 1 130 ? -2.981 40.686 60.680 1.00 30.19 ? 130 ALA A CB 1 ATOM 998 N N . SER A 1 131 ? -2.244 39.682 57.519 1.00 22.79 ? 131 SER A N 1 ATOM 999 C CA . SER A 1 131 ? -2.642 38.751 56.469 1.00 22.11 ? 131 SER A CA 1 ATOM 1000 C C . SER A 1 131 ? -2.276 37.340 56.901 1.00 24.96 ? 131 SER A C 1 ATOM 1001 O O . SER A 1 131 ? -1.105 37.053 57.171 1.00 28.24 ? 131 SER A O 1 ATOM 1002 C CB . SER A 1 131 ? -1.977 39.093 55.134 1.00 23.12 ? 131 SER A CB 1 ATOM 1003 O OG . SER A 1 131 ? -2.641 40.164 54.487 1.00 24.63 ? 131 SER A OG 1 ATOM 1004 N N . VAL A 1 132 ? -3.276 36.467 56.970 1.00 22.60 ? 132 VAL A N 1 ATOM 1005 C CA . VAL A 1 132 ? -3.092 35.062 57.313 1.00 19.36 ? 132 VAL A CA 1 ATOM 1006 C C . VAL A 1 132 ? -3.337 34.253 56.048 1.00 18.15 ? 132 VAL A C 1 ATOM 1007 O O . VAL A 1 132 ? -4.452 34.249 55.514 1.00 18.38 ? 132 VAL A O 1 ATOM 1008 C CB . VAL A 1 132 ? -4.038 34.626 58.442 1.00 18.85 ? 132 VAL A CB 1 ATOM 1009 C CG1 . VAL A 1 132 ? -3.590 33.296 59.035 1.00 18.30 ? 132 VAL A CG1 1 ATOM 1010 C CG2 . VAL A 1 132 ? -4.118 35.701 59.514 1.00 19.83 ? 132 VAL A CG2 1 ATOM 1011 N N . VAL A 1 133 ? -2.302 33.575 55.561 1.00 17.75 ? 133 VAL A N 1 ATOM 1012 C CA . VAL A 1 133 ? -2.361 32.861 54.291 1.00 17.51 ? 133 VAL A CA 1 ATOM 1013 C C . VAL A 1 133 ? -2.441 31.366 54.566 1.00 21.42 ? 133 VAL A C 1 ATOM 1014 O O . VAL A 1 133 ? -1.669 30.830 55.369 1.00 20.22 ? 133 VAL A O 1 ATOM 1015 C CB . VAL A 1 133 ? -1.156 33.200 53.396 1.00 18.14 ? 133 VAL A CB 1 ATOM 1016 C CG1 . VAL A 1 133 ? -1.260 32.467 52.067 1.00 18.01 ? 133 VAL A CG1 1 ATOM 1017 C CG2 . VAL A 1 133 ? -1.077 34.701 53.170 1.00 20.11 ? 133 VAL A CG2 1 ATOM 1018 N N . CYS A 1 134 ? -3.387 30.702 53.904 1.00 24.20 ? 134 CYS A N 1 ATOM 1019 C CA . CYS A 1 134 ? -3.566 29.256 53.958 1.00 25.16 ? 134 CYS A CA 1 ATOM 1020 C C . CYS A 1 134 ? -3.361 28.718 52.549 1.00 26.39 ? 134 CYS A C 1 ATOM 1021 O O . CYS A 1 134 ? -4.063 29.131 51.619 1.00 27.99 ? 134 CYS A O 1 ATOM 1022 C CB . CYS A 1 134 ? -4.962 28.906 54.481 1.00 33.13 ? 134 CYS A CB 1 ATOM 1023 S SG . CYS A 1 134 ? -5.383 27.156 54.675 1.00 33.70 ? 134 CYS A SG 1 ATOM 1024 N N . LEU A 1 135 ? -2.399 27.812 52.388 1.00 19.73 ? 135 LEU A N 1 ATOM 1025 C CA . LEU A 1 135 ? -1.981 27.333 51.076 1.00 20.95 ? 135 LEU A CA 1 ATOM 1026 C C . LEU A 1 135 ? -2.404 25.885 50.870 1.00 19.88 ? 135 LEU A C 1 ATOM 1027 O O . LEU A 1 135 ? -2.103 25.021 51.699 1.00 21.56 ? 135 LEU A O 1 ATOM 1028 C CB . LEU A 1 135 ? -0.466 27.459 50.907 1.00 14.94 ? 135 LEU A CB 1 ATOM 1029 C CG . LEU A 1 135 ? 0.114 26.791 49.661 1.00 21.60 ? 135 LEU A CG 1 ATOM 1030 C CD1 . LEU A 1 135 ? -0.337 27.518 48.413 1.00 27.03 ? 135 LEU A CD1 1 ATOM 1031 C CD2 . LEU A 1 135 ? 1.631 26.726 49.730 1.00 25.53 ? 135 LEU A CD2 1 ATOM 1032 N N . LEU A 1 136 ? -3.089 25.627 49.758 1.00 14.44 ? 136 LEU A N 1 ATOM 1033 C CA . LEU A 1 136 ? -3.475 24.285 49.328 1.00 18.10 ? 136 LEU A CA 1 ATOM 1034 C C . LEU A 1 136 ? -2.681 23.978 48.064 1.00 20.81 ? 136 LEU A C 1 ATOM 1035 O O . LEU A 1 136 ? -2.906 24.601 47.021 1.00 28.65 ? 136 LEU A O 1 ATOM 1036 C CB . LEU A 1 136 ? -4.979 24.196 49.062 1.00 24.56 ? 136 LEU A CB 1 ATOM 1037 C CG . LEU A 1 136 ? -6.020 24.254 50.187 1.00 26.85 ? 136 LEU A CG 1 ATOM 1038 C CD1 . LEU A 1 136 ? -5.982 25.564 50.968 1.00 15.03 ? 136 LEU A CD1 1 ATOM 1039 C CD2 . LEU A 1 136 ? -7.402 24.035 49.598 1.00 15.65 ? 136 LEU A CD2 1 ATOM 1040 N N . ASN A 1 137 ? -1.764 23.019 48.150 1.00 13.60 ? 137 ASN A N 1 ATOM 1041 C CA . ASN A 1 137 ? -0.751 22.817 47.122 1.00 22.82 ? 137 ASN A CA 1 ATOM 1042 C C . ASN A 1 137 ? -0.978 21.507 46.375 1.00 20.36 ? 137 ASN A C 1 ATOM 1043 O O . ASN A 1 137 ? -1.157 20.454 46.998 1.00 14.99 ? 137 ASN A O 1 ATOM 1044 C CB . ASN A 1 137 ? 0.649 22.833 47.742 1.00 22.73 ? 137 ASN A CB 1 ATOM 1045 C CG . ASN A 1 137 ? 1.724 23.221 46.745 1.00 24.36 ? 137 ASN A CG 1 ATOM 1046 O OD1 . ASN A 1 137 ? 1.507 24.069 45.879 1.00 28.16 ? 137 ASN A OD1 1 ATOM 1047 N ND2 . ASN A 1 137 ? 2.893 22.600 46.863 1.00 23.93 ? 137 ASN A ND2 1 ATOM 1048 N N . ASN A 1 138 ? -0.969 21.587 45.043 1.00 21.44 ? 138 ASN A N 1 ATOM 1049 C CA . ASN A 1 138 ? -0.933 20.435 44.135 1.00 22.83 ? 138 ASN A CA 1 ATOM 1050 C C . ASN A 1 138 ? -2.063 19.444 44.426 1.00 20.26 ? 138 ASN A C 1 ATOM 1051 O O . ASN A 1 138 ? -1.859 18.354 44.962 1.00 21.38 ? 138 ASN A O 1 ATOM 1052 C CB . ASN A 1 138 ? 0.429 19.737 44.202 1.00 13.70 ? 138 ASN A CB 1 ATOM 1053 C CG . ASN A 1 138 ? 1.573 20.656 43.829 1.00 24.29 ? 138 ASN A CG 1 ATOM 1054 O OD1 . ASN A 1 138 ? 1.371 21.700 43.210 1.00 32.26 ? 138 ASN A OD1 1 ATOM 1055 N ND2 . ASN A 1 138 ? 2.784 20.270 44.204 1.00 29.85 ? 138 ASN A ND2 1 ATOM 1056 N N . PHE A 1 139 ? -3.268 19.844 44.027 1.00 16.98 ? 139 PHE A N 1 ATOM 1057 C CA . PHE A 1 139 ? -4.451 19.017 44.212 1.00 18.61 ? 139 PHE A CA 1 ATOM 1058 C C . PHE A 1 139 ? -5.276 18.979 42.933 1.00 20.60 ? 139 PHE A C 1 ATOM 1059 O O . PHE A 1 139 ? -5.134 19.825 42.046 1.00 24.10 ? 139 PHE A O 1 ATOM 1060 C CB . PHE A 1 139 ? -5.317 19.513 45.382 1.00 16.05 ? 139 PHE A CB 1 ATOM 1061 C CG . PHE A 1 139 ? -5.813 20.925 45.225 1.00 17.94 ? 139 PHE A CG 1 ATOM 1062 C CD1 . PHE A 1 139 ? -5.034 21.998 45.628 1.00 18.16 ? 139 PHE A CD1 1 ATOM 1063 C CD2 . PHE A 1 139 ? -7.069 21.177 44.694 1.00 20.94 ? 139 PHE A CD2 1 ATOM 1064 C CE1 . PHE A 1 139 ? -5.492 23.295 45.490 1.00 22.04 ? 139 PHE A CE1 1 ATOM 1065 C CE2 . PHE A 1 139 ? -7.532 22.473 44.554 1.00 25.18 ? 139 PHE A CE2 1 ATOM 1066 C CZ . PHE A 1 139 ? -6.744 23.533 44.952 1.00 20.90 ? 139 PHE A CZ 1 ATOM 1067 N N . TYR A 1 140 ? -6.138 17.971 42.855 1.00 24.72 ? 140 TYR A N 1 ATOM 1068 C CA . TYR A 1 140 ? -7.071 17.802 41.747 1.00 17.22 ? 140 TYR A CA 1 ATOM 1069 C C . TYR A 1 140 ? -8.265 16.985 42.229 1.00 25.04 ? 140 TYR A C 1 ATOM 1070 O O . TYR A 1 140 ? -8.087 15.982 42.920 1.00 27.37 ? 140 TYR A O 1 ATOM 1071 C CB . TYR A 1 140 ? -6.398 17.114 40.554 1.00 23.25 ? 140 TYR A CB 1 ATOM 1072 C CG . TYR A 1 140 ? -7.283 17.035 39.330 1.00 22.02 ? 140 TYR A CG 1 ATOM 1073 C CD1 . TYR A 1 140 ? -7.332 18.080 38.420 1.00 21.06 ? 140 TYR A CD1 1 ATOM 1074 C CD2 . TYR A 1 140 ? -8.084 15.924 39.094 1.00 19.43 ? 140 TYR A CD2 1 ATOM 1075 C CE1 . TYR A 1 140 ? -8.144 18.022 37.307 1.00 25.52 ? 140 TYR A CE1 1 ATOM 1076 C CE2 . TYR A 1 140 ? -8.901 15.856 37.983 1.00 21.07 ? 140 TYR A CE2 1 ATOM 1077 C CZ . TYR A 1 140 ? -8.927 16.910 37.092 1.00 23.63 ? 140 TYR A CZ 1 ATOM 1078 O OH . TYR A 1 140 ? -9.737 16.854 35.982 1.00 24.88 ? 140 TYR A OH 1 ATOM 1079 N N . PRO A 1 141 ? -9.488 17.392 41.850 1.00 26.48 ? 141 PRO A N 1 ATOM 1080 C CA . PRO A 1 141 ? -9.809 18.503 40.947 1.00 21.36 ? 141 PRO A CA 1 ATOM 1081 C C . PRO A 1 141 ? -9.827 19.875 41.619 1.00 20.39 ? 141 PRO A C 1 ATOM 1082 O O . PRO A 1 141 ? -9.402 20.018 42.764 1.00 26.23 ? 141 PRO A O 1 ATOM 1083 C CB . PRO A 1 141 ? -11.202 18.133 40.442 1.00 22.24 ? 141 PRO A CB 1 ATOM 1084 C CG . PRO A 1 141 ? -11.818 17.426 41.594 1.00 22.02 ? 141 PRO A CG 1 ATOM 1085 C CD . PRO A 1 141 ? -10.701 16.667 42.270 1.00 28.83 ? 141 PRO A CD 1 ATOM 1086 N N . ARG A 1 142 ? -10.336 20.871 40.888 1.00 21.88 ? 142 ARG A N 1 ATOM 1087 C CA . ARG A 1 142 ? -10.258 22.264 41.313 1.00 29.75 ? 142 ARG A CA 1 ATOM 1088 C C . ARG A 1 142 ? -11.147 22.569 42.511 1.00 22.20 ? 142 ARG A C 1 ATOM 1089 O O . ARG A 1 142 ? -10.877 23.532 43.237 1.00 30.11 ? 142 ARG A O 1 ATOM 1090 C CB . ARG A 1 142 ? -10.634 23.174 40.140 1.00 44.25 ? 142 ARG A CB 1 ATOM 1091 C CG . ARG A 1 142 ? -10.281 24.644 40.312 1.00 44.56 ? 142 ARG A CG 1 ATOM 1092 C CD . ARG A 1 142 ? -10.845 25.465 39.157 1.00 50.56 ? 142 ARG A CD 1 ATOM 1093 N NE . ARG A 1 142 ? -10.247 26.795 39.069 1.00 59.33 ? 142 ARG A NE 1 ATOM 1094 C CZ . ARG A 1 142 ? -10.789 27.898 39.576 1.00 66.35 ? 142 ARG A CZ 1 ATOM 1095 N NH1 . ARG A 1 142 ? -11.951 27.839 40.212 1.00 67.26 ? 142 ARG A NH1 1 ATOM 1096 N NH2 . ARG A 1 142 ? -10.167 29.063 39.443 1.00 69.65 ? 142 ARG A NH2 1 ATOM 1097 N N . GLU A 1 143 ? -12.192 21.778 42.737 1.00 22.89 ? 143 GLU A N 1 ATOM 1098 C CA . GLU A 1 143 ? -13.133 22.067 43.811 1.00 23.97 ? 143 GLU A CA 1 ATOM 1099 C C . GLU A 1 143 ? -12.476 21.877 45.173 1.00 21.62 ? 143 GLU A C 1 ATOM 1100 O O . GLU A 1 143 ? -11.889 20.826 45.452 1.00 20.50 ? 143 GLU A O 1 ATOM 1101 C CB . GLU A 1 143 ? -14.366 21.174 43.690 1.00 24.84 ? 143 GLU A CB 1 ATOM 1102 C CG . GLU A 1 143 ? -15.232 21.127 44.947 1.00 37.68 ? 143 GLU A CG 1 ATOM 1103 C CD . GLU A 1 143 ? -15.839 22.476 45.307 1.00 46.45 ? 143 GLU A CD 1 ATOM 1104 O OE1 . GLU A 1 143 ? -15.927 23.357 44.424 1.00 45.84 ? 143 GLU A OE1 1 ATOM 1105 O OE2 . GLU A 1 143 ? -16.232 22.654 46.479 1.00 50.97 ? 143 GLU A OE2 1 ATOM 1106 N N . ALA A 1 144 ? -12.583 22.895 46.024 1.00 26.33 ? 144 ALA A N 1 ATOM 1107 C CA . ALA A 1 144 ? -12.031 22.834 47.370 1.00 20.22 ? 144 ALA A CA 1 ATOM 1108 C C . ALA A 1 144 ? -12.738 23.856 48.246 1.00 27.11 ? 144 ALA A C 1 ATOM 1109 O O . ALA A 1 144 ? -13.147 24.922 47.777 1.00 28.03 ? 144 ALA A O 1 ATOM 1110 C CB . ALA A 1 144 ? -10.520 23.085 47.372 1.00 18.71 ? 144 ALA A CB 1 ATOM 1111 N N . LYS A 1 145 ? -12.875 23.517 49.525 1.00 31.37 ? 145 LYS A N 1 ATOM 1112 C CA . LYS A 1 145 ? -13.497 24.382 50.516 1.00 29.98 ? 145 LYS A CA 1 ATOM 1113 C C . LYS A 1 145 ? -12.464 24.764 51.564 1.00 30.89 ? 145 LYS A C 1 ATOM 1114 O O . LYS A 1 145 ? -11.752 23.897 52.083 1.00 35.30 ? 145 LYS A O 1 ATOM 1115 C CB . LYS A 1 145 ? -14.688 23.690 51.186 1.00 34.63 ? 145 LYS A CB 1 ATOM 1116 C CG . LYS A 1 145 ? -15.861 23.411 50.262 1.00 36.23 ? 145 LYS A CG 1 ATOM 1117 C CD . LYS A 1 145 ? -16.526 24.699 49.805 1.00 44.28 ? 145 LYS A CD 1 ATOM 1118 C CE . LYS A 1 145 ? -17.824 24.413 49.071 1.00 49.00 ? 145 LYS A CE 1 ATOM 1119 N NZ . LYS A 1 145 ? -18.421 25.646 48.490 1.00 50.11 ? 145 LYS A NZ 1 ATOM 1120 N N . VAL A 1 146 ? -12.381 26.055 51.871 1.00 19.87 ? 146 VAL A N 1 ATOM 1121 C CA . VAL A 1 146 ? -11.517 26.565 52.929 1.00 18.88 ? 146 VAL A CA 1 ATOM 1122 C C . VAL A 1 146 ? -12.387 27.304 53.936 1.00 24.14 ? 146 VAL A C 1 ATOM 1123 O O . VAL A 1 146 ? -13.118 28.232 53.569 1.00 20.92 ? 146 VAL A O 1 ATOM 1124 C CB . VAL A 1 146 ? -10.413 27.483 52.374 1.00 18.53 ? 146 VAL A CB 1 ATOM 1125 C CG1 . VAL A 1 146 ? -9.619 28.104 53.513 1.00 23.28 ? 146 VAL A CG1 1 ATOM 1126 C CG2 . VAL A 1 146 ? -9.496 26.703 51.449 1.00 17.52 ? 146 VAL A CG2 1 ATOM 1127 N N . GLN A 1 147 ? -12.309 26.891 55.198 1.00 23.52 ? 147 GLN A N 1 ATOM 1128 C CA . GLN A 1 147 ? -13.116 27.460 56.270 1.00 22.60 ? 147 GLN A CA 1 ATOM 1129 C C . GLN A 1 147 ? -12.190 28.072 57.311 1.00 25.20 ? 147 GLN A C 1 ATOM 1130 O O . GLN A 1 147 ? -11.359 27.370 57.897 1.00 31.48 ? 147 GLN A O 1 ATOM 1131 C CB . GLN A 1 147 ? -14.014 26.395 56.902 1.00 29.05 ? 147 GLN A CB 1 ATOM 1132 C CG . GLN A 1 147 ? -14.992 26.927 57.931 1.00 37.43 ? 147 GLN A CG 1 ATOM 1133 C CD . GLN A 1 147 ? -15.935 25.853 58.441 1.00 50.90 ? 147 GLN A CD 1 ATOM 1134 O OE1 . GLN A 1 147 ? -16.893 25.481 57.763 1.00 52.75 ? 147 GLN A OE1 1 ATOM 1135 N NE2 . GLN A 1 147 ? -15.666 25.347 59.640 1.00 52.85 ? 147 GLN A NE2 1 ATOM 1136 N N . TRP A 1 148 ? -12.333 29.376 57.536 1.00 20.00 ? 148 TRP A N 1 ATOM 1137 C CA . TRP A 1 148 ? -11.512 30.090 58.503 1.00 19.60 ? 148 TRP A CA 1 ATOM 1138 C C . TRP A 1 148 ? -12.227 30.182 59.844 1.00 20.54 ? 148 TRP A C 1 ATOM 1139 O O . TRP A 1 148 ? -13.425 30.476 59.906 1.00 21.72 ? 148 TRP A O 1 ATOM 1140 C CB . TRP A 1 148 ? -11.175 31.496 58.001 1.00 23.25 ? 148 TRP A CB 1 ATOM 1141 C CG . TRP A 1 148 ? -10.101 31.534 56.965 1.00 18.94 ? 148 TRP A CG 1 ATOM 1142 C CD1 . TRP A 1 148 ? -10.267 31.641 55.617 1.00 29.58 ? 148 TRP A CD1 1 ATOM 1143 C CD2 . TRP A 1 148 ? -8.689 31.468 57.192 1.00 19.93 ? 148 TRP A CD2 1 ATOM 1144 N NE1 . TRP A 1 148 ? -9.047 31.646 54.987 1.00 24.64 ? 148 TRP A NE1 1 ATOM 1145 C CE2 . TRP A 1 148 ? -8.062 31.542 55.933 1.00 26.87 ? 148 TRP A CE2 1 ATOM 1146 C CE3 . TRP A 1 148 ? -7.895 31.355 58.337 1.00 25.11 ? 148 TRP A CE3 1 ATOM 1147 C CZ2 . TRP A 1 148 ? -6.678 31.507 55.787 1.00 17.13 ? 148 TRP A CZ2 1 ATOM 1148 C CZ3 . TRP A 1 148 ? -6.520 31.320 58.189 1.00 23.56 ? 148 TRP A CZ3 1 ATOM 1149 C CH2 . TRP A 1 148 ? -5.926 31.394 56.924 1.00 25.49 ? 148 TRP A CH2 1 ATOM 1150 N N . LYS A 1 149 ? -11.482 29.932 60.917 1.00 23.62 ? 149 LYS A N 1 ATOM 1151 C CA . LYS A 1 149 ? -12.010 30.056 62.268 1.00 24.50 ? 149 LYS A CA 1 ATOM 1152 C C . LYS A 1 149 ? -10.998 30.782 63.137 1.00 21.08 ? 149 LYS A C 1 ATOM 1153 O O . LYS A 1 149 ? -9.825 30.397 63.189 1.00 26.03 ? 149 LYS A O 1 ATOM 1154 C CB . LYS A 1 149 ? -12.344 28.692 62.878 1.00 21.40 ? 149 LYS A CB 1 ATOM 1155 C CG . LYS A 1 149 ? -13.696 28.138 62.467 1.00 28.19 ? 149 LYS A CG 1 ATOM 1156 C CD . LYS A 1 149 ? -14.185 27.117 63.477 1.00 44.15 ? 149 LYS A CD 1 ATOM 1157 C CE . LYS A 1 149 ? -15.595 26.646 63.161 1.00 54.87 ? 149 LYS A CE 1 ATOM 1158 N NZ . LYS A 1 149 ? -16.154 25.810 64.264 1.00 55.44 ? 149 LYS A NZ 1 ATOM 1159 N N . VAL A 1 150 ? -11.458 31.830 63.813 1.00 34.72 ? 150 VAL A N 1 ATOM 1160 C CA . VAL A 1 150 ? -10.664 32.582 64.775 1.00 22.29 ? 150 VAL A CA 1 ATOM 1161 C C . VAL A 1 150 ? -11.345 32.429 66.128 1.00 28.27 ? 150 VAL A C 1 ATOM 1162 O O . VAL A 1 150 ? -12.455 32.939 66.328 1.00 24.40 ? 150 VAL A O 1 ATOM 1163 C CB . VAL A 1 150 ? -10.534 34.060 64.384 1.00 22.59 ? 150 VAL A CB 1 ATOM 1164 C CG1 . VAL A 1 150 ? -9.664 34.790 65.387 1.00 22.97 ? 150 VAL A CG1 1 ATOM 1165 C CG2 . VAL A 1 150 ? -9.967 34.190 62.980 1.00 36.69 ? 150 VAL A CG2 1 ATOM 1166 N N . ASP A 1 151 ? -10.689 31.722 67.051 1.00 32.32 ? 151 ASP A N 1 ATOM 1167 C CA . ASP A 1 151 ? -11.249 31.446 68.377 1.00 36.29 ? 151 ASP A CA 1 ATOM 1168 C C . ASP A 1 151 ? -12.650 30.846 68.270 1.00 44.43 ? 151 ASP A C 1 ATOM 1169 O O . ASP A 1 151 ? -13.580 31.252 68.971 1.00 44.88 ? 151 ASP A O 1 ATOM 1170 C CB . ASP A 1 151 ? -11.264 32.706 69.247 1.00 35.72 ? 151 ASP A CB 1 ATOM 1171 C CG . ASP A 1 151 ? -9.877 33.134 69.684 1.00 32.72 ? 151 ASP A CG 1 ATOM 1172 O OD1 . ASP A 1 151 ? -8.957 32.287 69.659 1.00 32.31 ? 151 ASP A OD1 1 ATOM 1173 O OD2 . ASP A 1 151 ? -9.712 34.314 70.062 1.00 32.98 ? 151 ASP A OD2 1 ATOM 1174 N N . ASN A 1 152 ? -12.800 29.877 67.367 1.00 46.90 ? 152 ASN A N 1 ATOM 1175 C CA . ASN A 1 152 ? -14.036 29.160 67.065 1.00 42.51 ? 152 ASN A CA 1 ATOM 1176 C C . ASN A 1 152 ? -15.099 30.034 66.412 1.00 41.15 ? 152 ASN A C 1 ATOM 1177 O O . ASN A 1 152 ? -16.201 29.543 66.149 1.00 47.53 ? 152 ASN A O 1 ATOM 1178 C CB . ASN A 1 152 ? -14.647 28.489 68.303 1.00 42.92 ? 152 ASN A CB 1 ATOM 1179 C CG . ASN A 1 152 ? -14.169 27.066 68.485 1.00 56.13 ? 152 ASN A CG 1 ATOM 1180 O OD1 . ASN A 1 152 ? -13.127 26.677 67.955 1.00 53.67 ? 152 ASN A OD1 1 ATOM 1181 N ND2 . ASN A 1 152 ? -14.933 26.275 69.229 1.00 65.30 ? 152 ASN A ND2 1 ATOM 1182 N N . ALA A 1 153 ? -14.816 31.304 66.141 1.00 37.15 ? 153 ALA A N 1 ATOM 1183 C CA . ALA A 1 153 ? -15.749 32.137 65.399 1.00 35.24 ? 153 ALA A CA 1 ATOM 1184 C C . ALA A 1 153 ? -15.555 31.917 63.905 1.00 34.82 ? 153 ALA A C 1 ATOM 1185 O O . ALA A 1 153 ? -14.433 32.009 63.396 1.00 34.72 ? 153 ALA A O 1 ATOM 1186 C CB . ALA A 1 153 ? -15.555 33.612 65.750 1.00 33.98 ? 153 ALA A CB 1 ATOM 1187 N N . LEU A 1 154 ? -16.646 31.612 63.209 1.00 32.21 ? 154 LEU A N 1 ATOM 1188 C CA . LEU A 1 154 ? -16.594 31.409 61.767 1.00 26.53 ? 154 LEU A CA 1 ATOM 1189 C C . LEU A 1 154 ? -16.315 32.733 61.066 1.00 25.04 ? 154 LEU A C 1 ATOM 1190 O O . LEU A 1 154 ? -17.043 33.711 61.261 1.00 25.23 ? 154 LEU A O 1 ATOM 1191 C CB . LEU A 1 154 ? -17.907 30.810 61.274 1.00 27.89 ? 154 LEU A CB 1 ATOM 1192 C CG . LEU A 1 154 ? -18.058 30.659 59.760 1.00 28.91 ? 154 LEU A CG 1 ATOM 1193 C CD1 . LEU A 1 154 ? -17.190 29.525 59.249 1.00 29.44 ? 154 LEU A CD1 1 ATOM 1194 C CD2 . LEU A 1 154 ? -19.516 30.446 59.377 1.00 28.98 ? 154 LEU A CD2 1 ATOM 1195 N N . GLN A 1 155 ? -15.259 32.769 60.259 1.00 25.03 ? 155 GLN A N 1 ATOM 1196 C CA . GLN A 1 155 ? -14.942 33.951 59.473 1.00 27.80 ? 155 GLN A CA 1 ATOM 1197 C C . GLN A 1 155 ? -15.709 33.917 58.159 1.00 31.90 ? 155 GLN A C 1 ATOM 1198 O O . GLN A 1 155 ? -15.845 32.862 57.533 1.00 35.27 ? 155 GLN A O 1 ATOM 1199 C CB . GLN A 1 155 ? -13.439 34.040 59.206 1.00 21.34 ? 155 GLN A CB 1 ATOM 1200 C CG . GLN A 1 155 ? -12.598 34.070 60.465 1.00 27.64 ? 155 GLN A CG 1 ATOM 1201 C CD . GLN A 1 155 ? -13.030 35.158 61.427 1.00 29.57 ? 155 GLN A CD 1 ATOM 1202 O OE1 . GLN A 1 155 ? -12.929 36.348 61.126 1.00 23.24 ? 155 GLN A OE1 1 ATOM 1203 N NE2 . GLN A 1 155 ? -13.522 34.753 62.591 1.00 22.95 ? 155 GLN A NE2 1 ATOM 1204 N N . SER A 1 156 ? -16.217 35.077 57.747 1.00 26.82 ? 156 SER A N 1 ATOM 1205 C CA . SER A 1 156 ? -17.008 35.162 56.527 1.00 25.94 ? 156 SER A CA 1 ATOM 1206 C C . SER A 1 156 ? -16.882 36.555 55.933 1.00 31.04 ? 156 SER A C 1 ATOM 1207 O O . SER A 1 156 ? -17.076 37.553 56.636 1.00 22.99 ? 156 SER A O 1 ATOM 1208 C CB . SER A 1 156 ? -18.479 34.834 56.801 1.00 24.84 ? 156 SER A CB 1 ATOM 1209 O OG . SER A 1 156 ? -19.227 34.834 55.599 1.00 27.14 ? 156 SER A OG 1 ATOM 1210 N N . GLY A 1 157 ? -16.568 36.615 54.639 1.00 33.66 ? 157 GLY A N 1 ATOM 1211 C CA . GLY A 1 157 ? -16.443 37.870 53.931 1.00 30.84 ? 157 GLY A CA 1 ATOM 1212 C C . GLY A 1 157 ? -15.096 38.547 54.043 1.00 26.69 ? 157 GLY A C 1 ATOM 1213 O O . GLY A 1 157 ? -14.830 39.483 53.278 1.00 28.65 ? 157 GLY A O 1 ATOM 1214 N N . ASN A 1 158 ? -14.235 38.111 54.959 1.00 25.21 ? 158 ASN A N 1 ATOM 1215 C CA . ASN A 1 158 ? -12.936 38.732 55.191 1.00 23.35 ? 158 ASN A CA 1 ATOM 1216 C C . ASN A 1 158 ? -11.789 37.854 54.695 1.00 21.80 ? 158 ASN A C 1 ATOM 1217 O O . ASN A 1 158 ? -10.716 37.809 55.301 1.00 22.47 ? 158 ASN A O 1 ATOM 1218 C CB . ASN A 1 158 ? -12.761 39.059 56.671 1.00 19.75 ? 158 ASN A CB 1 ATOM 1219 C CG . ASN A 1 158 ? -12.990 37.857 57.563 1.00 19.92 ? 158 ASN A CG 1 ATOM 1220 O OD1 . ASN A 1 158 ? -13.558 36.852 57.136 1.00 29.84 ? 158 ASN A OD1 1 ATOM 1221 N ND2 . ASN A 1 158 ? -12.554 37.958 58.812 1.00 19.98 ? 158 ASN A ND2 1 ATOM 1222 N N . SER A 1 159 ? -12.006 37.146 53.587 1.00 18.84 ? 159 SER A N 1 ATOM 1223 C CA . SER A 1 159 ? -10.973 36.320 52.980 1.00 18.07 ? 159 SER A CA 1 ATOM 1224 C C . SER A 1 159 ? -11.159 36.332 51.471 1.00 22.58 ? 159 SER A C 1 ATOM 1225 O O . SER A 1 159 ? -12.250 36.599 50.963 1.00 28.77 ? 159 SER A O 1 ATOM 1226 C CB . SER A 1 159 ? -11.009 34.882 53.512 1.00 18.12 ? 159 SER A CB 1 ATOM 1227 O OG . SER A 1 159 ? -12.214 34.239 53.132 1.00 19.07 ? 159 SER A OG 1 ATOM 1228 N N . GLN A 1 160 ? -10.075 36.041 50.757 1.00 24.13 ? 160 GLN A N 1 ATOM 1229 C CA . GLN A 1 160 ? -10.092 35.997 49.302 1.00 20.21 ? 160 GLN A CA 1 ATOM 1230 C C . GLN A 1 160 ? -9.290 34.799 48.823 1.00 21.61 ? 160 GLN A C 1 ATOM 1231 O O . GLN A 1 160 ? -8.240 34.477 49.388 1.00 16.52 ? 160 GLN A O 1 ATOM 1232 C CB . GLN A 1 160 ? -9.523 37.283 48.688 1.00 24.98 ? 160 GLN A CB 1 ATOM 1233 C CG . GLN A 1 160 ? -10.387 38.518 48.917 1.00 32.43 ? 160 GLN A CG 1 ATOM 1234 C CD . GLN A 1 160 ? -9.763 39.780 48.348 1.00 41.81 ? 160 GLN A CD 1 ATOM 1235 O OE1 . GLN A 1 160 ? -8.558 39.998 48.473 1.00 48.96 ? 160 GLN A OE1 1 ATOM 1236 N NE2 . GLN A 1 160 ? -10.581 40.614 47.716 1.00 44.09 ? 160 GLN A NE2 1 ATOM 1237 N N . GLU A 1 161 ? -9.786 34.149 47.774 1.00 19.40 ? 161 GLU A N 1 ATOM 1238 C CA . GLU A 1 161 ? -9.145 32.974 47.208 1.00 17.71 ? 161 GLU A CA 1 ATOM 1239 C C . GLU A 1 161 ? -8.523 33.295 45.855 1.00 26.63 ? 161 GLU A C 1 ATOM 1240 O O . GLU A 1 161 ? -8.949 34.213 45.149 1.00 22.47 ? 161 GLU A O 1 ATOM 1241 C CB . GLU A 1 161 ? -10.138 31.819 47.055 1.00 25.30 ? 161 GLU A CB 1 ATOM 1242 C CG . GLU A 1 161 ? -10.644 31.246 48.362 1.00 36.25 ? 161 GLU A CG 1 ATOM 1243 C CD . GLU A 1 161 ? -11.432 29.965 48.162 1.00 49.69 ? 161 GLU A CD 1 ATOM 1244 O OE1 . GLU A 1 161 ? -11.604 29.536 46.997 1.00 53.01 ? 161 GLU A OE1 1 ATOM 1245 O OE2 . GLU A 1 161 ? -11.878 29.384 49.174 1.00 58.06 ? 161 GLU A OE2 1 ATOM 1246 N N . SER A 1 162 ? -7.495 32.526 45.509 1.00 25.28 ? 162 SER A N 1 ATOM 1247 C CA . SER A 1 162 ? -6.851 32.629 44.209 1.00 17.13 ? 162 SER A CA 1 ATOM 1248 C C . SER A 1 162 ? -6.358 31.247 43.814 1.00 18.32 ? 162 SER A C 1 ATOM 1249 O O . SER A 1 162 ? -5.710 30.566 44.614 1.00 25.37 ? 162 SER A O 1 ATOM 1250 C CB . SER A 1 162 ? -5.693 33.629 44.239 1.00 16.39 ? 162 SER A CB 1 ATOM 1251 O OG . SER A 1 162 ? -5.208 33.882 42.933 1.00 33.06 ? 162 SER A OG 1 ATOM 1252 N N . VAL A 1 163 ? -6.671 30.835 42.591 1.00 17.84 ? 163 VAL A N 1 ATOM 1253 C CA . VAL A 1 163 ? -6.322 29.512 42.090 1.00 21.13 ? 163 VAL A CA 1 ATOM 1254 C C . VAL A 1 163 ? -5.429 29.679 40.871 1.00 21.06 ? 163 VAL A C 1 ATOM 1255 O O . VAL A 1 163 ? -5.777 30.414 39.939 1.00 25.85 ? 163 VAL A O 1 ATOM 1256 C CB . VAL A 1 163 ? -7.577 28.692 41.736 1.00 23.91 ? 163 VAL A CB 1 ATOM 1257 C CG1 . VAL A 1 163 ? -7.188 27.289 41.304 1.00 19.80 ? 163 VAL A CG1 1 ATOM 1258 C CG2 . VAL A 1 163 ? -8.536 28.651 42.919 1.00 29.50 ? 163 VAL A CG2 1 ATOM 1259 N N . THR A 1 164 ? -4.279 29.008 40.879 1.00 18.68 ? 164 THR A N 1 ATOM 1260 C CA . THR A 1 164 ? -3.443 28.997 39.690 1.00 21.47 ? 164 THR A CA 1 ATOM 1261 C C . THR A 1 164 ? -4.158 28.271 38.559 1.00 16.05 ? 164 THR A C 1 ATOM 1262 O O . THR A 1 164 ? -5.054 27.450 38.776 1.00 25.72 ? 164 THR A O 1 ATOM 1263 C CB . THR A 1 164 ? -2.100 28.309 39.954 1.00 16.14 ? 164 THR A CB 1 ATOM 1264 O OG1 . THR A 1 164 ? -2.325 26.955 40.367 1.00 15.56 ? 164 THR A OG1 1 ATOM 1265 C CG2 . THR A 1 164 ? -1.313 29.043 41.024 1.00 21.91 ? 164 THR A CG2 1 ATOM 1266 N N . GLU A 1 165 ? -3.755 28.583 37.333 1.00 25.04 ? 165 GLU A N 1 ATOM 1267 C CA . GLU A 1 165 ? -4.171 27.749 36.223 1.00 17.46 ? 165 GLU A CA 1 ATOM 1268 C C . GLU A 1 165 ? -3.530 26.369 36.359 1.00 16.57 ? 165 GLU A C 1 ATOM 1269 O O . GLU A 1 165 ? -2.682 26.127 37.224 1.00 15.65 ? 165 GLU A O 1 ATOM 1270 C CB . GLU A 1 165 ? -3.805 28.405 34.891 1.00 20.70 ? 165 GLU A CB 1 ATOM 1271 C CG . GLU A 1 165 ? -4.527 29.726 34.640 1.00 30.36 ? 165 GLU A CG 1 ATOM 1272 C CD . GLU A 1 165 ? -6.033 29.557 34.500 1.00 44.44 ? 165 GLU A CD 1 ATOM 1273 O OE1 . GLU A 1 165 ? -6.478 28.440 34.159 1.00 52.00 ? 165 GLU A OE1 1 ATOM 1274 O OE2 . GLU A 1 165 ? -6.772 30.540 34.732 1.00 42.35 ? 165 GLU A OE2 1 ATOM 1275 N N . GLN A 1 166 ? -3.951 25.450 35.499 1.00 20.59 ? 166 GLN A N 1 ATOM 1276 C CA . GLN A 1 166 ? -3.477 24.079 35.606 1.00 20.90 ? 166 GLN A CA 1 ATOM 1277 C C . GLN A 1 166 ? -1.983 24.000 35.307 1.00 23.07 ? 166 GLN A C 1 ATOM 1278 O O . GLN A 1 166 ? -1.477 24.647 34.384 1.00 17.10 ? 166 GLN A O 1 ATOM 1279 C CB . GLN A 1 166 ? -4.263 23.169 34.663 1.00 24.38 ? 166 GLN A CB 1 ATOM 1280 C CG . GLN A 1 166 ? -4.933 22.006 35.377 1.00 25.33 ? 166 GLN A CG 1 ATOM 1281 C CD . GLN A 1 166 ? -5.763 21.137 34.453 1.00 33.64 ? 166 GLN A CD 1 ATOM 1282 O OE1 . GLN A 1 166 ? -6.262 21.596 33.425 1.00 39.09 ? 166 GLN A OE1 1 ATOM 1283 N NE2 . GLN A 1 166 ? -5.911 19.868 34.816 1.00 26.81 ? 166 GLN A NE2 1 ATOM 1284 N N . ASP A 1 167 ? -1.274 23.215 36.115 1.00 20.69 ? 167 ASP A N 1 ATOM 1285 C CA . ASP A 1 167 ? 0.161 23.048 35.943 1.00 22.72 ? 167 ASP A CA 1 ATOM 1286 C C . ASP A 1 167 ? 0.453 22.250 34.677 1.00 20.98 ? 167 ASP A C 1 ATOM 1287 O O . ASP A 1 167 ? -0.208 21.251 34.386 1.00 22.27 ? 167 ASP A O 1 ATOM 1288 C CB . ASP A 1 167 ? 0.760 22.347 37.163 1.00 31.03 ? 167 ASP A CB 1 ATOM 1289 C CG . ASP A 1 167 ? 2.273 22.293 37.121 1.00 32.51 ? 167 ASP A CG 1 ATOM 1290 O OD1 . ASP A 1 167 ? 2.909 23.256 37.600 1.00 38.33 ? 167 ASP A OD1 1 ATOM 1291 O OD2 . ASP A 1 167 ? 2.822 21.290 36.616 1.00 22.38 ? 167 ASP A OD2 1 ATOM 1292 N N . SER A 1 168 ? 1.456 22.697 33.919 1.00 17.59 ? 168 SER A N 1 ATOM 1293 C CA . SER A 1 168 ? 1.763 22.047 32.651 1.00 19.72 ? 168 SER A CA 1 ATOM 1294 C C . SER A 1 168 ? 2.429 20.688 32.823 1.00 26.82 ? 168 SER A C 1 ATOM 1295 O O . SER A 1 168 ? 2.506 19.934 31.848 1.00 19.14 ? 168 SER A O 1 ATOM 1296 C CB . SER A 1 168 ? 2.658 22.945 31.793 1.00 19.06 ? 168 SER A CB 1 ATOM 1297 O OG . SER A 1 168 ? 3.968 23.034 32.327 1.00 37.01 ? 168 SER A OG 1 ATOM 1298 N N . LYS A 1 169 ? 2.905 20.352 34.023 1.00 26.04 ? 169 LYS A N 1 ATOM 1299 C CA . LYS A 1 169 ? 3.651 19.115 34.229 1.00 21.81 ? 169 LYS A CA 1 ATOM 1300 C C . LYS A 1 169 ? 2.834 18.013 34.890 1.00 25.39 ? 169 LYS A C 1 ATOM 1301 O O . LYS A 1 169 ? 2.901 16.861 34.452 1.00 32.45 ? 169 LYS A O 1 ATOM 1302 C CB . LYS A 1 169 ? 4.906 19.386 35.065 1.00 25.56 ? 169 LYS A CB 1 ATOM 1303 N N . ASP A 1 170 ? 2.068 18.325 35.939 1.00 27.17 ? 170 ASP A N 1 ATOM 1304 C CA . ASP A 1 170 ? 1.302 17.311 36.657 1.00 25.38 ? 170 ASP A CA 1 ATOM 1305 C C . ASP A 1 170 ? -0.195 17.596 36.683 1.00 26.53 ? 170 ASP A C 1 ATOM 1306 O O . ASP A 1 170 ? -0.940 16.871 37.355 1.00 20.87 ? 170 ASP A O 1 ATOM 1307 C CB . ASP A 1 170 ? 1.828 17.148 38.089 1.00 23.38 ? 170 ASP A CB 1 ATOM 1308 C CG . ASP A 1 170 ? 1.818 18.448 38.880 1.00 28.31 ? 170 ASP A CG 1 ATOM 1309 O OD1 . ASP A 1 170 ? 1.056 19.376 38.532 1.00 27.41 ? 170 ASP A OD1 1 ATOM 1310 O OD2 . ASP A 1 170 ? 2.576 18.535 39.868 1.00 31.35 ? 170 ASP A OD2 1 ATOM 1311 N N . SER A 1 171 ? -0.650 18.641 35.993 1.00 26.20 ? 171 SER A N 1 ATOM 1312 C CA . SER A 1 171 ? -2.070 18.948 35.816 1.00 37.01 ? 171 SER A CA 1 ATOM 1313 C C . SER A 1 171 ? -2.781 19.271 37.127 1.00 35.05 ? 171 SER A C 1 ATOM 1314 O O . SER A 1 171 ? -4.010 19.174 37.207 1.00 37.86 ? 171 SER A O 1 ATOM 1315 C CB . SER A 1 171 ? -2.797 17.803 35.102 1.00 17.09 ? 171 SER A CB 1 ATOM 1316 O OG . SER A 1 171 ? -2.219 17.547 33.836 1.00 21.31 ? 171 SER A OG 1 ATOM 1317 N N . THR A 1 172 ? -2.047 19.662 38.162 1.00 26.39 ? 172 THR A N 1 ATOM 1318 C CA . THR A 1 172 ? -2.674 19.983 39.434 1.00 25.35 ? 172 THR A CA 1 ATOM 1319 C C . THR A 1 172 ? -2.937 21.483 39.542 1.00 25.26 ? 172 THR A C 1 ATOM 1320 O O . THR A 1 172 ? -2.389 22.297 38.794 1.00 26.64 ? 172 THR A O 1 ATOM 1321 C CB . THR A 1 172 ? -1.803 19.527 40.607 1.00 24.30 ? 172 THR A CB 1 ATOM 1322 O OG1 . THR A 1 172 ? -0.593 20.292 40.634 1.00 30.85 ? 172 THR A OG1 1 ATOM 1323 C CG2 . THR A 1 172 ? -1.460 18.050 40.480 1.00 18.58 ? 172 THR A CG2 1 ATOM 1324 N N . TYR A 1 173 ? -3.798 21.838 40.487 1.00 20.85 ? 173 TYR A N 1 ATOM 1325 C CA . TYR A 1 173 ? -4.033 23.223 40.853 1.00 15.09 ? 173 TYR A CA 1 ATOM 1326 C C . TYR A 1 173 ? -3.441 23.499 42.228 1.00 14.64 ? 173 TYR A C 1 ATOM 1327 O O . TYR A 1 173 ? -3.210 22.588 43.027 1.00 17.60 ? 173 TYR A O 1 ATOM 1328 C CB . TYR A 1 173 ? -5.528 23.555 40.875 1.00 15.49 ? 173 TYR A CB 1 ATOM 1329 C CG . TYR A 1 173 ? -6.272 23.286 39.592 1.00 19.00 ? 173 TYR A CG 1 ATOM 1330 C CD1 . TYR A 1 173 ? -6.315 24.234 38.576 1.00 23.69 ? 173 TYR A CD1 1 ATOM 1331 C CD2 . TYR A 1 173 ? -6.963 22.094 39.409 1.00 24.62 ? 173 TYR A CD2 1 ATOM 1332 C CE1 . TYR A 1 173 ? -7.009 23.995 37.404 1.00 28.04 ? 173 TYR A CE1 1 ATOM 1333 C CE2 . TYR A 1 173 ? -7.660 21.846 38.242 1.00 32.87 ? 173 TYR A CE2 1 ATOM 1334 C CZ . TYR A 1 173 ? -7.681 22.799 37.244 1.00 31.83 ? 173 TYR A CZ 1 ATOM 1335 O OH . TYR A 1 173 ? -8.372 22.550 36.081 1.00 37.64 ? 173 TYR A OH 1 ATOM 1336 N N . SER A 1 174 ? -3.203 24.778 42.495 1.00 12.88 ? 174 SER A N 1 ATOM 1337 C CA . SER A 1 174 ? -2.818 25.241 43.817 1.00 13.88 ? 174 SER A CA 1 ATOM 1338 C C . SER A 1 174 ? -3.695 26.425 44.192 1.00 14.15 ? 174 SER A C 1 ATOM 1339 O O . SER A 1 174 ? -4.079 27.227 43.337 1.00 22.36 ? 174 SER A O 1 ATOM 1340 C CB . SER A 1 174 ? -1.334 25.628 43.878 1.00 12.43 ? 174 SER A CB 1 ATOM 1341 O OG . SER A 1 174 ? -0.509 24.477 43.789 1.00 12.38 ? 174 SER A OG 1 ATOM 1342 N N . LEU A 1 175 ? -4.018 26.525 45.478 1.00 15.30 ? 175 LEU A N 1 ATOM 1343 C CA . LEU A 1 175 ? -4.969 27.516 45.957 1.00 16.92 ? 175 LEU A CA 1 ATOM 1344 C C . LEU A 1 175 ? -4.393 28.262 47.149 1.00 19.02 ? 175 LEU A C 1 ATOM 1345 O O . LEU A 1 175 ? -3.776 27.661 48.033 1.00 13.28 ? 175 LEU A O 1 ATOM 1346 C CB . LEU A 1 175 ? -6.304 26.857 46.344 1.00 16.67 ? 175 LEU A CB 1 ATOM 1347 C CG . LEU A 1 175 ? -7.455 27.759 46.794 1.00 14.02 ? 175 LEU A CG 1 ATOM 1348 C CD1 . LEU A 1 175 ? -8.782 27.190 46.324 1.00 14.70 ? 175 LEU A CD1 1 ATOM 1349 C CD2 . LEU A 1 175 ? -7.465 27.930 48.306 1.00 13.90 ? 175 LEU A CD2 1 ATOM 1350 N N . SER A 1 176 ? -4.610 29.574 47.170 1.00 19.06 ? 176 SER A N 1 ATOM 1351 C CA . SER A 1 176 ? -4.256 30.416 48.301 1.00 16.30 ? 176 SER A CA 1 ATOM 1352 C C . SER A 1 176 ? -5.523 31.019 48.888 1.00 24.91 ? 176 SER A C 1 ATOM 1353 O O . SER A 1 176 ? -6.376 31.527 48.154 1.00 34.12 ? 176 SER A O 1 ATOM 1354 C CB . SER A 1 176 ? -3.296 31.536 47.890 1.00 14.96 ? 176 SER A CB 1 ATOM 1355 O OG . SER A 1 176 ? -4.000 32.607 47.285 1.00 32.25 ? 176 SER A OG 1 ATOM 1356 N N . SER A 1 177 ? -5.646 30.953 50.210 1.00 28.13 ? 177 SER A N 1 ATOM 1357 C CA . SER A 1 177 ? -6.735 31.596 50.936 1.00 25.19 ? 177 SER A CA 1 ATOM 1358 C C . SER A 1 177 ? -6.129 32.587 51.919 1.00 19.84 ? 177 SER A C 1 ATOM 1359 O O . SER A 1 177 ? -5.383 32.193 52.822 1.00 22.67 ? 177 SER A O 1 ATOM 1360 C CB . SER A 1 177 ? -7.601 30.566 51.662 1.00 22.72 ? 177 SER A CB 1 ATOM 1361 O OG . SER A 1 177 ? -8.734 31.180 52.248 1.00 19.72 ? 177 SER A OG 1 ATOM 1362 N N . THR A 1 178 ? -6.444 33.867 51.740 1.00 20.37 ? 178 THR A N 1 ATOM 1363 C CA . THR A 1 178 ? -5.841 34.947 52.516 1.00 20.65 ? 178 THR A CA 1 ATOM 1364 C C . THR A 1 178 ? -6.916 35.599 53.379 1.00 18.15 ? 178 THR A C 1 ATOM 1365 O O . THR A 1 178 ? -7.797 36.293 52.863 1.00 24.28 ? 178 THR A O 1 ATOM 1366 C CB . THR A 1 178 ? -5.181 35.975 51.595 1.00 23.28 ? 178 THR A CB 1 ATOM 1367 O OG1 . THR A 1 178 ? -4.356 35.301 50.636 1.00 23.30 ? 178 THR A OG1 1 ATOM 1368 C CG2 . THR A 1 178 ? -4.328 36.941 52.396 1.00 18.18 ? 178 THR A CG2 1 ATOM 1369 N N . LEU A 1 179 ? -6.843 35.372 54.689 1.00 27.99 ? 179 LEU A N 1 ATOM 1370 C CA . LEU A 1 179 ? -7.706 36.042 55.653 1.00 19.33 ? 179 LEU A CA 1 ATOM 1371 C C . LEU A 1 179 ? -7.059 37.358 56.066 1.00 23.17 ? 179 LEU A C 1 ATOM 1372 O O . LEU A 1 179 ? -5.876 37.387 56.421 1.00 37.06 ? 179 LEU A O 1 ATOM 1373 C CB . LEU A 1 179 ? -7.933 35.155 56.878 1.00 19.10 ? 179 LEU A CB 1 ATOM 1374 C CG . LEU A 1 179 ? -8.802 35.710 58.010 1.00 20.41 ? 179 LEU A CG 1 ATOM 1375 C CD1 . LEU A 1 179 ? -10.282 35.570 57.687 1.00 21.15 ? 179 LEU A CD1 1 ATOM 1376 C CD2 . LEU A 1 179 ? -8.467 35.022 59.324 1.00 26.44 ? 179 LEU A CD2 1 ATOM 1377 N N . THR A 1 180 ? -7.829 38.443 56.022 1.00 21.71 ? 180 THR A N 1 ATOM 1378 C CA . THR A 1 180 ? -7.304 39.779 56.285 1.00 33.94 ? 180 THR A CA 1 ATOM 1379 C C . THR A 1 180 ? -8.025 40.392 57.477 1.00 39.09 ? 180 THR A C 1 ATOM 1380 O O . THR A 1 180 ? -9.248 40.567 57.448 1.00 44.68 ? 180 THR A O 1 ATOM 1381 C CB . THR A 1 180 ? -7.440 40.682 55.058 1.00 38.62 ? 180 THR A CB 1 ATOM 1382 O OG1 . THR A 1 180 ? -6.746 40.092 53.954 1.00 43.77 ? 180 THR A OG1 1 ATOM 1383 C CG2 . THR A 1 180 ? -6.840 42.051 55.340 1.00 34.89 ? 180 THR A CG2 1 ATOM 1384 N N . LEU A 1 181 ? -7.262 40.725 58.513 1.00 36.34 ? 181 LEU A N 1 ATOM 1385 C CA . LEU A 1 181 ? -7.751 41.400 59.704 1.00 31.51 ? 181 LEU A CA 1 ATOM 1386 C C . LEU A 1 181 ? -7.025 42.728 59.869 1.00 40.66 ? 181 LEU A C 1 ATOM 1387 O O . LEU A 1 181 ? -5.994 42.983 59.241 1.00 44.19 ? 181 LEU A O 1 ATOM 1388 C CB . LEU A 1 181 ? -7.530 40.547 60.960 1.00 38.21 ? 181 LEU A CB 1 ATOM 1389 C CG . LEU A 1 181 ? -7.982 39.091 60.971 1.00 45.76 ? 181 LEU A CG 1 ATOM 1390 C CD1 . LEU A 1 181 ? -7.478 38.416 62.233 1.00 48.17 ? 181 LEU A CD1 1 ATOM 1391 C CD2 . LEU A 1 181 ? -9.495 38.998 60.880 1.00 54.18 ? 181 LEU A CD2 1 ATOM 1392 N N . SER A 1 182 ? -7.575 43.579 60.729 1.00 41.63 ? 182 SER A N 1 ATOM 1393 C CA . SER A 1 182 ? -6.807 44.709 61.220 1.00 42.39 ? 182 SER A CA 1 ATOM 1394 C C . SER A 1 182 ? -5.841 44.229 62.297 1.00 38.97 ? 182 SER A C 1 ATOM 1395 O O . SER A 1 182 ? -6.026 43.168 62.899 1.00 37.64 ? 182 SER A O 1 ATOM 1396 C CB . SER A 1 182 ? -7.727 45.793 61.782 1.00 35.13 ? 182 SER A CB 1 ATOM 1397 O OG . SER A 1 182 ? -8.249 45.411 63.044 1.00 33.19 ? 182 SER A OG 1 ATOM 1398 N N . LYS A 1 183 ? -4.786 45.015 62.531 1.00 36.73 ? 183 LYS A N 1 ATOM 1399 C CA . LYS A 1 183 ? -3.853 44.644 63.588 1.00 38.13 ? 183 LYS A CA 1 ATOM 1400 C C . LYS A 1 183 ? -4.544 44.617 64.941 1.00 31.75 ? 183 LYS A C 1 ATOM 1401 O O . LYS A 1 183 ? -4.210 43.785 65.790 1.00 32.53 ? 183 LYS A O 1 ATOM 1402 C CB . LYS A 1 183 ? -2.660 45.598 63.630 1.00 35.72 ? 183 LYS A CB 1 ATOM 1403 C CG . LYS A 1 183 ? -1.556 45.107 64.557 1.00 34.76 ? 183 LYS A CG 1 ATOM 1404 C CD . LYS A 1 183 ? -0.629 46.219 65.007 1.00 40.53 ? 183 LYS A CD 1 ATOM 1405 C CE . LYS A 1 183 ? 0.330 45.709 66.076 1.00 46.03 ? 183 LYS A CE 1 ATOM 1406 N NZ . LYS A 1 183 ? 1.198 46.786 66.629 1.00 53.02 ? 183 LYS A NZ 1 ATOM 1407 N N . ALA A 1 184 ? -5.516 45.507 65.152 1.00 38.62 ? 184 ALA A N 1 ATOM 1408 C CA . ALA A 1 184 ? -6.249 45.523 66.412 1.00 40.30 ? 184 ALA A CA 1 ATOM 1409 C C . ALA A 1 184 ? -7.003 44.217 66.624 1.00 37.31 ? 184 ALA A C 1 ATOM 1410 O O . ALA A 1 184 ? -6.906 43.597 67.690 1.00 34.92 ? 184 ALA A O 1 ATOM 1411 C CB . ALA A 1 184 ? -7.206 46.716 66.443 1.00 39.27 ? 184 ALA A CB 1 ATOM 1412 N N . ASP A 1 185 ? -7.754 43.776 65.611 1.00 43.28 ? 185 ASP A N 1 ATOM 1413 C CA . ASP A 1 185 ? -8.522 42.543 65.749 1.00 47.61 ? 185 ASP A CA 1 ATOM 1414 C C . ASP A 1 185 ? -7.615 41.322 65.816 1.00 42.42 ? 185 ASP A C 1 ATOM 1415 O O . ASP A 1 185 ? -7.931 40.357 66.520 1.00 46.35 ? 185 ASP A O 1 ATOM 1416 C CB . ASP A 1 185 ? -9.518 42.402 64.596 1.00 54.28 ? 185 ASP A CB 1 ATOM 1417 C CG . ASP A 1 185 ? -10.560 43.508 64.580 1.00 63.26 ? 185 ASP A CG 1 ATOM 1418 O OD1 . ASP A 1 185 ? -10.690 44.227 65.594 1.00 71.13 ? 185 ASP A OD1 1 ATOM 1419 O OD2 . ASP A 1 185 ? -11.259 43.651 63.553 1.00 63.68 ? 185 ASP A OD2 1 ATOM 1420 N N . TYR A 1 186 ? -6.491 41.343 65.099 1.00 42.05 ? 186 TYR A N 1 ATOM 1421 C CA . TYR A 1 186 ? -5.571 40.213 65.149 1.00 27.17 ? 186 TYR A CA 1 ATOM 1422 C C . TYR A 1 186 ? -4.947 40.053 66.529 1.00 29.89 ? 186 TYR A C 1 ATOM 1423 O O . TYR A 1 186 ? -4.669 38.926 66.953 1.00 28.34 ? 186 TYR A O 1 ATOM 1424 C CB . TYR A 1 186 ? -4.474 40.366 64.093 1.00 34.39 ? 186 TYR A CB 1 ATOM 1425 C CG . TYR A 1 186 ? -3.426 39.276 64.166 1.00 25.17 ? 186 TYR A CG 1 ATOM 1426 C CD1 . TYR A 1 186 ? -3.712 37.983 63.748 1.00 28.68 ? 186 TYR A CD1 1 ATOM 1427 C CD2 . TYR A 1 186 ? -2.156 39.537 64.658 1.00 26.03 ? 186 TYR A CD2 1 ATOM 1428 C CE1 . TYR A 1 186 ? -2.763 36.981 63.819 1.00 28.70 ? 186 TYR A CE1 1 ATOM 1429 C CE2 . TYR A 1 186 ? -1.199 38.543 64.729 1.00 27.02 ? 186 TYR A CE2 1 ATOM 1430 C CZ . TYR A 1 186 ? -1.508 37.267 64.311 1.00 27.47 ? 186 TYR A CZ 1 ATOM 1431 O OH . TYR A 1 186 ? -0.557 36.275 64.383 1.00 23.32 ? 186 TYR A OH 1 ATOM 1432 N N . GLU A 1 187 ? -4.717 41.153 67.245 1.00 46.60 ? 187 GLU A N 1 ATOM 1433 C CA . GLU A 1 187 ? -4.102 41.050 68.562 1.00 43.61 ? 187 GLU A CA 1 ATOM 1434 C C . GLU A 1 187 ? -5.094 40.683 69.659 1.00 36.92 ? 187 GLU A C 1 ATOM 1435 O O . GLU A 1 187 ? -4.667 40.334 70.765 1.00 32.60 ? 187 GLU A O 1 ATOM 1436 C CB . GLU A 1 187 ? -3.391 42.358 68.923 1.00 38.46 ? 187 GLU A CB 1 ATOM 1437 C CG . GLU A 1 187 ? -2.191 42.700 68.041 1.00 36.55 ? 187 GLU A CG 1 ATOM 1438 C CD . GLU A 1 187 ? -1.007 41.761 68.234 1.00 41.65 ? 187 GLU A CD 1 ATOM 1439 O OE1 . GLU A 1 187 ? -0.057 41.833 67.425 1.00 40.48 ? 187 GLU A OE1 1 ATOM 1440 O OE2 . GLU A 1 187 ? -1.019 40.956 69.190 1.00 44.06 ? 187 GLU A OE2 1 ATOM 1441 N N . LYS A 1 188 ? -6.395 40.738 69.386 1.00 36.63 ? 188 LYS A N 1 ATOM 1442 C CA . LYS A 1 188 ? -7.408 40.387 70.372 1.00 39.70 ? 188 LYS A CA 1 ATOM 1443 C C . LYS A 1 188 ? -7.803 38.915 70.328 1.00 42.49 ? 188 LYS A C 1 ATOM 1444 O O . LYS A 1 188 ? -8.770 38.531 70.995 1.00 46.66 ? 188 LYS A O 1 ATOM 1445 C CB . LYS A 1 188 ? -8.654 41.257 70.182 1.00 40.81 ? 188 LYS A CB 1 ATOM 1446 C CG . LYS A 1 188 ? -8.514 42.666 70.731 1.00 48.94 ? 188 LYS A CG 1 ATOM 1447 C CD . LYS A 1 188 ? -9.643 43.563 70.249 1.00 54.26 ? 188 LYS A CD 1 ATOM 1448 C CE . LYS A 1 188 ? -9.441 44.997 70.712 1.00 59.97 ? 188 LYS A CE 1 ATOM 1449 N NZ . LYS A 1 188 ? -10.312 45.948 69.966 1.00 62.66 ? 188 LYS A NZ 1 ATOM 1450 N N . HIS A 1 189 ? -7.083 38.084 69.575 1.00 36.40 ? 189 HIS A N 1 ATOM 1451 C CA . HIS A 1 189 ? -7.445 36.682 69.423 1.00 35.34 ? 189 HIS A CA 1 ATOM 1452 C C . HIS A 1 189 ? -6.193 35.819 69.509 1.00 32.33 ? 189 HIS A C 1 ATOM 1453 O O . HIS A 1 189 ? -5.068 36.322 69.554 1.00 36.20 ? 189 HIS A O 1 ATOM 1454 C CB . HIS A 1 189 ? -8.199 36.451 68.111 1.00 40.45 ? 189 HIS A CB 1 ATOM 1455 C CG . HIS A 1 189 ? -9.488 37.209 68.022 1.00 47.91 ? 189 HIS A CG 1 ATOM 1456 N ND1 . HIS A 1 189 ? -10.583 36.907 68.803 1.00 52.81 ? 189 HIS A ND1 1 ATOM 1457 C CD2 . HIS A 1 189 ? -9.853 38.265 67.256 1.00 42.34 ? 189 HIS A CD2 1 ATOM 1458 C CE1 . HIS A 1 189 ? -11.569 37.739 68.517 1.00 45.67 ? 189 HIS A CE1 1 ATOM 1459 N NE2 . HIS A 1 189 ? -11.151 38.573 67.582 1.00 41.15 ? 189 HIS A NE2 1 ATOM 1460 N N . LYS A 1 190 ? -6.400 34.500 69.540 1.00 35.08 ? 190 LYS A N 1 ATOM 1461 C CA . LYS A 1 190 ? -5.299 33.573 69.782 1.00 36.50 ? 190 LYS A CA 1 ATOM 1462 C C . LYS A 1 190 ? -5.185 32.479 68.725 1.00 34.31 ? 190 LYS A C 1 ATOM 1463 O O . LYS A 1 190 ? -4.113 32.289 68.142 1.00 34.60 ? 190 LYS A O 1 ATOM 1464 C CB . LYS A 1 190 ? -5.442 32.931 71.165 1.00 41.14 ? 190 LYS A CB 1 ATOM 1465 C CG . LYS A 1 190 ? -4.302 31.982 71.513 1.00 52.25 ? 190 LYS A CG 1 ATOM 1466 C CD . LYS A 1 190 ? -4.590 31.172 72.767 1.00 60.23 ? 190 LYS A CD 1 ATOM 1467 C CE . LYS A 1 190 ? -3.502 30.132 73.007 1.00 59.51 ? 190 LYS A CE 1 ATOM 1468 N NZ . LYS A 1 190 ? -3.787 29.282 74.195 1.00 54.66 ? 190 LYS A NZ 1 ATOM 1469 N N . VAL A 1 191 ? -6.264 31.740 68.480 1.00 35.20 ? 191 VAL A N 1 ATOM 1470 C CA . VAL A 1 191 ? -6.223 30.543 67.643 1.00 27.96 ? 191 VAL A CA 1 ATOM 1471 C C . VAL A 1 191 ? -6.725 30.891 66.248 1.00 22.68 ? 191 VAL A C 1 ATOM 1472 O O . VAL A 1 191 ? -7.834 31.415 66.088 1.00 31.46 ? 191 VAL A O 1 ATOM 1473 C CB . VAL A 1 191 ? -7.049 29.402 68.258 1.00 24.60 ? 191 VAL A CB 1 ATOM 1474 C CG1 . VAL A 1 191 ? -7.214 28.266 67.260 1.00 23.42 ? 191 VAL A CG1 1 ATOM 1475 C CG2 . VAL A 1 191 ? -6.385 28.900 69.526 1.00 25.96 ? 191 VAL A CG2 1 ATOM 1476 N N . TYR A 1 192 ? -5.913 30.586 65.236 1.00 21.48 ? 192 TYR A N 1 ATOM 1477 C CA . TYR A 1 192 ? -6.254 30.834 63.840 1.00 27.67 ? 192 TYR A CA 1 ATOM 1478 C C . TYR A 1 192 ? -6.119 29.529 63.071 1.00 26.00 ? 192 TYR A C 1 ATOM 1479 O O . TYR A 1 192 ? -5.022 28.966 62.994 1.00 30.83 ? 192 TYR A O 1 ATOM 1480 C CB . TYR A 1 192 ? -5.352 31.913 63.234 1.00 20.04 ? 192 TYR A CB 1 ATOM 1481 C CG . TYR A 1 192 ? -5.524 33.270 63.873 1.00 25.30 ? 192 TYR A CG 1 ATOM 1482 C CD1 . TYR A 1 192 ? -4.886 33.586 65.065 1.00 25.46 ? 192 TYR A CD1 1 ATOM 1483 C CD2 . TYR A 1 192 ? -6.330 34.234 63.287 1.00 25.29 ? 192 TYR A CD2 1 ATOM 1484 C CE1 . TYR A 1 192 ? -5.045 34.825 65.654 1.00 23.42 ? 192 TYR A CE1 1 ATOM 1485 C CE2 . TYR A 1 192 ? -6.494 35.474 63.867 1.00 30.84 ? 192 TYR A CE2 1 ATOM 1486 C CZ . TYR A 1 192 ? -5.850 35.764 65.049 1.00 29.66 ? 192 TYR A CZ 1 ATOM 1487 O OH . TYR A 1 192 ? -6.016 37.001 65.624 1.00 31.74 ? 192 TYR A OH 1 ATOM 1488 N N . ALA A 1 193 ? -7.225 29.055 62.499 1.00 26.63 ? 193 ALA A N 1 ATOM 1489 C CA . ALA A 1 193 ? -7.248 27.764 61.827 1.00 29.44 ? 193 ALA A CA 1 ATOM 1490 C C . ALA A 1 193 ? -7.983 27.869 60.501 1.00 17.67 ? 193 ALA A C 1 ATOM 1491 O O . ALA A 1 193 ? -9.065 28.458 60.434 1.00 34.49 ? 193 ALA A O 1 ATOM 1492 C CB . ALA A 1 193 ? -7.917 26.703 62.706 1.00 19.20 ? 193 ALA A CB 1 ATOM 1493 N N . CYS A 1 194 ? -7.398 27.294 59.454 1.00 18.85 ? 194 CYS A N 1 ATOM 1494 C CA . CYS A 1 194 ? -8.083 27.097 58.183 1.00 34.35 ? 194 CYS A CA 1 ATOM 1495 C C . CYS A 1 194 ? -8.364 25.610 58.012 1.00 31.99 ? 194 CYS A C 1 ATOM 1496 O O . CYS A 1 194 ? -7.448 24.785 58.098 1.00 21.70 ? 194 CYS A O 1 ATOM 1497 C CB . CYS A 1 194 ? -7.276 27.644 57.001 1.00 42.58 ? 194 CYS A CB 1 ATOM 1498 S SG . CYS A 1 194 ? -5.650 26.916 56.677 1.00 54.21 ? 194 CYS A SG 1 ATOM 1499 N N . GLU A 1 195 ? -9.633 25.273 57.801 1.00 29.46 ? 195 GLU A N 1 ATOM 1500 C CA . GLU A 1 195 ? -10.056 23.899 57.579 1.00 22.68 ? 195 GLU A CA 1 ATOM 1501 C C . GLU A 1 195 ? -10.259 23.683 56.086 1.00 27.85 ? 195 GLU A C 1 ATOM 1502 O O . GLU A 1 195 ? -10.936 24.478 55.425 1.00 28.30 ? 195 GLU A O 1 ATOM 1503 C CB . GLU A 1 195 ? -11.341 23.596 58.349 1.00 17.94 ? 195 GLU A CB 1 ATOM 1504 C CG . GLU A 1 195 ? -11.637 22.120 58.517 1.00 31.16 ? 195 GLU A CG 1 ATOM 1505 C CD . GLU A 1 195 ? -12.990 21.874 59.150 1.00 34.25 ? 195 GLU A CD 1 ATOM 1506 O OE1 . GLU A 1 195 ? -14.006 22.268 58.539 1.00 41.36 ? 195 GLU A OE1 1 ATOM 1507 O OE2 . GLU A 1 195 ? -13.039 21.295 60.256 1.00 32.95 ? 195 GLU A OE2 1 ATOM 1508 N N . VAL A 1 196 ? -9.669 22.614 55.559 1.00 22.85 ? 196 VAL A N 1 ATOM 1509 C CA . VAL A 1 196 ? -9.670 22.332 54.128 1.00 19.03 ? 196 VAL A CA 1 ATOM 1510 C C . VAL A 1 196 ? -10.450 21.051 53.876 1.00 20.65 ? 196 VAL A C 1 ATOM 1511 O O . VAL A 1 196 ? -10.205 20.024 54.524 1.00 26.06 ? 196 VAL A O 1 ATOM 1512 C CB . VAL A 1 196 ? -8.239 22.221 53.575 1.00 17.47 ? 196 VAL A CB 1 ATOM 1513 C CG1 . VAL A 1 196 ? -8.256 21.687 52.156 1.00 14.16 ? 196 VAL A CG1 1 ATOM 1514 C CG2 . VAL A 1 196 ? -7.542 23.570 53.634 1.00 14.02 ? 196 VAL A CG2 1 ATOM 1515 N N . THR A 1 197 ? -11.385 21.117 52.933 1.00 18.22 ? 197 THR A N 1 ATOM 1516 C CA . THR A 1 197 ? -12.163 19.972 52.489 1.00 21.35 ? 197 THR A CA 1 ATOM 1517 C C . THR A 1 197 ? -11.889 19.757 51.007 1.00 21.00 ? 197 THR A C 1 ATOM 1518 O O . THR A 1 197 ? -11.929 20.712 50.223 1.00 31.63 ? 197 THR A O 1 ATOM 1519 C CB . THR A 1 197 ? -13.662 20.196 52.746 1.00 26.37 ? 197 THR A CB 1 ATOM 1520 O OG1 . THR A 1 197 ? -13.915 20.190 54.150 1.00 18.69 ? 197 THR A OG1 1 ATOM 1521 C CG2 . THR A 1 197 ? -14.490 19.093 52.086 1.00 24.66 ? 197 THR A CG2 1 ATOM 1522 N N . HIS A 1 198 ? -11.577 18.517 50.636 1.00 16.60 ? 198 HIS A N 1 ATOM 1523 C CA . HIS A 1 198 ? -11.292 18.176 49.250 1.00 20.13 ? 198 HIS A CA 1 ATOM 1524 C C . HIS A 1 198 ? -11.707 16.732 49.013 1.00 20.11 ? 198 HIS A C 1 ATOM 1525 O O . HIS A 1 198 ? -11.828 15.938 49.950 1.00 24.83 ? 198 HIS A O 1 ATOM 1526 C CB . HIS A 1 198 ? -9.808 18.381 48.910 1.00 24.17 ? 198 HIS A CB 1 ATOM 1527 C CG . HIS A 1 198 ? -9.490 18.216 47.456 1.00 26.58 ? 198 HIS A CG 1 ATOM 1528 N ND1 . HIS A 1 198 ? -9.123 17.007 46.906 1.00 15.50 ? 198 HIS A ND1 1 ATOM 1529 C CD2 . HIS A 1 198 ? -9.480 19.111 46.439 1.00 29.02 ? 198 HIS A CD2 1 ATOM 1530 C CE1 . HIS A 1 198 ? -8.902 17.164 45.612 1.00 27.01 ? 198 HIS A CE1 1 ATOM 1531 N NE2 . HIS A 1 198 ? -9.110 18.432 45.304 1.00 23.44 ? 198 HIS A NE2 1 ATOM 1532 N N . GLN A 1 199 ? -11.936 16.402 47.738 1.00 24.11 ? 199 GLN A N 1 ATOM 1533 C CA . GLN A 1 199 ? -12.374 15.055 47.380 1.00 30.36 ? 199 GLN A CA 1 ATOM 1534 C C . GLN A 1 199 ? -11.342 13.998 47.764 1.00 29.70 ? 199 GLN A C 1 ATOM 1535 O O . GLN A 1 199 ? -11.706 12.879 48.148 1.00 24.03 ? 199 GLN A O 1 ATOM 1536 C CB . GLN A 1 199 ? -12.679 14.998 45.880 1.00 25.34 ? 199 GLN A CB 1 ATOM 1537 C CG . GLN A 1 199 ? -13.111 13.633 45.370 1.00 31.85 ? 199 GLN A CG 1 ATOM 1538 C CD . GLN A 1 199 ? -13.486 13.651 43.897 1.00 38.62 ? 199 GLN A CD 1 ATOM 1539 O OE1 . GLN A 1 199 ? -13.782 14.705 43.328 1.00 40.85 ? 199 GLN A OE1 1 ATOM 1540 N NE2 . GLN A 1 199 ? -13.480 12.477 43.273 1.00 45.34 ? 199 GLN A NE2 1 ATOM 1541 N N . GLY A 1 200 ? -10.059 14.332 47.685 1.00 21.35 ? 200 GLY A N 1 ATOM 1542 C CA . GLY A 1 200 ? -8.993 13.402 47.993 1.00 20.11 ? 200 GLY A CA 1 ATOM 1543 C C . GLY A 1 200 ? -8.639 13.244 49.454 1.00 25.93 ? 200 GLY A C 1 ATOM 1544 O O . GLY A 1 200 ? -7.703 12.506 49.778 1.00 36.49 ? 200 GLY A O 1 ATOM 1545 N N . LEU A 1 201 ? -9.347 13.917 50.353 1.00 22.44 ? 201 LEU A N 1 ATOM 1546 C CA . LEU A 1 201 ? -9.137 13.778 51.787 1.00 25.26 ? 201 LEU A CA 1 ATOM 1547 C C . LEU A 1 201 ? -10.306 13.014 52.392 1.00 19.58 ? 201 LEU A C 1 ATOM 1548 O O . LEU A 1 201 ? -11.468 13.313 52.095 1.00 25.34 ? 201 LEU A O 1 ATOM 1549 C CB . LEU A 1 201 ? -8.990 15.146 52.455 1.00 17.42 ? 201 LEU A CB 1 ATOM 1550 C CG . LEU A 1 201 ? -7.746 15.953 52.076 1.00 16.33 ? 201 LEU A CG 1 ATOM 1551 C CD1 . LEU A 1 201 ? -7.843 17.367 52.620 1.00 15.72 ? 201 LEU A CD1 1 ATOM 1552 C CD2 . LEU A 1 201 ? -6.488 15.269 52.585 1.00 17.10 ? 201 LEU A CD2 1 ATOM 1553 N N . SER A 1 202 ? -9.999 12.021 53.230 1.00 37.01 ? 202 SER A N 1 ATOM 1554 C CA . SER A 1 202 ? -11.057 11.249 53.869 1.00 30.65 ? 202 SER A CA 1 ATOM 1555 C C . SER A 1 202 ? -11.779 12.044 54.948 1.00 33.91 ? 202 SER A C 1 ATOM 1556 O O . SER A 1 202 ? -12.918 11.711 55.288 1.00 45.31 ? 202 SER A O 1 ATOM 1557 C CB . SER A 1 202 ? -10.489 9.956 54.459 1.00 23.53 ? 202 SER A CB 1 ATOM 1558 O OG . SER A 1 202 ? -9.496 10.226 55.431 1.00 37.84 ? 202 SER A OG 1 ATOM 1559 N N . SER A 1 203 ? -11.145 13.083 55.485 1.00 29.97 ? 203 SER A N 1 ATOM 1560 C CA . SER A 1 203 ? -11.758 13.955 56.476 1.00 35.88 ? 203 SER A CA 1 ATOM 1561 C C . SER A 1 203 ? -11.026 15.288 56.442 1.00 35.73 ? 203 SER A C 1 ATOM 1562 O O . SER A 1 203 ? -9.845 15.324 56.078 1.00 27.60 ? 203 SER A O 1 ATOM 1563 C CB . SER A 1 203 ? -11.700 13.333 57.881 1.00 38.10 ? 203 SER A CB 1 ATOM 1564 O OG . SER A 1 203 ? -10.368 13.041 58.263 1.00 39.66 ? 203 SER A OG 1 ATOM 1565 N N . PRO A 1 204 ? -11.688 16.389 56.802 1.00 30.06 ? 204 PRO A N 1 ATOM 1566 C CA . PRO A 1 204 ? -11.074 17.714 56.627 1.00 23.64 ? 204 PRO A CA 1 ATOM 1567 C C . PRO A 1 204 ? -9.770 17.857 57.397 1.00 22.75 ? 204 PRO A C 1 ATOM 1568 O O . PRO A 1 204 ? -9.637 17.389 58.529 1.00 33.64 ? 204 PRO A O 1 ATOM 1569 C CB . PRO A 1 204 ? -12.145 18.674 57.160 1.00 22.40 ? 204 PRO A CB 1 ATOM 1570 C CG . PRO A 1 204 ? -13.420 17.933 57.005 1.00 27.51 ? 204 PRO A CG 1 ATOM 1571 C CD . PRO A 1 204 ? -13.087 16.489 57.246 1.00 27.82 ? 204 PRO A CD 1 ATOM 1572 N N . VAL A 1 205 ? -8.803 18.517 56.759 1.00 17.34 ? 205 VAL A N 1 ATOM 1573 C CA . VAL A 1 205 ? -7.489 18.778 57.337 1.00 17.16 ? 205 VAL A CA 1 ATOM 1574 C C . VAL A 1 205 ? -7.468 20.207 57.857 1.00 27.45 ? 205 VAL A C 1 ATOM 1575 O O . VAL A 1 205 ? -7.815 21.146 57.130 1.00 25.85 ? 205 VAL A O 1 ATOM 1576 C CB . VAL A 1 205 ? -6.372 18.556 56.303 1.00 16.44 ? 205 VAL A CB 1 ATOM 1577 C CG1 . VAL A 1 205 ? -5.042 19.056 56.841 1.00 16.38 ? 205 VAL A CG1 1 ATOM 1578 C CG2 . VAL A 1 205 ? -6.282 17.085 55.927 1.00 29.93 ? 205 VAL A CG2 1 ATOM 1579 N N . THR A 1 206 ? -7.055 20.377 59.110 1.00 17.51 ? 206 THR A N 1 ATOM 1580 C CA . THR A 1 206 ? -7.008 21.685 59.753 1.00 17.47 ? 206 THR A CA 1 ATOM 1581 C C . THR A 1 206 ? -5.572 22.011 60.137 1.00 22.23 ? 206 THR A C 1 ATOM 1582 O O . THR A 1 206 ? -4.918 21.230 60.836 1.00 19.47 ? 206 THR A O 1 ATOM 1583 C CB . THR A 1 206 ? -7.914 21.725 60.984 1.00 18.60 ? 206 THR A CB 1 ATOM 1584 O OG1 . THR A 1 206 ? -9.273 21.513 60.582 1.00 23.25 ? 206 THR A OG1 1 ATOM 1585 C CG2 . THR A 1 206 ? -7.808 23.071 61.682 1.00 26.60 ? 206 THR A CG2 1 ATOM 1586 N N . LYS A 1 207 ? -5.084 23.155 59.669 1.00 21.40 ? 207 LYS A N 1 ATOM 1587 C CA . LYS A 1 207 ? -3.810 23.711 60.096 1.00 26.31 ? 207 LYS A CA 1 ATOM 1588 C C . LYS A 1 207 ? -4.075 24.957 60.929 1.00 31.11 ? 207 LYS A C 1 ATOM 1589 O O . LYS A 1 207 ? -4.902 25.795 60.558 1.00 32.08 ? 207 LYS A O 1 ATOM 1590 C CB . LYS A 1 207 ? -2.924 24.058 58.897 1.00 27.07 ? 207 LYS A CB 1 ATOM 1591 C CG . LYS A 1 207 ? -2.468 22.856 58.092 1.00 21.74 ? 207 LYS A CG 1 ATOM 1592 C CD . LYS A 1 207 ? -1.523 21.974 58.890 1.00 19.97 ? 207 LYS A CD 1 ATOM 1593 C CE . LYS A 1 207 ? -1.080 20.774 58.069 1.00 31.44 ? 207 LYS A CE 1 ATOM 1594 N NZ . LYS A 1 207 ? -0.056 19.962 58.780 1.00 47.21 ? 207 LYS A NZ 1 ATOM 1595 N N . SER A 1 208 ? -3.378 25.077 62.056 1.00 34.35 ? 208 SER A N 1 ATOM 1596 C CA . SER A 1 208 ? -3.671 26.153 62.990 1.00 31.30 ? 208 SER A CA 1 ATOM 1597 C C . SER A 1 208 ? -2.408 26.567 63.726 1.00 31.82 ? 208 SER A C 1 ATOM 1598 O O . SER A 1 208 ? -1.414 25.837 63.767 1.00 44.72 ? 208 SER A O 1 ATOM 1599 C CB . SER A 1 208 ? -4.753 25.740 63.993 1.00 30.07 ? 208 SER A CB 1 ATOM 1600 O OG . SER A 1 208 ? -4.433 24.503 64.602 1.00 43.08 ? 208 SER A OG 1 ATOM 1601 N N . PHE A 1 209 ? -2.468 27.757 64.319 1.00 20.79 ? 209 PHE A N 1 ATOM 1602 C CA . PHE A 1 209 ? -1.390 28.261 65.152 1.00 27.23 ? 209 PHE A CA 1 ATOM 1603 C C . PHE A 1 209 ? -1.982 29.178 66.211 1.00 31.62 ? 209 PHE A C 1 ATOM 1604 O O . PHE A 1 209 ? -3.072 29.731 66.042 1.00 33.10 ? 209 PHE A O 1 ATOM 1605 C CB . PHE A 1 209 ? -0.334 29.004 64.323 1.00 30.64 ? 209 PHE A CB 1 ATOM 1606 C CG . PHE A 1 209 ? -0.836 30.278 63.695 1.00 27.83 ? 209 PHE A CG 1 ATOM 1607 C CD1 . PHE A 1 209 ? -0.722 31.489 64.363 1.00 26.64 ? 209 PHE A CD1 1 ATOM 1608 C CD2 . PHE A 1 209 ? -1.412 30.268 62.436 1.00 21.95 ? 209 PHE A CD2 1 ATOM 1609 C CE1 . PHE A 1 209 ? -1.180 32.660 63.791 1.00 23.65 ? 209 PHE A CE1 1 ATOM 1610 C CE2 . PHE A 1 209 ? -1.869 31.440 61.858 1.00 23.50 ? 209 PHE A CE2 1 ATOM 1611 C CZ . PHE A 1 209 ? -1.753 32.636 62.537 1.00 19.73 ? 209 PHE A CZ 1 ATOM 1612 N N . ASN A 1 210 ? -1.252 29.331 67.309 1.00 34.07 ? 210 ASN A N 1 ATOM 1613 C CA . ASN A 1 210 ? -1.586 30.307 68.337 1.00 34.07 ? 210 ASN A CA 1 ATOM 1614 C C . ASN A 1 210 ? -0.653 31.500 68.189 1.00 32.54 ? 210 ASN A C 1 ATOM 1615 O O . ASN A 1 210 ? 0.564 31.326 68.060 1.00 40.00 ? 210 ASN A O 1 ATOM 1616 C CB . ASN A 1 210 ? -1.464 29.709 69.740 1.00 41.41 ? 210 ASN A CB 1 ATOM 1617 C CG . ASN A 1 210 ? -2.165 28.368 69.873 1.00 38.24 ? 210 ASN A CG 1 ATOM 1618 O OD1 . ASN A 1 210 ? -1.719 27.498 70.618 1.00 38.36 ? 210 ASN A OD1 1 ATOM 1619 N ND2 . ASN A 1 210 ? -3.262 28.194 69.146 1.00 40.96 ? 210 ASN A ND2 1 ATOM 1620 N N . ARG A 1 211 ? -1.224 32.706 68.194 1.00 26.85 ? 211 ARG A N 1 ATOM 1621 C CA . ARG A 1 211 ? -0.429 33.919 68.046 1.00 39.60 ? 211 ARG A CA 1 ATOM 1622 C C . ARG A 1 211 ? 0.648 33.984 69.122 1.00 44.69 ? 211 ARG A C 1 ATOM 1623 O O . ARG A 1 211 ? 0.373 34.324 70.278 1.00 39.10 ? 211 ARG A O 1 ATOM 1624 C CB . ARG A 1 211 ? -1.318 35.160 68.095 1.00 36.36 ? 211 ARG A CB 1 ATOM 1625 C CG . ARG A 1 211 ? -0.551 36.462 67.976 1.00 36.45 ? 211 ARG A CG 1 ATOM 1626 C CD . ARG A 1 211 ? -1.484 37.656 68.013 1.00 38.87 ? 211 ARG A CD 1 ATOM 1627 N NE . ARG A 1 211 ? -2.543 37.494 69.002 1.00 42.25 ? 211 ARG A NE 1 ATOM 1628 C CZ . ARG A 1 211 ? -2.384 37.676 70.308 1.00 41.35 ? 211 ARG A CZ 1 ATOM 1629 N NH1 . ARG A 1 211 ? -1.200 38.024 70.794 1.00 44.62 ? 211 ARG A NH1 1 ATOM 1630 N NH2 . ARG A 1 211 ? -3.411 37.505 71.130 1.00 39.91 ? 211 ARG A NH2 1 ATOM 1631 N N . GLY A 1 212 ? 1.878 33.653 68.741 1.00 54.47 ? 212 GLY A N 1 ATOM 1632 C CA . GLY A 1 212 ? 2.961 33.463 69.689 1.00 61.88 ? 212 GLY A CA 1 ATOM 1633 C C . GLY A 1 212 ? 3.358 32.002 69.799 1.00 65.24 ? 212 GLY A C 1 ATOM 1634 O O . GLY A 1 212 ? 4.242 31.535 69.072 1.00 54.32 ? 212 GLY A O 1 ATOM 1635 N N . ALA A 1 213 ? 2.700 31.272 70.698 1.00 71.49 ? 213 ALA A N 1 ATOM 1636 C CA . ALA A 1 213 ? 2.929 29.837 70.866 1.00 72.34 ? 213 ALA A CA 1 ATOM 1637 C C . ALA A 1 213 ? 1.749 29.169 71.580 1.00 75.40 ? 213 ALA A C 1 ATOM 1638 O O . ALA A 1 213 ? 0.887 29.840 72.152 1.00 71.63 ? 213 ALA A O 1 ATOM 1639 C CB . ALA A 1 213 ? 4.222 29.589 71.636 1.00 70.63 ? 213 ALA A CB 1 ATOM 1640 O OXT . ALA A 1 213 ? 1.624 27.943 71.608 1.00 80.23 ? 213 ALA A OXT 1 ATOM 1641 N N . GLN B 2 1 ? 17.805 34.810 16.902 1.00 34.92 ? 1 GLN B N 1 ATOM 1642 C CA . GLN B 2 1 ? 16.726 34.651 15.929 1.00 59.79 ? 1 GLN B CA 1 ATOM 1643 C C . GLN B 2 1 ? 15.829 35.888 15.873 1.00 51.73 ? 1 GLN B C 1 ATOM 1644 O O . GLN B 2 1 ? 16.238 36.983 16.263 1.00 59.20 ? 1 GLN B O 1 ATOM 1645 C CB . GLN B 2 1 ? 15.885 33.413 16.256 1.00 66.71 ? 1 GLN B CB 1 ATOM 1646 N N . VAL B 2 2 ? 14.608 35.705 15.380 1.00 26.66 ? 2 VAL B N 1 ATOM 1647 C CA . VAL B 2 2 ? 13.649 36.799 15.271 1.00 26.84 ? 2 VAL B CA 1 ATOM 1648 C C . VAL B 2 2 ? 13.024 37.056 16.636 1.00 24.55 ? 2 VAL B C 1 ATOM 1649 O O . VAL B 2 2 ? 12.530 36.130 17.291 1.00 26.27 ? 2 VAL B O 1 ATOM 1650 C CB . VAL B 2 2 ? 12.576 36.476 14.220 1.00 28.91 ? 2 VAL B CB 1 ATOM 1651 C CG1 . VAL B 2 2 ? 11.453 37.503 14.269 1.00 21.75 ? 2 VAL B CG1 1 ATOM 1652 C CG2 . VAL B 2 2 ? 13.198 36.428 12.836 1.00 23.55 ? 2 VAL B CG2 1 ATOM 1653 N N . GLN B 2 3 ? 13.044 38.316 17.070 1.00 24.69 ? 3 GLN B N 1 ATOM 1654 C CA . GLN B 2 3 ? 12.505 38.699 18.367 1.00 30.21 ? 3 GLN B CA 1 ATOM 1655 C C . GLN B 2 3 ? 11.834 40.060 18.270 1.00 32.19 ? 3 GLN B C 1 ATOM 1656 O O . GLN B 2 3 ? 12.255 40.926 17.499 1.00 35.61 ? 3 GLN B O 1 ATOM 1657 C CB . GLN B 2 3 ? 13.593 38.746 19.447 1.00 43.26 ? 3 GLN B CB 1 ATOM 1658 C CG . GLN B 2 3 ? 14.107 37.385 19.878 1.00 52.83 ? 3 GLN B CG 1 ATOM 1659 C CD . GLN B 2 3 ? 15.201 37.481 20.921 1.00 55.90 ? 3 GLN B CD 1 ATOM 1660 O OE1 . GLN B 2 3 ? 15.558 38.573 21.365 1.00 61.18 ? 3 GLN B OE1 1 ATOM 1661 N NE2 . GLN B 2 3 ? 15.743 36.334 21.318 1.00 52.98 ? 3 GLN B NE2 1 ATOM 1662 N N . LEU B 2 4 ? 10.782 40.237 19.069 1.00 35.20 ? 4 LEU B N 1 ATOM 1663 C CA . LEU B 2 4 ? 10.094 41.514 19.219 1.00 33.57 ? 4 LEU B CA 1 ATOM 1664 C C . LEU B 2 4 ? 9.953 41.790 20.708 1.00 31.76 ? 4 LEU B C 1 ATOM 1665 O O . LEU B 2 4 ? 9.364 40.984 21.436 1.00 32.02 ? 4 LEU B O 1 ATOM 1666 C CB . LEU B 2 4 ? 8.717 41.503 18.543 1.00 33.57 ? 4 LEU B CB 1 ATOM 1667 C CG . LEU B 2 4 ? 8.611 41.335 17.023 1.00 30.74 ? 4 LEU B CG 1 ATOM 1668 C CD1 . LEU B 2 4 ? 8.746 39.877 16.611 1.00 35.67 ? 4 LEU B CD1 1 ATOM 1669 C CD2 . LEU B 2 4 ? 7.300 41.914 16.514 1.00 19.49 ? 4 LEU B CD2 1 ATOM 1670 N N . LYS B 2 5 ? 10.498 42.916 21.161 1.00 23.61 ? 5 LYS B N 1 ATOM 1671 C CA . LYS B 2 5 ? 10.477 43.287 22.569 1.00 28.71 ? 5 LYS B CA 1 ATOM 1672 C C . LYS B 2 5 ? 9.783 44.631 22.717 1.00 24.04 ? 5 LYS B C 1 ATOM 1673 O O . LYS B 2 5 ? 10.140 45.598 22.035 1.00 24.93 ? 5 LYS B O 1 ATOM 1674 C CB . LYS B 2 5 ? 11.896 43.335 23.148 1.00 33.89 ? 5 LYS B CB 1 ATOM 1675 C CG . LYS B 2 5 ? 12.619 41.995 23.069 1.00 43.26 ? 5 LYS B CG 1 ATOM 1676 C CD . LYS B 2 5 ? 13.946 42.008 23.806 1.00 61.01 ? 5 LYS B CD 1 ATOM 1677 C CE . LYS B 2 5 ? 14.585 40.624 23.797 1.00 67.95 ? 5 LYS B CE 1 ATOM 1678 N NZ . LYS B 2 5 ? 15.855 40.575 24.577 1.00 71.59 ? 5 LYS B NZ 1 ATOM 1679 N N . GLN B 2 6 ? 8.788 44.683 23.595 1.00 23.15 ? 6 GLN B N 1 ATOM 1680 C CA . GLN B 2 6 ? 7.948 45.860 23.757 1.00 22.59 ? 6 GLN B CA 1 ATOM 1681 C C . GLN B 2 6 ? 8.304 46.606 25.036 1.00 24.12 ? 6 GLN B C 1 ATOM 1682 O O . GLN B 2 6 ? 8.890 46.050 25.969 1.00 25.38 ? 6 GLN B O 1 ATOM 1683 C CB . GLN B 2 6 ? 6.468 45.470 23.779 1.00 20.74 ? 6 GLN B CB 1 ATOM 1684 C CG . GLN B 2 6 ? 6.023 44.647 22.586 1.00 19.69 ? 6 GLN B CG 1 ATOM 1685 C CD . GLN B 2 6 ? 4.586 44.176 22.706 1.00 29.44 ? 6 GLN B CD 1 ATOM 1686 O OE1 . GLN B 2 6 ? 4.219 43.131 22.170 1.00 29.30 ? 6 GLN B OE1 1 ATOM 1687 N NE2 . GLN B 2 6 ? 3.763 44.948 23.407 1.00 18.69 ? 6 GLN B NE2 1 ATOM 1688 N N . SER B 2 7 ? 7.937 47.884 25.067 1.00 24.53 ? 7 SER B N 1 ATOM 1689 C CA . SER B 2 7 ? 8.126 48.690 26.261 1.00 35.18 ? 7 SER B CA 1 ATOM 1690 C C . SER B 2 7 ? 7.222 48.195 27.390 1.00 30.55 ? 7 SER B C 1 ATOM 1691 O O . SER B 2 7 ? 6.248 47.468 27.174 1.00 24.89 ? 7 SER B O 1 ATOM 1692 C CB . SER B 2 7 ? 7.850 50.164 25.962 1.00 36.78 ? 7 SER B CB 1 ATOM 1693 O OG . SER B 2 7 ? 6.563 50.341 25.398 1.00 41.88 ? 7 SER B OG 1 ATOM 1694 N N . GLY B 2 8 ? 7.557 48.611 28.608 1.00 32.78 ? 8 GLY B N 1 ATOM 1695 C CA . GLY B 2 8 ? 6.923 48.096 29.798 1.00 31.34 ? 8 GLY B CA 1 ATOM 1696 C C . GLY B 2 8 ? 5.463 48.478 29.945 1.00 26.26 ? 8 GLY B C 1 ATOM 1697 O O . GLY B 2 8 ? 4.957 49.396 29.291 1.00 25.72 ? 8 GLY B O 1 ATOM 1698 N N . PRO B 2 9 ? 4.759 47.768 30.819 1.00 24.12 ? 9 PRO B N 1 ATOM 1699 C CA . PRO B 2 9 ? 3.356 48.092 31.083 1.00 37.43 ? 9 PRO B CA 1 ATOM 1700 C C . PRO B 2 9 ? 3.227 49.309 31.985 1.00 40.42 ? 9 PRO B C 1 ATOM 1701 O O . PRO B 2 9 ? 4.139 49.669 32.731 1.00 46.61 ? 9 PRO B O 1 ATOM 1702 C CB . PRO B 2 9 ? 2.836 46.833 31.781 1.00 42.73 ? 9 PRO B CB 1 ATOM 1703 C CG . PRO B 2 9 ? 4.037 46.303 32.493 1.00 38.30 ? 9 PRO B CG 1 ATOM 1704 C CD . PRO B 2 9 ? 5.221 46.617 31.615 1.00 38.82 ? 9 PRO B CD 1 ATOM 1705 N N . GLY B 2 10 ? 2.063 49.943 31.909 1.00 43.74 ? 10 GLY B N 1 ATOM 1706 C CA . GLY B 2 10 ? 1.849 51.137 32.704 1.00 49.36 ? 10 GLY B CA 1 ATOM 1707 C C . GLY B 2 10 ? 0.401 51.568 32.679 1.00 37.62 ? 10 GLY B C 1 ATOM 1708 O O . GLY B 2 10 ? -0.431 51.012 31.955 1.00 35.20 ? 10 GLY B O 1 ATOM 1709 N N . LEU B 2 11 ? 0.118 52.580 33.490 1.00 32.03 ? 11 LEU B N 1 ATOM 1710 C CA . LEU B 2 11 ? -1.210 53.156 33.599 1.00 23.99 ? 11 LEU B CA 1 ATOM 1711 C C . LEU B 2 11 ? -1.373 54.297 32.602 1.00 33.03 ? 11 LEU B C 1 ATOM 1712 O O . LEU B 2 11 ? -0.421 55.016 32.285 1.00 25.90 ? 11 LEU B O 1 ATOM 1713 C CB . LEU B 2 11 ? -1.450 53.667 35.021 1.00 24.96 ? 11 LEU B CB 1 ATOM 1714 C CG . LEU B 2 11 ? -2.848 54.164 35.391 1.00 25.09 ? 11 LEU B CG 1 ATOM 1715 C CD1 . LEU B 2 11 ? -3.842 53.020 35.359 1.00 28.88 ? 11 LEU B CD1 1 ATOM 1716 C CD2 . LEU B 2 11 ? -2.835 54.827 36.759 1.00 26.27 ? 11 LEU B CD2 1 ATOM 1717 N N . VAL B 2 12 ? -2.598 54.462 32.113 1.00 30.90 ? 12 VAL B N 1 ATOM 1718 C CA . VAL B 2 12 ? -2.961 55.600 31.278 1.00 27.74 ? 12 VAL B CA 1 ATOM 1719 C C . VAL B 2 12 ? -4.269 56.173 31.802 1.00 26.86 ? 12 VAL B C 1 ATOM 1720 O O . VAL B 2 12 ? -5.225 55.430 32.051 1.00 26.31 ? 12 VAL B O 1 ATOM 1721 C CB . VAL B 2 12 ? -3.079 55.215 29.790 1.00 37.42 ? 12 VAL B CB 1 ATOM 1722 C CG1 . VAL B 2 12 ? -1.711 54.866 29.231 1.00 36.02 ? 12 VAL B CG1 1 ATOM 1723 C CG2 . VAL B 2 12 ? -4.030 54.050 29.608 1.00 51.07 ? 12 VAL B CG2 1 ATOM 1724 N N . GLN B 2 13 ? -4.301 57.488 31.995 1.00 37.53 ? 13 GLN B N 1 ATOM 1725 C CA A GLN B 2 13 ? -5.504 58.140 32.482 0.41 40.58 ? 13 GLN B CA 1 ATOM 1726 C CA B GLN B 2 13 ? -5.504 58.132 32.485 0.59 40.58 ? 13 GLN B CA 1 ATOM 1727 C C . GLN B 2 13 ? -6.581 58.136 31.398 1.00 44.52 ? 13 GLN B C 1 ATOM 1728 O O . GLN B 2 13 ? -6.272 58.125 30.206 1.00 46.89 ? 13 GLN B O 1 ATOM 1729 C CB A GLN B 2 13 ? -5.204 59.575 32.903 0.41 42.63 ? 13 GLN B CB 1 ATOM 1730 C CB B GLN B 2 13 ? -5.193 59.557 32.931 0.59 42.55 ? 13 GLN B CB 1 ATOM 1731 C CG A GLN B 2 13 ? -4.260 59.694 34.081 0.41 43.03 ? 13 GLN B CG 1 ATOM 1732 C CG B GLN B 2 13 ? -4.196 59.640 34.078 0.59 42.95 ? 13 GLN B CG 1 ATOM 1733 C CD A GLN B 2 13 ? -3.938 61.133 34.416 0.41 40.87 ? 13 GLN B CD 1 ATOM 1734 C CD B GLN B 2 13 ? -4.743 59.064 35.368 0.59 41.43 ? 13 GLN B CD 1 ATOM 1735 O OE1 A GLN B 2 13 ? -3.593 61.457 35.552 0.41 38.24 ? 13 GLN B OE1 1 ATOM 1736 O OE1 B GLN B 2 13 ? -4.313 58.002 35.817 0.59 32.59 ? 13 GLN B OE1 1 ATOM 1737 N NE2 A GLN B 2 13 ? -4.047 62.009 33.423 0.41 43.76 ? 13 GLN B NE2 1 ATOM 1738 N NE2 B GLN B 2 13 ? -5.692 59.768 35.976 0.59 46.13 ? 13 GLN B NE2 1 ATOM 1739 N N . PRO B 2 14 ? -7.857 58.135 31.792 1.00 43.21 ? 14 PRO B N 1 ATOM 1740 C CA . PRO B 2 14 ? -8.932 58.142 30.790 1.00 42.95 ? 14 PRO B CA 1 ATOM 1741 C C . PRO B 2 14 ? -8.840 59.367 29.894 1.00 49.75 ? 14 PRO B C 1 ATOM 1742 O O . PRO B 2 14 ? -8.459 60.454 30.333 1.00 37.98 ? 14 PRO B O 1 ATOM 1743 C CB . PRO B 2 14 ? -10.209 58.158 31.641 1.00 39.67 ? 14 PRO B CB 1 ATOM 1744 C CG . PRO B 2 14 ? -9.797 57.584 32.954 1.00 37.49 ? 14 PRO B CG 1 ATOM 1745 C CD . PRO B 2 14 ? -8.380 58.025 33.163 1.00 36.60 ? 14 PRO B CD 1 ATOM 1746 N N . SER B 2 15 ? -9.186 59.172 28.620 1.00 56.75 ? 15 SER B N 1 ATOM 1747 C CA . SER B 2 15 ? -9.140 60.208 27.588 1.00 50.34 ? 15 SER B CA 1 ATOM 1748 C C . SER B 2 15 ? -7.726 60.705 27.301 1.00 46.13 ? 15 SER B C 1 ATOM 1749 O O . SER B 2 15 ? -7.551 61.833 26.831 1.00 52.43 ? 15 SER B O 1 ATOM 1750 C CB . SER B 2 15 ? -10.043 61.397 27.938 1.00 48.34 ? 15 SER B CB 1 ATOM 1751 O OG . SER B 2 15 ? -9.498 62.154 29.005 1.00 50.21 ? 15 SER B OG 1 ATOM 1752 N N . GLN B 2 16 ? -6.709 59.892 27.567 1.00 42.65 ? 16 GLN B N 1 ATOM 1753 C CA . GLN B 2 16 ? -5.326 60.233 27.267 1.00 41.91 ? 16 GLN B CA 1 ATOM 1754 C C . GLN B 2 16 ? -4.730 59.176 26.345 1.00 40.50 ? 16 GLN B C 1 ATOM 1755 O O . GLN B 2 16 ? -5.326 58.125 26.099 1.00 42.39 ? 16 GLN B O 1 ATOM 1756 C CB . GLN B 2 16 ? -4.497 60.369 28.549 1.00 40.15 ? 16 GLN B CB 1 ATOM 1757 C CG . GLN B 2 16 ? -5.012 61.440 29.495 1.00 54.18 ? 16 GLN B CG 1 ATOM 1758 C CD . GLN B 2 16 ? -3.926 62.406 29.928 1.00 64.88 ? 16 GLN B CD 1 ATOM 1759 O OE1 . GLN B 2 16 ? -3.085 62.081 30.767 1.00 72.85 ? 16 GLN B OE1 1 ATOM 1760 N NE2 . GLN B 2 16 ? -3.937 63.603 29.351 1.00 60.51 ? 16 GLN B NE2 1 ATOM 1761 N N . SER B 2 17 ? -3.536 59.462 25.836 1.00 37.18 ? 17 SER B N 1 ATOM 1762 C CA . SER B 2 17 ? -2.959 58.666 24.762 1.00 44.15 ? 17 SER B CA 1 ATOM 1763 C C . SER B 2 17 ? -2.068 57.549 25.299 1.00 43.46 ? 17 SER B C 1 ATOM 1764 O O . SER B 2 17 ? -1.576 57.591 26.429 1.00 47.63 ? 17 SER B O 1 ATOM 1765 C CB . SER B 2 17 ? -2.166 59.556 23.802 1.00 45.34 ? 17 SER B CB 1 ATOM 1766 O OG . SER B 2 17 ? -1.158 60.282 24.485 1.00 66.05 ? 17 SER B OG 1 ATOM 1767 N N . LEU B 2 18 ? -1.868 56.540 24.456 1.00 25.15 ? 18 LEU B N 1 ATOM 1768 C CA . LEU B 2 18 ? -1.075 55.362 24.773 1.00 29.46 ? 18 LEU B CA 1 ATOM 1769 C C . LEU B 2 18 ? 0.080 55.254 23.789 1.00 33.34 ? 18 LEU B C 1 ATOM 1770 O O . LEU B 2 18 ? -0.107 55.440 22.585 1.00 37.78 ? 18 LEU B O 1 ATOM 1771 C CB . LEU B 2 18 ? -1.940 54.098 24.718 1.00 27.19 ? 18 LEU B CB 1 ATOM 1772 C CG . LEU B 2 18 ? -1.238 52.742 24.664 1.00 32.18 ? 18 LEU B CG 1 ATOM 1773 C CD1 . LEU B 2 18 ? -0.399 52.519 25.911 1.00 34.07 ? 18 LEU B CD1 1 ATOM 1774 C CD2 . LEU B 2 18 ? -2.258 51.626 24.488 1.00 31.58 ? 18 LEU B CD2 1 ATOM 1775 N N . SER B 2 19 ? 1.274 54.959 24.301 1.00 30.02 ? 19 SER B N 1 ATOM 1776 C CA . SER B 2 19 ? 2.470 54.849 23.474 1.00 18.24 ? 19 SER B CA 1 ATOM 1777 C C . SER B 2 19 ? 3.230 53.588 23.852 1.00 17.18 ? 19 SER B C 1 ATOM 1778 O O . SER B 2 19 ? 3.653 53.436 25.004 1.00 23.83 ? 19 SER B O 1 ATOM 1779 C CB . SER B 2 19 ? 3.368 56.081 23.624 1.00 19.61 ? 19 SER B CB 1 ATOM 1780 O OG . SER B 2 19 ? 2.815 57.197 22.950 1.00 30.80 ? 19 SER B OG 1 ATOM 1781 N N . ILE B 2 20 ? 3.405 52.692 22.884 1.00 20.25 ? 20 ILE B N 1 ATOM 1782 C CA . ILE B 2 20 ? 4.193 51.478 23.053 1.00 20.81 ? 20 ILE B CA 1 ATOM 1783 C C . ILE B 2 20 ? 5.248 51.440 21.958 1.00 20.86 ? 20 ILE B C 1 ATOM 1784 O O . ILE B 2 20 ? 4.973 51.794 20.807 1.00 23.98 ? 20 ILE B O 1 ATOM 1785 C CB . ILE B 2 20 ? 3.315 50.210 23.010 1.00 19.08 ? 20 ILE B CB 1 ATOM 1786 C CG1 . ILE B 2 20 ? 2.175 50.315 24.025 1.00 24.07 ? 20 ILE B CG1 1 ATOM 1787 C CG2 . ILE B 2 20 ? 4.150 48.971 23.284 1.00 14.19 ? 20 ILE B CG2 1 ATOM 1788 C CD1 . ILE B 2 20 ? 1.320 49.073 24.112 1.00 26.31 ? 20 ILE B CD1 1 ATOM 1789 N N . THR B 2 21 ? 6.456 51.023 22.323 1.00 25.62 ? 21 THR B N 1 ATOM 1790 C CA . THR B 2 21 ? 7.564 50.890 21.388 1.00 26.96 ? 21 THR B CA 1 ATOM 1791 C C . THR B 2 21 ? 7.881 49.415 21.191 1.00 30.83 ? 21 THR B C 1 ATOM 1792 O O . THR B 2 21 ? 8.041 48.675 22.167 1.00 31.31 ? 21 THR B O 1 ATOM 1793 C CB . THR B 2 21 ? 8.804 51.635 21.891 1.00 22.53 ? 21 THR B CB 1 ATOM 1794 O OG1 . THR B 2 21 ? 8.520 53.038 21.971 1.00 32.14 ? 21 THR B OG1 1 ATOM 1795 C CG2 . THR B 2 21 ? 9.984 51.409 20.953 1.00 18.99 ? 21 THR B CG2 1 ATOM 1796 N N . CYS B 2 22 ? 7.961 48.993 19.933 1.00 16.07 ? 22 CYS B N 1 ATOM 1797 C CA . CYS B 2 22 ? 8.302 47.622 19.567 1.00 21.51 ? 22 CYS B CA 1 ATOM 1798 C C . CYS B 2 22 ? 9.673 47.647 18.903 1.00 21.24 ? 22 CYS B C 1 ATOM 1799 O O . CYS B 2 22 ? 9.807 48.106 17.764 1.00 23.57 ? 22 CYS B O 1 ATOM 1800 C CB . CYS B 2 22 ? 7.243 47.025 18.639 1.00 16.46 ? 22 CYS B CB 1 ATOM 1801 S SG . CYS B 2 22 ? 7.493 45.298 18.126 1.00 26.86 ? 22 CYS B SG 1 ATOM 1802 N N . THR B 2 23 ? 10.687 47.173 19.622 1.00 30.52 ? 23 THR B N 1 ATOM 1803 C CA . THR B 2 23 ? 12.038 47.038 19.092 1.00 32.12 ? 23 THR B CA 1 ATOM 1804 C C . THR B 2 23 ? 12.231 45.613 18.594 1.00 30.84 ? 23 THR B C 1 ATOM 1805 O O . THR B 2 23 ? 12.014 44.656 19.345 1.00 32.73 ? 23 THR B O 1 ATOM 1806 C CB . THR B 2 23 ? 13.086 47.370 20.157 1.00 26.84 ? 23 THR B CB 1 ATOM 1807 O OG1 . THR B 2 23 ? 12.895 48.711 20.628 1.00 22.91 ? 23 THR B OG1 1 ATOM 1808 C CG2 . THR B 2 23 ? 14.490 47.234 19.586 1.00 21.43 ? 23 THR B CG2 1 ATOM 1809 N N . VAL B 2 24 ? 12.638 45.473 17.336 1.00 21.79 ? 24 VAL B N 1 ATOM 1810 C CA . VAL B 2 24 ? 12.761 44.167 16.706 1.00 18.65 ? 24 VAL B CA 1 ATOM 1811 C C . VAL B 2 24 ? 14.230 43.860 16.445 1.00 29.07 ? 24 VAL B C 1 ATOM 1812 O O . VAL B 2 24 ? 15.090 44.747 16.419 1.00 37.13 ? 24 VAL B O 1 ATOM 1813 C CB . VAL B 2 24 ? 11.945 44.079 15.397 1.00 33.33 ? 24 VAL B CB 1 ATOM 1814 C CG1 . VAL B 2 24 ? 10.508 44.524 15.629 1.00 30.16 ? 24 VAL B CG1 1 ATOM 1815 C CG2 . VAL B 2 24 ? 12.602 44.903 14.294 1.00 19.21 ? 24 VAL B CG2 1 ATOM 1816 N N . SER B 2 25 ? 14.512 42.573 16.254 1.00 31.52 ? 25 SER B N 1 ATOM 1817 C CA . SER B 2 25 ? 15.828 42.110 15.837 1.00 34.88 ? 25 SER B CA 1 ATOM 1818 C C . SER B 2 25 ? 15.655 40.808 15.066 1.00 33.22 ? 25 SER B C 1 ATOM 1819 O O . SER B 2 25 ? 14.576 40.210 15.047 1.00 26.77 ? 25 SER B O 1 ATOM 1820 C CB . SER B 2 25 ? 16.772 41.928 17.032 1.00 22.64 ? 25 SER B CB 1 ATOM 1821 O OG . SER B 2 25 ? 16.376 40.837 17.842 1.00 26.28 ? 25 SER B OG 1 ATOM 1822 N N . GLY B 2 26 ? 16.737 40.371 14.424 1.00 26.42 ? 26 GLY B N 1 ATOM 1823 C CA . GLY B 2 26 ? 16.701 39.191 13.586 1.00 27.33 ? 26 GLY B CA 1 ATOM 1824 C C . GLY B 2 26 ? 16.136 39.409 12.200 1.00 31.98 ? 26 GLY B C 1 ATOM 1825 O O . GLY B 2 26 ? 16.066 38.450 11.419 1.00 29.44 ? 26 GLY B O 1 ATOM 1826 N N . PHE B 2 27 ? 15.723 40.630 11.875 1.00 23.22 ? 27 PHE B N 1 ATOM 1827 C CA . PHE B 2 27 ? 15.185 40.981 10.567 1.00 23.01 ? 27 PHE B CA 1 ATOM 1828 C C . PHE B 2 27 ? 15.134 42.500 10.494 1.00 22.76 ? 27 PHE B C 1 ATOM 1829 O O . PHE B 2 27 ? 15.299 43.194 11.501 1.00 24.67 ? 27 PHE B O 1 ATOM 1830 C CB . PHE B 2 27 ? 13.803 40.363 10.323 1.00 28.53 ? 27 PHE B CB 1 ATOM 1831 C CG . PHE B 2 27 ? 12.711 40.943 11.179 1.00 27.09 ? 27 PHE B CG 1 ATOM 1832 C CD1 . PHE B 2 27 ? 12.531 40.516 12.486 1.00 31.12 ? 27 PHE B CD1 1 ATOM 1833 C CD2 . PHE B 2 27 ? 11.851 41.905 10.670 1.00 24.85 ? 27 PHE B CD2 1 ATOM 1834 C CE1 . PHE B 2 27 ? 11.522 41.045 13.275 1.00 27.99 ? 27 PHE B CE1 1 ATOM 1835 C CE2 . PHE B 2 27 ? 10.839 42.439 11.453 1.00 29.97 ? 27 PHE B CE2 1 ATOM 1836 C CZ . PHE B 2 27 ? 10.674 42.007 12.756 1.00 25.06 ? 27 PHE B CZ 1 ATOM 1837 N N . SER B 2 28 ? 14.908 43.010 9.289 1.00 33.67 ? 28 SER B N 1 ATOM 1838 C CA . SER B 2 28 ? 14.918 44.441 9.026 1.00 33.43 ? 28 SER B CA 1 ATOM 1839 C C . SER B 2 28 ? 13.496 44.927 8.785 1.00 30.74 ? 28 SER B C 1 ATOM 1840 O O . SER B 2 28 ? 12.728 44.280 8.064 1.00 33.55 ? 28 SER B O 1 ATOM 1841 C CB . SER B 2 28 ? 15.804 44.764 7.820 1.00 24.37 ? 28 SER B CB 1 ATOM 1842 O OG . SER B 2 28 ? 15.694 46.129 7.453 1.00 25.21 ? 28 SER B OG 1 ATOM 1843 N N . LEU B 2 29 ? 13.150 46.069 9.384 1.00 26.20 ? 29 LEU B N 1 ATOM 1844 C CA . LEU B 2 29 ? 11.835 46.658 9.160 1.00 25.78 ? 29 LEU B CA 1 ATOM 1845 C C . LEU B 2 29 ? 11.626 47.091 7.715 1.00 34.85 ? 29 LEU B C 1 ATOM 1846 O O . LEU B 2 29 ? 10.494 47.419 7.341 1.00 26.91 ? 29 LEU B O 1 ATOM 1847 C CB . LEU B 2 29 ? 11.625 47.850 10.097 1.00 20.59 ? 29 LEU B CB 1 ATOM 1848 C CG . LEU B 2 29 ? 11.517 47.518 11.587 1.00 22.03 ? 29 LEU B CG 1 ATOM 1849 C CD1 . LEU B 2 29 ? 11.332 48.779 12.421 1.00 20.16 ? 29 LEU B CD1 1 ATOM 1850 C CD2 . LEU B 2 29 ? 10.379 46.543 11.830 1.00 18.37 ? 29 LEU B CD2 1 ATOM 1851 N N . THR B 2 30 ? 12.681 47.100 6.899 1.00 38.51 ? 30 THR B N 1 ATOM 1852 C CA . THR B 2 30 ? 12.557 47.388 5.478 1.00 41.89 ? 30 THR B CA 1 ATOM 1853 C C . THR B 2 30 ? 12.145 46.170 4.662 1.00 39.46 ? 30 THR B C 1 ATOM 1854 O O . THR B 2 30 ? 11.817 46.323 3.480 1.00 34.64 ? 30 THR B O 1 ATOM 1855 C CB . THR B 2 30 ? 13.878 47.938 4.933 1.00 42.49 ? 30 THR B CB 1 ATOM 1856 O OG1 . THR B 2 30 ? 14.893 46.931 5.038 1.00 43.32 ? 30 THR B OG1 1 ATOM 1857 C CG2 . THR B 2 30 ? 14.307 49.165 5.722 1.00 40.99 ? 30 THR B CG2 1 ATOM 1858 N N . ASN B 2 31 ? 12.154 44.973 5.256 1.00 42.11 ? 31 ASN B N 1 ATOM 1859 C CA . ASN B 2 31 ? 11.771 43.752 4.559 1.00 40.86 ? 31 ASN B CA 1 ATOM 1860 C C . ASN B 2 31 ? 10.489 43.120 5.078 1.00 41.39 ? 31 ASN B C 1 ATOM 1861 O O . ASN B 2 31 ? 9.935 42.250 4.400 1.00 41.76 ? 31 ASN B O 1 ATOM 1862 C CB . ASN B 2 31 ? 12.891 42.705 4.647 1.00 33.04 ? 31 ASN B CB 1 ATOM 1863 C CG . ASN B 2 31 ? 14.167 43.159 3.978 1.00 34.47 ? 31 ASN B CG 1 ATOM 1864 O OD1 . ASN B 2 31 ? 14.138 43.839 2.952 1.00 35.89 ? 31 ASN B OD1 1 ATOM 1865 N ND2 . ASN B 2 31 ? 15.301 42.786 4.559 1.00 39.61 ? 31 ASN B ND2 1 ATOM 1866 N N . TYR B 2 32 ? 10.012 43.519 6.255 1.00 34.60 ? 32 TYR B N 1 ATOM 1867 C CA . TYR B 2 32 ? 8.815 42.934 6.838 1.00 24.21 ? 32 TYR B CA 1 ATOM 1868 C C . TYR B 2 32 ? 7.951 44.027 7.446 1.00 26.99 ? 32 TYR B C 1 ATOM 1869 O O . TYR B 2 32 ? 8.454 45.043 7.932 1.00 35.72 ? 32 TYR B O 1 ATOM 1870 C CB . TYR B 2 32 ? 9.158 41.891 7.913 1.00 24.25 ? 32 TYR B CB 1 ATOM 1871 C CG . TYR B 2 32 ? 9.718 40.600 7.362 1.00 29.98 ? 32 TYR B CG 1 ATOM 1872 C CD1 . TYR B 2 32 ? 11.085 40.436 7.175 1.00 31.71 ? 32 TYR B CD1 1 ATOM 1873 C CD2 . TYR B 2 32 ? 8.879 39.544 7.031 1.00 27.16 ? 32 TYR B CD2 1 ATOM 1874 C CE1 . TYR B 2 32 ? 11.600 39.255 6.671 1.00 35.13 ? 32 TYR B CE1 1 ATOM 1875 C CE2 . TYR B 2 32 ? 9.384 38.360 6.527 1.00 31.87 ? 32 TYR B CE2 1 ATOM 1876 C CZ . TYR B 2 32 ? 10.744 38.220 6.349 1.00 37.19 ? 32 TYR B CZ 1 ATOM 1877 O OH . TYR B 2 32 ? 11.248 37.041 5.848 1.00 44.96 ? 32 TYR B OH 1 ATOM 1878 N N . GLY B 2 33 ? 6.641 43.804 7.412 1.00 29.21 ? 33 GLY B N 1 ATOM 1879 C CA . GLY B 2 33 ? 5.711 44.666 8.109 1.00 26.06 ? 33 GLY B CA 1 ATOM 1880 C C . GLY B 2 33 ? 5.447 44.175 9.522 1.00 29.04 ? 33 GLY B C 1 ATOM 1881 O O . GLY B 2 33 ? 5.516 42.982 9.808 1.00 30.30 ? 33 GLY B O 1 ATOM 1882 N N . VAL B 2 34 ? 5.150 45.118 10.413 1.00 22.58 ? 34 VAL B N 1 ATOM 1883 C CA . VAL B 2 34 ? 4.881 44.828 11.817 1.00 26.91 ? 34 VAL B CA 1 ATOM 1884 C C . VAL B 2 34 ? 3.415 45.124 12.099 1.00 28.44 ? 34 VAL B C 1 ATOM 1885 O O . VAL B 2 34 ? 2.925 46.217 11.788 1.00 30.59 ? 34 VAL B O 1 ATOM 1886 C CB . VAL B 2 34 ? 5.799 45.640 12.746 1.00 31.95 ? 34 VAL B CB 1 ATOM 1887 C CG1 . VAL B 2 34 ? 5.271 45.613 14.173 1.00 14.84 ? 34 VAL B CG1 1 ATOM 1888 C CG2 . VAL B 2 34 ? 7.214 45.090 12.695 1.00 22.63 ? 34 VAL B CG2 1 ATOM 1889 N N . HIS B 2 35 ? 2.720 44.154 12.682 1.00 25.98 ? 35 HIS B N 1 ATOM 1890 C CA . HIS B 2 35 ? 1.307 44.282 13.007 1.00 22.18 ? 35 HIS B CA 1 ATOM 1891 C C . HIS B 2 35 ? 1.122 44.538 14.498 1.00 21.84 ? 35 HIS B C 1 ATOM 1892 O O . HIS B 2 35 ? 2.008 44.278 15.317 1.00 15.20 ? 35 HIS B O 1 ATOM 1893 C CB . HIS B 2 35 ? 0.537 43.023 12.599 1.00 21.25 ? 35 HIS B CB 1 ATOM 1894 C CG . HIS B 2 35 ? 0.653 42.683 11.146 1.00 22.29 ? 35 HIS B CG 1 ATOM 1895 N ND1 . HIS B 2 35 ? -0.394 42.827 10.262 1.00 19.91 ? 35 HIS B ND1 1 ATOM 1896 C CD2 . HIS B 2 35 ? 1.691 42.199 10.424 1.00 25.47 ? 35 HIS B CD2 1 ATOM 1897 C CE1 . HIS B 2 35 ? -0.005 42.450 9.057 1.00 25.63 ? 35 HIS B CE1 1 ATOM 1898 N NE2 . HIS B 2 35 ? 1.257 42.065 9.128 1.00 31.09 ? 35 HIS B NE2 1 ATOM 1899 N N . TRP B 2 36 ? -0.059 45.045 14.844 1.00 16.83 ? 36 TRP B N 1 ATOM 1900 C CA . TRP B 2 36 ? -0.416 45.328 16.229 1.00 15.95 ? 36 TRP B CA 1 ATOM 1901 C C . TRP B 2 36 ? -1.763 44.690 16.532 1.00 21.75 ? 36 TRP B C 1 ATOM 1902 O O . TRP B 2 36 ? -2.764 45.005 15.880 1.00 22.07 ? 36 TRP B O 1 ATOM 1903 C CB . TRP B 2 36 ? -0.454 46.837 16.490 1.00 13.84 ? 36 TRP B CB 1 ATOM 1904 C CG . TRP B 2 36 ? 0.905 47.465 16.455 1.00 24.74 ? 36 TRP B CG 1 ATOM 1905 C CD1 . TRP B 2 36 ? 1.557 47.947 15.359 1.00 14.43 ? 36 TRP B CD1 1 ATOM 1906 C CD2 . TRP B 2 36 ? 1.787 47.663 17.567 1.00 26.87 ? 36 TRP B CD2 1 ATOM 1907 N NE1 . TRP B 2 36 ? 2.788 48.441 15.720 1.00 14.71 ? 36 TRP B NE1 1 ATOM 1908 C CE2 . TRP B 2 36 ? 2.954 48.277 17.069 1.00 28.12 ? 36 TRP B CE2 1 ATOM 1909 C CE3 . TRP B 2 36 ? 1.701 47.386 18.934 1.00 13.64 ? 36 TRP B CE3 1 ATOM 1910 C CZ2 . TRP B 2 36 ? 4.026 48.615 17.890 1.00 28.76 ? 36 TRP B CZ2 1 ATOM 1911 C CZ3 . TRP B 2 36 ? 2.768 47.723 19.747 1.00 27.95 ? 36 TRP B CZ3 1 ATOM 1912 C CH2 . TRP B 2 36 ? 3.915 48.331 19.222 1.00 25.69 ? 36 TRP B CH2 1 ATOM 1913 N N . VAL B 2 37 ? -1.780 43.789 17.510 1.00 20.63 ? 37 VAL B N 1 ATOM 1914 C CA . VAL B 2 37 ? -2.988 43.116 17.967 1.00 15.21 ? 37 VAL B CA 1 ATOM 1915 C C . VAL B 2 37 ? -3.149 43.397 19.453 1.00 24.80 ? 37 VAL B C 1 ATOM 1916 O O . VAL B 2 37 ? -2.164 43.518 20.188 1.00 28.67 ? 37 VAL B O 1 ATOM 1917 C CB . VAL B 2 37 ? -2.934 41.593 17.703 1.00 17.04 ? 37 VAL B CB 1 ATOM 1918 C CG1 . VAL B 2 37 ? -4.238 40.922 18.109 1.00 23.45 ? 37 VAL B CG1 1 ATOM 1919 C CG2 . VAL B 2 37 ? -2.611 41.310 16.242 1.00 13.64 ? 37 VAL B CG2 1 ATOM 1920 N N . ARG B 2 38 ? -4.397 43.512 19.896 1.00 18.70 ? 38 ARG B N 1 ATOM 1921 C CA . ARG B 2 38 ? -4.692 43.649 21.312 1.00 13.35 ? 38 ARG B CA 1 ATOM 1922 C C . ARG B 2 38 ? -5.648 42.548 21.752 1.00 17.05 ? 38 ARG B C 1 ATOM 1923 O O . ARG B 2 38 ? -6.342 41.932 20.937 1.00 19.14 ? 38 ARG B O 1 ATOM 1924 C CB . ARG B 2 38 ? -5.282 45.025 21.638 1.00 17.94 ? 38 ARG B CB 1 ATOM 1925 C CG . ARG B 2 38 ? -6.741 45.208 21.254 1.00 14.56 ? 38 ARG B CG 1 ATOM 1926 C CD . ARG B 2 38 ? -7.248 46.529 21.804 1.00 21.25 ? 38 ARG B CD 1 ATOM 1927 N NE . ARG B 2 38 ? -8.656 46.763 21.510 1.00 26.77 ? 38 ARG B NE 1 ATOM 1928 C CZ . ARG B 2 38 ? -9.323 47.840 21.910 1.00 26.47 ? 38 ARG B CZ 1 ATOM 1929 N NH1 . ARG B 2 38 ? -8.704 48.773 22.620 1.00 23.77 ? 38 ARG B NH1 1 ATOM 1930 N NH2 . ARG B 2 38 ? -10.604 47.985 21.602 1.00 20.12 ? 38 ARG B NH2 1 ATOM 1931 N N . GLN B 2 39 ? -5.674 42.306 23.062 1.00 17.36 ? 39 GLN B N 1 ATOM 1932 C CA . GLN B 2 39 ? -6.479 41.235 23.644 1.00 18.85 ? 39 GLN B CA 1 ATOM 1933 C C . GLN B 2 39 ? -7.123 41.761 24.919 1.00 15.67 ? 39 GLN B C 1 ATOM 1934 O O . GLN B 2 39 ? -6.436 41.973 25.923 1.00 13.46 ? 39 GLN B O 1 ATOM 1935 C CB . GLN B 2 39 ? -5.625 39.997 23.923 1.00 13.39 ? 39 GLN B CB 1 ATOM 1936 C CG . GLN B 2 39 ? -6.420 38.722 24.144 1.00 26.58 ? 39 GLN B CG 1 ATOM 1937 C CD . GLN B 2 39 ? -5.539 37.483 24.166 1.00 30.49 ? 39 GLN B CD 1 ATOM 1938 O OE1 . GLN B 2 39 ? -4.327 37.571 24.368 1.00 27.58 ? 39 GLN B OE1 1 ATOM 1939 N NE2 . GLN B 2 39 ? -6.148 36.320 23.951 1.00 28.04 ? 39 GLN B NE2 1 ATOM 1940 N N . SER B 2 40 ? -8.434 41.971 24.879 1.00 20.92 ? 40 SER B N 1 ATOM 1941 C CA . SER B 2 40 ? -9.195 42.532 25.983 1.00 21.49 ? 40 SER B CA 1 ATOM 1942 C C . SER B 2 40 ? -10.179 41.509 26.534 1.00 25.42 ? 40 SER B C 1 ATOM 1943 O O . SER B 2 40 ? -10.507 40.523 25.865 1.00 25.53 ? 40 SER B O 1 ATOM 1944 C CB . SER B 2 40 ? -9.959 43.786 25.530 1.00 15.96 ? 40 SER B CB 1 ATOM 1945 O OG . SER B 2 40 ? -11.023 43.451 24.658 1.00 16.83 ? 40 SER B OG 1 ATOM 1946 N N . PRO B 2 41 ? -10.663 41.702 27.766 1.00 28.63 ? 41 PRO B N 1 ATOM 1947 C CA . PRO B 2 41 ? -11.682 40.775 28.288 1.00 22.77 ? 41 PRO B CA 1 ATOM 1948 C C . PRO B 2 41 ? -12.958 40.768 27.465 1.00 23.14 ? 41 PRO B C 1 ATOM 1949 O O . PRO B 2 41 ? -13.520 39.697 27.207 1.00 22.79 ? 41 PRO B O 1 ATOM 1950 C CB . PRO B 2 41 ? -11.922 41.289 29.716 1.00 22.84 ? 41 PRO B CB 1 ATOM 1951 C CG . PRO B 2 41 ? -10.671 42.027 30.070 1.00 24.41 ? 41 PRO B CG 1 ATOM 1952 C CD . PRO B 2 41 ? -10.202 42.653 28.792 1.00 23.62 ? 41 PRO B CD 1 ATOM 1953 N N . GLY B 2 42 ? -13.420 41.934 27.028 1.00 26.05 ? 42 GLY B N 1 ATOM 1954 C CA . GLY B 2 42 ? -14.677 42.038 26.313 1.00 32.86 ? 42 GLY B CA 1 ATOM 1955 C C . GLY B 2 42 ? -14.654 41.522 24.888 1.00 33.79 ? 42 GLY B C 1 ATOM 1956 O O . GLY B 2 42 ? -15.516 40.731 24.497 1.00 39.21 ? 42 GLY B O 1 ATOM 1957 N N . LYS B 2 43 ? -13.674 41.959 24.098 1.00 33.65 ? 43 LYS B N 1 ATOM 1958 C CA . LYS B 2 43 ? -13.631 41.670 22.669 1.00 32.92 ? 43 LYS B CA 1 ATOM 1959 C C . LYS B 2 43 ? -12.604 40.609 22.288 1.00 25.95 ? 43 LYS B C 1 ATOM 1960 O O . LYS B 2 43 ? -12.565 40.201 21.123 1.00 25.58 ? 43 LYS B O 1 ATOM 1961 C CB . LYS B 2 43 ? -13.351 42.960 21.885 1.00 38.01 ? 43 LYS B CB 1 ATOM 1962 C CG . LYS B 2 43 ? -14.308 44.098 22.220 1.00 43.10 ? 43 LYS B CG 1 ATOM 1963 C CD . LYS B 2 43 ? -15.417 44.239 21.188 1.00 46.29 ? 43 LYS B CD 1 ATOM 1964 C CE . LYS B 2 43 ? -14.870 44.754 19.867 1.00 50.00 ? 43 LYS B CE 1 ATOM 1965 N NZ . LYS B 2 43 ? -15.927 45.386 19.028 1.00 55.03 ? 43 LYS B NZ 1 ATOM 1966 N N . GLY B 2 44 ? -11.781 40.150 23.228 1.00 17.61 ? 44 GLY B N 1 ATOM 1967 C CA . GLY B 2 44 ? -10.819 39.106 22.909 1.00 17.00 ? 44 GLY B CA 1 ATOM 1968 C C . GLY B 2 44 ? -9.716 39.617 22.001 1.00 18.22 ? 44 GLY B C 1 ATOM 1969 O O . GLY B 2 44 ? -9.249 40.754 22.128 1.00 21.23 ? 44 GLY B O 1 ATOM 1970 N N . LEU B 2 45 ? -9.293 38.767 21.068 1.00 21.05 ? 45 LEU B N 1 ATOM 1971 C CA . LEU B 2 45 ? -8.255 39.139 20.117 1.00 24.38 ? 45 LEU B CA 1 ATOM 1972 C C . LEU B 2 45 ? -8.821 40.055 19.041 1.00 30.09 ? 45 LEU B C 1 ATOM 1973 O O . LEU B 2 45 ? -9.893 39.802 18.483 1.00 36.04 ? 45 LEU B O 1 ATOM 1974 C CB . LEU B 2 45 ? -7.637 37.896 19.481 1.00 15.68 ? 45 LEU B CB 1 ATOM 1975 C CG . LEU B 2 45 ? -6.694 37.130 20.407 1.00 15.24 ? 45 LEU B CG 1 ATOM 1976 C CD1 . LEU B 2 45 ? -6.355 35.766 19.832 1.00 19.42 ? 45 LEU B CD1 1 ATOM 1977 C CD2 . LEU B 2 45 ? -5.433 37.942 20.646 1.00 22.75 ? 45 LEU B CD2 1 ATOM 1978 N N . GLU B 2 46 ? -8.077 41.115 18.742 1.00 26.66 ? 46 GLU B N 1 ATOM 1979 C CA . GLU B 2 46 ? -8.579 42.207 17.917 1.00 19.25 ? 46 GLU B CA 1 ATOM 1980 C C . GLU B 2 46 ? -7.403 42.780 17.140 1.00 21.20 ? 46 GLU B C 1 ATOM 1981 O O . GLU B 2 46 ? -6.487 43.349 17.741 1.00 17.88 ? 46 GLU B O 1 ATOM 1982 C CB . GLU B 2 46 ? -9.234 43.271 18.795 1.00 23.48 ? 46 GLU B CB 1 ATOM 1983 C CG . GLU B 2 46 ? -10.264 44.153 18.111 1.00 31.12 ? 46 GLU B CG 1 ATOM 1984 C CD . GLU B 2 46 ? -10.974 45.070 19.099 1.00 45.95 ? 46 GLU B CD 1 ATOM 1985 O OE1 . GLU B 2 46 ? -10.541 45.126 20.271 1.00 46.49 ? 46 GLU B OE1 1 ATOM 1986 O OE2 . GLU B 2 46 ? -11.963 45.729 18.712 1.00 54.29 ? 46 GLU B OE2 1 ATOM 1987 N N . TRP B 2 47 ? -7.423 42.620 15.820 1.00 15.50 ? 47 TRP B N 1 ATOM 1988 C CA . TRP B 2 47 ? -6.367 43.167 14.978 1.00 20.22 ? 47 TRP B CA 1 ATOM 1989 C C . TRP B 2 47 ? -6.574 44.666 14.797 1.00 19.19 ? 47 TRP B C 1 ATOM 1990 O O . TRP B 2 47 ? -7.669 45.112 14.442 1.00 24.01 ? 47 TRP B O 1 ATOM 1991 C CB . TRP B 2 47 ? -6.340 42.462 13.624 1.00 27.18 ? 47 TRP B CB 1 ATOM 1992 C CG . TRP B 2 47 ? -5.258 42.953 12.688 1.00 28.50 ? 47 TRP B CG 1 ATOM 1993 C CD1 . TRP B 2 47 ? -3.956 42.537 12.640 1.00 20.85 ? 47 TRP B CD1 1 ATOM 1994 C CD2 . TRP B 2 47 ? -5.400 43.936 11.656 1.00 26.36 ? 47 TRP B CD2 1 ATOM 1995 N NE1 . TRP B 2 47 ? -3.282 43.202 11.644 1.00 14.77 ? 47 TRP B NE1 1 ATOM 1996 C CE2 . TRP B 2 47 ? -4.146 44.066 11.025 1.00 23.85 ? 47 TRP B CE2 1 ATOM 1997 C CE3 . TRP B 2 47 ? -6.467 44.719 11.204 1.00 28.39 ? 47 TRP B CE3 1 ATOM 1998 C CZ2 . TRP B 2 47 ? -3.931 44.947 9.969 1.00 26.65 ? 47 TRP B CZ2 1 ATOM 1999 C CZ3 . TRP B 2 47 ? -6.251 45.594 10.155 1.00 29.16 ? 47 TRP B CZ3 1 ATOM 2000 C CH2 . TRP B 2 47 ? -4.993 45.702 9.549 1.00 25.18 ? 47 TRP B CH2 1 ATOM 2001 N N . LEU B 2 48 ? -5.519 45.442 15.045 1.00 21.17 ? 48 LEU B N 1 ATOM 2002 C CA . LEU B 2 48 ? -5.607 46.897 15.048 1.00 15.36 ? 48 LEU B CA 1 ATOM 2003 C C . LEU B 2 48 ? -5.031 47.533 13.787 1.00 27.75 ? 48 LEU B C 1 ATOM 2004 O O . LEU B 2 48 ? -5.698 48.354 13.151 1.00 16.23 ? 48 LEU B O 1 ATOM 2005 C CB . LEU B 2 48 ? -4.900 47.457 16.286 1.00 19.57 ? 48 LEU B CB 1 ATOM 2006 C CG . LEU B 2 48 ? -5.397 46.944 17.639 1.00 25.26 ? 48 LEU B CG 1 ATOM 2007 C CD1 . LEU B 2 48 ? -4.581 47.551 18.769 1.00 23.92 ? 48 LEU B CD1 1 ATOM 2008 C CD2 . LEU B 2 48 ? -6.873 47.244 17.827 1.00 21.83 ? 48 LEU B CD2 1 ATOM 2009 N N . GLY B 2 49 ? -3.807 47.179 13.413 1.00 23.88 ? 49 GLY B N 1 ATOM 2010 C CA . GLY B 2 49 ? -3.205 47.798 12.248 1.00 18.12 ? 49 GLY B CA 1 ATOM 2011 C C . GLY B 2 49 ? -1.852 47.201 11.929 1.00 19.83 ? 49 GLY B C 1 ATOM 2012 O O . GLY B 2 49 ? -1.415 46.223 12.541 1.00 22.02 ? 49 GLY B O 1 ATOM 2013 N N . VAL B 2 50 ? -1.191 47.819 10.953 1.00 26.16 ? 50 VAL B N 1 ATOM 2014 C CA . VAL B 2 50 ? 0.078 47.325 10.430 1.00 23.05 ? 50 VAL B CA 1 ATOM 2015 C C . VAL B 2 50 ? 0.797 48.485 9.759 1.00 22.22 ? 50 VAL B C 1 ATOM 2016 O O . VAL B 2 50 ? 0.171 49.332 9.118 1.00 25.18 ? 50 VAL B O 1 ATOM 2017 C CB . VAL B 2 50 ? -0.145 46.149 9.447 1.00 18.35 ? 50 VAL B CB 1 ATOM 2018 C CG1 . VAL B 2 50 ? -1.194 46.516 8.406 1.00 16.22 ? 50 VAL B CG1 1 ATOM 2019 C CG2 . VAL B 2 50 ? 1.159 45.758 8.766 1.00 15.33 ? 50 VAL B CG2 1 ATOM 2020 N N . ILE B 2 51 ? 2.116 48.531 9.929 1.00 23.20 ? 51 ILE B N 1 ATOM 2021 C CA . ILE B 2 51 ? 2.988 49.393 9.140 1.00 21.19 ? 51 ILE B CA 1 ATOM 2022 C C . ILE B 2 51 ? 3.828 48.494 8.244 1.00 21.20 ? 51 ILE B C 1 ATOM 2023 O O . ILE B 2 51 ? 4.441 47.530 8.717 1.00 24.21 ? 51 ILE B O 1 ATOM 2024 C CB . ILE B 2 51 ? 3.858 50.302 10.029 1.00 25.03 ? 51 ILE B CB 1 ATOM 2025 C CG1 . ILE B 2 51 ? 4.687 51.261 9.171 1.00 31.51 ? 51 ILE B CG1 1 ATOM 2026 C CG2 . ILE B 2 51 ? 4.746 49.493 10.974 1.00 16.60 ? 51 ILE B CG2 1 ATOM 2027 C CD1 . ILE B 2 51 ? 5.235 52.442 9.944 1.00 33.40 ? 51 ILE B CD1 1 ATOM 2028 N N . TRP B 2 52 ? 3.820 48.781 6.945 1.00 24.46 ? 52 TRP B N 1 ATOM 2029 C CA . TRP B 2 52 ? 4.447 47.907 5.969 1.00 19.95 ? 52 TRP B CA 1 ATOM 2030 C C . TRP B 2 52 ? 5.921 48.265 5.793 1.00 28.66 ? 52 TRP B C 1 ATOM 2031 O O . TRP B 2 52 ? 6.439 49.205 6.401 1.00 33.18 ? 52 TRP B O 1 ATOM 2032 C CB . TRP B 2 52 ? 3.699 47.974 4.638 1.00 23.01 ? 52 TRP B CB 1 ATOM 2033 C CG . TRP B 2 52 ? 2.284 47.482 4.712 1.00 20.78 ? 52 TRP B CG 1 ATOM 2034 C CD1 . TRP B 2 52 ? 1.149 48.239 4.690 1.00 17.16 ? 52 TRP B CD1 1 ATOM 2035 C CD2 . TRP B 2 52 ? 1.855 46.119 4.826 1.00 27.91 ? 52 TRP B CD2 1 ATOM 2036 N NE1 . TRP B 2 52 ? 0.039 47.433 4.782 1.00 19.46 ? 52 TRP B NE1 1 ATOM 2037 C CE2 . TRP B 2 52 ? 0.445 46.127 4.864 1.00 25.49 ? 52 TRP B CE2 1 ATOM 2038 C CE3 . TRP B 2 52 ? 2.526 44.894 4.897 1.00 27.17 ? 52 TRP B CE3 1 ATOM 2039 C CZ2 . TRP B 2 52 ? -0.305 44.959 4.973 1.00 33.27 ? 52 TRP B CZ2 1 ATOM 2040 C CZ3 . TRP B 2 52 ? 1.780 43.734 5.005 1.00 32.01 ? 52 TRP B CZ3 1 ATOM 2041 C CH2 . TRP B 2 52 ? 0.379 43.775 5.042 1.00 41.84 ? 52 TRP B CH2 1 ATOM 2042 N N . SER B 2 53 ? 6.609 47.496 4.945 1.00 35.93 ? 53 SER B N 1 ATOM 2043 C CA . SER B 2 53 ? 8.028 47.741 4.699 1.00 31.54 ? 53 SER B CA 1 ATOM 2044 C C . SER B 2 53 ? 8.256 49.145 4.155 1.00 32.65 ? 53 SER B C 1 ATOM 2045 O O . SER B 2 53 ? 9.133 49.876 4.630 1.00 33.33 ? 53 SER B O 1 ATOM 2046 C CB . SER B 2 53 ? 8.578 46.695 3.729 1.00 26.71 ? 53 SER B CB 1 ATOM 2047 O OG . SER B 2 53 ? 8.485 45.390 4.272 1.00 34.75 ? 53 SER B OG 1 ATOM 2048 N N . GLY B 2 54 ? 7.463 49.543 3.164 1.00 30.87 ? 54 GLY B N 1 ATOM 2049 C CA . GLY B 2 54 ? 7.596 50.830 2.515 1.00 26.37 ? 54 GLY B CA 1 ATOM 2050 C C . GLY B 2 54 ? 7.135 52.028 3.308 1.00 30.79 ? 54 GLY B C 1 ATOM 2051 O O . GLY B 2 54 ? 7.281 53.157 2.835 1.00 23.81 ? 54 GLY B O 1 ATOM 2052 N N . GLY B 2 55 ? 6.577 51.825 4.500 1.00 37.19 ? 55 GLY B N 1 ATOM 2053 C CA . GLY B 2 55 ? 6.129 52.918 5.337 1.00 24.42 ? 55 GLY B CA 1 ATOM 2054 C C . GLY B 2 55 ? 4.638 53.174 5.328 1.00 28.70 ? 55 GLY B C 1 ATOM 2055 O O . GLY B 2 55 ? 4.174 54.038 6.083 1.00 35.99 ? 55 GLY B O 1 ATOM 2056 N N . ASN B 2 56 ? 3.877 52.464 4.499 1.00 33.63 ? 56 ASN B N 1 ATOM 2057 C CA . ASN B 2 56 ? 2.431 52.617 4.496 1.00 34.70 ? 56 ASN B CA 1 ATOM 2058 C C . ASN B 2 56 ? 1.823 51.984 5.745 1.00 31.77 ? 56 ASN B C 1 ATOM 2059 O O . ASN B 2 56 ? 2.424 51.128 6.402 1.00 27.76 ? 56 ASN B O 1 ATOM 2060 C CB . ASN B 2 56 ? 1.821 51.983 3.246 1.00 38.76 ? 56 ASN B CB 1 ATOM 2061 C CG . ASN B 2 56 ? 2.160 52.744 1.981 1.00 45.33 ? 56 ASN B CG 1 ATOM 2062 O OD1 . ASN B 2 56 ? 2.346 53.961 2.006 1.00 44.99 ? 56 ASN B OD1 1 ATOM 2063 N ND2 . ASN B 2 56 ? 2.239 52.030 0.864 1.00 47.69 ? 56 ASN B ND2 1 ATOM 2064 N N . THR B 2 57 ? 0.607 52.419 6.069 1.00 32.35 ? 57 THR B N 1 ATOM 2065 C CA . THR B 2 57 ? -0.110 51.894 7.220 1.00 17.92 ? 57 THR B CA 1 ATOM 2066 C C . THR B 2 57 ? -1.557 51.619 6.847 1.00 23.60 ? 57 THR B C 1 ATOM 2067 O O . THR B 2 57 ? -2.155 52.350 6.051 1.00 32.17 ? 57 THR B O 1 ATOM 2068 C CB . THR B 2 57 ? -0.060 52.862 8.415 1.00 18.27 ? 57 THR B CB 1 ATOM 2069 O OG1 . THR B 2 57 ? -0.423 54.180 7.986 1.00 27.01 ? 57 THR B OG1 1 ATOM 2070 C CG2 . THR B 2 57 ? 1.330 52.890 9.034 1.00 21.14 ? 57 THR B CG2 1 ATOM 2071 N N . ASP B 2 58 ? -2.108 50.556 7.425 1.00 28.15 ? 58 ASP B N 1 ATOM 2072 C CA . ASP B 2 58 ? -3.533 50.261 7.372 1.00 29.13 ? 58 ASP B CA 1 ATOM 2073 C C . ASP B 2 58 ? -4.043 50.144 8.798 1.00 26.94 ? 58 ASP B C 1 ATOM 2074 O O . ASP B 2 58 ? -3.422 49.474 9.628 1.00 33.67 ? 58 ASP B O 1 ATOM 2075 C CB . ASP B 2 58 ? -3.817 48.968 6.604 1.00 29.71 ? 58 ASP B CB 1 ATOM 2076 C CG . ASP B 2 58 ? -3.371 49.036 5.160 1.00 35.82 ? 58 ASP B CG 1 ATOM 2077 O OD1 . ASP B 2 58 ? -3.713 50.024 4.477 1.00 43.62 ? 58 ASP B OD1 1 ATOM 2078 O OD2 . ASP B 2 58 ? -2.671 48.104 4.712 1.00 35.70 ? 58 ASP B OD2 1 ATOM 2079 N N . TYR B 2 59 ? -5.159 50.802 9.087 1.00 17.89 ? 59 TYR B N 1 ATOM 2080 C CA . TYR B 2 59 ? -5.775 50.750 10.403 1.00 28.09 ? 59 TYR B CA 1 ATOM 2081 C C . TYR B 2 59 ? -7.138 50.081 10.302 1.00 18.18 ? 59 TYR B C 1 ATOM 2082 O O . TYR B 2 59 ? -7.909 50.358 9.378 1.00 28.00 ? 59 TYR B O 1 ATOM 2083 C CB . TYR B 2 59 ? -5.921 52.152 11.011 1.00 29.41 ? 59 TYR B CB 1 ATOM 2084 C CG . TYR B 2 59 ? -4.628 52.938 11.073 1.00 22.97 ? 59 TYR B CG 1 ATOM 2085 C CD1 . TYR B 2 59 ? -3.437 52.332 11.448 1.00 17.82 ? 59 TYR B CD1 1 ATOM 2086 C CD2 . TYR B 2 59 ? -4.601 54.286 10.745 1.00 28.56 ? 59 TYR B CD2 1 ATOM 2087 C CE1 . TYR B 2 59 ? -2.255 53.050 11.499 1.00 18.05 ? 59 TYR B CE1 1 ATOM 2088 C CE2 . TYR B 2 59 ? -3.425 55.012 10.793 1.00 25.13 ? 59 TYR B CE2 1 ATOM 2089 C CZ . TYR B 2 59 ? -2.256 54.391 11.169 1.00 22.59 ? 59 TYR B CZ 1 ATOM 2090 O OH . TYR B 2 59 ? -1.083 55.111 11.216 1.00 33.15 ? 59 TYR B OH 1 ATOM 2091 N N . ASN B 2 60 ? -7.422 49.194 11.252 1.00 20.62 ? 60 ASN B N 1 ATOM 2092 C CA . ASN B 2 60 ? -8.748 48.601 11.339 1.00 21.15 ? 60 ASN B CA 1 ATOM 2093 C C . ASN B 2 60 ? -9.792 49.701 11.498 1.00 23.87 ? 60 ASN B C 1 ATOM 2094 O O . ASN B 2 60 ? -9.541 50.739 12.114 1.00 23.42 ? 60 ASN B O 1 ATOM 2095 C CB . ASN B 2 60 ? -8.823 47.619 12.510 1.00 23.08 ? 60 ASN B CB 1 ATOM 2096 C CG . ASN B 2 60 ? -9.930 46.596 12.340 1.00 27.91 ? 60 ASN B CG 1 ATOM 2097 O OD1 . ASN B 2 60 ? -10.839 46.778 11.530 1.00 32.32 ? 60 ASN B OD1 1 ATOM 2098 N ND2 . ASN B 2 60 ? -9.859 45.512 13.104 1.00 17.82 ? 60 ASN B ND2 1 ATOM 2099 N N . THR B 2 61 ? -10.973 49.457 10.934 1.00 24.87 ? 61 THR B N 1 ATOM 2100 C CA . THR B 2 61 ? -11.976 50.508 10.762 1.00 30.78 ? 61 THR B CA 1 ATOM 2101 C C . THR B 2 61 ? -12.303 51.278 12.042 1.00 33.30 ? 61 THR B C 1 ATOM 2102 O O . THR B 2 61 ? -12.250 52.518 12.011 1.00 29.25 ? 61 THR B O 1 ATOM 2103 C CB . THR B 2 61 ? -13.242 49.897 10.143 1.00 31.49 ? 61 THR B CB 1 ATOM 2104 O OG1 . THR B 2 61 ? -12.931 49.336 8.866 1.00 36.46 ? 61 THR B OG1 1 ATOM 2105 C CG2 . THR B 2 61 ? -14.323 50.959 9.985 1.00 31.18 ? 61 THR B CG2 1 ATOM 2106 N N . PRO B 2 62 ? -12.629 50.645 13.180 1.00 34.04 ? 62 PRO B N 1 ATOM 2107 C CA . PRO B 2 62 ? -13.011 51.436 14.365 1.00 34.40 ? 62 PRO B CA 1 ATOM 2108 C C . PRO B 2 62 ? -11.865 52.208 15.003 1.00 32.03 ? 62 PRO B C 1 ATOM 2109 O O . PRO B 2 62 ? -12.091 52.909 15.997 1.00 39.30 ? 62 PRO B O 1 ATOM 2110 C CB . PRO B 2 62 ? -13.564 50.377 15.328 1.00 29.67 ? 62 PRO B CB 1 ATOM 2111 C CG . PRO B 2 62 ? -12.902 49.121 14.930 1.00 29.91 ? 62 PRO B CG 1 ATOM 2112 C CD . PRO B 2 62 ? -12.717 49.195 13.446 1.00 29.67 ? 62 PRO B CD 1 ATOM 2113 N N . PHE B 2 63 ? -10.647 52.114 14.471 1.00 28.39 ? 63 PHE B N 1 ATOM 2114 C CA . PHE B 2 63 ? -9.497 52.784 15.056 1.00 27.30 ? 63 PHE B CA 1 ATOM 2115 C C . PHE B 2 63 ? -8.821 53.767 14.108 1.00 28.64 ? 63 PHE B C 1 ATOM 2116 O O . PHE B 2 63 ? -7.821 54.380 14.494 1.00 27.59 ? 63 PHE B O 1 ATOM 2117 C CB . PHE B 2 63 ? -8.465 51.752 15.533 1.00 25.74 ? 63 PHE B CB 1 ATOM 2118 C CG . PHE B 2 63 ? -9.034 50.703 16.439 1.00 28.91 ? 63 PHE B CG 1 ATOM 2119 C CD1 . PHE B 2 63 ? -9.120 50.921 17.804 1.00 29.97 ? 63 PHE B CD1 1 ATOM 2120 C CD2 . PHE B 2 63 ? -9.485 49.498 15.928 1.00 30.64 ? 63 PHE B CD2 1 ATOM 2121 C CE1 . PHE B 2 63 ? -9.644 49.951 18.644 1.00 34.60 ? 63 PHE B CE1 1 ATOM 2122 C CE2 . PHE B 2 63 ? -10.011 48.528 16.761 1.00 29.90 ? 63 PHE B CE2 1 ATOM 2123 C CZ . PHE B 2 63 ? -10.091 48.755 18.120 1.00 26.67 ? 63 PHE B CZ 1 ATOM 2124 N N . THR B 2 64 ? -9.341 53.951 12.891 1.00 27.54 ? 64 THR B N 1 ATOM 2125 C CA . THR B 2 64 ? -8.691 54.841 11.933 1.00 36.45 ? 64 THR B CA 1 ATOM 2126 C C . THR B 2 64 ? -8.608 56.277 12.437 1.00 34.84 ? 64 THR B C 1 ATOM 2127 O O . THR B 2 64 ? -7.756 57.040 11.969 1.00 32.09 ? 64 THR B O 1 ATOM 2128 C CB . THR B 2 64 ? -9.430 54.805 10.592 1.00 39.08 ? 64 THR B CB 1 ATOM 2129 O OG1 . THR B 2 64 ? -10.811 55.121 10.794 1.00 44.54 ? 64 THR B OG1 1 ATOM 2130 C CG2 . THR B 2 64 ? -9.321 53.424 9.956 1.00 42.03 ? 64 THR B CG2 1 ATOM 2131 N N . SER B 2 65 ? -9.458 56.660 13.389 1.00 37.55 ? 65 SER B N 1 ATOM 2132 C CA . SER B 2 65 ? -9.508 58.038 13.859 1.00 41.77 ? 65 SER B CA 1 ATOM 2133 C C . SER B 2 65 ? -8.545 58.326 15.001 1.00 39.55 ? 65 SER B C 1 ATOM 2134 O O . SER B 2 65 ? -8.190 59.491 15.208 1.00 32.50 ? 65 SER B O 1 ATOM 2135 C CB . SER B 2 65 ? -10.930 58.393 14.304 1.00 38.40 ? 65 SER B CB 1 ATOM 2136 O OG . SER B 2 65 ? -11.366 57.539 15.348 1.00 55.86 ? 65 SER B OG 1 ATOM 2137 N N . ARG B 2 66 ? -8.116 57.308 15.751 1.00 33.22 ? 66 ARG B N 1 ATOM 2138 C CA . ARG B 2 66 ? -7.264 57.537 16.910 1.00 34.22 ? 66 ARG B CA 1 ATOM 2139 C C . ARG B 2 66 ? -6.003 56.681 16.907 1.00 30.77 ? 66 ARG B C 1 ATOM 2140 O O . ARG B 2 66 ? -5.300 56.639 17.921 1.00 34.09 ? 66 ARG B O 1 ATOM 2141 C CB . ARG B 2 66 ? -8.049 57.305 18.209 1.00 38.42 ? 66 ARG B CB 1 ATOM 2142 C CG . ARG B 2 66 ? -8.623 55.903 18.383 1.00 34.61 ? 66 ARG B CG 1 ATOM 2143 C CD . ARG B 2 66 ? -9.638 55.892 19.522 1.00 35.14 ? 66 ARG B CD 1 ATOM 2144 N NE . ARG B 2 66 ? -10.172 54.564 19.817 1.00 30.45 ? 66 ARG B NE 1 ATOM 2145 C CZ . ARG B 2 66 ? -9.917 53.887 20.933 1.00 30.28 ? 66 ARG B CZ 1 ATOM 2146 N NH1 . ARG B 2 66 ? -9.134 54.415 21.864 1.00 23.34 ? 66 ARG B NH1 1 ATOM 2147 N NH2 . ARG B 2 66 ? -10.450 52.687 21.122 1.00 31.62 ? 66 ARG B NH2 1 ATOM 2148 N N . LEU B 2 67 ? -5.689 56.013 15.804 1.00 28.97 ? 67 LEU B N 1 ATOM 2149 C CA . LEU B 2 67 ? -4.513 55.161 15.721 1.00 25.73 ? 67 LEU B CA 1 ATOM 2150 C C . LEU B 2 67 ? -3.450 55.809 14.843 1.00 29.28 ? 67 LEU B C 1 ATOM 2151 O O . LEU B 2 67 ? -3.761 56.474 13.851 1.00 38.46 ? 67 LEU B O 1 ATOM 2152 C CB . LEU B 2 67 ? -4.876 53.778 15.169 1.00 35.83 ? 67 LEU B CB 1 ATOM 2153 C CG . LEU B 2 67 ? -3.883 52.654 15.453 1.00 36.36 ? 67 LEU B CG 1 ATOM 2154 C CD1 . LEU B 2 67 ? -3.451 52.728 16.901 1.00 34.81 ? 67 LEU B CD1 1 ATOM 2155 C CD2 . LEU B 2 67 ? -4.507 51.302 15.150 1.00 34.28 ? 67 LEU B CD2 1 ATOM 2156 N N . SER B 2 68 ? -2.189 55.611 15.221 1.00 31.99 ? 68 SER B N 1 ATOM 2157 C CA . SER B 2 68 ? -1.066 56.161 14.468 1.00 28.09 ? 68 SER B CA 1 ATOM 2158 C C . SER B 2 68 ? 0.150 55.278 14.690 1.00 19.18 ? 68 SER B C 1 ATOM 2159 O O . SER B 2 68 ? 0.624 55.150 15.823 1.00 18.94 ? 68 SER B O 1 ATOM 2160 C CB . SER B 2 68 ? -0.772 57.600 14.895 1.00 34.95 ? 68 SER B CB 1 ATOM 2161 O OG . SER B 2 68 ? 0.393 58.088 14.254 1.00 45.83 ? 68 SER B OG 1 ATOM 2162 N N . ILE B 2 69 ? 0.656 54.677 13.616 1.00 18.78 ? 69 ILE B N 1 ATOM 2163 C CA . ILE B 2 69 ? 1.823 53.805 13.670 1.00 18.13 ? 69 ILE B CA 1 ATOM 2164 C C . ILE B 2 69 ? 2.955 54.459 12.891 1.00 31.10 ? 69 ILE B C 1 ATOM 2165 O O . ILE B 2 69 ? 2.752 54.943 11.771 1.00 27.31 ? 69 ILE B O 1 ATOM 2166 C CB . ILE B 2 69 ? 1.513 52.406 13.111 1.00 27.21 ? 69 ILE B CB 1 ATOM 2167 C CG1 . ILE B 2 69 ? 0.278 51.813 13.791 1.00 20.99 ? 69 ILE B CG1 1 ATOM 2168 C CG2 . ILE B 2 69 ? 2.707 51.485 13.299 1.00 26.31 ? 69 ILE B CG2 1 ATOM 2169 C CD1 . ILE B 2 69 ? -0.125 50.454 13.247 1.00 15.91 ? 69 ILE B CD1 1 ATOM 2170 N N . ASN B 2 70 ? 4.145 54.478 13.488 1.00 31.75 ? 70 ASN B N 1 ATOM 2171 C CA . ASN B 2 70 ? 5.342 54.989 12.838 1.00 31.63 ? 70 ASN B CA 1 ATOM 2172 C C . ASN B 2 70 ? 6.501 54.059 13.158 1.00 30.78 ? 70 ASN B C 1 ATOM 2173 O O . ASN B 2 70 ? 6.386 53.149 13.983 1.00 35.93 ? 70 ASN B O 1 ATOM 2174 C CB . ASN B 2 70 ? 5.665 56.421 13.284 1.00 31.02 ? 70 ASN B CB 1 ATOM 2175 C CG . ASN B 2 70 ? 4.681 57.436 12.743 1.00 32.85 ? 70 ASN B CG 1 ATOM 2176 O OD1 . ASN B 2 70 ? 3.608 57.637 13.309 1.00 36.11 ? 70 ASN B OD1 1 ATOM 2177 N ND2 . ASN B 2 70 ? 5.047 58.089 11.646 1.00 48.69 ? 70 ASN B ND2 1 ATOM 2178 N N . LYS B 2 71 ? 7.633 54.296 12.503 1.00 26.47 ? 71 LYS B N 1 ATOM 2179 C CA . LYS B 2 71 ? 8.794 53.450 12.731 1.00 28.07 ? 71 LYS B CA 1 ATOM 2180 C C . LYS B 2 71 ? 10.065 54.215 12.393 1.00 30.70 ? 71 LYS B C 1 ATOM 2181 O O . LYS B 2 71 ? 10.033 55.306 11.817 1.00 22.96 ? 71 LYS B O 1 ATOM 2182 C CB . LYS B 2 71 ? 8.713 52.154 11.919 1.00 34.51 ? 71 LYS B CB 1 ATOM 2183 C CG . LYS B 2 71 ? 8.861 52.341 10.421 1.00 29.74 ? 71 LYS B CG 1 ATOM 2184 C CD . LYS B 2 71 ? 8.931 50.997 9.720 1.00 26.10 ? 71 LYS B CD 1 ATOM 2185 C CE . LYS B 2 71 ? 9.060 51.158 8.219 1.00 20.16 ? 71 LYS B CE 1 ATOM 2186 N NZ . LYS B 2 71 ? 9.399 49.860 7.577 1.00 25.22 ? 71 LYS B NZ 1 ATOM 2187 N N . ASP B 2 72 ? 11.191 53.615 12.775 1.00 34.68 ? 72 ASP B N 1 ATOM 2188 C CA . ASP B 2 72 ? 12.530 54.122 12.488 1.00 31.45 ? 72 ASP B CA 1 ATOM 2189 C C . ASP B 2 72 ? 13.339 52.911 12.032 1.00 31.92 ? 72 ASP B C 1 ATOM 2190 O O . ASP B 2 72 ? 13.771 52.101 12.859 1.00 32.83 ? 72 ASP B O 1 ATOM 2191 C CB . ASP B 2 72 ? 13.142 54.795 13.717 1.00 31.68 ? 72 ASP B CB 1 ATOM 2192 C CG . ASP B 2 72 ? 14.487 55.454 13.430 1.00 37.84 ? 72 ASP B CG 1 ATOM 2193 O OD1 . ASP B 2 72 ? 15.357 54.821 12.790 1.00 38.32 ? 72 ASP B OD1 1 ATOM 2194 O OD2 . ASP B 2 72 ? 14.673 56.615 13.854 1.00 50.60 ? 72 ASP B OD2 1 ATOM 2195 N N . ASN B 2 73 ? 13.533 52.787 10.716 1.00 37.53 ? 73 ASN B N 1 ATOM 2196 C CA . ASN B 2 73 ? 14.203 51.611 10.167 1.00 43.17 ? 73 ASN B CA 1 ATOM 2197 C C . ASN B 2 73 ? 15.613 51.459 10.723 1.00 53.60 ? 73 ASN B C 1 ATOM 2198 O O . ASN B 2 73 ? 16.049 50.343 11.031 1.00 56.48 ? 73 ASN B O 1 ATOM 2199 C CB . ASN B 2 73 ? 14.234 51.695 8.641 1.00 39.72 ? 73 ASN B CB 1 ATOM 2200 C CG . ASN B 2 73 ? 12.879 51.439 8.021 1.00 36.80 ? 73 ASN B CG 1 ATOM 2201 O OD1 . ASN B 2 73 ? 12.121 50.594 8.495 1.00 22.10 ? 73 ASN B OD1 1 ATOM 2202 N ND2 . ASN B 2 73 ? 12.563 52.172 6.957 1.00 33.60 ? 73 ASN B ND2 1 ATOM 2203 N N . SER B 2 74 ? 16.342 52.569 10.858 1.00 56.46 ? 74 SER B N 1 ATOM 2204 C CA . SER B 2 74 ? 17.702 52.507 11.384 1.00 52.55 ? 74 SER B CA 1 ATOM 2205 C C . SER B 2 74 ? 17.713 51.936 12.796 1.00 43.43 ? 74 SER B C 1 ATOM 2206 O O . SER B 2 74 ? 18.436 50.975 13.087 1.00 39.07 ? 74 SER B O 1 ATOM 2207 C CB . SER B 2 74 ? 18.334 53.899 11.362 1.00 63.89 ? 74 SER B CB 1 ATOM 2208 O OG . SER B 2 74 ? 18.060 54.564 10.140 1.00 72.18 ? 74 SER B OG 1 ATOM 2209 N N . LYS B 2 75 ? 16.906 52.509 13.685 1.00 38.79 ? 75 LYS B N 1 ATOM 2210 C CA . LYS B 2 75 ? 16.850 52.069 15.072 1.00 34.43 ? 75 LYS B CA 1 ATOM 2211 C C . LYS B 2 75 ? 16.013 50.809 15.268 1.00 35.04 ? 75 LYS B C 1 ATOM 2212 O O . LYS B 2 75 ? 15.925 50.319 16.399 1.00 23.84 ? 75 LYS B O 1 ATOM 2213 C CB . LYS B 2 75 ? 16.317 53.203 15.953 1.00 34.43 ? 75 LYS B CB 1 ATOM 2214 C CG . LYS B 2 75 ? 17.292 54.368 16.115 1.00 46.54 ? 75 LYS B CG 1 ATOM 2215 C CD . LYS B 2 75 ? 16.564 55.692 16.295 1.00 56.81 ? 75 LYS B CD 1 ATOM 2216 C CE . LYS B 2 75 ? 15.563 55.634 17.436 1.00 66.45 ? 75 LYS B CE 1 ATOM 2217 N NZ . LYS B 2 75 ? 14.625 56.792 17.401 1.00 68.20 ? 75 LYS B NZ 1 ATOM 2218 N N . SER B 2 76 ? 15.404 50.280 14.202 1.00 33.73 ? 76 SER B N 1 ATOM 2219 C CA . SER B 2 76 ? 14.644 49.027 14.254 1.00 29.40 ? 76 SER B CA 1 ATOM 2220 C C . SER B 2 76 ? 13.516 49.094 15.282 1.00 35.52 ? 76 SER B C 1 ATOM 2221 O O . SER B 2 76 ? 13.283 48.148 16.038 1.00 44.31 ? 76 SER B O 1 ATOM 2222 C CB . SER B 2 76 ? 15.563 47.836 14.538 1.00 26.10 ? 76 SER B CB 1 ATOM 2223 O OG . SER B 2 76 ? 16.715 47.867 13.714 1.00 38.74 ? 76 SER B OG 1 ATOM 2224 N N . GLN B 2 77 ? 12.806 50.218 15.313 1.00 35.37 ? 77 GLN B N 1 ATOM 2225 C CA . GLN B 2 77 ? 11.747 50.440 16.285 1.00 40.63 ? 77 GLN B CA 1 ATOM 2226 C C . GLN B 2 77 ? 10.455 50.803 15.570 1.00 34.27 ? 77 GLN B C 1 ATOM 2227 O O . GLN B 2 77 ? 10.466 51.565 14.600 1.00 22.45 ? 77 GLN B O 1 ATOM 2228 C CB . GLN B 2 77 ? 12.129 51.548 17.276 1.00 39.99 ? 77 GLN B CB 1 ATOM 2229 C CG . GLN B 2 77 ? 13.326 51.205 18.153 1.00 40.16 ? 77 GLN B CG 1 ATOM 2230 C CD . GLN B 2 77 ? 13.754 52.357 19.046 1.00 41.30 ? 77 GLN B CD 1 ATOM 2231 O OE1 . GLN B 2 77 ? 13.535 53.524 18.724 1.00 43.38 ? 77 GLN B OE1 1 ATOM 2232 N NE2 . GLN B 2 77 ? 14.366 52.030 20.178 1.00 27.21 ? 77 GLN B NE2 1 ATOM 2233 N N . VAL B 2 78 ? 9.345 50.246 16.050 1.00 29.06 ? 78 VAL B N 1 ATOM 2234 C CA . VAL B 2 78 ? 8.008 50.592 15.583 1.00 27.89 ? 78 VAL B CA 1 ATOM 2235 C C . VAL B 2 78 ? 7.284 51.283 16.729 1.00 30.14 ? 78 VAL B C 1 ATOM 2236 O O . VAL B 2 78 ? 7.323 50.808 17.871 1.00 36.60 ? 78 VAL B O 1 ATOM 2237 C CB . VAL B 2 78 ? 7.232 49.353 15.103 1.00 23.24 ? 78 VAL B CB 1 ATOM 2238 C CG1 . VAL B 2 78 ? 5.873 49.756 14.558 1.00 22.39 ? 78 VAL B CG1 1 ATOM 2239 C CG2 . VAL B 2 78 ? 8.029 48.602 14.048 1.00 24.00 ? 78 VAL B CG2 1 ATOM 2240 N N . PHE B 2 79 ? 6.634 52.405 16.433 1.00 24.78 ? 79 PHE B N 1 ATOM 2241 C CA . PHE B 2 79 ? 6.000 53.233 17.452 1.00 26.39 ? 79 PHE B CA 1 ATOM 2242 C C . PHE B 2 79 ? 4.487 53.191 17.286 1.00 31.22 ? 79 PHE B C 1 ATOM 2243 O O . PHE B 2 79 ? 3.958 53.563 16.233 1.00 35.23 ? 79 PHE B O 1 ATOM 2244 C CB . PHE B 2 79 ? 6.513 54.670 17.384 1.00 23.12 ? 79 PHE B CB 1 ATOM 2245 C CG . PHE B 2 79 ? 7.999 54.781 17.526 1.00 29.90 ? 79 PHE B CG 1 ATOM 2246 C CD1 . PHE B 2 79 ? 8.606 54.608 18.761 1.00 34.78 ? 79 PHE B CD1 1 ATOM 2247 C CD2 . PHE B 2 79 ? 8.793 55.055 16.424 1.00 25.96 ? 79 PHE B CD2 1 ATOM 2248 C CE1 . PHE B 2 79 ? 9.977 54.706 18.895 1.00 32.38 ? 79 PHE B CE1 1 ATOM 2249 C CE2 . PHE B 2 79 ? 10.164 55.155 16.550 1.00 29.63 ? 79 PHE B CE2 1 ATOM 2250 C CZ . PHE B 2 79 ? 10.758 54.981 17.788 1.00 35.88 ? 79 PHE B CZ 1 ATOM 2251 N N . PHE B 2 80 ? 3.804 52.746 18.334 1.00 31.05 ? 80 PHE B N 1 ATOM 2252 C CA . PHE B 2 80 ? 2.355 52.621 18.374 1.00 26.82 ? 80 PHE B CA 1 ATOM 2253 C C . PHE B 2 80 ? 1.805 53.724 19.267 1.00 21.76 ? 80 PHE B C 1 ATOM 2254 O O . PHE B 2 80 ? 2.297 53.923 20.383 1.00 27.27 ? 80 PHE B O 1 ATOM 2255 C CB . PHE B 2 80 ? 1.971 51.234 18.902 1.00 26.66 ? 80 PHE B CB 1 ATOM 2256 C CG . PHE B 2 80 ? 0.491 50.982 19.007 1.00 26.12 ? 80 PHE B CG 1 ATOM 2257 C CD1 . PHE B 2 80 ? -0.213 51.352 20.143 1.00 29.30 ? 80 PHE B CD1 1 ATOM 2258 C CD2 . PHE B 2 80 ? -0.184 50.317 17.996 1.00 26.11 ? 80 PHE B CD2 1 ATOM 2259 C CE1 . PHE B 2 80 ? -1.566 51.099 20.252 1.00 29.64 ? 80 PHE B CE1 1 ATOM 2260 C CE2 . PHE B 2 80 ? -1.538 50.058 18.102 1.00 15.09 ? 80 PHE B CE2 1 ATOM 2261 C CZ . PHE B 2 80 ? -2.229 50.451 19.232 1.00 15.32 ? 80 PHE B CZ 1 ATOM 2262 N N . LYS B 2 81 ? 0.805 54.451 18.771 1.00 22.81 ? 81 LYS B N 1 ATOM 2263 C CA . LYS B 2 81 ? 0.165 55.513 19.542 1.00 23.91 ? 81 LYS B CA 1 ATOM 2264 C C . LYS B 2 81 ? -1.330 55.491 19.265 1.00 24.13 ? 81 LYS B C 1 ATOM 2265 O O . LYS B 2 81 ? -1.751 55.580 18.108 1.00 21.78 ? 81 LYS B O 1 ATOM 2266 C CB . LYS B 2 81 ? 0.754 56.889 19.206 1.00 28.01 ? 81 LYS B CB 1 ATOM 2267 C CG . LYS B 2 81 ? 0.319 58.003 20.164 1.00 37.18 ? 81 LYS B CG 1 ATOM 2268 C CD . LYS B 2 81 ? 0.732 59.382 19.657 1.00 45.15 ? 81 LYS B CD 1 ATOM 2269 C CE . LYS B 2 81 ? 0.108 60.506 20.477 1.00 43.72 ? 81 LYS B CE 1 ATOM 2270 N NZ . LYS B 2 81 ? 0.791 60.723 21.780 1.00 43.97 ? 81 LYS B NZ 1 ATOM 2271 N N . MET B 2 82 ? -2.126 55.364 20.324 1.00 33.25 ? 82 MET B N 1 ATOM 2272 C CA . MET B 2 82 ? -3.580 55.407 20.241 1.00 42.54 ? 82 MET B CA 1 ATOM 2273 C C . MET B 2 82 ? -4.087 56.516 21.152 1.00 44.45 ? 82 MET B C 1 ATOM 2274 O O . MET B 2 82 ? -3.648 56.625 22.302 1.00 46.62 ? 82 MET B O 1 ATOM 2275 C CB . MET B 2 82 ? -4.196 54.060 20.634 1.00 43.87 ? 82 MET B CB 1 ATOM 2276 C CG . MET B 2 82 ? -5.714 54.050 20.685 1.00 51.21 ? 82 MET B CG 1 ATOM 2277 S SD . MET B 2 82 ? -6.386 52.403 20.989 1.00 46.22 ? 82 MET B SD 1 ATOM 2278 C CE . MET B 2 82 ? -5.947 51.579 19.462 1.00 39.22 ? 82 MET B CE 1 ATOM 2279 N N . ASN B 2 83 ? -5.003 57.334 20.642 1.00 38.11 ? 83 ASN B N 1 ATOM 2280 C CA . ASN B 2 83 ? -5.491 58.504 21.359 1.00 37.24 ? 83 ASN B CA 1 ATOM 2281 C C . ASN B 2 83 ? -6.787 58.208 22.104 1.00 35.89 ? 83 ASN B C 1 ATOM 2282 O O . ASN B 2 83 ? -7.516 57.264 21.788 1.00 35.84 ? 83 ASN B O 1 ATOM 2283 C CB . ASN B 2 83 ? -5.717 59.679 20.404 1.00 37.31 ? 83 ASN B CB 1 ATOM 2284 C CG . ASN B 2 83 ? -4.424 60.288 19.913 1.00 51.80 ? 83 ASN B CG 1 ATOM 2285 O OD1 . ASN B 2 83 ? -3.686 60.915 20.675 1.00 53.12 ? 83 ASN B OD1 1 ATOM 2286 N ND2 . ASN B 2 83 ? -4.148 60.121 18.626 1.00 60.88 ? 83 ASN B ND2 1 ATOM 2287 N N . SER B 2 84 ? -7.063 59.056 23.101 1.00 32.49 ? 84 SER B N 1 ATOM 2288 C CA . SER B 2 84 ? -8.310 59.085 23.862 1.00 41.09 ? 84 SER B CA 1 ATOM 2289 C C . SER B 2 84 ? -8.787 57.693 24.255 1.00 43.28 ? 84 SER B C 1 ATOM 2290 O O . SER B 2 84 ? -9.720 57.153 23.650 1.00 42.55 ? 84 SER B O 1 ATOM 2291 C CB . SER B 2 84 ? -9.398 59.820 23.073 1.00 47.14 ? 84 SER B CB 1 ATOM 2292 O OG . SER B 2 84 ? -9.554 59.287 21.771 1.00 56.47 ? 84 SER B OG 1 ATOM 2293 N N . LEU B 2 85 ? -8.155 57.113 25.269 1.00 38.51 ? 85 LEU B N 1 ATOM 2294 C CA . LEU B 2 85 ? -8.508 55.784 25.739 1.00 36.27 ? 85 LEU B CA 1 ATOM 2295 C C . LEU B 2 85 ? -9.629 55.855 26.768 1.00 30.08 ? 85 LEU B C 1 ATOM 2296 O O . LEU B 2 85 ? -9.735 56.808 27.545 1.00 38.73 ? 85 LEU B O 1 ATOM 2297 C CB . LEU B 2 85 ? -7.294 55.080 26.350 1.00 20.80 ? 85 LEU B CB 1 ATOM 2298 C CG . LEU B 2 85 ? -6.344 54.339 25.404 1.00 30.54 ? 85 LEU B CG 1 ATOM 2299 C CD1 . LEU B 2 85 ? -5.515 55.304 24.574 1.00 26.88 ? 85 LEU B CD1 1 ATOM 2300 C CD2 . LEU B 2 85 ? -5.445 53.386 26.180 1.00 26.76 ? 85 LEU B CD2 1 ATOM 2301 N N . GLN B 2 86 ? -10.470 54.833 26.759 1.00 30.36 ? 86 GLN B N 1 ATOM 2302 C CA . GLN B 2 86 ? -11.502 54.629 27.761 1.00 37.79 ? 86 GLN B CA 1 ATOM 2303 C C . GLN B 2 86 ? -11.259 53.287 28.442 1.00 38.06 ? 86 GLN B C 1 ATOM 2304 O O . GLN B 2 86 ? -10.362 52.529 28.060 1.00 43.27 ? 86 GLN B O 1 ATOM 2305 C CB . GLN B 2 86 ? -12.898 54.701 27.133 1.00 38.75 ? 86 GLN B CB 1 ATOM 2306 C CG . GLN B 2 86 ? -13.183 56.018 26.421 1.00 47.26 ? 86 GLN B CG 1 ATOM 2307 C CD . GLN B 2 86 ? -12.997 57.225 27.326 1.00 64.02 ? 86 GLN B CD 1 ATOM 2308 O OE1 . GLN B 2 86 ? -13.284 57.171 28.523 1.00 64.13 ? 86 GLN B OE1 1 ATOM 2309 N NE2 . GLN B 2 86 ? -12.509 58.322 26.756 1.00 71.95 ? 86 GLN B NE2 1 ATOM 2310 N N . SER B 2 87 ? -12.044 53.047 29.497 1.00 37.21 ? 87 SER B N 1 ATOM 2311 C CA . SER B 2 87 ? -11.823 51.891 30.357 1.00 41.22 ? 87 SER B CA 1 ATOM 2312 C C . SER B 2 87 ? -11.772 50.601 29.560 1.00 42.46 ? 87 SER B C 1 ATOM 2313 O O . SER B 2 87 ? -10.984 49.702 29.869 1.00 45.14 ? 87 SER B O 1 ATOM 2314 C CB . SER B 2 87 ? -12.922 51.805 31.414 1.00 37.22 ? 87 SER B CB 1 ATOM 2315 O OG . SER B 2 87 ? -12.810 52.869 32.334 1.00 40.12 ? 87 SER B OG 1 ATOM 2316 N N . ASN B 2 88 ? -12.597 50.491 28.530 1.00 40.09 ? 88 ASN B N 1 ATOM 2317 C CA . ASN B 2 88 ? -12.677 49.252 27.777 1.00 39.21 ? 88 ASN B CA 1 ATOM 2318 C C . ASN B 2 88 ? -11.562 49.109 26.735 1.00 36.30 ? 88 ASN B C 1 ATOM 2319 O O . ASN B 2 88 ? -11.546 48.119 25.991 1.00 40.49 ? 88 ASN B O 1 ATOM 2320 C CB . ASN B 2 88 ? -14.067 49.145 27.151 1.00 35.30 ? 88 ASN B CB 1 ATOM 2321 C CG . ASN B 2 88 ? -14.235 50.000 25.905 1.00 53.38 ? 88 ASN B CG 1 ATOM 2322 O OD1 . ASN B 2 88 ? -13.449 50.909 25.607 1.00 50.76 ? 88 ASN B OD1 1 ATOM 2323 N ND2 . ASN B 2 88 ? -15.296 49.703 25.174 1.00 76.47 ? 88 ASN B ND2 1 ATOM 2324 N N . ASP B 2 89 ? -10.639 50.071 26.669 1.00 28.40 ? 89 ASP B N 1 ATOM 2325 C CA . ASP B 2 89 ? -9.393 49.912 25.928 1.00 29.92 ? 89 ASP B CA 1 ATOM 2326 C C . ASP B 2 89 ? -8.319 49.225 26.761 1.00 32.14 ? 89 ASP B C 1 ATOM 2327 O O . ASP B 2 89 ? -7.219 48.973 26.258 1.00 29.54 ? 89 ASP B O 1 ATOM 2328 C CB . ASP B 2 89 ? -8.885 51.274 25.434 1.00 29.48 ? 89 ASP B CB 1 ATOM 2329 C CG . ASP B 2 89 ? -9.745 51.854 24.313 1.00 36.24 ? 89 ASP B CG 1 ATOM 2330 O OD1 . ASP B 2 89 ? -10.115 51.104 23.384 1.00 39.52 ? 89 ASP B OD1 1 ATOM 2331 O OD2 . ASP B 2 89 ? -10.051 53.064 24.359 1.00 34.16 ? 89 ASP B OD2 1 ATOM 2332 N N . THR B 2 90 ? -8.620 48.932 28.021 1.00 25.87 ? 90 THR B N 1 ATOM 2333 C CA . THR B 2 90 ? -7.729 48.164 28.880 1.00 24.82 ? 90 THR B CA 1 ATOM 2334 C C . THR B 2 90 ? -7.542 46.772 28.295 1.00 26.92 ? 90 THR B C 1 ATOM 2335 O O . THR B 2 90 ? -8.508 46.011 28.172 1.00 23.11 ? 90 THR B O 1 ATOM 2336 C CB . THR B 2 90 ? -8.296 48.082 30.294 1.00 25.50 ? 90 THR B CB 1 ATOM 2337 O OG1 . THR B 2 90 ? -8.323 49.393 30.872 1.00 34.11 ? 90 THR B OG1 1 ATOM 2338 C CG2 . THR B 2 90 ? -7.446 47.165 31.161 1.00 15.11 ? 90 THR B CG2 1 ATOM 2339 N N . ALA B 2 91 ? -6.309 46.440 27.926 1.00 14.20 ? 91 ALA B N 1 ATOM 2340 C CA . ALA B 2 91 ? -6.034 45.182 27.246 1.00 13.85 ? 91 ALA B CA 1 ATOM 2341 C C . ALA B 2 91 ? -4.529 44.964 27.192 1.00 20.11 ? 91 ALA B C 1 ATOM 2342 O O . ALA B 2 91 ? -3.736 45.840 27.549 1.00 24.83 ? 91 ALA B O 1 ATOM 2343 C CB . ALA B 2 91 ? -6.623 45.168 25.833 1.00 21.56 ? 91 ALA B CB 1 ATOM 2344 N N . ILE B 2 92 ? -4.150 43.778 26.738 1.00 19.54 ? 92 ILE B N 1 ATOM 2345 C CA . ILE B 2 92 ? -2.767 43.477 26.398 1.00 18.13 ? 92 ILE B CA 1 ATOM 2346 C C . ILE B 2 92 ? -2.556 43.818 24.933 1.00 20.42 ? 92 ILE B C 1 ATOM 2347 O O . ILE B 2 92 ? -3.301 43.349 24.065 1.00 19.02 ? 92 ILE B O 1 ATOM 2348 C CB . ILE B 2 92 ? -2.441 42.000 26.665 1.00 22.64 ? 92 ILE B CB 1 ATOM 2349 C CG1 . ILE B 2 92 ? -2.654 41.665 28.138 1.00 13.66 ? 92 ILE B CG1 1 ATOM 2350 C CG2 . ILE B 2 92 ? -1.017 41.683 26.226 1.00 11.64 ? 92 ILE B CG2 1 ATOM 2351 C CD1 . ILE B 2 92 ? -2.574 40.195 28.424 1.00 23.25 ? 92 ILE B CD1 1 ATOM 2352 N N . TYR B 2 93 ? -1.544 44.629 24.652 1.00 20.66 ? 93 TYR B N 1 ATOM 2353 C CA . TYR B 2 93 ? -1.214 45.023 23.290 1.00 14.68 ? 93 TYR B CA 1 ATOM 2354 C C . TYR B 2 93 ? 0.044 44.291 22.841 1.00 20.47 ? 93 TYR B C 1 ATOM 2355 O O . TYR B 2 93 ? 1.057 44.294 23.550 1.00 26.67 ? 93 TYR B O 1 ATOM 2356 C CB . TYR B 2 93 ? -1.028 46.538 23.196 1.00 19.15 ? 93 TYR B CB 1 ATOM 2357 C CG . TYR B 2 93 ? -2.327 47.297 23.339 1.00 30.18 ? 93 TYR B CG 1 ATOM 2358 C CD1 . TYR B 2 93 ? -2.881 47.540 24.590 1.00 23.75 ? 93 TYR B CD1 1 ATOM 2359 C CD2 . TYR B 2 93 ? -3.007 47.759 22.221 1.00 37.37 ? 93 TYR B CD2 1 ATOM 2360 C CE1 . TYR B 2 93 ? -4.074 48.227 24.722 1.00 23.83 ? 93 TYR B CE1 1 ATOM 2361 C CE2 . TYR B 2 93 ? -4.198 48.446 22.343 1.00 38.04 ? 93 TYR B CE2 1 ATOM 2362 C CZ . TYR B 2 93 ? -4.727 48.678 23.594 1.00 29.40 ? 93 TYR B CZ 1 ATOM 2363 O OH . TYR B 2 93 ? -5.916 49.363 23.712 1.00 24.14 ? 93 TYR B OH 1 ATOM 2364 N N . TYR B 2 94 ? -0.031 43.651 21.677 1.00 18.41 ? 94 TYR B N 1 ATOM 2365 C CA . TYR B 2 94 ? 1.099 42.947 21.092 1.00 15.07 ? 94 TYR B CA 1 ATOM 2366 C C . TYR B 2 94 ? 1.549 43.638 19.814 1.00 16.94 ? 94 TYR B C 1 ATOM 2367 O O . TYR B 2 94 ? 0.753 44.278 19.120 1.00 17.49 ? 94 TYR B O 1 ATOM 2368 C CB . TYR B 2 94 ? 0.756 41.496 20.741 1.00 16.76 ? 94 TYR B CB 1 ATOM 2369 C CG . TYR B 2 94 ? 0.074 40.689 21.817 1.00 16.75 ? 94 TYR B CG 1 ATOM 2370 C CD1 . TYR B 2 94 ? -1.308 40.657 21.907 1.00 18.94 ? 94 TYR B CD1 1 ATOM 2371 C CD2 . TYR B 2 94 ? 0.810 39.925 22.715 1.00 19.62 ? 94 TYR B CD2 1 ATOM 2372 C CE1 . TYR B 2 94 ? -1.942 39.909 22.876 1.00 23.72 ? 94 TYR B CE1 1 ATOM 2373 C CE2 . TYR B 2 94 ? 0.184 39.171 23.689 1.00 20.16 ? 94 TYR B CE2 1 ATOM 2374 C CZ . TYR B 2 94 ? -1.194 39.168 23.763 1.00 20.39 ? 94 TYR B CZ 1 ATOM 2375 O OH . TYR B 2 94 ? -1.832 38.424 24.727 1.00 21.43 ? 94 TYR B OH 1 ATOM 2376 N N . CYS B 2 95 ? 2.834 43.485 19.505 1.00 19.89 ? 95 CYS B N 1 ATOM 2377 C CA . CYS B 2 95 ? 3.349 43.682 18.158 1.00 21.78 ? 95 CYS B CA 1 ATOM 2378 C C . CYS B 2 95 ? 3.782 42.328 17.612 1.00 24.82 ? 95 CYS B C 1 ATOM 2379 O O . CYS B 2 95 ? 4.336 41.502 18.345 1.00 32.41 ? 95 CYS B O 1 ATOM 2380 C CB . CYS B 2 95 ? 4.514 44.681 18.123 1.00 23.12 ? 95 CYS B CB 1 ATOM 2381 S SG . CYS B 2 95 ? 6.008 44.261 19.063 1.00 36.91 ? 95 CYS B SG 1 ATOM 2382 N N . ALA B 2 96 ? 3.507 42.089 16.333 1.00 13.59 ? 96 ALA B N 1 ATOM 2383 C CA . ALA B 2 96 ? 3.737 40.779 15.745 1.00 13.92 ? 96 ALA B CA 1 ATOM 2384 C C . ALA B 2 96 ? 4.249 40.923 14.319 1.00 16.31 ? 96 ALA B C 1 ATOM 2385 O O . ALA B 2 96 ? 4.079 41.960 13.673 1.00 18.00 ? 96 ALA B O 1 ATOM 2386 C CB . ALA B 2 96 ? 2.463 39.925 15.759 1.00 13.83 ? 96 ALA B CB 1 ATOM 2387 N N . ARG B 2 97 ? 4.879 39.851 13.836 1.00 14.96 ? 97 ARG B N 1 ATOM 2388 C CA . ARG B 2 97 ? 5.395 39.780 12.479 1.00 15.56 ? 97 ARG B CA 1 ATOM 2389 C C . ARG B 2 97 ? 4.914 38.496 11.820 1.00 20.50 ? 97 ARG B C 1 ATOM 2390 O O . ARG B 2 97 ? 4.759 37.462 12.477 1.00 16.14 ? 97 ARG B O 1 ATOM 2391 C CB . ARG B 2 97 ? 6.925 39.825 12.447 1.00 16.21 ? 97 ARG B CB 1 ATOM 2392 C CG . ARG B 2 97 ? 7.492 40.250 11.105 1.00 16.82 ? 97 ARG B CG 1 ATOM 2393 C CD . ARG B 2 97 ? 8.833 39.597 10.828 1.00 17.85 ? 97 ARG B CD 1 ATOM 2394 N NE . ARG B 2 97 ? 8.677 38.242 10.309 1.00 31.44 ? 97 ARG B NE 1 ATOM 2395 C CZ . ARG B 2 97 ? 9.684 37.485 9.885 1.00 29.66 ? 97 ARG B CZ 1 ATOM 2396 N NH1 . ARG B 2 97 ? 10.926 37.950 9.920 1.00 30.81 ? 97 ARG B NH1 1 ATOM 2397 N NH2 . ARG B 2 97 ? 9.450 36.263 9.424 1.00 24.80 ? 97 ARG B NH2 1 ATOM 2398 N N . ALA B 2 98 ? 4.693 38.567 10.513 1.00 31.34 ? 98 ALA B N 1 ATOM 2399 C CA . ALA B 2 98 ? 4.187 37.427 9.767 1.00 27.95 ? 98 ALA B CA 1 ATOM 2400 C C . ALA B 2 98 ? 5.334 36.578 9.225 1.00 31.70 ? 98 ALA B C 1 ATOM 2401 O O . ALA B 2 98 ? 6.508 36.949 9.291 1.00 31.44 ? 98 ALA B O 1 ATOM 2402 C CB . ALA B 2 98 ? 3.282 37.891 8.627 1.00 22.19 ? 98 ALA B CB 1 ATOM 2403 N N . LEU B 2 99 ? 4.971 35.409 8.689 1.00 41.36 ? 99 LEU B N 1 ATOM 2404 C CA . LEU B 2 99 ? 5.955 34.550 8.036 1.00 41.02 ? 99 LEU B CA 1 ATOM 2405 C C . LEU B 2 99 ? 6.518 35.217 6.788 1.00 36.26 ? 99 LEU B C 1 ATOM 2406 O O . LEU B 2 99 ? 7.738 35.284 6.599 1.00 38.08 ? 99 LEU B O 1 ATOM 2407 C CB . LEU B 2 99 ? 5.325 33.204 7.682 1.00 38.66 ? 99 LEU B CB 1 ATOM 2408 C CG . LEU B 2 99 ? 5.546 32.057 8.664 1.00 38.78 ? 99 LEU B CG 1 ATOM 2409 C CD1 . LEU B 2 99 ? 4.854 30.805 8.159 1.00 39.28 ? 99 LEU B CD1 1 ATOM 2410 C CD2 . LEU B 2 99 ? 7.032 31.809 8.866 1.00 34.68 ? 99 LEU B CD2 1 ATOM 2411 N N . THR B 2 100 ? 5.641 35.711 5.922 1.00 35.09 ? 100 THR B N 1 ATOM 2412 C CA . THR B 2 100 ? 6.038 36.414 4.715 1.00 40.16 ? 100 THR B CA 1 ATOM 2413 C C . THR B 2 100 ? 5.755 37.902 4.877 1.00 30.38 ? 100 THR B C 1 ATOM 2414 O O . THR B 2 100 ? 4.999 38.320 5.758 1.00 28.68 ? 100 THR B O 1 ATOM 2415 C CB . THR B 2 100 ? 5.305 35.863 3.489 1.00 54.19 ? 100 THR B CB 1 ATOM 2416 O OG1 . THR B 2 100 ? 4.044 36.524 3.348 1.00 62.88 ? 100 THR B OG1 1 ATOM 2417 C CG2 . THR B 2 100 ? 5.066 34.366 3.646 1.00 56.42 ? 100 THR B CG2 1 ATOM 2418 N N . TYR B 2 101 ? 6.373 38.702 4.005 1.00 28.15 ? 101 TYR B N 1 ATOM 2419 C CA . TYR B 2 101 ? 6.321 40.152 4.157 1.00 32.56 ? 101 TYR B CA 1 ATOM 2420 C C . TYR B 2 101 ? 4.927 40.722 3.920 1.00 37.61 ? 101 TYR B C 1 ATOM 2421 O O . TYR B 2 101 ? 4.618 41.802 4.435 1.00 28.82 ? 101 TYR B O 1 ATOM 2422 C CB . TYR B 2 101 ? 7.325 40.815 3.207 1.00 28.23 ? 101 TYR B CB 1 ATOM 2423 C CG . TYR B 2 101 ? 6.928 40.807 1.743 1.00 25.21 ? 101 TYR B CG 1 ATOM 2424 C CD1 . TYR B 2 101 ? 6.161 41.836 1.205 1.00 19.40 ? 101 TYR B CD1 1 ATOM 2425 C CD2 . TYR B 2 101 ? 7.337 39.785 0.895 1.00 26.84 ? 101 TYR B CD2 1 ATOM 2426 C CE1 . TYR B 2 101 ? 5.800 41.838 -0.129 1.00 31.12 ? 101 TYR B CE1 1 ATOM 2427 C CE2 . TYR B 2 101 ? 6.982 39.781 -0.443 1.00 29.37 ? 101 TYR B CE2 1 ATOM 2428 C CZ . TYR B 2 101 ? 6.213 40.811 -0.949 1.00 30.47 ? 101 TYR B CZ 1 ATOM 2429 O OH . TYR B 2 101 ? 5.852 40.816 -2.279 1.00 21.04 ? 101 TYR B OH 1 ATOM 2430 N N . TYR B 2 102 ? 4.085 40.025 3.156 1.00 37.01 ? 102 TYR B N 1 ATOM 2431 C CA . TYR B 2 102 ? 2.786 40.537 2.746 1.00 31.99 ? 102 TYR B CA 1 ATOM 2432 C C . TYR B 2 102 ? 1.619 39.919 3.499 1.00 30.08 ? 102 TYR B C 1 ATOM 2433 O O . TYR B 2 102 ? 0.480 40.362 3.310 1.00 29.27 ? 102 TYR B O 1 ATOM 2434 C CB . TYR B 2 102 ? 2.580 40.288 1.245 1.00 22.17 ? 102 TYR B CB 1 ATOM 2435 C CG . TYR B 2 102 ? 2.709 38.826 0.877 1.00 19.35 ? 102 TYR B CG 1 ATOM 2436 C CD1 . TYR B 2 102 ? 1.613 37.975 0.931 1.00 19.53 ? 102 TYR B CD1 1 ATOM 2437 C CD2 . TYR B 2 102 ? 3.933 38.291 0.497 1.00 20.09 ? 102 TYR B CD2 1 ATOM 2438 C CE1 . TYR B 2 102 ? 1.728 36.638 0.611 1.00 24.75 ? 102 TYR B CE1 1 ATOM 2439 C CE2 . TYR B 2 102 ? 4.058 36.953 0.172 1.00 20.99 ? 102 TYR B CE2 1 ATOM 2440 C CZ . TYR B 2 102 ? 2.952 36.131 0.231 1.00 26.74 ? 102 TYR B CZ 1 ATOM 2441 O OH . TYR B 2 102 ? 3.074 34.798 -0.093 1.00 29.16 ? 102 TYR B OH 1 ATOM 2442 N N . ASP B 2 103 ? 1.861 38.913 4.332 1.00 31.96 ? 103 ASP B N 1 ATOM 2443 C CA . ASP B 2 103 ? 0.805 38.044 4.823 1.00 28.94 ? 103 ASP B CA 1 ATOM 2444 C C . ASP B 2 103 ? 0.415 38.407 6.254 1.00 27.54 ? 103 ASP B C 1 ATOM 2445 O O . ASP B 2 103 ? 0.939 39.346 6.859 1.00 16.54 ? 103 ASP B O 1 ATOM 2446 C CB . ASP B 2 103 ? 1.249 36.584 4.720 1.00 23.92 ? 103 ASP B CB 1 ATOM 2447 C CG . ASP B 2 103 ? 0.114 35.654 4.362 1.00 28.51 ? 103 ASP B CG 1 ATOM 2448 O OD1 . ASP B 2 103 ? -1.036 35.936 4.759 1.00 29.88 ? 103 ASP B OD1 1 ATOM 2449 O OD2 . ASP B 2 103 ? 0.373 34.642 3.674 1.00 20.27 ? 103 ASP B OD2 1 ATOM 2450 N N . TYR B 2 104 ? -0.528 37.637 6.802 1.00 19.88 ? 104 TYR B N 1 ATOM 2451 C CA . TYR B 2 104 ? -1.100 37.926 8.110 1.00 16.66 ? 104 TYR B CA 1 ATOM 2452 C C . TYR B 2 104 ? -1.041 36.741 9.068 1.00 22.48 ? 104 TYR B C 1 ATOM 2453 O O . TYR B 2 104 ? -1.681 36.790 10.124 1.00 21.17 ? 104 TYR B O 1 ATOM 2454 C CB . TYR B 2 104 ? -2.555 38.394 7.970 1.00 18.61 ? 104 TYR B CB 1 ATOM 2455 C CG . TYR B 2 104 ? -2.730 39.725 7.263 1.00 20.68 ? 104 TYR B CG 1 ATOM 2456 C CD1 . TYR B 2 104 ? -2.517 39.841 5.895 1.00 28.05 ? 104 TYR B CD1 1 ATOM 2457 C CD2 . TYR B 2 104 ? -3.127 40.859 7.960 1.00 18.41 ? 104 TYR B CD2 1 ATOM 2458 C CE1 . TYR B 2 104 ? -2.677 41.047 5.243 1.00 28.49 ? 104 TYR B CE1 1 ATOM 2459 C CE2 . TYR B 2 104 ? -3.294 42.073 7.313 1.00 26.38 ? 104 TYR B CE2 1 ATOM 2460 C CZ . TYR B 2 104 ? -3.069 42.158 5.953 1.00 27.62 ? 104 TYR B CZ 1 ATOM 2461 O OH . TYR B 2 104 ? -3.232 43.358 5.300 1.00 23.97 ? 104 TYR B OH 1 ATOM 2462 N N . GLU B 2 105 ? -0.313 35.676 8.736 1.00 17.57 ? 105 GLU B N 1 ATOM 2463 C CA . GLU B 2 105 ? -0.142 34.571 9.675 1.00 21.21 ? 105 GLU B CA 1 ATOM 2464 C C . GLU B 2 105 ? 1.004 34.942 10.614 1.00 30.49 ? 105 GLU B C 1 ATOM 2465 O O . GLU B 2 105 ? 2.151 35.099 10.187 1.00 37.12 ? 105 GLU B O 1 ATOM 2466 C CB . GLU B 2 105 ? 0.082 33.247 8.936 1.00 27.72 ? 105 GLU B CB 1 ATOM 2467 C CG . GLU B 2 105 ? 1.483 32.945 8.401 1.00 34.35 ? 105 GLU B CG 1 ATOM 2468 C CD . GLU B 2 105 ? 1.846 33.749 7.169 1.00 40.74 ? 105 GLU B CD 1 ATOM 2469 O OE1 . GLU B 2 105 ? 1.974 33.147 6.082 1.00 45.76 ? 105 GLU B OE1 1 ATOM 2470 O OE2 . GLU B 2 105 ? 2.010 34.980 7.286 1.00 41.26 ? 105 GLU B OE2 1 ATOM 2471 N N . PHE B 2 106 ? 0.688 35.131 11.893 1.00 29.69 ? 106 PHE B N 1 ATOM 2472 C CA . PHE B 2 106 ? 1.615 35.762 12.831 1.00 20.96 ? 106 PHE B CA 1 ATOM 2473 C C . PHE B 2 106 ? 2.439 34.687 13.529 1.00 19.71 ? 106 PHE B C 1 ATOM 2474 O O . PHE B 2 106 ? 1.968 34.027 14.458 1.00 16.75 ? 106 PHE B O 1 ATOM 2475 C CB . PHE B 2 106 ? 0.850 36.633 13.820 1.00 15.37 ? 106 PHE B CB 1 ATOM 2476 C CG . PHE B 2 106 ? -0.022 37.662 13.158 1.00 21.58 ? 106 PHE B CG 1 ATOM 2477 C CD1 . PHE B 2 106 ? 0.534 38.639 12.348 1.00 25.67 ? 106 PHE B CD1 1 ATOM 2478 C CD2 . PHE B 2 106 ? -1.394 37.650 13.338 1.00 25.42 ? 106 PHE B CD2 1 ATOM 2479 C CE1 . PHE B 2 106 ? -0.263 39.585 11.729 1.00 27.89 ? 106 PHE B CE1 1 ATOM 2480 C CE2 . PHE B 2 106 ? -2.197 38.598 12.723 1.00 29.97 ? 106 PHE B CE2 1 ATOM 2481 C CZ . PHE B 2 106 ? -1.629 39.566 11.918 1.00 29.92 ? 106 PHE B CZ 1 ATOM 2482 N N . ALA B 2 107 ? 3.684 34.518 13.079 1.00 20.48 ? 107 ALA B N 1 ATOM 2483 C CA . ALA B 2 107 ? 4.573 33.501 13.623 1.00 25.39 ? 107 ALA B CA 1 ATOM 2484 C C . ALA B 2 107 ? 5.452 34.013 14.755 1.00 26.79 ? 107 ALA B C 1 ATOM 2485 O O . ALA B 2 107 ? 5.944 33.204 15.550 1.00 33.13 ? 107 ALA B O 1 ATOM 2486 C CB . ALA B 2 107 ? 5.464 32.929 12.515 1.00 22.40 ? 107 ALA B CB 1 ATOM 2487 N N . TYR B 2 108 ? 5.663 35.325 14.847 1.00 23.35 ? 108 TYR B N 1 ATOM 2488 C CA . TYR B 2 108 ? 6.500 35.920 15.881 1.00 22.34 ? 108 TYR B CA 1 ATOM 2489 C C . TYR B 2 108 ? 5.725 37.028 16.577 1.00 22.22 ? 108 TYR B C 1 ATOM 2490 O O . TYR B 2 108 ? 5.207 37.934 15.918 1.00 17.16 ? 108 TYR B O 1 ATOM 2491 C CB . TYR B 2 108 ? 7.798 36.470 15.289 1.00 21.04 ? 108 TYR B CB 1 ATOM 2492 C CG . TYR B 2 108 ? 8.510 35.480 14.403 1.00 23.32 ? 108 TYR B CG 1 ATOM 2493 C CD1 . TYR B 2 108 ? 9.362 34.526 14.943 1.00 26.16 ? 108 TYR B CD1 1 ATOM 2494 C CD2 . TYR B 2 108 ? 8.325 35.491 13.026 1.00 18.74 ? 108 TYR B CD2 1 ATOM 2495 C CE1 . TYR B 2 108 ? 10.014 33.614 14.139 1.00 20.46 ? 108 TYR B CE1 1 ATOM 2496 C CE2 . TYR B 2 108 ? 8.972 34.584 12.214 1.00 23.11 ? 108 TYR B CE2 1 ATOM 2497 C CZ . TYR B 2 108 ? 9.815 33.648 12.775 1.00 26.90 ? 108 TYR B CZ 1 ATOM 2498 O OH . TYR B 2 108 ? 10.461 32.741 11.967 1.00 25.93 ? 108 TYR B OH 1 ATOM 2499 N N . TRP B 2 109 ? 5.654 36.956 17.904 1.00 21.18 ? 109 TRP B N 1 ATOM 2500 C CA . TRP B 2 109 ? 4.904 37.907 18.708 1.00 17.40 ? 109 TRP B CA 1 ATOM 2501 C C . TRP B 2 109 ? 5.813 38.577 19.730 1.00 23.47 ? 109 TRP B C 1 ATOM 2502 O O . TRP B 2 109 ? 6.753 37.968 20.248 1.00 31.13 ? 109 TRP B O 1 ATOM 2503 C CB . TRP B 2 109 ? 3.748 37.225 19.449 1.00 13.94 ? 109 TRP B CB 1 ATOM 2504 C CG . TRP B 2 109 ? 2.657 36.718 18.570 1.00 20.83 ? 109 TRP B CG 1 ATOM 2505 C CD1 . TRP B 2 109 ? 2.728 35.675 17.692 1.00 24.43 ? 109 TRP B CD1 1 ATOM 2506 C CD2 . TRP B 2 109 ? 1.316 37.213 18.499 1.00 18.33 ? 109 TRP B CD2 1 ATOM 2507 N NE1 . TRP B 2 109 ? 1.516 35.499 17.071 1.00 29.50 ? 109 TRP B NE1 1 ATOM 2508 C CE2 . TRP B 2 109 ? 0.632 36.430 17.549 1.00 21.58 ? 109 TRP B CE2 1 ATOM 2509 C CE3 . TRP B 2 109 ? 0.628 38.247 19.143 1.00 13.29 ? 109 TRP B CE3 1 ATOM 2510 C CZ2 . TRP B 2 109 ? -0.706 36.647 17.227 1.00 14.41 ? 109 TRP B CZ2 1 ATOM 2511 C CZ3 . TRP B 2 109 ? -0.701 38.461 18.823 1.00 18.35 ? 109 TRP B CZ3 1 ATOM 2512 C CH2 . TRP B 2 109 ? -1.353 37.665 17.874 1.00 22.45 ? 109 TRP B CH2 1 ATOM 2513 N N . GLY B 2 110 ? 5.518 39.840 20.020 1.00 28.27 ? 110 GLY B N 1 ATOM 2514 C CA . GLY B 2 110 ? 6.090 40.476 21.185 1.00 24.85 ? 110 GLY B CA 1 ATOM 2515 C C . GLY B 2 110 ? 5.540 39.880 22.466 1.00 29.54 ? 110 GLY B C 1 ATOM 2516 O O . GLY B 2 110 ? 4.530 39.172 22.475 1.00 25.32 ? 110 GLY B O 1 ATOM 2517 N N . GLN B 2 111 ? 6.220 40.170 23.576 1.00 25.52 ? 111 GLN B N 1 ATOM 2518 C CA . GLN B 2 111 ? 5.808 39.591 24.850 1.00 20.91 ? 111 GLN B CA 1 ATOM 2519 C C . GLN B 2 111 ? 4.535 40.220 25.399 1.00 21.88 ? 111 GLN B C 1 ATOM 2520 O O . GLN B 2 111 ? 3.983 39.704 26.376 1.00 15.79 ? 111 GLN B O 1 ATOM 2521 C CB . GLN B 2 111 ? 6.937 39.701 25.880 1.00 13.00 ? 111 GLN B CB 1 ATOM 2522 C CG . GLN B 2 111 ? 6.968 40.997 26.675 1.00 12.77 ? 111 GLN B CG 1 ATOM 2523 C CD . GLN B 2 111 ? 7.774 42.091 26.001 1.00 20.08 ? 111 GLN B CD 1 ATOM 2524 O OE1 . GLN B 2 111 ? 7.948 42.094 24.781 1.00 25.95 ? 111 GLN B OE1 1 ATOM 2525 N NE2 . GLN B 2 111 ? 8.277 43.028 26.799 1.00 15.02 ? 111 GLN B NE2 1 ATOM 2526 N N . GLY B 2 112 ? 4.057 41.293 24.798 1.00 23.28 ? 112 GLY B N 1 ATOM 2527 C CA . GLY B 2 112 ? 2.810 41.889 25.239 1.00 17.21 ? 112 GLY B CA 1 ATOM 2528 C C . GLY B 2 112 ? 3.022 42.982 26.263 1.00 20.82 ? 112 GLY B C 1 ATOM 2529 O O . GLY B 2 112 ? 3.927 42.935 27.097 1.00 32.20 ? 112 GLY B O 1 ATOM 2530 N N . THR B 2 113 ? 2.155 43.992 26.196 1.00 13.32 ? 113 THR B N 1 ATOM 2531 C CA . THR B 2 113 ? 2.186 45.122 27.116 1.00 15.45 ? 113 THR B CA 1 ATOM 2532 C C . THR B 2 113 ? 0.786 45.281 27.692 1.00 15.33 ? 113 THR B C 1 ATOM 2533 O O . THR B 2 113 ? -0.147 45.649 26.971 1.00 20.27 ? 113 THR B O 1 ATOM 2534 C CB . THR B 2 113 ? 2.643 46.404 26.414 1.00 25.52 ? 113 THR B CB 1 ATOM 2535 O OG1 . THR B 2 113 ? 3.949 46.210 25.859 1.00 27.40 ? 113 THR B OG1 1 ATOM 2536 C CG2 . THR B 2 113 ? 2.685 47.568 27.396 1.00 16.02 ? 113 THR B CG2 1 ATOM 2537 N N . LEU B 2 114 ? 0.642 45.016 28.989 1.00 18.79 ? 114 LEU B N 1 ATOM 2538 C CA . LEU B 2 114 ? -0.642 45.162 29.668 1.00 17.39 ? 114 LEU B CA 1 ATOM 2539 C C . LEU B 2 114 ? -0.870 46.637 29.975 1.00 19.10 ? 114 LEU B C 1 ATOM 2540 O O . LEU B 2 114 ? -0.153 47.228 30.788 1.00 24.70 ? 114 LEU B O 1 ATOM 2541 C CB . LEU B 2 114 ? -0.680 44.325 30.943 1.00 17.02 ? 114 LEU B CB 1 ATOM 2542 C CG . LEU B 2 114 ? -1.901 44.550 31.838 1.00 28.97 ? 114 LEU B CG 1 ATOM 2543 C CD1 . LEU B 2 114 ? -3.185 44.272 31.072 1.00 39.67 ? 114 LEU B CD1 1 ATOM 2544 C CD2 . LEU B 2 114 ? -1.823 43.686 33.087 1.00 29.08 ? 114 LEU B CD2 1 ATOM 2545 N N . VAL B 2 115 ? -1.867 47.232 29.329 1.00 13.42 ? 115 VAL B N 1 ATOM 2546 C CA . VAL B 2 115 ? -2.208 48.636 29.520 1.00 19.11 ? 115 VAL B CA 1 ATOM 2547 C C . VAL B 2 115 ? -3.504 48.716 30.313 1.00 24.78 ? 115 VAL B C 1 ATOM 2548 O O . VAL B 2 115 ? -4.512 48.107 29.932 1.00 16.63 ? 115 VAL B O 1 ATOM 2549 C CB . VAL B 2 115 ? -2.337 49.372 28.177 1.00 22.12 ? 115 VAL B CB 1 ATOM 2550 C CG1 . VAL B 2 115 ? -2.749 50.816 28.403 1.00 26.65 ? 115 VAL B CG1 1 ATOM 2551 C CG2 . VAL B 2 115 ? -1.026 49.295 27.411 1.00 21.19 ? 115 VAL B CG2 1 ATOM 2552 N N . THR B 2 116 ? -3.475 49.461 31.417 1.00 24.45 ? 116 THR B N 1 ATOM 2553 C CA . THR B 2 116 ? -4.638 49.670 32.270 1.00 16.66 ? 116 THR B CA 1 ATOM 2554 C C . THR B 2 116 ? -5.104 51.111 32.118 1.00 19.15 ? 116 THR B C 1 ATOM 2555 O O . THR B 2 116 ? -4.339 52.044 32.381 1.00 21.39 ? 116 THR B O 1 ATOM 2556 C CB . THR B 2 116 ? -4.312 49.373 33.735 1.00 18.91 ? 116 THR B CB 1 ATOM 2557 O OG1 . THR B 2 116 ? -3.773 48.050 33.856 1.00 13.83 ? 116 THR B OG1 1 ATOM 2558 C CG2 . THR B 2 116 ? -5.565 49.486 34.589 1.00 15.52 ? 116 THR B CG2 1 ATOM 2559 N N . VAL B 2 117 ? -6.351 51.289 31.690 1.00 26.04 ? 117 VAL B N 1 ATOM 2560 C CA . VAL B 2 117 ? -6.965 52.610 31.610 1.00 18.53 ? 117 VAL B CA 1 ATOM 2561 C C . VAL B 2 117 ? -7.703 52.856 32.920 1.00 23.32 ? 117 VAL B C 1 ATOM 2562 O O . VAL B 2 117 ? -8.700 52.191 33.214 1.00 35.85 ? 117 VAL B O 1 ATOM 2563 C CB . VAL B 2 117 ? -7.914 52.724 30.413 1.00 24.32 ? 117 VAL B CB 1 ATOM 2564 C CG1 . VAL B 2 117 ? -8.402 54.161 30.264 1.00 23.92 ? 117 VAL B CG1 1 ATOM 2565 C CG2 . VAL B 2 117 ? -7.232 52.248 29.148 1.00 18.25 ? 117 VAL B CG2 1 ATOM 2566 N N . SER B 2 118 ? -7.217 53.813 33.704 1.00 29.87 ? 118 SER B N 1 ATOM 2567 C CA . SER B 2 118 ? -7.826 54.107 34.992 1.00 36.46 ? 118 SER B CA 1 ATOM 2568 C C . SER B 2 118 ? -7.382 55.488 35.446 1.00 44.29 ? 118 SER B C 1 ATOM 2569 O O . SER B 2 118 ? -6.312 55.970 35.063 1.00 48.24 ? 118 SER B O 1 ATOM 2570 C CB . SER B 2 118 ? -7.456 53.053 36.042 1.00 29.93 ? 118 SER B CB 1 ATOM 2571 O OG . SER B 2 118 ? -8.062 53.335 37.290 1.00 30.99 ? 118 SER B OG 1 ATOM 2572 N N . ALA B 2 119 ? -8.223 56.117 36.262 1.00 44.32 ? 119 ALA B N 1 ATOM 2573 C CA . ALA B 2 119 ? -7.929 57.418 36.842 1.00 48.42 ? 119 ALA B CA 1 ATOM 2574 C C . ALA B 2 119 ? -7.152 57.319 38.147 1.00 47.11 ? 119 ALA B C 1 ATOM 2575 O O . ALA B 2 119 ? -6.792 58.355 38.718 1.00 44.17 ? 119 ALA B O 1 ATOM 2576 C CB . ALA B 2 119 ? -9.228 58.195 37.077 1.00 48.93 ? 119 ALA B CB 1 ATOM 2577 N N . ALA B 2 120 ? -6.879 56.108 38.623 1.00 46.62 ? 120 ALA B N 1 ATOM 2578 C CA . ALA B 2 120 ? -6.235 55.908 39.914 1.00 40.58 ? 120 ALA B CA 1 ATOM 2579 C C . ALA B 2 120 ? -4.762 56.305 39.831 1.00 34.22 ? 120 ALA B C 1 ATOM 2580 O O . ALA B 2 120 ? -4.286 56.862 38.838 1.00 36.24 ? 120 ALA B O 1 ATOM 2581 C CB . ALA B 2 120 ? -6.407 54.463 40.369 1.00 31.49 ? 120 ALA B CB 1 ATOM 2582 N N . SER B 2 121 ? -4.021 56.015 40.895 1.00 34.44 ? 121 SER B N 1 ATOM 2583 C CA . SER B 2 121 ? -2.603 56.326 40.982 1.00 35.42 ? 121 SER B CA 1 ATOM 2584 C C . SER B 2 121 ? -1.779 55.049 40.909 1.00 28.07 ? 121 SER B C 1 ATOM 2585 O O . SER B 2 121 ? -2.225 53.975 41.324 1.00 25.06 ? 121 SER B O 1 ATOM 2586 C CB . SER B 2 121 ? -2.276 57.070 42.281 1.00 30.52 ? 121 SER B CB 1 ATOM 2587 O OG . SER B 2 121 ? -2.896 58.343 42.315 1.00 43.28 ? 121 SER B OG 1 ATOM 2588 N N . THR B 2 122 ? -0.571 55.177 40.371 1.00 27.99 ? 122 THR B N 1 ATOM 2589 C CA . THR B 2 122 ? 0.381 54.076 40.405 1.00 22.84 ? 122 THR B CA 1 ATOM 2590 C C . THR B 2 122 ? 0.950 53.941 41.811 1.00 25.65 ? 122 THR B C 1 ATOM 2591 O O . THR B 2 122 ? 1.379 54.930 42.414 1.00 33.14 ? 122 THR B O 1 ATOM 2592 C CB . THR B 2 122 ? 1.504 54.312 39.397 1.00 33.21 ? 122 THR B CB 1 ATOM 2593 O OG1 . THR B 2 122 ? 0.957 54.371 38.075 1.00 44.57 ? 122 THR B OG1 1 ATOM 2594 C CG2 . THR B 2 122 ? 2.517 53.189 39.464 1.00 37.05 ? 122 THR B CG2 1 ATOM 2595 N N . LYS B 2 123 ? 0.946 52.721 42.340 1.00 27.45 ? 123 LYS B N 1 ATOM 2596 C CA . LYS B 2 123 ? 1.435 52.477 43.691 1.00 29.64 ? 123 LYS B CA 1 ATOM 2597 C C . LYS B 2 123 ? 2.214 51.172 43.724 1.00 24.21 ? 123 LYS B C 1 ATOM 2598 O O . LYS B 2 123 ? 1.731 50.144 43.240 1.00 15.01 ? 123 LYS B O 1 ATOM 2599 C CB . LYS B 2 123 ? 0.279 52.432 44.698 1.00 28.40 ? 123 LYS B CB 1 ATOM 2600 C CG . LYS B 2 123 ? 0.731 52.270 46.138 1.00 34.46 ? 123 LYS B CG 1 ATOM 2601 C CD . LYS B 2 123 ? -0.450 52.225 47.091 1.00 42.60 ? 123 LYS B CD 1 ATOM 2602 C CE . LYS B 2 123 ? 0.009 51.972 48.519 1.00 43.38 ? 123 LYS B CE 1 ATOM 2603 N NZ . LYS B 2 123 ? 0.760 50.690 48.633 1.00 44.67 ? 123 LYS B NZ 1 ATOM 2604 N N . GLY B 2 124 ? 3.415 51.219 44.295 1.00 26.86 ? 124 GLY B N 1 ATOM 2605 C CA . GLY B 2 124 ? 4.252 50.051 44.416 1.00 15.30 ? 124 GLY B CA 1 ATOM 2606 C C . GLY B 2 124 ? 3.822 49.171 45.569 1.00 29.85 ? 124 GLY B C 1 ATOM 2607 O O . GLY B 2 124 ? 3.125 49.609 46.489 1.00 38.56 ? 124 GLY B O 1 ATOM 2608 N N . PRO B 2 125 ? 4.230 47.906 45.540 1.00 24.34 ? 125 PRO B N 1 ATOM 2609 C CA . PRO B 2 125 ? 3.802 46.962 46.573 1.00 16.09 ? 125 PRO B CA 1 ATOM 2610 C C . PRO B 2 125 ? 4.760 46.876 47.748 1.00 17.11 ? 125 PRO B C 1 ATOM 2611 O O . PRO B 2 125 ? 5.965 47.106 47.634 1.00 23.82 ? 125 PRO B O 1 ATOM 2612 C CB . PRO B 2 125 ? 3.779 45.630 45.812 1.00 19.50 ? 125 PRO B CB 1 ATOM 2613 C CG . PRO B 2 125 ? 4.922 45.765 44.858 1.00 15.41 ? 125 PRO B CG 1 ATOM 2614 C CD . PRO B 2 125 ? 4.976 47.233 44.462 1.00 15.51 ? 125 PRO B CD 1 ATOM 2615 N N . SER B 2 126 ? 4.190 46.539 48.899 1.00 13.99 ? 126 SER B N 1 ATOM 2616 C CA . SER B 2 126 ? 4.982 46.039 50.007 1.00 17.01 ? 126 SER B CA 1 ATOM 2617 C C . SER B 2 126 ? 5.172 44.537 49.842 1.00 20.23 ? 126 SER B C 1 ATOM 2618 O O . SER B 2 126 ? 4.295 43.834 49.332 1.00 19.14 ? 126 SER B O 1 ATOM 2619 C CB . SER B 2 126 ? 4.305 46.342 51.344 1.00 16.77 ? 126 SER B CB 1 ATOM 2620 O OG . SER B 2 126 ? 4.080 47.730 51.503 1.00 26.18 ? 126 SER B OG 1 ATOM 2621 N N . VAL B 2 127 ? 6.335 44.047 50.259 1.00 16.34 ? 127 VAL B N 1 ATOM 2622 C CA . VAL B 2 127 ? 6.671 42.633 50.147 1.00 12.45 ? 127 VAL B CA 1 ATOM 2623 C C . VAL B 2 127 ? 6.916 42.092 51.547 1.00 12.54 ? 127 VAL B C 1 ATOM 2624 O O . VAL B 2 127 ? 7.833 42.545 52.244 1.00 21.58 ? 127 VAL B O 1 ATOM 2625 C CB . VAL B 2 127 ? 7.890 42.401 49.244 1.00 18.57 ? 127 VAL B CB 1 ATOM 2626 C CG1 . VAL B 2 127 ? 8.128 40.911 49.061 1.00 22.94 ? 127 VAL B CG1 1 ATOM 2627 C CG2 . VAL B 2 127 ? 7.684 43.076 47.898 1.00 12.74 ? 127 VAL B CG2 1 ATOM 2628 N N . PHE B 2 128 ? 6.101 41.121 51.955 1.00 12.09 ? 128 PHE B N 1 ATOM 2629 C CA . PHE B 2 128 ? 6.211 40.526 53.272 1.00 21.31 ? 128 PHE B CA 1 ATOM 2630 C C . PHE B 2 128 ? 6.506 39.036 53.163 1.00 17.38 ? 128 PHE B C 1 ATOM 2631 O O . PHE B 2 128 ? 6.021 38.373 52.240 1.00 22.65 ? 128 PHE B O 1 ATOM 2632 C CB . PHE B 2 128 ? 4.922 40.741 54.075 1.00 15.38 ? 128 PHE B CB 1 ATOM 2633 C CG . PHE B 2 128 ? 4.535 42.183 54.215 1.00 20.97 ? 128 PHE B CG 1 ATOM 2634 C CD1 . PHE B 2 128 ? 5.326 43.057 54.944 1.00 16.88 ? 128 PHE B CD1 1 ATOM 2635 C CD2 . PHE B 2 128 ? 3.382 42.666 53.618 1.00 20.03 ? 128 PHE B CD2 1 ATOM 2636 C CE1 . PHE B 2 128 ? 4.976 44.389 55.072 1.00 15.52 ? 128 PHE B CE1 1 ATOM 2637 C CE2 . PHE B 2 128 ? 3.023 43.996 53.747 1.00 19.65 ? 128 PHE B CE2 1 ATOM 2638 C CZ . PHE B 2 128 ? 3.821 44.859 54.476 1.00 21.01 ? 128 PHE B CZ 1 ATOM 2639 N N . PRO B 2 129 ? 7.295 38.484 54.080 1.00 17.03 ? 129 PRO B N 1 ATOM 2640 C CA . PRO B 2 129 ? 7.684 37.077 53.970 1.00 15.91 ? 129 PRO B CA 1 ATOM 2641 C C . PRO B 2 129 ? 6.605 36.131 54.471 1.00 15.71 ? 129 PRO B C 1 ATOM 2642 O O . PRO B 2 129 ? 5.872 36.421 55.419 1.00 22.62 ? 129 PRO B O 1 ATOM 2643 C CB . PRO B 2 129 ? 8.933 36.993 54.855 1.00 13.15 ? 129 PRO B CB 1 ATOM 2644 C CG . PRO B 2 129 ? 8.697 38.031 55.899 1.00 13.14 ? 129 PRO B CG 1 ATOM 2645 C CD . PRO B 2 129 ? 7.959 39.155 55.213 1.00 15.73 ? 129 PRO B CD 1 ATOM 2646 N N . LEU B 2 130 ? 6.518 34.984 53.805 1.00 14.23 ? 130 LEU B N 1 ATOM 2647 C CA . LEU B 2 130 ? 5.706 33.854 54.249 1.00 14.76 ? 130 LEU B CA 1 ATOM 2648 C C . LEU B 2 130 ? 6.692 32.801 54.743 1.00 16.65 ? 130 LEU B C 1 ATOM 2649 O O . LEU B 2 130 ? 7.153 31.951 53.978 1.00 17.89 ? 130 LEU B O 1 ATOM 2650 C CB . LEU B 2 130 ? 4.816 33.327 53.131 1.00 16.05 ? 130 LEU B CB 1 ATOM 2651 C CG . LEU B 2 130 ? 3.740 34.293 52.633 1.00 15.66 ? 130 LEU B CG 1 ATOM 2652 C CD1 . LEU B 2 130 ? 3.053 33.733 51.404 1.00 18.56 ? 130 LEU B CD1 1 ATOM 2653 C CD2 . LEU B 2 130 ? 2.735 34.568 53.735 1.00 27.28 ? 130 LEU B CD2 1 ATOM 2654 N N . ALA B 2 131 ? 7.017 32.871 56.034 1.00 15.73 ? 131 ALA B N 1 ATOM 2655 C CA . ALA B 2 131 ? 8.107 32.093 56.606 1.00 20.99 ? 131 ALA B CA 1 ATOM 2656 C C . ALA B 2 131 ? 7.700 30.631 56.777 1.00 25.93 ? 131 ALA B C 1 ATOM 2657 O O . ALA B 2 131 ? 6.567 30.343 57.172 1.00 29.76 ? 131 ALA B O 1 ATOM 2658 C CB . ALA B 2 131 ? 8.524 32.673 57.955 1.00 16.84 ? 131 ALA B CB 1 ATOM 2659 N N . PRO B 2 132 ? 8.602 29.694 56.491 1.00 27.46 ? 132 PRO B N 1 ATOM 2660 C CA . PRO B 2 132 ? 8.316 28.283 56.770 1.00 26.70 ? 132 PRO B CA 1 ATOM 2661 C C . PRO B 2 132 ? 8.398 27.988 58.260 1.00 27.49 ? 132 PRO B C 1 ATOM 2662 O O . PRO B 2 132 ? 8.989 28.737 59.041 1.00 30.62 ? 132 PRO B O 1 ATOM 2663 C CB . PRO B 2 132 ? 9.411 27.540 55.997 1.00 28.52 ? 132 PRO B CB 1 ATOM 2664 C CG . PRO B 2 132 ? 10.545 28.515 55.937 1.00 17.21 ? 132 PRO B CG 1 ATOM 2665 C CD . PRO B 2 132 ? 9.909 29.879 55.834 1.00 26.85 ? 132 PRO B CD 1 ATOM 2666 N N . SER B 2 133 ? 7.789 26.873 58.650 1.00 39.12 ? 133 SER B N 1 ATOM 2667 C CA . SER B 2 133 ? 7.835 26.434 60.043 1.00 45.95 ? 133 SER B CA 1 ATOM 2668 C C . SER B 2 133 ? 7.949 24.916 60.137 1.00 47.03 ? 133 SER B C 1 ATOM 2669 O O . SER B 2 133 ? 7.548 24.315 61.134 1.00 50.78 ? 133 SER B O 1 ATOM 2670 C CB . SER B 2 133 ? 6.598 26.914 60.806 1.00 45.46 ? 133 SER B CB 1 ATOM 2671 O OG . SER B 2 133 ? 5.448 26.170 60.440 1.00 53.47 ? 133 SER B OG 1 ATOM 2672 N N . SER B 2 138 ? 5.728 19.231 56.355 1.00 55.45 ? 138 SER B N 1 ATOM 2673 C CA . SER B 2 138 ? 5.038 18.011 55.951 1.00 63.94 ? 138 SER B CA 1 ATOM 2674 C C . SER B 2 138 ? 5.995 17.021 55.292 1.00 59.77 ? 138 SER B C 1 ATOM 2675 O O . SER B 2 138 ? 6.345 17.172 54.121 1.00 55.50 ? 138 SER B O 1 ATOM 2676 C CB . SER B 2 138 ? 3.882 18.332 54.998 1.00 72.97 ? 138 SER B CB 1 ATOM 2677 O OG . SER B 2 138 ? 2.771 18.873 55.693 1.00 75.22 ? 138 SER B OG 1 ATOM 2678 N N . GLY B 2 139 ? 6.412 16.016 56.055 1.00 59.67 ? 139 GLY B N 1 ATOM 2679 C CA . GLY B 2 139 ? 7.253 14.954 55.521 1.00 59.00 ? 139 GLY B CA 1 ATOM 2680 C C . GLY B 2 139 ? 8.559 15.424 54.918 1.00 59.98 ? 139 GLY B C 1 ATOM 2681 O O . GLY B 2 139 ? 8.944 14.958 53.839 1.00 70.36 ? 139 GLY B O 1 ATOM 2682 N N . GLY B 2 140 ? 9.252 16.341 55.590 1.00 45.90 ? 140 GLY B N 1 ATOM 2683 C CA . GLY B 2 140 ? 10.514 16.843 55.086 1.00 43.03 ? 140 GLY B CA 1 ATOM 2684 C C . GLY B 2 140 ? 10.412 17.848 53.961 1.00 37.96 ? 140 GLY B C 1 ATOM 2685 O O . GLY B 2 140 ? 11.437 18.179 53.355 1.00 33.20 ? 140 GLY B O 1 ATOM 2686 N N . THR B 2 141 ? 9.214 18.344 53.659 1.00 33.20 ? 141 THR B N 1 ATOM 2687 C CA . THR B 2 141 ? 9.006 19.354 52.628 1.00 28.44 ? 141 THR B CA 1 ATOM 2688 C C . THR B 2 141 ? 8.435 20.604 53.279 1.00 22.73 ? 141 THR B C 1 ATOM 2689 O O . THR B 2 141 ? 7.364 20.552 53.893 1.00 26.95 ? 141 THR B O 1 ATOM 2690 C CB . THR B 2 141 ? 8.063 18.848 51.535 1.00 28.96 ? 141 THR B CB 1 ATOM 2691 O OG1 . THR B 2 141 ? 8.648 17.717 50.879 1.00 45.52 ? 141 THR B OG1 1 ATOM 2692 C CG2 . THR B 2 141 ? 7.798 19.944 50.512 1.00 15.96 ? 141 THR B CG2 1 ATOM 2693 N N . ALA B 2 142 ? 9.144 21.720 53.144 1.00 17.06 ? 142 ALA B N 1 ATOM 2694 C CA . ALA B 2 142 ? 8.719 22.995 53.700 1.00 22.05 ? 142 ALA B CA 1 ATOM 2695 C C . ALA B 2 142 ? 8.191 23.904 52.598 1.00 23.32 ? 142 ALA B C 1 ATOM 2696 O O . ALA B 2 142 ? 8.655 23.858 51.454 1.00 26.07 ? 142 ALA B O 1 ATOM 2697 C CB . ALA B 2 142 ? 9.869 23.691 54.434 1.00 15.79 ? 142 ALA B CB 1 ATOM 2698 N N . ALA B 2 143 ? 7.214 24.732 52.953 1.00 14.42 ? 143 ALA B N 1 ATOM 2699 C CA . ALA B 2 143 ? 6.625 25.697 52.036 1.00 17.14 ? 143 ALA B CA 1 ATOM 2700 C C . ALA B 2 143 ? 6.929 27.104 52.529 1.00 16.79 ? 143 ALA B C 1 ATOM 2701 O O . ALA B 2 143 ? 6.744 27.409 53.712 1.00 24.38 ? 143 ALA B O 1 ATOM 2702 C CB . ALA B 2 143 ? 5.112 25.497 51.905 1.00 13.82 ? 143 ALA B CB 1 ATOM 2703 N N . LEU B 2 144 ? 7.400 27.952 51.621 1.00 14.65 ? 144 LEU B N 1 ATOM 2704 C CA . LEU B 2 144 ? 7.692 29.341 51.930 1.00 16.48 ? 144 LEU B CA 1 ATOM 2705 C C . LEU B 2 144 ? 7.260 30.199 50.751 1.00 16.92 ? 144 LEU B C 1 ATOM 2706 O O . LEU B 2 144 ? 7.037 29.700 49.645 1.00 11.85 ? 144 LEU B O 1 ATOM 2707 C CB . LEU B 2 144 ? 9.181 29.551 52.243 1.00 17.06 ? 144 LEU B CB 1 ATOM 2708 C CG . LEU B 2 144 ? 10.170 29.202 51.132 1.00 12.90 ? 144 LEU B CG 1 ATOM 2709 C CD1 . LEU B 2 144 ? 10.665 30.463 50.445 1.00 14.59 ? 144 LEU B CD1 1 ATOM 2710 C CD2 . LEU B 2 144 ? 11.331 28.391 51.680 1.00 15.28 ? 144 LEU B CD2 1 ATOM 2711 N N . GLY B 2 145 ? 7.139 31.495 50.996 1.00 12.17 ? 145 GLY B N 1 ATOM 2712 C CA . GLY B 2 145 ? 6.672 32.369 49.944 1.00 11.43 ? 145 GLY B CA 1 ATOM 2713 C C . GLY B 2 145 ? 6.811 33.828 50.310 1.00 15.64 ? 145 GLY B C 1 ATOM 2714 O O . GLY B 2 145 ? 7.416 34.185 51.324 1.00 11.76 ? 145 GLY B O 1 ATOM 2715 N N . CYS B 2 146 ? 6.235 34.669 49.453 1.00 16.29 ? 146 CYS B N 1 ATOM 2716 C CA . CYS B 2 146 ? 6.258 36.115 49.604 1.00 19.41 ? 146 CYS B CA 1 ATOM 2717 C C . CYS B 2 146 ? 4.859 36.672 49.396 1.00 18.26 ? 146 CYS B C 1 ATOM 2718 O O . CYS B 2 146 ? 4.118 36.208 48.525 1.00 13.88 ? 146 CYS B O 1 ATOM 2719 C CB . CYS B 2 146 ? 7.221 36.766 48.607 1.00 10.96 ? 146 CYS B CB 1 ATOM 2720 S SG . CYS B 2 146 ? 8.947 36.743 49.100 1.00 28.11 ? 146 CYS B SG 1 ATOM 2721 N N . LEU B 2 147 ? 4.505 37.671 50.197 1.00 19.94 ? 147 LEU B N 1 ATOM 2722 C CA . LEU B 2 147 ? 3.227 38.365 50.072 1.00 11.38 ? 147 LEU B CA 1 ATOM 2723 C C . LEU B 2 147 ? 3.475 39.707 49.390 1.00 22.19 ? 147 LEU B C 1 ATOM 2724 O O . LEU B 2 147 ? 4.144 40.580 49.951 1.00 21.80 ? 147 LEU B O 1 ATOM 2725 C CB . LEU B 2 147 ? 2.571 38.548 51.439 1.00 12.27 ? 147 LEU B CB 1 ATOM 2726 C CG . LEU B 2 147 ? 1.242 39.307 51.477 1.00 13.17 ? 147 LEU B CG 1 ATOM 2727 C CD1 . LEU B 2 147 ? 0.154 38.542 50.742 1.00 15.17 ? 147 LEU B CD1 1 ATOM 2728 C CD2 . LEU B 2 147 ? 0.825 39.598 52.911 1.00 13.19 ? 147 LEU B CD2 1 ATOM 2729 N N . VAL B 2 148 ? 2.948 39.861 48.177 1.00 25.16 ? 148 VAL B N 1 ATOM 2730 C CA . VAL B 2 148 ? 3.090 41.080 47.388 1.00 15.33 ? 148 VAL B CA 1 ATOM 2731 C C . VAL B 2 148 ? 1.749 41.802 47.434 1.00 20.36 ? 148 VAL B C 1 ATOM 2732 O O . VAL B 2 148 ? 0.783 41.376 46.790 1.00 27.78 ? 148 VAL B O 1 ATOM 2733 C CB . VAL B 2 148 ? 3.516 40.774 45.947 1.00 17.40 ? 148 VAL B CB 1 ATOM 2734 C CG1 . VAL B 2 148 ? 3.813 42.059 45.190 1.00 16.16 ? 148 VAL B CG1 1 ATOM 2735 C CG2 . VAL B 2 148 ? 4.725 39.850 45.940 1.00 19.99 ? 148 VAL B CG2 1 ATOM 2736 N N . LYS B 2 149 ? 1.688 42.905 48.181 1.00 11.72 ? 149 LYS B N 1 ATOM 2737 C CA . LYS B 2 149 ? 0.422 43.476 48.618 1.00 12.25 ? 149 LYS B CA 1 ATOM 2738 C C . LYS B 2 149 ? 0.318 44.955 48.269 1.00 18.19 ? 149 LYS B C 1 ATOM 2739 O O . LYS B 2 149 ? 1.313 45.685 48.309 1.00 21.53 ? 149 LYS B O 1 ATOM 2740 C CB . LYS B 2 149 ? 0.257 43.292 50.132 1.00 24.44 ? 149 LYS B CB 1 ATOM 2741 C CG . LYS B 2 149 ? -1.143 43.537 50.655 1.00 30.72 ? 149 LYS B CG 1 ATOM 2742 C CD . LYS B 2 149 ? -1.222 43.223 52.139 1.00 31.75 ? 149 LYS B CD 1 ATOM 2743 C CE . LYS B 2 149 ? -2.651 43.302 52.638 1.00 32.94 ? 149 LYS B CE 1 ATOM 2744 N NZ . LYS B 2 149 ? -3.216 44.664 52.454 1.00 28.62 ? 149 LYS B NZ 1 ATOM 2745 N N . ASP B 2 150 ? -0.901 45.380 47.924 1.00 19.82 ? 150 ASP B N 1 ATOM 2746 C CA . ASP B 2 150 ? -1.277 46.793 47.815 1.00 22.99 ? 150 ASP B CA 1 ATOM 2747 C C . ASP B 2 150 ? -0.481 47.512 46.725 1.00 18.85 ? 150 ASP B C 1 ATOM 2748 O O . ASP B 2 150 ? 0.233 48.486 46.976 1.00 25.95 ? 150 ASP B O 1 ATOM 2749 C CB . ASP B 2 150 ? -1.125 47.507 49.163 1.00 18.46 ? 150 ASP B CB 1 ATOM 2750 C CG . ASP B 2 150 ? -2.040 46.940 50.227 1.00 17.83 ? 150 ASP B CG 1 ATOM 2751 O OD1 . ASP B 2 150 ? -3.114 46.414 49.872 1.00 26.54 ? 150 ASP B OD1 1 ATOM 2752 O OD2 . ASP B 2 150 ? -1.683 47.024 51.421 1.00 29.19 ? 150 ASP B OD2 1 ATOM 2753 N N . TYR B 2 151 ? -0.632 47.027 45.495 1.00 19.57 ? 151 TYR B N 1 ATOM 2754 C CA . TYR B 2 151 ? -0.010 47.658 44.341 1.00 24.65 ? 151 TYR B CA 1 ATOM 2755 C C . TYR B 2 151 ? -1.056 47.911 43.266 1.00 28.22 ? 151 TYR B C 1 ATOM 2756 O O . TYR B 2 151 ? -2.154 47.347 43.286 1.00 31.14 ? 151 TYR B O 1 ATOM 2757 C CB . TYR B 2 151 ? 1.135 46.810 43.766 1.00 12.43 ? 151 TYR B CB 1 ATOM 2758 C CG . TYR B 2 151 ? 0.698 45.493 43.166 1.00 12.17 ? 151 TYR B CG 1 ATOM 2759 C CD1 . TYR B 2 151 ? 0.577 44.356 43.953 1.00 11.88 ? 151 TYR B CD1 1 ATOM 2760 C CD2 . TYR B 2 151 ? 0.421 45.383 41.810 1.00 12.38 ? 151 TYR B CD2 1 ATOM 2761 C CE1 . TYR B 2 151 ? 0.184 43.148 43.408 1.00 18.54 ? 151 TYR B CE1 1 ATOM 2762 C CE2 . TYR B 2 151 ? 0.028 44.183 41.257 1.00 15.72 ? 151 TYR B CE2 1 ATOM 2763 C CZ . TYR B 2 151 ? -0.090 43.067 42.063 1.00 20.20 ? 151 TYR B CZ 1 ATOM 2764 O OH . TYR B 2 151 ? -0.479 41.864 41.524 1.00 14.32 ? 151 TYR B OH 1 ATOM 2765 N N . PHE B 2 152 ? -0.690 48.769 42.321 1.00 23.12 ? 152 PHE B N 1 ATOM 2766 C CA . PHE B 2 152 ? -1.555 49.119 41.206 1.00 19.66 ? 152 PHE B CA 1 ATOM 2767 C C . PHE B 2 152 ? -0.756 49.890 40.161 1.00 19.36 ? 152 PHE B C 1 ATOM 2768 O O . PHE B 2 152 ? 0.025 50.776 40.507 1.00 18.24 ? 152 PHE B O 1 ATOM 2769 C CB . PHE B 2 152 ? -2.751 49.948 41.683 1.00 18.74 ? 152 PHE B CB 1 ATOM 2770 C CG . PHE B 2 152 ? -3.797 50.161 40.628 1.00 23.38 ? 152 PHE B CG 1 ATOM 2771 C CD1 . PHE B 2 152 ? -3.728 51.251 39.775 1.00 16.24 ? 152 PHE B CD1 1 ATOM 2772 C CD2 . PHE B 2 152 ? -4.847 49.268 40.487 1.00 18.81 ? 152 PHE B CD2 1 ATOM 2773 C CE1 . PHE B 2 152 ? -4.686 51.448 38.801 1.00 23.64 ? 152 PHE B CE1 1 ATOM 2774 C CE2 . PHE B 2 152 ? -5.813 49.459 39.518 1.00 21.43 ? 152 PHE B CE2 1 ATOM 2775 C CZ . PHE B 2 152 ? -5.732 50.551 38.673 1.00 31.12 ? 152 PHE B CZ 1 ATOM 2776 N N . PRO B 2 153 ? -0.946 49.555 38.877 1.00 16.86 ? 153 PRO B N 1 ATOM 2777 C CA . PRO B 2 153 ? -1.815 48.474 38.409 1.00 14.84 ? 153 PRO B CA 1 ATOM 2778 C C . PRO B 2 153 ? -1.058 47.170 38.208 1.00 19.16 ? 153 PRO B C 1 ATOM 2779 O O . PRO B 2 153 ? 0.136 47.101 38.494 1.00 20.23 ? 153 PRO B O 1 ATOM 2780 C CB . PRO B 2 153 ? -2.320 49.006 37.073 1.00 26.29 ? 153 PRO B CB 1 ATOM 2781 C CG . PRO B 2 153 ? -1.134 49.766 36.544 1.00 25.74 ? 153 PRO B CG 1 ATOM 2782 C CD . PRO B 2 153 ? -0.425 50.353 37.751 1.00 15.36 ? 153 PRO B CD 1 ATOM 2783 N N . GLU B 2 154 ? -1.755 46.149 37.722 1.00 21.16 ? 154 GLU B N 1 ATOM 2784 C CA . GLU B 2 154 ? -1.104 44.944 37.231 1.00 17.64 ? 154 GLU B CA 1 ATOM 2785 C C . GLU B 2 154 ? -0.236 45.336 36.039 1.00 24.15 ? 154 GLU B C 1 ATOM 2786 O O . GLU B 2 154 ? -0.490 46.358 35.404 1.00 27.52 ? 154 GLU B O 1 ATOM 2787 C CB . GLU B 2 154 ? -2.145 43.888 36.842 1.00 25.62 ? 154 GLU B CB 1 ATOM 2788 C CG . GLU B 2 154 ? -2.703 43.100 38.018 1.00 20.67 ? 154 GLU B CG 1 ATOM 2789 C CD . GLU B 2 154 ? -2.068 41.725 38.151 1.00 30.79 ? 154 GLU B CD 1 ATOM 2790 O OE1 . GLU B 2 154 ? -2.686 40.741 37.689 1.00 36.95 ? 154 GLU B OE1 1 ATOM 2791 O OE2 . GLU B 2 154 ? -0.951 41.629 38.705 1.00 18.64 ? 154 GLU B OE2 1 ATOM 2792 N N . PRO B 2 155 ? 0.795 44.536 35.724 1.00 25.29 ? 155 PRO B N 1 ATOM 2793 C CA . PRO B 2 155 ? 1.229 43.296 36.367 1.00 23.59 ? 155 PRO B CA 1 ATOM 2794 C C . PRO B 2 155 ? 2.376 43.490 37.343 1.00 26.57 ? 155 PRO B C 1 ATOM 2795 O O . PRO B 2 155 ? 2.907 44.590 37.490 1.00 35.62 ? 155 PRO B O 1 ATOM 2796 C CB . PRO B 2 155 ? 1.697 42.461 35.181 1.00 15.01 ? 155 PRO B CB 1 ATOM 2797 C CG . PRO B 2 155 ? 2.349 43.488 34.303 1.00 14.90 ? 155 PRO B CG 1 ATOM 2798 C CD . PRO B 2 155 ? 1.555 44.776 34.485 1.00 24.17 ? 155 PRO B CD 1 ATOM 2799 N N . VAL B 2 156 ? 2.754 42.401 38.000 1.00 19.71 ? 156 VAL B N 1 ATOM 2800 C CA . VAL B 2 156 ? 3.976 42.338 38.789 1.00 22.38 ? 156 VAL B CA 1 ATOM 2801 C C . VAL B 2 156 ? 4.614 40.981 38.531 1.00 17.47 ? 156 VAL B C 1 ATOM 2802 O O . VAL B 2 156 ? 3.918 39.965 38.428 1.00 31.80 ? 156 VAL B O 1 ATOM 2803 C CB . VAL B 2 156 ? 3.706 42.566 40.293 1.00 28.60 ? 156 VAL B CB 1 ATOM 2804 C CG1 . VAL B 2 156 ? 2.815 41.475 40.864 1.00 23.83 ? 156 VAL B CG1 1 ATOM 2805 C CG2 . VAL B 2 156 ? 5.014 42.657 41.063 1.00 36.65 ? 156 VAL B CG2 1 ATOM 2806 N N . THR B 2 157 ? 5.931 40.970 38.381 1.00 16.55 ? 157 THR B N 1 ATOM 2807 C CA . THR B 2 157 ? 6.668 39.744 38.120 1.00 18.71 ? 157 THR B CA 1 ATOM 2808 C C . THR B 2 157 ? 7.363 39.278 39.391 1.00 20.37 ? 157 THR B C 1 ATOM 2809 O O . THR B 2 157 ? 7.851 40.090 40.183 1.00 24.52 ? 157 THR B O 1 ATOM 2810 C CB . THR B 2 157 ? 7.695 39.945 37.004 1.00 17.71 ? 157 THR B CB 1 ATOM 2811 O OG1 . THR B 2 157 ? 8.492 41.100 37.291 1.00 31.41 ? 157 THR B OG1 1 ATOM 2812 C CG2 . THR B 2 157 ? 6.994 40.140 35.671 1.00 21.40 ? 157 THR B CG2 1 ATOM 2813 N N . VAL B 2 158 ? 7.392 37.962 39.587 1.00 20.01 ? 158 VAL B N 1 ATOM 2814 C CA . VAL B 2 158 ? 8.028 37.362 40.753 1.00 18.74 ? 158 VAL B CA 1 ATOM 2815 C C . VAL B 2 158 ? 8.853 36.171 40.290 1.00 25.13 ? 158 VAL B C 1 ATOM 2816 O O . VAL B 2 158 ? 8.303 35.200 39.758 1.00 31.27 ? 158 VAL B O 1 ATOM 2817 C CB . VAL B 2 158 ? 7.010 36.917 41.819 1.00 14.55 ? 158 VAL B CB 1 ATOM 2818 C CG1 . VAL B 2 158 ? 7.731 36.211 42.955 1.00 11.01 ? 158 VAL B CG1 1 ATOM 2819 C CG2 . VAL B 2 158 ? 6.222 38.109 42.346 1.00 13.25 ? 158 VAL B CG2 1 ATOM 2820 N N . SER B 2 159 ? 10.164 36.246 40.488 1.00 21.50 ? 159 SER B N 1 ATOM 2821 C CA . SER B 2 159 ? 11.062 35.113 40.334 1.00 21.60 ? 159 SER B CA 1 ATOM 2822 C C . SER B 2 159 ? 11.660 34.761 41.691 1.00 29.99 ? 159 SER B C 1 ATOM 2823 O O . SER B 2 159 ? 11.467 35.467 42.685 1.00 12.33 ? 159 SER B O 1 ATOM 2824 C CB . SER B 2 159 ? 12.167 35.423 39.318 1.00 20.92 ? 159 SER B CB 1 ATOM 2825 O OG . SER B 2 159 ? 12.924 36.549 39.725 1.00 30.11 ? 159 SER B OG 1 ATOM 2826 N N . TRP B 2 160 ? 12.395 33.653 41.725 1.00 27.76 ? 160 TRP B N 1 ATOM 2827 C CA . TRP B 2 160 ? 12.991 33.154 42.957 1.00 24.37 ? 160 TRP B CA 1 ATOM 2828 C C . TRP B 2 160 ? 14.469 32.873 42.736 1.00 14.14 ? 160 TRP B C 1 ATOM 2829 O O . TRP B 2 160 ? 14.836 32.150 41.803 1.00 24.70 ? 160 TRP B O 1 ATOM 2830 C CB . TRP B 2 160 ? 12.268 31.896 43.445 1.00 17.14 ? 160 TRP B CB 1 ATOM 2831 C CG . TRP B 2 160 ? 10.967 32.195 44.126 1.00 23.84 ? 160 TRP B CG 1 ATOM 2832 C CD1 . TRP B 2 160 ? 9.731 32.254 43.550 1.00 11.74 ? 160 TRP B CD1 1 ATOM 2833 C CD2 . TRP B 2 160 ? 10.775 32.481 45.516 1.00 28.72 ? 160 TRP B CD2 1 ATOM 2834 N NE1 . TRP B 2 160 ? 8.782 32.555 44.496 1.00 11.31 ? 160 TRP B NE1 1 ATOM 2835 C CE2 . TRP B 2 160 ? 9.397 32.700 45.711 1.00 19.13 ? 160 TRP B CE2 1 ATOM 2836 C CE3 . TRP B 2 160 ? 11.635 32.569 46.614 1.00 12.18 ? 160 TRP B CE3 1 ATOM 2837 C CZ2 . TRP B 2 160 ? 8.860 33.003 46.962 1.00 19.17 ? 160 TRP B CZ2 1 ATOM 2838 C CZ3 . TRP B 2 160 ? 11.102 32.872 47.852 1.00 24.74 ? 160 TRP B CZ3 1 ATOM 2839 C CH2 . TRP B 2 160 ? 9.727 33.085 48.017 1.00 18.16 ? 160 TRP B CH2 1 ATOM 2840 N N . ASN B 2 161 ? 15.308 33.445 43.603 1.00 14.49 ? 161 ASN B N 1 ATOM 2841 C CA . ASN B 2 161 ? 16.765 33.338 43.497 1.00 15.64 ? 161 ASN B CA 1 ATOM 2842 C C . ASN B 2 161 ? 17.249 33.720 42.101 1.00 20.07 ? 161 ASN B C 1 ATOM 2843 O O . ASN B 2 161 ? 18.072 33.031 41.494 1.00 28.83 ? 161 ASN B O 1 ATOM 2844 C CB . ASN B 2 161 ? 17.247 31.940 43.883 1.00 16.06 ? 161 ASN B CB 1 ATOM 2845 C CG . ASN B 2 161 ? 16.943 31.600 45.329 1.00 15.64 ? 161 ASN B CG 1 ATOM 2846 O OD1 . ASN B 2 161 ? 16.577 32.471 46.118 1.00 27.99 ? 161 ASN B OD1 1 ATOM 2847 N ND2 . ASN B 2 161 ? 17.099 30.330 45.687 1.00 22.67 ? 161 ASN B ND2 1 ATOM 2848 N N . SER B 2 162 ? 16.713 34.827 41.585 1.00 18.37 ? 162 SER B N 1 ATOM 2849 C CA . SER B 2 162 ? 17.163 35.421 40.324 1.00 27.76 ? 162 SER B CA 1 ATOM 2850 C C . SER B 2 162 ? 17.008 34.451 39.155 1.00 30.45 ? 162 SER B C 1 ATOM 2851 O O . SER B 2 162 ? 17.845 34.402 38.251 1.00 35.76 ? 162 SER B O 1 ATOM 2852 C CB . SER B 2 162 ? 18.608 35.912 40.433 1.00 38.07 ? 162 SER B CB 1 ATOM 2853 O OG . SER B 2 162 ? 18.784 36.719 41.585 1.00 39.58 ? 162 SER B OG 1 ATOM 2854 N N . GLY B 2 163 ? 15.927 33.672 39.170 1.00 22.35 ? 163 GLY B N 1 ATOM 2855 C CA . GLY B 2 163 ? 15.645 32.734 38.105 1.00 16.83 ? 163 GLY B CA 1 ATOM 2856 C C . GLY B 2 163 ? 16.174 31.331 38.315 1.00 23.24 ? 163 GLY B C 1 ATOM 2857 O O . GLY B 2 163 ? 15.742 30.411 37.607 1.00 29.11 ? 163 GLY B O 1 ATOM 2858 N N . ALA B 2 164 ? 17.091 31.129 39.263 1.00 22.15 ? 164 ALA B N 1 ATOM 2859 C CA . ALA B 2 164 ? 17.676 29.807 39.455 1.00 18.23 ? 164 ALA B CA 1 ATOM 2860 C C . ALA B 2 164 ? 16.709 28.823 40.100 1.00 32.37 ? 164 ALA B C 1 ATOM 2861 O O . ALA B 2 164 ? 16.934 27.612 40.012 1.00 34.76 ? 164 ALA B O 1 ATOM 2862 C CB . ALA B 2 164 ? 18.943 29.908 40.302 1.00 18.98 ? 164 ALA B CB 1 ATOM 2863 N N . LEU B 2 165 ? 15.649 29.307 40.744 1.00 22.89 ? 165 LEU B N 1 ATOM 2864 C CA . LEU B 2 165 ? 14.691 28.453 41.441 1.00 15.42 ? 165 LEU B CA 1 ATOM 2865 C C . LEU B 2 165 ? 13.335 28.579 40.757 1.00 24.84 ? 165 LEU B C 1 ATOM 2866 O O . LEU B 2 165 ? 12.673 29.618 40.864 1.00 23.85 ? 165 LEU B O 1 ATOM 2867 C CB . LEU B 2 165 ? 14.599 28.824 42.920 1.00 14.82 ? 165 LEU B CB 1 ATOM 2868 C CG . LEU B 2 165 ? 13.591 28.009 43.734 1.00 29.21 ? 165 LEU B CG 1 ATOM 2869 C CD1 . LEU B 2 165 ? 13.898 26.520 43.640 1.00 15.79 ? 165 LEU B CD1 1 ATOM 2870 C CD2 . LEU B 2 165 ? 13.572 28.467 45.181 1.00 31.39 ? 165 LEU B CD2 1 ATOM 2871 N N . THR B 2 166 ? 12.923 27.522 40.057 1.00 26.77 ? 166 THR B N 1 ATOM 2872 C CA . THR B 2 166 ? 11.656 27.522 39.335 1.00 24.40 ? 166 THR B CA 1 ATOM 2873 C C . THR B 2 166 ? 10.819 26.301 39.702 1.00 24.32 ? 166 THR B C 1 ATOM 2874 O O . THR B 2 166 ? 9.586 26.348 39.653 1.00 25.48 ? 166 THR B O 1 ATOM 2875 C CB . THR B 2 166 ? 11.893 27.553 37.822 1.00 23.56 ? 166 THR B CB 1 ATOM 2876 O OG1 . THR B 2 166 ? 12.644 26.397 37.431 1.00 28.32 ? 166 THR B OG1 1 ATOM 2877 C CG2 . THR B 2 166 ? 12.658 28.807 37.422 1.00 21.46 ? 166 THR B CG2 1 ATOM 2878 N N . SER B 2 167 ? 11.482 25.207 40.066 1.00 22.06 ? 167 SER B N 1 ATOM 2879 C CA . SER B 2 167 ? 10.785 23.969 40.392 1.00 21.48 ? 167 SER B CA 1 ATOM 2880 C C . SER B 2 167 ? 9.992 24.140 41.683 1.00 27.48 ? 167 SER B C 1 ATOM 2881 O O . SER B 2 167 ? 10.561 24.455 42.734 1.00 25.96 ? 167 SER B O 1 ATOM 2882 C CB . SER B 2 167 ? 11.790 22.825 40.516 1.00 24.04 ? 167 SER B CB 1 ATOM 2883 O OG . SER B 2 167 ? 11.141 21.581 40.703 1.00 34.96 ? 167 SER B OG 1 ATOM 2884 N N . GLY B 2 168 ? 8.678 23.942 41.604 1.00 26.47 ? 168 GLY B N 1 ATOM 2885 C CA . GLY B 2 168 ? 7.814 24.050 42.761 1.00 14.01 ? 168 GLY B CA 1 ATOM 2886 C C . GLY B 2 168 ? 7.277 25.434 43.045 1.00 20.09 ? 168 GLY B C 1 ATOM 2887 O O . GLY B 2 168 ? 6.732 25.655 44.133 1.00 24.17 ? 168 GLY B O 1 ATOM 2888 N N . VAL B 2 169 ? 7.407 26.368 42.108 1.00 15.19 ? 169 VAL B N 1 ATOM 2889 C CA . VAL B 2 169 ? 7.000 27.753 42.309 1.00 12.57 ? 169 VAL B CA 1 ATOM 2890 C C . VAL B 2 169 ? 5.554 27.928 41.872 1.00 24.32 ? 169 VAL B C 1 ATOM 2891 O O . VAL B 2 169 ? 5.144 27.442 40.813 1.00 29.72 ? 169 VAL B O 1 ATOM 2892 C CB . VAL B 2 169 ? 7.934 28.705 41.542 1.00 12.60 ? 169 VAL B CB 1 ATOM 2893 C CG1 . VAL B 2 169 ? 7.429 30.142 41.620 1.00 12.11 ? 169 VAL B CG1 1 ATOM 2894 C CG2 . VAL B 2 169 ? 9.348 28.598 42.082 1.00 12.77 ? 169 VAL B CG2 1 ATOM 2895 N N . HIS B 2 170 ? 4.771 28.625 42.691 1.00 20.78 ? 170 HIS B N 1 ATOM 2896 C CA . HIS B 2 170 ? 3.386 28.950 42.350 1.00 19.42 ? 170 HIS B CA 1 ATOM 2897 C C . HIS B 2 170 ? 3.159 30.420 42.684 1.00 22.03 ? 170 HIS B C 1 ATOM 2898 O O . HIS B 2 170 ? 3.071 30.790 43.858 1.00 20.98 ? 170 HIS B O 1 ATOM 2899 C CB . HIS B 2 170 ? 2.399 28.054 43.089 1.00 20.54 ? 170 HIS B CB 1 ATOM 2900 C CG . HIS B 2 170 ? 2.412 26.630 42.630 1.00 23.24 ? 170 HIS B CG 1 ATOM 2901 N ND1 . HIS B 2 170 ? 2.324 26.276 41.301 1.00 23.99 ? 170 HIS B ND1 1 ATOM 2902 C CD2 . HIS B 2 170 ? 2.493 25.471 43.325 1.00 21.43 ? 170 HIS B CD2 1 ATOM 2903 C CE1 . HIS B 2 170 ? 2.355 24.959 41.197 1.00 17.30 ? 170 HIS B CE1 1 ATOM 2904 N NE2 . HIS B 2 170 ? 2.455 24.447 42.411 1.00 20.53 ? 170 HIS B NE2 1 ATOM 2905 N N . THR B 2 171 ? 3.083 31.251 41.651 1.00 17.46 ? 171 THR B N 1 ATOM 2906 C CA . THR B 2 171 ? 2.701 32.650 41.787 1.00 21.41 ? 171 THR B CA 1 ATOM 2907 C C . THR B 2 171 ? 1.222 32.754 41.444 1.00 23.81 ? 171 THR B C 1 ATOM 2908 O O . THR B 2 171 ? 0.826 32.519 40.299 1.00 30.61 ? 171 THR B O 1 ATOM 2909 C CB . THR B 2 171 ? 3.548 33.543 40.886 1.00 18.56 ? 171 THR B CB 1 ATOM 2910 O OG1 . THR B 2 171 ? 4.926 33.417 41.258 1.00 24.02 ? 171 THR B OG1 1 ATOM 2911 C CG2 . THR B 2 171 ? 3.122 34.998 41.023 1.00 11.38 ? 171 THR B CG2 1 ATOM 2912 N N . PHE B 2 172 ? 0.413 33.086 42.436 1.00 21.83 ? 172 PHE B N 1 ATOM 2913 C CA . PHE B 2 172 ? -1.026 33.050 42.247 1.00 24.66 ? 172 PHE B CA 1 ATOM 2914 C C . PHE B 2 172 ? -1.509 34.272 41.472 1.00 23.66 ? 172 PHE B C 1 ATOM 2915 O O . PHE B 2 172 ? -0.882 35.334 41.514 1.00 23.98 ? 172 PHE B O 1 ATOM 2916 C CB . PHE B 2 172 ? -1.735 32.976 43.593 1.00 12.71 ? 172 PHE B CB 1 ATOM 2917 C CG . PHE B 2 172 ? -1.573 31.656 44.282 1.00 19.16 ? 172 PHE B CG 1 ATOM 2918 C CD1 . PHE B 2 172 ? -2.381 30.585 43.945 1.00 23.06 ? 172 PHE B CD1 1 ATOM 2919 C CD2 . PHE B 2 172 ? -0.607 31.480 45.258 1.00 13.72 ? 172 PHE B CD2 1 ATOM 2920 C CE1 . PHE B 2 172 ? -2.232 29.366 44.569 1.00 13.90 ? 172 PHE B CE1 1 ATOM 2921 C CE2 . PHE B 2 172 ? -0.456 30.260 45.888 1.00 12.67 ? 172 PHE B CE2 1 ATOM 2922 C CZ . PHE B 2 172 ? -1.269 29.203 45.542 1.00 13.39 ? 172 PHE B CZ 1 ATOM 2923 N N . PRO B 2 173 ? -2.611 34.134 40.738 1.00 17.23 ? 173 PRO B N 1 ATOM 2924 C CA . PRO B 2 173 ? -3.211 35.300 40.084 1.00 13.85 ? 173 PRO B CA 1 ATOM 2925 C C . PRO B 2 173 ? -3.561 36.374 41.102 1.00 31.71 ? 173 PRO B C 1 ATOM 2926 O O . PRO B 2 173 ? -4.026 36.083 42.207 1.00 33.50 ? 173 PRO B O 1 ATOM 2927 C CB . PRO B 2 173 ? -4.465 34.726 39.417 1.00 14.96 ? 173 PRO B CB 1 ATOM 2928 C CG . PRO B 2 173 ? -4.170 33.277 39.243 1.00 15.16 ? 173 PRO B CG 1 ATOM 2929 C CD . PRO B 2 173 ? -3.314 32.883 40.404 1.00 16.30 ? 173 PRO B CD 1 ATOM 2930 N N . ALA B 2 174 ? -3.322 37.625 40.721 1.00 28.07 ? 174 ALA B N 1 ATOM 2931 C CA . ALA B 2 174 ? -3.615 38.745 41.600 1.00 27.17 ? 174 ALA B CA 1 ATOM 2932 C C . ALA B 2 174 ? -5.119 38.888 41.802 1.00 22.40 ? 174 ALA B C 1 ATOM 2933 O O . ALA B 2 174 ? -5.923 38.544 40.933 1.00 23.56 ? 174 ALA B O 1 ATOM 2934 C CB . ALA B 2 174 ? -3.041 40.038 41.025 1.00 29.44 ? 174 ALA B CB 1 ATOM 2935 N N . VAL B 2 175 ? -5.496 39.390 42.972 1.00 14.34 ? 175 VAL B N 1 ATOM 2936 C CA . VAL B 2 175 ? -6.894 39.647 43.285 1.00 21.85 ? 175 VAL B CA 1 ATOM 2937 C C . VAL B 2 175 ? -7.052 41.121 43.625 1.00 25.49 ? 175 VAL B C 1 ATOM 2938 O O . VAL B 2 175 ? -6.145 41.756 44.173 1.00 29.78 ? 175 VAL B O 1 ATOM 2939 C CB . VAL B 2 175 ? -7.415 38.758 44.438 1.00 23.54 ? 175 VAL B CB 1 ATOM 2940 C CG1 . VAL B 2 175 ? -7.121 37.290 44.154 1.00 15.66 ? 175 VAL B CG1 1 ATOM 2941 C CG2 . VAL B 2 175 ? -6.820 39.189 45.770 1.00 30.43 ? 175 VAL B CG2 1 ATOM 2942 N N . LEU B 2 176 ? -8.214 41.664 43.279 1.00 32.37 ? 176 LEU B N 1 ATOM 2943 C CA . LEU B 2 176 ? -8.518 43.068 43.508 1.00 28.26 ? 176 LEU B CA 1 ATOM 2944 C C . LEU B 2 176 ? -9.188 43.211 44.869 1.00 28.58 ? 176 LEU B C 1 ATOM 2945 O O . LEU B 2 176 ? -10.267 42.654 45.099 1.00 41.39 ? 176 LEU B O 1 ATOM 2946 C CB . LEU B 2 176 ? -9.415 43.604 42.394 1.00 26.73 ? 176 LEU B CB 1 ATOM 2947 C CG . LEU B 2 176 ? -9.582 45.120 42.296 1.00 30.01 ? 176 LEU B CG 1 ATOM 2948 C CD1 . LEU B 2 176 ? -8.244 45.783 42.010 1.00 27.91 ? 176 LEU B CD1 1 ATOM 2949 C CD2 . LEU B 2 176 ? -10.597 45.467 41.222 1.00 19.43 ? 176 LEU B CD2 1 ATOM 2950 N N . GLN B 2 177 ? -8.544 43.947 45.770 1.00 26.32 ? 177 GLN B N 1 ATOM 2951 C CA . GLN B 2 177 ? -9.090 44.177 47.096 1.00 25.74 ? 177 GLN B CA 1 ATOM 2952 C C . GLN B 2 177 ? -10.108 45.316 47.063 1.00 25.20 ? 177 GLN B C 1 ATOM 2953 O O . GLN B 2 177 ? -10.230 46.052 46.082 1.00 20.78 ? 177 GLN B O 1 ATOM 2954 C CB . GLN B 2 177 ? -7.969 44.494 48.086 1.00 23.13 ? 177 GLN B CB 1 ATOM 2955 C CG . GLN B 2 177 ? -6.879 43.439 48.154 1.00 16.09 ? 177 GLN B CG 1 ATOM 2956 C CD . GLN B 2 177 ? -5.659 43.913 48.920 1.00 29.17 ? 177 GLN B CD 1 ATOM 2957 O OE1 . GLN B 2 177 ? -5.468 43.569 50.088 1.00 33.19 ? 177 GLN B OE1 1 ATOM 2958 N NE2 . GLN B 2 177 ? -4.824 44.709 48.264 1.00 37.23 ? 177 GLN B NE2 1 ATOM 2959 N N . SER B 2 178 ? -10.844 45.461 48.169 1.00 36.63 ? 178 SER B N 1 ATOM 2960 C CA . SER B 2 178 ? -11.846 46.519 48.257 1.00 34.80 ? 178 SER B CA 1 ATOM 2961 C C . SER B 2 178 ? -11.222 47.900 48.097 1.00 32.73 ? 178 SER B C 1 ATOM 2962 O O . SER B 2 178 ? -11.899 48.843 47.670 1.00 31.73 ? 178 SER B O 1 ATOM 2963 C CB . SER B 2 178 ? -12.594 46.425 49.588 1.00 35.32 ? 178 SER B CB 1 ATOM 2964 O OG . SER B 2 178 ? -11.707 46.542 50.688 1.00 34.85 ? 178 SER B OG 1 ATOM 2965 N N . SER B 2 179 ? -9.936 48.035 48.424 1.00 19.93 ? 179 SER B N 1 ATOM 2966 C CA . SER B 2 179 ? -9.232 49.303 48.286 1.00 19.62 ? 179 SER B CA 1 ATOM 2967 C C . SER B 2 179 ? -8.978 49.688 46.836 1.00 25.53 ? 179 SER B C 1 ATOM 2968 O O . SER B 2 179 ? -8.591 50.833 46.577 1.00 29.72 ? 179 SER B O 1 ATOM 2969 C CB . SER B 2 179 ? -7.900 49.234 49.028 1.00 18.68 ? 179 SER B CB 1 ATOM 2970 O OG . SER B 2 179 ? -7.101 48.185 48.508 1.00 17.50 ? 179 SER B OG 1 ATOM 2971 N N . GLY B 2 180 ? -9.182 48.776 45.892 1.00 18.83 ? 180 GLY B N 1 ATOM 2972 C CA . GLY B 2 180 ? -8.800 49.014 44.521 1.00 18.41 ? 180 GLY B CA 1 ATOM 2973 C C . GLY B 2 180 ? -7.357 48.691 44.209 1.00 28.88 ? 180 GLY B C 1 ATOM 2974 O O . GLY B 2 180 ? -6.905 48.965 43.091 1.00 33.91 ? 180 GLY B O 1 ATOM 2975 N N . LEU B 2 181 ? -6.621 48.125 45.159 1.00 18.53 ? 181 LEU B N 1 ATOM 2976 C CA . LEU B 2 181 ? -5.242 47.716 44.956 1.00 15.34 ? 181 LEU B CA 1 ATOM 2977 C C . LEU B 2 181 ? -5.171 46.199 44.855 1.00 17.86 ? 181 LEU B C 1 ATOM 2978 O O . LEU B 2 181 ? -5.974 45.483 45.460 1.00 18.01 ? 181 LEU B O 1 ATOM 2979 C CB . LEU B 2 181 ? -4.349 48.216 46.096 1.00 29.66 ? 181 LEU B CB 1 ATOM 2980 C CG . LEU B 2 181 ? -4.404 49.724 46.360 1.00 24.33 ? 181 LEU B CG 1 ATOM 2981 C CD1 . LEU B 2 181 ? -3.512 50.099 47.527 1.00 15.63 ? 181 LEU B CD1 1 ATOM 2982 C CD2 . LEU B 2 181 ? -4.010 50.502 45.118 1.00 20.19 ? 181 LEU B CD2 1 ATOM 2983 N N . TYR B 2 182 ? -4.212 45.713 44.075 1.00 19.29 ? 182 TYR B N 1 ATOM 2984 C CA . TYR B 2 182 ? -4.057 44.281 43.872 1.00 17.40 ? 182 TYR B CA 1 ATOM 2985 C C . TYR B 2 182 ? -3.174 43.670 44.954 1.00 18.90 ? 182 TYR B C 1 ATOM 2986 O O . TYR B 2 182 ? -2.412 44.356 45.638 1.00 23.83 ? 182 TYR B O 1 ATOM 2987 C CB . TYR B 2 182 ? -3.466 43.987 42.494 1.00 13.48 ? 182 TYR B CB 1 ATOM 2988 C CG . TYR B 2 182 ? -4.432 44.210 41.356 1.00 19.91 ? 182 TYR B CG 1 ATOM 2989 C CD1 . TYR B 2 182 ? -5.389 43.255 41.037 1.00 17.11 ? 182 TYR B CD1 1 ATOM 2990 C CD2 . TYR B 2 182 ? -4.384 45.370 40.597 1.00 21.97 ? 182 TYR B CD2 1 ATOM 2991 C CE1 . TYR B 2 182 ? -6.275 43.452 39.998 1.00 15.65 ? 182 TYR B CE1 1 ATOM 2992 C CE2 . TYR B 2 182 ? -5.264 45.576 39.554 1.00 33.04 ? 182 TYR B CE2 1 ATOM 2993 C CZ . TYR B 2 182 ? -6.208 44.615 39.259 1.00 32.58 ? 182 TYR B CZ 1 ATOM 2994 O OH . TYR B 2 182 ? -7.087 44.821 38.220 1.00 32.39 ? 182 TYR B OH 1 ATOM 2995 N N . SER B 2 183 ? -3.286 42.353 45.094 1.00 24.55 ? 183 SER B N 1 ATOM 2996 C CA . SER B 2 183 ? -2.479 41.603 46.043 1.00 24.68 ? 183 SER B CA 1 ATOM 2997 C C . SER B 2 183 ? -2.373 40.165 45.561 1.00 22.58 ? 183 SER B C 1 ATOM 2998 O O . SER B 2 183 ? -3.336 39.612 45.020 1.00 28.82 ? 183 SER B O 1 ATOM 2999 C CB . SER B 2 183 ? -3.079 41.656 47.452 1.00 22.60 ? 183 SER B CB 1 ATOM 3000 O OG . SER B 2 183 ? -2.284 40.931 48.372 1.00 27.76 ? 183 SER B OG 1 ATOM 3001 N N . LEU B 2 184 ? -1.197 39.570 45.745 1.00 18.36 ? 184 LEU B N 1 ATOM 3002 C CA . LEU B 2 184 ? -0.986 38.178 45.381 1.00 19.35 ? 184 LEU B CA 1 ATOM 3003 C C . LEU B 2 184 ? 0.092 37.590 46.277 1.00 24.47 ? 184 LEU B C 1 ATOM 3004 O O . LEU B 2 184 ? 0.787 38.302 47.008 1.00 24.61 ? 184 LEU B O 1 ATOM 3005 C CB . LEU B 2 184 ? -0.607 38.023 43.900 1.00 15.91 ? 184 LEU B CB 1 ATOM 3006 C CG . LEU B 2 184 ? 0.736 38.523 43.350 1.00 19.77 ? 184 LEU B CG 1 ATOM 3007 C CD1 . LEU B 2 184 ? 1.880 37.541 43.588 1.00 10.90 ? 184 LEU B CD1 1 ATOM 3008 C CD2 . LEU B 2 184 ? 0.604 38.811 41.862 1.00 25.14 ? 184 LEU B CD2 1 ATOM 3009 N N . SER B 2 185 ? 0.224 36.270 46.206 1.00 27.19 ? 185 SER B N 1 ATOM 3010 C CA . SER B 2 185 ? 1.298 35.555 46.871 1.00 30.13 ? 185 SER B CA 1 ATOM 3011 C C . SER B 2 185 ? 2.017 34.679 45.859 1.00 32.74 ? 185 SER B C 1 ATOM 3012 O O . SER B 2 185 ? 1.425 34.208 44.884 1.00 38.29 ? 185 SER B O 1 ATOM 3013 C CB . SER B 2 185 ? 0.784 34.697 48.037 1.00 24.09 ? 185 SER B CB 1 ATOM 3014 O OG . SER B 2 185 ? 0.400 35.506 49.134 1.00 32.60 ? 185 SER B OG 1 ATOM 3015 N N . SER B 2 186 ? 3.310 34.484 46.097 1.00 24.38 ? 186 SER B N 1 ATOM 3016 C CA . SER B 2 186 ? 4.131 33.562 45.324 1.00 15.44 ? 186 SER B CA 1 ATOM 3017 C C . SER B 2 186 ? 4.787 32.613 46.311 1.00 14.75 ? 186 SER B C 1 ATOM 3018 O O . SER B 2 186 ? 5.479 33.060 47.230 1.00 25.60 ? 186 SER B O 1 ATOM 3019 C CB . SER B 2 186 ? 5.181 34.310 44.499 1.00 11.52 ? 186 SER B CB 1 ATOM 3020 O OG . SER B 2 186 ? 5.957 33.421 43.718 1.00 10.88 ? 186 SER B OG 1 ATOM 3021 N N . VAL B 2 187 ? 4.551 31.315 46.140 1.00 17.11 ? 187 VAL B N 1 ATOM 3022 C CA . VAL B 2 187 ? 5.027 30.314 47.085 1.00 13.72 ? 187 VAL B CA 1 ATOM 3023 C C . VAL B 2 187 ? 5.919 29.318 46.356 1.00 17.73 ? 187 VAL B C 1 ATOM 3024 O O . VAL B 2 187 ? 5.930 29.232 45.126 1.00 20.49 ? 187 VAL B O 1 ATOM 3025 C CB . VAL B 2 187 ? 3.867 29.582 47.794 1.00 11.70 ? 187 VAL B CB 1 ATOM 3026 C CG1 . VAL B 2 187 ? 2.984 30.575 48.539 1.00 11.71 ? 187 VAL B CG1 1 ATOM 3027 C CG2 . VAL B 2 187 ? 3.050 28.782 46.792 1.00 13.68 ? 187 VAL B CG2 1 ATOM 3028 N N . VAL B 2 188 ? 6.678 28.562 47.146 1.00 11.78 ? 188 VAL B N 1 ATOM 3029 C CA . VAL B 2 188 ? 7.553 27.516 46.633 1.00 14.51 ? 188 VAL B CA 1 ATOM 3030 C C . VAL B 2 188 ? 7.741 26.488 47.738 1.00 18.92 ? 188 VAL B C 1 ATOM 3031 O O . VAL B 2 188 ? 7.664 26.809 48.928 1.00 24.93 ? 188 VAL B O 1 ATOM 3032 C CB . VAL B 2 188 ? 8.912 28.081 46.150 1.00 20.08 ? 188 VAL B CB 1 ATOM 3033 C CG1 . VAL B 2 188 ? 9.726 28.613 47.323 1.00 15.99 ? 188 VAL B CG1 1 ATOM 3034 C CG2 . VAL B 2 188 ? 9.698 27.030 45.374 1.00 25.50 ? 188 VAL B CG2 1 ATOM 3035 N N . THR B 2 189 ? 7.966 25.241 47.339 1.00 13.01 ? 189 THR B N 1 ATOM 3036 C CA . THR B 2 189 ? 8.225 24.153 48.270 1.00 20.62 ? 189 THR B CA 1 ATOM 3037 C C . THR B 2 189 ? 9.657 23.670 48.085 1.00 13.97 ? 189 THR B C 1 ATOM 3038 O O . THR B 2 189 ? 10.110 23.471 46.954 1.00 23.91 ? 189 THR B O 1 ATOM 3039 C CB . THR B 2 189 ? 7.232 23.008 48.067 1.00 22.16 ? 189 THR B CB 1 ATOM 3040 O OG1 . THR B 2 189 ? 7.037 22.786 46.663 1.00 31.13 ? 189 THR B OG1 1 ATOM 3041 C CG2 . THR B 2 189 ? 5.896 23.351 48.709 1.00 13.90 ? 189 THR B CG2 1 ATOM 3042 N N . VAL B 2 190 ? 10.371 23.510 49.194 1.00 17.19 ? 190 VAL B N 1 ATOM 3043 C CA . VAL B 2 190 ? 11.778 23.118 49.177 1.00 17.69 ? 190 VAL B CA 1 ATOM 3044 C C . VAL B 2 190 ? 11.984 22.016 50.209 1.00 23.28 ? 190 VAL B C 1 ATOM 3045 O O . VAL B 2 190 ? 11.099 21.785 51.047 1.00 25.39 ? 190 VAL B O 1 ATOM 3046 C CB . VAL B 2 190 ? 12.696 24.320 49.462 1.00 17.70 ? 190 VAL B CB 1 ATOM 3047 C CG1 . VAL B 2 190 ? 12.506 25.408 48.411 1.00 14.24 ? 190 VAL B CG1 1 ATOM 3048 C CG2 . VAL B 2 190 ? 12.436 24.864 50.860 1.00 17.08 ? 190 VAL B CG2 1 ATOM 3049 N N . PRO B 2 191 ? 13.108 21.300 50.184 1.00 24.42 ? 191 PRO B N 1 ATOM 3050 C CA . PRO B 2 191 ? 13.404 20.373 51.282 1.00 28.28 ? 191 PRO B CA 1 ATOM 3051 C C . PRO B 2 191 ? 13.675 21.130 52.573 1.00 26.57 ? 191 PRO B C 1 ATOM 3052 O O . PRO B 2 191 ? 14.299 22.193 52.570 1.00 25.34 ? 191 PRO B O 1 ATOM 3053 C CB . PRO B 2 191 ? 14.652 19.628 50.794 1.00 26.04 ? 191 PRO B CB 1 ATOM 3054 C CG . PRO B 2 191 ? 14.642 19.789 49.315 1.00 18.95 ? 191 PRO B CG 1 ATOM 3055 C CD . PRO B 2 191 ? 14.051 21.142 49.063 1.00 16.79 ? 191 PRO B CD 1 ATOM 3056 N N . SER B 2 192 ? 13.196 20.567 53.686 1.00 28.90 ? 192 SER B N 1 ATOM 3057 C CA . SER B 2 192 ? 13.414 21.198 54.985 1.00 26.82 ? 192 SER B CA 1 ATOM 3058 C C . SER B 2 192 ? 14.901 21.326 55.293 1.00 26.31 ? 192 SER B C 1 ATOM 3059 O O . SER B 2 192 ? 15.340 22.332 55.863 1.00 24.77 ? 192 SER B O 1 ATOM 3060 C CB . SER B 2 192 ? 12.711 20.400 56.084 1.00 32.86 ? 192 SER B CB 1 ATOM 3061 O OG . SER B 2 192 ? 11.335 20.225 55.796 1.00 45.95 ? 192 SER B OG 1 ATOM 3062 N N . SER B 2 193 ? 15.693 20.319 54.916 1.00 19.77 ? 193 SER B N 1 ATOM 3063 C CA . SER B 2 193 ? 17.116 20.321 55.241 1.00 26.94 ? 193 SER B CA 1 ATOM 3064 C C . SER B 2 193 ? 17.876 21.442 54.545 1.00 29.47 ? 193 SER B C 1 ATOM 3065 O O . SER B 2 193 ? 18.964 21.811 55.000 1.00 43.48 ? 193 SER B O 1 ATOM 3066 C CB . SER B 2 193 ? 17.742 18.969 54.886 1.00 23.04 ? 193 SER B CB 1 ATOM 3067 O OG . SER B 2 193 ? 17.548 18.648 53.518 1.00 27.54 ? 193 SER B OG 1 ATOM 3068 N N . SER B 2 194 ? 17.332 21.995 53.462 1.00 19.98 ? 194 SER B N 1 ATOM 3069 C CA . SER B 2 194 ? 18.002 23.076 52.753 1.00 23.62 ? 194 SER B CA 1 ATOM 3070 C C . SER B 2 194 ? 17.723 24.446 53.357 1.00 26.72 ? 194 SER B C 1 ATOM 3071 O O . SER B 2 194 ? 18.371 25.420 52.962 1.00 19.79 ? 194 SER B O 1 ATOM 3072 C CB . SER B 2 194 ? 17.591 23.074 51.278 1.00 31.57 ? 194 SER B CB 1 ATOM 3073 O OG . SER B 2 194 ? 16.215 23.381 51.132 1.00 40.28 ? 194 SER B OG 1 ATOM 3074 N N . LEU B 2 195 ? 16.789 24.544 54.307 1.00 31.51 ? 195 LEU B N 1 ATOM 3075 C CA . LEU B 2 195 ? 16.483 25.832 54.919 1.00 24.50 ? 195 LEU B CA 1 ATOM 3076 C C . LEU B 2 195 ? 17.662 26.403 55.693 1.00 26.53 ? 195 LEU B C 1 ATOM 3077 O O . LEU B 2 195 ? 17.687 27.609 55.957 1.00 29.53 ? 195 LEU B O 1 ATOM 3078 C CB . LEU B 2 195 ? 15.271 25.703 55.844 1.00 18.57 ? 195 LEU B CB 1 ATOM 3079 C CG . LEU B 2 195 ? 13.928 25.456 55.157 1.00 22.91 ? 195 LEU B CG 1 ATOM 3080 C CD1 . LEU B 2 195 ? 12.834 25.247 56.188 1.00 20.63 ? 195 LEU B CD1 1 ATOM 3081 C CD2 . LEU B 2 195 ? 13.586 26.614 54.230 1.00 16.64 ? 195 LEU B CD2 1 ATOM 3082 N N . GLY B 2 196 ? 18.636 25.573 56.058 1.00 38.86 ? 196 GLY B N 1 ATOM 3083 C CA . GLY B 2 196 ? 19.802 26.054 56.769 1.00 46.21 ? 196 GLY B CA 1 ATOM 3084 C C . GLY B 2 196 ? 20.933 26.489 55.859 1.00 50.59 ? 196 GLY B C 1 ATOM 3085 O O . GLY B 2 196 ? 21.640 27.454 56.161 1.00 49.96 ? 196 GLY B O 1 ATOM 3086 N N . THR B 2 197 ? 21.109 25.794 54.736 1.00 53.69 ? 197 THR B N 1 ATOM 3087 C CA . THR B 2 197 ? 22.241 26.048 53.853 1.00 50.17 ? 197 THR B CA 1 ATOM 3088 C C . THR B 2 197 ? 21.905 26.952 52.676 1.00 38.81 ? 197 THR B C 1 ATOM 3089 O O . THR B 2 197 ? 22.799 27.624 52.153 1.00 44.60 ? 197 THR B O 1 ATOM 3090 C CB . THR B 2 197 ? 22.804 24.725 53.320 1.00 56.07 ? 197 THR B CB 1 ATOM 3091 O OG1 . THR B 2 197 ? 21.950 24.217 52.286 1.00 65.23 ? 197 THR B OG1 1 ATOM 3092 C CG2 . THR B 2 197 ? 22.884 23.703 54.441 1.00 52.68 ? 197 THR B CG2 1 ATOM 3093 N N . GLN B 2 198 ? 20.647 26.990 52.248 1.00 32.20 ? 198 GLN B N 1 ATOM 3094 C CA . GLN B 2 198 ? 20.238 27.763 51.084 1.00 22.06 ? 198 GLN B CA 1 ATOM 3095 C C . GLN B 2 198 ? 19.525 29.040 51.510 1.00 27.27 ? 198 GLN B C 1 ATOM 3096 O O . GLN B 2 198 ? 18.765 29.047 52.483 1.00 33.86 ? 198 GLN B O 1 ATOM 3097 C CB . GLN B 2 198 ? 19.317 26.940 50.179 1.00 22.94 ? 198 GLN B CB 1 ATOM 3098 C CG . GLN B 2 198 ? 19.977 25.721 49.561 1.00 52.97 ? 198 GLN B CG 1 ATOM 3099 C CD . GLN B 2 198 ? 21.096 26.087 48.606 1.00 54.21 ? 198 GLN B CD 1 ATOM 3100 O OE1 . GLN B 2 198 ? 20.887 26.821 47.638 1.00 49.90 ? 198 GLN B OE1 1 ATOM 3101 N NE2 . GLN B 2 198 ? 22.295 25.581 48.878 1.00 51.76 ? 198 GLN B NE2 1 ATOM 3102 N N . THR B 2 199 ? 19.779 30.119 50.777 1.00 23.27 ? 199 THR B N 1 ATOM 3103 C CA . THR B 2 199 ? 19.014 31.350 50.914 1.00 26.17 ? 199 THR B CA 1 ATOM 3104 C C . THR B 2 199 ? 17.909 31.367 49.867 1.00 23.97 ? 199 THR B C 1 ATOM 3105 O O . THR B 2 199 ? 18.105 30.917 48.734 1.00 28.61 ? 199 THR B O 1 ATOM 3106 C CB . THR B 2 199 ? 19.900 32.587 50.747 1.00 24.66 ? 199 THR B CB 1 ATOM 3107 O OG1 . THR B 2 199 ? 20.327 32.692 49.381 1.00 21.50 ? 199 THR B OG1 1 ATOM 3108 C CG2 . THR B 2 199 ? 21.118 32.497 51.652 1.00 28.65 ? 199 THR B CG2 1 ATOM 3109 N N . TYR B 2 200 ? 16.748 31.891 50.250 1.00 24.08 ? 200 TYR B N 1 ATOM 3110 C CA . TYR B 2 200 ? 15.586 31.940 49.369 1.00 17.02 ? 200 TYR B CA 1 ATOM 3111 C C . TYR B 2 200 ? 15.100 33.380 49.275 1.00 15.83 ? 200 TYR B C 1 ATOM 3112 O O . TYR B 2 200 ? 14.556 33.923 50.243 1.00 18.31 ? 200 TYR B O 1 ATOM 3113 C CB . TYR B 2 200 ? 14.488 31.004 49.870 1.00 17.90 ? 200 TYR B CB 1 ATOM 3114 C CG . TYR B 2 200 ? 14.888 29.550 49.773 1.00 23.33 ? 200 TYR B CG 1 ATOM 3115 C CD1 . TYR B 2 200 ? 14.900 28.899 48.549 1.00 20.54 ? 200 TYR B CD1 1 ATOM 3116 C CD2 . TYR B 2 200 ? 15.275 28.836 50.899 1.00 28.95 ? 200 TYR B CD2 1 ATOM 3117 C CE1 . TYR B 2 200 ? 15.273 27.576 48.446 1.00 23.66 ? 200 TYR B CE1 1 ATOM 3118 C CE2 . TYR B 2 200 ? 15.650 27.506 50.807 1.00 26.61 ? 200 TYR B CE2 1 ATOM 3119 C CZ . TYR B 2 200 ? 15.645 26.883 49.576 1.00 23.11 ? 200 TYR B CZ 1 ATOM 3120 O OH . TYR B 2 200 ? 16.013 25.562 49.469 1.00 25.20 ? 200 TYR B OH 1 ATOM 3121 N N . ILE B 2 201 ? 15.305 33.992 48.112 1.00 18.95 ? 201 ILE B N 1 ATOM 3122 C CA . ILE B 2 201 ? 14.951 35.382 47.858 1.00 14.83 ? 201 ILE B CA 1 ATOM 3123 C C . ILE B 2 201 ? 13.911 35.416 46.750 1.00 18.89 ? 201 ILE B C 1 ATOM 3124 O O . ILE B 2 201 ? 14.106 34.800 45.696 1.00 28.65 ? 201 ILE B O 1 ATOM 3125 C CB . ILE B 2 201 ? 16.183 36.214 47.459 1.00 15.12 ? 201 ILE B CB 1 ATOM 3126 C CG1 . ILE B 2 201 ? 17.144 36.364 48.639 1.00 16.11 ? 201 ILE B CG1 1 ATOM 3127 C CG2 . ILE B 2 201 ? 15.756 37.566 46.909 1.00 14.78 ? 201 ILE B CG2 1 ATOM 3128 C CD1 . ILE B 2 201 ? 18.331 37.256 48.343 1.00 16.11 ? 201 ILE B CD1 1 ATOM 3129 N N . CYS B 2 202 ? 12.815 36.133 46.983 1.00 22.68 ? 202 CYS B N 1 ATOM 3130 C CA . CYS B 2 202 ? 11.839 36.403 45.936 1.00 23.90 ? 202 CYS B CA 1 ATOM 3131 C C . CYS B 2 202 ? 12.166 37.756 45.314 1.00 20.80 ? 202 CYS B C 1 ATOM 3132 O O . CYS B 2 202 ? 12.293 38.760 46.024 1.00 26.14 ? 202 CYS B O 1 ATOM 3133 C CB . CYS B 2 202 ? 10.404 36.366 46.471 1.00 14.27 ? 202 CYS B CB 1 ATOM 3134 S SG . CYS B 2 202 ? 9.910 37.695 47.590 1.00 28.06 ? 202 CYS B SG 1 ATOM 3135 N N . ASN B 2 203 ? 12.333 37.773 43.998 1.00 16.98 ? 203 ASN B N 1 ATOM 3136 C CA . ASN B 2 203 ? 12.666 38.986 43.258 1.00 15.12 ? 203 ASN B CA 1 ATOM 3137 C C . ASN B 2 203 ? 11.370 39.563 42.703 1.00 28.69 ? 203 ASN B C 1 ATOM 3138 O O . ASN B 2 203 ? 10.825 39.062 41.716 1.00 32.25 ? 203 ASN B O 1 ATOM 3139 C CB . ASN B 2 203 ? 13.667 38.682 42.150 1.00 16.64 ? 203 ASN B CB 1 ATOM 3140 C CG . ASN B 2 203 ? 14.752 37.723 42.596 1.00 17.07 ? 203 ASN B CG 1 ATOM 3141 O OD1 . ASN B 2 203 ? 14.787 36.568 42.175 1.00 17.92 ? 203 ASN B OD1 1 ATOM 3142 N ND2 . ASN B 2 203 ? 15.637 38.194 43.468 1.00 24.39 ? 203 ASN B ND2 1 ATOM 3143 N N . VAL B 2 204 ? 10.875 40.614 43.349 1.00 14.16 ? 204 VAL B N 1 ATOM 3144 C CA . VAL B 2 204 ? 9.638 41.279 42.957 1.00 14.06 ? 204 VAL B CA 1 ATOM 3145 C C . VAL B 2 204 ? 9.989 42.522 42.153 1.00 19.28 ? 204 VAL B C 1 ATOM 3146 O O . VAL B 2 204 ? 10.879 43.291 42.539 1.00 31.12 ? 204 VAL B O 1 ATOM 3147 C CB . VAL B 2 204 ? 8.786 41.641 44.186 1.00 18.88 ? 204 VAL B CB 1 ATOM 3148 C CG1 . VAL B 2 204 ? 7.457 42.241 43.755 1.00 13.35 ? 204 VAL B CG1 1 ATOM 3149 C CG2 . VAL B 2 204 ? 8.569 40.415 45.059 1.00 14.83 ? 204 VAL B CG2 1 ATOM 3150 N N . ASN B 2 205 ? 9.300 42.719 41.031 1.00 15.46 ? 205 ASN B N 1 ATOM 3151 C CA . ASN B 2 205 ? 9.478 43.914 40.216 1.00 22.27 ? 205 ASN B CA 1 ATOM 3152 C C . ASN B 2 205 ? 8.121 44.370 39.710 1.00 20.45 ? 205 ASN B C 1 ATOM 3153 O O . ASN B 2 205 ? 7.475 43.662 38.931 1.00 18.08 ? 205 ASN B O 1 ATOM 3154 C CB . ASN B 2 205 ? 10.424 43.661 39.040 1.00 31.86 ? 205 ASN B CB 1 ATOM 3155 C CG . ASN B 2 205 ? 10.733 44.927 38.268 1.00 34.48 ? 205 ASN B CG 1 ATOM 3156 O OD1 . ASN B 2 205 ? 10.569 46.035 38.781 1.00 38.65 ? 205 ASN B OD1 1 ATOM 3157 N ND2 . ASN B 2 205 ? 11.179 44.772 37.029 1.00 36.53 ? 205 ASN B ND2 1 ATOM 3158 N N . HIS B 2 206 ? 7.693 45.545 40.153 1.00 22.05 ? 206 HIS B N 1 ATOM 3159 C CA . HIS B 2 206 ? 6.462 46.178 39.693 1.00 20.28 ? 206 HIS B CA 1 ATOM 3160 C C . HIS B 2 206 ? 6.886 47.317 38.769 1.00 18.06 ? 206 HIS B C 1 ATOM 3161 O O . HIS B 2 206 ? 7.106 48.446 39.210 1.00 19.06 ? 206 HIS B O 1 ATOM 3162 C CB . HIS B 2 206 ? 5.622 46.667 40.872 1.00 16.89 ? 206 HIS B CB 1 ATOM 3163 C CG . HIS B 2 206 ? 4.326 47.301 40.475 1.00 20.60 ? 206 HIS B CG 1 ATOM 3164 N ND1 . HIS B 2 206 ? 4.022 48.614 40.765 1.00 17.69 ? 206 HIS B ND1 1 ATOM 3165 C CD2 . HIS B 2 206 ? 3.254 46.804 39.815 1.00 23.50 ? 206 HIS B CD2 1 ATOM 3166 C CE1 . HIS B 2 206 ? 2.819 48.898 40.301 1.00 16.79 ? 206 HIS B CE1 1 ATOM 3167 N NE2 . HIS B 2 206 ? 2.331 47.817 39.719 1.00 21.96 ? 206 HIS B NE2 1 ATOM 3168 N N . LYS B 2 207 ? 7.013 47.001 37.482 1.00 20.72 ? 207 LYS B N 1 ATOM 3169 C CA . LYS B 2 207 ? 7.518 47.980 36.522 1.00 26.79 ? 207 LYS B CA 1 ATOM 3170 C C . LYS B 2 207 ? 6.689 49.259 36.431 1.00 27.31 ? 207 LYS B C 1 ATOM 3171 O O . LYS B 2 207 ? 7.296 50.332 36.261 1.00 24.45 ? 207 LYS B O 1 ATOM 3172 C CB . LYS B 2 207 ? 7.657 47.321 35.144 1.00 31.48 ? 207 LYS B CB 1 ATOM 3173 C CG . LYS B 2 207 ? 8.863 46.397 35.031 1.00 42.31 ? 207 LYS B CG 1 ATOM 3174 C CD . LYS B 2 207 ? 8.940 45.722 33.670 1.00 46.90 ? 207 LYS B CD 1 ATOM 3175 C CE . LYS B 2 207 ? 10.204 44.881 33.545 1.00 51.12 ? 207 LYS B CE 1 ATOM 3176 N NZ . LYS B 2 207 ? 10.228 44.089 32.284 1.00 57.06 ? 207 LYS B NZ 1 ATOM 3177 N N . PRO B 2 208 ? 5.351 49.241 36.518 1.00 26.45 ? 208 PRO B N 1 ATOM 3178 C CA . PRO B 2 208 ? 4.611 50.514 36.442 1.00 25.04 ? 208 PRO B CA 1 ATOM 3179 C C . PRO B 2 208 ? 5.024 51.542 37.487 1.00 26.53 ? 208 PRO B C 1 ATOM 3180 O O . PRO B 2 208 ? 4.848 52.746 37.258 1.00 22.94 ? 208 PRO B O 1 ATOM 3181 C CB . PRO B 2 208 ? 3.153 50.076 36.631 1.00 20.88 ? 208 PRO B CB 1 ATOM 3182 C CG . PRO B 2 208 ? 3.114 48.705 36.103 1.00 20.88 ? 208 PRO B CG 1 ATOM 3183 C CD . PRO B 2 208 ? 4.428 48.089 36.484 1.00 23.55 ? 208 PRO B CD 1 ATOM 3184 N N . SER B 2 209 ? 5.542 51.112 38.635 1.00 26.22 ? 209 SER B N 1 ATOM 3185 C CA . SER B 2 209 ? 5.991 52.024 39.677 1.00 26.39 ? 209 SER B CA 1 ATOM 3186 C C . SER B 2 209 ? 7.503 52.060 39.806 1.00 41.66 ? 209 SER B C 1 ATOM 3187 O O . SER B 2 209 ? 8.018 52.783 40.667 1.00 36.92 ? 209 SER B O 1 ATOM 3188 C CB . SER B 2 209 ? 5.376 51.639 41.027 1.00 25.61 ? 209 SER B CB 1 ATOM 3189 O OG . SER B 2 209 ? 5.801 50.348 41.428 1.00 19.62 ? 209 SER B OG 1 ATOM 3190 N N . ASN B 2 210 ? 8.220 51.298 38.973 1.00 46.29 ? 210 ASN B N 1 ATOM 3191 C CA . ASN B 2 210 ? 9.675 51.176 39.052 1.00 41.56 ? 210 ASN B CA 1 ATOM 3192 C C . ASN B 2 210 ? 10.101 50.759 40.457 1.00 33.25 ? 210 ASN B C 1 ATOM 3193 O O . ASN B 2 210 ? 11.105 51.228 40.996 1.00 26.35 ? 210 ASN B O 1 ATOM 3194 C CB . ASN B 2 210 ? 10.361 52.473 38.611 1.00 47.25 ? 210 ASN B CB 1 ATOM 3195 C CG . ASN B 2 210 ? 10.353 52.659 37.090 1.00 56.49 ? 210 ASN B CG 1 ATOM 3196 O OD1 . ASN B 2 210 ? 10.777 51.776 36.343 1.00 56.97 ? 210 ASN B OD1 1 ATOM 3197 N ND2 . ASN B 2 210 ? 9.870 53.812 36.633 1.00 61.96 ? 210 ASN B ND2 1 ATOM 3198 N N . THR B 2 211 ? 9.314 49.870 41.057 1.00 36.65 ? 211 THR B N 1 ATOM 3199 C CA . THR B 2 211 ? 9.569 49.349 42.393 1.00 35.06 ? 211 THR B CA 1 ATOM 3200 C C . THR B 2 211 ? 10.164 47.955 42.262 1.00 34.75 ? 211 THR B C 1 ATOM 3201 O O . THR B 2 211 ? 9.521 47.046 41.725 1.00 24.64 ? 211 THR B O 1 ATOM 3202 C CB . THR B 2 211 ? 8.291 49.311 43.229 1.00 27.95 ? 211 THR B CB 1 ATOM 3203 O OG1 . THR B 2 211 ? 7.806 50.647 43.418 1.00 30.59 ? 211 THR B OG1 1 ATOM 3204 C CG2 . THR B 2 211 ? 8.563 48.671 44.581 1.00 21.30 ? 211 THR B CG2 1 ATOM 3205 N N . LYS B 2 212 ? 11.388 47.793 42.755 1.00 43.10 ? 212 LYS B N 1 ATOM 3206 C CA . LYS B 2 212 ? 12.138 46.550 42.617 1.00 31.23 ? 212 LYS B CA 1 ATOM 3207 C C . LYS B 2 212 ? 12.605 46.136 44.006 1.00 24.50 ? 212 LYS B C 1 ATOM 3208 O O . LYS B 2 212 ? 13.418 46.833 44.621 1.00 19.43 ? 212 LYS B O 1 ATOM 3209 C CB . LYS B 2 212 ? 13.317 46.739 41.664 1.00 29.53 ? 212 LYS B CB 1 ATOM 3210 C CG . LYS B 2 212 ? 13.687 45.516 40.852 1.00 36.19 ? 212 LYS B CG 1 ATOM 3211 C CD . LYS B 2 212 ? 14.788 45.859 39.860 1.00 36.38 ? 212 LYS B CD 1 ATOM 3212 C CE . LYS B 2 212 ? 15.409 44.612 39.262 1.00 37.63 ? 212 LYS B CE 1 ATOM 3213 N NZ . LYS B 2 212 ? 16.582 44.950 38.412 1.00 41.78 ? 212 LYS B NZ 1 ATOM 3214 N N . VAL B 2 213 ? 12.084 45.018 44.509 1.00 15.17 ? 213 VAL B N 1 ATOM 3215 C CA . VAL B 2 213 ? 12.359 44.569 45.869 1.00 17.06 ? 213 VAL B CA 1 ATOM 3216 C C . VAL B 2 213 ? 12.831 43.122 45.838 1.00 19.54 ? 213 VAL B C 1 ATOM 3217 O O . VAL B 2 213 ? 12.267 42.288 45.121 1.00 16.14 ? 213 VAL B O 1 ATOM 3218 C CB . VAL B 2 213 ? 11.117 44.708 46.777 1.00 22.51 ? 213 VAL B CB 1 ATOM 3219 C CG1 . VAL B 2 213 ? 11.450 44.300 48.205 1.00 22.01 ? 213 VAL B CG1 1 ATOM 3220 C CG2 . VAL B 2 213 ? 10.581 46.129 46.741 1.00 23.83 ? 213 VAL B CG2 1 ATOM 3221 N N . ASP B 2 214 ? 13.868 42.828 46.619 1.00 26.11 ? 214 ASP B N 1 ATOM 3222 C CA . ASP B 2 214 ? 14.309 41.464 46.886 1.00 22.19 ? 214 ASP B CA 1 ATOM 3223 C C . ASP B 2 214 ? 14.060 41.168 48.358 1.00 24.74 ? 214 ASP B C 1 ATOM 3224 O O . ASP B 2 214 ? 14.587 41.865 49.231 1.00 32.23 ? 214 ASP B O 1 ATOM 3225 C CB . ASP B 2 214 ? 15.785 41.275 46.539 1.00 15.31 ? 214 ASP B CB 1 ATOM 3226 C CG . ASP B 2 214 ? 16.035 41.268 45.044 1.00 25.65 ? 214 ASP B CG 1 ATOM 3227 O OD1 . ASP B 2 214 ? 15.128 40.859 44.291 1.00 21.07 ? 214 ASP B OD1 1 ATOM 3228 O OD2 . ASP B 2 214 ? 17.138 41.670 44.618 1.00 30.51 ? 214 ASP B OD2 1 ATOM 3229 N N . LYS B 2 215 ? 13.255 40.147 48.630 1.00 13.25 ? 215 LYS B N 1 ATOM 3230 C CA . LYS B 2 215 ? 12.878 39.790 49.990 1.00 13.31 ? 215 LYS B CA 1 ATOM 3231 C C . LYS B 2 215 ? 13.500 38.451 50.351 1.00 18.13 ? 215 LYS B C 1 ATOM 3232 O O . LYS B 2 215 ? 13.213 37.434 49.710 1.00 15.91 ? 215 LYS B O 1 ATOM 3233 C CB . LYS B 2 215 ? 11.359 39.728 50.145 1.00 17.26 ? 215 LYS B CB 1 ATOM 3234 C CG . LYS B 2 215 ? 10.900 39.543 51.587 1.00 13.80 ? 215 LYS B CG 1 ATOM 3235 C CD . LYS B 2 215 ? 11.186 40.789 52.412 1.00 15.90 ? 215 LYS B CD 1 ATOM 3236 C CE . LYS B 2 215 ? 11.357 40.461 53.881 1.00 24.59 ? 215 LYS B CE 1 ATOM 3237 N NZ . LYS B 2 215 ? 11.683 41.680 54.671 1.00 27.44 ? 215 LYS B NZ 1 ATOM 3238 N N . ARG B 2 216 ? 14.351 38.458 51.373 1.00 14.11 ? 216 ARG B N 1 ATOM 3239 C CA . ARG B 2 216 ? 14.878 37.229 51.947 1.00 19.43 ? 216 ARG B CA 1 ATOM 3240 C C . ARG B 2 216 ? 13.830 36.608 52.861 1.00 18.63 ? 216 ARG B C 1 ATOM 3241 O O . ARG B 2 216 ? 13.255 37.290 53.713 1.00 23.49 ? 216 ARG B O 1 ATOM 3242 C CB . ARG B 2 216 ? 16.160 37.519 52.724 1.00 23.82 ? 216 ARG B CB 1 ATOM 3243 C CG . ARG B 2 216 ? 16.670 36.357 53.548 1.00 29.89 ? 216 ARG B CG 1 ATOM 3244 C CD . ARG B 2 216 ? 17.278 35.281 52.673 1.00 31.01 ? 216 ARG B CD 1 ATOM 3245 N NE . ARG B 2 216 ? 17.929 34.256 53.481 1.00 41.09 ? 216 ARG B NE 1 ATOM 3246 C CZ . ARG B 2 216 ? 19.175 34.344 53.936 1.00 40.78 ? 216 ARG B CZ 1 ATOM 3247 N NH1 . ARG B 2 216 ? 19.910 35.413 53.657 1.00 38.89 ? 216 ARG B NH1 1 ATOM 3248 N NH2 . ARG B 2 216 ? 19.686 33.364 54.667 1.00 40.21 ? 216 ARG B NH2 1 ATOM 3249 N N . VAL B 2 217 ? 13.575 35.318 52.680 1.00 15.42 ? 217 VAL B N 1 ATOM 3250 C CA . VAL B 2 217 ? 12.560 34.604 53.446 1.00 25.91 ? 217 VAL B CA 1 ATOM 3251 C C . VAL B 2 217 ? 13.267 33.569 54.311 1.00 26.51 ? 217 VAL B C 1 ATOM 3252 O O . VAL B 2 217 ? 13.833 32.597 53.797 1.00 27.33 ? 217 VAL B O 1 ATOM 3253 C CB . VAL B 2 217 ? 11.514 33.950 52.536 1.00 18.98 ? 217 VAL B CB 1 ATOM 3254 C CG1 . VAL B 2 217 ? 10.516 33.164 53.368 1.00 18.37 ? 217 VAL B CG1 1 ATOM 3255 C CG2 . VAL B 2 217 ? 10.803 35.007 51.704 1.00 15.70 ? 217 VAL B CG2 1 ATOM 3256 N N . GLU B 2 218 ? 13.229 33.770 55.621 1.00 27.33 ? 218 GLU B N 1 ATOM 3257 C CA . GLU B 2 218 ? 13.867 32.893 56.588 1.00 28.00 ? 218 GLU B CA 1 ATOM 3258 C C . GLU B 2 218 ? 12.838 32.200 57.463 1.00 22.84 ? 218 GLU B C 1 ATOM 3259 O O . GLU B 2 218 ? 11.666 32.592 57.494 1.00 24.22 ? 218 GLU B O 1 ATOM 3260 C CB . GLU B 2 218 ? 14.831 33.686 57.483 1.00 30.86 ? 218 GLU B CB 1 ATOM 3261 C CG . GLU B 2 218 ? 16.208 33.908 56.892 1.00 41.93 ? 218 GLU B CG 1 ATOM 3262 C CD . GLU B 2 218 ? 16.985 34.968 57.644 1.00 56.55 ? 218 GLU B CD 1 ATOM 3263 O OE1 . GLU B 2 218 ? 18.169 35.191 57.312 1.00 68.31 ? 218 GLU B OE1 1 ATOM 3264 O OE2 . GLU B 2 218 ? 16.408 35.582 58.566 1.00 53.96 ? 218 GLU B OE2 1 ATOM 3265 N N . PRO B 2 219 ? 13.232 31.148 58.179 1.00 28.47 ? 219 PRO B N 1 ATOM 3266 C CA . PRO B 2 219 ? 12.389 30.645 59.268 1.00 28.91 ? 219 PRO B CA 1 ATOM 3267 C C . PRO B 2 219 ? 12.398 31.623 60.433 1.00 38.73 ? 219 PRO B C 1 ATOM 3268 O O . PRO B 2 219 ? 13.445 32.161 60.803 1.00 39.01 ? 219 PRO B O 1 ATOM 3269 C CB . PRO B 2 219 ? 13.044 29.312 59.650 1.00 29.12 ? 219 PRO B CB 1 ATOM 3270 C CG . PRO B 2 219 ? 13.888 28.942 58.465 1.00 25.97 ? 219 PRO B CG 1 ATOM 3271 C CD . PRO B 2 219 ? 14.353 30.239 57.886 1.00 30.50 ? 219 PRO B CD 1 ATOM 3272 N N . LYS B 2 220 ? 11.220 31.853 61.006 1.00 49.38 ? 220 LYS B N 1 ATOM 3273 C CA . LYS B 2 220 ? 11.057 32.870 62.044 1.00 52.10 ? 220 LYS B CA 1 ATOM 3274 C C . LYS B 2 220 ? 11.830 32.525 63.315 1.00 48.85 ? 220 LYS B C 1 ATOM 3275 O O . LYS B 2 220 ? 11.555 31.520 63.969 1.00 55.34 ? 220 LYS B O 1 ATOM 3276 C CB . LYS B 2 220 ? 9.573 33.062 62.369 1.00 57.84 ? 220 LYS B CB 1 ATOM 3277 C CG . LYS B 2 220 ? 9.264 34.301 63.200 1.00 61.21 ? 220 LYS B CG 1 ATOM 3278 C CD . LYS B 2 220 ? 7.775 34.629 63.159 1.00 60.50 ? 220 LYS B CD 1 ATOM 3279 C CE . LYS B 2 220 ? 7.444 35.874 63.972 1.00 61.72 ? 220 LYS B CE 1 ATOM 3280 N NZ . LYS B 2 220 ? 7.549 35.642 65.442 1.00 63.97 ? 220 LYS B NZ 1 ATOM 3281 N N . ASP C 1 1 ? -14.324 -0.289 5.754 1.00 58.50 ? 1 ASP C N 1 ATOM 3282 C CA . ASP C 1 1 ? -15.529 0.420 6.171 1.00 57.87 ? 1 ASP C CA 1 ATOM 3283 C C . ASP C 1 1 ? -15.276 1.911 6.365 1.00 53.37 ? 1 ASP C C 1 ATOM 3284 O O . ASP C 1 1 ? -14.141 2.340 6.575 1.00 62.74 ? 1 ASP C O 1 ATOM 3285 C CB . ASP C 1 1 ? -16.082 -0.178 7.468 1.00 58.01 ? 1 ASP C CB 1 ATOM 3286 C CG . ASP C 1 1 ? -16.881 -1.444 7.235 1.00 57.33 ? 1 ASP C CG 1 ATOM 3287 O OD1 . ASP C 1 1 ? -16.737 -2.055 6.155 1.00 55.44 ? 1 ASP C OD1 1 ATOM 3288 O OD2 . ASP C 1 1 ? -17.653 -1.830 8.139 1.00 58.00 ? 1 ASP C OD2 1 ATOM 3289 N N . ILE C 1 2 ? -16.347 2.695 6.293 1.00 39.95 ? 2 ILE C N 1 ATOM 3290 C CA . ILE C 1 2 ? -16.273 4.123 6.576 1.00 32.96 ? 2 ILE C CA 1 ATOM 3291 C C . ILE C 1 2 ? -16.228 4.319 8.084 1.00 33.89 ? 2 ILE C C 1 ATOM 3292 O O . ILE C 1 2 ? -17.096 3.824 8.813 1.00 32.94 ? 2 ILE C O 1 ATOM 3293 C CB . ILE C 1 2 ? -17.473 4.863 5.963 1.00 28.50 ? 2 ILE C CB 1 ATOM 3294 C CG1 . ILE C 1 2 ? -17.662 4.465 4.502 1.00 37.30 ? 2 ILE C CG1 1 ATOM 3295 C CG2 . ILE C 1 2 ? -17.286 6.369 6.073 1.00 27.65 ? 2 ILE C CG2 1 ATOM 3296 C CD1 . ILE C 1 2 ? -16.565 4.953 3.598 1.00 36.18 ? 2 ILE C CD1 1 ATOM 3297 N N . LEU C 1 3 ? -15.217 5.036 8.559 1.00 34.13 ? 3 LEU C N 1 ATOM 3298 C CA . LEU C 1 3 ? -15.121 5.389 9.967 1.00 35.06 ? 3 LEU C CA 1 ATOM 3299 C C . LEU C 1 3 ? -15.655 6.802 10.166 1.00 33.27 ? 3 LEU C C 1 ATOM 3300 O O . LEU C 1 3 ? -15.291 7.720 9.423 1.00 36.14 ? 3 LEU C O 1 ATOM 3301 C CB . LEU C 1 3 ? -13.680 5.288 10.468 1.00 41.11 ? 3 LEU C CB 1 ATOM 3302 C CG . LEU C 1 3 ? -13.504 5.507 11.974 1.00 44.89 ? 3 LEU C CG 1 ATOM 3303 C CD1 . LEU C 1 3 ? -14.250 4.441 12.772 1.00 39.03 ? 3 LEU C CD1 1 ATOM 3304 C CD2 . LEU C 1 3 ? -12.030 5.536 12.352 1.00 47.93 ? 3 LEU C CD2 1 ATOM 3305 N N . LEU C 1 4 ? -16.527 6.967 11.156 1.00 35.48 ? 4 LEU C N 1 ATOM 3306 C CA . LEU C 1 4 ? -17.136 8.253 11.469 1.00 36.08 ? 4 LEU C CA 1 ATOM 3307 C C . LEU C 1 4 ? -16.563 8.760 12.784 1.00 35.92 ? 4 LEU C C 1 ATOM 3308 O O . LEU C 1 4 ? -16.719 8.111 13.825 1.00 36.79 ? 4 LEU C O 1 ATOM 3309 C CB . LEU C 1 4 ? -18.658 8.134 11.554 1.00 29.64 ? 4 LEU C CB 1 ATOM 3310 C CG . LEU C 1 4 ? -19.371 7.728 10.264 1.00 30.40 ? 4 LEU C CG 1 ATOM 3311 C CD1 . LEU C 1 4 ? -20.881 7.703 10.456 1.00 25.24 ? 4 LEU C CD1 1 ATOM 3312 C CD2 . LEU C 1 4 ? -18.986 8.668 9.138 1.00 24.67 ? 4 LEU C CD2 1 ATOM 3313 N N . THR C 1 5 ? -15.904 9.913 12.736 1.00 21.17 ? 5 THR C N 1 ATOM 3314 C CA . THR C 1 5 ? -15.307 10.525 13.916 1.00 30.54 ? 5 THR C CA 1 ATOM 3315 C C . THR C 1 5 ? -16.211 11.660 14.383 1.00 31.68 ? 5 THR C C 1 ATOM 3316 O O . THR C 1 5 ? -16.316 12.694 13.714 1.00 27.70 ? 5 THR C O 1 ATOM 3317 C CB . THR C 1 5 ? -13.898 11.030 13.616 1.00 32.65 ? 5 THR C CB 1 ATOM 3318 O OG1 . THR C 1 5 ? -13.101 9.949 13.117 1.00 22.43 ? 5 THR C OG1 1 ATOM 3319 C CG2 . THR C 1 5 ? -13.251 11.582 14.877 1.00 28.21 ? 5 THR C CG2 1 ATOM 3320 N N . GLN C 1 6 ? -16.865 11.464 15.525 1.00 29.20 ? 6 GLN C N 1 ATOM 3321 C CA . GLN C 1 6 ? -17.691 12.502 16.125 1.00 31.15 ? 6 GLN C CA 1 ATOM 3322 C C . GLN C 1 6 ? -16.899 13.249 17.189 1.00 29.74 ? 6 GLN C C 1 ATOM 3323 O O . GLN C 1 6 ? -16.130 12.650 17.946 1.00 35.72 ? 6 GLN C O 1 ATOM 3324 C CB . GLN C 1 6 ? -18.961 11.911 16.741 1.00 19.53 ? 6 GLN C CB 1 ATOM 3325 C CG . GLN C 1 6 ? -19.900 11.270 15.737 1.00 19.99 ? 6 GLN C CG 1 ATOM 3326 C CD . GLN C 1 6 ? -21.265 10.968 16.324 1.00 30.18 ? 6 GLN C CD 1 ATOM 3327 O OE1 . GLN C 1 6 ? -21.733 9.829 16.289 1.00 21.29 ? 6 GLN C OE1 1 ATOM 3328 N NE2 . GLN C 1 6 ? -21.915 11.992 16.866 1.00 32.45 ? 6 GLN C NE2 1 ATOM 3329 N N . SER C 1 7 ? -17.089 14.562 17.236 1.00 24.42 ? 7 SER C N 1 ATOM 3330 C CA . SER C 1 7 ? -16.418 15.403 18.218 1.00 25.74 ? 7 SER C CA 1 ATOM 3331 C C . SER C 1 7 ? -17.313 16.587 18.576 1.00 29.25 ? 7 SER C C 1 ATOM 3332 O O . SER C 1 7 ? -18.058 17.079 17.731 1.00 35.88 ? 7 SER C O 1 ATOM 3333 C CB . SER C 1 7 ? -15.068 15.888 17.684 1.00 22.88 ? 7 SER C CB 1 ATOM 3334 O OG . SER C 1 7 ? -15.240 16.841 16.651 1.00 27.48 ? 7 SER C OG 1 ATOM 3335 N N . PRO C 1 8 ? -17.261 17.037 19.839 1.00 33.00 ? 8 PRO C N 1 ATOM 3336 C CA . PRO C 1 8 ? -16.431 16.461 20.899 1.00 31.05 ? 8 PRO C CA 1 ATOM 3337 C C . PRO C 1 8 ? -17.099 15.246 21.522 1.00 22.66 ? 8 PRO C C 1 ATOM 3338 O O . PRO C 1 8 ? -18.263 14.981 21.232 1.00 24.86 ? 8 PRO C O 1 ATOM 3339 C CB . PRO C 1 8 ? -16.324 17.603 21.905 1.00 23.45 ? 8 PRO C CB 1 ATOM 3340 C CG . PRO C 1 8 ? -17.643 18.290 21.791 1.00 22.52 ? 8 PRO C CG 1 ATOM 3341 C CD . PRO C 1 8 ? -18.076 18.159 20.341 1.00 28.90 ? 8 PRO C CD 1 ATOM 3342 N N . VAL C 1 9 ? -16.370 14.513 22.361 1.00 27.98 ? 9 VAL C N 1 ATOM 3343 C CA . VAL C 1 9 ? -16.970 13.377 23.050 1.00 34.22 ? 9 VAL C CA 1 ATOM 3344 C C . VAL C 1 9 ? -18.034 13.859 24.029 1.00 34.49 ? 9 VAL C C 1 ATOM 3345 O O . VAL C 1 9 ? -19.188 13.418 23.988 1.00 36.73 ? 9 VAL C O 1 ATOM 3346 C CB . VAL C 1 9 ? -15.886 12.545 23.754 1.00 33.33 ? 9 VAL C CB 1 ATOM 3347 C CG1 . VAL C 1 9 ? -16.472 11.243 24.258 1.00 40.15 ? 9 VAL C CG1 1 ATOM 3348 C CG2 . VAL C 1 9 ? -14.723 12.292 22.809 1.00 34.41 ? 9 VAL C CG2 1 ATOM 3349 N N . ILE C 1 10 ? -17.662 14.776 24.918 1.00 31.10 ? 10 ILE C N 1 ATOM 3350 C CA . ILE C 1 10 ? -18.592 15.424 25.832 1.00 29.87 ? 10 ILE C CA 1 ATOM 3351 C C . ILE C 1 10 ? -18.747 16.870 25.388 1.00 35.65 ? 10 ILE C C 1 ATOM 3352 O O . ILE C 1 10 ? -17.769 17.518 25.001 1.00 39.63 ? 10 ILE C O 1 ATOM 3353 C CB . ILE C 1 10 ? -18.106 15.342 27.292 1.00 25.16 ? 10 ILE C CB 1 ATOM 3354 C CG1 . ILE C 1 10 ? -17.690 13.913 27.632 1.00 32.05 ? 10 ILE C CG1 1 ATOM 3355 C CG2 . ILE C 1 10 ? -19.195 15.805 28.243 1.00 25.26 ? 10 ILE C CG2 1 ATOM 3356 C CD1 . ILE C 1 10 ? -16.323 13.819 28.269 1.00 40.74 ? 10 ILE C CD1 1 ATOM 3357 N N . LEU C 1 11 ? -19.978 17.374 25.439 1.00 36.96 ? 11 LEU C N 1 ATOM 3358 C CA . LEU C 1 11 ? -20.298 18.720 24.968 1.00 31.32 ? 11 LEU C CA 1 ATOM 3359 C C . LEU C 1 11 ? -21.098 19.439 26.050 1.00 28.21 ? 11 LEU C C 1 ATOM 3360 O O . LEU C 1 11 ? -22.318 19.276 26.141 1.00 27.03 ? 11 LEU C O 1 ATOM 3361 C CB . LEU C 1 11 ? -21.066 18.660 23.651 1.00 25.79 ? 11 LEU C CB 1 ATOM 3362 C CG . LEU C 1 11 ? -21.551 19.978 23.053 1.00 31.02 ? 11 LEU C CG 1 ATOM 3363 C CD1 . LEU C 1 11 ? -20.419 20.983 22.991 1.00 35.21 ? 11 LEU C CD1 1 ATOM 3364 C CD2 . LEU C 1 11 ? -22.120 19.737 21.668 1.00 34.85 ? 11 LEU C CD2 1 ATOM 3365 N N . SER C 1 12 ? -20.410 20.233 26.867 1.00 27.34 ? 12 SER C N 1 ATOM 3366 C CA . SER C 1 12 ? -21.051 21.008 27.920 1.00 31.66 ? 12 SER C CA 1 ATOM 3367 C C . SER C 1 12 ? -21.420 22.385 27.384 1.00 36.32 ? 12 SER C C 1 ATOM 3368 O O . SER C 1 12 ? -20.560 23.109 26.871 1.00 40.35 ? 12 SER C O 1 ATOM 3369 C CB . SER C 1 12 ? -20.131 21.132 29.135 1.00 33.35 ? 12 SER C CB 1 ATOM 3370 O OG . SER C 1 12 ? -20.840 21.598 30.269 1.00 39.55 ? 12 SER C OG 1 ATOM 3371 N N . VAL C 1 13 ? -22.700 22.742 27.505 1.00 28.29 ? 13 VAL C N 1 ATOM 3372 C CA . VAL C 1 13 ? -23.232 23.968 26.926 1.00 34.48 ? 13 VAL C CA 1 ATOM 3373 C C . VAL C 1 13 ? -24.227 24.583 27.903 1.00 36.04 ? 13 VAL C C 1 ATOM 3374 O O . VAL C 1 13 ? -24.736 23.919 28.808 1.00 35.07 ? 13 VAL C O 1 ATOM 3375 C CB . VAL C 1 13 ? -23.898 23.704 25.551 1.00 43.55 ? 13 VAL C CB 1 ATOM 3376 C CG1 . VAL C 1 13 ? -25.309 23.156 25.727 1.00 44.07 ? 13 VAL C CG1 1 ATOM 3377 C CG2 . VAL C 1 13 ? -23.892 24.957 24.683 1.00 47.63 ? 13 VAL C CG2 1 ATOM 3378 N N . SER C 1 14 ? -24.498 25.909 27.713 1.00 36.48 ? 14 SER C N 1 ATOM 3379 C CA . SER C 1 14 ? -25.455 26.647 28.523 1.00 39.02 ? 14 SER C CA 1 ATOM 3380 C C . SER C 1 14 ? -26.808 26.721 27.821 1.00 40.39 ? 14 SER C C 1 ATOM 3381 O O . SER C 1 14 ? -26.876 26.695 26.588 1.00 44.43 ? 14 SER C O 1 ATOM 3382 C CB . SER C 1 14 ? -24.949 28.066 28.804 1.00 39.88 ? 14 SER C CB 1 ATOM 3383 O OG . SER C 1 14 ? -23.637 28.046 29.339 1.00 45.51 ? 14 SER C OG 1 ATOM 3384 N N . PRO C 1 15 ? -27.905 26.812 28.574 1.00 38.74 ? 15 PRO C N 1 ATOM 3385 C CA . PRO C 1 15 ? -29.229 26.851 27.940 1.00 36.24 ? 15 PRO C CA 1 ATOM 3386 C C . PRO C 1 15 ? -29.390 28.082 27.058 1.00 37.17 ? 15 PRO C C 1 ATOM 3387 O O . PRO C 1 15 ? -28.900 29.169 27.374 1.00 38.07 ? 15 PRO C O 1 ATOM 3388 C CB . PRO C 1 15 ? -30.195 26.885 29.131 1.00 35.10 ? 15 PRO C CB 1 ATOM 3389 C CG . PRO C 1 15 ? -29.404 26.358 30.289 1.00 32.71 ? 15 PRO C CG 1 ATOM 3390 C CD . PRO C 1 15 ? -27.996 26.804 30.044 1.00 32.83 ? 15 PRO C CD 1 ATOM 3391 N N . GLY C 1 16 ? -30.091 27.898 25.938 1.00 39.91 ? 16 GLY C N 1 ATOM 3392 C CA . GLY C 1 16 ? -30.291 28.953 24.969 1.00 31.39 ? 16 GLY C CA 1 ATOM 3393 C C . GLY C 1 16 ? -29.146 29.171 24.005 1.00 43.20 ? 16 GLY C C 1 ATOM 3394 O O . GLY C 1 16 ? -29.343 29.823 22.972 1.00 34.15 ? 16 GLY C O 1 ATOM 3395 N N . GLU C 1 17 ? -27.957 28.648 24.302 1.00 37.44 ? 17 GLU C N 1 ATOM 3396 C CA . GLU C 1 17 ? -26.817 28.814 23.414 1.00 37.96 ? 17 GLU C CA 1 ATOM 3397 C C . GLU C 1 17 ? -27.006 28.014 22.124 1.00 41.65 ? 17 GLU C C 1 ATOM 3398 O O . GLU C 1 17 ? -27.894 27.167 22.000 1.00 29.86 ? 17 GLU C O 1 ATOM 3399 C CB . GLU C 1 17 ? -25.525 28.367 24.095 1.00 36.64 ? 17 GLU C CB 1 ATOM 3400 C CG . GLU C 1 17 ? -24.990 29.289 25.172 1.00 41.90 ? 17 GLU C CG 1 ATOM 3401 C CD . GLU C 1 17 ? -23.580 28.906 25.585 1.00 61.48 ? 17 GLU C CD 1 ATOM 3402 O OE1 . GLU C 1 17 ? -22.660 29.737 25.426 1.00 71.49 ? 17 GLU C OE1 1 ATOM 3403 O OE2 . GLU C 1 17 ? -23.388 27.762 26.048 1.00 57.99 ? 17 GLU C OE2 1 ATOM 3404 N N . ARG C 1 18 ? -26.140 28.300 21.155 1.00 47.83 ? 18 ARG C N 1 ATOM 3405 C CA . ARG C 1 18 ? -26.067 27.548 19.910 1.00 44.19 ? 18 ARG C CA 1 ATOM 3406 C C . ARG C 1 18 ? -25.153 26.343 20.099 1.00 41.48 ? 18 ARG C C 1 ATOM 3407 O O . ARG C 1 18 ? -24.116 26.433 20.762 1.00 47.47 ? 18 ARG C O 1 ATOM 3408 C CB . ARG C 1 18 ? -25.546 28.444 18.784 1.00 52.23 ? 18 ARG C CB 1 ATOM 3409 C CG . ARG C 1 18 ? -25.317 27.755 17.453 1.00 65.44 ? 18 ARG C CG 1 ATOM 3410 C CD . ARG C 1 18 ? -26.536 27.843 16.551 1.00 72.33 ? 18 ARG C CD 1 ATOM 3411 N NE . ARG C 1 18 ? -26.153 27.896 15.142 1.00 80.87 ? 18 ARG C NE 1 ATOM 3412 C CZ . ARG C 1 18 ? -26.984 27.677 14.128 1.00 89.11 ? 18 ARG C CZ 1 ATOM 3413 N NH1 . ARG C 1 18 ? -28.255 27.375 14.360 1.00 90.88 ? 18 ARG C NH1 1 ATOM 3414 N NH2 . ARG C 1 18 ? -26.542 27.750 12.880 1.00 92.15 ? 18 ARG C NH2 1 ATOM 3415 N N . VAL C 1 19 ? -25.548 25.210 19.523 1.00 27.94 ? 19 VAL C N 1 ATOM 3416 C CA . VAL C 1 19 ? -24.847 23.946 19.717 1.00 25.34 ? 19 VAL C CA 1 ATOM 3417 C C . VAL C 1 19 ? -24.521 23.341 18.358 1.00 24.43 ? 19 VAL C C 1 ATOM 3418 O O . VAL C 1 19 ? -25.369 23.326 17.458 1.00 27.03 ? 19 VAL C O 1 ATOM 3419 C CB . VAL C 1 19 ? -25.688 22.969 20.567 1.00 31.01 ? 19 VAL C CB 1 ATOM 3420 C CG1 . VAL C 1 19 ? -24.992 21.630 20.695 1.00 25.99 ? 19 VAL C CG1 1 ATOM 3421 C CG2 . VAL C 1 19 ? -25.959 23.560 21.941 1.00 25.02 ? 19 VAL C CG2 1 ATOM 3422 N N . SER C 1 20 ? -23.294 22.835 18.212 1.00 22.07 ? 20 SER C N 1 ATOM 3423 C CA . SER C 1 20 ? -22.832 22.254 16.955 1.00 25.95 ? 20 SER C CA 1 ATOM 3424 C C . SER C 1 20 ? -22.105 20.945 17.227 1.00 29.34 ? 20 SER C C 1 ATOM 3425 O O . SER C 1 20 ? -21.071 20.933 17.902 1.00 29.46 ? 20 SER C O 1 ATOM 3426 C CB . SER C 1 20 ? -21.914 23.221 16.202 1.00 30.79 ? 20 SER C CB 1 ATOM 3427 O OG . SER C 1 20 ? -22.639 24.339 15.713 1.00 46.58 ? 20 SER C OG 1 ATOM 3428 N N . PHE C 1 21 ? -22.636 19.849 16.688 1.00 29.61 ? 21 PHE C N 1 ATOM 3429 C CA . PHE C 1 21 ? -21.987 18.547 16.748 1.00 23.54 ? 21 PHE C CA 1 ATOM 3430 C C . PHE C 1 21 ? -21.204 18.312 15.463 1.00 25.26 ? 21 PHE C C 1 ATOM 3431 O O . PHE C 1 21 ? -21.695 18.592 14.365 1.00 19.05 ? 21 PHE C O 1 ATOM 3432 C CB . PHE C 1 21 ? -23.008 17.423 16.932 1.00 20.40 ? 21 PHE C CB 1 ATOM 3433 C CG . PHE C 1 21 ? -23.963 17.642 18.065 1.00 22.98 ? 21 PHE C CG 1 ATOM 3434 C CD1 . PHE C 1 21 ? -25.166 18.296 17.859 1.00 27.75 ? 21 PHE C CD1 1 ATOM 3435 C CD2 . PHE C 1 21 ? -23.665 17.185 19.335 1.00 28.98 ? 21 PHE C CD2 1 ATOM 3436 C CE1 . PHE C 1 21 ? -26.049 18.494 18.902 1.00 29.42 ? 21 PHE C CE1 1 ATOM 3437 C CE2 . PHE C 1 21 ? -24.543 17.379 20.381 1.00 29.15 ? 21 PHE C CE2 1 ATOM 3438 C CZ . PHE C 1 21 ? -25.736 18.033 20.165 1.00 26.26 ? 21 PHE C CZ 1 ATOM 3439 N N . SER C 1 22 ? -19.991 17.790 15.602 1.00 30.15 ? 22 SER C N 1 ATOM 3440 C CA . SER C 1 22 ? -19.140 17.488 14.461 1.00 24.60 ? 22 SER C CA 1 ATOM 3441 C C . SER C 1 22 ? -19.147 15.991 14.179 1.00 21.07 ? 22 SER C C 1 ATOM 3442 O O . SER C 1 22 ? -19.082 15.174 15.102 1.00 20.73 ? 22 SER C O 1 ATOM 3443 C CB . SER C 1 22 ? -17.707 17.967 14.705 1.00 36.76 ? 22 SER C CB 1 ATOM 3444 O OG . SER C 1 22 ? -16.813 17.425 13.749 1.00 45.65 ? 22 SER C OG 1 ATOM 3445 N N . CYS C 1 23 ? -19.237 15.641 12.897 1.00 19.51 ? 23 CYS C N 1 ATOM 3446 C CA . CYS C 1 23 ? -19.153 14.255 12.436 1.00 25.61 ? 23 CYS C CA 1 ATOM 3447 C C . CYS C 1 23 ? -18.350 14.258 11.144 1.00 32.98 ? 23 CYS C C 1 ATOM 3448 O O . CYS C 1 23 ? -18.812 14.793 10.131 1.00 37.40 ? 23 CYS C O 1 ATOM 3449 C CB . CYS C 1 23 ? -20.545 13.652 12.221 1.00 23.17 ? 23 CYS C CB 1 ATOM 3450 S SG . CYS C 1 23 ? -20.611 12.014 11.420 1.00 37.69 ? 23 CYS C SG 1 ATOM 3451 N N . ARG C 1 24 ? -17.150 13.686 11.180 1.00 27.62 ? 24 ARG C N 1 ATOM 3452 C CA . ARG C 1 24 ? -16.272 13.642 10.020 1.00 26.04 ? 24 ARG C CA 1 ATOM 3453 C C . ARG C 1 24 ? -16.084 12.199 9.573 1.00 28.80 ? 24 ARG C C 1 ATOM 3454 O O . ARG C 1 24 ? -15.891 11.302 10.399 1.00 34.95 ? 24 ARG C O 1 ATOM 3455 C CB . ARG C 1 24 ? -14.915 14.291 10.327 1.00 37.59 ? 24 ARG C CB 1 ATOM 3456 C CG . ARG C 1 24 ? -15.032 15.606 11.101 1.00 53.95 ? 24 ARG C CG 1 ATOM 3457 C CD . ARG C 1 24 ? -13.991 16.648 10.684 1.00 63.78 ? 24 ARG C CD 1 ATOM 3458 N NE . ARG C 1 24 ? -12.612 16.200 10.868 1.00 70.27 ? 24 ARG C NE 1 ATOM 3459 C CZ . ARG C 1 24 ? -11.781 15.898 9.874 1.00 64.95 ? 24 ARG C CZ 1 ATOM 3460 N NH1 . ARG C 1 24 ? -12.183 15.997 8.612 1.00 64.25 ? 24 ARG C NH1 1 ATOM 3461 N NH2 . ARG C 1 24 ? -10.543 15.501 10.140 1.00 56.15 ? 24 ARG C NH2 1 ATOM 3462 N N . ALA C 1 25 ? -16.153 11.980 8.262 1.00 25.47 ? 25 ALA C N 1 ATOM 3463 C CA . ALA C 1 25 ? -16.040 10.652 7.676 1.00 32.17 ? 25 ALA C CA 1 ATOM 3464 C C . ALA C 1 25 ? -14.621 10.403 7.176 1.00 33.97 ? 25 ALA C C 1 ATOM 3465 O O . ALA C 1 25 ? -13.900 11.334 6.808 1.00 33.82 ? 25 ALA C O 1 ATOM 3466 C CB . ALA C 1 25 ? -17.035 10.478 6.527 1.00 28.15 ? 25 ALA C CB 1 ATOM 3467 N N . SER C 1 26 ? -14.229 9.126 7.162 1.00 33.24 ? 26 SER C N 1 ATOM 3468 C CA . SER C 1 26 ? -12.881 8.761 6.736 1.00 37.20 ? 26 SER C CA 1 ATOM 3469 C C . SER C 1 26 ? -12.657 9.001 5.248 1.00 42.05 ? 26 SER C C 1 ATOM 3470 O O . SER C 1 26 ? -11.505 9.142 4.823 1.00 47.22 ? 26 SER C O 1 ATOM 3471 C CB . SER C 1 26 ? -12.594 7.300 7.083 1.00 25.45 ? 26 SER C CB 1 ATOM 3472 O OG . SER C 1 26 ? -13.607 6.445 6.585 1.00 36.37 ? 26 SER C OG 1 ATOM 3473 N N . GLN C 1 27 ? -13.724 9.045 4.454 1.00 36.56 ? 27 GLN C N 1 ATOM 3474 C CA . GLN C 1 27 ? -13.640 9.437 3.054 1.00 38.44 ? 27 GLN C CA 1 ATOM 3475 C C . GLN C 1 27 ? -14.930 10.165 2.694 1.00 36.34 ? 27 GLN C C 1 ATOM 3476 O O . GLN C 1 27 ? -15.831 10.317 3.524 1.00 28.96 ? 27 GLN C O 1 ATOM 3477 C CB . GLN C 1 27 ? -13.391 8.224 2.151 1.00 43.89 ? 27 GLN C CB 1 ATOM 3478 C CG . GLN C 1 27 ? -14.626 7.388 1.878 1.00 49.09 ? 27 GLN C CG 1 ATOM 3479 C CD . GLN C 1 27 ? -14.305 6.089 1.169 1.00 52.78 ? 27 GLN C CD 1 ATOM 3480 O OE1 . GLN C 1 27 ? -13.517 5.281 1.659 1.00 55.98 ? 27 GLN C OE1 1 ATOM 3481 N NE2 . GLN C 1 27 ? -14.914 5.882 0.006 1.00 51.14 ? 27 GLN C NE2 1 ATOM 3482 N N . SER C 1 28 ? -15.016 10.623 1.449 1.00 36.42 ? 28 SER C N 1 ATOM 3483 C CA . SER C 1 28 ? -16.176 11.395 1.025 1.00 34.59 ? 28 SER C CA 1 ATOM 3484 C C . SER C 1 28 ? -17.405 10.502 0.904 1.00 28.99 ? 28 SER C C 1 ATOM 3485 O O . SER C 1 28 ? -17.325 9.367 0.426 1.00 27.44 ? 28 SER C O 1 ATOM 3486 C CB . SER C 1 28 ? -15.897 12.090 -0.305 1.00 33.79 ? 28 SER C CB 1 ATOM 3487 O OG . SER C 1 28 ? -16.950 12.971 -0.641 1.00 40.59 ? 28 SER C OG 1 ATOM 3488 N N . ILE C 1 29 ? -18.550 11.023 1.349 1.00 25.14 ? 29 ILE C N 1 ATOM 3489 C CA . ILE C 1 29 ? -19.809 10.284 1.339 1.00 22.78 ? 29 ILE C CA 1 ATOM 3490 C C . ILE C 1 29 ? -20.932 11.180 0.832 1.00 24.37 ? 29 ILE C C 1 ATOM 3491 O O . ILE C 1 29 ? -22.114 10.907 1.073 1.00 17.80 ? 29 ILE C O 1 ATOM 3492 C CB . ILE C 1 29 ? -20.150 9.733 2.736 1.00 19.48 ? 29 ILE C CB 1 ATOM 3493 C CG1 . ILE C 1 29 ? -20.168 10.864 3.767 1.00 17.35 ? 29 ILE C CG1 1 ATOM 3494 C CG2 . ILE C 1 29 ? -19.176 8.637 3.140 1.00 18.67 ? 29 ILE C CG2 1 ATOM 3495 C CD1 . ILE C 1 29 ? -20.510 10.407 5.167 1.00 22.19 ? 29 ILE C CD1 1 ATOM 3496 N N . GLY C 1 30 ? -20.573 12.250 0.135 1.00 19.60 ? 30 GLY C N 1 ATOM 3497 C CA . GLY C 1 30 ? -21.578 13.144 -0.418 1.00 19.51 ? 30 GLY C CA 1 ATOM 3498 C C . GLY C 1 30 ? -22.394 13.796 0.680 1.00 18.88 ? 30 GLY C C 1 ATOM 3499 O O . GLY C 1 30 ? -21.869 14.533 1.524 1.00 19.53 ? 30 GLY C O 1 ATOM 3500 N N . THR C 1 31 ? -23.701 13.529 0.675 1.00 17.75 ? 31 THR C N 1 ATOM 3501 C CA . THR C 1 31 ? -24.609 13.999 1.715 1.00 30.88 ? 31 THR C CA 1 ATOM 3502 C C . THR C 1 31 ? -25.356 12.846 2.379 1.00 23.53 ? 31 THR C C 1 ATOM 3503 O O . THR C 1 31 ? -26.427 13.056 2.958 1.00 21.84 ? 31 THR C O 1 ATOM 3504 C CB . THR C 1 31 ? -25.608 15.010 1.147 1.00 33.59 ? 31 THR C CB 1 ATOM 3505 O OG1 . THR C 1 31 ? -26.307 14.422 0.042 1.00 37.51 ? 31 THR C OG1 1 ATOM 3506 C CG2 . THR C 1 31 ? -24.893 16.269 0.681 1.00 35.32 ? 31 THR C CG2 1 ATOM 3507 N N . ASN C 1 32 ? -24.813 11.632 2.307 1.00 22.96 ? 32 ASN C N 1 ATOM 3508 C CA . ASN C 1 32 ? -25.498 10.441 2.812 1.00 24.43 ? 32 ASN C CA 1 ATOM 3509 C C . ASN C 1 32 ? -25.139 10.228 4.284 1.00 23.77 ? 32 ASN C C 1 ATOM 3510 O O . ASN C 1 32 ? -24.433 9.292 4.667 1.00 17.64 ? 32 ASN C O 1 ATOM 3511 C CB . ASN C 1 32 ? -25.143 9.228 1.962 1.00 25.15 ? 32 ASN C CB 1 ATOM 3512 C CG . ASN C 1 32 ? -26.317 8.288 1.760 1.00 37.14 ? 32 ASN C CG 1 ATOM 3513 O OD1 . ASN C 1 32 ? -27.118 8.066 2.669 1.00 43.83 ? 32 ASN C OD1 1 ATOM 3514 N ND2 . ASN C 1 32 ? -26.426 7.733 0.559 1.00 39.33 ? 32 ASN C ND2 1 ATOM 3515 N N . ILE C 1 33 ? -25.649 11.131 5.120 1.00 19.78 ? 33 ILE C N 1 ATOM 3516 C CA . ILE C 1 33 ? -25.444 11.058 6.561 1.00 18.42 ? 33 ILE C CA 1 ATOM 3517 C C . ILE C 1 33 ? -26.778 11.311 7.250 1.00 23.45 ? 33 ILE C C 1 ATOM 3518 O O . ILE C 1 33 ? -27.583 12.129 6.791 1.00 23.01 ? 33 ILE C O 1 ATOM 3519 C CB . ILE C 1 33 ? -24.355 12.050 7.038 1.00 24.28 ? 33 ILE C CB 1 ATOM 3520 C CG1 . ILE C 1 33 ? -23.931 11.753 8.478 1.00 31.75 ? 33 ILE C CG1 1 ATOM 3521 C CG2 . ILE C 1 33 ? -24.818 13.485 6.909 1.00 26.29 ? 33 ILE C CG2 1 ATOM 3522 C CD1 . ILE C 1 33 ? -22.794 10.756 8.582 1.00 35.73 ? 33 ILE C CD1 1 ATOM 3523 N N . HIS C 1 34 ? -27.024 10.582 8.339 1.00 33.80 ? 34 HIS C N 1 ATOM 3524 C CA . HIS C 1 34 ? -28.244 10.716 9.123 1.00 30.16 ? 34 HIS C CA 1 ATOM 3525 C C . HIS C 1 34 ? -27.880 10.926 10.586 1.00 21.83 ? 34 HIS C C 1 ATOM 3526 O O . HIS C 1 34 ? -26.881 10.393 11.072 1.00 25.63 ? 34 HIS C O 1 ATOM 3527 C CB . HIS C 1 34 ? -29.148 9.481 8.987 1.00 28.15 ? 34 HIS C CB 1 ATOM 3528 C CG . HIS C 1 34 ? -29.445 9.097 7.569 1.00 26.34 ? 34 HIS C CG 1 ATOM 3529 N ND1 . HIS C 1 34 ? -29.727 10.022 6.587 1.00 27.52 ? 34 HIS C ND1 1 ATOM 3530 C CD2 . HIS C 1 34 ? -29.503 7.883 6.970 1.00 23.63 ? 34 HIS C CD2 1 ATOM 3531 C CE1 . HIS C 1 34 ? -29.947 9.395 5.445 1.00 24.03 ? 34 HIS C CE1 1 ATOM 3532 N NE2 . HIS C 1 34 ? -29.817 8.097 5.650 1.00 24.69 ? 34 HIS C NE2 1 ATOM 3533 N N . TRP C 1 35 ? -28.703 11.704 11.286 1.00 21.66 ? 35 TRP C N 1 ATOM 3534 C CA . TRP C 1 35 ? -28.450 12.062 12.674 1.00 21.72 ? 35 TRP C CA 1 ATOM 3535 C C . TRP C 1 35 ? -29.549 11.519 13.575 1.00 13.69 ? 35 TRP C C 1 ATOM 3536 O O . TRP C 1 35 ? -30.721 11.463 13.191 1.00 14.16 ? 35 TRP C O 1 ATOM 3537 C CB . TRP C 1 35 ? -28.354 13.577 12.852 1.00 22.32 ? 35 TRP C CB 1 ATOM 3538 C CG . TRP C 1 35 ? -27.114 14.171 12.278 1.00 25.14 ? 35 TRP C CG 1 ATOM 3539 C CD1 . TRP C 1 35 ? -26.932 14.610 11.000 1.00 28.69 ? 35 TRP C CD1 1 ATOM 3540 C CD2 . TRP C 1 35 ? -25.879 14.401 12.963 1.00 26.69 ? 35 TRP C CD2 1 ATOM 3541 N NE1 . TRP C 1 35 ? -25.657 15.099 10.846 1.00 33.99 ? 35 TRP C NE1 1 ATOM 3542 C CE2 . TRP C 1 35 ? -24.991 14.983 12.038 1.00 29.62 ? 35 TRP C CE2 1 ATOM 3543 C CE3 . TRP C 1 35 ? -25.438 14.172 14.270 1.00 23.45 ? 35 TRP C CE3 1 ATOM 3544 C CZ2 . TRP C 1 35 ? -23.690 15.338 12.377 1.00 32.53 ? 35 TRP C CZ2 1 ATOM 3545 C CZ3 . TRP C 1 35 ? -24.147 14.527 14.604 1.00 23.96 ? 35 TRP C CZ3 1 ATOM 3546 C CH2 . TRP C 1 35 ? -23.288 15.104 13.662 1.00 33.91 ? 35 TRP C CH2 1 ATOM 3547 N N . TYR C 1 36 ? -29.156 11.138 14.789 1.00 18.35 ? 36 TYR C N 1 ATOM 3548 C CA . TYR C 1 36 ? -30.062 10.500 15.731 1.00 14.14 ? 36 TYR C CA 1 ATOM 3549 C C . TYR C 1 36 ? -29.889 11.096 17.117 1.00 17.23 ? 36 TYR C C 1 ATOM 3550 O O . TYR C 1 36 ? -28.823 11.608 17.466 1.00 20.65 ? 36 TYR C O 1 ATOM 3551 C CB . TYR C 1 36 ? -29.830 8.986 15.802 1.00 13.90 ? 36 TYR C CB 1 ATOM 3552 C CG . TYR C 1 36 ? -30.182 8.255 14.533 1.00 23.33 ? 36 TYR C CG 1 ATOM 3553 C CD1 . TYR C 1 36 ? -31.470 7.786 14.318 1.00 14.40 ? 36 TYR C CD1 1 ATOM 3554 C CD2 . TYR C 1 36 ? -29.229 8.031 13.551 1.00 17.86 ? 36 TYR C CD2 1 ATOM 3555 C CE1 . TYR C 1 36 ? -31.799 7.113 13.163 1.00 16.72 ? 36 TYR C CE1 1 ATOM 3556 C CE2 . TYR C 1 36 ? -29.548 7.359 12.390 1.00 21.23 ? 36 TYR C CE2 1 ATOM 3557 C CZ . TYR C 1 36 ? -30.835 6.902 12.199 1.00 23.89 ? 36 TYR C CZ 1 ATOM 3558 O OH . TYR C 1 36 ? -31.163 6.229 11.042 1.00 23.30 ? 36 TYR C OH 1 ATOM 3559 N N . GLN C 1 37 ? -30.954 11.012 17.905 1.00 23.40 ? 37 GLN C N 1 ATOM 3560 C CA . GLN C 1 37 ? -30.944 11.404 19.305 1.00 16.20 ? 37 GLN C CA 1 ATOM 3561 C C . GLN C 1 37 ? -31.406 10.227 20.151 1.00 28.28 ? 37 GLN C C 1 ATOM 3562 O O . GLN C 1 37 ? -32.386 9.557 19.809 1.00 31.76 ? 37 GLN C O 1 ATOM 3563 C CB . GLN C 1 37 ? -31.854 12.606 19.546 1.00 17.32 ? 37 GLN C CB 1 ATOM 3564 C CG . GLN C 1 37 ? -31.982 13.008 20.999 1.00 18.43 ? 37 GLN C CG 1 ATOM 3565 C CD . GLN C 1 37 ? -33.231 13.815 21.252 1.00 20.08 ? 37 GLN C CD 1 ATOM 3566 O OE1 . GLN C 1 37 ? -34.339 13.283 21.214 1.00 20.78 ? 37 GLN C OE1 1 ATOM 3567 N NE2 . GLN C 1 37 ? -33.064 15.109 21.500 1.00 22.21 ? 37 GLN C NE2 1 ATOM 3568 N N . GLN C 1 38 ? -30.697 9.970 21.248 1.00 25.11 ? 38 GLN C N 1 ATOM 3569 C CA . GLN C 1 38 ? -31.057 8.900 22.174 1.00 27.65 ? 38 GLN C CA 1 ATOM 3570 C C . GLN C 1 38 ? -31.129 9.472 23.583 1.00 26.11 ? 38 GLN C C 1 ATOM 3571 O O . GLN C 1 38 ? -30.099 9.815 24.171 1.00 30.69 ? 38 GLN C O 1 ATOM 3572 C CB . GLN C 1 38 ? -30.063 7.741 22.113 1.00 28.26 ? 38 GLN C CB 1 ATOM 3573 C CG . GLN C 1 38 ? -30.485 6.541 22.958 1.00 26.57 ? 38 GLN C CG 1 ATOM 3574 C CD . GLN C 1 38 ? -29.542 5.360 22.823 1.00 23.66 ? 38 GLN C CD 1 ATOM 3575 O OE1 . GLN C 1 38 ? -28.323 5.525 22.789 1.00 22.57 ? 38 GLN C OE1 1 ATOM 3576 N NE2 . GLN C 1 38 ? -30.105 4.161 22.742 1.00 17.89 ? 38 GLN C NE2 1 ATOM 3577 N N . ARG C 1 39 ? -32.342 9.567 24.117 1.00 19.93 ? 39 ARG C N 1 ATOM 3578 C CA . ARG C 1 39 ? -32.567 9.971 25.494 1.00 21.36 ? 39 ARG C CA 1 ATOM 3579 C C . ARG C 1 39 ? -32.447 8.765 26.423 1.00 21.92 ? 39 ARG C C 1 ATOM 3580 O O . ARG C 1 39 ? -32.331 7.618 25.985 1.00 33.99 ? 39 ARG C O 1 ATOM 3581 C CB . ARG C 1 39 ? -33.938 10.631 25.637 1.00 22.90 ? 39 ARG C CB 1 ATOM 3582 C CG . ARG C 1 39 ? -34.049 11.976 24.941 1.00 30.33 ? 39 ARG C CG 1 ATOM 3583 C CD . ARG C 1 39 ? -35.498 12.368 24.707 1.00 33.60 ? 39 ARG C CD 1 ATOM 3584 N NE . ARG C 1 39 ? -35.620 13.770 24.321 1.00 42.89 ? 39 ARG C NE 1 ATOM 3585 C CZ . ARG C 1 39 ? -36.759 14.348 23.954 1.00 55.08 ? 39 ARG C CZ 1 ATOM 3586 N NH1 . ARG C 1 39 ? -37.881 13.642 23.917 1.00 57.79 ? 39 ARG C NH1 1 ATOM 3587 N NH2 . ARG C 1 39 ? -36.775 15.631 23.620 1.00 61.29 ? 39 ARG C NH2 1 ATOM 3588 N N . THR C 1 40 ? -32.487 9.037 27.727 1.00 27.28 ? 40 THR C N 1 ATOM 3589 C CA . THR C 1 40 ? -32.301 7.988 28.724 1.00 30.73 ? 40 THR C CA 1 ATOM 3590 C C . THR C 1 40 ? -33.398 6.932 28.619 1.00 36.16 ? 40 THR C C 1 ATOM 3591 O O . THR C 1 40 ? -34.585 7.259 28.514 1.00 25.96 ? 40 THR C O 1 ATOM 3592 C CB . THR C 1 40 ? -32.283 8.595 30.130 1.00 25.68 ? 40 THR C CB 1 ATOM 3593 O OG1 . THR C 1 40 ? -31.188 9.513 30.246 1.00 31.52 ? 40 THR C OG1 1 ATOM 3594 C CG2 . THR C 1 40 ? -32.134 7.508 31.187 1.00 26.74 ? 40 THR C CG2 1 ATOM 3595 N N . ASN C 1 41 ? -32.988 5.662 28.633 1.00 32.46 ? 41 ASN C N 1 ATOM 3596 C CA . ASN C 1 41 ? -33.858 4.491 28.547 1.00 27.03 ? 41 ASN C CA 1 ATOM 3597 C C . ASN C 1 41 ? -34.639 4.418 27.239 1.00 30.01 ? 41 ASN C C 1 ATOM 3598 O O . ASN C 1 41 ? -35.563 3.603 27.122 1.00 38.18 ? 41 ASN C O 1 ATOM 3599 C CB . ASN C 1 41 ? -34.841 4.419 29.725 1.00 29.16 ? 41 ASN C CB 1 ATOM 3600 C CG . ASN C 1 41 ? -34.146 4.257 31.063 1.00 34.99 ? 41 ASN C CG 1 ATOM 3601 O OD1 . ASN C 1 41 ? -34.448 4.973 32.017 1.00 30.11 ? 41 ASN C OD1 1 ATOM 3602 N ND2 . ASN C 1 41 ? -33.214 3.312 31.142 1.00 37.13 ? 41 ASN C ND2 1 ATOM 3603 N N . GLY C 1 42 ? -34.294 5.236 26.247 1.00 24.94 ? 42 GLY C N 1 ATOM 3604 C CA . GLY C 1 42 ? -35.049 5.264 25.009 1.00 30.16 ? 42 GLY C CA 1 ATOM 3605 C C . GLY C 1 42 ? -34.317 4.728 23.795 1.00 24.55 ? 42 GLY C C 1 ATOM 3606 O O . GLY C 1 42 ? -33.089 4.601 23.801 1.00 29.87 ? 42 GLY C O 1 ATOM 3607 N N . SER C 1 43 ? -35.070 4.402 22.742 1.00 21.59 ? 43 SER C N 1 ATOM 3608 C CA . SER C 1 43 ? -34.477 4.015 21.472 1.00 20.25 ? 43 SER C CA 1 ATOM 3609 C C . SER C 1 43 ? -34.097 5.269 20.686 1.00 19.11 ? 43 SER C C 1 ATOM 3610 O O . SER C 1 43 ? -34.693 6.332 20.880 1.00 23.33 ? 43 SER C O 1 ATOM 3611 C CB . SER C 1 43 ? -35.454 3.165 20.665 1.00 21.01 ? 43 SER C CB 1 ATOM 3612 O OG . SER C 1 43 ? -35.809 1.985 21.366 1.00 22.28 ? 43 SER C OG 1 ATOM 3613 N N . PRO C 1 44 ? -33.103 5.178 19.804 1.00 22.26 ? 44 PRO C N 1 ATOM 3614 C CA . PRO C 1 44 ? -32.658 6.375 19.075 1.00 18.92 ? 44 PRO C CA 1 ATOM 3615 C C . PRO C 1 44 ? -33.765 6.950 18.203 1.00 26.74 ? 44 PRO C C 1 ATOM 3616 O O . PRO C 1 44 ? -34.458 6.225 17.485 1.00 33.27 ? 44 PRO C O 1 ATOM 3617 C CB . PRO C 1 44 ? -31.480 5.864 18.235 1.00 18.64 ? 44 PRO C CB 1 ATOM 3618 C CG . PRO C 1 44 ? -31.638 4.379 18.198 1.00 22.53 ? 44 PRO C CG 1 ATOM 3619 C CD . PRO C 1 44 ? -32.276 4.001 19.493 1.00 17.35 ? 44 PRO C CD 1 ATOM 3620 N N . ARG C 1 45 ? -33.936 8.269 18.288 1.00 32.28 ? 45 ARG C N 1 ATOM 3621 C CA . ARG C 1 45 ? -34.900 9.004 17.480 1.00 23.11 ? 45 ARG C CA 1 ATOM 3622 C C . ARG C 1 45 ? -34.181 9.685 16.323 1.00 17.05 ? 45 ARG C C 1 ATOM 3623 O O . ARG C 1 45 ? -33.115 10.279 16.506 1.00 36.70 ? 45 ARG C O 1 ATOM 3624 C CB . ARG C 1 45 ? -35.653 10.047 18.318 1.00 23.80 ? 45 ARG C CB 1 ATOM 3625 C CG . ARG C 1 45 ? -36.533 10.989 17.492 1.00 36.59 ? 45 ARG C CG 1 ATOM 3626 C CD . ARG C 1 45 ? -37.581 11.742 18.320 1.00 53.72 ? 45 ARG C CD 1 ATOM 3627 N NE . ARG C 1 45 ? -37.044 12.899 19.039 1.00 62.23 ? 45 ARG C NE 1 ATOM 3628 C CZ . ARG C 1 45 ? -37.757 13.980 19.351 1.00 53.47 ? 45 ARG C CZ 1 ATOM 3629 N NH1 . ARG C 1 45 ? -39.033 14.061 18.993 1.00 44.04 ? 45 ARG C NH1 1 ATOM 3630 N NH2 . ARG C 1 45 ? -37.197 14.987 20.009 1.00 46.88 ? 45 ARG C NH2 1 ATOM 3631 N N . LEU C 1 46 ? -34.770 9.595 15.134 1.00 17.23 ? 46 LEU C N 1 ATOM 3632 C CA . LEU C 1 46 ? -34.190 10.203 13.943 1.00 24.61 ? 46 LEU C CA 1 ATOM 3633 C C . LEU C 1 46 ? -34.484 11.699 13.917 1.00 30.48 ? 46 LEU C C 1 ATOM 3634 O O . LEU C 1 46 ? -35.635 12.118 14.082 1.00 31.87 ? 46 LEU C O 1 ATOM 3635 C CB . LEU C 1 46 ? -34.742 9.528 12.687 1.00 26.15 ? 46 LEU C CB 1 ATOM 3636 C CG . LEU C 1 46 ? -34.302 10.067 11.325 1.00 27.77 ? 46 LEU C CG 1 ATOM 3637 C CD1 . LEU C 1 46 ? -32.806 9.875 11.122 1.00 29.61 ? 46 LEU C CD1 1 ATOM 3638 C CD2 . LEU C 1 46 ? -35.089 9.399 10.206 1.00 16.90 ? 46 LEU C CD2 1 ATOM 3639 N N . LEU C 1 47 ? -33.442 12.502 13.702 1.00 22.28 ? 47 LEU C N 1 ATOM 3640 C CA . LEU C 1 47 ? -33.555 13.956 13.676 1.00 23.73 ? 47 LEU C CA 1 ATOM 3641 C C . LEU C 1 47 ? -33.420 14.544 12.280 1.00 31.09 ? 47 LEU C C 1 ATOM 3642 O O . LEU C 1 47 ? -34.258 15.349 11.865 1.00 26.70 ? 47 LEU C O 1 ATOM 3643 C CB . LEU C 1 47 ? -32.493 14.583 14.588 1.00 16.74 ? 47 LEU C CB 1 ATOM 3644 C CG . LEU C 1 47 ? -32.511 14.217 16.067 1.00 21.50 ? 47 LEU C CG 1 ATOM 3645 C CD1 . LEU C 1 47 ? -31.270 14.776 16.738 1.00 31.74 ? 47 LEU C CD1 1 ATOM 3646 C CD2 . LEU C 1 47 ? -33.769 14.738 16.740 1.00 21.19 ? 47 LEU C CD2 1 ATOM 3647 N N . ILE C 1 48 ? -32.369 14.176 11.549 1.00 28.67 ? 48 ILE C N 1 ATOM 3648 C CA . ILE C 1 48 ? -32.063 14.758 10.246 1.00 21.02 ? 48 ILE C CA 1 ATOM 3649 C C . ILE C 1 48 ? -31.678 13.632 9.297 1.00 21.23 ? 48 ILE C C 1 ATOM 3650 O O . ILE C 1 48 ? -30.884 12.757 9.657 1.00 26.92 ? 48 ILE C O 1 ATOM 3651 C CB . ILE C 1 48 ? -30.926 15.798 10.340 1.00 21.77 ? 48 ILE C CB 1 ATOM 3652 C CG1 . ILE C 1 48 ? -31.306 16.941 11.287 1.00 27.50 ? 48 ILE C CG1 1 ATOM 3653 C CG2 . ILE C 1 48 ? -30.570 16.339 8.963 1.00 19.50 ? 48 ILE C CG2 1 ATOM 3654 C CD1 . ILE C 1 48 ? -32.424 17.825 10.776 1.00 31.12 ? 48 ILE C CD1 1 ATOM 3655 N N . LYS C 1 49 ? -32.238 13.650 8.089 1.00 15.84 ? 49 LYS C N 1 ATOM 3656 C CA . LYS C 1 49 ? -31.907 12.678 7.057 1.00 15.49 ? 49 LYS C CA 1 ATOM 3657 C C . LYS C 1 49 ? -31.204 13.374 5.899 1.00 24.06 ? 49 LYS C C 1 ATOM 3658 O O . LYS C 1 49 ? -31.537 14.512 5.551 1.00 23.42 ? 49 LYS C O 1 ATOM 3659 C CB . LYS C 1 49 ? -33.155 11.943 6.550 1.00 16.23 ? 49 LYS C CB 1 ATOM 3660 C CG . LYS C 1 49 ? -34.127 12.782 5.725 1.00 17.47 ? 49 LYS C CG 1 ATOM 3661 C CD . LYS C 1 49 ? -35.321 11.940 5.280 1.00 18.42 ? 49 LYS C CD 1 ATOM 3662 C CE . LYS C 1 49 ? -36.457 12.795 4.719 1.00 20.57 ? 49 LYS C CE 1 ATOM 3663 N NZ . LYS C 1 49 ? -36.148 13.365 3.375 1.00 21.99 ? 49 LYS C NZ 1 ATOM 3664 N N . TYR C 1 50 ? -30.226 12.683 5.315 1.00 25.70 ? 50 TYR C N 1 ATOM 3665 C CA . TYR C 1 50 ? -29.439 13.181 4.188 1.00 24.86 ? 50 TYR C CA 1 ATOM 3666 C C . TYR C 1 50 ? -28.894 14.585 4.465 1.00 25.88 ? 50 TYR C C 1 ATOM 3667 O O . TYR C 1 50 ? -29.221 15.562 3.786 1.00 32.69 ? 50 TYR C O 1 ATOM 3668 C CB . TYR C 1 50 ? -30.255 13.136 2.892 1.00 16.35 ? 50 TYR C CB 1 ATOM 3669 C CG . TYR C 1 50 ? -30.479 11.728 2.380 1.00 24.25 ? 50 TYR C CG 1 ATOM 3670 C CD1 . TYR C 1 50 ? -29.441 11.005 1.802 1.00 27.32 ? 50 TYR C CD1 1 ATOM 3671 C CD2 . TYR C 1 50 ? -31.724 11.116 2.483 1.00 29.34 ? 50 TYR C CD2 1 ATOM 3672 C CE1 . TYR C 1 50 ? -29.636 9.713 1.337 1.00 27.07 ? 50 TYR C CE1 1 ATOM 3673 C CE2 . TYR C 1 50 ? -31.929 9.824 2.020 1.00 25.61 ? 50 TYR C CE2 1 ATOM 3674 C CZ . TYR C 1 50 ? -30.882 9.130 1.448 1.00 30.95 ? 50 TYR C CZ 1 ATOM 3675 O OH . TYR C 1 50 ? -31.086 7.849 0.989 1.00 34.09 ? 50 TYR C OH 1 ATOM 3676 N N . ALA C 1 51 ? -28.070 14.663 5.514 1.00 15.18 ? 51 ALA C N 1 ATOM 3677 C CA . ALA C 1 51 ? -27.273 15.838 5.865 1.00 19.95 ? 51 ALA C CA 1 ATOM 3678 C C . ALA C 1 51 ? -28.087 17.016 6.394 1.00 27.15 ? 51 ALA C C 1 ATOM 3679 O O . ALA C 1 51 ? -27.711 17.621 7.403 1.00 19.10 ? 51 ALA C O 1 ATOM 3680 C CB . ALA C 1 51 ? -26.434 16.292 4.667 1.00 17.60 ? 51 ALA C CB 1 ATOM 3681 N N . SER C 1 52 ? -29.189 17.367 5.729 1.00 16.87 ? 52 SER C N 1 ATOM 3682 C CA . SER C 1 52 ? -29.897 18.590 6.094 1.00 28.66 ? 52 SER C CA 1 ATOM 3683 C C . SER C 1 52 ? -31.414 18.489 6.085 1.00 27.76 ? 52 SER C C 1 ATOM 3684 O O . SER C 1 52 ? -32.064 19.418 6.573 1.00 31.76 ? 52 SER C O 1 ATOM 3685 C CB . SER C 1 52 ? -29.486 19.736 5.159 1.00 18.97 ? 52 SER C CB 1 ATOM 3686 O OG . SER C 1 52 ? -29.981 19.525 3.848 1.00 20.51 ? 52 SER C OG 1 ATOM 3687 N N . GLU C 1 53 ? -32.003 17.419 5.562 1.00 24.94 ? 53 GLU C N 1 ATOM 3688 C CA . GLU C 1 53 ? -33.445 17.371 5.373 1.00 26.76 ? 53 GLU C CA 1 ATOM 3689 C C . GLU C 1 53 ? -34.157 17.064 6.687 1.00 23.17 ? 53 GLU C C 1 ATOM 3690 O O . GLU C 1 53 ? -33.691 16.252 7.491 1.00 19.12 ? 53 GLU C O 1 ATOM 3691 C CB . GLU C 1 53 ? -33.795 16.334 4.307 1.00 29.56 ? 53 GLU C CB 1 ATOM 3692 C CG . GLU C 1 53 ? -33.044 16.554 2.997 1.00 32.72 ? 53 GLU C CG 1 ATOM 3693 C CD . GLU C 1 53 ? -33.276 15.446 1.992 1.00 39.10 ? 53 GLU C CD 1 ATOM 3694 O OE1 . GLU C 1 53 ? -33.869 14.415 2.371 1.00 43.10 ? 53 GLU C OE1 1 ATOM 3695 O OE2 . GLU C 1 53 ? -32.865 15.607 0.822 1.00 36.76 ? 53 GLU C OE2 1 ATOM 3696 N N . SER C 1 54 ? -35.289 17.727 6.904 1.00 22.19 ? 54 SER C N 1 ATOM 3697 C CA . SER C 1 54 ? -35.984 17.675 8.181 1.00 29.49 ? 54 SER C CA 1 ATOM 3698 C C . SER C 1 54 ? -36.954 16.501 8.238 1.00 35.45 ? 54 SER C C 1 ATOM 3699 O O . SER C 1 54 ? -37.507 16.069 7.222 1.00 39.22 ? 54 SER C O 1 ATOM 3700 C CB . SER C 1 54 ? -36.740 18.980 8.438 1.00 27.01 ? 54 SER C CB 1 ATOM 3701 O OG . SER C 1 54 ? -37.751 19.181 7.468 1.00 33.75 ? 54 SER C OG 1 ATOM 3702 N N . ILE C 1 55 ? -37.158 15.994 9.451 1.00 32.56 ? 55 ILE C N 1 ATOM 3703 C CA . ILE C 1 55 ? -38.041 14.865 9.720 1.00 29.55 ? 55 ILE C CA 1 ATOM 3704 C C . ILE C 1 55 ? -39.329 15.389 10.336 1.00 39.50 ? 55 ILE C C 1 ATOM 3705 O O . ILE C 1 55 ? -39.309 16.330 11.140 1.00 49.68 ? 55 ILE C O 1 ATOM 3706 C CB . ILE C 1 55 ? -37.356 13.847 10.653 1.00 28.42 ? 55 ILE C CB 1 ATOM 3707 C CG1 . ILE C 1 55 ? -36.031 13.380 10.049 1.00 21.77 ? 55 ILE C CG1 1 ATOM 3708 C CG2 . ILE C 1 55 ? -38.271 12.660 10.933 1.00 26.93 ? 55 ILE C CG2 1 ATOM 3709 C CD1 . ILE C 1 55 ? -36.187 12.687 8.721 1.00 18.85 ? 55 ILE C CD1 1 ATOM 3710 N N . SER C 1 56 ? -40.452 14.780 9.961 1.00 44.47 ? 56 SER C N 1 ATOM 3711 C CA . SER C 1 56 ? -41.744 15.179 10.505 1.00 52.67 ? 56 SER C CA 1 ATOM 3712 C C . SER C 1 56 ? -41.811 14.887 12.000 1.00 57.45 ? 56 SER C C 1 ATOM 3713 O O . SER C 1 56 ? -41.515 13.772 12.440 1.00 65.50 ? 56 SER C O 1 ATOM 3714 C CB . SER C 1 56 ? -42.870 14.450 9.773 1.00 61.66 ? 56 SER C CB 1 ATOM 3715 O OG . SER C 1 56 ? -44.118 14.663 10.412 1.00 74.59 ? 56 SER C OG 1 ATOM 3716 N N . GLY C 1 57 ? -42.201 15.896 12.781 1.00 53.12 ? 57 GLY C N 1 ATOM 3717 C CA . GLY C 1 57 ? -42.365 15.758 14.213 1.00 43.58 ? 57 GLY C CA 1 ATOM 3718 C C . GLY C 1 57 ? -41.195 16.242 15.042 1.00 42.56 ? 57 GLY C C 1 ATOM 3719 O O . GLY C 1 57 ? -41.326 16.342 16.269 1.00 31.58 ? 57 GLY C O 1 ATOM 3720 N N . ILE C 1 58 ? -40.061 16.542 14.417 1.00 46.97 ? 58 ILE C N 1 ATOM 3721 C CA . ILE C 1 58 ? -38.875 17.011 15.129 1.00 38.70 ? 58 ILE C CA 1 ATOM 3722 C C . ILE C 1 58 ? -38.967 18.525 15.275 1.00 41.01 ? 58 ILE C C 1 ATOM 3723 O O . ILE C 1 58 ? -39.336 19.212 14.311 1.00 41.84 ? 58 ILE C O 1 ATOM 3724 C CB . ILE C 1 58 ? -37.590 16.595 14.394 1.00 31.11 ? 58 ILE C CB 1 ATOM 3725 C CG1 . ILE C 1 58 ? -37.505 15.069 14.287 1.00 25.46 ? 58 ILE C CG1 1 ATOM 3726 C CG2 . ILE C 1 58 ? -36.362 17.165 15.083 1.00 22.38 ? 58 ILE C CG2 1 ATOM 3727 C CD1 . ILE C 1 58 ? -37.606 14.351 15.616 1.00 22.29 ? 58 ILE C CD1 1 ATOM 3728 N N . PRO C 1 59 ? -38.668 19.084 16.449 1.00 41.17 ? 59 PRO C N 1 ATOM 3729 C CA . PRO C 1 59 ? -38.691 20.545 16.594 1.00 38.24 ? 59 PRO C CA 1 ATOM 3730 C C . PRO C 1 59 ? -37.767 21.222 15.591 1.00 30.44 ? 59 PRO C C 1 ATOM 3731 O O . PRO C 1 59 ? -36.673 20.735 15.294 1.00 26.47 ? 59 PRO C O 1 ATOM 3732 C CB . PRO C 1 59 ? -38.223 20.769 18.038 1.00 35.94 ? 59 PRO C CB 1 ATOM 3733 C CG . PRO C 1 59 ? -37.660 19.454 18.492 1.00 29.89 ? 59 PRO C CG 1 ATOM 3734 C CD . PRO C 1 59 ? -38.404 18.411 17.729 1.00 34.61 ? 59 PRO C CD 1 ATOM 3735 N N . SER C 1 60 ? -38.225 22.361 15.070 1.00 31.19 ? 60 SER C N 1 ATOM 3736 C CA . SER C 1 60 ? -37.525 23.064 14.001 1.00 35.61 ? 60 SER C CA 1 ATOM 3737 C C . SER C 1 60 ? -36.165 23.602 14.425 1.00 36.35 ? 60 SER C C 1 ATOM 3738 O O . SER C 1 60 ? -35.385 24.007 13.555 1.00 27.90 ? 60 SER C O 1 ATOM 3739 C CB . SER C 1 60 ? -38.391 24.213 13.481 1.00 35.27 ? 60 SER C CB 1 ATOM 3740 O OG . SER C 1 60 ? -38.675 25.143 14.513 1.00 34.72 ? 60 SER C OG 1 ATOM 3741 N N . ARG C 1 61 ? -35.862 23.618 15.725 1.00 31.05 ? 61 ARG C N 1 ATOM 3742 C CA . ARG C 1 61 ? -34.565 24.094 16.188 1.00 28.02 ? 61 ARG C CA 1 ATOM 3743 C C . ARG C 1 61 ? -33.428 23.139 15.847 1.00 34.07 ? 61 ARG C C 1 ATOM 3744 O O . ARG C 1 61 ? -32.261 23.524 15.978 1.00 33.00 ? 61 ARG C O 1 ATOM 3745 C CB . ARG C 1 61 ? -34.604 24.337 17.697 1.00 39.22 ? 61 ARG C CB 1 ATOM 3746 C CG . ARG C 1 61 ? -34.853 23.092 18.523 1.00 39.56 ? 61 ARG C CG 1 ATOM 3747 C CD . ARG C 1 61 ? -34.750 23.391 20.007 1.00 35.61 ? 61 ARG C CD 1 ATOM 3748 N NE . ARG C 1 61 ? -34.854 22.176 20.807 1.00 42.15 ? 61 ARG C NE 1 ATOM 3749 C CZ . ARG C 1 61 ? -36.002 21.641 21.208 1.00 44.92 ? 61 ARG C CZ 1 ATOM 3750 N NH1 . ARG C 1 61 ? -37.153 22.217 20.883 1.00 40.11 ? 61 ARG C NH1 1 ATOM 3751 N NH2 . ARG C 1 61 ? -36.001 20.530 21.932 1.00 40.09 ? 61 ARG C NH2 1 ATOM 3752 N N . PHE C 1 62 ? -33.734 21.914 15.428 1.00 32.42 ? 62 PHE C N 1 ATOM 3753 C CA . PHE C 1 62 ? -32.730 20.993 14.913 1.00 29.18 ? 62 PHE C CA 1 ATOM 3754 C C . PHE C 1 62 ? -32.517 21.260 13.428 1.00 26.87 ? 62 PHE C C 1 ATOM 3755 O O . PHE C 1 62 ? -33.485 21.396 12.674 1.00 22.61 ? 62 PHE C O 1 ATOM 3756 C CB . PHE C 1 62 ? -33.157 19.539 15.121 1.00 31.73 ? 62 PHE C CB 1 ATOM 3757 C CG . PHE C 1 62 ? -33.123 19.088 16.553 1.00 31.01 ? 62 PHE C CG 1 ATOM 3758 C CD1 . PHE C 1 62 ? -31.929 18.716 17.146 1.00 20.05 ? 62 PHE C CD1 1 ATOM 3759 C CD2 . PHE C 1 62 ? -34.288 19.012 17.300 1.00 33.35 ? 62 PHE C CD2 1 ATOM 3760 C CE1 . PHE C 1 62 ? -31.895 18.290 18.458 1.00 24.91 ? 62 PHE C CE1 1 ATOM 3761 C CE2 . PHE C 1 62 ? -34.260 18.586 18.614 1.00 30.37 ? 62 PHE C CE2 1 ATOM 3762 C CZ . PHE C 1 62 ? -33.062 18.225 19.194 1.00 27.23 ? 62 PHE C CZ 1 ATOM 3763 N N . SER C 1 63 ? -31.254 21.337 13.013 1.00 22.25 ? 63 SER C N 1 ATOM 3764 C CA . SER C 1 63 ? -30.929 21.472 11.601 1.00 28.66 ? 63 SER C CA 1 ATOM 3765 C C . SER C 1 63 ? -29.566 20.846 11.345 1.00 31.59 ? 63 SER C C 1 ATOM 3766 O O . SER C 1 63 ? -28.769 20.644 12.265 1.00 18.73 ? 63 SER C O 1 ATOM 3767 C CB . SER C 1 63 ? -30.933 22.937 11.146 1.00 22.18 ? 63 SER C CB 1 ATOM 3768 O OG . SER C 1 63 ? -29.731 23.590 11.511 1.00 30.41 ? 63 SER C OG 1 ATOM 3769 N N . GLY C 1 64 ? -29.307 20.545 10.074 1.00 23.89 ? 64 GLY C N 1 ATOM 3770 C CA . GLY C 1 64 ? -28.046 19.953 9.685 1.00 22.45 ? 64 GLY C CA 1 ATOM 3771 C C . GLY C 1 64 ? -27.479 20.632 8.454 1.00 25.28 ? 64 GLY C C 1 ATOM 3772 O O . GLY C 1 64 ? -28.197 21.255 7.669 1.00 31.26 ? 64 GLY C O 1 ATOM 3773 N N . SER C 1 65 ? -26.163 20.499 8.303 1.00 22.99 ? 65 SER C N 1 ATOM 3774 C CA . SER C 1 65 ? -25.452 21.055 7.162 1.00 24.84 ? 65 SER C CA 1 ATOM 3775 C C . SER C 1 65 ? -24.211 20.217 6.900 1.00 23.54 ? 65 SER C C 1 ATOM 3776 O O . SER C 1 65 ? -23.720 19.507 7.782 1.00 24.71 ? 65 SER C O 1 ATOM 3777 C CB . SER C 1 65 ? -25.057 22.519 7.393 1.00 26.82 ? 65 SER C CB 1 ATOM 3778 O OG . SER C 1 65 ? -24.053 22.620 8.388 1.00 29.23 ? 65 SER C OG 1 ATOM 3779 N N . GLY C 1 66 ? -23.704 20.310 5.674 1.00 26.09 ? 66 GLY C N 1 ATOM 3780 C CA . GLY C 1 66 ? -22.472 19.632 5.322 1.00 28.52 ? 66 GLY C CA 1 ATOM 3781 C C . GLY C 1 66 ? -22.557 18.799 4.061 1.00 27.93 ? 66 GLY C C 1 ATOM 3782 O O . GLY C 1 66 ? -23.650 18.438 3.614 1.00 31.13 ? 66 GLY C O 1 ATOM 3783 N N . SER C 1 67 ? -21.399 18.491 3.481 1.00 30.64 ? 67 SER C N 1 ATOM 3784 C CA . SER C 1 67 ? -21.298 17.663 2.288 1.00 28.88 ? 67 SER C CA 1 ATOM 3785 C C . SER C 1 67 ? -19.843 17.260 2.106 1.00 30.80 ? 67 SER C C 1 ATOM 3786 O O . SER C 1 67 ? -18.940 18.065 2.346 1.00 31.62 ? 67 SER C O 1 ATOM 3787 C CB . SER C 1 67 ? -21.806 18.402 1.043 1.00 32.43 ? 67 SER C CB 1 ATOM 3788 O OG . SER C 1 67 ? -21.091 19.606 0.835 1.00 47.05 ? 67 SER C OG 1 ATOM 3789 N N . GLY C 1 68 ? -19.626 16.017 1.685 1.00 27.83 ? 68 GLY C N 1 ATOM 3790 C CA . GLY C 1 68 ? -18.280 15.513 1.506 1.00 24.27 ? 68 GLY C CA 1 ATOM 3791 C C . GLY C 1 68 ? -17.800 14.688 2.681 1.00 30.21 ? 68 GLY C C 1 ATOM 3792 O O . GLY C 1 68 ? -18.026 13.474 2.726 1.00 32.09 ? 68 GLY C O 1 ATOM 3793 N N . THR C 1 69 ? -17.138 15.338 3.645 1.00 30.63 ? 69 THR C N 1 ATOM 3794 C CA . THR C 1 69 ? -16.632 14.646 4.828 1.00 30.75 ? 69 THR C CA 1 ATOM 3795 C C . THR C 1 69 ? -17.028 15.317 6.136 1.00 28.91 ? 69 THR C C 1 ATOM 3796 O O . THR C 1 69 ? -17.267 14.619 7.124 1.00 33.62 ? 69 THR C O 1 ATOM 3797 C CB . THR C 1 69 ? -15.095 14.520 4.765 1.00 36.86 ? 69 THR C CB 1 ATOM 3798 O OG1 . THR C 1 69 ? -14.506 15.823 4.635 1.00 34.55 ? 69 THR C OG1 1 ATOM 3799 C CG2 . THR C 1 69 ? -14.671 13.654 3.590 1.00 23.51 ? 69 THR C CG2 1 ATOM 3800 N N . ASP C 1 70 ? -17.098 16.647 6.178 1.00 31.89 ? 70 ASP C N 1 ATOM 3801 C CA . ASP C 1 70 ? -17.402 17.358 7.415 1.00 31.65 ? 70 ASP C CA 1 ATOM 3802 C C . ASP C 1 70 ? -18.891 17.674 7.474 1.00 28.75 ? 70 ASP C C 1 ATOM 3803 O O . ASP C 1 70 ? -19.419 18.372 6.602 1.00 34.73 ? 70 ASP C O 1 ATOM 3804 C CB . ASP C 1 70 ? -16.575 18.637 7.527 1.00 42.35 ? 70 ASP C CB 1 ATOM 3805 C CG . ASP C 1 70 ? -15.083 18.375 7.449 1.00 53.87 ? 70 ASP C CG 1 ATOM 3806 O OD1 . ASP C 1 70 ? -14.673 17.200 7.550 1.00 51.64 ? 70 ASP C OD1 1 ATOM 3807 O OD2 . ASP C 1 70 ? -14.313 19.348 7.293 1.00 60.53 ? 70 ASP C OD2 1 ATOM 3808 N N . PHE C 1 71 ? -19.562 17.163 8.504 1.00 17.80 ? 71 PHE C N 1 ATOM 3809 C CA . PHE C 1 71 ? -20.989 17.362 8.693 1.00 18.94 ? 71 PHE C CA 1 ATOM 3810 C C . PHE C 1 71 ? -21.246 17.941 10.076 1.00 22.53 ? 71 PHE C C 1 ATOM 3811 O O . PHE C 1 71 ? -20.408 17.850 10.977 1.00 17.29 ? 71 PHE C O 1 ATOM 3812 C CB . PHE C 1 71 ? -21.763 16.053 8.507 1.00 24.30 ? 71 PHE C CB 1 ATOM 3813 C CG . PHE C 1 71 ? -21.521 15.404 7.179 1.00 25.46 ? 71 PHE C CG 1 ATOM 3814 C CD1 . PHE C 1 71 ? -22.288 15.744 6.078 1.00 23.09 ? 71 PHE C CD1 1 ATOM 3815 C CD2 . PHE C 1 71 ? -20.514 14.468 7.026 1.00 26.92 ? 71 PHE C CD2 1 ATOM 3816 C CE1 . PHE C 1 71 ? -22.061 15.153 4.851 1.00 27.71 ? 71 PHE C CE1 1 ATOM 3817 C CE2 . PHE C 1 71 ? -20.283 13.875 5.802 1.00 30.35 ? 71 PHE C CE2 1 ATOM 3818 C CZ . PHE C 1 71 ? -21.058 14.217 4.713 1.00 31.13 ? 71 PHE C CZ 1 ATOM 3819 N N . THR C 1 72 ? -22.427 18.534 10.234 1.00 22.71 ? 72 THR C N 1 ATOM 3820 C CA . THR C 1 72 ? -22.738 19.295 11.434 1.00 21.65 ? 72 THR C CA 1 ATOM 3821 C C . THR C 1 72 ? -24.213 19.155 11.771 1.00 28.63 ? 72 THR C C 1 ATOM 3822 O O . THR C 1 72 ? -25.069 19.314 10.897 1.00 42.84 ? 72 THR C O 1 ATOM 3823 C CB . THR C 1 72 ? -22.382 20.774 11.246 1.00 18.67 ? 72 THR C CB 1 ATOM 3824 O OG1 . THR C 1 72 ? -20.975 20.902 11.006 1.00 26.45 ? 72 THR C OG1 1 ATOM 3825 C CG2 . THR C 1 72 ? -22.763 21.580 12.481 1.00 19.35 ? 72 THR C CG2 1 ATOM 3826 N N . LEU C 1 73 ? -24.499 18.854 13.034 1.00 22.07 ? 73 LEU C N 1 ATOM 3827 C CA . LEU C 1 73 ? -25.848 18.907 13.580 1.00 21.26 ? 73 LEU C CA 1 ATOM 3828 C C . LEU C 1 73 ? -25.948 20.136 14.470 1.00 22.92 ? 73 LEU C C 1 ATOM 3829 O O . LEU C 1 73 ? -25.085 20.354 15.326 1.00 29.54 ? 73 LEU C O 1 ATOM 3830 C CB . LEU C 1 73 ? -26.179 17.640 14.372 1.00 25.46 ? 73 LEU C CB 1 ATOM 3831 C CG . LEU C 1 73 ? -27.565 17.593 15.022 1.00 31.79 ? 73 LEU C CG 1 ATOM 3832 C CD1 . LEU C 1 73 ? -28.650 17.628 13.961 1.00 33.39 ? 73 LEU C CD1 1 ATOM 3833 C CD2 . LEU C 1 73 ? -27.717 16.363 15.910 1.00 32.02 ? 73 LEU C CD2 1 ATOM 3834 N N . SER C 1 74 ? -26.987 20.941 14.263 1.00 23.27 ? 74 SER C N 1 ATOM 3835 C CA . SER C 1 74 ? -27.123 22.220 14.947 1.00 26.24 ? 74 SER C CA 1 ATOM 3836 C C . SER C 1 74 ? -28.434 22.286 15.713 1.00 22.12 ? 74 SER C C 1 ATOM 3837 O O . SER C 1 74 ? -29.493 21.934 15.181 1.00 29.25 ? 74 SER C O 1 ATOM 3838 C CB . SER C 1 74 ? -27.043 23.390 13.960 1.00 27.04 ? 74 SER C CB 1 ATOM 3839 O OG . SER C 1 74 ? -25.701 23.809 13.778 1.00 30.04 ? 74 SER C OG 1 ATOM 3840 N N . ILE C 1 75 ? -28.352 22.736 16.961 1.00 22.00 ? 75 ILE C N 1 ATOM 3841 C CA . ILE C 1 75 ? -29.508 23.133 17.754 1.00 27.77 ? 75 ILE C CA 1 ATOM 3842 C C . ILE C 1 75 ? -29.324 24.614 18.049 1.00 30.44 ? 75 ILE C C 1 ATOM 3843 O O . ILE C 1 75 ? -28.405 24.991 18.788 1.00 40.10 ? 75 ILE C O 1 ATOM 3844 C CB . ILE C 1 75 ? -29.632 22.323 19.050 1.00 29.55 ? 75 ILE C CB 1 ATOM 3845 C CG1 . ILE C 1 75 ? -29.382 20.837 18.776 1.00 26.22 ? 75 ILE C CG1 1 ATOM 3846 C CG2 . ILE C 1 75 ? -31.005 22.532 19.672 1.00 29.26 ? 75 ILE C CG2 1 ATOM 3847 C CD1 . ILE C 1 75 ? -29.239 20.001 20.026 1.00 20.99 ? 75 ILE C CD1 1 ATOM 3848 N N . ASN C 1 76 ? -30.185 25.457 17.469 1.00 39.47 ? 76 ASN C N 1 ATOM 3849 C CA . ASN C 1 76 ? -29.952 26.899 17.537 1.00 56.61 ? 76 ASN C CA 1 ATOM 3850 C C . ASN C 1 76 ? -30.063 27.418 18.968 1.00 57.00 ? 76 ASN C C 1 ATOM 3851 O O . ASN C 1 76 ? -29.233 28.223 19.408 1.00 62.73 ? 76 ASN C O 1 ATOM 3852 C CB . ASN C 1 76 ? -30.917 27.644 16.606 1.00 57.09 ? 76 ASN C CB 1 ATOM 3853 C CG . ASN C 1 76 ? -32.379 27.449 16.979 1.00 55.46 ? 76 ASN C CG 1 ATOM 3854 O OD1 . ASN C 1 76 ? -32.704 26.816 17.982 1.00 61.52 ? 76 ASN C OD1 1 ATOM 3855 N ND2 . ASN C 1 76 ? -33.270 28.011 16.170 1.00 49.48 ? 76 ASN C ND2 1 ATOM 3856 N N . SER C 1 77 ? -31.070 26.965 19.710 1.00 47.54 ? 77 SER C N 1 ATOM 3857 C CA . SER C 1 77 ? -31.279 27.378 21.097 1.00 42.67 ? 77 SER C CA 1 ATOM 3858 C C . SER C 1 77 ? -31.559 26.118 21.909 1.00 30.52 ? 77 SER C C 1 ATOM 3859 O O . SER C 1 77 ? -32.695 25.635 21.945 1.00 30.71 ? 77 SER C O 1 ATOM 3860 C CB . SER C 1 77 ? -32.419 28.386 21.209 1.00 41.82 ? 77 SER C CB 1 ATOM 3861 O OG . SER C 1 77 ? -32.542 28.875 22.533 1.00 39.95 ? 77 SER C OG 1 ATOM 3862 N N . VAL C 1 78 ? -30.519 25.592 22.557 1.00 22.77 ? 78 VAL C N 1 ATOM 3863 C CA . VAL C 1 78 ? -30.627 24.312 23.244 1.00 30.55 ? 78 VAL C CA 1 ATOM 3864 C C . VAL C 1 78 ? -31.514 24.452 24.474 1.00 31.79 ? 78 VAL C C 1 ATOM 3865 O O . VAL C 1 78 ? -31.524 25.493 25.147 1.00 34.94 ? 78 VAL C O 1 ATOM 3866 C CB . VAL C 1 78 ? -29.227 23.792 23.614 1.00 30.99 ? 78 VAL C CB 1 ATOM 3867 C CG1 . VAL C 1 78 ? -28.527 24.760 24.558 1.00 38.99 ? 78 VAL C CG1 1 ATOM 3868 C CG2 . VAL C 1 78 ? -29.304 22.400 24.221 1.00 26.12 ? 78 VAL C CG2 1 ATOM 3869 N N . GLU C 1 79 ? -32.277 23.405 24.767 1.00 30.07 ? 79 GLU C N 1 ATOM 3870 C CA . GLU C 1 79 ? -33.132 23.362 25.940 1.00 38.49 ? 79 GLU C CA 1 ATOM 3871 C C . GLU C 1 79 ? -32.733 22.182 26.816 1.00 32.19 ? 79 GLU C C 1 ATOM 3872 O O . GLU C 1 79 ? -32.075 21.240 26.363 1.00 25.38 ? 79 GLU C O 1 ATOM 3873 C CB . GLU C 1 79 ? -34.614 23.255 25.545 1.00 41.88 ? 79 GLU C CB 1 ATOM 3874 C CG . GLU C 1 79 ? -35.131 24.422 24.709 1.00 48.50 ? 79 GLU C CG 1 ATOM 3875 C CD . GLU C 1 79 ? -36.520 24.171 24.150 1.00 53.39 ? 79 GLU C CD 1 ATOM 3876 O OE1 . GLU C 1 79 ? -36.960 23.000 24.153 1.00 53.36 ? 79 GLU C OE1 1 ATOM 3877 O OE2 . GLU C 1 79 ? -37.173 25.139 23.708 1.00 54.94 ? 79 GLU C OE2 1 ATOM 3878 N N . SER C 1 80 ? -33.199 22.223 28.069 1.00 33.11 ? 80 SER C N 1 ATOM 3879 C CA . SER C 1 80 ? -32.923 21.136 29.001 1.00 31.89 ? 80 SER C CA 1 ATOM 3880 C C . SER C 1 80 ? -33.508 19.818 28.519 1.00 24.51 ? 80 SER C C 1 ATOM 3881 O O . SER C 1 80 ? -32.941 18.756 28.787 1.00 19.10 ? 80 SER C O 1 ATOM 3882 C CB . SER C 1 80 ? -33.465 21.473 30.389 1.00 41.54 ? 80 SER C CB 1 ATOM 3883 O OG . SER C 1 80 ? -34.857 21.733 30.338 1.00 52.45 ? 80 SER C OG 1 ATOM 3884 N N . GLU C 1 81 ? -34.625 19.861 27.800 1.00 37.99 ? 81 GLU C N 1 ATOM 3885 C CA . GLU C 1 81 ? -35.202 18.630 27.285 1.00 39.42 ? 81 GLU C CA 1 ATOM 3886 C C . GLU C 1 81 ? -34.331 17.965 26.223 1.00 34.41 ? 81 GLU C C 1 ATOM 3887 O O . GLU C 1 81 ? -34.568 16.797 25.891 1.00 31.22 ? 81 GLU C O 1 ATOM 3888 C CB . GLU C 1 81 ? -36.596 18.925 26.747 1.00 47.08 ? 81 GLU C CB 1 ATOM 3889 C CG . GLU C 1 81 ? -36.633 19.589 25.404 1.00 61.36 ? 81 GLU C CG 1 ATOM 3890 C CD . GLU C 1 81 ? -38.043 19.599 24.781 1.00 73.45 ? 81 GLU C CD 1 ATOM 3891 O OE1 . GLU C 1 81 ? -38.202 20.164 23.678 1.00 78.59 ? 81 GLU C OE1 1 ATOM 3892 O OE2 . GLU C 1 81 ? -38.993 19.059 25.390 1.00 76.00 ? 81 GLU C OE2 1 ATOM 3893 N N . ASP C 1 82 ? -33.314 18.659 25.717 1.00 39.58 ? 82 ASP C N 1 ATOM 3894 C CA . ASP C 1 82 ? -32.418 18.115 24.705 1.00 32.99 ? 82 ASP C CA 1 ATOM 3895 C C . ASP C 1 82 ? -31.275 17.293 25.283 1.00 24.42 ? 82 ASP C C 1 ATOM 3896 O O . ASP C 1 82 ? -30.413 16.849 24.516 1.00 26.49 ? 82 ASP C O 1 ATOM 3897 C CB . ASP C 1 82 ? -31.826 19.243 23.854 1.00 24.70 ? 82 ASP C CB 1 ATOM 3898 C CG . ASP C 1 82 ? -32.881 20.023 23.105 1.00 28.36 ? 82 ASP C CG 1 ATOM 3899 O OD1 . ASP C 1 82 ? -33.919 19.419 22.758 1.00 28.05 ? 82 ASP C OD1 1 ATOM 3900 O OD2 . ASP C 1 82 ? -32.688 21.242 22.875 1.00 31.80 ? 82 ASP C OD2 1 ATOM 3901 N N . ILE C 1 83 ? -31.224 17.091 26.599 1.00 23.33 ? 83 ILE C N 1 ATOM 3902 C CA . ILE C 1 83 ? -30.130 16.315 27.178 1.00 20.85 ? 83 ILE C CA 1 ATOM 3903 C C . ILE C 1 83 ? -30.231 14.875 26.699 1.00 20.14 ? 83 ILE C C 1 ATOM 3904 O O . ILE C 1 83 ? -31.185 14.161 27.028 1.00 24.94 ? 83 ILE C O 1 ATOM 3905 C CB . ILE C 1 83 ? -30.158 16.401 28.707 1.00 33.94 ? 83 ILE C CB 1 ATOM 3906 C CG1 . ILE C 1 83 ? -29.916 17.843 29.158 1.00 43.76 ? 83 ILE C CG1 1 ATOM 3907 C CG2 . ILE C 1 83 ? -29.131 15.456 29.316 1.00 36.57 ? 83 ILE C CG2 1 ATOM 3908 C CD1 . ILE C 1 83 ? -30.223 18.087 30.618 1.00 40.12 ? 83 ILE C CD1 1 ATOM 3909 N N . ALA C 1 84 ? -29.249 14.443 25.918 1.00 17.35 ? 84 ALA C N 1 ATOM 3910 C CA . ALA C 1 84 ? -29.238 13.102 25.338 1.00 16.60 ? 84 ALA C CA 1 ATOM 3911 C C . ALA C 1 84 ? -27.869 12.869 24.709 1.00 15.40 ? 84 ALA C C 1 ATOM 3912 O O . ALA C 1 84 ? -26.946 13.678 24.867 1.00 18.57 ? 84 ALA C O 1 ATOM 3913 C CB . ALA C 1 84 ? -30.364 12.930 24.316 1.00 15.31 ? 84 ALA C CB 1 ATOM 3914 N N . ASP C 1 85 ? -27.737 11.752 24.001 1.00 24.09 ? 85 ASP C N 1 ATOM 3915 C CA . ASP C 1 85 ? -26.586 11.473 23.160 1.00 19.62 ? 85 ASP C CA 1 ATOM 3916 C C . ASP C 1 85 ? -27.006 11.582 21.701 1.00 21.15 ? 85 ASP C C 1 ATOM 3917 O O . ASP C 1 85 ? -28.145 11.270 21.343 1.00 38.91 ? 85 ASP C O 1 ATOM 3918 C CB . ASP C 1 85 ? -26.013 10.082 23.444 1.00 19.83 ? 85 ASP C CB 1 ATOM 3919 C CG . ASP C 1 85 ? -25.692 9.875 24.910 1.00 24.97 ? 85 ASP C CG 1 ATOM 3920 O OD1 . ASP C 1 85 ? -25.345 10.868 25.585 1.00 28.24 ? 85 ASP C OD1 1 ATOM 3921 O OD2 . ASP C 1 85 ? -25.789 8.723 25.386 1.00 26.34 ? 85 ASP C OD2 1 ATOM 3922 N N . TYR C 1 86 ? -26.080 12.030 20.859 1.00 15.83 ? 86 TYR C N 1 ATOM 3923 C CA . TYR C 1 86 ? -26.374 12.304 19.460 1.00 29.10 ? 86 TYR C CA 1 ATOM 3924 C C . TYR C 1 86 ? -25.391 11.553 18.575 1.00 22.39 ? 86 TYR C C 1 ATOM 3925 O O . TYR C 1 86 ? -24.175 11.668 18.755 1.00 27.94 ? 86 TYR C O 1 ATOM 3926 C CB . TYR C 1 86 ? -26.333 13.812 19.189 1.00 27.99 ? 86 TYR C CB 1 ATOM 3927 C CG . TYR C 1 86 ? -27.444 14.551 19.904 1.00 22.17 ? 86 TYR C CG 1 ATOM 3928 C CD1 . TYR C 1 86 ? -27.289 14.983 21.214 1.00 19.24 ? 86 TYR C CD1 1 ATOM 3929 C CD2 . TYR C 1 86 ? -28.657 14.790 19.276 1.00 28.47 ? 86 TYR C CD2 1 ATOM 3930 C CE1 . TYR C 1 86 ? -28.309 15.646 21.873 1.00 25.85 ? 86 TYR C CE1 1 ATOM 3931 C CE2 . TYR C 1 86 ? -29.681 15.453 19.926 1.00 34.45 ? 86 TYR C CE2 1 ATOM 3932 C CZ . TYR C 1 86 ? -29.504 15.877 21.223 1.00 36.08 ? 86 TYR C CZ 1 ATOM 3933 O OH . TYR C 1 86 ? -30.525 16.536 21.870 1.00 38.44 ? 86 TYR C OH 1 ATOM 3934 N N . TYR C 1 87 ? -25.922 10.784 17.625 1.00 16.35 ? 87 TYR C N 1 ATOM 3935 C CA . TYR C 1 87 ? -25.125 9.931 16.755 1.00 25.27 ? 87 TYR C CA 1 ATOM 3936 C C . TYR C 1 87 ? -25.336 10.313 15.297 1.00 25.55 ? 87 TYR C C 1 ATOM 3937 O O . TYR C 1 87 ? -26.424 10.741 14.902 1.00 28.18 ? 87 TYR C O 1 ATOM 3938 C CB . TYR C 1 87 ? -25.488 8.451 16.933 1.00 26.97 ? 87 TYR C CB 1 ATOM 3939 C CG . TYR C 1 87 ? -25.220 7.895 18.311 1.00 28.90 ? 87 TYR C CG 1 ATOM 3940 C CD1 . TYR C 1 87 ? -26.181 7.965 19.310 1.00 21.49 ? 87 TYR C CD1 1 ATOM 3941 C CD2 . TYR C 1 87 ? -24.009 7.285 18.609 1.00 24.89 ? 87 TYR C CD2 1 ATOM 3942 C CE1 . TYR C 1 87 ? -25.937 7.452 20.572 1.00 24.31 ? 87 TYR C CE1 1 ATOM 3943 C CE2 . TYR C 1 87 ? -23.758 6.769 19.865 1.00 27.11 ? 87 TYR C CE2 1 ATOM 3944 C CZ . TYR C 1 87 ? -24.723 6.855 20.843 1.00 21.60 ? 87 TYR C CZ 1 ATOM 3945 O OH . TYR C 1 87 ? -24.472 6.339 22.094 1.00 20.94 ? 87 TYR C OH 1 ATOM 3946 N N . CYS C 1 88 ? -24.288 10.141 14.496 1.00 17.24 ? 88 CYS C N 1 ATOM 3947 C CA . CYS C 1 88 ? -24.392 10.237 13.048 1.00 26.55 ? 88 CYS C CA 1 ATOM 3948 C C . CYS C 1 88 ? -24.219 8.857 12.420 1.00 25.31 ? 88 CYS C C 1 ATOM 3949 O O . CYS C 1 88 ? -23.612 7.952 13.001 1.00 19.74 ? 88 CYS C O 1 ATOM 3950 C CB . CYS C 1 88 ? -23.366 11.226 12.470 1.00 21.37 ? 88 CYS C CB 1 ATOM 3951 S SG . CYS C 1 88 ? -21.614 10.841 12.743 1.00 34.16 ? 88 CYS C SG 1 ATOM 3952 N N . GLN C 1 89 ? -24.780 8.705 11.221 1.00 32.52 ? 89 GLN C N 1 ATOM 3953 C CA . GLN C 1 89 ? -24.760 7.444 10.490 1.00 25.95 ? 89 GLN C CA 1 ATOM 3954 C C . GLN C 1 89 ? -24.554 7.736 9.014 1.00 23.41 ? 89 GLN C C 1 ATOM 3955 O O . GLN C 1 89 ? -25.197 8.638 8.471 1.00 22.55 ? 89 GLN C O 1 ATOM 3956 C CB . GLN C 1 89 ? -26.068 6.669 10.686 1.00 23.47 ? 89 GLN C CB 1 ATOM 3957 C CG . GLN C 1 89 ? -26.272 5.544 9.683 1.00 20.68 ? 89 GLN C CG 1 ATOM 3958 C CD . GLN C 1 89 ? -27.738 5.258 9.408 1.00 27.72 ? 89 GLN C CD 1 ATOM 3959 O OE1 . GLN C 1 89 ? -28.617 6.033 9.789 1.00 19.47 ? 89 GLN C OE1 1 ATOM 3960 N NE2 . GLN C 1 89 ? -28.009 4.143 8.738 1.00 35.81 ? 89 GLN C NE2 1 ATOM 3961 N N . GLN C 1 90 ? -23.670 6.980 8.368 1.00 26.61 ? 90 GLN C N 1 ATOM 3962 C CA . GLN C 1 90 ? -23.443 7.100 6.936 1.00 19.26 ? 90 GLN C CA 1 ATOM 3963 C C . GLN C 1 90 ? -24.041 5.896 6.220 1.00 19.31 ? 90 GLN C C 1 ATOM 3964 O O . GLN C 1 90 ? -24.039 4.779 6.744 1.00 19.07 ? 90 GLN C O 1 ATOM 3965 C CB . GLN C 1 90 ? -21.945 7.222 6.610 1.00 19.65 ? 90 GLN C CB 1 ATOM 3966 C CG . GLN C 1 90 ? -21.107 5.963 6.846 1.00 19.62 ? 90 GLN C CG 1 ATOM 3967 C CD . GLN C 1 90 ? -21.165 4.970 5.685 1.00 34.82 ? 90 GLN C CD 1 ATOM 3968 O OE1 . GLN C 1 90 ? -21.354 5.355 4.530 1.00 20.34 ? 90 GLN C OE1 1 ATOM 3969 N NE2 . GLN C 1 90 ? -21.018 3.684 5.996 1.00 19.85 ? 90 GLN C NE2 1 ATOM 3970 N N . ASN C 1 91 ? -24.563 6.134 5.015 1.00 30.24 ? 91 ASN C N 1 ATOM 3971 C CA . ASN C 1 91 ? -25.031 5.037 4.173 1.00 27.85 ? 91 ASN C CA 1 ATOM 3972 C C . ASN C 1 91 ? -24.738 5.336 2.706 1.00 29.46 ? 91 ASN C C 1 ATOM 3973 O O . ASN C 1 91 ? -25.580 5.120 1.827 1.00 23.38 ? 91 ASN C O 1 ATOM 3974 C CB . ASN C 1 91 ? -26.518 4.747 4.394 1.00 25.71 ? 91 ASN C CB 1 ATOM 3975 C CG . ASN C 1 91 ? -26.966 3.470 3.714 1.00 33.85 ? 91 ASN C CG 1 ATOM 3976 O OD1 . ASN C 1 91 ? -27.951 3.463 2.978 1.00 44.38 ? 91 ASN C OD1 1 ATOM 3977 N ND2 . ASN C 1 91 ? -26.223 2.391 3.929 1.00 26.83 ? 91 ASN C ND2 1 ATOM 3978 N N . ASN C 1 92 ? -23.540 5.848 2.431 1.00 35.18 ? 92 ASN C N 1 ATOM 3979 C CA . ASN C 1 92 ? -23.041 5.943 1.069 1.00 33.97 ? 92 ASN C CA 1 ATOM 3980 C C . ASN C 1 92 ? -22.250 4.707 0.664 1.00 29.54 ? 92 ASN C C 1 ATOM 3981 O O . ASN C 1 92 ? -22.160 4.404 -0.532 1.00 25.40 ? 92 ASN C O 1 ATOM 3982 C CB . ASN C 1 92 ? -22.168 7.194 0.919 1.00 31.17 ? 92 ASN C CB 1 ATOM 3983 C CG . ASN C 1 92 ? -21.782 7.473 -0.519 1.00 22.47 ? 92 ASN C CG 1 ATOM 3984 O OD1 . ASN C 1 92 ? -22.574 8.009 -1.292 1.00 27.05 ? 92 ASN C OD1 1 ATOM 3985 N ND2 . ASN C 1 92 ? -20.552 7.127 -0.879 1.00 22.84 ? 92 ASN C ND2 1 ATOM 3986 N N . ASN C 1 93 ? -21.696 3.982 1.635 1.00 23.50 ? 93 ASN C N 1 ATOM 3987 C CA . ASN C 1 93 ? -20.963 2.746 1.395 1.00 27.25 ? 93 ASN C CA 1 ATOM 3988 C C . ASN C 1 93 ? -21.524 1.645 2.281 1.00 21.15 ? 93 ASN C C 1 ATOM 3989 O O . ASN C 1 93 ? -21.770 1.865 3.470 1.00 21.73 ? 93 ASN C O 1 ATOM 3990 C CB . ASN C 1 93 ? -19.465 2.925 1.667 1.00 28.49 ? 93 ASN C CB 1 ATOM 3991 C CG . ASN C 1 93 ? -18.733 3.563 0.503 1.00 43.64 ? 93 ASN C CG 1 ATOM 3992 O OD1 . ASN C 1 93 ? -18.744 4.784 0.341 1.00 47.63 ? 93 ASN C OD1 1 ATOM 3993 N ND2 . ASN C 1 93 ? -18.085 2.738 -0.313 1.00 40.44 ? 93 ASN C ND2 1 ATOM 3994 N N . TRP C 1 94 ? -21.725 0.469 1.701 1.00 31.68 ? 94 TRP C N 1 ATOM 3995 C CA . TRP C 1 94 ? -22.180 -0.694 2.451 1.00 26.96 ? 94 TRP C CA 1 ATOM 3996 C C . TRP C 1 94 ? -21.007 -1.287 3.223 1.00 30.58 ? 94 TRP C C 1 ATOM 3997 O O . TRP C 1 94 ? -19.915 -1.432 2.674 1.00 38.09 ? 94 TRP C O 1 ATOM 3998 C CB . TRP C 1 94 ? -22.789 -1.735 1.506 1.00 21.70 ? 94 TRP C CB 1 ATOM 3999 C CG . TRP C 1 94 ? -23.526 -2.849 2.191 1.00 28.22 ? 94 TRP C CG 1 ATOM 4000 C CD1 . TRP C 1 94 ? -24.876 -2.946 2.380 1.00 21.42 ? 94 TRP C CD1 1 ATOM 4001 C CD2 . TRP C 1 94 ? -22.956 -4.031 2.767 1.00 31.56 ? 94 TRP C CD2 1 ATOM 4002 N NE1 . TRP C 1 94 ? -25.180 -4.112 3.039 1.00 21.52 ? 94 TRP C NE1 1 ATOM 4003 C CE2 . TRP C 1 94 ? -24.019 -4.795 3.290 1.00 30.40 ? 94 TRP C CE2 1 ATOM 4004 C CE3 . TRP C 1 94 ? -21.651 -4.518 2.890 1.00 22.21 ? 94 TRP C CE3 1 ATOM 4005 C CZ2 . TRP C 1 94 ? -23.815 -6.018 3.928 1.00 32.46 ? 94 TRP C CZ2 1 ATOM 4006 C CZ3 . TRP C 1 94 ? -21.452 -5.729 3.526 1.00 22.48 ? 94 TRP C CZ3 1 ATOM 4007 C CH2 . TRP C 1 94 ? -22.527 -6.466 4.036 1.00 24.71 ? 94 TRP C CH2 1 ATOM 4008 N N . PRO C 1 95 ? -21.224 -1.636 4.501 1.00 33.51 ? 95 PRO C N 1 ATOM 4009 C CA . PRO C 1 95 ? -22.486 -1.489 5.230 1.00 27.56 ? 95 PRO C CA 1 ATOM 4010 C C . PRO C 1 95 ? -22.621 -0.122 5.888 1.00 20.74 ? 95 PRO C C 1 ATOM 4011 O O . PRO C 1 95 ? -21.623 0.591 6.035 1.00 19.94 ? 95 PRO C O 1 ATOM 4012 C CB . PRO C 1 95 ? -22.397 -2.590 6.287 1.00 31.03 ? 95 PRO C CB 1 ATOM 4013 C CG . PRO C 1 95 ? -20.934 -2.657 6.598 1.00 27.08 ? 95 PRO C CG 1 ATOM 4014 C CD . PRO C 1 95 ? -20.200 -2.315 5.316 1.00 25.01 ? 95 PRO C CD 1 ATOM 4015 N N . THR C 1 96 ? -23.842 0.235 6.277 1.00 22.78 ? 96 THR C N 1 ATOM 4016 C CA . THR C 1 96 ? -24.056 1.487 6.987 1.00 19.12 ? 96 THR C CA 1 ATOM 4017 C C . THR C 1 96 ? -23.403 1.414 8.363 1.00 19.07 ? 96 THR C C 1 ATOM 4018 O O . THR C 1 96 ? -23.443 0.380 9.035 1.00 19.66 ? 96 THR C O 1 ATOM 4019 C CB . THR C 1 96 ? -25.555 1.787 7.107 1.00 18.90 ? 96 THR C CB 1 ATOM 4020 O OG1 . THR C 1 96 ? -25.748 3.051 7.751 1.00 18.58 ? 96 THR C OG1 1 ATOM 4021 C CG2 . THR C 1 96 ? -26.271 0.702 7.901 1.00 18.73 ? 96 THR C CG2 1 ATOM 4022 N N . THR C 1 97 ? -22.767 2.509 8.771 1.00 23.78 ? 97 THR C N 1 ATOM 4023 C CA . THR C 1 97 ? -22.042 2.546 10.031 1.00 26.95 ? 97 THR C CA 1 ATOM 4024 C C . THR C 1 97 ? -22.435 3.787 10.821 1.00 25.61 ? 97 THR C C 1 ATOM 4025 O O . THR C 1 97 ? -22.950 4.764 10.272 1.00 27.15 ? 97 THR C O 1 ATOM 4026 C CB . THR C 1 97 ? -20.519 2.522 9.816 1.00 18.80 ? 97 THR C CB 1 ATOM 4027 O OG1 . THR C 1 97 ? -20.140 3.575 8.923 1.00 25.40 ? 97 THR C OG1 1 ATOM 4028 C CG2 . THR C 1 97 ? -20.081 1.188 9.234 1.00 19.22 ? 97 THR C CG2 1 ATOM 4029 N N . PHE C 1 98 ? -22.180 3.732 12.126 1.00 25.63 ? 98 PHE C N 1 ATOM 4030 C CA . PHE C 1 98 ? -22.518 4.805 13.047 1.00 26.90 ? 98 PHE C CA 1 ATOM 4031 C C . PHE C 1 98 ? -21.256 5.346 13.707 1.00 27.81 ? 98 PHE C C 1 ATOM 4032 O O . PHE C 1 98 ? -20.237 4.655 13.802 1.00 28.63 ? 98 PHE C O 1 ATOM 4033 C CB . PHE C 1 98 ? -23.496 4.324 14.133 1.00 17.90 ? 98 PHE C CB 1 ATOM 4034 C CG . PHE C 1 98 ? -24.835 3.882 13.604 1.00 18.34 ? 98 PHE C CG 1 ATOM 4035 C CD1 . PHE C 1 98 ? -24.997 2.623 13.050 1.00 24.69 ? 98 PHE C CD1 1 ATOM 4036 C CD2 . PHE C 1 98 ? -25.937 4.721 13.684 1.00 23.58 ? 98 PHE C CD2 1 ATOM 4037 C CE1 . PHE C 1 98 ? -26.230 2.212 12.572 1.00 24.89 ? 98 PHE C CE1 1 ATOM 4038 C CE2 . PHE C 1 98 ? -27.174 4.317 13.208 1.00 22.59 ? 98 PHE C CE2 1 ATOM 4039 C CZ . PHE C 1 98 ? -27.321 3.061 12.651 1.00 20.86 ? 98 PHE C CZ 1 ATOM 4040 N N . GLY C 1 99 ? -21.331 6.596 14.163 1.00 25.67 ? 99 GLY C N 1 ATOM 4041 C CA . GLY C 1 99 ? -20.256 7.164 14.945 1.00 17.43 ? 99 GLY C CA 1 ATOM 4042 C C . GLY C 1 99 ? -20.340 6.760 16.408 1.00 16.98 ? 99 GLY C C 1 ATOM 4043 O O . GLY C 1 99 ? -21.301 6.139 16.860 1.00 25.10 ? 99 GLY C O 1 ATOM 4044 N N . ALA C 1 100 ? -19.298 7.122 17.159 1.00 17.11 ? 100 ALA C N 1 ATOM 4045 C CA . ALA C 1 100 ? -19.259 6.792 18.579 1.00 16.74 ? 100 ALA C CA 1 ATOM 4046 C C . ALA C 1 100 ? -20.203 7.659 19.402 1.00 21.36 ? 100 ALA C C 1 ATOM 4047 O O . ALA C 1 100 ? -20.548 7.284 20.528 1.00 15.97 ? 100 ALA C O 1 ATOM 4048 C CB . ALA C 1 100 ? -17.832 6.924 19.113 1.00 17.08 ? 100 ALA C CB 1 ATOM 4049 N N . GLY C 1 101 ? -20.621 8.804 18.877 1.00 27.47 ? 101 GLY C N 1 ATOM 4050 C CA . GLY C 1 101 ? -21.603 9.639 19.534 1.00 26.16 ? 101 GLY C CA 1 ATOM 4051 C C . GLY C 1 101 ? -20.977 10.755 20.353 1.00 27.61 ? 101 GLY C C 1 ATOM 4052 O O . GLY C 1 101 ? -19.775 10.786 20.625 1.00 28.17 ? 101 GLY C O 1 ATOM 4053 N N . THR C 1 102 ? -21.836 11.693 20.746 1.00 24.30 ? 102 THR C N 1 ATOM 4054 C CA . THR C 1 102 ? -21.451 12.835 21.563 1.00 18.07 ? 102 THR C CA 1 ATOM 4055 C C . THR C 1 102 ? -22.491 13.018 22.655 1.00 22.95 ? 102 THR C C 1 ATOM 4056 O O . THR C 1 102 ? -23.688 13.093 22.363 1.00 16.03 ? 102 THR C O 1 ATOM 4057 C CB . THR C 1 102 ? -21.337 14.112 20.719 1.00 31.82 ? 102 THR C CB 1 ATOM 4058 O OG1 . THR C 1 102 ? -20.085 14.118 20.021 1.00 38.73 ? 102 THR C OG1 1 ATOM 4059 C CG2 . THR C 1 102 ? -21.441 15.356 21.594 1.00 27.18 ? 102 THR C CG2 1 ATOM 4060 N N . LYS C 1 103 ? -22.041 13.078 23.906 1.00 27.28 ? 103 LYS C N 1 ATOM 4061 C CA . LYS C 1 103 ? -22.938 13.303 25.031 1.00 23.94 ? 103 LYS C CA 1 ATOM 4062 C C . LYS C 1 103 ? -23.141 14.800 25.227 1.00 25.98 ? 103 LYS C C 1 ATOM 4063 O O . LYS C 1 103 ? -22.173 15.569 25.249 1.00 32.77 ? 103 LYS C O 1 ATOM 4064 C CB . LYS C 1 103 ? -22.387 12.670 26.308 1.00 25.49 ? 103 LYS C CB 1 ATOM 4065 C CG . LYS C 1 103 ? -23.355 12.723 27.480 1.00 33.47 ? 103 LYS C CG 1 ATOM 4066 C CD . LYS C 1 103 ? -22.814 11.999 28.704 1.00 36.32 ? 103 LYS C CD 1 ATOM 4067 C CE . LYS C 1 103 ? -23.870 11.924 29.803 1.00 42.80 ? 103 LYS C CE 1 ATOM 4068 N NZ . LYS C 1 103 ? -23.363 11.270 31.043 1.00 47.35 ? 103 LYS C NZ 1 ATOM 4069 N N . LEU C 1 104 ? -24.399 15.208 25.364 1.00 20.48 ? 104 LEU C N 1 ATOM 4070 C CA . LEU C 1 104 ? -24.757 16.607 25.555 1.00 21.48 ? 104 LEU C CA 1 ATOM 4071 C C . LEU C 1 104 ? -25.089 16.842 27.023 1.00 24.68 ? 104 LEU C C 1 ATOM 4072 O O . LEU C 1 104 ? -26.014 16.226 27.563 1.00 16.88 ? 104 LEU C O 1 ATOM 4073 C CB . LEU C 1 104 ? -25.939 16.994 24.666 1.00 24.03 ? 104 LEU C CB 1 ATOM 4074 C CG . LEU C 1 104 ? -26.445 18.433 24.799 1.00 25.99 ? 104 LEU C CG 1 ATOM 4075 C CD1 . LEU C 1 104 ? -25.328 19.420 24.513 1.00 24.91 ? 104 LEU C CD1 1 ATOM 4076 C CD2 . LEU C 1 104 ? -27.637 18.685 23.881 1.00 25.13 ? 104 LEU C CD2 1 ATOM 4077 N N . GLU C 1 105 ? -24.329 17.726 27.663 1.00 28.21 ? 105 GLU C N 1 ATOM 4078 C CA . GLU C 1 105 ? -24.549 18.112 29.047 1.00 21.85 ? 105 GLU C CA 1 ATOM 4079 C C . GLU C 1 105 ? -24.899 19.591 29.106 1.00 20.98 ? 105 GLU C C 1 ATOM 4080 O O . GLU C 1 105 ? -24.281 20.412 28.421 1.00 23.64 ? 105 GLU C O 1 ATOM 4081 C CB . GLU C 1 105 ? -23.309 17.841 29.902 1.00 37.00 ? 105 GLU C CB 1 ATOM 4082 C CG . GLU C 1 105 ? -22.812 16.410 29.836 1.00 50.21 ? 105 GLU C CG 1 ATOM 4083 C CD . GLU C 1 105 ? -21.599 16.182 30.712 1.00 55.50 ? 105 GLU C CD 1 ATOM 4084 O OE1 . GLU C 1 105 ? -20.949 17.177 31.098 1.00 52.35 ? 105 GLU C OE1 1 ATOM 4085 O OE2 . GLU C 1 105 ? -21.297 15.009 31.018 1.00 59.71 ? 105 GLU C OE2 1 ATOM 4086 N N . LEU C 1 106 ? -25.889 19.928 29.924 1.00 21.42 ? 106 LEU C N 1 ATOM 4087 C CA . LEU C 1 106 ? -26.322 21.308 30.088 1.00 26.16 ? 106 LEU C CA 1 ATOM 4088 C C . LEU C 1 106 ? -25.876 21.833 31.444 1.00 28.24 ? 106 LEU C C 1 ATOM 4089 O O . LEU C 1 106 ? -26.019 21.147 32.462 1.00 31.29 ? 106 LEU C O 1 ATOM 4090 C CB . LEU C 1 106 ? -27.836 21.438 29.940 1.00 29.80 ? 106 LEU C CB 1 ATOM 4091 C CG . LEU C 1 106 ? -28.233 21.984 28.565 1.00 42.17 ? 106 LEU C CG 1 ATOM 4092 C CD1 . LEU C 1 106 ? -28.071 20.919 27.484 1.00 41.87 ? 106 LEU C CD1 1 ATOM 4093 C CD2 . LEU C 1 106 ? -29.640 22.557 28.573 1.00 45.07 ? 106 LEU C CD2 1 ATOM 4094 N N . LYS C 1 107 ? -25.327 23.041 31.449 1.00 31.92 ? 107 LYS C N 1 ATOM 4095 C CA . LYS C 1 107 ? -24.914 23.692 32.679 1.00 31.04 ? 107 LYS C CA 1 ATOM 4096 C C . LYS C 1 107 ? -26.090 24.428 33.308 1.00 30.84 ? 107 LYS C C 1 ATOM 4097 O O . LYS C 1 107 ? -27.070 24.773 32.645 1.00 29.95 ? 107 LYS C O 1 ATOM 4098 C CB . LYS C 1 107 ? -23.762 24.663 32.415 1.00 34.19 ? 107 LYS C CB 1 ATOM 4099 C CG . LYS C 1 107 ? -22.524 24.016 31.813 1.00 35.13 ? 107 LYS C CG 1 ATOM 4100 C CD . LYS C 1 107 ? -21.472 25.056 31.464 1.00 36.05 ? 107 LYS C CD 1 ATOM 4101 C CE . LYS C 1 107 ? -21.109 25.007 29.988 1.00 50.26 ? 107 LYS C CE 1 ATOM 4102 N NZ . LYS C 1 107 ? -20.065 26.016 29.649 1.00 48.31 ? 107 LYS C NZ 1 ATOM 4103 N N . ARG C 1 108 ? -25.983 24.657 34.611 1.00 30.72 ? 108 ARG C N 1 ATOM 4104 C CA . ARG C 1 108 ? -26.979 25.422 35.345 1.00 23.89 ? 108 ARG C CA 1 ATOM 4105 C C . ARG C 1 108 ? -26.325 25.943 36.617 1.00 22.10 ? 108 ARG C C 1 ATOM 4106 O O . ARG C 1 108 ? -25.167 25.638 36.914 1.00 28.45 ? 108 ARG C O 1 ATOM 4107 C CB . ARG C 1 108 ? -28.223 24.581 35.648 1.00 18.98 ? 108 ARG C CB 1 ATOM 4108 C CG . ARG C 1 108 ? -27.939 23.269 36.356 1.00 17.96 ? 108 ARG C CG 1 ATOM 4109 C CD . ARG C 1 108 ? -29.089 22.917 37.278 1.00 21.82 ? 108 ARG C CD 1 ATOM 4110 N NE . ARG C 1 108 ? -29.270 23.940 38.304 1.00 21.76 ? 108 ARG C NE 1 ATOM 4111 C CZ . ARG C 1 108 ? -30.414 24.165 38.940 1.00 26.90 ? 108 ARG C CZ 1 ATOM 4112 N NH1 . ARG C 1 108 ? -31.488 23.443 38.649 1.00 26.31 ? 108 ARG C NH1 1 ATOM 4113 N NH2 . ARG C 1 108 ? -30.487 25.120 39.859 1.00 29.40 ? 108 ARG C NH2 1 ATOM 4114 N N . THR C 1 109 ? -27.078 26.741 37.366 1.00 30.40 ? 109 THR C N 1 ATOM 4115 C CA . THR C 1 109 ? -26.562 27.289 38.608 1.00 30.90 ? 109 THR C CA 1 ATOM 4116 C C . THR C 1 109 ? -26.354 26.177 39.633 1.00 24.31 ? 109 THR C C 1 ATOM 4117 O O . THR C 1 109 ? -26.923 25.087 39.535 1.00 18.82 ? 109 THR C O 1 ATOM 4118 C CB . THR C 1 109 ? -27.511 28.352 39.159 1.00 30.83 ? 109 THR C CB 1 ATOM 4119 O OG1 . THR C 1 109 ? -28.838 27.817 39.235 1.00 29.88 ? 109 THR C OG1 1 ATOM 4120 C CG2 . THR C 1 109 ? -27.516 29.575 38.255 1.00 22.67 ? 109 THR C CG2 1 ATOM 4121 N N . VAL C 1 110 ? -25.511 26.465 40.622 1.00 27.07 ? 110 VAL C N 1 ATOM 4122 C CA . VAL C 1 110 ? -25.210 25.488 41.660 1.00 23.77 ? 110 VAL C CA 1 ATOM 4123 C C . VAL C 1 110 ? -26.447 25.267 42.521 1.00 28.31 ? 110 VAL C C 1 ATOM 4124 O O . VAL C 1 110 ? -27.105 26.223 42.952 1.00 36.12 ? 110 VAL C O 1 ATOM 4125 C CB . VAL C 1 110 ? -24.013 25.952 42.502 1.00 19.41 ? 110 VAL C CB 1 ATOM 4126 C CG1 . VAL C 1 110 ? -23.815 25.039 43.696 1.00 18.67 ? 110 VAL C CG1 1 ATOM 4127 C CG2 . VAL C 1 110 ? -22.754 25.986 41.646 1.00 19.75 ? 110 VAL C CG2 1 ATOM 4128 N N . ALA C 1 111 ? -26.776 24.001 42.765 1.00 20.13 ? 111 ALA C N 1 ATOM 4129 C CA . ALA C 1 111 ? -27.936 23.629 43.562 1.00 18.77 ? 111 ALA C CA 1 ATOM 4130 C C . ALA C 1 111 ? -27.508 22.628 44.622 1.00 20.85 ? 111 ALA C C 1 ATOM 4131 O O . ALA C 1 111 ? -26.925 21.588 44.298 1.00 21.12 ? 111 ALA C O 1 ATOM 4132 C CB . ALA C 1 111 ? -29.047 23.039 42.688 1.00 17.07 ? 111 ALA C CB 1 ATOM 4133 N N . ALA C 1 112 ? -27.804 22.940 45.881 1.00 23.24 ? 112 ALA C N 1 ATOM 4134 C CA . ALA C 1 112 ? -27.445 22.063 46.985 1.00 20.02 ? 112 ALA C CA 1 ATOM 4135 C C . ALA C 1 112 ? -28.363 20.842 47.013 1.00 21.83 ? 112 ALA C C 1 ATOM 4136 O O . ALA C 1 112 ? -29.555 20.953 46.713 1.00 22.00 ? 112 ALA C O 1 ATOM 4137 C CB . ALA C 1 112 ? -27.533 22.808 48.314 1.00 16.58 ? 112 ALA C CB 1 ATOM 4138 N N . PRO C 1 113 ? -27.835 19.674 47.363 1.00 20.49 ? 113 PRO C N 1 ATOM 4139 C CA . PRO C 1 113 ? -28.677 18.479 47.454 1.00 17.70 ? 113 PRO C CA 1 ATOM 4140 C C . PRO C 1 113 ? -29.517 18.458 48.720 1.00 21.34 ? 113 PRO C C 1 ATOM 4141 O O . PRO C 1 113 ? -29.155 19.023 49.754 1.00 18.61 ? 113 PRO C O 1 ATOM 4142 C CB . PRO C 1 113 ? -27.657 17.332 47.461 1.00 22.96 ? 113 PRO C CB 1 ATOM 4143 C CG . PRO C 1 113 ? -26.433 17.941 48.057 1.00 25.80 ? 113 PRO C CG 1 ATOM 4144 C CD . PRO C 1 113 ? -26.409 19.365 47.570 1.00 27.15 ? 113 PRO C CD 1 ATOM 4145 N N . SER C 1 114 ? -30.661 17.790 48.618 1.00 27.30 ? 114 SER C N 1 ATOM 4146 C CA . SER C 1 114 ? -31.491 17.469 49.770 1.00 20.19 ? 114 SER C CA 1 ATOM 4147 C C . SER C 1 114 ? -31.239 16.017 50.156 1.00 16.78 ? 114 SER C C 1 ATOM 4148 O O . SER C 1 114 ? -31.276 15.127 49.299 1.00 22.30 ? 114 SER C O 1 ATOM 4149 C CB . SER C 1 114 ? -32.968 17.701 49.459 1.00 19.74 ? 114 SER C CB 1 ATOM 4150 O OG . SER C 1 114 ? -33.194 19.054 49.108 1.00 28.96 ? 114 SER C OG 1 ATOM 4151 N N . VAL C 1 115 ? -30.977 15.783 51.437 1.00 17.31 ? 115 VAL C N 1 ATOM 4152 C CA . VAL C 1 115 ? -30.490 14.497 51.917 1.00 27.83 ? 115 VAL C CA 1 ATOM 4153 C C . VAL C 1 115 ? -31.583 13.804 52.717 1.00 27.53 ? 115 VAL C C 1 ATOM 4154 O O . VAL C 1 115 ? -32.291 14.439 53.508 1.00 22.99 ? 115 VAL C O 1 ATOM 4155 C CB . VAL C 1 115 ? -29.209 14.670 52.757 1.00 13.20 ? 115 VAL C CB 1 ATOM 4156 C CG1 . VAL C 1 115 ? -28.621 13.314 53.123 1.00 12.92 ? 115 VAL C CG1 1 ATOM 4157 C CG2 . VAL C 1 115 ? -28.199 15.503 51.990 1.00 13.38 ? 115 VAL C CG2 1 ATOM 4158 N N . PHE C 1 116 ? -31.721 12.496 52.500 1.00 21.39 ? 116 PHE C N 1 ATOM 4159 C CA . PHE C 1 116 ? -32.650 11.658 53.243 1.00 23.37 ? 116 PHE C CA 1 ATOM 4160 C C . PHE C 1 116 ? -31.964 10.338 53.553 1.00 21.32 ? 116 PHE C C 1 ATOM 4161 O O . PHE C 1 116 ? -31.242 9.797 52.710 1.00 15.27 ? 116 PHE C O 1 ATOM 4162 C CB . PHE C 1 116 ? -33.942 11.391 52.456 1.00 13.44 ? 116 PHE C CB 1 ATOM 4163 C CG . PHE C 1 116 ? -34.629 12.633 51.970 1.00 15.32 ? 116 PHE C CG 1 ATOM 4164 C CD1 . PHE C 1 116 ? -34.269 13.212 50.764 1.00 14.72 ? 116 PHE C CD1 1 ATOM 4165 C CD2 . PHE C 1 116 ? -35.647 13.214 52.709 1.00 13.99 ? 116 PHE C CD2 1 ATOM 4166 C CE1 . PHE C 1 116 ? -34.903 14.353 50.308 1.00 16.18 ? 116 PHE C CE1 1 ATOM 4167 C CE2 . PHE C 1 116 ? -36.286 14.353 52.257 1.00 14.73 ? 116 PHE C CE2 1 ATOM 4168 C CZ . PHE C 1 116 ? -35.913 14.923 51.053 1.00 14.33 ? 116 PHE C CZ 1 ATOM 4169 N N . ILE C 1 117 ? -32.189 9.825 54.760 1.00 19.58 ? 117 ILE C N 1 ATOM 4170 C CA . ILE C 1 117 ? -31.641 8.539 55.171 1.00 22.02 ? 117 ILE C CA 1 ATOM 4171 C C . ILE C 1 117 ? -32.793 7.569 55.395 1.00 25.96 ? 117 ILE C C 1 ATOM 4172 O O . ILE C 1 117 ? -33.893 7.960 55.803 1.00 35.02 ? 117 ILE C O 1 ATOM 4173 C CB . ILE C 1 117 ? -30.752 8.665 56.427 1.00 27.72 ? 117 ILE C CB 1 ATOM 4174 C CG1 . ILE C 1 117 ? -29.964 7.374 56.658 1.00 18.15 ? 117 ILE C CG1 1 ATOM 4175 C CG2 . ILE C 1 117 ? -31.584 9.033 57.652 1.00 13.12 ? 117 ILE C CG2 1 ATOM 4176 C CD1 . ILE C 1 117 ? -28.899 7.494 57.724 1.00 18.90 ? 117 ILE C CD1 1 ATOM 4177 N N . PHE C 1 118 ? -32.538 6.295 55.100 1.00 24.81 ? 118 PHE C N 1 ATOM 4178 C CA . PHE C 1 118 ? -33.556 5.250 55.175 1.00 17.35 ? 118 PHE C CA 1 ATOM 4179 C C . PHE C 1 118 ? -33.007 4.054 55.939 1.00 22.47 ? 118 PHE C C 1 ATOM 4180 O O . PHE C 1 118 ? -32.015 3.442 55.498 1.00 27.58 ? 118 PHE C O 1 ATOM 4181 C CB . PHE C 1 118 ? -34.004 4.814 53.779 1.00 16.50 ? 118 PHE C CB 1 ATOM 4182 C CG . PHE C 1 118 ? -34.631 5.909 52.970 1.00 23.15 ? 118 PHE C CG 1 ATOM 4183 C CD1 . PHE C 1 118 ? -35.927 6.322 53.227 1.00 17.81 ? 118 PHE C CD1 1 ATOM 4184 C CD2 . PHE C 1 118 ? -33.927 6.517 51.942 1.00 25.81 ? 118 PHE C CD2 1 ATOM 4185 C CE1 . PHE C 1 118 ? -36.510 7.324 52.479 1.00 16.54 ? 118 PHE C CE1 1 ATOM 4186 C CE2 . PHE C 1 118 ? -34.504 7.522 51.191 1.00 25.76 ? 118 PHE C CE2 1 ATOM 4187 C CZ . PHE C 1 118 ? -35.799 7.927 51.459 1.00 24.51 ? 118 PHE C CZ 1 ATOM 4188 N N . PRO C 1 119 ? -33.609 3.672 57.061 1.00 24.25 ? 119 PRO C N 1 ATOM 4189 C CA . PRO C 1 119 ? -33.161 2.473 57.774 1.00 18.27 ? 119 PRO C CA 1 ATOM 4190 C C . PRO C 1 119 ? -33.510 1.225 56.987 1.00 21.82 ? 119 PRO C C 1 ATOM 4191 O O . PRO C 1 119 ? -34.369 1.267 56.094 1.00 22.94 ? 119 PRO C O 1 ATOM 4192 C CB . PRO C 1 119 ? -33.945 2.531 59.097 1.00 14.71 ? 119 PRO C CB 1 ATOM 4193 C CG . PRO C 1 119 ? -34.502 3.923 59.179 1.00 25.01 ? 119 PRO C CG 1 ATOM 4194 C CD . PRO C 1 119 ? -34.706 4.355 57.763 1.00 28.01 ? 119 PRO C CD 1 ATOM 4195 N N . PRO C 1 120 ? -32.861 0.100 57.274 1.00 32.02 ? 120 PRO C N 1 ATOM 4196 C CA . PRO C 1 120 ? -33.297 -1.163 56.674 1.00 36.06 ? 120 PRO C CA 1 ATOM 4197 C C . PRO C 1 120 ? -34.623 -1.613 57.266 1.00 28.29 ? 120 PRO C C 1 ATOM 4198 O O . PRO C 1 120 ? -34.967 -1.288 58.405 1.00 26.42 ? 120 PRO C O 1 ATOM 4199 C CB . PRO C 1 120 ? -32.165 -2.137 57.024 1.00 30.55 ? 120 PRO C CB 1 ATOM 4200 C CG . PRO C 1 120 ? -31.530 -1.555 58.235 1.00 24.90 ? 120 PRO C CG 1 ATOM 4201 C CD . PRO C 1 120 ? -31.642 -0.063 58.084 1.00 28.43 ? 120 PRO C CD 1 ATOM 4202 N N . SER C 1 121 ? -35.377 -2.360 56.469 1.00 25.96 ? 121 SER C N 1 ATOM 4203 C CA . SER C 1 121 ? -36.697 -2.816 56.870 1.00 31.01 ? 121 SER C CA 1 ATOM 4204 C C . SER C 1 121 ? -36.605 -4.127 57.643 1.00 26.59 ? 121 SER C C 1 ATOM 4205 O O . SER C 1 121 ? -35.648 -4.892 57.507 1.00 30.94 ? 121 SER C O 1 ATOM 4206 C CB . SER C 1 121 ? -37.598 -2.996 55.649 1.00 36.62 ? 121 SER C CB 1 ATOM 4207 O OG . SER C 1 121 ? -37.138 -4.065 54.840 1.00 22.49 ? 121 SER C OG 1 ATOM 4208 N N . ASP C 1 122 ? -37.627 -4.376 58.466 1.00 26.08 ? 122 ASP C N 1 ATOM 4209 C CA . ASP C 1 122 ? -37.699 -5.639 59.195 1.00 19.54 ? 122 ASP C CA 1 ATOM 4210 C C . ASP C 1 122 ? -37.801 -6.826 58.248 1.00 29.41 ? 122 ASP C C 1 ATOM 4211 O O . ASP C 1 122 ? -37.339 -7.925 58.581 1.00 34.10 ? 122 ASP C O 1 ATOM 4212 C CB . ASP C 1 122 ? -38.892 -5.635 60.152 1.00 28.49 ? 122 ASP C CB 1 ATOM 4213 C CG . ASP C 1 122 ? -38.751 -4.612 61.259 1.00 32.66 ? 122 ASP C CG 1 ATOM 4214 O OD1 . ASP C 1 122 ? -37.602 -4.293 61.634 1.00 38.32 ? 122 ASP C OD1 1 ATOM 4215 O OD2 . ASP C 1 122 ? -39.789 -4.129 61.756 1.00 31.03 ? 122 ASP C OD2 1 ATOM 4216 N N . GLU C 1 123 ? -38.404 -6.629 57.072 1.00 27.27 ? 123 GLU C N 1 ATOM 4217 C CA . GLU C 1 123 ? -38.551 -7.725 56.121 1.00 33.53 ? 123 GLU C CA 1 ATOM 4218 C C . GLU C 1 123 ? -37.203 -8.149 55.549 1.00 33.89 ? 123 GLU C C 1 ATOM 4219 O O . GLU C 1 123 ? -36.975 -9.340 55.305 1.00 36.55 ? 123 GLU C O 1 ATOM 4220 C CB . GLU C 1 123 ? -39.511 -7.327 55.000 1.00 37.86 ? 123 GLU C CB 1 ATOM 4221 C CG . GLU C 1 123 ? -39.849 -8.467 54.047 1.00 53.71 ? 123 GLU C CG 1 ATOM 4222 C CD . GLU C 1 123 ? -40.832 -8.065 52.959 1.00 69.87 ? 123 GLU C CD 1 ATOM 4223 O OE1 . GLU C 1 123 ? -41.253 -6.888 52.933 1.00 74.37 ? 123 GLU C OE1 1 ATOM 4224 O OE2 . GLU C 1 123 ? -41.182 -8.930 52.128 1.00 72.46 ? 123 GLU C OE2 1 ATOM 4225 N N . GLN C 1 124 ? -36.292 -7.197 55.339 1.00 20.08 ? 124 GLN C N 1 ATOM 4226 C CA . GLN C 1 124 ? -34.979 -7.556 54.813 1.00 19.54 ? 124 GLN C CA 1 ATOM 4227 C C . GLN C 1 124 ? -34.104 -8.190 55.888 1.00 31.95 ? 124 GLN C C 1 ATOM 4228 O O . GLN C 1 124 ? -33.323 -9.104 55.598 1.00 40.61 ? 124 GLN C O 1 ATOM 4229 C CB . GLN C 1 124 ? -34.291 -6.327 54.221 1.00 18.23 ? 124 GLN C CB 1 ATOM 4230 C CG . GLN C 1 124 ? -32.937 -6.644 53.610 1.00 32.90 ? 124 GLN C CG 1 ATOM 4231 C CD . GLN C 1 124 ? -32.146 -5.410 53.233 1.00 26.10 ? 124 GLN C CD 1 ATOM 4232 O OE1 . GLN C 1 124 ? -32.440 -4.303 53.684 1.00 25.51 ? 124 GLN C OE1 1 ATOM 4233 N NE2 . GLN C 1 124 ? -31.131 -5.597 52.398 1.00 22.01 ? 124 GLN C NE2 1 ATOM 4234 N N . LEU C 1 125 ? -34.224 -7.723 57.134 1.00 35.94 ? 125 LEU C N 1 ATOM 4235 C CA . LEU C 1 125 ? -33.400 -8.246 58.220 1.00 34.12 ? 125 LEU C CA 1 ATOM 4236 C C . LEU C 1 125 ? -33.581 -9.747 58.411 1.00 43.27 ? 125 LEU C C 1 ATOM 4237 O O . LEU C 1 125 ? -32.664 -10.414 58.907 1.00 41.87 ? 125 LEU C O 1 ATOM 4238 C CB . LEU C 1 125 ? -33.718 -7.507 59.521 1.00 19.81 ? 125 LEU C CB 1 ATOM 4239 C CG . LEU C 1 125 ? -33.306 -6.032 59.559 1.00 30.82 ? 125 LEU C CG 1 ATOM 4240 C CD1 . LEU C 1 125 ? -33.801 -5.357 60.827 1.00 18.63 ? 125 LEU C CD1 1 ATOM 4241 C CD2 . LEU C 1 125 ? -31.795 -5.894 59.428 1.00 18.38 ? 125 LEU C CD2 1 ATOM 4242 N N . LYS C 1 126 ? -34.734 -10.295 58.017 1.00 47.35 ? 126 LYS C N 1 ATOM 4243 C CA . LYS C 1 126 ? -34.936 -11.737 58.084 1.00 40.74 ? 126 LYS C CA 1 ATOM 4244 C C . LYS C 1 126 ? -34.011 -12.494 57.140 1.00 35.21 ? 126 LYS C C 1 ATOM 4245 O O . LYS C 1 126 ? -33.853 -13.710 57.291 1.00 37.00 ? 126 LYS C O 1 ATOM 4246 C CB . LYS C 1 126 ? -36.394 -12.082 57.770 1.00 39.68 ? 126 LYS C CB 1 ATOM 4247 C CG . LYS C 1 126 ? -37.398 -11.420 58.703 1.00 46.10 ? 126 LYS C CG 1 ATOM 4248 C CD . LYS C 1 126 ? -38.741 -12.147 58.707 1.00 55.83 ? 126 LYS C CD 1 ATOM 4249 C CE . LYS C 1 126 ? -39.787 -11.421 57.871 1.00 59.45 ? 126 LYS C CE 1 ATOM 4250 N NZ . LYS C 1 126 ? -39.490 -11.481 56.414 1.00 58.87 ? 126 LYS C NZ 1 ATOM 4251 N N . SER C 1 127 ? -33.401 -11.811 56.176 1.00 25.38 ? 127 SER C N 1 ATOM 4252 C CA . SER C 1 127 ? -32.498 -12.447 55.227 1.00 27.30 ? 127 SER C CA 1 ATOM 4253 C C . SER C 1 127 ? -31.046 -12.419 55.683 1.00 33.07 ? 127 SER C C 1 ATOM 4254 O O . SER C 1 127 ? -30.180 -12.946 54.976 1.00 33.03 ? 127 SER C O 1 ATOM 4255 C CB . SER C 1 127 ? -32.621 -11.778 53.852 1.00 27.32 ? 127 SER C CB 1 ATOM 4256 O OG . SER C 1 127 ? -32.152 -10.440 53.887 1.00 22.39 ? 127 SER C OG 1 ATOM 4257 N N . GLY C 1 128 ? -30.761 -11.822 56.839 1.00 34.87 ? 128 GLY C N 1 ATOM 4258 C CA . GLY C 1 128 ? -29.405 -11.732 57.339 1.00 30.58 ? 128 GLY C CA 1 ATOM 4259 C C . GLY C 1 128 ? -28.595 -10.578 56.797 1.00 31.06 ? 128 GLY C C 1 ATOM 4260 O O . GLY C 1 128 ? -27.381 -10.533 57.027 1.00 34.22 ? 128 GLY C O 1 ATOM 4261 N N . THR C 1 129 ? -29.225 -9.642 56.090 1.00 29.36 ? 129 THR C N 1 ATOM 4262 C CA . THR C 1 129 ? -28.534 -8.520 55.472 1.00 30.13 ? 129 THR C CA 1 ATOM 4263 C C . THR C 1 129 ? -29.329 -7.244 55.707 1.00 27.80 ? 129 THR C C 1 ATOM 4264 O O . THR C 1 129 ? -30.562 -7.251 55.645 1.00 32.22 ? 129 THR C O 1 ATOM 4265 C CB . THR C 1 129 ? -28.333 -8.762 53.963 1.00 22.97 ? 129 THR C CB 1 ATOM 4266 O OG1 . THR C 1 129 ? -27.380 -9.815 53.770 1.00 21.96 ? 129 THR C OG1 1 ATOM 4267 C CG2 . THR C 1 129 ? -27.834 -7.505 53.262 1.00 17.42 ? 129 THR C CG2 1 ATOM 4268 N N . ALA C 1 130 ? -28.617 -6.156 55.995 1.00 15.69 ? 130 ALA C N 1 ATOM 4269 C CA . ALA C 1 130 ? -29.216 -4.846 56.210 1.00 15.48 ? 130 ALA C CA 1 ATOM 4270 C C . ALA C 1 130 ? -28.697 -3.877 55.159 1.00 21.22 ? 130 ALA C C 1 ATOM 4271 O O . ALA C 1 130 ? -27.483 -3.761 54.964 1.00 23.28 ? 130 ALA C O 1 ATOM 4272 C CB . ALA C 1 130 ? -28.904 -4.321 57.613 1.00 15.06 ? 130 ALA C CB 1 ATOM 4273 N N . SER C 1 131 ? -29.614 -3.187 54.484 1.00 19.66 ? 131 SER C N 1 ATOM 4274 C CA . SER C 1 131 ? -29.277 -2.177 53.485 1.00 15.08 ? 131 SER C CA 1 ATOM 4275 C C . SER C 1 131 ? -29.689 -0.812 54.020 1.00 14.81 ? 131 SER C C 1 ATOM 4276 O O . SER C 1 131 ? -30.881 -0.552 54.220 1.00 21.24 ? 131 SER C O 1 ATOM 4277 C CB . SER C 1 131 ? -29.963 -2.464 52.152 1.00 15.89 ? 131 SER C CB 1 ATOM 4278 O OG . SER C 1 131 ? -29.488 -3.662 51.569 1.00 16.41 ? 131 SER C OG 1 ATOM 4279 N N . VAL C 1 132 ? -28.709 0.054 54.254 1.00 14.15 ? 132 VAL C N 1 ATOM 4280 C CA . VAL C 1 132 ? -28.959 1.427 54.674 1.00 22.86 ? 132 VAL C CA 1 ATOM 4281 C C . VAL C 1 132 ? -28.723 2.333 53.476 1.00 24.11 ? 132 VAL C C 1 ATOM 4282 O O . VAL C 1 132 ? -27.685 2.234 52.810 1.00 22.54 ? 132 VAL C O 1 ATOM 4283 C CB . VAL C 1 132 ? -28.061 1.823 55.857 1.00 21.32 ? 132 VAL C CB 1 ATOM 4284 C CG1 . VAL C 1 132 ? -28.559 3.113 56.482 1.00 22.94 ? 132 VAL C CG1 1 ATOM 4285 C CG2 . VAL C 1 132 ? -28.025 0.705 56.885 1.00 27.24 ? 132 VAL C CG2 1 ATOM 4286 N N . VAL C 1 133 ? -29.682 3.211 53.194 1.00 15.25 ? 133 VAL C N 1 ATOM 4287 C CA . VAL C 1 133 ? -29.693 3.981 51.956 1.00 16.90 ? 133 VAL C CA 1 ATOM 4288 C C . VAL C 1 133 ? -29.729 5.467 52.284 1.00 21.69 ? 133 VAL C C 1 ATOM 4289 O O . VAL C 1 133 ? -30.515 5.905 53.130 1.00 22.09 ? 133 VAL C O 1 ATOM 4290 C CB . VAL C 1 133 ? -30.882 3.588 51.057 1.00 20.56 ? 133 VAL C CB 1 ATOM 4291 C CG1 . VAL C 1 133 ? -30.957 4.492 49.841 1.00 14.69 ? 133 VAL C CG1 1 ATOM 4292 C CG2 . VAL C 1 133 ? -30.760 2.128 50.633 1.00 15.06 ? 133 VAL C CG2 1 ATOM 4293 N N . CYS C 1 134 ? -28.874 6.234 51.608 1.00 25.14 ? 134 CYS C N 1 ATOM 4294 C CA . CYS C 1 134 ? -28.808 7.684 51.720 1.00 29.27 ? 134 CYS C CA 1 ATOM 4295 C C . CYS C 1 134 ? -29.128 8.277 50.355 1.00 26.52 ? 134 CYS C C 1 ATOM 4296 O O . CYS C 1 134 ? -28.538 7.872 49.347 1.00 25.46 ? 134 CYS C O 1 ATOM 4297 C CB . CYS C 1 134 ? -27.417 8.127 52.190 1.00 31.60 ? 134 CYS C CB 1 ATOM 4298 S SG . CYS C 1 134 ? -27.188 9.879 52.595 1.00 26.40 ? 134 CYS C SG 1 ATOM 4299 N N . LEU C 1 135 ? -30.062 9.225 50.319 1.00 17.47 ? 135 LEU C N 1 ATOM 4300 C CA . LEU C 1 135 ? -30.533 9.827 49.078 1.00 13.98 ? 135 LEU C CA 1 ATOM 4301 C C . LEU C 1 135 ? -30.064 11.272 48.986 1.00 13.86 ? 135 LEU C C 1 ATOM 4302 O O . LEU C 1 135 ? -30.213 12.039 49.941 1.00 15.16 ? 135 LEU C O 1 ATOM 4303 C CB . LEU C 1 135 ? -32.061 9.765 48.989 1.00 14.73 ? 135 LEU C CB 1 ATOM 4304 C CG . LEU C 1 135 ? -32.726 10.598 47.890 1.00 23.42 ? 135 LEU C CG 1 ATOM 4305 C CD1 . LEU C 1 135 ? -32.251 10.156 46.514 1.00 21.43 ? 135 LEU C CD1 1 ATOM 4306 C CD2 . LEU C 1 135 ? -34.244 10.520 47.990 1.00 21.18 ? 135 LEU C CD2 1 ATOM 4307 N N . LEU C 1 136 ? -29.503 11.640 47.835 1.00 15.22 ? 136 LEU C N 1 ATOM 4308 C CA . LEU C 1 136 ? -29.094 13.013 47.545 1.00 16.45 ? 136 LEU C CA 1 ATOM 4309 C C . LEU C 1 136 ? -29.876 13.473 46.323 1.00 23.38 ? 136 LEU C C 1 ATOM 4310 O O . LEU C 1 136 ? -29.611 13.019 45.206 1.00 25.31 ? 136 LEU C O 1 ATOM 4311 C CB . LEU C 1 136 ? -27.588 13.109 47.301 1.00 18.60 ? 136 LEU C CB 1 ATOM 4312 C CG . LEU C 1 136 ? -26.629 13.125 48.495 1.00 18.09 ? 136 LEU C CG 1 ATOM 4313 C CD1 . LEU C 1 136 ? -26.736 11.864 49.342 1.00 13.38 ? 136 LEU C CD1 1 ATOM 4314 C CD2 . LEU C 1 136 ? -25.210 13.306 47.990 1.00 18.87 ? 136 LEU C CD2 1 ATOM 4315 N N . ASN C 1 137 ? -30.827 14.380 46.529 1.00 20.25 ? 137 ASN C N 1 ATOM 4316 C CA . ASN C 1 137 ? -31.858 14.669 45.542 1.00 23.26 ? 137 ASN C CA 1 ATOM 4317 C C . ASN C 1 137 ? -31.632 16.027 44.887 1.00 20.46 ? 137 ASN C C 1 ATOM 4318 O O . ASN C 1 137 ? -31.481 17.038 45.581 1.00 16.66 ? 137 ASN C O 1 ATOM 4319 C CB . ASN C 1 137 ? -33.241 14.627 46.193 1.00 28.24 ? 137 ASN C CB 1 ATOM 4320 C CG . ASN C 1 137 ? -34.348 14.425 45.187 1.00 31.20 ? 137 ASN C CG 1 ATOM 4321 O OD1 . ASN C 1 137 ? -34.212 13.636 44.252 1.00 26.58 ? 137 ASN C OD1 1 ATOM 4322 N ND2 . ASN C 1 137 ? -35.451 15.141 45.368 1.00 32.81 ? 137 ASN C ND2 1 ATOM 4323 N N . ASN C 1 138 ? -31.610 16.034 43.550 1.00 20.22 ? 138 ASN C N 1 ATOM 4324 C CA . ASN C 1 138 ? -31.691 17.240 42.720 1.00 23.77 ? 138 ASN C CA 1 ATOM 4325 C C . ASN C 1 138 ? -30.605 18.257 43.088 1.00 26.68 ? 138 ASN C C 1 ATOM 4326 O O . ASN C 1 138 ? -30.861 19.295 43.700 1.00 36.71 ? 138 ASN C O 1 ATOM 4327 C CB . ASN C 1 138 ? -33.084 17.875 42.825 1.00 20.82 ? 138 ASN C CB 1 ATOM 4328 C CG . ASN C 1 138 ? -34.197 16.902 42.495 1.00 20.24 ? 138 ASN C CG 1 ATOM 4329 O OD1 . ASN C 1 138 ? -33.994 15.924 41.774 1.00 30.69 ? 138 ASN C OD1 1 ATOM 4330 N ND2 . ASN C 1 138 ? -35.386 17.169 43.020 1.00 16.52 ? 138 ASN C ND2 1 ATOM 4331 N N . PHE C 1 139 ? -29.379 17.943 42.670 1.00 20.98 ? 139 PHE C N 1 ATOM 4332 C CA . PHE C 1 139 ? -28.231 18.792 42.953 1.00 14.79 ? 139 PHE C CA 1 ATOM 4333 C C . PHE C 1 139 ? -27.411 19.017 41.690 1.00 13.97 ? 139 PHE C C 1 ATOM 4334 O O . PHE C 1 139 ? -27.527 18.287 40.703 1.00 13.98 ? 139 PHE C O 1 ATOM 4335 C CB . PHE C 1 139 ? -27.336 18.192 44.049 1.00 23.58 ? 139 PHE C CB 1 ATOM 4336 C CG . PHE C 1 139 ? -26.823 16.817 43.730 1.00 13.69 ? 139 PHE C CG 1 ATOM 4337 C CD1 . PHE C 1 139 ? -25.655 16.647 43.004 1.00 15.95 ? 139 PHE C CD1 1 ATOM 4338 C CD2 . PHE C 1 139 ? -27.506 15.694 44.161 1.00 13.52 ? 139 PHE C CD2 1 ATOM 4339 C CE1 . PHE C 1 139 ? -25.182 15.383 42.708 1.00 13.96 ? 139 PHE C CE1 1 ATOM 4340 C CE2 . PHE C 1 139 ? -27.037 14.427 43.872 1.00 19.48 ? 139 PHE C CE2 1 ATOM 4341 C CZ . PHE C 1 139 ? -25.874 14.271 43.143 1.00 13.72 ? 139 PHE C CZ 1 ATOM 4342 N N . TYR C 1 140 ? -26.565 20.039 41.745 1.00 16.03 ? 140 TYR C N 1 ATOM 4343 C CA . TYR C 1 140 ? -25.664 20.364 40.648 1.00 15.48 ? 140 TYR C CA 1 ATOM 4344 C C . TYR C 1 140 ? -24.515 21.214 41.186 1.00 20.66 ? 140 TYR C C 1 ATOM 4345 O O . TYR C 1 140 ? -24.741 22.123 41.984 1.00 15.36 ? 140 TYR C O 1 ATOM 4346 C CB . TYR C 1 140 ? -26.407 21.098 39.527 1.00 15.97 ? 140 TYR C CB 1 ATOM 4347 C CG . TYR C 1 140 ? -25.570 21.317 38.288 1.00 15.03 ? 140 TYR C CG 1 ATOM 4348 C CD1 . TYR C 1 140 ? -25.519 20.360 37.284 1.00 27.64 ? 140 TYR C CD1 1 ATOM 4349 C CD2 . TYR C 1 140 ? -24.820 22.474 38.128 1.00 26.34 ? 140 TYR C CD2 1 ATOM 4350 C CE1 . TYR C 1 140 ? -24.749 20.553 36.152 1.00 29.00 ? 140 TYR C CE1 1 ATOM 4351 C CE2 . TYR C 1 140 ? -24.046 22.675 37.001 1.00 26.11 ? 140 TYR C CE2 1 ATOM 4352 C CZ . TYR C 1 140 ? -24.015 21.712 36.014 1.00 29.58 ? 140 TYR C CZ 1 ATOM 4353 O OH . TYR C 1 140 ? -23.246 21.911 34.889 1.00 17.26 ? 140 TYR C OH 1 ATOM 4354 N N . PRO C 1 141 ? -23.277 20.929 40.750 1.00 20.24 ? 141 PRO C N 1 ATOM 4355 C CA . PRO C 1 141 ? -22.883 19.931 39.748 1.00 15.86 ? 141 PRO C CA 1 ATOM 4356 C C . PRO C 1 141 ? -22.918 18.479 40.224 1.00 19.00 ? 141 PRO C C 1 ATOM 4357 O O . PRO C 1 141 ? -23.412 18.176 41.311 1.00 19.98 ? 141 PRO C O 1 ATOM 4358 C CB . PRO C 1 141 ? -21.448 20.341 39.408 1.00 24.17 ? 141 PRO C CB 1 ATOM 4359 C CG . PRO C 1 141 ? -20.943 20.942 40.657 1.00 17.28 ? 141 PRO C CG 1 ATOM 4360 C CD . PRO C 1 141 ? -22.113 21.680 41.253 1.00 21.87 ? 141 PRO C CD 1 ATOM 4361 N N . ARG C 1 142 ? -22.363 17.595 39.394 1.00 25.91 ? 142 ARG C N 1 ATOM 4362 C CA . ARG C 1 142 ? -22.547 16.157 39.549 1.00 36.06 ? 142 ARG C CA 1 ATOM 4363 C C . ARG C 1 142 ? -21.777 15.575 40.730 1.00 39.63 ? 142 ARG C C 1 ATOM 4364 O O . ARG C 1 142 ? -22.231 14.591 41.325 1.00 43.73 ? 142 ARG C O 1 ATOM 4365 C CB . ARG C 1 142 ? -22.127 15.454 38.256 1.00 39.11 ? 142 ARG C CB 1 ATOM 4366 C CG . ARG C 1 142 ? -22.560 14.004 38.136 1.00 38.04 ? 142 ARG C CG 1 ATOM 4367 C CD . ARG C 1 142 ? -21.967 13.371 36.882 1.00 38.08 ? 142 ARG C CD 1 ATOM 4368 N NE . ARG C 1 142 ? -22.680 12.159 36.488 1.00 44.50 ? 142 ARG C NE 1 ATOM 4369 C CZ . ARG C 1 142 ? -22.431 10.951 36.981 1.00 46.80 ? 142 ARG C CZ 1 ATOM 4370 N NH1 . ARG C 1 142 ? -21.483 10.787 37.894 1.00 44.91 ? 142 ARG C NH1 1 ATOM 4371 N NH2 . ARG C 1 142 ? -23.133 9.906 36.564 1.00 50.69 ? 142 ARG C NH2 1 ATOM 4372 N N . GLU C 1 143 ? -20.626 16.144 41.084 1.00 35.58 ? 143 GLU C N 1 ATOM 4373 C CA . GLU C 1 143 ? -19.750 15.520 42.067 1.00 30.37 ? 143 GLU C CA 1 ATOM 4374 C C . GLU C 1 143 ? -20.228 15.797 43.487 1.00 26.01 ? 143 GLU C C 1 ATOM 4375 O O . GLU C 1 143 ? -20.523 16.941 43.843 1.00 28.05 ? 143 GLU C O 1 ATOM 4376 C CB . GLU C 1 143 ? -18.312 16.006 41.892 1.00 29.75 ? 143 GLU C CB 1 ATOM 4377 C CG . GLU C 1 143 ? -17.333 15.400 42.895 1.00 48.51 ? 143 GLU C CG 1 ATOM 4378 C CD . GLU C 1 143 ? -17.346 13.873 42.898 1.00 56.62 ? 143 GLU C CD 1 ATOM 4379 O OE1 . GLU C 1 143 ? -17.409 13.267 41.803 1.00 55.12 ? 143 GLU C OE1 1 ATOM 4380 O OE2 . GLU C 1 143 ? -17.292 13.281 43.999 1.00 53.97 ? 143 GLU C OE2 1 ATOM 4381 N N . ALA C 1 144 ? -20.293 14.741 44.295 1.00 26.76 ? 144 ALA C N 1 ATOM 4382 C CA . ALA C 1 144 ? -20.658 14.837 45.700 1.00 24.23 ? 144 ALA C CA 1 ATOM 4383 C C . ALA C 1 144 ? -20.007 13.684 46.447 1.00 24.39 ? 144 ALA C C 1 ATOM 4384 O O . ALA C 1 144 ? -19.770 12.614 45.878 1.00 28.05 ? 144 ALA C O 1 ATOM 4385 C CB . ALA C 1 144 ? -22.177 14.808 45.899 1.00 21.18 ? 144 ALA C CB 1 ATOM 4386 N N . LYS C 1 145 ? -19.722 13.907 47.727 1.00 26.15 ? 145 LYS C N 1 ATOM 4387 C CA . LYS C 1 145 ? -19.063 12.914 48.567 1.00 18.96 ? 145 LYS C CA 1 ATOM 4388 C C . LYS C 1 145 ? -20.019 12.478 49.669 1.00 18.73 ? 145 LYS C C 1 ATOM 4389 O O . LYS C 1 145 ? -20.447 13.301 50.487 1.00 25.08 ? 145 LYS C O 1 ATOM 4390 C CB . LYS C 1 145 ? -17.768 13.468 49.166 1.00 21.86 ? 145 LYS C CB 1 ATOM 4391 C CG . LYS C 1 145 ? -16.863 12.408 49.789 1.00 25.81 ? 145 LYS C CG 1 ATOM 4392 C CD . LYS C 1 145 ? -15.986 13.003 50.886 1.00 37.40 ? 145 LYS C CD 1 ATOM 4393 C CE . LYS C 1 145 ? -14.520 13.074 50.479 1.00 40.73 ? 145 LYS C CE 1 ATOM 4394 N NZ . LYS C 1 145 ? -13.911 11.719 50.346 1.00 37.78 ? 145 LYS C NZ 1 ATOM 4395 N N . VAL C 1 146 ? -20.351 11.190 49.686 1.00 19.33 ? 146 VAL C N 1 ATOM 4396 C CA . VAL C 1 146 ? -21.151 10.585 50.745 1.00 21.35 ? 146 VAL C CA 1 ATOM 4397 C C . VAL C 1 146 ? -20.230 9.751 51.622 1.00 15.72 ? 146 VAL C C 1 ATOM 4398 O O . VAL C 1 146 ? -19.484 8.902 51.119 1.00 15.45 ? 146 VAL C O 1 ATOM 4399 C CB . VAL C 1 146 ? -22.284 9.720 50.166 1.00 16.50 ? 146 VAL C CB 1 ATOM 4400 C CG1 . VAL C 1 146 ? -23.004 8.969 51.278 1.00 14.92 ? 146 VAL C CG1 1 ATOM 4401 C CG2 . VAL C 1 146 ? -23.258 10.576 49.379 1.00 15.50 ? 146 VAL C CG2 1 ATOM 4402 N N . GLN C 1 147 ? -20.281 9.987 52.931 1.00 28.24 ? 147 GLN C N 1 ATOM 4403 C CA . GLN C 1 147 ? -19.496 9.225 53.894 1.00 31.37 ? 147 GLN C CA 1 ATOM 4404 C C . GLN C 1 147 ? -20.423 8.619 54.936 1.00 27.37 ? 147 GLN C C 1 ATOM 4405 O O . GLN C 1 147 ? -21.282 9.314 55.488 1.00 30.52 ? 147 GLN C O 1 ATOM 4406 C CB . GLN C 1 147 ? -18.435 10.102 54.567 1.00 29.66 ? 147 GLN C CB 1 ATOM 4407 C CG . GLN C 1 147 ? -17.325 10.554 53.628 1.00 36.08 ? 147 GLN C CG 1 ATOM 4408 C CD . GLN C 1 147 ? -16.123 11.110 54.367 1.00 39.64 ? 147 GLN C CD 1 ATOM 4409 O OE1 . GLN C 1 147 ? -16.244 12.040 55.166 1.00 40.41 ? 147 GLN C OE1 1 ATOM 4410 N NE2 . GLN C 1 147 ? -14.953 10.534 54.111 1.00 43.50 ? 147 GLN C NE2 1 ATOM 4411 N N . TRP C 1 148 ? -20.255 7.324 55.184 1.00 24.70 ? 148 TRP C N 1 ATOM 4412 C CA . TRP C 1 148 ? -21.046 6.595 56.165 1.00 19.09 ? 148 TRP C CA 1 ATOM 4413 C C . TRP C 1 148 ? -20.270 6.477 57.467 1.00 20.81 ? 148 TRP C C 1 ATOM 4414 O O . TRP C 1 148 ? -19.098 6.087 57.466 1.00 21.07 ? 148 TRP C O 1 ATOM 4415 C CB . TRP C 1 148 ? -21.402 5.198 55.660 1.00 18.22 ? 148 TRP C CB 1 ATOM 4416 C CG . TRP C 1 148 ? -22.411 5.182 54.572 1.00 21.59 ? 148 TRP C CG 1 ATOM 4417 C CD1 . TRP C 1 148 ? -22.171 5.108 53.230 1.00 20.02 ? 148 TRP C CD1 1 ATOM 4418 C CD2 . TRP C 1 148 ? -23.831 5.233 54.725 1.00 13.45 ? 148 TRP C CD2 1 ATOM 4419 N NE1 . TRP C 1 148 ? -23.357 5.114 52.539 1.00 24.89 ? 148 TRP C NE1 1 ATOM 4420 C CE2 . TRP C 1 148 ? -24.392 5.189 53.434 1.00 25.33 ? 148 TRP C CE2 1 ATOM 4421 C CE3 . TRP C 1 148 ? -24.684 5.314 55.827 1.00 13.64 ? 148 TRP C CE3 1 ATOM 4422 C CZ2 . TRP C 1 148 ? -25.767 5.223 53.215 1.00 17.61 ? 148 TRP C CZ2 1 ATOM 4423 C CZ3 . TRP C 1 148 ? -26.052 5.348 55.606 1.00 22.46 ? 148 TRP C CZ3 1 ATOM 4424 C CH2 . TRP C 1 148 ? -26.578 5.300 54.311 1.00 19.43 ? 148 TRP C CH2 1 ATOM 4425 N N . LYS C 1 149 ? -20.927 6.804 58.574 1.00 26.45 ? 149 LYS C N 1 ATOM 4426 C CA . LYS C 1 149 ? -20.356 6.616 59.900 1.00 16.99 ? 149 LYS C CA 1 ATOM 4427 C C . LYS C 1 149 ? -21.333 5.799 60.729 1.00 25.68 ? 149 LYS C C 1 ATOM 4428 O O . LYS C 1 149 ? -22.508 6.163 60.846 1.00 35.03 ? 149 LYS C O 1 ATOM 4429 C CB . LYS C 1 149 ? -20.038 7.957 60.566 1.00 18.33 ? 149 LYS C CB 1 ATOM 4430 C CG . LYS C 1 149 ? -18.654 8.473 60.197 1.00 28.70 ? 149 LYS C CG 1 ATOM 4431 C CD . LYS C 1 149 ? -18.386 9.880 60.702 1.00 27.07 ? 149 LYS C CD 1 ATOM 4432 C CE . LYS C 1 149 ? -18.242 10.855 59.537 1.00 32.29 ? 149 LYS C CE 1 ATOM 4433 N NZ . LYS C 1 149 ? -17.550 12.123 59.930 1.00 27.64 ? 149 LYS C NZ 1 ATOM 4434 N N . VAL C 1 150 ? -20.850 4.688 61.277 1.00 25.34 ? 150 VAL C N 1 ATOM 4435 C CA . VAL C 1 150 ? -21.641 3.787 62.110 1.00 20.72 ? 150 VAL C CA 1 ATOM 4436 C C . VAL C 1 150 ? -21.030 3.803 63.503 1.00 24.71 ? 150 VAL C C 1 ATOM 4437 O O . VAL C 1 150 ? -19.908 3.319 63.699 1.00 34.52 ? 150 VAL C O 1 ATOM 4438 C CB . VAL C 1 150 ? -21.682 2.365 61.540 1.00 15.55 ? 150 VAL C CB 1 ATOM 4439 C CG1 . VAL C 1 150 ? -22.364 1.429 62.517 1.00 15.58 ? 150 VAL C CG1 1 ATOM 4440 C CG2 . VAL C 1 150 ? -22.393 2.354 60.198 1.00 14.75 ? 150 VAL C CG2 1 ATOM 4441 N N . ASP C 1 151 ? -21.769 4.352 64.471 1.00 25.57 ? 151 ASP C N 1 ATOM 4442 C CA . ASP C 1 151 ? -21.235 4.630 65.801 1.00 26.26 ? 151 ASP C CA 1 ATOM 4443 C C . ASP C 1 151 ? -19.924 5.403 65.691 1.00 25.27 ? 151 ASP C C 1 ATOM 4444 O O . ASP C 1 151 ? -18.942 5.106 66.375 1.00 24.56 ? 151 ASP C O 1 ATOM 4445 C CB . ASP C 1 151 ? -21.057 3.342 66.610 1.00 29.78 ? 151 ASP C CB 1 ATOM 4446 C CG . ASP C 1 151 ? -22.343 2.890 67.286 1.00 29.79 ? 151 ASP C CG 1 ATOM 4447 O OD1 . ASP C 1 151 ? -23.247 3.735 67.472 1.00 31.65 ? 151 ASP C OD1 1 ATOM 4448 O OD2 . ASP C 1 151 ? -22.447 1.698 67.640 1.00 26.94 ? 151 ASP C OD2 1 ATOM 4449 N N . ASN C 1 152 ? -19.914 6.393 64.794 1.00 29.99 ? 152 ASN C N 1 ATOM 4450 C CA . ASN C 1 152 ? -18.794 7.296 64.542 1.00 32.48 ? 152 ASN C CA 1 ATOM 4451 C C . ASN C 1 152 ? -17.570 6.600 63.959 1.00 30.88 ? 152 ASN C C 1 ATOM 4452 O O . ASN C 1 152 ? -16.460 7.136 64.039 1.00 24.82 ? 152 ASN C O 1 ATOM 4453 C CB . ASN C 1 152 ? -18.401 8.070 65.805 1.00 30.64 ? 152 ASN C CB 1 ATOM 4454 C CG . ASN C 1 152 ? -19.111 9.403 65.907 1.00 50.03 ? 152 ASN C CG 1 ATOM 4455 O OD1 . ASN C 1 152 ? -19.934 9.617 66.795 1.00 60.07 ? 152 ASN C OD1 1 ATOM 4456 N ND2 . ASN C 1 152 ? -18.799 10.309 64.985 1.00 54.92 ? 152 ASN C ND2 1 ATOM 4457 N N . ALA C 1 153 ? -17.738 5.428 63.356 1.00 25.06 ? 153 ALA C N 1 ATOM 4458 C CA . ALA C 1 153 ? -16.659 4.763 62.638 1.00 19.12 ? 153 ALA C CA 1 ATOM 4459 C C . ALA C 1 153 ? -16.889 4.942 61.142 1.00 22.44 ? 153 ALA C C 1 ATOM 4460 O O . ALA C 1 153 ? -17.944 4.562 60.622 1.00 22.45 ? 153 ALA C O 1 ATOM 4461 C CB . ALA C 1 153 ? -16.581 3.282 63.004 1.00 22.38 ? 153 ALA C CB 1 ATOM 4462 N N . LEU C 1 154 ? -15.914 5.539 60.461 1.00 22.72 ? 154 LEU C N 1 ATOM 4463 C CA . LEU C 1 154 ? -16.022 5.754 59.025 1.00 18.99 ? 154 LEU C CA 1 ATOM 4464 C C . LEU C 1 154 ? -16.028 4.417 58.295 1.00 25.93 ? 154 LEU C C 1 ATOM 4465 O O . LEU C 1 154 ? -15.141 3.582 58.497 1.00 26.34 ? 154 LEU C O 1 ATOM 4466 C CB . LEU C 1 154 ? -14.866 6.624 58.534 1.00 17.23 ? 154 LEU C CB 1 ATOM 4467 C CG . LEU C 1 154 ? -14.717 6.819 57.023 1.00 16.70 ? 154 LEU C CG 1 ATOM 4468 C CD1 . LEU C 1 154 ? -15.773 7.768 56.478 1.00 22.82 ? 154 LEU C CD1 1 ATOM 4469 C CD2 . LEU C 1 154 ? -13.321 7.310 56.686 1.00 17.50 ? 154 LEU C CD2 1 ATOM 4470 N N . GLN C 1 155 ? -17.038 4.210 57.454 1.00 25.03 ? 155 GLN C N 1 ATOM 4471 C CA . GLN C 1 155 ? -17.164 2.979 56.689 1.00 19.85 ? 155 GLN C CA 1 ATOM 4472 C C . GLN C 1 155 ? -16.394 3.092 55.381 1.00 27.47 ? 155 GLN C C 1 ATOM 4473 O O . GLN C 1 155 ? -16.399 4.141 54.731 1.00 38.12 ? 155 GLN C O 1 ATOM 4474 C CB . GLN C 1 155 ? -18.633 2.668 56.402 1.00 13.96 ? 155 GLN C CB 1 ATOM 4475 C CG . GLN C 1 155 ? -19.503 2.606 57.646 1.00 18.31 ? 155 GLN C CG 1 ATOM 4476 C CD . GLN C 1 155 ? -19.137 1.453 58.553 1.00 18.26 ? 155 GLN C CD 1 ATOM 4477 O OE1 . GLN C 1 155 ? -19.048 0.308 58.113 1.00 13.76 ? 155 GLN C OE1 1 ATOM 4478 N NE2 . GLN C 1 155 ? -18.917 1.749 59.829 1.00 22.19 ? 155 GLN C NE2 1 ATOM 4479 N N . SER C 1 156 ? -15.728 2.004 55.003 1.00 18.16 ? 156 SER C N 1 ATOM 4480 C CA . SER C 1 156 ? -14.984 1.948 53.753 1.00 16.40 ? 156 SER C CA 1 ATOM 4481 C C . SER C 1 156 ? -15.099 0.553 53.163 1.00 21.12 ? 156 SER C C 1 ATOM 4482 O O . SER C 1 156 ? -14.849 -0.438 53.855 1.00 29.76 ? 156 SER C O 1 ATOM 4483 C CB . SER C 1 156 ? -13.509 2.310 53.963 1.00 14.33 ? 156 SER C CB 1 ATOM 4484 O OG . SER C 1 156 ? -12.799 2.260 52.737 1.00 16.32 ? 156 SER C OG 1 ATOM 4485 N N . GLY C 1 157 ? -15.481 0.480 51.889 1.00 15.77 ? 157 GLY C N 1 ATOM 4486 C CA . GLY C 1 157 ? -15.528 -0.774 51.171 1.00 13.38 ? 157 GLY C CA 1 ATOM 4487 C C . GLY C 1 157 ? -16.858 -1.493 51.187 1.00 13.06 ? 157 GLY C C 1 ATOM 4488 O O . GLY C 1 157 ? -16.976 -2.551 50.558 1.00 19.26 ? 157 GLY C O 1 ATOM 4489 N N . ASN C 1 158 ? -17.861 -0.966 51.882 1.00 12.73 ? 158 ASN C N 1 ATOM 4490 C CA . ASN C 1 158 ? -19.164 -1.615 51.979 1.00 16.31 ? 158 ASN C CA 1 ATOM 4491 C C . ASN C 1 158 ? -20.280 -0.670 51.553 1.00 18.65 ? 158 ASN C C 1 ATOM 4492 O O . ASN C 1 158 ? -21.364 -0.654 52.143 1.00 18.47 ? 158 ASN C O 1 ATOM 4493 C CB . ASN C 1 158 ? -19.411 -2.144 53.392 1.00 13.50 ? 158 ASN C CB 1 ATOM 4494 C CG . ASN C 1 158 ? -19.255 -1.075 54.457 1.00 14.10 ? 158 ASN C CG 1 ATOM 4495 O OD1 . ASN C 1 158 ? -18.976 0.086 54.157 1.00 20.37 ? 158 ASN C OD1 1 ATOM 4496 N ND2 . ASN C 1 158 ? -19.441 -1.463 55.709 1.00 19.54 ? 158 ASN C ND2 1 ATOM 4497 N N . SER C 1 159 ? -20.037 0.130 50.516 1.00 17.40 ? 159 SER C N 1 ATOM 4498 C CA . SER C 1 159 ? -21.053 1.041 50.009 1.00 22.81 ? 159 SER C CA 1 ATOM 4499 C C . SER C 1 159 ? -20.908 1.183 48.500 1.00 25.35 ? 159 SER C C 1 ATOM 4500 O O . SER C 1 159 ? -19.808 1.063 47.951 1.00 19.15 ? 159 SER C O 1 ATOM 4501 C CB . SER C 1 159 ? -20.968 2.419 50.680 1.00 19.23 ? 159 SER C CB 1 ATOM 4502 O OG . SER C 1 159 ? -19.729 3.049 50.408 1.00 16.32 ? 159 SER C OG 1 ATOM 4503 N N . GLN C 1 160 ? -22.035 1.436 47.836 1.00 21.79 ? 160 GLN C N 1 ATOM 4504 C CA . GLN C 1 160 ? -22.071 1.646 46.396 1.00 18.31 ? 160 GLN C CA 1 ATOM 4505 C C . GLN C 1 160 ? -22.959 2.839 46.078 1.00 12.82 ? 160 GLN C C 1 ATOM 4506 O O . GLN C 1 160 ? -24.011 3.023 46.696 1.00 13.33 ? 160 GLN C O 1 ATOM 4507 C CB . GLN C 1 160 ? -22.584 0.404 45.654 1.00 13.34 ? 160 GLN C CB 1 ATOM 4508 C CG . GLN C 1 160 ? -21.624 -0.772 45.667 1.00 19.25 ? 160 GLN C CG 1 ATOM 4509 C CD . GLN C 1 160 ? -22.109 -1.935 44.822 1.00 31.22 ? 160 GLN C CD 1 ATOM 4510 O OE1 . GLN C 1 160 ? -23.096 -2.592 45.155 1.00 45.14 ? 160 GLN C OE1 1 ATOM 4511 N NE2 . GLN C 1 160 ? -21.416 -2.194 43.718 1.00 23.09 ? 160 GLN C NE2 1 ATOM 4512 N N . GLU C 1 161 ? -22.532 3.643 45.111 1.00 18.61 ? 161 GLU C N 1 ATOM 4513 C CA . GLU C 1 161 ? -23.284 4.805 44.669 1.00 21.39 ? 161 GLU C CA 1 ATOM 4514 C C . GLU C 1 161 ? -23.904 4.551 43.304 1.00 16.61 ? 161 GLU C C 1 ATOM 4515 O O . GLU C 1 161 ? -23.453 3.701 42.534 1.00 19.89 ? 161 GLU C O 1 ATOM 4516 C CB . GLU C 1 161 ? -22.395 6.049 44.595 1.00 23.04 ? 161 GLU C CB 1 ATOM 4517 C CG . GLU C 1 161 ? -21.812 6.476 45.918 1.00 21.31 ? 161 GLU C CG 1 ATOM 4518 C CD . GLU C 1 161 ? -20.931 7.695 45.778 1.00 39.36 ? 161 GLU C CD 1 ATOM 4519 O OE1 . GLU C 1 161 ? -20.604 8.064 44.631 1.00 42.06 ? 161 GLU C OE1 1 ATOM 4520 O OE2 . GLU C 1 161 ? -20.571 8.289 46.814 1.00 47.77 ? 161 GLU C OE2 1 ATOM 4521 N N . SER C 1 162 ? -24.947 5.320 43.015 1.00 21.25 ? 162 SER C N 1 ATOM 4522 C CA . SER C 1 162 ? -25.597 5.299 41.716 1.00 18.37 ? 162 SER C CA 1 ATOM 4523 C C . SER C 1 162 ? -26.133 6.695 41.447 1.00 22.04 ? 162 SER C C 1 ATOM 4524 O O . SER C 1 162 ? -26.734 7.315 42.329 1.00 28.09 ? 162 SER C O 1 ATOM 4525 C CB . SER C 1 162 ? -26.723 4.263 41.669 1.00 16.03 ? 162 SER C CB 1 ATOM 4526 O OG . SER C 1 162 ? -27.238 4.138 40.357 1.00 30.37 ? 162 SER C OG 1 ATOM 4527 N N . VAL C 1 163 ? -25.902 7.192 40.237 1.00 14.14 ? 163 VAL C N 1 ATOM 4528 C CA . VAL C 1 163 ? -26.237 8.565 39.882 1.00 23.12 ? 163 VAL C CA 1 ATOM 4529 C C . VAL C 1 163 ? -27.146 8.550 38.663 1.00 23.12 ? 163 VAL C C 1 ATOM 4530 O O . VAL C 1 163 ? -26.810 7.944 37.639 1.00 24.71 ? 163 VAL C O 1 ATOM 4531 C CB . VAL C 1 163 ? -24.976 9.405 39.600 1.00 19.63 ? 163 VAL C CB 1 ATOM 4532 C CG1 . VAL C 1 163 ? -25.360 10.824 39.224 1.00 22.96 ? 163 VAL C CG1 1 ATOM 4533 C CG2 . VAL C 1 163 ? -24.055 9.402 40.806 1.00 14.40 ? 163 VAL C CG2 1 ATOM 4534 N N . THR C 1 164 ? -28.289 9.222 38.770 1.00 21.64 ? 164 THR C N 1 ATOM 4535 C CA . THR C 1 164 ? -29.165 9.377 37.622 1.00 19.41 ? 164 THR C CA 1 ATOM 4536 C C . THR C 1 164 ? -28.490 10.227 36.551 1.00 24.20 ? 164 THR C C 1 ATOM 4537 O O . THR C 1 164 ? -27.560 10.992 36.818 1.00 22.52 ? 164 THR C O 1 ATOM 4538 C CB . THR C 1 164 ? -30.487 10.027 38.035 1.00 21.42 ? 164 THR C CB 1 ATOM 4539 O OG1 . THR C 1 164 ? -30.223 11.271 38.697 1.00 27.52 ? 164 THR C OG1 1 ATOM 4540 C CG2 . THR C 1 164 ? -31.263 9.114 38.971 1.00 14.68 ? 164 THR C CG2 1 ATOM 4541 N N . GLU C 1 165 ? -28.965 10.081 35.318 1.00 26.63 ? 165 GLU C N 1 ATOM 4542 C CA . GLU C 1 165 ? -28.565 11.022 34.289 1.00 25.27 ? 165 GLU C CA 1 ATOM 4543 C C . GLU C 1 165 ? -29.216 12.379 34.553 1.00 22.02 ? 165 GLU C C 1 ATOM 4544 O O . GLU C 1 165 ? -30.087 12.526 35.416 1.00 25.02 ? 165 GLU C O 1 ATOM 4545 C CB . GLU C 1 165 ? -28.931 10.497 32.899 1.00 35.91 ? 165 GLU C CB 1 ATOM 4546 C CG . GLU C 1 165 ? -28.089 9.303 32.437 1.00 39.86 ? 165 GLU C CG 1 ATOM 4547 C CD . GLU C 1 165 ? -26.639 9.681 32.190 1.00 37.55 ? 165 GLU C CD 1 ATOM 4548 O OE1 . GLU C 1 165 ? -26.357 10.894 32.106 1.00 39.07 ? 165 GLU C OE1 1 ATOM 4549 O OE2 . GLU C 1 165 ? -25.783 8.776 32.078 1.00 31.34 ? 165 GLU C OE2 1 ATOM 4550 N N . GLN C 1 166 ? -28.777 13.382 33.801 1.00 17.27 ? 166 GLN C N 1 ATOM 4551 C CA . GLN C 1 166 ? -29.242 14.742 34.036 1.00 17.28 ? 166 GLN C CA 1 ATOM 4552 C C . GLN C 1 166 ? -30.738 14.846 33.762 1.00 24.59 ? 166 GLN C C 1 ATOM 4553 O O . GLN C 1 166 ? -31.237 14.329 32.758 1.00 26.01 ? 166 GLN C O 1 ATOM 4554 C CB . GLN C 1 166 ? -28.465 15.720 33.158 1.00 23.36 ? 166 GLN C CB 1 ATOM 4555 C CG . GLN C 1 166 ? -27.939 16.934 33.898 1.00 26.47 ? 166 GLN C CG 1 ATOM 4556 C CD . GLN C 1 166 ? -27.165 17.875 32.995 1.00 29.26 ? 166 GLN C CD 1 ATOM 4557 O OE1 . GLN C 1 166 ? -26.679 17.479 31.934 1.00 28.08 ? 166 GLN C OE1 1 ATOM 4558 N NE2 . GLN C 1 166 ? -27.052 19.132 33.410 1.00 28.43 ? 166 GLN C NE2 1 ATOM 4559 N N . ASP C 1 167 ? -31.457 15.500 34.670 1.00 21.92 ? 167 ASP C N 1 ATOM 4560 C CA . ASP C 1 167 ? -32.904 15.598 34.544 1.00 24.83 ? 167 ASP C CA 1 ATOM 4561 C C . ASP C 1 167 ? -33.277 16.529 33.397 1.00 21.72 ? 167 ASP C C 1 ATOM 4562 O O . ASP C 1 167 ? -32.699 17.606 33.236 1.00 19.48 ? 167 ASP C O 1 ATOM 4563 C CB . ASP C 1 167 ? -33.518 16.095 35.853 1.00 27.92 ? 167 ASP C CB 1 ATOM 4564 C CG . ASP C 1 167 ? -35.031 15.981 35.866 1.00 29.82 ? 167 ASP C CG 1 ATOM 4565 O OD1 . ASP C 1 167 ? -35.544 14.903 36.243 1.00 25.17 ? 167 ASP C OD1 1 ATOM 4566 O OD2 . ASP C 1 167 ? -35.703 16.968 35.497 1.00 27.06 ? 167 ASP C OD2 1 ATOM 4567 N N . SER C 1 168 ? -34.253 16.110 32.595 1.00 17.89 ? 168 SER C N 1 ATOM 4568 C CA . SER C 1 168 ? -34.591 16.850 31.385 1.00 31.79 ? 168 SER C CA 1 ATOM 4569 C C . SER C 1 168 ? -35.393 18.114 31.660 1.00 34.25 ? 168 SER C C 1 ATOM 4570 O O . SER C 1 168 ? -35.697 18.846 30.712 1.00 31.96 ? 168 SER C O 1 ATOM 4571 C CB . SER C 1 168 ? -35.363 15.957 30.405 1.00 19.05 ? 168 SER C CB 1 ATOM 4572 O OG . SER C 1 168 ? -36.650 15.630 30.900 1.00 21.55 ? 168 SER C OG 1 ATOM 4573 N N . LYS C 1 169 ? -35.734 18.396 32.916 1.00 35.44 ? 169 LYS C N 1 ATOM 4574 C CA . LYS C 1 169 ? -36.516 19.576 33.262 1.00 18.88 ? 169 LYS C CA 1 ATOM 4575 C C . LYS C 1 169 ? -35.727 20.615 34.045 1.00 28.44 ? 169 LYS C C 1 ATOM 4576 O O . LYS C 1 169 ? -35.789 21.804 33.719 1.00 34.26 ? 169 LYS C O 1 ATOM 4577 C CB . LYS C 1 169 ? -37.764 19.163 34.054 1.00 18.83 ? 169 LYS C CB 1 ATOM 4578 N N . ASP C 1 170 ? -34.978 20.207 35.073 1.00 23.42 ? 170 ASP C N 1 ATOM 4579 C CA . ASP C 1 170 ? -34.196 21.150 35.862 1.00 22.66 ? 170 ASP C CA 1 ATOM 4580 C C . ASP C 1 170 ? -32.693 20.922 35.783 1.00 21.30 ? 170 ASP C C 1 ATOM 4581 O O . ASP C 1 170 ? -31.943 21.640 36.454 1.00 21.31 ? 170 ASP C O 1 ATOM 4582 C CB . ASP C 1 170 ? -34.643 21.136 37.334 1.00 24.17 ? 170 ASP C CB 1 ATOM 4583 C CG . ASP C 1 170 ? -34.580 19.756 37.966 1.00 28.69 ? 170 ASP C CG 1 ATOM 4584 O OD1 . ASP C 1 170 ? -33.866 18.875 37.445 1.00 24.27 ? 170 ASP C OD1 1 ATOM 4585 O OD2 . ASP C 1 170 ? -35.248 19.558 39.003 1.00 28.19 ? 170 ASP C OD2 1 ATOM 4586 N N . SER C 1 171 ? -32.234 19.947 34.997 1.00 18.52 ? 171 SER C N 1 ATOM 4587 C CA . SER C 1 171 ? -30.817 19.724 34.709 1.00 27.02 ? 171 SER C CA 1 ATOM 4588 C C . SER C 1 171 ? -30.018 19.300 35.938 1.00 24.62 ? 171 SER C C 1 ATOM 4589 O O . SER C 1 171 ? -28.795 19.471 35.972 1.00 20.40 ? 171 SER C O 1 ATOM 4590 C CB . SER C 1 171 ? -30.180 20.964 34.070 1.00 25.14 ? 171 SER C CB 1 ATOM 4591 O OG . SER C 1 171 ? -30.902 21.368 32.919 1.00 22.95 ? 171 SER C OG 1 ATOM 4592 N N . THR C 1 172 ? -30.677 18.730 36.941 1.00 17.62 ? 172 THR C N 1 ATOM 4593 C CA . THR C 1 172 ? -30.013 18.296 38.161 1.00 19.34 ? 172 THR C CA 1 ATOM 4594 C C . THR C 1 172 ? -29.679 16.808 38.102 1.00 16.75 ? 172 THR C C 1 ATOM 4595 O O . THR C 1 172 ? -30.135 16.066 37.228 1.00 24.73 ? 172 THR C O 1 ATOM 4596 C CB . THR C 1 172 ? -30.882 18.584 39.389 1.00 19.43 ? 172 THR C CB 1 ATOM 4597 O OG1 . THR C 1 172 ? -32.064 17.774 39.344 1.00 18.37 ? 172 THR C OG1 1 ATOM 4598 C CG2 . THR C 1 172 ? -31.279 20.054 39.432 1.00 18.29 ? 172 THR C CG2 1 ATOM 4599 N N . TYR C 1 173 ? -28.860 16.381 39.057 1.00 17.78 ? 173 TYR C N 1 ATOM 4600 C CA . TYR C 1 173 ? -28.526 14.983 39.272 1.00 20.95 ? 173 TYR C CA 1 ATOM 4601 C C . TYR C 1 173 ? -29.086 14.527 40.612 1.00 22.32 ? 173 TYR C C 1 ATOM 4602 O O . TYR C 1 173 ? -29.375 15.338 41.496 1.00 20.69 ? 173 TYR C O 1 ATOM 4603 C CB . TYR C 1 173 ? -27.009 14.759 39.254 1.00 20.16 ? 173 TYR C CB 1 ATOM 4604 C CG . TYR C 1 173 ? -26.326 15.148 37.967 1.00 28.75 ? 173 TYR C CG 1 ATOM 4605 C CD1 . TYR C 1 173 ? -25.862 16.442 37.768 1.00 31.94 ? 173 TYR C CD1 1 ATOM 4606 C CD2 . TYR C 1 173 ? -26.132 14.218 36.955 1.00 33.84 ? 173 TYR C CD2 1 ATOM 4607 C CE1 . TYR C 1 173 ? -25.234 16.801 36.592 1.00 29.63 ? 173 TYR C CE1 1 ATOM 4608 C CE2 . TYR C 1 173 ? -25.503 14.567 35.775 1.00 33.00 ? 173 TYR C CE2 1 ATOM 4609 C CZ . TYR C 1 173 ? -25.057 15.859 35.600 1.00 27.65 ? 173 TYR C CZ 1 ATOM 4610 O OH . TYR C 1 173 ? -24.432 16.209 34.427 1.00 29.46 ? 173 TYR C OH 1 ATOM 4611 N N . SER C 1 174 ? -29.229 13.213 40.757 1.00 14.72 ? 174 SER C N 1 ATOM 4612 C CA . SER C 1 174 ? -29.587 12.622 42.036 1.00 16.55 ? 174 SER C CA 1 ATOM 4613 C C . SER C 1 174 ? -28.714 11.402 42.281 1.00 14.03 ? 174 SER C C 1 ATOM 4614 O O . SER C 1 174 ? -28.338 10.688 41.348 1.00 29.91 ? 174 SER C O 1 ATOM 4615 C CB . SER C 1 174 ? -31.074 12.248 42.104 1.00 14.53 ? 174 SER C CB 1 ATOM 4616 O OG . SER C 1 174 ? -31.874 13.406 42.292 1.00 15.04 ? 174 SER C OG 1 ATOM 4617 N N . LEU C 1 175 ? -28.387 11.180 43.550 1.00 16.04 ? 175 LEU C N 1 ATOM 4618 C CA . LEU C 1 175 ? -27.478 10.120 43.953 1.00 15.41 ? 175 LEU C CA 1 ATOM 4619 C C . LEU C 1 175 ? -28.120 9.297 45.058 1.00 21.06 ? 175 LEU C C 1 ATOM 4620 O O . LEU C 1 175 ? -28.844 9.830 45.905 1.00 14.48 ? 175 LEU C O 1 ATOM 4621 C CB . LEU C 1 175 ? -26.136 10.701 44.431 1.00 19.28 ? 175 LEU C CB 1 ATOM 4622 C CG . LEU C 1 175 ? -24.980 9.760 44.790 1.00 25.51 ? 175 LEU C CG 1 ATOM 4623 C CD1 . LEU C 1 175 ? -23.649 10.440 44.509 1.00 15.53 ? 175 LEU C CD1 1 ATOM 4624 C CD2 . LEU C 1 175 ? -25.042 9.325 46.249 1.00 13.93 ? 175 LEU C CD2 1 ATOM 4625 N N . SER C 1 176 ? -27.856 7.992 45.037 1.00 20.01 ? 176 SER C N 1 ATOM 4626 C CA . SER C 1 176 ? -28.246 7.090 46.112 1.00 20.07 ? 176 SER C CA 1 ATOM 4627 C C . SER C 1 176 ? -27.041 6.249 46.500 1.00 27.48 ? 176 SER C C 1 ATOM 4628 O O . SER C 1 176 ? -26.439 5.589 45.647 1.00 29.09 ? 176 SER C O 1 ATOM 4629 C CB . SER C 1 176 ? -29.409 6.183 45.702 1.00 14.80 ? 176 SER C CB 1 ATOM 4630 O OG . SER C 1 176 ? -28.977 5.184 44.793 1.00 32.62 ? 176 SER C OG 1 ATOM 4631 N N . SER C 1 177 ? -26.688 6.284 47.780 1.00 32.32 ? 177 SER C N 1 ATOM 4632 C CA . SER C 1 177 ? -25.628 5.456 48.335 1.00 18.69 ? 177 SER C CA 1 ATOM 4633 C C . SER C 1 177 ? -26.260 4.369 49.191 1.00 17.18 ? 177 SER C C 1 ATOM 4634 O O . SER C 1 177 ? -27.126 4.655 50.023 1.00 18.70 ? 177 SER C O 1 ATOM 4635 C CB . SER C 1 177 ? -24.655 6.295 49.167 1.00 19.81 ? 177 SER C CB 1 ATOM 4636 O OG . SER C 1 177 ? -23.580 5.505 49.644 1.00 27.22 ? 177 SER C OG 1 ATOM 4637 N N . THR C 1 178 ? -25.838 3.128 48.983 1.00 24.69 ? 178 THR C N 1 ATOM 4638 C CA . THR C 1 178 ? -26.369 1.989 49.723 1.00 12.81 ? 178 THR C CA 1 ATOM 4639 C C . THR C 1 178 ? -25.247 1.378 50.551 1.00 22.90 ? 178 THR C C 1 ATOM 4640 O O . THR C 1 178 ? -24.253 0.894 49.998 1.00 16.50 ? 178 THR C O 1 ATOM 4641 C CB . THR C 1 178 ? -26.983 0.957 48.778 1.00 13.63 ? 178 THR C CB 1 ATOM 4642 O OG1 . THR C 1 178 ? -28.011 1.579 47.996 1.00 34.52 ? 178 THR C OG1 1 ATOM 4643 C CG2 . THR C 1 178 ? -27.586 -0.192 49.569 1.00 16.36 ? 178 THR C CG2 1 ATOM 4644 N N . LEU C 1 179 ? -25.400 1.420 51.872 1.00 23.56 ? 179 LEU C N 1 ATOM 4645 C CA . LEU C 1 179 ? -24.482 0.761 52.790 1.00 18.25 ? 179 LEU C CA 1 ATOM 4646 C C . LEU C 1 179 ? -25.005 -0.635 53.103 1.00 12.88 ? 179 LEU C C 1 ATOM 4647 O O . LEU C 1 179 ? -26.154 -0.792 53.528 1.00 18.44 ? 179 LEU C O 1 ATOM 4648 C CB . LEU C 1 179 ? -24.334 1.571 54.079 1.00 12.45 ? 179 LEU C CB 1 ATOM 4649 C CG . LEU C 1 179 ? -23.458 0.977 55.184 1.00 18.28 ? 179 LEU C CG 1 ATOM 4650 C CD1 . LEU C 1 179 ? -21.984 1.163 54.865 1.00 21.96 ? 179 LEU C CD1 1 ATOM 4651 C CD2 . LEU C 1 179 ? -23.801 1.595 56.529 1.00 13.09 ? 179 LEU C CD2 1 ATOM 4652 N N . THR C 1 180 ? -24.168 -1.645 52.892 1.00 19.70 ? 180 THR C N 1 ATOM 4653 C CA . THR C 1 180 ? -24.559 -3.034 53.106 1.00 18.93 ? 180 THR C CA 1 ATOM 4654 C C . THR C 1 180 ? -23.806 -3.598 54.303 1.00 20.56 ? 180 THR C C 1 ATOM 4655 O O . THR C 1 180 ? -22.571 -3.620 54.314 1.00 24.35 ? 180 THR C O 1 ATOM 4656 C CB . THR C 1 180 ? -24.299 -3.882 51.862 1.00 25.82 ? 180 THR C CB 1 ATOM 4657 O OG1 . THR C 1 180 ? -25.000 -3.318 50.748 1.00 30.22 ? 180 THR C OG1 1 ATOM 4658 C CG2 . THR C 1 180 ? -24.792 -5.302 52.086 1.00 24.35 ? 180 THR C CG2 1 ATOM 4659 N N . LEU C 1 181 ? -24.558 -4.046 55.304 1.00 25.05 ? 181 LEU C N 1 ATOM 4660 C CA . LEU C 1 181 ? -24.019 -4.642 56.514 1.00 20.11 ? 181 LEU C CA 1 ATOM 4661 C C . LEU C 1 181 ? -24.697 -5.982 56.746 1.00 25.37 ? 181 LEU C C 1 ATOM 4662 O O . LEU C 1 181 ? -25.843 -6.191 56.339 1.00 32.75 ? 181 LEU C O 1 ATOM 4663 C CB . LEU C 1 181 ? -24.249 -3.745 57.740 1.00 23.13 ? 181 LEU C CB 1 ATOM 4664 C CG . LEU C 1 181 ? -23.621 -2.352 57.762 1.00 23.17 ? 181 LEU C CG 1 ATOM 4665 C CD1 . LEU C 1 181 ? -24.139 -1.559 58.951 1.00 14.37 ? 181 LEU C CD1 1 ATOM 4666 C CD2 . LEU C 1 181 ? -22.108 -2.458 57.813 1.00 15.12 ? 181 LEU C CD2 1 ATOM 4667 N N . SER C 1 182 ? -23.983 -6.891 57.403 1.00 16.24 ? 182 SER C N 1 ATOM 4668 C CA . SER C 1 182 ? -24.626 -8.106 57.878 1.00 18.45 ? 182 SER C CA 1 ATOM 4669 C C . SER C 1 182 ? -25.645 -7.752 58.955 1.00 16.70 ? 182 SER C C 1 ATOM 4670 O O . SER C 1 182 ? -25.548 -6.710 59.610 1.00 16.28 ? 182 SER C O 1 ATOM 4671 C CB . SER C 1 182 ? -23.590 -9.087 58.431 1.00 30.67 ? 182 SER C CB 1 ATOM 4672 O OG . SER C 1 182 ? -23.097 -8.656 59.690 1.00 21.55 ? 182 SER C OG 1 ATOM 4673 N N . LYS C 1 183 ? -26.645 -8.620 59.126 1.00 25.11 ? 183 LYS C N 1 ATOM 4674 C CA . LYS C 1 183 ? -27.615 -8.398 60.193 1.00 22.03 ? 183 LYS C CA 1 ATOM 4675 C C . LYS C 1 183 ? -26.924 -8.338 61.549 1.00 23.22 ? 183 LYS C C 1 ATOM 4676 O O . LYS C 1 183 ? -27.293 -7.530 62.407 1.00 24.75 ? 183 LYS C O 1 ATOM 4677 C CB . LYS C 1 183 ? -28.684 -9.491 60.184 1.00 22.70 ? 183 LYS C CB 1 ATOM 4678 C CG . LYS C 1 183 ? -29.732 -9.336 61.285 1.00 33.00 ? 183 LYS C CG 1 ATOM 4679 C CD . LYS C 1 183 ? -30.584 -10.589 61.440 1.00 40.91 ? 183 LYS C CD 1 ATOM 4680 C CE . LYS C 1 183 ? -31.579 -10.452 62.586 1.00 34.71 ? 183 LYS C CE 1 ATOM 4681 N NZ . LYS C 1 183 ? -32.347 -11.711 62.809 1.00 27.98 ? 183 LYS C NZ 1 ATOM 4682 N N . ALA C 1 184 ? -25.905 -9.175 61.748 1.00 23.00 ? 184 ALA C N 1 ATOM 4683 C CA . ALA C 1 184 ? -25.167 -9.173 63.006 1.00 30.34 ? 184 ALA C CA 1 ATOM 4684 C C . ALA C 1 184 ? -24.503 -7.823 63.256 1.00 30.24 ? 184 ALA C C 1 ATOM 4685 O O . ALA C 1 184 ? -24.683 -7.220 64.321 1.00 26.72 ? 184 ALA C O 1 ATOM 4686 C CB . ALA C 1 184 ? -24.128 -10.295 63.001 1.00 33.61 ? 184 ALA C CB 1 ATOM 4687 N N . ASP C 1 185 ? -23.726 -7.334 62.285 1.00 30.28 ? 185 ASP C N 1 ATOM 4688 C CA . ASP C 1 185 ? -23.059 -6.047 62.453 1.00 36.43 ? 185 ASP C CA 1 ATOM 4689 C C . ASP C 1 185 ? -24.067 -4.937 62.726 1.00 31.19 ? 185 ASP C C 1 ATOM 4690 O O . ASP C 1 185 ? -23.862 -4.109 63.622 1.00 26.07 ? 185 ASP C O 1 ATOM 4691 C CB . ASP C 1 185 ? -22.219 -5.715 61.216 1.00 41.88 ? 185 ASP C CB 1 ATOM 4692 C CG . ASP C 1 185 ? -20.924 -6.505 61.157 1.00 53.90 ? 185 ASP C CG 1 ATOM 4693 O OD1 . ASP C 1 185 ? -20.484 -7.012 62.210 1.00 60.37 ? 185 ASP C OD1 1 ATOM 4694 O OD2 . ASP C 1 185 ? -20.341 -6.614 60.057 1.00 57.87 ? 185 ASP C OD2 1 ATOM 4695 N N . TYR C 1 186 ? -25.172 -4.919 61.975 1.00 16.79 ? 186 TYR C N 1 ATOM 4696 C CA . TYR C 1 186 ? -26.170 -3.869 62.139 1.00 16.51 ? 186 TYR C CA 1 ATOM 4697 C C . TYR C 1 186 ? -26.782 -3.882 63.536 1.00 30.89 ? 186 TYR C C 1 ATOM 4698 O O . TYR C 1 186 ? -27.081 -2.818 64.091 1.00 26.45 ? 186 TYR C O 1 ATOM 4699 C CB . TYR C 1 186 ? -27.257 -4.016 61.071 1.00 15.88 ? 186 TYR C CB 1 ATOM 4700 C CG . TYR C 1 186 ? -28.403 -3.038 61.218 1.00 15.98 ? 186 TYR C CG 1 ATOM 4701 C CD1 . TYR C 1 186 ? -28.258 -1.707 60.854 1.00 15.45 ? 186 TYR C CD1 1 ATOM 4702 C CD2 . TYR C 1 186 ? -29.632 -3.451 61.714 1.00 16.92 ? 186 TYR C CD2 1 ATOM 4703 C CE1 . TYR C 1 186 ? -29.302 -0.810 60.989 1.00 15.83 ? 186 TYR C CE1 1 ATOM 4704 C CE2 . TYR C 1 186 ? -30.683 -2.564 61.850 1.00 35.32 ? 186 TYR C CE2 1 ATOM 4705 C CZ . TYR C 1 186 ? -30.512 -1.244 61.488 1.00 34.61 ? 186 TYR C CZ 1 ATOM 4706 O OH . TYR C 1 186 ? -31.559 -0.360 61.623 1.00 17.70 ? 186 TYR C OH 1 ATOM 4707 N N . GLU C 1 187 ? -26.961 -5.064 64.131 1.00 31.95 ? 187 GLU C N 1 ATOM 4708 C CA . GLU C 1 187 ? -27.586 -5.139 65.446 1.00 27.85 ? 187 GLU C CA 1 ATOM 4709 C C . GLU C 1 187 ? -26.639 -4.765 66.580 1.00 29.42 ? 187 GLU C C 1 ATOM 4710 O O . GLU C 1 187 ? -27.102 -4.523 67.700 1.00 28.98 ? 187 GLU C O 1 ATOM 4711 C CB . GLU C 1 187 ? -28.144 -6.541 65.696 1.00 32.10 ? 187 GLU C CB 1 ATOM 4712 C CG . GLU C 1 187 ? -29.274 -6.955 64.761 1.00 36.16 ? 187 GLU C CG 1 ATOM 4713 C CD . GLU C 1 187 ? -30.571 -6.203 65.010 1.00 47.28 ? 187 GLU C CD 1 ATOM 4714 O OE1 . GLU C 1 187 ? -30.639 -5.410 65.974 1.00 54.69 ? 187 GLU C OE1 1 ATOM 4715 O OE2 . GLU C 1 187 ? -31.531 -6.412 64.237 1.00 48.98 ? 187 GLU C OE2 1 ATOM 4716 N N . LYS C 1 188 ? -25.335 -4.715 66.324 1.00 27.65 ? 188 LYS C N 1 ATOM 4717 C CA . LYS C 1 188 ? -24.360 -4.386 67.355 1.00 29.91 ? 188 LYS C CA 1 ATOM 4718 C C . LYS C 1 188 ? -24.099 -2.891 67.481 1.00 29.63 ? 188 LYS C C 1 ATOM 4719 O O . LYS C 1 188 ? -23.326 -2.487 68.355 1.00 36.63 ? 188 LYS C O 1 ATOM 4720 C CB . LYS C 1 188 ? -23.034 -5.107 67.086 1.00 29.94 ? 188 LYS C CB 1 ATOM 4721 C CG . LYS C 1 188 ? -23.086 -6.611 67.290 1.00 42.06 ? 188 LYS C CG 1 ATOM 4722 C CD . LYS C 1 188 ? -21.767 -7.259 66.896 1.00 54.99 ? 188 LYS C CD 1 ATOM 4723 C CE . LYS C 1 188 ? -21.810 -8.770 67.071 1.00 54.71 ? 188 LYS C CE 1 ATOM 4724 N NZ . LYS C 1 188 ? -22.885 -9.404 66.256 1.00 46.31 ? 188 LYS C NZ 1 ATOM 4725 N N . HIS C 1 189 ? -24.720 -2.062 66.645 1.00 25.69 ? 189 HIS C N 1 ATOM 4726 C CA . HIS C 1 189 ? -24.442 -0.635 66.629 1.00 26.90 ? 189 HIS C CA 1 ATOM 4727 C C . HIS C 1 189 ? -25.746 0.150 66.618 1.00 28.24 ? 189 HIS C C 1 ATOM 4728 O O . HIS C 1 189 ? -26.818 -0.389 66.333 1.00 35.71 ? 189 HIS C O 1 ATOM 4729 C CB . HIS C 1 189 ? -23.570 -0.259 65.427 1.00 35.02 ? 189 HIS C CB 1 ATOM 4730 C CG . HIS C 1 189 ? -22.229 -0.924 65.430 1.00 38.98 ? 189 HIS C CG 1 ATOM 4731 N ND1 . HIS C 1 189 ? -21.915 -1.970 64.589 1.00 43.03 ? 189 HIS C ND1 1 ATOM 4732 C CD2 . HIS C 1 189 ? -21.127 -0.705 66.186 1.00 35.54 ? 189 HIS C CD2 1 ATOM 4733 C CE1 . HIS C 1 189 ? -20.673 -2.358 64.818 1.00 42.99 ? 189 HIS C CE1 1 ATOM 4734 N NE2 . HIS C 1 189 ? -20.173 -1.607 65.783 1.00 33.79 ? 189 HIS C NE2 1 ATOM 4735 N N . LYS C 1 190 ? -25.639 1.443 66.932 1.00 21.97 ? 190 LYS C N 1 ATOM 4736 C CA . LYS C 1 190 ? -26.809 2.271 67.207 1.00 22.68 ? 190 LYS C CA 1 ATOM 4737 C C . LYS C 1 190 ? -26.946 3.444 66.247 1.00 25.46 ? 190 LYS C C 1 ATOM 4738 O O . LYS C 1 190 ? -27.988 3.580 65.598 1.00 29.42 ? 190 LYS C O 1 ATOM 4739 C CB . LYS C 1 190 ? -26.754 2.780 68.652 1.00 25.40 ? 190 LYS C CB 1 ATOM 4740 C CG . LYS C 1 190 ? -28.017 3.500 69.105 1.00 41.68 ? 190 LYS C CG 1 ATOM 4741 C CD . LYS C 1 190 ? -27.710 4.509 70.202 1.00 52.25 ? 190 LYS C CD 1 ATOM 4742 C CE . LYS C 1 190 ? -28.980 5.022 70.863 1.00 53.40 ? 190 LYS C CE 1 ATOM 4743 N NZ . LYS C 1 190 ? -28.676 6.100 71.846 1.00 49.23 ? 190 LYS C NZ 1 ATOM 4744 N N . VAL C 1 191 ? -25.939 4.305 66.151 1.00 21.92 ? 191 VAL C N 1 ATOM 4745 C CA . VAL C 1 191 ? -26.038 5.540 65.381 1.00 21.42 ? 191 VAL C CA 1 ATOM 4746 C C . VAL C 1 191 ? -25.600 5.275 63.948 1.00 19.36 ? 191 VAL C C 1 ATOM 4747 O O . VAL C 1 191 ? -24.513 4.735 63.708 1.00 30.10 ? 191 VAL C O 1 ATOM 4748 C CB . VAL C 1 191 ? -25.191 6.654 66.018 1.00 23.10 ? 191 VAL C CB 1 ATOM 4749 C CG1 . VAL C 1 191 ? -25.358 7.958 65.251 1.00 22.78 ? 191 VAL C CG1 1 ATOM 4750 C CG2 . VAL C 1 191 ? -25.566 6.838 67.478 1.00 32.93 ? 191 VAL C CG2 1 ATOM 4751 N N . TYR C 1 192 ? -26.442 5.663 62.993 1.00 18.35 ? 192 TYR C N 1 ATOM 4752 C CA . TYR C 1 192 ? -26.145 5.520 61.574 1.00 22.72 ? 192 TYR C CA 1 ATOM 4753 C C . TYR C 1 192 ? -26.312 6.873 60.906 1.00 21.31 ? 192 TYR C C 1 ATOM 4754 O O . TYR C 1 192 ? -27.336 7.537 61.092 1.00 27.14 ? 192 TYR C O 1 ATOM 4755 C CB . TYR C 1 192 ? -27.056 4.479 60.920 1.00 22.34 ? 192 TYR C CB 1 ATOM 4756 C CG . TYR C 1 192 ? -26.801 3.082 61.427 1.00 28.06 ? 192 TYR C CG 1 ATOM 4757 C CD1 . TYR C 1 192 ? -27.389 2.631 62.602 1.00 16.96 ? 192 TYR C CD1 1 ATOM 4758 C CD2 . TYR C 1 192 ? -25.956 2.220 60.741 1.00 15.06 ? 192 TYR C CD2 1 ATOM 4759 C CE1 . TYR C 1 192 ? -27.148 1.357 63.074 1.00 17.16 ? 192 TYR C CE1 1 ATOM 4760 C CE2 . TYR C 1 192 ? -25.709 0.946 61.205 1.00 15.33 ? 192 TYR C CE2 1 ATOM 4761 C CZ . TYR C 1 192 ? -26.306 0.520 62.372 1.00 26.89 ? 192 TYR C CZ 1 ATOM 4762 O OH . TYR C 1 192 ? -26.062 -0.750 62.834 1.00 35.67 ? 192 TYR C OH 1 ATOM 4763 N N . ALA C 1 193 ? -25.309 7.281 60.133 1.00 20.39 ? 193 ALA C N 1 ATOM 4764 C CA . ALA C 1 193 ? -25.326 8.599 59.521 1.00 25.90 ? 193 ALA C CA 1 ATOM 4765 C C . ALA C 1 193 ? -24.655 8.548 58.160 1.00 23.95 ? 193 ALA C C 1 ATOM 4766 O O . ALA C 1 193 ? -23.746 7.748 57.927 1.00 21.87 ? 193 ALA C O 1 ATOM 4767 C CB . ALA C 1 193 ? -24.624 9.634 60.410 1.00 17.84 ? 193 ALA C CB 1 ATOM 4768 N N . CYS C 1 194 ? -25.120 9.410 57.262 1.00 14.88 ? 194 CYS C N 1 ATOM 4769 C CA . CYS C 1 194 ? -24.407 9.710 56.029 1.00 36.10 ? 194 CYS C CA 1 ATOM 4770 C C . CYS C 1 194 ? -24.120 11.202 56.008 1.00 30.55 ? 194 CYS C C 1 ATOM 4771 O O . CYS C 1 194 ? -25.036 12.019 56.148 1.00 24.16 ? 194 CYS C O 1 ATOM 4772 C CB . CYS C 1 194 ? -25.188 9.276 54.783 1.00 36.71 ? 194 CYS C CB 1 ATOM 4773 S SG . CYS C 1 194 ? -26.874 9.883 54.606 1.00 46.07 ? 194 CYS C SG 1 ATOM 4774 N N . GLU C 1 195 ? -22.846 11.549 55.869 1.00 30.58 ? 195 GLU C N 1 ATOM 4775 C CA . GLU C 1 195 ? -22.412 12.934 55.781 1.00 27.65 ? 195 GLU C CA 1 ATOM 4776 C C . GLU C 1 195 ? -22.228 13.289 54.314 1.00 20.44 ? 195 GLU C C 1 ATOM 4777 O O . GLU C 1 195 ? -21.537 12.574 53.580 1.00 21.33 ? 195 GLU C O 1 ATOM 4778 C CB . GLU C 1 195 ? -21.111 13.143 56.554 1.00 22.72 ? 195 GLU C CB 1 ATOM 4779 C CG . GLU C 1 195 ? -20.753 14.592 56.789 1.00 27.68 ? 195 GLU C CG 1 ATOM 4780 C CD . GLU C 1 195 ? -19.473 14.737 57.581 1.00 40.34 ? 195 GLU C CD 1 ATOM 4781 O OE1 . GLU C 1 195 ? -18.672 13.781 57.577 1.00 49.72 ? 195 GLU C OE1 1 ATOM 4782 O OE2 . GLU C 1 195 ? -19.271 15.797 58.212 1.00 43.65 ? 195 GLU C OE2 1 ATOM 4783 N N . VAL C 1 196 ? -22.854 14.380 53.886 1.00 16.77 ? 196 VAL C N 1 ATOM 4784 C CA . VAL C 1 196 ? -22.871 14.773 52.483 1.00 16.46 ? 196 VAL C CA 1 ATOM 4785 C C . VAL C 1 196 ? -22.019 16.020 52.306 1.00 17.82 ? 196 VAL C C 1 ATOM 4786 O O . VAL C 1 196 ? -22.164 16.997 53.051 1.00 34.83 ? 196 VAL C O 1 ATOM 4787 C CB . VAL C 1 196 ? -24.304 15.006 51.980 1.00 15.90 ? 196 VAL C CB 1 ATOM 4788 C CG1 . VAL C 1 196 ? -24.277 15.571 50.570 1.00 15.97 ? 196 VAL C CG1 1 ATOM 4789 C CG2 . VAL C 1 196 ? -25.080 13.705 52.022 1.00 14.85 ? 196 VAL C CG2 1 ATOM 4790 N N . THR C 1 197 ? -21.135 15.980 51.314 1.00 27.75 ? 197 THR C N 1 ATOM 4791 C CA . THR C 1 197 ? -20.283 17.101 50.946 1.00 26.93 ? 197 THR C CA 1 ATOM 4792 C C . THR C 1 197 ? -20.508 17.417 49.474 1.00 30.58 ? 197 THR C C 1 ATOM 4793 O O . THR C 1 197 ? -20.402 16.529 48.622 1.00 46.25 ? 197 THR C O 1 ATOM 4794 C CB . THR C 1 197 ? -18.811 16.775 51.211 1.00 20.82 ? 197 THR C CB 1 ATOM 4795 O OG1 . THR C 1 197 ? -18.552 16.845 52.620 1.00 21.67 ? 197 THR C OG1 1 ATOM 4796 C CG2 . THR C 1 197 ? -17.903 17.745 50.476 1.00 33.80 ? 197 THR C CG2 1 ATOM 4797 N N . HIS C 1 198 ? -20.830 18.675 49.181 1.00 24.25 ? 198 HIS C N 1 ATOM 4798 C CA . HIS C 1 198 ? -21.124 19.092 47.817 1.00 30.42 ? 198 HIS C CA 1 ATOM 4799 C C . HIS C 1 198 ? -20.773 20.566 47.670 1.00 35.47 ? 198 HIS C C 1 ATOM 4800 O O . HIS C 1 198 ? -20.798 21.323 48.644 1.00 35.07 ? 198 HIS C O 1 ATOM 4801 C CB . HIS C 1 198 ? -22.596 18.838 47.462 1.00 19.00 ? 198 HIS C CB 1 ATOM 4802 C CG . HIS C 1 198 ? -22.970 19.262 46.076 1.00 24.14 ? 198 HIS C CG 1 ATOM 4803 N ND1 . HIS C 1 198 ? -23.501 20.503 45.796 1.00 25.54 ? 198 HIS C ND1 1 ATOM 4804 C CD2 . HIS C 1 198 ? -22.891 18.611 44.890 1.00 30.36 ? 198 HIS C CD2 1 ATOM 4805 C CE1 . HIS C 1 198 ? -23.731 20.600 44.498 1.00 25.05 ? 198 HIS C CE1 1 ATOM 4806 N NE2 . HIS C 1 198 ? -23.370 19.465 43.926 1.00 25.55 ? 198 HIS C NE2 1 ATOM 4807 N N . GLN C 1 199 ? -20.444 20.962 46.434 1.00 29.80 ? 199 GLN C N 1 ATOM 4808 C CA . GLN C 1 199 ? -20.005 22.332 46.172 1.00 36.06 ? 199 GLN C CA 1 ATOM 4809 C C . GLN C 1 199 ? -21.020 23.359 46.661 1.00 39.19 ? 199 GLN C C 1 ATOM 4810 O O . GLN C 1 199 ? -20.647 24.440 47.132 1.00 46.31 ? 199 GLN C O 1 ATOM 4811 C CB . GLN C 1 199 ? -19.741 22.519 44.677 1.00 32.63 ? 199 GLN C CB 1 ATOM 4812 C CG . GLN C 1 199 ? -19.399 23.951 44.284 1.00 39.47 ? 199 GLN C CG 1 ATOM 4813 C CD . GLN C 1 199 ? -19.185 24.123 42.795 1.00 41.58 ? 199 GLN C CD 1 ATOM 4814 O OE1 . GLN C 1 199 ? -18.979 23.151 42.071 1.00 45.72 ? 199 GLN C OE1 1 ATOM 4815 N NE2 . GLN C 1 199 ? -19.236 25.367 42.329 1.00 34.68 ? 199 GLN C NE2 1 ATOM 4816 N N . GLY C 1 200 ? -22.307 23.037 46.565 1.00 36.01 ? 200 GLY C N 1 ATOM 4817 C CA . GLY C 1 200 ? -23.363 23.922 47.006 1.00 34.33 ? 200 GLY C CA 1 ATOM 4818 C C . GLY C 1 200 ? -23.625 23.951 48.493 1.00 36.35 ? 200 GLY C C 1 ATOM 4819 O O . GLY C 1 200 ? -24.572 24.612 48.930 1.00 34.59 ? 200 GLY C O 1 ATOM 4820 N N . LEU C 1 201 ? -22.820 23.258 49.292 1.00 35.23 ? 201 LEU C N 1 ATOM 4821 C CA . LEU C 1 201 ? -22.982 23.240 50.739 1.00 38.12 ? 201 LEU C CA 1 ATOM 4822 C C . LEU C 1 201 ? -21.847 24.013 51.397 1.00 42.00 ? 201 LEU C C 1 ATOM 4823 O O . LEU C 1 201 ? -20.673 23.805 51.072 1.00 40.75 ? 201 LEU C O 1 ATOM 4824 C CB . LEU C 1 201 ? -23.027 21.806 51.270 1.00 37.88 ? 201 LEU C CB 1 ATOM 4825 C CG . LEU C 1 201 ? -24.327 21.043 51.010 1.00 33.58 ? 201 LEU C CG 1 ATOM 4826 C CD1 . LEU C 1 201 ? -24.237 19.619 51.535 1.00 28.34 ? 201 LEU C CD1 1 ATOM 4827 C CD2 . LEU C 1 201 ? -25.505 21.771 51.634 1.00 22.06 ? 201 LEU C CD2 1 ATOM 4828 N N . SER C 1 202 ? -22.205 24.912 52.318 1.00 50.56 ? 202 SER C N 1 ATOM 4829 C CA . SER C 1 202 ? -21.194 25.657 53.061 1.00 51.09 ? 202 SER C CA 1 ATOM 4830 C C . SER C 1 202 ? -20.486 24.766 54.074 1.00 49.20 ? 202 SER C C 1 ATOM 4831 O O . SER C 1 202 ? -19.267 24.862 54.246 1.00 41.78 ? 202 SER C O 1 ATOM 4832 C CB . SER C 1 202 ? -21.837 26.858 53.752 1.00 47.80 ? 202 SER C CB 1 ATOM 4833 O OG . SER C 1 202 ? -22.965 26.459 54.514 1.00 50.61 ? 202 SER C OG 1 ATOM 4834 N N . SER C 1 203 ? -21.232 23.904 54.750 1.00 45.69 ? 203 SER C N 1 ATOM 4835 C CA . SER C 1 203 ? -20.692 22.896 55.650 1.00 40.83 ? 203 SER C CA 1 ATOM 4836 C C . SER C 1 203 ? -21.460 21.606 55.402 1.00 32.59 ? 203 SER C C 1 ATOM 4837 O O . SER C 1 203 ? -22.562 21.635 54.849 1.00 37.21 ? 203 SER C O 1 ATOM 4838 C CB . SER C 1 203 ? -20.802 23.336 57.118 1.00 30.88 ? 203 SER C CB 1 ATOM 4839 O OG . SER C 1 203 ? -22.013 22.898 57.710 1.00 30.11 ? 203 SER C OG 1 ATOM 4840 N N . PRO C 1 204 ? -20.895 20.455 55.785 1.00 33.36 ? 204 PRO C N 1 ATOM 4841 C CA . PRO C 1 204 ? -21.546 19.180 55.452 1.00 23.14 ? 204 PRO C CA 1 ATOM 4842 C C . PRO C 1 204 ? -22.904 19.031 56.124 1.00 32.06 ? 204 PRO C C 1 ATOM 4843 O O . PRO C 1 204 ? -23.152 19.561 57.210 1.00 40.29 ? 204 PRO C O 1 ATOM 4844 C CB . PRO C 1 204 ? -20.559 18.126 55.971 1.00 23.14 ? 204 PRO C CB 1 ATOM 4845 C CG . PRO C 1 204 ? -19.262 18.840 56.125 1.00 25.26 ? 204 PRO C CG 1 ATOM 4846 C CD . PRO C 1 204 ? -19.612 20.247 56.479 1.00 26.94 ? 204 PRO C CD 1 ATOM 4847 N N . VAL C 1 205 ? -23.790 18.297 55.457 1.00 21.01 ? 205 VAL C N 1 ATOM 4848 C CA . VAL C 1 205 ? -25.103 17.956 55.990 1.00 24.72 ? 205 VAL C CA 1 ATOM 4849 C C . VAL C 1 205 ? -25.081 16.504 56.442 1.00 31.07 ? 205 VAL C C 1 ATOM 4850 O O . VAL C 1 205 ? -24.554 15.630 55.742 1.00 18.35 ? 205 VAL C O 1 ATOM 4851 C CB . VAL C 1 205 ? -26.208 18.198 54.943 1.00 20.10 ? 205 VAL C CB 1 ATOM 4852 C CG1 . VAL C 1 205 ? -27.537 17.656 55.437 1.00 20.05 ? 205 VAL C CG1 1 ATOM 4853 C CG2 . VAL C 1 205 ? -26.317 19.680 54.631 1.00 21.51 ? 205 VAL C CG2 1 ATOM 4854 N N . THR C 1 206 ? -25.644 16.244 57.620 1.00 29.48 ? 206 THR C N 1 ATOM 4855 C CA . THR C 1 206 ? -25.674 14.907 58.194 1.00 24.30 ? 206 THR C CA 1 ATOM 4856 C C . THR C 1 206 ? -27.109 14.529 58.528 1.00 25.49 ? 206 THR C C 1 ATOM 4857 O O . THR C 1 206 ? -27.827 15.298 59.175 1.00 26.78 ? 206 THR C O 1 ATOM 4858 C CB . THR C 1 206 ? -24.800 14.821 59.451 1.00 21.01 ? 206 THR C CB 1 ATOM 4859 O OG1 . THR C 1 206 ? -23.463 15.221 59.129 1.00 31.20 ? 206 THR C OG1 1 ATOM 4860 C CG2 . THR C 1 206 ? -24.778 13.400 59.991 1.00 20.28 ? 206 THR C CG2 1 ATOM 4861 N N . LYS C 1 207 ? -27.521 13.348 58.080 1.00 29.98 ? 207 LYS C N 1 ATOM 4862 C CA . LYS C 1 207 ? -28.821 12.784 58.407 1.00 29.18 ? 207 LYS C CA 1 ATOM 4863 C C . LYS C 1 207 ? -28.600 11.463 59.126 1.00 27.33 ? 207 LYS C C 1 ATOM 4864 O O . LYS C 1 207 ? -27.820 10.624 58.663 1.00 23.81 ? 207 LYS C O 1 ATOM 4865 C CB . LYS C 1 207 ? -29.669 12.584 57.147 1.00 29.28 ? 207 LYS C CB 1 ATOM 4866 C CG . LYS C 1 207 ? -30.026 13.880 56.433 1.00 29.78 ? 207 LYS C CG 1 ATOM 4867 C CD . LYS C 1 207 ? -30.916 14.763 57.294 1.00 28.80 ? 207 LYS C CD 1 ATOM 4868 C CE . LYS C 1 207 ? -31.340 16.022 56.550 1.00 30.36 ? 207 LYS C CE 1 ATOM 4869 N NZ . LYS C 1 207 ? -32.148 16.935 57.411 1.00 36.11 ? 207 LYS C NZ 1 ATOM 4870 N N . SER C 1 208 ? -29.273 11.282 60.257 1.00 24.94 ? 208 SER C N 1 ATOM 4871 C CA . SER C 1 208 ? -29.010 10.145 61.122 1.00 26.96 ? 208 SER C CA 1 ATOM 4872 C C . SER C 1 208 ? -30.310 9.505 61.583 1.00 28.23 ? 208 SER C C 1 ATOM 4873 O O . SER C 1 208 ? -31.384 10.110 61.532 1.00 49.45 ? 208 SER C O 1 ATOM 4874 C CB . SER C 1 208 ? -28.182 10.557 62.350 1.00 31.93 ? 208 SER C CB 1 ATOM 4875 O OG . SER C 1 208 ? -27.027 11.281 61.968 1.00 40.03 ? 208 SER C OG 1 ATOM 4876 N N . PHE C 1 209 ? -30.189 8.256 62.026 1.00 24.06 ? 209 PHE C N 1 ATOM 4877 C CA . PHE C 1 209 ? -31.222 7.588 62.799 1.00 28.46 ? 209 PHE C CA 1 ATOM 4878 C C . PHE C 1 209 ? -30.541 6.697 63.824 1.00 31.87 ? 209 PHE C C 1 ATOM 4879 O O . PHE C 1 209 ? -29.376 6.319 63.673 1.00 27.98 ? 209 PHE C O 1 ATOM 4880 C CB . PHE C 1 209 ? -32.184 6.772 61.917 1.00 20.31 ? 209 PHE C CB 1 ATOM 4881 C CG . PHE C 1 209 ? -31.569 5.536 61.307 1.00 28.23 ? 209 PHE C CG 1 ATOM 4882 C CD1 . PHE C 1 209 ? -31.560 4.329 61.995 1.00 32.27 ? 209 PHE C CD1 1 ATOM 4883 C CD2 . PHE C 1 209 ? -31.025 5.575 60.034 1.00 26.86 ? 209 PHE C CD2 1 ATOM 4884 C CE1 . PHE C 1 209 ? -31.002 3.196 61.434 1.00 33.23 ? 209 PHE C CE1 1 ATOM 4885 C CE2 . PHE C 1 209 ? -30.468 4.444 59.465 1.00 24.33 ? 209 PHE C CE2 1 ATOM 4886 C CZ . PHE C 1 209 ? -30.457 3.254 60.166 1.00 31.94 ? 209 PHE C CZ 1 ATOM 4887 N N . ASN C 1 210 ? -31.279 6.367 64.878 1.00 28.88 ? 210 ASN C N 1 ATOM 4888 C CA . ASN C 1 210 ? -30.830 5.418 65.886 1.00 24.98 ? 210 ASN C CA 1 ATOM 4889 C C . ASN C 1 210 ? -31.611 4.125 65.701 1.00 29.81 ? 210 ASN C C 1 ATOM 4890 O O . ASN C 1 210 ? -32.846 4.140 65.714 1.00 37.63 ? 210 ASN C O 1 ATOM 4891 C CB . ASN C 1 210 ? -31.029 5.972 67.298 1.00 29.66 ? 210 ASN C CB 1 ATOM 4892 C CG . ASN C 1 210 ? -30.151 7.175 67.584 1.00 27.22 ? 210 ASN C CG 1 ATOM 4893 O OD1 . ASN C 1 210 ? -29.038 7.284 67.069 1.00 25.83 ? 210 ASN C OD1 1 ATOM 4894 N ND2 . ASN C 1 210 ? -30.648 8.085 68.414 1.00 29.77 ? 210 ASN C ND2 1 ATOM 4895 N N . ARG C 1 211 ? -30.893 3.016 65.516 1.00 28.40 ? 211 ARG C N 1 ATOM 4896 C CA . ARG C 1 211 ? -31.540 1.717 65.378 1.00 22.00 ? 211 ARG C CA 1 ATOM 4897 C C . ARG C 1 211 ? -32.371 1.414 66.617 1.00 31.50 ? 211 ARG C C 1 ATOM 4898 O O . ARG C 1 211 ? -31.854 1.415 67.739 1.00 36.68 ? 211 ARG C O 1 ATOM 4899 C CB . ARG C 1 211 ? -30.496 0.622 65.160 1.00 20.72 ? 211 ARG C CB 1 ATOM 4900 C CG . ARG C 1 211 ? -31.088 -0.779 65.055 1.00 20.80 ? 211 ARG C CG 1 ATOM 4901 C CD . ARG C 1 211 ? -30.026 -1.862 65.212 1.00 20.26 ? 211 ARG C CD 1 ATOM 4902 N NE . ARG C 1 211 ? -29.218 -1.669 66.413 1.00 21.34 ? 211 ARG C NE 1 ATOM 4903 C CZ . ARG C 1 211 ? -29.595 -2.029 67.636 1.00 32.31 ? 211 ARG C CZ 1 ATOM 4904 N NH1 . ARG C 1 211 ? -30.775 -2.601 67.830 1.00 28.43 ? 211 ARG C NH1 1 ATOM 4905 N NH2 . ARG C 1 211 ? -28.793 -1.811 68.668 1.00 28.43 ? 211 ARG C NH2 1 ATOM 4906 N N . GLY C 1 212 ? -33.662 1.161 66.411 1.00 36.65 ? 212 GLY C N 1 ATOM 4907 C CA . GLY C 1 212 ? -34.561 0.873 67.511 1.00 49.91 ? 212 GLY C CA 1 ATOM 4908 C C . GLY C 1 212 ? -35.379 2.077 67.929 1.00 64.30 ? 212 GLY C C 1 ATOM 4909 O O . GLY C 1 212 ? -36.599 1.980 68.100 1.00 74.26 ? 212 GLY C O 1 ATOM 4910 N N . ALA C 1 213 ? -34.717 3.217 68.097 1.00 63.85 ? 213 ALA C N 1 ATOM 4911 C CA . ALA C 1 213 ? -35.395 4.452 68.474 1.00 57.98 ? 213 ALA C CA 1 ATOM 4912 C C . ALA C 1 213 ? -36.334 4.907 67.364 1.00 57.36 ? 213 ALA C C 1 ATOM 4913 O O . ALA C 1 213 ? -35.891 5.306 66.286 1.00 55.56 ? 213 ALA C O 1 ATOM 4914 C CB . ALA C 1 213 ? -34.380 5.541 68.794 1.00 53.51 ? 213 ALA C CB 1 ATOM 4915 O OXT . ALA C 1 213 ? -37.555 4.884 67.521 1.00 56.41 ? 213 ALA C OXT 1 ATOM 4916 N N . GLN D 2 1 ? -50.881 4.244 13.255 1.00 33.24 ? 1 GLN D N 1 ATOM 4917 C CA . GLN D 2 1 ? -49.628 4.467 13.964 1.00 38.37 ? 1 GLN D CA 1 ATOM 4918 C C . GLN D 2 1 ? -48.634 3.338 13.696 1.00 36.77 ? 1 GLN D C 1 ATOM 4919 O O . GLN D 2 1 ? -48.906 2.179 14.007 1.00 43.16 ? 1 GLN D O 1 ATOM 4920 C CB . GLN D 2 1 ? -49.883 4.602 15.467 1.00 37.36 ? 1 GLN D CB 1 ATOM 4921 N N . VAL D 2 2 ? -47.487 3.684 13.115 1.00 32.09 ? 2 VAL D N 1 ATOM 4922 C CA . VAL D 2 2 ? -46.443 2.702 12.840 1.00 34.45 ? 2 VAL D CA 1 ATOM 4923 C C . VAL D 2 2 ? -45.698 2.387 14.131 1.00 36.56 ? 2 VAL D C 1 ATOM 4924 O O . VAL D 2 2 ? -45.176 3.288 14.799 1.00 27.96 ? 2 VAL D O 1 ATOM 4925 C CB . VAL D 2 2 ? -45.483 3.218 11.757 1.00 36.64 ? 2 VAL D CB 1 ATOM 4926 C CG1 . VAL D 2 2 ? -44.315 2.254 11.582 1.00 25.77 ? 2 VAL D CG1 1 ATOM 4927 C CG2 . VAL D 2 2 ? -46.222 3.411 10.443 1.00 29.63 ? 2 VAL D CG2 1 ATOM 4928 N N . GLN D 2 3 ? -45.640 1.104 14.482 1.00 26.02 ? 3 GLN D N 1 ATOM 4929 C CA . GLN D 2 3 ? -45.004 0.669 15.715 1.00 34.16 ? 3 GLN D CA 1 ATOM 4930 C C . GLN D 2 3 ? -44.300 -0.661 15.494 1.00 32.19 ? 3 GLN D C 1 ATOM 4931 O O . GLN D 2 3 ? -44.732 -1.486 14.684 1.00 23.83 ? 3 GLN D O 1 ATOM 4932 C CB . GLN D 2 3 ? -46.016 0.528 16.860 1.00 40.31 ? 3 GLN D CB 1 ATOM 4933 C CG . GLN D 2 3 ? -46.549 1.846 17.386 1.00 48.12 ? 3 GLN D CG 1 ATOM 4934 C CD . GLN D 2 3 ? -47.602 1.662 18.458 1.00 58.10 ? 3 GLN D CD 1 ATOM 4935 O OE1 . GLN D 2 3 ? -47.940 0.537 18.828 1.00 66.57 ? 3 GLN D OE1 1 ATOM 4936 N NE2 . GLN D 2 3 ? -48.130 2.770 18.962 1.00 63.81 ? 3 GLN D NE2 1 ATOM 4937 N N . LEU D 2 4 ? -43.208 -0.858 16.232 1.00 26.84 ? 4 LEU D N 1 ATOM 4938 C CA . LEU D 2 4 ? -42.491 -2.125 16.274 1.00 26.46 ? 4 LEU D CA 1 ATOM 4939 C C . LEU D 2 4 ? -42.329 -2.533 17.730 1.00 30.10 ? 4 LEU D C 1 ATOM 4940 O O . LEU D 2 4 ? -41.828 -1.752 18.546 1.00 39.85 ? 4 LEU D O 1 ATOM 4941 C CB . LEU D 2 4 ? -41.123 -2.031 15.589 1.00 32.94 ? 4 LEU D CB 1 ATOM 4942 C CG . LEU D 2 4 ? -41.101 -1.765 14.080 1.00 36.27 ? 4 LEU D CG 1 ATOM 4943 C CD1 . LEU D 2 4 ? -41.159 -0.274 13.779 1.00 31.63 ? 4 LEU D CD1 1 ATOM 4944 C CD2 . LEU D 2 4 ? -39.876 -2.398 13.437 1.00 36.24 ? 4 LEU D CD2 1 ATOM 4945 N N . LYS D 2 5 ? -42.759 -3.749 18.053 1.00 22.53 ? 5 LYS D N 1 ATOM 4946 C CA . LYS D 2 5 ? -42.733 -4.266 19.414 1.00 28.98 ? 5 LYS D CA 1 ATOM 4947 C C . LYS D 2 5 ? -41.940 -5.564 19.432 1.00 28.14 ? 5 LYS D C 1 ATOM 4948 O O . LYS D 2 5 ? -42.252 -6.498 18.686 1.00 32.37 ? 5 LYS D O 1 ATOM 4949 C CB . LYS D 2 5 ? -44.151 -4.494 19.941 1.00 33.72 ? 5 LYS D CB 1 ATOM 4950 C CG . LYS D 2 5 ? -44.993 -3.226 20.021 1.00 48.74 ? 5 LYS D CG 1 ATOM 4951 C CD . LYS D 2 5 ? -46.386 -3.443 19.443 1.00 60.45 ? 5 LYS D CD 1 ATOM 4952 C CE . LYS D 2 5 ? -46.340 -3.600 17.929 1.00 60.15 ? 5 LYS D CE 1 ATOM 4953 N NZ . LYS D 2 5 ? -47.618 -4.124 17.365 1.00 51.74 ? 5 LYS D NZ 1 ATOM 4954 N N . GLN D 2 6 ? -40.924 -5.621 20.285 1.00 25.32 ? 6 GLN D N 1 ATOM 4955 C CA . GLN D 2 6 ? -40.014 -6.754 20.347 1.00 26.92 ? 6 GLN D CA 1 ATOM 4956 C C . GLN D 2 6 ? -40.332 -7.640 21.545 1.00 30.90 ? 6 GLN D C 1 ATOM 4957 O O . GLN D 2 6 ? -40.878 -7.183 22.552 1.00 25.92 ? 6 GLN D O 1 ATOM 4958 C CB . GLN D 2 6 ? -38.564 -6.275 20.430 1.00 27.04 ? 6 GLN D CB 1 ATOM 4959 C CG . GLN D 2 6 ? -38.218 -5.197 19.416 1.00 29.26 ? 6 GLN D CG 1 ATOM 4960 C CD . GLN D 2 6 ? -36.787 -4.716 19.539 1.00 31.00 ? 6 GLN D CD 1 ATOM 4961 O OE1 . GLN D 2 6 ? -36.429 -3.660 19.021 1.00 38.91 ? 6 GLN D OE1 1 ATOM 4962 N NE2 . GLN D 2 6 ? -35.960 -5.492 20.227 1.00 28.73 ? 6 GLN D NE2 1 ATOM 4963 N N . SER D 2 7 ? -39.979 -8.918 21.426 1.00 32.51 ? 7 SER D N 1 ATOM 4964 C CA . SER D 2 7 ? -40.123 -9.835 22.546 1.00 30.50 ? 7 SER D CA 1 ATOM 4965 C C . SER D 2 7 ? -39.210 -9.411 23.695 1.00 35.91 ? 7 SER D C 1 ATOM 4966 O O . SER D 2 7 ? -38.191 -8.741 23.497 1.00 21.04 ? 7 SER D O 1 ATOM 4967 C CB . SER D 2 7 ? -39.808 -11.266 22.109 1.00 22.45 ? 7 SER D CB 1 ATOM 4968 O OG . SER D 2 7 ? -38.506 -11.359 21.560 1.00 37.76 ? 7 SER D OG 1 ATOM 4969 N N . GLY D 2 8 ? -39.582 -9.816 24.907 1.00 36.60 ? 8 GLY D N 1 ATOM 4970 C CA . GLY D 2 8 ? -38.974 -9.307 26.115 1.00 31.54 ? 8 GLY D CA 1 ATOM 4971 C C . GLY D 2 8 ? -37.508 -9.655 26.289 1.00 30.55 ? 8 GLY D C 1 ATOM 4972 O O . GLY D 2 8 ? -36.940 -10.469 25.554 1.00 22.24 ? 8 GLY D O 1 ATOM 4973 N N . PRO D 2 9 ? -36.867 -9.034 27.278 1.00 36.36 ? 9 PRO D N 1 ATOM 4974 C CA . PRO D 2 9 ? -35.453 -9.316 27.540 1.00 38.71 ? 9 PRO D CA 1 ATOM 4975 C C . PRO D 2 9 ? -35.282 -10.662 28.225 1.00 43.64 ? 9 PRO D C 1 ATOM 4976 O O . PRO D 2 9 ? -36.232 -11.278 28.713 1.00 53.88 ? 9 PRO D O 1 ATOM 4977 C CB . PRO D 2 9 ? -35.034 -8.166 28.457 1.00 40.21 ? 9 PRO D CB 1 ATOM 4978 C CG . PRO D 2 9 ? -36.283 -7.841 29.204 1.00 37.22 ? 9 PRO D CG 1 ATOM 4979 C CD . PRO D 2 9 ? -37.413 -8.042 28.221 1.00 36.38 ? 9 PRO D CD 1 ATOM 4980 N N . GLY D 2 10 ? -34.036 -11.117 28.265 1.00 39.71 ? 10 GLY D N 1 ATOM 4981 C CA . GLY D 2 10 ? -33.765 -12.407 28.867 1.00 42.06 ? 10 GLY D CA 1 ATOM 4982 C C . GLY D 2 10 ? -32.286 -12.717 28.875 1.00 33.41 ? 10 GLY D C 1 ATOM 4983 O O . GLY D 2 10 ? -31.458 -11.971 28.340 1.00 27.48 ? 10 GLY D O 1 ATOM 4984 N N . LEU D 2 11 ? -31.977 -13.851 29.493 1.00 28.18 ? 11 LEU D N 1 ATOM 4985 C CA . LEU D 2 11 ? -30.619 -14.336 29.670 1.00 26.26 ? 11 LEU D CA 1 ATOM 4986 C C . LEU D 2 11 ? -30.330 -15.440 28.660 1.00 27.44 ? 11 LEU D C 1 ATOM 4987 O O . LEU D 2 11 ? -31.192 -16.276 28.375 1.00 27.91 ? 11 LEU D O 1 ATOM 4988 C CB . LEU D 2 11 ? -30.437 -14.858 31.097 1.00 22.73 ? 11 LEU D CB 1 ATOM 4989 C CG . LEU D 2 11 ? -29.150 -15.573 31.493 1.00 33.56 ? 11 LEU D CG 1 ATOM 4990 C CD1 . LEU D 2 11 ? -28.021 -14.579 31.702 1.00 39.09 ? 11 LEU D CD1 1 ATOM 4991 C CD2 . LEU D 2 11 ? -29.393 -16.394 32.746 1.00 37.35 ? 11 LEU D CD2 1 ATOM 4992 N N . VAL D 2 12 ? -29.117 -15.434 28.110 1.00 31.80 ? 12 VAL D N 1 ATOM 4993 C CA . VAL D 2 12 ? -28.690 -16.434 27.138 1.00 38.19 ? 12 VAL D CA 1 ATOM 4994 C C . VAL D 2 12 ? -27.362 -17.019 27.598 1.00 39.14 ? 12 VAL D C 1 ATOM 4995 O O . VAL D 2 12 ? -26.431 -16.275 27.926 1.00 49.38 ? 12 VAL D O 1 ATOM 4996 C CB . VAL D 2 12 ? -28.565 -15.838 25.722 1.00 49.02 ? 12 VAL D CB 1 ATOM 4997 C CG1 . VAL D 2 12 ? -28.019 -16.873 24.752 1.00 46.34 ? 12 VAL D CG1 1 ATOM 4998 C CG2 . VAL D 2 12 ? -29.917 -15.323 25.246 1.00 53.72 ? 12 VAL D CG2 1 ATOM 4999 N N . GLN D 2 13 ? -27.278 -18.347 27.631 1.00 36.47 ? 13 GLN D N 1 ATOM 5000 C CA . GLN D 2 13 ? -26.047 -19.004 28.036 1.00 37.21 ? 13 GLN D CA 1 ATOM 5001 C C . GLN D 2 13 ? -25.008 -18.905 26.919 1.00 37.39 ? 13 GLN D C 1 ATOM 5002 O O . GLN D 2 13 ? -25.363 -18.837 25.740 1.00 43.92 ? 13 GLN D O 1 ATOM 5003 C CB . GLN D 2 13 ? -26.309 -20.471 28.375 1.00 35.67 ? 13 GLN D CB 1 ATOM 5004 C CG . GLN D 2 13 ? -27.468 -20.708 29.338 1.00 48.00 ? 13 GLN D CG 1 ATOM 5005 C CD . GLN D 2 13 ? -27.164 -20.259 30.755 1.00 61.61 ? 13 GLN D CD 1 ATOM 5006 O OE1 . GLN D 2 13 ? -26.056 -20.453 31.256 1.00 71.33 ? 13 GLN D OE1 1 ATOM 5007 N NE2 . GLN D 2 13 ? -28.151 -19.654 31.410 1.00 56.00 ? 13 GLN D NE2 1 ATOM 5008 N N . PRO D 2 14 ? -23.719 -18.874 27.264 1.00 35.87 ? 14 PRO D N 1 ATOM 5009 C CA . PRO D 2 14 ? -22.682 -18.853 26.225 1.00 39.84 ? 14 PRO D CA 1 ATOM 5010 C C . PRO D 2 14 ? -22.793 -20.053 25.296 1.00 43.92 ? 14 PRO D C 1 ATOM 5011 O O . PRO D 2 14 ? -23.281 -21.119 25.679 1.00 38.48 ? 14 PRO D O 1 ATOM 5012 C CB . PRO D 2 14 ? -21.376 -18.880 27.026 1.00 33.54 ? 14 PRO D CB 1 ATOM 5013 C CG . PRO D 2 14 ? -21.736 -18.272 28.335 1.00 32.78 ? 14 PRO D CG 1 ATOM 5014 C CD . PRO D 2 14 ? -23.152 -18.703 28.612 1.00 34.96 ? 14 PRO D CD 1 ATOM 5015 N N . SER D 2 15 ? -22.350 -19.847 24.051 1.00 44.64 ? 15 SER D N 1 ATOM 5016 C CA . SER D 2 15 ? -22.392 -20.834 22.973 1.00 46.97 ? 15 SER D CA 1 ATOM 5017 C C . SER D 2 15 ? -23.813 -21.125 22.498 1.00 46.97 ? 15 SER D C 1 ATOM 5018 O O . SER D 2 15 ? -23.998 -21.701 21.422 1.00 46.34 ? 15 SER D O 1 ATOM 5019 C CB . SER D 2 15 ? -21.705 -22.139 23.393 1.00 52.60 ? 15 SER D CB 1 ATOM 5020 O OG . SER D 2 15 ? -20.297 -21.987 23.450 1.00 63.60 ? 15 SER D OG 1 ATOM 5021 N N . GLN D 2 16 ? -24.821 -20.726 23.271 1.00 48.84 ? 16 GLN D N 1 ATOM 5022 C CA . GLN D 2 16 ? -26.200 -21.024 22.923 1.00 53.83 ? 16 GLN D CA 1 ATOM 5023 C C . GLN D 2 16 ? -26.777 -19.922 22.034 1.00 53.12 ? 16 GLN D C 1 ATOM 5024 O O . GLN D 2 16 ? -26.110 -18.939 21.702 1.00 55.78 ? 16 GLN D O 1 ATOM 5025 C CB . GLN D 2 16 ? -27.035 -21.226 24.186 1.00 56.90 ? 16 GLN D CB 1 ATOM 5026 C CG . GLN D 2 16 ? -26.392 -22.139 25.229 1.00 63.42 ? 16 GLN D CG 1 ATOM 5027 C CD . GLN D 2 16 ? -26.397 -23.614 24.848 1.00 68.33 ? 16 GLN D CD 1 ATOM 5028 O OE1 . GLN D 2 16 ? -26.507 -23.974 23.675 1.00 67.30 ? 16 GLN D OE1 1 ATOM 5029 N NE2 . GLN D 2 16 ? -26.278 -24.477 25.851 1.00 72.43 ? 16 GLN D NE2 1 ATOM 5030 N N . SER D 2 17 ? -28.038 -20.086 21.648 1.00 51.41 ? 17 SER D N 1 ATOM 5031 C CA . SER D 2 17 ? -28.666 -19.262 20.626 1.00 50.83 ? 17 SER D CA 1 ATOM 5032 C C . SER D 2 17 ? -29.542 -18.174 21.238 1.00 46.51 ? 17 SER D C 1 ATOM 5033 O O . SER D 2 17 ? -29.951 -18.244 22.399 1.00 56.71 ? 17 SER D O 1 ATOM 5034 C CB . SER D 2 17 ? -29.501 -20.129 19.681 1.00 51.59 ? 17 SER D CB 1 ATOM 5035 O OG . SER D 2 17 ? -30.079 -19.346 18.653 1.00 54.09 ? 17 SER D OG 1 ATOM 5036 N N . LEU D 2 18 ? -29.833 -17.160 20.422 1.00 30.84 ? 18 LEU D N 1 ATOM 5037 C CA . LEU D 2 18 ? -30.653 -16.021 20.815 1.00 27.31 ? 18 LEU D CA 1 ATOM 5038 C C . LEU D 2 18 ? -31.747 -15.813 19.779 1.00 32.97 ? 18 LEU D C 1 ATOM 5039 O O . LEU D 2 18 ? -31.473 -15.823 18.575 1.00 39.77 ? 18 LEU D O 1 ATOM 5040 C CB . LEU D 2 18 ? -29.800 -14.754 20.951 1.00 23.71 ? 18 LEU D CB 1 ATOM 5041 C CG . LEU D 2 18 ? -30.486 -13.395 20.788 1.00 22.43 ? 18 LEU D CG 1 ATOM 5042 C CD1 . LEU D 2 18 ? -31.500 -13.145 21.893 1.00 21.97 ? 18 LEU D CD1 1 ATOM 5043 C CD2 . LEU D 2 18 ? -29.446 -12.285 20.750 1.00 25.26 ? 18 LEU D CD2 1 ATOM 5044 N N . SER D 2 19 ? -32.981 -15.625 20.246 1.00 28.02 ? 19 SER D N 1 ATOM 5045 C CA . SER D 2 19 ? -34.132 -15.425 19.375 1.00 29.89 ? 19 SER D CA 1 ATOM 5046 C C . SER D 2 19 ? -34.930 -14.224 19.857 1.00 26.60 ? 19 SER D C 1 ATOM 5047 O O . SER D 2 19 ? -35.239 -14.119 21.049 1.00 34.04 ? 19 SER D O 1 ATOM 5048 C CB . SER D 2 19 ? -35.024 -16.671 19.340 1.00 25.72 ? 19 SER D CB 1 ATOM 5049 O OG . SER D 2 19 ? -34.299 -17.805 18.897 1.00 30.62 ? 19 SER D OG 1 ATOM 5050 N N . ILE D 2 20 ? -35.260 -13.322 18.932 1.00 26.55 ? 20 ILE D N 1 ATOM 5051 C CA . ILE D 2 20 ? -36.062 -12.137 19.215 1.00 28.17 ? 20 ILE D CA 1 ATOM 5052 C C . ILE D 2 20 ? -37.147 -12.029 18.154 1.00 34.63 ? 20 ILE D C 1 ATOM 5053 O O . ILE D 2 20 ? -36.886 -12.242 16.965 1.00 30.77 ? 20 ILE D O 1 ATOM 5054 C CB . ILE D 2 20 ? -35.206 -10.851 19.239 1.00 30.69 ? 20 ILE D CB 1 ATOM 5055 C CG1 . ILE D 2 20 ? -34.010 -11.011 20.176 1.00 20.48 ? 20 ILE D CG1 1 ATOM 5056 C CG2 . ILE D 2 20 ? -36.042 -9.656 19.669 1.00 20.09 ? 20 ILE D CG2 1 ATOM 5057 C CD1 . ILE D 2 20 ? -33.076 -9.837 20.151 1.00 24.28 ? 20 ILE D CD1 1 ATOM 5058 N N . THR D 2 21 ? -38.362 -11.695 18.581 1.00 33.96 ? 21 THR D N 1 ATOM 5059 C CA . THR D 2 21 ? -39.500 -11.544 17.683 1.00 31.37 ? 21 THR D CA 1 ATOM 5060 C C . THR D 2 21 ? -39.891 -10.076 17.591 1.00 31.83 ? 21 THR D C 1 ATOM 5061 O O . THR D 2 21 ? -40.123 -9.427 18.616 1.00 33.26 ? 21 THR D O 1 ATOM 5062 C CB . THR D 2 21 ? -40.695 -12.375 18.162 1.00 28.73 ? 21 THR D CB 1 ATOM 5063 O OG1 . THR D 2 21 ? -40.416 -13.769 17.981 1.00 27.31 ? 21 THR D OG1 1 ATOM 5064 C CG2 . THR D 2 21 ? -41.946 -12.006 17.383 1.00 28.93 ? 21 THR D CG2 1 ATOM 5065 N N . CYS D 2 22 ? -39.964 -9.560 16.364 1.00 29.20 ? 22 CYS D N 1 ATOM 5066 C CA . CYS D 2 22 ? -40.388 -8.190 16.089 1.00 24.61 ? 22 CYS D CA 1 ATOM 5067 C C . CYS D 2 22 ? -41.766 -8.231 15.437 1.00 30.24 ? 22 CYS D C 1 ATOM 5068 O O . CYS D 2 22 ? -41.922 -8.788 14.344 1.00 35.00 ? 22 CYS D O 1 ATOM 5069 C CB . CYS D 2 22 ? -39.378 -7.480 15.183 1.00 20.92 ? 22 CYS D CB 1 ATOM 5070 S SG . CYS D 2 22 ? -39.671 -5.713 14.854 1.00 30.80 ? 22 CYS D SG 1 ATOM 5071 N N . THR D 2 23 ? -42.759 -7.650 16.107 1.00 33.11 ? 23 THR D N 1 ATOM 5072 C CA . THR D 2 23 ? -44.139 -7.630 15.631 1.00 37.77 ? 23 THR D CA 1 ATOM 5073 C C . THR D 2 23 ? -44.491 -6.209 15.211 1.00 40.43 ? 23 THR D C 1 ATOM 5074 O O . THR D 2 23 ? -44.494 -5.297 16.044 1.00 35.85 ? 23 THR D O 1 ATOM 5075 C CB . THR D 2 23 ? -45.106 -8.114 16.712 1.00 32.61 ? 23 THR D CB 1 ATOM 5076 O OG1 . THR D 2 23 ? -44.794 -9.466 17.065 1.00 35.36 ? 23 THR D OG1 1 ATOM 5077 C CG2 . THR D 2 23 ? -46.540 -8.041 16.209 1.00 25.86 ? 23 THR D CG2 1 ATOM 5078 N N . VAL D 2 24 ? -44.808 -6.026 13.933 1.00 23.32 ? 24 VAL D N 1 ATOM 5079 C CA . VAL D 2 24 ? -45.025 -4.696 13.379 1.00 36.17 ? 24 VAL D CA 1 ATOM 5080 C C . VAL D 2 24 ? -46.514 -4.450 13.200 1.00 37.26 ? 24 VAL D C 1 ATOM 5081 O O . VAL D 2 24 ? -47.319 -5.380 13.057 1.00 40.00 ? 24 VAL D O 1 ATOM 5082 C CB . VAL D 2 24 ? -44.286 -4.510 12.039 1.00 22.95 ? 24 VAL D CB 1 ATOM 5083 C CG1 . VAL D 2 24 ? -42.823 -4.884 12.186 1.00 22.28 ? 24 VAL D CG1 1 ATOM 5084 C CG2 . VAL D 2 24 ? -44.951 -5.329 10.943 1.00 23.70 ? 24 VAL D CG2 1 ATOM 5085 N N . SER D 2 25 ? -46.882 -3.171 13.201 1.00 37.27 ? 25 SER D N 1 ATOM 5086 C CA . SER D 2 25 ? -48.249 -2.758 12.920 1.00 38.41 ? 25 SER D CA 1 ATOM 5087 C C . SER D 2 25 ? -48.218 -1.355 12.332 1.00 35.83 ? 25 SER D C 1 ATOM 5088 O O . SER D 2 25 ? -47.271 -0.593 12.544 1.00 27.66 ? 25 SER D O 1 ATOM 5089 C CB . SER D 2 25 ? -49.127 -2.816 14.178 1.00 38.31 ? 25 SER D CB 1 ATOM 5090 O OG . SER D 2 25 ? -48.718 -1.858 15.137 1.00 44.61 ? 25 SER D OG 1 ATOM 5091 N N . GLY D 2 26 ? -49.262 -1.028 11.577 1.00 27.20 ? 26 GLY D N 1 ATOM 5092 C CA . GLY D 2 26 ? -49.316 0.221 10.856 1.00 27.57 ? 26 GLY D CA 1 ATOM 5093 C C . GLY D 2 26 ? -48.715 0.180 9.468 1.00 26.89 ? 26 GLY D C 1 ATOM 5094 O O . GLY D 2 26 ? -48.733 1.204 8.772 1.00 29.82 ? 26 GLY D O 1 ATOM 5095 N N . PHE D 2 27 ? -48.175 -0.962 9.051 1.00 26.14 ? 27 PHE D N 1 ATOM 5096 C CA . PHE D 2 27 ? -47.631 -1.146 7.714 1.00 29.64 ? 27 PHE D CA 1 ATOM 5097 C C . PHE D 2 27 ? -47.462 -2.638 7.487 1.00 30.61 ? 27 PHE D C 1 ATOM 5098 O O . PHE D 2 27 ? -47.313 -3.408 8.438 1.00 38.55 ? 27 PHE D O 1 ATOM 5099 C CB . PHE D 2 27 ? -46.292 -0.419 7.527 1.00 26.39 ? 27 PHE D CB 1 ATOM 5100 C CG . PHE D 2 27 ? -45.151 -1.030 8.295 1.00 29.71 ? 27 PHE D CG 1 ATOM 5101 C CD1 . PHE D 2 27 ? -44.932 -0.696 9.620 1.00 28.01 ? 27 PHE D CD1 1 ATOM 5102 C CD2 . PHE D 2 27 ? -44.293 -1.936 7.688 1.00 26.40 ? 27 PHE D CD2 1 ATOM 5103 C CE1 . PHE D 2 27 ? -43.883 -1.257 10.327 1.00 30.66 ? 27 PHE D CE1 1 ATOM 5104 C CE2 . PHE D 2 27 ? -43.245 -2.500 8.390 1.00 24.60 ? 27 PHE D CE2 1 ATOM 5105 C CZ . PHE D 2 27 ? -43.039 -2.159 9.710 1.00 25.98 ? 27 PHE D CZ 1 ATOM 5106 N N . SER D 2 28 ? -47.490 -3.041 6.224 1.00 28.75 ? 28 SER D N 1 ATOM 5107 C CA . SER D 2 28 ? -47.351 -4.447 5.885 1.00 34.37 ? 28 SER D CA 1 ATOM 5108 C C . SER D 2 28 ? -45.890 -4.786 5.625 1.00 38.84 ? 28 SER D C 1 ATOM 5109 O O . SER D 2 28 ? -45.152 -3.998 5.024 1.00 40.98 ? 28 SER D O 1 ATOM 5110 C CB . SER D 2 28 ? -48.199 -4.797 4.661 1.00 32.05 ? 28 SER D CB 1 ATOM 5111 O OG . SER D 2 28 ? -48.062 -6.170 4.331 1.00 29.29 ? 28 SER D OG 1 ATOM 5112 N N . LEU D 2 29 ? -45.475 -5.966 6.091 1.00 35.51 ? 29 LEU D N 1 ATOM 5113 C CA . LEU D 2 29 ? -44.119 -6.436 5.832 1.00 36.52 ? 29 LEU D CA 1 ATOM 5114 C C . LEU D 2 29 ? -43.856 -6.626 4.346 1.00 38.61 ? 29 LEU D C 1 ATOM 5115 O O . LEU D 2 29 ? -42.692 -6.670 3.933 1.00 37.70 ? 29 LEU D O 1 ATOM 5116 C CB . LEU D 2 29 ? -43.863 -7.747 6.577 1.00 36.57 ? 29 LEU D CB 1 ATOM 5117 C CG . LEU D 2 29 ? -43.720 -7.643 8.093 1.00 25.57 ? 29 LEU D CG 1 ATOM 5118 C CD1 . LEU D 2 29 ? -43.465 -9.009 8.715 1.00 26.06 ? 29 LEU D CD1 1 ATOM 5119 C CD2 . LEU D 2 29 ? -42.598 -6.689 8.420 1.00 24.51 ? 29 LEU D CD2 1 ATOM 5120 N N . THR D 2 30 ? -44.910 -6.737 3.537 1.00 45.59 ? 30 THR D N 1 ATOM 5121 C CA . THR D 2 30 ? -44.760 -6.888 2.096 1.00 44.18 ? 30 THR D CA 1 ATOM 5122 C C . THR D 2 30 ? -44.306 -5.608 1.409 1.00 36.28 ? 30 THR D C 1 ATOM 5123 O O . THR D 2 30 ? -43.924 -5.663 0.236 1.00 38.19 ? 30 THR D O 1 ATOM 5124 C CB . THR D 2 30 ? -46.081 -7.346 1.476 1.00 46.68 ? 30 THR D CB 1 ATOM 5125 O OG1 . THR D 2 30 ? -47.098 -6.375 1.755 1.00 38.95 ? 30 THR D OG1 1 ATOM 5126 C CG2 . THR D 2 30 ? -46.499 -8.694 2.046 1.00 45.16 ? 30 THR D CG2 1 ATOM 5127 N N . ASN D 2 31 ? -44.341 -4.465 2.098 1.00 29.22 ? 31 ASN D N 1 ATOM 5128 C CA . ASN D 2 31 ? -44.001 -3.190 1.485 1.00 36.54 ? 31 ASN D CA 1 ATOM 5129 C C . ASN D 2 31 ? -42.788 -2.505 2.095 1.00 41.94 ? 31 ASN D C 1 ATOM 5130 O O . ASN D 2 31 ? -42.316 -1.516 1.526 1.00 45.03 ? 31 ASN D O 1 ATOM 5131 C CB . ASN D 2 31 ? -45.195 -2.225 1.556 1.00 29.09 ? 31 ASN D CB 1 ATOM 5132 C CG . ASN D 2 31 ? -46.409 -2.747 0.819 1.00 38.40 ? 31 ASN D CG 1 ATOM 5133 O OD1 . ASN D 2 31 ? -46.288 -3.410 -0.213 1.00 47.68 ? 31 ASN D OD1 1 ATOM 5134 N ND2 . ASN D 2 31 ? -47.591 -2.452 1.347 1.00 36.88 ? 31 ASN D ND2 1 ATOM 5135 N N . TYR D 2 32 ? -42.277 -2.983 3.227 1.00 46.30 ? 32 TYR D N 1 ATOM 5136 C CA . TYR D 2 32 ? -41.111 -2.384 3.859 1.00 35.97 ? 32 TYR D CA 1 ATOM 5137 C C . TYR D 2 32 ? -40.207 -3.475 4.405 1.00 31.30 ? 32 TYR D C 1 ATOM 5138 O O . TYR D 2 32 ? -40.684 -4.476 4.947 1.00 34.14 ? 32 TYR D O 1 ATOM 5139 C CB . TYR D 2 32 ? -41.504 -1.438 5.002 1.00 32.19 ? 32 TYR D CB 1 ATOM 5140 C CG . TYR D 2 32 ? -42.193 -0.169 4.563 1.00 34.31 ? 32 TYR D CG 1 ATOM 5141 C CD1 . TYR D 2 32 ? -43.570 -0.126 4.391 1.00 26.83 ? 32 TYR D CD1 1 ATOM 5142 C CD2 . TYR D 2 32 ? -41.466 0.994 4.336 1.00 27.84 ? 32 TYR D CD2 1 ATOM 5143 C CE1 . TYR D 2 32 ? -44.204 1.036 3.996 1.00 37.15 ? 32 TYR D CE1 1 ATOM 5144 C CE2 . TYR D 2 32 ? -42.090 2.162 3.942 1.00 28.59 ? 32 TYR D CE2 1 ATOM 5145 C CZ . TYR D 2 32 ? -43.459 2.178 3.773 1.00 41.43 ? 32 TYR D CZ 1 ATOM 5146 O OH . TYR D 2 32 ? -44.084 3.340 3.379 1.00 38.89 ? 32 TYR D OH 1 ATOM 5147 N N . GLY D 2 33 ? -38.900 -3.279 4.259 1.00 34.87 ? 33 GLY D N 1 ATOM 5148 C CA . GLY D 2 33 ? -37.954 -4.152 4.917 1.00 33.66 ? 33 GLY D CA 1 ATOM 5149 C C . GLY D 2 33 ? -37.778 -3.781 6.378 1.00 33.43 ? 33 GLY D C 1 ATOM 5150 O O . GLY D 2 33 ? -37.929 -2.627 6.776 1.00 45.93 ? 33 GLY D O 1 ATOM 5151 N N . VAL D 2 34 ? -37.467 -4.786 7.191 1.00 23.78 ? 34 VAL D N 1 ATOM 5152 C CA . VAL D 2 34 ? -37.193 -4.597 8.611 1.00 26.92 ? 34 VAL D CA 1 ATOM 5153 C C . VAL D 2 34 ? -35.719 -4.886 8.853 1.00 27.59 ? 34 VAL D C 1 ATOM 5154 O O . VAL D 2 34 ? -35.208 -5.934 8.440 1.00 17.78 ? 34 VAL D O 1 ATOM 5155 C CB . VAL D 2 34 ? -38.089 -5.492 9.486 1.00 27.57 ? 34 VAL D CB 1 ATOM 5156 C CG1 . VAL D 2 34 ? -37.644 -5.432 10.938 1.00 20.52 ? 34 VAL D CG1 1 ATOM 5157 C CG2 . VAL D 2 34 ? -39.539 -5.063 9.361 1.00 26.17 ? 34 VAL D CG2 1 ATOM 5158 N N . HIS D 2 35 ? -35.037 -3.952 9.506 1.00 31.87 ? 35 HIS D N 1 ATOM 5159 C CA . HIS D 2 35 ? -33.615 -4.067 9.792 1.00 28.96 ? 35 HIS D CA 1 ATOM 5160 C C . HIS D 2 35 ? -33.401 -4.481 11.241 1.00 27.26 ? 35 HIS D C 1 ATOM 5161 O O . HIS D 2 35 ? -34.331 -4.531 12.048 1.00 25.23 ? 35 HIS D O 1 ATOM 5162 C CB . HIS D 2 35 ? -32.897 -2.744 9.510 1.00 25.95 ? 35 HIS D CB 1 ATOM 5163 C CG . HIS D 2 35 ? -33.032 -2.270 8.097 1.00 24.26 ? 35 HIS D CG 1 ATOM 5164 N ND1 . HIS D 2 35 ? -31.943 -2.025 7.288 1.00 20.40 ? 35 HIS D ND1 1 ATOM 5165 C CD2 . HIS D 2 35 ? -34.126 -1.992 7.350 1.00 18.48 ? 35 HIS D CD2 1 ATOM 5166 C CE1 . HIS D 2 35 ? -32.361 -1.616 6.104 1.00 25.99 ? 35 HIS D CE1 1 ATOM 5167 N NE2 . HIS D 2 35 ? -33.682 -1.587 6.115 1.00 26.84 ? 35 HIS D NE2 1 ATOM 5168 N N . TRP D 2 36 ? -32.145 -4.775 11.570 1.00 26.56 ? 36 TRP D N 1 ATOM 5169 C CA . TRP D 2 36 ? -31.775 -5.141 12.932 1.00 24.66 ? 36 TRP D CA 1 ATOM 5170 C C . TRP D 2 36 ? -30.460 -4.465 13.286 1.00 33.70 ? 36 TRP D C 1 ATOM 5171 O O . TRP D 2 36 ? -29.452 -4.656 12.598 1.00 26.29 ? 36 TRP D O 1 ATOM 5172 C CB . TRP D 2 36 ? -31.678 -6.662 13.090 1.00 21.26 ? 36 TRP D CB 1 ATOM 5173 C CG . TRP D 2 36 ? -33.017 -7.341 12.974 1.00 23.25 ? 36 TRP D CG 1 ATOM 5174 C CD1 . TRP D 2 36 ? -33.634 -7.743 11.826 1.00 28.29 ? 36 TRP D CD1 1 ATOM 5175 C CD2 . TRP D 2 36 ? -33.907 -7.681 14.047 1.00 19.21 ? 36 TRP D CD2 1 ATOM 5176 N NE1 . TRP D 2 36 ? -34.849 -8.316 12.116 1.00 28.27 ? 36 TRP D NE1 1 ATOM 5177 C CE2 . TRP D 2 36 ? -35.040 -8.290 13.472 1.00 23.05 ? 36 TRP D CE2 1 ATOM 5178 C CE3 . TRP D 2 36 ? -33.854 -7.533 15.436 1.00 21.65 ? 36 TRP D CE3 1 ATOM 5179 C CZ2 . TRP D 2 36 ? -36.111 -8.750 14.238 1.00 20.34 ? 36 TRP D CZ2 1 ATOM 5180 C CZ3 . TRP D 2 36 ? -34.917 -7.990 16.195 1.00 28.09 ? 36 TRP D CZ3 1 ATOM 5181 C CH2 . TRP D 2 36 ? -36.030 -8.590 15.594 1.00 25.96 ? 36 TRP D CH2 1 ATOM 5182 N N . VAL D 2 37 ? -30.485 -3.664 14.349 1.00 41.34 ? 37 VAL D N 1 ATOM 5183 C CA . VAL D 2 37 ? -29.323 -2.962 14.872 1.00 31.59 ? 37 VAL D CA 1 ATOM 5184 C C . VAL D 2 37 ? -29.127 -3.401 16.314 1.00 35.85 ? 37 VAL D C 1 ATOM 5185 O O . VAL D 2 37 ? -30.092 -3.720 17.017 1.00 40.11 ? 37 VAL D O 1 ATOM 5186 C CB . VAL D 2 37 ? -29.495 -1.427 14.784 1.00 26.68 ? 37 VAL D CB 1 ATOM 5187 C CG1 . VAL D 2 37 ? -28.224 -0.700 15.220 1.00 26.66 ? 37 VAL D CG1 1 ATOM 5188 C CG2 . VAL D 2 37 ? -29.904 -1.013 13.379 1.00 27.70 ? 37 VAL D CG2 1 ATOM 5189 N N . ARG D 2 38 ? -27.874 -3.429 16.755 1.00 33.97 ? 38 ARG D N 1 ATOM 5190 C CA . ARG D 2 38 ? -27.571 -3.695 18.151 1.00 31.20 ? 38 ARG D CA 1 ATOM 5191 C C . ARG D 2 38 ? -26.662 -2.600 18.689 1.00 27.14 ? 38 ARG D C 1 ATOM 5192 O O . ARG D 2 38 ? -25.967 -1.910 17.938 1.00 23.21 ? 38 ARG D O 1 ATOM 5193 C CB . ARG D 2 38 ? -26.929 -5.075 18.347 1.00 22.82 ? 38 ARG D CB 1 ATOM 5194 C CG . ARG D 2 38 ? -25.456 -5.155 18.006 1.00 23.11 ? 38 ARG D CG 1 ATOM 5195 C CD . ARG D 2 38 ? -24.933 -6.552 18.294 1.00 19.55 ? 38 ARG D CD 1 ATOM 5196 N NE . ARG D 2 38 ? -23.491 -6.654 18.105 1.00 24.52 ? 38 ARG D NE 1 ATOM 5197 C CZ . ARG D 2 38 ? -22.795 -7.770 18.285 1.00 32.08 ? 38 ARG D CZ 1 ATOM 5198 N NH1 . ARG D 2 38 ? -23.411 -8.883 18.660 1.00 29.06 ? 38 ARG D NH1 1 ATOM 5199 N NH2 . ARG D 2 38 ? -21.483 -7.773 18.091 1.00 41.37 ? 38 ARG D NH2 1 ATOM 5200 N N . GLN D 2 39 ? -26.688 -2.441 20.010 1.00 24.00 ? 39 GLN D N 1 ATOM 5201 C CA . GLN D 2 39 ? -25.928 -1.400 20.693 1.00 22.20 ? 39 GLN D CA 1 ATOM 5202 C C . GLN D 2 39 ? -25.256 -2.031 21.904 1.00 17.16 ? 39 GLN D C 1 ATOM 5203 O O . GLN D 2 39 ? -25.922 -2.336 22.899 1.00 26.44 ? 39 GLN D O 1 ATOM 5204 C CB . GLN D 2 39 ? -26.836 -0.239 21.100 1.00 24.60 ? 39 GLN D CB 1 ATOM 5205 C CG . GLN D 2 39 ? -26.118 1.082 21.310 1.00 32.46 ? 39 GLN D CG 1 ATOM 5206 C CD . GLN D 2 39 ? -27.080 2.244 21.482 1.00 37.40 ? 39 GLN D CD 1 ATOM 5207 O OE1 . GLN D 2 39 ? -28.282 2.049 21.672 1.00 35.57 ? 39 GLN D OE1 1 ATOM 5208 N NE2 . GLN D 2 39 ? -26.553 3.462 21.418 1.00 37.93 ? 39 GLN D NE2 1 ATOM 5209 N N . SER D 2 40 ? -23.947 -2.231 21.817 1.00 24.03 ? 40 SER D N 1 ATOM 5210 C CA . SER D 2 40 ? -23.161 -2.889 22.847 1.00 29.34 ? 40 SER D CA 1 ATOM 5211 C C . SER D 2 40 ? -22.234 -1.892 23.531 1.00 33.00 ? 40 SER D C 1 ATOM 5212 O O . SER D 2 40 ? -21.930 -0.830 22.977 1.00 26.22 ? 40 SER D O 1 ATOM 5213 C CB . SER D 2 40 ? -22.334 -4.035 22.242 1.00 30.71 ? 40 SER D CB 1 ATOM 5214 O OG . SER D 2 40 ? -21.253 -3.543 21.467 1.00 27.31 ? 40 SER D OG 1 ATOM 5215 N N . PRO D 2 41 ? -21.770 -2.197 24.747 1.00 42.04 ? 41 PRO D N 1 ATOM 5216 C CA . PRO D 2 41 ? -20.803 -1.297 25.400 1.00 34.67 ? 41 PRO D CA 1 ATOM 5217 C C . PRO D 2 41 ? -19.484 -1.185 24.657 1.00 35.08 ? 41 PRO D C 1 ATOM 5218 O O . PRO D 2 41 ? -18.807 -0.155 24.764 1.00 36.98 ? 41 PRO D O 1 ATOM 5219 C CB . PRO D 2 41 ? -20.613 -1.934 26.786 1.00 35.37 ? 41 PRO D CB 1 ATOM 5220 C CG . PRO D 2 41 ? -21.849 -2.757 27.003 1.00 39.99 ? 41 PRO D CG 1 ATOM 5221 C CD . PRO D 2 41 ? -22.208 -3.280 25.645 1.00 43.51 ? 41 PRO D CD 1 ATOM 5222 N N . GLY D 2 42 ? -19.098 -2.209 23.900 1.00 42.49 ? 42 GLY D N 1 ATOM 5223 C CA . GLY D 2 42 ? -17.813 -2.211 23.230 1.00 49.13 ? 42 GLY D CA 1 ATOM 5224 C C . GLY D 2 42 ? -17.796 -1.531 21.875 1.00 41.98 ? 42 GLY D C 1 ATOM 5225 O O . GLY D 2 42 ? -16.946 -0.673 21.620 1.00 38.88 ? 42 GLY D O 1 ATOM 5226 N N . LYS D 2 43 ? -18.724 -1.901 20.994 1.00 35.14 ? 43 LYS D N 1 ATOM 5227 C CA . LYS D 2 43 ? -18.728 -1.398 19.627 1.00 35.02 ? 43 LYS D CA 1 ATOM 5228 C C . LYS D 2 43 ? -19.824 -0.377 19.347 1.00 31.03 ? 43 LYS D C 1 ATOM 5229 O O . LYS D 2 43 ? -19.971 0.043 18.194 1.00 31.25 ? 43 LYS D O 1 ATOM 5230 C CB . LYS D 2 43 ? -18.851 -2.561 18.635 1.00 44.50 ? 43 LYS D CB 1 ATOM 5231 C CG . LYS D 2 43 ? -17.567 -3.342 18.423 1.00 48.95 ? 43 LYS D CG 1 ATOM 5232 C CD . LYS D 2 43 ? -17.694 -4.259 17.223 1.00 63.94 ? 43 LYS D CD 1 ATOM 5233 C CE . LYS D 2 43 ? -16.360 -4.882 16.857 1.00 71.24 ? 43 LYS D CE 1 ATOM 5234 N NZ . LYS D 2 43 ? -16.487 -5.788 15.680 1.00 67.65 ? 43 LYS D NZ 1 ATOM 5235 N N . GLY D 2 44 ? -20.592 0.037 20.354 1.00 19.05 ? 44 GLY D N 1 ATOM 5236 C CA . GLY D 2 44 ? -21.607 1.056 20.115 1.00 20.43 ? 44 GLY D CA 1 ATOM 5237 C C . GLY D 2 44 ? -22.716 0.557 19.204 1.00 27.43 ? 44 GLY D C 1 ATOM 5238 O O . GLY D 2 44 ? -23.126 -0.608 19.259 1.00 29.01 ? 44 GLY D O 1 ATOM 5239 N N . LEU D 2 45 ? -23.220 1.460 18.363 1.00 22.03 ? 45 LEU D N 1 ATOM 5240 C CA . LEU D 2 45 ? -24.280 1.125 17.420 1.00 17.77 ? 45 LEU D CA 1 ATOM 5241 C C . LEU D 2 45 ? -23.730 0.342 16.233 1.00 15.79 ? 45 LEU D C 1 ATOM 5242 O O . LEU D 2 45 ? -22.713 0.708 15.639 1.00 16.63 ? 45 LEU D O 1 ATOM 5243 C CB . LEU D 2 45 ? -24.976 2.397 16.939 1.00 18.84 ? 45 LEU D CB 1 ATOM 5244 C CG . LEU D 2 45 ? -25.955 3.055 17.914 1.00 18.81 ? 45 LEU D CG 1 ATOM 5245 C CD1 . LEU D 2 45 ? -26.243 4.486 17.491 1.00 14.54 ? 45 LEU D CD1 1 ATOM 5246 C CD2 . LEU D 2 45 ? -27.235 2.250 17.968 1.00 13.99 ? 45 LEU D CD2 1 ATOM 5247 N N . GLU D 2 46 ? -24.428 -0.734 15.877 1.00 25.62 ? 46 GLU D N 1 ATOM 5248 C CA . GLU D 2 46 ? -23.901 -1.700 14.919 1.00 25.65 ? 46 GLU D CA 1 ATOM 5249 C C . GLU D 2 46 ? -25.042 -2.272 14.090 1.00 28.08 ? 46 GLU D C 1 ATOM 5250 O O . GLU D 2 46 ? -25.949 -2.911 14.634 1.00 24.30 ? 46 GLU D O 1 ATOM 5251 C CB . GLU D 2 46 ? -23.153 -2.813 15.654 1.00 25.60 ? 46 GLU D CB 1 ATOM 5252 C CG . GLU D 2 46 ? -22.023 -3.451 14.877 1.00 35.89 ? 46 GLU D CG 1 ATOM 5253 C CD . GLU D 2 46 ? -21.155 -4.344 15.745 1.00 41.09 ? 46 GLU D CD 1 ATOM 5254 O OE1 . GLU D 2 46 ? -21.479 -4.504 16.941 1.00 37.92 ? 46 GLU D OE1 1 ATOM 5255 O OE2 . GLU D 2 46 ? -20.151 -4.879 15.229 1.00 45.23 ? 46 GLU D OE2 1 ATOM 5256 N N . TRP D 2 47 ? -24.998 -2.041 12.779 1.00 23.50 ? 47 TRP D N 1 ATOM 5257 C CA . TRP D 2 47 ? -26.003 -2.585 11.871 1.00 24.18 ? 47 TRP D CA 1 ATOM 5258 C C . TRP D 2 47 ? -25.742 -4.067 11.632 1.00 28.96 ? 47 TRP D C 1 ATOM 5259 O O . TRP D 2 47 ? -24.644 -4.458 11.224 1.00 33.14 ? 47 TRP D O 1 ATOM 5260 C CB . TRP D 2 47 ? -25.999 -1.826 10.542 1.00 22.38 ? 47 TRP D CB 1 ATOM 5261 C CG . TRP D 2 47 ? -27.043 -2.301 9.555 1.00 25.31 ? 47 TRP D CG 1 ATOM 5262 C CD1 . TRP D 2 47 ? -28.363 -1.944 9.520 1.00 25.88 ? 47 TRP D CD1 1 ATOM 5263 C CD2 . TRP D 2 47 ? -26.849 -3.216 8.467 1.00 24.29 ? 47 TRP D CD2 1 ATOM 5264 N NE1 . TRP D 2 47 ? -29.001 -2.582 8.483 1.00 17.65 ? 47 TRP D NE1 1 ATOM 5265 C CE2 . TRP D 2 47 ? -28.094 -3.368 7.821 1.00 21.30 ? 47 TRP D CE2 1 ATOM 5266 C CE3 . TRP D 2 47 ? -25.746 -3.920 7.975 1.00 23.94 ? 47 TRP D CE3 1 ATOM 5267 C CZ2 . TRP D 2 47 ? -28.265 -4.192 6.712 1.00 17.27 ? 47 TRP D CZ2 1 ATOM 5268 C CZ3 . TRP D 2 47 ? -25.920 -4.740 6.872 1.00 21.44 ? 47 TRP D CZ3 1 ATOM 5269 C CH2 . TRP D 2 47 ? -27.170 -4.869 6.255 1.00 25.14 ? 47 TRP D CH2 1 ATOM 5270 N N . LEU D 2 48 ? -26.755 -4.893 11.888 1.00 25.08 ? 48 LEU D N 1 ATOM 5271 C CA . LEU D 2 48 ? -26.609 -6.341 11.807 1.00 26.28 ? 48 LEU D CA 1 ATOM 5272 C C . LEU D 2 48 ? -27.097 -6.914 10.481 1.00 25.37 ? 48 LEU D C 1 ATOM 5273 O O . LEU D 2 48 ? -26.354 -7.645 9.813 1.00 31.90 ? 48 LEU D O 1 ATOM 5274 C CB . LEU D 2 48 ? -27.352 -7.008 12.968 1.00 21.68 ? 48 LEU D CB 1 ATOM 5275 C CG . LEU D 2 48 ? -26.807 -6.661 14.355 1.00 23.04 ? 48 LEU D CG 1 ATOM 5276 C CD1 . LEU D 2 48 ? -27.632 -7.334 15.439 1.00 17.81 ? 48 LEU D CD1 1 ATOM 5277 C CD2 . LEU D 2 48 ? -25.345 -7.062 14.458 1.00 23.06 ? 48 LEU D CD2 1 ATOM 5278 N N . GLY D 2 49 ? -28.325 -6.608 10.083 1.00 22.83 ? 49 GLY D N 1 ATOM 5279 C CA . GLY D 2 49 ? -28.848 -7.186 8.864 1.00 17.13 ? 49 GLY D CA 1 ATOM 5280 C C . GLY D 2 49 ? -30.195 -6.602 8.504 1.00 31.54 ? 49 GLY D C 1 ATOM 5281 O O . GLY D 2 49 ? -30.672 -5.648 9.126 1.00 31.20 ? 49 GLY D O 1 ATOM 5282 N N . VAL D 2 50 ? -30.809 -7.199 7.487 1.00 17.18 ? 50 VAL D N 1 ATOM 5283 C CA . VAL D 2 50 ? -32.086 -6.719 6.971 1.00 23.54 ? 50 VAL D CA 1 ATOM 5284 C C . VAL D 2 50 ? -32.757 -7.858 6.216 1.00 25.59 ? 50 VAL D C 1 ATOM 5285 O O . VAL D 2 50 ? -32.095 -8.656 5.544 1.00 18.53 ? 50 VAL D O 1 ATOM 5286 C CB . VAL D 2 50 ? -31.892 -5.474 6.070 1.00 28.17 ? 50 VAL D CB 1 ATOM 5287 C CG1 . VAL D 2 50 ? -30.929 -5.778 4.929 1.00 19.19 ? 50 VAL D CG1 1 ATOM 5288 C CG2 . VAL D 2 50 ? -33.229 -4.984 5.524 1.00 29.28 ? 50 VAL D CG2 1 ATOM 5289 N N . ILE D 2 51 ? -34.079 -7.938 6.348 1.00 19.67 ? 51 ILE D N 1 ATOM 5290 C CA . ILE D 2 51 ? -34.918 -8.765 5.490 1.00 21.10 ? 51 ILE D CA 1 ATOM 5291 C C . ILE D 2 51 ? -35.828 -7.830 4.703 1.00 25.32 ? 51 ILE D C 1 ATOM 5292 O O . ILE D 2 51 ? -36.465 -6.941 5.282 1.00 19.88 ? 51 ILE D O 1 ATOM 5293 C CB . ILE D 2 51 ? -35.719 -9.806 6.297 1.00 28.31 ? 51 ILE D CB 1 ATOM 5294 C CG1 . ILE D 2 51 ? -36.553 -10.687 5.366 1.00 31.13 ? 51 ILE D CG1 1 ATOM 5295 C CG2 . ILE D 2 51 ? -36.593 -9.142 7.359 1.00 26.91 ? 51 ILE D CG2 1 ATOM 5296 C CD1 . ILE D 2 51 ? -37.121 -11.916 6.047 1.00 22.28 ? 51 ILE D CD1 1 ATOM 5297 N N . TRP D 2 52 ? -35.859 -8.004 3.384 1.00 21.18 ? 52 TRP D N 1 ATOM 5298 C CA . TRP D 2 52 ? -36.517 -7.057 2.499 1.00 21.06 ? 52 TRP D CA 1 ATOM 5299 C C . TRP D 2 52 ? -37.967 -7.462 2.240 1.00 23.34 ? 52 TRP D C 1 ATOM 5300 O O . TRP D 2 52 ? -38.462 -8.471 2.748 1.00 36.05 ? 52 TRP D O 1 ATOM 5301 C CB . TRP D 2 52 ? -35.739 -6.929 1.191 1.00 21.43 ? 52 TRP D CB 1 ATOM 5302 C CG . TRP D 2 52 ? -34.374 -6.354 1.373 1.00 20.92 ? 52 TRP D CG 1 ATOM 5303 C CD1 . TRP D 2 52 ? -33.190 -7.033 1.371 1.00 36.71 ? 52 TRP D CD1 1 ATOM 5304 C CD2 . TRP D 2 52 ? -34.047 -4.978 1.591 1.00 27.46 ? 52 TRP D CD2 1 ATOM 5305 N NE1 . TRP D 2 52 ? -32.144 -6.164 1.571 1.00 23.67 ? 52 TRP D NE1 1 ATOM 5306 C CE2 . TRP D 2 52 ? -32.644 -4.896 1.708 1.00 27.74 ? 52 TRP D CE2 1 ATOM 5307 C CE3 . TRP D 2 52 ? -34.803 -3.806 1.696 1.00 21.85 ? 52 TRP D CE3 1 ATOM 5308 C CZ2 . TRP D 2 52 ? -31.982 -3.690 1.928 1.00 25.37 ? 52 TRP D CZ2 1 ATOM 5309 C CZ3 . TRP D 2 52 ? -34.145 -2.610 1.913 1.00 30.47 ? 52 TRP D CZ3 1 ATOM 5310 C CH2 . TRP D 2 52 ? -32.748 -2.561 2.027 1.00 30.05 ? 52 TRP D CH2 1 ATOM 5311 N N . SER D 2 53 ? -38.656 -6.655 1.427 1.00 22.96 ? 53 SER D N 1 ATOM 5312 C CA . SER D 2 53 ? -40.072 -6.890 1.155 1.00 26.03 ? 53 SER D CA 1 ATOM 5313 C C . SER D 2 53 ? -40.296 -8.268 0.545 1.00 27.98 ? 53 SER D C 1 ATOM 5314 O O . SER D 2 53 ? -41.143 -9.037 1.013 1.00 25.26 ? 53 SER D O 1 ATOM 5315 C CB . SER D 2 53 ? -40.614 -5.798 0.231 1.00 34.31 ? 53 SER D CB 1 ATOM 5316 O OG . SER D 2 53 ? -40.487 -4.515 0.818 1.00 48.28 ? 53 SER D OG 1 ATOM 5317 N N . GLY D 2 54 ? -39.539 -8.599 -0.498 1.00 29.51 ? 54 GLY D N 1 ATOM 5318 C CA . GLY D 2 54 ? -39.663 -9.875 -1.169 1.00 25.68 ? 54 GLY D CA 1 ATOM 5319 C C . GLY D 2 54 ? -39.086 -11.067 -0.442 1.00 32.52 ? 54 GLY D C 1 ATOM 5320 O O . GLY D 2 54 ? -39.140 -12.181 -0.971 1.00 34.75 ? 54 GLY D O 1 ATOM 5321 N N . GLY D 2 55 ? -38.528 -10.877 0.754 1.00 30.72 ? 55 GLY D N 1 ATOM 5322 C CA . GLY D 2 55 ? -37.999 -11.969 1.541 1.00 22.63 ? 55 GLY D CA 1 ATOM 5323 C C . GLY D 2 55 ? -36.495 -12.143 1.475 1.00 32.74 ? 55 GLY D C 1 ATOM 5324 O O . GLY D 2 55 ? -35.958 -12.984 2.208 1.00 33.50 ? 55 GLY D O 1 ATOM 5325 N N . ASN D 2 56 ? -35.804 -11.389 0.623 1.00 35.85 ? 56 ASN D N 1 ATOM 5326 C CA . ASN D 2 56 ? -34.351 -11.456 0.571 1.00 38.18 ? 56 ASN D CA 1 ATOM 5327 C C . ASN D 2 56 ? -33.747 -10.979 1.890 1.00 35.03 ? 56 ASN D C 1 ATOM 5328 O O . ASN D 2 56 ? -34.375 -10.256 2.667 1.00 37.36 ? 56 ASN D O 1 ATOM 5329 C CB . ASN D 2 56 ? -33.812 -10.611 -0.585 1.00 46.36 ? 56 ASN D CB 1 ATOM 5330 C CG . ASN D 2 56 ? -33.920 -11.313 -1.925 1.00 47.67 ? 56 ASN D CG 1 ATOM 5331 O OD1 . ASN D 2 56 ? -33.909 -12.541 -2.000 1.00 46.40 ? 56 ASN D OD1 1 ATOM 5332 N ND2 . ASN D 2 56 ? -34.014 -10.531 -2.995 1.00 57.89 ? 56 ASN D ND2 1 ATOM 5333 N N . THR D 2 57 ? -32.504 -11.392 2.137 1.00 34.59 ? 57 THR D N 1 ATOM 5334 C CA . THR D 2 57 ? -31.792 -11.038 3.357 1.00 26.37 ? 57 THR D CA 1 ATOM 5335 C C . THR D 2 57 ? -30.391 -10.549 3.032 1.00 24.22 ? 57 THR D C 1 ATOM 5336 O O . THR D 2 57 ? -29.711 -11.105 2.165 1.00 33.81 ? 57 THR D O 1 ATOM 5337 C CB . THR D 2 57 ? -31.689 -12.227 4.326 1.00 28.55 ? 57 THR D CB 1 ATOM 5338 O OG1 . THR D 2 57 ? -31.145 -13.363 3.640 1.00 37.27 ? 57 THR D OG1 1 ATOM 5339 C CG2 . THR D 2 57 ? -33.052 -12.578 4.904 1.00 19.99 ? 57 THR D CG2 1 ATOM 5340 N N . ASP D 2 58 ? -29.965 -9.506 3.737 1.00 26.71 ? 58 ASP D N 1 ATOM 5341 C CA . ASP D 2 58 ? -28.577 -9.073 3.758 1.00 19.67 ? 58 ASP D CA 1 ATOM 5342 C C . ASP D 2 58 ? -28.092 -9.069 5.200 1.00 22.84 ? 58 ASP D C 1 ATOM 5343 O O . ASP D 2 58 ? -28.797 -8.599 6.098 1.00 29.12 ? 58 ASP D O 1 ATOM 5344 C CB . ASP D 2 58 ? -28.404 -7.677 3.146 1.00 21.85 ? 58 ASP D CB 1 ATOM 5345 C CG . ASP D 2 58 ? -28.632 -7.662 1.648 1.00 28.79 ? 58 ASP D CG 1 ATOM 5346 O OD1 . ASP D 2 58 ? -28.413 -8.706 0.997 1.00 32.13 ? 58 ASP D OD1 1 ATOM 5347 O OD2 . ASP D 2 58 ? -29.022 -6.599 1.120 1.00 28.46 ? 58 ASP D OD2 1 ATOM 5348 N N . TYR D 2 59 ? -26.896 -9.603 5.420 1.00 24.75 ? 59 TYR D N 1 ATOM 5349 C CA . TYR D 2 59 ? -26.278 -9.633 6.737 1.00 22.66 ? 59 TYR D CA 1 ATOM 5350 C C . TYR D 2 59 ? -24.951 -8.892 6.685 1.00 30.08 ? 59 TYR D C 1 ATOM 5351 O O . TYR D 2 59 ? -24.220 -8.979 5.693 1.00 31.46 ? 59 TYR D O 1 ATOM 5352 C CB . TYR D 2 59 ? -26.050 -11.073 7.214 1.00 24.93 ? 59 TYR D CB 1 ATOM 5353 C CG . TYR D 2 59 ? -27.291 -11.937 7.181 1.00 30.67 ? 59 TYR D CG 1 ATOM 5354 C CD1 . TYR D 2 59 ? -28.498 -11.476 7.690 1.00 29.59 ? 59 TYR D CD1 1 ATOM 5355 C CD2 . TYR D 2 59 ? -27.256 -13.211 6.631 1.00 31.43 ? 59 TYR D CD2 1 ATOM 5356 C CE1 . TYR D 2 59 ? -29.635 -12.265 7.661 1.00 30.59 ? 59 TYR D CE1 1 ATOM 5357 C CE2 . TYR D 2 59 ? -28.387 -14.006 6.595 1.00 36.44 ? 59 TYR D CE2 1 ATOM 5358 C CZ . TYR D 2 59 ? -29.573 -13.529 7.111 1.00 35.94 ? 59 TYR D CZ 1 ATOM 5359 O OH . TYR D 2 59 ? -30.700 -14.317 7.075 1.00 29.60 ? 59 TYR D OH 1 ATOM 5360 N N . ASN D 2 60 ? -24.650 -8.153 7.749 1.00 30.37 ? 60 ASN D N 1 ATOM 5361 C CA . ASN D 2 60 ? -23.338 -7.535 7.858 1.00 20.94 ? 60 ASN D CA 1 ATOM 5362 C C . ASN D 2 60 ? -22.275 -8.623 7.932 1.00 28.81 ? 60 ASN D C 1 ATOM 5363 O O . ASN D 2 60 ? -22.462 -9.650 8.591 1.00 23.84 ? 60 ASN D O 1 ATOM 5364 C CB . ASN D 2 60 ? -23.269 -6.628 9.086 1.00 20.69 ? 60 ASN D CB 1 ATOM 5365 C CG . ASN D 2 60 ? -22.155 -5.605 8.991 1.00 27.62 ? 60 ASN D CG 1 ATOM 5366 O OD1 . ASN D 2 60 ? -21.212 -5.767 8.216 1.00 26.42 ? 60 ASN D OD1 1 ATOM 5367 N ND2 . ASN D 2 60 ? -22.257 -4.542 9.781 1.00 21.30 ? 60 ASN D ND2 1 ATOM 5368 N N . THR D 2 61 ? -21.156 -8.389 7.245 1.00 27.09 ? 61 THR D N 1 ATOM 5369 C CA . THR D 2 61 ? -20.160 -9.434 7.003 1.00 25.42 ? 61 THR D CA 1 ATOM 5370 C C . THR D 2 61 ? -19.734 -10.205 8.250 1.00 34.57 ? 61 THR D C 1 ATOM 5371 O O . THR D 2 61 ? -19.685 -11.444 8.187 1.00 27.64 ? 61 THR D O 1 ATOM 5372 C CB . THR D 2 61 ? -18.946 -8.814 6.297 1.00 32.10 ? 61 THR D CB 1 ATOM 5373 O OG1 . THR D 2 61 ? -19.371 -8.174 5.087 1.00 31.41 ? 61 THR D OG1 1 ATOM 5374 C CG2 . THR D 2 61 ? -17.920 -9.885 5.958 1.00 29.16 ? 61 THR D CG2 1 ATOM 5375 N N . PRO D 2 62 ? -19.429 -9.572 9.402 1.00 39.15 ? 62 PRO D N 1 ATOM 5376 C CA . PRO D 2 62 ? -18.979 -10.366 10.557 1.00 35.95 ? 62 PRO D CA 1 ATOM 5377 C C . PRO D 2 62 ? -20.080 -11.181 11.223 1.00 36.43 ? 62 PRO D C 1 ATOM 5378 O O . PRO D 2 62 ? -19.862 -11.746 12.299 1.00 39.53 ? 62 PRO D O 1 ATOM 5379 C CB . PRO D 2 62 ? -18.424 -9.302 11.512 1.00 38.67 ? 62 PRO D CB 1 ATOM 5380 C CG . PRO D 2 62 ? -19.181 -8.077 11.175 1.00 39.63 ? 62 PRO D CG 1 ATOM 5381 C CD . PRO D 2 62 ? -19.363 -8.126 9.688 1.00 40.53 ? 62 PRO D CD 1 ATOM 5382 N N . PHE D 2 63 ? -21.262 -11.257 10.609 1.00 31.26 ? 63 PHE D N 1 ATOM 5383 C CA . PHE D 2 63 ? -22.363 -12.028 11.168 1.00 29.09 ? 63 PHE D CA 1 ATOM 5384 C C . PHE D 2 63 ? -22.997 -12.990 10.175 1.00 37.12 ? 63 PHE D C 1 ATOM 5385 O O . PHE D 2 63 ? -23.970 -13.663 10.532 1.00 42.87 ? 63 PHE D O 1 ATOM 5386 C CB . PHE D 2 63 ? -23.454 -11.095 11.721 1.00 30.00 ? 63 PHE D CB 1 ATOM 5387 C CG . PHE D 2 63 ? -22.955 -10.107 12.736 1.00 39.73 ? 63 PHE D CG 1 ATOM 5388 C CD1 . PHE D 2 63 ? -22.940 -10.425 14.084 1.00 35.82 ? 63 PHE D CD1 1 ATOM 5389 C CD2 . PHE D 2 63 ? -22.508 -8.855 12.343 1.00 43.82 ? 63 PHE D CD2 1 ATOM 5390 C CE1 . PHE D 2 63 ? -22.483 -9.515 15.019 1.00 33.99 ? 63 PHE D CE1 1 ATOM 5391 C CE2 . PHE D 2 63 ? -22.051 -7.941 13.273 1.00 34.75 ? 63 PHE D CE2 1 ATOM 5392 C CZ . PHE D 2 63 ? -22.038 -8.271 14.612 1.00 30.20 ? 63 PHE D CZ 1 ATOM 5393 N N . THR D 2 64 ? -22.473 -13.086 8.950 1.00 36.45 ? 64 THR D N 1 ATOM 5394 C CA . THR D 2 64 ? -23.126 -13.885 7.916 1.00 39.50 ? 64 THR D CA 1 ATOM 5395 C C . THR D 2 64 ? -23.224 -15.354 8.313 1.00 43.33 ? 64 THR D C 1 ATOM 5396 O O . THR D 2 64 ? -24.218 -16.021 8.002 1.00 51.45 ? 64 THR D O 1 ATOM 5397 C CB . THR D 2 64 ? -22.376 -13.741 6.590 1.00 40.40 ? 64 THR D CB 1 ATOM 5398 O OG1 . THR D 2 64 ? -20.983 -14.011 6.794 1.00 48.01 ? 64 THR D OG1 1 ATOM 5399 C CG2 . THR D 2 64 ? -22.538 -12.336 6.031 1.00 25.46 ? 64 THR D CG2 1 ATOM 5400 N N . SER D 2 65 ? -22.214 -15.873 9.007 1.00 43.13 ? 65 SER D N 1 ATOM 5401 C CA . SER D 2 65 ? -22.138 -17.295 9.315 1.00 43.68 ? 65 SER D CA 1 ATOM 5402 C C . SER D 2 65 ? -22.844 -17.675 10.612 1.00 47.17 ? 65 SER D C 1 ATOM 5403 O O . SER D 2 65 ? -22.718 -18.821 11.053 1.00 53.06 ? 65 SER D O 1 ATOM 5404 C CB . SER D 2 65 ? -20.675 -17.742 9.375 1.00 50.63 ? 65 SER D CB 1 ATOM 5405 O OG . SER D 2 65 ? -20.074 -17.681 8.093 1.00 62.83 ? 65 SER D OG 1 ATOM 5406 N N . ARG D 2 66 ? -23.579 -16.750 11.235 1.00 43.19 ? 66 ARG D N 1 ATOM 5407 C CA . ARG D 2 66 ? -24.322 -17.117 12.436 1.00 43.68 ? 66 ARG D CA 1 ATOM 5408 C C . ARG D 2 66 ? -25.607 -16.316 12.613 1.00 35.34 ? 66 ARG D C 1 ATOM 5409 O O . ARG D 2 66 ? -26.204 -16.380 13.695 1.00 30.06 ? 66 ARG D O 1 ATOM 5410 C CB . ARG D 2 66 ? -23.435 -16.970 13.686 1.00 44.34 ? 66 ARG D CB 1 ATOM 5411 C CG . ARG D 2 66 ? -23.050 -15.545 14.059 1.00 39.73 ? 66 ARG D CG 1 ATOM 5412 C CD . ARG D 2 66 ? -21.951 -15.567 15.116 1.00 44.07 ? 66 ARG D CD 1 ATOM 5413 N NE . ARG D 2 66 ? -21.659 -14.252 15.679 1.00 41.30 ? 66 ARG D NE 1 ATOM 5414 C CZ . ARG D 2 66 ? -21.989 -13.877 16.911 1.00 39.80 ? 66 ARG D CZ 1 ATOM 5415 N NH1 . ARG D 2 66 ? -22.625 -14.718 17.715 1.00 37.06 ? 66 ARG D NH1 1 ATOM 5416 N NH2 . ARG D 2 66 ? -21.678 -12.662 17.342 1.00 40.11 ? 66 ARG D NH2 1 ATOM 5417 N N . LEU D 2 67 ? -26.064 -15.586 11.601 1.00 26.34 ? 67 LEU D N 1 ATOM 5418 C CA . LEU D 2 67 ? -27.269 -14.777 11.690 1.00 32.87 ? 67 LEU D CA 1 ATOM 5419 C C . LEU D 2 67 ? -28.283 -15.252 10.659 1.00 34.23 ? 67 LEU D C 1 ATOM 5420 O O . LEU D 2 67 ? -27.929 -15.536 9.511 1.00 41.33 ? 67 LEU D O 1 ATOM 5421 C CB . LEU D 2 67 ? -26.947 -13.293 11.471 1.00 32.45 ? 67 LEU D CB 1 ATOM 5422 C CG . LEU D 2 67 ? -28.066 -12.299 11.760 1.00 31.28 ? 67 LEU D CG 1 ATOM 5423 C CD1 . LEU D 2 67 ? -28.546 -12.499 13.177 1.00 40.53 ? 67 LEU D CD1 1 ATOM 5424 C CD2 . LEU D 2 67 ? -27.589 -10.873 11.546 1.00 32.44 ? 67 LEU D CD2 1 ATOM 5425 N N . SER D 2 68 ? -29.546 -15.340 11.074 1.00 23.57 ? 68 SER D N 1 ATOM 5426 C CA . SER D 2 68 ? -30.626 -15.727 10.176 1.00 30.12 ? 68 SER D CA 1 ATOM 5427 C C . SER D 2 68 ? -31.856 -14.891 10.493 1.00 33.62 ? 68 SER D C 1 ATOM 5428 O O . SER D 2 68 ? -32.253 -14.784 11.657 1.00 37.08 ? 68 SER D O 1 ATOM 5429 C CB . SER D 2 68 ? -30.955 -17.219 10.302 1.00 36.22 ? 68 SER D CB 1 ATOM 5430 O OG . SER D 2 68 ? -32.016 -17.431 11.217 1.00 50.19 ? 68 SER D OG 1 ATOM 5431 N N . ILE D 2 69 ? -32.449 -14.298 9.461 1.00 21.08 ? 69 ILE D N 1 ATOM 5432 C CA . ILE D 2 69 ? -33.640 -13.471 9.602 1.00 20.32 ? 69 ILE D CA 1 ATOM 5433 C C . ILE D 2 69 ? -34.721 -14.038 8.695 1.00 31.81 ? 69 ILE D C 1 ATOM 5434 O O . ILE D 2 69 ? -34.513 -14.178 7.483 1.00 26.28 ? 69 ILE D O 1 ATOM 5435 C CB . ILE D 2 69 ? -33.367 -11.998 9.261 1.00 21.29 ? 69 ILE D CB 1 ATOM 5436 C CG1 . ILE D 2 69 ? -32.193 -11.458 10.077 1.00 19.06 ? 69 ILE D CG1 1 ATOM 5437 C CG2 . ILE D 2 69 ? -34.605 -11.163 9.526 1.00 18.95 ? 69 ILE D CG2 1 ATOM 5438 C CD1 . ILE D 2 69 ? -31.849 -10.018 9.752 1.00 18.29 ? 69 ILE D CD1 1 ATOM 5439 N N . ASN D 2 70 ? -35.870 -14.360 9.282 1.00 36.15 ? 70 ASN D N 1 ATOM 5440 C CA . ASN D 2 70 ? -37.041 -14.818 8.551 1.00 31.08 ? 70 ASN D CA 1 ATOM 5441 C C . ASN D 2 70 ? -38.242 -14.011 9.019 1.00 32.00 ? 70 ASN D C 1 ATOM 5442 O O . ASN D 2 70 ? -38.165 -13.253 9.990 1.00 38.00 ? 70 ASN D O 1 ATOM 5443 C CB . ASN D 2 70 ? -37.280 -16.321 8.758 1.00 38.01 ? 70 ASN D CB 1 ATOM 5444 C CG . ASN D 2 70 ? -36.012 -17.138 8.594 1.00 47.45 ? 70 ASN D CG 1 ATOM 5445 O OD1 . ASN D 2 70 ? -35.256 -17.329 9.548 1.00 48.30 ? 70 ASN D OD1 1 ATOM 5446 N ND2 . ASN D 2 70 ? -35.769 -17.622 7.378 1.00 47.41 ? 70 ASN D ND2 1 ATOM 5447 N N . LYS D 2 71 ? -39.366 -14.171 8.324 1.00 30.55 ? 71 LYS D N 1 ATOM 5448 C CA . LYS D 2 71 ? -40.565 -13.431 8.683 1.00 25.23 ? 71 LYS D CA 1 ATOM 5449 C C . LYS D 2 71 ? -41.801 -14.243 8.319 1.00 24.06 ? 71 LYS D C 1 ATOM 5450 O O . LYS D 2 71 ? -41.718 -15.319 7.720 1.00 25.69 ? 71 LYS D O 1 ATOM 5451 C CB . LYS D 2 71 ? -40.591 -12.056 8.007 1.00 25.07 ? 71 LYS D CB 1 ATOM 5452 C CG . LYS D 2 71 ? -40.739 -12.092 6.495 1.00 22.17 ? 71 LYS D CG 1 ATOM 5453 C CD . LYS D 2 71 ? -40.838 -10.678 5.946 1.00 26.17 ? 71 LYS D CD 1 ATOM 5454 C CE . LYS D 2 71 ? -40.785 -10.650 4.431 1.00 27.17 ? 71 LYS D CE 1 ATOM 5455 N NZ . LYS D 2 71 ? -41.019 -9.276 3.909 1.00 29.61 ? 71 LYS D NZ 1 ATOM 5456 N N . ASP D 2 72 ? -42.958 -13.708 8.707 1.00 24.86 ? 72 ASP D N 1 ATOM 5457 C CA . ASP D 2 72 ? -44.266 -14.269 8.373 1.00 34.02 ? 72 ASP D CA 1 ATOM 5458 C C . ASP D 2 72 ? -45.162 -13.075 8.055 1.00 41.78 ? 72 ASP D C 1 ATOM 5459 O O . ASP D 2 72 ? -45.679 -12.426 8.970 1.00 32.68 ? 72 ASP D O 1 ATOM 5460 C CB . ASP D 2 72 ? -44.820 -15.108 9.520 1.00 37.00 ? 72 ASP D CB 1 ATOM 5461 C CG . ASP D 2 72 ? -46.133 -15.793 9.175 1.00 44.59 ? 72 ASP D CG 1 ATOM 5462 O OD1 . ASP D 2 72 ? -47.083 -15.105 8.745 1.00 46.83 ? 72 ASP D OD1 1 ATOM 5463 O OD2 . ASP D 2 72 ? -46.216 -17.028 9.343 1.00 50.94 ? 72 ASP D OD2 1 ATOM 5464 N N . ASN D 2 73 ? -45.336 -12.792 6.759 1.00 48.71 ? 73 ASN D N 1 ATOM 5465 C CA . ASN D 2 73 ? -46.045 -11.583 6.340 1.00 42.83 ? 73 ASN D CA 1 ATOM 5466 C C . ASN D 2 73 ? -47.465 -11.540 6.889 1.00 46.95 ? 73 ASN D C 1 ATOM 5467 O O . ASN D 2 73 ? -47.963 -10.469 7.257 1.00 45.45 ? 73 ASN D O 1 ATOM 5468 C CB . ASN D 2 73 ? -46.068 -11.489 4.814 1.00 37.65 ? 73 ASN D CB 1 ATOM 5469 C CG . ASN D 2 73 ? -44.705 -11.187 4.224 1.00 38.48 ? 73 ASN D CG 1 ATOM 5470 O OD1 . ASN D 2 73 ? -43.951 -10.371 4.756 1.00 39.19 ? 73 ASN D OD1 1 ATOM 5471 N ND2 . ASN D 2 73 ? -44.381 -11.845 3.117 1.00 30.42 ? 73 ASN D ND2 1 ATOM 5472 N N . SER D 2 74 ? -48.134 -12.694 6.952 1.00 55.27 ? 74 SER D N 1 ATOM 5473 C CA . SER D 2 74 ? -49.516 -12.718 7.421 1.00 48.91 ? 74 SER D CA 1 ATOM 5474 C C . SER D 2 74 ? -49.609 -12.358 8.900 1.00 39.43 ? 74 SER D C 1 ATOM 5475 O O . SER D 2 74 ? -50.547 -11.667 9.315 1.00 32.33 ? 74 SER D O 1 ATOM 5476 C CB . SER D 2 74 ? -50.136 -14.091 7.156 1.00 52.46 ? 74 SER D CB 1 ATOM 5477 O OG . SER D 2 74 ? -49.361 -15.123 7.739 1.00 56.57 ? 74 SER D OG 1 ATOM 5478 N N . LYS D 2 75 ? -48.646 -12.807 9.708 1.00 36.75 ? 75 LYS D N 1 ATOM 5479 C CA . LYS D 2 75 ? -48.644 -12.515 11.136 1.00 31.37 ? 75 LYS D CA 1 ATOM 5480 C C . LYS D 2 75 ? -47.943 -11.207 11.487 1.00 27.49 ? 75 LYS D C 1 ATOM 5481 O O . LYS D 2 75 ? -47.978 -10.806 12.655 1.00 25.93 ? 75 LYS D O 1 ATOM 5482 C CB . LYS D 2 75 ? -47.985 -13.659 11.917 1.00 31.68 ? 75 LYS D CB 1 ATOM 5483 C CG . LYS D 2 75 ? -48.781 -14.951 11.937 1.00 37.64 ? 75 LYS D CG 1 ATOM 5484 C CD . LYS D 2 75 ? -48.168 -15.948 12.906 1.00 50.95 ? 75 LYS D CD 1 ATOM 5485 C CE . LYS D 2 75 ? -46.741 -16.302 12.515 1.00 62.65 ? 75 LYS D CE 1 ATOM 5486 N NZ . LYS D 2 75 ? -46.149 -17.329 13.419 1.00 62.31 ? 75 LYS D NZ 1 ATOM 5487 N N . SER D 2 76 ? -47.317 -10.540 10.513 1.00 27.58 ? 76 SER D N 1 ATOM 5488 C CA . SER D 2 76 ? -46.598 -9.282 10.743 1.00 25.06 ? 76 SER D CA 1 ATOM 5489 C C . SER D 2 76 ? -45.477 -9.472 11.763 1.00 27.48 ? 76 SER D C 1 ATOM 5490 O O . SER D 2 76 ? -45.245 -8.624 12.627 1.00 19.73 ? 76 SER D O 1 ATOM 5491 C CB . SER D 2 76 ? -47.552 -8.157 11.173 1.00 20.71 ? 76 SER D CB 1 ATOM 5492 O OG . SER D 2 76 ? -48.452 -7.785 10.137 1.00 35.05 ? 76 SER D OG 1 ATOM 5493 N N . GLN D 2 77 ? -44.776 -10.599 11.662 1.00 30.03 ? 77 GLN D N 1 ATOM 5494 C CA . GLN D 2 77 ? -43.743 -10.966 12.619 1.00 32.56 ? 77 GLN D CA 1 ATOM 5495 C C . GLN D 2 77 ? -42.432 -11.211 11.889 1.00 30.51 ? 77 GLN D C 1 ATOM 5496 O O . GLN D 2 77 ? -42.389 -11.969 10.915 1.00 34.68 ? 77 GLN D O 1 ATOM 5497 C CB . GLN D 2 77 ? -44.153 -12.207 13.418 1.00 41.21 ? 77 GLN D CB 1 ATOM 5498 C CG . GLN D 2 77 ? -45.435 -12.011 14.205 1.00 44.35 ? 77 GLN D CG 1 ATOM 5499 C CD . GLN D 2 77 ? -45.610 -13.042 15.295 1.00 41.92 ? 77 GLN D CD 1 ATOM 5500 O OE1 . GLN D 2 77 ? -45.963 -12.709 16.426 1.00 50.35 ? 77 GLN D OE1 1 ATOM 5501 N NE2 . GLN D 2 77 ? -45.362 -14.304 14.963 1.00 34.81 ? 77 GLN D NE2 1 ATOM 5502 N N . VAL D 2 78 ? -41.374 -10.558 12.357 1.00 25.55 ? 78 VAL D N 1 ATOM 5503 C CA . VAL D 2 78 ? -40.020 -10.762 11.859 1.00 30.30 ? 78 VAL D CA 1 ATOM 5504 C C . VAL D 2 78 ? -39.238 -11.493 12.939 1.00 32.38 ? 78 VAL D C 1 ATOM 5505 O O . VAL D 2 78 ? -39.294 -11.116 14.116 1.00 37.71 ? 78 VAL D O 1 ATOM 5506 C CB . VAL D 2 78 ? -39.348 -9.429 11.490 1.00 24.65 ? 78 VAL D CB 1 ATOM 5507 C CG1 . VAL D 2 78 ? -37.923 -9.665 11.031 1.00 19.68 ? 78 VAL D CG1 1 ATOM 5508 C CG2 . VAL D 2 78 ? -40.150 -8.714 10.414 1.00 19.45 ? 78 VAL D CG2 1 ATOM 5509 N N . PHE D 2 79 ? -38.518 -12.538 12.543 1.00 30.66 ? 79 PHE D N 1 ATOM 5510 C CA . PHE D 2 79 ? -37.820 -13.411 13.477 1.00 31.01 ? 79 PHE D CA 1 ATOM 5511 C C . PHE D 2 79 ? -36.316 -13.241 13.314 1.00 38.41 ? 79 PHE D C 1 ATOM 5512 O O . PHE D 2 79 ? -35.779 -13.415 12.214 1.00 42.47 ? 79 PHE D O 1 ATOM 5513 C CB . PHE D 2 79 ? -38.229 -14.867 13.265 1.00 29.03 ? 79 PHE D CB 1 ATOM 5514 C CG . PHE D 2 79 ? -39.714 -15.070 13.216 1.00 27.56 ? 79 PHE D CG 1 ATOM 5515 C CD1 . PHE D 2 79 ? -40.485 -14.904 14.356 1.00 32.33 ? 79 PHE D CD1 1 ATOM 5516 C CD2 . PHE D 2 79 ? -40.340 -15.418 12.031 1.00 23.68 ? 79 PHE D CD2 1 ATOM 5517 C CE1 . PHE D 2 79 ? -41.854 -15.083 14.317 1.00 27.84 ? 79 PHE D CE1 1 ATOM 5518 C CE2 . PHE D 2 79 ? -41.710 -15.600 11.985 1.00 34.76 ? 79 PHE D CE2 1 ATOM 5519 C CZ . PHE D 2 79 ? -42.469 -15.432 13.129 1.00 23.63 ? 79 PHE D CZ 1 ATOM 5520 N N . PHE D 2 80 ? -35.649 -12.908 14.414 1.00 36.03 ? 80 PHE D N 1 ATOM 5521 C CA . PHE D 2 80 ? -34.212 -12.687 14.466 1.00 27.36 ? 80 PHE D CA 1 ATOM 5522 C C . PHE D 2 80 ? -33.579 -13.825 15.251 1.00 33.48 ? 80 PHE D C 1 ATOM 5523 O O . PHE D 2 80 ? -34.078 -14.195 16.319 1.00 41.39 ? 80 PHE D O 1 ATOM 5524 C CB . PHE D 2 80 ? -33.916 -11.336 15.126 1.00 28.48 ? 80 PHE D CB 1 ATOM 5525 C CG . PHE D 2 80 ? -32.454 -11.047 15.338 1.00 32.93 ? 80 PHE D CG 1 ATOM 5526 C CD1 . PHE D 2 80 ? -31.799 -11.491 16.479 1.00 37.32 ? 80 PHE D CD1 1 ATOM 5527 C CD2 . PHE D 2 80 ? -31.748 -10.288 14.419 1.00 27.19 ? 80 PHE D CD2 1 ATOM 5528 C CE1 . PHE D 2 80 ? -30.461 -11.211 16.681 1.00 36.38 ? 80 PHE D CE1 1 ATOM 5529 C CE2 . PHE D 2 80 ? -30.412 -10.000 14.618 1.00 19.73 ? 80 PHE D CE2 1 ATOM 5530 C CZ . PHE D 2 80 ? -29.767 -10.462 15.751 1.00 32.75 ? 80 PHE D CZ 1 ATOM 5531 N N . LYS D 2 81 ? -32.486 -14.377 14.730 1.00 35.67 ? 81 LYS D N 1 ATOM 5532 C CA . LYS D 2 81 ? -31.820 -15.483 15.405 1.00 31.08 ? 81 LYS D CA 1 ATOM 5533 C C . LYS D 2 81 ? -30.324 -15.418 15.143 1.00 33.24 ? 81 LYS D C 1 ATOM 5534 O O . LYS D 2 81 ? -29.895 -15.369 13.987 1.00 37.54 ? 81 LYS D O 1 ATOM 5535 C CB . LYS D 2 81 ? -32.395 -16.831 14.950 1.00 31.25 ? 81 LYS D CB 1 ATOM 5536 C CG . LYS D 2 81 ? -31.799 -18.035 15.661 1.00 37.67 ? 81 LYS D CG 1 ATOM 5537 C CD . LYS D 2 81 ? -32.706 -19.255 15.556 1.00 42.05 ? 81 LYS D CD 1 ATOM 5538 C CE . LYS D 2 81 ? -31.987 -20.516 16.023 1.00 50.72 ? 81 LYS D CE 1 ATOM 5539 N NZ . LYS D 2 81 ? -32.917 -21.664 16.222 1.00 52.44 ? 81 LYS D NZ 1 ATOM 5540 N N . MET D 2 82 ? -29.553 -15.444 16.220 1.00 31.77 ? 82 MET D N 1 ATOM 5541 C CA . MET D 2 82 ? -28.104 -15.507 16.162 1.00 32.70 ? 82 MET D CA 1 ATOM 5542 C C . MET D 2 82 ? -27.649 -16.628 17.091 1.00 38.02 ? 82 MET D C 1 ATOM 5543 O O . MET D 2 82 ? -28.161 -16.745 18.206 1.00 45.40 ? 82 MET D O 1 ATOM 5544 C CB . MET D 2 82 ? -27.494 -14.168 16.573 1.00 25.10 ? 82 MET D CB 1 ATOM 5545 C CG . MET D 2 82 ? -25.987 -14.053 16.386 1.00 33.27 ? 82 MET D CG 1 ATOM 5546 S SD . MET D 2 82 ? -25.393 -12.466 17.029 1.00 33.27 ? 82 MET D SD 1 ATOM 5547 C CE . MET D 2 82 ? -26.297 -11.322 15.991 1.00 39.63 ? 82 MET D CE 1 ATOM 5548 N N . ASN D 2 83 ? -26.709 -17.444 16.622 1.00 39.81 ? 83 ASN D N 1 ATOM 5549 C CA A ASN D 2 83 ? -26.213 -18.638 17.311 0.59 41.06 ? 83 ASN D CA 1 ATOM 5550 C CA B ASN D 2 83 ? -26.259 -18.563 17.446 0.41 40.93 ? 83 ASN D CA 1 ATOM 5551 C C . ASN D 2 83 ? -24.793 -18.392 17.836 1.00 42.12 ? 83 ASN D C 1 ATOM 5552 O O . ASN D 2 83 ? -24.086 -17.506 17.368 1.00 46.49 ? 83 ASN D O 1 ATOM 5553 C CB A ASN D 2 83 ? -26.204 -19.842 16.355 0.59 38.53 ? 83 ASN D CB 1 ATOM 5554 C CB B ASN D 2 83 ? -26.511 -19.909 16.746 0.41 38.55 ? 83 ASN D CB 1 ATOM 5555 C CG A ASN D 2 83 ? -27.579 -20.157 15.767 0.59 32.85 ? 83 ASN D CG 1 ATOM 5556 C CG B ASN D 2 83 ? -25.649 -20.143 15.523 0.41 36.04 ? 83 ASN D CG 1 ATOM 5557 O OD1 A ASN D 2 83 ? -28.065 -19.451 14.882 0.59 28.78 ? 83 ASN D OD1 1 ATOM 5558 O OD1 B ASN D 2 83 ? -25.506 -21.283 15.064 0.41 40.54 ? 83 ASN D OD1 1 ATOM 5559 N ND2 A ASN D 2 83 ? -28.192 -21.243 16.234 0.59 30.32 ? 83 ASN D ND2 1 ATOM 5560 N ND2 B ASN D 2 83 ? -25.080 -19.091 14.990 0.41 29.75 ? 83 ASN D ND2 1 ATOM 5561 N N . SER D 2 84 ? -24.380 -19.255 18.770 1.00 48.37 ? 84 SER D N 1 ATOM 5562 C CA . SER D 2 84 ? -23.041 -19.227 19.355 1.00 57.19 ? 84 SER D CA 1 ATOM 5563 C C . SER D 2 84 ? -22.700 -17.832 19.876 1.00 54.54 ? 84 SER D C 1 ATOM 5564 O O . SER D 2 84 ? -21.690 -17.226 19.516 1.00 63.99 ? 84 SER D O 1 ATOM 5565 C CB . SER D 2 84 ? -21.998 -19.715 18.350 1.00 60.85 ? 84 SER D CB 1 ATOM 5566 O OG . SER D 2 84 ? -20.771 -20.001 19.002 1.00 62.43 ? 84 SER D OG 1 ATOM 5567 N N . LEU D 2 85 ? -23.581 -17.323 20.730 1.00 44.83 ? 85 LEU D N 1 ATOM 5568 C CA . LEU D 2 85 ? -23.358 -16.028 21.351 1.00 39.26 ? 85 LEU D CA 1 ATOM 5569 C C . LEU D 2 85 ? -22.230 -16.094 22.373 1.00 34.90 ? 85 LEU D C 1 ATOM 5570 O O . LEU D 2 85 ? -22.061 -17.088 23.086 1.00 43.21 ? 85 LEU D O 1 ATOM 5571 C CB . LEU D 2 85 ? -24.623 -15.528 22.041 1.00 36.95 ? 85 LEU D CB 1 ATOM 5572 C CG . LEU D 2 85 ? -25.392 -14.510 21.199 1.00 41.78 ? 85 LEU D CG 1 ATOM 5573 C CD1 . LEU D 2 85 ? -26.157 -15.213 20.092 1.00 36.19 ? 85 LEU D CD1 1 ATOM 5574 C CD2 . LEU D 2 85 ? -26.314 -13.663 22.061 1.00 48.69 ? 85 LEU D CD2 1 ATOM 5575 N N . GLN D 2 86 ? -21.463 -15.010 22.450 1.00 31.20 ? 86 GLN D N 1 ATOM 5576 C CA . GLN D 2 86 ? -20.381 -14.864 23.426 1.00 34.76 ? 86 GLN D CA 1 ATOM 5577 C C . GLN D 2 86 ? -20.652 -13.668 24.346 1.00 36.37 ? 86 GLN D C 1 ATOM 5578 O O . GLN D 2 86 ? -21.668 -12.986 24.225 1.00 39.49 ? 86 GLN D O 1 ATOM 5579 C CB . GLN D 2 86 ? -19.023 -14.722 22.729 1.00 25.85 ? 86 GLN D CB 1 ATOM 5580 C CG . GLN D 2 86 ? -18.778 -15.732 21.600 1.00 46.91 ? 86 GLN D CG 1 ATOM 5581 C CD . GLN D 2 86 ? -18.637 -17.178 22.089 1.00 61.33 ? 86 GLN D CD 1 ATOM 5582 O OE1 . GLN D 2 86 ? -18.663 -17.458 23.294 1.00 65.41 ? 86 GLN D OE1 1 ATOM 5583 N NE2 . GLN D 2 86 ? -18.482 -18.106 21.139 1.00 64.29 ? 86 GLN D NE2 1 ATOM 5584 N N . SER D 2 87 ? -19.778 -13.532 25.345 1.00 32.67 ? 87 SER D N 1 ATOM 5585 C CA . SER D 2 87 ? -20.038 -12.604 26.438 1.00 29.74 ? 87 SER D CA 1 ATOM 5586 C C . SER D 2 87 ? -20.164 -11.178 25.930 1.00 33.65 ? 87 SER D C 1 ATOM 5587 O O . SER D 2 87 ? -21.007 -10.410 26.415 1.00 32.72 ? 87 SER D O 1 ATOM 5588 C CB . SER D 2 87 ? -18.928 -12.704 27.483 1.00 24.25 ? 87 SER D CB 1 ATOM 5589 O OG . SER D 2 87 ? -19.103 -11.751 28.516 1.00 34.88 ? 87 SER D OG 1 ATOM 5590 N N . ASN D 2 88 ? -19.340 -10.808 24.953 1.00 36.96 ? 88 ASN D N 1 ATOM 5591 C CA . ASN D 2 88 ? -19.378 -9.456 24.423 1.00 41.08 ? 88 ASN D CA 1 ATOM 5592 C C . ASN D 2 88 ? -20.497 -9.243 23.414 1.00 36.52 ? 88 ASN D C 1 ATOM 5593 O O . ASN D 2 88 ? -20.642 -8.124 22.909 1.00 42.52 ? 88 ASN D O 1 ATOM 5594 C CB . ASN D 2 88 ? -18.033 -9.110 23.802 1.00 39.34 ? 88 ASN D CB 1 ATOM 5595 C CG . ASN D 2 88 ? -17.814 -9.780 22.463 1.00 48.10 ? 88 ASN D CG 1 ATOM 5596 O OD1 . ASN D 2 88 ? -18.404 -10.811 22.141 1.00 46.32 ? 88 ASN D OD1 1 ATOM 5597 N ND2 . ASN D 2 88 ? -16.941 -9.182 21.678 1.00 71.80 ? 88 ASN D ND2 1 ATOM 5598 N N . ASP D 2 89 ? -21.282 -10.276 23.105 1.00 25.92 ? 89 ASP D N 1 ATOM 5599 C CA . ASP D 2 89 ? -22.522 -10.082 22.362 1.00 27.26 ? 89 ASP D CA 1 ATOM 5600 C C . ASP D 2 89 ? -23.642 -9.555 23.247 1.00 31.45 ? 89 ASP D C 1 ATOM 5601 O O . ASP D 2 89 ? -24.742 -9.293 22.751 1.00 23.89 ? 89 ASP D O 1 ATOM 5602 C CB . ASP D 2 89 ? -22.965 -11.386 21.688 1.00 29.02 ? 89 ASP D CB 1 ATOM 5603 C CG . ASP D 2 89 ? -22.144 -11.713 20.451 1.00 41.08 ? 89 ASP D CG 1 ATOM 5604 O OD1 . ASP D 2 89 ? -21.811 -10.779 19.685 1.00 41.71 ? 89 ASP D OD1 1 ATOM 5605 O OD2 . ASP D 2 89 ? -21.825 -12.904 20.241 1.00 46.22 ? 89 ASP D OD2 1 ATOM 5606 N N . THR D 2 90 ? -23.387 -9.408 24.541 1.00 35.44 ? 90 THR D N 1 ATOM 5607 C CA . THR D 2 90 ? -24.338 -8.763 25.436 1.00 32.69 ? 90 THR D CA 1 ATOM 5608 C C . THR D 2 90 ? -24.582 -7.333 24.970 1.00 33.82 ? 90 THR D C 1 ATOM 5609 O O . THR D 2 90 ? -23.658 -6.514 24.946 1.00 35.00 ? 90 THR D O 1 ATOM 5610 C CB . THR D 2 90 ? -23.802 -8.789 26.870 1.00 30.11 ? 90 THR D CB 1 ATOM 5611 O OG1 . THR D 2 90 ? -23.793 -10.140 27.353 1.00 37.77 ? 90 THR D OG1 1 ATOM 5612 C CG2 . THR D 2 90 ? -24.648 -7.931 27.790 1.00 24.91 ? 90 THR D CG2 1 ATOM 5613 N N . ALA D 2 91 ? -25.821 -7.039 24.584 1.00 33.08 ? 91 ALA D N 1 ATOM 5614 C CA . ALA D 2 91 ? -26.147 -5.754 23.978 1.00 25.03 ? 91 ALA D CA 1 ATOM 5615 C C . ALA D 2 91 ? -27.661 -5.592 23.944 1.00 27.11 ? 91 ALA D C 1 ATOM 5616 O O . ALA D 2 91 ? -28.414 -6.522 24.244 1.00 23.64 ? 91 ALA D O 1 ATOM 5617 C CB . ALA D 2 91 ? -25.565 -5.642 22.566 1.00 16.71 ? 91 ALA D CB 1 ATOM 5618 N N . ILE D 2 92 ? -28.095 -4.392 23.570 1.00 15.16 ? 92 ILE D N 1 ATOM 5619 C CA . ILE D 2 92 ? -29.502 -4.127 23.293 1.00 28.74 ? 92 ILE D CA 1 ATOM 5620 C C . ILE D 2 92 ? -29.717 -4.289 21.795 1.00 32.01 ? 92 ILE D C 1 ATOM 5621 O O . ILE D 2 92 ? -29.023 -3.659 20.990 1.00 31.23 ? 92 ILE D O 1 ATOM 5622 C CB . ILE D 2 92 ? -29.915 -2.726 23.768 1.00 29.05 ? 92 ILE D CB 1 ATOM 5623 C CG1 . ILE D 2 92 ? -29.729 -2.607 25.280 1.00 33.44 ? 92 ILE D CG1 1 ATOM 5624 C CG2 . ILE D 2 92 ? -31.365 -2.439 23.390 1.00 22.90 ? 92 ILE D CG2 1 ATOM 5625 C CD1 . ILE D 2 92 ? -30.079 -1.251 25.832 1.00 38.64 ? 92 ILE D CD1 1 ATOM 5626 N N . TYR D 2 93 ? -30.665 -5.142 21.420 1.00 28.55 ? 93 TYR D N 1 ATOM 5627 C CA . TYR D 2 93 ? -30.941 -5.455 20.024 1.00 24.07 ? 93 TYR D CA 1 ATOM 5628 C C . TYR D 2 93 ? -32.241 -4.786 19.603 1.00 19.31 ? 93 TYR D C 1 ATOM 5629 O O . TYR D 2 93 ? -33.245 -4.870 20.317 1.00 21.28 ? 93 TYR D O 1 ATOM 5630 C CB . TYR D 2 93 ? -31.018 -6.968 19.811 1.00 22.01 ? 93 TYR D CB 1 ATOM 5631 C CG . TYR D 2 93 ? -29.684 -7.668 19.943 1.00 26.92 ? 93 TYR D CG 1 ATOM 5632 C CD1 . TYR D 2 93 ? -29.154 -7.969 21.191 1.00 29.91 ? 93 TYR D CD1 1 ATOM 5633 C CD2 . TYR D 2 93 ? -28.954 -8.028 18.819 1.00 27.45 ? 93 TYR D CD2 1 ATOM 5634 C CE1 . TYR D 2 93 ? -27.932 -8.608 21.314 1.00 28.03 ? 93 TYR D CE1 1 ATOM 5635 C CE2 . TYR D 2 93 ? -27.735 -8.667 18.931 1.00 28.00 ? 93 TYR D CE2 1 ATOM 5636 C CZ . TYR D 2 93 ? -27.228 -8.954 20.180 1.00 26.56 ? 93 TYR D CZ 1 ATOM 5637 O OH . TYR D 2 93 ? -26.013 -9.588 20.292 1.00 27.33 ? 93 TYR D OH 1 ATOM 5638 N N . TYR D 2 94 ? -32.215 -4.119 18.450 1.00 22.80 ? 94 TYR D N 1 ATOM 5639 C CA . TYR D 2 94 ? -33.367 -3.399 17.928 1.00 24.28 ? 94 TYR D CA 1 ATOM 5640 C C . TYR D 2 94 ? -33.808 -3.989 16.598 1.00 25.14 ? 94 TYR D C 1 ATOM 5641 O O . TYR D 2 94 ? -33.001 -4.543 15.846 1.00 26.62 ? 94 TYR D O 1 ATOM 5642 C CB . TYR D 2 94 ? -33.067 -1.910 17.696 1.00 21.94 ? 94 TYR D CB 1 ATOM 5643 C CG . TYR D 2 94 ? -32.544 -1.142 18.886 1.00 24.26 ? 94 TYR D CG 1 ATOM 5644 C CD1 . TYR D 2 94 ? -31.184 -1.092 19.157 1.00 20.20 ? 94 TYR D CD1 1 ATOM 5645 C CD2 . TYR D 2 94 ? -33.407 -0.438 19.719 1.00 22.97 ? 94 TYR D CD2 1 ATOM 5646 C CE1 . TYR D 2 94 ? -30.697 -0.379 20.233 1.00 27.06 ? 94 TYR D CE1 1 ATOM 5647 C CE2 . TYR D 2 94 ? -32.928 0.280 20.799 1.00 14.33 ? 94 TYR D CE2 1 ATOM 5648 C CZ . TYR D 2 94 ? -31.571 0.304 21.050 1.00 19.09 ? 94 TYR D CZ 1 ATOM 5649 O OH . TYR D 2 94 ? -31.078 1.012 22.121 1.00 19.15 ? 94 TYR D OH 1 ATOM 5650 N N . CYS D 2 95 ? -35.098 -3.849 16.310 1.00 23.95 ? 95 CYS D N 1 ATOM 5651 C CA . CYS D 2 95 ? -35.607 -3.932 14.952 1.00 30.95 ? 95 CYS D CA 1 ATOM 5652 C C . CYS D 2 95 ? -36.104 -2.552 14.541 1.00 28.83 ? 95 CYS D C 1 ATOM 5653 O O . CYS D 2 95 ? -36.620 -1.792 15.365 1.00 31.99 ? 95 CYS D O 1 ATOM 5654 C CB . CYS D 2 95 ? -36.723 -4.975 14.818 1.00 28.54 ? 95 CYS D CB 1 ATOM 5655 S SG . CYS D 2 95 ? -38.184 -4.752 15.864 1.00 32.23 ? 95 CYS D SG 1 ATOM 5656 N N . ALA D 2 96 ? -35.919 -2.219 13.266 1.00 16.34 ? 96 ALA D N 1 ATOM 5657 C CA . ALA D 2 96 ? -36.204 -0.870 12.802 1.00 16.34 ? 96 ALA D CA 1 ATOM 5658 C C . ALA D 2 96 ? -36.734 -0.912 11.377 1.00 21.80 ? 96 ALA D C 1 ATOM 5659 O O . ALA D 2 96 ? -36.520 -1.877 10.637 1.00 31.04 ? 96 ALA D O 1 ATOM 5660 C CB . ALA D 2 96 ? -34.960 0.021 12.880 1.00 18.44 ? 96 ALA D CB 1 ATOM 5661 N N . ARG D 2 97 ? -37.429 0.163 11.002 1.00 20.97 ? 97 ARG D N 1 ATOM 5662 C CA . ARG D 2 97 ? -37.990 0.328 9.669 1.00 23.28 ? 97 ARG D CA 1 ATOM 5663 C C . ARG D 2 97 ? -37.544 1.667 9.101 1.00 19.61 ? 97 ARG D C 1 ATOM 5664 O O . ARG D 2 97 ? -37.475 2.665 9.824 1.00 29.27 ? 97 ARG D O 1 ATOM 5665 C CB . ARG D 2 97 ? -39.526 0.260 9.689 1.00 17.67 ? 97 ARG D CB 1 ATOM 5666 C CG . ARG D 2 97 ? -40.150 -0.076 8.339 1.00 17.85 ? 97 ARG D CG 1 ATOM 5667 C CD . ARG D 2 97 ? -41.496 0.611 8.144 1.00 18.06 ? 97 ARG D CD 1 ATOM 5668 N NE . ARG D 2 97 ? -41.349 1.979 7.657 1.00 21.99 ? 97 ARG D NE 1 ATOM 5669 C CZ . ARG D 2 97 ? -42.365 2.765 7.313 1.00 27.68 ? 97 ARG D CZ 1 ATOM 5670 N NH1 . ARG D 2 97 ? -43.610 2.320 7.404 1.00 29.12 ? 97 ARG D NH1 1 ATOM 5671 N NH2 . ARG D 2 97 ? -42.137 3.998 6.877 1.00 25.84 ? 97 ARG D NH2 1 ATOM 5672 N N . ALA D 2 98 ? -37.245 1.685 7.808 1.00 23.37 ? 98 ALA D N 1 ATOM 5673 C CA . ALA D 2 98 ? -36.797 2.899 7.146 1.00 26.29 ? 98 ALA D CA 1 ATOM 5674 C C . ALA D 2 98 ? -37.987 3.709 6.637 1.00 29.80 ? 98 ALA D C 1 ATOM 5675 O O . ALA D 2 98 ? -39.122 3.231 6.581 1.00 33.63 ? 98 ALA D O 1 ATOM 5676 C CB . ALA D 2 98 ? -35.848 2.559 5.997 1.00 22.64 ? 98 ALA D CB 1 ATOM 5677 N N . LEU D 2 99 ? -37.714 4.963 6.266 1.00 32.51 ? 99 LEU D N 1 ATOM 5678 C CA . LEU D 2 99 ? -38.759 5.818 5.710 1.00 33.69 ? 99 LEU D CA 1 ATOM 5679 C C . LEU D 2 99 ? -39.289 5.256 4.395 1.00 32.25 ? 99 LEU D C 1 ATOM 5680 O O . LEU D 2 99 ? -40.505 5.178 4.182 1.00 25.26 ? 99 LEU D O 1 ATOM 5681 C CB . LEU D 2 99 ? -38.226 7.234 5.505 1.00 33.93 ? 99 LEU D CB 1 ATOM 5682 C CG . LEU D 2 99 ? -38.561 8.280 6.566 1.00 39.20 ? 99 LEU D CG 1 ATOM 5683 C CD1 . LEU D 2 99 ? -38.113 9.657 6.104 1.00 32.50 ? 99 LEU D CD1 1 ATOM 5684 C CD2 . LEU D 2 99 ? -40.049 8.275 6.875 1.00 40.16 ? 99 LEU D CD2 1 ATOM 5685 N N . THR D 2 100 ? -38.390 4.873 3.497 1.00 30.96 ? 100 THR D N 1 ATOM 5686 C CA . THR D 2 100 ? -38.763 4.292 2.220 1.00 35.21 ? 100 THR D CA 1 ATOM 5687 C C . THR D 2 100 ? -38.364 2.823 2.190 1.00 32.30 ? 100 THR D C 1 ATOM 5688 O O . THR D 2 100 ? -37.456 2.388 2.905 1.00 31.46 ? 100 THR D O 1 ATOM 5689 C CB . THR D 2 100 ? -38.111 5.046 1.056 1.00 40.08 ? 100 THR D CB 1 ATOM 5690 O OG1 . THR D 2 100 ? -36.768 4.583 0.878 1.00 48.19 ? 100 THR D OG1 1 ATOM 5691 C CG2 . THR D 2 100 ? -38.084 6.539 1.345 1.00 36.68 ? 100 THR D CG2 1 ATOM 5692 N N . TYR D 2 101 ? -39.055 2.061 1.338 1.00 20.69 ? 101 TYR D N 1 ATOM 5693 C CA . TYR D 2 101 ? -38.925 0.607 1.347 1.00 30.98 ? 101 TYR D CA 1 ATOM 5694 C C . TYR D 2 101 ? -37.506 0.135 1.059 1.00 35.52 ? 101 TYR D C 1 ATOM 5695 O O . TYR D 2 101 ? -37.163 -1.000 1.405 1.00 34.14 ? 101 TYR D O 1 ATOM 5696 C CB . TYR D 2 101 ? -39.897 -0.012 0.335 1.00 21.08 ? 101 TYR D CB 1 ATOM 5697 C CG . TYR D 2 101 ? -39.503 0.136 -1.125 1.00 27.19 ? 101 TYR D CG 1 ATOM 5698 C CD1 . TYR D 2 101 ? -38.718 -0.824 -1.755 1.00 22.87 ? 101 TYR D CD1 1 ATOM 5699 C CD2 . TYR D 2 101 ? -39.939 1.219 -1.879 1.00 28.57 ? 101 TYR D CD2 1 ATOM 5700 C CE1 . TYR D 2 101 ? -38.363 -0.699 -3.085 1.00 29.36 ? 101 TYR D CE1 1 ATOM 5701 C CE2 . TYR D 2 101 ? -39.592 1.352 -3.210 1.00 29.08 ? 101 TYR D CE2 1 ATOM 5702 C CZ . TYR D 2 101 ? -38.804 0.390 -3.808 1.00 33.95 ? 101 TYR D CZ 1 ATOM 5703 O OH . TYR D 2 101 ? -38.454 0.517 -5.134 1.00 34.20 ? 101 TYR D OH 1 ATOM 5704 N N . TYR D 2 102 ? -36.678 0.971 0.439 1.00 37.92 ? 102 TYR D N 1 ATOM 5705 C CA . TYR D 2 102 ? -35.358 0.567 -0.017 1.00 34.25 ? 102 TYR D CA 1 ATOM 5706 C C . TYR D 2 102 ? -34.217 1.225 0.744 1.00 31.22 ? 102 TYR D C 1 ATOM 5707 O O . TYR D 2 102 ? -33.061 0.829 0.553 1.00 32.55 ? 102 TYR D O 1 ATOM 5708 C CB . TYR D 2 102 ? -35.210 0.887 -1.513 1.00 28.12 ? 102 TYR D CB 1 ATOM 5709 C CG . TYR D 2 102 ? -35.431 2.354 -1.817 1.00 22.73 ? 102 TYR D CG 1 ATOM 5710 C CD1 . TYR D 2 102 ? -34.389 3.267 -1.717 1.00 23.02 ? 102 TYR D CD1 1 ATOM 5711 C CD2 . TYR D 2 102 ? -36.685 2.830 -2.186 1.00 27.30 ? 102 TYR D CD2 1 ATOM 5712 C CE1 . TYR D 2 102 ? -34.584 4.612 -1.978 1.00 25.28 ? 102 TYR D CE1 1 ATOM 5713 C CE2 . TYR D 2 102 ? -36.891 4.177 -2.452 1.00 32.48 ? 102 TYR D CE2 1 ATOM 5714 C CZ . TYR D 2 102 ? -35.833 5.064 -2.346 1.00 26.00 ? 102 TYR D CZ 1 ATOM 5715 O OH . TYR D 2 102 ? -36.016 6.406 -2.606 1.00 23.83 ? 102 TYR D OH 1 ATOM 5716 N N . ASP D 2 103 ? -34.504 2.209 1.593 1.00 22.00 ? 103 ASP D N 1 ATOM 5717 C CA . ASP D 2 103 ? -33.482 3.074 2.162 1.00 33.97 ? 103 ASP D CA 1 ATOM 5718 C C . ASP D 2 103 ? -33.022 2.547 3.522 1.00 36.35 ? 103 ASP D C 1 ATOM 5719 O O . ASP D 2 103 ? -33.426 1.470 3.970 1.00 44.79 ? 103 ASP D O 1 ATOM 5720 C CB . ASP D 2 103 ? -34.012 4.502 2.265 1.00 38.63 ? 103 ASP D CB 1 ATOM 5721 C CG . ASP D 2 103 ? -32.937 5.543 2.042 1.00 36.16 ? 103 ASP D CG 1 ATOM 5722 O OD1 . ASP D 2 103 ? -31.745 5.219 2.225 1.00 31.43 ? 103 ASP D OD1 1 ATOM 5723 O OD2 . ASP D 2 103 ? -33.289 6.686 1.681 1.00 31.91 ? 103 ASP D OD2 1 ATOM 5724 N N . TYR D 2 104 ? -32.162 3.320 4.196 1.00 29.63 ? 104 TYR D N 1 ATOM 5725 C CA . TYR D 2 104 ? -31.567 2.923 5.467 1.00 20.38 ? 104 TYR D CA 1 ATOM 5726 C C . TYR D 2 104 ? -31.702 4.008 6.531 1.00 27.12 ? 104 TYR D C 1 ATOM 5727 O O . TYR D 2 104 ? -30.983 3.974 7.534 1.00 31.93 ? 104 TYR D O 1 ATOM 5728 C CB . TYR D 2 104 ? -30.090 2.566 5.286 1.00 23.07 ? 104 TYR D CB 1 ATOM 5729 C CG . TYR D 2 104 ? -29.831 1.285 4.526 1.00 27.09 ? 104 TYR D CG 1 ATOM 5730 C CD1 . TYR D 2 104 ? -30.049 1.209 3.159 1.00 29.52 ? 104 TYR D CD1 1 ATOM 5731 C CD2 . TYR D 2 104 ? -29.343 0.160 5.173 1.00 34.17 ? 104 TYR D CD2 1 ATOM 5732 C CE1 . TYR D 2 104 ? -29.805 0.045 2.461 1.00 38.88 ? 104 TYR D CE1 1 ATOM 5733 C CE2 . TYR D 2 104 ? -29.093 -1.011 4.482 1.00 35.72 ? 104 TYR D CE2 1 ATOM 5734 C CZ . TYR D 2 104 ? -29.326 -1.060 3.125 1.00 36.18 ? 104 TYR D CZ 1 ATOM 5735 O OH . TYR D 2 104 ? -29.081 -2.219 2.426 1.00 31.75 ? 104 TYR D OH 1 ATOM 5736 N N . GLU D 2 105 ? -32.590 4.978 6.331 1.00 29.95 ? 105 GLU D N 1 ATOM 5737 C CA . GLU D 2 105 ? -32.837 6.022 7.325 1.00 30.93 ? 105 GLU D CA 1 ATOM 5738 C C . GLU D 2 105 ? -33.920 5.514 8.267 1.00 35.65 ? 105 GLU D C 1 ATOM 5739 O O . GLU D 2 105 ? -35.112 5.581 7.958 1.00 30.44 ? 105 GLU D O 1 ATOM 5740 C CB . GLU D 2 105 ? -33.237 7.331 6.653 1.00 31.78 ? 105 GLU D CB 1 ATOM 5741 C CG . GLU D 2 105 ? -33.287 7.259 5.136 1.00 36.63 ? 105 GLU D CG 1 ATOM 5742 C CD . GLU D 2 105 ? -34.693 7.069 4.606 1.00 44.62 ? 105 GLU D CD 1 ATOM 5743 O OE1 . GLU D 2 105 ? -35.248 8.038 4.047 1.00 53.82 ? 105 GLU D OE1 1 ATOM 5744 O OE2 . GLU D 2 105 ? -35.246 5.959 4.758 1.00 41.33 ? 105 GLU D OE2 1 ATOM 5745 N N . PHE D 2 106 ? -33.502 5.008 9.426 1.00 37.14 ? 106 PHE D N 1 ATOM 5746 C CA . PHE D 2 106 ? -34.395 4.321 10.359 1.00 29.24 ? 106 PHE D CA 1 ATOM 5747 C C . PHE D 2 106 ? -35.227 5.346 11.121 1.00 30.55 ? 106 PHE D C 1 ATOM 5748 O O . PHE D 2 106 ? -34.815 5.876 12.154 1.00 28.70 ? 106 PHE D O 1 ATOM 5749 C CB . PHE D 2 106 ? -33.594 3.441 11.307 1.00 21.90 ? 106 PHE D CB 1 ATOM 5750 C CG . PHE D 2 106 ? -32.606 2.547 10.611 1.00 24.38 ? 106 PHE D CG 1 ATOM 5751 C CD1 . PHE D 2 106 ? -33.037 1.576 9.724 1.00 25.35 ? 106 PHE D CD1 1 ATOM 5752 C CD2 . PHE D 2 106 ? -31.249 2.670 10.856 1.00 23.02 ? 106 PHE D CD2 1 ATOM 5753 C CE1 . PHE D 2 106 ? -32.131 0.749 9.088 1.00 29.65 ? 106 PHE D CE1 1 ATOM 5754 C CE2 . PHE D 2 106 ? -30.338 1.845 10.222 1.00 22.23 ? 106 PHE D CE2 1 ATOM 5755 C CZ . PHE D 2 106 ? -30.780 0.883 9.338 1.00 28.96 ? 106 PHE D CZ 1 ATOM 5756 N N . ALA D 2 107 ? -36.428 5.617 10.608 1.00 26.78 ? 107 ALA D N 1 ATOM 5757 C CA . ALA D 2 107 ? -37.339 6.557 11.243 1.00 22.45 ? 107 ALA D CA 1 ATOM 5758 C C . ALA D 2 107 ? -38.207 5.918 12.317 1.00 22.56 ? 107 ALA D C 1 ATOM 5759 O O . ALA D 2 107 ? -38.780 6.641 13.140 1.00 25.21 ? 107 ALA D O 1 ATOM 5760 C CB . ALA D 2 107 ? -38.243 7.213 10.194 1.00 26.01 ? 107 ALA D CB 1 ATOM 5761 N N . TYR D 2 108 ? -38.321 4.592 12.333 1.00 27.65 ? 108 TYR D N 1 ATOM 5762 C CA . TYR D 2 108 ? -39.169 3.894 13.289 1.00 26.92 ? 108 TYR D CA 1 ATOM 5763 C C . TYR D 2 108 ? -38.372 2.769 13.929 1.00 23.38 ? 108 TYR D C 1 ATOM 5764 O O . TYR D 2 108 ? -37.731 1.983 13.224 1.00 21.74 ? 108 TYR D O 1 ATOM 5765 C CB . TYR D 2 108 ? -40.432 3.354 12.608 1.00 21.07 ? 108 TYR D CB 1 ATOM 5766 C CG . TYR D 2 108 ? -41.242 4.435 11.923 1.00 29.34 ? 108 TYR D CG 1 ATOM 5767 C CD1 . TYR D 2 108 ? -42.112 5.243 12.649 1.00 18.77 ? 108 TYR D CD1 1 ATOM 5768 C CD2 . TYR D 2 108 ? -41.125 4.660 10.556 1.00 33.63 ? 108 TYR D CD2 1 ATOM 5769 C CE1 . TYR D 2 108 ? -42.848 6.237 12.031 1.00 20.09 ? 108 TYR D CE1 1 ATOM 5770 C CE2 . TYR D 2 108 ? -41.857 5.652 9.929 1.00 31.47 ? 108 TYR D CE2 1 ATOM 5771 C CZ . TYR D 2 108 ? -42.716 6.439 10.671 1.00 31.83 ? 108 TYR D CZ 1 ATOM 5772 O OH . TYR D 2 108 ? -43.447 7.429 10.053 1.00 30.49 ? 108 TYR D OH 1 ATOM 5773 N N . TRP D 2 109 ? -38.407 2.700 15.260 1.00 19.69 ? 109 TRP D N 1 ATOM 5774 C CA . TRP D 2 109 ? -37.641 1.718 16.013 1.00 17.18 ? 109 TRP D CA 1 ATOM 5775 C C . TRP D 2 109 ? -38.551 0.927 16.941 1.00 20.71 ? 109 TRP D C 1 ATOM 5776 O O . TRP D 2 109 ? -39.629 1.387 17.327 1.00 28.50 ? 109 TRP D O 1 ATOM 5777 C CB . TRP D 2 109 ? -36.536 2.380 16.847 1.00 15.30 ? 109 TRP D CB 1 ATOM 5778 C CG . TRP D 2 109 ? -35.452 3.017 16.038 1.00 19.66 ? 109 TRP D CG 1 ATOM 5779 C CD1 . TRP D 2 109 ? -35.563 4.120 15.241 1.00 22.02 ? 109 TRP D CD1 1 ATOM 5780 C CD2 . TRP D 2 109 ? -34.081 2.605 15.964 1.00 19.88 ? 109 TRP D CD2 1 ATOM 5781 N NE1 . TRP D 2 109 ? -34.351 4.412 14.665 1.00 23.44 ? 109 TRP D NE1 1 ATOM 5782 C CE2 . TRP D 2 109 ? -33.424 3.498 15.093 1.00 19.07 ? 109 TRP D CE2 1 ATOM 5783 C CE3 . TRP D 2 109 ? -33.347 1.565 16.544 1.00 21.09 ? 109 TRP D CE3 1 ATOM 5784 C CZ2 . TRP D 2 109 ? -32.068 3.382 14.786 1.00 16.48 ? 109 TRP D CZ2 1 ATOM 5785 C CZ3 . TRP D 2 109 ? -32.000 1.451 16.238 1.00 20.97 ? 109 TRP D CZ3 1 ATOM 5786 C CH2 . TRP D 2 109 ? -31.375 2.355 15.368 1.00 27.47 ? 109 TRP D CH2 1 ATOM 5787 N N . GLY D 2 110 ? -38.102 -0.278 17.289 1.00 21.83 ? 110 GLY D N 1 ATOM 5788 C CA . GLY D 2 110 ? -38.699 -1.009 18.383 1.00 18.52 ? 110 GLY D CA 1 ATOM 5789 C C . GLY D 2 110 ? -38.143 -0.542 19.713 1.00 24.99 ? 110 GLY D C 1 ATOM 5790 O O . GLY D 2 110 ? -37.192 0.235 19.781 1.00 30.72 ? 110 GLY D O 1 ATOM 5791 N N . GLN D 2 111 ? -38.751 -1.024 20.797 1.00 25.77 ? 111 GLN D N 1 ATOM 5792 C CA . GLN D 2 111 ? -38.304 -0.591 22.116 1.00 23.87 ? 111 GLN D CA 1 ATOM 5793 C C . GLN D 2 111 ? -37.002 -1.255 22.544 1.00 22.41 ? 111 GLN D C 1 ATOM 5794 O O . GLN D 2 111 ? -36.435 -0.862 23.570 1.00 19.85 ? 111 GLN D O 1 ATOM 5795 C CB . GLN D 2 111 ? -39.391 -0.844 23.169 1.00 14.13 ? 111 GLN D CB 1 ATOM 5796 C CG . GLN D 2 111 ? -39.362 -2.221 23.818 1.00 14.12 ? 111 GLN D CG 1 ATOM 5797 C CD . GLN D 2 111 ? -40.113 -3.266 23.018 1.00 26.65 ? 111 GLN D CD 1 ATOM 5798 O OE1 . GLN D 2 111 ? -40.274 -3.142 21.805 1.00 24.34 ? 111 GLN D OE1 1 ATOM 5799 N NE2 . GLN D 2 111 ? -40.586 -4.303 23.700 1.00 36.97 ? 111 GLN D NE2 1 ATOM 5800 N N . GLY D 2 112 ? -36.511 -2.227 21.789 1.00 19.50 ? 112 GLY D N 1 ATOM 5801 C CA . GLY D 2 112 ? -35.236 -2.853 22.107 1.00 22.05 ? 112 GLY D CA 1 ATOM 5802 C C . GLY D 2 112 ? -35.383 -4.018 23.063 1.00 24.93 ? 112 GLY D C 1 ATOM 5803 O O . GLY D 2 112 ? -36.318 -4.101 23.859 1.00 34.65 ? 112 GLY D O 1 ATOM 5804 N N . THR D 2 113 ? -34.431 -4.944 22.978 1.00 21.47 ? 113 THR D N 1 ATOM 5805 C CA . THR D 2 113 ? -34.394 -6.116 23.844 1.00 15.56 ? 113 THR D CA 1 ATOM 5806 C C . THR D 2 113 ? -33.004 -6.230 24.449 1.00 16.84 ? 113 THR D C 1 ATOM 5807 O O . THR D 2 113 ? -32.019 -6.387 23.721 1.00 23.34 ? 113 THR D O 1 ATOM 5808 C CB . THR D 2 113 ? -34.750 -7.389 23.073 1.00 19.08 ? 113 THR D CB 1 ATOM 5809 O OG1 . THR D 2 113 ? -36.106 -7.309 22.615 1.00 31.62 ? 113 THR D OG1 1 ATOM 5810 C CG2 . THR D 2 113 ? -34.592 -8.610 23.962 1.00 17.30 ? 113 THR D CG2 1 ATOM 5811 N N . LEU D 2 114 ? -32.925 -6.145 25.774 1.00 18.46 ? 114 LEU D N 1 ATOM 5812 C CA . LEU D 2 114 ? -31.651 -6.273 26.470 1.00 20.95 ? 114 LEU D CA 1 ATOM 5813 C C . LEU D 2 114 ? -31.298 -7.749 26.604 1.00 26.75 ? 114 LEU D C 1 ATOM 5814 O O . LEU D 2 114 ? -32.030 -8.515 27.240 1.00 36.74 ? 114 LEU D O 1 ATOM 5815 C CB . LEU D 2 114 ? -31.718 -5.598 27.839 1.00 25.65 ? 114 LEU D CB 1 ATOM 5816 C CG . LEU D 2 114 ? -30.481 -5.712 28.735 1.00 25.35 ? 114 LEU D CG 1 ATOM 5817 C CD1 . LEU D 2 114 ? -29.214 -5.409 27.959 1.00 32.13 ? 114 LEU D CD1 1 ATOM 5818 C CD2 . LEU D 2 114 ? -30.611 -4.778 29.923 1.00 23.16 ? 114 LEU D CD2 1 ATOM 5819 N N . VAL D 2 115 ? -30.180 -8.145 26.005 1.00 27.33 ? 115 VAL D N 1 ATOM 5820 C CA . VAL D 2 115 ? -29.746 -9.536 25.969 1.00 31.02 ? 115 VAL D CA 1 ATOM 5821 C C . VAL D 2 115 ? -28.460 -9.655 26.771 1.00 32.07 ? 115 VAL D C 1 ATOM 5822 O O . VAL D 2 115 ? -27.466 -8.980 26.473 1.00 30.47 ? 115 VAL D O 1 ATOM 5823 C CB . VAL D 2 115 ? -29.545 -10.026 24.527 1.00 32.89 ? 115 VAL D CB 1 ATOM 5824 C CG1 . VAL D 2 115 ? -28.821 -11.360 24.515 1.00 42.13 ? 115 VAL D CG1 1 ATOM 5825 C CG2 . VAL D 2 115 ? -30.884 -10.133 23.818 1.00 33.74 ? 115 VAL D CG2 1 ATOM 5826 N N . THR D 2 116 ? -28.476 -10.514 27.784 1.00 25.66 ? 116 THR D N 1 ATOM 5827 C CA . THR D 2 116 ? -27.311 -10.770 28.619 1.00 16.93 ? 116 THR D CA 1 ATOM 5828 C C . THR D 2 116 ? -26.792 -12.171 28.329 1.00 22.65 ? 116 THR D C 1 ATOM 5829 O O . THR D 2 116 ? -27.546 -13.147 28.411 1.00 24.13 ? 116 THR D O 1 ATOM 5830 C CB . THR D 2 116 ? -27.653 -10.625 30.101 1.00 28.41 ? 116 THR D CB 1 ATOM 5831 O OG1 . THR D 2 116 ? -28.089 -9.286 30.361 1.00 28.06 ? 116 THR D OG1 1 ATOM 5832 C CG2 . THR D 2 116 ? -26.434 -10.934 30.961 1.00 25.39 ? 116 THR D CG2 1 ATOM 5833 N N . VAL D 2 117 ? -25.513 -12.263 27.981 1.00 19.27 ? 117 VAL D N 1 ATOM 5834 C CA . VAL D 2 117 ? -24.837 -13.539 27.785 1.00 22.87 ? 117 VAL D CA 1 ATOM 5835 C C . VAL D 2 117 ? -24.045 -13.843 29.047 1.00 28.83 ? 117 VAL D C 1 ATOM 5836 O O . VAL D 2 117 ? -23.104 -13.117 29.391 1.00 28.56 ? 117 VAL D O 1 ATOM 5837 C CB . VAL D 2 117 ? -23.925 -13.514 26.550 1.00 32.12 ? 117 VAL D CB 1 ATOM 5838 C CG1 . VAL D 2 117 ? -23.194 -14.840 26.413 1.00 24.19 ? 117 VAL D CG1 1 ATOM 5839 C CG2 . VAL D 2 117 ? -24.741 -13.220 25.302 1.00 41.03 ? 117 VAL D CG2 1 ATOM 5840 N N . SER D 2 118 ? -24.430 -14.910 29.742 1.00 30.56 ? 118 SER D N 1 ATOM 5841 C CA . SER D 2 118 ? -23.828 -15.251 31.022 1.00 28.92 ? 118 SER D CA 1 ATOM 5842 C C . SER D 2 118 ? -24.167 -16.694 31.356 1.00 33.93 ? 118 SER D C 1 ATOM 5843 O O . SER D 2 118 ? -25.182 -17.229 30.900 1.00 31.85 ? 118 SER D O 1 ATOM 5844 C CB . SER D 2 118 ? -24.316 -14.316 32.139 1.00 34.43 ? 118 SER D CB 1 ATOM 5845 O OG . SER D 2 118 ? -23.664 -14.600 33.364 1.00 37.72 ? 118 SER D OG 1 ATOM 5846 N N . ALA D 2 119 ? -23.307 -17.312 32.159 1.00 34.69 ? 119 ALA D N 1 ATOM 5847 C CA . ALA D 2 119 ? -23.530 -18.673 32.621 1.00 32.70 ? 119 ALA D CA 1 ATOM 5848 C C . ALA D 2 119 ? -24.327 -18.737 33.918 1.00 38.03 ? 119 ALA D C 1 ATOM 5849 O O . ALA D 2 119 ? -24.637 -19.837 34.386 1.00 36.75 ? 119 ALA D O 1 ATOM 5850 C CB . ALA D 2 119 ? -22.188 -19.391 32.798 1.00 31.05 ? 119 ALA D CB 1 ATOM 5851 N N . ALA D 2 120 ? -24.674 -17.592 34.500 1.00 42.71 ? 120 ALA D N 1 ATOM 5852 C CA . ALA D 2 120 ? -25.390 -17.566 35.765 1.00 46.23 ? 120 ALA D CA 1 ATOM 5853 C C . ALA D 2 120 ? -26.861 -17.932 35.562 1.00 38.04 ? 120 ALA D C 1 ATOM 5854 O O . ALA D 2 120 ? -27.321 -18.211 34.452 1.00 34.08 ? 120 ALA D O 1 ATOM 5855 C CB . ALA D 2 120 ? -25.259 -16.193 36.420 1.00 54.57 ? 120 ALA D CB 1 ATOM 5856 N N . SER D 2 121 ? -27.603 -17.925 36.663 1.00 38.50 ? 121 SER D N 1 ATOM 5857 C CA . SER D 2 121 ? -29.014 -18.270 36.677 1.00 37.01 ? 121 SER D CA 1 ATOM 5858 C C . SER D 2 121 ? -29.870 -17.013 36.756 1.00 29.50 ? 121 SER D C 1 ATOM 5859 O O . SER D 2 121 ? -29.434 -15.963 37.235 1.00 21.51 ? 121 SER D O 1 ATOM 5860 C CB . SER D 2 121 ? -29.336 -19.189 37.860 1.00 41.64 ? 121 SER D CB 1 ATOM 5861 O OG . SER D 2 121 ? -28.566 -20.376 37.815 1.00 53.94 ? 121 SER D OG 1 ATOM 5862 N N . THR D 2 122 ? -31.106 -17.136 36.276 1.00 35.57 ? 122 THR D N 1 ATOM 5863 C CA . THR D 2 122 ? -32.080 -16.062 36.402 1.00 30.09 ? 122 THR D CA 1 ATOM 5864 C C . THR D 2 122 ? -32.662 -16.064 37.809 1.00 23.49 ? 122 THR D C 1 ATOM 5865 O O . THR D 2 122 ? -33.071 -17.111 38.317 1.00 25.66 ? 122 THR D O 1 ATOM 5866 C CB . THR D 2 122 ? -33.196 -16.220 35.369 1.00 28.76 ? 122 THR D CB 1 ATOM 5867 O OG1 . THR D 2 122 ? -32.659 -16.039 34.054 1.00 32.63 ? 122 THR D OG1 1 ATOM 5868 C CG2 . THR D 2 122 ? -34.294 -15.194 35.608 1.00 26.46 ? 122 THR D CG2 1 ATOM 5869 N N . LYS D 2 123 ? -32.690 -14.892 38.440 1.00 23.99 ? 123 LYS D N 1 ATOM 5870 C CA . LYS D 2 123 ? -33.224 -14.755 39.789 1.00 24.29 ? 123 LYS D CA 1 ATOM 5871 C C . LYS D 2 123 ? -34.029 -13.469 39.892 1.00 22.95 ? 123 LYS D C 1 ATOM 5872 O O . LYS D 2 123 ? -33.554 -12.402 39.493 1.00 21.64 ? 123 LYS D O 1 ATOM 5873 C CB . LYS D 2 123 ? -32.102 -14.763 40.835 1.00 17.74 ? 123 LYS D CB 1 ATOM 5874 C CG . LYS D 2 123 ? -32.546 -14.304 42.211 1.00 32.83 ? 123 LYS D CG 1 ATOM 5875 C CD . LYS D 2 123 ? -31.491 -14.590 43.267 1.00 38.67 ? 123 LYS D CD 1 ATOM 5876 C CE . LYS D 2 123 ? -31.740 -13.769 44.522 1.00 38.60 ? 123 LYS D CE 1 ATOM 5877 N NZ . LYS D 2 123 ? -33.185 -13.700 44.870 1.00 40.87 ? 123 LYS D NZ 1 ATOM 5878 N N . GLY D 2 124 ? -35.245 -13.578 40.419 1.00 24.79 ? 124 GLY D N 1 ATOM 5879 C CA . GLY D 2 124 ? -36.084 -12.429 40.649 1.00 16.47 ? 124 GLY D CA 1 ATOM 5880 C C . GLY D 2 124 ? -35.648 -11.659 41.878 1.00 15.97 ? 124 GLY D C 1 ATOM 5881 O O . GLY D 2 124 ? -34.954 -12.184 42.755 1.00 35.30 ? 124 GLY D O 1 ATOM 5882 N N . PRO D 2 125 ? -36.046 -10.397 41.966 1.00 15.34 ? 125 PRO D N 1 ATOM 5883 C CA . PRO D 2 125 ? -35.589 -9.540 43.060 1.00 26.90 ? 125 PRO D CA 1 ATOM 5884 C C . PRO D 2 125 ? -36.501 -9.605 44.281 1.00 25.58 ? 125 PRO D C 1 ATOM 5885 O O . PRO D 2 125 ? -37.625 -10.108 44.235 1.00 17.00 ? 125 PRO D O 1 ATOM 5886 C CB . PRO D 2 125 ? -35.641 -8.144 42.433 1.00 19.14 ? 125 PRO D CB 1 ATOM 5887 C CG . PRO D 2 125 ? -36.817 -8.227 41.514 1.00 20.41 ? 125 PRO D CG 1 ATOM 5888 C CD . PRO D 2 125 ? -36.829 -9.645 40.971 1.00 15.07 ? 125 PRO D CD 1 ATOM 5889 N N . SER D 2 126 ? -35.982 -9.079 45.383 1.00 27.80 ? 126 SER D N 1 ATOM 5890 C CA . SER D 2 126 ? -36.781 -8.750 46.552 1.00 31.85 ? 126 SER D CA 1 ATOM 5891 C C . SER D 2 126 ? -36.994 -7.243 46.586 1.00 24.81 ? 126 SER D C 1 ATOM 5892 O O . SER D 2 126 ? -36.123 -6.468 46.183 1.00 28.30 ? 126 SER D O 1 ATOM 5893 C CB . SER D 2 126 ? -36.105 -9.219 47.843 1.00 15.42 ? 126 SER D CB 1 ATOM 5894 O OG . SER D 2 126 ? -35.848 -10.613 47.808 1.00 16.37 ? 126 SER D OG 1 ATOM 5895 N N . VAL D 2 127 ? -38.168 -6.831 47.054 1.00 20.38 ? 127 VAL D N 1 ATOM 5896 C CA . VAL D 2 127 ? -38.551 -5.425 47.079 1.00 20.12 ? 127 VAL D CA 1 ATOM 5897 C C . VAL D 2 127 ? -38.813 -5.027 48.524 1.00 22.71 ? 127 VAL D C 1 ATOM 5898 O O . VAL D 2 127 ? -39.687 -5.603 49.185 1.00 26.61 ? 127 VAL D O 1 ATOM 5899 C CB . VAL D 2 127 ? -39.780 -5.150 46.199 1.00 15.12 ? 127 VAL D CB 1 ATOM 5900 C CG1 . VAL D 2 127 ? -40.138 -3.672 46.239 1.00 19.36 ? 127 VAL D CG1 1 ATOM 5901 C CG2 . VAL D 2 127 ? -39.515 -5.596 44.773 1.00 14.87 ? 127 VAL D CG2 1 ATOM 5902 N N . PHE D 2 128 ? -38.062 -4.042 49.009 1.00 24.83 ? 128 PHE D N 1 ATOM 5903 C CA . PHE D 2 128 ? -38.168 -3.560 50.373 1.00 26.36 ? 128 PHE D CA 1 ATOM 5904 C C . PHE D 2 128 ? -38.526 -2.080 50.380 1.00 26.58 ? 128 PHE D C 1 ATOM 5905 O O . PHE D 2 128 ? -38.214 -1.359 49.428 1.00 14.80 ? 128 PHE D O 1 ATOM 5906 C CB . PHE D 2 128 ? -36.856 -3.775 51.137 1.00 14.77 ? 128 PHE D CB 1 ATOM 5907 C CG . PHE D 2 128 ? -36.379 -5.196 51.125 1.00 14.82 ? 128 PHE D CG 1 ATOM 5908 C CD1 . PHE D 2 128 ? -37.103 -6.187 51.763 1.00 15.43 ? 128 PHE D CD1 1 ATOM 5909 C CD2 . PHE D 2 128 ? -35.208 -5.543 50.476 1.00 14.41 ? 128 PHE D CD2 1 ATOM 5910 C CE1 . PHE D 2 128 ? -36.669 -7.500 51.753 1.00 15.65 ? 128 PHE D CE1 1 ATOM 5911 C CE2 . PHE D 2 128 ? -34.767 -6.855 50.464 1.00 16.97 ? 128 PHE D CE2 1 ATOM 5912 C CZ . PHE D 2 128 ? -35.499 -7.833 51.104 1.00 15.27 ? 128 PHE D CZ 1 ATOM 5913 N N . PRO D 2 129 ? -39.188 -1.600 51.431 1.00 26.64 ? 129 PRO D N 1 ATOM 5914 C CA . PRO D 2 129 ? -39.575 -0.186 51.471 1.00 17.89 ? 129 PRO D CA 1 ATOM 5915 C C . PRO D 2 129 ? -38.428 0.707 51.916 1.00 15.68 ? 129 PRO D C 1 ATOM 5916 O O . PRO D 2 129 ? -37.619 0.340 52.772 1.00 20.23 ? 129 PRO D O 1 ATOM 5917 C CB . PRO D 2 129 ? -40.713 -0.170 52.498 1.00 16.83 ? 129 PRO D CB 1 ATOM 5918 C CG . PRO D 2 129 ? -40.358 -1.279 53.430 1.00 16.82 ? 129 PRO D CG 1 ATOM 5919 C CD . PRO D 2 129 ? -39.733 -2.352 52.576 1.00 16.24 ? 129 PRO D CD 1 ATOM 5920 N N . LEU D 2 130 ? -38.360 1.888 51.313 1.00 15.72 ? 130 LEU D N 1 ATOM 5921 C CA . LEU D 2 130 ? -37.490 2.971 51.768 1.00 25.71 ? 130 LEU D CA 1 ATOM 5922 C C . LEU D 2 130 ? -38.414 4.000 52.413 1.00 27.67 ? 130 LEU D C 1 ATOM 5923 O O . LEU D 2 130 ? -38.910 4.913 51.752 1.00 17.03 ? 130 LEU D O 1 ATOM 5924 C CB . LEU D 2 130 ? -36.680 3.567 50.617 1.00 21.83 ? 130 LEU D CB 1 ATOM 5925 C CG . LEU D 2 130 ? -35.639 2.659 49.958 1.00 19.64 ? 130 LEU D CG 1 ATOM 5926 C CD1 . LEU D 2 130 ? -35.048 3.331 48.731 1.00 16.69 ? 130 LEU D CD1 1 ATOM 5927 C CD2 . LEU D 2 130 ? -34.544 2.298 50.948 1.00 22.71 ? 130 LEU D CD2 1 ATOM 5928 N N . ALA D 2 131 ? -38.650 3.840 53.709 1.00 24.60 ? 131 ALA D N 1 ATOM 5929 C CA . ALA D 2 131 ? -39.696 4.600 54.368 1.00 27.01 ? 131 ALA D CA 1 ATOM 5930 C C . ALA D 2 131 ? -39.122 5.679 55.280 1.00 36.34 ? 131 ALA D C 1 ATOM 5931 O O . ALA D 2 131 ? -38.164 5.422 56.016 1.00 35.79 ? 131 ALA D O 1 ATOM 5932 C CB . ALA D 2 131 ? -40.593 3.671 55.192 1.00 29.33 ? 131 ALA D CB 1 ATOM 5933 N N . PRO D 2 132 ? -39.687 6.879 55.261 1.00 39.90 ? 132 PRO D N 1 ATOM 5934 C CA . PRO D 2 132 ? -39.257 7.932 56.182 1.00 43.23 ? 132 PRO D CA 1 ATOM 5935 C C . PRO D 2 132 ? -39.836 7.734 57.578 1.00 58.37 ? 132 PRO D C 1 ATOM 5936 O O . PRO D 2 132 ? -40.831 7.038 57.782 1.00 67.22 ? 132 PRO D O 1 ATOM 5937 C CB . PRO D 2 132 ? -39.820 9.202 55.541 1.00 41.66 ? 132 PRO D CB 1 ATOM 5938 C CG . PRO D 2 132 ? -41.050 8.728 54.833 1.00 39.42 ? 132 PRO D CG 1 ATOM 5939 C CD . PRO D 2 132 ? -40.750 7.337 54.349 1.00 35.64 ? 132 PRO D CD 1 ATOM 5940 N N . SER D 2 133 ? -39.199 8.387 58.543 1.00 64.03 ? 133 SER D N 1 ATOM 5941 C CA . SER D 2 133 ? -39.644 8.295 59.935 1.00 61.05 ? 133 SER D CA 1 ATOM 5942 C C . SER D 2 133 ? -40.733 9.330 60.260 1.00 59.33 ? 133 SER D C 1 ATOM 5943 O O . SER D 2 133 ? -40.532 10.541 60.093 1.00 59.72 ? 133 SER D O 1 ATOM 5944 C CB . SER D 2 133 ? -38.454 8.465 60.891 1.00 53.76 ? 133 SER D CB 1 ATOM 5945 O OG . SER D 2 133 ? -37.706 9.625 60.564 1.00 48.50 ? 133 SER D OG 1 ATOM 5946 N N . GLY D 2 140 ? -41.391 20.464 54.456 1.00 35.97 ? 140 GLY D N 1 ATOM 5947 C CA . GLY D 2 140 ? -42.418 19.453 54.629 1.00 36.71 ? 140 GLY D CA 1 ATOM 5948 C C . GLY D 2 140 ? -42.476 18.486 53.465 1.00 39.68 ? 140 GLY D C 1 ATOM 5949 O O . GLY D 2 140 ? -43.537 17.955 53.141 1.00 38.19 ? 140 GLY D O 1 ATOM 5950 N N . THR D 2 141 ? -41.330 18.269 52.825 1.00 21.28 ? 141 THR D N 1 ATOM 5951 C CA . THR D 2 141 ? -41.207 17.299 51.746 1.00 18.91 ? 141 THR D CA 1 ATOM 5952 C C . THR D 2 141 ? -40.642 16.000 52.299 1.00 23.87 ? 141 THR D C 1 ATOM 5953 O O . THR D 2 141 ? -39.617 16.005 52.988 1.00 33.53 ? 141 THR D O 1 ATOM 5954 C CB . THR D 2 141 ? -40.308 17.820 50.625 1.00 18.81 ? 141 THR D CB 1 ATOM 5955 O OG1 . THR D 2 141 ? -40.931 18.945 49.997 1.00 14.08 ? 141 THR D OG1 1 ATOM 5956 C CG2 . THR D 2 141 ? -40.071 16.733 49.588 1.00 13.34 ? 141 THR D CG2 1 ATOM 5957 N N . ALA D 2 142 ? -41.316 14.894 52.003 1.00 23.57 ? 142 ALA D N 1 ATOM 5958 C CA . ALA D 2 142 ? -40.888 13.575 52.439 1.00 26.60 ? 142 ALA D CA 1 ATOM 5959 C C . ALA D 2 142 ? -40.381 12.775 51.249 1.00 28.52 ? 142 ALA D C 1 ATOM 5960 O O . ALA D 2 142 ? -40.888 12.911 50.130 1.00 27.55 ? 142 ALA D O 1 ATOM 5961 C CB . ALA D 2 142 ? -42.030 12.822 53.124 1.00 26.59 ? 142 ALA D CB 1 ATOM 5962 N N . ALA D 2 143 ? -39.375 11.947 51.497 1.00 19.18 ? 143 ALA D N 1 ATOM 5963 C CA . ALA D 2 143 ? -38.823 11.060 50.487 1.00 18.93 ? 143 ALA D CA 1 ATOM 5964 C C . ALA D 2 143 ? -39.124 9.623 50.878 1.00 23.45 ? 143 ALA D C 1 ATOM 5965 O O . ALA D 2 143 ? -38.940 9.237 52.037 1.00 21.21 ? 143 ALA D O 1 ATOM 5966 C CB . ALA D 2 143 ? -37.317 11.264 50.331 1.00 19.38 ? 143 ALA D CB 1 ATOM 5967 N N . LEU D 2 144 ? -39.608 8.846 49.915 1.00 20.12 ? 144 LEU D N 1 ATOM 5968 C CA . LEU D 2 144 ? -39.830 7.423 50.105 1.00 18.90 ? 144 LEU D CA 1 ATOM 5969 C C . LEU D 2 144 ? -39.466 6.711 48.814 1.00 16.84 ? 144 LEU D C 1 ATOM 5970 O O . LEU D 2 144 ? -39.358 7.330 47.753 1.00 14.84 ? 144 LEU D O 1 ATOM 5971 C CB . LEU D 2 144 ? -41.278 7.121 50.521 1.00 21.96 ? 144 LEU D CB 1 ATOM 5972 C CG . LEU D 2 144 ? -42.422 7.694 49.681 1.00 22.30 ? 144 LEU D CG 1 ATOM 5973 C CD1 . LEU D 2 144 ? -42.762 6.800 48.497 1.00 27.09 ? 144 LEU D CD1 1 ATOM 5974 C CD2 . LEU D 2 144 ? -43.646 7.913 50.550 1.00 12.99 ? 144 LEU D CD2 1 ATOM 5975 N N . GLY D 2 145 ? -39.273 5.402 48.913 1.00 13.86 ? 145 GLY D N 1 ATOM 5976 C CA . GLY D 2 145 ? -38.881 4.657 47.738 1.00 16.82 ? 145 GLY D CA 1 ATOM 5977 C C . GLY D 2 145 ? -38.901 3.165 47.973 1.00 11.75 ? 145 GLY D C 1 ATOM 5978 O O . GLY D 2 145 ? -39.338 2.683 49.020 1.00 15.71 ? 145 GLY D O 1 ATOM 5979 N N . CYS D 2 146 ? -38.415 2.439 46.968 1.00 17.44 ? 146 CYS D N 1 ATOM 5980 C CA . CYS D 2 146 ? -38.370 0.984 46.974 1.00 20.49 ? 146 CYS D CA 1 ATOM 5981 C C . CYS D 2 146 ? -36.965 0.514 46.638 1.00 23.06 ? 146 CYS D C 1 ATOM 5982 O O . CYS D 2 146 ? -36.320 1.043 45.728 1.00 19.63 ? 146 CYS D O 1 ATOM 5983 C CB . CYS D 2 146 ? -39.366 0.379 45.973 1.00 20.52 ? 146 CYS D CB 1 ATOM 5984 S SG . CYS D 2 146 ? -41.075 0.318 46.541 1.00 29.60 ? 146 CYS D SG 1 ATOM 5985 N N . LEU D 2 147 ? -36.497 -0.485 47.378 1.00 24.14 ? 147 LEU D N 1 ATOM 5986 C CA . LEU D 2 147 ? -35.210 -1.118 47.125 1.00 22.27 ? 147 LEU D CA 1 ATOM 5987 C C . LEU D 2 147 ? -35.462 -2.419 46.371 1.00 21.07 ? 147 LEU D C 1 ATOM 5988 O O . LEU D 2 147 ? -36.086 -3.342 46.906 1.00 20.15 ? 147 LEU D O 1 ATOM 5989 C CB . LEU D 2 147 ? -34.464 -1.368 48.433 1.00 23.53 ? 147 LEU D CB 1 ATOM 5990 C CG . LEU D 2 147 ? -33.123 -2.092 48.324 1.00 23.63 ? 147 LEU D CG 1 ATOM 5991 C CD1 . LEU D 2 147 ? -32.120 -1.253 47.545 1.00 12.34 ? 147 LEU D CD1 1 ATOM 5992 C CD2 . LEU D 2 147 ? -32.594 -2.435 49.706 1.00 25.05 ? 147 LEU D CD2 1 ATOM 5993 N N . VAL D 2 148 ? -35.000 -2.480 45.125 1.00 18.83 ? 148 VAL D N 1 ATOM 5994 C CA . VAL D 2 148 ? -35.137 -3.662 44.281 1.00 18.45 ? 148 VAL D CA 1 ATOM 5995 C C . VAL D 2 148 ? -33.783 -4.361 44.299 1.00 19.78 ? 148 VAL D C 1 ATOM 5996 O O . VAL D 2 148 ? -32.838 -3.928 43.633 1.00 27.51 ? 148 VAL D O 1 ATOM 5997 C CB . VAL D 2 148 ? -35.575 -3.296 42.860 1.00 17.51 ? 148 VAL D CB 1 ATOM 5998 C CG1 . VAL D 2 148 ? -35.781 -4.548 42.027 1.00 12.22 ? 148 VAL D CG1 1 ATOM 5999 C CG2 . VAL D 2 148 ? -36.843 -2.457 42.893 1.00 11.87 ? 148 VAL D CG2 1 ATOM 6000 N N . LYS D 2 149 ? -33.683 -5.450 45.057 1.00 24.49 ? 149 LYS D N 1 ATOM 6001 C CA . LYS D 2 149 ? -32.396 -6.010 45.446 1.00 20.11 ? 149 LYS D CA 1 ATOM 6002 C C . LYS D 2 149 ? -32.265 -7.470 45.029 1.00 13.21 ? 149 LYS D C 1 ATOM 6003 O O . LYS D 2 149 ? -33.218 -8.249 45.143 1.00 13.39 ? 149 LYS D O 1 ATOM 6004 C CB . LYS D 2 149 ? -32.200 -5.878 46.961 1.00 14.99 ? 149 LYS D CB 1 ATOM 6005 C CG . LYS D 2 149 ? -30.900 -6.449 47.486 1.00 23.94 ? 149 LYS D CG 1 ATOM 6006 C CD . LYS D 2 149 ? -30.601 -5.912 48.871 1.00 26.18 ? 149 LYS D CD 1 ATOM 6007 C CE . LYS D 2 149 ? -29.497 -6.705 49.542 1.00 27.03 ? 149 LYS D CE 1 ATOM 6008 N NZ . LYS D 2 149 ? -28.313 -6.860 48.662 1.00 29.77 ? 149 LYS D NZ 1 ATOM 6009 N N . ASP D 2 150 ? -31.071 -7.822 44.544 1.00 20.62 ? 150 ASP D N 1 ATOM 6010 C CA . ASP D 2 150 ? -30.666 -9.197 44.260 1.00 25.10 ? 150 ASP D CA 1 ATOM 6011 C C . ASP D 2 150 ? -31.457 -9.818 43.114 1.00 30.32 ? 150 ASP D C 1 ATOM 6012 O O . ASP D 2 150 ? -32.243 -10.746 43.331 1.00 33.75 ? 150 ASP D O 1 ATOM 6013 C CB . ASP D 2 150 ? -30.796 -10.066 45.516 1.00 20.89 ? 150 ASP D CB 1 ATOM 6014 C CG . ASP D 2 150 ? -29.820 -9.671 46.606 1.00 24.29 ? 150 ASP D CG 1 ATOM 6015 O OD1 . ASP D 2 150 ? -28.717 -9.185 46.277 1.00 23.18 ? 150 ASP D OD1 1 ATOM 6016 O OD2 . ASP D 2 150 ? -30.156 -9.849 47.796 1.00 28.03 ? 150 ASP D OD2 1 ATOM 6017 N N . TYR D 2 151 ? -31.244 -9.332 41.892 1.00 14.92 ? 151 TYR D N 1 ATOM 6018 C CA . TYR D 2 151 ? -31.868 -9.922 40.717 1.00 15.21 ? 151 TYR D CA 1 ATOM 6019 C C . TYR D 2 151 ? -30.845 -10.054 39.600 1.00 23.66 ? 151 TYR D C 1 ATOM 6020 O O . TYR D 2 151 ? -29.837 -9.345 39.560 1.00 33.38 ? 151 TYR D O 1 ATOM 6021 C CB . TYR D 2 151 ? -33.070 -9.103 40.221 1.00 13.42 ? 151 TYR D CB 1 ATOM 6022 C CG . TYR D 2 151 ? -32.722 -7.720 39.718 1.00 13.03 ? 151 TYR D CG 1 ATOM 6023 C CD1 . TYR D 2 151 ? -32.630 -6.647 40.592 1.00 12.70 ? 151 TYR D CD1 1 ATOM 6024 C CD2 . TYR D 2 151 ? -32.499 -7.485 38.369 1.00 21.10 ? 151 TYR D CD2 1 ATOM 6025 C CE1 . TYR D 2 151 ? -32.318 -5.382 40.140 1.00 12.42 ? 151 TYR D CE1 1 ATOM 6026 C CE2 . TYR D 2 151 ? -32.187 -6.222 37.907 1.00 22.16 ? 151 TYR D CE2 1 ATOM 6027 C CZ . TYR D 2 151 ? -32.098 -5.174 38.799 1.00 19.76 ? 151 TYR D CZ 1 ATOM 6028 O OH . TYR D 2 151 ? -31.789 -3.912 38.349 1.00 13.89 ? 151 TYR D OH 1 ATOM 6029 N N . PHE D 2 152 ? -31.131 -10.974 38.685 1.00 14.19 ? 152 PHE D N 1 ATOM 6030 C CA . PHE D 2 152 ? -30.294 -11.200 37.517 1.00 21.37 ? 152 PHE D CA 1 ATOM 6031 C C . PHE D 2 152 ? -31.102 -11.916 36.435 1.00 24.77 ? 152 PHE D C 1 ATOM 6032 O O . PHE D 2 152 ? -31.840 -12.854 36.730 1.00 30.43 ? 152 PHE D O 1 ATOM 6033 C CB . PHE D 2 152 ? -29.055 -12.017 37.890 1.00 21.34 ? 152 PHE D CB 1 ATOM 6034 C CG . PHE D 2 152 ? -27.967 -11.967 36.860 1.00 15.16 ? 152 PHE D CG 1 ATOM 6035 C CD1 . PHE D 2 152 ? -27.952 -12.861 35.801 1.00 16.74 ? 152 PHE D CD1 1 ATOM 6036 C CD2 . PHE D 2 152 ? -26.962 -11.019 36.944 1.00 14.85 ? 152 PHE D CD2 1 ATOM 6037 C CE1 . PHE D 2 152 ? -26.952 -12.811 34.848 1.00 19.86 ? 152 PHE D CE1 1 ATOM 6038 C CE2 . PHE D 2 152 ? -25.959 -10.964 35.995 1.00 20.24 ? 152 PHE D CE2 1 ATOM 6039 C CZ . PHE D 2 152 ? -25.953 -11.861 34.945 1.00 16.79 ? 152 PHE D CZ 1 ATOM 6040 N N . PRO D 2 153 ? -30.970 -11.472 35.178 1.00 22.77 ? 153 PRO D N 1 ATOM 6041 C CA . PRO D 2 153 ? -30.152 -10.327 34.786 1.00 20.95 ? 153 PRO D CA 1 ATOM 6042 C C . PRO D 2 153 ? -30.973 -9.057 34.713 1.00 23.80 ? 153 PRO D C 1 ATOM 6043 O O . PRO D 2 153 ? -32.117 -9.020 35.164 1.00 28.90 ? 153 PRO D O 1 ATOM 6044 C CB . PRO D 2 153 ? -29.665 -10.725 33.400 1.00 22.25 ? 153 PRO D CB 1 ATOM 6045 C CG . PRO D 2 153 ? -30.859 -11.440 32.827 1.00 19.42 ? 153 PRO D CG 1 ATOM 6046 C CD . PRO D 2 153 ? -31.540 -12.146 33.997 1.00 15.38 ? 153 PRO D CD 1 ATOM 6047 N N . GLU D 2 154 ? -30.388 -8.024 34.129 1.00 21.77 ? 154 GLU D N 1 ATOM 6048 C CA . GLU D 2 154 ? -31.122 -6.803 33.866 1.00 23.21 ? 154 GLU D CA 1 ATOM 6049 C C . GLU D 2 154 ? -32.053 -7.050 32.684 1.00 19.57 ? 154 GLU D C 1 ATOM 6050 O O . GLU D 2 154 ? -31.895 -8.043 31.975 1.00 31.31 ? 154 GLU D O 1 ATOM 6051 C CB . GLU D 2 154 ? -30.149 -5.652 33.607 1.00 20.78 ? 154 GLU D CB 1 ATOM 6052 C CG . GLU D 2 154 ? -29.573 -5.060 34.879 1.00 29.31 ? 154 GLU D CG 1 ATOM 6053 C CD . GLU D 2 154 ? -29.611 -3.550 34.859 1.00 44.28 ? 154 GLU D CD 1 ATOM 6054 O OE1 . GLU D 2 154 ? -28.758 -2.944 34.187 1.00 44.79 ? 154 GLU D OE1 1 ATOM 6055 O OE2 . GLU D 2 154 ? -30.531 -2.970 35.479 1.00 48.10 ? 154 GLU D OE2 1 ATOM 6056 N N . PRO D 2 155 ? -33.053 -6.177 32.480 1.00 18.32 ? 155 PRO D N 1 ATOM 6057 C CA . PRO D 2 155 ? -33.440 -5.020 33.285 1.00 18.58 ? 155 PRO D CA 1 ATOM 6058 C C . PRO D 2 155 ? -34.640 -5.291 34.177 1.00 24.88 ? 155 PRO D C 1 ATOM 6059 O O . PRO D 2 155 ? -35.261 -6.350 34.090 1.00 27.79 ? 155 PRO D O 1 ATOM 6060 C CB . PRO D 2 155 ? -33.799 -3.989 32.223 1.00 15.99 ? 155 PRO D CB 1 ATOM 6061 C CG . PRO D 2 155 ? -34.466 -4.828 31.171 1.00 14.47 ? 155 PRO D CG 1 ATOM 6062 C CD . PRO D 2 155 ? -33.793 -6.195 31.206 1.00 23.25 ? 155 PRO D CD 1 ATOM 6063 N N . VAL D 2 156 ? -34.960 -4.324 35.027 1.00 22.44 ? 156 VAL D N 1 ATOM 6064 C CA . VAL D 2 156 ? -36.202 -4.313 35.784 1.00 22.64 ? 156 VAL D CA 1 ATOM 6065 C C . VAL D 2 156 ? -36.828 -2.939 35.598 1.00 20.45 ? 156 VAL D C 1 ATOM 6066 O O . VAL D 2 156 ? -36.119 -1.927 35.545 1.00 28.30 ? 156 VAL D O 1 ATOM 6067 C CB . VAL D 2 156 ? -35.970 -4.643 37.278 1.00 23.86 ? 156 VAL D CB 1 ATOM 6068 C CG1 . VAL D 2 156 ? -35.148 -3.564 37.962 1.00 19.51 ? 156 VAL D CG1 1 ATOM 6069 C CG2 . VAL D 2 156 ? -37.290 -4.856 38.001 1.00 31.66 ? 156 VAL D CG2 1 ATOM 6070 N N . THR D 2 157 ? -38.147 -2.906 35.444 1.00 13.27 ? 157 THR D N 1 ATOM 6071 C CA . THR D 2 157 ? -38.878 -1.659 35.282 1.00 24.31 ? 157 THR D CA 1 ATOM 6072 C C . THR D 2 157 ? -39.618 -1.336 36.570 1.00 22.66 ? 157 THR D C 1 ATOM 6073 O O . THR D 2 157 ? -40.125 -2.234 37.251 1.00 27.15 ? 157 THR D O 1 ATOM 6074 C CB . THR D 2 157 ? -39.871 -1.731 34.118 1.00 22.94 ? 157 THR D CB 1 ATOM 6075 O OG1 . THR D 2 157 ? -40.850 -2.742 34.387 1.00 32.68 ? 157 THR D OG1 1 ATOM 6076 C CG2 . THR D 2 157 ? -39.151 -2.057 32.818 1.00 14.32 ? 157 THR D CG2 1 ATOM 6077 N N . VAL D 2 158 ? -39.666 -0.051 36.908 1.00 18.75 ? 158 VAL D N 1 ATOM 6078 C CA . VAL D 2 158 ? -40.320 0.414 38.125 1.00 18.38 ? 158 VAL D CA 1 ATOM 6079 C C . VAL D 2 158 ? -41.173 1.626 37.782 1.00 27.39 ? 158 VAL D C 1 ATOM 6080 O O . VAL D 2 158 ? -40.676 2.600 37.207 1.00 34.02 ? 158 VAL D O 1 ATOM 6081 C CB . VAL D 2 158 ? -39.306 0.767 39.231 1.00 18.32 ? 158 VAL D CB 1 ATOM 6082 C CG1 . VAL D 2 158 ? -40.030 1.309 40.455 1.00 12.02 ? 158 VAL D CG1 1 ATOM 6083 C CG2 . VAL D 2 158 ? -38.465 -0.450 39.601 1.00 12.03 ? 158 VAL D CG2 1 ATOM 6084 N N . SER D 2 159 ? -42.457 1.561 38.122 1.00 22.85 ? 159 SER D N 1 ATOM 6085 C CA . SER D 2 159 ? -43.363 2.695 38.029 1.00 21.48 ? 159 SER D CA 1 ATOM 6086 C C . SER D 2 159 ? -43.984 2.939 39.396 1.00 22.46 ? 159 SER D C 1 ATOM 6087 O O . SER D 2 159 ? -43.798 2.164 40.336 1.00 29.41 ? 159 SER D O 1 ATOM 6088 C CB . SER D 2 159 ? -44.453 2.464 36.974 1.00 25.03 ? 159 SER D CB 1 ATOM 6089 O OG . SER D 2 159 ? -45.287 1.381 37.337 1.00 28.83 ? 159 SER D OG 1 ATOM 6090 N N . TRP D 2 160 ? -44.732 4.032 39.503 1.00 23.72 ? 160 TRP D N 1 ATOM 6091 C CA . TRP D 2 160 ? -45.336 4.436 40.766 1.00 19.34 ? 160 TRP D CA 1 ATOM 6092 C C . TRP D 2 160 ? -46.822 4.685 40.558 1.00 23.80 ? 160 TRP D C 1 ATOM 6093 O O . TRP D 2 160 ? -47.206 5.459 39.674 1.00 31.89 ? 160 TRP D O 1 ATOM 6094 C CB . TRP D 2 160 ? -44.643 5.680 41.328 1.00 21.71 ? 160 TRP D CB 1 ATOM 6095 C CG . TRP D 2 160 ? -43.315 5.373 41.949 1.00 26.28 ? 160 TRP D CG 1 ATOM 6096 C CD1 . TRP D 2 160 ? -42.090 5.431 41.348 1.00 25.38 ? 160 TRP D CD1 1 ATOM 6097 C CD2 . TRP D 2 160 ? -43.083 4.943 43.294 1.00 27.61 ? 160 TRP D CD2 1 ATOM 6098 N NE1 . TRP D 2 160 ? -41.108 5.069 42.240 1.00 15.09 ? 160 TRP D NE1 1 ATOM 6099 C CE2 . TRP D 2 160 ? -41.693 4.764 43.442 1.00 30.67 ? 160 TRP D CE2 1 ATOM 6100 C CE3 . TRP D 2 160 ? -43.915 4.694 44.388 1.00 26.37 ? 160 TRP D CE3 1 ATOM 6101 C CZ2 . TRP D 2 160 ? -41.118 4.349 44.642 1.00 29.65 ? 160 TRP D CZ2 1 ATOM 6102 C CZ3 . TRP D 2 160 ? -43.343 4.282 45.577 1.00 30.52 ? 160 TRP D CZ3 1 ATOM 6103 C CH2 . TRP D 2 160 ? -41.958 4.114 45.695 1.00 26.41 ? 160 TRP D CH2 1 ATOM 6104 N N . ASN D 2 161 ? -47.647 4.028 41.375 1.00 22.03 ? 161 ASN D N 1 ATOM 6105 C CA . ASN D 2 161 ? -49.106 4.126 41.299 1.00 24.01 ? 161 ASN D CA 1 ATOM 6106 C C . ASN D 2 161 ? -49.599 3.882 39.875 1.00 24.37 ? 161 ASN D C 1 ATOM 6107 O O . ASN D 2 161 ? -50.320 4.692 39.289 1.00 16.46 ? 161 ASN D O 1 ATOM 6108 C CB . ASN D 2 161 ? -49.599 5.473 41.825 1.00 15.34 ? 161 ASN D CB 1 ATOM 6109 C CG . ASN D 2 161 ? -49.241 5.697 43.277 1.00 22.85 ? 161 ASN D CG 1 ATOM 6110 O OD1 . ASN D 2 161 ? -49.000 4.749 44.023 1.00 26.68 ? 161 ASN D OD1 1 ATOM 6111 N ND2 . ASN D 2 161 ? -49.208 6.956 43.688 1.00 21.56 ? 161 ASN D ND2 1 ATOM 6112 N N . SER D 2 162 ? -49.174 2.751 39.311 1.00 28.90 ? 162 SER D N 1 ATOM 6113 C CA . SER D 2 162 ? -49.605 2.308 37.985 1.00 26.63 ? 162 SER D CA 1 ATOM 6114 C C . SER D 2 162 ? -49.301 3.348 36.909 1.00 29.19 ? 162 SER D C 1 ATOM 6115 O O . SER D 2 162 ? -49.962 3.395 35.869 1.00 32.25 ? 162 SER D O 1 ATOM 6116 C CB . SER D 2 162 ? -51.091 1.947 37.987 1.00 17.66 ? 162 SER D CB 1 ATOM 6117 O OG . SER D 2 162 ? -51.379 1.027 39.026 1.00 39.57 ? 162 SER D OG 1 ATOM 6118 N N . GLY D 2 163 ? -48.299 4.191 37.152 1.00 29.12 ? 163 GLY D N 1 ATOM 6119 C CA . GLY D 2 163 ? -47.883 5.201 36.205 1.00 16.06 ? 163 GLY D CA 1 ATOM 6120 C C . GLY D 2 163 ? -48.467 6.578 36.438 1.00 28.82 ? 163 GLY D C 1 ATOM 6121 O O . GLY D 2 163 ? -48.026 7.536 35.790 1.00 38.85 ? 163 GLY D O 1 ATOM 6122 N N . ALA D 2 164 ? -49.437 6.710 37.345 1.00 30.96 ? 164 ALA D N 1 ATOM 6123 C CA . ALA D 2 164 ? -50.084 7.997 37.567 1.00 24.89 ? 164 ALA D CA 1 ATOM 6124 C C . ALA D 2 164 ? -49.184 8.991 38.287 1.00 32.09 ? 164 ALA D C 1 ATOM 6125 O O . ALA D 2 164 ? -49.483 10.190 38.286 1.00 33.72 ? 164 ALA D O 1 ATOM 6126 C CB . ALA D 2 164 ? -51.378 7.805 38.361 1.00 17.40 ? 164 ALA D CB 1 ATOM 6127 N N . LEU D 2 165 ? -48.097 8.525 38.898 1.00 32.58 ? 165 LEU D N 1 ATOM 6128 C CA . LEU D 2 165 ? -47.184 9.372 39.662 1.00 27.00 ? 165 LEU D CA 1 ATOM 6129 C C . LEU D 2 165 ? -45.829 9.368 38.967 1.00 27.25 ? 165 LEU D C 1 ATOM 6130 O O . LEU D 2 165 ? -45.118 8.357 38.992 1.00 33.74 ? 165 LEU D O 1 ATOM 6131 C CB . LEU D 2 165 ? -47.064 8.880 41.103 1.00 14.18 ? 165 LEU D CB 1 ATOM 6132 C CG . LEU D 2 165 ? -46.132 9.679 42.014 1.00 13.65 ? 165 LEU D CG 1 ATOM 6133 C CD1 . LEU D 2 165 ? -46.561 11.136 42.065 1.00 15.11 ? 165 LEU D CD1 1 ATOM 6134 C CD2 . LEU D 2 165 ? -46.108 9.076 43.408 1.00 13.40 ? 165 LEU D CD2 1 ATOM 6135 N N . THR D 2 166 ? -45.469 10.494 38.355 1.00 25.23 ? 166 THR D N 1 ATOM 6136 C CA . THR D 2 166 ? -44.216 10.606 37.614 1.00 25.32 ? 166 THR D CA 1 ATOM 6137 C C . THR D 2 166 ? -43.305 11.713 38.115 1.00 30.53 ? 166 THR D C 1 ATOM 6138 O O . THR D 2 166 ? -42.094 11.504 38.218 1.00 33.51 ? 166 THR D O 1 ATOM 6139 C CB . THR D 2 166 ? -44.491 10.836 36.121 1.00 26.76 ? 166 THR D CB 1 ATOM 6140 O OG1 . THR D 2 166 ? -45.269 12.029 35.956 1.00 29.61 ? 166 THR D OG1 1 ATOM 6141 C CG2 . THR D 2 166 ? -45.236 9.651 35.524 1.00 19.37 ? 166 THR D CG2 1 ATOM 6142 N N . SER D 2 167 ? -43.846 12.892 38.414 1.00 31.81 ? 167 SER D N 1 ATOM 6143 C CA . SER D 2 167 ? -43.009 14.006 38.838 1.00 35.54 ? 167 SER D CA 1 ATOM 6144 C C . SER D 2 167 ? -42.395 13.712 40.199 1.00 29.52 ? 167 SER D C 1 ATOM 6145 O O . SER D 2 167 ? -43.087 13.273 41.124 1.00 23.11 ? 167 SER D O 1 ATOM 6146 C CB . SER D 2 167 ? -43.822 15.299 38.881 1.00 31.14 ? 167 SER D CB 1 ATOM 6147 O OG . SER D 2 167 ? -45.022 15.117 39.605 1.00 37.07 ? 167 SER D OG 1 ATOM 6148 N N . GLY D 2 168 ? -41.088 13.945 40.316 1.00 25.25 ? 168 GLY D N 1 ATOM 6149 C CA . GLY D 2 168 ? -40.353 13.636 41.521 1.00 21.43 ? 168 GLY D CA 1 ATOM 6150 C C . GLY D 2 168 ? -39.773 12.240 41.574 1.00 23.97 ? 168 GLY D C 1 ATOM 6151 O O . GLY D 2 168 ? -39.027 11.932 42.512 1.00 34.72 ? 168 GLY D O 1 ATOM 6152 N N . VAL D 2 169 ? -40.083 11.390 40.599 1.00 18.57 ? 169 VAL D N 1 ATOM 6153 C CA . VAL D 2 169 ? -39.603 10.013 40.595 1.00 17.86 ? 169 VAL D CA 1 ATOM 6154 C C . VAL D 2 169 ? -38.199 9.965 40.008 1.00 20.56 ? 169 VAL D C 1 ATOM 6155 O O . VAL D 2 169 ? -37.943 10.504 38.925 1.00 24.12 ? 169 VAL D O 1 ATOM 6156 C CB . VAL D 2 169 ? -40.563 9.107 39.809 1.00 12.20 ? 169 VAL D CB 1 ATOM 6157 C CG1 . VAL D 2 169 ? -39.981 7.706 39.664 1.00 12.00 ? 169 VAL D CG1 1 ATOM 6158 C CG2 . VAL D 2 169 ? -41.919 9.060 40.489 1.00 28.23 ? 169 VAL D CG2 1 ATOM 6159 N N . HIS D 2 170 ? -37.284 9.321 40.728 1.00 11.57 ? 170 HIS D N 1 ATOM 6160 C CA . HIS D 2 170 ? -35.941 9.029 40.235 1.00 12.42 ? 170 HIS D CA 1 ATOM 6161 C C . HIS D 2 170 ? -35.701 7.537 40.397 1.00 21.27 ? 170 HIS D C 1 ATOM 6162 O O . HIS D 2 170 ? -35.633 7.037 41.524 1.00 18.52 ? 170 HIS D O 1 ATOM 6163 C CB . HIS D 2 170 ? -34.873 9.828 40.986 1.00 14.83 ? 170 HIS D CB 1 ATOM 6164 C CG . HIS D 2 170 ? -34.998 11.308 40.826 1.00 25.12 ? 170 HIS D CG 1 ATOM 6165 N ND1 . HIS D 2 170 ? -34.845 11.940 39.611 1.00 24.33 ? 170 HIS D ND1 1 ATOM 6166 C CD2 . HIS D 2 170 ? -35.254 12.283 41.729 1.00 11.84 ? 170 HIS D CD2 1 ATOM 6167 C CE1 . HIS D 2 170 ? -35.007 13.240 39.772 1.00 14.86 ? 170 HIS D CE1 1 ATOM 6168 N NE2 . HIS D 2 170 ? -35.255 13.475 41.048 1.00 14.37 ? 170 HIS D NE2 1 ATOM 6169 N N . THR D 2 171 ? -35.587 6.828 39.281 1.00 24.17 ? 171 THR D N 1 ATOM 6170 C CA . THR D 2 171 ? -35.200 5.424 39.290 1.00 18.03 ? 171 THR D CA 1 ATOM 6171 C C . THR D 2 171 ? -33.723 5.356 38.932 1.00 16.41 ? 171 THR D C 1 ATOM 6172 O O . THR D 2 171 ? -33.330 5.688 37.809 1.00 24.92 ? 171 THR D O 1 ATOM 6173 C CB . THR D 2 171 ? -36.049 4.602 38.324 1.00 19.90 ? 171 THR D CB 1 ATOM 6174 O OG1 . THR D 2 171 ? -37.420 4.651 38.739 1.00 28.16 ? 171 THR D OG1 1 ATOM 6175 C CG2 . THR D 2 171 ? -35.586 3.155 38.317 1.00 13.78 ? 171 THR D CG2 1 ATOM 6176 N N . PHE D 2 172 ? -32.911 4.945 39.887 1.00 19.32 ? 172 PHE D N 1 ATOM 6177 C CA . PHE D 2 172 ? -31.473 4.996 39.710 1.00 23.81 ? 172 PHE D CA 1 ATOM 6178 C C . PHE D 2 172 ? -30.990 3.859 38.813 1.00 26.12 ? 172 PHE D C 1 ATOM 6179 O O . PHE D 2 172 ? -31.624 2.802 38.735 1.00 22.73 ? 172 PHE D O 1 ATOM 6180 C CB . PHE D 2 172 ? -30.776 4.924 41.064 1.00 11.50 ? 172 PHE D CB 1 ATOM 6181 C CG . PHE D 2 172 ? -31.009 6.132 41.924 1.00 20.86 ? 172 PHE D CG 1 ATOM 6182 C CD1 . PHE D 2 172 ? -32.092 6.189 42.786 1.00 14.06 ? 172 PHE D CD1 1 ATOM 6183 C CD2 . PHE D 2 172 ? -30.149 7.217 41.860 1.00 18.29 ? 172 PHE D CD2 1 ATOM 6184 C CE1 . PHE D 2 172 ? -32.306 7.303 43.572 1.00 17.40 ? 172 PHE D CE1 1 ATOM 6185 C CE2 . PHE D 2 172 ? -30.357 8.332 42.642 1.00 11.81 ? 172 PHE D CE2 1 ATOM 6186 C CZ . PHE D 2 172 ? -31.437 8.376 43.501 1.00 22.80 ? 172 PHE D CZ 1 ATOM 6187 N N . PRO D 2 173 ? -29.880 4.064 38.107 1.00 24.22 ? 173 PRO D N 1 ATOM 6188 C CA . PRO D 2 173 ? -29.272 2.957 37.365 1.00 12.01 ? 173 PRO D CA 1 ATOM 6189 C C . PRO D 2 173 ? -28.886 1.838 38.317 1.00 21.74 ? 173 PRO D C 1 ATOM 6190 O O . PRO D 2 173 ? -28.454 2.082 39.446 1.00 31.36 ? 173 PRO D O 1 ATOM 6191 C CB . PRO D 2 173 ? -28.038 3.596 36.716 1.00 12.34 ? 173 PRO D CB 1 ATOM 6192 C CG . PRO D 2 173 ? -28.307 5.064 36.725 1.00 12.89 ? 173 PRO D CG 1 ATOM 6193 C CD . PRO D 2 173 ? -29.131 5.322 37.943 1.00 23.27 ? 173 PRO D CD 1 ATOM 6194 N N . ALA D 2 174 ? -29.055 0.603 37.861 1.00 20.50 ? 174 ALA D N 1 ATOM 6195 C CA . ALA D 2 174 ? -28.697 -0.533 38.695 1.00 23.01 ? 174 ALA D CA 1 ATOM 6196 C C . ALA D 2 174 ? -27.182 -0.648 38.816 1.00 25.38 ? 174 ALA D C 1 ATOM 6197 O O . ALA D 2 174 ? -26.432 -0.300 37.900 1.00 19.90 ? 174 ALA D O 1 ATOM 6198 C CB . ALA D 2 174 ? -29.277 -1.826 38.126 1.00 18.60 ? 174 ALA D CB 1 ATOM 6199 N N . VAL D 2 175 ? -26.736 -1.132 39.971 1.00 20.10 ? 175 VAL D N 1 ATOM 6200 C CA . VAL D 2 175 ? -25.326 -1.394 40.225 1.00 15.51 ? 175 VAL D CA 1 ATOM 6201 C C . VAL D 2 175 ? -25.136 -2.897 40.355 1.00 18.82 ? 175 VAL D C 1 ATOM 6202 O O . VAL D 2 175 ? -26.022 -3.608 40.846 1.00 19.76 ? 175 VAL D O 1 ATOM 6203 C CB . VAL D 2 175 ? -24.816 -0.659 41.482 1.00 24.05 ? 175 VAL D CB 1 ATOM 6204 C CG1 . VAL D 2 175 ? -25.079 0.834 41.367 1.00 16.77 ? 175 VAL D CG1 1 ATOM 6205 C CG2 . VAL D 2 175 ? -25.457 -1.227 42.744 1.00 31.53 ? 175 VAL D CG2 1 ATOM 6206 N N . LEU D 2 176 ? -23.986 -3.382 39.894 1.00 20.40 ? 176 LEU D N 1 ATOM 6207 C CA . LEU D 2 176 ? -23.647 -4.797 39.984 1.00 19.43 ? 176 LEU D CA 1 ATOM 6208 C C . LEU D 2 176 ? -22.963 -5.048 41.323 1.00 19.80 ? 176 LEU D C 1 ATOM 6209 O O . LEU D 2 176 ? -21.836 -4.594 41.547 1.00 29.27 ? 176 LEU D O 1 ATOM 6210 C CB . LEU D 2 176 ? -22.752 -5.211 38.821 1.00 21.68 ? 176 LEU D CB 1 ATOM 6211 C CG . LEU D 2 176 ? -22.325 -6.677 38.800 1.00 21.78 ? 176 LEU D CG 1 ATOM 6212 C CD1 . LEU D 2 176 ? -23.546 -7.590 38.799 1.00 20.00 ? 176 LEU D CD1 1 ATOM 6213 C CD2 . LEU D 2 176 ? -21.440 -6.949 37.596 1.00 15.43 ? 176 LEU D CD2 1 ATOM 6214 N N . GLN D 2 177 ? -23.647 -5.761 42.215 1.00 22.90 ? 177 GLN D N 1 ATOM 6215 C CA . GLN D 2 177 ? -23.083 -6.072 43.519 1.00 15.04 ? 177 GLN D CA 1 ATOM 6216 C C . GLN D 2 177 ? -21.955 -7.094 43.390 1.00 15.77 ? 177 GLN D C 1 ATOM 6217 O O . GLN D 2 177 ? -21.804 -7.771 42.370 1.00 20.04 ? 177 GLN D O 1 ATOM 6218 C CB . GLN D 2 177 ? -24.162 -6.608 44.458 1.00 14.90 ? 177 GLN D CB 1 ATOM 6219 C CG . GLN D 2 177 ? -25.199 -5.584 44.871 1.00 16.72 ? 177 GLN D CG 1 ATOM 6220 C CD . GLN D 2 177 ? -26.420 -6.224 45.500 1.00 23.65 ? 177 GLN D CD 1 ATOM 6221 O OE1 . GLN D 2 177 ? -26.920 -5.764 46.526 1.00 26.47 ? 177 GLN D OE1 1 ATOM 6222 N NE2 . GLN D 2 177 ? -26.913 -7.290 44.880 1.00 27.48 ? 177 GLN D NE2 1 ATOM 6223 N N . SER D 2 178 ? -21.159 -7.203 44.457 1.00 16.43 ? 178 SER D N 1 ATOM 6224 C CA . SER D 2 178 ? -20.042 -8.140 44.461 1.00 29.04 ? 178 SER D CA 1 ATOM 6225 C C . SER D 2 178 ? -20.501 -9.587 44.341 1.00 27.98 ? 178 SER D C 1 ATOM 6226 O O . SER D 2 178 ? -19.704 -10.448 43.949 1.00 37.98 ? 178 SER D O 1 ATOM 6227 C CB . SER D 2 178 ? -19.208 -7.959 45.729 1.00 47.80 ? 178 SER D CB 1 ATOM 6228 O OG . SER D 2 178 ? -19.981 -8.214 46.888 1.00 56.07 ? 178 SER D OG 1 ATOM 6229 N N . SER D 2 179 ? -21.763 -9.874 44.659 1.00 24.30 ? 179 SER D N 1 ATOM 6230 C CA . SER D 2 179 ? -22.306 -11.221 44.543 1.00 26.77 ? 179 SER D CA 1 ATOM 6231 C C . SER D 2 179 ? -22.742 -11.569 43.126 1.00 37.34 ? 179 SER D C 1 ATOM 6232 O O . SER D 2 179 ? -23.272 -12.666 42.911 1.00 35.34 ? 179 SER D O 1 ATOM 6233 C CB . SER D 2 179 ? -23.494 -11.391 45.493 1.00 24.36 ? 179 SER D CB 1 ATOM 6234 O OG . SER D 2 179 ? -24.578 -10.565 45.099 1.00 28.29 ? 179 SER D OG 1 ATOM 6235 N N . GLY D 2 180 ? -22.539 -10.675 42.160 1.00 31.76 ? 180 GLY D N 1 ATOM 6236 C CA . GLY D 2 180 ? -22.994 -10.902 40.806 1.00 15.99 ? 180 GLY D CA 1 ATOM 6237 C C . GLY D 2 180 ? -24.455 -10.595 40.559 1.00 15.34 ? 180 GLY D C 1 ATOM 6238 O O . GLY D 2 180 ? -24.925 -10.773 39.428 1.00 15.19 ? 180 GLY D O 1 ATOM 6239 N N . LEU D 2 181 ? -25.189 -10.148 41.573 1.00 21.50 ? 181 LEU D N 1 ATOM 6240 C CA . LEU D 2 181 ? -26.590 -9.786 41.437 1.00 20.22 ? 181 LEU D CA 1 ATOM 6241 C C . LEU D 2 181 ? -26.729 -8.273 41.351 1.00 23.05 ? 181 LEU D C 1 ATOM 6242 O O . LEU D 2 181 ? -25.942 -7.523 41.937 1.00 28.22 ? 181 LEU D O 1 ATOM 6243 C CB . LEU D 2 181 ? -27.409 -10.315 42.615 1.00 24.51 ? 181 LEU D CB 1 ATOM 6244 C CG . LEU D 2 181 ? -27.367 -11.825 42.849 1.00 23.93 ? 181 LEU D CG 1 ATOM 6245 C CD1 . LEU D 2 181 ? -28.161 -12.195 44.092 1.00 15.30 ? 181 LEU D CD1 1 ATOM 6246 C CD2 . LEU D 2 181 ? -27.895 -12.560 41.629 1.00 15.19 ? 181 LEU D CD2 1 ATOM 6247 N N . TYR D 2 182 ? -27.743 -7.829 40.619 1.00 18.05 ? 182 TYR D N 1 ATOM 6248 C CA . TYR D 2 182 ? -27.992 -6.408 40.448 1.00 13.20 ? 182 TYR D CA 1 ATOM 6249 C C . TYR D 2 182 ? -28.871 -5.871 41.573 1.00 22.42 ? 182 TYR D C 1 ATOM 6250 O O . TYR D 2 182 ? -29.531 -6.618 42.299 1.00 26.58 ? 182 TYR D O 1 ATOM 6251 C CB . TYR D 2 182 ? -28.642 -6.135 39.093 1.00 13.03 ? 182 TYR D CB 1 ATOM 6252 C CG . TYR D 2 182 ? -27.666 -6.175 37.941 1.00 24.44 ? 182 TYR D CG 1 ATOM 6253 C CD1 . TYR D 2 182 ? -26.965 -5.038 37.564 1.00 24.71 ? 182 TYR D CD1 1 ATOM 6254 C CD2 . TYR D 2 182 ? -27.441 -7.349 37.231 1.00 27.34 ? 182 TYR D CD2 1 ATOM 6255 C CE1 . TYR D 2 182 ? -26.068 -5.066 36.513 1.00 24.66 ? 182 TYR D CE1 1 ATOM 6256 C CE2 . TYR D 2 182 ? -26.543 -7.387 36.176 1.00 21.96 ? 182 TYR D CE2 1 ATOM 6257 C CZ . TYR D 2 182 ? -25.861 -6.241 35.824 1.00 18.29 ? 182 TYR D CZ 1 ATOM 6258 O OH . TYR D 2 182 ? -24.966 -6.262 34.779 1.00 29.92 ? 182 TYR D OH 1 ATOM 6259 N N . SER D 2 183 ? -28.864 -4.549 41.714 1.00 12.66 ? 183 SER D N 1 ATOM 6260 C CA . SER D 2 183 ? -29.674 -3.878 42.717 1.00 12.45 ? 183 SER D CA 1 ATOM 6261 C C . SER D 2 183 ? -29.847 -2.426 42.298 1.00 12.14 ? 183 SER D C 1 ATOM 6262 O O . SER D 2 183 ? -28.909 -1.808 41.790 1.00 16.00 ? 183 SER D O 1 ATOM 6263 C CB . SER D 2 183 ? -29.028 -3.965 44.105 1.00 25.71 ? 183 SER D CB 1 ATOM 6264 O OG . SER D 2 183 ? -29.845 -3.357 45.090 1.00 27.25 ? 183 SER D OG 1 ATOM 6265 N N . LEU D 2 184 ? -31.050 -1.895 42.492 1.00 16.91 ? 184 LEU D N 1 ATOM 6266 C CA . LEU D 2 184 ? -31.290 -0.483 42.245 1.00 18.72 ? 184 LEU D CA 1 ATOM 6267 C C . LEU D 2 184 ? -32.323 0.021 43.239 1.00 15.97 ? 184 LEU D C 1 ATOM 6268 O O . LEU D 2 184 ? -32.873 -0.739 44.040 1.00 11.64 ? 184 LEU D O 1 ATOM 6269 C CB . LEU D 2 184 ? -31.730 -0.222 40.798 1.00 21.88 ? 184 LEU D CB 1 ATOM 6270 C CG . LEU D 2 184 ? -33.024 -0.802 40.217 1.00 25.86 ? 184 LEU D CG 1 ATOM 6271 C CD1 . LEU D 2 184 ? -34.269 -0.011 40.617 1.00 11.46 ? 184 LEU D CD1 1 ATOM 6272 C CD2 . LEU D 2 184 ? -32.902 -0.855 38.704 1.00 26.82 ? 184 LEU D CD2 1 ATOM 6273 N N . SER D 2 185 ? -32.581 1.321 43.174 1.00 17.10 ? 185 SER D N 1 ATOM 6274 C CA . SER D 2 185 ? -33.584 1.955 44.008 1.00 14.44 ? 185 SER D CA 1 ATOM 6275 C C . SER D 2 185 ? -34.366 2.940 43.157 1.00 16.71 ? 185 SER D C 1 ATOM 6276 O O . SER D 2 185 ? -33.848 3.497 42.184 1.00 15.51 ? 185 SER D O 1 ATOM 6277 C CB . SER D 2 185 ? -32.954 2.666 45.211 1.00 11.45 ? 185 SER D CB 1 ATOM 6278 O OG . SER D 2 185 ? -32.191 1.760 45.988 1.00 47.67 ? 185 SER D OG 1 ATOM 6279 N N . SER D 2 186 ? -35.627 3.129 43.523 1.00 11.18 ? 186 SER D N 1 ATOM 6280 C CA . SER D 2 186 ? -36.489 4.121 42.904 1.00 18.90 ? 186 SER D CA 1 ATOM 6281 C C . SER D 2 186 ? -37.136 4.921 44.020 1.00 19.98 ? 186 SER D C 1 ATOM 6282 O O . SER D 2 186 ? -37.732 4.341 44.932 1.00 18.65 ? 186 SER D O 1 ATOM 6283 C CB . SER D 2 186 ? -37.552 3.466 42.017 1.00 11.30 ? 186 SER D CB 1 ATOM 6284 O OG . SER D 2 186 ? -38.355 4.441 41.381 1.00 13.42 ? 186 SER D OG 1 ATOM 6285 N N . VAL D 2 187 ? -36.996 6.244 43.963 1.00 20.51 ? 187 VAL D N 1 ATOM 6286 C CA . VAL D 2 187 ? -37.479 7.121 45.019 1.00 19.47 ? 187 VAL D CA 1 ATOM 6287 C C . VAL D 2 187 ? -38.379 8.185 44.411 1.00 22.16 ? 187 VAL D C 1 ATOM 6288 O O . VAL D 2 187 ? -38.385 8.416 43.200 1.00 29.94 ? 187 VAL D O 1 ATOM 6289 C CB . VAL D 2 187 ? -36.323 7.782 45.804 1.00 14.80 ? 187 VAL D CB 1 ATOM 6290 C CG1 . VAL D 2 187 ? -35.441 6.721 46.445 1.00 11.39 ? 187 VAL D CG1 1 ATOM 6291 C CG2 . VAL D 2 187 ? -35.508 8.677 44.888 1.00 11.36 ? 187 VAL D CG2 1 ATOM 6292 N N . VAL D 2 188 ? -39.150 8.833 45.278 1.00 24.78 ? 188 VAL D N 1 ATOM 6293 C CA . VAL D 2 188 ? -40.036 9.919 44.880 1.00 22.96 ? 188 VAL D CA 1 ATOM 6294 C C . VAL D 2 188 ? -40.236 10.821 46.088 1.00 17.38 ? 188 VAL D C 1 ATOM 6295 O O . VAL D 2 188 ? -40.286 10.352 47.229 1.00 21.01 ? 188 VAL D O 1 ATOM 6296 C CB . VAL D 2 188 ? -41.382 9.388 44.332 1.00 31.99 ? 188 VAL D CB 1 ATOM 6297 C CG1 . VAL D 2 188 ? -42.071 8.504 45.359 1.00 17.94 ? 188 VAL D CG1 1 ATOM 6298 C CG2 . VAL D 2 188 ? -42.294 10.537 43.904 1.00 12.25 ? 188 VAL D CG2 1 ATOM 6299 N N . THR D 2 189 ? -40.322 12.122 45.837 1.00 16.34 ? 189 THR D N 1 ATOM 6300 C CA . THR D 2 189 ? -40.597 13.097 46.880 1.00 16.42 ? 189 THR D CA 1 ATOM 6301 C C . THR D 2 189 ? -42.074 13.466 46.846 1.00 23.41 ? 189 THR D C 1 ATOM 6302 O O . THR D 2 189 ? -42.632 13.714 45.773 1.00 21.37 ? 189 THR D O 1 ATOM 6303 C CB . THR D 2 189 ? -39.728 14.343 46.717 1.00 17.24 ? 189 THR D CB 1 ATOM 6304 O OG1 . THR D 2 189 ? -39.723 14.747 45.340 1.00 24.87 ? 189 THR D OG1 1 ATOM 6305 C CG2 . THR D 2 189 ? -38.305 14.048 47.168 1.00 12.32 ? 189 THR D CG2 1 ATOM 6306 N N . VAL D 2 190 ? -42.699 13.474 48.014 1.00 19.99 ? 190 VAL D N 1 ATOM 6307 C CA . VAL D 2 190 ? -44.133 13.757 48.133 1.00 21.94 ? 190 VAL D CA 1 ATOM 6308 C C . VAL D 2 190 ? -44.332 14.713 49.286 1.00 26.04 ? 190 VAL D C 1 ATOM 6309 O O . VAL D 2 190 ? -43.480 14.819 50.191 1.00 13.47 ? 190 VAL D O 1 ATOM 6310 C CB . VAL D 2 190 ? -44.950 12.455 48.333 1.00 13.23 ? 190 VAL D CB 1 ATOM 6311 C CG1 . VAL D 2 190 ? -44.630 11.439 47.245 1.00 12.95 ? 190 VAL D CG1 1 ATOM 6312 C CG2 . VAL D 2 190 ? -44.682 11.869 49.705 1.00 13.23 ? 190 VAL D CG2 1 ATOM 6313 N N . PRO D 2 191 ? -45.442 15.459 49.296 1.00 21.37 ? 191 PRO D N 1 ATOM 6314 C CA . PRO D 2 191 ? -45.753 16.300 50.457 1.00 22.85 ? 191 PRO D CA 1 ATOM 6315 C C . PRO D 2 191 ? -45.957 15.441 51.697 1.00 30.38 ? 191 PRO D C 1 ATOM 6316 O O . PRO D 2 191 ? -46.682 14.444 51.667 1.00 27.58 ? 191 PRO D O 1 ATOM 6317 C CB . PRO D 2 191 ? -47.042 17.021 50.047 1.00 14.85 ? 191 PRO D CB 1 ATOM 6318 C CG . PRO D 2 191 ? -47.079 16.933 48.562 1.00 17.13 ? 191 PRO D CG 1 ATOM 6319 C CD . PRO D 2 191 ? -46.415 15.643 48.203 1.00 14.20 ? 191 PRO D CD 1 ATOM 6320 N N . SER D 2 192 ? -45.304 15.836 52.795 1.00 27.62 ? 192 SER D N 1 ATOM 6321 C CA . SER D 2 192 ? -45.364 15.040 54.018 1.00 14.82 ? 192 SER D CA 1 ATOM 6322 C C . SER D 2 192 ? -46.792 14.865 54.516 1.00 19.57 ? 192 SER D C 1 ATOM 6323 O O . SER D 2 192 ? -47.125 13.817 55.081 1.00 15.34 ? 192 SER D O 1 ATOM 6324 C CB . SER D 2 192 ? -44.506 15.677 55.112 1.00 21.17 ? 192 SER D CB 1 ATOM 6325 O OG . SER D 2 192 ? -43.125 15.509 54.842 1.00 42.30 ? 192 SER D OG 1 ATOM 6326 N N . SER D 2 193 ? -47.650 15.865 54.314 1.00 22.89 ? 193 SER D N 1 ATOM 6327 C CA . SER D 2 193 ? -49.008 15.802 54.843 1.00 23.41 ? 193 SER D CA 1 ATOM 6328 C C . SER D 2 193 ? -49.929 14.902 54.029 1.00 20.06 ? 193 SER D C 1 ATOM 6329 O O . SER D 2 193 ? -51.120 14.815 54.347 1.00 23.80 ? 193 SER D O 1 ATOM 6330 C CB . SER D 2 193 ? -49.609 17.207 54.936 1.00 27.39 ? 193 SER D CB 1 ATOM 6331 O OG . SER D 2 193 ? -49.672 17.824 53.663 1.00 27.56 ? 193 SER D OG 1 ATOM 6332 N N . SER D 2 194 ? -49.422 14.236 52.995 1.00 18.58 ? 194 SER D N 1 ATOM 6333 C CA . SER D 2 194 ? -50.210 13.284 52.227 1.00 24.00 ? 194 SER D CA 1 ATOM 6334 C C . SER D 2 194 ? -49.822 11.837 52.504 1.00 24.40 ? 194 SER D C 1 ATOM 6335 O O . SER D 2 194 ? -50.392 10.928 51.890 1.00 24.97 ? 194 SER D O 1 ATOM 6336 C CB . SER D 2 194 ? -50.086 13.579 50.727 1.00 24.36 ? 194 SER D CB 1 ATOM 6337 O OG . SER D 2 194 ? -48.798 13.245 50.242 1.00 23.92 ? 194 SER D OG 1 ATOM 6338 N N . LEU D 2 195 ? -48.882 11.599 53.423 1.00 27.72 ? 195 LEU D N 1 ATOM 6339 C CA . LEU D 2 195 ? -48.428 10.240 53.705 1.00 33.84 ? 195 LEU D CA 1 ATOM 6340 C C . LEU D 2 195 ? -49.503 9.402 54.383 1.00 39.05 ? 195 LEU D C 1 ATOM 6341 O O . LEU D 2 195 ? -49.456 8.168 54.317 1.00 48.38 ? 195 LEU D O 1 ATOM 6342 C CB . LEU D 2 195 ? -47.177 10.275 54.581 1.00 29.95 ? 195 LEU D CB 1 ATOM 6343 C CG . LEU D 2 195 ? -45.915 10.810 53.913 1.00 32.14 ? 195 LEU D CG 1 ATOM 6344 C CD1 . LEU D 2 195 ? -44.744 10.765 54.881 1.00 31.56 ? 195 LEU D CD1 1 ATOM 6345 C CD2 . LEU D 2 195 ? -45.623 9.998 52.668 1.00 28.33 ? 195 LEU D CD2 1 ATOM 6346 N N . GLY D 2 196 ? -50.468 10.044 55.044 1.00 19.95 ? 196 GLY D N 1 ATOM 6347 C CA . GLY D 2 196 ? -51.486 9.295 55.756 1.00 30.75 ? 196 GLY D CA 1 ATOM 6348 C C . GLY D 2 196 ? -52.677 8.915 54.906 1.00 34.71 ? 196 GLY D C 1 ATOM 6349 O O . GLY D 2 196 ? -53.276 7.857 55.120 1.00 44.32 ? 196 GLY D O 1 ATOM 6350 N N . THR D 2 197 ? -53.029 9.749 53.928 1.00 32.85 ? 197 THR D N 1 ATOM 6351 C CA . THR D 2 197 ? -54.240 9.559 53.141 1.00 33.67 ? 197 THR D CA 1 ATOM 6352 C C . THR D 2 197 ? -53.990 9.048 51.730 1.00 34.31 ? 197 THR D C 1 ATOM 6353 O O . THR D 2 197 ? -54.832 8.322 51.195 1.00 34.01 ? 197 THR D O 1 ATOM 6354 C CB . THR D 2 197 ? -55.025 10.873 53.060 1.00 37.44 ? 197 THR D CB 1 ATOM 6355 O OG1 . THR D 2 197 ? -54.155 11.924 52.623 1.00 49.30 ? 197 THR D OG1 1 ATOM 6356 C CG2 . THR D 2 197 ? -55.594 11.233 54.424 1.00 39.66 ? 197 THR D CG2 1 ATOM 6357 N N . GLN D 2 198 ? -52.864 9.405 51.115 1.00 29.43 ? 198 GLN D N 1 ATOM 6358 C CA . GLN D 2 198 ? -52.568 8.995 49.749 1.00 34.55 ? 198 GLN D CA 1 ATOM 6359 C C . GLN D 2 198 ? -51.754 7.709 49.745 1.00 27.29 ? 198 GLN D C 1 ATOM 6360 O O . GLN D 2 198 ? -50.796 7.563 50.509 1.00 31.80 ? 198 GLN D O 1 ATOM 6361 C CB . GLN D 2 198 ? -51.803 10.093 49.006 1.00 36.72 ? 198 GLN D CB 1 ATOM 6362 C CG . GLN D 2 198 ? -51.410 9.720 47.583 1.00 40.11 ? 198 GLN D CG 1 ATOM 6363 C CD . GLN D 2 198 ? -52.598 9.668 46.642 1.00 42.37 ? 198 GLN D CD 1 ATOM 6364 O OE1 . GLN D 2 198 ? -53.401 10.599 46.591 1.00 46.44 ? 198 GLN D OE1 1 ATOM 6365 N NE2 . GLN D 2 198 ? -52.718 8.576 45.893 1.00 38.50 ? 198 GLN D NE2 1 ATOM 6366 N N . THR D 2 199 ? -52.139 6.778 48.880 1.00 27.35 ? 199 THR D N 1 ATOM 6367 C CA . THR D 2 199 ? -51.408 5.531 48.740 1.00 24.76 ? 199 THR D CA 1 ATOM 6368 C C . THR D 2 199 ? -50.255 5.726 47.761 1.00 20.17 ? 199 THR D C 1 ATOM 6369 O O . THR D 2 199 ? -50.361 6.488 46.794 1.00 24.73 ? 199 THR D O 1 ATOM 6370 C CB . THR D 2 199 ? -52.336 4.397 48.283 1.00 24.82 ? 199 THR D CB 1 ATOM 6371 O OG1 . THR D 2 199 ? -51.774 3.135 48.665 1.00 32.27 ? 199 THR D OG1 1 ATOM 6372 C CG2 . THR D 2 199 ? -52.546 4.410 46.769 1.00 23.54 ? 199 THR D CG2 1 ATOM 6373 N N . TYR D 2 200 ? -49.137 5.065 48.045 1.00 16.08 ? 200 TYR D N 1 ATOM 6374 C CA . TYR D 2 200 ? -47.928 5.169 47.235 1.00 15.18 ? 200 TYR D CA 1 ATOM 6375 C C . TYR D 2 200 ? -47.392 3.764 47.020 1.00 18.38 ? 200 TYR D C 1 ATOM 6376 O O . TYR D 2 200 ? -46.935 3.116 47.968 1.00 26.85 ? 200 TYR D O 1 ATOM 6377 C CB . TYR D 2 200 ? -46.888 6.065 47.905 1.00 14.62 ? 200 TYR D CB 1 ATOM 6378 C CG . TYR D 2 200 ? -47.280 7.525 47.935 1.00 15.59 ? 200 TYR D CG 1 ATOM 6379 C CD1 . TYR D 2 200 ? -47.245 8.294 46.778 1.00 24.35 ? 200 TYR D CD1 1 ATOM 6380 C CD2 . TYR D 2 200 ? -47.684 8.135 49.115 1.00 16.06 ? 200 TYR D CD2 1 ATOM 6381 C CE1 . TYR D 2 200 ? -47.605 9.628 46.794 1.00 23.20 ? 200 TYR D CE1 1 ATOM 6382 C CE2 . TYR D 2 200 ? -48.043 9.472 49.141 1.00 24.62 ? 200 TYR D CE2 1 ATOM 6383 C CZ . TYR D 2 200 ? -48.001 10.212 47.977 1.00 29.41 ? 200 TYR D CZ 1 ATOM 6384 O OH . TYR D 2 200 ? -48.358 11.540 47.993 1.00 19.22 ? 200 TYR D OH 1 ATOM 6385 N N . ILE D 2 201 ? -47.458 3.289 45.781 1.00 18.55 ? 201 ILE D N 1 ATOM 6386 C CA . ILE D 2 201 ? -47.103 1.919 45.441 1.00 19.66 ? 201 ILE D CA 1 ATOM 6387 C C . ILE D 2 201 ? -46.066 1.951 44.331 1.00 17.18 ? 201 ILE D C 1 ATOM 6388 O O . ILE D 2 201 ? -46.268 2.613 43.308 1.00 35.14 ? 201 ILE D O 1 ATOM 6389 C CB . ILE D 2 201 ? -48.338 1.108 45.000 1.00 23.25 ? 201 ILE D CB 1 ATOM 6390 C CG1 . ILE D 2 201 ? -49.397 1.107 46.106 1.00 22.68 ? 201 ILE D CG1 1 ATOM 6391 C CG2 . ILE D 2 201 ? -47.936 -0.310 44.616 1.00 18.28 ? 201 ILE D CG2 1 ATOM 6392 C CD1 . ILE D 2 201 ? -50.711 0.477 45.697 1.00 37.95 ? 201 ILE D CD1 1 ATOM 6393 N N . CYS D 2 202 ? -44.957 1.246 44.533 1.00 12.73 ? 202 CYS D N 1 ATOM 6394 C CA . CYS D 2 202 ? -43.999 1.026 43.460 1.00 27.40 ? 202 CYS D CA 1 ATOM 6395 C C . CYS D 2 202 ? -44.364 -0.257 42.725 1.00 23.52 ? 202 CYS D C 1 ATOM 6396 O O . CYS D 2 202 ? -44.677 -1.276 43.349 1.00 27.61 ? 202 CYS D O 1 ATOM 6397 C CB . CYS D 2 202 ? -42.562 0.963 43.989 1.00 24.47 ? 202 CYS D CB 1 ATOM 6398 S SG . CYS D 2 202 ? -42.119 -0.472 44.991 1.00 30.45 ? 202 CYS D SG 1 ATOM 6399 N N . ASN D 2 203 ? -44.349 -0.196 41.400 1.00 13.45 ? 203 ASN D N 1 ATOM 6400 C CA . ASN D 2 203 ? -44.709 -1.334 40.560 1.00 19.98 ? 203 ASN D CA 1 ATOM 6401 C C . ASN D 2 203 ? -43.422 -1.901 39.977 1.00 19.32 ? 203 ASN D C 1 ATOM 6402 O O . ASN D 2 203 ? -42.921 -1.438 38.952 1.00 26.71 ? 203 ASN D O 1 ATOM 6403 C CB . ASN D 2 203 ? -45.689 -0.911 39.473 1.00 15.78 ? 203 ASN D CB 1 ATOM 6404 C CG . ASN D 2 203 ? -46.861 -0.129 40.024 1.00 16.57 ? 203 ASN D CG 1 ATOM 6405 O OD1 . ASN D 2 203 ? -47.016 1.060 39.747 1.00 17.04 ? 203 ASN D OD1 1 ATOM 6406 N ND2 . ASN D 2 203 ? -47.691 -0.792 40.818 1.00 16.95 ? 203 ASN D ND2 1 ATOM 6407 N N . VAL D 2 204 ? -42.880 -2.909 40.647 1.00 18.21 ? 204 VAL D N 1 ATOM 6408 C CA . VAL D 2 204 ? -41.654 -3.562 40.208 1.00 24.01 ? 204 VAL D CA 1 ATOM 6409 C C . VAL D 2 204 ? -42.017 -4.732 39.306 1.00 27.66 ? 204 VAL D C 1 ATOM 6410 O O . VAL D 2 204 ? -42.913 -5.522 39.626 1.00 37.56 ? 204 VAL D O 1 ATOM 6411 C CB . VAL D 2 204 ? -40.816 -4.027 41.410 1.00 18.98 ? 204 VAL D CB 1 ATOM 6412 C CG1 . VAL D 2 204 ? -39.560 -4.738 40.934 1.00 11.45 ? 204 VAL D CG1 1 ATOM 6413 C CG2 . VAL D 2 204 ? -40.464 -2.843 42.295 1.00 24.78 ? 204 VAL D CG2 1 ATOM 6414 N N . ASN D 2 205 ? -41.328 -4.838 38.172 1.00 25.15 ? 205 ASN D N 1 ATOM 6415 C CA . ASN D 2 205 ? -41.545 -5.926 37.227 1.00 28.54 ? 205 ASN D CA 1 ATOM 6416 C C . ASN D 2 205 ? -40.209 -6.306 36.613 1.00 32.11 ? 205 ASN D C 1 ATOM 6417 O O . ASN D 2 205 ? -39.578 -5.490 35.934 1.00 27.12 ? 205 ASN D O 1 ATOM 6418 C CB . ASN D 2 205 ? -42.552 -5.526 36.143 1.00 31.07 ? 205 ASN D CB 1 ATOM 6419 C CG . ASN D 2 205 ? -42.713 -6.588 35.071 1.00 32.18 ? 205 ASN D CG 1 ATOM 6420 O OD1 . ASN D 2 205 ? -42.978 -6.272 33.913 1.00 40.48 ? 205 ASN D OD1 1 ATOM 6421 N ND2 . ASN D 2 205 ? -42.541 -7.852 35.448 1.00 30.96 ? 205 ASN D ND2 1 ATOM 6422 N N . HIS D 2 206 ? -39.784 -7.540 36.863 1.00 27.61 ? 206 HIS D N 1 ATOM 6423 C CA . HIS D 2 206 ? -38.540 -8.099 36.340 1.00 19.58 ? 206 HIS D CA 1 ATOM 6424 C C . HIS D 2 206 ? -38.931 -9.223 35.384 1.00 23.62 ? 206 HIS D C 1 ATOM 6425 O O . HIS D 2 206 ? -39.163 -10.360 35.797 1.00 31.43 ? 206 HIS D O 1 ATOM 6426 C CB . HIS D 2 206 ? -37.648 -8.591 37.479 1.00 27.86 ? 206 HIS D CB 1 ATOM 6427 C CG . HIS D 2 206 ? -36.385 -9.250 37.022 1.00 21.92 ? 206 HIS D CG 1 ATOM 6428 N ND1 . HIS D 2 206 ? -36.171 -10.606 37.142 1.00 14.46 ? 206 HIS D ND1 1 ATOM 6429 C CD2 . HIS D 2 206 ? -35.265 -8.739 36.458 1.00 14.03 ? 206 HIS D CD2 1 ATOM 6430 C CE1 . HIS D 2 206 ? -34.975 -10.903 36.666 1.00 19.64 ? 206 HIS D CE1 1 ATOM 6431 N NE2 . HIS D 2 206 ? -34.406 -9.789 36.243 1.00 16.46 ? 206 HIS D NE2 1 ATOM 6432 N N . LYS D 2 207 ? -39.011 -8.889 34.098 1.00 18.55 ? 207 LYS D N 1 ATOM 6433 C CA . LYS D 2 207 ? -39.528 -9.770 33.052 1.00 19.74 ? 207 LYS D CA 1 ATOM 6434 C C . LYS D 2 207 ? -38.697 -11.030 32.798 1.00 20.08 ? 207 LYS D C 1 ATOM 6435 O O . LYS D 2 207 ? -39.271 -12.075 32.460 1.00 29.80 ? 207 LYS D O 1 ATOM 6436 C CB . LYS D 2 207 ? -39.676 -8.977 31.753 1.00 29.20 ? 207 LYS D CB 1 ATOM 6437 C CG . LYS D 2 207 ? -40.845 -8.010 31.790 1.00 23.13 ? 207 LYS D CG 1 ATOM 6438 C CD . LYS D 2 207 ? -41.045 -7.300 30.464 1.00 34.41 ? 207 LYS D CD 1 ATOM 6439 C CE . LYS D 2 207 ? -42.247 -6.369 30.538 1.00 36.03 ? 207 LYS D CE 1 ATOM 6440 N NZ . LYS D 2 207 ? -42.423 -5.602 29.276 1.00 33.51 ? 207 LYS D NZ 1 ATOM 6441 N N . PRO D 2 208 ? -37.362 -10.989 32.913 1.00 23.81 ? 208 PRO D N 1 ATOM 6442 C CA . PRO D 2 208 ? -36.588 -12.234 32.744 1.00 18.58 ? 208 PRO D CA 1 ATOM 6443 C C . PRO D 2 208 ? -37.013 -13.361 33.674 1.00 23.65 ? 208 PRO D C 1 ATOM 6444 O O . PRO D 2 208 ? -36.881 -14.538 33.311 1.00 36.62 ? 208 PRO D O 1 ATOM 6445 C CB . PRO D 2 208 ? -35.150 -11.784 33.024 1.00 17.50 ? 208 PRO D CB 1 ATOM 6446 C CG . PRO D 2 208 ? -35.125 -10.372 32.593 1.00 17.09 ? 208 PRO D CG 1 ATOM 6447 C CD . PRO D 2 208 ? -36.470 -9.811 32.948 1.00 20.01 ? 208 PRO D CD 1 ATOM 6448 N N . SER D 2 209 ? -37.511 -13.041 34.867 1.00 19.45 ? 209 SER D N 1 ATOM 6449 C CA . SER D 2 209 ? -37.993 -14.045 35.806 1.00 18.59 ? 209 SER D CA 1 ATOM 6450 C C . SER D 2 209 ? -39.509 -14.022 35.956 1.00 25.35 ? 209 SER D C 1 ATOM 6451 O O . SER D 2 209 ? -40.044 -14.735 36.813 1.00 20.14 ? 209 SER D O 1 ATOM 6452 C CB . SER D 2 209 ? -37.343 -13.845 37.178 1.00 17.40 ? 209 SER D CB 1 ATOM 6453 O OG . SER D 2 209 ? -37.723 -12.602 37.737 1.00 21.97 ? 209 SER D OG 1 ATOM 6454 N N . ASN D 2 210 ? -40.208 -13.220 35.148 1.00 19.75 ? 210 ASN D N 1 ATOM 6455 C CA . ASN D 2 210 ? -41.660 -13.052 35.231 1.00 35.26 ? 210 ASN D CA 1 ATOM 6456 C C . ASN D 2 210 ? -42.099 -12.793 36.671 1.00 24.88 ? 210 ASN D C 1 ATOM 6457 O O . ASN D 2 210 ? -43.025 -13.420 37.185 1.00 25.15 ? 210 ASN D O 1 ATOM 6458 C CB . ASN D 2 210 ? -42.384 -14.266 34.641 1.00 39.79 ? 210 ASN D CB 1 ATOM 6459 C CG . ASN D 2 210 ? -42.086 -14.467 33.165 1.00 45.34 ? 210 ASN D CG 1 ATOM 6460 O OD1 . ASN D 2 210 ? -42.587 -13.735 32.311 1.00 52.47 ? 210 ASN D OD1 1 ATOM 6461 N ND2 . ASN D 2 210 ? -41.263 -15.463 32.860 1.00 50.82 ? 210 ASN D ND2 1 ATOM 6462 N N . THR D 2 211 ? -41.418 -11.848 37.325 1.00 18.14 ? 211 THR D N 1 ATOM 6463 C CA . THR D 2 211 ? -41.651 -11.510 38.727 1.00 18.80 ? 211 THR D CA 1 ATOM 6464 C C . THR D 2 211 ? -42.234 -10.103 38.810 1.00 18.66 ? 211 THR D C 1 ATOM 6465 O O . THR D 2 211 ? -41.534 -9.119 38.552 1.00 18.30 ? 211 THR D O 1 ATOM 6466 C CB . THR D 2 211 ? -40.355 -11.604 39.529 1.00 22.81 ? 211 THR D CB 1 ATOM 6467 O OG1 . THR D 2 211 ? -39.863 -12.950 39.497 1.00 27.08 ? 211 THR D OG1 1 ATOM 6468 C CG2 . THR D 2 211 ? -40.588 -11.178 40.967 1.00 15.53 ? 211 THR D CG2 1 ATOM 6469 N N . LYS D 2 212 ? -43.509 -10.009 39.176 1.00 23.51 ? 212 LYS D N 1 ATOM 6470 C CA . LYS D 2 212 ? -44.181 -8.731 39.374 1.00 21.68 ? 212 LYS D CA 1 ATOM 6471 C C . LYS D 2 212 ? -44.494 -8.542 40.853 1.00 25.80 ? 212 LYS D C 1 ATOM 6472 O O . LYS D 2 212 ? -45.024 -9.451 41.501 1.00 17.65 ? 212 LYS D O 1 ATOM 6473 C CB . LYS D 2 212 ? -45.466 -8.651 38.548 1.00 18.94 ? 212 LYS D CB 1 ATOM 6474 C CG . LYS D 2 212 ? -45.259 -8.177 37.122 1.00 19.38 ? 212 LYS D CG 1 ATOM 6475 C CD . LYS D 2 212 ? -46.574 -8.107 36.364 1.00 34.44 ? 212 LYS D CD 1 ATOM 6476 C CE . LYS D 2 212 ? -47.195 -9.485 36.215 1.00 50.04 ? 212 LYS D CE 1 ATOM 6477 N NZ . LYS D 2 212 ? -48.508 -9.424 35.517 1.00 64.43 ? 212 LYS D NZ 1 ATOM 6478 N N . VAL D 2 213 ? -44.166 -7.363 41.383 1.00 20.11 ? 213 VAL D N 1 ATOM 6479 C CA . VAL D 2 213 ? -44.417 -7.026 42.781 1.00 22.86 ? 213 VAL D CA 1 ATOM 6480 C C . VAL D 2 213 ? -44.926 -5.592 42.859 1.00 22.21 ? 213 VAL D C 1 ATOM 6481 O O . VAL D 2 213 ? -44.322 -4.681 42.281 1.00 24.22 ? 213 VAL D O 1 ATOM 6482 C CB . VAL D 2 213 ? -43.154 -7.187 43.653 1.00 24.27 ? 213 VAL D CB 1 ATOM 6483 C CG1 . VAL D 2 213 ? -43.411 -6.659 45.061 1.00 13.62 ? 213 VAL D CG1 1 ATOM 6484 C CG2 . VAL D 2 213 ? -42.711 -8.643 43.704 1.00 21.67 ? 213 VAL D CG2 1 ATOM 6485 N N . ASP D 2 214 ? -46.035 -5.394 43.570 1.00 15.33 ? 214 ASP D N 1 ATOM 6486 C CA . ASP D 2 214 ? -46.539 -4.070 43.922 1.00 16.49 ? 214 ASP D CA 1 ATOM 6487 C C . ASP D 2 214 ? -46.372 -3.878 45.424 1.00 14.58 ? 214 ASP D C 1 ATOM 6488 O O . ASP D 2 214 ? -46.986 -4.601 46.216 1.00 21.52 ? 214 ASP D O 1 ATOM 6489 C CB . ASP D 2 214 ? -48.007 -3.910 43.526 1.00 16.77 ? 214 ASP D CB 1 ATOM 6490 C CG . ASP D 2 214 ? -48.220 -3.969 42.026 1.00 28.60 ? 214 ASP D CG 1 ATOM 6491 O OD1 . ASP D 2 214 ? -47.369 -3.444 41.277 1.00 16.84 ? 214 ASP D OD1 1 ATOM 6492 O OD2 . ASP D 2 214 ? -49.243 -4.542 41.596 1.00 24.43 ? 214 ASP D OD2 1 ATOM 6493 N N . LYS D 2 215 ? -45.552 -2.905 45.814 1.00 20.70 ? 215 LYS D N 1 ATOM 6494 C CA . LYS D 2 215 ? -45.194 -2.686 47.210 1.00 24.63 ? 215 LYS D CA 1 ATOM 6495 C C . LYS D 2 215 ? -45.682 -1.317 47.661 1.00 28.61 ? 215 LYS D C 1 ATOM 6496 O O . LYS D 2 215 ? -45.350 -0.303 47.038 1.00 28.74 ? 215 LYS D O 1 ATOM 6497 C CB . LYS D 2 215 ? -43.676 -2.796 47.403 1.00 26.12 ? 215 LYS D CB 1 ATOM 6498 C CG . LYS D 2 215 ? -43.187 -2.573 48.830 1.00 24.69 ? 215 LYS D CG 1 ATOM 6499 C CD . LYS D 2 215 ? -43.311 -3.828 49.679 1.00 29.79 ? 215 LYS D CD 1 ATOM 6500 C CE . LYS D 2 215 ? -42.778 -3.590 51.085 1.00 32.06 ? 215 LYS D CE 1 ATOM 6501 N NZ . LYS D 2 215 ? -43.485 -4.413 52.111 1.00 35.63 ? 215 LYS D NZ 1 ATOM 6502 N N . ARG D 2 216 ? -46.467 -1.289 48.738 1.00 26.49 ? 216 ARG D N 1 ATOM 6503 C CA . ARG D 2 216 ? -46.840 -0.024 49.352 1.00 21.63 ? 216 ARG D CA 1 ATOM 6504 C C . ARG D 2 216 ? -45.727 0.446 50.277 1.00 17.24 ? 216 ARG D C 1 ATOM 6505 O O . ARG D 2 216 ? -45.148 -0.344 51.028 1.00 17.83 ? 216 ARG D O 1 ATOM 6506 C CB . ARG D 2 216 ? -48.147 -0.141 50.138 1.00 15.13 ? 216 ARG D CB 1 ATOM 6507 C CG . ARG D 2 216 ? -48.572 1.197 50.737 1.00 15.38 ? 216 ARG D CG 1 ATOM 6508 C CD . ARG D 2 216 ? -49.860 1.147 51.535 1.00 24.39 ? 216 ARG D CD 1 ATOM 6509 N NE . ARG D 2 216 ? -50.147 2.462 52.107 1.00 31.73 ? 216 ARG D NE 1 ATOM 6510 C CZ . ARG D 2 216 ? -51.143 2.723 52.948 1.00 32.83 ? 216 ARG D CZ 1 ATOM 6511 N NH1 . ARG D 2 216 ? -51.967 1.758 53.327 1.00 34.89 ? 216 ARG D NH1 1 ATOM 6512 N NH2 . ARG D 2 216 ? -51.313 3.954 53.411 1.00 33.15 ? 216 ARG D NH2 1 ATOM 6513 N N . VAL D 2 217 ? -45.425 1.740 50.213 1.00 12.91 ? 217 VAL D N 1 ATOM 6514 C CA . VAL D 2 217 ? -44.371 2.347 51.017 1.00 12.64 ? 217 VAL D CA 1 ATOM 6515 C C . VAL D 2 217 ? -45.004 3.432 51.873 1.00 22.45 ? 217 VAL D C 1 ATOM 6516 O O . VAL D 2 217 ? -45.572 4.396 51.346 1.00 24.46 ? 217 VAL D O 1 ATOM 6517 C CB . VAL D 2 217 ? -43.245 2.920 50.144 1.00 12.05 ? 217 VAL D CB 1 ATOM 6518 C CG1 . VAL D 2 217 ? -42.120 3.460 51.013 1.00 12.18 ? 217 VAL D CG1 1 ATOM 6519 C CG2 . VAL D 2 217 ? -42.726 1.855 49.200 1.00 11.53 ? 217 VAL D CG2 1 ATOM 6520 N N . GLU D 2 218 ? -44.909 3.273 53.187 1.00 23.62 ? 218 GLU D N 1 ATOM 6521 C CA . GLU D 2 218 ? -45.491 4.208 54.136 1.00 28.97 ? 218 GLU D CA 1 ATOM 6522 C C . GLU D 2 218 ? -44.585 4.267 55.355 1.00 34.51 ? 218 GLU D C 1 ATOM 6523 O O . GLU D 2 218 ? -43.820 3.329 55.607 1.00 44.02 ? 218 GLU D O 1 ATOM 6524 C CB . GLU D 2 218 ? -46.909 3.783 54.538 1.00 23.63 ? 218 GLU D CB 1 ATOM 6525 C CG . GLU D 2 218 ? -46.965 2.467 55.288 1.00 25.09 ? 218 GLU D CG 1 ATOM 6526 C CD . GLU D 2 218 ? -48.344 2.177 55.836 1.00 40.62 ? 218 GLU D CD 1 ATOM 6527 O OE1 . GLU D 2 218 ? -48.734 0.991 55.879 1.00 47.01 ? 218 GLU D OE1 1 ATOM 6528 O OE2 . GLU D 2 218 ? -49.040 3.139 56.221 1.00 57.43 ? 218 GLU D OE2 1 ATOM 6529 N N . PRO D 2 219 ? -44.637 5.355 56.124 1.00 31.96 ? 219 PRO D N 1 ATOM 6530 C CA . PRO D 2 219 ? -43.776 5.447 57.310 1.00 38.82 ? 219 PRO D CA 1 ATOM 6531 C C . PRO D 2 219 ? -44.130 4.378 58.333 1.00 35.29 ? 219 PRO D C 1 ATOM 6532 O O . PRO D 2 219 ? -45.299 4.031 58.521 1.00 24.53 ? 219 PRO D O 1 ATOM 6533 C CB . PRO D 2 219 ? -44.052 6.858 57.843 1.00 39.85 ? 219 PRO D CB 1 ATOM 6534 C CG . PRO D 2 219 ? -45.390 7.217 57.293 1.00 33.50 ? 219 PRO D CG 1 ATOM 6535 C CD . PRO D 2 219 ? -45.449 6.570 55.943 1.00 35.19 ? 219 PRO D CD 1 ATOM 6536 N N . LYS D 2 220 ? -43.100 3.854 58.990 1.00 35.40 ? 220 LYS D N 1 ATOM 6537 C CA . LYS D 2 220 ? -43.263 2.769 59.949 1.00 39.64 ? 220 LYS D CA 1 ATOM 6538 C C . LYS D 2 220 ? -43.499 3.302 61.360 1.00 34.30 ? 220 LYS D C 1 ATOM 6539 O O . LYS D 2 220 ? -43.641 4.510 61.564 1.00 27.90 ? 220 LYS D O 1 ATOM 6540 C CB . LYS D 2 220 ? -42.033 1.859 59.920 1.00 43.87 ? 220 LYS D CB 1 ATOM 6541 C CG . LYS D 2 220 ? -42.017 0.769 60.976 1.00 46.96 ? 220 LYS D CG 1 ATOM 6542 C CD . LYS D 2 220 ? -40.683 0.039 60.957 1.00 48.89 ? 220 LYS D CD 1 ATOM 6543 C CE . LYS D 2 220 ? -40.253 -0.367 62.355 1.00 54.96 ? 220 LYS D CE 1 ATOM 6544 N NZ . LYS D 2 220 ? -38.771 -0.483 62.464 1.00 56.59 ? 220 LYS D NZ 1 HETATM 6545 C C . SC2 E 3 1 ? -15.167 33.913 28.467 1.00 40.60 ? 1 SC2 E C 1 HETATM 6546 C CB . SC2 E 3 1 ? -14.703 31.532 28.030 1.00 47.33 ? 1 SC2 E CB 1 HETATM 6547 C CT . SC2 E 3 1 ? -18.091 32.198 29.009 1.00 69.51 ? 1 SC2 E CT 1 HETATM 6548 C CA . SC2 E 3 1 ? -15.668 32.494 28.721 1.00 48.81 ? 1 SC2 E CA 1 HETATM 6549 N N . SC2 E 3 1 ? -17.026 32.321 28.192 1.00 63.53 ? 1 SC2 E N 1 HETATM 6550 O O . SC2 E 3 1 ? -15.420 34.453 27.368 1.00 51.18 ? 1 SC2 E O 1 HETATM 6551 O OT . SC2 E 3 1 ? -18.031 32.280 30.237 1.00 68.84 ? 1 SC2 E OT 1 HETATM 6552 C CM . SC2 E 3 1 ? -19.427 31.944 28.314 1.00 67.67 ? 1 SC2 E CM 1 HETATM 6553 S SG . SC2 E 3 1 ? -14.979 29.778 28.468 1.00 56.45 ? 1 SC2 E SG 1 ATOM 6554 N N . GLN E 3 2 ? -14.475 34.497 29.440 1.00 36.69 ? 2 GLN E N 1 ATOM 6555 C CA . GLN E 3 2 ? -13.852 35.799 29.248 1.00 34.73 ? 2 GLN E CA 1 ATOM 6556 C C . GLN E 3 2 ? -12.344 35.730 29.457 1.00 34.83 ? 2 GLN E C 1 ATOM 6557 O O . GLN E 3 2 ? -11.856 35.003 30.328 1.00 20.05 ? 2 GLN E O 1 ATOM 6558 C CB . GLN E 3 2 ? -14.454 36.842 30.188 1.00 32.28 ? 2 GLN E CB 1 ATOM 6559 C CG . GLN E 3 2 ? -15.684 37.528 29.629 1.00 44.43 ? 2 GLN E CG 1 ATOM 6560 C CD . GLN E 3 2 ? -15.833 38.950 30.130 1.00 60.74 ? 2 GLN E CD 1 ATOM 6561 O OE1 . GLN E 3 2 ? -16.510 39.773 29.507 1.00 63.42 ? 2 GLN E OE1 1 ATOM 6562 N NE2 . GLN E 3 2 ? -15.193 39.252 31.258 1.00 64.50 ? 2 GLN E NE2 1 ATOM 6563 N N . PHE E 3 3 ? -11.617 36.489 28.643 1.00 35.05 ? 3 PHE E N 1 ATOM 6564 C CA . PHE E 3 3 ? -10.167 36.547 28.754 1.00 24.82 ? 3 PHE E CA 1 ATOM 6565 C C . PHE E 3 3 ? -9.756 37.265 30.034 1.00 20.70 ? 3 PHE E C 1 ATOM 6566 O O . PHE E 3 3 ? -10.363 38.267 30.425 1.00 24.74 ? 3 PHE E O 1 ATOM 6567 C CB . PHE E 3 3 ? -9.586 37.255 27.534 1.00 15.99 ? 3 PHE E CB 1 ATOM 6568 C CG . PHE E 3 3 ? -8.091 37.383 27.556 1.00 14.74 ? 3 PHE E CG 1 ATOM 6569 C CD1 . PHE E 3 3 ? -7.286 36.287 27.312 1.00 13.63 ? 3 PHE E CD1 1 ATOM 6570 C CD2 . PHE E 3 3 ? -7.490 38.607 27.799 1.00 23.97 ? 3 PHE E CD2 1 ATOM 6571 C CE1 . PHE E 3 3 ? -5.914 36.405 27.321 1.00 15.53 ? 3 PHE E CE1 1 ATOM 6572 C CE2 . PHE E 3 3 ? -6.114 38.729 27.809 1.00 18.57 ? 3 PHE E CE2 1 ATOM 6573 C CZ . PHE E 3 3 ? -5.327 37.626 27.569 1.00 15.68 ? 3 PHE E CZ 1 ATOM 6574 N N . ASP E 3 4 ? -8.717 36.746 30.687 1.00 17.03 ? 4 ASP E N 1 ATOM 6575 C CA . ASP E 3 4 ? -8.239 37.266 31.962 1.00 22.58 ? 4 ASP E CA 1 ATOM 6576 C C . ASP E 3 4 ? -6.890 37.938 31.743 1.00 27.23 ? 4 ASP E C 1 ATOM 6577 O O . ASP E 3 4 ? -5.927 37.280 31.336 1.00 32.83 ? 4 ASP E O 1 ATOM 6578 C CB . ASP E 3 4 ? -8.135 36.144 32.996 1.00 31.37 ? 4 ASP E CB 1 ATOM 6579 C CG . ASP E 3 4 ? -7.732 36.641 34.369 1.00 34.56 ? 4 ASP E CG 1 ATOM 6580 O OD1 . ASP E 3 4 ? -7.736 37.868 34.586 1.00 39.10 ? 4 ASP E OD1 1 ATOM 6581 O OD2 . ASP E 3 4 ? -7.426 35.798 35.238 1.00 39.08 ? 4 ASP E OD2 1 ATOM 6582 N N . LEU E 3 5 ? -6.820 39.243 32.031 1.00 29.78 ? 5 LEU E N 1 ATOM 6583 C CA . LEU E 3 5 ? -5.586 39.994 31.809 1.00 24.80 ? 5 LEU E CA 1 ATOM 6584 C C . LEU E 3 5 ? -4.475 39.553 32.753 1.00 24.23 ? 5 LEU E C 1 ATOM 6585 O O . LEU E 3 5 ? -3.289 39.701 32.430 1.00 25.89 ? 5 LEU E O 1 ATOM 6586 C CB . LEU E 3 5 ? -5.845 41.490 31.975 1.00 19.89 ? 5 LEU E CB 1 ATOM 6587 C CG . LEU E 3 5 ? -6.844 42.108 31.002 1.00 22.04 ? 5 LEU E CG 1 ATOM 6588 C CD1 . LEU E 3 5 ? -7.205 43.513 31.446 1.00 23.33 ? 5 LEU E CD1 1 ATOM 6589 C CD2 . LEU E 3 5 ? -6.266 42.132 29.605 1.00 20.95 ? 5 LEU E CD2 1 ATOM 6590 N N . SER E 3 6 ? -4.833 38.996 33.911 1.00 26.37 ? 6 SER E N 1 ATOM 6591 C CA . SER E 3 6 ? -3.820 38.596 34.883 1.00 29.98 ? 6 SER E CA 1 ATOM 6592 C C . SER E 3 6 ? -3.092 37.321 34.463 1.00 26.70 ? 6 SER E C 1 ATOM 6593 O O . SER E 3 6 ? -1.861 37.238 34.568 1.00 40.62 ? 6 SER E O 1 ATOM 6594 C CB . SER E 3 6 ? -4.462 38.409 36.258 1.00 34.51 ? 6 SER E CB 1 ATOM 6595 O OG . SER E 3 6 ? -5.036 39.618 36.723 1.00 34.18 ? 6 SER E OG 1 ATOM 6596 N N . THR E 3 7 ? -3.828 36.322 33.977 1.00 29.74 ? 7 THR E N 1 ATOM 6597 C CA . THR E 3 7 ? -3.250 35.035 33.607 1.00 31.50 ? 7 THR E CA 1 ATOM 6598 C C . THR E 3 7 ? -3.088 34.847 32.104 1.00 25.99 ? 7 THR E C 1 ATOM 6599 O O . THR E 3 7 ? -2.490 33.849 31.684 1.00 22.09 ? 7 THR E O 1 ATOM 6600 C CB . THR E 3 7 ? -4.113 33.892 34.152 1.00 37.84 ? 7 THR E CB 1 ATOM 6601 O OG1 . THR E 3 7 ? -5.397 33.927 33.516 1.00 39.61 ? 7 THR E OG1 1 ATOM 6602 C CG2 . THR E 3 7 ? -4.293 34.037 35.658 1.00 35.71 ? 7 THR E CG2 1 ATOM 6603 N N . ARG E 3 8 ? -3.606 35.767 31.293 1.00 21.60 ? 8 ARG E N 1 ATOM 6604 C CA . ARG E 3 8 ? -3.631 35.625 29.836 1.00 22.84 ? 8 ARG E CA 1 ATOM 6605 C C . ARG E 3 8 ? -4.329 34.339 29.400 1.00 28.67 ? 8 ARG E C 1 ATOM 6606 O O . ARG E 3 8 ? -4.055 33.806 28.323 1.00 31.21 ? 8 ARG E O 1 ATOM 6607 C CB . ARG E 3 8 ? -2.223 35.700 29.237 1.00 19.67 ? 8 ARG E CB 1 ATOM 6608 C CG . ARG E 3 8 ? -1.501 37.010 29.522 1.00 15.99 ? 8 ARG E CG 1 ATOM 6609 C CD . ARG E 3 8 ? -0.318 37.228 28.585 1.00 25.55 ? 8 ARG E CD 1 ATOM 6610 N NE . ARG E 3 8 ? 0.400 38.460 28.903 1.00 37.60 ? 8 ARG E NE 1 ATOM 6611 C CZ . ARG E 3 8 ? 1.391 38.961 28.171 1.00 27.86 ? 8 ARG E CZ 1 ATOM 6612 N NH1 . ARG E 3 8 ? 1.782 38.335 27.070 1.00 28.42 ? 8 ARG E NH1 1 ATOM 6613 N NH2 . ARG E 3 8 ? 1.987 40.092 28.537 1.00 24.34 ? 8 ARG E NH2 1 ATOM 6614 N N . ARG E 3 9 ? -5.240 33.837 30.226 1.00 14.42 ? 9 ARG E N 1 ATOM 6615 C CA . ARG E 3 9 ? -5.996 32.634 29.929 1.00 15.02 ? 9 ARG E CA 1 ATOM 6616 C C . ARG E 3 9 ? -7.482 32.951 29.958 1.00 29.76 ? 9 ARG E C 1 ATOM 6617 O O . ARG E 3 9 ? -7.916 33.958 30.527 1.00 21.97 ? 9 ARG E O 1 ATOM 6618 C CB . ARG E 3 9 ? -5.685 31.515 30.930 1.00 21.70 ? 9 ARG E CB 1 ATOM 6619 C CG . ARG E 3 9 ? -4.271 30.978 30.848 1.00 21.38 ? 9 ARG E CG 1 ATOM 6620 C CD . ARG E 3 9 ? -4.041 30.228 29.549 1.00 20.93 ? 9 ARG E CD 1 ATOM 6621 N NE . ARG E 3 9 ? -5.067 29.218 29.334 1.00 24.30 ? 9 ARG E NE 1 ATOM 6622 C CZ . ARG E 3 9 ? -5.090 28.041 29.945 1.00 31.55 ? 9 ARG E CZ 1 ATOM 6623 N NH1 . ARG E 3 9 ? -4.140 27.723 30.817 1.00 20.79 ? 9 ARG E NH1 1 ATOM 6624 N NH2 . ARG E 3 9 ? -6.066 27.184 29.685 1.00 36.09 ? 9 ARG E NH2 1 ATOM 6625 N N . LEU E 3 10 ? -8.263 32.079 29.332 1.00 18.28 ? 10 LEU E N 1 ATOM 6626 C CA . LEU E 3 10 ? -9.710 32.231 29.329 1.00 17.53 ? 10 LEU E CA 1 ATOM 6627 C C . LEU E 3 10 ? -10.277 31.758 30.659 1.00 21.51 ? 10 LEU E C 1 ATOM 6628 O O . LEU E 3 10 ? -9.890 30.707 31.174 1.00 21.82 ? 10 LEU E O 1 ATOM 6629 C CB . LEU E 3 10 ? -10.336 31.452 28.173 1.00 17.86 ? 10 LEU E CB 1 ATOM 6630 C CG . LEU E 3 10 ? -10.161 32.068 26.783 1.00 19.14 ? 10 LEU E CG 1 ATOM 6631 C CD1 . LEU E 3 10 ? -10.581 31.087 25.701 1.00 24.63 ? 10 LEU E CD1 1 ATOM 6632 C CD2 . LEU E 3 10 ? -10.965 33.344 26.683 1.00 17.40 ? 10 LEU E CD2 1 ATOM 6633 N N . LYS E 3 11 ? -11.182 32.542 31.219 1.00 27.55 ? 11 LYS E N 1 ATOM 6634 C CA . LYS E 3 11 ? -11.822 32.206 32.482 1.00 32.57 ? 11 LYS E CA 1 ATOM 6635 C C . LYS E 3 11 ? -13.304 31.983 32.264 1.00 36.99 ? 11 LYS E C 1 ATOM 6636 O O . LYS E 3 11 ? -14.004 32.858 31.757 1.00 30.56 ? 11 LYS E O 1 ATOM 6637 C CB . LYS E 3 11 ? -11.594 33.317 33.514 1.00 42.44 ? 11 LYS E CB 1 ATOM 6638 C CG . LYS E 3 11 ? -11.488 32.821 34.944 1.00 50.72 ? 11 LYS E CG 1 ATOM 6639 C CD . LYS E 3 11 ? -11.333 33.986 35.915 1.00 55.42 ? 11 LYS E CD 1 ATOM 6640 C CE . LYS E 3 11 ? -10.583 33.548 37.168 1.00 64.07 ? 11 LYS E CE 1 ATOM 6641 N NZ . LYS E 3 11 ? -9.163 33.205 36.859 1.00 61.84 ? 11 LYS E NZ 1 HETATM 6642 C C . SC2 F 3 1 ? -17.283 5.800 26.251 1.00 51.09 ? 1 SC2 F C 1 HETATM 6643 C CB . SC2 F 3 1 ? -17.905 8.223 26.130 1.00 54.61 ? 1 SC2 F CB 1 HETATM 6644 C CT . SC2 F 3 1 ? -15.118 7.728 24.895 1.00 74.65 ? 1 SC2 F CT 1 HETATM 6645 C CA . SC2 F 3 1 ? -16.861 7.224 26.646 1.00 57.51 ? 1 SC2 F CA 1 HETATM 6646 N N . SC2 F 3 1 ? -15.506 7.584 26.186 1.00 67.92 ? 1 SC2 F N 1 HETATM 6647 O O . SC2 F 3 1 ? -16.758 5.255 25.254 1.00 49.81 ? 1 SC2 F O 1 HETATM 6648 O OT . SC2 F 3 1 ? -15.850 7.553 23.919 1.00 82.36 ? 1 SC2 F OT 1 HETATM 6649 C CM . SC2 F 3 1 ? -13.658 8.141 24.707 1.00 70.40 ? 1 SC2 F CM 1 HETATM 6650 S SG . SC2 F 3 1 ? -18.003 9.719 27.172 1.00 61.10 ? 1 SC2 F SG 1 ATOM 6651 N N . GLN F 3 2 ? -18.208 5.213 27.009 1.00 47.86 ? 2 GLN F N 1 ATOM 6652 C CA . GLN F 3 2 ? -18.745 3.890 26.686 1.00 43.71 ? 2 GLN F CA 1 ATOM 6653 C C . GLN F 3 2 ? -20.251 3.841 26.886 1.00 36.34 ? 2 GLN F C 1 ATOM 6654 O O . GLN F 3 2 ? -20.816 4.635 27.644 1.00 29.75 ? 2 GLN F O 1 ATOM 6655 C CB . GLN F 3 2 ? -18.071 2.811 27.528 1.00 46.26 ? 2 GLN F CB 1 ATOM 6656 C CG . GLN F 3 2 ? -16.826 2.235 26.879 1.00 51.33 ? 2 GLN F CG 1 ATOM 6657 C CD . GLN F 3 2 ? -16.697 0.744 27.104 1.00 55.81 ? 2 GLN F CD 1 ATOM 6658 O OE1 . GLN F 3 2 ? -17.392 0.172 27.943 1.00 63.19 ? 2 GLN F OE1 1 ATOM 6659 N NE2 . GLN F 3 2 ? -15.813 0.103 26.346 1.00 51.19 ? 2 GLN F NE2 1 ATOM 6660 N N . PHE F 3 3 ? -20.891 2.898 26.198 1.00 35.17 ? 3 PHE F N 1 ATOM 6661 C CA . PHE F 3 3 ? -22.341 2.762 26.224 1.00 26.80 ? 3 PHE F CA 1 ATOM 6662 C C . PHE F 3 3 ? -22.781 1.904 27.405 1.00 29.51 ? 3 PHE F C 1 ATOM 6663 O O . PHE F 3 3 ? -22.210 0.838 27.659 1.00 34.35 ? 3 PHE F O 1 ATOM 6664 C CB . PHE F 3 3 ? -22.845 2.157 24.914 1.00 20.69 ? 3 PHE F CB 1 ATOM 6665 C CG . PHE F 3 3 ? -24.336 1.991 24.856 1.00 24.11 ? 3 PHE F CG 1 ATOM 6666 C CD1 . PHE F 3 3 ? -25.163 3.099 24.775 1.00 18.31 ? 3 PHE F CD1 1 ATOM 6667 C CD2 . PHE F 3 3 ? -24.911 0.730 24.875 1.00 26.26 ? 3 PHE F CD2 1 ATOM 6668 C CE1 . PHE F 3 3 ? -26.534 2.956 24.718 1.00 17.43 ? 3 PHE F CE1 1 ATOM 6669 C CE2 . PHE F 3 3 ? -26.285 0.582 24.820 1.00 20.53 ? 3 PHE F CE2 1 ATOM 6670 C CZ . PHE F 3 3 ? -27.096 1.697 24.743 1.00 19.73 ? 3 PHE F CZ 1 ATOM 6671 N N . ASP F 3 4 ? -23.803 2.374 28.115 1.00 23.71 ? 4 ASP F N 1 ATOM 6672 C CA . ASP F 3 4 ? -24.332 1.716 29.302 1.00 25.51 ? 4 ASP F CA 1 ATOM 6673 C C . ASP F 3 4 ? -25.667 1.071 28.953 1.00 22.36 ? 4 ASP F C 1 ATOM 6674 O O . ASP F 3 4 ? -26.603 1.760 28.530 1.00 26.41 ? 4 ASP F O 1 ATOM 6675 C CB . ASP F 3 4 ? -24.494 2.720 30.445 1.00 38.20 ? 4 ASP F CB 1 ATOM 6676 C CG . ASP F 3 4 ? -24.747 2.055 31.784 1.00 40.72 ? 4 ASP F CG 1 ATOM 6677 O OD1 . ASP F 3 4 ? -25.390 0.986 31.820 1.00 41.61 ? 4 ASP F OD1 1 ATOM 6678 O OD2 . ASP F 3 4 ? -24.303 2.610 32.808 1.00 48.57 ? 4 ASP F OD2 1 ATOM 6679 N N . LEU F 3 5 ? -25.757 -0.247 29.152 1.00 27.22 ? 5 LEU F N 1 ATOM 6680 C CA . LEU F 3 5 ? -27.002 -0.952 28.869 1.00 33.75 ? 5 LEU F CA 1 ATOM 6681 C C . LEU F 3 5 ? -28.087 -0.615 29.885 1.00 39.95 ? 5 LEU F C 1 ATOM 6682 O O . LEU F 3 5 ? -29.279 -0.684 29.562 1.00 45.97 ? 5 LEU F O 1 ATOM 6683 C CB . LEU F 3 5 ? -26.756 -2.461 28.840 1.00 33.48 ? 5 LEU F CB 1 ATOM 6684 C CG . LEU F 3 5 ? -25.770 -2.986 27.795 1.00 33.16 ? 5 LEU F CG 1 ATOM 6685 C CD1 . LEU F 3 5 ? -25.598 -4.482 27.939 1.00 28.69 ? 5 LEU F CD1 1 ATOM 6686 C CD2 . LEU F 3 5 ? -26.239 -2.639 26.394 1.00 37.08 ? 5 LEU F CD2 1 ATOM 6687 N N . SER F 3 6 ? -27.699 -0.247 31.107 1.00 47.13 ? 6 SER F N 1 ATOM 6688 C CA . SER F 3 6 ? -28.684 0.051 32.144 1.00 47.92 ? 6 SER F CA 1 ATOM 6689 C C . SER F 3 6 ? -29.449 1.334 31.837 1.00 43.02 ? 6 SER F C 1 ATOM 6690 O O . SER F 3 6 ? -30.649 1.433 32.123 1.00 49.27 ? 6 SER F O 1 ATOM 6691 C CB . SER F 3 6 ? -27.989 0.157 33.503 1.00 58.67 ? 6 SER F CB 1 ATOM 6692 O OG . SER F 3 6 ? -26.958 -0.810 33.633 1.00 61.42 ? 6 SER F OG 1 ATOM 6693 N N . THR F 3 7 ? -28.777 2.327 31.255 1.00 35.98 ? 7 THR F N 1 ATOM 6694 C CA . THR F 3 7 ? -29.377 3.630 31.013 1.00 35.01 ? 7 THR F CA 1 ATOM 6695 C C . THR F 3 7 ? -29.507 3.998 29.543 1.00 29.58 ? 7 THR F C 1 ATOM 6696 O O . THR F 3 7 ? -30.124 5.025 29.238 1.00 31.90 ? 7 THR F O 1 ATOM 6697 C CB . THR F 3 7 ? -28.569 4.730 31.721 1.00 33.10 ? 7 THR F CB 1 ATOM 6698 O OG1 . THR F 3 7 ? -27.195 4.656 31.318 1.00 31.53 ? 7 THR F OG1 1 ATOM 6699 C CG2 . THR F 3 7 ? -28.653 4.555 33.222 1.00 32.37 ? 7 THR F CG2 1 ATOM 6700 N N . ARG F 3 8 ? -28.955 3.200 28.629 1.00 20.14 ? 8 ARG F N 1 ATOM 6701 C CA . ARG F 3 8 ? -28.945 3.526 27.202 1.00 24.24 ? 8 ARG F CA 1 ATOM 6702 C C . ARG F 3 8 ? -28.332 4.901 26.951 1.00 25.52 ? 8 ARG F C 1 ATOM 6703 O O . ARG F 3 8 ? -28.697 5.599 26.002 1.00 25.94 ? 8 ARG F O 1 ATOM 6704 C CB . ARG F 3 8 ? -30.349 3.436 26.590 1.00 22.19 ? 8 ARG F CB 1 ATOM 6705 C CG . ARG F 3 8 ? -31.021 2.081 26.778 1.00 31.60 ? 8 ARG F CG 1 ATOM 6706 C CD . ARG F 3 8 ? -32.131 1.843 25.757 1.00 34.03 ? 8 ARG F CD 1 ATOM 6707 N NE . ARG F 3 8 ? -32.919 0.653 26.082 1.00 34.79 ? 8 ARG F NE 1 ATOM 6708 C CZ . ARG F 3 8 ? -33.893 0.165 25.321 1.00 33.43 ? 8 ARG F CZ 1 ATOM 6709 N NH1 . ARG F 3 8 ? -34.205 0.758 24.175 1.00 32.97 ? 8 ARG F NH1 1 ATOM 6710 N NH2 . ARG F 3 8 ? -34.555 -0.918 25.703 1.00 20.87 ? 8 ARG F NH2 1 ATOM 6711 N N . ARG F 3 9 ? -27.386 5.294 27.802 1.00 19.48 ? 9 ARG F N 1 ATOM 6712 C CA . ARG F 3 9 ? -26.690 6.563 27.666 1.00 26.98 ? 9 ARG F CA 1 ATOM 6713 C C . ARG F 3 9 ? -25.186 6.334 27.691 1.00 32.35 ? 9 ARG F C 1 ATOM 6714 O O . ARG F 3 9 ? -24.700 5.329 28.218 1.00 21.48 ? 9 ARG F O 1 ATOM 6715 C CB . ARG F 3 9 ? -27.095 7.537 28.775 1.00 23.22 ? 9 ARG F CB 1 ATOM 6716 C CG . ARG F 3 9 ? -28.520 8.036 28.653 1.00 23.18 ? 9 ARG F CG 1 ATOM 6717 C CD . ARG F 3 9 ? -28.687 8.889 27.414 1.00 26.74 ? 9 ARG F CD 1 ATOM 6718 N NE . ARG F 3 9 ? -27.732 9.991 27.391 1.00 23.26 ? 9 ARG F NE 1 ATOM 6719 C CZ . ARG F 3 9 ? -27.883 11.122 28.074 1.00 26.89 ? 9 ARG F CZ 1 ATOM 6720 N NH1 . ARG F 3 9 ? -28.955 11.302 28.839 1.00 25.78 ? 9 ARG F NH1 1 ATOM 6721 N NH2 . ARG F 3 9 ? -26.957 12.072 27.998 1.00 34.30 ? 9 ARG F NH2 1 ATOM 6722 N N . LEU F 3 10 ? -24.452 7.275 27.104 1.00 21.13 ? 10 LEU F N 1 ATOM 6723 C CA . LEU F 3 10 ? -23.000 7.201 27.116 1.00 22.50 ? 10 LEU F CA 1 ATOM 6724 C C . LEU F 3 10 ? -22.473 7.533 28.503 1.00 35.37 ? 10 LEU F C 1 ATOM 6725 O O . LEU F 3 10 ? -22.894 8.515 29.124 1.00 40.35 ? 10 LEU F O 1 ATOM 6726 C CB . LEU F 3 10 ? -22.408 8.152 26.078 1.00 33.39 ? 10 LEU F CB 1 ATOM 6727 C CG . LEU F 3 10 ? -22.587 7.747 24.613 1.00 24.15 ? 10 LEU F CG 1 ATOM 6728 C CD1 . LEU F 3 10 ? -21.992 8.793 23.695 1.00 22.53 ? 10 LEU F CD1 1 ATOM 6729 C CD2 . LEU F 3 10 ? -21.975 6.377 24.346 1.00 21.56 ? 10 LEU F CD2 1 ATOM 6730 N N . LYS F 3 11 ? -21.558 6.705 28.990 1.00 32.46 ? 11 LYS F N 1 ATOM 6731 C CA . LYS F 3 11 ? -20.909 6.933 30.271 1.00 28.38 ? 11 LYS F CA 1 ATOM 6732 C C . LYS F 3 11 ? -19.476 7.385 30.040 1.00 41.55 ? 11 LYS F C 1 ATOM 6733 O O . LYS F 3 11 ? -18.711 6.704 29.357 1.00 42.72 ? 11 LYS F O 1 ATOM 6734 C CB . LYS F 3 11 ? -20.938 5.660 31.117 1.00 46.48 ? 11 LYS F CB 1 ATOM 6735 C CG . LYS F 3 11 ? -19.890 5.598 32.213 1.00 54.47 ? 11 LYS F CG 1 ATOM 6736 C CD . LYS F 3 11 ? -19.637 4.156 32.637 1.00 60.23 ? 11 LYS F CD 1 ATOM 6737 C CE . LYS F 3 11 ? -20.929 3.476 33.065 1.00 61.14 ? 11 LYS F CE 1 ATOM 6738 N NZ . LYS F 3 11 ? -20.748 2.010 33.253 1.00 63.96 ? 11 LYS F NZ 1 HETATM 6739 C C1 . NAG G 4 . ? -15.676 50.284 23.927 1.00 68.02 ? 301 NAG B C1 1 HETATM 6740 C C2 . NAG G 4 . ? -15.923 49.068 23.006 1.00 75.23 ? 301 NAG B C2 1 HETATM 6741 C C3 . NAG G 4 . ? -16.514 49.492 21.654 1.00 76.64 ? 301 NAG B C3 1 HETATM 6742 C C4 . NAG G 4 . ? -17.684 50.454 21.842 1.00 76.57 ? 301 NAG B C4 1 HETATM 6743 C C5 . NAG G 4 . ? -17.237 51.598 22.741 1.00 78.17 ? 301 NAG B C5 1 HETATM 6744 C C6 . NAG G 4 . ? -18.301 52.630 23.009 1.00 82.68 ? 301 NAG B C6 1 HETATM 6745 C C7 . NAG G 4 . ? -14.336 47.235 23.484 1.00 66.28 ? 301 NAG B C7 1 HETATM 6746 C C8 . NAG G 4 . ? -15.359 46.703 24.451 1.00 62.33 ? 301 NAG B C8 1 HETATM 6747 N N2 . NAG G 4 . ? -14.670 48.343 22.811 1.00 75.89 ? 301 NAG B N2 1 HETATM 6748 O O3 . NAG G 4 . ? -16.951 48.338 20.948 1.00 75.33 ? 301 NAG B O3 1 HETATM 6749 O O4 . NAG G 4 . ? -18.121 50.969 20.588 1.00 73.44 ? 301 NAG B O4 1 HETATM 6750 O O5 . NAG G 4 . ? -16.852 51.063 24.010 1.00 72.99 ? 301 NAG B O5 1 HETATM 6751 O O6 . NAG G 4 . ? -17.702 53.884 23.309 1.00 85.57 ? 301 NAG B O6 1 HETATM 6752 O O7 . NAG G 4 . ? -13.253 46.683 23.318 1.00 62.52 ? 301 NAG B O7 1 HETATM 6753 C C1 . NAG H 4 . ? -16.571 -9.560 20.359 1.00 67.34 ? 301 NAG D C1 1 HETATM 6754 C C2 . NAG H 4 . ? -16.277 -8.196 19.696 1.00 73.31 ? 301 NAG D C2 1 HETATM 6755 C C3 . NAG H 4 . ? -15.546 -8.350 18.355 1.00 72.00 ? 301 NAG D C3 1 HETATM 6756 C C4 . NAG H 4 . ? -14.435 -9.391 18.413 1.00 72.03 ? 301 NAG D C4 1 HETATM 6757 C C5 . NAG H 4 . ? -14.929 -10.661 19.081 1.00 74.04 ? 301 NAG D C5 1 HETATM 6758 C C6 . NAG H 4 . ? -13.843 -11.692 19.269 1.00 78.20 ? 301 NAG D C6 1 HETATM 6759 C C7 . NAG H 4 . ? -17.941 -6.459 20.300 1.00 76.62 ? 301 NAG D C7 1 HETATM 6760 C C8 . NAG H 4 . ? -17.027 -6.072 21.431 1.00 76.66 ? 301 NAG D C8 1 HETATM 6761 N N2 . NAG H 4 . ? -17.527 -7.459 19.510 1.00 73.52 ? 301 NAG D N2 1 HETATM 6762 O O3 . NAG H 4 . ? -14.937 -7.105 18.047 1.00 74.93 ? 301 NAG D O3 1 HETATM 6763 O O4 . NAG H 4 . ? -14.006 -9.689 17.087 1.00 73.56 ? 301 NAG D O4 1 HETATM 6764 O O5 . NAG H 4 . ? -15.406 -10.330 20.386 1.00 71.32 ? 301 NAG D O5 1 HETATM 6765 O O6 . NAG H 4 . ? -14.391 -12.996 19.396 1.00 77.67 ? 301 NAG D O6 1 HETATM 6766 O O7 . NAG H 4 . ? -19.015 -5.891 20.112 1.00 80.75 ? 301 NAG D O7 1 HETATM 6767 N N . CY3 I 5 . ? -13.776 30.802 32.643 1.00 47.88 ? 101 CY3 E N 1 HETATM 6768 C CA . CY3 I 5 . ? -15.195 30.455 32.465 1.00 54.53 ? 101 CY3 E CA 1 HETATM 6769 C C . CY3 I 5 . ? -15.867 30.288 33.828 1.00 60.43 ? 101 CY3 E C 1 HETATM 6770 O O . CY3 I 5 . ? -15.218 29.934 34.814 1.00 65.05 ? 101 CY3 E O 1 HETATM 6771 C CB . CY3 I 5 . ? -15.321 29.166 31.657 1.00 56.51 ? 101 CY3 E CB 1 HETATM 6772 S SG . CY3 I 5 . ? -14.195 29.153 30.211 1.00 58.84 ? 101 CY3 E SG 1 HETATM 6773 N N1 . CY3 I 5 . ? -17.172 30.561 33.846 1.00 62.05 ? 101 CY3 E N1 1 HETATM 6774 N N . CY3 J 5 . ? -19.112 8.535 30.596 1.00 52.74 ? 101 CY3 F N 1 HETATM 6775 C CA . CY3 J 5 . ? -17.758 9.063 30.412 1.00 54.72 ? 101 CY3 F CA 1 HETATM 6776 C C . CY3 J 5 . ? -17.059 9.115 31.766 1.00 49.95 ? 101 CY3 F C 1 HETATM 6777 O O . CY3 J 5 . ? -17.695 9.301 32.803 1.00 60.18 ? 101 CY3 F O 1 HETATM 6778 C CB . CY3 J 5 . ? -17.816 10.458 29.794 1.00 62.21 ? 101 CY3 F CB 1 HETATM 6779 S SG . CY3 J 5 . ? -19.156 10.614 28.554 1.00 68.02 ? 101 CY3 F SG 1 HETATM 6780 N N1 . CY3 J 5 . ? -15.748 8.915 31.716 1.00 41.84 ? 101 CY3 F N1 1 HETATM 6781 O O . HOH K 6 . ? -10.288 18.360 60.161 1.00 46.30 ? 301 HOH A O 1 HETATM 6782 O O . HOH K 6 . ? 0.269 27.352 73.034 1.00 44.29 ? 302 HOH A O 1 HETATM 6783 O O . HOH K 6 . ? 11.886 39.731 57.182 1.00 39.26 ? 303 HOH A O 1 HETATM 6784 O O . HOH K 6 . ? -20.164 37.396 6.574 1.00 30.70 ? 304 HOH A O 1 HETATM 6785 O O . HOH K 6 . ? -7.693 38.147 51.841 1.00 30.91 ? 305 HOH A O 1 HETATM 6786 O O . HOH K 6 . ? -13.500 28.110 49.700 1.00 28.85 ? 306 HOH A O 1 HETATM 6787 O O . HOH K 6 . ? -6.593 32.691 26.266 1.00 39.72 ? 307 HOH A O 1 HETATM 6788 O O . HOH K 6 . ? 7.559 27.072 15.927 1.00 28.92 ? 308 HOH A O 1 HETATM 6789 O O . HOH K 6 . ? -5.548 26.349 33.883 1.00 29.23 ? 309 HOH A O 1 HETATM 6790 O O . HOH K 6 . ? -0.908 26.549 33.151 1.00 31.15 ? 310 HOH A O 1 HETATM 6791 O O . HOH K 6 . ? -10.981 46.036 67.078 1.00 30.04 ? 311 HOH A O 1 HETATM 6792 O O . HOH K 6 . ? -7.957 26.986 -0.552 1.00 31.01 ? 312 HOH A O 1 HETATM 6793 O O . HOH K 6 . ? -11.525 12.243 25.271 1.00 40.11 ? 313 HOH A O 1 HETATM 6794 O O . HOH K 6 . ? -1.065 26.932 29.604 1.00 25.88 ? 314 HOH A O 1 HETATM 6795 O O . HOH K 6 . ? 6.703 26.790 19.446 1.00 35.06 ? 315 HOH A O 1 HETATM 6796 O O . HOH K 6 . ? 1.686 31.009 24.594 1.00 16.84 ? 316 HOH A O 1 HETATM 6797 O O . HOH K 6 . ? 0.923 36.233 55.950 1.00 14.31 ? 317 HOH A O 1 HETATM 6798 O O . HOH K 6 . ? 2.379 28.095 23.618 1.00 36.61 ? 318 HOH A O 1 HETATM 6799 O O . HOH K 6 . ? 2.525 38.901 56.542 1.00 36.02 ? 319 HOH A O 1 HETATM 6800 O O . HOH K 6 . ? -14.576 36.561 15.101 1.00 25.92 ? 320 HOH A O 1 HETATM 6801 O O . HOH K 6 . ? 2.148 22.061 23.566 1.00 28.45 ? 321 HOH A O 1 HETATM 6802 O O . HOH K 6 . ? -6.658 39.455 50.226 1.00 27.03 ? 322 HOH A O 1 HETATM 6803 O O . HOH K 6 . ? -8.075 24.169 10.314 1.00 44.34 ? 323 HOH A O 1 HETATM 6804 O O . HOH K 6 . ? -11.196 39.356 15.876 1.00 21.99 ? 324 HOH A O 1 HETATM 6805 O O . HOH K 6 . ? -14.573 30.735 56.431 1.00 23.52 ? 325 HOH A O 1 HETATM 6806 O O . HOH K 6 . ? -10.489 43.033 61.013 1.00 38.04 ? 326 HOH A O 1 HETATM 6807 O O . HOH K 6 . ? 2.378 19.969 13.310 1.00 30.13 ? 327 HOH A O 1 HETATM 6808 O O . HOH K 6 . ? -0.712 24.866 39.672 1.00 29.48 ? 328 HOH A O 1 HETATM 6809 O O . HOH K 6 . ? 2.280 22.663 12.430 1.00 30.55 ? 329 HOH A O 1 HETATM 6810 O O . HOH K 6 . ? -12.216 25.667 19.041 1.00 36.87 ? 330 HOH A O 1 HETATM 6811 O O . HOH K 6 . ? -12.029 25.875 44.139 1.00 16.04 ? 331 HOH A O 1 HETATM 6812 O O . HOH K 6 . ? -16.299 19.582 55.445 1.00 18.21 ? 332 HOH A O 1 HETATM 6813 O O . HOH K 6 . ? -13.142 18.407 46.029 1.00 24.68 ? 333 HOH A O 1 HETATM 6814 O O . HOH K 6 . ? -9.183 37.678 -0.184 1.00 24.01 ? 334 HOH A O 1 HETATM 6815 O O . HOH K 6 . ? -0.310 23.029 41.219 1.00 27.42 ? 335 HOH A O 1 HETATM 6816 O O . HOH K 6 . ? -14.738 35.819 52.026 1.00 20.25 ? 336 HOH A O 1 HETATM 6817 O O . HOH K 6 . ? -7.197 24.127 32.456 1.00 38.90 ? 337 HOH A O 1 HETATM 6818 O O . HOH K 6 . ? -2.556 24.829 71.276 1.00 34.11 ? 338 HOH A O 1 HETATM 6819 O O . HOH K 6 . ? -13.718 22.965 55.097 1.00 35.51 ? 339 HOH A O 1 HETATM 6820 O O . HOH K 6 . ? -18.801 28.335 66.800 1.00 27.65 ? 340 HOH A O 1 HETATM 6821 O O . HOH K 6 . ? -5.505 36.441 72.902 1.00 27.06 ? 341 HOH A O 1 HETATM 6822 O O . HOH K 6 . ? -6.398 42.610 8.169 1.00 32.97 ? 342 HOH A O 1 HETATM 6823 O O . HOH K 6 . ? -7.569 27.637 37.142 1.00 29.64 ? 343 HOH A O 1 HETATM 6824 O O . HOH K 6 . ? -13.725 31.679 53.592 1.00 11.80 ? 344 HOH A O 1 HETATM 6825 O O . HOH K 6 . ? 0.044 17.284 47.055 1.00 25.34 ? 345 HOH A O 1 HETATM 6826 O O . HOH K 6 . ? -20.626 32.056 1.898 1.00 22.33 ? 346 HOH A O 1 HETATM 6827 O O . HOH K 6 . ? -9.290 48.707 69.166 1.00 27.87 ? 347 HOH A O 1 HETATM 6828 O O . HOH K 6 . ? -16.269 20.352 57.809 1.00 19.57 ? 348 HOH A O 1 HETATM 6829 O O . HOH K 6 . ? 2.378 21.100 5.484 1.00 29.00 ? 349 HOH A O 1 HETATM 6830 O O . HOH K 6 . ? -15.052 22.610 32.537 1.00 37.57 ? 350 HOH A O 1 HETATM 6831 O O . HOH K 6 . ? -15.130 17.822 26.892 1.00 18.78 ? 351 HOH A O 1 HETATM 6832 O O . HOH K 6 . ? -16.978 20.002 47.902 1.00 32.81 ? 352 HOH A O 1 HETATM 6833 O O . HOH K 6 . ? -0.639 45.864 55.331 1.00 34.27 ? 353 HOH A O 1 HETATM 6834 O O . HOH K 6 . ? 5.284 29.356 15.757 1.00 27.02 ? 354 HOH A O 1 HETATM 6835 O O . HOH K 6 . ? -15.134 17.235 44.572 1.00 30.40 ? 355 HOH A O 1 HETATM 6836 O O . HOH K 6 . ? -13.208 16.945 20.663 1.00 38.19 ? 356 HOH A O 1 HETATM 6837 O O . HOH K 6 . ? -16.260 33.766 53.372 1.00 21.24 ? 357 HOH A O 1 HETATM 6838 O O . HOH K 6 . ? -18.067 23.838 5.017 1.00 30.47 ? 358 HOH A O 1 HETATM 6839 O O . HOH K 6 . ? 5.246 21.796 43.000 1.00 32.05 ? 359 HOH A O 1 HETATM 6840 O O . HOH K 6 . ? -12.405 35.099 46.325 1.00 18.95 ? 360 HOH A O 1 HETATM 6841 O O . HOH K 6 . ? -16.764 27.163 -1.131 1.00 27.96 ? 361 HOH A O 1 HETATM 6842 O O . HOH K 6 . ? -14.003 26.515 -0.022 1.00 32.87 ? 362 HOH A O 1 HETATM 6843 O O . HOH K 6 . ? -0.522 29.075 0.931 1.00 12.70 ? 363 HOH A O 1 HETATM 6844 O O . HOH K 6 . ? 2.016 38.657 34.686 1.00 39.59 ? 364 HOH A O 1 HETATM 6845 O O . HOH K 6 . ? -13.991 34.890 48.196 1.00 31.10 ? 365 HOH A O 1 HETATM 6846 O O . HOH K 6 . ? -14.696 18.883 48.392 1.00 31.80 ? 366 HOH A O 1 HETATM 6847 O O . HOH K 6 . ? 1.208 26.082 31.536 1.00 27.29 ? 367 HOH A O 1 HETATM 6848 O O . HOH K 6 . ? -16.648 18.591 29.311 1.00 25.83 ? 368 HOH A O 1 HETATM 6849 O O . HOH K 6 . ? -2.714 23.530 73.089 1.00 26.17 ? 369 HOH A O 1 HETATM 6850 O O . HOH L 6 . ? -3.268 59.105 17.012 1.00 38.84 ? 401 HOH B O 1 HETATM 6851 O O . HOH L 6 . ? -4.231 45.199 6.049 1.00 25.70 ? 402 HOH B O 1 HETATM 6852 O O . HOH L 6 . ? -1.236 47.779 33.807 1.00 32.03 ? 403 HOH B O 1 HETATM 6853 O O . HOH L 6 . ? 4.780 50.680 26.764 1.00 33.45 ? 404 HOH B O 1 HETATM 6854 O O . HOH L 6 . ? 18.286 37.475 43.681 1.00 41.24 ? 405 HOH B O 1 HETATM 6855 O O . HOH L 6 . ? 11.108 52.524 5.213 1.00 36.81 ? 406 HOH B O 1 HETATM 6856 O O . HOH L 6 . ? 2.680 40.931 7.129 1.00 29.52 ? 407 HOH B O 1 HETATM 6857 O O . HOH L 6 . ? -9.291 43.143 22.261 1.00 32.61 ? 408 HOH B O 1 HETATM 6858 O O . HOH L 6 . ? 18.027 43.060 37.879 1.00 34.98 ? 409 HOH B O 1 HETATM 6859 O O . HOH L 6 . ? 5.241 24.007 45.198 1.00 29.62 ? 410 HOH B O 1 HETATM 6860 O O . HOH L 6 . ? 5.673 35.316 57.634 1.00 29.73 ? 411 HOH B O 1 HETATM 6861 O O . HOH L 6 . ? 4.366 32.078 17.105 1.00 30.48 ? 412 HOH B O 1 HETATM 6862 O O . HOH L 6 . ? -9.555 41.823 14.697 1.00 26.01 ? 413 HOH B O 1 HETATM 6863 O O . HOH L 6 . ? 3.405 59.197 10.038 1.00 38.82 ? 414 HOH B O 1 HETATM 6864 O O . HOH L 6 . ? 16.844 29.787 54.007 1.00 30.00 ? 415 HOH B O 1 HETATM 6865 O O . HOH L 6 . ? 0.636 46.596 52.495 1.00 30.38 ? 416 HOH B O 1 HETATM 6866 O O . HOH L 6 . ? 12.913 49.765 43.582 1.00 38.59 ? 417 HOH B O 1 HETATM 6867 O O . HOH L 6 . ? 21.197 29.366 48.221 1.00 47.10 ? 418 HOH B O 1 HETATM 6868 O O . HOH L 6 . ? -0.637 58.998 28.449 1.00 25.89 ? 419 HOH B O 1 HETATM 6869 O O . HOH L 6 . ? 0.896 39.818 38.178 1.00 22.02 ? 420 HOH B O 1 HETATM 6870 O O . HOH L 6 . ? 15.330 37.899 57.885 1.00 27.36 ? 421 HOH B O 1 HETATM 6871 O O . HOH L 6 . ? -3.222 34.955 5.939 1.00 23.83 ? 422 HOH B O 1 HETATM 6872 O O . HOH L 6 . ? -10.489 36.363 21.165 1.00 24.61 ? 423 HOH B O 1 HETATM 6873 O O . HOH L 6 . ? 16.404 31.834 53.494 1.00 37.70 ? 424 HOH B O 1 HETATM 6874 O O . HOH L 6 . ? 9.426 37.680 19.826 1.00 17.65 ? 425 HOH B O 1 HETATM 6875 O O . HOH L 6 . ? 4.785 40.989 8.094 1.00 20.69 ? 426 HOH B O 1 HETATM 6876 O O . HOH L 6 . ? -12.590 50.356 22.502 1.00 29.77 ? 427 HOH B O 1 HETATM 6877 O O . HOH L 6 . ? -12.065 52.675 18.874 1.00 22.51 ? 428 HOH B O 1 HETATM 6878 O O . HOH L 6 . ? -1.818 48.697 2.138 1.00 33.51 ? 429 HOH B O 1 HETATM 6879 O O . HOH L 6 . ? 0.101 18.666 54.907 1.00 19.86 ? 430 HOH B O 1 HETATM 6880 O O . HOH L 6 . ? 13.565 42.580 41.947 1.00 34.95 ? 431 HOH B O 1 HETATM 6881 O O . HOH L 6 . ? 16.835 58.433 13.298 1.00 34.90 ? 432 HOH B O 1 HETATM 6882 O O . HOH L 6 . ? 12.536 32.417 66.524 1.00 14.23 ? 433 HOH B O 1 HETATM 6883 O O . HOH L 6 . ? 3.635 30.315 38.970 1.00 33.79 ? 434 HOH B O 1 HETATM 6884 O O . HOH L 6 . ? 10.193 39.662 23.872 1.00 25.88 ? 435 HOH B O 1 HETATM 6885 O O . HOH L 6 . ? -3.156 55.002 6.642 1.00 16.68 ? 436 HOH B O 1 HETATM 6886 O O . HOH L 6 . ? -2.466 35.277 46.631 1.00 41.76 ? 437 HOH B O 1 HETATM 6887 O O . HOH L 6 . ? 5.527 44.461 3.670 1.00 35.70 ? 438 HOH B O 1 HETATM 6888 O O . HOH L 6 . ? -9.681 40.042 41.327 1.00 24.35 ? 439 HOH B O 1 HETATM 6889 O O . HOH L 6 . ? -4.645 46.540 36.215 1.00 26.45 ? 440 HOH B O 1 HETATM 6890 O O . HOH L 6 . ? 2.861 43.692 30.462 1.00 18.82 ? 441 HOH B O 1 HETATM 6891 O O . HOH L 6 . ? 5.557 44.557 36.106 1.00 33.33 ? 442 HOH B O 1 HETATM 6892 O O . HOH L 6 . ? -1.514 38.079 38.382 1.00 23.02 ? 443 HOH B O 1 HETATM 6893 O O . HOH L 6 . ? -5.753 45.582 53.775 1.00 33.50 ? 444 HOH B O 1 HETATM 6894 O O . HOH L 6 . ? -13.712 47.905 19.845 1.00 35.65 ? 445 HOH B O 1 HETATM 6895 O O . HOH L 6 . ? 7.221 34.650 19.123 1.00 25.95 ? 446 HOH B O 1 HETATM 6896 O O . HOH L 6 . ? 15.029 37.679 37.751 1.00 25.99 ? 447 HOH B O 1 HETATM 6897 O O . HOH L 6 . ? 5.548 36.290 37.725 1.00 11.24 ? 448 HOH B O 1 HETATM 6898 O O . HOH L 6 . ? 19.121 42.395 14.114 1.00 22.79 ? 449 HOH B O 1 HETATM 6899 O O . HOH L 6 . ? -6.269 51.833 5.005 1.00 39.33 ? 450 HOH B O 1 HETATM 6900 O O . HOH L 6 . ? -2.447 44.019 2.260 1.00 45.30 ? 451 HOH B O 1 HETATM 6901 O O . HOH L 6 . ? -0.849 42.922 1.780 1.00 39.72 ? 452 HOH B O 1 HETATM 6902 O O . HOH L 6 . ? 19.196 39.427 45.812 1.00 11.49 ? 453 HOH B O 1 HETATM 6903 O O . HOH L 6 . ? 11.994 47.600 35.495 1.00 26.53 ? 454 HOH B O 1 HETATM 6904 O O . HOH L 6 . ? 11.767 48.706 37.154 1.00 25.36 ? 455 HOH B O 1 HETATM 6905 O O . HOH L 6 . ? -13.375 50.801 19.583 1.00 32.27 ? 456 HOH B O 1 HETATM 6906 O O . HOH L 6 . ? 12.630 50.360 46.175 1.00 38.70 ? 457 HOH B O 1 HETATM 6907 O O . HOH L 6 . ? 4.515 33.589 37.260 1.00 35.27 ? 458 HOH B O 1 HETATM 6908 O O . HOH L 6 . ? 0.669 37.457 38.427 1.00 25.59 ? 459 HOH B O 1 HETATM 6909 O O . HOH M 6 . ? -34.910 17.712 22.396 1.00 44.39 ? 301 HOH C O 1 HETATM 6910 O O . HOH M 6 . ? -23.699 -0.959 49.286 1.00 32.25 ? 302 HOH C O 1 HETATM 6911 O O . HOH M 6 . ? -19.427 -8.129 58.918 1.00 35.68 ? 303 HOH C O 1 HETATM 6912 O O . HOH M 6 . ? -27.884 24.092 10.348 1.00 31.35 ? 304 HOH C O 1 HETATM 6913 O O . HOH M 6 . ? -31.480 13.042 38.016 1.00 38.22 ? 305 HOH C O 1 HETATM 6914 O O . HOH M 6 . ? -14.868 21.163 6.034 1.00 23.08 ? 306 HOH C O 1 HETATM 6915 O O . HOH M 6 . ? -25.760 16.892 8.428 1.00 25.77 ? 307 HOH C O 1 HETATM 6916 O O . HOH M 6 . ? -18.627 2.199 53.260 1.00 18.09 ? 308 HOH C O 1 HETATM 6917 O O . HOH M 6 . ? -10.768 15.773 6.753 1.00 33.26 ? 309 HOH C O 1 HETATM 6918 O O . HOH M 6 . ? -32.585 15.476 39.698 1.00 38.87 ? 310 HOH C O 1 HETATM 6919 O O . HOH M 6 . ? -27.231 13.036 31.506 1.00 45.98 ? 311 HOH C O 1 HETATM 6920 O O . HOH M 6 . ? -39.266 18.749 11.229 1.00 31.42 ? 312 HOH C O 1 HETATM 6921 O O . HOH M 6 . ? -32.135 12.262 28.233 1.00 49.14 ? 313 HOH C O 1 HETATM 6922 O O . HOH M 6 . ? -31.751 21.095 8.349 1.00 22.96 ? 314 HOH C O 1 HETATM 6923 O O . HOH M 6 . ? -13.278 20.283 9.325 1.00 32.10 ? 315 HOH C O 1 HETATM 6924 O O . HOH M 6 . ? -34.444 -2.926 54.094 1.00 18.63 ? 316 HOH C O 1 HETATM 6925 O O . HOH M 6 . ? -20.545 -4.408 55.560 1.00 22.37 ? 317 HOH C O 1 HETATM 6926 O O . HOH M 6 . ? -26.046 6.550 24.060 1.00 34.34 ? 318 HOH C O 1 HETATM 6927 O O . HOH M 6 . ? -35.376 11.012 21.733 1.00 20.99 ? 319 HOH C O 1 HETATM 6928 O O . HOH M 6 . ? -25.676 -12.290 57.789 1.00 23.96 ? 320 HOH C O 1 HETATM 6929 O O . HOH M 6 . ? -24.766 9.226 -1.873 1.00 27.38 ? 321 HOH C O 1 HETATM 6930 O O . HOH M 6 . ? -35.964 17.507 11.157 1.00 23.91 ? 322 HOH C O 1 HETATM 6931 O O . HOH M 6 . ? -23.941 3.934 21.327 1.00 25.11 ? 323 HOH C O 1 HETATM 6932 O O . HOH M 6 . ? -12.750 9.495 10.600 1.00 17.07 ? 324 HOH C O 1 HETATM 6933 O O . HOH M 6 . ? -17.221 10.650 20.069 1.00 35.41 ? 325 HOH C O 1 HETATM 6934 O O . HOH M 6 . ? -24.988 11.000 35.068 1.00 50.34 ? 326 HOH C O 1 HETATM 6935 O O . HOH M 6 . ? -22.075 4.234 18.527 1.00 29.66 ? 327 HOH C O 1 HETATM 6936 O O . HOH M 6 . ? -18.528 20.722 17.126 1.00 44.09 ? 328 HOH C O 1 HETATM 6937 O O . HOH M 6 . ? -15.274 19.349 17.571 1.00 21.12 ? 329 HOH C O 1 HETATM 6938 O O . HOH M 6 . ? -32.032 20.043 46.126 1.00 13.21 ? 330 HOH C O 1 HETATM 6939 O O . HOH M 6 . ? -34.499 8.671 22.746 1.00 19.68 ? 331 HOH C O 1 HETATM 6940 O O . HOH M 6 . ? -22.439 17.743 59.229 1.00 34.63 ? 332 HOH C O 1 HETATM 6941 O O . HOH M 6 . ? -12.774 11.226 0.021 1.00 34.15 ? 333 HOH C O 1 HETATM 6942 O O . HOH M 6 . ? -33.251 0.463 53.273 1.00 23.90 ? 334 HOH C O 1 HETATM 6943 O O . HOH M 6 . ? -21.822 1.140 12.971 1.00 30.78 ? 335 HOH C O 1 HETATM 6944 O O . HOH M 6 . ? -37.027 7.971 15.062 1.00 23.39 ? 336 HOH C O 1 HETATM 6945 O O . HOH M 6 . ? -30.947 24.828 13.875 1.00 34.51 ? 337 HOH C O 1 HETATM 6946 O O . HOH M 6 . ? -25.528 -11.638 60.380 1.00 26.62 ? 338 HOH C O 1 HETATM 6947 O O . HOH M 6 . ? -25.571 15.454 -2.514 1.00 27.19 ? 339 HOH C O 1 HETATM 6948 O O . HOH M 6 . ? -33.247 -11.322 65.491 1.00 31.19 ? 340 HOH C O 1 HETATM 6949 O O . HOH M 6 . ? -22.477 18.296 34.518 1.00 31.29 ? 341 HOH C O 1 HETATM 6950 O O . HOH M 6 . ? -25.769 22.726 10.676 1.00 32.14 ? 342 HOH C O 1 HETATM 6951 O O . HOH M 6 . ? -35.846 19.800 12.404 1.00 25.58 ? 343 HOH C O 1 HETATM 6952 O O . HOH M 6 . ? -16.652 18.781 3.936 1.00 25.16 ? 344 HOH C O 1 HETATM 6953 O O . HOH M 6 . ? -21.209 -5.893 57.399 1.00 12.26 ? 345 HOH C O 1 HETATM 6954 O O . HOH M 6 . ? -17.608 20.296 26.108 1.00 35.56 ? 346 HOH C O 1 HETATM 6955 O O . HOH M 6 . ? -33.673 0.922 29.558 1.00 22.03 ? 347 HOH C O 1 HETATM 6956 O O . HOH M 6 . ? -15.812 14.449 59.788 1.00 34.98 ? 348 HOH C O 1 HETATM 6957 O O . HOH M 6 . ? -25.763 -9.291 66.733 1.00 19.47 ? 349 HOH C O 1 HETATM 6958 O O . HOH M 6 . ? -20.938 -10.481 60.427 1.00 30.56 ? 350 HOH C O 1 HETATM 6959 O O . HOH M 6 . ? -34.396 14.565 55.532 1.00 22.07 ? 351 HOH C O 1 HETATM 6960 O O . HOH M 6 . ? -34.032 11.575 56.223 1.00 21.56 ? 352 HOH C O 1 HETATM 6961 O O . HOH M 6 . ? -37.966 15.947 42.281 1.00 38.73 ? 353 HOH C O 1 HETATM 6962 O O . HOH M 6 . ? -34.125 -1.277 62.789 1.00 35.50 ? 354 HOH C O 1 HETATM 6963 O O . HOH M 6 . ? -21.191 14.960 17.355 1.00 18.38 ? 355 HOH C O 1 HETATM 6964 O O . HOH M 6 . ? -39.367 -1.957 58.931 1.00 47.31 ? 356 HOH C O 1 HETATM 6965 O O . HOH M 6 . ? -18.081 10.366 44.036 1.00 39.01 ? 357 HOH C O 1 HETATM 6966 O O . HOH M 6 . ? -16.000 8.493 16.757 1.00 18.21 ? 358 HOH C O 1 HETATM 6967 O O . HOH M 6 . ? -19.983 2.829 43.656 1.00 22.32 ? 359 HOH C O 1 HETATM 6968 O O . HOH M 6 . ? -37.942 14.909 33.576 1.00 41.84 ? 360 HOH C O 1 HETATM 6969 O O . HOH M 6 . ? -38.395 10.798 13.989 1.00 27.78 ? 361 HOH C O 1 HETATM 6970 O O . HOH M 6 . ? -27.015 -12.835 54.331 1.00 42.14 ? 362 HOH C O 1 HETATM 6971 O O . HOH M 6 . ? -33.927 7.954 65.248 1.00 32.72 ? 363 HOH C O 1 HETATM 6972 O O . HOH M 6 . ? -31.065 -8.932 51.349 1.00 17.95 ? 364 HOH C O 1 HETATM 6973 O O . HOH M 6 . ? -15.380 7.954 52.361 1.00 18.16 ? 365 HOH C O 1 HETATM 6974 O O . HOH M 6 . ? -16.669 1.940 11.299 1.00 42.63 ? 366 HOH C O 1 HETATM 6975 O O . HOH M 6 . ? -21.343 18.189 36.459 1.00 19.93 ? 367 HOH C O 1 HETATM 6976 O O . HOH M 6 . ? -24.966 11.588 -1.573 1.00 29.36 ? 368 HOH C O 1 HETATM 6977 O O . HOH M 6 . ? -30.182 18.384 53.204 1.00 26.44 ? 369 HOH C O 1 HETATM 6978 O O . HOH M 6 . ? -15.250 3.348 50.328 1.00 21.43 ? 370 HOH C O 1 HETATM 6979 O O . HOH M 6 . ? -26.385 18.941 59.324 1.00 47.73 ? 371 HOH C O 1 HETATM 6980 O O . HOH M 6 . ? -17.509 3.792 12.191 1.00 32.55 ? 372 HOH C O 1 HETATM 6981 O O . HOH M 6 . ? -16.214 17.134 54.933 1.00 29.69 ? 373 HOH C O 1 HETATM 6982 O O . HOH M 6 . ? -33.284 26.322 41.195 1.00 32.16 ? 374 HOH C O 1 HETATM 6983 O O . HOH M 6 . ? -12.431 4.640 50.345 1.00 19.94 ? 375 HOH C O 1 HETATM 6984 O O . HOH M 6 . ? -41.649 -4.710 55.675 1.00 29.37 ? 376 HOH C O 1 HETATM 6985 O O . HOH M 6 . ? -40.871 -3.411 57.439 1.00 19.20 ? 377 HOH C O 1 HETATM 6986 O O . HOH M 6 . ? -29.211 -2.786 72.050 1.00 39.72 ? 378 HOH C O 1 HETATM 6987 O O . HOH M 6 . ? -14.018 6.004 52.849 1.00 39.40 ? 379 HOH C O 1 HETATM 6988 O O . HOH M 6 . ? -35.025 12.794 -0.617 1.00 25.07 ? 380 HOH C O 1 HETATM 6989 O O . HOH M 6 . ? -33.220 18.009 53.768 1.00 28.46 ? 381 HOH C O 1 HETATM 6990 O O . HOH M 6 . ? -33.698 12.406 29.157 1.00 46.11 ? 382 HOH C O 1 HETATM 6991 O O . HOH M 6 . ? -16.764 -2.389 67.138 1.00 35.00 ? 383 HOH C O 1 HETATM 6992 O O . HOH M 6 . ? -25.785 -7.820 69.105 1.00 34.28 ? 384 HOH C O 1 HETATM 6993 O O . HOH M 6 . ? -27.333 -12.745 61.495 1.00 19.83 ? 385 HOH C O 1 HETATM 6994 O O . HOH M 6 . ? -31.571 -12.471 66.514 1.00 36.16 ? 386 HOH C O 1 HETATM 6995 O O . HOH M 6 . ? -20.911 -10.932 62.738 1.00 38.10 ? 387 HOH C O 1 HETATM 6996 O O . HOH M 6 . ? -24.832 18.454 61.089 1.00 28.87 ? 388 HOH C O 1 HETATM 6997 O O . HOH M 6 . ? -31.250 -1.902 71.896 1.00 26.72 ? 389 HOH C O 1 HETATM 6998 O O . HOH M 6 . ? -10.742 9.042 0.469 1.00 32.09 ? 390 HOH C O 1 HETATM 6999 O O . HOH M 6 . ? -37.210 8.275 24.153 1.00 31.46 ? 391 HOH C O 1 HETATM 7000 O O . HOH M 6 . ? -14.516 5.057 48.332 1.00 27.96 ? 392 HOH C O 1 HETATM 7001 O O . HOH N 6 . ? -43.339 1.411 55.626 1.00 35.55 ? 401 HOH D O 1 HETATM 7002 O O . HOH N 6 . ? -32.472 -2.055 35.010 1.00 30.31 ? 402 HOH D O 1 HETATM 7003 O O . HOH N 6 . ? -30.792 -9.115 30.345 1.00 40.32 ? 403 HOH D O 1 HETATM 7004 O O . HOH N 6 . ? -38.880 4.652 36.970 1.00 21.44 ? 404 HOH D O 1 HETATM 7005 O O . HOH N 6 . ? -26.934 -3.817 32.893 1.00 39.26 ? 405 HOH D O 1 HETATM 7006 O O . HOH N 6 . ? -19.448 -13.002 19.866 1.00 28.98 ? 406 HOH D O 1 HETATM 7007 O O . HOH N 6 . ? -49.192 -17.233 6.405 1.00 36.86 ? 407 HOH D O 1 HETATM 7008 O O . HOH N 6 . ? -29.596 5.786 3.419 1.00 28.01 ? 408 HOH D O 1 HETATM 7009 O O . HOH N 6 . ? -42.900 -1.699 36.354 1.00 28.75 ? 409 HOH D O 1 HETATM 7010 O O . HOH N 6 . ? -49.304 -5.314 9.929 1.00 33.29 ? 410 HOH D O 1 HETATM 7011 O O . HOH N 6 . ? -18.540 -7.378 16.173 1.00 22.78 ? 411 HOH D O 1 HETATM 7012 O O . HOH N 6 . ? -22.513 -3.310 19.140 1.00 20.26 ? 412 HOH D O 1 HETATM 7013 O O . HOH N 6 . ? -29.132 -13.791 1.938 1.00 10.55 ? 413 HOH D O 1 HETATM 7014 O O . HOH N 6 . ? -49.277 -11.599 34.146 1.00 33.06 ? 414 HOH D O 1 HETATM 7015 O O . HOH N 6 . ? -37.799 -3.440 0.470 1.00 24.75 ? 415 HOH D O 1 HETATM 7016 O O . HOH N 6 . ? -37.690 -6.361 32.762 1.00 28.00 ? 416 HOH D O 1 HETATM 7017 O O . HOH N 6 . ? -45.985 -4.927 39.331 1.00 27.62 ? 417 HOH D O 1 HETATM 7018 O O . HOH N 6 . ? -25.999 -8.089 49.742 1.00 19.43 ? 418 HOH D O 1 HETATM 7019 O O . HOH N 6 . ? -44.074 -4.495 -2.403 1.00 26.91 ? 419 HOH D O 1 HETATM 7020 O O . HOH N 6 . ? -32.370 -9.586 49.659 1.00 25.89 ? 420 HOH D O 1 HETATM 7021 O O . HOH N 6 . ? -30.719 -19.434 30.060 1.00 39.00 ? 421 HOH D O 1 HETATM 7022 O O . HOH N 6 . ? -48.601 -18.700 9.235 1.00 38.06 ? 422 HOH D O 1 HETATM 7023 O O . HOH N 6 . ? -35.038 -0.998 52.559 1.00 27.44 ? 423 HOH D O 1 HETATM 7024 O O . HOH N 6 . ? -48.475 4.642 50.999 1.00 26.27 ? 424 HOH D O 1 HETATM 7025 O O . HOH N 6 . ? -33.343 -16.390 23.059 1.00 29.82 ? 425 HOH D O 1 HETATM 7026 O O . HOH N 6 . ? -27.716 -7.755 32.898 1.00 10.78 ? 426 HOH D O 1 HETATM 7027 O O . HOH N 6 . ? -42.154 2.816 16.732 1.00 43.76 ? 427 HOH D O 1 HETATM 7028 O O . HOH N 6 . ? -35.708 -0.413 4.142 1.00 31.65 ? 428 HOH D O 1 HETATM 7029 O O . HOH N 6 . ? -34.137 -14.948 31.224 1.00 39.97 ? 429 HOH D O 1 HETATM 7030 O O . HOH N 6 . ? -35.168 -4.928 27.355 1.00 26.74 ? 430 HOH D O 1 HETATM 7031 O O . HOH N 6 . ? -43.548 -9.384 19.796 1.00 23.36 ? 431 HOH D O 1 HETATM 7032 O O . HOH N 6 . ? -42.416 5.441 1.880 1.00 23.49 ? 432 HOH D O 1 HETATM 7033 O O . HOH N 6 . ? -47.757 -0.811 3.898 1.00 31.17 ? 433 HOH D O 1 HETATM 7034 O O . HOH N 6 . ? -42.829 -15.380 18.908 1.00 23.57 ? 434 HOH D O 1 HETATM 7035 O O . HOH N 6 . ? -19.420 -11.743 15.324 1.00 25.86 ? 435 HOH D O 1 HETATM 7036 O O . HOH N 6 . ? -20.516 -6.012 25.119 1.00 28.05 ? 436 HOH D O 1 HETATM 7037 O O . HOH N 6 . ? -31.429 -13.766 0.514 1.00 23.69 ? 437 HOH D O 1 HETATM 7038 O O . HOH N 6 . ? -38.758 5.163 17.065 1.00 31.87 ? 438 HOH D O 1 HETATM 7039 O O . HOH N 6 . ? -31.854 -19.244 34.160 1.00 35.54 ? 439 HOH D O 1 HETATM 7040 O O . HOH N 6 . ? -22.040 -10.274 30.078 1.00 20.47 ? 440 HOH D O 1 HETATM 7041 O O . HOH N 6 . ? -47.424 13.218 39.028 1.00 15.03 ? 441 HOH D O 1 HETATM 7042 O O . HOH N 6 . ? -48.142 13.125 36.478 1.00 21.55 ? 442 HOH D O 1 HETATM 7043 O O . HOH N 6 . ? -42.772 -1.241 21.843 1.00 35.27 ? 443 HOH D O 1 HETATM 7044 O O . HOH N 6 . ? -30.769 -7.635 -1.325 1.00 13.01 ? 444 HOH D O 1 HETATM 7045 O O . HOH N 6 . ? -20.497 -2.448 11.412 1.00 31.94 ? 445 HOH D O 1 HETATM 7046 O O . HOH N 6 . ? -42.696 -10.662 25.383 1.00 33.98 ? 446 HOH D O 1 HETATM 7047 O O . HOH N 6 . ? -31.329 0.591 35.493 1.00 32.99 ? 447 HOH D O 1 HETATM 7048 O O . HOH N 6 . ? -30.524 -4.787 -1.365 1.00 32.20 ? 448 HOH D O 1 HETATM 7049 O O . HOH N 6 . ? -51.239 -2.320 7.875 1.00 38.64 ? 449 HOH D O 1 HETATM 7050 O O . HOH N 6 . ? -52.130 -0.071 8.662 1.00 32.55 ? 450 HOH D O 1 HETATM 7051 O O . HOH N 6 . ? -26.605 -5.329 31.649 1.00 36.01 ? 451 HOH D O 1 HETATM 7052 O O . HOH N 6 . ? -47.283 2.505 5.370 1.00 52.54 ? 452 HOH D O 1 HETATM 7053 O O . HOH N 6 . ? -41.596 0.267 56.502 1.00 43.65 ? 453 HOH D O 1 HETATM 7054 O O . HOH N 6 . ? -48.121 1.386 3.310 1.00 39.37 ? 454 HOH D O 1 HETATM 7055 O O . HOH N 6 . ? -45.834 -3.689 36.578 1.00 9.47 ? 455 HOH D O 1 HETATM 7056 O O . HOH O 6 . ? -7.120 25.210 30.577 1.00 27.12 ? 201 HOH E O 1 HETATM 7057 O O . HOH O 6 . ? -0.045 39.474 35.070 1.00 45.39 ? 202 HOH E O 1 HETATM 7058 O O . HOH P 6 . ? -17.918 8.193 22.767 1.00 35.58 ? 201 HOH F O 1 HETATM 7059 O O . HOH P 6 . ? -22.177 0.056 33.701 1.00 34.19 ? 202 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 ? 0.4446 0.5799 0.4757 0.0849 0.0234 0.1229 1 ASP A N 2 C CA . ASP A 1 ? 0.5219 0.6402 0.5435 0.0725 0.0217 0.1050 1 ASP A CA 3 C C . ASP A 1 ? 0.4496 0.5831 0.4771 0.0604 0.0040 0.0989 1 ASP A C 4 O O . ASP A 1 ? 0.4180 0.5734 0.4645 0.0597 -0.0020 0.1072 1 ASP A O 5 C CB . ASP A 1 ? 0.6273 0.7273 0.6540 0.0725 0.0379 0.1003 1 ASP A CB 6 C CG . ASP A 1 ? 0.5208 0.5994 0.5381 0.0810 0.0560 0.1024 1 ASP A CG 7 O OD1 . ASP A 1 ? 0.5657 0.6455 0.5755 0.0891 0.0575 0.1109 1 ASP A OD1 8 O OD2 . ASP A 1 ? 0.2819 0.3416 0.2980 0.0790 0.0687 0.0957 1 ASP A OD2 9 N N . ILE A 2 ? 0.3971 0.5184 0.4089 0.0510 -0.0034 0.0845 2 ILE A N 10 C CA . ILE A 2 ? 0.3558 0.4840 0.3699 0.0387 -0.0182 0.0767 2 ILE A CA 11 C C . ILE A 2 ? 0.3270 0.4478 0.3524 0.0338 -0.0120 0.0724 2 ILE A C 12 O O . ILE A 2 ? 0.1957 0.2963 0.2143 0.0345 -0.0017 0.0649 2 ILE A O 13 C CB . ILE A 2 ? 0.3894 0.5036 0.3814 0.0323 -0.0262 0.0629 2 ILE A CB 14 C CG1 . ILE A 2 ? 0.3384 0.4556 0.3146 0.0383 -0.0288 0.0671 2 ILE A CG1 15 C CG2 . ILE A 2 ? 0.2202 0.3392 0.2123 0.0197 -0.0416 0.0556 2 ILE A CG2 16 C CD1 . ILE A 2 ? 0.2590 0.4020 0.2411 0.0390 -0.0418 0.0786 2 ILE A CD1 17 N N . LEU A 3 ? 0.2356 0.3735 0.2781 0.0284 -0.0184 0.0775 3 LEU A N 18 C CA . LEU A 3 ? 0.2775 0.4084 0.3287 0.0228 -0.0131 0.0742 3 LEU A CA 19 C C . LEU A 3 ? 0.3227 0.4438 0.3641 0.0102 -0.0248 0.0619 3 LEU A C 20 O O . LEU A 3 ? 0.3548 0.4883 0.3980 0.0021 -0.0388 0.0616 3 LEU A O 21 C CB . LEU A 3 ? 0.1870 0.3411 0.2634 0.0239 -0.0109 0.0871 3 LEU A CB 22 C CG . LEU A 3 ? 0.4337 0.5828 0.5187 0.0164 -0.0064 0.0848 3 LEU A CG 23 C CD1 . LEU A 3 ? 0.5030 0.6252 0.5759 0.0200 0.0081 0.0781 3 LEU A CD1 24 C CD2 . LEU A 3 ? 0.4508 0.6258 0.5632 0.0184 -0.0023 0.0987 3 LEU A CD2 25 N N . LEU A 4 ? 0.2406 0.3388 0.2709 0.0085 -0.0194 0.0518 4 LEU A N 26 C CA . LEU A 4 ? 0.2755 0.3604 0.2957 -0.0012 -0.0283 0.0408 4 LEU A CA 27 C C . LEU A 4 ? 0.3454 0.4273 0.3749 -0.0068 -0.0248 0.0426 4 LEU A C 28 O O . LEU A 4 ? 0.5203 0.5926 0.5500 -0.0024 -0.0131 0.0433 4 LEU A O 29 C CB . LEU A 4 ? 0.1911 0.2547 0.1937 0.0017 -0.0255 0.0293 4 LEU A CB 30 C CG . LEU A 4 ? 0.2896 0.3531 0.2805 0.0064 -0.0275 0.0263 4 LEU A CG 31 C CD1 . LEU A 4 ? 0.2718 0.3168 0.2501 0.0089 -0.0229 0.0153 4 LEU A CD1 32 C CD2 . LEU A 4 ? 0.2072 0.2778 0.1918 0.0000 -0.0417 0.0242 4 LEU A CD2 33 N N . THR A 5 ? 0.2881 0.3768 0.3235 -0.0171 -0.0345 0.0431 5 THR A N 34 C CA . THR A 5 ? 0.3242 0.4100 0.3679 -0.0238 -0.0311 0.0456 5 THR A CA 35 C C . THR A 5 ? 0.3426 0.4049 0.3702 -0.0312 -0.0374 0.0349 5 THR A C 36 O O . THR A 5 ? 0.2950 0.3549 0.3161 -0.0386 -0.0491 0.0293 5 THR A O 37 C CB . THR A 5 ? 0.2971 0.4086 0.3625 -0.0310 -0.0357 0.0553 5 THR A CB 38 O OG1 . THR A 5 ? 0.1903 0.3235 0.2723 -0.0213 -0.0281 0.0669 5 THR A OG1 39 C CG2 . THR A 5 ? 0.2014 0.3081 0.2743 -0.0394 -0.0313 0.0577 5 THR A CG2 40 N N . GLN A 6 ? 0.3380 0.3821 0.3577 -0.0288 -0.0297 0.0322 6 GLN A N 41 C CA . GLN A 6 ? 0.2906 0.3114 0.2952 -0.0335 -0.0344 0.0240 6 GLN A CA 42 C C . GLN A 6 ? 0.3076 0.3247 0.3178 -0.0419 -0.0320 0.0293 6 GLN A C 43 O O . GLN A 6 ? 0.4310 0.4522 0.4484 -0.0396 -0.0213 0.0363 6 GLN A O 44 C CB . GLN A 6 ? 0.2110 0.2149 0.2020 -0.0250 -0.0292 0.0177 6 GLN A CB 45 C CG . GLN A 6 ? 0.3447 0.3502 0.3299 -0.0178 -0.0306 0.0116 6 GLN A CG 46 C CD . GLN A 6 ? 0.3270 0.3176 0.3011 -0.0116 -0.0273 0.0045 6 GLN A CD 47 O OE1 . GLN A 6 ? 0.2519 0.2461 0.2266 -0.0054 -0.0207 0.0036 6 GLN A OE1 48 N NE2 . GLN A 6 ? 0.2278 0.2019 0.1921 -0.0135 -0.0321 -0.0004 6 GLN A NE2 49 N N . SER A 7 ? 0.3256 0.3332 0.3313 -0.0520 -0.0407 0.0258 7 SER A N 50 C CA . SER A 7 ? 0.4998 0.5014 0.5097 -0.0617 -0.0380 0.0308 7 SER A CA 51 C C . SER A 7 ? 0.5676 0.5403 0.5591 -0.0668 -0.0442 0.0234 7 SER A C 52 O O . SER A 7 ? 0.6677 0.6319 0.6493 -0.0675 -0.0533 0.0150 7 SER A O 53 C CB . SER A 7 ? 0.5300 0.5563 0.5616 -0.0725 -0.0413 0.0379 7 SER A CB 54 O OG . SER A 7 ? 0.6183 0.6406 0.6452 -0.0830 -0.0542 0.0314 7 SER A OG 55 N N . PRO A 8 ? 0.5962 0.5520 0.5814 -0.0696 -0.0384 0.0270 8 PRO A N 56 C CA . PRO A 8 ? 0.5275 0.4899 0.5201 -0.0680 -0.0261 0.0363 8 PRO A CA 57 C C . PRO A 8 ? 0.5183 0.4764 0.5012 -0.0547 -0.0194 0.0347 8 PRO A C 58 O O . PRO A 8 ? 0.4744 0.4257 0.4469 -0.0473 -0.0247 0.0268 8 PRO A O 59 C CB . PRO A 8 ? 0.5711 0.5107 0.5538 -0.0762 -0.0239 0.0390 8 PRO A CB 60 C CG . PRO A 8 ? 0.5834 0.4975 0.5463 -0.0745 -0.0334 0.0298 8 PRO A CG 61 C CD . PRO A 8 ? 0.6315 0.5577 0.5995 -0.0744 -0.0430 0.0224 8 PRO A CD 62 N N . VAL A 9 ? 0.4410 0.4029 0.4272 -0.0523 -0.0072 0.0418 9 VAL A N 63 C CA . VAL A 9 ? 0.4076 0.3633 0.3824 -0.0417 -0.0007 0.0394 9 VAL A CA 64 C C . VAL A 9 ? 0.3752 0.3045 0.3264 -0.0395 -0.0028 0.0357 9 VAL A C 65 O O . VAL A 9 ? 0.2694 0.1926 0.2091 -0.0316 -0.0029 0.0304 9 VAL A O 66 C CB . VAL A 9 ? 0.3971 0.3642 0.3813 -0.0393 0.0142 0.0475 9 VAL A CB 67 C CG1 . VAL A 9 ? 0.2457 0.2410 0.2551 -0.0394 0.0159 0.0529 9 VAL A CG1 68 C CG2 . VAL A 9 ? 0.5239 0.4811 0.5041 -0.0456 0.0225 0.0546 9 VAL A CG2 69 N N . ILE A 10 ? 0.4078 0.3214 0.3516 -0.0465 -0.0048 0.0385 10 ILE A N 70 C CA . ILE A 10 ? 0.3894 0.2770 0.3099 -0.0435 -0.0078 0.0367 10 ILE A CA 71 C C . ILE A 10 ? 0.3834 0.2553 0.2992 -0.0492 -0.0169 0.0347 10 ILE A C 72 O O . ILE A 10 ? 0.4623 0.3374 0.3889 -0.0600 -0.0164 0.0385 10 ILE A O 73 C CB . ILE A 10 ? 0.4650 0.3417 0.3741 -0.0451 0.0034 0.0445 10 ILE A CB 74 C CG1 . ILE A 10 ? 0.5349 0.4254 0.4488 -0.0407 0.0149 0.0465 10 ILE A CG1 75 C CG2 . ILE A 10 ? 0.3456 0.1967 0.2280 -0.0400 -0.0012 0.0430 10 ILE A CG2 76 C CD1 . ILE A 10 ? 0.6550 0.5416 0.5659 -0.0449 0.0294 0.0557 10 ILE A CD1 77 N N . LEU A 11 ? 0.4091 0.2640 0.3094 -0.0421 -0.0251 0.0288 11 LEU A N 78 C CA . LEU A 11 ? 0.4561 0.2888 0.3468 -0.0450 -0.0321 0.0270 11 LEU A CA 79 C C . LEU A 11 ? 0.4457 0.2534 0.3138 -0.0384 -0.0328 0.0299 11 LEU A C 80 O O . LEU A 11 ? 0.3830 0.1931 0.2430 -0.0286 -0.0337 0.0284 11 LEU A O 81 C CB . LEU A 11 ? 0.5036 0.3386 0.3974 -0.0408 -0.0415 0.0171 11 LEU A CB 82 C CG . LEU A 11 ? 0.5395 0.3901 0.4491 -0.0499 -0.0440 0.0143 11 LEU A CG 83 C CD1 . LEU A 11 ? 0.5566 0.4091 0.4652 -0.0435 -0.0516 0.0042 11 LEU A CD1 84 C CD2 . LEU A 11 ? 0.5510 0.3876 0.4601 -0.0635 -0.0445 0.0175 11 LEU A CD2 85 N N . SER A 12 ? 0.5585 0.3420 0.4161 -0.0441 -0.0327 0.0344 12 SER A N 86 C CA . SER A 12 ? 0.5285 0.2853 0.3626 -0.0376 -0.0334 0.0393 12 SER A CA 87 C C . SER A 12 ? 0.5049 0.2342 0.3298 -0.0389 -0.0387 0.0381 12 SER A C 88 O O . SER A 12 ? 0.6780 0.3965 0.5057 -0.0518 -0.0349 0.0413 12 SER A O 89 C CB . SER A 12 ? 0.5220 0.2722 0.3474 -0.0436 -0.0227 0.0499 12 SER A CB 90 O OG . SER A 12 ? 0.5865 0.3104 0.3860 -0.0365 -0.0240 0.0554 12 SER A OG 91 N N . VAL A 13 ? 0.4604 0.1784 0.2754 -0.0258 -0.0468 0.0335 13 VAL A N 92 C CA . VAL A 13 ? 0.6758 0.3651 0.4807 -0.0239 -0.0511 0.0315 13 VAL A CA 93 C C . VAL A 13 ? 0.5887 0.2572 0.3734 -0.0087 -0.0551 0.0363 13 VAL A C 94 O O . VAL A 13 ? 0.5891 0.2675 0.3677 -0.0013 -0.0559 0.0402 13 VAL A O 95 C CB . VAL A 13 ? 0.6712 0.3691 0.4874 -0.0215 -0.0569 0.0197 13 VAL A CB 96 C CG1 . VAL A 13 ? 0.6893 0.4092 0.5242 -0.0359 -0.0547 0.0159 13 VAL A CG1 97 C CG2 . VAL A 13 ? 0.5534 0.2700 0.3741 -0.0059 -0.0623 0.0142 13 VAL A CG2 98 N N . SER A 14 ? 0.5839 0.2228 0.3573 -0.0039 -0.0579 0.0359 14 SER A N 99 C CA . SER A 14 ? 0.6162 0.2336 0.3713 0.0125 -0.0626 0.0411 14 SER A CA 100 C C . SER A 14 ? 0.6421 0.2640 0.4038 0.0273 -0.0700 0.0321 14 SER A C 101 O O . SER A 14 ? 0.6754 0.3047 0.4498 0.0230 -0.0700 0.0221 14 SER A O 102 C CB . SER A 14 ? 0.6677 0.2427 0.4030 0.0084 -0.0581 0.0496 14 SER A CB 103 O OG . SER A 14 ? 0.7182 0.2896 0.4486 -0.0061 -0.0496 0.0583 14 SER A OG 104 N N . PRO A 15 ? 0.7545 0.3735 0.5081 0.0453 -0.0764 0.0357 15 PRO A N 105 C CA . PRO A 15 ? 0.7429 0.3685 0.5057 0.0607 -0.0823 0.0279 15 PRO A CA 106 C C . PRO A 15 ? 0.6935 0.2877 0.4509 0.0612 -0.0792 0.0235 15 PRO A C 107 O O . PRO A 15 ? 0.6543 0.2130 0.3949 0.0561 -0.0750 0.0298 15 PRO A O 108 C CB . PRO A 15 ? 0.5808 0.2051 0.3336 0.0790 -0.0897 0.0360 15 PRO A CB 109 C CG . PRO A 15 ? 0.5785 0.2099 0.3210 0.0715 -0.0890 0.0444 15 PRO A CG 110 C CD . PRO A 15 ? 0.5856 0.1996 0.3225 0.0525 -0.0790 0.0470 15 PRO A CD 111 N N . GLY A 16 ? 0.6547 0.2608 0.4253 0.0668 -0.0804 0.0122 16 GLY A N 112 C CA . GLY A 16 ? 0.6779 0.2553 0.4426 0.0672 -0.0769 0.0054 16 GLY A CA 113 C C . GLY A 16 ? 0.6885 0.2619 0.4551 0.0458 -0.0723 -0.0018 16 GLY A C 114 O O . GLY A 16 ? 0.7503 0.3078 0.5141 0.0447 -0.0702 -0.0114 16 GLY A O 115 N N . GLU A 17 ? 0.6533 0.2412 0.4245 0.0291 -0.0706 0.0023 17 GLU A N 116 C CA . GLU A 17 ? 0.7445 0.3345 0.5209 0.0085 -0.0677 -0.0035 17 GLU A CA 117 C C . GLU A 17 ? 0.6717 0.2964 0.4654 0.0071 -0.0699 -0.0138 17 GLU A C 118 O O . GLU A 17 ? 0.6023 0.2542 0.4066 0.0184 -0.0723 -0.0148 17 GLU A O 119 C CB . GLU A 17 ? 0.7435 0.3399 0.5217 -0.0076 -0.0641 0.0057 17 GLU A CB 120 C CG . GLU A 17 ? 0.9114 0.4702 0.6709 -0.0112 -0.0598 0.0160 17 GLU A CG 121 C CD . GLU A 17 ? 0.9254 0.4938 0.6882 -0.0263 -0.0545 0.0255 17 GLU A CD 122 O OE1 . GLU A 17 ? 0.8195 0.4236 0.5967 -0.0277 -0.0546 0.0260 17 GLU A OE1 123 O OE2 . GLU A 17 ? 0.8181 0.3576 0.5691 -0.0367 -0.0489 0.0324 17 GLU A OE2 124 N N . ARG A 18 ? 0.6720 0.2949 0.4677 -0.0075 -0.0694 -0.0214 18 ARG A N 125 C CA . ARG A 18 ? 0.6643 0.3178 0.4736 -0.0107 -0.0713 -0.0300 18 ARG A CA 126 C C . ARG A 18 ? 0.6205 0.3052 0.4450 -0.0236 -0.0708 -0.0246 18 ARG A C 127 O O . ARG A 18 ? 0.6127 0.2910 0.4367 -0.0366 -0.0685 -0.0175 18 ARG A O 128 C CB . ARG A 18 ? 0.6902 0.3260 0.4912 -0.0196 -0.0720 -0.0411 18 ARG A CB 129 C CG . ARG A 18 ? 0.7798 0.4436 0.5903 -0.0221 -0.0742 -0.0500 18 ARG A CG 130 C CD . ARG A 18 ? 0.9237 0.5632 0.7191 -0.0255 -0.0747 -0.0623 18 ARG A CD 131 N NE . ARG A 18 ? 1.0412 0.7039 0.8416 -0.0346 -0.0779 -0.0696 18 ARG A NE 132 C CZ . ARG A 18 ? 1.0787 0.7572 0.8810 -0.0242 -0.0771 -0.0762 18 ARG A CZ 133 N NH1 . ARG A 18 ? 1.1110 0.7873 0.9139 -0.0047 -0.0733 -0.0770 18 ARG A NH1 134 N NH2 . ARG A 18 ? 0.9911 0.6888 0.7951 -0.0332 -0.0803 -0.0815 18 ARG A NH2 135 N N . VAL A 19 ? 0.6113 0.3291 0.4496 -0.0193 -0.0717 -0.0274 19 VAL A N 136 C CA . VAL A 19 ? 0.5630 0.3107 0.4163 -0.0285 -0.0701 -0.0221 19 VAL A CA 137 C C . VAL A 19 ? 0.4884 0.2615 0.3523 -0.0305 -0.0719 -0.0291 19 VAL A C 138 O O . VAL A 19 ? 0.4253 0.1999 0.2869 -0.0205 -0.0731 -0.0368 19 VAL A O 139 C CB . VAL A 19 ? 0.4300 0.1913 0.2874 -0.0196 -0.0675 -0.0145 19 VAL A CB 140 C CG1 . VAL A 19 ? 0.3990 0.1792 0.2627 -0.0059 -0.0688 -0.0198 19 VAL A CG1 141 C CG2 . VAL A 19 ? 0.3893 0.1704 0.2579 -0.0304 -0.0631 -0.0069 19 VAL A CG2 142 N N . SER A 20 ? 0.4992 0.2927 0.3751 -0.0430 -0.0716 -0.0255 20 SER A N 143 C CA . SER A 20 ? 0.4822 0.3000 0.3673 -0.0463 -0.0739 -0.0299 20 SER A CA 144 C C . SER A 20 ? 0.4807 0.3295 0.3830 -0.0472 -0.0701 -0.0220 20 SER A C 145 O O . SER A 20 ? 0.4179 0.2707 0.3273 -0.0545 -0.0668 -0.0136 20 SER A O 146 C CB . SER A 20 ? 0.4926 0.3048 0.3749 -0.0620 -0.0791 -0.0340 20 SER A CB 147 O OG . SER A 20 ? 0.6749 0.4586 0.5392 -0.0603 -0.0818 -0.0439 20 SER A OG 148 N N . PHE A 21 ? 0.4374 0.3066 0.3460 -0.0398 -0.0693 -0.0245 21 PHE A N 149 C CA . PHE A 21 ? 0.4081 0.3047 0.3321 -0.0397 -0.0649 -0.0177 21 PHE A CA 150 C C . PHE A 21 ? 0.3996 0.3154 0.3309 -0.0460 -0.0687 -0.0185 21 PHE A C 151 O O . PHE A 21 ? 0.4340 0.3461 0.3567 -0.0443 -0.0731 -0.0264 21 PHE A O 152 C CB . PHE A 21 ? 0.4048 0.3095 0.3302 -0.0267 -0.0602 -0.0188 21 PHE A CB 153 C CG . PHE A 21 ? 0.2861 0.1753 0.2038 -0.0197 -0.0586 -0.0184 21 PHE A CG 154 C CD1 . PHE A 21 ? 0.3679 0.2590 0.2877 -0.0204 -0.0536 -0.0110 21 PHE A CD1 155 C CD2 . PHE A 21 ? 0.3804 0.2532 0.2878 -0.0118 -0.0620 -0.0251 21 PHE A CD2 156 C CE1 . PHE A 21 ? 0.4384 0.3157 0.3485 -0.0141 -0.0535 -0.0102 21 PHE A CE1 157 C CE2 . PHE A 21 ? 0.4482 0.3092 0.3492 -0.0044 -0.0620 -0.0236 21 PHE A CE2 158 C CZ . PHE A 21 ? 0.3770 0.2403 0.2783 -0.0059 -0.0586 -0.0160 21 PHE A CZ 159 N N . SER A 22 ? 0.3893 0.3260 0.3360 -0.0525 -0.0669 -0.0100 22 SER A N 160 C CA . SER A 22 ? 0.3909 0.3497 0.3464 -0.0576 -0.0716 -0.0085 22 SER A CA 161 C C . SER A 22 ? 0.4171 0.3985 0.3835 -0.0482 -0.0653 -0.0028 22 SER A C 162 O O . SER A 22 ? 0.3791 0.3648 0.3533 -0.0436 -0.0567 0.0034 22 SER A O 163 C CB . SER A 22 ? 0.3846 0.3541 0.3527 -0.0722 -0.0752 -0.0023 22 SER A CB 164 O OG . SER A 22 ? 0.5577 0.5120 0.5149 -0.0835 -0.0844 -0.0098 22 SER A OG 165 N N . CYS A 23 ? 0.4974 0.4905 0.4620 -0.0454 -0.0689 -0.0052 23 CYS A N 166 C CA . CYS A 23 ? 0.3560 0.3690 0.3297 -0.0369 -0.0630 0.0009 23 CYS A CA 167 C C . CYS A 23 ? 0.3746 0.4067 0.3517 -0.0410 -0.0710 0.0037 23 CYS A C 168 O O . CYS A 23 ? 0.3815 0.4068 0.3439 -0.0430 -0.0783 -0.0041 23 CYS A O 169 C CB . CYS A 23 ? 0.2605 0.2642 0.2239 -0.0256 -0.0574 -0.0052 23 CYS A CB 170 S SG . CYS A 23 ? 0.4919 0.5143 0.4615 -0.0160 -0.0500 0.0008 23 CYS A SG 171 N N . ARG A 24 ? 0.4352 0.4914 0.4310 -0.0419 -0.0694 0.0149 24 ARG A N 172 C CA . ARG A 24 ? 0.4292 0.5083 0.4313 -0.0462 -0.0787 0.0197 24 ARG A CA 173 C C . ARG A 24 ? 0.4182 0.5155 0.4280 -0.0341 -0.0724 0.0289 24 ARG A C 174 O O . ARG A 24 ? 0.5061 0.6077 0.5281 -0.0267 -0.0606 0.0362 24 ARG A O 175 C CB . ARG A 24 ? 0.3919 0.4877 0.4128 -0.0586 -0.0843 0.0264 24 ARG A CB 176 C CG . ARG A 24 ? 0.3996 0.4761 0.4107 -0.0728 -0.0921 0.0172 24 ARG A CG 177 C CD . ARG A 24 ? 0.4337 0.5274 0.4654 -0.0868 -0.0964 0.0240 24 ARG A CD 178 N NE . ARG A 24 ? 0.4635 0.5401 0.4838 -0.1027 -0.1064 0.0146 24 ARG A NE 179 C CZ . ARG A 24 ? 0.4863 0.5353 0.4981 -0.1083 -0.1025 0.0097 24 ARG A CZ 180 N NH1 . ARG A 24 ? 0.5295 0.5669 0.5426 -0.0995 -0.0900 0.0133 24 ARG A NH1 181 N NH2 . ARG A 24 ? 0.4869 0.5182 0.4872 -0.1229 -0.1111 0.0011 24 ARG A NH2 182 N N . ALA A 25 ? 0.3812 0.4867 0.3816 -0.0320 -0.0795 0.0284 25 ALA A N 183 C CA . ALA A 25 ? 0.3782 0.4980 0.3820 -0.0201 -0.0740 0.0376 25 ALA A CA 184 C C . ALA A 25 ? 0.3583 0.5102 0.3812 -0.0217 -0.0813 0.0505 25 ALA A C 185 O O . ALA A 25 ? 0.2399 0.4038 0.2665 -0.0336 -0.0949 0.0495 25 ALA A O 186 C CB . ALA A 25 ? 0.3537 0.4628 0.3337 -0.0154 -0.0762 0.0306 25 ALA A CB 187 N N . SER A 26 ? 0.4289 0.5946 0.4643 -0.0094 -0.0719 0.0628 26 SER A N 188 C CA . SER A 26 ? 0.3118 0.5107 0.3682 -0.0074 -0.0775 0.0773 26 SER A CA 189 C C . SER A 26 ? 0.2536 0.4663 0.2979 -0.0078 -0.0922 0.0791 26 SER A C 190 O O . SER A 26 ? 0.2428 0.4865 0.3041 -0.0084 -0.1016 0.0903 26 SER A O 191 C CB . SER A 26 ? 0.3616 0.5672 0.4330 0.0079 -0.0612 0.0902 26 SER A CB 192 O OG . SER A 26 ? 0.3957 0.5834 0.4487 0.0190 -0.0521 0.0885 26 SER A OG 193 N N . GLN A 27 ? 0.3088 0.5005 0.3243 -0.0071 -0.0942 0.0688 27 GLN A N 194 C CA . GLN A 27 ? 0.3974 0.5971 0.3946 -0.0098 -0.1089 0.0676 27 GLN A CA 195 C C . GLN A 27 ? 0.3634 0.5320 0.3293 -0.0136 -0.1088 0.0509 27 GLN A C 196 O O . GLN A 27 ? 0.3398 0.4848 0.3014 -0.0114 -0.0970 0.0427 27 GLN A O 197 C CB . GLN A 27 ? 0.4756 0.6906 0.4725 0.0050 -0.1060 0.0821 27 GLN A CB 198 C CG . GLN A 27 ? 0.5819 0.7724 0.5596 0.0173 -0.0905 0.0799 27 GLN A CG 199 C CD . GLN A 27 ? 0.6841 0.8871 0.6673 0.0333 -0.0830 0.0969 27 GLN A CD 200 O OE1 . GLN A 27 ? 0.7181 0.9379 0.7270 0.0399 -0.0773 0.1096 27 GLN A OE1 201 N NE2 . GLN A 27 ? 0.7259 0.9193 0.6840 0.0401 -0.0819 0.0977 27 GLN A NE2 202 N N . SER A 28 ? 0.3626 0.5322 0.3066 -0.0192 -0.1224 0.0458 28 SER A N 203 C CA . SER A 28 ? 0.4037 0.5443 0.3176 -0.0233 -0.1226 0.0294 28 SER A CA 204 C C . SER A 28 ? 0.4138 0.5351 0.3158 -0.0099 -0.1055 0.0277 28 SER A C 205 O O . SER A 28 ? 0.5362 0.6659 0.4381 0.0016 -0.0990 0.0385 28 SER A O 206 C CB . SER A 28 ? 0.4252 0.5704 0.3144 -0.0305 -0.1390 0.0253 28 SER A CB 207 O OG . SER A 28 ? 0.4366 0.5518 0.2957 -0.0342 -0.1378 0.0087 28 SER A OG 208 N N . ILE A 29 ? 0.3783 0.4739 0.2716 -0.0113 -0.0979 0.0147 29 ILE A N 209 C CA . ILE A 29 ? 0.4441 0.5228 0.3286 -0.0006 -0.0821 0.0114 29 ILE A CA 210 C C . ILE A 29 ? 0.4743 0.5296 0.3334 -0.0034 -0.0822 -0.0042 29 ILE A C 211 O O . ILE A 29 ? 0.3959 0.4359 0.2502 0.0032 -0.0695 -0.0100 29 ILE A O 212 C CB . ILE A 29 ? 0.2913 0.3651 0.1970 0.0034 -0.0693 0.0129 29 ILE A CB 213 C CG1 . ILE A 29 ? 0.2736 0.3362 0.1845 -0.0058 -0.0736 0.0034 29 ILE A CG1 214 C CG2 . ILE A 29 ? 0.2635 0.3574 0.1919 0.0085 -0.0654 0.0283 29 ILE A CG2 215 C CD1 . ILE A 29 ? 0.2536 0.3079 0.1790 -0.0020 -0.0619 0.0028 29 ILE A CD1 216 N N . GLY A 30 ? 0.4586 0.5110 0.3016 -0.0134 -0.0960 -0.0113 30 GLY A N 217 C CA . GLY A 30 ? 0.4908 0.5184 0.3073 -0.0156 -0.0954 -0.0266 30 GLY A CA 218 C C . GLY A 30 ? 0.4525 0.4613 0.2772 -0.0161 -0.0885 -0.0361 30 GLY A C 219 O O . GLY A 30 ? 0.5356 0.5443 0.3742 -0.0240 -0.0942 -0.0367 30 GLY A O 220 N N . THR A 31 ? 0.3536 0.3468 0.1701 -0.0075 -0.0759 -0.0430 31 THR A N 221 C CA . THR A 31 ? 0.3895 0.3671 0.2149 -0.0052 -0.0689 -0.0506 31 THR A CA 222 C C . THR A 31 ? 0.3791 0.3624 0.2216 0.0049 -0.0550 -0.0456 31 THR A C 223 O O . THR A 31 ? 0.4624 0.4342 0.3084 0.0096 -0.0474 -0.0525 31 THR A O 224 C CB . THR A 31 ? 0.4233 0.3767 0.2254 -0.0044 -0.0671 -0.0651 31 THR A CB 225 O OG1 . THR A 31 ? 0.4377 0.3898 0.2207 0.0019 -0.0603 -0.0667 31 THR A OG1 226 C CG2 . THR A 31 ? 0.3937 0.3357 0.1808 -0.0166 -0.0806 -0.0722 31 THR A CG2 227 N N . ASN A 32 ? 0.3642 0.3647 0.2176 0.0081 -0.0515 -0.0337 32 ASN A N 228 C CA . ASN A 32 ? 0.2871 0.2910 0.1538 0.0162 -0.0376 -0.0294 32 ASN A CA 229 C C . ASN A 32 ? 0.3457 0.3538 0.2351 0.0146 -0.0368 -0.0255 32 ASN A C 230 O O . ASN A 32 ? 0.2756 0.2956 0.1785 0.0160 -0.0337 -0.0152 32 ASN A O 231 C CB . ASN A 32 ? 0.2892 0.3045 0.1528 0.0212 -0.0325 -0.0187 32 ASN A CB 232 C CG . ASN A 32 ? 0.3890 0.3995 0.2527 0.0287 -0.0166 -0.0194 32 ASN A CG 233 O OD1 . ASN A 32 ? 0.4393 0.4473 0.3181 0.0302 -0.0088 -0.0221 32 ASN A OD1 234 N ND2 . ASN A 32 ? 0.3028 0.3122 0.1491 0.0327 -0.0118 -0.0170 32 ASN A ND2 235 N N . ILE A 33 ? 0.3517 0.3483 0.2436 0.0124 -0.0389 -0.0338 33 ILE A N 236 C CA . ILE A 33 ? 0.3521 0.3494 0.2610 0.0107 -0.0384 -0.0312 33 ILE A CA 237 C C . ILE A 33 ? 0.2950 0.2809 0.2059 0.0150 -0.0332 -0.0397 33 ILE A C 238 O O . ILE A 33 ? 0.3372 0.3119 0.2370 0.0170 -0.0340 -0.0487 33 ILE A O 239 C CB . ILE A 33 ? 0.3893 0.3858 0.3002 0.0018 -0.0496 -0.0298 33 ILE A CB 240 C CG1 . ILE A 33 ? 0.4927 0.4896 0.4192 0.0005 -0.0474 -0.0256 33 ILE A CG1 241 C CG2 . ILE A 33 ? 0.4420 0.4213 0.3374 -0.0021 -0.0566 -0.0405 33 ILE A CG2 242 C CD1 . ILE A 33 ? 0.6548 0.6520 0.5855 -0.0088 -0.0561 -0.0227 33 ILE A CD1 243 N N . HIS A 34 ? 0.4170 0.4064 0.3418 0.0169 -0.0277 -0.0368 34 HIS A N 244 C CA . HIS A 34 ? 0.3869 0.3700 0.3165 0.0207 -0.0245 -0.0434 34 HIS A CA 245 C C . HIS A 34 ? 0.4055 0.3856 0.3429 0.0177 -0.0282 -0.0407 34 HIS A C 246 O O . HIS A 34 ? 0.3778 0.3637 0.3210 0.0140 -0.0280 -0.0329 34 HIS A O 247 C CB . HIS A 34 ? 0.2273 0.2176 0.1640 0.0253 -0.0134 -0.0438 34 HIS A CB 248 C CG . HIS A 34 ? 0.2670 0.2599 0.1951 0.0280 -0.0075 -0.0443 34 HIS A CG 249 N ND1 . HIS A 34 ? 0.2401 0.2262 0.1536 0.0291 -0.0109 -0.0497 34 HIS A ND1 250 C CD2 . HIS A 34 ? 0.3169 0.3162 0.2466 0.0299 0.0023 -0.0399 34 HIS A CD2 251 C CE1 . HIS A 34 ? 0.3303 0.3196 0.2360 0.0317 -0.0036 -0.0484 34 HIS A CE1 252 N NE2 . HIS A 34 ? 0.2635 0.2608 0.1794 0.0323 0.0046 -0.0419 34 HIS A NE2 253 N N . TRP A 35 ? 0.3495 0.3203 0.2867 0.0202 -0.0309 -0.0464 35 TRP A N 254 C CA . TRP A 35 ? 0.2186 0.1838 0.1593 0.0181 -0.0348 -0.0439 35 TRP A CA 255 C C . TRP A 35 ? 0.2691 0.2374 0.2171 0.0227 -0.0314 -0.0465 35 TRP A C 256 O O . TRP A 35 ? 0.4472 0.4174 0.3975 0.0284 -0.0296 -0.0527 35 TRP A O 257 C CB . TRP A 35 ? 0.4126 0.3617 0.3443 0.0168 -0.0428 -0.0471 35 TRP A CB 258 C CG . TRP A 35 ? 0.3504 0.2965 0.2759 0.0088 -0.0479 -0.0444 35 TRP A CG 259 C CD1 . TRP A 35 ? 0.3142 0.2568 0.2297 0.0070 -0.0508 -0.0488 35 TRP A CD1 260 C CD2 . TRP A 35 ? 0.3483 0.2956 0.2774 0.0008 -0.0509 -0.0371 35 TRP A CD2 261 N NE1 . TRP A 35 ? 0.3228 0.2657 0.2361 -0.0026 -0.0570 -0.0449 35 TRP A NE1 262 C CE2 . TRP A 35 ? 0.3711 0.3180 0.2946 -0.0064 -0.0566 -0.0373 35 TRP A CE2 263 C CE3 . TRP A 35 ? 0.3444 0.2935 0.2806 -0.0013 -0.0488 -0.0304 35 TRP A CE3 264 C CZ2 . TRP A 35 ? 0.3585 0.3096 0.2871 -0.0160 -0.0606 -0.0308 35 TRP A CZ2 265 C CZ3 . TRP A 35 ? 0.3663 0.3176 0.3062 -0.0098 -0.0510 -0.0237 35 TRP A CZ3 266 C CH2 . TRP A 35 ? 0.3576 0.3113 0.2955 -0.0172 -0.0570 -0.0237 35 TRP A CH2 267 N N . TYR A 36 ? 0.2439 0.2134 0.1956 0.0200 -0.0307 -0.0418 36 TYR A N 268 C CA . TYR A 36 ? 0.2013 0.1744 0.1582 0.0223 -0.0290 -0.0442 36 TYR A CA 269 C C . TYR A 36 ? 0.2430 0.2067 0.1950 0.0212 -0.0348 -0.0415 36 TYR A C 270 O O . TYR A 36 ? 0.2115 0.1682 0.1585 0.0168 -0.0362 -0.0359 36 TYR A O 271 C CB . TYR A 36 ? 0.1917 0.1737 0.1542 0.0197 -0.0200 -0.0419 36 TYR A CB 272 C CG . TYR A 36 ? 0.1879 0.1778 0.1541 0.0212 -0.0128 -0.0436 36 TYR A CG 273 C CD1 . TYR A 36 ? 0.1878 0.1792 0.1510 0.0201 -0.0102 -0.0385 36 TYR A CD1 274 C CD2 . TYR A 36 ? 0.3781 0.3750 0.3512 0.0235 -0.0087 -0.0497 36 TYR A CD2 275 C CE1 . TYR A 36 ? 0.1888 0.1856 0.1523 0.0221 -0.0034 -0.0390 36 TYR A CE1 276 C CE2 . TYR A 36 ? 0.2946 0.2970 0.2697 0.0246 -0.0006 -0.0506 36 TYR A CE2 277 C CZ . TYR A 36 ? 0.2901 0.2910 0.2588 0.0242 0.0022 -0.0450 36 TYR A CZ 278 O OH . TYR A 36 ? 0.4069 0.4117 0.3746 0.0258 0.0105 -0.0448 36 TYR A OH 279 N N . GLN A 37 ? 0.2636 0.2284 0.2174 0.0252 -0.0381 -0.0451 37 GLN A N 280 C CA . GLN A 37 ? 0.2194 0.1757 0.1662 0.0252 -0.0437 -0.0423 37 GLN A CA 281 C C . GLN A 37 ? 0.3282 0.2922 0.2768 0.0228 -0.0412 -0.0433 37 GLN A C 282 O O . GLN A 37 ? 0.3620 0.3384 0.3200 0.0237 -0.0387 -0.0486 37 GLN A O 283 C CB . GLN A 37 ? 0.2314 0.1812 0.1762 0.0329 -0.0519 -0.0450 37 GLN A CB 284 C CG . GLN A 37 ? 0.3867 0.3258 0.3216 0.0341 -0.0585 -0.0407 37 GLN A CG 285 C CD . GLN A 37 ? 0.4291 0.3660 0.3647 0.0442 -0.0664 -0.0428 37 GLN A CD 286 O OE1 . GLN A 37 ? 0.3113 0.2638 0.2580 0.0490 -0.0682 -0.0473 37 GLN A OE1 287 N NE2 . GLN A 37 ? 0.5316 0.4493 0.4567 0.0476 -0.0708 -0.0392 37 GLN A NE2 288 N N . GLN A 38 ? 0.2223 0.1782 0.1611 0.0189 -0.0412 -0.0386 38 GLN A N 289 C CA . GLN A 38 ? 0.3267 0.2859 0.2624 0.0156 -0.0391 -0.0403 38 GLN A CA 290 C C . GLN A 38 ? 0.3789 0.3275 0.3004 0.0164 -0.0464 -0.0373 38 GLN A C 291 O O . GLN A 38 ? 0.2482 0.1845 0.1588 0.0135 -0.0439 -0.0309 38 GLN A O 292 C CB . GLN A 38 ? 0.3579 0.3162 0.2926 0.0097 -0.0276 -0.0375 38 GLN A CB 293 C CG . GLN A 38 ? 0.2257 0.1834 0.1541 0.0053 -0.0238 -0.0407 38 GLN A CG 294 C CD . GLN A 38 ? 0.4338 0.3898 0.3631 0.0013 -0.0102 -0.0389 38 GLN A CD 295 O OE1 . GLN A 38 ? 0.4274 0.3794 0.3567 0.0014 -0.0041 -0.0320 38 GLN A OE1 296 N NE2 . GLN A 38 ? 0.3885 0.3478 0.3197 -0.0023 -0.0052 -0.0450 38 GLN A NE2 297 N N . ARG A 39 ? 0.3664 0.3208 0.2883 0.0204 -0.0553 -0.0411 39 ARG A N 298 C CA . ARG A 39 ? 0.3433 0.2890 0.2498 0.0218 -0.0634 -0.0380 39 ARG A CA 299 C C . ARG A 39 ? 0.4143 0.3593 0.3098 0.0145 -0.0597 -0.0397 39 ARG A C 300 O O . ARG A 39 ? 0.6100 0.5613 0.5118 0.0088 -0.0510 -0.0440 39 ARG A O 301 C CB . ARG A 39 ? 0.3837 0.3387 0.2963 0.0302 -0.0755 -0.0407 39 ARG A CB 302 C CG . ARG A 39 ? 0.2736 0.2227 0.1913 0.0391 -0.0791 -0.0386 39 ARG A CG 303 C CD . ARG A 39 ? 0.3407 0.3026 0.2688 0.0490 -0.0890 -0.0414 39 ARG A CD 304 N NE . ARG A 39 ? 0.4473 0.3996 0.3778 0.0589 -0.0913 -0.0395 39 ARG A NE 305 C CZ . ARG A 39 ? 0.5858 0.5483 0.5287 0.0701 -0.0971 -0.0417 39 ARG A CZ 306 N NH1 . ARG A 39 ? 0.6205 0.6071 0.5772 0.0719 -0.1024 -0.0457 39 ARG A NH1 307 N NH2 . ARG A 39 ? 0.7200 0.6688 0.6621 0.0791 -0.0973 -0.0402 39 ARG A NH2 308 N N . THR A 40 ? 0.3318 0.2664 0.2084 0.0147 -0.0658 -0.0362 40 THR A N 309 C CA . THR A 40 ? 0.3827 0.3126 0.2432 0.0075 -0.0624 -0.0383 40 THR A CA 310 C C . THR A 40 ? 0.4142 0.3609 0.2841 0.0034 -0.0651 -0.0481 40 THR A C 311 O O . THR A 40 ? 0.3946 0.3563 0.2747 0.0076 -0.0767 -0.0515 40 THR A O 312 C CB . THR A 40 ? 0.3722 0.2888 0.2084 0.0096 -0.0708 -0.0330 40 THR A CB 313 O OG1 . THR A 40 ? 0.4664 0.3659 0.2942 0.0115 -0.0662 -0.0237 40 THR A OG1 314 C CG2 . THR A 40 ? 0.3491 0.2588 0.1645 0.0017 -0.0672 -0.0363 40 THR A CG2 315 N N . ASN A 41 ? 0.3950 0.3390 0.2624 -0.0048 -0.0536 -0.0523 41 ASN A N 316 C CA . ASN A 41 ? 0.3628 0.3188 0.2374 -0.0118 -0.0533 -0.0622 41 ASN A CA 317 C C . ASN A 41 ? 0.2782 0.2537 0.1804 -0.0093 -0.0537 -0.0662 41 ASN A C 318 O O . ASN A 41 ? 0.2780 0.2682 0.1907 -0.0143 -0.0567 -0.0742 41 ASN A O 319 C CB . ASN A 41 ? 0.4045 0.3649 0.2657 -0.0148 -0.0670 -0.0667 41 ASN A CB 320 C CG . ASN A 41 ? 0.5112 0.4512 0.3415 -0.0208 -0.0631 -0.0660 41 ASN A CG 321 O OD1 . ASN A 41 ? 0.4301 0.3640 0.2408 -0.0184 -0.0735 -0.0627 41 ASN A OD1 322 N ND2 . ASN A 41 ? 0.5335 0.4613 0.3578 -0.0277 -0.0470 -0.0688 41 ASN A ND2 323 N N . GLY A 42 ? 0.2715 0.2473 0.1852 -0.0026 -0.0501 -0.0612 42 GLY A N 324 C CA . GLY A 42 ? 0.2869 0.2787 0.2233 0.0010 -0.0497 -0.0644 42 GLY A CA 325 C C . GLY A 42 ? 0.3830 0.3729 0.3273 -0.0018 -0.0350 -0.0642 42 GLY A C 326 O O . GLY A 42 ? 0.5034 0.4802 0.4380 -0.0047 -0.0254 -0.0601 42 GLY A O 327 N N . SER A 43 ? 0.3137 0.3177 0.2761 -0.0002 -0.0330 -0.0680 43 SER A N 328 C CA . SER A 43 ? 0.3161 0.3191 0.2857 -0.0004 -0.0208 -0.0665 43 SER A CA 329 C C . SER A 43 ? 0.2822 0.2838 0.2545 0.0077 -0.0231 -0.0616 43 SER A C 330 O O . SER A 43 ? 0.2837 0.2866 0.2561 0.0137 -0.0333 -0.0612 43 SER A O 331 C CB . SER A 43 ? 0.2204 0.2377 0.2059 -0.0042 -0.0156 -0.0733 43 SER A CB 332 O OG . SER A 43 ? 0.2306 0.2478 0.2130 -0.0138 -0.0135 -0.0790 43 SER A OG 333 N N . PRO A 44 ? 0.3454 0.3429 0.3183 0.0081 -0.0142 -0.0577 44 PRO A N 334 C CA . PRO A 44 ? 0.1922 0.1880 0.1657 0.0141 -0.0171 -0.0543 44 PRO A CA 335 C C . PRO A 44 ? 0.2527 0.2583 0.2362 0.0198 -0.0217 -0.0596 44 PRO A C 336 O O . PRO A 44 ? 0.2873 0.3050 0.2821 0.0189 -0.0182 -0.0649 44 PRO A O 337 C CB . PRO A 44 ? 0.1866 0.1810 0.1606 0.0126 -0.0065 -0.0503 44 PRO A CB 338 C CG . PRO A 44 ? 0.1895 0.1783 0.1590 0.0072 0.0013 -0.0481 44 PRO A CG 339 C CD . PRO A 44 ? 0.3096 0.3018 0.2801 0.0034 -0.0015 -0.0552 44 PRO A CD 340 N N . ARG A 45 ? 0.2607 0.2603 0.2404 0.0257 -0.0286 -0.0581 45 ARG A N 341 C CA . ARG A 45 ? 0.3498 0.3553 0.3371 0.0332 -0.0321 -0.0626 45 ARG A CA 342 C C . ARG A 45 ? 0.3655 0.3625 0.3468 0.0359 -0.0298 -0.0615 45 ARG A C 343 O O . ARG A 45 ? 0.3466 0.3304 0.3172 0.0352 -0.0341 -0.0576 45 ARG A O 344 C CB . ARG A 45 ? 0.3234 0.3260 0.3090 0.0390 -0.0432 -0.0625 45 ARG A CB 345 C CG . ARG A 45 ? 0.4266 0.4319 0.4191 0.0493 -0.0466 -0.0660 45 ARG A CG 346 C CD . ARG A 45 ? 0.6120 0.6076 0.5979 0.0559 -0.0574 -0.0629 45 ARG A CD 347 N NE . ARG A 45 ? 0.6486 0.6442 0.6407 0.0678 -0.0602 -0.0654 45 ARG A NE 348 C CZ . ARG A 45 ? 0.6123 0.5954 0.5975 0.0760 -0.0681 -0.0621 45 ARG A CZ 349 N NH1 . ARG A 45 ? 0.3081 0.2781 0.2793 0.0727 -0.0742 -0.0561 45 ARG A NH1 350 N NH2 . ARG A 45 ? 0.7175 0.6997 0.7090 0.0883 -0.0688 -0.0644 45 ARG A NH2 351 N N . LEU A 46 ? 0.3782 0.3826 0.3654 0.0380 -0.0229 -0.0652 46 LEU A N 352 C CA . LEU A 46 ? 0.3501 0.3466 0.3286 0.0396 -0.0206 -0.0650 46 LEU A CA 353 C C . LEU A 46 ? 0.3415 0.3266 0.3139 0.0462 -0.0275 -0.0676 46 LEU A C 354 O O . LEU A 46 ? 0.3045 0.2941 0.2847 0.0537 -0.0283 -0.0721 46 LEU A O 355 C CB . LEU A 46 ? 0.3069 0.3128 0.2907 0.0409 -0.0106 -0.0683 46 LEU A CB 356 C CG . LEU A 46 ? 0.3333 0.3316 0.3050 0.0425 -0.0078 -0.0688 46 LEU A CG 357 C CD1 . LEU A 46 ? 0.3169 0.3092 0.2781 0.0365 -0.0094 -0.0620 46 LEU A CD1 358 C CD2 . LEU A 46 ? 0.2297 0.2369 0.2058 0.0446 0.0034 -0.0720 46 LEU A CD2 359 N N . LEU A 47 ? 0.3263 0.2966 0.2857 0.0432 -0.0320 -0.0646 47 LEU A N 360 C CA . LEU A 47 ? 0.3530 0.3067 0.3033 0.0477 -0.0379 -0.0669 47 LEU A CA 361 C C . LEU A 47 ? 0.3815 0.3267 0.3212 0.0485 -0.0352 -0.0714 47 LEU A C 362 O O . LEU A 47 ? 0.3786 0.3159 0.3155 0.0563 -0.0342 -0.0771 47 LEU A O 363 C CB . LEU A 47 ? 0.4015 0.3418 0.3433 0.0421 -0.0447 -0.0611 47 LEU A CB 364 C CG . LEU A 47 ? 0.3979 0.3406 0.3437 0.0417 -0.0484 -0.0566 47 LEU A CG 365 C CD1 . LEU A 47 ? 0.4603 0.3887 0.3961 0.0350 -0.0524 -0.0503 47 LEU A CD1 366 C CD2 . LEU A 47 ? 0.2532 0.1953 0.2033 0.0517 -0.0526 -0.0593 47 LEU A CD2 367 N N . ILE A 48 ? 0.3400 0.2861 0.2728 0.0410 -0.0340 -0.0686 48 ILE A N 368 C CA . ILE A 48 ? 0.3591 0.2970 0.2779 0.0399 -0.0331 -0.0726 48 ILE A CA 369 C C . ILE A 48 ? 0.3718 0.3238 0.2915 0.0369 -0.0269 -0.0698 48 ILE A C 370 O O . ILE A 48 ? 0.3276 0.2900 0.2546 0.0324 -0.0260 -0.0629 48 ILE A O 371 C CB . ILE A 48 ? 0.3191 0.2413 0.2250 0.0322 -0.0413 -0.0713 48 ILE A CB 372 C CG1 . ILE A 48 ? 0.3434 0.2484 0.2472 0.0350 -0.0463 -0.0725 48 ILE A CG1 373 C CG2 . ILE A 48 ? 0.2976 0.2106 0.1865 0.0300 -0.0417 -0.0769 48 ILE A CG2 374 C CD1 . ILE A 48 ? 0.3096 0.2007 0.2071 0.0449 -0.0440 -0.0807 48 ILE A CD1 375 N N . LYS A 49 ? 0.2666 0.2171 0.1773 0.0403 -0.0216 -0.0749 49 LYS A N 376 C CA . LYS A 49 ? 0.3770 0.3371 0.2834 0.0381 -0.0158 -0.0716 49 LYS A CA 377 C C . LYS A 49 ? 0.4551 0.4050 0.3402 0.0346 -0.0203 -0.0738 49 LYS A C 378 O O . LYS A 49 ? 0.5393 0.4738 0.4118 0.0366 -0.0223 -0.0817 49 LYS A O 379 C CB . LYS A 49 ? 0.3490 0.3179 0.2622 0.0445 -0.0038 -0.0748 49 LYS A CB 380 C CG . LYS A 49 ? 0.3471 0.3068 0.2507 0.0514 0.0009 -0.0838 49 LYS A CG 381 C CD . LYS A 49 ? 0.3712 0.3427 0.2844 0.0567 0.0144 -0.0859 49 LYS A CD 382 C CE . LYS A 49 ? 0.3863 0.3489 0.2899 0.0645 0.0212 -0.0946 49 LYS A CE 383 N NZ . LYS A 49 ? 0.5225 0.4985 0.4378 0.0691 0.0359 -0.0961 49 LYS A NZ 384 N N . TYR A 50 ? 0.4871 0.4454 0.3678 0.0295 -0.0221 -0.0668 50 TYR A N 385 C CA . TYR A 50 ? 0.4869 0.4398 0.3472 0.0248 -0.0283 -0.0678 50 TYR A CA 386 C C . TYR A 50 ? 0.5087 0.4462 0.3600 0.0186 -0.0391 -0.0730 50 TYR A C 387 O O . TYR A 50 ? 0.4501 0.3711 0.2831 0.0190 -0.0402 -0.0822 50 TYR A O 388 C CB . TYR A 50 ? 0.3207 0.2686 0.1641 0.0301 -0.0201 -0.0736 50 TYR A CB 389 C CG . TYR A 50 ? 0.3522 0.3133 0.2009 0.0342 -0.0092 -0.0672 50 TYR A CG 390 C CD1 . TYR A 50 ? 0.3560 0.3269 0.1996 0.0314 -0.0113 -0.0576 50 TYR A CD1 391 C CD2 . TYR A 50 ? 0.4819 0.4462 0.3415 0.0408 0.0034 -0.0703 50 TYR A CD2 392 C CE1 . TYR A 50 ? 0.3694 0.3487 0.2163 0.0355 -0.0001 -0.0510 50 TYR A CE1 393 C CE2 . TYR A 50 ? 0.3939 0.3679 0.2579 0.0431 0.0145 -0.0646 50 TYR A CE2 394 C CZ . TYR A 50 ? 0.4108 0.3903 0.2671 0.0406 0.0132 -0.0549 50 TYR A CZ 395 O OH . TYR A 50 ? 0.3717 0.3572 0.2308 0.0432 0.0255 -0.0485 50 TYR A OH 396 N N . ALA A 51 ? 0.4010 0.3424 0.2649 0.0128 -0.0458 -0.0671 51 ALA A N 397 C CA . ALA A 51 ? 0.3459 0.2745 0.2038 0.0043 -0.0560 -0.0696 51 ALA A CA 398 C C . ALA A 51 ? 0.4223 0.3285 0.2748 0.0081 -0.0551 -0.0784 51 ALA A C 399 O O . ALA A 51 ? 0.3610 0.2596 0.2201 0.0050 -0.0591 -0.0765 51 ALA A O 400 C CB . ALA A 51 ? 0.4455 0.3719 0.2848 -0.0041 -0.0641 -0.0720 51 ALA A CB 401 N N . SER A 52 ? 0.3487 0.2435 0.1888 0.0157 -0.0491 -0.0873 52 SER A N 402 C CA . SER A 52 ? 0.3686 0.2394 0.2009 0.0202 -0.0485 -0.0957 52 SER A CA 403 C C . SER A 52 ? 0.3683 0.2380 0.2056 0.0344 -0.0378 -0.1007 52 SER A C 404 O O . SER A 52 ? 0.3842 0.2353 0.2180 0.0406 -0.0367 -0.1063 52 SER A O 405 C CB . SER A 52 ? 0.4721 0.3207 0.2781 0.0132 -0.0534 -0.1046 52 SER A CB 406 O OG . SER A 52 ? 0.4170 0.2667 0.2067 0.0162 -0.0482 -0.1099 52 SER A OG 407 N N . GLU A 53 ? 0.3532 0.2416 0.1990 0.0397 -0.0296 -0.0986 53 GLU A N 408 C CA . GLU A 53 ? 0.4184 0.3079 0.2694 0.0520 -0.0187 -0.1041 53 GLU A CA 409 C C . GLU A 53 ? 0.4738 0.3727 0.3487 0.0588 -0.0180 -0.1009 53 GLU A C 410 O O . GLU A 53 ? 0.4135 0.3272 0.3033 0.0545 -0.0213 -0.0933 53 GLU A O 411 C CB . GLU A 53 ? 0.3870 0.2923 0.2378 0.0536 -0.0093 -0.1028 53 GLU A CB 412 C CG . GLU A 53 ? 0.4824 0.3806 0.3075 0.0471 -0.0113 -0.1045 53 GLU A CG 413 C CD . GLU A 53 ? 0.6203 0.5323 0.4430 0.0494 -0.0013 -0.1016 53 GLU A CD 414 O OE1 . GLU A 53 ? 0.6645 0.5696 0.4630 0.0468 -0.0011 -0.1038 53 GLU A OE1 415 O OE2 . GLU A 53 ? 0.6173 0.5459 0.4611 0.0534 0.0063 -0.0971 53 GLU A OE2 416 N N . SER A 54 ? 0.5525 0.4427 0.4303 0.0698 -0.0135 -0.1067 54 SER A N 417 C CA . SER A 54 ? 0.5399 0.4389 0.4390 0.0774 -0.0148 -0.1038 54 SER A CA 418 C C . SER A 54 ? 0.5378 0.4652 0.4591 0.0799 -0.0081 -0.1010 54 SER A C 419 O O . SER A 54 ? 0.6505 0.5874 0.5710 0.0797 0.0010 -0.1029 54 SER A O 420 C CB . SER A 54 ? 0.6865 0.5693 0.5835 0.0903 -0.0117 -0.1099 54 SER A CB 421 O OG . SER A 54 ? 0.9016 0.7553 0.7796 0.0873 -0.0183 -0.1118 54 SER A OG 422 N N . ILE A 55 ? 0.4476 0.3872 0.3875 0.0817 -0.0127 -0.0966 55 ILE A N 423 C CA . ILE A 55 ? 0.3392 0.3050 0.3016 0.0829 -0.0079 -0.0949 55 ILE A CA 424 C C . ILE A 55 ? 0.4278 0.4014 0.4076 0.0948 -0.0087 -0.0969 55 ILE A C 425 O O . ILE A 55 ? 0.5007 0.4610 0.4768 0.1000 -0.0166 -0.0956 55 ILE A O 426 C CB . ILE A 55 ? 0.3515 0.3272 0.3200 0.0729 -0.0134 -0.0879 55 ILE A CB 427 C CG1 . ILE A 55 ? 0.2547 0.2238 0.2080 0.0629 -0.0132 -0.0845 55 ILE A CG1 428 C CG2 . ILE A 55 ? 0.3321 0.3322 0.3218 0.0721 -0.0081 -0.0876 55 ILE A CG2 429 C CD1 . ILE A 55 ? 0.2537 0.2311 0.2051 0.0616 -0.0026 -0.0858 55 ILE A CD1 430 N N . SER A 56 ? 0.5067 0.5022 0.5059 0.0994 -0.0004 -0.0994 56 SER A N 431 C CA . SER A 56 ? 0.5214 0.5307 0.5419 0.1112 -0.0014 -0.1006 56 SER A CA 432 C C . SER A 56 ? 0.4926 0.5100 0.5228 0.1092 -0.0143 -0.0951 56 SER A C 433 O O . SER A 56 ? 0.4844 0.5075 0.5139 0.0976 -0.0181 -0.0916 56 SER A O 434 C CB . SER A 56 ? 0.5689 0.6051 0.6121 0.1135 0.0101 -0.1037 56 SER A CB 435 O OG . SER A 56 ? 0.5700 0.6283 0.6400 0.1220 0.0062 -0.1032 56 SER A OG 436 N N . GLY A 57 ? 0.4524 0.4688 0.4900 0.1212 -0.0206 -0.0941 57 GLY A N 437 C CA . GLY A 57 ? 0.3948 0.4183 0.4393 0.1212 -0.0334 -0.0885 57 GLY A CA 438 C C . GLY A 57 ? 0.3969 0.3958 0.4188 0.1146 -0.0423 -0.0834 57 GLY A C 439 O O . GLY A 57 ? 0.4739 0.4748 0.4972 0.1155 -0.0526 -0.0782 57 GLY A O 440 N N . ILE A 58 ? 0.4091 0.3859 0.4102 0.1075 -0.0388 -0.0843 58 ILE A N 441 C CA . ILE A 58 ? 0.4237 0.3783 0.4055 0.1002 -0.0460 -0.0793 58 ILE A CA 442 C C . ILE A 58 ? 0.3804 0.3083 0.3495 0.1098 -0.0490 -0.0791 58 ILE A C 443 O O . ILE A 58 ? 0.4330 0.3491 0.3967 0.1163 -0.0424 -0.0848 58 ILE A O 444 C CB . ILE A 58 ? 0.4780 0.4253 0.4464 0.0871 -0.0419 -0.0797 58 ILE A CB 445 C CG1 . ILE A 58 ? 0.4107 0.3811 0.3908 0.0788 -0.0377 -0.0789 58 ILE A CG1 446 C CG2 . ILE A 58 ? 0.3794 0.3062 0.3312 0.0793 -0.0486 -0.0744 58 ILE A CG2 447 C CD1 . ILE A 58 ? 0.2917 0.2736 0.2800 0.0755 -0.0442 -0.0744 58 ILE A CD1 448 N N . PRO A 59 ? 0.4477 0.3630 0.4099 0.1111 -0.0579 -0.0727 59 PRO A N 449 C CA . PRO A 59 ? 0.4032 0.2890 0.3518 0.1203 -0.0598 -0.0718 59 PRO A CA 450 C C . PRO A 59 ? 0.3661 0.2252 0.2946 0.1130 -0.0550 -0.0765 59 PRO A C 451 O O . PRO A 59 ? 0.3589 0.2192 0.2806 0.0987 -0.0542 -0.0768 59 PRO A O 452 C CB . PRO A 59 ? 0.4927 0.3696 0.4339 0.1180 -0.0694 -0.0627 59 PRO A CB 453 C CG . PRO A 59 ? 0.5378 0.4457 0.4944 0.1142 -0.0733 -0.0602 59 PRO A CG 454 C CD . PRO A 59 ? 0.4397 0.3656 0.4046 0.1048 -0.0656 -0.0661 59 PRO A CD 455 N N . SER A 60 ? 0.4632 0.2976 0.3818 0.1232 -0.0518 -0.0801 60 SER A N 456 C CA . SER A 60 ? 0.5394 0.3472 0.4374 0.1164 -0.0472 -0.0868 60 SER A CA 457 C C . SER A 60 ? 0.5856 0.3713 0.4662 0.1017 -0.0530 -0.0827 60 SER A C 458 O O . SER A 60 ? 0.4334 0.2040 0.2987 0.0909 -0.0513 -0.0879 60 SER A O 459 C CB . SER A 60 ? 0.4479 0.2311 0.3380 0.1316 -0.0412 -0.0923 60 SER A CB 460 O OG . SER A 60 ? 0.5210 0.2809 0.4046 0.1393 -0.0461 -0.0861 60 SER A OG 461 N N . ARG A 61 ? 0.5108 0.2950 0.3930 0.1006 -0.0598 -0.0736 61 ARG A N 462 C CA . ARG A 61 ? 0.4716 0.2360 0.3392 0.0863 -0.0637 -0.0691 61 ARG A CA 463 C C . ARG A 61 ? 0.5222 0.3053 0.3929 0.0695 -0.0642 -0.0686 61 ARG A C 464 O O . ARG A 61 ? 0.5030 0.2737 0.3644 0.0561 -0.0666 -0.0656 61 ARG A O 465 C CB . ARG A 61 ? 0.5284 0.2863 0.3953 0.0900 -0.0694 -0.0587 61 ARG A CB 466 C CG . ARG A 61 ? 0.5862 0.3753 0.4676 0.0888 -0.0732 -0.0528 61 ARG A CG 467 C CD . ARG A 61 ? 0.6233 0.4018 0.4983 0.0926 -0.0791 -0.0427 61 ARG A CD 468 N NE . ARG A 61 ? 0.5509 0.3571 0.4366 0.0912 -0.0829 -0.0381 61 ARG A NE 469 C CZ . ARG A 61 ? 0.5082 0.3367 0.4078 0.1026 -0.0863 -0.0384 61 ARG A CZ 470 N NH1 . ARG A 61 ? 0.5305 0.3593 0.4378 0.1176 -0.0857 -0.0420 61 ARG A NH1 471 N NH2 . ARG A 61 ? 0.5208 0.3717 0.4270 0.0987 -0.0901 -0.0354 61 ARG A NH2 472 N N . PHE A 62 ? 0.5067 0.3191 0.3912 0.0700 -0.0614 -0.0710 62 PHE A N 473 C CA . PHE A 62 ? 0.5054 0.3350 0.3929 0.0566 -0.0607 -0.0702 62 PHE A CA 474 C C . PHE A 62 ? 0.5830 0.4082 0.4615 0.0528 -0.0570 -0.0784 62 PHE A C 475 O O . PHE A 62 ? 0.7396 0.5661 0.6187 0.0625 -0.0518 -0.0851 62 PHE A O 476 C CB . PHE A 62 ? 0.4454 0.3061 0.3505 0.0588 -0.0589 -0.0677 62 PHE A CB 477 C CG . PHE A 62 ? 0.4231 0.2896 0.3338 0.0595 -0.0632 -0.0601 62 PHE A CG 478 C CD1 . PHE A 62 ? 0.5643 0.4325 0.4807 0.0717 -0.0660 -0.0590 62 PHE A CD1 479 C CD2 . PHE A 62 ? 0.3081 0.1791 0.2179 0.0483 -0.0643 -0.0538 62 PHE A CD2 480 C CE1 . PHE A 62 ? 0.4458 0.3188 0.3639 0.0719 -0.0710 -0.0522 62 PHE A CE1 481 C CE2 . PHE A 62 ? 0.3459 0.2200 0.2571 0.0488 -0.0673 -0.0474 62 PHE A CE2 482 C CZ . PHE A 62 ? 0.3725 0.2470 0.2863 0.0601 -0.0712 -0.0467 62 PHE A CZ 483 N N . SER A 63 ? 0.6152 0.4364 0.4855 0.0387 -0.0597 -0.0776 63 SER A N 484 C CA . SER A 63 ? 0.6014 0.4205 0.4608 0.0331 -0.0583 -0.0847 63 SER A CA 485 C C . SER A 63 ? 0.5148 0.3484 0.3765 0.0185 -0.0622 -0.0796 63 SER A C 486 O O . SER A 63 ? 0.5087 0.3486 0.3787 0.0124 -0.0651 -0.0714 63 SER A O 487 C CB . SER A 63 ? 0.5824 0.3683 0.4215 0.0324 -0.0589 -0.0926 63 SER A CB 488 O OG . SER A 63 ? 0.4268 0.1955 0.2586 0.0202 -0.0648 -0.0892 63 SER A OG 489 N N . GLY A 64 ? 0.4185 0.2576 0.2722 0.0137 -0.0620 -0.0840 64 GLY A N 490 C CA . GLY A 64 ? 0.3549 0.2110 0.2121 0.0016 -0.0663 -0.0786 64 GLY A CA 491 C C . GLY A 64 ? 0.4620 0.3098 0.3012 -0.0069 -0.0706 -0.0853 64 GLY A C 492 O O . GLY A 64 ? 0.5456 0.3772 0.3686 -0.0020 -0.0678 -0.0949 64 GLY A O 493 N N . SER A 65 ? 0.3740 0.2341 0.2162 -0.0197 -0.0774 -0.0800 65 SER A N 494 C CA . SER A 65 ? 0.5004 0.3570 0.3262 -0.0302 -0.0842 -0.0854 65 SER A CA 495 C C . SER A 65 ? 0.5012 0.3866 0.3399 -0.0391 -0.0901 -0.0757 65 SER A C 496 O O . SER A 65 ? 0.4667 0.3698 0.3258 -0.0376 -0.0877 -0.0655 65 SER A O 497 C CB . SER A 65 ? 0.4784 0.3055 0.2890 -0.0405 -0.0897 -0.0928 65 SER A CB 498 O OG . SER A 65 ? 0.4988 0.3278 0.3231 -0.0500 -0.0936 -0.0851 65 SER A OG 499 N N . GLY A 66 ? 0.5143 0.4042 0.3402 -0.0478 -0.0977 -0.0789 66 GLY A N 500 C CA . GLY A 66 ? 0.4317 0.3502 0.2694 -0.0558 -0.1049 -0.0695 66 GLY A CA 501 C C . GLY A 66 ? 0.4371 0.3706 0.2650 -0.0507 -0.1051 -0.0687 66 GLY A C 502 O O . GLY A 66 ? 0.3924 0.3169 0.2078 -0.0399 -0.0972 -0.0741 66 GLY A O 503 N N . SER A 67 ? 0.4884 0.4461 0.3229 -0.0584 -0.1142 -0.0609 67 SER A N 504 C CA . SER A 67 ? 0.5863 0.5609 0.4117 -0.0541 -0.1163 -0.0572 67 SER A CA 505 C C . SER A 67 ? 0.5770 0.5834 0.4205 -0.0612 -0.1261 -0.0447 67 SER A C 506 O O . SER A 67 ? 0.6294 0.6417 0.4854 -0.0738 -0.1344 -0.0430 67 SER A O 507 C CB . SER A 67 ? 0.6361 0.5924 0.4277 -0.0584 -0.1218 -0.0699 67 SER A CB 508 O OG . SER A 67 ? 0.7187 0.6731 0.5058 -0.0745 -0.1344 -0.0745 67 SER A OG 509 N N . GLY A 68 ? 0.3693 0.3962 0.2151 -0.0526 -0.1244 -0.0352 68 GLY A N 510 C CA . GLY A 68 ? 0.4081 0.4676 0.2726 -0.0558 -0.1327 -0.0215 68 GLY A CA 511 C C . GLY A 68 ? 0.3848 0.4596 0.2812 -0.0500 -0.1239 -0.0093 68 GLY A C 512 O O . GLY A 68 ? 0.3782 0.4591 0.2815 -0.0369 -0.1128 -0.0015 68 GLY A O 513 N N . THR A 69 ? 0.3924 0.4718 0.3073 -0.0603 -0.1277 -0.0078 69 THR A N 514 C CA . THR A 69 ? 0.3536 0.4451 0.2966 -0.0557 -0.1185 0.0030 69 THR A CA 515 C C . THR A 69 ? 0.3678 0.4390 0.3157 -0.0606 -0.1130 -0.0026 69 THR A C 516 O O . THR A 69 ? 0.4069 0.4819 0.3720 -0.0549 -0.1027 0.0045 69 THR A O 517 C CB . THR A 69 ? 0.3261 0.4521 0.2938 -0.0614 -0.1265 0.0161 69 THR A CB 518 O OG1 . THR A 69 ? 0.3683 0.4971 0.3348 -0.0793 -0.1411 0.0105 69 THR A OG1 519 C CG2 . THR A 69 ? 0.2959 0.4446 0.2625 -0.0523 -0.1299 0.0258 69 THR A CG2 520 N N . ASP A 70 ? 0.3957 0.4437 0.3272 -0.0703 -0.1187 -0.0148 70 ASP A N 521 C CA . ASP A 70 ? 0.3910 0.4188 0.3259 -0.0756 -0.1148 -0.0187 70 ASP A CA 522 C C . ASP A 70 ? 0.3997 0.3960 0.3140 -0.0677 -0.1083 -0.0301 70 ASP A C 523 O O . ASP A 70 ? 0.4854 0.4646 0.3774 -0.0702 -0.1131 -0.0410 70 ASP A O 524 C CB . ASP A 70 ? 0.4165 0.4421 0.3519 -0.0944 -0.1262 -0.0223 70 ASP A CB 525 C CG . ASP A 70 ? 0.5971 0.6039 0.5385 -0.1004 -0.1211 -0.0230 70 ASP A CG 526 O OD1 . ASP A 70 ? 0.6393 0.6410 0.5878 -0.0899 -0.1098 -0.0186 70 ASP A OD1 527 O OD2 . ASP A 70 ? 0.6532 0.6494 0.5910 -0.1162 -0.1285 -0.0279 70 ASP A OD2 528 N N . PHE A 71 ? 0.3636 0.3526 0.2851 -0.0580 -0.0973 -0.0277 71 PHE A N 529 C CA . PHE A 71 ? 0.3985 0.3636 0.3058 -0.0485 -0.0909 -0.0366 71 PHE A CA 530 C C . PHE A 71 ? 0.4090 0.3570 0.3204 -0.0489 -0.0869 -0.0365 71 PHE A C 531 O O . PHE A 71 ? 0.4408 0.3985 0.3680 -0.0518 -0.0844 -0.0277 71 PHE A O 532 C CB . PHE A 71 ? 0.3974 0.3722 0.3075 -0.0346 -0.0817 -0.0340 71 PHE A CB 533 C CG . PHE A 71 ? 0.4127 0.4041 0.3182 -0.0328 -0.0841 -0.0315 71 PHE A CG 534 C CD1 . PHE A 71 ? 0.3076 0.2883 0.1921 -0.0303 -0.0855 -0.0405 71 PHE A CD1 535 C CD2 . PHE A 71 ? 0.3544 0.3711 0.2754 -0.0328 -0.0845 -0.0196 71 PHE A CD2 536 C CE1 . PHE A 71 ? 0.3941 0.3886 0.2710 -0.0284 -0.0877 -0.0374 71 PHE A CE1 537 C CE2 . PHE A 71 ? 0.4514 0.4828 0.3668 -0.0300 -0.0872 -0.0159 71 PHE A CE2 538 C CZ . PHE A 71 ? 0.4534 0.4734 0.3456 -0.0281 -0.0892 -0.0247 71 PHE A CZ 539 N N . THR A 72 ? 0.4368 0.3588 0.3332 -0.0448 -0.0857 -0.0458 72 THR A N 540 C CA . THR A 72 ? 0.4699 0.3720 0.3661 -0.0448 -0.0834 -0.0458 72 THR A CA 541 C C . THR A 72 ? 0.3671 0.2554 0.2566 -0.0306 -0.0775 -0.0510 72 THR A C 542 O O . THR A 72 ? 0.3625 0.2397 0.2390 -0.0254 -0.0774 -0.0600 72 THR A O 543 C CB . THR A 72 ? 0.5037 0.3836 0.3883 -0.0573 -0.0900 -0.0510 72 THR A CB 544 O OG1 . THR A 72 ? 0.5071 0.4037 0.4031 -0.0719 -0.0956 -0.0448 72 THR A OG1 545 C CG2 . THR A 72 ? 0.3664 0.2209 0.2469 -0.0550 -0.0866 -0.0507 72 THR A CG2 546 N N . LEU A 73 ? 0.3380 0.2285 0.2367 -0.0244 -0.0726 -0.0455 73 LEU A N 547 C CA . LEU A 73 ? 0.3780 0.2569 0.2731 -0.0121 -0.0689 -0.0491 73 LEU A CA 548 C C . LEU A 73 ? 0.3855 0.2391 0.2728 -0.0136 -0.0710 -0.0487 73 LEU A C 549 O O . LEU A 73 ? 0.4187 0.2708 0.3098 -0.0215 -0.0716 -0.0416 73 LEU A O 550 C CB . LEU A 73 ? 0.3738 0.2705 0.2816 -0.0051 -0.0633 -0.0437 73 LEU A CB 551 C CG . LEU A 73 ? 0.3198 0.2092 0.2273 0.0059 -0.0614 -0.0457 73 LEU A CG 552 C CD1 . LEU A 73 ? 0.3248 0.2133 0.2293 0.0154 -0.0596 -0.0542 73 LEU A CD1 553 C CD2 . LEU A 73 ? 0.3268 0.2317 0.2447 0.0082 -0.0572 -0.0399 73 LEU A CD2 554 N N . SER A 74 ? 0.4571 0.2902 0.3334 -0.0054 -0.0711 -0.0557 74 SER A N 555 C CA . SER A 74 ? 0.4541 0.2584 0.3199 -0.0058 -0.0728 -0.0554 74 SER A CA 556 C C . SER A 74 ? 0.4931 0.2892 0.3583 0.0100 -0.0708 -0.0556 74 SER A C 557 O O . SER A 74 ? 0.5103 0.3153 0.3790 0.0210 -0.0684 -0.0608 74 SER A O 558 C CB . SER A 74 ? 0.4908 0.2708 0.3406 -0.0123 -0.0754 -0.0638 74 SER A CB 559 O OG . SER A 74 ? 0.6375 0.4249 0.4884 -0.0291 -0.0794 -0.0628 74 SER A OG 560 N N . ILE A 75 ? 0.3898 0.1702 0.2509 0.0110 -0.0718 -0.0492 75 ILE A N 561 C CA . ILE A 75 ? 0.5108 0.2784 0.3683 0.0258 -0.0719 -0.0481 75 ILE A CA 562 C C . ILE A 75 ? 0.5356 0.2663 0.3768 0.0239 -0.0727 -0.0475 75 ILE A C 563 O O . ILE A 75 ? 0.6803 0.3998 0.5167 0.0131 -0.0732 -0.0410 75 ILE A O 564 C CB . ILE A 75 ? 0.4450 0.2273 0.3099 0.0300 -0.0726 -0.0396 75 ILE A CB 565 C CG1 . ILE A 75 ? 0.3526 0.1677 0.2321 0.0272 -0.0706 -0.0397 75 ILE A CG1 566 C CG2 . ILE A 75 ? 0.3952 0.1721 0.2593 0.0469 -0.0747 -0.0391 75 ILE A CG2 567 C CD1 . ILE A 75 ? 0.3402 0.1674 0.2239 0.0284 -0.0706 -0.0325 75 ILE A CD1 568 N N . ASN A 76 ? 0.6326 0.3997 0.6229 0.1706 -0.1237 -0.1271 76 ASN A N 569 C CA . ASN A 76 ? 0.7274 0.4442 0.7016 0.1717 -0.1348 -0.1324 76 ASN A CA 570 C C . ASN A 76 ? 0.7655 0.4710 0.7509 0.1751 -0.1331 -0.1179 76 ASN A C 571 O O . ASN A 76 ? 0.9962 0.6581 0.9698 0.1732 -0.1423 -0.1192 76 ASN A O 572 C CB . ASN A 76 ? 0.8600 0.5638 0.8039 0.1949 -0.1334 -0.1552 76 ASN A CB 573 C CG . ASN A 76 ? 1.0070 0.7544 0.9565 0.2226 -0.1156 -0.1582 76 ASN A CG 574 O OD1 . ASN A 76 ? 1.0937 0.8720 1.0687 0.2254 -0.1083 -0.1431 76 ASN A OD1 575 N ND2 . ASN A 76 ? 1.0213 0.7719 0.9463 0.2422 -0.1084 -0.1759 76 ASN A ND2 576 N N . SER A 77 ? 0.6392 0.3808 0.6443 0.1791 -0.1228 -0.1041 77 SER A N 577 C CA . SER A 77 ? 0.5968 0.3279 0.6103 0.1814 -0.1221 -0.0893 77 SER A CA 578 C C . SER A 77 ? 0.5669 0.3361 0.5992 0.1743 -0.1142 -0.0712 77 SER A C 579 O O . SER A 77 ? 0.5422 0.3476 0.5836 0.1902 -0.1082 -0.0707 77 SER A O 580 C CB . SER A 77 ? 0.6296 0.3550 0.6357 0.2097 -0.1198 -0.0988 77 SER A CB 581 O OG . SER A 77 ? 0.6788 0.3824 0.6891 0.2105 -0.1226 -0.0858 77 SER A OG 582 N N . VAL A 78 ? 0.4768 0.2373 0.5139 0.1503 -0.1141 -0.0551 78 VAL A N 583 C CA . VAL A 78 ? 0.5417 0.3298 0.5875 0.1412 -0.1067 -0.0386 78 VAL A CA 584 C C . VAL A 78 ? 0.5382 0.3319 0.5873 0.1507 -0.1063 -0.0275 78 VAL A C 585 O O . VAL A 78 ? 0.5858 0.3519 0.6310 0.1525 -0.1094 -0.0229 78 VAL A O 586 C CB . VAL A 78 ? 0.4751 0.2494 0.5210 0.1157 -0.1028 -0.0228 78 VAL A CB 587 C CG1 . VAL A 78 ? 0.3864 0.1797 0.4317 0.1074 -0.0935 -0.0054 78 VAL A CG1 588 C CG2 . VAL A 78 ? 0.4948 0.2687 0.5427 0.1067 -0.1058 -0.0314 78 VAL A CG2 589 N N . GLU A 79 ? 0.4154 0.2454 0.4719 0.1564 -0.1041 -0.0222 79 GLU A N 590 C CA . GLU A 79 ? 0.4698 0.3096 0.5306 0.1624 -0.1073 -0.0086 79 GLU A CA 591 C C . GLU A 79 ? 0.4919 0.3337 0.5444 0.1431 -0.1055 0.0093 79 GLU A C 592 O O . GLU A 79 ? 0.3710 0.2151 0.4175 0.1293 -0.0998 0.0105 79 GLU A O 593 C CB . GLU A 79 ? 0.4950 0.3792 0.5726 0.1852 -0.1088 -0.0143 79 GLU A CB 594 C CG . GLU A 79 ? 0.7154 0.5921 0.7956 0.2080 -0.1076 -0.0295 79 GLU A CG 595 C CD . GLU A 79 ? 0.8989 0.8280 0.9974 0.2304 -0.1024 -0.0354 79 GLU A CD 596 O OE1 . GLU A 79 ? 0.8638 0.8398 0.9763 0.2257 -0.1017 -0.0265 79 GLU A OE1 597 O OE2 . GLU A 79 ? 1.0144 0.9384 1.1122 0.2519 -0.0984 -0.0476 79 GLU A OE2 598 N N . SER A 80 ? 0.4583 0.2959 0.5066 0.1429 -0.1104 0.0236 80 SER A N 599 C CA . SER A 80 ? 0.4049 0.2347 0.4350 0.1244 -0.1086 0.0403 80 SER A CA 600 C C . SER A 80 ? 0.3946 0.2546 0.4236 0.1198 -0.1114 0.0425 80 SER A C 601 O O . SER A 80 ? 0.3811 0.2282 0.3892 0.1019 -0.1045 0.0513 80 SER A O 602 C CB . SER A 80 ? 0.5993 0.4195 0.6220 0.1265 -0.1166 0.0537 80 SER A CB 603 O OG . SER A 80 ? 0.8141 0.6697 0.8556 0.1435 -0.1295 0.0542 80 SER A OG 604 N N . GLU A 81 ? 0.3592 0.2633 0.4100 0.1357 -0.1189 0.0355 81 GLU A N 605 C CA . GLU A 81 ? 0.3340 0.2772 0.3864 0.1293 -0.1220 0.0385 81 GLU A CA 606 C C . GLU A 81 ? 0.4311 0.3786 0.4775 0.1189 -0.1064 0.0274 81 GLU A C 607 O O . GLU A 81 ? 0.5223 0.5048 0.5654 0.1061 -0.1003 0.0288 81 GLU A O 608 C CB . GLU A 81 ? 0.4357 0.4410 0.5191 0.1460 -0.1271 0.0352 81 GLU A CB 609 C CG . GLU A 81 ? 0.6310 0.6462 0.7245 0.1518 -0.1408 0.0502 81 GLU A CG 610 C CD . GLU A 81 ? 0.7321 0.7206 0.8326 0.1704 -0.1380 0.0447 81 GLU A CD 611 O OE1 . GLU A 81 ? 0.7583 0.7185 0.8545 0.1769 -0.1277 0.0290 81 GLU A OE1 612 O OE2 . GLU A 81 ? 0.6888 0.6838 0.7971 0.1768 -0.1475 0.0572 81 GLU A OE2 613 N N . ASP A 82 ? 0.3333 0.2465 0.3783 0.1224 -0.1016 0.0182 82 ASP A N 614 C CA . ASP A 82 ? 0.2995 0.2163 0.3405 0.1124 -0.0898 0.0097 82 ASP A CA 615 C C . ASP A 82 ? 0.2944 0.1808 0.3137 0.0914 -0.0813 0.0245 82 ASP A C 616 O O . ASP A 82 ? 0.3469 0.2355 0.3648 0.0831 -0.0719 0.0210 82 ASP A O 617 C CB . ASP A 82 ? 0.3139 0.2119 0.3657 0.1256 -0.0921 -0.0075 82 ASP A CB 618 C CG . ASP A 82 ? 0.3242 0.2513 0.3899 0.1494 -0.0947 -0.0250 82 ASP A CG 619 O OD1 . ASP A 82 ? 0.3875 0.3642 0.4605 0.1529 -0.0902 -0.0255 82 ASP A OD1 620 O OD2 . ASP A 82 ? 0.3528 0.2562 0.4174 0.1576 -0.0961 -0.0356 82 ASP A OD2 621 N N . ILE A 83 ? 0.3136 0.1711 0.3144 0.0845 -0.0838 0.0416 83 ILE A N 622 C CA . ILE A 83 ? 0.3938 0.2296 0.3701 0.0655 -0.0673 0.0550 83 ILE A CA 623 C C . ILE A 83 ? 0.3485 0.1997 0.3061 0.0556 -0.0633 0.0585 83 ILE A C 624 O O . ILE A 83 ? 0.4426 0.3110 0.3883 0.0499 -0.0698 0.0621 83 ILE A O 625 C CB . ILE A 83 ? 0.4687 0.2867 0.4279 0.0582 -0.0624 0.0666 83 ILE A CB 626 C CG1 . ILE A 83 ? 0.5863 0.3919 0.5610 0.0652 -0.0621 0.0643 83 ILE A CG1 627 C CG2 . ILE A 83 ? 0.3232 0.1352 0.2650 0.0434 -0.0414 0.0763 83 ILE A CG2 628 C CD1 . ILE A 83 ? 0.6288 0.4191 0.5893 0.0622 -0.0608 0.0747 83 ILE A CD1 629 N N . ALA A 84 ? 0.2810 0.1337 0.2382 0.0499 -0.0502 0.0573 84 ALA A N 630 C CA . ALA A 84 ? 0.3754 0.2469 0.3153 0.0387 -0.0411 0.0586 84 ALA A CA 631 C C . ALA A 84 ? 0.4029 0.2661 0.3447 0.0359 -0.0269 0.0617 84 ALA A C 632 O O . ALA A 84 ? 0.4250 0.2725 0.3837 0.0392 -0.0239 0.0649 84 ALA A O 633 C CB . ALA A 84 ? 0.3891 0.3118 0.3465 0.0414 -0.0472 0.0443 84 ALA A CB 634 N N . ASP A 85 ? 0.4371 0.3158 0.3651 0.0283 -0.0181 0.0622 85 ASP A N 635 C CA . ASP A 85 ? 0.3634 0.2489 0.3000 0.0274 -0.0076 0.0632 85 ASP A CA 636 C C . ASP A 85 ? 0.3531 0.2814 0.3078 0.0291 -0.0135 0.0455 85 ASP A C 637 O O . ASP A 85 ? 0.4007 0.3545 0.3521 0.0283 -0.0188 0.0374 85 ASP A O 638 C CB . ASP A 85 ? 0.3894 0.2712 0.3049 0.0165 0.0057 0.0716 85 ASP A CB 639 C CG . ASP A 85 ? 0.4315 0.3076 0.3475 0.0103 0.0066 0.0733 85 ASP A CG 640 O OD1 . ASP A 85 ? 0.4499 0.3169 0.3801 0.0129 0.0029 0.0755 85 ASP A OD1 641 O OD2 . ASP A 85 ? 0.5173 0.3974 0.4192 0.0045 0.0102 0.0721 85 ASP A OD2 642 N N . TYR A 86 ? 0.3386 0.2758 0.3122 0.0311 -0.0129 0.0410 86 TYR A N 643 C CA . TYR A 86 ? 0.3146 0.2856 0.2993 0.0340 -0.0188 0.0235 86 TYR A CA 644 C C . TYR A 86 ? 0.3107 0.2907 0.2910 0.0280 -0.0111 0.0292 86 TYR A C 645 O O . TYR A 86 ? 0.3322 0.2977 0.3225 0.0261 -0.0075 0.0415 86 TYR A O 646 C CB . TYR A 86 ? 0.2874 0.2563 0.2956 0.0432 -0.0322 0.0085 86 TYR A CB 647 C CG . TYR A 86 ? 0.2871 0.2491 0.2999 0.0530 -0.0400 0.0022 86 TYR A CG 648 C CD1 . TYR A 86 ? 0.2888 0.2179 0.3042 0.0535 -0.0423 0.0135 86 TYR A CD1 649 C CD2 . TYR A 86 ? 0.2173 0.2074 0.2321 0.0634 -0.0439 -0.0129 86 TYR A CD2 650 C CE1 . TYR A 86 ? 0.3321 0.2544 0.3512 0.0635 -0.0509 0.0093 86 TYR A CE1 651 C CE2 . TYR A 86 ? 0.2595 0.2473 0.2822 0.0751 -0.0511 -0.0163 86 TYR A CE2 652 C CZ . TYR A 86 ? 0.3162 0.2689 0.3404 0.0749 -0.0558 -0.0054 86 TYR A CZ 653 O OH . TYR A 86 ? 0.3058 0.2555 0.3374 0.0876 -0.0644 -0.0073 86 TYR A OH 654 N N . TYR A 87 ? 0.1835 0.1899 0.1507 0.0252 -0.0084 0.0224 87 TYR A N 655 C CA . TYR A 87 ? 0.2587 0.2740 0.2167 0.0200 -0.0016 0.0285 87 TYR A CA 656 C C . TYR A 87 ? 0.1778 0.2219 0.1414 0.0228 -0.0094 0.0110 87 TYR A C 657 O O . TYR A 87 ? 0.1805 0.2425 0.1449 0.0286 -0.0141 -0.0049 87 TYR A O 658 C CB . TYR A 87 ? 0.3209 0.3331 0.2472 0.0120 0.0100 0.0393 87 TYR A CB 659 C CG . TYR A 87 ? 0.3930 0.3673 0.3002 0.0095 0.0187 0.0566 87 TYR A CG 660 C CD1 . TYR A 87 ? 0.3731 0.3346 0.2706 0.0072 0.0146 0.0566 87 TYR A CD1 661 C CD2 . TYR A 87 ? 0.3585 0.3136 0.2640 0.0081 0.0274 0.0673 87 TYR A CD2 662 C CE1 . TYR A 87 ? 0.3196 0.2525 0.2074 0.0022 0.0179 0.0651 87 TYR A CE1 663 C CE2 . TYR A 87 ? 0.4255 0.3634 0.3324 0.0031 0.0267 0.0669 87 TYR A CE2 664 C CZ . TYR A 87 ? 0.3743 0.3039 0.2742 0.0004 0.0223 0.0661 87 TYR A CZ 665 O OH . TYR A 87 ? 0.4119 0.3269 0.3094 0.0002 0.0240 0.0662 87 TYR A OH 666 N N . CYS A 88 ? 0.2746 0.3230 0.2404 0.0200 -0.0101 0.0153 88 CYS A N 667 C CA . CYS A 88 ? 0.2387 0.3099 0.1984 0.0209 -0.0165 0.0012 88 CYS A CA 668 C C . CYS A 88 ? 0.1805 0.2638 0.1174 0.0147 -0.0061 0.0111 88 CYS A C 669 O O . CYS A 88 ? 0.3084 0.3771 0.2375 0.0109 0.0041 0.0301 88 CYS A O 670 C CB . CYS A 88 ? 0.1923 0.2580 0.1699 0.0206 -0.0314 -0.0024 88 CYS A CB 671 S SG . CYS A 88 ? 0.2951 0.3538 0.2914 0.0138 -0.0291 0.0248 88 CYS A SG 672 N N . GLN A 89 ? 0.2811 0.3875 0.2032 0.0153 -0.0076 -0.0016 89 GLN A N 673 C CA . GLN A 89 ? 0.1898 0.3079 0.0870 0.0088 0.0014 0.0065 89 GLN A CA 674 C C . GLN A 89 ? 0.3059 0.4407 0.1940 0.0108 -0.0067 -0.0051 89 GLN A C 675 O O . GLN A 89 ? 0.4085 0.5540 0.2954 0.0177 -0.0128 -0.0247 89 GLN A O 676 C CB . GLN A 89 ? 0.1889 0.3112 0.0790 0.0036 0.0104 0.0057 89 GLN A CB 677 C CG . GLN A 89 ? 0.2660 0.3792 0.1485 -0.0036 0.0155 0.0103 89 GLN A CG 678 C CD . GLN A 89 ? 0.2014 0.3335 0.0865 -0.0064 0.0186 0.0048 89 GLN A CD 679 O OE1 . GLN A 89 ? 0.1978 0.3562 0.0919 -0.0003 0.0173 -0.0048 89 GLN A OE1 680 N NE2 . GLN A 89 ? 0.2324 0.3539 0.1096 -0.0135 0.0226 0.0112 89 GLN A NE2 681 N N . GLN A 90 ? 0.3126 0.4466 0.1909 0.0064 -0.0066 0.0072 90 GLN A N 682 C CA . GLN A 90 ? 0.2278 0.3700 0.0955 0.0065 -0.0148 -0.0014 90 GLN A CA 683 C C . GLN A 90 ? 0.2448 0.3784 0.1031 0.0016 -0.0025 0.0029 90 GLN A C 684 O O . GLN A 90 ? 0.3671 0.4816 0.2267 -0.0029 0.0070 0.0156 90 GLN A O 685 C CB . GLN A 90 ? 0.2402 0.3812 0.1168 0.0048 -0.0284 0.0106 90 GLN A CB 686 C CG . GLN A 90 ? 0.3311 0.4671 0.2049 0.0025 -0.0181 0.0363 90 GLN A CG 687 C CD . GLN A 90 ? 0.3996 0.5301 0.2577 0.0000 -0.0151 0.0353 90 GLN A CD 688 O OE1 . GLN A 90 ? 0.2786 0.4165 0.1232 -0.0005 -0.0235 0.0208 90 GLN A OE1 689 N NE2 . GLN A 90 ? 0.4240 0.5343 0.2808 -0.0004 -0.0035 0.0493 90 GLN A NE2 690 N N . ASN A 91 ? 0.4246 0.2795 0.2113 -0.0049 -0.1019 -0.0140 91 ASN A N 691 C CA . ASN A 91 ? 0.4812 0.3239 0.2444 -0.0004 -0.0871 -0.0177 91 ASN A CA 692 C C . ASN A 91 ? 0.5564 0.3939 0.2976 -0.0082 -0.0979 -0.0133 91 ASN A C 693 O O . ASN A 91 ? 0.6105 0.4349 0.3333 -0.0093 -0.0860 -0.0232 91 ASN A O 694 C CB . ASN A 91 ? 0.4660 0.2975 0.2307 0.0016 -0.0663 -0.0400 91 ASN A CB 695 C CG . ASN A 91 ? 0.6239 0.4475 0.3744 0.0077 -0.0468 -0.0420 91 ASN A CG 696 O OD1 . ASN A 91 ? 0.7206 0.5463 0.4780 0.0040 -0.0349 -0.0526 91 ASN A OD1 697 N ND2 . ASN A 91 ? 0.3698 0.1951 0.1129 0.0170 -0.0422 -0.0276 91 ASN A ND2 698 N N . ASN A 92 ? 0.5347 0.3869 0.2877 -0.0136 -0.1169 0.0018 92 ASN A N 699 C CA . ASN A 92 ? 0.5343 0.3850 0.2732 -0.0194 -0.1259 0.0083 92 ASN A CA 700 C C . ASN A 92 ? 0.5207 0.3763 0.2535 -0.0127 -0.1251 0.0268 92 ASN A C 701 O O . ASN A 92 ? 0.4681 0.3162 0.1820 -0.0158 -0.1285 0.0296 92 ASN A O 702 C CB . ASN A 92 ? 0.5189 0.3843 0.2778 -0.0272 -0.1435 0.0145 92 ASN A CB 703 C CG . ASN A 92 ? 0.5581 0.4187 0.3007 -0.0333 -0.1528 0.0180 92 ASN A CG 704 O OD1 . ASN A 92 ? 0.5169 0.3891 0.2666 -0.0322 -0.1626 0.0343 92 ASN A OD1 705 N ND2 . ASN A 92 ? 0.6118 0.4561 0.3354 -0.0392 -0.1484 0.0026 92 ASN A ND2 706 N N . ASN A 93 ? 0.5549 0.4231 0.3060 -0.0030 -0.1193 0.0397 93 ASN A N 707 C CA A ASN A 93 ? 0.5196 0.3969 0.2748 0.0048 -0.1152 0.0578 93 ASN A CA 708 C CA B ASN A 93 ? 0.5234 0.4008 0.2787 0.0048 -0.1152 0.0579 93 ASN A CA 709 C C . ASN A 93 ? 0.4814 0.3601 0.2455 0.0167 -0.0937 0.0588 93 ASN A C 710 O O . ASN A 93 ? 0.4506 0.3411 0.2422 0.0201 -0.0876 0.0574 93 ASN A O 711 C CB A ASN A 93 ? 0.5560 0.4611 0.3461 0.0046 -0.1288 0.0766 93 ASN A CB 712 C CB B ASN A 93 ? 0.5627 0.4679 0.3531 0.0046 -0.1289 0.0765 93 ASN A CB 713 C CG A ASN A 93 ? 0.6362 0.5415 0.4214 -0.0054 -0.1463 0.0753 93 ASN A CG 714 C CG B ASN A 93 ? 0.6171 0.5305 0.4094 0.0106 -0.1282 0.0922 93 ASN A CG 715 O OD1 A ASN A 93 ? 0.6966 0.5955 0.4644 -0.0065 -0.1508 0.0793 93 ASN A OD1 716 O OD1 B ASN A 93 ? 0.6331 0.5395 0.4138 0.0182 -0.1139 0.0946 93 ASN A OD1 717 N ND2 A ASN A 93 ? 0.4312 0.3432 0.2320 -0.0124 -0.1558 0.0698 93 ASN A ND2 718 N ND2 B ASN A 93 ? 0.6669 0.5940 0.4740 0.0076 -0.1431 0.1016 93 ASN A ND2 719 N N . TRP A 94 ? 0.5545 0.4226 0.2990 0.0228 -0.0800 0.0600 94 TRP A N 720 C CA . TRP A 94 ? 0.4562 0.3279 0.2123 0.0344 -0.0563 0.0601 94 TRP A CA 721 C C . TRP A 94 ? 0.4856 0.3827 0.2763 0.0421 -0.0579 0.0826 94 TRP A C 722 O O . TRP A 94 ? 0.4587 0.3674 0.2563 0.0406 -0.0709 0.0985 94 TRP A O 723 C CB . TRP A 94 ? 0.5481 0.3996 0.2709 0.0376 -0.0419 0.0549 94 TRP A CB 724 C CG . TRP A 94 ? 0.5008 0.3519 0.2311 0.0487 -0.0160 0.0507 94 TRP A CG 725 C CD1 . TRP A 94 ? 0.4651 0.3010 0.1852 0.0502 0.0027 0.0294 94 TRP A CD1 726 C CD2 . TRP A 94 ? 0.5419 0.4120 0.2989 0.0582 -0.0060 0.0659 94 TRP A CD2 727 N NE1 . TRP A 94 ? 0.4925 0.3365 0.2316 0.0605 0.0229 0.0312 94 TRP A NE1 728 C CE2 . TRP A 94 ? 0.5157 0.3804 0.2764 0.0652 0.0181 0.0530 94 TRP A CE2 729 C CE3 . TRP A 94 ? 0.4477 0.3410 0.2318 0.0595 -0.0155 0.0867 94 TRP A CE3 730 C CZ2 . TRP A 94 ? 0.4376 0.3187 0.2262 0.0735 0.0318 0.0599 94 TRP A CZ2 731 C CZ3 . TRP A 94 ? 0.3492 0.2572 0.1594 0.0667 -0.0012 0.0925 94 TRP A CZ3 732 C CH2 . TRP A 94 ? 0.3798 0.2821 0.1913 0.0738 0.0221 0.0791 94 TRP A CH2 733 N N . PRO A 95 ? 0.5016 0.4102 0.3194 0.0496 -0.0432 0.0823 95 PRO A N 734 C CA . PRO A 95 ? 0.4599 0.3576 0.2757 0.0513 -0.0271 0.0623 95 PRO A CA 735 C C . PRO A 95 ? 0.3542 0.2542 0.1826 0.0439 -0.0385 0.0533 95 PRO A C 736 O O . PRO A 95 ? 0.3276 0.2427 0.1746 0.0393 -0.0551 0.0655 95 PRO A O 737 C CB . PRO A 95 ? 0.4999 0.4097 0.3393 0.0633 -0.0083 0.0703 95 PRO A CB 738 C CG . PRO A 95 ? 0.2950 0.2292 0.1645 0.0633 -0.0201 0.0922 95 PRO A CG 739 C CD . PRO A 95 ? 0.3230 0.2558 0.1768 0.0564 -0.0403 0.1012 95 PRO A CD 740 N N . THR A 96 ? 0.3812 0.2659 0.2004 0.0427 -0.0297 0.0317 96 THR A N 741 C CA . THR A 96 ? 0.3855 0.2702 0.2162 0.0364 -0.0396 0.0220 96 THR A CA 742 C C . THR A 96 ? 0.2780 0.1803 0.1422 0.0414 -0.0370 0.0335 96 THR A C 743 O O . THR A 96 ? 0.3013 0.2091 0.1774 0.0513 -0.0202 0.0391 96 THR A O 744 C CB . THR A 96 ? 0.3040 0.1679 0.1197 0.0355 -0.0294 -0.0042 96 THR A CB 745 O OG1 . THR A 96 ? 0.3619 0.2244 0.1878 0.0293 -0.0407 -0.0138 96 THR A OG1 746 C CG2 . THR A 96 ? 0.2863 0.1469 0.1085 0.0469 -0.0058 -0.0099 96 THR A CG2 747 N N . THR A 97 ? 0.2748 0.1854 0.1536 0.0342 -0.0534 0.0376 97 THR A N 748 C CA . THR A 97 ? 0.3470 0.2736 0.2563 0.0368 -0.0525 0.0498 97 THR A CA 749 C C . THR A 97 ? 0.2633 0.1837 0.1783 0.0301 -0.0615 0.0385 97 THR A C 750 O O . THR A 97 ? 0.3099 0.2215 0.2113 0.0210 -0.0760 0.0282 97 THR A O 751 C CB . THR A 97 ? 0.4445 0.3922 0.3721 0.0349 -0.0646 0.0727 97 THR A CB 752 O OG1 . THR A 97 ? 0.4831 0.4296 0.3994 0.0245 -0.0859 0.0725 97 THR A OG1 753 C CG2 . THR A 97 ? 0.2592 0.2145 0.1869 0.0434 -0.0543 0.0859 97 THR A CG2 754 N N . PHE A 98 ? 0.2642 0.1881 0.1983 0.0344 -0.0530 0.0406 98 PHE A N 755 C CA . PHE A 98 ? 0.2669 0.1832 0.2065 0.0289 -0.0603 0.0310 98 PHE A CA 756 C C . PHE A 98 ? 0.3131 0.2459 0.2763 0.0240 -0.0702 0.0479 98 PHE A C 757 O O . PHE A 98 ? 0.3260 0.2762 0.3067 0.0278 -0.0656 0.0662 98 PHE A O 758 C CB . PHE A 98 ? 0.2767 0.1805 0.2180 0.0366 -0.0441 0.0191 98 PHE A CB 759 C CG . PHE A 98 ? 0.3591 0.2461 0.2805 0.0414 -0.0333 0.0002 98 PHE A CG 760 C CD1 . PHE A 98 ? 0.3386 0.2280 0.2553 0.0501 -0.0170 0.0039 98 PHE A CD1 761 C CD2 . PHE A 98 ? 0.3801 0.2484 0.2885 0.0371 -0.0389 -0.0218 98 PHE A CD2 762 C CE1 . PHE A 98 ? 0.2966 0.1702 0.1958 0.0541 -0.0058 -0.0141 98 PHE A CE1 763 C CE2 . PHE A 98 ? 0.4212 0.2902 0.3240 0.0371 -0.0258 -0.0351 98 PHE A CE2 764 C CZ . PHE A 98 ? 0.3534 0.2268 0.2535 0.0436 -0.0103 -0.0311 98 PHE A CZ 765 N N . GLY A 99 ? 0.3055 0.2323 0.2699 0.0154 -0.0837 0.0412 99 GLY A N 766 C CA . GLY A 99 ? 0.3998 0.3384 0.3861 0.0104 -0.0907 0.0543 99 GLY A CA 767 C C . GLY A 99 ? 0.3655 0.3009 0.3644 0.0165 -0.0754 0.0563 99 GLY A C 768 O O . GLY A 99 ? 0.3335 0.2583 0.3252 0.0251 -0.0602 0.0478 99 GLY A O 769 N N . ALA A 100 ? 0.3251 0.2689 0.3429 0.0115 -0.0795 0.0675 100 ALA A N 770 C CA . ALA A 100 ? 0.2512 0.1927 0.2796 0.0153 -0.0638 0.0692 100 ALA A CA 771 C C . ALA A 100 ? 0.3322 0.2515 0.3500 0.0116 -0.0683 0.0546 100 ALA A C 772 O O . ALA A 100 ? 0.2113 0.1261 0.2306 0.0151 -0.0534 0.0512 100 ALA A O 773 C CB . ALA A 100 ? 0.1828 0.1451 0.2352 0.0111 -0.0610 0.0852 100 ALA A CB 774 N N . GLY A 101 ? 0.3463 0.2539 0.3516 0.0040 -0.0867 0.0437 101 GLY A N 775 C CA . GLY A 101 ? 0.3375 0.2215 0.3301 0.0015 -0.0918 0.0268 101 GLY A CA 776 C C . GLY A 101 ? 0.3555 0.2381 0.3556 -0.0086 -0.1021 0.0309 101 GLY A C 777 O O . GLY A 101 ? 0.4468 0.3455 0.4647 -0.0125 -0.1012 0.0475 101 GLY A O 778 N N . THR A 102 ? 0.3686 0.1940 0.2174 -0.0520 -0.0066 0.0693 102 THR A N 779 C CA . THR A 102 ? 0.4469 0.2647 0.2964 -0.0566 -0.0179 0.0671 102 THR A CA 780 C C . THR A 102 ? 0.4402 0.2594 0.2980 -0.0529 -0.0113 0.0600 102 THR A C 781 O O . THR A 102 ? 0.3880 0.2059 0.2381 -0.0457 -0.0030 0.0534 102 THR A O 782 C CB . THR A 102 ? 0.5002 0.2982 0.3235 -0.0574 -0.0309 0.0625 102 THR A CB 783 O OG1 . THR A 102 ? 0.4085 0.2081 0.2271 -0.0634 -0.0398 0.0706 102 THR A OG1 784 C CG2 . THR A 102 ? 0.6350 0.4209 0.4562 -0.0615 -0.0412 0.0586 102 THR A CG2 785 N N . LYS A 103 ? 0.4512 0.2753 0.3252 -0.0573 -0.0146 0.0623 103 LYS A N 786 C CA . LYS A 103 ? 0.3919 0.2192 0.2751 -0.0541 -0.0091 0.0565 103 LYS A CA 787 C C . LYS A 103 ? 0.3936 0.2041 0.2621 -0.0529 -0.0183 0.0501 103 LYS A C 788 O O . LYS A 103 ? 0.4572 0.2580 0.3210 -0.0593 -0.0309 0.0533 103 LYS A O 789 C CB . LYS A 103 ? 0.3932 0.2342 0.3003 -0.0582 -0.0072 0.0626 103 LYS A CB 790 C CG . LYS A 103 ? 0.4316 0.2795 0.3505 -0.0551 -0.0003 0.0574 103 LYS A CG 791 C CD . LYS A 103 ? 0.4503 0.3105 0.3901 -0.0583 0.0014 0.0639 103 LYS A CD 792 C CE . LYS A 103 ? 0.5158 0.3834 0.4666 -0.0556 0.0073 0.0587 103 LYS A CE 793 N NZ . LYS A 103 ? 0.6139 0.4889 0.5673 -0.0531 0.0193 0.0543 103 LYS A NZ 794 N N . LEU A 104 ? 0.3953 0.2022 0.2557 -0.0448 -0.0120 0.0419 104 LEU A N 795 C CA . LEU A 104 ? 0.4130 0.2017 0.2571 -0.0411 -0.0187 0.0354 104 LEU A CA 796 C C . LEU A 104 ? 0.3880 0.1856 0.2488 -0.0398 -0.0152 0.0341 104 LEU A C 797 O O . LEU A 104 ? 0.3967 0.2073 0.2651 -0.0335 -0.0042 0.0308 104 LEU A O 798 C CB . LEU A 104 ? 0.3939 0.1716 0.2139 -0.0302 -0.0139 0.0279 104 LEU A CB 799 C CG . LEU A 104 ? 0.4170 0.1725 0.2165 -0.0240 -0.0196 0.0210 104 LEU A CG 800 C CD1 . LEU A 104 ? 0.4514 0.1816 0.2332 -0.0319 -0.0360 0.0216 104 LEU A CD1 801 C CD2 . LEU A 104 ? 0.5077 0.2568 0.2855 -0.0097 -0.0115 0.0144 104 LEU A CD2 802 N N . GLU A 105 ? 0.3900 0.1817 0.2566 -0.0461 -0.0248 0.0373 105 GLU A N 803 C CA . GLU A 105 ? 0.3934 0.1909 0.2730 -0.0445 -0.0231 0.0364 105 GLU A CA 804 C C . GLU A 105 ? 0.4575 0.2319 0.3165 -0.0398 -0.0293 0.0304 105 GLU A C 805 O O . GLU A 105 ? 0.5593 0.3104 0.3962 -0.0422 -0.0393 0.0290 105 GLU A O 806 C CB . GLU A 105 ? 0.4196 0.2272 0.3202 -0.0535 -0.0286 0.0452 105 GLU A CB 807 C CG . GLU A 105 ? 0.4230 0.2505 0.3417 -0.0567 -0.0222 0.0517 105 GLU A CG 808 C CD . GLU A 105 ? 0.5535 0.3912 0.4907 -0.0634 -0.0273 0.0616 105 GLU A CD 809 O OE1 . GLU A 105 ? 0.6323 0.4632 0.5685 -0.0674 -0.0374 0.0640 105 GLU A OE1 810 O OE2 . GLU A 105 ? 0.5764 0.4298 0.5289 -0.0638 -0.0207 0.0668 105 GLU A OE2 811 N N . LEU A 106 ? 0.3585 0.1382 0.2235 -0.0329 -0.0236 0.0271 106 LEU A N 812 C CA . LEU A 106 ? 0.3822 0.1400 0.2272 -0.0258 -0.0272 0.0216 106 LEU A CA 813 C C . LEU A 106 ? 0.4729 0.2308 0.3309 -0.0296 -0.0321 0.0251 106 LEU A C 814 O O . LEU A 106 ? 0.4407 0.2222 0.3232 -0.0301 -0.0260 0.0283 106 LEU A O 815 C CB . LEU A 106 ? 0.3848 0.1489 0.2219 -0.0113 -0.0151 0.0151 106 LEU A CB 816 C CG . LEU A 106 ? 0.6538 0.3972 0.4597 -0.0031 -0.0153 0.0096 106 LEU A CG 817 C CD1 . LEU A 106 ? 0.6068 0.3645 0.4094 0.0113 -0.0017 0.0059 106 LEU A CD1 818 C CD2 . LEU A 106 ? 0.7259 0.4328 0.5041 -0.0016 -0.0264 0.0062 106 LEU A CD2 819 N N . LYS A 107 ? 0.4554 0.1858 0.2957 -0.0325 -0.0433 0.0247 107 LYS A N 820 C CA . LYS A 107 ? 0.5191 0.2457 0.3678 -0.0349 -0.0479 0.0281 107 LYS A CA 821 C C . LYS A 107 ? 0.4935 0.2155 0.3332 -0.0205 -0.0400 0.0218 107 LYS A C 822 O O . LYS A 107 ? 0.5197 0.2329 0.3394 -0.0089 -0.0340 0.0149 107 LYS A O 823 C CB . LYS A 107 ? 0.5791 0.2767 0.4119 -0.0457 -0.0640 0.0312 107 LYS A CB 824 C CG . LYS A 107 ? 0.7004 0.4171 0.5501 -0.0591 -0.0713 0.0387 107 LYS A CG 825 C CD . LYS A 107 ? 0.7862 0.4877 0.6226 -0.0679 -0.0856 0.0396 107 LYS A CD 826 C CE . LYS A 107 ? 0.7948 0.5221 0.6548 -0.0799 -0.0924 0.0497 107 LYS A CE 827 N NZ . LYS A 107 ? 0.7438 0.4868 0.6122 -0.0828 -0.0898 0.0534 107 LYS A NZ 828 N N . ARG A 108 ? 0.3937 0.1235 0.2485 -0.0202 -0.0396 0.0253 108 ARG A N 829 C CA . ARG A 108 ? 0.4017 0.1271 0.2486 -0.0066 -0.0331 0.0210 108 ARG A CA 830 C C . ARG A 108 ? 0.5035 0.2294 0.3641 -0.0108 -0.0377 0.0270 108 ARG A C 831 O O . ARG A 108 ? 0.5431 0.2748 0.4197 -0.0237 -0.0452 0.0347 108 ARG A O 832 C CB . ARG A 108 ? 0.4538 0.2097 0.3133 0.0042 -0.0184 0.0177 108 ARG A CB 833 C CG . ARG A 108 ? 0.3622 0.1524 0.2546 -0.0023 -0.0137 0.0225 108 ARG A CG 834 C CD . ARG A 108 ? 0.3235 0.1390 0.2274 0.0083 -0.0019 0.0200 108 ARG A CD 835 N NE . ARG A 108 ? 0.3311 0.1401 0.2321 0.0158 -0.0024 0.0205 108 ARG A NE 836 C CZ . ARG A 108 ? 0.3655 0.1908 0.2696 0.0278 0.0065 0.0183 108 ARG A CZ 837 N NH1 . ARG A 108 ? 0.3941 0.2440 0.3047 0.0325 0.0161 0.0157 108 ARG A NH1 838 N NH2 . ARG A 108 ? 0.3340 0.1517 0.2346 0.0348 0.0057 0.0196 108 ARG A NH2 839 N N . THR A 109 ? 0.5001 0.2212 0.3541 0.0012 -0.0327 0.0245 109 THR A N 840 C CA . THR A 109 ? 0.3975 0.1201 0.2641 -0.0008 -0.0357 0.0304 109 THR A CA 841 C C . THR A 109 ? 0.4809 0.2424 0.3822 -0.0048 -0.0304 0.0359 109 THR A C 842 O O . THR A 109 ? 0.4940 0.2808 0.4072 -0.0019 -0.0216 0.0333 109 THR A O 843 C CB . THR A 109 ? 0.4143 0.1262 0.2663 0.0151 -0.0297 0.0266 109 THR A CB 844 O OG1 . THR A 109 ? 0.4107 0.1544 0.2749 0.0270 -0.0161 0.0234 109 THR A OG1 845 C CG2 . THR A 109 ? 0.4586 0.1299 0.2721 0.0220 -0.0333 0.0202 109 THR A CG2 846 N N . VAL A 110 ? 0.4628 0.2274 0.3789 -0.0116 -0.0359 0.0441 110 VAL A N 847 C CA . VAL A 110 ? 0.4060 0.2047 0.3520 -0.0135 -0.0308 0.0495 110 VAL A CA 848 C C . VAL A 110 ? 0.3124 0.1318 0.2647 0.0002 -0.0189 0.0446 110 VAL A C 849 O O . VAL A 110 ? 0.3287 0.1371 0.2681 0.0107 -0.0163 0.0416 110 VAL A O 850 C CB . VAL A 110 ? 0.3567 0.1542 0.3154 -0.0216 -0.0387 0.0603 110 VAL A CB 851 C CG1 . VAL A 110 ? 0.3512 0.1813 0.3361 -0.0180 -0.0317 0.0648 110 VAL A CG1 852 C CG2 . VAL A 110 ? 0.3811 0.1833 0.3446 -0.0345 -0.0459 0.0638 110 VAL A CG2 853 N N . ALA A 111 ? 0.3370 0.1862 0.3081 -0.0001 -0.0116 0.0439 111 ALA A N 854 C CA . ALA A 111 ? 0.3857 0.2591 0.3654 0.0102 -0.0013 0.0399 111 ALA A CA 855 C C . ALA A 111 ? 0.3793 0.2792 0.3835 0.0060 0.0012 0.0443 111 ALA A C 856 O O . ALA A 111 ? 0.3368 0.2442 0.3497 -0.0020 0.0007 0.0459 111 ALA A O 857 C CB . ALA A 111 ? 0.2570 0.1383 0.2291 0.0148 0.0061 0.0324 111 ALA A CB 858 N N . ALA A 112 ? 0.2951 0.2081 0.3087 0.0124 0.0040 0.0465 112 ALA A N 859 C CA . ALA A 112 ? 0.2321 0.1686 0.2662 0.0101 0.0062 0.0504 112 ALA A CA 860 C C . ALA A 112 ? 0.2858 0.2454 0.3266 0.0116 0.0144 0.0439 112 ALA A C 861 O O . ALA A 112 ? 0.2699 0.2352 0.3036 0.0178 0.0196 0.0378 112 ALA A O 862 C CB . ALA A 112 ? 0.1953 0.1381 0.2361 0.0169 0.0064 0.0552 112 ALA A CB 863 N N . PRO A 113 ? 0.1978 0.1706 0.2512 0.0061 0.0157 0.0457 113 PRO A N 864 C CA . PRO A 113 ? 0.1747 0.1665 0.2329 0.0055 0.0225 0.0396 113 PRO A CA 865 C C . PRO A 113 ? 0.2828 0.2958 0.3480 0.0128 0.0269 0.0374 113 PRO A C 866 O O . PRO A 113 ? 0.3647 0.3815 0.4358 0.0174 0.0254 0.0420 113 PRO A O 867 C CB . PRO A 113 ? 0.2122 0.2059 0.2786 -0.0018 0.0218 0.0431 113 PRO A CB 868 C CG . PRO A 113 ? 0.1462 0.1340 0.2181 -0.0014 0.0163 0.0524 113 PRO A CG 869 C CD . PRO A 113 ? 0.1613 0.1311 0.2233 -0.0002 0.0110 0.0541 113 PRO A CD 870 N N . SER A 114 ? 0.2792 0.3073 0.3436 0.0137 0.0323 0.0309 114 SER A N 871 C CA . SER A 114 ? 0.1352 0.1881 0.2076 0.0177 0.0363 0.0284 114 SER A CA 872 C C . SER A 114 ? 0.1987 0.2601 0.2781 0.0098 0.0374 0.0265 114 SER A C 873 O O . SER A 114 ? 0.2308 0.2875 0.3075 0.0019 0.0386 0.0237 114 SER A O 874 C CB . SER A 114 ? 0.1869 0.2546 0.2552 0.0221 0.0411 0.0238 114 SER A CB 875 O OG . SER A 114 ? 0.3687 0.4246 0.4266 0.0312 0.0408 0.0253 114 SER A OG 876 N N . VAL A 115 ? 0.2160 0.2881 0.3028 0.0125 0.0372 0.0283 115 VAL A N 877 C CA . VAL A 115 ? 0.1143 0.1885 0.2044 0.0069 0.0377 0.0273 115 VAL A CA 878 C C . VAL A 115 ? 0.1112 0.2069 0.2036 0.0059 0.0405 0.0211 115 VAL A C 879 O O . VAL A 115 ? 0.1445 0.2569 0.2406 0.0129 0.0411 0.0211 115 VAL A O 880 C CB . VAL A 115 ? 0.1152 0.1841 0.2100 0.0110 0.0352 0.0348 115 VAL A CB 881 C CG1 . VAL A 115 ? 0.1103 0.1780 0.2050 0.0072 0.0366 0.0341 115 VAL A CG1 882 C CG2 . VAL A 115 ? 0.1153 0.1655 0.2087 0.0104 0.0311 0.0421 115 VAL A CG2 883 N N . PHE A 116 ? 0.1973 0.2922 0.2870 -0.0032 0.0419 0.0163 116 PHE A N 884 C CA . PHE A 116 ? 0.1895 0.3016 0.2797 -0.0074 0.0432 0.0102 116 PHE A CA 885 C C . PHE A 116 ? 0.2282 0.3276 0.3132 -0.0135 0.0431 0.0082 116 PHE A C 886 O O . PHE A 116 ? 0.2764 0.3565 0.3570 -0.0175 0.0435 0.0100 116 PHE A O 887 C CB . PHE A 116 ? 0.1611 0.2857 0.2507 -0.0145 0.0451 0.0056 116 PHE A CB 888 C CG . PHE A 116 ? 0.2001 0.3329 0.2914 -0.0072 0.0463 0.0081 116 PHE A CG 889 C CD1 . PHE A 116 ? 0.1688 0.2845 0.2552 -0.0067 0.0467 0.0104 116 PHE A CD1 890 C CD2 . PHE A 116 ? 0.2748 0.4317 0.3705 0.0000 0.0474 0.0082 116 PHE A CD2 891 C CE1 . PHE A 116 ? 0.1794 0.2988 0.2634 0.0014 0.0480 0.0122 116 PHE A CE1 892 C CE2 . PHE A 116 ? 0.3154 0.4775 0.4098 0.0087 0.0494 0.0108 116 PHE A CE2 893 C CZ . PHE A 116 ? 0.2484 0.3903 0.3360 0.0096 0.0498 0.0125 116 PHE A CZ 894 N N . ILE A 117 ? 0.2098 0.3192 0.2935 -0.0133 0.0427 0.0046 117 ILE A N 895 C CA . ILE A 117 ? 0.2132 0.3086 0.2881 -0.0175 0.0429 0.0018 117 ILE A CA 896 C C . ILE A 117 ? 0.2607 0.3656 0.3304 -0.0280 0.0422 -0.0068 117 ILE A C 897 O O . ILE A 117 ? 0.3140 0.4425 0.3885 -0.0277 0.0408 -0.0093 117 ILE A O 898 C CB . ILE A 117 ? 0.2323 0.3261 0.3069 -0.0065 0.0425 0.0062 117 ILE A CB 899 C CG1 . ILE A 117 ? 0.1465 0.2225 0.2085 -0.0085 0.0436 0.0036 117 ILE A CG1 900 C CG2 . ILE A 117 ? 0.2019 0.3194 0.2815 -0.0003 0.0412 0.0048 117 ILE A CG2 901 C CD1 . ILE A 117 ? 0.1466 0.2196 0.2074 0.0040 0.0443 0.0098 117 ILE A CD1 902 N N . PHE A 118 ? 0.2245 0.3109 0.2838 -0.0379 0.0429 -0.0107 118 PHE A N 903 C CA . PHE A 118 ? 0.2063 0.2970 0.2588 -0.0511 0.0413 -0.0186 118 PHE A CA 904 C C . PHE A 118 ? 0.2597 0.3295 0.2963 -0.0524 0.0408 -0.0228 118 PHE A C 905 O O . PHE A 118 ? 0.2124 0.2560 0.2402 -0.0506 0.0433 -0.0206 118 PHE A O 906 C CB . PHE A 118 ? 0.1751 0.2604 0.2272 -0.0637 0.0427 -0.0196 118 PHE A CB 907 C CG . PHE A 118 ? 0.1604 0.2645 0.2249 -0.0615 0.0439 -0.0157 118 PHE A CG 908 C CD1 . PHE A 118 ? 0.1562 0.2896 0.2283 -0.0653 0.0428 -0.0172 118 PHE A CD1 909 C CD2 . PHE A 118 ? 0.1531 0.2454 0.2202 -0.0551 0.0460 -0.0100 118 PHE A CD2 910 C CE1 . PHE A 118 ? 0.1457 0.2951 0.2266 -0.0609 0.0449 -0.0131 118 PHE A CE1 911 C CE2 . PHE A 118 ? 0.2862 0.3920 0.3608 -0.0520 0.0471 -0.0070 118 PHE A CE2 912 C CZ . PHE A 118 ? 0.1407 0.2744 0.2216 -0.0540 0.0471 -0.0085 118 PHE A CZ 913 N N . PRO A 119 ? 0.3291 0.4085 0.3598 -0.0546 0.0377 -0.0287 119 PRO A N 914 C CA . PRO A 119 ? 0.3403 0.3960 0.3512 -0.0568 0.0369 -0.0343 119 PRO A CA 915 C C . PRO A 119 ? 0.3390 0.3739 0.3379 -0.0734 0.0367 -0.0395 119 PRO A C 916 O O . PRO A 119 ? 0.3258 0.3718 0.3337 -0.0845 0.0365 -0.0391 119 PRO A O 917 C CB . PRO A 119 ? 0.2658 0.3417 0.2745 -0.0569 0.0324 -0.0398 119 PRO A CB 918 C CG . PRO A 119 ? 0.2004 0.3099 0.2295 -0.0489 0.0323 -0.0344 119 PRO A CG 919 C CD . PRO A 119 ? 0.3175 0.4299 0.3581 -0.0536 0.0347 -0.0302 119 PRO A CD 920 N N . PRO A 120 ? 0.2692 0.2731 0.2467 -0.0750 0.0373 -0.0437 120 PRO A N 921 C CA . PRO A 120 ? 0.3014 0.2836 0.2650 -0.0925 0.0365 -0.0494 120 PRO A CA 922 C C . PRO A 120 ? 0.3041 0.3041 0.2666 -0.1093 0.0300 -0.0570 120 PRO A C 923 O O . PRO A 120 ? 0.3046 0.3207 0.2659 -0.1062 0.0259 -0.0607 120 PRO A O 924 C CB . PRO A 120 ? 0.3223 0.2656 0.2603 -0.0862 0.0389 -0.0519 120 PRO A CB 925 C CG . PRO A 120 ? 0.3503 0.3025 0.2872 -0.0692 0.0386 -0.0507 120 PRO A CG 926 C CD . PRO A 120 ? 0.3263 0.3116 0.2901 -0.0599 0.0394 -0.0426 120 PRO A CD 927 N N . SER A 121 ? 0.3715 0.3705 0.3351 -0.1273 0.0289 -0.0584 121 SER A N 928 C CA . SER A 121 ? 0.3777 0.3950 0.3412 -0.1460 0.0222 -0.0642 121 SER A CA 929 C C . SER A 121 ? 0.4397 0.4265 0.3751 -0.1552 0.0175 -0.0737 121 SER A C 930 O O . SER A 121 ? 0.4873 0.4331 0.4018 -0.1521 0.0207 -0.0756 121 SER A O 931 C CB . SER A 121 ? 0.3953 0.4215 0.3688 -0.1629 0.0227 -0.0612 121 SER A CB 932 O OG . SER A 121 ? 0.4714 0.4585 0.4292 -0.1695 0.0259 -0.0618 121 SER A OG 933 N N . ASP A 122 ? 0.4304 0.4372 0.3639 -0.1663 0.0098 -0.0795 122 ASP A N 934 C CA . ASP A 122 ? 0.5460 0.5233 0.4507 -0.1790 0.0036 -0.0896 122 ASP A CA 935 C C . ASP A 122 ? 0.4420 0.3885 0.3331 -0.1993 0.0032 -0.0918 122 ASP A C 936 O O . ASP A 122 ? 0.4819 0.3864 0.3428 -0.2056 0.0009 -0.0994 122 ASP A O 937 C CB . ASP A 122 ? 0.6074 0.6171 0.5150 -0.1900 -0.0058 -0.0947 122 ASP A CB 938 C CG . ASP A 122 ? 0.6640 0.7011 0.5818 -0.1694 -0.0054 -0.0929 122 ASP A CG 939 O OD1 . ASP A 122 ? 0.6619 0.6807 0.5735 -0.1483 0.0005 -0.0909 122 ASP A OD1 940 O OD2 . ASP A 122 ? 0.7110 0.7892 0.6431 -0.1740 -0.0106 -0.0925 122 ASP A OD2 941 N N . GLU A 123 ? 0.4784 0.4434 0.3897 -0.2090 0.0056 -0.0850 123 GLU A N 942 C CA . GLU A 123 ? 0.5886 0.5246 0.4887 -0.2270 0.0064 -0.0853 123 GLU A CA 943 C C . GLU A 123 ? 0.5768 0.4650 0.4580 -0.2140 0.0142 -0.0846 123 GLU A C 944 O O . GLU A 123 ? 0.5658 0.4129 0.4217 -0.2223 0.0135 -0.0886 123 GLU A O 945 C CB . GLU A 123 ? 0.5558 0.5257 0.4834 -0.2328 0.0087 -0.0754 123 GLU A CB 946 C CG . GLU A 123 ? 0.5865 0.6031 0.5316 -0.2426 0.0019 -0.0727 123 GLU A CG 947 C CD . GLU A 123 ? 0.6597 0.7210 0.6264 -0.2330 0.0020 -0.0714 123 GLU A CD 948 O OE1 . GLU A 123 ? 0.6304 0.6826 0.5933 -0.2133 0.0050 -0.0731 123 GLU A OE1 949 O OE2 . GLU A 123 ? 0.7764 0.8801 0.7631 -0.2350 0.0001 -0.0649 123 GLU A OE2 950 N N . GLN A 124 ? 0.4352 0.3294 0.3286 -0.1911 0.0215 -0.0779 124 GLN A N 951 C CA . GLN A 124 ? 0.5754 0.4298 0.4534 -0.1778 0.0291 -0.0752 124 GLN A CA 952 C C . GLN A 124 ? 0.5746 0.3933 0.4223 -0.1680 0.0286 -0.0820 124 GLN A C 953 O O . GLN A 124 ? 0.6624 0.4372 0.4858 -0.1658 0.0328 -0.0831 124 GLN A O 954 C CB . GLN A 124 ? 0.4078 0.2808 0.3074 -0.1574 0.0357 -0.0655 124 GLN A CB 955 C CG . GLN A 124 ? 0.5413 0.3792 0.4288 -0.1451 0.0435 -0.0605 124 GLN A CG 956 C CD . GLN A 124 ? 0.5131 0.3681 0.4189 -0.1244 0.0484 -0.0513 124 GLN A CD 957 O OE1 . GLN A 124 ? 0.5648 0.4552 0.4918 -0.1191 0.0463 -0.0489 124 GLN A OE1 958 N NE2 . GLN A 124 ? 0.3886 0.2179 0.2856 -0.1128 0.0548 -0.0456 124 GLN A NE2 959 N N . LEU A 125 ? 0.4731 0.3095 0.3206 -0.1608 0.0240 -0.0862 125 LEU A N 960 C CA . LEU A 125 ? 0.5995 0.4045 0.4175 -0.1491 0.0239 -0.0924 125 LEU A CA 961 C C . LEU A 125 ? 0.7102 0.4718 0.4935 -0.1665 0.0194 -0.1025 125 LEU A C 962 O O . LEU A 125 ? 0.8578 0.5785 0.6098 -0.1557 0.0219 -0.1067 125 LEU A O 963 C CB . LEU A 125 ? 0.4878 0.3242 0.3134 -0.1405 0.0190 -0.0950 125 LEU A CB 964 C CG . LEU A 125 ? 0.4415 0.3131 0.2961 -0.1204 0.0239 -0.0850 125 LEU A CG 965 C CD1 . LEU A 125 ? 0.4265 0.3329 0.2907 -0.1150 0.0186 -0.0872 125 LEU A CD1 966 C CD2 . LEU A 125 ? 0.5056 0.3522 0.3508 -0.0978 0.0323 -0.0787 125 LEU A CD2 967 N N . LYS A 126 ? 0.6372 0.4062 0.4242 -0.1932 0.0128 -0.1059 126 LYS A N 968 C CA . LYS A 126 ? 0.7098 0.4410 0.4682 -0.2083 0.0079 -0.1122 126 LYS A CA 969 C C . LYS A 126 ? 0.6869 0.3763 0.4297 -0.2006 0.0160 -0.1070 126 LYS A C 970 O O . LYS A 126 ? 0.7499 0.4054 0.4676 -0.2050 0.0136 -0.1101 126 LYS A O 971 C CB . LYS A 126 ? 0.7764 0.5394 0.5537 -0.2309 -0.0003 -0.1098 126 LYS A CB 972 C CG . LYS A 126 ? 0.7526 0.5557 0.5412 -0.2395 -0.0097 -0.1145 126 LYS A CG 973 C CD . LYS A 126 ? 0.7893 0.6214 0.5946 -0.2605 -0.0170 -0.1103 126 LYS A CD 974 C CE . LYS A 126 ? 0.8389 0.7121 0.6548 -0.2679 -0.0263 -0.1137 126 LYS A CE 975 N NZ . LYS A 126 ? 0.8583 0.7608 0.6901 -0.2872 -0.0328 -0.1083 126 LYS A NZ 976 N N . SER A 127 ? 0.6943 0.3860 0.4513 -0.1893 0.0253 -0.0990 127 SER A N 977 C CA . SER A 127 ? 0.8223 0.4801 0.5672 -0.1804 0.0333 -0.0926 127 SER A CA 978 C C . SER A 127 ? 0.9103 0.5389 0.6366 -0.1554 0.0422 -0.0914 127 SER A C 979 O O . SER A 127 ? 0.9416 0.5456 0.6590 -0.1447 0.0497 -0.0846 127 SER A O 980 C CB . SER A 127 ? 0.8564 0.5386 0.6304 -0.1847 0.0374 -0.0826 127 SER A CB 981 O OG . SER A 127 ? 0.8429 0.5514 0.6397 -0.1750 0.0419 -0.0783 127 SER A OG 982 N N . GLY A 128 ? 0.9135 0.5529 0.6379 -0.1421 0.0413 -0.0949 128 GLY A N 983 C CA . GLY A 128 ? 0.9744 0.5952 0.6841 -0.1140 0.0490 -0.0906 128 GLY A CA 984 C C . GLY A 128 ? 0.8858 0.5354 0.6247 -0.0947 0.0564 -0.0771 128 GLY A C 985 O O . GLY A 128 ? 0.8421 0.4767 0.5702 -0.0718 0.0636 -0.0710 128 GLY A O 986 N N . THR A 129 ? 0.4378 0.4908 0.8654 0.0051 0.0764 -0.1613 129 THR A N 987 C CA . THR A 129 ? 0.4364 0.4866 0.8434 0.0147 0.0684 -0.1453 129 THR A CA 988 C C . THR A 129 ? 0.3296 0.3935 0.7102 0.0113 0.0616 -0.1468 129 THR A C 989 O O . THR A 129 ? 0.1930 0.2613 0.5763 0.0011 0.0672 -0.1589 129 THR A O 990 C CB . THR A 129 ? 0.5204 0.5450 0.9377 0.0179 0.0809 -0.1362 129 THR A CB 991 O OG1 . THR A 129 ? 0.5889 0.5918 1.0211 0.0259 0.0853 -0.1325 129 THR A OG1 992 C CG2 . THR A 129 ? 0.5076 0.5312 0.9058 0.0285 0.0699 -0.1213 129 THR A CG2 993 N N . ALA A 130 ? 0.2389 0.3093 0.5947 0.0198 0.0501 -0.1354 130 ALA A N 994 C CA . ALA A 130 ? 0.2711 0.3509 0.5998 0.0193 0.0443 -0.1341 130 ALA A CA 995 C C . ALA A 130 ? 0.1722 0.2475 0.4920 0.0235 0.0432 -0.1213 130 ALA A C 996 O O . ALA A 130 ? 0.1640 0.2368 0.4863 0.0310 0.0389 -0.1114 130 ALA A O 997 C CB . ALA A 130 ? 0.2447 0.3365 0.5659 0.0220 0.0352 -0.1402 130 ALA A CB 998 N N . SER A 131 ? 0.1596 0.2352 0.4711 0.0186 0.0464 -0.1232 131 SER A N 999 C CA . SER A 131 ? 0.1549 0.2282 0.4571 0.0220 0.0450 -0.1127 131 SER A CA 1000 C C . SER A 131 ? 0.1973 0.2810 0.4702 0.0224 0.0382 -0.1115 131 SER A C 1001 O O . SER A 131 ? 0.2395 0.3279 0.5057 0.0172 0.0391 -0.1211 131 SER A O 1002 C CB . SER A 131 ? 0.1663 0.2269 0.4851 0.0166 0.0582 -0.1149 131 SER A CB 1003 O OG . SER A 131 ? 0.1842 0.2263 0.5253 0.0219 0.0649 -0.1093 131 SER A OG 1004 N N . VAL A 132 ? 0.1711 0.2581 0.4294 0.0287 0.0319 -0.1009 132 VAL A N 1005 C CA . VAL A 132 ? 0.1347 0.2280 0.3729 0.0291 0.0278 -0.1013 132 VAL A CA 1006 C C . VAL A 132 ? 0.1226 0.2142 0.3528 0.0303 0.0279 -0.0910 132 VAL A C 1007 O O . VAL A 132 ? 0.1227 0.2140 0.3615 0.0340 0.0255 -0.0835 132 VAL A O 1008 C CB . VAL A 132 ? 0.1283 0.2261 0.3620 0.0330 0.0240 -0.1016 132 VAL A CB 1009 C CG1 . VAL A 132 ? 0.1263 0.2288 0.3402 0.0343 0.0218 -0.1050 132 VAL A CG1 1010 C CG2 . VAL A 132 ? 0.1354 0.2348 0.3832 0.0328 0.0241 -0.1105 132 VAL A CG2 1011 N N . VAL A 133 ? 0.1203 0.2130 0.3409 0.0267 0.0295 -0.0948 133 VAL A N 1012 C CA . VAL A 133 ? 0.1176 0.2100 0.3375 0.0261 0.0305 -0.0900 133 VAL A CA 1013 C C . VAL A 133 ? 0.1737 0.2705 0.3698 0.0284 0.0259 -0.0861 133 VAL A C 1014 O O . VAL A 133 ? 0.1626 0.2613 0.3444 0.0283 0.0240 -0.0922 133 VAL A O 1015 C CB . VAL A 133 ? 0.1236 0.2130 0.3526 0.0189 0.0390 -0.0986 133 VAL A CB 1016 C CG1 . VAL A 133 ? 0.1223 0.2115 0.3505 0.0186 0.0415 -0.0934 133 VAL A CG1 1017 C CG2 . VAL A 133 ? 0.1429 0.2230 0.3983 0.0157 0.0484 -0.1032 133 VAL A CG2 1018 N N . CYS A 134 ? 0.2081 0.3068 0.4047 0.0307 0.0236 -0.0782 134 CYS A N 1019 C CA . CYS A 134 ? 0.2252 0.3265 0.4040 0.0318 0.0215 -0.0752 134 CYS A CA 1020 C C . CYS A 134 ? 0.2389 0.3431 0.4205 0.0297 0.0213 -0.0738 134 CYS A C 1021 O O . CYS A 134 ? 0.2524 0.3589 0.4522 0.0309 0.0193 -0.0692 134 CYS A O 1022 C CB . CYS A 134 ? 0.3247 0.4283 0.5059 0.0345 0.0200 -0.0703 134 CYS A CB 1023 S SG . CYS A 134 ? 0.3368 0.4417 0.5019 0.0349 0.0213 -0.0691 134 CYS A SG 1024 N N . LEU A 135 ? 0.1601 0.2646 0.3250 0.0278 0.0221 -0.0781 135 LEU A N 1025 C CA . LEU A 135 ? 0.1740 0.2823 0.3396 0.0248 0.0236 -0.0791 135 LEU A CA 1026 C C . LEU A 135 ? 0.1638 0.2757 0.3156 0.0262 0.0201 -0.0764 135 LEU A C 1027 O O . LEU A 135 ? 0.1929 0.3007 0.3256 0.0283 0.0192 -0.0787 135 LEU A O 1028 C CB . LEU A 135 ? 0.1003 0.2077 0.2595 0.0198 0.0280 -0.0893 135 LEU A CB 1029 C CG . LEU A 135 ? 0.1850 0.2966 0.3390 0.0152 0.0318 -0.0926 135 LEU A CG 1030 C CD1 . LEU A 135 ? 0.2464 0.3593 0.4214 0.0120 0.0400 -0.0893 135 LEU A CD1 1031 C CD2 . LEU A 135 ? 0.2374 0.3493 0.3834 0.0096 0.0342 -0.1045 135 LEU A CD2 1032 N N . LEU A 136 ? 0.0884 0.2083 0.2518 0.0253 0.0175 -0.0722 136 LEU A N 1033 C CA . LEU A 136 ? 0.1359 0.2621 0.2898 0.0247 0.0143 -0.0716 136 LEU A CA 1034 C C . LEU A 136 ? 0.1771 0.2991 0.3144 0.0185 0.0136 -0.0698 136 LEU A C 1035 O O . LEU A 136 ? 0.2814 0.3923 0.4147 0.0140 0.0095 -0.0596 136 LEU A O 1036 C CB . LEU A 136 ? 0.2096 0.3428 0.3807 0.0249 0.0071 -0.0653 136 LEU A CB 1037 C CG . LEU A 136 ? 0.2377 0.3681 0.4144 0.0265 0.0090 -0.0646 136 LEU A CG 1038 C CD1 . LEU A 136 ? 0.0881 0.2115 0.2712 0.0294 0.0108 -0.0634 136 LEU A CD1 1039 C CD2 . LEU A 136 ? 0.0859 0.2270 0.2818 0.0249 0.0010 -0.0625 136 LEU A CD2 1040 N N . ASN A 137 ? 0.0911 0.2152 0.2107 0.0186 0.0169 -0.0784 137 ASN A N 1041 C CA . ASN A 137 ? 0.2153 0.3343 0.3174 0.0117 0.0191 -0.0799 137 ASN A CA 1042 C C . ASN A 137 ? 0.1935 0.3083 0.2719 0.0085 0.0132 -0.0747 137 ASN A C 1043 O O . ASN A 137 ? 0.1275 0.2443 0.1976 0.0134 0.0123 -0.0791 137 ASN A O 1044 C CB . ASN A 137 ? 0.2128 0.3367 0.3139 0.0140 0.0249 -0.0958 137 ASN A CB 1045 C CG . ASN A 137 ? 0.2337 0.3584 0.3333 0.0049 0.0338 -0.1033 137 ASN A CG 1046 O OD1 . ASN A 137 ? 0.2866 0.3980 0.3853 -0.0038 0.0379 -0.0931 137 ASN A OD1 1047 N ND2 . ASN A 137 ? 0.2327 0.3563 0.3202 0.0033 0.0302 -0.1096 137 ASN A ND2 1048 N N . ASN A 138 ? 0.2152 0.3200 0.2792 0.0004 0.0103 -0.0656 138 ASN A N 1049 C CA . ASN A 138 ? 0.2422 0.3430 0.2823 -0.0040 0.0055 -0.0628 138 ASN A CA 1050 C C . ASN A 138 ? 0.2084 0.3123 0.2489 -0.0016 -0.0017 -0.0597 138 ASN A C 1051 O O . ASN A 138 ? 0.2257 0.3303 0.2563 0.0010 0.0007 -0.0667 138 ASN A O 1052 C CB . ASN A 138 ? 0.1291 0.2346 0.1568 -0.0040 0.0121 -0.0769 138 ASN A CB 1053 C CG . ASN A 138 ? 0.2619 0.3672 0.2937 -0.0098 0.0226 -0.0845 138 ASN A CG 1054 O OD1 . ASN A 138 ? 0.3667 0.4597 0.3993 -0.0161 0.0259 -0.0752 138 ASN A OD1 1055 N ND2 . ASN A 138 ? 0.3279 0.4450 0.3613 -0.0073 0.0285 -0.1034 138 ASN A ND2 1056 N N . PHE A 139 ? 0.1636 0.2671 0.2146 -0.0024 -0.0102 -0.0505 139 PHE A N 1057 C CA . PHE A 139 ? 0.1795 0.2893 0.2384 -0.0030 -0.0154 -0.0509 139 PHE A CA 1058 C C . PHE A 139 ? 0.2062 0.3153 0.2613 -0.0056 -0.0290 -0.0441 139 PHE A C 1059 O O . PHE A 139 ? 0.2568 0.3567 0.3024 -0.0042 -0.0354 -0.0363 139 PHE A O 1060 C CB . PHE A 139 ? 0.1347 0.2532 0.2220 0.0014 -0.0122 -0.0539 139 PHE A CB 1061 C CG . PHE A 139 ? 0.1513 0.2720 0.2584 0.0056 -0.0185 -0.0484 139 PHE A CG 1062 C CD1 . PHE A 139 ? 0.1543 0.2705 0.2654 0.0089 -0.0124 -0.0482 139 PHE A CD1 1063 C CD2 . PHE A 139 ? 0.1817 0.3091 0.3047 0.0072 -0.0309 -0.0458 139 PHE A CD2 1064 C CE1 . PHE A 139 ? 0.1996 0.3123 0.3256 0.0132 -0.0173 -0.0427 139 PHE A CE1 1065 C CE2 . PHE A 139 ? 0.2311 0.3568 0.3687 0.0143 -0.0385 -0.0412 139 PHE A CE2 1066 C CZ . PHE A 139 ? 0.1805 0.2962 0.3175 0.0170 -0.0310 -0.0383 139 PHE A CZ 1067 N N . TYR A 140 ? 0.2543 0.3707 0.3144 -0.0090 -0.0328 -0.0486 140 TYR A N 1068 C CA . TYR A 140 ? 0.1569 0.2785 0.2190 -0.0098 -0.0481 -0.0472 140 TYR A CA 1069 C C . TYR A 140 ? 0.2424 0.3792 0.3297 -0.0142 -0.0474 -0.0580 140 TYR A C 1070 O O . TYR A 140 ? 0.2749 0.4080 0.3573 -0.0202 -0.0342 -0.0639 140 TYR A O 1071 C CB . TYR A 140 ? 0.2475 0.3591 0.2767 -0.0139 -0.0524 -0.0443 140 TYR A CB 1072 C CG . TYR A 140 ? 0.2317 0.3471 0.2578 -0.0118 -0.0708 -0.0435 140 TYR A CG 1073 C CD1 . TYR A 140 ? 0.2285 0.3320 0.2396 -0.0039 -0.0830 -0.0341 140 TYR A CD1 1074 C CD2 . TYR A 140 ? 0.1912 0.3195 0.2274 -0.0168 -0.0759 -0.0536 140 TYR A CD2 1075 C CE1 . TYR A 140 ? 0.2870 0.3920 0.2905 0.0022 -0.1029 -0.0347 140 TYR A CE1 1076 C CE2 . TYR A 140 ? 0.2097 0.3453 0.2457 -0.0129 -0.0952 -0.0566 140 TYR A CE2 1077 C CZ . TYR A 140 ? 0.2518 0.3760 0.2702 -0.0018 -0.1103 -0.0471 140 TYR A CZ 1078 O OH . TYR A 140 ? 0.2677 0.3969 0.2807 0.0062 -0.1325 -0.0512 140 TYR A OH 1079 N N . PRO A 141 ? 0.2469 0.3992 0.3602 -0.0108 -0.0610 -0.0625 141 PRO A N 1080 C CA . PRO A 141 ? 0.1828 0.3339 0.2949 0.0001 -0.0798 -0.0559 141 PRO A CA 1081 C C . PRO A 141 ? 0.1665 0.3147 0.2934 0.0085 -0.0784 -0.0507 141 PRO A C 1082 O O . PRO A 141 ? 0.2376 0.3854 0.3735 0.0058 -0.0624 -0.0516 141 PRO A O 1083 C CB . PRO A 141 ? 0.1776 0.3510 0.3165 0.0019 -0.0957 -0.0690 141 PRO A CB 1084 C CG . PRO A 141 ? 0.1584 0.3482 0.3300 -0.0083 -0.0796 -0.0829 141 PRO A CG 1085 C CD . PRO A 141 ? 0.2597 0.4308 0.4048 -0.0173 -0.0583 -0.0775 141 PRO A CD 1086 N N . ARG A 142 ? 0.1870 0.3310 0.3135 0.0205 -0.0962 -0.0461 142 ARG A N 1087 C CA . ARG A 142 ? 0.2878 0.4216 0.4209 0.0297 -0.0960 -0.0393 142 ARG A CA 1088 C C . ARG A 142 ? 0.1693 0.3260 0.3483 0.0316 -0.0920 -0.0505 142 ARG A C 1089 O O . ARG A 142 ? 0.2687 0.4191 0.4561 0.0355 -0.0849 -0.0467 142 ARG A O 1090 C CB . ARG A 142 ? 0.4844 0.6001 0.5969 0.0445 -0.1174 -0.0312 142 ARG A CB 1091 C CG . ARG A 142 ? 0.4997 0.5906 0.6029 0.0533 -0.1152 -0.0203 142 ARG A CG 1092 C CD . ARG A 142 ? 0.5921 0.6594 0.6695 0.0715 -0.1384 -0.0129 142 ARG A CD 1093 N NE . ARG A 142 ? 0.7247 0.7534 0.7760 0.0774 -0.1323 0.0011 142 ARG A NE 1094 C CZ . ARG A 142 ? 0.8088 0.8331 0.8792 0.0897 -0.1376 0.0009 142 ARG A CZ 1095 N NH1 . ARG A 142 ? 0.7924 0.8522 0.9109 0.0976 -0.1497 -0.0138 142 ARG A NH1 1096 N NH2 . ARG A 142 ? 0.8735 0.8571 0.9159 0.0931 -0.1292 0.0138 142 ARG A NH2 1097 N N . GLU A 143 ? 0.1589 0.3421 0.3687 0.0277 -0.0947 -0.0658 143 GLU A N 1098 C CA . GLU A 143 ? 0.1537 0.3545 0.4025 0.0276 -0.0871 -0.0771 143 GLU A CA 1099 C C . GLU A 143 ? 0.1251 0.3215 0.3751 0.0189 -0.0625 -0.0765 143 GLU A C 1100 O O . GLU A 143 ? 0.1162 0.3098 0.3530 0.0086 -0.0495 -0.0781 143 GLU A O 1101 C CB . GLU A 143 ? 0.1534 0.3704 0.4202 0.0212 -0.0869 -0.0920 143 GLU A CB 1102 C CG . GLU A 143 ? 0.3044 0.5295 0.5977 0.0149 -0.0691 -0.1033 143 GLU A CG 1103 C CD . GLU A 143 ? 0.4099 0.6359 0.7190 0.0267 -0.0756 -0.1035 143 GLU A CD 1104 O OE1 . GLU A 143 ? 0.4048 0.6277 0.7091 0.0411 -0.0967 -0.0983 143 GLU A OE1 1105 O OE2 . GLU A 143 ? 0.4621 0.6893 0.7854 0.0221 -0.0599 -0.1092 143 GLU A OE2 1106 N N . ALA A 144 ? 0.1828 0.3746 0.4430 0.0242 -0.0564 -0.0743 144 ALA A N 1107 C CA . ALA A 144 ? 0.1095 0.2936 0.3654 0.0190 -0.0351 -0.0742 144 ALA A CA 1108 C C . ALA A 144 ? 0.1917 0.3750 0.4632 0.0238 -0.0318 -0.0764 144 ALA A C 1109 O O . ALA A 144 ? 0.1999 0.3840 0.4812 0.0336 -0.0455 -0.0739 144 ALA A O 1110 C CB . ALA A 144 ? 0.1007 0.2734 0.3367 0.0209 -0.0309 -0.0659 144 ALA A CB 1111 N N . LYS A 145 ? 0.2470 0.4267 0.5182 0.0178 -0.0143 -0.0816 145 LYS A N 1112 C CA . LYS A 145 ? 0.2259 0.4043 0.5088 0.0205 -0.0095 -0.0850 145 LYS A CA 1113 C C . LYS A 145 ? 0.2488 0.4121 0.5128 0.0217 0.0018 -0.0794 145 LYS A C 1114 O O . LYS A 145 ? 0.3133 0.4688 0.5590 0.0176 0.0131 -0.0797 145 LYS A O 1115 C CB . LYS A 145 ? 0.2763 0.4634 0.5762 0.0124 0.0007 -0.0989 145 LYS A CB 1116 C CG . LYS A 145 ? 0.2830 0.4877 0.6060 0.0117 -0.0108 -0.1092 145 LYS A CG 1117 C CD . LYS A 145 ? 0.3769 0.5888 0.7166 0.0237 -0.0281 -0.1098 145 LYS A CD 1118 C CE . LYS A 145 ? 0.4220 0.6531 0.7866 0.0248 -0.0397 -0.1249 145 LYS A CE 1119 N NZ . LYS A 145 ? 0.4300 0.6665 0.8075 0.0400 -0.0601 -0.1261 145 LYS A NZ 1120 N N . VAL A 146 ? 0.1095 0.2684 0.3770 0.0281 -0.0018 -0.0756 146 VAL A N 1121 C CA . VAL A 146 ? 0.1064 0.2528 0.3582 0.0294 0.0070 -0.0727 146 VAL A CA 1122 C C . VAL A 146 ? 0.1680 0.3163 0.4329 0.0303 0.0103 -0.0779 146 VAL A C 1123 O O . VAL A 146 ? 0.1190 0.2732 0.4026 0.0349 0.0013 -0.0790 146 VAL A O 1124 C CB . VAL A 146 ? 0.1072 0.2457 0.3513 0.0344 0.0017 -0.0653 146 VAL A CB 1125 C CG1 . VAL A 146 ? 0.1751 0.3033 0.4063 0.0351 0.0095 -0.0654 146 VAL A CG1 1126 C CG2 . VAL A 146 ? 0.0988 0.2364 0.3305 0.0327 0.0001 -0.0621 146 VAL A CG2 1127 N N . GLN A 147 ? 0.1654 0.3081 0.4203 0.0271 0.0224 -0.0817 147 GLN A N 1128 C CA . GLN A 147 ? 0.1491 0.2940 0.4157 0.0268 0.0275 -0.0879 147 GLN A CA 1129 C C . GLN A 147 ? 0.1918 0.3258 0.4400 0.0304 0.0315 -0.0842 147 GLN A C 1130 O O . GLN A 147 ? 0.2815 0.4070 0.5073 0.0306 0.0383 -0.0828 147 GLN A O 1131 C CB . GLN A 147 ? 0.2270 0.3759 0.5010 0.0191 0.0400 -0.0983 147 GLN A CB 1132 C CG . GLN A 147 ? 0.3262 0.4793 0.6166 0.0174 0.0464 -0.1072 147 GLN A CG 1133 C CD . GLN A 147 ? 0.4924 0.6484 0.7929 0.0071 0.0620 -0.1198 147 GLN A CD 1134 O OE1 . GLN A 147 ? 0.5043 0.6725 0.8273 0.0018 0.0602 -0.1292 147 GLN A OE1 1135 N NE2 . GLN A 147 ? 0.5274 0.6708 0.8098 0.0041 0.0784 -0.1210 147 GLN A NE2 1136 N N . TRP A 148 ? 0.1226 0.2570 0.3804 0.0342 0.0267 -0.0837 148 TRP A N 1137 C CA . TRP A 148 ? 0.1240 0.2504 0.3702 0.0368 0.0292 -0.0833 148 TRP A CA 1138 C C . TRP A 148 ? 0.1327 0.2614 0.3862 0.0358 0.0371 -0.0915 148 TRP A C 1139 O O . TRP A 148 ? 0.1377 0.2749 0.4127 0.0343 0.0373 -0.0972 148 TRP A O 1140 C CB . TRP A 148 ? 0.1676 0.2919 0.4237 0.0403 0.0213 -0.0810 148 TRP A CB 1141 C CG . TRP A 148 ? 0.1187 0.2375 0.3634 0.0413 0.0174 -0.0738 148 TRP A CG 1142 C CD1 . TRP A 148 ? 0.2492 0.3701 0.5047 0.0431 0.0103 -0.0703 148 TRP A CD1 1143 C CD2 . TRP A 148 ? 0.1392 0.2505 0.3674 0.0403 0.0199 -0.0743 148 TRP A CD2 1144 N NE1 . TRP A 148 ? 0.1921 0.3064 0.4375 0.0426 0.0105 -0.0672 148 TRP A NE1 1145 C CE2 . TRP A 148 ? 0.2280 0.3372 0.4556 0.0404 0.0166 -0.0696 148 TRP A CE2 1146 C CE3 . TRP A 148 ? 0.2097 0.3177 0.4267 0.0398 0.0238 -0.0808 148 TRP A CE3 1147 C CZ2 . TRP A 148 ? 0.1106 0.2145 0.3258 0.0386 0.0188 -0.0709 148 TRP A CZ2 1148 C CZ3 . TRP A 148 ? 0.1952 0.2993 0.4006 0.0391 0.0232 -0.0827 148 TRP A CZ3 1149 C CH2 . TRP A 148 ? 0.2208 0.3227 0.4252 0.0377 0.0215 -0.0779 148 TRP A CH2 1150 N N . LYS A 149 ? 0.1799 0.3020 0.4154 0.0376 0.0435 -0.0929 149 LYS A N 1151 C CA . LYS A 149 ? 0.1900 0.3128 0.4280 0.0382 0.0522 -0.0996 149 LYS A CA 1152 C C . LYS A 149 ? 0.1517 0.2699 0.3794 0.0433 0.0503 -0.1013 149 LYS A C 1153 O O . LYS A 149 ? 0.2234 0.3355 0.4302 0.0470 0.0487 -0.0987 149 LYS A O 1154 C CB . LYS A 149 ? 0.1578 0.2759 0.3794 0.0372 0.0658 -0.1004 149 LYS A CB 1155 C CG . LYS A 149 ? 0.2347 0.3606 0.4760 0.0290 0.0718 -0.1054 149 LYS A CG 1156 C CD . LYS A 149 ? 0.4429 0.5610 0.6737 0.0251 0.0911 -0.1119 149 LYS A CD 1157 C CE . LYS A 149 ? 0.5659 0.6928 0.8259 0.0122 0.1001 -0.1238 149 LYS A CE 1158 N NZ . LYS A 149 ? 0.5808 0.6956 0.8302 0.0051 0.1235 -0.1315 149 LYS A NZ 1159 N N . VAL A 150 ? 0.3175 0.4399 0.5616 0.0436 0.0501 -0.1073 150 VAL A N 1160 C CA . VAL A 150 ? 0.1625 0.2832 0.4011 0.0479 0.0488 -0.1115 150 VAL A CA 1161 C C . VAL A 150 ? 0.2386 0.3605 0.4751 0.0506 0.0595 -0.1169 150 VAL A C 1162 O O . VAL A 150 ? 0.1800 0.3085 0.4385 0.0471 0.0622 -0.1221 150 VAL A O 1163 C CB . VAL A 150 ? 0.1589 0.2815 0.4178 0.0462 0.0402 -0.1143 150 VAL A CB 1164 C CG1 . VAL A 150 ? 0.1650 0.2875 0.4203 0.0493 0.0389 -0.1210 150 VAL A CG1 1165 C CG2 . VAL A 150 ? 0.3387 0.4574 0.5980 0.0443 0.0330 -0.1081 150 VAL A CG2 1166 N N . ASP A 151 ? 0.3039 0.5305 0.3936 0.1384 0.0612 0.1344 151 ASP A N 1167 C CA . ASP A 151 ? 0.3482 0.6018 0.4286 0.1501 0.0734 0.1515 151 ASP A CA 1168 C C . ASP A 151 ? 0.4449 0.6981 0.5453 0.1386 0.0893 0.1600 151 ASP A C 1169 O O . ASP A 151 ? 0.4431 0.7215 0.5407 0.1425 0.0942 0.1596 151 ASP A O 1170 C CB . ASP A 151 ? 0.3363 0.6229 0.3978 0.1635 0.0636 0.1374 151 ASP A CB 1171 C CG . ASP A 151 ? 0.3008 0.5980 0.3444 0.1769 0.0526 0.1295 151 ASP A CG 1172 O OD1 . ASP A 151 ? 0.3002 0.5863 0.3411 0.1811 0.0548 0.1420 151 ASP A OD1 1173 O OD2 . ASP A 151 ? 0.3034 0.6157 0.3339 0.1798 0.0422 0.1075 151 ASP A OD2 1174 N N . ASN A 152 ? 0.4773 0.7038 0.6007 0.1235 0.0979 0.1649 152 ASN A N 1175 C CA . ASN A 152 ? 0.4135 0.6378 0.5640 0.1086 0.1147 0.1682 152 ASN A CA 1176 C C . ASN A 152 ? 0.3875 0.6263 0.5498 0.1004 0.1052 0.1440 152 ASN A C 1177 O O . ASN A 152 ? 0.4579 0.7028 0.6452 0.0881 0.1177 0.1410 152 ASN A O 1178 C CB . ASN A 152 ? 0.4149 0.6532 0.5627 0.1147 0.1378 0.1917 152 ASN A CB 1179 C CG . ASN A 152 ? 0.5886 0.8008 0.7430 0.1141 0.1588 0.2180 152 ASN A CG 1180 O OD1 . ASN A 152 ? 0.5656 0.7545 0.7190 0.1148 0.1526 0.2203 152 ASN A OD1 1181 N ND2 . ASN A 152 ? 0.7017 0.9160 0.8634 0.1129 0.1854 0.2380 152 ASN A ND2 1182 N N . ALA A 153 ? 0.3400 0.5850 0.4865 0.1074 0.0850 0.1258 153 ALA A N 1183 C CA . ALA A 153 ? 0.3097 0.5644 0.4650 0.1031 0.0753 0.1041 153 ALA A CA 1184 C C . ALA A 153 ? 0.3070 0.5390 0.4771 0.0917 0.0679 0.0920 153 ALA A C 1185 O O . ALA A 153 ? 0.3165 0.5260 0.4766 0.0923 0.0590 0.0909 153 ALA A O 1186 C CB . ALA A 153 ? 0.2976 0.5643 0.4294 0.1169 0.0599 0.0909 153 ALA A CB 1187 N N . LEU A 154 ? 0.2625 0.5042 0.4571 0.0814 0.0720 0.0813 154 LEU A N 1188 C CA . LEU A 154 ? 0.1901 0.4182 0.3995 0.0720 0.0647 0.0673 154 LEU A CA 1189 C C . LEU A 154 ? 0.1805 0.4028 0.3681 0.0825 0.0447 0.0523 154 LEU A C 1190 O O . LEU A 154 ? 0.1799 0.4201 0.3585 0.0924 0.0383 0.0429 154 LEU A O 1191 C CB . LEU A 154 ? 0.1892 0.4387 0.4319 0.0603 0.0739 0.0553 154 LEU A CB 1192 C CG . LEU A 154 ? 0.1972 0.4444 0.4567 0.0527 0.0652 0.0360 154 LEU A CG 1193 C CD1 . LEU A 154 ? 0.2077 0.4288 0.4823 0.0397 0.0728 0.0428 154 LEU A CD1 1194 C CD2 . LEU A 154 ? 0.1765 0.4586 0.4659 0.0461 0.0702 0.0169 154 LEU A CD2 1195 N N . GLN A 155 ? 0.1921 0.3877 0.3714 0.0807 0.0367 0.0505 155 GLN A N 1196 C CA . GLN A 155 ? 0.2380 0.4214 0.3969 0.0895 0.0217 0.0378 155 GLN A CA 1197 C C . GLN A 155 ? 0.2835 0.4734 0.4551 0.0868 0.0162 0.0230 155 GLN A C 1198 O O . GLN A 155 ? 0.3175 0.5094 0.5134 0.0742 0.0214 0.0206 155 GLN A O 1199 C CB . GLN A 155 ? 0.1713 0.3244 0.3151 0.0885 0.0172 0.0413 155 GLN A CB 1200 C CG . GLN A 155 ? 0.2554 0.4083 0.3867 0.0935 0.0209 0.0526 155 GLN A CG 1201 C CD . GLN A 155 ? 0.2789 0.4501 0.3947 0.1061 0.0187 0.0490 155 GLN A CD 1202 O OE1 . GLN A 155 ? 0.2064 0.3696 0.3069 0.1136 0.0109 0.0370 155 GLN A OE1 1203 N NE2 . GLN A 155 ? 0.1858 0.3805 0.3057 0.1089 0.0274 0.0595 155 GLN A NE2 1204 N N . SER A 156 ? 0.2229 0.4178 0.3785 0.1003 0.0063 0.0122 156 SER A N 1205 C CA . SER A 156 ? 0.2049 0.4126 0.3680 0.1035 -0.0006 -0.0024 156 SER A CA 1206 C C . SER A 156 ? 0.2849 0.4771 0.4173 0.1217 -0.0115 -0.0079 156 SER A C 1207 O O . SER A 156 ? 0.1885 0.3807 0.3042 0.1339 -0.0128 -0.0069 156 SER A O 1208 C CB . SER A 156 ? 0.1692 0.4181 0.3564 0.1029 0.0036 -0.0116 156 SER A CB 1209 O OG . SER A 156 ? 0.1885 0.4572 0.3854 0.1072 -0.0039 -0.0289 156 SER A OG 1210 N N . GLY A 157 ? 0.3251 0.5035 0.4502 0.1239 -0.0178 -0.0137 157 GLY A N 1211 C CA . GLY A 157 ? 0.3063 0.4650 0.4005 0.1423 -0.0250 -0.0165 157 GLY A CA 1212 C C . GLY A 157 ? 0.2763 0.3917 0.3461 0.1422 -0.0226 -0.0088 157 GLY A C 1213 O O . GLY A 157 ? 0.3178 0.4085 0.3624 0.1549 -0.0250 -0.0100 157 GLY A O 1214 N N . ASN A 158 ? 0.2583 0.3646 0.3348 0.1292 -0.0167 -0.0016 158 ASN A N 1215 C CA . ASN A 158 ? 0.2521 0.3246 0.3104 0.1279 -0.0138 0.0012 158 ASN A CA 1216 C C . ASN A 158 ? 0.2359 0.2908 0.3014 0.1127 -0.0123 0.0039 158 ASN A C 1217 O O . ASN A 158 ? 0.2496 0.2912 0.3129 0.1062 -0.0088 0.0066 158 ASN A O 1218 C CB . ASN A 158 ? 0.2037 0.2850 0.2618 0.1287 -0.0097 0.0039 158 ASN A CB 1219 C CG . ASN A 158 ? 0.1893 0.2975 0.2699 0.1185 -0.0060 0.0116 158 ASN A CG 1220 O OD1 . ASN A 158 ? 0.3037 0.4263 0.4037 0.1110 -0.0051 0.0133 158 ASN A OD1 1221 N ND2 . ASN A 158 ? 0.1884 0.3041 0.2666 0.1191 -0.0022 0.0157 158 ASN A ND2 1222 N N . SER A 159 ? 0.1940 0.2524 0.2692 0.1079 -0.0153 0.0012 159 SER A N 1223 C CA . SER A 159 ? 0.1871 0.2294 0.2701 0.0941 -0.0141 0.0020 159 SER A CA 1224 C C . SER A 159 ? 0.2476 0.2854 0.3249 0.0973 -0.0188 -0.0050 159 SER A C 1225 O O . SER A 159 ? 0.3200 0.3777 0.3954 0.1087 -0.0234 -0.0105 159 SER A O 1226 C CB . SER A 159 ? 0.1716 0.2318 0.2849 0.0798 -0.0098 0.0069 159 SER A CB 1227 O OG . SER A 159 ? 0.1670 0.2558 0.3019 0.0780 -0.0102 0.0015 159 SER A OG 1228 N N . GLN A 160 ? 0.2760 0.2910 0.3500 0.0886 -0.0179 -0.0059 160 GLN A N 1229 C CA . GLN A 160 ? 0.2300 0.2411 0.2968 0.0914 -0.0217 -0.0123 160 GLN A CA 1230 C C . GLN A 160 ? 0.2416 0.2502 0.3293 0.0736 -0.0206 -0.0151 160 GLN A C 1231 O O . GLN A 160 ? 0.1810 0.1728 0.2737 0.0629 -0.0164 -0.0108 160 GLN A O 1232 C CB . GLN A 160 ? 0.3141 0.2905 0.3446 0.1033 -0.0195 -0.0108 160 GLN A CB 1233 C CG . GLN A 160 ? 0.4162 0.3917 0.4244 0.1242 -0.0197 -0.0086 160 GLN A CG 1234 C CD . GLN A 160 ? 0.5606 0.4944 0.5338 0.1355 -0.0128 -0.0054 160 GLN A CD 1235 O OE1 . GLN A 160 ? 0.6631 0.5663 0.6308 0.1248 -0.0050 -0.0052 160 GLN A OE1 1236 N NE2 . GLN A 160 ? 0.5974 0.5303 0.5473 0.1563 -0.0139 -0.0034 160 GLN A NE2 1237 N N . GLU A 161 ? 0.2027 0.2310 0.3034 0.0719 -0.0246 -0.0243 161 GLU A N 1238 C CA . GLU A 161 ? 0.1732 0.2021 0.2973 0.0553 -0.0233 -0.0298 161 GLU A CA 1239 C C . GLU A 161 ? 0.2979 0.3116 0.4022 0.0584 -0.0261 -0.0356 161 GLU A C 1240 O O . GLU A 161 ? 0.2547 0.2675 0.3316 0.0753 -0.0295 -0.0367 161 GLU A O 1241 C CB . GLU A 161 ? 0.2444 0.3109 0.4062 0.0473 -0.0233 -0.0399 161 GLU A CB 1242 C CG . GLU A 161 ? 0.3709 0.4496 0.5567 0.0404 -0.0164 -0.0330 161 GLU A CG 1243 C CD . GLU A 161 ? 0.5167 0.6259 0.7453 0.0276 -0.0113 -0.0444 161 GLU A CD 1244 O OE1 . GLU A 161 ? 0.5490 0.6745 0.7906 0.0242 -0.0149 -0.0606 161 GLU A OE1 1245 O OE2 . GLU A 161 ? 0.6127 0.7304 0.8630 0.0208 -0.0022 -0.0382 161 GLU A OE2 1246 N N . SER A 162 ? 0.2807 0.2819 0.3980 0.0434 -0.0236 -0.0383 162 SER A N 1247 C CA . SER A 162 ? 0.1859 0.1758 0.2889 0.0434 -0.0251 -0.0450 162 SER A CA 1248 C C . SER A 162 ? 0.1865 0.1860 0.3237 0.0251 -0.0243 -0.0541 162 SER A C 1249 O O . SER A 162 ? 0.2726 0.2621 0.4294 0.0125 -0.0198 -0.0494 162 SER A O 1250 C CB . SER A 162 ? 0.2010 0.1497 0.2722 0.0456 -0.0197 -0.0377 162 SER A CB 1251 O OG . SER A 162 ? 0.4224 0.3594 0.4743 0.0483 -0.0191 -0.0426 162 SER A OG 1252 N N . VAL A 163 ? 0.1711 0.1916 0.3150 0.0254 -0.0285 -0.0677 163 VAL A N 1253 C CA . VAL A 163 ? 0.1965 0.2300 0.3764 0.0083 -0.0274 -0.0803 163 VAL A CA 1254 C C . VAL A 163 ? 0.2056 0.2269 0.3676 0.0078 -0.0288 -0.0869 163 VAL A C 1255 O O . VAL A 163 ? 0.2733 0.3020 0.4068 0.0229 -0.0330 -0.0901 163 VAL A O 1256 C CB . VAL A 163 ? 0.2052 0.2842 0.4192 0.0062 -0.0297 -0.0968 163 VAL A CB 1257 C CG1 . VAL A 163 ? 0.1356 0.2247 0.3919 -0.0133 -0.0256 -0.1111 163 VAL A CG1 1258 C CG2 . VAL A 163 ? 0.2670 0.3582 0.4956 0.0076 -0.0265 -0.0901 163 VAL A CG2 1259 N N . THR A 164 ? 0.2178 0.2040 0.2880 0.0186 -0.0777 0.0133 164 THR A N 1260 C CA . THR A 164 ? 0.2657 0.2368 0.3132 0.0072 -0.0756 0.0165 164 THR A CA 1261 C C . THR A 164 ? 0.1964 0.1735 0.2400 0.0048 -0.0801 0.0143 164 THR A C 1262 O O . THR A 164 ? 0.3052 0.3035 0.3685 0.0088 -0.0805 0.0089 164 THR A O 1263 C CB . THR A 164 ? 0.1938 0.1719 0.2476 -0.0032 -0.0608 0.0158 164 THR A CB 1264 O OG1 . THR A 164 ? 0.1714 0.1714 0.2484 -0.0016 -0.0531 0.0120 164 THR A OG1 1265 C CG2 . THR A 164 ? 0.2668 0.2428 0.3229 -0.0032 -0.0574 0.0172 164 THR A CG2 1266 N N . GLU A 165 ? 0.3260 0.2839 0.3415 -0.0041 -0.0828 0.0176 165 GLU A N 1267 C CA . GLU A 165 ? 0.2301 0.1944 0.2390 -0.0112 -0.0840 0.0144 165 GLU A CA 1268 C C . GLU A 165 ? 0.2080 0.1877 0.2340 -0.0207 -0.0663 0.0084 165 GLU A C 1269 O O . GLU A 165 ? 0.1897 0.1743 0.2305 -0.0206 -0.0550 0.0084 165 GLU A O 1270 C CB . GLU A 165 ? 0.2932 0.2302 0.2631 -0.0206 -0.0897 0.0196 165 GLU A CB 1271 C CG . GLU A 165 ? 0.4295 0.3460 0.3781 -0.0089 -0.1085 0.0272 165 GLU A CG 1272 C CD . GLU A 165 ? 0.5966 0.5335 0.5583 0.0043 -0.1250 0.0252 165 GLU A CD 1273 O OE1 . GLU A 165 ? 0.6798 0.6412 0.6548 -0.0017 -0.1224 0.0179 165 GLU A OE1 1274 O OE2 . GLU A 165 ? 0.5734 0.5027 0.5330 0.0206 -0.1397 0.0298 165 GLU A OE2 1275 N N . GLN A 166 ? 0.2572 0.2443 0.2806 -0.0285 -0.0640 0.0031 166 GLN A N 1276 C CA . GLN A 166 ? 0.2524 0.2502 0.2915 -0.0360 -0.0461 -0.0032 166 GLN A CA 1277 C C . GLN A 166 ? 0.2866 0.2725 0.3176 -0.0455 -0.0321 -0.0020 166 GLN A C 1278 O O . GLN A 166 ? 0.2255 0.1939 0.2302 -0.0547 -0.0340 0.0001 166 GLN A O 1279 C CB . GLN A 166 ? 0.2955 0.3011 0.3298 -0.0451 -0.0454 -0.0107 166 GLN A CB 1280 C CG . GLN A 166 ? 0.2924 0.3171 0.3530 -0.0429 -0.0366 -0.0182 166 GLN A CG 1281 C CD . GLN A 166 ? 0.3964 0.4301 0.4515 -0.0546 -0.0352 -0.0278 166 GLN A CD 1282 O OE1 . GLN A 166 ? 0.4724 0.5055 0.5074 -0.0598 -0.0486 -0.0282 166 GLN A OE1 1283 N NE2 . GLN A 166 ? 0.3025 0.3430 0.3731 -0.0595 -0.0189 -0.0356 166 GLN A NE2 1284 N N . ASP A 167 ? 0.2455 0.2412 0.2992 -0.0428 -0.0180 -0.0036 167 ASP A N 1285 C CA . ASP A 167 ? 0.2723 0.2644 0.3267 -0.0494 -0.0042 -0.0041 167 ASP A CA 1286 C C . ASP A 167 ? 0.2566 0.2416 0.2990 -0.0635 0.0078 -0.0109 167 ASP A C 1287 O O . ASP A 167 ? 0.2703 0.2589 0.3169 -0.0659 0.0130 -0.0164 167 ASP A O 1288 C CB . ASP A 167 ? 0.3630 0.3698 0.4462 -0.0397 0.0054 -0.0031 167 ASP A CB 1289 C CG . ASP A 167 ? 0.3783 0.3885 0.4682 -0.0435 0.0172 -0.0038 167 ASP A CG 1290 O OD1 . ASP A 167 ? 0.4516 0.4643 0.5406 -0.0428 0.0123 -0.0005 167 ASP A OD1 1291 O OD2 . ASP A 167 ? 0.2472 0.2586 0.3444 -0.0475 0.0321 -0.0089 167 ASP A OD2 1292 N N . SER A 168 ? 0.2227 0.1968 0.2488 -0.0749 0.0141 -0.0121 168 SER A N 1293 C CA . SER A 168 ? 0.2578 0.2229 0.2686 -0.0907 0.0267 -0.0197 168 SER A CA 1294 C C . SER A 168 ? 0.3361 0.3108 0.3720 -0.0898 0.0477 -0.0267 168 SER A C 1295 O O . SER A 168 ? 0.2445 0.2120 0.2708 -0.1022 0.0604 -0.0349 168 SER A O 1296 C CB . SER A 168 ? 0.2639 0.2127 0.2477 -0.1052 0.0295 -0.0200 168 SER A CB 1297 O OG . SER A 168 ? 0.4817 0.4401 0.4845 -0.1044 0.0414 -0.0217 168 SER A OG 1298 N N . LYS A 169 ? 0.3114 0.3006 0.3775 -0.0752 0.0516 -0.0235 169 LYS A N 1299 C CA . LYS A 169 ? 0.2476 0.2434 0.3375 -0.0707 0.0709 -0.0282 169 LYS A CA 1300 C C . LYS A 169 ? 0.2877 0.2848 0.3920 -0.0606 0.0742 -0.0278 169 LYS A C 1301 O O . LYS A 169 ? 0.3783 0.3682 0.4864 -0.0641 0.0910 -0.0346 169 LYS A O 1302 C CB . LYS A 169 ? 0.2821 0.2939 0.3951 -0.0611 0.0741 -0.0249 169 LYS A CB 1303 N N . ASP A 170 ? 0.3060 0.3097 0.4168 -0.0495 0.0607 -0.0208 170 ASP A N 1304 C CA . ASP A 170 ? 0.2796 0.2828 0.4019 -0.0416 0.0652 -0.0207 170 ASP A CA 1305 C C . ASP A 170 ? 0.2972 0.3015 0.4093 -0.0448 0.0522 -0.0220 170 ASP A C 1306 O O . ASP A 170 ? 0.2224 0.2275 0.3429 -0.0403 0.0557 -0.0229 170 ASP A O 1307 C CB . ASP A 170 ? 0.2442 0.2563 0.3877 -0.0244 0.0650 -0.0122 170 ASP A CB 1308 C CG . ASP A 170 ? 0.3029 0.3262 0.4464 -0.0188 0.0471 -0.0051 170 ASP A CG 1309 O OD1 . ASP A 170 ? 0.2971 0.3185 0.4258 -0.0247 0.0342 -0.0057 170 ASP A OD1 1310 O OD2 . ASP A 170 ? 0.3332 0.3667 0.4911 -0.0079 0.0460 0.0011 170 ASP A OD2 1311 N N . SER A 171 ? 0.2989 0.3034 0.3932 -0.0518 0.0375 -0.0221 171 SER A N 1312 C CA . SER A 171 ? 0.4369 0.4464 0.5230 -0.0541 0.0237 -0.0245 171 SER A CA 1313 C C . SER A 171 ? 0.4033 0.4237 0.5049 -0.0410 0.0143 -0.0202 171 SER A C 1314 O O . SER A 171 ? 0.4351 0.4645 0.5390 -0.0415 0.0076 -0.0248 171 SER A O 1315 C CB . SER A 171 ? 0.1865 0.1946 0.2682 -0.0659 0.0339 -0.0350 171 SER A CB 1316 O OG . SER A 171 ? 0.2495 0.2465 0.3137 -0.0801 0.0429 -0.0404 171 SER A OG 1317 N N . THR A 172 ? 0.2893 0.3115 0.4018 -0.0304 0.0138 -0.0128 172 THR A N 1318 C CA . THR A 172 ? 0.2693 0.3003 0.3937 -0.0197 0.0064 -0.0095 172 THR A CA 1319 C C . THR A 172 ? 0.2701 0.3027 0.3872 -0.0155 -0.0111 -0.0056 172 THR A C 1320 O O . THR A 172 ? 0.2954 0.3195 0.3974 -0.0198 -0.0166 -0.0031 172 THR A O 1321 C CB . THR A 172 ? 0.2510 0.2830 0.3891 -0.0107 0.0151 -0.0036 172 THR A CB 1322 O OG1 . THR A 172 ? 0.3341 0.3669 0.4710 -0.0089 0.0122 0.0017 172 THR A OG1 1323 C CG2 . THR A 172 ? 0.1792 0.2039 0.3228 -0.0122 0.0332 -0.0061 172 THR A CG2 1324 N N . TYR A 173 ? 0.2083 0.2492 0.3348 -0.0076 -0.0183 -0.0055 173 TYR A N 1325 C CA . TYR A 173 ? 0.1369 0.1770 0.2594 -0.0010 -0.0324 -0.0020 173 TYR A CA 1326 C C . TYR A 173 ? 0.1274 0.1698 0.2589 0.0056 -0.0298 0.0027 173 TYR A C 1327 O O . TYR A 173 ? 0.1597 0.2071 0.3020 0.0074 -0.0199 0.0033 173 TYR A O 1328 C CB . TYR A 173 ? 0.1369 0.1869 0.2647 0.0036 -0.0431 -0.0072 173 TYR A CB 1329 C CG . TYR A 173 ? 0.1828 0.2365 0.3027 -0.0026 -0.0487 -0.0125 173 TYR A CG 1330 C CD1 . TYR A 173 ? 0.2519 0.2958 0.3523 -0.0028 -0.0622 -0.0091 173 TYR A CD1 1331 C CD2 . TYR A 173 ? 0.2469 0.3127 0.3759 -0.0094 -0.0406 -0.0212 173 TYR A CD2 1332 C CE1 . TYR A 173 ? 0.3087 0.3575 0.3991 -0.0088 -0.0695 -0.0134 173 TYR A CE1 1333 C CE2 . TYR A 173 ? 0.3517 0.4244 0.4729 -0.0172 -0.0464 -0.0274 173 TYR A CE2 1334 C CZ . TYR A 173 ? 0.3472 0.4129 0.4493 -0.0164 -0.0619 -0.0231 173 TYR A CZ 1335 O OH . TYR A 173 ? 0.4215 0.4955 0.5131 -0.0244 -0.0695 -0.0287 173 TYR A OH 1336 N N . SER A 174 ? 0.1096 0.1462 0.2337 0.0087 -0.0387 0.0061 174 SER A N 1337 C CA . SER A 174 ? 0.1191 0.1590 0.2491 0.0134 -0.0383 0.0089 174 SER A CA 1338 C C . SER A 174 ? 0.1249 0.1607 0.2522 0.0194 -0.0486 0.0072 174 SER A C 1339 O O . SER A 174 ? 0.2364 0.2614 0.3519 0.0204 -0.0576 0.0072 174 SER A O 1340 C CB . SER A 174 ? 0.1038 0.1407 0.2279 0.0090 -0.0353 0.0134 174 SER A CB 1341 O OG . SER A 174 ? 0.0978 0.1421 0.2304 0.0071 -0.0249 0.0147 174 SER A OG 1342 N N . LEU A 175 ? 0.1339 0.1767 0.2708 0.0239 -0.0469 0.0057 175 LEU A N 1343 C CA . LEU A 175 ? 0.1545 0.1950 0.2932 0.0307 -0.0539 0.0018 175 LEU A CA 1344 C C . LEU A 175 ? 0.1835 0.2203 0.3187 0.0302 -0.0519 0.0031 175 LEU A C 1345 O O . LEU A 175 ? 0.1068 0.1519 0.2457 0.0270 -0.0451 0.0052 175 LEU A O 1346 C CB . LEU A 175 ? 0.1406 0.1964 0.2964 0.0347 -0.0519 -0.0058 175 LEU A CB 1347 C CG . LEU A 175 ? 0.1052 0.1624 0.2652 0.0422 -0.0564 -0.0122 175 LEU A CG 1348 C CD1 . LEU A 175 ? 0.1056 0.1776 0.2754 0.0435 -0.0567 -0.0198 175 LEU A CD1 1349 C CD2 . LEU A 175 ? 0.1007 0.1609 0.2664 0.0422 -0.0495 -0.0150 175 LEU A CD2 1350 N N . SER A 176 ? 0.1916 0.2145 0.3180 0.0336 -0.0579 0.0020 176 SER A N 1351 C CA . SER A 176 ? 0.1601 0.1776 0.2817 0.0319 -0.0555 0.0006 176 SER A CA 1352 C C . SER A 176 ? 0.2667 0.2830 0.3969 0.0409 -0.0571 -0.0067 176 SER A C 1353 O O . SER A 176 ? 0.3852 0.3945 0.5169 0.0499 -0.0645 -0.0086 176 SER A O 1354 C CB . SER A 176 ? 0.1567 0.1538 0.2579 0.0260 -0.0576 0.0038 176 SER A CB 1355 O OG . SER A 176 ? 0.3864 0.3617 0.4774 0.0332 -0.0644 0.0029 176 SER A OG 1356 N N . SER A 177 ? 0.3030 0.3272 0.4388 0.0388 -0.0504 -0.0111 177 SER A N 1357 C CA . SER A 177 ? 0.2631 0.2864 0.4075 0.0455 -0.0488 -0.0201 177 SER A CA 1358 C C . SER A 177 ? 0.2043 0.2145 0.3350 0.0395 -0.0443 -0.0220 177 SER A C 1359 O O . SER A 177 ? 0.2394 0.2575 0.3646 0.0297 -0.0389 -0.0204 177 SER A O 1360 C CB . SER A 177 ? 0.2191 0.2632 0.3809 0.0454 -0.0418 -0.0266 177 SER A CB 1361 O OG . SER A 177 ? 0.1763 0.2228 0.3503 0.0521 -0.0392 -0.0376 177 SER A OG 1362 N N . THR A 178 ? 0.2204 0.2095 0.3441 0.0454 -0.0468 -0.0254 178 THR A N 1363 C CA . THR A 178 ? 0.2356 0.2066 0.3424 0.0379 -0.0415 -0.0283 178 THR A CA 1364 C C . THR A 178 ? 0.2024 0.1689 0.3183 0.0450 -0.0357 -0.0397 178 THR A C 1365 O O . THR A 178 ? 0.2822 0.2358 0.4045 0.0593 -0.0395 -0.0431 178 THR A O 1366 C CB . THR A 178 ? 0.2857 0.2276 0.3711 0.0367 -0.0459 -0.0233 178 THR A CB 1367 O OG1 . THR A 178 ? 0.2855 0.2337 0.3660 0.0312 -0.0506 -0.0144 178 THR A OG1 1368 C CG2 . THR A 178 ? 0.2333 0.1586 0.2989 0.0234 -0.0384 -0.0270 178 THR A CG2 1369 N N . LEU A 179 ? 0.3234 0.3005 0.4394 0.0355 -0.0264 -0.0458 179 LEU A N 1370 C CA . LEU A 179 ? 0.2138 0.1854 0.3354 0.0383 -0.0174 -0.0586 179 LEU A CA 1371 C C . LEU A 179 ? 0.2793 0.2228 0.3782 0.0306 -0.0124 -0.0619 179 LEU A C 1372 O O . LEU A 179 ? 0.4618 0.4047 0.5418 0.0147 -0.0111 -0.0580 179 LEU A O 1373 C CB . LEU A 179 ? 0.2017 0.1951 0.3288 0.0288 -0.0084 -0.0640 179 LEU A CB 1374 C CG . LEU A 179 ? 0.2176 0.2081 0.3496 0.0279 0.0040 -0.0792 179 LEU A CG 1375 C CD1 . LEU A 179 ? 0.2132 0.2154 0.3748 0.0436 0.0051 -0.0887 179 LEU A CD1 1376 C CD2 . LEU A 179 ? 0.2937 0.2968 0.4142 0.0111 0.0128 -0.0812 179 LEU A CD2 1377 N N . THR A 180 ? 0.2675 0.1884 0.3688 0.0419 -0.0091 -0.0699 180 THR A N 1378 C CA . THR A 180 ? 0.4419 0.3284 0.5194 0.0354 -0.0026 -0.0738 180 THR A CA 1379 C C . THR A 180 ? 0.5080 0.3877 0.5895 0.0348 0.0114 -0.0895 180 THR A C 1380 O O . THR A 180 ? 0.5710 0.4520 0.6748 0.0522 0.0133 -0.0973 180 THR A O 1381 C CB . THR A 180 ? 0.5150 0.3683 0.5839 0.0498 -0.0099 -0.0679 180 THR A CB 1382 O OG1 . THR A 180 ? 0.5804 0.4397 0.6431 0.0476 -0.0213 -0.0545 180 THR A OG1 1383 C CG2 . THR A 180 ? 0.4914 0.3032 0.5311 0.0406 -0.0007 -0.0722 180 THR A CG2 1384 N N . LEU A 181 ? 0.4818 0.3564 0.5425 0.0142 0.0213 -0.0951 181 LEU A N 1385 C CA . LEU A 181 ? 0.4253 0.2893 0.4827 0.0084 0.0370 -0.1112 181 LEU A CA 1386 C C . LEU A 181 ? 0.5638 0.3895 0.5915 -0.0032 0.0451 -0.1159 181 LEU A C 1387 O O . LEU A 181 ? 0.6191 0.4326 0.6273 -0.0118 0.0393 -0.1069 181 LEU A O 1388 C CB . LEU A 181 ? 0.5016 0.3944 0.5558 -0.0099 0.0432 -0.1155 181 LEU A CB 1389 C CG . LEU A 181 ? 0.5786 0.5070 0.6532 -0.0056 0.0375 -0.1100 181 LEU A CG 1390 C CD1 . LEU A 181 ? 0.6083 0.5548 0.6672 -0.0262 0.0431 -0.1114 181 LEU A CD1 1391 C CD2 . LEU A 181 ? 0.6730 0.6080 0.7777 0.0124 0.0423 -0.1202 181 LEU A CD2 1392 N N . SER A 182 ? 0.5840 0.3897 0.6079 -0.0050 0.0607 -0.1315 182 SER A N 1393 C CA . SER A 182 ? 0.6155 0.3880 0.6072 -0.0236 0.0725 -0.1393 182 SER A CA 1394 C C . SER A 182 ? 0.5696 0.3676 0.5433 -0.0530 0.0757 -0.1419 182 SER A C 1395 O O . SER A 182 ? 0.5370 0.3709 0.5223 -0.0565 0.0728 -0.1407 182 SER A O 1396 C CB . SER A 182 ? 0.5340 0.2738 0.5270 -0.0155 0.0900 -0.1564 182 SER A CB 1397 O OG . SER A 182 ? 0.4991 0.2612 0.5007 -0.0249 0.1018 -0.1702 182 SER A OG 1398 N N . LYS A 183 ? 0.5578 0.3368 0.5010 -0.0748 0.0813 -0.1454 183 LYS A N 1399 C CA . LYS A 183 ? 0.5724 0.3784 0.4978 -0.1029 0.0828 -0.1488 183 LYS A CA 1400 C C . LYS A 183 ? 0.4900 0.3022 0.4141 -0.1109 0.0964 -0.1637 183 LYS A C 1401 O O . LYS A 183 ? 0.4904 0.3359 0.4098 -0.1250 0.0931 -0.1623 183 LYS A O 1402 C CB . LYS A 183 ? 0.5592 0.3451 0.4527 -0.1271 0.0882 -0.1535 183 LYS A CB 1403 C CG . LYS A 183 ? 0.5396 0.3631 0.4178 -0.1549 0.0843 -0.1545 183 LYS A CG 1404 C CD . LYS A 183 ? 0.6275 0.4364 0.4759 -0.1805 0.0946 -0.1636 183 LYS A CD 1405 C CE . LYS A 183 ? 0.6860 0.5399 0.5229 -0.2044 0.0893 -0.1637 183 LYS A CE 1406 N NZ . LYS A 183 ? 0.7838 0.6338 0.5970 -0.2263 0.0997 -0.1694 183 LYS A NZ 1407 N N . ALA A 184 ? 0.5868 0.3662 0.5144 -0.1015 0.1122 -0.1779 184 ALA A N 1408 C CA . ALA A 184 ? 0.6059 0.3913 0.5341 -0.1088 0.1274 -0.1929 184 ALA A CA 1409 C C . ALA A 184 ? 0.5477 0.3689 0.5010 -0.0987 0.1217 -0.1895 184 ALA A C 1410 O O . ALA A 184 ? 0.5135 0.3574 0.4560 -0.1162 0.1254 -0.1933 184 ALA A O 1411 C CB . ALA A 184 ? 0.6005 0.3547 0.5370 -0.0928 0.1408 -0.2005 184 ALA A CB 1412 N N . ASP A 185 ? 0.6109 0.4381 0.5957 -0.0713 0.1122 -0.1809 185 ASP A N 1413 C CA . ASP A 185 ? 0.6462 0.5073 0.6556 -0.0624 0.1080 -0.1779 185 ASP A CA 1414 C C . ASP A 185 ? 0.5731 0.4660 0.5727 -0.0742 0.0935 -0.1617 185 ASP A C 1415 O O . ASP A 185 ? 0.6144 0.5306 0.6161 -0.0803 0.0954 -0.1619 185 ASP A O 1416 C CB . ASP A 185 ? 0.7183 0.5805 0.7636 -0.0316 0.1005 -0.1738 185 ASP A CB 1417 C CG . ASP A 185 ? 0.8359 0.6711 0.8966 -0.0150 0.1140 -0.1897 185 ASP A CG 1418 O OD1 . ASP A 185 ? 0.9449 0.7664 0.9913 -0.0275 0.1303 -0.2027 185 ASP A OD1 1419 O OD2 . ASP A 185 ? 0.8338 0.6653 0.9203 0.0117 0.1058 -0.1857 185 ASP A OD2 1420 N N . TYR A 186 ? 0.5722 0.4650 0.5607 -0.0774 0.0799 -0.1480 186 TYR A N 1421 C CA . TYR A 186 ? 0.3757 0.2993 0.3575 -0.0863 0.0662 -0.1329 186 TYR A CA 1422 C C . TYR A 186 ? 0.4150 0.3513 0.3692 -0.1116 0.0708 -0.1374 186 TYR A C 1423 O O . TYR A 186 ? 0.3880 0.3502 0.3387 -0.1159 0.0632 -0.1277 186 TYR A O 1424 C CB . TYR A 186 ? 0.4691 0.3911 0.4467 -0.0853 0.0528 -0.1200 186 TYR A CB 1425 C CG . TYR A 186 ? 0.3430 0.2977 0.3156 -0.0934 0.0393 -0.1057 186 TYR A CG 1426 C CD1 . TYR A 186 ? 0.3741 0.3501 0.3654 -0.0801 0.0302 -0.0936 186 TYR A CD1 1427 C CD2 . TYR A 186 ? 0.3579 0.3229 0.3081 -0.1141 0.0359 -0.1050 186 TYR A CD2 1428 C CE1 . TYR A 186 ? 0.3669 0.3696 0.3542 -0.0848 0.0186 -0.0802 186 TYR A CE1 1429 C CE2 . TYR A 186 ? 0.3600 0.3576 0.3091 -0.1183 0.0224 -0.0918 186 TYR A CE2 1430 C CZ . TYR A 186 ? 0.3540 0.3684 0.3215 -0.1024 0.0141 -0.0790 186 TYR A CZ 1431 O OH . TYR A 186 ? 0.2918 0.3355 0.2587 -0.1041 0.0014 -0.0656 186 TYR A OH 1432 N N . GLU A 187 ? 0.6405 0.5574 0.5725 -0.1288 0.0832 -0.1517 187 GLU A N 1433 C CA . GLU A 187 ? 0.6081 0.5383 0.5105 -0.1550 0.0866 -0.1567 187 GLU A CA 1434 C C . GLU A 187 ? 0.5239 0.4560 0.4229 -0.1600 0.1002 -0.1675 187 GLU A C 1435 O O . GLU A 187 ? 0.4734 0.4193 0.3460 -0.1805 0.1008 -0.1686 187 GLU A O 1436 C CB . GLU A 187 ? 0.5584 0.4682 0.4348 -0.1760 0.0955 -0.1694 187 GLU A CB 1437 C CG . GLU A 187 ? 0.5349 0.4465 0.4072 -0.1794 0.0836 -0.1604 187 GLU A CG 1438 C CD . GLU A 187 ? 0.5879 0.5411 0.4534 -0.1897 0.0654 -0.1462 187 GLU A CD 1439 O OE1 . GLU A 187 ? 0.5691 0.5310 0.4380 -0.1901 0.0549 -0.1381 187 GLU A OE1 1440 O OE2 . GLU A 187 ? 0.6137 0.5903 0.4700 -0.1969 0.0619 -0.1433 187 GLU A OE2 1441 N N . LYS A 188 ? 0.5157 0.4360 0.4401 -0.1424 0.1107 -0.1759 188 LYS A N 1442 C CA . LYS A 188 ? 0.5537 0.4766 0.4780 -0.1478 0.1262 -0.1886 188 LYS A CA 1443 C C . LYS A 188 ? 0.5768 0.5245 0.5131 -0.1401 0.1186 -0.1765 188 LYS A C 1444 O O . LYS A 188 ? 0.6276 0.5776 0.5675 -0.1430 0.1324 -0.1871 188 LYS A O 1445 C CB . LYS A 188 ? 0.5671 0.4677 0.5158 -0.1334 0.1439 -0.2073 188 LYS A CB 1446 C CG . LYS A 188 ? 0.6843 0.5588 0.6163 -0.1445 0.1581 -0.2198 188 LYS A CG 1447 C CD . LYS A 188 ? 0.7477 0.6033 0.7107 -0.1210 0.1681 -0.2277 188 LYS A CD 1448 C CE . LYS A 188 ? 0.8346 0.6629 0.7810 -0.1296 0.1805 -0.2348 188 LYS A CE 1449 N NZ . LYS A 188 ? 0.8679 0.6728 0.8403 -0.1029 0.1846 -0.2384 188 LYS A NZ 1450 N N . HIS A 189 ? 0.4924 0.4569 0.4337 -0.1316 0.0990 -0.1559 189 HIS A N 1451 C CA . HIS A 189 ? 0.4693 0.4519 0.4213 -0.1234 0.0929 -0.1441 189 HIS A CA 1452 C C . HIS A 189 ? 0.4322 0.4321 0.3642 -0.1297 0.0752 -0.1238 189 HIS A C 1453 O O . HIS A 189 ? 0.4856 0.4885 0.4014 -0.1389 0.0663 -0.1193 189 HIS A O 1454 C CB . HIS A 189 ? 0.5205 0.5050 0.5115 -0.0981 0.0886 -0.1412 189 HIS A CB 1455 C CG . HIS A 189 ? 0.6107 0.5837 0.6260 -0.0881 0.1039 -0.1605 189 HIS A CG 1456 N ND1 . HIS A 189 ? 0.6693 0.6464 0.6910 -0.0929 0.1208 -0.1754 189 HIS A ND1 1457 C CD2 . HIS A 189 ? 0.5388 0.4961 0.5737 -0.0729 0.1051 -0.1677 189 HIS A CD2 1458 C CE1 . HIS A 189 ? 0.5725 0.5413 0.6212 -0.0798 0.1314 -0.1918 189 HIS A CE1 1459 N NE2 . HIS A 189 ? 0.5175 0.4726 0.5736 -0.0663 0.1214 -0.1865 189 HIS A NE2 1460 N N . LYS A 190 ? 0.4627 0.4741 0.3962 -0.1248 0.0709 -0.1121 190 LYS A N 1461 C CA . LYS A 190 ? 0.4825 0.5088 0.3957 -0.1290 0.0554 -0.0927 190 LYS A CA 1462 C C . LYS A 190 ? 0.4444 0.4801 0.3790 -0.1102 0.0439 -0.0760 190 LYS A C 1463 O O . LYS A 190 ? 0.4435 0.4908 0.3805 -0.1047 0.0284 -0.0623 190 LYS A O 1464 C CB . LYS A 190 ? 0.5527 0.5783 0.4321 -0.1456 0.0620 -0.0923 190 LYS A CB 1465 C CG . LYS A 190 ? 0.6966 0.7364 0.5523 -0.1477 0.0445 -0.0709 190 LYS A CG 1466 C CD . LYS A 190 ? 0.8117 0.8451 0.6315 -0.1611 0.0506 -0.0676 190 LYS A CD 1467 C CE . LYS A 190 ? 0.8057 0.8513 0.6041 -0.1574 0.0313 -0.0434 190 LYS A CE 1468 N NZ . LYS A 190 ? 0.7619 0.7953 0.5197 -0.1691 0.0365 -0.0373 190 LYS A NZ 1469 N N . VAL A 191 ? 0.4518 0.4837 0.4020 -0.1019 0.0524 -0.0783 191 VAL A N 1470 C CA . VAL A 191 ? 0.3532 0.3914 0.3179 -0.0879 0.0444 -0.0635 191 VAL A CA 1471 C C . VAL A 191 ? 0.2739 0.3129 0.2750 -0.0712 0.0425 -0.0677 191 VAL A C 1472 O O . VAL A 191 ? 0.3805 0.4148 0.4002 -0.0677 0.0534 -0.0832 191 VAL A O 1473 C CB . VAL A 191 ? 0.3159 0.3485 0.2702 -0.0923 0.0556 -0.0632 191 VAL A CB 1474 C CG1 . VAL A 191 ? 0.2938 0.3292 0.2669 -0.0781 0.0513 -0.0522 191 VAL A CG1 1475 C CG2 . VAL A 191 ? 0.3481 0.3775 0.2608 -0.1066 0.0535 -0.0536 191 VAL A CG2 1476 N N . TYR A 192 ? 0.2529 0.2990 0.2642 -0.0605 0.0285 -0.0540 192 TYR A N 1477 C CA . TYR A 192 ? 0.3216 0.3677 0.3620 -0.0456 0.0244 -0.0552 192 TYR A CA 1478 C C . TYR A 192 ? 0.2950 0.3480 0.3450 -0.0362 0.0185 -0.0420 192 TYR A C 1479 O O . TYR A 192 ? 0.3574 0.4163 0.3976 -0.0356 0.0090 -0.0276 192 TYR A O 1480 C CB . TYR A 192 ? 0.2257 0.2693 0.2664 -0.0444 0.0153 -0.0537 192 TYR A CB 1481 C CG . TYR A 192 ? 0.2997 0.3310 0.3307 -0.0535 0.0232 -0.0680 192 TYR A CG 1482 C CD1 . TYR A 192 ? 0.3103 0.3427 0.3144 -0.0706 0.0255 -0.0703 192 TYR A CD1 1483 C CD2 . TYR A 192 ? 0.2986 0.3162 0.3462 -0.0446 0.0282 -0.0794 192 TYR A CD2 1484 C CE1 . TYR A 192 ? 0.2925 0.3113 0.2860 -0.0808 0.0349 -0.0850 192 TYR A CE1 1485 C CE2 . TYR A 192 ? 0.3773 0.3792 0.4154 -0.0519 0.0374 -0.0930 192 TYR A CE2 1486 C CZ . TYR A 192 ? 0.3715 0.3732 0.3823 -0.0711 0.0417 -0.0965 192 TYR A CZ 1487 O OH . TYR A 192 ? 0.4075 0.3910 0.4073 -0.0801 0.0529 -0.1116 192 TYR A OH 1488 N N . ALA A 193 ? 0.2961 0.3494 0.3663 -0.0290 0.0247 -0.0480 193 ALA A N 1489 C CA . ALA A 193 ? 0.3280 0.3849 0.4055 -0.0227 0.0227 -0.0383 193 ALA A CA 1490 C C . ALA A 193 ? 0.1680 0.2295 0.2739 -0.0114 0.0206 -0.0439 193 ALA A C 1491 O O . ALA A 193 ? 0.3748 0.4387 0.4971 -0.0090 0.0264 -0.0582 193 ALA A O 1492 C CB . ALA A 193 ? 0.2039 0.2564 0.2691 -0.0308 0.0353 -0.0399 193 ALA A CB 1493 N N . CYS A 194 ? 0.1801 0.2439 0.2921 -0.0043 0.0122 -0.0330 194 CYS A N 1494 C CA . CYS A 194 ? 0.3672 0.4361 0.5018 0.0045 0.0100 -0.0366 194 CYS A CA 1495 C C . CYS A 194 ? 0.3367 0.4069 0.4719 0.0026 0.0164 -0.0328 194 CYS A C 1496 O O . CYS A 194 ? 0.2127 0.2775 0.3343 0.0019 0.0149 -0.0198 194 CYS A O 1497 C CB . CYS A 194 ? 0.4705 0.5380 0.6093 0.0118 -0.0025 -0.0293 194 CYS A CB 1498 S SG . CYS A 194 ? 0.6220 0.6894 0.7484 0.0113 -0.0094 -0.0120 194 CYS A SG 1499 N N . GLU A 195 ? 0.2969 0.3742 0.4482 0.0018 0.0243 -0.0450 195 GLU A N 1500 C CA . GLU A 195 ? 0.2110 0.2878 0.3629 -0.0026 0.0331 -0.0446 195 GLU A CA 1501 C C . GLU A 195 ? 0.2675 0.3527 0.4378 0.0042 0.0263 -0.0453 195 GLU A C 1502 O O . GLU A 195 ? 0.2626 0.3603 0.4524 0.0103 0.0201 -0.0545 195 GLU A O 1503 C CB . GLU A 195 ? 0.1477 0.2296 0.3044 -0.0120 0.0485 -0.0601 195 GLU A CB 1504 C CG . GLU A 195 ? 0.3217 0.3947 0.4677 -0.0215 0.0618 -0.0589 195 GLU A CG 1505 C CD . GLU A 195 ? 0.3558 0.4366 0.5091 -0.0333 0.0786 -0.0774 195 GLU A CD 1506 O OE1 . GLU A 195 ? 0.4281 0.5318 0.6113 -0.0309 0.0784 -0.0933 195 GLU A OE1 1507 O OE2 . GLU A 195 ? 0.3526 0.4176 0.4816 -0.0451 0.0919 -0.0765 195 GLU A OE2 1508 N N . VAL A 196 ? 0.2093 0.2867 0.3721 0.0035 0.0275 -0.0354 196 VAL A N 1509 C CA . VAL A 196 ? 0.1552 0.2379 0.3300 0.0077 0.0217 -0.0348 196 VAL A CA 1510 C C . VAL A 196 ? 0.1745 0.2576 0.3525 -0.0005 0.0345 -0.0416 196 VAL A C 1511 O O . VAL A 196 ? 0.2539 0.3211 0.4151 -0.0066 0.0461 -0.0362 196 VAL A O 1512 C CB . VAL A 196 ? 0.1420 0.2152 0.3066 0.0129 0.0139 -0.0196 196 VAL A CB 1513 C CG1 . VAL A 196 ? 0.0966 0.1719 0.2693 0.0139 0.0120 -0.0198 196 VAL A CG1 1514 C CG2 . VAL A 196 ? 0.0985 0.1731 0.2612 0.0182 0.0020 -0.0158 196 VAL A CG2 1515 N N . THR A 197 ? 0.1315 0.2317 0.3290 -0.0009 0.0321 -0.0533 197 THR A N 1516 C CA . THR A 197 ? 0.1681 0.2726 0.3707 -0.0109 0.0436 -0.0625 197 THR A CA 1517 C C . THR A 197 ? 0.1607 0.2689 0.3683 -0.0083 0.0354 -0.0600 197 THR A C 1518 O O . THR A 197 ? 0.2877 0.4082 0.5059 0.0000 0.0203 -0.0606 197 THR A O 1519 C CB . THR A 197 ? 0.2165 0.3454 0.4402 -0.0166 0.0490 -0.0824 197 THR A CB 1520 O OG1 . THR A 197 ? 0.1244 0.2463 0.3394 -0.0228 0.0611 -0.0859 197 THR A OG1 1521 C CG2 . THR A 197 ? 0.1909 0.3271 0.4189 -0.0286 0.0586 -0.0935 197 THR A CG2 1522 N N . HIS A 198 ? 0.1134 0.2071 0.3101 -0.0157 0.0462 -0.0568 198 HIS A N 1523 C CA . HIS A 198 ? 0.1574 0.2520 0.3556 -0.0162 0.0418 -0.0557 198 HIS A CA 1524 C C . HIS A 198 ? 0.1623 0.2475 0.3544 -0.0300 0.0597 -0.0627 198 HIS A C 1525 O O . HIS A 198 ? 0.2314 0.3001 0.4119 -0.0368 0.0756 -0.0626 198 HIS A O 1526 C CB . HIS A 198 ? 0.2180 0.2961 0.4041 -0.0072 0.0346 -0.0392 198 HIS A CB 1527 C CG . HIS A 198 ? 0.2480 0.3272 0.4346 -0.0084 0.0298 -0.0390 198 HIS A CG 1528 N ND1 . HIS A 198 ? 0.1155 0.1798 0.2936 -0.0152 0.0423 -0.0381 198 HIS A ND1 1529 C CD2 . HIS A 198 ? 0.2736 0.3641 0.4651 -0.0044 0.0147 -0.0396 198 HIS A CD2 1530 C CE1 . HIS A 198 ? 0.2597 0.3283 0.4383 -0.0166 0.0355 -0.0393 198 HIS A CE1 1531 N NE2 . HIS A 198 ? 0.2072 0.2912 0.3924 -0.0103 0.0182 -0.0396 198 HIS A NE2 1532 N N . GLN A 199 ? 0.2084 0.3020 0.4055 -0.0355 0.0578 -0.0690 199 GLN A N 1533 C CA . GLN A 199 ? 0.2927 0.3773 0.4834 -0.0512 0.0759 -0.0781 199 GLN A CA 1534 C C . GLN A 199 ? 0.3046 0.3507 0.4731 -0.0508 0.0914 -0.0654 199 GLN A C 1535 O O . GLN A 199 ? 0.2429 0.2704 0.3999 -0.0626 0.1112 -0.0704 199 GLN A O 1536 C CB . GLN A 199 ? 0.2214 0.3224 0.4190 -0.0573 0.0691 -0.0865 199 GLN A CB 1537 C CG . GLN A 199 ? 0.3103 0.4013 0.4986 -0.0754 0.0878 -0.0975 199 GLN A CG 1538 C CD . GLN A 199 ? 0.3896 0.4982 0.5794 -0.0816 0.0784 -0.1062 199 GLN A CD 1539 O OE1 . GLN A 199 ? 0.4046 0.5401 0.6074 -0.0744 0.0578 -0.1072 199 GLN A OE1 1540 N NE2 . GLN A 199 ? 0.4862 0.5770 0.6595 -0.0946 0.0934 -0.1119 199 GLN A NE2 1541 N N . GLY A 200 ? 0.2052 0.2387 0.3673 -0.0373 0.0831 -0.0493 200 GLY A N 1542 C CA . GLY A 200 ? 0.2059 0.2070 0.3511 -0.0326 0.0949 -0.0363 200 GLY A CA 1543 C C . GLY A 200 ? 0.2898 0.2734 0.4221 -0.0262 0.0995 -0.0253 200 GLY A C 1544 O O . GLY A 200 ? 0.4370 0.3942 0.5552 -0.0187 0.1068 -0.0124 200 GLY A O 1545 N N . LEU A 201 ? 0.2398 0.2372 0.3758 -0.0281 0.0953 -0.0299 201 LEU A N 1546 C CA . LEU A 201 ? 0.2865 0.2672 0.4061 -0.0252 0.1002 -0.0209 201 LEU A CA 1547 C C . LEU A 201 ? 0.2211 0.1918 0.3312 -0.0415 0.1191 -0.0329 201 LEU A C 1548 O O . LEU A 201 ? 0.2805 0.2754 0.4070 -0.0526 0.1204 -0.0508 201 LEU A O 1549 C CB . LEU A 201 ? 0.1781 0.1787 0.3052 -0.0174 0.0838 -0.0179 201 LEU A CB 1550 C CG . LEU A 201 ? 0.1601 0.1681 0.2924 -0.0034 0.0668 -0.0058 201 LEU A CG 1551 C CD1 . LEU A 201 ? 0.1434 0.1706 0.2832 0.0004 0.0529 -0.0075 201 LEU A CD1 1552 C CD2 . LEU A 201 ? 0.1825 0.1688 0.2986 0.0060 0.0692 0.0115 201 LEU A CD2 1553 N N . SER A 202 ? 0.4625 0.3978 0.5461 -0.0431 0.1338 -0.0234 202 SER A N 1554 C CA . SER A 202 ? 0.3920 0.3117 0.4608 -0.0611 0.1546 -0.0346 202 SER A CA 1555 C C . SER A 202 ? 0.4271 0.3635 0.4980 -0.0666 0.1525 -0.0418 202 SER A C 1556 O O . SER A 202 ? 0.5711 0.5098 0.6407 -0.0844 0.1681 -0.0581 202 SER A O 1557 C CB . SER A 202 ? 0.3301 0.1997 0.3641 -0.0604 0.1714 -0.0205 202 SER A CB 1558 O OG . SER A 202 ? 0.5213 0.3777 0.5389 -0.0447 0.1611 -0.0002 202 SER A OG 1559 N N . SER A 203 ? 0.3720 0.3205 0.4462 -0.0534 0.1352 -0.0318 203 SER A N 1560 C CA . SER A 203 ? 0.4406 0.4051 0.5175 -0.0579 0.1331 -0.0394 203 SER A CA 1561 C C . SER A 203 ? 0.4269 0.4129 0.5179 -0.0425 0.1105 -0.0319 203 SER A C 1562 O O . SER A 203 ? 0.3272 0.3067 0.4148 -0.0293 0.0993 -0.0163 203 SER A O 1563 C CB . SER A 203 ? 0.4918 0.4233 0.5325 -0.0650 0.1468 -0.0314 203 SER A CB 1564 O OG . SER A 203 ? 0.5274 0.4341 0.5452 -0.0506 0.1389 -0.0077 203 SER A OG 1565 N N . PRO A 204 ? 0.3415 0.3524 0.4485 -0.0442 0.1049 -0.0436 204 PRO A N 1566 C CA . PRO A 204 ? 0.2497 0.2787 0.3700 -0.0311 0.0851 -0.0388 204 PRO A CA 1567 C C . PRO A 204 ? 0.2512 0.2641 0.3491 -0.0229 0.0773 -0.0197 204 PRO A C 1568 O O . PRO A 204 ? 0.4041 0.3979 0.4762 -0.0280 0.0854 -0.0133 204 PRO A O 1569 C CB . PRO A 204 ? 0.2215 0.2720 0.3576 -0.0362 0.0864 -0.0559 204 PRO A CB 1570 C CG . PRO A 204 ? 0.2806 0.3384 0.4263 -0.0500 0.1027 -0.0734 204 PRO A CG 1571 C CD . PRO A 204 ? 0.3047 0.3302 0.4219 -0.0585 0.1176 -0.0644 204 PRO A CD 1572 N N . VAL A 205 ? 0.1767 0.1986 0.2835 -0.0110 0.0612 -0.0109 205 VAL A N 1573 C CA . VAL A 205 ? 0.1815 0.1973 0.2733 -0.0029 0.0511 0.0054 205 VAL A CA 1574 C C . VAL A 205 ? 0.3051 0.3363 0.4017 -0.0027 0.0414 0.0006 205 VAL A C 1575 O O . VAL A 205 ? 0.2729 0.3196 0.3897 -0.0002 0.0344 -0.0085 205 VAL A O 1576 C CB . VAL A 205 ? 0.1696 0.1863 0.2688 0.0079 0.0422 0.0162 205 VAL A CB 1577 C CG1 . VAL A 205 ? 0.1703 0.1911 0.2611 0.0158 0.0297 0.0296 205 VAL A CG1 1578 C CG2 . VAL A 205 ? 0.3501 0.3462 0.4410 0.0083 0.0540 0.0218 205 VAL A CG2 1579 N N . THR A 206 ? 0.1884 0.2131 0.2638 -0.0056 0.0410 0.0068 206 THR A N 1580 C CA . THR A 206 ? 0.1843 0.2199 0.2595 -0.0081 0.0345 0.0013 206 THR A CA 1581 C C . THR A 206 ? 0.2480 0.2862 0.3105 -0.0032 0.0217 0.0155 206 THR A C 1582 O O . THR A 206 ? 0.2234 0.2517 0.2647 -0.0021 0.0214 0.0285 206 THR A O 1583 C CB . THR A 206 ? 0.2056 0.2349 0.2663 -0.0202 0.0469 -0.0083 206 THR A CB 1584 O OG1 . THR A 206 ? 0.2571 0.2910 0.3355 -0.0254 0.0587 -0.0245 206 THR A OG1 1585 C CG2 . THR A 206 ? 0.3048 0.3426 0.3632 -0.0236 0.0419 -0.0147 206 THR A CG2 1586 N N . LYS A 207 ? 0.2291 0.2804 0.3037 -0.0001 0.0110 0.0129 207 LYS A N 1587 C CA . LYS A 207 ? 0.2918 0.3513 0.3567 0.0008 -0.0004 0.0216 207 LYS A CA 1588 C C . LYS A 207 ? 0.3539 0.4166 0.4114 -0.0084 -0.0003 0.0115 207 LYS A C 1589 O O . LYS A 207 ? 0.3618 0.4245 0.4327 -0.0096 0.0030 -0.0017 207 LYS A O 1590 C CB . LYS A 207 ? 0.2925 0.3621 0.3739 0.0082 -0.0102 0.0254 207 LYS A CB 1591 C CG . LYS A 207 ? 0.2237 0.2905 0.3119 0.0170 -0.0096 0.0352 207 LYS A CG 1592 C CD . LYS A 207 ? 0.2065 0.2726 0.2795 0.0217 -0.0126 0.0499 207 LYS A CD 1593 C CE . LYS A 207 ? 0.3512 0.4111 0.4321 0.0321 -0.0099 0.0588 207 LYS A CE 1594 N NZ . LYS A 207 ? 0.5551 0.6151 0.6238 0.0410 -0.0148 0.0746 207 LYS A NZ 1595 N N . SER A 208 ? 0.4015 0.4666 0.4371 -0.0144 -0.0042 0.0173 208 SER A N 1596 C CA . SER A 208 ? 0.3667 0.4320 0.3907 -0.0259 -0.0013 0.0065 208 SER A CA 1597 C C . SER A 208 ? 0.3754 0.4521 0.3816 -0.0313 -0.0121 0.0138 208 SER A C 1598 O O . SER A 208 ? 0.5376 0.6230 0.5384 -0.0254 -0.0214 0.0283 208 SER A O 1599 C CB . SER A 208 ? 0.3604 0.4132 0.3690 -0.0347 0.0125 -0.0004 208 SER A CB 1600 O OG . SER A 208 ? 0.5352 0.5798 0.5219 -0.0346 0.0130 0.0134 208 SER A OG 1601 N N . PHE A 209 ? 0.2379 0.3158 0.2360 -0.0426 -0.0104 0.0026 209 PHE A N 1602 C CA . PHE A 209 ? 0.3217 0.4125 0.3004 -0.0523 -0.0192 0.0058 209 PHE A CA 1603 C C . PHE A 209 ? 0.3862 0.4685 0.3466 -0.0682 -0.0097 -0.0086 209 PHE A C 1604 O O . PHE A 209 ? 0.4060 0.4751 0.3765 -0.0693 0.0023 -0.0227 209 PHE A O 1605 C CB . PHE A 209 ? 0.3552 0.4608 0.3481 -0.0506 -0.0294 0.0063 209 PHE A CB 1606 C CG . PHE A 209 ? 0.3195 0.4141 0.3239 -0.0539 -0.0231 -0.0084 209 PHE A CG 1607 C CD1 . PHE A 209 ? 0.3103 0.4016 0.3005 -0.0684 -0.0196 -0.0202 209 PHE A CD1 1608 C CD2 . PHE A 209 ? 0.2406 0.3260 0.2675 -0.0423 -0.0207 -0.0102 209 PHE A CD2 1609 C CE1 . PHE A 209 ? 0.2749 0.3503 0.2732 -0.0696 -0.0131 -0.0326 209 PHE A CE1 1610 C CE2 . PHE A 209 ? 0.2621 0.3342 0.2966 -0.0429 -0.0165 -0.0217 209 PHE A CE2 1611 C CZ . PHE A 209 ? 0.2214 0.2866 0.2416 -0.0556 -0.0123 -0.0325 209 PHE A CZ 1612 N N . ASN A 210 ? 0.4231 0.5146 0.3570 -0.0804 -0.0153 -0.0056 210 ASN A N 1613 C CA . ASN A 210 ? 0.4321 0.5171 0.3453 -0.0986 -0.0067 -0.0202 210 ASN A CA 1614 C C . ASN A 210 ? 0.4085 0.5054 0.3223 -0.1075 -0.0131 -0.0267 210 ASN A C 1615 O O . ASN A 210 ? 0.4957 0.6149 0.4091 -0.1067 -0.0278 -0.0164 210 ASN A O 1616 C CB . ASN A 210 ? 0.5371 0.6223 0.4139 -0.1101 -0.0074 -0.0141 210 ASN A CB 1617 C CG . ASN A 210 ? 0.5037 0.5750 0.3745 -0.1021 -0.0018 -0.0044 210 ASN A CG 1618 O OD1 . ASN A 210 ? 0.5139 0.5856 0.3580 -0.1031 -0.0087 0.0100 210 ASN A OD1 1619 N ND2 . ASN A 210 ? 0.5347 0.5929 0.4288 -0.0943 0.0105 -0.0122 210 ASN A ND2 1620 N N . ARG A 211 ? 0.3408 0.4228 0.2565 -0.1160 -0.0013 -0.0444 211 ARG A N 1621 C CA . ARG A 211 ? 0.5019 0.5880 0.4147 -0.1269 -0.0037 -0.0527 211 ARG A CA 1622 C C . ARG A 211 ? 0.5684 0.6762 0.4535 -0.1447 -0.0128 -0.0501 211 ARG A C 1623 O O . ARG A 211 ? 0.5083 0.6104 0.3670 -0.1615 -0.0053 -0.0591 211 ARG A O 1624 C CB . ARG A 211 ? 0.4695 0.5295 0.3827 -0.1334 0.0130 -0.0723 211 ARG A CB 1625 C CG . ARG A 211 ? 0.4744 0.5308 0.3797 -0.1469 0.0138 -0.0822 211 ARG A CG 1626 C CD . ARG A 211 ? 0.5158 0.5403 0.4208 -0.1502 0.0317 -0.1009 211 ARG A CD 1627 N NE . ARG A 211 ? 0.5648 0.5797 0.4609 -0.1544 0.0451 -0.1105 211 ARG A NE 1628 C CZ . ARG A 211 ? 0.5623 0.5800 0.4289 -0.1757 0.0511 -0.1184 211 ARG A CZ 1629 N NH1 . ARG A 211 ? 0.6062 0.6390 0.4503 -0.1941 0.0431 -0.1176 211 ARG A NH1 1630 N NH2 . ARG A 211 ? 0.5500 0.5573 0.4092 -0.1798 0.0654 -0.1280 211 ARG A NH2 1631 N N . GLY A 212 ? 0.6810 0.8159 0.5727 -0.1415 -0.0290 -0.0386 212 GLY A N 1632 C CA . GLY A 212 ? 0.7722 0.9365 0.6423 -0.1539 -0.0423 -0.0328 212 GLY A CA 1633 C C . GLY A 212 ? 0.8085 0.9903 0.6799 -0.1379 -0.0568 -0.0115 212 GLY A C 1634 O O . GLY A 212 ? 0.6559 0.8603 0.5478 -0.1256 -0.0694 -0.0008 212 GLY A O 1635 N N . ALA A 213 ? 0.8996 1.0686 0.7481 -0.1381 -0.0535 -0.0058 213 ALA A N 1636 C CA . ALA A 213 ? 0.9099 1.0851 0.7537 -0.1221 -0.0645 0.0152 213 ALA A CA 1637 C C . ALA A 213 ? 0.9664 1.1114 0.7870 -0.1234 -0.0519 0.0168 213 ALA A C 1638 O O . ALA A 213 ? 0.9297 1.0562 0.7357 -0.1390 -0.0363 0.0010 213 ALA A O 1639 C CB . ALA A 213 ? 0.8825 1.0923 0.7087 -0.1263 -0.0851 0.0264 213 ALA A CB 1640 O OXT . ALA A 213 ? 1.0320 1.1690 0.8474 -0.1098 -0.0552 0.0328 213 ALA A OXT 1641 N N . GLN B 1 ? 0.2333 0.6311 0.4623 0.1559 -0.0114 -0.0858 1 GLN B N 1642 C CA . GLN B 1 ? 0.5652 0.9220 0.7846 0.1375 0.0124 -0.0620 1 GLN B CA 1643 C C . GLN B 1 ? 0.4655 0.8123 0.6876 0.1053 0.0204 -0.0573 1 GLN B C 1644 O O . GLN B 1 ? 0.5415 0.9190 0.7890 0.0887 0.0163 -0.0772 1 GLN B O 1645 C CB . GLN B 1 ? 0.6886 0.9917 0.8543 0.1692 0.0174 -0.0354 1 GLN B CB 1646 N N . VAL B 2 ? 0.1779 0.4695 0.3656 0.0928 0.0334 -0.0325 2 VAL B N 1647 C CA . VAL B 2 ? 0.1921 0.4602 0.3677 0.0679 0.0393 -0.0245 2 VAL B CA 1648 C C . VAL B 2 ? 0.1745 0.4309 0.3273 0.0794 0.0245 -0.0187 2 VAL B C 1649 O O . VAL B 2 ? 0.2160 0.4450 0.3370 0.1007 0.0210 -0.0071 2 VAL B O 1650 C CB . VAL B 2 ? 0.2385 0.4697 0.3901 0.0571 0.0541 -0.0087 2 VAL B CB 1651 C CG1 . VAL B 2 ? 0.1619 0.3716 0.2928 0.0451 0.0548 -0.0010 2 VAL B CG1 1652 C CG2 . VAL B 2 ? 0.1630 0.4016 0.3303 0.0448 0.0699 -0.0145 2 VAL B CG2 1653 N N . GLN B 3 ? 0.1687 0.4370 0.3322 0.0641 0.0215 -0.0278 3 GLN B N 1654 C CA . GLN B 3 ? 0.2483 0.5078 0.3919 0.0724 0.0081 -0.0247 3 GLN B CA 1655 C C . GLN B 3 ? 0.2807 0.5221 0.4203 0.0475 0.0175 -0.0227 3 GLN B C 1656 O O . GLN B 3 ? 0.3176 0.5620 0.4734 0.0262 0.0336 -0.0320 3 GLN B O 1657 C CB . GLN B 3 ? 0.3911 0.6997 0.5531 0.0919 -0.0121 -0.0476 3 GLN B CB 1658 C CG . GLN B 3 ? 0.5163 0.8310 0.6600 0.1337 -0.0255 -0.0455 3 GLN B CG 1659 C CD . GLN B 3 ? 0.5329 0.9029 0.6881 0.1609 -0.0508 -0.0728 3 GLN B CD 1660 O OE1 . GLN B 3 ? 0.5781 0.9854 0.7609 0.1417 -0.0568 -0.0971 3 GLN B OE1 1661 N NE2 . GLN B 3 ? 0.5115 0.8696 0.6318 0.1997 -0.0612 -0.0698 3 GLN B NE2 1662 N N . LEU B 4 ? 0.3371 0.5516 0.4487 0.0520 0.0119 -0.0108 4 LEU B N 1663 C CA . LEU B 4 ? 0.3261 0.5214 0.4280 0.0362 0.0184 -0.0086 4 LEU B CA 1664 C C . LEU B 4 ? 0.3051 0.5037 0.3980 0.0434 0.0044 -0.0130 4 LEU B C 1665 O O . LEU B 4 ? 0.3226 0.5037 0.3904 0.0605 -0.0034 -0.0032 4 LEU B O 1666 C CB . LEU B 4 ? 0.3454 0.5082 0.4220 0.0363 0.0263 0.0077 4 LEU B CB 1667 C CG . LEU B 4 ? 0.3125 0.4695 0.3861 0.0342 0.0383 0.0119 4 LEU B CG 1668 C CD1 . LEU B 4 ? 0.3687 0.5366 0.4499 0.0418 0.0370 0.0123 4 LEU B CD1 1669 C CD2 . LEU B 4 ? 0.1858 0.3226 0.2323 0.0397 0.0417 0.0193 4 LEU B CD2 1670 N N . LYS B 5 ? 0.1907 0.4063 0.2998 0.0289 0.0061 -0.0304 5 LYS B N 1671 C CA . LYS B 5 ? 0.2543 0.4800 0.3564 0.0347 -0.0080 -0.0397 5 LYS B CA 1672 C C . LYS B 5 ? 0.2086 0.4044 0.3003 0.0139 0.0065 -0.0379 5 LYS B C 1673 O O . LYS B 5 ? 0.2185 0.4066 0.3221 -0.0083 0.0284 -0.0474 5 LYS B O 1674 C CB . LYS B 5 ? 0.2873 0.5766 0.4237 0.0391 -0.0217 -0.0735 5 LYS B CB 1675 C CG . LYS B 5 ? 0.3950 0.7137 0.5350 0.0703 -0.0382 -0.0756 5 LYS B CG 1676 C CD . LYS B 5 ? 0.5832 0.9796 0.7554 0.0868 -0.0597 -0.1150 5 LYS B CD 1677 C CE . LYS B 5 ? 0.6673 1.0851 0.8295 0.1306 -0.0778 -0.1134 5 LYS B CE 1678 N NZ . LYS B 5 ? 0.6943 1.1629 0.8630 0.1493 -0.0968 -0.1496 5 LYS B NZ 1679 N N . GLN B 6 ? 0.2151 0.3856 0.2789 0.0222 -0.0004 -0.0259 6 GLN B N 1680 C CA . GLN B 6 ? 0.2242 0.3615 0.2725 0.0090 0.0127 -0.0209 6 GLN B CA 1681 C C . GLN B 6 ? 0.2378 0.3891 0.2895 0.0013 0.0071 -0.0397 6 GLN B C 1682 O O . GLN B 6 ? 0.2415 0.4260 0.2968 0.0149 -0.0132 -0.0524 6 GLN B O 1683 C CB . GLN B 6 ? 0.2205 0.3259 0.2415 0.0210 0.0118 -0.0005 6 GLN B CB 1684 C CG . GLN B 6 ? 0.2082 0.3111 0.2288 0.0288 0.0155 0.0102 6 GLN B CG 1685 C CD . GLN B 6 ? 0.3413 0.4302 0.3471 0.0368 0.0162 0.0165 6 GLN B CD 1686 O OE1 . GLN B 6 ? 0.3367 0.4312 0.3452 0.0417 0.0181 0.0169 6 GLN B OE1 1687 N NE2 . GLN B 6 ? 0.2143 0.2878 0.2080 0.0356 0.0180 0.0162 6 GLN B NE2 1688 N N . SER B 7 ? 0.2550 0.3777 0.2991 -0.0167 0.0263 -0.0422 7 SER B N 1689 C CA . SER B 7 ? 0.3864 0.5178 0.4323 -0.0280 0.0252 -0.0617 7 SER B CA 1690 C C . SER B 7 ? 0.3413 0.4605 0.3589 -0.0088 0.0062 -0.0485 7 SER B C 1691 O O . SER B 7 ? 0.2849 0.3788 0.2820 0.0063 0.0033 -0.0256 7 SER B O 1692 C CB . SER B 7 ? 0.4252 0.5120 0.4601 -0.0511 0.0582 -0.0646 7 SER B CB 1693 O OG . SER B 7 ? 0.5190 0.5538 0.5186 -0.0365 0.0663 -0.0346 7 SER B OG 1694 N N . GLY B 8 ? 0.3637 0.5016 0.3802 -0.0118 -0.0030 -0.0681 8 GLY B N 1695 C CA . GLY B 8 ? 0.3615 0.4854 0.3439 0.0080 -0.0190 -0.0592 8 GLY B CA 1696 C C . GLY B 8 ? 0.3236 0.3942 0.2801 0.0045 -0.0050 -0.0384 8 GLY B C 1697 O O . GLY B 8 ? 0.3229 0.3698 0.2846 -0.0098 0.0143 -0.0332 8 GLY B O 1698 N N . PRO B 9 ? 0.3153 0.3627 0.2384 0.0208 -0.0118 -0.0280 9 PRO B N 1699 C CA . PRO B 9 ? 0.5035 0.5098 0.4089 0.0162 0.0025 -0.0162 9 PRO B CA 1700 C C . PRO B 9 ? 0.5465 0.5437 0.4455 0.0031 0.0073 -0.0274 9 PRO B C 1701 O O . PRO B 9 ? 0.6164 0.6382 0.5164 -0.0002 -0.0029 -0.0465 9 PRO B O 1702 C CB . PRO B 9 ? 0.5918 0.5709 0.4608 0.0338 0.0017 -0.0072 9 PRO B CB 1703 C CG . PRO B 9 ? 0.5361 0.5341 0.3850 0.0538 -0.0180 -0.0152 9 PRO B CG 1704 C CD . PRO B 9 ? 0.5102 0.5615 0.4032 0.0476 -0.0287 -0.0281 9 PRO B CD 1705 N N . GLY B 10 ? 0.6003 0.5672 0.4943 -0.0029 0.0229 -0.0198 10 GLY B N 1706 C CA . GLY B 10 ? 0.6799 0.6301 0.5655 -0.0156 0.0321 -0.0289 10 GLY B CA 1707 C C . GLY B 10 ? 0.5448 0.4633 0.4215 -0.0129 0.0469 -0.0197 10 GLY B C 1708 O O . GLY B 10 ? 0.5114 0.4310 0.3949 -0.0019 0.0493 -0.0114 10 GLY B O 1709 N N . LEU B 11 ? 0.4850 0.3824 0.3497 -0.0225 0.0568 -0.0267 11 LEU B N 1710 C CA . LEU B 11 ? 0.3946 0.2654 0.2517 -0.0177 0.0710 -0.0224 11 LEU B CA 1711 C C . LEU B 11 ? 0.5151 0.3672 0.3727 -0.0125 0.0871 -0.0172 11 LEU B C 1712 O O . LEU B 11 ? 0.4287 0.2705 0.2848 -0.0249 0.0976 -0.0214 11 LEU B O 1713 C CB . LEU B 11 ? 0.4205 0.2704 0.2575 -0.0283 0.0762 -0.0317 11 LEU B CB 1714 C CG . LEU B 11 ? 0.4328 0.2578 0.2628 -0.0238 0.0911 -0.0314 11 LEU B CG 1715 C CD1 . LEU B 11 ? 0.4756 0.3097 0.3119 -0.0148 0.0909 -0.0315 11 LEU B CD1 1716 C CD2 . LEU B 11 ? 0.4629 0.2642 0.2709 -0.0378 0.0981 -0.0414 11 LEU B CD2 1717 N N . VAL B 12 ? 0.4909 0.3368 0.3465 0.0082 0.0921 -0.0118 12 VAL B N 1718 C CA . VAL B 12 ? 0.4676 0.2826 0.3039 0.0272 0.1085 -0.0044 12 VAL B CA 1719 C C . VAL B 12 ? 0.4633 0.2660 0.2911 0.0429 0.1157 -0.0086 12 VAL B C 1720 O O . VAL B 12 ? 0.4383 0.2747 0.2869 0.0500 0.1056 -0.0180 12 VAL B O 1721 C CB . VAL B 12 ? 0.5844 0.4156 0.4219 0.0535 0.1020 0.0045 12 VAL B CB 1722 C CG1 . VAL B 12 ? 0.5634 0.3983 0.4068 0.0365 0.1014 0.0080 12 VAL B CG1 1723 C CG2 . VAL B 12 ? 0.7304 0.6136 0.5965 0.0664 0.0836 -0.0040 12 VAL B CG2 1724 N N . GLN B 13 ? 0.6253 0.3776 0.4229 0.0457 0.1379 -0.0055 13 GLN B N 1725 C CA A GLN B 13 ? 0.6723 0.4101 0.4594 0.0644 0.1463 -0.0098 13 GLN B CA 1726 C CA B GLN B 13 ? 0.6722 0.4103 0.4595 0.0642 0.1462 -0.0099 13 GLN B CA 1727 C C . GLN B 13 ? 0.7160 0.4757 0.4998 0.1138 0.1382 -0.0084 13 GLN B C 1728 O O . GLN B 13 ? 0.7529 0.5089 0.5199 0.1369 0.1358 0.0023 13 GLN B O 1729 C CB A GLN B 13 ? 0.7340 0.4031 0.4828 0.0567 0.1771 -0.0066 13 GLN B CB 1730 C CB B GLN B 13 ? 0.7324 0.4022 0.4819 0.0557 0.1768 -0.0069 13 GLN B CB 1731 C CG A GLN B 13 ? 0.7393 0.4004 0.4954 0.0098 0.1837 -0.0187 13 GLN B CG 1732 C CG B GLN B 13 ? 0.7370 0.4004 0.4946 0.0084 0.1827 -0.0189 13 GLN B CG 1733 C CD A GLN B 13 ? 0.7460 0.3394 0.4676 -0.0035 0.2209 -0.0222 13 GLN B CD 1734 C CD B GLN B 13 ? 0.7026 0.3934 0.4781 -0.0053 0.1687 -0.0304 13 GLN B CD 1735 O OE1 A GLN B 13 ? 0.7129 0.3014 0.4384 -0.0353 0.2282 -0.0382 13 GLN B OE1 1736 O OE1 B GLN B 13 ? 0.5727 0.2996 0.3661 -0.0204 0.1489 -0.0356 13 GLN B OE1 1737 N NE2 A GLN B 13 ? 0.8158 0.3506 0.4962 0.0226 0.2480 -0.0087 13 GLN B NE2 1738 N NE2 B GLN B 13 ? 0.7748 0.4404 0.5377 0.0028 0.1825 -0.0341 13 GLN B NE2 1739 N N . PRO B 14 ? 0.6846 0.4728 0.4844 0.1326 0.1337 -0.0235 14 PRO B N 1740 C CA . PRO B 14 ? 0.6668 0.4958 0.4695 0.1858 0.1213 -0.0326 14 PRO B CA 1741 C C . PRO B 14 ? 0.7952 0.5626 0.5326 0.2330 0.1354 -0.0122 14 PRO B C 1742 O O . PRO B 14 ? 0.6868 0.3762 0.3803 0.2265 0.1631 0.0016 14 PRO B O 1743 C CB . PRO B 14 ? 0.6030 0.4680 0.4362 0.1904 0.1214 -0.0587 14 PRO B CB 1744 C CG . PRO B 14 ? 0.5718 0.4269 0.4258 0.1336 0.1290 -0.0630 14 PRO B CG 1745 C CD . PRO B 14 ? 0.5925 0.3863 0.4119 0.1066 0.1388 -0.0387 14 PRO B CD 1746 N N . SER B 15 ? 0.8754 0.6767 0.6040 0.2752 0.1164 -0.0104 15 SER B N 1747 C CA . SER B 15 ? 0.8352 0.5834 0.4940 0.3141 0.1223 0.0150 15 SER B CA 1748 C C . SER B 15 ? 0.8299 0.4857 0.4371 0.2918 0.1551 0.0413 15 SER B C 1749 O O . SER B 15 ? 0.9586 0.5394 0.4943 0.3094 0.1798 0.0634 15 SER B O 1750 C CB . SER B 15 ? 0.8308 0.5507 0.4553 0.3418 0.1301 0.0186 15 SER B CB 1751 O OG . SER B 15 ? 0.8852 0.5305 0.4922 0.3071 0.1642 0.0276 15 SER B OG 1752 N N . GLN B 16 ? 0.7738 0.4336 0.4130 0.2513 0.1602 0.0358 16 GLN B N 1753 C CA . GLN B 16 ? 0.7975 0.3890 0.4058 0.2205 0.1896 0.0504 16 GLN B CA 1754 C C . GLN B 16 ? 0.7565 0.3934 0.3889 0.2151 0.1697 0.0519 16 GLN B C 1755 O O . GLN B 16 ? 0.7381 0.4575 0.4150 0.2271 0.1352 0.0402 16 GLN B O 1756 C CB . GLN B 16 ? 0.7692 0.3484 0.4080 0.1553 0.2047 0.0406 16 GLN B CB 1757 C CG . GLN B 16 ? 0.9714 0.5013 0.5858 0.1549 0.2281 0.0376 16 GLN B CG 1758 C CD . GLN B 16 ? 1.1420 0.5945 0.7287 0.1121 0.2730 0.0353 16 GLN B CD 1759 O OE1 . GLN B 16 ? 1.2184 0.7013 0.8482 0.0585 0.2700 0.0179 16 GLN B OE1 1760 N NE2 . GLN B 16 ? 1.1309 0.5140 0.6543 0.1281 0.3071 0.0535 16 GLN B NE2 1761 N N . SER B 17 ? 0.7421 0.3237 0.3469 0.1932 0.1966 0.0622 17 SER B N 1762 C CA . SER B 17 ? 0.8198 0.4264 0.4314 0.1962 0.1851 0.0669 17 SER B CA 1763 C C . SER B 17 ? 0.7651 0.4365 0.4496 0.1414 0.1662 0.0533 17 SER B C 1764 O O . SER B 17 ? 0.8051 0.4840 0.5206 0.0989 0.1701 0.0415 17 SER B O 1765 C CB . SER B 17 ? 0.8936 0.3994 0.4297 0.2058 0.2300 0.0835 17 SER B CB 1766 O OG . SER B 17 ? 1.1754 0.6244 0.7097 0.1527 0.2713 0.0757 17 SER B OG 1767 N N . LEU B 18 ? 0.4696 0.2063 0.2797 0.0612 0.0268 -0.0118 18 LEU B N 1768 C CA . LEU B 18 ? 0.4999 0.2726 0.3468 0.0437 0.0267 -0.0145 18 LEU B CA 1769 C C . LEU B 18 ? 0.5466 0.3216 0.3984 0.0221 0.0260 -0.0138 18 LEU B C 1770 O O . LEU B 18 ? 0.6047 0.3781 0.4525 0.0236 0.0262 -0.0110 18 LEU B O 1771 C CB . LEU B 18 ? 0.4432 0.2632 0.3265 0.0535 0.0277 -0.0141 18 LEU B CB 1772 C CG . LEU B 18 ? 0.4830 0.3382 0.4014 0.0385 0.0276 -0.0162 18 LEU B CG 1773 C CD1 . LEU B 18 ? 0.5056 0.3600 0.4287 0.0282 0.0272 -0.0196 18 LEU B CD1 1774 C CD2 . LEU B 18 ? 0.4546 0.3468 0.3984 0.0475 0.0277 -0.0151 18 LEU B CD2 1775 N N . SER B 19 ? 0.4995 0.2814 0.3597 0.0027 0.0254 -0.0159 19 SER B N 1776 C CA . SER B 19 ? 0.3457 0.1366 0.2108 -0.0178 0.0250 -0.0147 19 SER B CA 1777 C C . SER B 19 ? 0.3068 0.1392 0.2067 -0.0263 0.0258 -0.0169 19 SER B C 1778 O O . SER B 19 ? 0.3888 0.2245 0.2920 -0.0312 0.0253 -0.0189 19 SER B O 1779 C CB . SER B 19 ? 0.3880 0.1406 0.2164 -0.0360 0.0227 -0.0133 19 SER B CB 1780 O OG . SER B 19 ? 0.5556 0.2667 0.3481 -0.0294 0.0218 -0.0105 19 SER B OG 1781 N N . ILE B 20 ? 0.3284 0.1900 0.2511 -0.0270 0.0271 -0.0163 20 ILE B N 1782 C CA . ILE B 20 ? 0.3142 0.2118 0.2646 -0.0325 0.0281 -0.0180 20 ILE B CA 1783 C C . ILE B 20 ? 0.3097 0.2213 0.2618 -0.0453 0.0289 -0.0159 20 ILE B C 1784 O O . ILE B 20 ? 0.3544 0.2582 0.2985 -0.0445 0.0291 -0.0137 20 ILE B O 1785 C CB . ILE B 20 ? 0.2771 0.1968 0.2512 -0.0183 0.0290 -0.0199 20 ILE B CB 1786 C CG1 . ILE B 20 ? 0.3441 0.2546 0.3158 -0.0059 0.0282 -0.0209 20 ILE B CG1 1787 C CG2 . ILE B 20 ? 0.1984 0.1469 0.1939 -0.0218 0.0300 -0.0218 20 ILE B CG2 1788 C CD1 . ILE B 20 ? 0.3580 0.2912 0.3503 0.0036 0.0283 -0.0218 20 ILE B CD1 1789 N N . THR B 21 ? 0.3587 0.2939 0.3208 -0.0564 0.0294 -0.0159 21 THR B N 1790 C CA . THR B 21 ? 0.3669 0.3250 0.3326 -0.0676 0.0306 -0.0133 21 THR B CA 1791 C C . THR B 21 ? 0.3954 0.3889 0.3869 -0.0579 0.0330 -0.0153 21 THR B C 1792 O O . THR B 21 ? 0.3930 0.3996 0.3969 -0.0529 0.0333 -0.0175 21 THR B O 1793 C CB . THR B 21 ? 0.3135 0.2761 0.2666 -0.0887 0.0292 -0.0104 21 THR B CB 1794 O OG1 . THR B 21 ? 0.4598 0.3805 0.3808 -0.0990 0.0264 -0.0085 21 THR B OG1 1795 C CG2 . THR B 21 ? 0.2550 0.2518 0.2146 -0.0997 0.0307 -0.0068 21 THR B CG2 1796 N N . CYS B 22 ? 0.2030 0.2083 0.1992 -0.0545 0.0347 -0.0145 22 CYS B N 1797 C CA . CYS B 22 ? 0.2572 0.2897 0.2703 -0.0441 0.0371 -0.0164 22 CYS B CA 1798 C C . CYS B 22 ? 0.2435 0.3059 0.2575 -0.0527 0.0391 -0.0132 22 CYS B C 1799 O O . CYS B 22 ? 0.2755 0.3379 0.2822 -0.0582 0.0396 -0.0107 22 CYS B O 1800 C CB . CYS B 22 ? 0.1960 0.2184 0.2111 -0.0323 0.0373 -0.0183 22 CYS B CB 1801 S SG . CYS B 22 ? 0.3174 0.3595 0.3435 -0.0186 0.0396 -0.0214 22 CYS B SG 1802 N N . THR B 23 ? 0.3489 0.4396 0.3713 -0.0536 0.0402 -0.0127 23 THR B N 1803 C CA . THR B 23 ? 0.3550 0.4849 0.3804 -0.0589 0.0426 -0.0089 23 THR B CA 1804 C C . THR B 23 ? 0.3289 0.4785 0.3643 -0.0385 0.0460 -0.0115 23 THR B C 1805 O O . THR B 23 ? 0.3514 0.4992 0.3933 -0.0249 0.0463 -0.0149 23 THR B O 1806 C CB . THR B 23 ? 0.2793 0.4341 0.3064 -0.0712 0.0418 -0.0057 23 THR B CB 1807 O OG1 . THR B 23 ? 0.2436 0.3723 0.2547 -0.0912 0.0382 -0.0037 23 THR B OG1 1808 C CG2 . THR B 23 ? 0.1930 0.3976 0.2238 -0.0766 0.0444 -0.0005 23 THR B CG2 1809 N N . VAL B 24 ? 0.2097 0.3751 0.2430 -0.0362 0.0483 -0.0098 24 VAL B N 1810 C CA . VAL B 24 ? 0.1654 0.3418 0.2014 -0.0156 0.0516 -0.0126 24 VAL B CA 1811 C C . VAL B 24 ? 0.2798 0.5056 0.3190 -0.0119 0.0553 -0.0087 24 VAL B C 1812 O O . VAL B 24 ? 0.3724 0.6264 0.4120 -0.0291 0.0552 -0.0029 24 VAL B O 1813 C CB . VAL B 24 ? 0.3610 0.5154 0.3900 -0.0117 0.0517 -0.0146 24 VAL B CB 1814 C CG1 . VAL B 24 ? 0.3355 0.4493 0.3614 -0.0160 0.0480 -0.0169 24 VAL B CG1 1815 C CG2 . VAL B 24 ? 0.1771 0.3509 0.2017 -0.0237 0.0530 -0.0097 24 VAL B CG2 1816 N N . SER B 25 ? 0.3076 0.5439 0.3462 0.0110 0.0584 -0.0114 25 SER B N 1817 C CA . SER B 25 ? 0.3336 0.6185 0.3730 0.0218 0.0629 -0.0078 25 SER B CA 1818 C C . SER B 25 ? 0.3201 0.5933 0.3488 0.0482 0.0660 -0.0125 25 SER B C 1819 O O . SER B 25 ? 0.2558 0.4845 0.2769 0.0554 0.0641 -0.0182 25 SER B O 1820 C CB . SER B 25 ? 0.1658 0.4821 0.2121 0.0239 0.0624 -0.0046 25 SER B CB 1821 O OG . SER B 25 ? 0.2194 0.5152 0.2639 0.0433 0.0626 -0.0094 25 SER B OG 1822 N N . GLY B 26 ? 0.2256 0.5285 0.2497 0.0599 0.0672 -0.0091 26 GLY B N 1823 C CA . GLY B 26 ? 0.2480 0.5340 0.2564 0.0836 0.0685 -0.0126 26 GLY B CA 1824 C C . GLY B 26 ? 0.3133 0.5873 0.3147 0.0813 0.0711 -0.0148 26 GLY B C 1825 O O . GLY B 26 ? 0.2924 0.5485 0.2778 0.0995 0.0719 -0.0181 26 GLY B O 1826 N N . PHE B 27 ? 0.1979 0.4763 0.2079 0.0583 0.0713 -0.0128 27 PHE B N 1827 C CA . PHE B 27 ? 0.2028 0.4650 0.2063 0.0519 0.0711 -0.0135 27 PHE B CA 1828 C C . PHE B 27 ? 0.1946 0.4636 0.2066 0.0231 0.0683 -0.0080 27 PHE B C 1829 O O . PHE B 27 ? 0.2141 0.4891 0.2340 0.0084 0.0659 -0.0052 27 PHE B O 1830 C CB . PHE B 27 ? 0.2947 0.5019 0.2875 0.0577 0.0683 -0.0203 27 PHE B CB 1831 C CG . PHE B 27 ? 0.2847 0.4598 0.2847 0.0422 0.0631 -0.0213 27 PHE B CG 1832 C CD1 . PHE B 27 ? 0.3379 0.5028 0.3416 0.0464 0.0614 -0.0233 27 PHE B CD1 1833 C CD2 . PHE B 27 ? 0.2624 0.4180 0.2637 0.0255 0.0601 -0.0201 27 PHE B CD2 1834 C CE1 . PHE B 27 ? 0.3052 0.4435 0.3147 0.0338 0.0570 -0.0241 27 PHE B CE1 1835 C CE2 . PHE B 27 ? 0.3348 0.4632 0.3405 0.0149 0.0559 -0.0207 27 PHE B CE2 1836 C CZ . PHE B 27 ? 0.2737 0.3945 0.2839 0.0190 0.0544 -0.0228 27 PHE B CZ 1837 N N . SER B 28 ? 0.3359 0.6008 0.3428 0.0151 0.0685 -0.0066 28 SER B N 1838 C CA . SER B 28 ? 0.3313 0.5990 0.3397 -0.0113 0.0659 -0.0009 28 SER B CA 1839 C C . SER B 28 ? 0.3159 0.5329 0.3192 -0.0187 0.0618 -0.0038 28 SER B C 1840 O O . SER B 28 ? 0.3609 0.5551 0.3586 -0.0069 0.0621 -0.0082 28 SER B O 1841 C CB . SER B 28 ? 0.2051 0.5105 0.2102 -0.0160 0.0691 0.0043 28 SER B CB 1842 O OG . SER B 28 ? 0.2195 0.5180 0.2204 -0.0425 0.0660 0.0097 28 SER B OG 1843 N N . LEU B 29 ? 0.2644 0.4641 0.2670 -0.0379 0.0580 -0.0010 29 LEU B N 1844 C CA . LEU B 29 ? 0.2758 0.4317 0.2719 -0.0432 0.0544 -0.0025 29 LEU B CA 1845 C C . LEU B 29 ? 0.3949 0.5468 0.3826 -0.0478 0.0548 -0.0003 29 LEU B C 1846 O O . LEU B 29 ? 0.3071 0.4263 0.2889 -0.0480 0.0523 -0.0014 29 LEU B O 1847 C CB . LEU B 29 ? 0.2180 0.3549 0.2095 -0.0605 0.0506 0.0004 29 LEU B CB 1848 C CG . LEU B 29 ? 0.2354 0.3673 0.2343 -0.0563 0.0494 -0.0024 29 LEU B CG 1849 C CD1 . LEU B 29 ? 0.2223 0.3319 0.2116 -0.0736 0.0458 0.0004 29 LEU B CD1 1850 C CD2 . LEU B 29 ? 0.1952 0.3037 0.1989 -0.0386 0.0489 -0.0086 29 LEU B CD2 1851 N N . THR B 30 ? 0.4299 0.6170 0.4165 -0.0509 0.0579 0.0034 30 THR B N 1852 C CA . THR B 30 ? 0.4753 0.6621 0.4542 -0.0539 0.0587 0.0055 30 THR B CA 1853 C C . THR B 30 ? 0.4459 0.6291 0.4244 -0.0330 0.0613 -0.0002 30 THR B C 1854 O O . THR B 30 ? 0.3892 0.5661 0.3609 -0.0340 0.0615 0.0005 30 THR B O 1855 C CB . THR B 30 ? 0.4695 0.6989 0.4462 -0.0676 0.0609 0.0125 30 THR B CB 1856 O OG1 . THR B 30 ? 0.4627 0.7358 0.4477 -0.0527 0.0655 0.0117 30 THR B OG1 1857 C CG2 . THR B 30 ? 0.4523 0.6814 0.4236 -0.0925 0.0575 0.0185 30 THR B CG2 1858 N N . ASN B 31 ? 0.4779 0.6619 0.4604 -0.0150 0.0628 -0.0055 31 ASN B N 1859 C CA . ASN B 31 ? 0.4681 0.6411 0.4433 0.0040 0.0646 -0.0113 31 ASN B CA 1860 C C . ASN B 31 ? 0.4889 0.6221 0.4615 0.0104 0.0612 -0.0168 31 ASN B C 1861 O O . ASN B 31 ? 0.5031 0.6185 0.4651 0.0206 0.0612 -0.0212 31 ASN B O 1862 C CB . ASN B 31 ? 0.3594 0.5632 0.3328 0.0227 0.0695 -0.0128 31 ASN B CB 1863 C CG . ASN B 31 ? 0.3608 0.6127 0.3361 0.0188 0.0735 -0.0068 31 ASN B CG 1864 O OD1 . ASN B 31 ? 0.3784 0.6349 0.3505 0.0077 0.0734 -0.0035 31 ASN B OD1 1865 N ND2 . ASN B 31 ? 0.4113 0.7025 0.3912 0.0278 0.0769 -0.0048 31 ASN B ND2 1866 N N . TYR B 32 ? 0.4050 0.5245 0.3850 0.0036 0.0580 -0.0166 32 TYR B N 1867 C CA . TYR B 32 ? 0.2845 0.3725 0.2629 0.0082 0.0547 -0.0209 32 TYR B CA 1868 C C . TYR B 32 ? 0.3234 0.3948 0.3073 -0.0045 0.0508 -0.0182 32 TYR B C 1869 O O . TYR B 32 ? 0.4296 0.5099 0.4176 -0.0152 0.0507 -0.0142 32 TYR B O 1870 C CB . TYR B 32 ? 0.2844 0.3732 0.2639 0.0203 0.0555 -0.0246 32 TYR B CB 1871 C CG . TYR B 32 ? 0.3602 0.4524 0.3266 0.0382 0.0587 -0.0285 32 TYR B CG 1872 C CD1 . TYR B 32 ? 0.3705 0.4971 0.3371 0.0474 0.0636 -0.0267 32 TYR B CD1 1873 C CD2 . TYR B 32 ? 0.3401 0.4011 0.2907 0.0461 0.0569 -0.0335 32 TYR B CD2 1874 C CE1 . TYR B 32 ? 0.4189 0.5467 0.3693 0.0679 0.0670 -0.0303 32 TYR B CE1 1875 C CE2 . TYR B 32 ? 0.4078 0.4638 0.3393 0.0637 0.0597 -0.0374 32 TYR B CE2 1876 C CZ . TYR B 32 ? 0.4646 0.5529 0.3956 0.0766 0.0650 -0.0360 32 TYR B CZ 1877 O OH . TYR B 32 ? 0.5729 0.6543 0.4809 0.0981 0.0682 -0.0400 32 TYR B OH 1878 N N . GLY B 33 ? 0.3605 0.4079 0.3415 -0.0033 0.0475 -0.0200 33 GLY B N 1879 C CA . GLY B 33 ? 0.3246 0.3568 0.3090 -0.0100 0.0442 -0.0179 33 GLY B CA 1880 C C . GLY B 33 ? 0.3620 0.3886 0.3527 -0.0063 0.0428 -0.0204 33 GLY B C 1881 O O . GLY B 33 ? 0.3788 0.4043 0.3682 0.0017 0.0431 -0.0243 33 GLY B O 1882 N N . VAL B 34 ? 0.2814 0.3012 0.2755 -0.0118 0.0411 -0.0181 34 VAL B N 1883 C CA . VAL B 34 ? 0.3357 0.3510 0.3359 -0.0093 0.0397 -0.0199 34 VAL B CA 1884 C C . VAL B 34 ? 0.3604 0.3605 0.3596 -0.0084 0.0364 -0.0189 34 VAL B C 1885 O O . VAL B 34 ? 0.3923 0.3840 0.3861 -0.0112 0.0354 -0.0155 34 VAL B O 1886 C CB . VAL B 34 ? 0.3961 0.4183 0.3993 -0.0160 0.0405 -0.0180 34 VAL B CB 1887 C CG1 . VAL B 34 ? 0.1808 0.1941 0.1888 -0.0142 0.0386 -0.0194 34 VAL B CG1 1888 C CG2 . VAL B 34 ? 0.2688 0.3154 0.2756 -0.0149 0.0437 -0.0186 34 VAL B CG2 1889 N N . HIS B 35 ? 0.3293 0.3264 0.3313 -0.0039 0.0346 -0.0215 35 HIS B N 1890 C CA . HIS B 35 ? 0.2832 0.2743 0.2853 -0.0029 0.0314 -0.0199 35 HIS B CA 1891 C C . HIS B 35 ? 0.2775 0.2668 0.2854 -0.0016 0.0306 -0.0200 35 HIS B C 1892 O O . HIS B 35 ? 0.1911 0.1829 0.2033 -0.0018 0.0319 -0.0221 35 HIS B O 1893 C CB . HIS B 35 ? 0.2729 0.2633 0.2713 -0.0025 0.0291 -0.0216 35 HIS B CB 1894 C CG . HIS B 35 ? 0.2890 0.2787 0.2790 -0.0037 0.0296 -0.0220 35 HIS B CG 1895 N ND1 . HIS B 35 ? 0.2601 0.2510 0.2454 -0.0061 0.0273 -0.0192 35 HIS B ND1 1896 C CD2 . HIS B 35 ? 0.3310 0.3211 0.3158 -0.0018 0.0323 -0.0245 35 HIS B CD2 1897 C CE1 . HIS B 35 ? 0.3358 0.3249 0.3131 -0.0070 0.0284 -0.0205 35 HIS B CE1 1898 N NE2 . HIS B 35 ? 0.4054 0.3938 0.3819 -0.0037 0.0316 -0.0238 35 HIS B NE2 1899 N N . TRP B 36 ? 0.2149 0.2023 0.2223 0.0009 0.0284 -0.0173 36 TRP B N 1900 C CA . TRP B 36 ? 0.2029 0.1890 0.2141 0.0037 0.0276 -0.0172 36 TRP B CA 1901 C C . TRP B 36 ? 0.2724 0.2676 0.2863 0.0059 0.0247 -0.0158 36 TRP B C 1902 O O . TRP B 36 ? 0.2757 0.2769 0.2860 0.0083 0.0233 -0.0122 36 TRP B O 1903 C CB . TRP B 36 ? 0.1826 0.1572 0.1859 0.0063 0.0283 -0.0145 36 TRP B CB 1904 C CG . TRP B 36 ? 0.3249 0.2916 0.3236 -0.0004 0.0303 -0.0152 36 TRP B CG 1905 C CD1 . TRP B 36 ? 0.1976 0.1614 0.1893 -0.0057 0.0315 -0.0137 36 TRP B CD1 1906 C CD2 . TRP B 36 ? 0.3522 0.3164 0.3523 -0.0046 0.0310 -0.0168 36 TRP B CD2 1907 N NE1 . TRP B 36 ? 0.2029 0.1647 0.1914 -0.0141 0.0328 -0.0138 36 TRP B NE1 1908 C CE2 . TRP B 36 ? 0.3709 0.3332 0.3644 -0.0137 0.0324 -0.0158 36 TRP B CE2 1909 C CE3 . TRP B 36 ? 0.1822 0.1478 0.1882 -0.0025 0.0304 -0.0187 36 TRP B CE3 1910 C CZ2 . TRP B 36 ? 0.3789 0.3424 0.3712 -0.0219 0.0330 -0.0162 36 TRP B CZ2 1911 C CZ3 . TRP B 36 ? 0.3643 0.3284 0.3694 -0.0091 0.0312 -0.0196 36 TRP B CZ3 1912 C CH2 . TRP B 36 ? 0.3380 0.3021 0.3362 -0.0193 0.0323 -0.0182 36 TRP B CH2 1913 N N . VAL B 37 ? 0.2556 0.2538 0.2746 0.0044 0.0236 -0.0180 37 VAL B N 1914 C CA . VAL B 37 ? 0.1828 0.1919 0.2034 0.0032 0.0203 -0.0162 37 VAL B CA 1915 C C . VAL B 37 ? 0.3014 0.3131 0.3276 0.0068 0.0203 -0.0161 37 VAL B C 1916 O O . VAL B 37 ? 0.3524 0.3557 0.3813 0.0073 0.0221 -0.0191 37 VAL B O 1917 C CB . VAL B 37 ? 0.2085 0.2146 0.2244 -0.0044 0.0181 -0.0186 37 VAL B CB 1918 C CG1 . VAL B 37 ? 0.2861 0.3044 0.3004 -0.0102 0.0138 -0.0155 37 VAL B CG1 1919 C CG2 . VAL B 37 ? 0.1702 0.1702 0.1779 -0.0069 0.0186 -0.0195 37 VAL B CG2 1920 N N . ARG B 38 ? 0.2188 0.2454 0.2464 0.0095 0.0182 -0.0124 38 ARG B N 1921 C CA . ARG B 38 ? 0.1477 0.1797 0.1800 0.0133 0.0180 -0.0121 38 ARG B CA 1922 C C . ARG B 38 ? 0.1878 0.2374 0.2226 0.0063 0.0143 -0.0099 38 ARG B C 1923 O O . ARG B 38 ? 0.2121 0.2721 0.2431 -0.0008 0.0116 -0.0073 38 ARG B O 1924 C CB . ARG B 38 ? 0.2061 0.2406 0.2347 0.0257 0.0195 -0.0089 38 ARG B CB 1925 C CG . ARG B 38 ? 0.1558 0.2146 0.1829 0.0316 0.0177 -0.0029 38 ARG B CG 1926 C CD . ARG B 38 ? 0.2434 0.3011 0.2628 0.0486 0.0197 -0.0002 38 ARG B CD 1927 N NE . ARG B 38 ? 0.3042 0.3912 0.3219 0.0582 0.0185 0.0065 38 ARG B NE 1928 C CZ . ARG B 38 ? 0.3024 0.3930 0.3103 0.0772 0.0203 0.0099 38 ARG B CZ 1929 N NH1 . ARG B 38 ? 0.2821 0.3425 0.2784 0.0863 0.0228 0.0067 38 ARG B NH1 1930 N NH2 . ARG B 38 ? 0.2111 0.3352 0.2181 0.0874 0.0194 0.0169 38 ARG B NH2 1931 N N . GLN B 39 ? 0.1892 0.2419 0.2284 0.0066 0.0139 -0.0107 39 GLN B N 1932 C CA . GLN B 39 ? 0.2030 0.2707 0.2427 -0.0025 0.0101 -0.0084 39 GLN B CA 1933 C C . GLN B 39 ? 0.1550 0.2398 0.2007 0.0048 0.0105 -0.0058 39 GLN B C 1934 O O . GLN B 39 ? 0.1296 0.2030 0.1786 0.0088 0.0123 -0.0091 39 GLN B O 1935 C CB . GLN B 39 ? 0.1417 0.1901 0.1771 -0.0117 0.0089 -0.0127 39 GLN B CB 1936 C CG . GLN B 39 ? 0.3092 0.3641 0.3367 -0.0256 0.0039 -0.0102 39 GLN B CG 1937 C CD . GLN B 39 ? 0.3722 0.3988 0.3874 -0.0323 0.0026 -0.0146 39 GLN B CD 1938 O OE1 . GLN B 39 ? 0.3403 0.3500 0.3575 -0.0245 0.0059 -0.0192 39 GLN B OE1 1939 N NE2 . GLN B 39 ? 0.3482 0.3695 0.3475 -0.0469 -0.0023 -0.0127 39 GLN B NE2 1940 N N . SER B 40 ? 0.2113 0.3258 0.2578 0.0071 0.0088 0.0003 40 SER B N 1941 C CA . SER B 40 ? 0.2099 0.3462 0.2604 0.0171 0.0095 0.0037 40 SER B CA 1942 C C . SER B 40 ? 0.2489 0.4150 0.3017 0.0046 0.0052 0.0086 40 SER B C 1943 O O . SER B 40 ? 0.2501 0.4218 0.2983 -0.0119 0.0012 0.0107 40 SER B O 1944 C CB . SER B 40 ? 0.1358 0.2875 0.1829 0.0346 0.0117 0.0081 40 SER B CB 1945 O OG . SER B 40 ? 0.1367 0.3194 0.1835 0.0296 0.0089 0.0146 40 SER B OG 1946 N N . PRO B 41 ? 0.2819 0.4666 0.3392 0.0106 0.0056 0.0107 41 PRO B N 1947 C CA . PRO B 41 ? 0.1959 0.4145 0.2547 -0.0031 0.0012 0.0167 41 PRO B CA 1948 C C . PRO B 41 ? 0.1873 0.4470 0.2448 -0.0067 -0.0014 0.0251 41 PRO B C 1949 O O . PRO B 41 ? 0.1790 0.4548 0.2320 -0.0282 -0.0067 0.0293 41 PRO B O 1950 C CB . PRO B 41 ? 0.1903 0.4229 0.2545 0.0092 0.0034 0.0174 41 PRO B CB 1951 C CG . PRO B 41 ? 0.2238 0.4163 0.2874 0.0213 0.0078 0.0095 41 PRO B CG 1952 C CD . PRO B 41 ? 0.2221 0.3944 0.2810 0.0269 0.0097 0.0074 41 PRO B CD 1953 N N . GLY B 42 ? 0.2186 0.4943 0.2770 0.0134 0.0018 0.0281 42 GLY B N 1954 C CA . GLY B 42 ? 0.2895 0.6115 0.3476 0.0137 -0.0003 0.0371 42 GLY B CA 1955 C C . GLY B 42 ? 0.3051 0.6209 0.3578 -0.0015 -0.0034 0.0378 42 GLY B C 1956 O O . GLY B 42 ? 0.3637 0.7120 0.4140 -0.0200 -0.0084 0.0445 42 GLY B O 1957 N N . LYS B 43 ? 0.3181 0.5931 0.3674 0.0048 -0.0006 0.0314 43 LYS B N 1958 C CA . LYS B 43 ? 0.3130 0.5813 0.3564 -0.0052 -0.0026 0.0318 43 LYS B CA 1959 C C . LYS B 43 ? 0.2408 0.4677 0.2773 -0.0240 -0.0046 0.0248 43 LYS B C 1960 O O . LYS B 43 ? 0.2412 0.4606 0.2703 -0.0344 -0.0067 0.0247 43 LYS B O 1961 C CB . LYS B 43 ? 0.3824 0.6379 0.4240 0.0162 0.0019 0.0307 43 LYS B CB 1962 C CG . LYS B 43 ? 0.4354 0.7245 0.4777 0.0403 0.0045 0.0373 43 LYS B CG 1963 C CD . LYS B 43 ? 0.4625 0.7932 0.5031 0.0420 0.0025 0.0461 43 LYS B CD 1964 C CE . LYS B 43 ? 0.5210 0.8237 0.5549 0.0463 0.0040 0.0436 43 LYS B CE 1965 N NZ . LYS B 43 ? 0.5731 0.9141 0.6036 0.0594 0.0039 0.0524 43 LYS B NZ 1966 N N . GLY B 44 ? 0.1438 0.3442 0.1810 -0.0272 -0.0039 0.0191 44 GLY B N 1967 C CA . GLY B 44 ? 0.1521 0.3141 0.1796 -0.0413 -0.0056 0.0129 44 GLY B CA 1968 C C . GLY B 44 ? 0.1784 0.3092 0.2047 -0.0321 -0.0017 0.0069 44 GLY B C 1969 O O . GLY B 44 ? 0.2162 0.3410 0.2495 -0.0153 0.0029 0.0051 44 GLY B O 1970 N N . LEU B 45 ? 0.2254 0.3346 0.2397 -0.0439 -0.0037 0.0042 45 LEU B N 1971 C CA . LEU B 45 ? 0.2768 0.3604 0.2890 -0.0366 -0.0002 -0.0009 45 LEU B CA 1972 C C . LEU B 45 ? 0.3426 0.4436 0.3573 -0.0302 0.0008 0.0031 45 LEU B C 1973 O O . LEU B 45 ? 0.4111 0.5365 0.4218 -0.0387 -0.0029 0.0088 45 LEU B O 1974 C CB . LEU B 45 ? 0.1820 0.2365 0.1773 -0.0486 -0.0024 -0.0051 45 LEU B CB 1975 C CG . LEU B 45 ? 0.1867 0.2152 0.1771 -0.0486 -0.0018 -0.0103 45 LEU B CG 1976 C CD1 . LEU B 45 ? 0.2578 0.2561 0.2238 -0.0597 -0.0050 -0.0134 45 LEU B CD1 1977 C CD2 . LEU B 45 ? 0.2818 0.2992 0.2836 -0.0330 0.0040 -0.0150 45 LEU B CD2 1978 N N . GLU B 46 ? 0.3016 0.3902 0.3210 -0.0163 0.0054 0.0006 46 GLU B N 1979 C CA . GLU B 46 ? 0.2031 0.3048 0.2234 -0.0062 0.0069 0.0047 46 GLU B CA 1980 C C . GLU B 46 ? 0.2376 0.3125 0.2552 -0.0010 0.0105 0.0002 46 GLU B C 1981 O O . GLU B 46 ? 0.2005 0.2581 0.2207 0.0058 0.0138 -0.0034 46 GLU B O 1982 C CB . GLU B 46 ? 0.2488 0.3688 0.2747 0.0090 0.0086 0.0087 46 GLU B CB 1983 C CG . GLU B 46 ? 0.3381 0.4827 0.3616 0.0202 0.0087 0.0155 46 GLU B CG 1984 C CD . GLU B 46 ? 0.5195 0.6819 0.5443 0.0381 0.0104 0.0195 46 GLU B CD 1985 O OE1 . GLU B 46 ? 0.5293 0.6802 0.5570 0.0411 0.0119 0.0161 46 GLU B OE1 1986 O OE2 . GLU B 46 ? 0.6175 0.8060 0.6392 0.0506 0.0105 0.0262 46 GLU B OE2 1987 N N . TRP B 47 ? 0.1681 0.2413 0.1796 -0.0056 0.0098 0.0008 47 TRP B N 1988 C CA . TRP B 47 ? 0.2358 0.2882 0.2443 -0.0018 0.0131 -0.0025 47 TRP B CA 1989 C C . TRP B 47 ? 0.2226 0.2763 0.2303 0.0115 0.0156 0.0011 47 TRP B C 1990 O O . TRP B 47 ? 0.2777 0.3511 0.2836 0.0171 0.0142 0.0068 47 TRP B O 1991 C CB . TRP B 47 ? 0.3278 0.3770 0.3281 -0.0109 0.0115 -0.0031 47 TRP B CB 1992 C CG . TRP B 47 ? 0.3512 0.3833 0.3483 -0.0076 0.0150 -0.0059 47 TRP B CG 1993 C CD1 . TRP B 47 ? 0.2608 0.2750 0.2562 -0.0089 0.0175 -0.0114 47 TRP B CD1 1994 C CD2 . TRP B 47 ? 0.3244 0.3587 0.3186 -0.0026 0.0163 -0.0027 47 TRP B CD2 1995 N NE1 . TRP B 47 ? 0.1868 0.1950 0.1795 -0.0064 0.0202 -0.0116 47 TRP B NE1 1996 C CE2 . TRP B 47 ? 0.2991 0.3167 0.2903 -0.0032 0.0193 -0.0064 47 TRP B CE2 1997 C CE3 . TRP B 47 ? 0.3451 0.3957 0.3378 0.0034 0.0151 0.0036 47 TRP B CE3 1998 C CZ2 . TRP B 47 ? 0.3372 0.3515 0.3237 -0.0005 0.0210 -0.0043 47 TRP B CZ2 1999 C CZ3 . TRP B 47 ? 0.3589 0.4032 0.3458 0.0081 0.0168 0.0055 47 TRP B CZ3 2000 C CH2 . TRP B 47 ? 0.3160 0.3410 0.2996 0.0049 0.0196 0.0016 47 TRP B CH2 2001 N N . LEU B 48 ? 0.2553 0.2878 0.2614 0.0163 0.0189 -0.0020 48 LEU B N 2002 C CA . LEU B 48 ? 0.1874 0.2107 0.1857 0.0281 0.0208 0.0009 48 LEU B CA 2003 C C . LEU B 48 ? 0.3518 0.3611 0.3414 0.0272 0.0223 0.0014 48 LEU B C 2004 O O . LEU B 48 ? 0.2084 0.2191 0.1891 0.0357 0.0222 0.0061 48 LEU B O 2005 C CB . LEU B 48 ? 0.2466 0.2530 0.2438 0.0315 0.0227 -0.0020 48 LEU B CB 2006 C CG . LEU B 48 ? 0.3119 0.3306 0.3172 0.0332 0.0216 -0.0025 48 LEU B CG 2007 C CD1 . LEU B 48 ? 0.3024 0.3019 0.3047 0.0355 0.0235 -0.0056 48 LEU B CD1 2008 C CD2 . LEU B 48 ? 0.2615 0.3028 0.2652 0.0441 0.0202 0.0032 48 LEU B CD2 2009 N N . GLY B 49 ? 0.3063 0.3039 0.2972 0.0182 0.0238 -0.0028 49 GLY B N 2010 C CA . GLY B 49 ? 0.2398 0.2265 0.2222 0.0161 0.0252 -0.0019 49 GLY B CA 2011 C C . GLY B 49 ? 0.2616 0.2442 0.2476 0.0067 0.0271 -0.0063 49 GLY B C 2012 O O . GLY B 49 ? 0.2852 0.2723 0.2791 0.0034 0.0271 -0.0102 49 GLY B O 2013 N N . VAL B 50 ? 0.3468 0.3219 0.3252 0.0035 0.0286 -0.0051 50 VAL B N 2014 C CA . VAL B 50 ? 0.3057 0.2834 0.2864 -0.0037 0.0307 -0.0081 50 VAL B CA 2015 C C . VAL B 50 ? 0.3022 0.2700 0.2720 -0.0084 0.0322 -0.0052 50 VAL B C 2016 O O . VAL B 50 ? 0.3463 0.3051 0.3055 -0.0057 0.0313 -0.0012 50 VAL B O 2017 C CB . VAL B 50 ? 0.2423 0.2299 0.2249 -0.0048 0.0302 -0.0100 50 VAL B CB 2018 C CG1 . VAL B 50 ? 0.2167 0.2063 0.1932 -0.0031 0.0284 -0.0060 50 VAL B CG1 2019 C CG2 . VAL B 50 ? 0.2032 0.1944 0.1848 -0.0085 0.0331 -0.0126 50 VAL B CG2 2020 N N . ILE B 51 ? 0.3133 0.2840 0.2841 -0.0157 0.0342 -0.0066 51 ILE B N 2021 C CA . ILE B 51 ? 0.2925 0.2598 0.2530 -0.0245 0.0355 -0.0036 51 ILE B CA 2022 C C . ILE B 51 ? 0.2836 0.2713 0.2508 -0.0267 0.0379 -0.0055 51 ILE B C 2023 O O . ILE B 51 ? 0.3139 0.3156 0.2906 -0.0245 0.0394 -0.0092 51 ILE B O 2024 C CB . ILE B 51 ? 0.3467 0.3047 0.2995 -0.0337 0.0356 -0.0021 51 ILE B CB 2025 C CG1 . ILE B 51 ? 0.4353 0.3886 0.3732 -0.0464 0.0360 0.0022 51 ILE B CG1 2026 C CG2 . ILE B 51 ? 0.2295 0.2056 0.1959 -0.0356 0.0370 -0.0056 51 ILE B CG2 2027 C CD1 . ILE B 51 ? 0.4719 0.4050 0.3921 -0.0582 0.0345 0.0050 51 ILE B CD1 2028 N N . TRP B 52 ? 0.3270 0.3154 0.2871 -0.0291 0.0383 -0.0031 52 TRP B N 2029 C CA . TRP B 52 ? 0.2627 0.2691 0.2263 -0.0285 0.0407 -0.0051 52 TRP B CA 2030 C C . TRP B 52 ? 0.3678 0.3909 0.3302 -0.0374 0.0434 -0.0032 52 TRP B C 2031 O O . TRP B 52 ? 0.4280 0.4470 0.3856 -0.0472 0.0428 -0.0001 52 TRP B O 2032 C CB . TRP B 52 ? 0.3050 0.3073 0.2619 -0.0268 0.0398 -0.0033 52 TRP B CB 2033 C CG . TRP B 52 ? 0.2786 0.2737 0.2372 -0.0196 0.0370 -0.0044 52 TRP B CG 2034 C CD1 . TRP B 52 ? 0.2381 0.2224 0.1915 -0.0168 0.0344 -0.0006 52 TRP B CD1 2035 C CD2 . TRP B 52 ? 0.3659 0.3654 0.3291 -0.0148 0.0362 -0.0089 52 TRP B CD2 2036 N NE1 . TRP B 52 ? 0.2644 0.2531 0.2220 -0.0118 0.0321 -0.0019 52 TRP B NE1 2037 C CE2 . TRP B 52 ? 0.3369 0.3324 0.2993 -0.0124 0.0328 -0.0070 52 TRP B CE2 2038 C CE3 . TRP B 52 ? 0.3541 0.3595 0.3186 -0.0120 0.0379 -0.0140 52 TRP B CE3 2039 C CZ2 . TRP B 52 ? 0.4345 0.4320 0.3975 -0.0115 0.0304 -0.0097 52 TRP B CZ2 2040 C CZ3 . TRP B 52 ? 0.4183 0.4181 0.3799 -0.0092 0.0356 -0.0173 52 TRP B CZ3 2041 C CH2 . TRP B 52 ? 0.5442 0.5404 0.5051 -0.0111 0.0316 -0.0150 52 TRP B CH2 2042 N N . SER B 53 ? 0.4525 0.4955 0.4170 -0.0345 0.0463 -0.0047 53 SER B N 2043 C CA . SER B 53 ? 0.3885 0.4570 0.3529 -0.0420 0.0492 -0.0021 53 SER B CA 2044 C C . SER B 53 ? 0.4084 0.4709 0.3611 -0.0577 0.0480 0.0044 53 SER B C 2045 O O . SER B 53 ? 0.4154 0.4865 0.3644 -0.0710 0.0479 0.0083 53 SER B O 2046 C CB . SER B 53 ? 0.3199 0.4098 0.2853 -0.0325 0.0527 -0.0046 53 SER B CB 2047 O OG . SER B 53 ? 0.4203 0.5102 0.3900 -0.0182 0.0537 -0.0105 53 SER B OG 2048 N N . GLY B 54 ? 0.3942 0.4404 0.3383 -0.0575 0.0466 0.0062 54 GLY B N 2049 C CA . GLY B 54 ? 0.3463 0.3812 0.2746 -0.0711 0.0452 0.0125 54 GLY B CA 2050 C C . GLY B 54 ? 0.4177 0.4204 0.3319 -0.0783 0.0417 0.0157 54 GLY B C 2051 O O . GLY B 54 ? 0.3412 0.3274 0.2361 -0.0905 0.0401 0.0212 54 GLY B O 2052 N N . GLY B 55 ? 0.5009 0.4914 0.4207 -0.0708 0.0405 0.0124 55 GLY B N 2053 C CA . GLY B 55 ? 0.3555 0.3133 0.2591 -0.0747 0.0375 0.0148 55 GLY B CA 2054 C C . GLY B 55 ? 0.4204 0.3525 0.3176 -0.0605 0.0354 0.0147 55 GLY B C 2055 O O . GLY B 55 ? 0.5276 0.4309 0.4091 -0.0591 0.0333 0.0163 55 GLY B O 2056 N N . ASN B 56 ? 0.4761 0.4187 0.3829 -0.0498 0.0359 0.0133 56 ASN B N 2057 C CA . ASN B 56 ? 0.4958 0.4238 0.3988 -0.0362 0.0339 0.0141 56 ASN B CA 2058 C C . ASN B 56 ? 0.4532 0.3847 0.3691 -0.0268 0.0333 0.0102 56 ASN B C 2059 O O . ASN B 56 ? 0.3923 0.3394 0.3230 -0.0290 0.0345 0.0060 56 ASN B O 2060 C CB . ASN B 56 ? 0.5404 0.4828 0.4495 -0.0306 0.0341 0.0142 56 ASN B CB 2061 C CG . ASN B 56 ? 0.6307 0.5667 0.5248 -0.0377 0.0343 0.0189 56 ASN B CG 2062 O OD1 . ASN B 56 ? 0.6416 0.5531 0.5147 -0.0433 0.0331 0.0235 56 ASN B OD1 2063 N ND2 . ASN B 56 ? 0.6519 0.6067 0.5532 -0.0381 0.0355 0.0179 56 ASN B ND2 2064 N N . THR B 57 ? 0.4674 0.3856 0.3764 -0.0151 0.0314 0.0122 57 THR B N 2065 C CA . THR B 57 ? 0.2790 0.2027 0.1990 -0.0060 0.0306 0.0095 57 THR B CA 2066 C C . THR B 57 ? 0.3466 0.2805 0.2696 0.0065 0.0289 0.0117 57 THR B C 2067 O O . THR B 57 ? 0.4623 0.3882 0.3718 0.0123 0.0281 0.0164 57 THR B O 2068 C CB . THR B 57 ? 0.2964 0.1955 0.2023 -0.0039 0.0299 0.0104 57 THR B CB 2069 O OG1 . THR B 57 ? 0.4258 0.2960 0.3045 0.0003 0.0289 0.0155 57 THR B OG1 2070 C CG2 . THR B 57 ? 0.3330 0.2303 0.2400 -0.0183 0.0310 0.0080 57 THR B CG2 2071 N N . ASP B 58 ? 0.3925 0.3453 0.3318 0.0096 0.0282 0.0088 58 ASP B N 2072 C CA . ASP B 58 ? 0.3985 0.3669 0.3413 0.0193 0.0260 0.0115 58 ASP B CA 2073 C C . ASP B 58 ? 0.3678 0.3396 0.3162 0.0259 0.0254 0.0106 58 ASP B C 2074 O O . ASP B 58 ? 0.4492 0.4223 0.4077 0.0198 0.0259 0.0060 58 ASP B O 2075 C CB . ASP B 58 ? 0.3949 0.3851 0.3488 0.0130 0.0249 0.0097 58 ASP B CB 2076 C CG . ASP B 58 ? 0.4748 0.4634 0.4227 0.0076 0.0256 0.0105 58 ASP B CG 2077 O OD1 . ASP B 58 ? 0.5798 0.5614 0.5161 0.0126 0.0255 0.0155 58 ASP B OD1 2078 O OD2 . ASP B 58 ? 0.4701 0.4633 0.4231 -0.0005 0.0265 0.0062 58 ASP B OD2 2079 N N . TYR B 59 ? 0.2548 0.2292 0.1957 0.0397 0.0243 0.0153 59 TYR B N 2080 C CA . TYR B 59 ? 0.3803 0.3615 0.3253 0.0480 0.0238 0.0152 59 TYR B CA 2081 C C . TYR B 59 ? 0.2400 0.2561 0.1945 0.0531 0.0215 0.0190 59 TYR B C 2082 O O . TYR B 59 ? 0.3619 0.3909 0.3111 0.0592 0.0205 0.0243 59 TYR B O 2083 C CB . TYR B 59 ? 0.4129 0.3679 0.3368 0.0622 0.0249 0.0179 59 TYR B CB 2084 C CG . TYR B 59 ? 0.3484 0.2672 0.2572 0.0538 0.0263 0.0155 59 TYR B CG 2085 C CD1 . TYR B 59 ? 0.2796 0.1974 0.2002 0.0379 0.0270 0.0102 59 TYR B CD1 2086 C CD2 . TYR B 59 ? 0.4397 0.3258 0.3197 0.0612 0.0265 0.0191 59 TYR B CD2 2087 C CE1 . TYR B 59 ? 0.2958 0.1873 0.2026 0.0276 0.0279 0.0091 59 TYR B CE1 2088 C CE2 . TYR B 59 ? 0.4132 0.2660 0.2758 0.0492 0.0270 0.0177 59 TYR B CE2 2089 C CZ . TYR B 59 ? 0.3740 0.2328 0.2514 0.0314 0.0276 0.0130 59 TYR B CZ 2090 O OH . TYR B 59 ? 0.5222 0.3547 0.3826 0.0171 0.0277 0.0127 59 TYR B OH 2091 N N . ASN B 60 ? 0.2610 0.2940 0.2286 0.0493 0.0203 0.0169 60 ASN B N 2092 C CA . ASN B 60 ? 0.2531 0.3225 0.2281 0.0517 0.0176 0.0215 60 ASN B CA 2093 C C . ASN B 60 ? 0.2874 0.3675 0.2519 0.0729 0.0181 0.0285 60 ASN B C 2094 O O . ASN B 60 ? 0.2941 0.3498 0.2459 0.0863 0.0204 0.0283 60 ASN B O 2095 C CB . ASN B 60 ? 0.2695 0.3507 0.2566 0.0440 0.0163 0.0186 60 ASN B CB 2096 C CG . ASN B 60 ? 0.3160 0.4340 0.3102 0.0355 0.0123 0.0225 60 ASN B CG 2097 O OD1 . ASN B 60 ? 0.3649 0.5067 0.3562 0.0388 0.0107 0.0287 60 ASN B OD1 2098 N ND2 . ASN B 60 ? 0.1843 0.3073 0.1857 0.0233 0.0104 0.0195 60 ASN B ND2 2099 N N . THR B 61 ? 0.2870 0.4038 0.2542 0.0762 0.0158 0.0351 61 THR B N 2100 C CA . THR B 61 ? 0.3611 0.4922 0.3161 0.0993 0.0165 0.0430 61 THR B CA 2101 C C . THR B 61 ? 0.3974 0.5234 0.3442 0.1195 0.0186 0.0441 61 THR B C 2102 O O . THR B 61 ? 0.3625 0.4610 0.2877 0.1390 0.0209 0.0459 61 THR B O 2103 C CB . THR B 61 ? 0.3499 0.5334 0.3130 0.0968 0.0131 0.0505 61 THR B CB 2104 O OG1 . THR B 61 ? 0.4126 0.5946 0.3779 0.0799 0.0113 0.0493 61 THR B OG1 2105 C CG2 . THR B 61 ? 0.3430 0.5484 0.2936 0.1242 0.0141 0.0596 61 THR B CG2 2106 N N . PRO B 62 ? 0.3957 0.5429 0.3548 0.1165 0.0178 0.0432 62 PRO B N 2107 C CA . PRO B 62 ? 0.4047 0.5484 0.3539 0.1383 0.0201 0.0446 62 PRO B CA 2108 C C . PRO B 62 ? 0.3982 0.4862 0.3325 0.1412 0.0228 0.0378 62 PRO B C 2109 O O . PRO B 62 ? 0.4984 0.5753 0.4197 0.1590 0.0246 0.0381 62 PRO B O 2110 C CB . PRO B 62 ? 0.3253 0.5082 0.2938 0.1287 0.0180 0.0451 62 PRO B CB 2111 C CG . PRO B 62 ? 0.3242 0.5045 0.3078 0.0995 0.0154 0.0401 62 PRO B CG 2112 C CD . PRO B 62 ? 0.3249 0.4984 0.3039 0.0938 0.0147 0.0412 62 PRO B CD 2113 N N . PHE B 63 ? 0.3636 0.4177 0.2974 0.1241 0.0229 0.0321 63 PHE B N 2114 C CA . PHE B 63 ? 0.3704 0.3764 0.2903 0.1219 0.0248 0.0264 63 PHE B CA 2115 C C . PHE B 63 ? 0.4081 0.3747 0.3054 0.1224 0.0257 0.0267 63 PHE B C 2116 O O . PHE B 63 ? 0.4133 0.3394 0.2956 0.1170 0.0267 0.0227 63 PHE B O 2117 C CB . PHE B 63 ? 0.3451 0.3486 0.2845 0.0990 0.0243 0.0194 63 PHE B CB 2118 C CG . PHE B 63 ? 0.3672 0.4046 0.3265 0.0950 0.0229 0.0190 63 PHE B CG 2119 C CD1 . PHE B 63 ? 0.3826 0.4162 0.3400 0.1029 0.0238 0.0175 63 PHE B CD1 2120 C CD2 . PHE B 63 ? 0.3722 0.4430 0.3489 0.0822 0.0203 0.0203 63 PHE B CD2 2121 C CE1 . PHE B 63 ? 0.4249 0.4901 0.3997 0.0980 0.0224 0.0176 63 PHE B CE1 2122 C CE2 . PHE B 63 ? 0.3488 0.4478 0.3396 0.0758 0.0184 0.0205 63 PHE B CE2 2123 C CZ . PHE B 63 ? 0.3083 0.4059 0.2993 0.0838 0.0195 0.0194 63 PHE B CZ 2124 N N . THR B 64 ? 0.3919 0.3696 0.2847 0.1274 0.0251 0.0317 64 THR B N 2125 C CA . THR B 64 ? 0.5246 0.4650 0.3953 0.1259 0.0256 0.0324 64 THR B CA 2126 C C . THR B 64 ? 0.5323 0.4256 0.3659 0.1431 0.0269 0.0336 64 THR B C 2127 O O . THR B 64 ? 0.5190 0.3700 0.3301 0.1358 0.0270 0.0328 64 THR B O 2128 C CB . THR B 64 ? 0.5499 0.5136 0.4214 0.1311 0.0246 0.0384 64 THR B CB 2129 O OG1 . THR B 64 ? 0.6117 0.6029 0.4775 0.1556 0.0246 0.0452 64 THR B OG1 2130 C CG2 . THR B 64 ? 0.5658 0.5644 0.4667 0.1102 0.0229 0.0363 64 THR B CG2 2131 N N . SER B 65 ? 0.5684 0.4663 0.3920 0.1652 0.0277 0.0358 65 SER B N 2132 C CA . SER B 65 ? 0.6525 0.5010 0.4337 0.1854 0.0289 0.0371 65 SER B CA 2133 C C . SER B 65 ? 0.6414 0.4506 0.4108 0.1750 0.0292 0.0307 65 SER B C 2134 O O . SER B 65 ? 0.5844 0.3380 0.3126 0.1820 0.0293 0.0306 65 SER B O 2135 C CB . SER B 65 ? 0.6052 0.4776 0.3762 0.2189 0.0302 0.0430 65 SER B CB 2136 O OG . SER B 65 ? 0.8036 0.7171 0.6019 0.2185 0.0304 0.0414 65 SER B OG 2137 N N . ARG B 66 ? 0.5423 0.3766 0.3434 0.1580 0.0290 0.0257 66 ARG B N 2138 C CA . ARG B 66 ? 0.5684 0.3716 0.3603 0.1487 0.0292 0.0201 66 ARG B CA 2139 C C . ARG B 66 ? 0.5137 0.3241 0.3314 0.1180 0.0284 0.0148 66 ARG B C 2140 O O . ARG B 66 ? 0.5604 0.3570 0.3780 0.1082 0.0283 0.0103 66 ARG B O 2141 C CB . ARG B 66 ? 0.6125 0.4362 0.4109 0.1650 0.0302 0.0196 66 ARG B CB 2142 C CG . ARG B 66 ? 0.5292 0.4150 0.3709 0.1594 0.0297 0.0198 66 ARG B CG 2143 C CD . ARG B 66 ? 0.5281 0.4368 0.3703 0.1802 0.0308 0.0216 66 ARG B CD 2144 N NE . ARG B 66 ? 0.4373 0.4027 0.3169 0.1716 0.0297 0.0223 66 ARG B NE 2145 C CZ . ARG B 66 ? 0.4260 0.4023 0.3223 0.1622 0.0295 0.0183 66 ARG B CZ 2146 N NH1 . ARG B 66 ? 0.3560 0.2937 0.2371 0.1606 0.0304 0.0133 66 ARG B NH1 2147 N NH2 . ARG B 66 ? 0.4171 0.4415 0.3428 0.1532 0.0280 0.0197 66 ARG B NH2 2148 N N . LEU B 67 ? 0.4770 0.3089 0.3148 0.1039 0.0278 0.0152 67 LEU B N 2149 C CA . LEU B 67 ? 0.4250 0.2669 0.2856 0.0788 0.0276 0.0106 67 LEU B CA 2150 C C . LEU B 67 ? 0.4857 0.2983 0.3286 0.0638 0.0273 0.0110 67 LEU B C 2151 O O . LEU B 67 ? 0.6128 0.4112 0.4373 0.0698 0.0270 0.0152 67 LEU B O 2152 C CB . LEU B 67 ? 0.5261 0.4145 0.4209 0.0732 0.0272 0.0103 67 LEU B CB 2153 C CG . LEU B 67 ? 0.5196 0.4231 0.4388 0.0541 0.0272 0.0051 67 LEU B CG 2154 C CD1 . LEU B 67 ? 0.5037 0.3967 0.4223 0.0525 0.0276 0.0016 67 LEU B CD1 2155 C CD2 . LEU B 67 ? 0.4719 0.4139 0.4165 0.0520 0.0263 0.0049 67 LEU B CD2 2156 N N . SER B 68 ? 0.5204 0.3267 0.3684 0.0438 0.0272 0.0073 68 SER B N 2157 C CA . SER B 68 ? 0.4829 0.2685 0.3158 0.0257 0.0268 0.0083 68 SER B CA 2158 C C . SER B 68 ? 0.3540 0.1633 0.2114 0.0058 0.0273 0.0046 68 SER B C 2159 O O . SER B 68 ? 0.3502 0.1583 0.2110 0.0005 0.0272 0.0016 68 SER B O 2160 C CB . SER B 68 ? 0.6019 0.3346 0.3913 0.0242 0.0254 0.0100 68 SER B CB 2161 O OG . SER B 68 ? 0.7505 0.4662 0.5249 0.0018 0.0244 0.0115 68 SER B OG 2162 N N . ILE B 69 ? 0.3365 0.1680 0.2092 -0.0037 0.0281 0.0049 69 ILE B N 2163 C CA . ILE B 69 ? 0.3125 0.1699 0.2065 -0.0188 0.0292 0.0020 69 ILE B CA 2164 C C . ILE B 69 ? 0.4847 0.3333 0.3637 -0.0367 0.0291 0.0048 69 ILE B C 2165 O O . ILE B 69 ? 0.4441 0.2831 0.3105 -0.0368 0.0288 0.0082 69 ILE B O 2166 C CB . ILE B 69 ? 0.4061 0.2989 0.3287 -0.0137 0.0304 -0.0003 69 ILE B CB 2167 C CG1 . ILE B 69 ? 0.3205 0.2227 0.2544 0.0012 0.0297 -0.0017 69 ILE B CG1 2168 C CG2 . ILE B 69 ? 0.3808 0.2977 0.3213 -0.0243 0.0319 -0.0034 69 ILE B CG2 2169 C CD1 . ILE B 69 ? 0.2395 0.1702 0.1947 0.0035 0.0299 -0.0035 69 ILE B CD1 2170 N N . ASN B 70 ? 0.4907 0.3453 0.3705 -0.0527 0.0291 0.0040 70 ASN B N 2171 C CA . ASN B 70 ? 0.4924 0.3487 0.3605 -0.0732 0.0289 0.0074 70 ASN B CA 2172 C C . ASN B 70 ? 0.4601 0.3569 0.3523 -0.0826 0.0307 0.0055 70 ASN B C 2173 O O . ASN B 70 ? 0.5125 0.4272 0.4255 -0.0738 0.0317 0.0015 70 ASN B O 2174 C CB . ASN B 70 ? 0.5117 0.3254 0.3416 -0.0870 0.0259 0.0108 70 ASN B CB 2175 C CG . ASN B 70 ? 0.5596 0.3300 0.3585 -0.0769 0.0243 0.0137 70 ASN B CG 2176 O OD1 . ASN B 70 ? 0.6103 0.3601 0.4016 -0.0580 0.0240 0.0123 70 ASN B OD1 2177 N ND2 . ASN B 70 ? 0.7709 0.5287 0.5502 -0.0884 0.0234 0.0183 70 ASN B ND2 2178 N N . LYS B 71 ? 0.4017 0.3145 0.2894 -0.1002 0.0310 0.0091 71 LYS B N 2179 C CA . LYS B 71 ? 0.4003 0.3571 0.3092 -0.1069 0.0332 0.0084 71 LYS B CA 2180 C C . LYS B 71 ? 0.4350 0.4029 0.3286 -0.1323 0.0322 0.0142 71 LYS B C 2181 O O . LYS B 71 ? 0.3555 0.2951 0.2219 -0.1452 0.0298 0.0187 71 LYS B O 2182 C CB . LYS B 71 ? 0.4628 0.4520 0.3966 -0.0923 0.0365 0.0056 71 LYS B CB 2183 C CG . LYS B 71 ? 0.4021 0.3975 0.3302 -0.0960 0.0375 0.0087 71 LYS B CG 2184 C CD . LYS B 71 ? 0.3387 0.3652 0.2879 -0.0820 0.0409 0.0054 71 LYS B CD 2185 C CE . LYS B 71 ? 0.2631 0.2965 0.2065 -0.0850 0.0421 0.0083 71 LYS B CE 2186 N NZ . LYS B 71 ? 0.3115 0.3760 0.2708 -0.0726 0.0457 0.0051 71 LYS B NZ 2187 N N . ASP B 72 ? 0.4657 0.4766 0.3754 -0.1393 0.0338 0.0148 72 ASP B N 2188 C CA . ASP B 72 ? 0.4187 0.4570 0.3194 -0.1640 0.0333 0.0213 72 ASP B CA 2189 C C . ASP B 72 ? 0.3957 0.4929 0.3243 -0.1545 0.0378 0.0209 72 ASP B C 2190 O O . ASP B 72 ? 0.3918 0.5173 0.3384 -0.1465 0.0395 0.0186 72 ASP B O 2191 C CB . ASP B 72 ? 0.4285 0.4602 0.3149 -0.1839 0.0300 0.0235 72 ASP B CB 2192 C CG . ASP B 72 ? 0.5019 0.5615 0.3744 -0.2142 0.0280 0.0314 72 ASP B CG 2193 O OD1 . ASP B 72 ? 0.4840 0.5967 0.3754 -0.2115 0.0300 0.0333 72 ASP B OD1 2194 O OD2 . ASP B 72 ? 0.6849 0.7105 0.5272 -0.2305 0.0210 0.0327 72 ASP B OD2 2195 N N . ASN B 73 ? 0.4608 0.5746 0.3905 -0.1537 0.0399 0.0232 73 ASN B N 2196 C CA . ASN B 73 ? 0.5080 0.6728 0.4596 -0.1400 0.0447 0.0224 73 ASN B CA 2197 C C . ASN B 73 ? 0.6200 0.8373 0.5790 -0.1514 0.0458 0.0269 73 ASN B C 2198 O O . ASN B 73 ? 0.6383 0.8912 0.6163 -0.1336 0.0494 0.0243 73 ASN B O 2199 C CB . ASN B 73 ? 0.4632 0.6358 0.4103 -0.1404 0.0464 0.0249 73 ASN B CB 2200 C CG . ASN B 73 ? 0.4391 0.5736 0.3856 -0.1229 0.0463 0.0198 73 ASN B CG 2201 O OD1 . ASN B 73 ? 0.2529 0.3757 0.2111 -0.1034 0.0470 0.0135 73 ASN B OD1 2202 N ND2 . ASN B 73 ? 0.4096 0.5259 0.3410 -0.1311 0.0451 0.0232 73 ASN B ND2 2203 N N . SER B 74 ? 0.6614 0.8808 0.6030 -0.1785 0.0411 0.0332 74 SER B N 2204 C CA . SER B 74 ? 0.5956 0.8585 0.5426 -0.1841 0.0366 0.0358 74 SER B CA 2205 C C . SER B 74 ? 0.4741 0.7427 0.4332 -0.1754 0.0374 0.0326 74 SER B C 2206 O O . SER B 74 ? 0.3988 0.7101 0.3757 -0.1597 0.0390 0.0319 74 SER B O 2207 C CB . SER B 74 ? 0.7523 1.0025 0.6728 -0.2133 0.0277 0.0408 74 SER B CB 2208 O OG . SER B 74 ? 0.8690 1.0996 0.7740 -0.2224 0.0267 0.0433 74 SER B OG 2209 N N . LYS B 75 ? 0.4343 0.6577 0.3819 -0.1837 0.0359 0.0305 75 LYS B N 2210 C CA . LYS B 75 ? 0.3753 0.6001 0.3328 -0.1775 0.0362 0.0274 75 LYS B CA 2211 C C . LYS B 75 ? 0.3766 0.5990 0.3556 -0.1485 0.0419 0.0206 75 LYS B C 2212 O O . LYS B 75 ? 0.2315 0.4544 0.2200 -0.1397 0.0418 0.0173 75 LYS B O 2213 C CB . LYS B 75 ? 0.4007 0.5734 0.3339 -0.1953 0.0311 0.0271 75 LYS B CB 2214 C CG . LYS B 75 ? 0.5630 0.7345 0.4707 -0.2203 0.0225 0.0316 75 LYS B CG 2215 C CD . LYS B 75 ? 0.7272 0.8322 0.5992 -0.2356 0.0177 0.0313 75 LYS B CD 2216 C CE . LYS B 75 ? 0.8632 0.9282 0.7335 -0.2270 0.0192 0.0265 75 LYS B CE 2217 N NZ . LYS B 75 ? 0.9205 0.9156 0.7551 -0.2325 0.0159 0.0256 75 LYS B NZ 2218 N N . SER B 76 ? 0.3614 0.5749 0.3453 -0.1311 0.0445 0.0175 76 SER B N 2219 C CA . SER B 76 ? 0.3044 0.5094 0.3035 -0.1019 0.0472 0.0102 76 SER B CA 2220 C C . SER B 76 ? 0.3970 0.5580 0.3947 -0.0961 0.0444 0.0051 76 SER B C 2221 O O . SER B 76 ? 0.5033 0.6671 0.5133 -0.0799 0.0454 0.0007 76 SER B O 2222 C CB . SER B 76 ? 0.2409 0.4944 0.2562 -0.0861 0.0511 0.0099 76 SER B CB 2223 O OG . SER B 76 ? 0.3846 0.6869 0.4006 -0.0918 0.0539 0.0158 76 SER B OG 2224 N N . GLN B 77 ? 0.4146 0.5344 0.3949 -0.1084 0.0409 0.0060 77 GLN B N 2225 C CA . GLN B 77 ? 0.4959 0.5760 0.4719 -0.1028 0.0384 0.0020 77 GLN B CA 2226 C C . GLN B 77 ? 0.4315 0.4730 0.3977 -0.0950 0.0373 0.0003 77 GLN B C 2227 O O . GLN B 77 ? 0.2903 0.3208 0.2419 -0.1044 0.0367 0.0038 77 GLN B O 2228 C CB . GLN B 77 ? 0.4987 0.5633 0.4573 -0.1234 0.0349 0.0049 77 GLN B CB 2229 C CG . GLN B 77 ? 0.4841 0.5891 0.4527 -0.1318 0.0353 0.0069 77 GLN B CG 2230 C CD . GLN B 77 ? 0.5112 0.5997 0.4583 -0.1565 0.0312 0.0102 77 GLN B CD 2231 O OE1 . GLN B 77 ? 0.5586 0.6111 0.4784 -0.1725 0.0281 0.0129 77 GLN B OE1 2232 N NE2 . GLN B 77 ? 0.3219 0.4339 0.2780 -0.1597 0.0309 0.0102 77 GLN B NE2 2233 N N . VAL B 78 ? 0.3688 0.3925 0.3427 -0.0782 0.0371 -0.0044 78 VAL B N 2234 C CA . VAL B 78 ? 0.3676 0.3591 0.3330 -0.0693 0.0358 -0.0054 78 VAL B CA 2235 C C . VAL B 78 ? 0.4102 0.3708 0.3641 -0.0682 0.0333 -0.0063 78 VAL B C 2236 O O . VAL B 78 ? 0.4865 0.4536 0.4503 -0.0645 0.0332 -0.0090 78 VAL B O 2237 C CB . VAL B 78 ? 0.3005 0.3008 0.2818 -0.0516 0.0373 -0.0091 78 VAL B CB 2238 C CG1 . VAL B 78 ? 0.3011 0.2759 0.2740 -0.0440 0.0358 -0.0088 78 VAL B CG1 2239 C CG2 . VAL B 78 ? 0.2980 0.3267 0.2872 -0.0505 0.0401 -0.0088 78 VAL B CG2 2240 N N . PHE B 79 ? 0.3615 0.2876 0.2925 -0.0701 0.0314 -0.0041 79 PHE B N 2241 C CA . PHE B 79 ? 0.3993 0.2915 0.3121 -0.0677 0.0293 -0.0046 79 PHE B CA 2242 C C . PHE B 79 ? 0.4659 0.3423 0.3779 -0.0477 0.0291 -0.0057 79 PHE B C 2243 O O . PHE B 79 ? 0.5234 0.3894 0.4259 -0.0433 0.0291 -0.0033 79 PHE B O 2244 C CB . PHE B 79 ? 0.3803 0.2397 0.2584 -0.0851 0.0268 -0.0006 79 PHE B CB 2245 C CG . PHE B 79 ? 0.4595 0.3397 0.3367 -0.1083 0.0263 0.0018 79 PHE B CG 2246 C CD1 . PHE B 79 ? 0.5160 0.4072 0.3984 -0.1157 0.0257 0.0004 79 PHE B CD1 2247 C CD2 . PHE B 79 ? 0.4072 0.3004 0.2786 -0.1233 0.0265 0.0062 79 PHE B CD2 2248 C CE1 . PHE B 79 ? 0.4770 0.3944 0.3590 -0.1376 0.0250 0.0037 79 PHE B CE1 2249 C CE2 . PHE B 79 ? 0.4447 0.3651 0.3158 -0.1455 0.0260 0.0097 79 PHE B CE2 2250 C CZ . PHE B 79 ? 0.5176 0.4515 0.3941 -0.1527 0.0252 0.0086 79 PHE B CZ 2251 N N . PHE B 80 ? 0.4601 0.3380 0.3817 -0.0361 0.0291 -0.0086 80 PHE B N 2252 C CA . PHE B 80 ? 0.4078 0.2802 0.3310 -0.0175 0.0289 -0.0089 80 PHE B CA 2253 C C . PHE B 80 ? 0.3638 0.2019 0.2612 -0.0109 0.0276 -0.0083 80 PHE B C 2254 O O . PHE B 80 ? 0.4379 0.2679 0.3304 -0.0169 0.0270 -0.0102 80 PHE B O 2255 C CB . PHE B 80 ? 0.3866 0.2884 0.3379 -0.0100 0.0296 -0.0121 80 PHE B CB 2256 C CG . PHE B 80 ? 0.3774 0.2827 0.3326 0.0061 0.0290 -0.0115 80 PHE B CG 2257 C CD1 . PHE B 80 ? 0.4229 0.3187 0.3717 0.0157 0.0284 -0.0119 80 PHE B CD1 2258 C CD2 . PHE B 80 ? 0.3683 0.2902 0.3335 0.0110 0.0289 -0.0104 80 PHE B CD2 2259 C CE1 . PHE B 80 ? 0.4219 0.3291 0.3752 0.0303 0.0279 -0.0103 80 PHE B CE1 2260 C CE2 . PHE B 80 ? 0.2241 0.1563 0.1931 0.0233 0.0280 -0.0088 80 PHE B CE2 2261 C CZ . PHE B 80 ? 0.2302 0.1575 0.1942 0.0331 0.0276 -0.0084 80 PHE B CZ 2262 N N . LYS B 81 ? 0.3902 0.2077 0.2689 0.0024 0.0272 -0.0056 81 LYS B N 2263 C CA . LYS B 81 ? 0.4259 0.2077 0.2748 0.0141 0.0264 -0.0049 81 LYS B CA 2264 C C . LYS B 81 ? 0.4261 0.2150 0.2756 0.0381 0.0271 -0.0027 81 LYS B C 2265 O O . LYS B 81 ? 0.3956 0.1885 0.2433 0.0429 0.0272 0.0005 81 LYS B O 2266 C CB . LYS B 81 ? 0.5072 0.2423 0.3149 0.0040 0.0248 -0.0024 81 LYS B CB 2267 C CG . LYS B 81 ? 0.6516 0.3404 0.4206 0.0143 0.0238 -0.0026 81 LYS B CG 2268 C CD . LYS B 81 ? 0.7870 0.4213 0.5071 0.0055 0.0216 0.0006 81 LYS B CD 2269 C CE . LYS B 81 ? 0.8023 0.3828 0.4762 0.0215 0.0207 0.0004 81 LYS B CE 2270 N NZ . LYS B 81 ? 0.8106 0.3830 0.4769 0.0081 0.0189 -0.0029 81 LYS B NZ 2271 N N . MET B 82 ? 0.5390 0.3334 0.3911 0.0528 0.0274 -0.0038 82 MET B N 2272 C CA . MET B 82 ? 0.6527 0.4599 0.5039 0.0767 0.0281 -0.0007 82 MET B CA 2273 C C . MET B 82 ? 0.7001 0.4720 0.5170 0.0943 0.0284 -0.0002 82 MET B C 2274 O O . MET B 82 ? 0.7338 0.4923 0.5453 0.0898 0.0282 -0.0037 82 MET B O 2275 C CB . MET B 82 ? 0.6411 0.4966 0.5289 0.0790 0.0283 -0.0016 82 MET B CB 2276 C CG . MET B 82 ? 0.7263 0.6046 0.6149 0.1015 0.0286 0.0026 82 MET B CG 2277 S SD . MET B 82 ? 0.6310 0.5659 0.5592 0.0969 0.0277 0.0026 82 MET B SD 2278 C CE . MET B 82 ? 0.5321 0.4816 0.4765 0.0803 0.0266 0.0029 82 MET B CE 2279 N N . ASN B 83 ? 0.6334 0.3897 0.4250 0.1156 0.0289 0.0041 83 ASN B N 2280 C CA . ASN B 83 ? 0.6500 0.3649 0.3999 0.1365 0.0294 0.0048 83 ASN B CA 2281 C C . ASN B 83 ? 0.6171 0.3680 0.3786 0.1604 0.0307 0.0067 83 ASN B C 2282 O O . ASN B 83 ? 0.5890 0.3900 0.3827 0.1662 0.0314 0.0091 83 ASN B O 2283 C CB . ASN B 83 ? 0.6754 0.3551 0.3872 0.1452 0.0287 0.0090 83 ASN B CB 2284 C CG . ASN B 83 ? 0.8815 0.5169 0.5699 0.1204 0.0267 0.0078 83 ASN B CG 2285 O OD1 . ASN B 83 ? 0.9157 0.5206 0.5819 0.1067 0.0249 0.0050 83 ASN B OD1 2286 N ND2 . ASN B 83 ? 0.9932 0.6320 0.6878 0.1118 0.0264 0.0105 83 ASN B ND2 2287 N N . SER B 84 ? 0.5893 0.3207 0.3245 0.1689 0.0303 0.0062 84 SER B N 2288 C CA . SER B 84 ? 0.6878 0.4492 0.4243 0.1906 0.0313 0.0088 84 SER B CA 2289 C C . SER B 84 ? 0.6812 0.5003 0.4630 0.1903 0.0320 0.0089 84 SER B C 2290 O O . SER B 84 ? 0.6511 0.5137 0.4518 0.2002 0.0325 0.0136 84 SER B O 2291 C CB . SER B 84 ? 0.7704 0.5362 0.4846 0.2127 0.0322 0.0146 84 SER B CB 2292 O OG . SER B 84 ? 0.8744 0.6631 0.6081 0.2115 0.0324 0.0178 84 SER B OG 2293 N N . LEU B 85 ? 0.6149 0.4357 0.4126 0.1776 0.0318 0.0040 85 LEU B N 2294 C CA . LEU B 85 ? 0.5563 0.4278 0.3938 0.1747 0.0323 0.0035 85 LEU B CA 2295 C C . LEU B 85 ? 0.4688 0.3686 0.3054 0.1899 0.0323 0.0066 85 LEU B C 2296 O O . LEU B 85 ? 0.5972 0.4696 0.4046 0.1987 0.0323 0.0062 85 LEU B O 2297 C CB . LEU B 85 ? 0.3575 0.2205 0.2125 0.1521 0.0320 -0.0029 85 LEU B CB 2298 C CG . LEU B 85 ? 0.4710 0.3411 0.3482 0.1262 0.0304 -0.0045 85 LEU B CG 2299 C CD1 . LEU B 85 ? 0.4487 0.2739 0.2986 0.1191 0.0301 -0.0049 85 LEU B CD1 2300 C CD2 . LEU B 85 ? 0.4110 0.2929 0.3127 0.1057 0.0296 -0.0091 85 LEU B CD2 2301 N N . GLN B 86 ? 0.4439 0.3992 0.3106 0.1918 0.0322 0.0100 86 GLN B N 2302 C CA . GLN B 86 ? 0.5245 0.5154 0.3960 0.2014 0.0320 0.0133 86 GLN B CA 2303 C C . GLN B 86 ? 0.5056 0.5285 0.4121 0.1857 0.0313 0.0108 86 GLN B C 2304 O O . GLN B 86 ? 0.5664 0.5856 0.4920 0.1700 0.0314 0.0067 86 GLN B O 2305 C CB . GLN B 86 ? 0.5235 0.5555 0.3932 0.2162 0.0320 0.0214 86 GLN B CB 2306 C CG . GLN B 86 ? 0.6539 0.6550 0.4867 0.2337 0.0333 0.0241 86 GLN B CG 2307 C CD . GLN B 86 ? 0.8943 0.8493 0.6887 0.2452 0.0341 0.0216 86 GLN B CD 2308 O OE1 . GLN B 86 ? 0.8931 0.8572 0.6865 0.2492 0.0341 0.0211 86 GLN B OE1 2309 N NE2 . GLN B 86 ? 1.0231 0.9271 0.7835 0.2497 0.0345 0.0203 86 GLN B NE2 2310 N N . SER B 87 ? 0.4837 0.5355 0.3945 0.1907 0.0308 0.0132 87 SER B N 2311 C CA . SER B 87 ? 0.5171 0.5940 0.4553 0.1762 0.0299 0.0108 87 SER B CA 2312 C C . SER B 87 ? 0.5112 0.6223 0.4798 0.1603 0.0286 0.0121 87 SER B C 2313 O O . SER B 87 ? 0.5396 0.6493 0.5265 0.1425 0.0278 0.0077 87 SER B O 2314 C CB . SER B 87 ? 0.4556 0.5659 0.3925 0.1844 0.0292 0.0153 87 SER B CB 2315 O OG . SER B 87 ? 0.5127 0.5895 0.4222 0.1974 0.0304 0.0131 87 SER B OG 2316 N N . ASN B 88 ? 0.4707 0.6105 0.4422 0.1634 0.0276 0.0182 88 ASN B N 2317 C CA . ASN B 88 ? 0.4394 0.6137 0.4366 0.1458 0.0254 0.0203 88 ASN B CA 2318 C C . ASN B 88 ? 0.4144 0.5526 0.4121 0.1291 0.0245 0.0155 88 ASN B C 2319 O O . ASN B 88 ? 0.4573 0.6118 0.4693 0.1104 0.0217 0.0165 88 ASN B O 2320 C CB . ASN B 88 ? 0.3747 0.5948 0.3719 0.1501 0.0234 0.0295 88 ASN B CB 2321 C CG . ASN B 88 ? 0.6126 0.8207 0.5947 0.1629 0.0246 0.0321 88 ASN B CG 2322 O OD1 . ASN B 88 ? 0.6007 0.7620 0.5661 0.1722 0.0269 0.0277 88 ASN B OD1 2323 N ND2 . ASN B 88 ? 0.8900 1.1403 0.8755 0.1619 0.0228 0.0397 88 ASN B ND2 2324 N N . ASP B 89 ? 0.3366 0.4261 0.3164 0.1346 0.0267 0.0106 89 ASP B N 2325 C CA . ASP B 89 ? 0.3662 0.4232 0.3474 0.1169 0.0261 0.0056 89 ASP B CA 2326 C C . ASP B 89 ? 0.3952 0.4386 0.3876 0.0996 0.0255 -0.0005 89 ASP B C 2327 O O . ASP B 89 ? 0.3680 0.3909 0.3634 0.0849 0.0251 -0.0044 89 ASP B O 2328 C CB . ASP B 89 ? 0.3843 0.3974 0.3385 0.1277 0.0281 0.0043 89 ASP B CB 2329 C CG . ASP B 89 ? 0.4705 0.4930 0.4134 0.1427 0.0285 0.0102 89 ASP B CG 2330 O OD1 . ASP B 89 ? 0.4970 0.5486 0.4559 0.1337 0.0267 0.0133 89 ASP B OD1 2331 O OD2 . ASP B 89 ? 0.4614 0.4600 0.3765 0.1639 0.0304 0.0119 89 ASP B OD2 2332 N N . THR B 90 ? 0.3093 0.3663 0.3072 0.1021 0.0254 -0.0009 90 THR B N 2333 C CA . THR B 90 ? 0.2945 0.3445 0.3042 0.0868 0.0245 -0.0057 90 THR B CA 2334 C C . THR B 90 ? 0.3095 0.3764 0.3371 0.0681 0.0219 -0.0057 90 THR B C 2335 O O . THR B 90 ? 0.2475 0.3469 0.2837 0.0648 0.0197 -0.0013 90 THR B O 2336 C CB . THR B 90 ? 0.2969 0.3632 0.3088 0.0942 0.0248 -0.0051 90 THR B CB 2337 O OG1 . THR B 90 ? 0.4215 0.4632 0.4112 0.1122 0.0274 -0.0062 90 THR B OG1 2338 C CG2 . THR B 90 ? 0.1623 0.2248 0.1872 0.0782 0.0236 -0.0093 90 THR B CG2 2339 N N . ALA B 91 ? 0.1548 0.1998 0.1850 0.0556 0.0219 -0.0102 91 ALA B N 2340 C CA . ALA B 91 ? 0.1443 0.1970 0.1848 0.0408 0.0197 -0.0108 91 ALA B CA 2341 C C . ALA B 91 ? 0.2309 0.2604 0.2726 0.0322 0.0208 -0.0160 91 ALA B C 2342 O O . ALA B 91 ? 0.2993 0.3097 0.3344 0.0348 0.0227 -0.0185 91 ALA B O 2343 C CB . ALA B 91 ? 0.2397 0.3018 0.2778 0.0405 0.0189 -0.0073 91 ALA B CB 2344 N N . ILE B 92 ? 0.2211 0.2529 0.2684 0.0217 0.0192 -0.0173 92 ILE B N 2345 C CA . ILE B 92 ? 0.2083 0.2246 0.2561 0.0160 0.0205 -0.0212 92 ILE B CA 2346 C C . ILE B 92 ? 0.2409 0.2514 0.2836 0.0153 0.0214 -0.0207 92 ILE B C 2347 O O . ILE B 92 ? 0.2208 0.2397 0.2623 0.0133 0.0197 -0.0185 92 ILE B O 2348 C CB . ILE B 92 ? 0.2638 0.2814 0.3149 0.0086 0.0187 -0.0230 92 ILE B CB 2349 C CG1 . ILE B 92 ? 0.1467 0.1700 0.2022 0.0086 0.0176 -0.0231 92 ILE B CG1 2350 C CG2 . ILE B 92 ? 0.1286 0.1348 0.1787 0.0068 0.0205 -0.0264 92 ILE B CG2 2351 C CD1 . ILE B 92 ? 0.2694 0.2907 0.3232 0.0016 0.0151 -0.0238 92 ILE B CD1 2352 N N . TYR B 93 ? 0.2497 0.2470 0.2883 0.0153 0.0237 -0.0223 93 TYR B N 2353 C CA . TYR B 93 ? 0.1777 0.1693 0.2109 0.0138 0.0247 -0.0216 93 TYR B CA 2354 C C . TYR B 93 ? 0.2502 0.2411 0.2864 0.0079 0.0258 -0.0244 93 TYR B C 2355 O O . TYR B 93 ? 0.3282 0.3182 0.3670 0.0056 0.0270 -0.0263 93 TYR B O 2356 C CB . TYR B 93 ? 0.2432 0.2196 0.2647 0.0170 0.0261 -0.0204 93 TYR B CB 2357 C CG . TYR B 93 ? 0.3857 0.3618 0.3994 0.0277 0.0255 -0.0171 93 TYR B CG 2358 C CD1 . TYR B 93 ? 0.3041 0.2818 0.3167 0.0346 0.0252 -0.0169 93 TYR B CD1 2359 C CD2 . TYR B 93 ? 0.4789 0.4555 0.4855 0.0328 0.0254 -0.0138 93 TYR B CD2 2360 C CE1 . TYR B 93 ? 0.3068 0.2880 0.3108 0.0479 0.0252 -0.0134 93 TYR B CE1 2361 C CE2 . TYR B 93 ? 0.4890 0.4691 0.4871 0.0459 0.0251 -0.0100 93 TYR B CE2 2362 C CZ . TYR B 93 ? 0.3791 0.3624 0.3757 0.0543 0.0252 -0.0098 93 TYR B CZ 2363 O OH . TYR B 93 ? 0.3134 0.3038 0.3002 0.0707 0.0254 -0.0056 93 TYR B OH 2364 N N . TYR B 94 ? 0.2240 0.2171 0.2586 0.0062 0.0255 -0.0243 94 TYR B N 2365 C CA . TYR B 94 ? 0.1817 0.1749 0.2160 0.0042 0.0271 -0.0267 94 TYR B CA 2366 C C . TYR B 94 ? 0.2074 0.1992 0.2369 0.0026 0.0288 -0.0255 94 TYR B C 2367 O O . TYR B 94 ? 0.2168 0.2057 0.2420 0.0031 0.0281 -0.0230 94 TYR B O 2368 C CB . TYR B 94 ? 0.2047 0.1966 0.2353 0.0039 0.0253 -0.0281 94 TYR B CB 2369 C CG . TYR B 94 ? 0.2044 0.1960 0.2359 0.0029 0.0226 -0.0283 94 TYR B CG 2370 C CD1 . TYR B 94 ? 0.2305 0.2277 0.2614 -0.0001 0.0195 -0.0254 94 TYR B CD1 2371 C CD2 . TYR B 94 ? 0.2417 0.2302 0.2736 0.0047 0.0229 -0.0307 94 TYR B CD2 2372 C CE1 . TYR B 94 ? 0.2902 0.2900 0.3210 -0.0033 0.0167 -0.0248 94 TYR B CE1 2373 C CE2 . TYR B 94 ? 0.2497 0.2362 0.2803 0.0025 0.0201 -0.0305 94 TYR B CE2 2374 C CZ . TYR B 94 ? 0.2508 0.2429 0.2809 -0.0025 0.0169 -0.0275 94 TYR B CZ 2375 O OH . TYR B 94 ? 0.2643 0.2573 0.2924 -0.0069 0.0139 -0.0265 94 TYR B OH 2376 N N . CYS B 95 ? 0.2432 0.2397 0.2729 0.0012 0.0312 -0.0268 95 CYS B N 2377 C CA . CYS B 95 ? 0.2677 0.2670 0.2929 -0.0004 0.0329 -0.0261 95 CYS B CA 2378 C C . CYS B 95 ? 0.3059 0.3086 0.3285 0.0043 0.0338 -0.0287 95 CYS B C 2379 O O . CYS B 95 ? 0.4007 0.4062 0.4246 0.0086 0.0343 -0.0308 95 CYS B O 2380 C CB . CYS B 95 ? 0.2830 0.2883 0.3072 -0.0064 0.0350 -0.0244 95 CYS B CB 2381 S SG . CYS B 95 ? 0.4493 0.4730 0.4800 -0.0072 0.0370 -0.0254 95 CYS B SG 2382 N N . ALA B 96 ? 0.1669 0.1667 0.1827 0.0047 0.0338 -0.0286 96 ALA B N 2383 C CA . ALA B 96 ? 0.1756 0.1711 0.1824 0.0101 0.0342 -0.0315 96 ALA B CA 2384 C C . ALA B 96 ? 0.2062 0.2064 0.2071 0.0109 0.0365 -0.0312 96 ALA B C 2385 O O . ALA B 96 ? 0.2256 0.2294 0.2288 0.0056 0.0368 -0.0284 96 ALA B O 2386 C CB . ALA B 96 ? 0.1818 0.1629 0.1807 0.0081 0.0303 -0.0324 96 ALA B CB 2387 N N . ARG B 97 ? 0.1933 0.1913 0.1837 0.0190 0.0382 -0.0341 97 ARG B N 2388 C CA . ARG B 97 ? 0.2020 0.2047 0.1844 0.0221 0.0407 -0.0343 97 ARG B CA 2389 C C . ARG B 97 ? 0.2783 0.2596 0.2408 0.0271 0.0392 -0.0379 97 ARG B C 2390 O O . ARG B 97 ? 0.2321 0.1972 0.1840 0.0317 0.0375 -0.0406 97 ARG B O 2391 C CB . ARG B 97 ? 0.2018 0.2273 0.1869 0.0294 0.0454 -0.0339 97 ARG B CB 2392 C CG . ARG B 97 ? 0.2058 0.2452 0.1879 0.0290 0.0482 -0.0323 97 ARG B CG 2393 C CD . ARG B 97 ? 0.2142 0.2737 0.1905 0.0425 0.0528 -0.0331 97 ARG B CD 2394 N NE . ARG B 97 ? 0.4002 0.4388 0.3556 0.0565 0.0532 -0.0378 97 ARG B NE 2395 C CZ . ARG B 97 ? 0.3782 0.4275 0.3212 0.0734 0.0574 -0.0393 97 ARG B CZ 2396 N NH1 . ARG B 97 ? 0.3761 0.4648 0.3295 0.0775 0.0616 -0.0358 97 ARG B NH1 2397 N NH2 . ARG B 97 ? 0.3347 0.3556 0.2521 0.0863 0.0572 -0.0439 97 ARG B NH2 2398 N N . ALA B 98 ? 0.4193 0.3979 0.3737 0.0253 0.0394 -0.0377 98 ALA B N 2399 C CA . ALA B 98 ? 0.3919 0.3469 0.3232 0.0275 0.0374 -0.0410 98 ALA B CA 2400 C C . ALA B 98 ? 0.4462 0.3981 0.3602 0.0428 0.0415 -0.0445 98 ALA B C 2401 O O . ALA B 98 ? 0.4317 0.4077 0.3549 0.0512 0.0461 -0.0434 98 ALA B O 2402 C CB . ALA B 98 ? 0.3202 0.2736 0.2495 0.0178 0.0352 -0.0390 98 ALA B CB 2403 N N . LEU B 99 ? 0.5879 0.5099 0.4736 0.0465 0.0396 -0.0483 99 LEU B N 2404 C CA . LEU B 99 ? 0.5942 0.5078 0.4565 0.0642 0.0435 -0.0520 99 LEU B CA 2405 C C . LEU B 99 ? 0.5244 0.4610 0.3925 0.0666 0.0475 -0.0505 99 LEU B C 2406 O O . LEU B 99 ? 0.5389 0.4986 0.4092 0.0806 0.0530 -0.0502 99 LEU B O 2407 C CB . LEU B 99 ? 0.5924 0.4604 0.4163 0.0653 0.0397 -0.0565 99 LEU B CB 2408 C CG . LEU B 99 ? 0.6111 0.4503 0.4122 0.0757 0.0386 -0.0596 99 LEU B CG 2409 C CD1 . LEU B 99 ? 0.6495 0.4372 0.4059 0.0726 0.0339 -0.0637 99 LEU B CD1 2410 C CD2 . LEU B 99 ? 0.5548 0.4098 0.3532 0.1009 0.0452 -0.0607 99 LEU B CD2 2411 N N . THR B 100 ? 0.5098 0.4434 0.3800 0.0530 0.0448 -0.0490 100 THR B N 2412 C CA . THR B 100 ? 0.5655 0.5192 0.4410 0.0525 0.0480 -0.0470 100 THR B CA 2413 C C . THR B 100 ? 0.4237 0.4024 0.3283 0.0386 0.0473 -0.0413 100 THR B C 2414 O O . THR B 100 ? 0.3990 0.3747 0.3161 0.0293 0.0439 -0.0393 100 THR B O 2415 C CB . THR B 100 ? 0.7592 0.6888 0.6110 0.0486 0.0455 -0.0494 100 THR B CB 2416 O OG1 . THR B 100 ? 0.8656 0.7948 0.7287 0.0304 0.0406 -0.0460 100 THR B OG1 2417 C CG2 . THR B 100 ? 0.8127 0.7016 0.6295 0.0555 0.0430 -0.0550 100 THR B CG2 2418 N N . TYR B 101 ? 0.3853 0.3869 0.2973 0.0377 0.0506 -0.0384 101 TYR B N 2419 C CA . TYR B 101 ? 0.4276 0.4486 0.3608 0.0256 0.0503 -0.0327 101 TYR B CA 2420 C C . TYR B 101 ? 0.4952 0.5027 0.4312 0.0135 0.0456 -0.0304 101 TYR B C 2421 O O . TYR B 101 ? 0.3774 0.3907 0.3269 0.0056 0.0443 -0.0263 101 TYR B O 2422 C CB . TYR B 101 ? 0.3633 0.4102 0.2991 0.0256 0.0546 -0.0296 101 TYR B CB 2423 C CG . TYR B 101 ? 0.3306 0.3718 0.2552 0.0237 0.0544 -0.0297 101 TYR B CG 2424 C CD1 . TYR B 101 ? 0.2559 0.2951 0.1862 0.0111 0.0518 -0.0254 101 TYR B CD1 2425 C CD2 . TYR B 101 ? 0.3591 0.3958 0.2648 0.0360 0.0570 -0.0338 101 TYR B CD2 2426 C CE1 . TYR B 101 ? 0.4088 0.4444 0.3291 0.0091 0.0516 -0.0251 101 TYR B CE1 2427 C CE2 . TYR B 101 ? 0.3967 0.4279 0.2912 0.0337 0.0568 -0.0340 101 TYR B CE2 2428 C CZ . TYR B 101 ? 0.4074 0.4397 0.3107 0.0195 0.0540 -0.0295 101 TYR B CZ 2429 O OH . TYR B 101 ? 0.2928 0.3212 0.1853 0.0169 0.0536 -0.0293 101 TYR B OH 2430 N N . TYR B 102 ? 0.4984 0.4884 0.4195 0.0124 0.0430 -0.0326 102 TYR B N 2431 C CA . TYR B 102 ? 0.4359 0.4207 0.3588 0.0019 0.0387 -0.0294 102 TYR B CA 2432 C C . TYR B 102 ? 0.4177 0.3880 0.3371 -0.0030 0.0336 -0.0302 102 TYR B C 2433 O O . TYR B 102 ? 0.4055 0.3782 0.3282 -0.0108 0.0300 -0.0265 102 TYR B O 2434 C CB . TYR B 102 ? 0.3176 0.2986 0.2261 0.0006 0.0386 -0.0299 102 TYR B CB 2435 C CG . TYR B 102 ? 0.2969 0.2573 0.1809 0.0065 0.0384 -0.0359 102 TYR B CG 2436 C CD1 . TYR B 102 ? 0.3116 0.2503 0.1800 -0.0007 0.0330 -0.0376 102 TYR B CD1 2437 C CD2 . TYR B 102 ? 0.3094 0.2713 0.1825 0.0195 0.0433 -0.0395 102 TYR B CD2 2438 C CE1 . TYR B 102 ? 0.3967 0.3081 0.2354 0.0035 0.0322 -0.0433 102 TYR B CE1 2439 C CE2 . TYR B 102 ? 0.3390 0.2754 0.1833 0.0278 0.0432 -0.0453 102 TYR B CE2 2440 C CZ . TYR B 102 ? 0.4279 0.3351 0.2531 0.0191 0.0374 -0.0475 102 TYR B CZ 2441 O OH . TYR B 102 ? 0.4815 0.3553 0.2710 0.0261 0.0367 -0.0533 102 TYR B OH 2442 N N . ASP B 103 ? 0.4484 0.4058 0.3600 0.0016 0.0333 -0.0342 103 ASP B N 2443 C CA . ASP B 103 ? 0.4196 0.3598 0.3201 -0.0052 0.0280 -0.0353 103 ASP B CA 2444 C C . ASP B 103 ? 0.3941 0.3411 0.3111 -0.0075 0.0264 -0.0332 103 ASP B C 2445 O O . ASP B 103 ? 0.2438 0.2056 0.1792 -0.0039 0.0292 -0.0312 103 ASP B O 2446 C CB . ASP B 103 ? 0.3743 0.2875 0.2470 0.0008 0.0280 -0.0413 103 ASP B CB 2447 C CG . ASP B 103 ? 0.4483 0.3382 0.2969 -0.0113 0.0219 -0.0421 103 ASP B CG 2448 O OD1 . ASP B 103 ? 0.4597 0.3584 0.3172 -0.0241 0.0172 -0.0380 103 ASP B OD1 2449 O OD2 . ASP B 103 ? 0.3628 0.2262 0.1811 -0.0082 0.0216 -0.0466 103 ASP B OD2 2450 N N . TYR B 104 ? 0.3041 0.2394 0.2119 -0.0151 0.0215 -0.0333 104 TYR B N 2451 C CA . TYR B 104 ? 0.2557 0.1994 0.1779 -0.0183 0.0194 -0.0308 104 TYR B CA 2452 C C . TYR B 104 ? 0.3403 0.2646 0.2492 -0.0189 0.0173 -0.0342 104 TYR B C 2453 O O . TYR B 104 ? 0.3190 0.2492 0.2364 -0.0238 0.0147 -0.0319 104 TYR B O 2454 C CB . TYR B 104 ? 0.2737 0.2321 0.2014 -0.0287 0.0150 -0.0252 104 TYR B CB 2455 C CG . TYR B 104 ? 0.2893 0.2662 0.2303 -0.0261 0.0169 -0.0209 104 TYR B CG 2456 C CD1 . TYR B 104 ? 0.3857 0.3612 0.3187 -0.0264 0.0180 -0.0210 104 TYR B CD1 2457 C CD2 . TYR B 104 ? 0.2497 0.2423 0.2075 -0.0226 0.0174 -0.0165 104 TYR B CD2 2458 C CE1 . TYR B 104 ? 0.3837 0.3730 0.3258 -0.0241 0.0194 -0.0166 104 TYR B CE1 2459 C CE2 . TYR B 104 ? 0.3452 0.3481 0.3090 -0.0190 0.0188 -0.0123 104 TYR B CE2 2460 C CZ . TYR B 104 ? 0.3641 0.3652 0.3202 -0.0203 0.0197 -0.0122 104 TYR B CZ 2461 O OH . TYR B 104 ? 0.3143 0.3228 0.2736 -0.0169 0.0209 -0.0077 104 TYR B OH 2462 N N . GLU B 105 ? 0.2939 0.1939 0.1796 -0.0130 0.0184 -0.0392 105 GLU B N 2463 C CA . GLU B 105 ? 0.3535 0.2301 0.2225 -0.0111 0.0166 -0.0423 105 GLU B CA 2464 C C . GLU B 105 ? 0.4613 0.3496 0.3475 0.0029 0.0216 -0.0434 105 GLU B C 2465 O O . GLU B 105 ? 0.5428 0.4373 0.4302 0.0157 0.0267 -0.0453 105 GLU B O 2466 C CB . GLU B 105 ? 0.4614 0.3009 0.2911 -0.0091 0.0152 -0.0471 105 GLU B CB 2467 C CG . GLU B 105 ? 0.5519 0.3831 0.3701 0.0109 0.0212 -0.0516 105 GLU B CG 2468 C CD . GLU B 105 ? 0.6225 0.4741 0.4513 0.0143 0.0250 -0.0507 105 GLU B CD 2469 O OE1 . GLU B 105 ? 0.7012 0.5335 0.5039 0.0173 0.0252 -0.0537 105 GLU B OE1 2470 O OE2 . GLU B 105 ? 0.6076 0.4921 0.4680 0.0137 0.0276 -0.0469 105 GLU B OE2 2471 N N . PHE B 106 ? 0.4441 0.3397 0.3442 -0.0003 0.0201 -0.0416 106 PHE B N 2472 C CA . PHE B 106 ? 0.3207 0.2338 0.2417 0.0092 0.0242 -0.0414 106 PHE B CA 2473 C C . PHE B 106 ? 0.3162 0.2114 0.2214 0.0203 0.0253 -0.0450 106 PHE B C 2474 O O . PHE B 106 ? 0.2861 0.1667 0.1835 0.0162 0.0219 -0.0453 106 PHE B O 2475 C CB . PHE B 106 ? 0.2368 0.1673 0.1800 0.0015 0.0223 -0.0375 106 PHE B CB 2476 C CG . PHE B 106 ? 0.3065 0.2526 0.2608 -0.0059 0.0212 -0.0334 106 PHE B CG 2477 C CD1 . PHE B 106 ? 0.3515 0.3096 0.3144 -0.0022 0.0247 -0.0323 106 PHE B CD1 2478 C CD2 . PHE B 106 ? 0.3536 0.3041 0.3081 -0.0161 0.0165 -0.0300 106 PHE B CD2 2479 C CE1 . PHE B 106 ? 0.3736 0.3427 0.3433 -0.0071 0.0236 -0.0283 106 PHE B CE1 2480 C CE2 . PHE B 106 ? 0.4028 0.3700 0.3660 -0.0197 0.0157 -0.0257 106 PHE B CE2 2481 C CZ . PHE B 106 ? 0.3977 0.3716 0.3676 -0.0143 0.0193 -0.0250 106 PHE B CZ 2482 N N . ALA B 107 ? 0.3268 0.2250 0.2264 0.0352 0.0302 -0.0474 107 ALA B N 2483 C CA . ALA B 107 ? 0.3998 0.2830 0.2817 0.0506 0.0321 -0.0505 107 ALA B CA 2484 C C . ALA B 107 ? 0.4015 0.3107 0.3058 0.0579 0.0353 -0.0489 107 ALA B C 2485 O O . ALA B 107 ? 0.4894 0.3873 0.3819 0.0687 0.0356 -0.0505 107 ALA B O 2486 C CB . ALA B 107 ? 0.3721 0.2472 0.2318 0.0664 0.0360 -0.0535 107 ALA B CB 2487 N N . TYR B 108 ? 0.3376 0.2789 0.2705 0.0518 0.0372 -0.0456 108 TYR B N 2488 C CA . TYR B 108 ? 0.3097 0.2767 0.2624 0.0552 0.0398 -0.0437 108 TYR B CA 2489 C C . TYR B 108 ? 0.2979 0.2743 0.2720 0.0404 0.0373 -0.0408 108 TYR B C 2490 O O . TYR B 108 ? 0.2293 0.2114 0.2111 0.0313 0.0367 -0.0388 108 TYR B O 2491 C CB . TYR B 108 ? 0.2805 0.2780 0.2410 0.0628 0.0451 -0.0421 108 TYR B CB 2492 C CG . TYR B 108 ? 0.3190 0.3101 0.2570 0.0800 0.0482 -0.0447 108 TYR B CG 2493 C CD1 . TYR B 108 ? 0.3598 0.3497 0.2843 0.0987 0.0505 -0.0463 108 TYR B CD1 2494 C CD2 . TYR B 108 ? 0.2664 0.2517 0.1940 0.0794 0.0489 -0.0456 108 TYR B CD2 2495 C CE1 . TYR B 108 ? 0.2988 0.2805 0.1982 0.1182 0.0537 -0.0487 108 TYR B CE1 2496 C CE2 . TYR B 108 ? 0.3324 0.3097 0.2361 0.0970 0.0520 -0.0483 108 TYR B CE2 2497 C CZ . TYR B 108 ? 0.3863 0.3611 0.2748 0.1173 0.0545 -0.0499 108 TYR B CZ 2498 O OH . TYR B 108 ? 0.3861 0.3511 0.2479 0.1371 0.0573 -0.0521 108 TYR B OH 2499 N N . TRP B 109 ? 0.2822 0.2591 0.2635 0.0396 0.0359 -0.0405 109 TRP B N 2500 C CA . TRP B 109 ? 0.2268 0.2097 0.2245 0.0285 0.0337 -0.0382 109 TRP B CA 2501 C C . TRP B 109 ? 0.2922 0.2951 0.3045 0.0294 0.0359 -0.0368 109 TRP B C 2502 O O . TRP B 109 ? 0.3875 0.3976 0.3976 0.0385 0.0377 -0.0377 109 TRP B O 2503 C CB . TRP B 109 ? 0.1910 0.1560 0.1827 0.0237 0.0292 -0.0386 109 TRP B CB 2504 C CG . TRP B 109 ? 0.2884 0.2370 0.2662 0.0173 0.0259 -0.0387 109 TRP B CG 2505 C CD1 . TRP B 109 ? 0.3481 0.2769 0.3032 0.0206 0.0253 -0.0411 109 TRP B CD1 2506 C CD2 . TRP B 109 ? 0.2539 0.2056 0.2370 0.0065 0.0225 -0.0359 109 TRP B CD2 2507 N NE1 . TRP B 109 ? 0.4184 0.3377 0.3648 0.0094 0.0212 -0.0399 109 TRP B NE1 2508 C CE2 . TRP B 109 ? 0.3062 0.2428 0.2710 0.0011 0.0195 -0.0363 109 TRP B CE2 2509 C CE3 . TRP B 109 ? 0.1798 0.1460 0.1790 0.0020 0.0217 -0.0328 109 TRP B CE3 2510 C CZ2 . TRP B 109 ? 0.2135 0.1553 0.1786 -0.0099 0.0157 -0.0330 109 TRP B CZ2 2511 C CZ3 . TRP B 109 ? 0.2426 0.2133 0.2414 -0.0054 0.0184 -0.0297 109 TRP B CZ3 2512 C CH2 . TRP B 109 ? 0.3027 0.2643 0.2861 -0.0119 0.0154 -0.0294 109 TRP B CH2 2513 N N . GLY B 110 ? 0.3464 0.3571 0.3706 0.0201 0.0354 -0.0344 110 GLY B N 2514 C CA . GLY B 110 ? 0.2956 0.3186 0.3301 0.0174 0.0359 -0.0332 110 GLY B CA 2515 C C . GLY B 110 ? 0.3573 0.3716 0.3933 0.0190 0.0336 -0.0344 110 GLY B C 2516 O O . GLY B 110 ? 0.3112 0.3101 0.3408 0.0191 0.0309 -0.0354 110 GLY B O 2517 N N . GLN B 111 ? 0.3001 0.3260 0.3436 0.0184 0.0343 -0.0339 111 GLN B N 2518 C CA . GLN B 111 ? 0.2433 0.2627 0.2884 0.0202 0.0322 -0.0348 111 GLN B CA 2519 C C . GLN B 111 ? 0.2575 0.2678 0.3062 0.0135 0.0295 -0.0341 111 GLN B C 2520 O O . GLN B 111 ? 0.1818 0.1871 0.2311 0.0140 0.0274 -0.0345 111 GLN B O 2521 C CB . GLN B 111 ? 0.1352 0.1719 0.1869 0.0220 0.0337 -0.0342 111 GLN B CB 2522 C CG . GLN B 111 ? 0.1277 0.1705 0.1872 0.0118 0.0332 -0.0327 111 GLN B CG 2523 C CD . GLN B 111 ? 0.2159 0.2714 0.2755 0.0038 0.0349 -0.0305 111 GLN B CD 2524 O OE1 . GLN B 111 ? 0.2907 0.3485 0.3467 0.0047 0.0363 -0.0300 111 GLN B OE1 2525 N NE2 . GLN B 111 ? 0.1489 0.2114 0.2103 -0.0056 0.0346 -0.0290 111 GLN B NE2 2526 N N . GLY B 112 ? 0.2757 0.2842 0.3248 0.0086 0.0295 -0.0326 112 GLY B N 2527 C CA . GLY B 112 ? 0.2006 0.2028 0.2506 0.0064 0.0274 -0.0314 112 GLY B CA 2528 C C . GLY B 112 ? 0.2455 0.2479 0.2979 0.0038 0.0278 -0.0309 112 GLY B C 2529 O O . GLY B 112 ? 0.3864 0.3950 0.4422 0.0025 0.0285 -0.0317 112 GLY B O 2530 N N . THR B 113 ? 0.1545 0.1491 0.2023 0.0040 0.0272 -0.0294 113 THR B N 2531 C CA . THR B 113 ? 0.1857 0.1725 0.2286 0.0028 0.0272 -0.0291 113 THR B CA 2532 C C . THR B 113 ? 0.1854 0.1701 0.2270 0.0096 0.0258 -0.0280 113 THR B C 2533 O O . THR B 113 ? 0.2502 0.2331 0.2870 0.0142 0.0255 -0.0259 113 THR B O 2534 C CB . THR B 113 ? 0.3215 0.2961 0.3522 -0.0019 0.0282 -0.0277 113 THR B CB 2535 O OG1 . THR B 113 ? 0.3413 0.3255 0.3744 -0.0092 0.0295 -0.0278 113 THR B OG1 2536 C CG2 . THR B 113 ? 0.2108 0.1691 0.2289 -0.0039 0.0277 -0.0277 113 THR B CG2 2537 N N . LEU B 114 ? 0.2267 0.2149 0.2725 0.0109 0.0251 -0.0290 114 LEU B N 2538 C CA . LEU B 114 ? 0.2079 0.1998 0.2529 0.0180 0.0241 -0.0275 114 LEU B CA 2539 C C . LEU B 114 ? 0.2401 0.2156 0.2701 0.0236 0.0250 -0.0270 114 LEU B C 2540 O O . LEU B 114 ? 0.3172 0.2808 0.3405 0.0205 0.0255 -0.0289 114 LEU B O 2541 C CB . LEU B 114 ? 0.1973 0.1986 0.2507 0.0170 0.0230 -0.0285 114 LEU B CB 2542 C CG . LEU B 114 ? 0.3464 0.3556 0.3989 0.0240 0.0221 -0.0267 114 LEU B CG 2543 C CD1 . LEU B 114 ? 0.4768 0.5003 0.5300 0.0274 0.0209 -0.0230 114 LEU B CD1 2544 C CD2 . LEU B 114 ? 0.3421 0.3602 0.4026 0.0211 0.0209 -0.0275 114 LEU B CD2 2545 N N . VAL B 115 ? 0.1716 0.1451 0.1932 0.0323 0.0252 -0.0244 115 VAL B N 2546 C CA . VAL B 115 ? 0.2576 0.2101 0.2585 0.0415 0.0262 -0.0237 115 VAL B CA 2547 C C . VAL B 115 ? 0.3256 0.2906 0.3252 0.0556 0.0261 -0.0217 115 VAL B C 2548 O O . VAL B 115 ? 0.2107 0.2008 0.2202 0.0601 0.0254 -0.0184 115 VAL B O 2549 C CB . VAL B 115 ? 0.3042 0.2439 0.2923 0.0443 0.0267 -0.0215 115 VAL B CB 2550 C CG1 . VAL B 115 ? 0.3804 0.2919 0.3404 0.0563 0.0275 -0.0206 115 VAL B CG1 2551 C CG2 . VAL B 115 ? 0.2946 0.2264 0.2841 0.0297 0.0269 -0.0230 115 VAL B CG2 2552 N N . THR B 116 ? 0.3313 0.2806 0.3173 0.0618 0.0268 -0.0232 116 THR B N 2553 C CA . THR B 116 ? 0.2301 0.1912 0.2118 0.0776 0.0274 -0.0214 116 THR B CA 2554 C C . THR B 116 ? 0.2810 0.2146 0.2321 0.0947 0.0290 -0.0203 116 THR B C 2555 O O . THR B 116 ? 0.3297 0.2254 0.2576 0.0922 0.0292 -0.0232 116 THR B O 2556 C CB . THR B 116 ? 0.2562 0.2193 0.2428 0.0742 0.0271 -0.0242 116 THR B CB 2557 O OG1 . THR B 116 ? 0.1774 0.1602 0.1879 0.0593 0.0256 -0.0251 116 THR B OG1 2558 C CG2 . THR B 116 ? 0.2079 0.1899 0.1920 0.0909 0.0279 -0.0217 116 THR B CG2 2559 N N . VAL B 117 ? 0.3630 0.3151 0.3111 0.1119 0.0297 -0.0158 117 VAL B N 2560 C CA . VAL B 117 ? 0.2869 0.2145 0.2026 0.1341 0.0315 -0.0140 117 VAL B CA 2561 C C . VAL B 117 ? 0.3466 0.2841 0.2553 0.1477 0.0320 -0.0132 117 VAL B C 2562 O O . VAL B 117 ? 0.4847 0.4661 0.4112 0.1532 0.0316 -0.0091 117 VAL B O 2563 C CB . VAL B 117 ? 0.3540 0.3006 0.2693 0.1465 0.0319 -0.0084 117 VAL B CB 2564 C CG1 . VAL B 117 ? 0.3710 0.2882 0.2497 0.1635 0.0321 -0.0056 117 VAL B CG1 2565 C CG2 . VAL B 117 ? 0.2731 0.2189 0.2016 0.1278 0.0304 -0.0086 117 VAL B CG2 2566 N N . SER B 118 ? 0.4515 0.3501 0.3334 0.1486 0.0317 -0.0160 118 SER B N 2567 C CA . SER B 118 ? 0.5357 0.4407 0.4088 0.1587 0.0315 -0.0151 118 SER B CA 2568 C C . SER B 118 ? 0.6658 0.5189 0.4982 0.1622 0.0309 -0.0169 118 SER B C 2569 O O . SER B 118 ? 0.7339 0.5480 0.5510 0.1491 0.0301 -0.0201 118 SER B O 2570 C CB . SER B 118 ? 0.4371 0.3641 0.3361 0.1481 0.0316 -0.0186 118 SER B CB 2571 O OG . SER B 118 ? 0.4511 0.3851 0.3413 0.1580 0.0315 -0.0175 118 SER B OG 2572 N N . ALA B 119 ? 0.6725 0.5260 0.4853 0.1788 0.0309 -0.0141 119 ALA B N 2573 C CA . ALA B 119 ? 0.7551 0.5596 0.5251 0.1839 0.0300 -0.0151 119 ALA B CA 2574 C C . ALA B 119 ? 0.7438 0.5334 0.5130 0.1726 0.0295 -0.0202 119 ALA B C 2575 O O . ALA B 119 ? 0.7328 0.4798 0.4656 0.1734 0.0283 -0.0212 119 ALA B O 2576 C CB . ALA B 119 ? 0.7686 0.5783 0.5123 0.2101 0.0305 -0.0094 119 ALA B CB 2577 N N . ALA B 120 ? 0.7143 0.5367 0.5204 0.1619 0.0300 -0.0230 120 ALA B N 2578 C CA . ALA B 120 ? 0.6398 0.4544 0.4476 0.1526 0.0297 -0.0276 120 ALA B CA 2579 C C . ALA B 120 ? 0.5785 0.3506 0.3713 0.1313 0.0283 -0.0325 120 ALA B C 2580 O O . ALA B 120 ? 0.6180 0.3641 0.3951 0.1243 0.0274 -0.0318 120 ALA B O 2581 C CB . ALA B 120 ? 0.4946 0.3576 0.3443 0.1478 0.0307 -0.0286 120 ALA B CB 2582 N N . SER B 121 ? 0.5815 0.3487 0.3783 0.1193 0.0278 -0.0370 121 SER B N 2583 C CA . SER B 121 ? 0.6097 0.3435 0.3928 0.0958 0.0258 -0.0409 121 SER B CA 2584 C C . SER B 121 ? 0.4966 0.2555 0.3144 0.0791 0.0264 -0.0448 121 SER B C 2585 O O . SER B 121 ? 0.4354 0.2328 0.2840 0.0849 0.0280 -0.0451 121 SER B O 2586 C CB . SER B 121 ? 0.5664 0.2719 0.3214 0.0928 0.0243 -0.0427 121 SER B CB 2587 O OG . SER B 121 ? 0.7520 0.4255 0.4670 0.1075 0.0235 -0.0390 121 SER B OG 2588 N N . THR B 122 ? 0.5040 0.2436 0.3157 0.0569 0.0248 -0.0465 122 THR B N 2589 C CA . THR B 122 ? 0.4144 0.1900 0.2634 0.0361 0.0235 -0.0463 122 THR B CA 2590 C C . THR B 122 ? 0.4497 0.2265 0.2985 0.0266 0.0223 -0.0491 122 THR B C 2591 O O . THR B 122 ? 0.5699 0.3069 0.3824 0.0200 0.0208 -0.0515 122 THR B O 2592 C CB . THR B 122 ? 0.5504 0.3160 0.3954 0.0147 0.0217 -0.0451 122 THR B CB 2593 O OG1 . THR B 122 ? 0.6932 0.4599 0.5404 0.0237 0.0229 -0.0425 122 THR B OG1 2594 C CG2 . THR B 122 ? 0.5734 0.3794 0.4549 -0.0031 0.0208 -0.0444 122 THR B CG2 2595 N N . LYS B 123 ? 0.4458 0.2654 0.3318 0.0255 0.0226 -0.0486 123 LYS B N 2596 C CA . LYS B 123 ? 0.4704 0.2963 0.3597 0.0178 0.0215 -0.0507 123 LYS B CA 2597 C C . LYS B 123 ? 0.3749 0.2424 0.3027 0.0047 0.0207 -0.0491 123 LYS B C 2598 O O . LYS B 123 ? 0.2389 0.1366 0.1948 0.0114 0.0217 -0.0470 123 LYS B O 2599 C CB . LYS B 123 ? 0.4539 0.2846 0.3407 0.0381 0.0233 -0.0517 123 LYS B CB 2600 C CG . LYS B 123 ? 0.5295 0.3634 0.4163 0.0310 0.0222 -0.0541 123 LYS B CG 2601 C CD . LYS B 123 ? 0.6308 0.4726 0.5151 0.0520 0.0242 -0.0547 123 LYS B CD 2602 C CE . LYS B 123 ? 0.6379 0.4856 0.5247 0.0443 0.0230 -0.0570 123 LYS B CE 2603 N NZ . LYS B 123 ? 0.6287 0.5148 0.5536 0.0288 0.0215 -0.0550 123 LYS B NZ 2604 N N . GLY B 124 ? 0.4089 0.2769 0.3347 -0.0137 0.0187 -0.0499 124 GLY B N 2605 C CA . GLY B 124 ? 0.2392 0.1453 0.1967 -0.0235 0.0181 -0.0481 124 GLY B CA 2606 C C . GLY B 124 ? 0.4100 0.3382 0.3859 -0.0157 0.0183 -0.0486 124 GLY B C 2607 O O . GLY B 124 ? 0.5295 0.4440 0.4916 -0.0070 0.0187 -0.0506 124 GLY B O 2608 N N . PRO B 125 ? 0.3197 0.2808 0.3243 -0.0177 0.0182 -0.0466 125 PRO B N 2609 C CA . PRO B 125 ? 0.2031 0.1841 0.2241 -0.0112 0.0181 -0.0464 125 PRO B CA 2610 C C . PRO B 125 ? 0.2130 0.2023 0.2347 -0.0215 0.0166 -0.0470 125 PRO B C 2611 O O . PRO B 125 ? 0.2975 0.2912 0.3165 -0.0352 0.0154 -0.0462 125 PRO B O 2612 C CB . PRO B 125 ? 0.2301 0.2353 0.2754 -0.0081 0.0184 -0.0438 125 PRO B CB 2613 C CG . PRO B 125 ? 0.1775 0.1850 0.2230 -0.0179 0.0183 -0.0428 125 PRO B CG 2614 C CD . PRO B 125 ? 0.1964 0.1759 0.2171 -0.0234 0.0183 -0.0443 125 PRO B CD 2615 N N . SER B 126 ? 0.1705 0.1655 0.1957 -0.0152 0.0164 -0.0477 126 SER B N 2616 C CA . SER B 126 ? 0.2005 0.2120 0.2338 -0.0224 0.0150 -0.0473 126 SER B CA 2617 C C . SER B 126 ? 0.2236 0.2629 0.2821 -0.0189 0.0148 -0.0442 126 SER B C 2618 O O . SER B 126 ? 0.2054 0.2487 0.2730 -0.0099 0.0155 -0.0430 126 SER B O 2619 C CB . SER B 126 ? 0.2030 0.2072 0.2270 -0.0171 0.0149 -0.0494 126 SER B CB 2620 O OG . SER B 126 ? 0.3430 0.3147 0.3371 -0.0176 0.0151 -0.0526 126 SER B OG 2621 N N . VAL B 127 ? 0.1655 0.2232 0.2321 -0.0261 0.0137 -0.0426 127 VAL B N 2622 C CA . VAL B 127 ? 0.1032 0.1825 0.1875 -0.0209 0.0136 -0.0396 127 VAL B CA 2623 C C . VAL B 127 ? 0.0984 0.1904 0.1876 -0.0210 0.0122 -0.0388 127 VAL B C 2624 O O . VAL B 127 ? 0.2113 0.3119 0.2968 -0.0298 0.0113 -0.0387 127 VAL B O 2625 C CB . VAL B 127 ? 0.1740 0.2684 0.2633 -0.0248 0.0140 -0.0373 127 VAL B CB 2626 C CG1 . VAL B 127 ? 0.2202 0.3297 0.3216 -0.0148 0.0141 -0.0346 127 VAL B CG1 2627 C CG2 . VAL B 127 ? 0.1068 0.1876 0.1896 -0.0265 0.0152 -0.0382 127 VAL B CG2 2628 N N . PHE B 128 ? 0.0898 0.1838 0.1858 -0.0128 0.0118 -0.0377 128 PHE B N 2629 C CA . PHE B 128 ? 0.2018 0.3063 0.3017 -0.0122 0.0104 -0.0365 128 PHE B CA 2630 C C . PHE B 128 ? 0.1460 0.2604 0.2538 -0.0056 0.0096 -0.0330 128 PHE B C 2631 O O . PHE B 128 ? 0.2152 0.3221 0.3234 -0.0007 0.0097 -0.0320 128 PHE B O 2632 C CB . PHE B 128 ? 0.1306 0.2272 0.2266 -0.0093 0.0103 -0.0378 128 PHE B CB 2633 C CG . PHE B 128 ? 0.2111 0.2924 0.2934 -0.0114 0.0114 -0.0415 128 PHE B CG 2634 C CD1 . PHE B 128 ? 0.1641 0.2414 0.2360 -0.0197 0.0108 -0.0436 128 PHE B CD1 2635 C CD2 . PHE B 128 ? 0.2051 0.2745 0.2812 -0.0048 0.0128 -0.0426 128 PHE B CD2 2636 C CE1 . PHE B 128 ? 0.1612 0.2157 0.2127 -0.0212 0.0115 -0.0472 128 PHE B CE1 2637 C CE2 . PHE B 128 ? 0.2127 0.2631 0.2706 -0.0033 0.0139 -0.0459 128 PHE B CE2 2638 C CZ . PHE B 128 ? 0.2385 0.2778 0.2821 -0.0114 0.0132 -0.0485 128 PHE B CZ 2639 N N . PRO B 129 ? 0.1358 0.2645 0.2467 -0.0051 0.0085 -0.0309 129 PRO B N 2640 C CA . PRO B 129 ? 0.1196 0.2527 0.2321 0.0038 0.0077 -0.0274 129 PRO B CA 2641 C C . PRO B 129 ? 0.1223 0.2431 0.2314 0.0068 0.0058 -0.0260 129 PRO B C 2642 O O . PRO B 129 ? 0.2097 0.3304 0.3192 0.0027 0.0050 -0.0267 129 PRO B O 2643 C CB . PRO B 129 ? 0.0762 0.2318 0.1918 0.0036 0.0072 -0.0252 129 PRO B CB 2644 C CG . PRO B 129 ? 0.0757 0.2329 0.1907 -0.0066 0.0066 -0.0276 129 PRO B CG 2645 C CD . PRO B 129 ? 0.1158 0.2560 0.2257 -0.0123 0.0078 -0.0315 129 PRO B CD 2646 N N . LEU B 130 ? 0.1094 0.2191 0.2123 0.0135 0.0050 -0.0237 130 LEU B N 2647 C CA . LEU B 130 ? 0.1236 0.2195 0.2179 0.0143 0.0023 -0.0211 130 LEU B CA 2648 C C . LEU B 130 ? 0.1497 0.2461 0.2367 0.0236 0.0013 -0.0179 130 LEU B C 2649 O O . LEU B 130 ? 0.1730 0.2576 0.2491 0.0329 0.0013 -0.0164 130 LEU B O 2650 C CB . LEU B 130 ? 0.1492 0.2258 0.2348 0.0131 0.0015 -0.0207 130 LEU B CB 2651 C CG . LEU B 130 ? 0.1416 0.2203 0.2332 0.0062 0.0024 -0.0228 130 LEU B CG 2652 C CD1 . LEU B 130 ? 0.1864 0.2496 0.2694 0.0048 0.0014 -0.0219 130 LEU B CD1 2653 C CD2 . LEU B 130 ? 0.2851 0.3720 0.3795 0.0002 0.0013 -0.0221 130 LEU B CD2 2654 N N . ALA B 131 ? 0.1323 0.2421 0.2234 0.0225 0.0005 -0.0168 131 ALA B N 2655 C CA . ALA B 131 ? 0.1980 0.3155 0.2842 0.0329 0.0000 -0.0134 131 ALA B CA 2656 C C . ALA B 131 ? 0.2759 0.3670 0.3424 0.0389 -0.0030 -0.0099 131 ALA B C 2657 O O . ALA B 131 ? 0.3311 0.4077 0.3920 0.0297 -0.0054 -0.0092 131 ALA B O 2658 C CB . ALA B 131 ? 0.1345 0.2747 0.2304 0.0281 -0.0003 -0.0132 131 ALA B CB 2659 N N . PRO B 132 ? 0.3023 0.3862 0.3549 0.0543 -0.0029 -0.0071 132 PRO B N 2660 C CA . PRO B 132 ? 0.3119 0.3639 0.3385 0.0608 -0.0061 -0.0035 132 PRO B CA 2661 C C . PRO B 132 ? 0.3198 0.3790 0.3458 0.0598 -0.0082 -0.0005 132 PRO B C 2662 O O . PRO B 132 ? 0.3425 0.4340 0.3869 0.0587 -0.0068 -0.0008 132 PRO B O 2663 C CB . PRO B 132 ? 0.3430 0.3873 0.3534 0.0820 -0.0045 -0.0018 132 PRO B CB 2664 C CG . PRO B 132 ? 0.1774 0.2656 0.2110 0.0868 -0.0007 -0.0026 132 PRO B CG 2665 C CD . PRO B 132 ? 0.2864 0.3905 0.3432 0.0673 0.0002 -0.0068 132 PRO B CD 2666 N N . SER B 133 ? 0.4858 0.5129 0.4877 0.0587 -0.0121 0.0028 133 SER B N 2667 C CA . SER B 133 ? 0.5731 0.6026 0.5704 0.0582 -0.0145 0.0064 133 SER B CA 2668 C C . SER B 133 ? 0.6130 0.6014 0.5728 0.0691 -0.0180 0.0111 133 SER B C 2669 O O . SER B 133 ? 0.6691 0.6443 0.6159 0.0636 -0.0215 0.0146 133 SER B O 2670 C CB . SER B 133 ? 0.5610 0.5969 0.5693 0.0375 -0.0164 0.0058 133 SER B CB 2671 O OG . SER B 133 ? 0.6801 0.6840 0.6677 0.0262 -0.0201 0.0076 133 SER B OG 2672 N N . SER B 138 ? 0.8876 0.5921 0.6273 0.0660 -0.0372 0.0191 138 SER B N 2673 C CA . SER B 138 ? 1.0368 0.6728 0.7198 0.0546 -0.0438 0.0219 138 SER B CA 2674 C C . SER B 138 ? 1.0175 0.6012 0.6522 0.0844 -0.0432 0.0217 138 SER B C 2675 O O . SER B 138 ? 0.9653 0.5451 0.5985 0.0964 -0.0399 0.0177 138 SER B O 2676 C CB . SER B 138 ? 1.1500 0.7847 0.8378 0.0277 -0.0460 0.0201 138 SER B CB 2677 O OG . SER B 138 ? 1.1585 0.8265 0.8729 -0.0013 -0.0484 0.0223 138 SER B OG 2678 N N . GLY B 139 ? 1.0429 0.5874 0.6371 0.0975 -0.0462 0.0259 139 GLY B N 2679 C CA . GLY B 139 ? 1.0568 0.5721 0.6129 0.1209 -0.0432 0.0210 139 GLY B CA 2680 C C . GLY B 139 ? 1.0488 0.6024 0.6277 0.1537 -0.0349 0.0177 139 GLY B C 2681 O O . GLY B 139 ? 1.1933 0.7304 0.7497 0.1652 -0.0322 0.0132 139 GLY B O 2682 N N . GLY B 140 ? 0.8377 0.4459 0.4603 0.1675 -0.0311 0.0202 140 GLY B N 2683 C CA . GLY B 140 ? 0.7770 0.4329 0.4251 0.1942 -0.0232 0.0176 140 GLY B CA 2684 C C . GLY B 140 ? 0.6924 0.3771 0.3728 0.1897 -0.0201 0.0141 140 GLY B C 2685 O O . GLY B 140 ? 0.6143 0.3363 0.3109 0.2082 -0.0138 0.0121 140 GLY B O 2686 N N . THR B 141 ? 0.4535 0.3416 0.4663 0.0554 -0.0287 0.0042 141 THR B N 2687 C CA . THR B 141 ? 0.3811 0.2907 0.4089 0.0503 -0.0254 -0.0013 141 THR B CA 2688 C C . THR B 141 ? 0.3080 0.2246 0.3312 0.0464 -0.0204 0.0021 141 THR B C 2689 O O . THR B 141 ? 0.3669 0.2743 0.3830 0.0421 -0.0132 0.0091 141 THR B O 2690 C CB . THR B 141 ? 0.3847 0.2936 0.4220 0.0431 -0.0218 -0.0027 141 THR B CB 2691 O OG1 . THR B 141 ? 0.5972 0.4968 0.6355 0.0478 -0.0267 -0.0072 141 THR B OG1 2692 C CG2 . THR B 141 ? 0.2098 0.1382 0.2586 0.0382 -0.0192 -0.0075 141 THR B CG2 2693 N N . ALA B 142 ? 0.2293 0.1614 0.2576 0.0481 -0.0234 -0.0025 142 ALA B N 2694 C CA . ALA B 142 ? 0.2925 0.2299 0.3154 0.0454 -0.0198 -0.0007 142 ALA B CA 2695 C C . ALA B 142 ? 0.2977 0.2527 0.3357 0.0390 -0.0151 -0.0040 142 ALA B C 2696 O O . ALA B 142 ? 0.3246 0.2906 0.3754 0.0385 -0.0170 -0.0094 142 ALA B O 2697 C CB . ALA B 142 ? 0.2149 0.1538 0.2314 0.0513 -0.0287 -0.0031 142 ALA B CB 2698 N N . ALA B 143 ? 0.1857 0.1418 0.2205 0.0349 -0.0083 -0.0005 143 ALA B N 2699 C CA . ALA B 143 ? 0.2109 0.1820 0.2584 0.0294 -0.0045 -0.0027 143 ALA B CA 2700 C C . ALA B 143 ? 0.2064 0.1828 0.2487 0.0306 -0.0051 -0.0040 143 ALA B C 2701 O O . ALA B 143 ? 0.3116 0.2768 0.3379 0.0335 -0.0032 -0.0006 143 ALA B O 2702 C CB . ALA B 143 ? 0.1674 0.1367 0.2210 0.0236 0.0034 0.0026 143 ALA B CB 2703 N N . LEU B 144 ? 0.1709 0.1616 0.2242 0.0287 -0.0074 -0.0089 144 LEU B N 2704 C CA . LEU B 144 ? 0.1933 0.1887 0.2441 0.0286 -0.0088 -0.0105 144 LEU B CA 2705 C C . LEU B 144 ? 0.1903 0.1988 0.2536 0.0236 -0.0055 -0.0123 144 LEU B C 2706 O O . LEU B 144 ? 0.1213 0.1353 0.1937 0.0212 -0.0044 -0.0135 144 LEU B O 2707 C CB . LEU B 144 ? 0.1997 0.1973 0.2512 0.0323 -0.0182 -0.0143 144 LEU B CB 2708 C CG . LEU B 144 ? 0.1368 0.1477 0.2058 0.0325 -0.0209 -0.0183 144 LEU B CG 2709 C CD1 . LEU B 144 ? 0.1497 0.1742 0.2305 0.0290 -0.0210 -0.0209 144 LEU B CD1 2710 C CD2 . LEU B 144 ? 0.1677 0.1752 0.2378 0.0386 -0.0291 -0.0194 144 LEU B CD2 2711 N N . GLY B 145 ? 0.1304 0.1409 0.1912 0.0226 -0.0048 -0.0126 145 GLY B N 2712 C CA . GLY B 145 ? 0.1145 0.1348 0.1848 0.0184 -0.0021 -0.0134 145 GLY B CA 2713 C C . GLY B 145 ? 0.1692 0.1894 0.2357 0.0181 -0.0030 -0.0143 145 GLY B C 2714 O O . GLY B 145 ? 0.1259 0.1385 0.1825 0.0208 -0.0073 -0.0154 145 GLY B O 2715 N N . CYS B 146 ? 0.1731 0.1997 0.2463 0.0148 -0.0002 -0.0140 146 CYS B N 2716 C CA . CYS B 146 ? 0.2138 0.2393 0.2843 0.0140 -0.0008 -0.0147 146 CYS B CA 2717 C C . CYS B 146 ? 0.1989 0.2239 0.2709 0.0137 0.0051 -0.0117 146 CYS B C 2718 O O . CYS B 146 ? 0.1384 0.1695 0.2196 0.0117 0.0070 -0.0100 146 CYS B O 2719 C CB . CYS B 146 ? 0.1008 0.1351 0.1805 0.0104 -0.0039 -0.0170 146 CYS B CB 2720 S SG . CYS B 146 ? 0.3159 0.3523 0.3999 0.0108 -0.0116 -0.0201 146 CYS B SG 2721 N N . LEU B 147 ? 0.2259 0.2429 0.2890 0.0162 0.0070 -0.0113 147 LEU B N 2722 C CA . LEU B 147 ? 0.1163 0.1332 0.1828 0.0174 0.0130 -0.0084 147 LEU B CA 2723 C C . LEU B 147 ? 0.2522 0.2704 0.3207 0.0152 0.0097 -0.0101 147 LEU B C 2724 O O . LEU B 147 ? 0.2532 0.2631 0.3120 0.0160 0.0063 -0.0127 147 LEU B O 2725 C CB . LEU B 147 ? 0.1362 0.1407 0.1895 0.0234 0.0199 -0.0065 147 LEU B CB 2726 C CG . LEU B 147 ? 0.1457 0.1502 0.2043 0.0266 0.0281 -0.0031 147 LEU B CG 2727 C CD1 . LEU B 147 ? 0.1597 0.1770 0.2399 0.0242 0.0320 0.0015 147 LEU B CD1 2728 C CD2 . LEU B 147 ? 0.1576 0.1462 0.1975 0.0342 0.0366 -0.0020 147 LEU B CD2 2729 N N . VAL B 148 ? 0.2832 0.3097 0.3630 0.0124 0.0095 -0.0084 148 VAL B N 2730 C CA . VAL B 148 ? 0.1583 0.1849 0.2393 0.0103 0.0069 -0.0087 148 VAL B CA 2731 C C . VAL B 148 ? 0.2215 0.2460 0.3061 0.0138 0.0106 -0.0057 148 VAL B C 2732 O O . VAL B 148 ? 0.3093 0.3408 0.4054 0.0137 0.0111 -0.0028 148 VAL B O 2733 C CB . VAL B 148 ? 0.1802 0.2142 0.2667 0.0058 0.0039 -0.0086 148 VAL B CB 2734 C CG1 . VAL B 148 ? 0.1660 0.1974 0.2507 0.0035 0.0022 -0.0080 148 VAL B CG1 2735 C CG2 . VAL B 148 ? 0.2118 0.2495 0.2981 0.0041 0.0024 -0.0112 148 VAL B CG2 2736 N N . LYS B 149 ? 0.1184 0.1327 0.1943 0.0173 0.0121 -0.0066 149 LYS B N 2737 C CA . LYS B 149 ? 0.1254 0.1362 0.2039 0.0234 0.0183 -0.0040 149 LYS B CA 2738 C C . LYS B 149 ? 0.2041 0.2074 0.2795 0.0246 0.0160 -0.0043 149 LYS B C 2739 O O . LYS B 149 ? 0.2527 0.2475 0.3179 0.0218 0.0111 -0.0073 149 LYS B O 2740 C CB . LYS B 149 ? 0.2876 0.2877 0.3531 0.0295 0.0253 -0.0047 149 LYS B CB 2741 C CG . LYS B 149 ? 0.3656 0.3647 0.4370 0.0370 0.0359 -0.0008 149 LYS B CG 2742 C CD . LYS B 149 ? 0.3890 0.3750 0.4424 0.0435 0.0450 -0.0010 149 LYS B CD 2743 C CE . LYS B 149 ? 0.4005 0.3878 0.4633 0.0513 0.0592 0.0042 149 LYS B CE 2744 N NZ . LYS B 149 ? 0.3466 0.3293 0.4114 0.0567 0.0608 0.0038 149 LYS B NZ 2745 N N . ASP B 150 ? 0.2200 0.2265 0.3066 0.0287 0.0189 -0.0008 150 ASP B N 2746 C CA . ASP B 150 ? 0.2643 0.2612 0.3478 0.0327 0.0184 -0.0004 150 ASP B CA 2747 C C . ASP B 150 ? 0.2142 0.2082 0.2940 0.0264 0.0099 -0.0008 150 ASP B C 2748 O O . ASP B 150 ? 0.3124 0.2934 0.3801 0.0253 0.0074 -0.0032 150 ASP B O 2749 C CB . ASP B 150 ? 0.2188 0.1983 0.2844 0.0390 0.0234 -0.0038 150 ASP B CB 2750 C CG . ASP B 150 ? 0.2105 0.1902 0.2770 0.0469 0.0350 -0.0021 150 ASP B CG 2751 O OD1 . ASP B 150 ? 0.3090 0.3028 0.3966 0.0487 0.0399 0.0028 150 ASP B OD1 2752 O OD2 . ASP B 150 ? 0.3662 0.3307 0.4120 0.0512 0.0391 -0.0053 150 ASP B OD2 2753 N N . TYR B 151 ? 0.2166 0.2209 0.3059 0.0222 0.0055 0.0019 151 TYR B N 2754 C CA . TYR B 151 ? 0.2840 0.2845 0.3680 0.0171 -0.0004 0.0030 151 TYR B CA 2755 C C . TYR B 151 ? 0.3258 0.3288 0.4176 0.0193 -0.0048 0.0074 151 TYR B C 2756 O O . TYR B 151 ? 0.3551 0.3669 0.4611 0.0230 -0.0048 0.0092 151 TYR B O 2757 C CB . TYR B 151 ? 0.1284 0.1348 0.2091 0.0100 -0.0019 0.0017 151 TYR B CB 2758 C CG . TYR B 151 ? 0.1190 0.1365 0.2070 0.0092 -0.0032 0.0024 151 TYR B CG 2759 C CD1 . TYR B 151 ? 0.1111 0.1355 0.2047 0.0102 -0.0002 0.0007 151 TYR B CD1 2760 C CD2 . TYR B 151 ? 0.1219 0.1399 0.2086 0.0075 -0.0083 0.0048 151 TYR B CD2 2761 C CE1 . TYR B 151 ? 0.1906 0.2228 0.2910 0.0089 -0.0023 0.0011 151 TYR B CE1 2762 C CE2 . TYR B 151 ? 0.1605 0.1851 0.2516 0.0067 -0.0114 0.0046 151 TYR B CE2 2763 C CZ . TYR B 151 ? 0.2119 0.2441 0.3113 0.0070 -0.0085 0.0027 151 TYR B CZ 2764 O OH . TYR B 151 ? 0.1344 0.1712 0.2386 0.0056 -0.0126 0.0023 151 TYR B OH 2765 N N . PHE B 152 ? 0.2670 0.2613 0.3502 0.0167 -0.0092 0.0095 152 PHE B N 2766 C CA . PHE B 152 ? 0.2229 0.2155 0.3085 0.0189 -0.0158 0.0138 152 PHE B CA 2767 C C . PHE B 152 ? 0.2285 0.2091 0.2980 0.0144 -0.0187 0.0164 152 PHE B C 2768 O O . PHE B 152 ? 0.2200 0.1908 0.2820 0.0120 -0.0157 0.0160 152 PHE B O 2769 C CB . PHE B 152 ? 0.2087 0.1985 0.3049 0.0273 -0.0158 0.0157 152 PHE B CB 2770 C CG . PHE B 152 ? 0.2646 0.2551 0.3685 0.0308 -0.0248 0.0203 152 PHE B CG 2771 C CD1 . PHE B 152 ? 0.1830 0.1592 0.2748 0.0313 -0.0307 0.0237 152 PHE B CD1 2772 C CD2 . PHE B 152 ? 0.1955 0.1999 0.3194 0.0331 -0.0287 0.0217 152 PHE B CD2 2773 C CE1 . PHE B 152 ? 0.2755 0.2504 0.3725 0.0352 -0.0412 0.0281 152 PHE B CE1 2774 C CE2 . PHE B 152 ? 0.2257 0.2304 0.3584 0.0362 -0.0400 0.0257 152 PHE B CE2 2775 C CZ . PHE B 152 ? 0.3583 0.3478 0.4763 0.0377 -0.0468 0.0288 152 PHE B CZ 2776 N N . PRO B 153 ? 0.1994 0.1788 0.2625 0.0131 -0.0246 0.0193 153 PRO B N 2777 C CA . PRO B 153 ? 0.1679 0.1566 0.2393 0.0148 -0.0309 0.0191 153 PRO B CA 2778 C C . PRO B 153 ? 0.2220 0.2174 0.2888 0.0100 -0.0284 0.0158 153 PRO B C 2779 O O . PRO B 153 ? 0.2378 0.2331 0.2979 0.0059 -0.0211 0.0139 153 PRO B O 2780 C CB . PRO B 153 ? 0.3205 0.2977 0.3806 0.0166 -0.0408 0.0237 153 PRO B CB 2781 C CG . PRO B 153 ? 0.3254 0.2888 0.3639 0.0122 -0.0357 0.0258 153 PRO B CG 2782 C CD . PRO B 153 ? 0.1913 0.1561 0.2361 0.0103 -0.0266 0.0235 153 PRO B CD 2783 N N . GLU B 154 ? 0.2436 0.2444 0.3158 0.0106 -0.0353 0.0152 154 GLU B N 2784 C CA . GLU B 154 ? 0.2017 0.2039 0.2646 0.0070 -0.0349 0.0121 154 GLU B CA 2785 C C . GLU B 154 ? 0.2973 0.2858 0.3346 0.0051 -0.0341 0.0138 154 GLU B C 2786 O O . GLU B 154 ? 0.3471 0.3242 0.3742 0.0066 -0.0378 0.0180 154 GLU B O 2787 C CB . GLU B 154 ? 0.2981 0.3046 0.3708 0.0079 -0.0451 0.0112 154 GLU B CB 2788 C CG . GLU B 154 ? 0.2223 0.2434 0.3197 0.0082 -0.0419 0.0098 154 GLU B CG 2789 C CD . GLU B 154 ? 0.3505 0.3748 0.4447 0.0049 -0.0391 0.0057 154 GLU B CD 2790 O OE1 . GLU B 154 ? 0.4265 0.4514 0.5261 0.0037 -0.0476 0.0047 154 GLU B OE1 2791 O OE2 . GLU B 154 ? 0.1985 0.2239 0.2857 0.0035 -0.0296 0.0035 154 GLU B OE2 2792 N N . PRO B 155 ? 0.3155 0.3038 0.3417 0.0023 -0.0281 0.0112 155 PRO B N 2793 C CA . PRO B 155 ? 0.2874 0.2865 0.3226 0.0010 -0.0240 0.0064 155 PRO B CA 2794 C C . PRO B 155 ? 0.3201 0.3267 0.3625 -0.0014 -0.0133 0.0051 155 PRO B C 2795 O O . PRO B 155 ? 0.4364 0.4397 0.4773 -0.0030 -0.0090 0.0077 155 PRO B O 2796 C CB . PRO B 155 ? 0.1886 0.1787 0.2030 0.0011 -0.0248 0.0047 155 PRO B CB 2797 C CG . PRO B 155 ? 0.1979 0.1757 0.1924 0.0006 -0.0198 0.0090 155 PRO B CG 2798 C CD . PRO B 155 ? 0.3146 0.2890 0.3149 0.0015 -0.0252 0.0134 155 PRO B CD 2799 N N . VAL B 156 ? 0.2277 0.2431 0.2782 -0.0018 -0.0105 0.0013 156 VAL B N 2800 C CA . VAL B 156 ? 0.2574 0.2793 0.3136 -0.0037 -0.0027 -0.0005 156 VAL B CA 2801 C C . VAL B 156 ? 0.1949 0.2202 0.2485 -0.0033 -0.0002 -0.0039 156 VAL B C 2802 O O . VAL B 156 ? 0.3764 0.4015 0.4302 -0.0017 -0.0051 -0.0060 156 VAL B O 2803 C CB . VAL B 156 ? 0.3298 0.3574 0.3996 -0.0030 -0.0026 -0.0016 156 VAL B CB 2804 C CG1 . VAL B 156 ? 0.2649 0.2975 0.3430 -0.0007 -0.0053 -0.0033 156 VAL B CG1 2805 C CG2 . VAL B 156 ? 0.4290 0.4605 0.5031 -0.0051 0.0021 -0.0034 156 VAL B CG2 2806 N N . THR B 157 ? 0.1827 0.2106 0.2354 -0.0046 0.0073 -0.0043 157 THR B N 2807 C CA . THR B 157 ? 0.2097 0.2406 0.2606 -0.0029 0.0112 -0.0075 157 THR B CA 2808 C C . THR B 157 ? 0.2217 0.2632 0.2888 -0.0029 0.0125 -0.0099 157 THR B C 2809 O O . THR B 157 ? 0.2696 0.3154 0.3466 -0.0053 0.0132 -0.0088 157 THR B O 2810 C CB . THR B 157 ? 0.2019 0.2291 0.2421 -0.0028 0.0203 -0.0057 157 THR B CB 2811 O OG1 . THR B 157 ? 0.3705 0.4023 0.4207 -0.0067 0.0258 -0.0019 157 THR B OG1 2812 C CG2 . THR B 157 ? 0.2614 0.2735 0.2782 -0.0012 0.0179 -0.0039 157 THR B CG2 2813 N N . VAL B 158 ? 0.2164 0.2595 0.2844 -0.0002 0.0114 -0.0134 158 VAL B N 2814 C CA . VAL B 158 ? 0.1937 0.2443 0.2740 0.0008 0.0113 -0.0155 158 VAL B CA 2815 C C . VAL B 158 ? 0.2746 0.3265 0.3538 0.0042 0.0152 -0.0183 158 VAL B C 2816 O O . VAL B 158 ? 0.3579 0.4028 0.4274 0.0065 0.0131 -0.0206 158 VAL B O 2817 C CB . VAL B 158 ? 0.1401 0.1893 0.2235 0.0015 0.0057 -0.0160 158 VAL B CB 2818 C CG1 . VAL B 158 ? 0.0915 0.1447 0.1822 0.0034 0.0052 -0.0179 158 VAL B CG1 2819 C CG2 . VAL B 158 ? 0.1237 0.1712 0.2086 -0.0002 0.0037 -0.0134 158 VAL B CG2 2820 N N . SER B 159 ? 0.2220 0.2824 0.3124 0.0048 0.0202 -0.0184 159 SER B N 2821 C CA . SER B 159 ? 0.2207 0.2846 0.3153 0.0095 0.0242 -0.0211 159 SER B CA 2822 C C . SER B 159 ? 0.3192 0.3907 0.4295 0.0105 0.0193 -0.0222 159 SER B C 2823 O O . SER B 159 ? 0.0934 0.1661 0.2089 0.0074 0.0137 -0.0210 159 SER B O 2824 C CB . SER B 159 ? 0.2097 0.2782 0.3070 0.0106 0.0354 -0.0195 159 SER B CB 2825 O OG . SER B 159 ? 0.3169 0.3955 0.4317 0.0060 0.0373 -0.0159 159 SER B OG 2826 N N . TRP B 160 ? 0.2883 0.3626 0.4041 0.0157 0.0210 -0.0246 160 TRP B N 2827 C CA . TRP B 160 ? 0.2394 0.3185 0.3678 0.0180 0.0148 -0.0256 160 TRP B CA 2828 C C . TRP B 160 ? 0.0996 0.1907 0.2470 0.0218 0.0197 -0.0260 160 TRP B C 2829 O O . TRP B 160 ? 0.2344 0.3250 0.3792 0.0268 0.0279 -0.0275 160 TRP B O 2830 C CB . TRP B 160 ? 0.1548 0.2238 0.2727 0.0214 0.0097 -0.0277 160 TRP B CB 2831 C CG . TRP B 160 ? 0.2457 0.3066 0.3537 0.0178 0.0045 -0.0262 160 TRP B CG 2832 C CD1 . TRP B 160 ? 0.0984 0.1523 0.1955 0.0152 0.0049 -0.0255 160 TRP B CD1 2833 C CD2 . TRP B 160 ? 0.3079 0.3668 0.4165 0.0171 -0.0014 -0.0248 160 TRP B CD2 2834 N NE1 . TRP B 160 ? 0.0948 0.1450 0.1898 0.0130 0.0013 -0.0233 160 TRP B NE1 2835 C CE2 . TRP B 160 ? 0.1920 0.2436 0.2911 0.0145 -0.0017 -0.0229 160 TRP B CE2 2836 C CE3 . TRP B 160 ? 0.0955 0.1565 0.2108 0.0189 -0.0070 -0.0250 160 TRP B CE3 2837 C CZ2 . TRP B 160 ? 0.1961 0.2420 0.2903 0.0144 -0.0044 -0.0210 160 TRP B CZ2 2838 C CZ3 . TRP B 160 ? 0.2604 0.3130 0.3666 0.0187 -0.0120 -0.0237 160 TRP B CZ3 2839 C CH2 . TRP B 160 ? 0.1835 0.2283 0.2783 0.0168 -0.0092 -0.0216 160 TRP B CH2 2840 N N . ASN B 161 ? 0.0942 0.1952 0.2611 0.0199 0.0144 -0.0247 161 ASN B N 2841 C CA . ASN B 161 ? 0.0949 0.2111 0.2882 0.0226 0.0178 -0.0240 161 ASN B CA 2842 C C . ASN B 161 ? 0.1470 0.2700 0.3455 0.0223 0.0333 -0.0217 161 ASN B C 2843 O O . ASN B 161 ? 0.2521 0.3820 0.4611 0.0287 0.0426 -0.0221 161 ASN B O 2844 C CB . ASN B 161 ? 0.0985 0.2149 0.2968 0.0312 0.0147 -0.0268 161 ASN B CB 2845 C CG . ASN B 161 ? 0.0975 0.2062 0.2905 0.0319 -0.0001 -0.0279 161 ASN B CG 2846 O OD1 . ASN B 161 ? 0.2565 0.3615 0.4453 0.0265 -0.0080 -0.0269 161 ASN B OD1 2847 N ND2 . ASN B 161 ? 0.1891 0.2927 0.3796 0.0392 -0.0035 -0.0298 161 ASN B ND2 2848 N N . SER B 162 ? 0.1300 0.2490 0.3189 0.0158 0.0369 -0.0189 162 SER B N 2849 C CA . SER B 162 ? 0.2469 0.3697 0.4380 0.0144 0.0519 -0.0151 162 SER B CA 2850 C C . SER B 162 ? 0.2905 0.4047 0.4617 0.0221 0.0633 -0.0172 162 SER B C 2851 O O . SER B 162 ? 0.3536 0.4735 0.5316 0.0256 0.0782 -0.0149 162 SER B O 2852 C CB . SER B 162 ? 0.3589 0.5012 0.5865 0.0124 0.0569 -0.0113 162 SER B CB 2853 O OG . SER B 162 ? 0.3708 0.5179 0.6151 0.0056 0.0430 -0.0106 162 SER B OG 2854 N N . GLY B 163 ? 0.2013 0.3004 0.3476 0.0248 0.0566 -0.0214 163 GLY B N 2855 C CA . GLY B 163 ? 0.1436 0.2295 0.2665 0.0317 0.0637 -0.0245 163 GLY B CA 2856 C C . GLY B 163 ? 0.2231 0.3091 0.3509 0.0405 0.0641 -0.0289 163 GLY B C 2857 O O . GLY B 163 ? 0.3105 0.3808 0.4150 0.0462 0.0661 -0.0330 163 GLY B O 2858 N N . ALA B 164 ? 0.1947 0.2960 0.3510 0.0422 0.0607 -0.0284 164 ALA B N 2859 C CA . ALA B 164 ? 0.1429 0.2442 0.3055 0.0517 0.0610 -0.0321 164 ALA B CA 2860 C C . ALA B 164 ? 0.3330 0.4188 0.4781 0.0529 0.0481 -0.0360 164 ALA B C 2861 O O . ALA B 164 ? 0.3672 0.4457 0.5080 0.0611 0.0486 -0.0397 164 ALA B O 2862 C CB . ALA B 164 ? 0.1328 0.2551 0.3333 0.0534 0.0588 -0.0299 164 ALA B CB 2863 N N . LEU B 165 ? 0.2180 0.2981 0.3537 0.0452 0.0375 -0.0349 165 LEU B N 2864 C CA . LEU B 165 ? 0.1323 0.1989 0.2548 0.0451 0.0268 -0.0370 165 LEU B CA 2865 C C . LEU B 165 ? 0.2642 0.3165 0.3631 0.0405 0.0254 -0.0377 165 LEU B C 2866 O O . LEU B 165 ? 0.2517 0.3060 0.3487 0.0336 0.0231 -0.0348 165 LEU B O 2867 C CB . LEU B 165 ? 0.1194 0.1911 0.2526 0.0412 0.0161 -0.0345 165 LEU B CB 2868 C CG . LEU B 165 ? 0.3107 0.3683 0.4307 0.0407 0.0074 -0.0349 165 LEU B CG 2869 C CD1 . LEU B 165 ? 0.1450 0.1936 0.2615 0.0485 0.0069 -0.0379 165 LEU B CD1 2870 C CD2 . LEU B 165 ? 0.3358 0.3957 0.4613 0.0382 -0.0011 -0.0322 165 LEU B CD2 2871 N N . THR B 166 ? 0.2996 0.3364 0.3812 0.0446 0.0255 -0.0416 166 THR B N 2872 C CA . THR B 166 ? 0.2814 0.3033 0.3422 0.0406 0.0215 -0.0428 166 THR B CA 2873 C C . THR B 166 ? 0.2879 0.2950 0.3410 0.0406 0.0122 -0.0451 166 THR B C 2874 O O . THR B 166 ? 0.3075 0.3068 0.3538 0.0347 0.0049 -0.0443 166 THR B O 2875 C CB . THR B 166 ? 0.2804 0.2927 0.3221 0.0447 0.0298 -0.0455 166 THR B CB 2876 O OG1 . THR B 166 ? 0.3452 0.3495 0.3814 0.0541 0.0349 -0.0501 166 THR B OG1 2877 C CG2 . THR B 166 ? 0.2467 0.2726 0.2962 0.0435 0.0405 -0.0416 166 THR B CG2 2878 N N . SER B 167 ? 0.2593 0.2628 0.3160 0.0472 0.0124 -0.0475 167 SER B N 2879 C CA . SER B 167 ? 0.2597 0.2470 0.3093 0.0473 0.0043 -0.0494 167 SER B CA 2880 C C . SER B 167 ? 0.3311 0.3222 0.3907 0.0405 -0.0025 -0.0442 167 SER B C 2881 O O . SER B 167 ? 0.3042 0.3062 0.3761 0.0414 -0.0021 -0.0411 167 SER B O 2882 C CB . SER B 167 ? 0.2934 0.2754 0.3447 0.0571 0.0066 -0.0527 167 SER B CB 2883 O OG . SER B 167 ? 0.4411 0.4038 0.4833 0.0572 -0.0011 -0.0546 167 SER B OG 2884 N N . GLY B 168 ? 0.3234 0.3048 0.3775 0.0340 -0.0088 -0.0431 168 GLY B N 2885 C CA . GLY B 168 ? 0.1619 0.1456 0.2249 0.0280 -0.0125 -0.0374 168 GLY B CA 2886 C C . GLY B 168 ? 0.2324 0.2289 0.3020 0.0225 -0.0108 -0.0333 168 GLY B C 2887 O O . GLY B 168 ? 0.2809 0.2803 0.3571 0.0195 -0.0111 -0.0284 168 GLY B O 2888 N N . VAL B 169 ? 0.1696 0.1719 0.2357 0.0219 -0.0084 -0.0349 169 VAL B N 2889 C CA . VAL B 169 ? 0.1309 0.1440 0.2026 0.0175 -0.0068 -0.0313 169 VAL B CA 2890 C C . VAL B 169 ? 0.2814 0.2899 0.3527 0.0119 -0.0121 -0.0296 169 VAL B C 2891 O O . VAL B 169 ? 0.3562 0.3544 0.4185 0.0113 -0.0169 -0.0327 169 VAL B O 2892 C CB . VAL B 169 ? 0.1296 0.1505 0.1988 0.0196 -0.0012 -0.0327 169 VAL B CB 2893 C CG1 . VAL B 169 ? 0.1196 0.1481 0.1923 0.0149 -0.0006 -0.0292 169 VAL B CG1 2894 C CG2 . VAL B 169 ? 0.1263 0.1553 0.2036 0.0245 0.0032 -0.0335 169 VAL B CG2 2895 N N . HIS B 170 ? 0.2311 0.2463 0.3122 0.0082 -0.0118 -0.0247 170 HIS B N 2896 C CA . HIS B 170 ? 0.2120 0.2267 0.2991 0.0032 -0.0163 -0.0221 170 HIS B CA 2897 C C . HIS B 170 ? 0.2401 0.2649 0.3322 0.0023 -0.0128 -0.0188 170 HIS B C 2898 O O . HIS B 170 ? 0.2232 0.2527 0.3213 0.0027 -0.0083 -0.0154 170 HIS B O 2899 C CB . HIS B 170 ? 0.2237 0.2346 0.3221 -0.0001 -0.0184 -0.0184 170 HIS B CB 2900 C CG . HIS B 170 ? 0.2637 0.2616 0.3577 -0.0004 -0.0241 -0.0216 170 HIS B CG 2901 N ND1 . HIS B 170 ? 0.2799 0.2679 0.3637 -0.0007 -0.0318 -0.0268 170 HIS B ND1 2902 C CD2 . HIS B 170 ? 0.2428 0.2329 0.3385 -0.0001 -0.0237 -0.0205 170 HIS B CD2 2903 C CE1 . HIS B 170 ? 0.2009 0.1754 0.2810 -0.0006 -0.0363 -0.0293 170 HIS B CE1 2904 N NE2 . HIS B 170 ? 0.2385 0.2146 0.3269 -0.0004 -0.0313 -0.0253 170 HIS B NE2 2905 N N . THR B 171 ? 0.1838 0.2091 0.2703 0.0017 -0.0149 -0.0198 171 THR B N 2906 C CA . THR B 171 ? 0.2303 0.2623 0.3210 0.0007 -0.0131 -0.0167 171 THR B CA 2907 C C . THR B 171 ? 0.2575 0.2892 0.3581 -0.0023 -0.0196 -0.0139 171 THR B C 2908 O O . THR B 171 ? 0.3477 0.3728 0.4426 -0.0035 -0.0276 -0.0157 171 THR B O 2909 C CB . THR B 171 ? 0.1980 0.2298 0.2772 0.0019 -0.0110 -0.0183 171 THR B CB 2910 O OG1 . THR B 171 ? 0.2670 0.3020 0.3438 0.0043 -0.0050 -0.0202 171 THR B OG1 2911 C CG2 . THR B 171 ? 0.1044 0.1406 0.1873 0.0007 -0.0101 -0.0149 171 THR B CG2 2912 N N . PHE B 172 ? 0.2254 0.2634 0.3407 -0.0029 -0.0164 -0.0094 172 PHE B N 2913 C CA . PHE B 172 ? 0.2546 0.2954 0.3870 -0.0056 -0.0217 -0.0057 172 PHE B CA 2914 C C . PHE B 172 ? 0.2412 0.2839 0.3738 -0.0051 -0.0263 -0.0047 172 PHE B C 2915 O O . PHE B 172 ? 0.2483 0.2917 0.3711 -0.0028 -0.0218 -0.0050 172 PHE B O 2916 C CB . PHE B 172 ? 0.0957 0.1427 0.2447 -0.0054 -0.0137 -0.0003 172 PHE B CB 2917 C CG . PHE B 172 ? 0.1783 0.2210 0.3287 -0.0066 -0.0108 0.0003 172 PHE B CG 2918 C CD1 . PHE B 172 ? 0.2238 0.2643 0.3881 -0.0111 -0.0169 0.0018 172 PHE B CD1 2919 C CD2 . PHE B 172 ? 0.1146 0.1540 0.2526 -0.0033 -0.0033 -0.0005 172 PHE B CD2 2920 C CE1 . PHE B 172 ? 0.1096 0.1439 0.2745 -0.0125 -0.0142 0.0029 172 PHE B CE1 2921 C CE2 . PHE B 172 ? 0.1036 0.1369 0.2410 -0.0038 -0.0013 0.0007 172 PHE B CE2 2922 C CZ . PHE B 172 ? 0.1093 0.1397 0.2598 -0.0084 -0.0060 0.0026 172 PHE B CZ 2923 N N . PRO B 173 ? 0.1559 0.1985 0.3002 -0.0074 -0.0366 -0.0032 173 PRO B N 2924 C CA . PRO B 173 ? 0.1119 0.1559 0.2585 -0.0062 -0.0422 -0.0012 173 PRO B CA 2925 C C . PRO B 173 ? 0.3309 0.3841 0.4898 -0.0031 -0.0324 0.0032 173 PRO B C 2926 O O . PRO B 173 ? 0.3459 0.4060 0.5210 -0.0026 -0.0244 0.0064 173 PRO B O 2927 C CB . PRO B 173 ? 0.1201 0.1640 0.2844 -0.0095 -0.0562 0.0003 173 PRO B CB 2928 C CG . PRO B 173 ? 0.1269 0.1630 0.2859 -0.0128 -0.0602 -0.0034 173 PRO B CG 2929 C CD . PRO B 173 ? 0.1415 0.1807 0.2970 -0.0116 -0.0457 -0.0035 173 PRO B CD 2930 N N . ALA B 174 ? 0.2889 0.3398 0.4377 -0.0004 -0.0325 0.0034 174 ALA B N 2931 C CA . ALA B 174 ? 0.2734 0.3291 0.4298 0.0035 -0.0242 0.0066 174 ALA B CA 2932 C C . ALA B 174 ? 0.2005 0.2653 0.3853 0.0050 -0.0263 0.0116 174 ALA B C 2933 O O . ALA B 174 ? 0.2105 0.2770 0.4078 0.0028 -0.0384 0.0128 174 ALA B O 2934 C CB . ALA B 174 ? 0.3100 0.3589 0.4495 0.0053 -0.0252 0.0059 174 ALA B CB 2935 N N . VAL B 175 ? 0.0931 0.1632 0.2886 0.0092 -0.0146 0.0147 175 VAL B N 2936 C CA . VAL B 175 ? 0.1748 0.2553 0.4003 0.0122 -0.0127 0.0204 175 VAL B CA 2937 C C . VAL B 175 ? 0.2226 0.3009 0.4451 0.0192 -0.0071 0.0216 175 VAL B C 2938 O O . VAL B 175 ? 0.2875 0.3568 0.4873 0.0215 0.0000 0.0187 175 VAL B O 2939 C CB . VAL B 175 ? 0.1875 0.2755 0.4314 0.0120 -0.0007 0.0242 175 VAL B CB 2940 C CG1 . VAL B 175 ? 0.0882 0.1750 0.3317 0.0049 -0.0064 0.0225 175 VAL B CG1 2941 C CG2 . VAL B 175 ? 0.2827 0.3645 0.5091 0.0172 0.0153 0.0236 175 VAL B CG2 2942 N N . LEU B 176 ? 0.2991 0.3849 0.5457 0.0227 -0.0115 0.0259 176 LEU B N 2943 C CA . LEU B 176 ? 0.2482 0.3311 0.4945 0.0304 -0.0073 0.0274 176 LEU B CA 2944 C C . LEU B 176 ? 0.2461 0.3340 0.5058 0.0367 0.0102 0.0308 176 LEU B C 2945 O O . LEU B 176 ? 0.3995 0.4950 0.6781 0.0351 0.0131 0.0347 176 LEU B O 2946 C CB . LEU B 176 ? 0.2219 0.3084 0.4855 0.0320 -0.0221 0.0304 176 LEU B CB 2947 C CG . LEU B 176 ? 0.2677 0.3470 0.5255 0.0397 -0.0220 0.0314 176 LEU B CG 2948 C CD1 . LEU B 176 ? 0.2598 0.3215 0.4790 0.0377 -0.0228 0.0268 176 LEU B CD1 2949 C CD2 . LEU B 176 ? 0.1273 0.2095 0.4014 0.0408 -0.0377 0.0347 176 LEU B CD2 2950 N N . GLN B 177 ? 0.2279 0.3053 0.4669 0.0423 0.0215 0.0283 177 GLN B N 2951 C CA . GLN B 177 ? 0.2199 0.2962 0.4617 0.0497 0.0391 0.0307 177 GLN B CA 2952 C C . GLN B 177 ? 0.2096 0.2860 0.4618 0.0570 0.0408 0.0333 177 GLN B C 2953 O O . GLN B 177 ? 0.1521 0.2283 0.4090 0.0579 0.0287 0.0332 177 GLN B O 2954 C CB . GLN B 177 ? 0.2035 0.2633 0.4119 0.0526 0.0480 0.0258 177 GLN B CB 2955 C CG . GLN B 177 ? 0.1214 0.1778 0.3120 0.0444 0.0446 0.0223 177 GLN B CG 2956 C CD . GLN B 177 ? 0.3047 0.3433 0.4606 0.0458 0.0472 0.0166 177 GLN B CD 2957 O OE1 . GLN B 177 ? 0.3626 0.3934 0.5051 0.0492 0.0575 0.0162 177 GLN B OE1 2958 N NE2 . GLN B 177 ? 0.4142 0.4452 0.5554 0.0430 0.0372 0.0125 177 GLN B NE2 2959 N N . SER B 178 ? 0.3539 0.4294 0.6084 0.0630 0.0563 0.0359 178 SER B N 2960 C CA . SER B 178 ? 0.3270 0.4030 0.5921 0.0710 0.0599 0.0382 178 SER B CA 2961 C C . SER B 178 ? 0.3123 0.3733 0.5578 0.0782 0.0567 0.0339 178 SER B C 2962 O O . SER B 178 ? 0.2964 0.3576 0.5515 0.0836 0.0525 0.0353 178 SER B O 2963 C CB . SER B 178 ? 0.3336 0.4086 0.5999 0.0770 0.0794 0.0415 178 SER B CB 2964 O OG . SER B 178 ? 0.3440 0.4019 0.5780 0.0814 0.0911 0.0377 178 SER B OG 2965 N N . SER B 179 ? 0.1640 0.2105 0.3826 0.0783 0.0579 0.0289 179 SER B N 2966 C CA . SER B 179 ? 0.1731 0.2010 0.3713 0.0836 0.0540 0.0249 179 SER B CA 2967 C C . SER B 179 ? 0.2469 0.2759 0.4471 0.0772 0.0353 0.0250 179 SER B C 2968 O O . SER B 179 ? 0.3109 0.3241 0.4940 0.0795 0.0303 0.0228 179 SER B O 2969 C CB . SER B 179 ? 0.1797 0.1896 0.3403 0.0797 0.0561 0.0184 179 SER B CB 2970 O OG . SER B 179 ? 0.1633 0.1807 0.3208 0.0680 0.0475 0.0172 179 SER B OG 2971 N N . GLY B 180 ? 0.1511 0.1954 0.3690 0.0694 0.0249 0.0277 180 GLY B N 2972 C CA . GLY B 180 ? 0.1490 0.1902 0.3603 0.0631 0.0077 0.0274 180 GLY B CA 2973 C C . GLY B 180 ? 0.2945 0.3262 0.4766 0.0534 0.0031 0.0227 180 GLY B C 2974 O O . GLY B 180 ? 0.3638 0.3897 0.5350 0.0487 -0.0085 0.0228 180 GLY B O 2975 N N . LEU B 181 ? 0.1686 0.1979 0.3377 0.0511 0.0121 0.0192 181 LEU B N 2976 C CA . LEU B 181 ? 0.1376 0.1608 0.2845 0.0425 0.0085 0.0151 181 LEU B CA 2977 C C . LEU B 181 ? 0.1626 0.1982 0.3179 0.0366 0.0078 0.0151 181 LEU B C 2978 O O . LEU B 181 ? 0.1553 0.2008 0.3284 0.0391 0.0145 0.0175 181 LEU B O 2979 C CB . LEU B 181 ? 0.3311 0.3401 0.4559 0.0441 0.0159 0.0106 181 LEU B CB 2980 C CG . LEU B 181 ? 0.2725 0.2652 0.3866 0.0502 0.0167 0.0096 181 LEU B CG 2981 C CD1 . LEU B 181 ? 0.1755 0.1520 0.2664 0.0512 0.0215 0.0043 181 LEU B CD1 2982 C CD2 . LEU B 181 ? 0.2239 0.2105 0.3326 0.0457 0.0060 0.0110 181 LEU B CD2 2983 N N . TYR B 182 ? 0.1852 0.2194 0.3282 0.0291 0.0007 0.0128 182 TYR B N 2984 C CA . TYR B 182 ? 0.1567 0.1996 0.3048 0.0238 -0.0011 0.0121 182 TYR B CA 2985 C C . TYR B 182 ? 0.1803 0.2208 0.3170 0.0226 0.0068 0.0089 182 TYR B C 2986 O O . TYR B 182 ? 0.2510 0.2820 0.3723 0.0240 0.0106 0.0062 182 TYR B O 2987 C CB . TYR B 182 ? 0.1113 0.1518 0.2492 0.0180 -0.0115 0.0109 182 TYR B CB 2988 C CG . TYR B 182 ? 0.1890 0.2308 0.3367 0.0189 -0.0224 0.0142 182 TYR B CG 2989 C CD1 . TYR B 182 ? 0.1438 0.1950 0.3114 0.0178 -0.0287 0.0159 182 TYR B CD1 2990 C CD2 . TYR B 182 ? 0.2218 0.2540 0.3591 0.0205 -0.0278 0.0157 182 TYR B CD2 2991 C CE1 . TYR B 182 ? 0.1221 0.1735 0.2992 0.0186 -0.0418 0.0186 182 TYR B CE1 2992 C CE2 . TYR B 182 ? 0.3601 0.3913 0.5039 0.0221 -0.0398 0.0189 182 TYR B CE2 2993 C CZ . TYR B 182 ? 0.3443 0.3853 0.5082 0.0213 -0.0476 0.0200 182 TYR B CZ 2994 O OH . TYR B 182 ? 0.3403 0.3792 0.5112 0.0228 -0.0626 0.0229 182 TYR B OH 2995 N N . SER B 183 ? 0.2469 0.2946 0.3914 0.0198 0.0077 0.0092 183 SER B N 2996 C CA . SER B 183 ? 0.2531 0.2979 0.3868 0.0189 0.0134 0.0067 183 SER B CA 2997 C C . SER B 183 ? 0.2225 0.2732 0.3620 0.0139 0.0094 0.0064 183 SER B C 2998 O O . SER B 183 ? 0.2934 0.3512 0.4506 0.0124 0.0056 0.0093 183 SER B O 2999 C CB . SER B 183 ? 0.2269 0.2693 0.3626 0.0250 0.0251 0.0088 183 SER B CB 3000 O OG . SER B 183 ? 0.2989 0.3355 0.4204 0.0246 0.0291 0.0067 183 SER B OG 3001 N N . LEU B 184 ? 0.1748 0.2219 0.3007 0.0115 0.0091 0.0029 184 LEU B N 3002 C CA . LEU B 184 ? 0.1857 0.2354 0.3141 0.0079 0.0059 0.0019 184 LEU B CA 3003 C C . LEU B 184 ? 0.2561 0.3013 0.3722 0.0084 0.0095 -0.0006 184 LEU B C 3004 O O . LEU B 184 ? 0.2634 0.3034 0.3682 0.0107 0.0120 -0.0023 184 LEU B O 3005 C CB . LEU B 184 ? 0.1436 0.1930 0.2677 0.0043 -0.0030 -0.0004 184 LEU B CB 3006 C CG . LEU B 184 ? 0.1993 0.2446 0.3074 0.0033 -0.0040 -0.0038 184 LEU B CG 3007 C CD1 . LEU B 184 ? 0.0894 0.1342 0.1908 0.0025 -0.0024 -0.0071 184 LEU B CD1 3008 C CD2 . LEU B 184 ? 0.2700 0.3125 0.3728 0.0017 -0.0106 -0.0038 184 LEU B CD2 3009 N N . SER B 185 ? 0.2897 0.3355 0.4080 0.0064 0.0081 -0.0010 185 SER B N 3010 C CA . SER B 185 ? 0.3320 0.3733 0.4395 0.0073 0.0092 -0.0034 185 SER B CA 3011 C C . SER B 185 ? 0.3654 0.4074 0.4710 0.0048 0.0035 -0.0068 185 SER B C 3012 O O . SER B 185 ? 0.4334 0.4765 0.5449 0.0023 -0.0009 -0.0068 185 SER B O 3013 C CB . SER B 185 ? 0.2564 0.2937 0.3652 0.0091 0.0152 0.0001 185 SER B CB 3014 O OG . SER B 185 ? 0.3674 0.4003 0.4708 0.0134 0.0225 0.0025 185 SER B OG 3015 N N . SER B 186 ? 0.2629 0.3033 0.3601 0.0061 0.0031 -0.0100 186 SER B N 3016 C CA . SER B 186 ? 0.1506 0.1907 0.2453 0.0058 0.0002 -0.0133 186 SER B CA 3017 C C . SER B 186 ? 0.1441 0.1804 0.2358 0.0085 0.0007 -0.0138 186 SER B C 3018 O O . SER B 186 ? 0.2832 0.3187 0.3708 0.0107 0.0011 -0.0141 186 SER B O 3019 C CB . SER B 186 ? 0.1010 0.1446 0.1922 0.0055 -0.0001 -0.0159 186 SER B CB 3020 O OG . SER B 186 ? 0.0939 0.1370 0.1823 0.0066 -0.0005 -0.0190 186 SER B OG 3021 N N . VAL B 187 ? 0.1751 0.2071 0.2678 0.0084 -0.0007 -0.0140 187 VAL B N 3022 C CA . VAL B 187 ? 0.1356 0.1613 0.2244 0.0113 -0.0006 -0.0135 187 VAL B CA 3023 C C . VAL B 187 ? 0.1875 0.2114 0.2748 0.0134 -0.0036 -0.0177 187 VAL B C 3024 O O . VAL B 187 ? 0.2222 0.2469 0.3093 0.0123 -0.0048 -0.0206 187 VAL B O 3025 C CB . VAL B 187 ? 0.1112 0.1305 0.2027 0.0099 0.0021 -0.0085 187 VAL B CB 3026 C CG1 . VAL B 187 ? 0.1102 0.1313 0.2035 0.0097 0.0077 -0.0042 187 VAL B CG1 3027 C CG2 . VAL B 187 ? 0.1341 0.1519 0.2339 0.0059 -0.0011 -0.0086 187 VAL B CG2 3028 N N . VAL B 188 ? 0.1148 0.1339 0.1987 0.0173 -0.0047 -0.0179 188 VAL B N 3029 C CA . VAL B 188 ? 0.1507 0.1668 0.2339 0.0211 -0.0068 -0.0216 188 VAL B CA 3030 C C . VAL B 188 ? 0.2113 0.2173 0.2902 0.0246 -0.0088 -0.0194 188 VAL B C 3031 O O . VAL B 188 ? 0.2900 0.2930 0.3642 0.0254 -0.0086 -0.0159 188 VAL B O 3032 C CB . VAL B 188 ? 0.2164 0.2425 0.3041 0.0243 -0.0062 -0.0252 188 VAL B CB 3033 C CG1 . VAL B 188 ? 0.1625 0.1924 0.2529 0.0266 -0.0089 -0.0240 188 VAL B CG1 3034 C CG2 . VAL B 188 ? 0.2859 0.3093 0.3737 0.0293 -0.0059 -0.0292 188 VAL B CG2 3035 N N . THR B 189 ? 0.1397 0.1375 0.2171 0.0271 -0.0107 -0.0214 189 THR B N 3036 C CA . THR B 189 ? 0.2417 0.2277 0.3139 0.0311 -0.0132 -0.0192 189 THR B CA 3037 C C . THR B 189 ? 0.1562 0.1440 0.2307 0.0388 -0.0162 -0.0235 189 THR B C 3038 O O . THR B 189 ? 0.2797 0.2711 0.3578 0.0408 -0.0148 -0.0283 189 THR B O 3039 C CB . THR B 189 ? 0.2664 0.2387 0.3367 0.0278 -0.0135 -0.0172 189 THR B CB 3040 O OG1 . THR B 189 ? 0.3794 0.3518 0.4518 0.0259 -0.0149 -0.0222 189 THR B OG1 3041 C CG2 . THR B 189 ? 0.1617 0.1324 0.2338 0.0214 -0.0096 -0.0105 189 THR B CG2 3042 N N . VAL B 190 ? 0.1987 0.1836 0.2710 0.0437 -0.0202 -0.0215 190 VAL B N 3043 C CA . VAL B 190 ? 0.2012 0.1902 0.2807 0.0517 -0.0243 -0.0247 190 VAL B CA 3044 C C . VAL B 190 ? 0.2805 0.2532 0.3510 0.0572 -0.0301 -0.0217 190 VAL B C 3045 O O . VAL B 190 ? 0.3159 0.2753 0.3735 0.0542 -0.0297 -0.0165 190 VAL B O 3046 C CB . VAL B 190 ? 0.1926 0.1973 0.2826 0.0524 -0.0269 -0.0256 190 VAL B CB 3047 C CG1 . VAL B 190 ? 0.1417 0.1603 0.2392 0.0469 -0.0205 -0.0277 190 VAL B CG1 3048 C CG2 . VAL B 190 ? 0.1907 0.1885 0.2698 0.0512 -0.0320 -0.0216 190 VAL B CG2 3049 N N . PRO B 191 ? 0.2927 0.2652 0.3698 0.0657 -0.0347 -0.0242 191 PRO B N 3050 C CA . PRO B 191 ? 0.3503 0.3065 0.4178 0.0719 -0.0420 -0.0207 191 PRO B CA 3051 C C . PRO B 191 ? 0.3312 0.2865 0.3917 0.0725 -0.0490 -0.0172 191 PRO B C 3052 O O . PRO B 191 ? 0.3067 0.2778 0.3784 0.0718 -0.0519 -0.0194 191 PRO B O 3053 C CB . PRO B 191 ? 0.3160 0.2764 0.3971 0.0818 -0.0454 -0.0250 191 PRO B CB 3054 C CG . PRO B 191 ? 0.2192 0.1907 0.3101 0.0803 -0.0365 -0.0304 191 PRO B CG 3055 C CD . PRO B 191 ? 0.1871 0.1715 0.2794 0.0710 -0.0318 -0.0298 191 PRO B CD 3056 N N . SER B 192 ? 0.3745 0.3089 0.4146 0.0738 -0.0520 -0.0115 192 SER B N 3057 C CA . SER B 192 ? 0.3555 0.2825 0.3810 0.0758 -0.0594 -0.0083 192 SER B CA 3058 C C . SER B 192 ? 0.3423 0.2772 0.3801 0.0836 -0.0731 -0.0115 192 SER B C 3059 O O . SER B 192 ? 0.3212 0.2611 0.3587 0.0832 -0.0806 -0.0124 192 SER B O 3060 C CB . SER B 192 ? 0.4503 0.3498 0.4485 0.0774 -0.0588 -0.0009 192 SER B CB 3061 O OG . SER B 192 ? 0.6194 0.5137 0.6126 0.0696 -0.0458 0.0029 192 SER B OG 3062 N N . SER B 193 ? 0.2551 0.1907 0.3053 0.0910 -0.0771 -0.0133 193 SER B N 3063 C CA . SER B 193 ? 0.3376 0.2817 0.4044 0.0995 -0.0909 -0.0155 193 SER B CA 3064 C C . SER B 193 ? 0.3502 0.3229 0.4465 0.0966 -0.0907 -0.0202 193 SER B C 3065 O O . SER B 193 ? 0.5194 0.5012 0.6316 0.1009 -0.1036 -0.0213 193 SER B O 3066 C CB . SER B 193 ? 0.2866 0.2260 0.3628 0.1091 -0.0931 -0.0164 193 SER B CB 3067 O OG . SER B 193 ? 0.3355 0.2853 0.4254 0.1074 -0.0802 -0.0204 193 SER B OG 3068 N N . SER B 194 ? 0.2228 0.2091 0.3273 0.0893 -0.0771 -0.0226 194 SER B N 3069 C CA . SER B 194 ? 0.2517 0.2633 0.3826 0.0859 -0.0748 -0.0259 194 SER B CA 3070 C C . SER B 194 ? 0.2925 0.3060 0.4168 0.0784 -0.0790 -0.0251 194 SER B C 3071 O O . SER B 194 ? 0.1909 0.2235 0.3376 0.0751 -0.0798 -0.0270 194 SER B O 3072 C CB . SER B 194 ? 0.3462 0.3683 0.4850 0.0823 -0.0588 -0.0286 194 SER B CB 3073 O OG . SER B 194 ? 0.4665 0.4791 0.5847 0.0741 -0.0512 -0.0272 194 SER B OG 3074 N N . LEU B 195 ? 0.3700 0.3630 0.4641 0.0761 -0.0810 -0.0219 195 LEU B N 3075 C CA . LEU B 195 ? 0.2854 0.2763 0.3691 0.0704 -0.0845 -0.0217 195 LEU B CA 3076 C C . LEU B 195 ? 0.3068 0.3008 0.4005 0.0734 -0.1025 -0.0233 195 LEU B C 3077 O O . LEU B 195 ? 0.3442 0.3407 0.4373 0.0682 -0.1067 -0.0247 195 LEU B O 3078 C CB . LEU B 195 ? 0.2307 0.1967 0.2783 0.0695 -0.0812 -0.0176 195 LEU B CB 3079 C CG . LEU B 195 ? 0.2883 0.2528 0.3294 0.0640 -0.0645 -0.0155 195 LEU B CG 3080 C CD1 . LEU B 195 ? 0.2777 0.2186 0.2875 0.0641 -0.0602 -0.0100 195 LEU B CD1 3081 C CD2 . LEU B 195 ? 0.1983 0.1806 0.2533 0.0564 -0.0565 -0.0181 195 LEU B CD2 3082 N N . GLY B 196 ? 0.4676 0.3822 0.6268 0.1160 -0.0106 0.0459 196 GLY B N 3083 C CA . GLY B 196 ? 0.5658 0.4996 0.6905 0.1333 -0.0121 0.0345 196 GLY B CA 3084 C C . GLY B 196 ? 0.6125 0.5748 0.7349 0.1296 -0.0241 0.0016 196 GLY B C 3085 O O . GLY B 196 ? 0.6016 0.5889 0.7080 0.1314 -0.0258 -0.0085 196 GLY B O 3086 N N . THR B 197 ? 0.6464 0.6065 0.7871 0.1263 -0.0339 -0.0142 197 THR B N 3087 C CA . THR B 197 ? 0.5909 0.5853 0.7299 0.1294 -0.0416 -0.0405 197 THR B CA 3088 C C . THR B 197 ? 0.4370 0.4540 0.5837 0.1111 -0.0378 -0.0496 197 THR B C 3089 O O . THR B 197 ? 0.4974 0.5537 0.6435 0.1101 -0.0372 -0.0613 197 THR B O 3090 C CB . THR B 197 ? 0.6677 0.6507 0.8122 0.1476 -0.0556 -0.0554 197 THR B CB 3091 O OG1 . THR B 197 ? 0.7855 0.7467 0.9461 0.1409 -0.0633 -0.0615 197 THR B OG1 3092 C CG2 . THR B 197 ? 0.6372 0.5870 0.7773 0.1643 -0.0598 -0.0411 197 THR B CG2 3093 N N . GLN B 198 ? 0.3567 0.3524 0.5142 0.0971 -0.0352 -0.0416 198 GLN B N 3094 C CA . GLN B 198 ? 0.2212 0.2343 0.3827 0.0829 -0.0330 -0.0500 198 GLN B CA 3095 C C . GLN B 198 ? 0.2869 0.3041 0.4449 0.0651 -0.0215 -0.0355 198 GLN B C 3096 O O . GLN B 198 ? 0.3777 0.3738 0.5352 0.0635 -0.0155 -0.0172 198 GLN B O 3097 C CB . GLN B 198 ? 0.2362 0.2221 0.4132 0.0823 -0.0441 -0.0566 198 GLN B CB 3098 C CG . GLN B 198 ? 0.6194 0.5970 0.7962 0.1043 -0.0616 -0.0774 198 GLN B CG 3099 C CD . GLN B 198 ? 0.6259 0.6486 0.7851 0.1181 -0.0603 -0.0974 198 GLN B CD 3100 O OE1 . GLN B 198 ? 0.5657 0.6110 0.7194 0.1127 -0.0556 -0.1026 198 GLN B OE1 3101 N NE2 . GLN B 198 ? 0.5917 0.6314 0.7434 0.1377 -0.0630 -0.1056 198 GLN B NE2 3102 N N . THR B 199 ? 0.2278 0.2734 0.3830 0.0545 -0.0181 -0.0417 199 THR B N 3103 C CA . THR B 199 ? 0.2655 0.3109 0.4179 0.0381 -0.0111 -0.0314 199 THR B CA 3104 C C . THR B 199 ? 0.2381 0.2740 0.3985 0.0285 -0.0110 -0.0327 199 THR B C 3105 O O . THR B 199 ? 0.2934 0.3379 0.4559 0.0339 -0.0167 -0.0463 199 THR B O 3106 C CB . THR B 199 ? 0.2362 0.3137 0.3872 0.0300 -0.0106 -0.0340 199 THR B CB 3107 O OG1 . THR B 199 ? 0.1843 0.2904 0.3421 0.0279 -0.0088 -0.0414 199 THR B OG1 3108 C CG2 . THR B 199 ? 0.2826 0.3730 0.4328 0.0407 -0.0166 -0.0371 199 THR B CG2 3109 N N . TYR B 200 ? 0.2442 0.2640 0.4069 0.0184 -0.0057 -0.0197 200 TYR B N 3110 C CA . TYR B 200 ? 0.1541 0.1641 0.3284 0.0093 -0.0077 -0.0202 200 TYR B CA 3111 C C . TYR B 200 ? 0.1393 0.1581 0.3040 -0.0030 -0.0011 -0.0143 200 TYR B C 3112 O O . TYR B 200 ? 0.1752 0.1854 0.3351 -0.0044 0.0052 -0.0010 200 TYR B O 3113 C CB . TYR B 200 ? 0.1665 0.1487 0.3648 0.0094 -0.0092 -0.0069 200 TYR B CB 3114 C CG . TYR B 200 ? 0.2359 0.2018 0.4486 0.0204 -0.0213 -0.0139 200 TYR B CG 3115 C CD1 . TYR B 200 ? 0.1999 0.1596 0.4208 0.0252 -0.0387 -0.0350 200 TYR B CD1 3116 C CD2 . TYR B 200 ? 0.3103 0.2650 0.5246 0.0300 -0.0178 -0.0008 200 TYR B CD2 3117 C CE1 . TYR B 200 ? 0.2424 0.1818 0.4750 0.0385 -0.0549 -0.0449 200 TYR B CE1 3118 C CE2 . TYR B 200 ? 0.2825 0.2177 0.5107 0.0408 -0.0313 -0.0070 200 TYR B CE2 3119 C CZ . TYR B 200 ? 0.2379 0.1639 0.4763 0.0445 -0.0511 -0.0301 200 TYR B CZ 3120 O OH . TYR B 200 ? 0.2684 0.1696 0.5193 0.0583 -0.0696 -0.0397 200 TYR B OH 3121 N N . ILE B 201 ? 0.1749 0.2108 0.3342 -0.0082 -0.0028 -0.0232 201 ILE B N 3122 C CA . ILE B 201 ? 0.1233 0.1658 0.2743 -0.0199 0.0011 -0.0175 201 ILE B CA 3123 C C . ILE B 201 ? 0.1754 0.2126 0.3296 -0.0230 -0.0023 -0.0216 201 ILE B C 3124 O O . ILE B 201 ? 0.2971 0.3413 0.4501 -0.0147 -0.0084 -0.0341 201 ILE B O 3125 C CB . ILE B 201 ? 0.1192 0.1900 0.2651 -0.0238 0.0026 -0.0179 201 ILE B CB 3126 C CG1 . ILE B 201 ? 0.1301 0.2045 0.2775 -0.0217 0.0003 -0.0154 201 ILE B CG1 3127 C CG2 . ILE B 201 ? 0.1154 0.1893 0.2569 -0.0364 0.0041 -0.0105 201 ILE B CG2 3128 C CD1 . ILE B 201 ? 0.1170 0.2206 0.2744 -0.0297 -0.0014 -0.0120 201 ILE B CD1 3129 N N . CYS B 202 ? 0.2271 0.2523 0.3825 -0.0309 -0.0002 -0.0131 202 CYS B N 3130 C CA . CYS B 202 ? 0.2428 0.2650 0.4002 -0.0339 -0.0050 -0.0172 202 CYS B CA 3131 C C . CYS B 202 ? 0.2054 0.2411 0.3439 -0.0401 -0.0015 -0.0141 202 CYS B C 3132 O O . CYS B 202 ? 0.2759 0.3089 0.4083 -0.0471 0.0019 -0.0048 202 CYS B O 3133 C CB . CYS B 202 ? 0.1202 0.1261 0.2960 -0.0377 -0.0048 -0.0078 202 CYS B CB 3134 S SG . CYS B 202 ? 0.3004 0.3030 0.4629 -0.0406 0.0054 0.0079 202 CYS B SG 3135 N N . ASN B 203 ? 0.1557 0.2049 0.2845 -0.0348 -0.0042 -0.0213 203 ASN B N 3136 C CA . ASN B 203 ? 0.1319 0.1968 0.2457 -0.0395 0.0010 -0.0125 203 ASN B CA 3137 C C . ASN B 203 ? 0.3106 0.3613 0.4182 -0.0412 -0.0040 -0.0127 203 ASN B C 3138 O O . ASN B 203 ? 0.3577 0.4083 0.4595 -0.0299 -0.0118 -0.0243 203 ASN B O 3139 C CB . ASN B 203 ? 0.1448 0.2403 0.2473 -0.0266 0.0052 -0.0152 203 ASN B CB 3140 C CG . ASN B 203 ? 0.1430 0.2520 0.2536 -0.0187 0.0068 -0.0210 203 ASN B CG 3141 O OD1 . ASN B 203 ? 0.1554 0.2636 0.2620 -0.0013 -0.0003 -0.0373 203 ASN B OD1 3142 N ND2 . ASN B 203 ? 0.2285 0.3470 0.3514 -0.0297 0.0122 -0.0098 203 ASN B ND2 3143 N N . VAL B 204 ? 0.1310 0.1684 0.2386 -0.0521 -0.0027 -0.0023 204 VAL B N 3144 C CA . VAL B 204 ? 0.1358 0.1602 0.2381 -0.0530 -0.0074 -0.0015 204 VAL B CA 3145 C C . VAL B 204 ? 0.2055 0.2367 0.2903 -0.0571 -0.0051 0.0096 204 VAL B C 3146 O O . VAL B 204 ? 0.3537 0.3886 0.4403 -0.0667 -0.0018 0.0219 204 VAL B O 3147 C CB . VAL B 204 ? 0.2001 0.2064 0.3109 -0.0566 -0.0074 0.0035 204 VAL B CB 3148 C CG1 . VAL B 204 ? 0.1338 0.1310 0.2425 -0.0549 -0.0124 0.0037 204 VAL B CG1 3149 C CG2 . VAL B 204 ? 0.1426 0.1467 0.2743 -0.0525 -0.0054 0.0014 204 VAL B CG2 3150 N N . ASN B 205 ? 0.1613 0.1935 0.2325 -0.0493 -0.0090 0.0067 205 ASN B N 3151 C CA . ASN B 205 ? 0.2520 0.2888 0.3055 -0.0513 -0.0059 0.0219 205 ASN B CA 3152 C C . ASN B 205 ? 0.2380 0.2587 0.2804 -0.0454 -0.0149 0.0170 205 ASN B C 3153 O O . ASN B 205 ? 0.2089 0.2326 0.2454 -0.0311 -0.0226 0.0021 205 ASN B O 3154 C CB . ASN B 205 ? 0.3679 0.4358 0.4069 -0.0394 0.0029 0.0281 205 ASN B CB 3155 C CG . ASN B 205 ? 0.4021 0.4792 0.4286 -0.0426 0.0103 0.0534 205 ASN B CG 3156 O OD1 . ASN B 205 ? 0.4587 0.5161 0.4938 -0.0590 0.0070 0.0668 205 ASN B OD1 3157 N ND2 . ASN B 205 ? 0.4255 0.5319 0.4307 -0.0240 0.0195 0.0612 205 ASN B ND2 3158 N N . HIS B 206 ? 0.2652 0.2670 0.3055 -0.0544 -0.0175 0.0272 206 HIS B N 3159 C CA . HIS B 206 ? 0.2516 0.2387 0.2803 -0.0482 -0.0260 0.0250 206 HIS B CA 3160 C C . HIS B 206 ? 0.2302 0.2180 0.2378 -0.0490 -0.0233 0.0444 206 HIS B C 3161 O O . HIS B 206 ? 0.2481 0.2186 0.2574 -0.0605 -0.0255 0.0591 206 HIS B O 3162 C CB . HIS B 206 ? 0.2124 0.1783 0.2512 -0.0522 -0.0312 0.0230 206 HIS B CB 3163 C CG . HIS B 206 ? 0.2662 0.2203 0.2963 -0.0440 -0.0400 0.0202 206 HIS B CG 3164 N ND1 . HIS B 206 ? 0.2410 0.1732 0.2579 -0.0450 -0.0457 0.0285 206 HIS B ND1 3165 C CD2 . HIS B 206 ? 0.2992 0.2593 0.3343 -0.0334 -0.0475 0.0086 206 HIS B CD2 3166 C CE1 . HIS B 206 ? 0.2329 0.1607 0.2443 -0.0344 -0.0533 0.0231 206 HIS B CE1 3167 N NE2 . HIS B 206 ? 0.2880 0.2339 0.3123 -0.0280 -0.0547 0.0112 206 HIS B NE2 3168 N N . LYS B 207 ? 0.2643 0.2711 0.2520 -0.0341 -0.0201 0.0451 207 LYS B N 3169 C CA . LYS B 207 ? 0.3450 0.3601 0.3128 -0.0316 -0.0124 0.0707 207 LYS B CA 3170 C C . LYS B 207 ? 0.3645 0.3515 0.3218 -0.0348 -0.0213 0.0808 207 LYS B C 3171 O O . LYS B 207 ? 0.3294 0.3116 0.2878 -0.0455 -0.0167 0.1091 207 LYS B O 3172 C CB . LYS B 207 ? 0.4050 0.4476 0.3434 -0.0050 -0.0077 0.0669 207 LYS B CB 3173 C CG . LYS B 207 ? 0.5297 0.6053 0.4728 0.0011 0.0049 0.0675 207 LYS B CG 3174 C CD . LYS B 207 ? 0.5916 0.6934 0.4971 0.0366 0.0065 0.0590 207 LYS B CD 3175 C CE . LYS B 207 ? 0.6322 0.7704 0.5395 0.0471 0.0203 0.0613 207 LYS B CE 3176 N NZ . LYS B 207 ? 0.7142 0.8753 0.5784 0.0901 0.0174 0.0455 207 LYS B NZ 3177 N N . PRO B 208 ? 0.3616 0.3302 0.3131 -0.0263 -0.0348 0.0618 208 PRO B N 3178 C CA . PRO B 208 ? 0.3567 0.2983 0.2962 -0.0267 -0.0439 0.0715 208 PRO B CA 3179 C C . PRO B 208 ? 0.3791 0.2947 0.3341 -0.0458 -0.0477 0.0850 208 PRO B C 3180 O O . PRO B 208 ? 0.3450 0.2367 0.2899 -0.0479 -0.0551 0.1009 208 PRO B O 3181 C CB . PRO B 208 ? 0.3053 0.2396 0.2482 -0.0149 -0.0572 0.0457 208 PRO B CB 3182 C CG . PRO B 208 ? 0.2962 0.2540 0.2430 -0.0033 -0.0578 0.0271 208 PRO B CG 3183 C CD . PRO B 208 ? 0.3209 0.2949 0.2790 -0.0136 -0.0443 0.0331 208 PRO B CD 3184 N N . SER B 209 ? 0.3676 0.2834 0.3454 -0.0570 -0.0465 0.0775 209 SER B N 3185 C CA . SER B 209 ? 0.3744 0.2630 0.3651 -0.0704 -0.0561 0.0846 209 SER B CA 3186 C C . SER B 209 ? 0.5562 0.4573 0.5692 -0.0877 -0.0502 0.1025 209 SER B C 3187 O O . SER B 209 ? 0.4975 0.3794 0.5261 -0.0964 -0.0618 0.1034 209 SER B O 3188 C CB . SER B 209 ? 0.3661 0.2441 0.3628 -0.0644 -0.0623 0.0626 209 SER B CB 3189 O OG . SER B 209 ? 0.2769 0.1804 0.2881 -0.0655 -0.0511 0.0530 209 SER B OG 3190 N N . ASN B 210 ? 0.6018 0.5402 0.6168 -0.0866 -0.0331 0.1116 210 ASN B N 3191 C CA . ASN B 210 ? 0.5252 0.4872 0.5668 -0.1007 -0.0242 0.1296 210 ASN B CA 3192 C C . ASN B 210 ? 0.4159 0.3706 0.4768 -0.1062 -0.0316 0.1101 210 ASN B C 3193 O O . ASN B 210 ? 0.3210 0.2776 0.4027 -0.1115 -0.0357 0.1121 210 ASN B O 3194 C CB . ASN B 210 ? 0.5935 0.5517 0.6500 -0.1095 -0.0256 0.1560 210 ASN B CB 3195 C CG . ASN B 210 ? 0.7088 0.6902 0.7473 -0.1015 -0.0096 0.1851 210 ASN B CG 3196 O OD1 . ASN B 210 ? 0.7043 0.7272 0.7331 -0.0914 0.0093 0.1947 210 ASN B OD1 3197 N ND2 . ASN B 210 ? 0.7893 0.7462 0.8187 -0.1003 -0.0169 0.1977 210 ASN B ND2 3198 N N . THR B 211 ? 0.4639 0.4139 0.5147 -0.0966 -0.0327 0.0860 211 THR B N 3199 C CA . THR B 211 ? 0.4419 0.3867 0.5035 -0.0960 -0.0370 0.0695 211 THR B CA 3200 C C . THR B 211 ? 0.4245 0.4015 0.4945 -0.0937 -0.0234 0.0638 211 THR B C 3201 O O . THR B 211 ? 0.2958 0.2848 0.3557 -0.0820 -0.0167 0.0528 211 THR B O 3202 C CB . THR B 211 ? 0.3641 0.2855 0.4124 -0.0842 -0.0449 0.0523 211 THR B CB 3203 O OG1 . THR B 211 ? 0.4115 0.3017 0.4490 -0.0822 -0.0602 0.0550 211 THR B OG1 3204 C CG2 . THR B 211 ? 0.2780 0.1988 0.3326 -0.0790 -0.0456 0.0399 211 THR B CG2 3205 N N . LYS B 212 ? 0.5203 0.5101 0.6073 -0.0988 -0.0215 0.0662 212 LYS B N 3206 C CA . LYS B 212 ? 0.3558 0.3771 0.4538 -0.0980 -0.0103 0.0640 212 LYS B CA 3207 C C . LYS B 212 ? 0.2716 0.2837 0.3755 -0.0939 -0.0155 0.0493 212 LYS B C 3208 O O . LYS B 212 ? 0.2067 0.2121 0.3196 -0.0976 -0.0237 0.0517 212 LYS B O 3209 C CB . LYS B 212 ? 0.3185 0.3742 0.4294 -0.1028 0.0007 0.0853 212 LYS B CB 3210 C CG . LYS B 212 ? 0.3930 0.4857 0.4962 -0.0881 0.0155 0.0810 212 LYS B CG 3211 C CD . LYS B 212 ? 0.3777 0.5125 0.4921 -0.0887 0.0304 0.1090 212 LYS B CD 3212 C CE . LYS B 212 ? 0.3837 0.5577 0.4885 -0.0676 0.0435 0.1011 212 LYS B CE 3213 N NZ . LYS B 212 ? 0.4143 0.6394 0.5338 -0.0649 0.0621 0.1332 212 LYS B NZ 3214 N N . VAL B 213 ? 0.1542 0.1660 0.2560 -0.0866 -0.0129 0.0364 213 VAL B N 3215 C CA . VAL B 213 ? 0.1803 0.1831 0.2846 -0.0813 -0.0170 0.0270 213 VAL B CA 3216 C C . VAL B 213 ? 0.2017 0.2254 0.3153 -0.0761 -0.0082 0.0211 213 VAL B C 3217 O O . VAL B 213 ? 0.1573 0.1882 0.2679 -0.0695 -0.0022 0.0158 213 VAL B O 3218 C CB . VAL B 213 ? 0.2618 0.2395 0.3540 -0.0717 -0.0217 0.0209 213 VAL B CB 3219 C CG1 . VAL B 213 ? 0.2588 0.2295 0.3480 -0.0610 -0.0248 0.0148 213 VAL B CG1 3220 C CG2 . VAL B 213 ? 0.2899 0.2442 0.3712 -0.0740 -0.0336 0.0245 213 VAL B CG2 3221 N N . ASP B 214 ? 0.2794 0.3099 0.4027 -0.0760 -0.0109 0.0195 214 ASP B N 3222 C CA . ASP B 214 ? 0.2241 0.2673 0.3519 -0.0667 -0.0049 0.0119 214 ASP B CA 3223 C C . ASP B 214 ? 0.2650 0.2888 0.3861 -0.0569 -0.0089 0.0072 214 ASP B C 3224 O O . ASP B 214 ? 0.3638 0.3784 0.4825 -0.0563 -0.0198 0.0064 214 ASP B O 3225 C CB . ASP B 214 ? 0.1215 0.1949 0.2653 -0.0701 -0.0030 0.0154 214 ASP B CB 3226 C CG . ASP B 214 ? 0.2427 0.3443 0.3877 -0.0705 0.0067 0.0225 214 ASP B CG 3227 O OD1 . ASP B 214 ? 0.1915 0.2876 0.3216 -0.0627 0.0099 0.0166 214 ASP B OD1 3228 O OD2 . ASP B 214 ? 0.2883 0.4202 0.4507 -0.0764 0.0106 0.0353 214 ASP B OD2 3229 N N . LYS B 215 ? 0.1222 0.1396 0.2418 -0.0472 -0.0020 0.0053 215 LYS B N 3230 C CA . LYS B 215 ? 0.1301 0.1338 0.2418 -0.0336 -0.0004 0.0078 215 LYS B CA 3231 C C . LYS B 215 ? 0.1861 0.1965 0.3061 -0.0260 0.0035 0.0063 215 LYS B C 3232 O O . LYS B 215 ? 0.1521 0.1658 0.2865 -0.0269 0.0073 0.0052 215 LYS B O 3233 C CB . LYS B 215 ? 0.1833 0.1774 0.2953 -0.0284 0.0066 0.0154 215 LYS B CB 3234 C CG . LYS B 215 ? 0.1457 0.1325 0.2462 -0.0093 0.0127 0.0247 215 LYS B CG 3235 C CD . LYS B 215 ? 0.1859 0.1607 0.2575 0.0018 0.0019 0.0193 215 LYS B CD 3236 C CE . LYS B 215 ? 0.3044 0.2752 0.3546 0.0278 0.0043 0.0233 215 LYS B CE 3237 N NZ . LYS B 215 ? 0.3566 0.3108 0.3751 0.0437 -0.0140 0.0116 215 LYS B NZ 3238 N N . ARG B 216 ? 0.1387 0.1480 0.2494 -0.0165 -0.0013 0.0044 216 ARG B N 3239 C CA . ARG B 216 ? 0.2044 0.2158 0.3182 -0.0051 0.0019 0.0048 216 ARG B CA 3240 C C . ARG B 216 ? 0.2000 0.1982 0.3095 0.0091 0.0123 0.0190 216 ARG B C 3241 O O . ARG B 216 ? 0.2705 0.2611 0.3609 0.0209 0.0144 0.0256 216 ARG B O 3242 C CB . ARG B 216 ? 0.2612 0.2774 0.3664 0.0024 -0.0091 -0.0026 216 ARG B CB 3243 C CG . ARG B 216 ? 0.3400 0.3548 0.4410 0.0193 -0.0070 -0.0015 216 ARG B CG 3244 C CD . ARG B 216 ? 0.3431 0.3718 0.4635 0.0146 -0.0046 -0.0065 216 ARG B CD 3245 N NE . ARG B 216 ? 0.4731 0.4989 0.5892 0.0315 -0.0059 -0.0066 216 ARG B NE 3246 C CZ . ARG B 216 ? 0.4659 0.5042 0.5792 0.0389 -0.0160 -0.0156 216 ARG B CZ 3247 N NH1 . ARG B 216 ? 0.4333 0.4890 0.5555 0.0280 -0.0262 -0.0230 216 ARG B NH1 3248 N NH2 . ARG B 216 ? 0.4625 0.4960 0.5691 0.0567 -0.0173 -0.0154 216 ARG B NH2 3249 N N . VAL B 217 ? 0.1534 0.1498 0.2825 0.0099 0.0183 0.0255 217 VAL B N 3250 C CA . VAL B 217 ? 0.2855 0.2739 0.4249 0.0198 0.0302 0.0471 217 VAL B CA 3251 C C . VAL B 217 ? 0.2958 0.2796 0.4317 0.0350 0.0322 0.0538 217 VAL B C 3252 O O . VAL B 217 ? 0.3017 0.2824 0.4543 0.0309 0.0259 0.0465 217 VAL B O 3253 C CB . VAL B 217 ? 0.1863 0.1715 0.3632 0.0062 0.0312 0.0531 217 VAL B CB 3254 C CG1 . VAL B 217 ? 0.1715 0.1532 0.3733 0.0137 0.0442 0.0827 217 VAL B CG1 3255 C CG2 . VAL B 217 ? 0.1436 0.1334 0.3196 -0.0055 0.0286 0.0462 217 VAL B CG2 3256 N N . GLU B 218 ? 0.3153 0.2977 0.4255 0.0568 0.0398 0.0670 218 GLU B N 3257 C CA . GLU B 218 ? 0.3290 0.3068 0.4281 0.0765 0.0425 0.0760 218 GLU B CA 3258 C C . GLU B 218 ? 0.2610 0.2372 0.3695 0.0916 0.0624 0.1122 218 GLU B C 3259 O O . GLU B 218 ? 0.2725 0.2560 0.3917 0.0902 0.0747 0.1295 218 GLU B O 3260 C CB . GLU B 218 ? 0.3790 0.3582 0.4352 0.0969 0.0321 0.0616 218 GLU B CB 3261 C CG . GLU B 218 ? 0.5163 0.5016 0.5752 0.0856 0.0131 0.0342 218 GLU B CG 3262 C CD . GLU B 218 ? 0.7114 0.6970 0.7404 0.0999 -0.0038 0.0183 218 GLU B CD 3263 O OE1 . GLU B 218 ? 0.8539 0.8492 0.8925 0.0916 -0.0200 -0.0001 218 GLU B OE1 3264 O OE2 . GLU B 218 ? 0.6917 0.6689 0.6897 0.1213 -0.0026 0.0241 218 GLU B OE2 3265 N N . PRO B 219 ? 0.3346 0.3040 0.4430 0.1068 0.0673 0.1279 219 PRO B N 3266 C CA . PRO B 219 ? 0.3383 0.3165 0.4438 0.1209 0.0880 0.1612 219 PRO B CA 3267 C C . PRO B 219 ? 0.4781 0.4673 0.5262 0.1509 0.0946 0.1605 219 PRO B C 3268 O O . PRO B 219 ? 0.4975 0.4797 0.5050 0.1670 0.0788 0.1369 219 PRO B O 3269 C CB . PRO B 219 ? 0.3420 0.3094 0.4549 0.1248 0.0858 0.1684 219 PRO B CB 3270 C CG . PRO B 219 ? 0.2999 0.2507 0.4362 0.1087 0.0647 0.1432 219 PRO B CG 3271 C CD . PRO B 219 ? 0.3614 0.3207 0.4768 0.1039 0.0538 0.1130 219 PRO B CD 3272 N N . LYS B 220 ? 0.6066 0.6153 0.6545 0.1597 0.1160 0.1837 220 LYS B N 3273 C CA . LYS B 220 ? 0.6567 0.6758 0.6470 0.1913 0.1216 0.1797 220 LYS B CA 3274 C C . LYS B 220 ? 0.6319 0.6496 0.5745 0.2218 0.1230 0.1788 220 LYS B C 3275 O O . LYS B 220 ? 0.7056 0.7356 0.6613 0.2308 0.1435 0.2062 220 LYS B O 3276 C CB . LYS B 220 ? 0.7140 0.7623 0.7215 0.1987 0.1488 0.2073 220 LYS B CB 3277 C CG . LYS B 220 ? 0.7741 0.8310 0.7205 0.2316 0.1520 0.1976 220 LYS B CG 3278 C CD . LYS B 220 ? 0.7454 0.8336 0.7198 0.2354 0.1760 0.2209 220 LYS B CD 3279 C CE . LYS B 220 ? 0.7819 0.8744 0.6890 0.2702 0.1759 0.2080 220 LYS B CE 3280 N NZ . LYS B 220 ? 0.8207 0.9229 0.6868 0.3076 0.1846 0.2144 220 LYS B NZ 3281 N N . ASP C 1 ? 0.8037 0.8179 0.6011 0.0763 -0.1206 -0.1410 1 ASP C N 3282 C CA . ASP C 1 ? 0.7800 0.8102 0.6085 0.0542 -0.1175 -0.1485 1 ASP C CA 3283 C C . ASP C 1 ? 0.7078 0.7689 0.5511 0.0602 -0.1165 -0.1203 1 ASP C C 3284 O O . ASP C 1 ? 0.8292 0.8891 0.6654 0.0705 -0.1130 -0.0971 1 ASP C O 3285 C CB . ASP C 1 ? 0.8018 0.7744 0.6280 0.0238 -0.1011 -0.1567 1 ASP C CB 3286 C CG . ASP C 1 ? 0.8024 0.7455 0.6305 0.0060 -0.0915 -0.1946 1 ASP C CG 3287 O OD1 . ASP C 1 ? 0.7739 0.7349 0.5978 0.0204 -0.1018 -0.2142 1 ASP C OD1 3288 O OD2 . ASP C 1 ? 0.8231 0.7226 0.6580 -0.0235 -0.0701 -0.2070 1 ASP C OD2 3289 N N . ILE C 2 ? 0.5205 0.6105 0.3870 0.0537 -0.1176 -0.1267 2 ILE C N 3290 C CA . ILE C 2 ? 0.4229 0.5292 0.3004 0.0568 -0.1111 -0.1014 2 ILE C CA 3291 C C . ILE C 2 ? 0.4432 0.5152 0.3291 0.0301 -0.1018 -0.0920 2 ILE C C 3292 O O . ILE C 2 ? 0.4362 0.4865 0.3288 0.0079 -0.0984 -0.1080 2 ILE C O 3293 C CB . ILE C 2 ? 0.3486 0.4958 0.2383 0.0681 -0.1165 -0.1125 2 ILE C CB 3294 C CG1 . ILE C 2 ? 0.4530 0.6293 0.3349 0.0980 -0.1236 -0.1255 2 ILE C CG1 3295 C CG2 . ILE C 2 ? 0.3363 0.4889 0.2255 0.0785 -0.1042 -0.0823 2 ILE C CG2 3296 C CD1 . ILE C 2 ? 0.4473 0.6262 0.3010 0.1308 -0.1166 -0.0989 2 ILE C CD1 3297 N N . LEU C 3 ? 0.4470 0.5154 0.3342 0.0328 -0.0954 -0.0697 3 LEU C N 3298 C CA . LEU C 3 ? 0.4646 0.5095 0.3582 0.0150 -0.0900 -0.0632 3 LEU C CA 3299 C C . LEU C 3 ? 0.4284 0.4909 0.3447 0.0083 -0.0823 -0.0524 3 LEU C C 3300 O O . LEU C 3 ? 0.4553 0.5392 0.3786 0.0212 -0.0744 -0.0394 3 LEU C O 3301 C CB . LEU C 3 ? 0.5449 0.5849 0.4323 0.0238 -0.0908 -0.0565 3 LEU C CB 3302 C CG . LEU C 3 ? 0.6002 0.6192 0.4862 0.0147 -0.0902 -0.0561 3 LEU C CG 3303 C CD1 . LEU C 3 ? 0.5545 0.5214 0.4072 0.0084 -0.0881 -0.0636 3 LEU C CD1 3304 C CD2 . LEU C 3 ? 0.6322 0.6683 0.5207 0.0301 -0.0957 -0.0590 3 LEU C CD2 3305 N N . LEU C 4 ? 0.4595 0.5061 0.3825 -0.0101 -0.0800 -0.0567 4 LEU C N 3306 C CA . LEU C 4 ? 0.4573 0.5154 0.3983 -0.0160 -0.0729 -0.0479 4 LEU C CA 3307 C C . LEU C 4 ? 0.4596 0.4989 0.4064 -0.0279 -0.0682 -0.0411 4 LEU C C 3308 O O . LEU C 4 ? 0.4845 0.4953 0.4179 -0.0369 -0.0702 -0.0475 4 LEU C O 3309 C CB . LEU C 4 ? 0.3704 0.4358 0.3198 -0.0255 -0.0745 -0.0632 4 LEU C CB 3310 C CG . LEU C 4 ? 0.3679 0.4683 0.3189 -0.0100 -0.0837 -0.0813 4 LEU C CG 3311 C CD1 . LEU C 4 ? 0.2877 0.4104 0.2609 -0.0211 -0.0855 -0.1061 4 LEU C CD1 3312 C CD2 . LEU C 4 ? 0.2909 0.4159 0.2305 0.0215 -0.0827 -0.0646 4 LEU C CD2 3313 N N . THR C 5 ? 0.2627 0.3147 0.2270 -0.0260 -0.0588 -0.0304 5 THR C N 3314 C CA . THR C 5 ? 0.3783 0.4245 0.3574 -0.0364 -0.0561 -0.0324 5 THR C CA 3315 C C . THR C 5 ? 0.3909 0.4314 0.3815 -0.0468 -0.0464 -0.0264 5 THR C C 3316 O O . THR C 5 ? 0.3352 0.3816 0.3358 -0.0429 -0.0309 -0.0156 5 THR C O 3317 C CB . THR C 5 ? 0.3899 0.4575 0.3930 -0.0332 -0.0478 -0.0345 5 THR C CB 3318 O OG1 . THR C 5 ? 0.2618 0.3384 0.2521 -0.0196 -0.0577 -0.0404 5 THR C OG1 3319 C CG2 . THR C 5 ? 0.3238 0.3983 0.3499 -0.0428 -0.0495 -0.0489 5 THR C CG2 3320 N N . GLN C 6 ? 0.3681 0.3907 0.3508 -0.0563 -0.0519 -0.0318 6 GLN C N 3321 C CA . GLN C 6 ? 0.3912 0.4084 0.3838 -0.0652 -0.0440 -0.0278 6 GLN C CA 3322 C C . GLN C 6 ? 0.3693 0.3837 0.3770 -0.0717 -0.0422 -0.0339 6 GLN C C 3323 O O . GLN C 6 ? 0.4482 0.4610 0.4479 -0.0674 -0.0535 -0.0457 6 GLN C O 3324 C CB . GLN C 6 ? 0.2537 0.2556 0.2326 -0.0726 -0.0466 -0.0328 6 GLN C CB 3325 C CG . GLN C 6 ? 0.2547 0.2720 0.2329 -0.0698 -0.0484 -0.0389 6 GLN C CG 3326 C CD . GLN C 6 ? 0.3840 0.3965 0.3663 -0.0830 -0.0436 -0.0506 6 GLN C CD 3327 O OE1 . GLN C 6 ? 0.2756 0.2788 0.2545 -0.0922 -0.0410 -0.0655 6 GLN C OE1 3328 N NE2 . GLN C 6 ? 0.4080 0.4249 0.4001 -0.0858 -0.0382 -0.0464 6 GLN C NE2 3329 N N . SER C 7 ? 0.2956 0.3098 0.3224 -0.0781 -0.0277 -0.0291 7 SER C N 3330 C CA . SER C 7 ? 0.3040 0.3197 0.3541 -0.0875 -0.0242 -0.0422 7 SER C CA 3331 C C . SER C 7 ? 0.3527 0.3517 0.4070 -0.0942 -0.0103 -0.0349 7 SER C C 3332 O O . SER C 7 ? 0.4422 0.4330 0.4881 -0.0880 0.0032 -0.0182 7 SER C O 3333 C CB . SER C 7 ? 0.2494 0.2852 0.3347 -0.0922 -0.0113 -0.0525 7 SER C CB 3334 O OG . SER C 7 ? 0.3097 0.3320 0.4027 -0.0940 0.0181 -0.0358 7 SER C OG 3335 N N . PRO C 8 ? 0.3993 0.3936 0.4609 -0.1010 -0.0150 -0.0487 8 PRO C N 3336 C CA . PRO C 8 ? 0.3706 0.3777 0.4316 -0.0966 -0.0346 -0.0714 8 PRO C CA 3337 C C . PRO C 8 ? 0.2862 0.2737 0.3011 -0.0842 -0.0494 -0.0655 8 PRO C C 3338 O O . PRO C 8 ? 0.3254 0.2956 0.3234 -0.0872 -0.0429 -0.0496 8 PRO C O 3339 C CB . PRO C 8 ? 0.2668 0.2742 0.3500 -0.1050 -0.0304 -0.0888 8 PRO C CB 3340 C CG . PRO C 8 ? 0.2685 0.2483 0.3389 -0.1097 -0.0157 -0.0674 8 PRO C CG 3341 C CD . PRO C 8 ? 0.3527 0.3288 0.4166 -0.1066 -0.0028 -0.0442 8 PRO C CD 3342 N N . VAL C 9 ? 0.3600 0.3493 0.3538 -0.0677 -0.0661 -0.0809 9 VAL C N 3343 C CA . VAL C 9 ? 0.4698 0.4219 0.4085 -0.0529 -0.0699 -0.0729 9 VAL C CA 3344 C C . VAL C 9 ? 0.4872 0.4133 0.4099 -0.0568 -0.0617 -0.0677 9 VAL C C 3345 O O . VAL C 9 ? 0.5310 0.4293 0.4352 -0.0646 -0.0480 -0.0533 9 VAL C O 3346 C CB . VAL C 9 ? 0.4695 0.4225 0.3745 -0.0224 -0.0878 -0.0892 9 VAL C CB 3347 C CG1 . VAL C 9 ? 0.5980 0.4932 0.4341 -0.0046 -0.0806 -0.0750 9 VAL C CG1 3348 C CG2 . VAL C 9 ? 0.4610 0.4526 0.3939 -0.0193 -0.0964 -0.0997 9 VAL C CG2 3349 N N . ILE C 10 ? 0.4360 0.3751 0.3705 -0.0523 -0.0687 -0.0838 10 ILE C N 3350 C CA . ILE C 10 ? 0.4310 0.3497 0.3543 -0.0550 -0.0613 -0.0804 10 ILE C CA 3351 C C . ILE C 10 ? 0.4804 0.4198 0.4544 -0.0762 -0.0524 -0.0829 10 ILE C C 3352 O O . ILE C 10 ? 0.5078 0.4757 0.5223 -0.0833 -0.0542 -0.0993 10 ILE C O 3353 C CB . ILE C 10 ? 0.3863 0.2971 0.2726 -0.0264 -0.0757 -0.0989 10 ILE C CB 3354 C CG1 . ILE C 10 ? 0.5032 0.3866 0.3282 0.0049 -0.0819 -0.0960 10 ILE C CG1 3355 C CG2 . ILE C 10 ? 0.4054 0.2861 0.2682 -0.0261 -0.0646 -0.0909 10 ILE C CG2 3356 C CD1 . ILE C 10 ? 0.6062 0.5220 0.4199 0.0402 -0.1091 -0.1270 10 ILE C CD1 3357 N N . LEU C 11 ? 0.5036 0.4258 0.4748 -0.0855 -0.0386 -0.0680 11 LEU C N 3358 C CA . LEU C 11 ? 0.4192 0.3472 0.4236 -0.0988 -0.0253 -0.0647 11 LEU C CA 3359 C C . LEU C 11 ? 0.3895 0.3006 0.3819 -0.0968 -0.0214 -0.0666 11 LEU C C 3360 O O . LEU C 11 ? 0.3843 0.2832 0.3597 -0.0963 -0.0132 -0.0524 11 LEU C O 3361 C CB . LEU C 11 ? 0.3463 0.2773 0.3561 -0.1033 -0.0133 -0.0442 11 LEU C CB 3362 C CG . LEU C 11 ? 0.4093 0.3353 0.4341 -0.1051 0.0045 -0.0346 11 LEU C CG 3363 C CD1 . LEU C 11 ? 0.4543 0.3759 0.5076 -0.1138 0.0160 -0.0464 11 LEU C CD1 3364 C CD2 . LEU C 11 ? 0.4557 0.3923 0.4761 -0.0967 0.0104 -0.0187 11 LEU C CD2 3365 N N . SER C 12 ? 0.3722 0.2880 0.3785 -0.0957 -0.0269 -0.0891 12 SER C N 3366 C CA . SER C 12 ? 0.4360 0.3361 0.4310 -0.0919 -0.0242 -0.0943 12 SER C CA 3367 C C . SER C 12 ? 0.4885 0.3795 0.5119 -0.1054 -0.0039 -0.0892 12 SER C C 3368 O O . SER C 12 ? 0.5258 0.4219 0.5854 -0.1179 0.0061 -0.1021 12 SER C O 3369 C CB . SER C 12 ? 0.4542 0.3669 0.4461 -0.0782 -0.0431 -0.1277 12 SER C CB 3370 O OG . SER C 12 ? 0.5476 0.4416 0.5136 -0.0674 -0.0431 -0.1307 12 SER C OG 3371 N N . VAL C 13 ? 0.3986 0.2726 0.4037 -0.1014 0.0063 -0.0716 13 VAL C N 3372 C CA . VAL C 13 ? 0.4789 0.3365 0.4947 -0.1041 0.0274 -0.0611 13 VAL C CA 3373 C C . VAL C 13 ? 0.5100 0.3523 0.5071 -0.0959 0.0304 -0.0607 13 VAL C C 3374 O O . VAL C 13 ? 0.5043 0.3496 0.4785 -0.0888 0.0201 -0.0619 13 VAL C O 3375 C CB . VAL C 13 ? 0.5937 0.4574 0.6038 -0.0976 0.0368 -0.0365 13 VAL C CB 3376 C CG1 . VAL C 13 ? 0.6024 0.4791 0.5931 -0.0877 0.0325 -0.0266 13 VAL C CG1 3377 C CG2 . VAL C 13 ? 0.6526 0.4909 0.6663 -0.0928 0.0625 -0.0258 13 VAL C CG2 3378 N N . SER C 14 ? 0.5219 0.3398 0.5244 -0.0950 0.0499 -0.0579 14 SER C N 3379 C CA . SER C 14 ? 0.5655 0.3670 0.5501 -0.0849 0.0552 -0.0568 14 SER C CA 3380 C C . SER C 14 ? 0.5871 0.3940 0.5537 -0.0679 0.0642 -0.0331 14 SER C C 3381 O O . SER C 14 ? 0.6366 0.4482 0.6035 -0.0607 0.0721 -0.0188 14 SER C O 3382 C CB . SER C 14 ? 0.5831 0.3504 0.5817 -0.0916 0.0730 -0.0722 14 SER C CB 3383 O OG . SER C 14 ? 0.6409 0.4182 0.6700 -0.1081 0.0639 -0.1051 14 SER C OG 3384 N N . PRO C 15 ? 0.5699 0.3815 0.5205 -0.0572 0.0630 -0.0316 15 PRO C N 3385 C CA . PRO C 15 ? 0.5339 0.3673 0.4757 -0.0384 0.0685 -0.0184 15 PRO C CA 3386 C C . PRO C 15 ? 0.5588 0.3665 0.4870 -0.0173 0.0864 -0.0060 15 PRO C C 3387 O O . PRO C 15 ? 0.5877 0.3492 0.5094 -0.0186 0.1018 -0.0080 15 PRO C O 3388 C CB . PRO C 15 ? 0.5211 0.3601 0.4526 -0.0336 0.0682 -0.0244 15 PRO C CB 3389 C CG . PRO C 15 ? 0.4974 0.3214 0.4241 -0.0481 0.0589 -0.0365 15 PRO C CG 3390 C CD . PRO C 15 ? 0.5015 0.3051 0.4406 -0.0583 0.0558 -0.0453 15 PRO C CD 3391 N N . GLY C 16 ? 0.5867 0.4223 0.5073 0.0054 0.0866 0.0044 16 GLY C N 3392 C CA . GLY C 16 ? 0.4984 0.3050 0.3891 0.0383 0.1055 0.0202 16 GLY C CA 3393 C C . GLY C 16 ? 0.6627 0.4310 0.5478 0.0349 0.1222 0.0315 16 GLY C C 3394 O O . GLY C 16 ? 0.5686 0.3110 0.4181 0.0695 0.1411 0.0489 16 GLY C O 3395 N N . GLU C 17 ? 0.5813 0.3448 0.4964 -0.0012 0.1180 0.0213 17 GLU C N 3396 C CA . GLU C 17 ? 0.5970 0.3296 0.5157 -0.0089 0.1373 0.0281 17 GLU C CA 3397 C C . GLU C 17 ? 0.6365 0.4025 0.5435 0.0113 0.1286 0.0406 17 GLU C C 3398 O O . GLU C 17 ? 0.4681 0.2897 0.3769 0.0228 0.1037 0.0364 17 GLU C O 3399 C CB . GLU C 17 ? 0.5649 0.3018 0.5253 -0.0494 0.1295 0.0063 17 GLU C CB 3400 C CG . GLU C 17 ? 0.6370 0.3400 0.6151 -0.0693 0.1417 -0.0145 17 GLU C CG 3401 C CD . GLU C 17 ? 0.8650 0.5832 0.8878 -0.1017 0.1344 -0.0431 17 GLU C CD 3402 O OE1 . GLU C 17 ? 0.9901 0.6902 1.0362 -0.1141 0.1574 -0.0554 17 GLU C OE1 3403 O OE2 . GLU C 17 ? 0.8024 0.5659 0.8349 -0.1073 0.1022 -0.0533 17 GLU C OE2 3404 N N . ARG C 18 ? 0.7295 0.4607 0.6272 0.0146 0.1528 0.0526 18 ARG C N 3405 C CA . ARG C 18 ? 0.6784 0.4365 0.5641 0.0333 0.1459 0.0628 18 ARG C CA 3406 C C . ARG C 18 ? 0.6178 0.4122 0.5461 -0.0031 0.1243 0.0475 18 ARG C C 3407 O O . ARG C 18 ? 0.6884 0.4670 0.6482 -0.0366 0.1301 0.0341 18 ARG C O 3408 C CB . ARG C 18 ? 0.8150 0.5086 0.6611 0.0585 0.1888 0.0861 18 ARG C CB 3409 C CG . ARG C 18 ? 0.9820 0.6955 0.8089 0.0818 0.1858 0.0977 18 ARG C CG 3410 C CD . ARG C 18 ? 1.0805 0.8157 0.8518 0.1449 0.1766 0.1098 18 ARG C CD 3411 N NE . ARG C 18 ? 1.2131 0.9223 0.9371 0.1835 0.1979 0.1305 18 ARG C NE 3412 C CZ . ARG C 18 ? 1.3217 1.0658 0.9981 0.2436 0.1824 0.1352 18 ARG C CZ 3413 N NH1 . ARG C 18 ? 1.3190 1.1338 1.0002 0.2670 0.1453 0.1155 18 ARG C NH1 3414 N NH2 . ARG C 18 ? 1.3875 1.1004 1.0132 0.2822 0.2046 0.1555 18 ARG C NH2 3415 N N . VAL C 19 ? 0.5375 0.2429 0.2811 0.0099 0.0565 -0.0628 19 VAL C N 3416 C CA . VAL C 19 ? 0.4813 0.2308 0.2509 -0.0034 0.0472 -0.0645 19 VAL C CA 3417 C C . VAL C 19 ? 0.4474 0.2310 0.2498 -0.0116 0.0418 -0.0568 19 VAL C C 3418 O O . VAL C 19 ? 0.4735 0.2648 0.2887 0.0004 0.0462 -0.0465 19 VAL C O 3419 C CB . VAL C 19 ? 0.5412 0.3165 0.3208 0.0118 0.0512 -0.0622 19 VAL C CB 3420 C CG1 . VAL C 19 ? 0.4564 0.2714 0.2597 -0.0002 0.0396 -0.0629 19 VAL C CG1 3421 C CG2 . VAL C 19 ? 0.4892 0.2295 0.2319 0.0192 0.0582 -0.0710 19 VAL C CG2 3422 N N . SER C 20 ? 0.4061 0.2109 0.2215 -0.0315 0.0322 -0.0618 20 SER C N 3423 C CA . SER C 20 ? 0.4356 0.2717 0.2786 -0.0400 0.0286 -0.0568 20 SER C CA 3424 C C . SER C 20 ? 0.4568 0.3335 0.3243 -0.0456 0.0196 -0.0605 20 SER C C 3425 O O . SER C 20 ? 0.4579 0.3382 0.3231 -0.0586 0.0121 -0.0694 20 SER C O 3426 C CB . SER C 20 ? 0.5066 0.3243 0.3392 -0.0599 0.0282 -0.0590 20 SER C CB 3427 O OG . SER C 20 ? 0.7276 0.5051 0.5370 -0.0531 0.0351 -0.0534 20 SER C OG 3428 N N . PHE C 21 ? 0.4434 0.3489 0.3328 -0.0358 0.0187 -0.0536 21 PHE C N 3429 C CA . PHE C 21 ? 0.3481 0.2877 0.2588 -0.0384 0.0097 -0.0563 21 PHE C CA 3430 C C . PHE C 21 ? 0.3570 0.3170 0.2857 -0.0477 0.0092 -0.0562 21 PHE C C 3431 O O . PHE C 21 ? 0.2801 0.2350 0.2088 -0.0464 0.0152 -0.0490 21 PHE C O 3432 C CB . PHE C 21 ? 0.3009 0.2548 0.2193 -0.0242 0.0084 -0.0490 21 PHE C CB 3433 C CG . PHE C 21 ? 0.3446 0.2825 0.2461 -0.0142 0.0129 -0.0473 21 PHE C CG 3434 C CD1 . PHE C 21 ? 0.4114 0.3363 0.3065 -0.0027 0.0232 -0.0396 21 PHE C CD1 3435 C CD2 . PHE C 21 ? 0.4241 0.3612 0.3158 -0.0152 0.0069 -0.0531 21 PHE C CD2 3436 C CE1 . PHE C 21 ? 0.4407 0.3552 0.3218 0.0083 0.0302 -0.0386 21 PHE C CE1 3437 C CE2 . PHE C 21 ? 0.4374 0.3598 0.3104 -0.0066 0.0134 -0.0520 21 PHE C CE2 3438 C CZ . PHE C 21 ? 0.4054 0.3182 0.2741 0.0056 0.0263 -0.0451 21 PHE C CZ 3439 N N . SER C 22 ? 0.4060 0.3900 0.3497 -0.0563 0.0020 -0.0640 22 SER C N 3440 C CA . SER C 22 ? 0.3211 0.3300 0.2836 -0.0639 0.0035 -0.0656 22 SER C CA 3441 C C . SER C 22 ? 0.2622 0.2966 0.2417 -0.0523 -0.0019 -0.0651 22 SER C C 3442 O O . SER C 22 ? 0.2544 0.2961 0.2371 -0.0449 -0.0114 -0.0678 22 SER C O 3443 C CB . SER C 22 ? 0.4671 0.4911 0.4386 -0.0812 0.0004 -0.0748 22 SER C CB 3444 O OG . SER C 22 ? 0.5605 0.6187 0.5555 -0.0855 0.0025 -0.0776 22 SER C OG 3445 N N . CYS C 23 ? 0.2377 0.2805 0.2232 -0.0512 0.0035 -0.0614 23 CYS C N 3446 C CA . CYS C 23 ? 0.3051 0.3663 0.3017 -0.0410 -0.0010 -0.0619 23 CYS C CA 3447 C C . CYS C 23 ? 0.3896 0.4677 0.3956 -0.0475 0.0069 -0.0652 23 CYS C C 3448 O O . CYS C 23 ? 0.4537 0.5185 0.4487 -0.0529 0.0152 -0.0590 23 CYS C O 3449 C CB . CYS C 23 ? 0.2831 0.3290 0.2683 -0.0308 -0.0028 -0.0516 23 CYS C CB 3450 S SG . CYS C 23 ? 0.4630 0.5183 0.4508 -0.0212 -0.0087 -0.0508 23 CYS C SG 3451 N N . ARG C 24 ? 0.3053 0.4131 0.3310 -0.0466 0.0046 -0.0746 24 ARG C N 3452 C CA . ARG C 24 ? 0.2741 0.4043 0.3110 -0.0520 0.0147 -0.0793 24 ARG C CA 3453 C C . ARG C 24 ? 0.3026 0.4458 0.3459 -0.0353 0.0117 -0.0833 24 ARG C C 3454 O O . ARG C 24 ? 0.3755 0.5258 0.4267 -0.0225 -0.0001 -0.0872 24 ARG C O 3455 C CB . ARG C 24 ? 0.4032 0.5637 0.4613 -0.0655 0.0170 -0.0875 24 ARG C CB 3456 C CG . ARG C 24 ? 0.6205 0.7617 0.6676 -0.0816 0.0154 -0.0851 24 ARG C CG 3457 C CD . ARG C 24 ? 0.7366 0.8947 0.7919 -0.1048 0.0239 -0.0883 24 ARG C CD 3458 N NE . ARG C 24 ? 0.7909 0.9991 0.8800 -0.1073 0.0215 -0.0976 24 ARG C NE 3459 C CZ . ARG C 24 ? 0.7047 0.9493 0.8137 -0.1098 0.0327 -0.1017 24 ARG C CZ 3460 N NH1 . ARG C 24 ? 0.7054 0.9369 0.7988 -0.1121 0.0467 -0.0974 24 ARG C NH1 3461 N NH2 . ARG C 24 ? 0.5646 0.8600 0.7090 -0.1095 0.0299 -0.1099 24 ARG C NH2 3462 N N . ALA C 25 ? 0.2639 0.4051 0.2989 -0.0355 0.0217 -0.0823 25 ALA C N 3463 C CA . ALA C 25 ? 0.3484 0.4929 0.3810 -0.0197 0.0204 -0.0865 25 ALA C CA 3464 C C . ALA C 25 ? 0.3507 0.5339 0.4061 -0.0167 0.0300 -0.0983 25 ALA C C 3465 O O . ALA C 25 ? 0.3375 0.5425 0.4050 -0.0321 0.0419 -0.1006 25 ALA C O 3466 C CB . ALA C 25 ? 0.3164 0.4319 0.3211 -0.0211 0.0247 -0.0784 25 ALA C CB 3467 N N . SER C 26 ? 0.3371 0.5285 0.3975 0.0034 0.0249 -0.1057 26 SER C N 3468 C CA . SER C 26 ? 0.3650 0.5979 0.4507 0.0118 0.0343 -0.1179 26 SER C CA 3469 C C . SER C 26 ? 0.4286 0.6656 0.5036 0.0046 0.0549 -0.1198 26 SER C C 3470 O O . SER C 26 ? 0.4720 0.7510 0.5711 0.0038 0.0685 -0.1285 26 SER C O 3471 C CB . SER C 26 ? 0.2151 0.4482 0.3038 0.0390 0.0228 -0.1252 26 SER C CB 3472 O OG . SER C 26 ? 0.3804 0.5688 0.4329 0.0475 0.0181 -0.1208 26 SER C OG 3473 N N . GLN C 27 ? 0.3843 0.5809 0.4238 -0.0012 0.0573 -0.1115 27 GLN C N 3474 C CA . GLN C 27 ? 0.4153 0.6082 0.4370 -0.0123 0.0757 -0.1112 27 GLN C CA 3475 C C . GLN C 27 ? 0.4130 0.5641 0.4037 -0.0280 0.0723 -0.0968 27 GLN C C 3476 O O . GLN C 27 ? 0.3275 0.4581 0.3146 -0.0282 0.0577 -0.0883 27 GLN C O 3477 C CB . GLN C 27 ? 0.4915 0.6788 0.4973 0.0062 0.0822 -0.1200 27 GLN C CB 3478 C CG . GLN C 27 ? 0.5874 0.7234 0.5544 0.0137 0.0694 -0.1133 27 GLN C CG 3479 C CD . GLN C 27 ? 0.6443 0.7688 0.5923 0.0341 0.0730 -0.1238 27 GLN C CD 3480 O OE1 . GLN C 27 ? 0.6719 0.8162 0.6390 0.0553 0.0703 -0.1348 27 GLN C OE1 3481 N NE2 . GLN C 27 ? 0.6488 0.7382 0.5561 0.0287 0.0781 -0.1206 27 GLN C NE2 3482 N N . SER C 28 ? 0.4254 0.5649 0.3934 -0.0406 0.0859 -0.0937 28 SER C N 3483 C CA . SER C 28 ? 0.4242 0.5260 0.3639 -0.0549 0.0820 -0.0794 28 SER C CA 3484 C C . SER C 28 ? 0.3736 0.4397 0.2883 -0.0442 0.0672 -0.0723 28 SER C C 3485 O O . SER C 28 ? 0.3610 0.4196 0.2620 -0.0318 0.0665 -0.0784 28 SER C O 3486 C CB . SER C 28 ? 0.4232 0.5195 0.3412 -0.0721 0.0992 -0.0774 28 SER C CB 3487 O OG . SER C 28 ? 0.5295 0.5902 0.4225 -0.0854 0.0936 -0.0627 28 SER C OG 3488 N N . ILE C 29 ? 0.3343 0.3783 0.2425 -0.0493 0.0552 -0.0593 29 ILE C N 3489 C CA . ILE C 29 ? 0.3201 0.3362 0.2094 -0.0429 0.0398 -0.0501 29 ILE C CA 3490 C C . ILE C 29 ? 0.3543 0.3461 0.2255 -0.0548 0.0359 -0.0344 29 ILE C C 3491 O O . ILE C 29 ? 0.2783 0.2546 0.1432 -0.0520 0.0220 -0.0236 29 ILE C O 3492 C CB . ILE C 29 ? 0.2702 0.2921 0.1778 -0.0316 0.0259 -0.0500 29 ILE C CB 3493 C CG1 . ILE C 29 ? 0.2323 0.2658 0.1610 -0.0371 0.0260 -0.0468 29 ILE C CG1 3494 C CG2 . ILE C 29 ? 0.2506 0.2890 0.1699 -0.0168 0.0253 -0.0639 29 ILE C CG2 3495 C CD1 . ILE C 29 ? 0.2876 0.3252 0.2302 -0.0277 0.0138 -0.0465 29 ILE C CD1 3496 N N . GLY C 30 ? 0.2973 0.2867 0.1606 -0.0681 0.0475 -0.0325 30 GLY C N 3497 C CA . GLY C 30 ? 0.3113 0.2747 0.1552 -0.0777 0.0428 -0.0173 30 GLY C CA 3498 C C . GLY C 30 ? 0.2983 0.2602 0.1589 -0.0735 0.0331 -0.0089 30 GLY C C 3499 O O . GLY C 30 ? 0.2967 0.2701 0.1751 -0.0750 0.0381 -0.0134 30 GLY C O 3500 N N . THR C 31 ? 0.2907 0.2389 0.1448 -0.0685 0.0194 0.0035 31 THR C N 3501 C CA . THR C 31 ? 0.4510 0.4009 0.3215 -0.0614 0.0113 0.0117 31 THR C CA 3502 C C . THR C 31 ? 0.3518 0.3104 0.2318 -0.0519 -0.0008 0.0143 31 THR C C 3503 O O . THR C 31 ? 0.3268 0.2870 0.2161 -0.0467 -0.0085 0.0247 31 THR C O 3504 C CB . THR C 31 ? 0.4963 0.4258 0.3541 -0.0643 0.0067 0.0271 31 THR C CB 3505 O OG1 . THR C 31 ? 0.5569 0.4739 0.3943 -0.0679 -0.0025 0.0364 31 THR C OG1 3506 C CG2 . THR C 31 ? 0.5272 0.4424 0.3726 -0.0750 0.0178 0.0255 31 THR C CG2 3507 N N . ASN C 32 ? 0.3441 0.3076 0.2207 -0.0494 -0.0021 0.0052 32 ASN C N 3508 C CA . ASN C 32 ? 0.3620 0.3265 0.2398 -0.0436 -0.0150 0.0084 32 ASN C CA 3509 C C . ASN C 32 ? 0.3407 0.3218 0.2405 -0.0353 -0.0152 0.0012 32 ASN C C 3510 O O . ASN C 32 ? 0.2613 0.2467 0.1624 -0.0297 -0.0168 -0.0091 32 ASN C O 3511 C CB . ASN C 32 ? 0.3830 0.3346 0.2380 -0.0442 -0.0181 0.0024 32 ASN C CB 3512 C CG . ASN C 32 ? 0.5445 0.4822 0.3844 -0.0471 -0.0347 0.0136 32 ASN C CG 3513 O OD1 . ASN C 32 ? 0.6220 0.5681 0.4754 -0.0454 -0.0437 0.0213 32 ASN C OD1 3514 N ND2 . ASN C 32 ? 0.5897 0.5054 0.3993 -0.0534 -0.0386 0.0148 32 ASN C ND2 3515 N N . ILE C 33 ? 0.2832 0.2709 0.1976 -0.0336 -0.0140 0.0068 33 ILE C N 3516 C CA . ILE C 33 ? 0.2565 0.2562 0.1871 -0.0272 -0.0144 0.0015 33 ILE C CA 3517 C C . ILE C 33 ? 0.3171 0.3194 0.2544 -0.0242 -0.0192 0.0141 33 ILE C C 3518 O O . ILE C 33 ? 0.3129 0.3114 0.2499 -0.0249 -0.0181 0.0245 33 ILE C O 3519 C CB . ILE C 33 ? 0.3252 0.3315 0.2659 -0.0284 -0.0039 -0.0090 33 ILE C CB 3520 C CG1 . ILE C 33 ? 0.4122 0.4292 0.3651 -0.0227 -0.0067 -0.0165 33 ILE C CG1 3521 C CG2 . ILE C 33 ? 0.3545 0.3511 0.2934 -0.0317 0.0021 -0.0020 33 ILE C CG2 3522 C CD1 . ILE C 33 ? 0.4576 0.4851 0.4148 -0.0192 -0.0094 -0.0286 33 ILE C CD1 3523 N N . HIS C 34 ? 0.4439 0.4535 0.3868 -0.0204 -0.0247 0.0136 34 HIS C N 3524 C CA . HIS C 34 ? 0.3925 0.4102 0.3432 -0.0176 -0.0269 0.0246 34 HIS C CA 3525 C C . HIS C 34 ? 0.2832 0.3059 0.2404 -0.0125 -0.0227 0.0171 34 HIS C C 3526 O O . HIS C 34 ? 0.3326 0.3539 0.2873 -0.0121 -0.0248 0.0061 34 HIS C O 3527 C CB . HIS C 34 ? 0.3681 0.3882 0.3133 -0.0224 -0.0389 0.0346 34 HIS C CB 3528 C CG . HIS C 34 ? 0.3525 0.3632 0.2852 -0.0294 -0.0459 0.0410 34 HIS C CG 3529 N ND1 . HIS C 34 ? 0.3685 0.3761 0.3008 -0.0305 -0.0428 0.0470 34 HIS C ND1 3530 C CD2 . HIS C 34 ? 0.3280 0.3266 0.2431 -0.0361 -0.0569 0.0423 34 HIS C CD2 3531 C CE1 . HIS C 34 ? 0.3338 0.3299 0.2494 -0.0384 -0.0515 0.0518 34 HIS C CE1 3532 N NE2 . HIS C 34 ? 0.3480 0.3377 0.2523 -0.0419 -0.0599 0.0486 34 HIS C NE2 3533 N N . TRP C 35 ? 0.2769 0.3051 0.2411 -0.0076 -0.0169 0.0232 35 TRP C N 3534 C CA . TRP C 35 ? 0.2774 0.3057 0.2421 -0.0031 -0.0116 0.0164 35 TRP C CA 3535 C C . TRP C 35 ? 0.1709 0.2111 0.1381 -0.0012 -0.0128 0.0252 35 TRP C C 3536 O O . TRP C 35 ? 0.1700 0.2228 0.1452 -0.0008 -0.0134 0.0383 35 TRP C O 3537 C CB . TRP C 35 ? 0.2882 0.3070 0.2529 0.0020 -0.0008 0.0132 35 TRP C CB 3538 C CG . TRP C 35 ? 0.3292 0.3366 0.2894 -0.0036 0.0016 0.0032 35 TRP C CG 3539 C CD1 . TRP C 35 ? 0.3771 0.3779 0.3350 -0.0079 0.0029 0.0057 35 TRP C CD1 3540 C CD2 . TRP C 35 ? 0.3511 0.3544 0.3084 -0.0075 0.0027 -0.0101 35 TRP C CD2 3541 N NE1 . TRP C 35 ? 0.4474 0.4420 0.4019 -0.0151 0.0066 -0.0053 35 TRP C NE1 3542 C CE2 . TRP C 35 ? 0.3903 0.3885 0.3466 -0.0151 0.0058 -0.0150 35 TRP C CE2 3543 C CE3 . TRP C 35 ? 0.3108 0.3148 0.2653 -0.0068 0.0004 -0.0178 35 TRP C CE3 3544 C CZ2 . TRP C 35 ? 0.4266 0.4256 0.3837 -0.0225 0.0070 -0.0269 35 TRP C CZ2 3545 C CZ3 . TRP C 35 ? 0.3182 0.3203 0.2720 -0.0131 -0.0004 -0.0297 35 TRP C CZ3 3546 C CH2 . TRP C 35 ? 0.4430 0.4451 0.4004 -0.0212 0.0029 -0.0339 35 TRP C CH2 3547 N N . TYR C 36 ? 0.2330 0.2709 0.1932 -0.0012 -0.0134 0.0185 36 TYR C N 3548 C CA . TYR C 36 ? 0.1772 0.2250 0.1352 -0.0024 -0.0140 0.0261 36 TYR C CA 3549 C C . TYR C 36 ? 0.2209 0.2631 0.1706 0.0025 -0.0054 0.0191 36 TYR C C 3550 O O . TYR C 36 ? 0.2713 0.2994 0.2139 0.0037 -0.0047 0.0068 36 TYR C O 3551 C CB . TYR C 36 ? 0.1790 0.2226 0.1264 -0.0108 -0.0278 0.0272 36 TYR C CB 3552 C CG . TYR C 36 ? 0.2977 0.3423 0.2463 -0.0171 -0.0371 0.0351 36 TYR C CG 3553 C CD1 . TYR C 36 ? 0.1786 0.2372 0.1314 -0.0241 -0.0404 0.0503 36 TYR C CD1 3554 C CD2 . TYR C 36 ? 0.2339 0.2663 0.1783 -0.0171 -0.0423 0.0273 36 TYR C CD2 3555 C CE1 . TYR C 36 ? 0.2100 0.2658 0.1595 -0.0321 -0.0509 0.0577 36 TYR C CE1 3556 C CE2 . TYR C 36 ? 0.2799 0.3078 0.2189 -0.0231 -0.0506 0.0336 36 TYR C CE2 3557 C CZ . TYR C 36 ? 0.3102 0.3475 0.2501 -0.0313 -0.0560 0.0489 36 TYR C CZ 3558 O OH . TYR C 36 ? 0.3086 0.3378 0.2390 -0.0395 -0.0663 0.0554 36 TYR C OH 3559 N N . GLN C 37 ? 0.2950 0.3494 0.2447 0.0041 0.0012 0.0271 37 GLN C N 3560 C CA . GLN C 37 ? 0.2108 0.2583 0.1466 0.0078 0.0100 0.0213 37 GLN C CA 3561 C C . GLN C 37 ? 0.3653 0.4192 0.2902 -0.0009 0.0054 0.0276 37 GLN C C 3562 O O . GLN C 37 ? 0.3996 0.4730 0.3340 -0.0067 0.0035 0.0408 37 GLN C O 3563 C CB . GLN C 37 ? 0.2204 0.2751 0.1628 0.0203 0.0272 0.0244 37 GLN C CB 3564 C CG . GLN C 37 ? 0.2437 0.2894 0.1671 0.0250 0.0388 0.0184 37 GLN C CG 3565 C CD . GLN C 37 ? 0.2563 0.3178 0.1888 0.0392 0.0569 0.0249 37 GLN C CD 3566 O OE1 . GLN C 37 ? 0.2495 0.3421 0.1980 0.0384 0.0607 0.0378 37 GLN C OE1 3567 N NE2 . GLN C 37 ? 0.2936 0.3341 0.2160 0.0522 0.0680 0.0162 37 GLN C NE2 3568 N N . GLN C 38 ? 0.3382 0.3746 0.2413 -0.0038 0.0020 0.0190 38 GLN C N 3569 C CA . GLN C 38 ? 0.3765 0.4121 0.2619 -0.0132 -0.0028 0.0247 38 GLN C CA 3570 C C . GLN C 38 ? 0.3671 0.3932 0.2316 -0.0102 0.0089 0.0191 38 GLN C C 3571 O O . GLN C 38 ? 0.4382 0.4419 0.2861 -0.0088 0.0045 0.0069 38 GLN C O 3572 C CB . GLN C 38 ? 0.3948 0.4120 0.2668 -0.0206 -0.0232 0.0208 38 GLN C CB 3573 C CG . GLN C 38 ? 0.3834 0.3936 0.2325 -0.0321 -0.0308 0.0287 38 GLN C CG 3574 C CD . GLN C 38 ? 0.3592 0.3466 0.1932 -0.0362 -0.0526 0.0254 38 GLN C CD 3575 O OE1 . GLN C 38 ? 0.3496 0.3247 0.1834 -0.0290 -0.0608 0.0133 38 GLN C OE1 3576 N NE2 . GLN C 38 ? 0.2923 0.2740 0.1135 -0.0476 -0.0624 0.0364 38 GLN C NE2 3577 N N . ARG C 39 ? 0.2827 0.3270 0.1476 -0.0099 0.0239 0.0281 39 ARG C N 3578 C CA . ARG C 39 ? 0.3120 0.3474 0.1522 -0.0078 0.0373 0.0238 39 ARG C CA 3579 C C . ARG C 39 ? 0.3326 0.3560 0.1442 -0.0230 0.0271 0.0274 39 ARG C C 3580 O O . ARG C 39 ? 0.4854 0.5083 0.2978 -0.0341 0.0105 0.0345 39 ARG C O 3581 C CB . ARG C 39 ? 0.3170 0.3813 0.1719 0.0015 0.0605 0.0316 39 ARG C CB 3582 C CG . ARG C 39 ? 0.4036 0.4706 0.2783 0.0197 0.0712 0.0269 39 ARG C CG 3583 C CD . ARG C 39 ? 0.4234 0.5287 0.3246 0.0305 0.0890 0.0386 39 ARG C CD 3584 N NE . ARG C 39 ? 0.5399 0.6390 0.4507 0.0515 0.1008 0.0328 39 ARG C NE 3585 C CZ . ARG C 39 ? 0.6752 0.8050 0.6126 0.0670 0.1149 0.0415 39 ARG C CZ 3586 N NH1 . ARG C 39 ? 0.6865 0.8618 0.6476 0.0619 0.1193 0.0568 39 ARG C NH1 3587 N NH2 . ARG C 39 ? 0.7578 0.8728 0.6980 0.0873 0.1234 0.0355 39 ARG C NH2 3588 N N . THR C 40 ? 0.4154 0.4243 0.1968 -0.0235 0.0369 0.0226 40 THR C N 3589 C CA . THR C 40 ? 0.4767 0.4674 0.2236 -0.0382 0.0267 0.0256 40 THR C CA 3590 C C . THR C 40 ? 0.5361 0.5502 0.2878 -0.0523 0.0280 0.0429 40 THR C C 3591 O O . THR C 40 ? 0.3889 0.4372 0.1601 -0.0503 0.0474 0.0517 40 THR C O 3592 C CB . THR C 40 ? 0.4315 0.4025 0.1419 -0.0364 0.0401 0.0177 40 THR C CB 3593 O OG1 . THR C 40 ? 0.5169 0.4620 0.2188 -0.0275 0.0350 0.0020 40 THR C OG1 3594 C CG2 . THR C 40 ? 0.4656 0.4149 0.1355 -0.0530 0.0290 0.0222 40 THR C CG2 3595 N N . ASN C 41 ? 0.5012 0.4968 0.2353 -0.0665 0.0064 0.0480 41 ASN C N 3596 C CA . ASN C 41 ? 0.4295 0.4366 0.1610 -0.0844 0.0020 0.0643 41 ASN C CA 3597 C C . ASN C 41 ? 0.4428 0.4844 0.2129 -0.0857 0.0035 0.0749 41 ASN C C 3598 O O . ASN C 41 ? 0.5387 0.5963 0.3159 -0.1004 0.0025 0.0880 41 ASN C O 3599 C CB . ASN C 41 ? 0.4576 0.4756 0.1748 -0.0924 0.0204 0.0706 41 ASN C CB 3600 C CG . ASN C 41 ? 0.5566 0.5372 0.2359 -0.0932 0.0154 0.0617 41 ASN C CG 3601 O OD1 . ASN C 41 ? 0.4996 0.4818 0.1624 -0.0889 0.0344 0.0576 41 ASN C OD1 3602 N ND2 . ASN C 41 ? 0.5985 0.5460 0.2663 -0.0969 -0.0099 0.0582 41 ASN C ND2 3603 N N . GLY C 42 ? 0.3655 0.4163 0.1660 -0.0698 0.0046 0.0677 42 GLY C N 3604 C CA . GLY C 42 ? 0.4092 0.4912 0.2455 -0.0700 0.0056 0.0775 42 GLY C CA 3605 C C . GLY C 42 ? 0.3414 0.4070 0.1845 -0.0704 -0.0155 0.0752 42 GLY C C 3606 O O . GLY C 42 ? 0.4239 0.4586 0.2526 -0.0648 -0.0281 0.0631 42 GLY C O 3607 N N . SER C 43 ? 0.2892 0.3768 0.1542 -0.0773 -0.0194 0.0869 43 SER C N 3608 C CA . SER C 43 ? 0.2753 0.3480 0.1460 -0.0764 -0.0362 0.0843 43 SER C CA 3609 C C . SER C 43 ? 0.2491 0.3312 0.1458 -0.0579 -0.0278 0.0753 43 SER C C 3610 O O . SER C 43 ? 0.2883 0.3944 0.2039 -0.0479 -0.0103 0.0764 43 SER C O 3611 C CB . SER C 43 ? 0.2772 0.3647 0.1563 -0.0933 -0.0451 0.1000 43 SER C CB 3612 O OG . SER C 43 ? 0.3039 0.3766 0.1661 -0.1094 -0.0516 0.1031 43 SER C OG 3613 N N . PRO C 44 ? 0.2961 0.3578 0.1920 -0.0526 -0.0394 0.0664 44 PRO C N 3614 C CA . PRO C 44 ? 0.2455 0.3122 0.1613 -0.0379 -0.0316 0.0580 44 PRO C CA 3615 C C . PRO C 44 ? 0.3260 0.4219 0.2683 -0.0363 -0.0243 0.0695 44 PRO C C 3616 O O . PRO C 44 ? 0.4037 0.5097 0.3507 -0.0476 -0.0335 0.0816 44 PRO C O 3617 C CB . PRO C 44 ? 0.2524 0.2952 0.1606 -0.0367 -0.0461 0.0487 44 PRO C CB 3618 C CG . PRO C 44 ? 0.3135 0.3412 0.2015 -0.0498 -0.0622 0.0555 44 PRO C CG 3619 C CD . PRO C 44 ? 0.2513 0.2823 0.1254 -0.0586 -0.0591 0.0625 44 PRO C CD 3620 N N . ARG C 45 ? 0.3874 0.4944 0.3449 -0.0221 -0.0091 0.0661 45 ARG C N 3621 C CA . ARG C 45 ? 0.2538 0.3867 0.2374 -0.0156 -0.0026 0.0761 45 ARG C CA 3622 C C . ARG C 45 ? 0.1808 0.2983 0.1687 -0.0085 -0.0062 0.0694 45 ARG C C 3623 O O . ARG C 45 ? 0.4404 0.5356 0.4184 -0.0019 -0.0032 0.0555 45 ARG C O 3624 C CB . ARG C 45 ? 0.2524 0.4047 0.2472 -0.0019 0.0173 0.0773 45 ARG C CB 3625 C CG . ARG C 45 ? 0.3972 0.5732 0.4198 0.0108 0.0237 0.0861 45 ARG C CG 3626 C CD . ARG C 45 ? 0.5999 0.8040 0.6373 0.0252 0.0433 0.0908 45 ARG C CD 3627 N NE . ARG C 45 ? 0.7209 0.9000 0.7437 0.0425 0.0579 0.0764 45 ARG C NE 3628 C CZ . ARG C 45 ? 0.6023 0.7931 0.6360 0.0632 0.0749 0.0770 45 ARG C CZ 3629 N NH1 . ARG C 45 ? 0.4579 0.6919 0.5234 0.0707 0.0796 0.0920 45 ARG C NH1 3630 N NH2 . ARG C 45 ? 0.5366 0.6956 0.5491 0.0769 0.0864 0.0628 45 ARG C NH2 3631 N N . LEU C 46 ? 0.1745 0.3041 0.1759 -0.0119 -0.0133 0.0801 46 LEU C N 3632 C CA . LEU C 46 ? 0.2727 0.3873 0.2750 -0.0074 -0.0167 0.0758 46 LEU C CA 3633 C C . LEU C 46 ? 0.3417 0.4601 0.3564 0.0090 -0.0037 0.0753 46 LEU C C 3634 O O . LEU C 46 ? 0.3444 0.4887 0.3776 0.0168 0.0027 0.0862 46 LEU C O 3635 C CB . LEU C 46 ? 0.2887 0.4101 0.2948 -0.0183 -0.0307 0.0879 46 LEU C CB 3636 C CG . LEU C 46 ? 0.3153 0.4213 0.3186 -0.0162 -0.0348 0.0861 46 LEU C CG 3637 C CD1 . LEU C 46 ? 0.3548 0.4315 0.3386 -0.0176 -0.0360 0.0698 46 LEU C CD1 3638 C CD2 . LEU C 46 ? 0.1743 0.2887 0.1791 -0.0281 -0.0494 0.1003 46 LEU C CD2 3639 N N . LEU C 47 ? 0.2498 0.3425 0.2541 0.0144 0.0000 0.0629 47 LEU C N 3640 C CA . LEU C 47 ? 0.2700 0.3543 0.2774 0.0290 0.0110 0.0608 47 LEU C CA 3641 C C . LEU C 47 ? 0.3670 0.4395 0.3747 0.0292 0.0058 0.0644 47 LEU C C 3642 O O . LEU C 47 ? 0.3059 0.3846 0.3241 0.0403 0.0085 0.0737 47 LEU C O 3643 C CB . LEU C 47 ? 0.1955 0.2549 0.1857 0.0322 0.0191 0.0445 47 LEU C CB 3644 C CG . LEU C 47 ? 0.2571 0.3200 0.2396 0.0327 0.0250 0.0391 47 LEU C CG 3645 C CD1 . LEU C 47 ? 0.4028 0.4376 0.3657 0.0318 0.0278 0.0229 47 LEU C CD1 3646 C CD2 . LEU C 47 ? 0.2440 0.3249 0.2361 0.0462 0.0380 0.0467 47 LEU C CD2 3647 N N . ILE C 48 ? 0.3463 0.4017 0.3415 0.0182 -0.0011 0.0573 48 ILE C N 3648 C CA . ILE C 48 ? 0.2567 0.2964 0.2457 0.0160 -0.0042 0.0591 48 ILE C CA 3649 C C . ILE C 48 ? 0.2619 0.3010 0.2437 0.0023 -0.0155 0.0599 48 ILE C C 3650 O O . ILE C 48 ? 0.3370 0.3737 0.3121 -0.0041 -0.0179 0.0505 48 ILE C O 3651 C CB . ILE C 48 ? 0.2797 0.2926 0.2547 0.0167 0.0039 0.0461 48 ILE C CB 3652 C CG1 . ILE C 48 ? 0.3553 0.3597 0.3298 0.0306 0.0147 0.0442 48 ILE C CG1 3653 C CG2 . ILE C 48 ? 0.2603 0.2557 0.2250 0.0110 0.0013 0.0486 48 ILE C CG2 3654 C CD1 . ILE C 48 ? 0.3992 0.4030 0.3803 0.0442 0.0160 0.0567 48 ILE C CD1 3655 N N . LYS C 49 ? 0.1942 0.2328 0.1749 -0.0011 -0.0232 0.0709 49 LYS C N 3656 C CA . LYS C 49 ? 0.1967 0.2280 0.1638 -0.0137 -0.0334 0.0713 49 LYS C CA 3657 C C . LYS C 49 ? 0.3180 0.3269 0.2691 -0.0174 -0.0312 0.0680 49 LYS C C 3658 O O . LYS C 49 ? 0.3123 0.3135 0.2639 -0.0118 -0.0281 0.0738 49 LYS C O 3659 C CB . LYS C 49 ? 0.1989 0.2461 0.1718 -0.0195 -0.0468 0.0878 49 LYS C CB 3660 C CG . LYS C 49 ? 0.2103 0.2627 0.1908 -0.0152 -0.0515 0.1027 49 LYS C CG 3661 C CD . LYS C 49 ? 0.2127 0.2859 0.2012 -0.0241 -0.0672 0.1193 49 LYS C CD 3662 C CE . LYS C 49 ? 0.2294 0.3173 0.2349 -0.0162 -0.0721 0.1344 49 LYS C CE 3663 N NZ . LYS C 49 ? 0.2637 0.3232 0.2486 -0.0191 -0.0767 0.1343 49 LYS C NZ 3664 N N . TYR C 50 ? 0.3480 0.3454 0.2832 -0.0262 -0.0321 0.0585 50 TYR C N 3665 C CA . TYR C 50 ? 0.3498 0.3279 0.2669 -0.0325 -0.0279 0.0541 50 TYR C CA 3666 C C . TYR C 50 ? 0.3653 0.3341 0.2839 -0.0291 -0.0163 0.0492 50 TYR C C 3667 O O . TYR C 50 ? 0.4594 0.4134 0.3693 -0.0293 -0.0159 0.0569 50 TYR C O 3668 C CB . TYR C 50 ? 0.2497 0.2185 0.1531 -0.0386 -0.0383 0.0680 50 TYR C CB 3669 C CG . TYR C 50 ? 0.3543 0.3220 0.2451 -0.0467 -0.0498 0.0699 50 TYR C CG 3670 C CD1 . TYR C 50 ? 0.4049 0.3581 0.2749 -0.0526 -0.0467 0.0577 50 TYR C CD1 3671 C CD2 . TYR C 50 ? 0.4118 0.3925 0.3106 -0.0489 -0.0636 0.0838 50 TYR C CD2 3672 C CE1 . TYR C 50 ? 0.4107 0.3549 0.2628 -0.0589 -0.0575 0.0584 50 TYR C CE1 3673 C CE2 . TYR C 50 ? 0.3706 0.3450 0.2576 -0.0574 -0.0730 0.0823 50 TYR C CE2 3674 C CZ . TYR C 50 ? 0.4544 0.4069 0.3148 -0.0621 -0.0709 0.0703 50 TYR C CZ 3675 O OH . TYR C 50 ? 0.5014 0.4425 0.3515 -0.0678 -0.0777 0.0663 50 TYR C OH 3676 N N . ALA C 51 ? 0.2250 0.1996 0.1521 -0.0266 -0.0086 0.0366 51 ALA C N 3677 C CA . ALA C 51 ? 0.2899 0.2535 0.2145 -0.0278 0.0018 0.0287 51 ALA C CA 3678 C C . ALA C 51 ? 0.3840 0.3371 0.3107 -0.0181 0.0041 0.0359 51 ALA C C 3679 O O . ALA C 51 ? 0.2827 0.2313 0.2116 -0.0147 0.0104 0.0282 51 ALA C O 3680 C CB . ALA C 51 ? 0.2708 0.2196 0.1782 -0.0398 0.0069 0.0258 51 ALA C CB 3681 N N . SER C 52 ? 0.2562 0.2039 0.1810 -0.0127 -0.0016 0.0502 52 SER C N 3682 C CA . SER C 52 ? 0.4101 0.3442 0.3348 -0.0002 0.0012 0.0566 52 SER C CA 3683 C C . SER C 52 ? 0.3881 0.3385 0.3284 0.0135 -0.0060 0.0720 52 SER C C 3684 O O . SER C 52 ? 0.4396 0.3833 0.3838 0.0288 -0.0023 0.0762 52 SER C O 3685 C CB . SER C 52 ? 0.3062 0.2069 0.2076 -0.0064 0.0033 0.0586 52 SER C CB 3686 O OG . SER C 52 ? 0.3299 0.2267 0.2227 -0.0110 -0.0058 0.0706 52 SER C OG 3687 N N . GLU C 53 ? 0.3425 0.3139 0.2913 0.0088 -0.0163 0.0805 53 GLU C N 3688 C CA . GLU C 53 ? 0.3532 0.3444 0.3189 0.0185 -0.0252 0.0973 53 GLU C CA 3689 C C . GLU C 53 ? 0.2899 0.3106 0.2799 0.0298 -0.0204 0.0980 53 GLU C C 3690 O O . GLU C 53 ? 0.2345 0.2652 0.2268 0.0239 -0.0169 0.0888 53 GLU C O 3691 C CB . GLU C 53 ? 0.3870 0.3873 0.3490 0.0053 -0.0396 0.1065 53 GLU C CB 3692 C CG . GLU C 53 ? 0.4467 0.4168 0.3799 -0.0071 -0.0425 0.1048 53 GLU C CG 3693 C CD . GLU C 53 ? 0.5302 0.5032 0.4523 -0.0211 -0.0560 0.1112 53 GLU C CD 3694 O OE1 . GLU C 53 ? 0.5685 0.5650 0.5042 -0.0236 -0.0634 0.1153 53 GLU C OE1 3695 O OE2 . GLU C 53 ? 0.5173 0.4661 0.4133 -0.0310 -0.0591 0.1122 53 GLU C OE2 3696 N N . SER C 54 ? 0.2671 0.3016 0.2742 0.0469 -0.0199 0.1092 54 SER C N 3697 C CA . SER C 54 ? 0.3434 0.4051 0.3719 0.0601 -0.0111 0.1094 54 SER C CA 3698 C C . SER C 54 ? 0.3968 0.5015 0.4487 0.0535 -0.0197 0.1215 54 SER C C 3699 O O . SER C 54 ? 0.4390 0.5550 0.4961 0.0453 -0.0344 0.1344 54 SER C O 3700 C CB . SER C 54 ? 0.3106 0.3684 0.3471 0.0849 -0.0040 0.1146 54 SER C CB 3701 O OG . SER C 54 ? 0.3863 0.4590 0.4373 0.0916 -0.0162 0.1323 54 SER C OG 3702 N N . ILE C 55 ? 0.3493 0.4758 0.4122 0.0549 -0.0112 0.1176 55 ILE C N 3703 C CA . ILE C 55 ? 0.2910 0.4578 0.3738 0.0457 -0.0174 0.1286 55 ILE C CA 3704 C C . ILE C 55 ? 0.3939 0.5994 0.5074 0.0642 -0.0089 0.1394 55 ILE C C 3705 O O . ILE C 55 ? 0.5255 0.7234 0.6389 0.0837 0.0069 0.1319 55 ILE C O 3706 C CB . ILE C 55 ? 0.2822 0.4454 0.3525 0.0324 -0.0140 0.1176 55 ILE C CB 3707 C CG1 . ILE C 55 ? 0.2187 0.3465 0.2618 0.0186 -0.0210 0.1058 55 ILE C CG1 3708 C CG2 . ILE C 55 ? 0.2461 0.4457 0.3316 0.0194 -0.0212 0.1298 55 ILE C CG2 3709 C CD1 . ILE C 55 ? 0.1845 0.3100 0.2218 0.0043 -0.0378 0.1148 55 ILE C CD1 3710 N N . SER C 56 ? 0.4342 0.6819 0.5735 0.0580 -0.0194 0.1568 56 SER C N 3711 C CA . SER C 56 ? 0.5100 0.8059 0.6855 0.0754 -0.0111 0.1687 56 SER C CA 3712 C C . SER C 56 ? 0.5639 0.8766 0.7423 0.0777 0.0073 0.1611 56 SER C C 3713 O O . SER C 56 ? 0.6688 0.9835 0.8365 0.0563 0.0044 0.1587 56 SER C O 3714 C CB . SER C 56 ? 0.6055 0.9363 0.8011 0.0595 -0.0262 0.1848 56 SER C CB 3715 O OG . SER C 56 ? 0.7447 1.1192 0.9701 0.0706 -0.0156 0.1920 56 SER C OG 3716 N N . GLY C 57 ? 0.5029 0.8236 0.6919 0.1042 0.0260 0.1574 57 GLY C N 3717 C CA . GLY C 57 ? 0.3767 0.7131 0.5661 0.1089 0.0458 0.1505 57 GLY C CA 3718 C C . GLY C 57 ? 0.3935 0.6783 0.5455 0.1137 0.0581 0.1293 57 GLY C C 3719 O O . GLY C 57 ? 0.2540 0.5450 0.4009 0.1213 0.0760 0.1224 57 GLY C O 3720 N N . ILE C 58 ? 0.4747 0.7103 0.5996 0.1081 0.0492 0.1192 58 ILE C N 3721 C CA . ILE C 58 ? 0.3971 0.5854 0.4878 0.1094 0.0579 0.0998 58 ILE C CA 3722 C C . ILE C 58 ? 0.4374 0.6002 0.5205 0.1363 0.0701 0.0940 58 ILE C C 3723 O O . ILE C 58 ? 0.4460 0.6050 0.5385 0.1479 0.0638 0.1020 58 ILE C O 3724 C CB . ILE C 58 ? 0.3204 0.4734 0.3883 0.0894 0.0434 0.0920 58 ILE C CB 3725 C CG1 . ILE C 58 ? 0.2419 0.4133 0.3123 0.0656 0.0312 0.0968 58 ILE C CG1 3726 C CG2 . ILE C 58 ? 0.2347 0.3439 0.2717 0.0899 0.0509 0.0732 58 ILE C CG2 3727 C CD1 . ILE C 58 ? 0.1986 0.3836 0.2645 0.0597 0.0394 0.0933 58 ILE C CD1 3728 N N . PRO C 59 ? 0.4537 0.5947 0.5161 0.1470 0.0866 0.0806 59 PRO C N 3729 C CA . PRO C 59 ? 0.4334 0.5394 0.4803 0.1724 0.0974 0.0736 59 PRO C CA 3730 C C . PRO C 59 ? 0.3574 0.4160 0.3831 0.1667 0.0854 0.0693 59 PRO C C 3731 O O . PRO C 59 ? 0.3187 0.3583 0.3288 0.1434 0.0754 0.0628 59 PRO C O 3732 C CB . PRO C 59 ? 0.4220 0.5039 0.4398 0.1752 0.1134 0.0574 59 PRO C CB 3733 C CG . PRO C 59 ? 0.3418 0.4378 0.3560 0.1481 0.1069 0.0549 59 PRO C CG 3734 C CD . PRO C 59 ? 0.3735 0.5190 0.4227 0.1372 0.0957 0.0721 59 PRO C CD 3735 N N . SER C 60 ? 0.3734 0.4133 0.3982 0.1889 0.0868 0.0735 60 SER C N 3736 C CA . SER C 60 ? 0.4509 0.4468 0.4553 0.1834 0.0752 0.0729 60 SER C CA 3737 C C . SER C 60 ? 0.4926 0.4329 0.4556 0.1710 0.0781 0.0552 60 SER C C 3738 O O . SER C 60 ? 0.4028 0.3097 0.3477 0.1585 0.0685 0.0540 60 SER C O 3739 C CB . SER C 60 ? 0.4493 0.4329 0.4580 0.2127 0.0760 0.0818 60 SER C CB 3740 O OG . SER C 60 ? 0.4554 0.4157 0.4480 0.2386 0.0935 0.0723 60 SER C OG 3741 N N . ARG C 61 ? 0.4342 0.3647 0.3809 0.1722 0.0904 0.0422 61 ARG C N 3742 C CA . ARG C 61 ? 0.4250 0.3061 0.3334 0.1579 0.0910 0.0259 61 ARG C CA 3743 C C . ARG C 61 ? 0.4984 0.3880 0.4081 0.1269 0.0790 0.0222 61 ARG C C 3744 O O . ARG C 61 ? 0.5052 0.3599 0.3889 0.1117 0.0763 0.0107 61 ARG C O 3745 C CB . ARG C 61 ? 0.5782 0.4460 0.4661 0.1675 0.1061 0.0135 61 ARG C CB 3746 C CG . ARG C 61 ? 0.5615 0.4743 0.4672 0.1596 0.1098 0.0140 61 ARG C CG 3747 C CD . ARG C 61 ? 0.5283 0.4197 0.4048 0.1661 0.1242 0.0007 61 ARG C CD 3748 N NE . ARG C 61 ? 0.5955 0.5237 0.4824 0.1545 0.1260 0.0013 61 ARG C NE 3749 C CZ . ARG C 61 ? 0.6078 0.5807 0.5184 0.1658 0.1367 0.0102 61 ARG C CZ 3750 N NH1 . ARG C 61 ? 0.5336 0.5256 0.4650 0.1913 0.1467 0.0192 61 ARG C NH1 3751 N NH2 . ARG C 61 ? 0.5368 0.5362 0.4504 0.1512 0.1369 0.0110 61 ARG C NH2 3752 N N . PHE C 62 ? 0.4528 0.3876 0.3913 0.1174 0.0715 0.0314 62 PHE C N 3753 C CA . PHE C 62 ? 0.4087 0.3508 0.3492 0.0923 0.0597 0.0287 62 PHE C CA 3754 C C . PHE C 62 ? 0.3824 0.3146 0.3241 0.0855 0.0499 0.0360 62 PHE C C 3755 O O . PHE C 62 ? 0.3189 0.2644 0.2756 0.0965 0.0467 0.0494 62 PHE C O 3756 C CB . PHE C 62 ? 0.4186 0.4050 0.3819 0.0849 0.0553 0.0351 62 PHE C CB 3757 C CG . PHE C 62 ? 0.4095 0.4028 0.3660 0.0848 0.0628 0.0274 62 PHE C CG 3758 C CD1 . PHE C 62 ? 0.2816 0.2595 0.2208 0.0698 0.0589 0.0148 62 PHE C CD1 3759 C CD2 . PHE C 62 ? 0.4272 0.4450 0.3950 0.0994 0.0737 0.0335 62 PHE C CD2 3760 C CE1 . PHE C 62 ? 0.3457 0.3264 0.2744 0.0689 0.0639 0.0086 62 PHE C CE1 3761 C CE2 . PHE C 62 ? 0.3919 0.4136 0.3486 0.0976 0.0814 0.0269 62 PHE C CE2 3762 C CZ . PHE C 62 ? 0.3664 0.3669 0.3014 0.0820 0.0756 0.0146 62 PHE C CZ 3763 N N . SER C 63 ? 0.3363 0.2470 0.2623 0.0670 0.0452 0.0276 63 SER C N 3764 C CA . SER C 63 ? 0.4211 0.3231 0.3446 0.0568 0.0372 0.0336 63 SER C CA 3765 C C . SER C 63 ? 0.4591 0.3630 0.3782 0.0341 0.0330 0.0240 63 SER C C 3766 O O . SER C 63 ? 0.2980 0.2012 0.2123 0.0273 0.0354 0.0122 63 SER C O 3767 C CB . SER C 63 ? 0.3611 0.2198 0.2617 0.0634 0.0396 0.0349 63 SER C CB 3768 O OG . SER C 63 ? 0.4849 0.3103 0.3602 0.0498 0.0429 0.0219 63 SER C OG 3769 N N . GLY C 64 ? 0.3601 0.2671 0.2803 0.0233 0.0266 0.0294 64 GLY C N 3770 C CA . GLY C 64 ? 0.3408 0.2533 0.2589 0.0045 0.0245 0.0207 64 GLY C CA 3771 C C . GLY C 64 ? 0.3894 0.2799 0.2913 -0.0076 0.0244 0.0227 64 GLY C C 3772 O O . GLY C 64 ? 0.4734 0.3474 0.3668 -0.0020 0.0222 0.0337 64 GLY C O 3773 N N . SER C 65 ? 0.3611 0.2533 0.2590 -0.0245 0.0268 0.0122 65 SER C N 3774 C CA . SER C 65 ? 0.3954 0.2711 0.2773 -0.0402 0.0291 0.0129 65 SER C CA 3775 C C . SER C 65 ? 0.3675 0.2681 0.2588 -0.0547 0.0311 0.0028 65 SER C C 3776 O O . SER C 65 ? 0.3696 0.2926 0.2766 -0.0531 0.0302 -0.0063 65 SER C O 3777 C CB . SER C 65 ? 0.4407 0.2788 0.2996 -0.0467 0.0337 0.0103 65 SER C CB 3778 O OG . SER C 65 ? 0.4688 0.3116 0.3301 -0.0560 0.0368 -0.0029 65 SER C OG 3779 N N . GLY C 66 ? 0.4049 0.3013 0.2853 -0.0680 0.0342 0.0046 66 GLY C N 3780 C CA . GLY C 66 ? 0.4242 0.3457 0.3135 -0.0805 0.0390 -0.0054 66 GLY C CA 3781 C C . GLY C 66 ? 0.4157 0.3453 0.3003 -0.0824 0.0390 -0.0016 66 GLY C C 3782 O O . GLY C 66 ? 0.4606 0.3824 0.3396 -0.0732 0.0317 0.0088 66 GLY C O 3783 N N . SER C 67 ? 0.4439 0.3903 0.3301 -0.0946 0.0472 -0.0101 67 SER C N 3784 C CA . SER C 67 ? 0.4225 0.3750 0.2998 -0.0967 0.0498 -0.0095 67 SER C CA 3785 C C . SER C 67 ? 0.4330 0.4149 0.3223 -0.1054 0.0611 -0.0230 67 SER C C 3786 O O . SER C 67 ? 0.4391 0.4285 0.3336 -0.1191 0.0689 -0.0281 67 SER C O 3787 C CB . SER C 67 ? 0.4881 0.4094 0.3348 -0.1063 0.0509 0.0023 67 SER C CB 3788 O OG . SER C 67 ? 0.6819 0.5896 0.5160 -0.1238 0.0599 0.0016 67 SER C OG 3789 N N . GLY C 68 ? 0.3884 0.3871 0.2819 -0.0974 0.0617 -0.0287 68 GLY C N 3790 C CA . GLY C 68 ? 0.3274 0.3589 0.2359 -0.1003 0.0730 -0.0422 68 GLY C CA 3791 C C . GLY C 68 ? 0.3831 0.4430 0.3216 -0.0863 0.0668 -0.0522 68 GLY C C 3792 O O . GLY C 68 ? 0.4053 0.4685 0.3455 -0.0710 0.0605 -0.0554 68 GLY C O 3793 N N . THR C 69 ? 0.3761 0.4528 0.3348 -0.0924 0.0671 -0.0570 69 THR C N 3794 C CA . THR C 69 ? 0.3601 0.4626 0.3458 -0.0805 0.0592 -0.0658 69 THR C CA 3795 C C . THR C 69 ? 0.3391 0.4304 0.3289 -0.0816 0.0495 -0.0629 69 THR C C 3796 O O . THR C 69 ? 0.3941 0.4896 0.3937 -0.0682 0.0386 -0.0650 69 THR C O 3797 C CB . THR C 69 ? 0.4142 0.5604 0.4258 -0.0856 0.0686 -0.0780 69 THR C CB 3798 O OG1 . THR C 69 ? 0.3833 0.5340 0.3953 -0.1091 0.0774 -0.0768 69 THR C OG1 3799 C CG2 . THR C 69 ? 0.2419 0.4016 0.2499 -0.0789 0.0796 -0.0835 69 THR C CG2 3800 N N . ASP C 70 ? 0.3865 0.4598 0.3652 -0.0972 0.0532 -0.0582 70 ASP C N 3801 C CA . ASP C 70 ? 0.3890 0.4472 0.3665 -0.0981 0.0456 -0.0571 70 ASP C CA 3802 C C . ASP C 70 ? 0.3714 0.3929 0.3280 -0.0889 0.0410 -0.0458 70 ASP C C 3803 O O . ASP C 70 ? 0.4619 0.4589 0.3987 -0.0948 0.0455 -0.0373 70 ASP C O 3804 C CB . ASP C 70 ? 0.5264 0.5819 0.5006 -0.1204 0.0511 -0.0596 70 ASP C CB 3805 C CG . ASP C 70 ? 0.6486 0.7493 0.6491 -0.1314 0.0561 -0.0697 70 ASP C CG 3806 O OD1 . ASP C 70 ? 0.6020 0.7350 0.6250 -0.1173 0.0536 -0.0763 70 ASP C OD1 3807 O OD2 . ASP C 70 ? 0.7322 0.8366 0.7311 -0.1542 0.0621 -0.0709 70 ASP C OD2 3808 N N . PHE C 71 ? 0.2320 0.2513 0.1932 -0.0746 0.0321 -0.0451 71 PHE C N 3809 C CA . PHE C 71 ? 0.2590 0.2534 0.2072 -0.0638 0.0284 -0.0346 71 PHE C CA 3810 C C . PHE C 71 ? 0.3095 0.2917 0.2549 -0.0601 0.0253 -0.0366 71 PHE C C 3811 O O . PHE C 71 ? 0.2362 0.2307 0.1901 -0.0640 0.0223 -0.0459 71 PHE C O 3812 C CB . PHE C 71 ? 0.3223 0.3258 0.2753 -0.0505 0.0219 -0.0299 71 PHE C CB 3813 C CG . PHE C 71 ? 0.3358 0.3460 0.2857 -0.0534 0.0244 -0.0292 71 PHE C CG 3814 C CD1 . PHE C 71 ? 0.3173 0.3092 0.2508 -0.0560 0.0258 -0.0187 71 PHE C CD1 3815 C CD2 . PHE C 71 ? 0.3428 0.3760 0.3040 -0.0525 0.0251 -0.0393 71 PHE C CD2 3816 C CE1 . PHE C 71 ? 0.3783 0.3719 0.3027 -0.0598 0.0283 -0.0186 71 PHE C CE1 3817 C CE2 . PHE C 71 ? 0.3877 0.4237 0.3416 -0.0537 0.0293 -0.0400 71 PHE C CE2 3818 C CZ . PHE C 71 ? 0.4115 0.4263 0.3450 -0.0585 0.0311 -0.0298 71 PHE C CZ 3819 N N . THR C 72 ? 0.3242 0.2822 0.2567 -0.0515 0.0258 -0.0278 72 THR C N 3820 C CA . THR C 72 ? 0.3204 0.2592 0.2430 -0.0471 0.0261 -0.0299 72 THR C CA 3821 C C . THR C 72 ? 0.4115 0.3438 0.3324 -0.0294 0.0256 -0.0205 72 THR C C 3822 O O . THR C 72 ? 0.5943 0.5203 0.5130 -0.0238 0.0263 -0.0100 72 THR C O 3823 C CB . THR C 72 ? 0.3001 0.2072 0.2021 -0.0585 0.0312 -0.0309 72 THR C CB 3824 O OG1 . THR C 72 ? 0.3929 0.3125 0.2995 -0.0782 0.0320 -0.0392 72 THR C OG1 3825 C CG2 . THR C 72 ? 0.3234 0.2032 0.2086 -0.0521 0.0319 -0.0340 72 THR C CG2 3826 N N . LEU C 73 ? 0.3270 0.2627 0.2490 -0.0214 0.0241 -0.0239 73 LEU C N 3827 C CA . LEU C 73 ? 0.3186 0.2502 0.2388 -0.0054 0.0267 -0.0163 73 LEU C CA 3828 C C . LEU C 73 ? 0.3568 0.2576 0.2566 -0.0010 0.0332 -0.0211 73 LEU C C 3829 O O . LEU C 73 ? 0.4470 0.3388 0.3366 -0.0093 0.0319 -0.0318 73 LEU C O 3830 C CB . LEU C 73 ? 0.3604 0.3156 0.2916 -0.0003 0.0220 -0.0160 73 LEU C CB 3831 C CG . LEU C 73 ? 0.4389 0.3979 0.3710 0.0141 0.0265 -0.0078 73 LEU C CG 3832 C CD1 . LEU C 73 ? 0.4529 0.4202 0.3957 0.0212 0.0268 0.0061 73 LEU C CD1 3833 C CD2 . LEU C 73 ? 0.4338 0.4119 0.3709 0.0141 0.0218 -0.0082 73 LEU C CD2 3834 N N . SER C 74 ? 0.3697 0.2527 0.2618 0.0126 0.0390 -0.0133 74 SER C N 3835 C CA . SER C 74 ? 0.4285 0.2734 0.2953 0.0193 0.0459 -0.0181 74 SER C CA 3836 C C . SER C 74 ? 0.3751 0.2226 0.2429 0.0419 0.0535 -0.0134 74 SER C C 3837 O O . SER C 74 ? 0.4518 0.3211 0.3385 0.0543 0.0541 -0.0015 74 SER C O 3838 C CB . SER C 74 ? 0.4552 0.2666 0.3054 0.0165 0.0469 -0.0142 74 SER C CB 3839 O OG . SER C 74 ? 0.5030 0.2987 0.3399 -0.0061 0.0441 -0.0227 74 SER C OG 3840 N N . ILE C 75 ? 0.3874 0.2140 0.2345 0.0464 0.0594 -0.0228 75 ILE C N 3841 C CA . ILE C 75 ? 0.4651 0.2850 0.3051 0.0693 0.0708 -0.0209 75 ILE C CA 3842 C C . ILE C 75 ? 0.5296 0.2940 0.3329 0.0751 0.0766 -0.0285 75 ILE C C 3843 O O . ILE C 75 ? 0.6705 0.4062 0.4469 0.0620 0.0749 -0.0407 75 ILE C O 3844 C CB . ILE C 75 ? 0.4815 0.3200 0.3212 0.0701 0.0742 -0.0260 75 ILE C CB 3845 C CG1 . ILE C 75 ? 0.4161 0.2974 0.2828 0.0572 0.0641 -0.0213 75 ILE C CG1 3846 C CG2 . ILE C 75 ? 0.4748 0.3210 0.3161 0.0947 0.0884 -0.0212 75 ILE C CG2 3847 C CD1 . ILE C 75 ? 0.3482 0.2408 0.2086 0.0529 0.0637 -0.0267 75 ILE C CD1 3848 N N . ASN C 76 ? 0.6827 0.4016 0.4156 -0.0106 -0.0034 0.0819 76 ASN C N 3849 C CA . ASN C 76 ? 0.9203 0.6025 0.6281 -0.0122 -0.0020 0.0853 76 ASN C CA 3850 C C . ASN C 76 ? 0.9282 0.6004 0.6373 -0.0100 -0.0018 0.0810 76 ASN C C 3851 O O . ASN C 76 ? 1.0109 0.6633 0.7091 -0.0205 0.0018 0.0801 76 ASN C O 3852 C CB . ASN C 76 ? 0.9371 0.6038 0.6282 0.0014 -0.0056 0.0902 76 ASN C CB 3853 C CG . ASN C 76 ? 0.9128 0.5869 0.6075 0.0209 -0.0112 0.0899 76 ASN C CG 3854 O OD1 . ASN C 76 ? 0.9761 0.6708 0.6904 0.0236 -0.0122 0.0843 76 ASN C OD1 3855 N ND2 . ASN C 76 ? 0.8430 0.5105 0.5266 0.0340 -0.0146 0.0929 76 ASN C ND2 3856 N N . SER C 77 ? 0.7980 0.4867 0.5216 0.0028 -0.0055 0.0775 77 SER C N 3857 C CA . SER C 77 ? 0.7372 0.4201 0.4638 0.0064 -0.0058 0.0730 77 SER C CA 3858 C C . SER C 77 ? 0.5621 0.2805 0.3170 0.0078 -0.0069 0.0674 77 SER C C 3859 O O . SER C 77 ? 0.5559 0.2910 0.3198 0.0205 -0.0110 0.0666 77 SER C O 3860 C CB . SER C 77 ? 0.7397 0.4004 0.4489 0.0237 -0.0099 0.0750 77 SER C CB 3861 O OG . SER C 77 ? 0.7184 0.3711 0.4284 0.0267 -0.0099 0.0705 77 SER C OG 3862 N N . VAL C 78 ? 0.4558 0.1859 0.2234 -0.0053 -0.0030 0.0636 78 VAL C N 3863 C CA . VAL C 78 ? 0.5354 0.2973 0.3279 -0.0054 -0.0035 0.0588 78 VAL C CA 3864 C C . VAL C 78 ? 0.5474 0.3134 0.3470 0.0048 -0.0061 0.0551 78 VAL C C 3865 O O . VAL C 78 ? 0.5980 0.3432 0.3863 0.0069 -0.0058 0.0543 78 VAL C O 3866 C CB . VAL C 78 ? 0.5345 0.3067 0.3363 -0.0209 0.0013 0.0558 78 VAL C CB 3867 C CG1 . VAL C 78 ? 0.6445 0.3989 0.4382 -0.0280 0.0043 0.0535 78 VAL C CG1 3868 C CG2 . VAL C 78 ? 0.4549 0.2576 0.2799 -0.0204 0.0008 0.0515 78 VAL C CG2 3869 N N . GLU C 79 ? 0.5109 0.3033 0.3281 0.0109 -0.0087 0.0527 79 GLU C N 3870 C CA . GLU C 79 ? 0.6114 0.4134 0.4375 0.0197 -0.0112 0.0489 79 GLU C CA 3871 C C . GLU C 79 ? 0.5166 0.3430 0.3635 0.0128 -0.0095 0.0445 79 GLU C C 3872 O O . GLU C 79 ? 0.4236 0.2623 0.2785 0.0045 -0.0076 0.0445 79 GLU C O 3873 C CB . GLU C 79 ? 0.6509 0.4632 0.4770 0.0344 -0.0162 0.0500 79 GLU C CB 3874 C CG . GLU C 79 ? 0.7499 0.5386 0.5542 0.0444 -0.0185 0.0545 79 GLU C CG 3875 C CD . GLU C 79 ? 0.8062 0.6108 0.6115 0.0584 -0.0234 0.0556 79 GLU C CD 3876 O OE1 . GLU C 79 ? 0.7904 0.6240 0.6129 0.0571 -0.0246 0.0534 79 GLU C OE1 3877 O OE2 . GLU C 79 ? 0.8371 0.6253 0.6250 0.0708 -0.0262 0.0584 79 GLU C OE2 3878 N N . SER C 80 ? 0.5233 0.3567 0.3782 0.0175 -0.0105 0.0407 80 SER C N 3879 C CA . SER C 80 ? 0.4944 0.3496 0.3675 0.0122 -0.0092 0.0367 80 SER C CA 3880 C C . SER C 80 ? 0.3896 0.2676 0.2741 0.0131 -0.0111 0.0370 80 SER C C 3881 O O . SER C 80 ? 0.3129 0.2044 0.2085 0.0060 -0.0092 0.0352 80 SER C O 3882 C CB . SER C 80 ? 0.6136 0.4726 0.4920 0.0182 -0.0103 0.0329 80 SER C CB 3883 O OG . SER C 80 ? 0.7510 0.6147 0.6273 0.0311 -0.0147 0.0332 80 SER C OG 3884 N N . GLU C 81 ? 0.5603 0.4423 0.4410 0.0219 -0.0147 0.0390 81 GLU C N 3885 C CA . GLU C 81 ? 0.5682 0.4712 0.4582 0.0213 -0.0164 0.0389 81 GLU C CA 3886 C C . GLU C 81 ? 0.5056 0.4075 0.3944 0.0127 -0.0142 0.0409 81 GLU C C 3887 O O . GLU C 81 ? 0.4573 0.3749 0.3539 0.0099 -0.0148 0.0401 81 GLU C O 3888 C CB . GLU C 81 ? 0.6647 0.5741 0.5501 0.0327 -0.0208 0.0401 81 GLU C CB 3889 C CG . GLU C 81 ? 0.8550 0.7505 0.7260 0.0364 -0.0218 0.0446 81 GLU C CG 3890 C CD . GLU C 81 ? 1.0045 0.9132 0.8730 0.0477 -0.0264 0.0454 81 GLU C CD 3891 O OE1 . GLU C 81 ? 1.0773 0.9757 0.9331 0.0527 -0.0277 0.0492 81 GLU C OE1 3892 O OE2 . GLU C 81 ? 1.0261 0.9568 0.9047 0.0515 -0.0287 0.0422 81 GLU C OE2 3893 N N . ASP C 82 ? 0.5803 0.4644 0.4591 0.0078 -0.0116 0.0431 82 ASP C N 3894 C CA . ASP C 82 ? 0.4974 0.3815 0.3745 -0.0002 -0.0094 0.0448 82 ASP C CA 3895 C C . ASP C 82 ? 0.3832 0.2753 0.2695 -0.0093 -0.0059 0.0418 82 ASP C C 3896 O O . ASP C 82 ? 0.4094 0.3027 0.2942 -0.0156 -0.0038 0.0426 82 ASP C O 3897 C CB . ASP C 82 ? 0.4050 0.2676 0.2659 -0.0022 -0.0079 0.0487 82 ASP C CB 3898 C CG . ASP C 82 ? 0.4586 0.3116 0.3075 0.0079 -0.0114 0.0523 82 ASP C CG 3899 O OD1 . ASP C 82 ? 0.4478 0.3159 0.3019 0.0145 -0.0147 0.0522 82 ASP C OD1 3900 O OD2 . ASP C 82 ? 0.5150 0.3452 0.3482 0.0094 -0.0109 0.0552 82 ASP C OD2 3901 N N . ILE C 83 ? 0.3642 0.2625 0.2595 -0.0095 -0.0052 0.0384 83 ILE C N 3902 C CA . ILE C 83 ? 0.3276 0.2341 0.2307 -0.0167 -0.0020 0.0356 83 ILE C CA 3903 C C . ILE C 83 ? 0.3119 0.2321 0.2212 -0.0177 -0.0027 0.0350 83 ILE C C 3904 O O . ILE C 83 ? 0.3673 0.2973 0.2828 -0.0142 -0.0050 0.0339 83 ILE C O 3905 C CB . ILE C 83 ? 0.4893 0.4001 0.4002 -0.0157 -0.0015 0.0322 83 ILE C CB 3906 C CG1 . ILE C 83 ? 0.6217 0.5165 0.5245 -0.0158 -0.0004 0.0322 83 ILE C CG1 3907 C CG2 . ILE C 83 ? 0.5163 0.4380 0.4353 -0.0213 0.0014 0.0293 83 ILE C CG2 3908 C CD1 . ILE C 83 ? 0.5722 0.4705 0.4816 -0.0128 -0.0007 0.0289 83 ILE C CD1 3909 N N . ALA C 84 ? 0.2772 0.1981 0.1840 -0.0229 -0.0005 0.0354 84 ALA C N 3910 C CA . ALA C 84 ? 0.2634 0.1940 0.1732 -0.0237 -0.0010 0.0346 84 ALA C CA 3911 C C . ALA C 84 ? 0.2491 0.1803 0.1556 -0.0291 0.0021 0.0343 84 ALA C C 3912 O O . ALA C 84 ? 0.2919 0.2187 0.1951 -0.0332 0.0048 0.0343 84 ALA C O 3913 C CB . ALA C 84 ? 0.2480 0.1795 0.1544 -0.0201 -0.0043 0.0368 84 ALA C CB 3914 N N . ASP C 85 ? 0.3570 0.2946 0.2636 -0.0293 0.0018 0.0336 85 ASP C N 3915 C CA . ASP C 85 ? 0.3009 0.2412 0.2033 -0.0330 0.0041 0.0332 85 ASP C CA 3916 C C . ASP C 85 ? 0.3238 0.2608 0.2192 -0.0328 0.0026 0.0362 85 ASP C C 3917 O O . ASP C 85 ? 0.5486 0.4856 0.4441 -0.0294 -0.0004 0.0371 85 ASP C O 3918 C CB . ASP C 85 ? 0.2995 0.2486 0.2055 -0.0321 0.0050 0.0298 85 ASP C CB 3919 C CG . ASP C 85 ? 0.3611 0.3141 0.2737 -0.0312 0.0062 0.0271 85 ASP C CG 3920 O OD1 . ASP C 85 ? 0.4024 0.3539 0.3166 -0.0333 0.0077 0.0271 85 ASP C OD1 3921 O OD2 . ASP C 85 ? 0.3765 0.3329 0.2915 -0.0285 0.0056 0.0250 85 ASP C OD2 3922 N N . TYR C 86 ? 0.2589 0.1947 0.1479 -0.0369 0.0048 0.0374 86 TYR C N 3923 C CA . TYR C 86 ? 0.4308 0.3629 0.3119 -0.0372 0.0036 0.0407 86 TYR C CA 3924 C C . TYR C 86 ? 0.3438 0.2844 0.2226 -0.0399 0.0054 0.0392 86 TYR C C 3925 O O . TYR C 86 ? 0.4125 0.3583 0.2909 -0.0441 0.0086 0.0376 86 TYR C O 3926 C CB . TYR C 86 ? 0.4239 0.3433 0.2963 -0.0397 0.0044 0.0447 86 TYR C CB 3927 C CG . TYR C 86 ? 0.3531 0.2634 0.2259 -0.0347 0.0020 0.0461 86 TYR C CG 3928 C CD1 . TYR C 86 ? 0.3155 0.2230 0.1926 -0.0351 0.0031 0.0442 86 TYR C CD1 3929 C CD2 . TYR C 86 ? 0.4355 0.3419 0.3043 -0.0287 -0.0015 0.0490 86 TYR C CD2 3930 C CE1 . TYR C 86 ? 0.4016 0.3018 0.2787 -0.0296 0.0008 0.0450 86 TYR C CE1 3931 C CE2 . TYR C 86 ? 0.5132 0.4136 0.3820 -0.0227 -0.0038 0.0498 86 TYR C CE2 3932 C CZ . TYR C 86 ? 0.5337 0.4306 0.4065 -0.0230 -0.0027 0.0478 86 TYR C CZ 3933 O OH . TYR C 86 ? 0.5655 0.4573 0.4378 -0.0161 -0.0052 0.0482 86 TYR C OH 3934 N N . TYR C 87 ? 0.2670 0.2105 0.1439 -0.0374 0.0033 0.0393 87 TYR C N 3935 C CA . TYR C 87 ? 0.3781 0.3297 0.2524 -0.0384 0.0044 0.0373 87 TYR C CA 3936 C C . TYR C 87 ? 0.3848 0.3348 0.2512 -0.0395 0.0036 0.0406 87 TYR C C 3937 O O . TYR C 87 ? 0.4209 0.3650 0.2849 -0.0373 0.0009 0.0437 87 TYR C O 3938 C CB . TYR C 87 ? 0.3971 0.3529 0.2747 -0.0344 0.0028 0.0335 87 TYR C CB 3939 C CG . TYR C 87 ? 0.4190 0.3763 0.3028 -0.0327 0.0036 0.0303 87 TYR C CG 3940 C CD1 . TYR C 87 ? 0.3249 0.2780 0.2138 -0.0312 0.0019 0.0305 87 TYR C CD1 3941 C CD2 . TYR C 87 ? 0.3658 0.3301 0.2498 -0.0319 0.0060 0.0268 87 TYR C CD2 3942 C CE1 . TYR C 87 ? 0.3584 0.3129 0.2524 -0.0297 0.0028 0.0279 87 TYR C CE1 3943 C CE2 . TYR C 87 ? 0.3920 0.3576 0.2805 -0.0295 0.0067 0.0241 87 TYR C CE2 3944 C CZ . TYR C 87 ? 0.3224 0.2824 0.2159 -0.0287 0.0051 0.0248 87 TYR C CZ 3945 O OH . TYR C 87 ? 0.3123 0.2735 0.2097 -0.0264 0.0058 0.0224 87 TYR C OH 3946 N N . CYS C 88 ? 0.2787 0.2356 0.1408 -0.0425 0.0057 0.0399 88 CYS C N 3947 C CA . CYS C 88 ? 0.3987 0.3566 0.2535 -0.0434 0.0050 0.0423 88 CYS C CA 3948 C C . CYS C 88 ? 0.3800 0.3469 0.2350 -0.0405 0.0042 0.0382 88 CYS C C 3949 O O . CYS C 88 ? 0.3063 0.2789 0.1648 -0.0386 0.0052 0.0337 88 CYS C O 3950 C CB . CYS C 88 ? 0.3353 0.2937 0.1828 -0.0501 0.0082 0.0450 88 CYS C CB 3951 S SG . CYS C 88 ? 0.4915 0.4656 0.3408 -0.0545 0.0124 0.0404 88 CYS C SG 3952 N N . GLN C 89 ? 0.4728 0.4401 0.3227 -0.0397 0.0023 0.0398 89 GLN C N 3953 C CA . GLN C 89 ? 0.3880 0.3617 0.2362 -0.0371 0.0012 0.0359 89 GLN C CA 3954 C C . GLN C 89 ? 0.3569 0.3351 0.1977 -0.0389 0.0013 0.0382 89 GLN C C 3955 O O . GLN C 89 ? 0.3488 0.3221 0.1858 -0.0400 0.0002 0.0432 89 GLN C O 3956 C CB . GLN C 89 ? 0.3572 0.3269 0.2078 -0.0339 -0.0022 0.0344 89 GLN C CB 3957 C CG . GLN C 89 ? 0.3221 0.2955 0.1681 -0.0326 -0.0037 0.0310 89 GLN C CG 3958 C CD . GLN C 89 ? 0.4119 0.3834 0.2578 -0.0321 -0.0071 0.0313 89 GLN C CD 3959 O OE1 . GLN C 89 ? 0.3072 0.2766 0.1561 -0.0319 -0.0086 0.0347 89 GLN C OE1 3960 N NE2 . GLN C 89 ? 0.5152 0.4885 0.3569 -0.0319 -0.0085 0.0274 89 GLN C NE2 3961 N N . GLN C 90 ? 0.3952 0.3827 0.2331 -0.0384 0.0026 0.0347 90 GLN C N 3962 C CA . GLN C 90 ? 0.3024 0.2962 0.1333 -0.0399 0.0026 0.0361 90 GLN C CA 3963 C C . GLN C 90 ? 0.3030 0.2987 0.1318 -0.0360 0.0000 0.0323 90 GLN C C 3964 O O . GLN C 90 ? 0.2999 0.2942 0.1304 -0.0326 -0.0006 0.0272 90 GLN C O 3965 C CB . GLN C 90 ? 0.3043 0.3100 0.1324 -0.0428 0.0062 0.0347 90 GLN C CB 3966 C CG . GLN C 90 ? 0.3003 0.3154 0.1297 -0.0381 0.0070 0.0277 90 GLN C CG 3967 C CD . GLN C 90 ? 0.4929 0.5133 0.3167 -0.0343 0.0054 0.0242 90 GLN C CD 3968 O OE1 . GLN C 90 ? 0.3100 0.3338 0.1290 -0.0368 0.0050 0.0270 90 GLN C OE1 3969 N NE2 . GLN C 90 ? 0.3037 0.3236 0.1270 -0.0280 0.0046 0.0181 90 GLN C NE2 3970 N N . ASN C 91 ? 0.4426 0.4403 0.2661 -0.0368 -0.0015 0.0349 91 ASN C N 3971 C CA . ASN C 91 ? 0.4123 0.4133 0.2325 -0.0342 -0.0037 0.0309 91 ASN C CA 3972 C C . ASN C 91 ? 0.4321 0.4416 0.2455 -0.0356 -0.0035 0.0329 91 ASN C C 3973 O O . ASN C 91 ? 0.3557 0.3667 0.1658 -0.0349 -0.0059 0.0332 91 ASN C O 3974 C CB . ASN C 91 ? 0.3865 0.3814 0.2089 -0.0332 -0.0071 0.0309 91 ASN C CB 3975 C CG . ASN C 91 ? 0.4903 0.4872 0.3086 -0.0321 -0.0091 0.0255 91 ASN C CG 3976 O OD1 . ASN C 91 ? 0.6235 0.6230 0.4396 -0.0327 -0.0116 0.0263 91 ASN C OD1 3977 N ND2 . ASN C 91 ? 0.4026 0.3982 0.2186 -0.0300 -0.0081 0.0197 91 ASN C ND2 3978 N N . ASN C 92 ? 0.5030 0.5197 0.3139 -0.0382 -0.0004 0.0342 92 ASN C N 3979 C CA . ASN C 92 ? 0.4866 0.5137 0.2906 -0.0397 0.0003 0.0349 92 ASN C CA 3980 C C . ASN C 92 ? 0.4276 0.4650 0.2296 -0.0360 0.0009 0.0276 92 ASN C C 3981 O O . ASN C 92 ? 0.3744 0.4200 0.1707 -0.0354 0.0003 0.0265 92 ASN C O 3982 C CB . ASN C 92 ? 0.4511 0.4815 0.2518 -0.0458 0.0036 0.0403 92 ASN C CB 3983 C CG . ASN C 92 ? 0.3402 0.3807 0.1328 -0.0485 0.0044 0.0425 92 ASN C CG 3984 O OD1 . ASN C 92 ? 0.4015 0.4375 0.1890 -0.0491 0.0026 0.0475 92 ASN C OD1 3985 N ND2 . ASN C 92 ? 0.3405 0.3960 0.1313 -0.0499 0.0070 0.0389 92 ASN C ND2 3986 N N . ASN C 93 ? 0.3503 0.3869 0.1558 -0.0325 0.0018 0.0225 93 ASN C N 3987 C CA . ASN C 93 ? 0.3968 0.4402 0.1986 -0.0267 0.0020 0.0151 93 ASN C CA 3988 C C . ASN C 93 ? 0.3235 0.3538 0.1264 -0.0218 0.0001 0.0103 93 ASN C C 3989 O O . ASN C 93 ? 0.3317 0.3537 0.1402 -0.0224 0.0003 0.0117 93 ASN C O 3990 C CB . ASN C 93 ? 0.4075 0.4653 0.2098 -0.0263 0.0055 0.0132 93 ASN C CB 3991 C CG . ASN C 93 ? 0.5954 0.6695 0.3932 -0.0306 0.0074 0.0154 93 ASN C CG 3992 O OD1 . ASN C 93 ? 0.6457 0.7203 0.4437 -0.0383 0.0089 0.0219 93 ASN C OD1 3993 N ND2 . ASN C 93 ? 0.5525 0.6391 0.3450 -0.0258 0.0075 0.0100 93 ASN C ND2 3994 N N . TRP C 94 ? 0.4601 0.4875 0.2562 -0.0175 -0.0017 0.0048 94 TRP C N 3995 C CA . TRP C 94 ? 0.4061 0.4188 0.1996 -0.0134 -0.0033 -0.0002 94 TRP C CA 3996 C C . TRP C 94 ? 0.4520 0.4662 0.2437 -0.0064 -0.0015 -0.0048 94 TRP C C 3997 O O . TRP C 94 ? 0.5438 0.5715 0.3317 -0.0022 0.0001 -0.0076 94 TRP C O 3998 C CB . TRP C 94 ? 0.3443 0.3515 0.1287 -0.0121 -0.0057 -0.0049 94 TRP C CB 3999 C CG . TRP C 94 ? 0.4347 0.4232 0.2143 -0.0109 -0.0076 -0.0092 94 TRP C CG 4000 C CD1 . TRP C 94 ? 0.3513 0.3304 0.1322 -0.0167 -0.0097 -0.0080 94 TRP C CD1 4001 C CD2 . TRP C 94 ? 0.4837 0.4607 0.2548 -0.0039 -0.0073 -0.0154 94 TRP C CD2 4002 N NE1 . TRP C 94 ? 0.3607 0.3225 0.1343 -0.0153 -0.0106 -0.0129 94 TRP C NE1 4003 C CE2 . TRP C 94 ? 0.4767 0.4350 0.2434 -0.0071 -0.0092 -0.0173 94 TRP C CE2 4004 C CE3 . TRP C 94 ? 0.3656 0.3467 0.1314 0.0051 -0.0057 -0.0196 94 TRP C CE3 4005 C CZ2 . TRP C 94 ? 0.5125 0.4525 0.2682 -0.0020 -0.0094 -0.0227 94 TRP C CZ2 4006 C CZ3 . TRP C 94 ? 0.3782 0.3423 0.1335 0.0120 -0.0062 -0.0251 94 TRP C CZ3 4007 C CH2 . TRP C 94 ? 0.4157 0.3577 0.1654 0.0083 -0.0080 -0.0264 94 TRP C CH2 4008 N N . PRO C 95 ? 0.4924 0.4943 0.2863 -0.0046 -0.0016 -0.0055 95 PRO C N 4009 C CA . PRO C 95 ? 0.4201 0.4083 0.2186 -0.0096 -0.0033 -0.0025 95 PRO C CA 4010 C C . PRO C 95 ? 0.3285 0.3214 0.1380 -0.0148 -0.0021 0.0040 95 PRO C C 4011 O O . PRO C 95 ? 0.3135 0.3178 0.1264 -0.0148 0.0004 0.0056 95 PRO C O 4012 C CB . PRO C 95 ? 0.4706 0.4442 0.2643 -0.0043 -0.0036 -0.0070 95 PRO C CB 4013 C CG . PRO C 95 ? 0.4174 0.4014 0.2102 0.0030 -0.0012 -0.0095 95 PRO C CG 4014 C CD . PRO C 95 ? 0.3859 0.3876 0.1767 0.0036 -0.0002 -0.0101 95 PRO C CD 4015 N N . THR C 96 ? 0.3555 0.3404 0.1695 -0.0193 -0.0038 0.0073 96 THR C N 4016 C CA . THR C 96 ? 0.3058 0.2920 0.1285 -0.0231 -0.0030 0.0130 96 THR C CA 4017 C C . THR C 96 ? 0.3046 0.2883 0.1317 -0.0207 -0.0012 0.0118 96 THR C C 4018 O O . THR C 96 ? 0.3159 0.2910 0.1401 -0.0170 -0.0017 0.0078 96 THR C O 4019 C CB . THR C 96 ? 0.3041 0.2839 0.1300 -0.0268 -0.0056 0.0160 96 THR C CB 4020 O OG1 . THR C 96 ? 0.2977 0.2778 0.1305 -0.0291 -0.0049 0.0214 96 THR C OG1 4021 C CG2 . THR C 96 ? 0.3061 0.2749 0.1307 -0.0263 -0.0071 0.0122 96 THR C CG2 4022 N N . THR C 97 ? 0.3601 0.3507 0.1926 -0.0229 0.0011 0.0152 97 THR C N 4023 C CA . THR C 97 ? 0.3985 0.3900 0.2355 -0.0210 0.0030 0.0140 97 THR C CA 4024 C C . THR C 97 ? 0.3799 0.3687 0.2243 -0.0258 0.0036 0.0190 97 THR C C 4025 O O . THR C 97 ? 0.3996 0.3877 0.2443 -0.0302 0.0031 0.0236 97 THR C O 4026 C CB . THR C 97 ? 0.2910 0.2972 0.1258 -0.0185 0.0059 0.0112 97 THR C CB 4027 O OG1 . THR C 97 ? 0.3715 0.3877 0.2059 -0.0243 0.0073 0.0149 97 THR C OG1 4028 C CG2 . THR C 97 ? 0.2988 0.3063 0.1252 -0.0111 0.0051 0.0054 97 THR C CG2 4029 N N . PHE C 98 ? 0.3793 0.3660 0.2285 -0.0243 0.0046 0.0178 98 PHE C N 4030 C CA . PHE C 98 ? 0.3943 0.3775 0.2503 -0.0281 0.0052 0.0216 98 PHE C CA 4031 C C . PHE C 98 ? 0.4017 0.3944 0.2605 -0.0294 0.0085 0.0208 98 PHE C C 4032 O O . PHE C 98 ? 0.4096 0.4116 0.2666 -0.0254 0.0100 0.0166 98 PHE C O 4033 C CB . PHE C 98 ? 0.2824 0.2554 0.1424 -0.0262 0.0033 0.0210 98 PHE C CB 4034 C CG . PHE C 98 ? 0.2910 0.2570 0.1488 -0.0267 0.0001 0.0216 98 PHE C CG 4035 C CD1 . PHE C 98 ? 0.3746 0.3375 0.2259 -0.0244 -0.0012 0.0178 98 PHE C CD1 4036 C CD2 . PHE C 98 ? 0.3573 0.3200 0.2186 -0.0293 -0.0016 0.0255 98 PHE C CD2 4037 C CE1 . PHE C 98 ? 0.3796 0.3377 0.2285 -0.0263 -0.0040 0.0178 98 PHE C CE1 4038 C CE2 . PHE C 98 ? 0.3462 0.3063 0.2057 -0.0299 -0.0045 0.0256 98 PHE C CE2 4039 C CZ . PHE C 98 ? 0.3268 0.2852 0.1805 -0.0292 -0.0056 0.0217 98 PHE C CZ 4040 N N . GLY C 99 ? 0.3741 0.3648 0.2364 -0.0347 0.0096 0.0245 99 GLY C N 4041 C CA . GLY C 99 ? 0.2659 0.2651 0.1312 -0.0375 0.0128 0.0235 99 GLY C CA 4042 C C . GLY C 99 ? 0.2590 0.2558 0.1305 -0.0338 0.0127 0.0211 99 GLY C C 4043 O O . GLY C 99 ? 0.3645 0.3515 0.2378 -0.0300 0.0102 0.0209 99 GLY C O 4044 N N . ALA C 100 ? 0.2562 0.2633 0.1305 -0.0356 0.0155 0.0192 100 ALA C N 4045 C CA . ALA C 100 ? 0.2498 0.2565 0.1299 -0.0320 0.0157 0.0170 100 ALA C CA 4046 C C . ALA C 100 ? 0.3106 0.3053 0.1955 -0.0354 0.0148 0.0202 100 ALA C C 4047 O O . ALA C 100 ? 0.2420 0.2334 0.1316 -0.0319 0.0140 0.0190 100 ALA C O 4048 C CB . ALA C 100 ? 0.2476 0.2722 0.1293 -0.0326 0.0190 0.0134 100 ALA C CB 4049 N N . GLY C 101 ? 0.3910 0.3789 0.2737 -0.0414 0.0148 0.0244 101 GLY C N 4050 C CA . GLY C 101 ? 0.3776 0.3531 0.2631 -0.0430 0.0135 0.0274 101 GLY C CA 4051 C C . GLY C 101 ? 0.3953 0.3716 0.2822 -0.0488 0.0162 0.0275 101 GLY C C 4052 O O . GLY C 101 ? 0.3980 0.3868 0.2855 -0.0518 0.0192 0.0247 101 GLY C O 4053 N N . THR C 102 ? 0.3578 0.3209 0.2445 -0.0501 0.0150 0.0305 102 THR C N 4054 C CA . THR C 102 ? 0.2803 0.2396 0.1668 -0.0557 0.0172 0.0307 102 THR C CA 4055 C C . THR C 102 ? 0.3432 0.2936 0.2350 -0.0513 0.0150 0.0310 102 THR C C 4056 O O . THR C 102 ? 0.2591 0.2001 0.1499 -0.0471 0.0119 0.0337 102 THR C O 4057 C CB . THR C 102 ? 0.4617 0.4100 0.3376 -0.0629 0.0184 0.0347 102 THR C CB 4058 O OG1 . THR C 102 ? 0.5466 0.5067 0.4181 -0.0697 0.0216 0.0336 102 THR C OG1 4059 C CG2 . THR C 102 ? 0.4078 0.3436 0.2811 -0.0672 0.0195 0.0356 102 THR C CG2 4060 N N . LYS C 103 ? 0.3944 0.3500 0.2921 -0.0520 0.0166 0.0280 103 LYS C N 4061 C CA . LYS C 103 ? 0.3525 0.3017 0.2555 -0.0483 0.0148 0.0278 103 LYS C CA 4062 C C . LYS C 103 ? 0.3850 0.3201 0.2820 -0.0526 0.0154 0.0299 103 LYS C C 4063 O O . LYS C 103 ? 0.4727 0.4074 0.3649 -0.0604 0.0186 0.0292 103 LYS C O 4064 C CB . LYS C 103 ? 0.3655 0.3263 0.2768 -0.0466 0.0161 0.0236 103 LYS C CB 4065 C CG . LYS C 103 ? 0.4660 0.4223 0.3834 -0.0423 0.0141 0.0233 103 LYS C CG 4066 C CD . LYS C 103 ? 0.4958 0.4638 0.4205 -0.0400 0.0153 0.0195 103 LYS C CD 4067 C CE . LYS C 103 ? 0.5769 0.5415 0.5076 -0.0357 0.0132 0.0195 103 LYS C CE 4068 N NZ . LYS C 103 ? 0.6290 0.6041 0.5660 -0.0335 0.0143 0.0162 103 LYS C NZ 4069 N N . LEU C 104 ? 0.3194 0.2430 0.2156 -0.0475 0.0124 0.0322 104 LEU C N 4070 C CA . LEU C 104 ? 0.3403 0.2472 0.2288 -0.0490 0.0123 0.0342 104 LEU C CA 4071 C C . LEU C 104 ? 0.3786 0.2855 0.2737 -0.0463 0.0120 0.0315 104 LEU C C 4072 O O . LEU C 104 ? 0.2754 0.1875 0.1783 -0.0393 0.0093 0.0308 104 LEU C O 4073 C CB . LEU C 104 ? 0.3790 0.2738 0.2604 -0.0433 0.0090 0.0385 104 LEU C CB 4074 C CG . LEU C 104 ? 0.4142 0.2885 0.2846 -0.0421 0.0083 0.0410 104 LEU C CG 4075 C CD1 . LEU C 104 ? 0.4084 0.2710 0.2671 -0.0524 0.0120 0.0418 104 LEU C CD1 4076 C CD2 . LEU C 104 ? 0.4086 0.2741 0.2720 -0.0343 0.0046 0.0451 104 LEU C CD2 4077 N N . GLU C 105 ? 0.4260 0.3280 0.3177 -0.0527 0.0148 0.0297 105 GLU C N 4078 C CA . GLU C 105 ? 0.3442 0.2452 0.2408 -0.0510 0.0148 0.0269 105 GLU C CA 4079 C C . GLU C 105 ? 0.3448 0.2234 0.2291 -0.0522 0.0147 0.0285 105 GLU C C 4080 O O . GLU C 105 ? 0.3868 0.2528 0.2586 -0.0598 0.0168 0.0302 105 GLU C O 4081 C CB . GLU C 105 ? 0.5291 0.4447 0.4320 -0.0574 0.0183 0.0224 105 GLU C CB 4082 C CG . GLU C 105 ? 0.6866 0.6223 0.5987 -0.0552 0.0187 0.0207 105 GLU C CG 4083 C CD . GLU C 105 ? 0.7466 0.6983 0.6640 -0.0598 0.0220 0.0162 105 GLU C CD 4084 O OE1 . GLU C 105 ? 0.7091 0.6576 0.6222 -0.0676 0.0246 0.0144 105 GLU C OE1 4085 O OE2 . GLU C 105 ? 0.7922 0.7594 0.7172 -0.0555 0.0219 0.0142 105 GLU C OE2 4086 N N . LEU C 106 ? 0.3515 0.2244 0.2380 -0.0447 0.0121 0.0278 106 LEU C N 4087 C CA . LEU C 106 ? 0.4236 0.2734 0.2971 -0.0433 0.0115 0.0288 106 LEU C CA 4088 C C . LEU C 106 ? 0.4493 0.2984 0.3252 -0.0469 0.0135 0.0243 106 LEU C C 4089 O O . LEU C 106 ? 0.4778 0.3435 0.3674 -0.0436 0.0130 0.0210 106 LEU C O 4090 C CB . LEU C 106 ? 0.4722 0.3159 0.3442 -0.0306 0.0069 0.0311 106 LEU C CB 4091 C CG . LEU C 106 ? 0.6392 0.4666 0.4966 -0.0282 0.0054 0.0362 106 LEU C CG 4092 C CD1 . LEU C 106 ? 0.6289 0.4705 0.4916 -0.0299 0.0052 0.0383 106 LEU C CD1 4093 C CD2 . LEU C 106 ? 0.6813 0.4985 0.5327 -0.0151 0.0011 0.0379 106 LEU C CD2 4094 N N . LYS C 107 ? 0.5074 0.3366 0.3689 -0.0543 0.0159 0.0240 107 LYS C N 4095 C CA . LYS C 107 ? 0.4976 0.3231 0.3587 -0.0587 0.0178 0.0194 107 LYS C CA 4096 C C . LYS C 107 ? 0.5019 0.3117 0.3580 -0.0478 0.0145 0.0191 107 LYS C C 4097 O O . LYS C 107 ? 0.4982 0.2940 0.3457 -0.0387 0.0113 0.0228 107 LYS C O 4098 C CB . LYS C 107 ? 0.5475 0.3582 0.3936 -0.0733 0.0221 0.0188 107 LYS C CB 4099 C CG . LYS C 107 ? 0.5517 0.3809 0.4021 -0.0844 0.0256 0.0184 107 LYS C CG 4100 C CD . LYS C 107 ? 0.5739 0.3883 0.4075 -0.1002 0.0299 0.0180 107 LYS C CD 4101 C CE . LYS C 107 ? 0.7582 0.5688 0.5825 -0.1057 0.0309 0.0227 107 LYS C CE 4102 N NZ . LYS C 107 ? 0.7440 0.5408 0.5508 -0.1230 0.0354 0.0224 107 LYS C NZ 4103 N N . ARG C 108 ? 0.4973 0.3111 0.3588 -0.0481 0.0153 0.0143 108 ARG C N 4104 C CA . ARG C 108 ? 0.4172 0.2170 0.2736 -0.0381 0.0125 0.0128 108 ARG C CA 4105 C C . ARG C 108 ? 0.3944 0.1937 0.2515 -0.0448 0.0152 0.0070 108 ARG C C 4106 O O . ARG C 108 ? 0.4686 0.2811 0.3315 -0.0564 0.0189 0.0043 108 ARG C O 4107 C CB . ARG C 108 ? 0.3444 0.1620 0.2148 -0.0243 0.0082 0.0133 108 ARG C CB 4108 C CG . ARG C 108 ? 0.3145 0.1625 0.2055 -0.0259 0.0090 0.0108 108 ARG C CG 4109 C CD . ARG C 108 ? 0.3557 0.2161 0.2571 -0.0147 0.0056 0.0090 108 ARG C CD 4110 N NE . ARG C 108 ? 0.3606 0.2097 0.2565 -0.0120 0.0055 0.0052 108 ARG C NE 4111 C CZ . ARG C 108 ? 0.4244 0.2754 0.3223 -0.0005 0.0021 0.0038 108 ARG C CZ 4112 N NH1 . ARG C 108 ? 0.4097 0.2750 0.3151 0.0085 -0.0013 0.0059 108 ARG C NH1 4113 N NH2 . ARG C 108 ? 0.4619 0.3015 0.3536 0.0019 0.0022 -0.0002 108 ARG C NH2 4114 N N . THR C 109 ? 0.5063 0.2915 0.3572 -0.0367 0.0131 0.0048 109 THR C N 4115 C CA . THR C 109 ? 0.5131 0.2968 0.3640 -0.0422 0.0154 -0.0011 109 THR C CA 4116 C C . THR C 109 ? 0.4107 0.2283 0.2846 -0.0419 0.0158 -0.0046 109 THR C C 4117 O O . THR C 109 ? 0.3297 0.1677 0.2178 -0.0345 0.0135 -0.0026 109 THR C O 4118 C CB . THR C 109 ? 0.5241 0.2849 0.3625 -0.0316 0.0126 -0.0029 109 THR C CB 4119 O OG1 . THR C 109 ? 0.5047 0.2780 0.3527 -0.0153 0.0079 -0.0013 109 THR C OG1 4120 C CG2 . THR C 109 ? 0.4426 0.1648 0.2541 -0.0333 0.0128 0.0002 109 THR C CG2 4121 N N . VAL C 110 ? 0.4433 0.2660 0.3193 -0.0505 0.0189 -0.0099 110 VAL C N 4122 C CA . VAL C 110 ? 0.3847 0.2382 0.2804 -0.0504 0.0197 -0.0133 110 VAL C CA 4123 C C . VAL C 110 ? 0.4367 0.2976 0.3413 -0.0365 0.0158 -0.0144 110 VAL C C 4124 O O . VAL C 110 ? 0.5446 0.3880 0.4398 -0.0306 0.0141 -0.0164 110 VAL C O 4125 C CB . VAL C 110 ? 0.3284 0.1862 0.2231 -0.0630 0.0239 -0.0191 110 VAL C CB 4126 C CG1 . VAL C 110 ? 0.3024 0.1907 0.2161 -0.0607 0.0242 -0.0228 110 VAL C CG1 4127 C CG2 . VAL C 110 ? 0.3347 0.1928 0.2229 -0.0775 0.0278 -0.0183 110 VAL C CG2 4128 N N . ALA C 111 ? 0.3189 0.2053 0.2404 -0.0314 0.0144 -0.0132 111 ALA C N 4129 C CA . ALA C 111 ? 0.2947 0.1927 0.2257 -0.0197 0.0110 -0.0140 111 ALA C CA 4130 C C . ALA C 111 ? 0.3065 0.2316 0.2539 -0.0216 0.0124 -0.0166 111 ALA C C 4131 O O . ALA C 111 ? 0.3026 0.2423 0.2575 -0.0254 0.0137 -0.0147 111 ALA C O 4132 C CB . ALA C 111 ? 0.2718 0.1720 0.2046 -0.0107 0.0074 -0.0091 111 ALA C CB 4133 N N . ALA C 112 ? 0.3334 0.2644 0.2852 -0.0181 0.0119 -0.0209 112 ALA C N 4134 C CA . ALA C 112 ? 0.2795 0.2355 0.2457 -0.0191 0.0131 -0.0233 112 ALA C CA 4135 C C . ALA C 112 ? 0.2932 0.2660 0.2702 -0.0116 0.0104 -0.0199 112 ALA C C 4136 O O . ALA C 112 ? 0.2974 0.2660 0.2726 -0.0037 0.0071 -0.0180 112 ALA C O 4137 C CB . ALA C 112 ? 0.2353 0.1924 0.2022 -0.0175 0.0134 -0.0290 112 ALA C CB 4138 N N . PRO C 113 ? 0.2667 0.2583 0.2535 -0.0141 0.0118 -0.0192 113 PRO C N 4139 C CA . PRO C 113 ? 0.2240 0.2295 0.2190 -0.0088 0.0096 -0.0161 113 PRO C CA 4140 C C . PRO C 113 ? 0.2638 0.2814 0.2658 -0.0031 0.0079 -0.0185 113 PRO C C 4141 O O . PRO C 113 ? 0.2273 0.2486 0.2312 -0.0038 0.0092 -0.0229 113 PRO C O 4142 C CB . PRO C 113 ? 0.2849 0.3027 0.2848 -0.0133 0.0120 -0.0150 113 PRO C CB 4143 C CG . PRO C 113 ? 0.3203 0.3405 0.3195 -0.0191 0.0153 -0.0194 113 PRO C CG 4144 C CD . PRO C 113 ? 0.3474 0.3478 0.3364 -0.0221 0.0155 -0.0211 113 PRO C CD 4145 N N . SER C 114 ? 0.3355 0.3605 0.3411 0.0020 0.0052 -0.0158 114 SER C N 4146 C CA . SER C 114 ? 0.2376 0.2787 0.2508 0.0065 0.0037 -0.0173 114 SER C CA 4147 C C . SER C 114 ? 0.1874 0.2430 0.2072 0.0035 0.0048 -0.0149 114 SER C C 4148 O O . SER C 114 ? 0.2585 0.3123 0.2766 0.0016 0.0045 -0.0110 114 SER C O 4149 C CB . SER C 114 ? 0.2319 0.2742 0.2440 0.0135 0.0000 -0.0164 114 SER C CB 4150 O OG . SER C 114 ? 0.3568 0.3831 0.3604 0.0180 -0.0012 -0.0185 114 SER C OG 4151 N N . VAL C 115 ? 0.1878 0.2564 0.2136 0.0035 0.0059 -0.0173 115 VAL C N 4152 C CA . VAL C 115 ? 0.3161 0.3957 0.3456 0.0011 0.0075 -0.0153 115 VAL C CA 4153 C C . VAL C 115 ? 0.3062 0.3994 0.3403 0.0033 0.0057 -0.0141 115 VAL C C 4154 O O . VAL C 115 ? 0.2449 0.3460 0.2827 0.0067 0.0045 -0.0170 115 VAL C O 4155 C CB . VAL C 115 ? 0.1282 0.2135 0.1600 -0.0011 0.0105 -0.0186 115 VAL C CB 4156 C CG1 . VAL C 115 ? 0.1211 0.2156 0.1543 -0.0018 0.0119 -0.0160 115 VAL C CG1 4157 C CG2 . VAL C 115 ? 0.1361 0.2095 0.1627 -0.0049 0.0123 -0.0204 115 VAL C CG2 4158 N N . PHE C 116 ? 0.2281 0.3237 0.2609 0.0011 0.0058 -0.0100 116 PHE C N 4159 C CA . PHE C 116 ? 0.2483 0.3562 0.2836 0.0008 0.0047 -0.0083 116 PHE C CA 4160 C C . PHE C 116 ? 0.2232 0.3314 0.2555 -0.0018 0.0066 -0.0052 116 PHE C C 4161 O O . PHE C 116 ? 0.1520 0.2495 0.1788 -0.0032 0.0076 -0.0030 116 PHE C O 4162 C CB . PHE C 116 ? 0.1231 0.2311 0.1563 0.0000 0.0021 -0.0059 116 PHE C CB 4163 C CG . PHE C 116 ? 0.1474 0.2534 0.1812 0.0045 -0.0002 -0.0084 116 PHE C CG 4164 C CD1 . PHE C 116 ? 0.1465 0.2372 0.1754 0.0051 -0.0004 -0.0079 116 PHE C CD1 4165 C CD2 . PHE C 116 ? 0.1247 0.2440 0.1628 0.0087 -0.0021 -0.0112 116 PHE C CD2 4166 C CE1 . PHE C 116 ? 0.1670 0.2534 0.1941 0.0103 -0.0025 -0.0098 116 PHE C CE1 4167 C CE2 . PHE C 116 ? 0.1356 0.2519 0.1723 0.0147 -0.0044 -0.0136 116 PHE C CE2 4168 C CZ . PHE C 116 ? 0.1385 0.2371 0.1690 0.0157 -0.0046 -0.0127 116 PHE C CZ 4169 N N . ILE C 117 ? 0.1964 0.3164 0.2311 -0.0018 0.0071 -0.0050 117 ILE C N 4170 C CA . ILE C 117 ? 0.2294 0.3482 0.2590 -0.0032 0.0087 -0.0017 117 ILE C CA 4171 C C . ILE C 117 ? 0.2796 0.4015 0.3054 -0.0072 0.0075 0.0018 117 ILE C C 4172 O O . ILE C 117 ? 0.3888 0.5224 0.4195 -0.0081 0.0059 0.0005 117 ILE C O 4173 C CB . ILE C 117 ? 0.2970 0.4258 0.3302 -0.0003 0.0107 -0.0041 117 ILE C CB 4174 C CG1 . ILE C 117 ? 0.1800 0.3044 0.2053 0.0005 0.0123 -0.0006 117 ILE C CG1 4175 C CG2 . ILE C 117 ? 0.1048 0.2494 0.1445 0.0003 0.0099 -0.0061 117 ILE C CG2 4176 C CD1 . ILE C 117 ? 0.1850 0.3199 0.2131 0.0044 0.0143 -0.0030 117 ILE C CD1 4177 N N . PHE C 118 ? 0.2717 0.3831 0.2879 -0.0098 0.0083 0.0060 118 PHE C N 4178 C CA . PHE C 118 ? 0.1798 0.2902 0.1891 -0.0159 0.0076 0.0097 118 PHE C CA 4179 C C . PHE C 118 ? 0.2498 0.3543 0.2496 -0.0162 0.0094 0.0130 118 PHE C C 4180 O O . PHE C 118 ? 0.3220 0.4124 0.3136 -0.0134 0.0106 0.0147 118 PHE C O 4181 C CB . PHE C 118 ? 0.1755 0.2732 0.1782 -0.0201 0.0065 0.0118 118 PHE C CB 4182 C CG . PHE C 118 ? 0.2556 0.3583 0.2655 -0.0191 0.0044 0.0091 118 PHE C CG 4183 C CD1 . PHE C 118 ? 0.1812 0.2990 0.1965 -0.0211 0.0025 0.0077 118 PHE C CD1 4184 C CD2 . PHE C 118 ? 0.2925 0.3853 0.3029 -0.0158 0.0045 0.0080 118 PHE C CD2 4185 C CE1 . PHE C 118 ? 0.1621 0.2839 0.1823 -0.0184 0.0005 0.0054 118 PHE C CE1 4186 C CE2 . PHE C 118 ? 0.2896 0.3846 0.3046 -0.0143 0.0026 0.0060 118 PHE C CE2 4187 C CZ . PHE C 118 ? 0.2677 0.3766 0.2872 -0.0149 0.0005 0.0047 118 PHE C CZ 4188 N N . PRO C 119 ? 0.2692 0.3836 0.2685 -0.0190 0.0096 0.0142 119 PRO C N 4189 C CA . PRO C 119 ? 0.2003 0.3062 0.1876 -0.0193 0.0113 0.0182 119 PRO C CA 4190 C C . PRO C 119 ? 0.2573 0.3431 0.2287 -0.0256 0.0112 0.0227 119 PRO C C 4191 O O . PRO C 119 ? 0.2721 0.3561 0.2434 -0.0317 0.0098 0.0227 119 PRO C O 4192 C CB . PRO C 119 ? 0.1479 0.2714 0.1394 -0.0223 0.0113 0.0181 119 PRO C CB 4193 C CG . PRO C 119 ? 0.2667 0.4094 0.2743 -0.0206 0.0098 0.0130 119 PRO C CG 4194 C CD . PRO C 119 ? 0.3069 0.4414 0.3159 -0.0212 0.0084 0.0118 119 PRO C CD 4195 N N . PRO C 120 ? 0.3968 0.4665 0.3531 -0.0240 0.0127 0.0265 120 PRO C N 4196 C CA . PRO C 120 ? 0.4613 0.5093 0.3994 -0.0312 0.0128 0.0308 120 PRO C CA 4197 C C . PRO C 120 ? 0.3622 0.4163 0.2962 -0.0427 0.0126 0.0330 120 PRO C C 4198 O O . PRO C 120 ? 0.3304 0.4021 0.2714 -0.0433 0.0129 0.0325 120 PRO C O 4199 C CB . PRO C 120 ? 0.4030 0.4325 0.3252 -0.0239 0.0143 0.0339 120 PRO C CB 4200 C CG . PRO C 120 ? 0.3222 0.3694 0.2543 -0.0162 0.0152 0.0322 120 PRO C CG 4201 C CD . PRO C 120 ? 0.3524 0.4218 0.3062 -0.0147 0.0143 0.0267 120 PRO C CD 4202 N N . SER C 121 ? 0.3410 0.3819 0.2635 -0.0525 0.0121 0.0351 121 SER C N 4203 C CA . SER C 121 ? 0.4043 0.4522 0.3219 -0.0658 0.0120 0.0368 121 SER C CA 4204 C C . SER C 121 ? 0.3618 0.3906 0.2579 -0.0707 0.0139 0.0421 121 SER C C 4205 O O . SER C 121 ? 0.4304 0.4341 0.3112 -0.0647 0.0149 0.0448 121 SER C O 4206 C CB . SER C 121 ? 0.4774 0.5219 0.3920 -0.0755 0.0107 0.0361 121 SER C CB 4207 O OG . SER C 121 ? 0.3152 0.3290 0.2105 -0.0775 0.0114 0.0389 121 SER C OG 4208 N N . ASP C 122 ? 0.3520 0.3930 0.2460 -0.0816 0.0143 0.0435 122 ASP C N 4209 C CA . ASP C 122 ? 0.2832 0.3047 0.1544 -0.0888 0.0162 0.0490 122 ASP C CA 4210 C C . ASP C 122 ? 0.4272 0.4156 0.2746 -0.0971 0.0167 0.0521 122 ASP C C 4211 O O . ASP C 122 ? 0.5040 0.4638 0.3279 -0.0974 0.0183 0.0569 122 ASP C O 4212 C CB . ASP C 122 ? 0.3884 0.4319 0.2621 -0.1011 0.0167 0.0496 122 ASP C CB 4213 C CG . ASP C 122 ? 0.4247 0.4979 0.3183 -0.0926 0.0164 0.0469 122 ASP C CG 4214 O OD1 . ASP C 122 ? 0.4961 0.5660 0.3941 -0.0786 0.0167 0.0465 122 ASP C OD1 4215 O OD2 . ASP C 122 ? 0.3911 0.4923 0.2957 -0.0998 0.0158 0.0448 122 ASP C OD2 4216 N N . GLU C 123 ? 0.3978 0.3887 0.2495 -0.1036 0.0154 0.0495 123 GLU C N 4217 C CA . GLU C 123 ? 0.4948 0.4551 0.3241 -0.1125 0.0158 0.0517 123 GLU C CA 4218 C C . GLU C 123 ? 0.5130 0.4439 0.3309 -0.0990 0.0160 0.0528 123 GLU C C 4219 O O . GLU C 123 ? 0.5666 0.4637 0.3584 -0.1024 0.0171 0.0563 123 GLU C O 4220 C CB . GLU C 123 ? 0.5419 0.5161 0.3805 -0.1218 0.0142 0.0480 123 GLU C CB 4221 C CG . GLU C 123 ? 0.7600 0.7054 0.5753 -0.1340 0.0146 0.0497 123 GLU C CG 4222 C CD . GLU C 123 ? 0.9558 0.9183 0.7807 -0.1434 0.0130 0.0458 123 GLU C CD 4223 O OE1 . GLU C 123 ? 0.9936 0.9895 0.8427 -0.1392 0.0113 0.0421 123 GLU C OE1 4224 O OE2 . GLU C 123 ? 1.0013 0.9433 0.8085 -0.1544 0.0133 0.0464 123 GLU C OE2 4225 N N . GLN C 124 ? 0.3279 0.2710 0.1639 -0.0836 0.0151 0.0497 124 GLN C N 4226 C CA . GLN C 124 ? 0.3321 0.2520 0.1585 -0.0703 0.0153 0.0502 124 GLN C CA 4227 C C . GLN C 124 ? 0.4986 0.4045 0.3109 -0.0611 0.0168 0.0538 124 GLN C C 4228 O O . GLN C 124 ? 0.6252 0.5016 0.4164 -0.0544 0.0174 0.0562 124 GLN C O 4229 C CB . GLN C 124 ? 0.3015 0.2403 0.1508 -0.0586 0.0141 0.0455 124 GLN C CB 4230 C CG . GLN C 124 ? 0.4965 0.4163 0.3374 -0.0452 0.0143 0.0454 124 GLN C CG 4231 C CD . GLN C 124 ? 0.3963 0.3362 0.2590 -0.0343 0.0136 0.0410 124 GLN C CD 4232 O OE1 . GLN C 124 ? 0.3733 0.3395 0.2564 -0.0344 0.0132 0.0383 124 GLN C OE1 4233 N NE2 . GLN C 124 ? 0.3506 0.2777 0.2078 -0.0251 0.0136 0.0400 124 GLN C NE2 4234 N N . LEU C 125 ? 0.5386 0.4655 0.3613 -0.0599 0.0174 0.0542 125 LEU C N 4235 C CA . LEU C 125 ? 0.5229 0.4400 0.3335 -0.0503 0.0187 0.0576 125 LEU C CA 4236 C C . LEU C 125 ? 0.6620 0.5428 0.4392 -0.0568 0.0200 0.0635 125 LEU C C 4237 O O . LEU C 125 ? 0.6564 0.5179 0.4165 -0.0455 0.0209 0.0666 125 LEU C O 4238 C CB . LEU C 125 ? 0.3260 0.2733 0.1533 -0.0507 0.0191 0.0569 125 LEU C CB 4239 C CG . LEU C 125 ? 0.4448 0.4243 0.3018 -0.0417 0.0181 0.0511 125 LEU C CG 4240 C CD1 . LEU C 125 ? 0.2761 0.2841 0.1477 -0.0438 0.0184 0.0501 125 LEU C CD1 4241 C CD2 . LEU C 125 ? 0.2887 0.2633 0.1462 -0.0247 0.0183 0.0497 125 LEU C CD2 4242 N N . LYS C 126 ? 0.7207 0.5914 0.4870 -0.0746 0.0202 0.0649 126 LYS C N 4243 C CA . LYS C 126 ? 0.6616 0.4933 0.3932 -0.0828 0.0216 0.0703 126 LYS C CA 4244 C C . LYS C 126 ? 0.6100 0.4064 0.3213 -0.0726 0.0213 0.0709 126 LYS C C 4245 O O . LYS C 126 ? 0.6512 0.4160 0.3387 -0.0720 0.0217 0.0731 126 LYS C O 4246 C CB . LYS C 126 ? 0.6492 0.4820 0.3765 -0.1053 0.0217 0.0702 126 LYS C CB 4247 C CG . LYS C 126 ? 0.7131 0.5812 0.4573 -0.1164 0.0221 0.0698 126 LYS C CG 4248 C CD . LYS C 126 ? 0.8387 0.7056 0.5769 -0.1356 0.0218 0.0684 126 LYS C CD 4249 C CE . LYS C 126 ? 0.8694 0.7638 0.6258 -0.1472 0.0204 0.0637 126 LYS C CE 4250 N NZ . LYS C 126 ? 0.8682 0.7469 0.6215 -0.1449 0.0194 0.0616 126 LYS C NZ 4251 N N . SER C 127 ? 0.4765 0.2833 0.2044 -0.0625 0.0198 0.0663 127 SER C N 4252 C CA . SER C 127 ? 0.5162 0.2938 0.2271 -0.0518 0.0194 0.0660 127 SER C CA 4253 C C . SER C 127 ? 0.5904 0.3664 0.2996 -0.0296 0.0195 0.0662 127 SER C C 4254 O O . SER C 127 ? 0.6021 0.3561 0.2968 -0.0181 0.0191 0.0657 127 SER C O 4255 C CB . SER C 127 ? 0.5069 0.2963 0.2349 -0.0535 0.0179 0.0610 127 SER C CB 4256 O OG . SER C 127 ? 0.4222 0.2470 0.1813 -0.0440 0.0170 0.0568 127 SER C OG 4257 N N . GLY C 128 ? 0.6005 0.4007 0.3238 -0.0233 0.0200 0.0665 128 GLY C N 4258 C CA . GLY C 128 ? 0.5446 0.3490 0.2681 -0.0028 0.0201 0.0662 128 GLY C CA 4259 C C . GLY C 128 ? 0.5321 0.3654 0.2827 0.0080 0.0191 0.0602 128 GLY C C 4260 O O . GLY C 128 ? 0.5709 0.4085 0.3209 0.0250 0.0192 0.0591 128 GLY C O 4261 N N . THR C 129 ? 0.2849 0.2791 0.5517 0.0051 0.0143 0.0235 129 THR C N 4262 C CA . THR C 129 ? 0.3019 0.2941 0.5486 0.0091 0.0232 0.0115 129 THR C CA 4263 C C . THR C 129 ? 0.2642 0.2746 0.5176 0.0129 0.0295 0.0251 129 THR C C 4264 O O . THR C 129 ? 0.3106 0.3326 0.5812 0.0085 0.0233 0.0435 129 THR C O 4265 C CB . THR C 129 ? 0.2261 0.1972 0.4495 0.0012 0.0143 -0.0003 129 THR C CB 4266 O OG1 . THR C 129 ? 0.2252 0.1745 0.4345 0.0033 0.0141 -0.0141 129 THR C OG1 4267 C CG2 . THR C 129 ? 0.1603 0.1341 0.3675 0.0046 0.0232 -0.0080 129 THR C CG2 4268 N N . ALA C 130 ? 0.1147 0.1263 0.3551 0.0213 0.0411 0.0184 130 ALA C N 4269 C CA . ALA C 130 ? 0.1111 0.1313 0.3458 0.0268 0.0481 0.0285 130 ALA C CA 4270 C C . ALA C 130 ? 0.1899 0.2070 0.4096 0.0245 0.0492 0.0176 130 ALA C C 4271 O O . ALA C 130 ? 0.2226 0.2315 0.4304 0.0251 0.0515 0.0035 130 ALA C O 4272 C CB . ALA C 130 ? 0.1169 0.1297 0.3255 0.0337 0.0546 0.0311 130 ALA C CB 4273 N N . SER C 131 ? 0.1669 0.1920 0.3882 0.0214 0.0474 0.0266 131 SER C N 4274 C CA . SER C 131 ? 0.1150 0.1379 0.3202 0.0188 0.0483 0.0184 131 SER C CA 4275 C C . SER C 131 ? 0.1116 0.1399 0.3112 0.0282 0.0576 0.0281 131 SER C C 4276 O O . SER C 131 ? 0.1852 0.2247 0.3970 0.0315 0.0599 0.0462 131 SER C O 4277 C CB . SER C 131 ? 0.1253 0.1474 0.3310 0.0067 0.0367 0.0201 131 SER C CB 4278 O OG . SER C 131 ? 0.1402 0.1455 0.3378 -0.0001 0.0278 0.0089 131 SER C OG 4279 N N . VAL C 132 ? 0.1125 0.1314 0.2937 0.0329 0.0625 0.0186 132 VAL C N 4280 C CA . VAL C 132 ? 0.2318 0.2445 0.3924 0.0400 0.0674 0.0247 132 VAL C CA 4281 C C . VAL C 132 ? 0.2474 0.2640 0.4046 0.0354 0.0668 0.0188 132 VAL C C 4282 O O . VAL C 132 ? 0.2293 0.2440 0.3832 0.0288 0.0632 0.0063 132 VAL C O 4283 C CB . VAL C 132 ? 0.2265 0.2200 0.3635 0.0458 0.0676 0.0206 132 VAL C CB 4284 C CG1 . VAL C 132 ? 0.2605 0.2397 0.3712 0.0561 0.0728 0.0288 132 VAL C CG1 4285 C CG2 . VAL C 132 ? 0.3013 0.2923 0.4413 0.0468 0.0661 0.0226 132 VAL C CG2 4286 N N . VAL C 133 ? 0.1340 0.1562 0.2893 0.0385 0.0703 0.0295 133 VAL C N 4287 C CA . VAL C 133 ? 0.1547 0.1822 0.3054 0.0313 0.0673 0.0258 133 VAL C CA 4288 C C . VAL C 133 ? 0.2252 0.2431 0.3559 0.0401 0.0732 0.0298 133 VAL C C 4289 O O . VAL C 133 ? 0.2341 0.2465 0.3586 0.0527 0.0814 0.0431 133 VAL C O 4290 C CB . VAL C 133 ? 0.1900 0.2327 0.3585 0.0234 0.0620 0.0364 133 VAL C CB 4291 C CG1 . VAL C 133 ? 0.1173 0.1632 0.2777 0.0170 0.0592 0.0336 133 VAL C CG1 4292 C CG2 . VAL C 133 ? 0.1172 0.1589 0.2960 0.0133 0.0521 0.0306 133 VAL C CG2 4293 N N . CYS C 134 ? 0.2743 0.2879 0.3930 0.0346 0.0697 0.0199 134 CYS C N 4294 C CA . CYS C 134 ? 0.3378 0.3390 0.4352 0.0399 0.0715 0.0223 134 CYS C CA 4295 C C . CYS C 134 ? 0.2968 0.3119 0.3989 0.0321 0.0698 0.0221 134 CYS C C 4296 O O . CYS C 134 ? 0.2779 0.3021 0.3875 0.0219 0.0652 0.0131 134 CYS C O 4297 C CB . CYS C 134 ? 0.3790 0.3617 0.4601 0.0381 0.0651 0.0140 134 CYS C CB 4298 S SG . CYS C 134 ? 0.3345 0.2884 0.3803 0.0436 0.0614 0.0173 134 CYS C SG 4299 N N . LEU C 135 ? 0.1846 0.1994 0.2799 0.0387 0.0748 0.0330 135 LEU C N 4300 C CA . LEU C 135 ? 0.1340 0.1625 0.2346 0.0316 0.0730 0.0353 135 LEU C CA 4301 C C . LEU C 135 ? 0.1445 0.1594 0.2226 0.0343 0.0730 0.0330 135 LEU C C 4302 O O . LEU C 135 ? 0.1755 0.1689 0.2316 0.0467 0.0776 0.0386 135 LEU C O 4303 C CB . LEU C 135 ? 0.1329 0.1764 0.2505 0.0356 0.0777 0.0541 135 LEU C CB 4304 C CG . LEU C 135 ? 0.2375 0.2930 0.3592 0.0304 0.0760 0.0612 135 LEU C CG 4305 C CD1 . LEU C 135 ? 0.2087 0.2713 0.3343 0.0133 0.0646 0.0488 135 LEU C CD1 4306 C CD2 . LEU C 135 ? 0.1956 0.2685 0.3407 0.0354 0.0807 0.0861 135 LEU C CD2 4307 N N . LEU C 136 ? 0.1584 0.1817 0.2382 0.0236 0.0676 0.0256 136 LEU C N 4308 C CA . LEU C 136 ? 0.1826 0.1967 0.2456 0.0234 0.0655 0.0251 136 LEU C CA 4309 C C . LEU C 136 ? 0.2622 0.2931 0.3330 0.0182 0.0662 0.0296 136 LEU C C 4310 O O . LEU C 136 ? 0.2790 0.3233 0.3594 0.0078 0.0625 0.0236 136 LEU C O 4311 C CB . LEU C 136 ? 0.2114 0.2225 0.2731 0.0154 0.0583 0.0160 136 LEU C CB 4312 C CG . LEU C 136 ? 0.2158 0.2054 0.2663 0.0180 0.0524 0.0147 136 LEU C CG 4313 C CD1 . LEU C 136 ? 0.1540 0.1423 0.2121 0.0223 0.0554 0.0130 136 LEU C CD1 4314 C CD2 . LEU C 136 ? 0.2204 0.2163 0.2804 0.0082 0.0447 0.0124 136 LEU C CD2 4315 N N . ASN C 137 ? 0.2264 0.2533 0.2896 0.0266 0.0714 0.0411 137 ASN C N 4316 C CA . ASN C 137 ? 0.2540 0.2994 0.3303 0.0226 0.0723 0.0505 137 ASN C CA 4317 C C . ASN C 137 ? 0.2245 0.2659 0.2869 0.0207 0.0707 0.0496 137 ASN C C 4318 O O . ASN C 137 ? 0.1910 0.2109 0.2309 0.0306 0.0735 0.0519 137 ASN C O 4319 C CB . ASN C 137 ? 0.3119 0.3625 0.3985 0.0348 0.0815 0.0703 137 ASN C CB 4320 C CG . ASN C 137 ? 0.3323 0.4081 0.4449 0.0261 0.0780 0.0840 137 ASN C CG 4321 O OD1 . ASN C 137 ? 0.2669 0.3526 0.3905 0.0105 0.0668 0.0773 137 ASN C OD1 4322 N ND2 . ASN C 137 ? 0.3485 0.4305 0.4677 0.0368 0.0863 0.1044 137 ASN C ND2 4323 N N . ASN C 138 ? 0.2131 0.2705 0.2847 0.0083 0.0652 0.0463 138 ASN C N 4324 C CA . ASN C 138 ? 0.2594 0.3195 0.3241 0.0052 0.0639 0.0487 138 ASN C CA 4325 C C . ASN C 138 ? 0.3092 0.3509 0.3535 0.0075 0.0617 0.0424 138 ASN C C 4326 O O . ASN C 138 ? 0.4485 0.4719 0.4746 0.0169 0.0640 0.0485 138 ASN C O 4327 C CB . ASN C 138 ? 0.2186 0.2840 0.2886 0.0132 0.0700 0.0665 138 ASN C CB 4328 C CG . ASN C 138 ? 0.1957 0.2812 0.2922 0.0084 0.0682 0.0788 138 ASN C CG 4329 O OD1 . ASN C 138 ? 0.3231 0.4154 0.4276 -0.0046 0.0589 0.0715 138 ASN C OD1 4330 N ND2 . ASN C 138 ? 0.1421 0.2345 0.2509 0.0195 0.0766 0.0999 138 ASN C ND2 4331 N N . PHE C 139 ? 0.2352 0.2800 0.2821 -0.0009 0.0565 0.0324 139 PHE C N 4332 C CA . PHE C 139 ? 0.1651 0.1963 0.2006 -0.0026 0.0502 0.0305 139 PHE C CA 4333 C C . PHE C 139 ? 0.1457 0.1940 0.1909 -0.0126 0.0478 0.0281 139 PHE C C 4334 O O . PHE C 139 ? 0.1373 0.2019 0.1918 -0.0166 0.0517 0.0245 139 PHE C O 4335 C CB . PHE C 139 ? 0.2819 0.2990 0.3152 -0.0007 0.0464 0.0270 139 PHE C CB 4336 C CG . PHE C 139 ? 0.1446 0.1785 0.1971 -0.0047 0.0494 0.0208 139 PHE C CG 4337 C CD1 . PHE C 139 ? 0.1649 0.2116 0.2294 -0.0112 0.0482 0.0192 139 PHE C CD1 4338 C CD2 . PHE C 139 ? 0.1399 0.1757 0.1980 -0.0005 0.0543 0.0188 139 PHE C CD2 4339 C CE1 . PHE C 139 ? 0.1323 0.1894 0.2089 -0.0114 0.0535 0.0143 139 PHE C CE1 4340 C CE2 . PHE C 139 ? 0.2080 0.2535 0.2786 -0.0034 0.0562 0.0126 139 PHE C CE2 4341 C CZ . PHE C 139 ? 0.1299 0.1841 0.2072 -0.0079 0.0567 0.0096 139 PHE C CZ 4342 N N . TYR C 140 ? 0.1763 0.2168 0.2161 -0.0159 0.0404 0.0318 140 TYR C N 4343 C CA . TYR C 140 ? 0.1594 0.2174 0.2112 -0.0237 0.0392 0.0341 140 TYR C CA 4344 C C . TYR C 140 ? 0.2287 0.2754 0.2807 -0.0285 0.0267 0.0419 140 TYR C C 4345 O O . TYR C 140 ? 0.1775 0.1973 0.2089 -0.0272 0.0171 0.0449 140 TYR C O 4346 C CB . TYR C 140 ? 0.1635 0.2316 0.2116 -0.0261 0.0419 0.0358 140 TYR C CB 4347 C CG . TYR C 140 ? 0.1419 0.2287 0.2003 -0.0318 0.0439 0.0387 140 TYR C CG 4348 C CD1 . TYR C 140 ? 0.2963 0.3961 0.3579 -0.0313 0.0530 0.0340 140 TYR C CD1 4349 C CD2 . TYR C 140 ? 0.2837 0.3714 0.3456 -0.0368 0.0365 0.0476 140 TYR C CD2 4350 C CE1 . TYR C 140 ? 0.3075 0.4210 0.3735 -0.0326 0.0585 0.0382 140 TYR C CE1 4351 C CE2 . TYR C 140 ? 0.2700 0.3777 0.3444 -0.0402 0.0407 0.0538 140 TYR C CE2 4352 C CZ . TYR C 140 ? 0.3093 0.4300 0.3847 -0.0366 0.0535 0.0491 140 TYR C CZ 4353 O OH . TYR C 140 ? 0.1453 0.2826 0.2280 -0.0361 0.0611 0.0568 140 TYR C OH 4354 N N . PRO C 141 ? 0.2103 0.2747 0.2841 -0.0336 0.0262 0.0478 141 PRO C N 4355 C CA . PRO C 141 ? 0.1409 0.2304 0.2313 -0.0316 0.0400 0.0459 141 PRO C CA 4356 C C . PRO C 141 ? 0.1801 0.2685 0.2735 -0.0259 0.0472 0.0379 141 PRO C C 4357 O O . PRO C 141 ? 0.2010 0.2727 0.2856 -0.0236 0.0428 0.0331 141 PRO C O 4358 C CB . PRO C 141 ? 0.2329 0.3386 0.3470 -0.0363 0.0368 0.0614 141 PRO C CB 4359 C CG . PRO C 141 ? 0.1521 0.2382 0.2661 -0.0427 0.0178 0.0693 141 PRO C CG 4360 C CD . PRO C 141 ? 0.2308 0.2876 0.3126 -0.0413 0.0104 0.0607 141 PRO C CD 4361 N N . ARG C 142 ? 0.2593 0.3628 0.3622 -0.0221 0.0593 0.0375 142 ARG C N 4362 C CA . ARG C 142 ? 0.3902 0.4898 0.4901 -0.0162 0.0673 0.0283 142 ARG C CA 4363 C C . ARG C 142 ? 0.4315 0.5282 0.5460 -0.0150 0.0637 0.0315 142 ARG C C 4364 O O . ARG C 142 ? 0.4882 0.5757 0.5976 -0.0118 0.0652 0.0229 142 ARG C O 4365 C CB . ARG C 142 ? 0.4276 0.5350 0.5234 -0.0098 0.0820 0.0274 142 ARG C CB 4366 C CG . ARG C 142 ? 0.4234 0.5178 0.5042 -0.0040 0.0885 0.0156 142 ARG C CG 4367 C CD . ARG C 142 ? 0.4294 0.5215 0.4961 0.0057 0.1040 0.0159 142 ARG C CD 4368 N NE . ARG C 142 ? 0.5282 0.5963 0.5661 0.0089 0.1054 0.0028 142 ARG C NE 4369 C CZ . ARG C 142 ? 0.5615 0.6190 0.5977 0.0147 0.1091 -0.0021 142 ARG C CZ 4370 N NH1 . ARG C 142 ? 0.5236 0.5953 0.5876 0.0183 0.1129 0.0054 142 ARG C NH1 4371 N NH2 . ARG C 142 ? 0.6296 0.6603 0.6359 0.0157 0.1067 -0.0132 142 ARG C NH2 4372 N N . GLU C 143 ? 0.3711 0.4755 0.5052 -0.0189 0.0571 0.0457 143 GLU C N 4373 C CA . GLU C 143 ? 0.2995 0.4034 0.4510 -0.0189 0.0529 0.0520 143 GLU C CA 4374 C C . GLU C 143 ? 0.2576 0.3358 0.3947 -0.0230 0.0370 0.0477 143 GLU C C 4375 O O . GLU C 143 ? 0.2937 0.3557 0.4163 -0.0282 0.0240 0.0503 143 GLU C O 4376 C CB . GLU C 143 ? 0.2747 0.3979 0.4576 -0.0230 0.0492 0.0743 143 GLU C CB 4377 C CG . GLU C 143 ? 0.5040 0.6291 0.7102 -0.0248 0.0424 0.0853 143 GLU C CG 4378 C CD . GLU C 143 ? 0.6051 0.7335 0.8126 -0.0135 0.0593 0.0759 143 GLU C CD 4379 O OE1 . GLU C 143 ? 0.5843 0.7227 0.7872 -0.0029 0.0793 0.0718 143 GLU C OE1 4380 O OE2 . GLU C 143 ? 0.5750 0.6918 0.7838 -0.0149 0.0517 0.0728 143 GLU C OE2 4381 N N . ALA C 144 ? 0.2696 0.3405 0.4068 -0.0190 0.0389 0.0414 144 ALA C N 4382 C CA . ALA C 144 ? 0.2520 0.2959 0.3727 -0.0199 0.0265 0.0383 144 ALA C CA 4383 C C . ALA C 144 ? 0.2485 0.2940 0.3842 -0.0180 0.0271 0.0393 144 ALA C C 4384 O O . ALA C 144 ? 0.2837 0.3473 0.4346 -0.0128 0.0411 0.0365 144 ALA C O 4385 C CB . ALA C 144 ? 0.2267 0.2561 0.3218 -0.0136 0.0316 0.0262 144 ALA C CB 4386 N N . LYS C 145 ? 0.2817 0.3033 0.4084 -0.0217 0.0114 0.0433 145 LYS C N 4387 C CA . LYS C 145 ? 0.1864 0.2071 0.3270 -0.0215 0.0088 0.0460 145 LYS C CA 4388 C C . LYS C 145 ? 0.2015 0.1953 0.3147 -0.0150 0.0082 0.0344 145 LYS C C 4389 O O . LYS C 145 ? 0.3036 0.2642 0.3852 -0.0148 -0.0034 0.0343 145 LYS C O 4390 C CB . LYS C 145 ? 0.2200 0.2346 0.3758 -0.0329 -0.0122 0.0647 145 LYS C CB 4391 C CG . LYS C 145 ? 0.2584 0.2821 0.4404 -0.0337 -0.0138 0.0724 145 LYS C CG 4392 C CD . LYS C 145 ? 0.4136 0.4128 0.5948 -0.0469 -0.0430 0.0887 145 LYS C CD 4393 C CE . LYS C 145 ? 0.4286 0.4590 0.6598 -0.0565 -0.0503 0.1159 145 LYS C CE 4394 N NZ . LYS C 145 ? 0.3686 0.4301 0.6368 -0.0489 -0.0329 0.1209 145 LYS C NZ 4395 N N . VAL C 146 ? 0.2023 0.2074 0.3248 -0.0083 0.0213 0.0262 146 VAL C N 4396 C CA . VAL C 146 ? 0.2403 0.2259 0.3450 -0.0017 0.0224 0.0188 146 VAL C CA 4397 C C . VAL C 146 ? 0.1653 0.1480 0.2840 -0.0037 0.0161 0.0230 146 VAL C C 4398 O O . VAL C 146 ? 0.1442 0.1509 0.2919 -0.0044 0.0231 0.0255 146 VAL C O 4399 C CB . VAL C 146 ? 0.1736 0.1729 0.2803 0.0053 0.0382 0.0090 146 VAL C CB 4400 C CG1 . VAL C 146 ? 0.1617 0.1466 0.2586 0.0122 0.0401 0.0057 146 VAL C CG1 4401 C CG2 . VAL C 146 ? 0.1645 0.1658 0.2585 0.0063 0.0422 0.0076 146 VAL C CG2 4402 N N . GLN C 147 ? 0.3425 0.2929 0.4375 -0.0032 0.0037 0.0245 147 GLN C N 4403 C CA . GLN C 147 ? 0.3814 0.3245 0.4859 -0.0058 -0.0046 0.0289 147 GLN C CA 4404 C C . GLN C 147 ? 0.3461 0.2674 0.4265 0.0044 0.0003 0.0209 147 GLN C C 4405 O O . GLN C 147 ? 0.4083 0.2998 0.4516 0.0117 -0.0006 0.0188 147 GLN C O 4406 C CB . GLN C 147 ? 0.3703 0.2892 0.4674 -0.0174 -0.0300 0.0425 147 GLN C CB 4407 C CG . GLN C 147 ? 0.4302 0.3775 0.5632 -0.0283 -0.0357 0.0571 147 GLN C CG 4408 C CD . GLN C 147 ? 0.4796 0.4084 0.6181 -0.0430 -0.0645 0.0762 147 GLN C CD 4409 O OE1 . GLN C 147 ? 0.5181 0.4010 0.6161 -0.0483 -0.0864 0.0779 147 GLN C OE1 4410 N NE2 . GLN C 147 ? 0.5014 0.4629 0.6886 -0.0494 -0.0656 0.0928 147 GLN C NE2 4411 N N . TRP C 148 ? 0.3003 0.2363 0.4019 0.0066 0.0072 0.0182 148 TRP C N 4412 C CA . TRP C 148 ? 0.2396 0.1601 0.3256 0.0160 0.0125 0.0132 148 TRP C CA 4413 C C . TRP C 148 ? 0.2747 0.1674 0.3486 0.0129 -0.0034 0.0187 148 TRP C C 4414 O O . TRP C 148 ? 0.2650 0.1700 0.3658 0.0036 -0.0121 0.0255 148 TRP C O 4415 C CB . TRP C 148 ? 0.2095 0.1592 0.3235 0.0194 0.0275 0.0069 148 TRP C CB 4416 C CG . TRP C 148 ? 0.2450 0.2125 0.3627 0.0224 0.0398 0.0018 148 TRP C CG 4417 C CD1 . TRP C 148 ? 0.2123 0.2021 0.3464 0.0183 0.0453 -0.0007 148 TRP C CD1 4418 C CD2 . TRP C 148 ? 0.1479 0.1110 0.2522 0.0303 0.0474 0.0015 148 TRP C CD2 4419 N NE1 . TRP C 148 ? 0.2734 0.2697 0.4026 0.0208 0.0526 -0.0042 148 TRP C NE1 4420 C CE2 . TRP C 148 ? 0.2877 0.2713 0.4032 0.0276 0.0537 -0.0013 148 TRP C CE2 4421 C CE3 . TRP C 148 ? 0.1636 0.1071 0.2477 0.0406 0.0501 0.0059 148 TRP C CE3 4422 C CZ2 . TRP C 148 ? 0.1893 0.1776 0.3023 0.0320 0.0599 0.0021 148 TRP C CZ2 4423 C CZ3 . TRP C 148 ? 0.2729 0.2241 0.3565 0.0479 0.0603 0.0106 148 TRP C CZ3 4424 C CH2 . TRP C 148 ? 0.2207 0.1959 0.3217 0.0422 0.0637 0.0095 148 TRP C CH2 4425 N N . LYS C 149 ? 0.3730 0.2267 0.4053 0.0217 -0.0064 0.0180 149 LYS C N 4426 C CA . LYS C 149 ? 0.2719 0.0909 0.2828 0.0205 -0.0216 0.0221 149 LYS C CA 4427 C C . LYS C 149 ? 0.3900 0.1996 0.3861 0.0355 -0.0074 0.0180 149 LYS C C 4428 O O . LYS C 149 ? 0.5191 0.3205 0.4913 0.0488 0.0055 0.0166 149 LYS C O 4429 C CB . LYS C 149 ? 0.3206 0.0928 0.2832 0.0168 -0.0414 0.0271 149 LYS C CB 4430 C CG . LYS C 149 ? 0.4422 0.2223 0.4259 -0.0025 -0.0639 0.0369 149 LYS C CG 4431 C CD . LYS C 149 ? 0.4470 0.1952 0.3862 -0.0078 -0.0826 0.0393 149 LYS C CD 4432 C CE . LYS C 149 ? 0.5057 0.2644 0.4570 -0.0151 -0.0869 0.0438 149 LYS C CE 4433 N NZ . LYS C 149 ? 0.4643 0.1993 0.3868 -0.0263 -0.1127 0.0492 149 LYS C NZ 4434 N N . VAL C 150 ? 0.3762 0.1942 0.3925 0.0331 -0.0092 0.0184 150 VAL C N 4435 C CA . VAL C 150 ? 0.3214 0.1361 0.3298 0.0452 0.0020 0.0162 150 VAL C CA 4436 C C . VAL C 150 ? 0.3887 0.1773 0.3729 0.0418 -0.0106 0.0201 150 VAL C C 4437 O O . VAL C 150 ? 0.5077 0.2980 0.5061 0.0310 -0.0226 0.0230 150 VAL C O 4438 C CB . VAL C 150 ? 0.2248 0.0844 0.2816 0.0429 0.0143 0.0126 150 VAL C CB 4439 C CG1 . VAL C 150 ? 0.2285 0.0886 0.2749 0.0510 0.0198 0.0122 150 VAL C CG1 4440 C CG2 . VAL C 150 ? 0.1959 0.0876 0.2769 0.0437 0.0285 0.0090 150 VAL C CG2 4441 N N . ASP C 151 ? 0.3587 0.3653 0.2473 0.1184 -0.0039 -0.0611 151 ASP C N 4442 C CA . ASP C 151 ? 0.3815 0.3754 0.2409 0.1352 -0.0152 -0.0682 151 ASP C CA 4443 C C . ASP C 151 ? 0.3825 0.3389 0.2387 0.1257 -0.0391 -0.0787 151 ASP C C 4444 O O . ASP C 151 ? 0.3777 0.3249 0.2304 0.1229 -0.0481 -0.0784 151 ASP C O 4445 C CB . ASP C 151 ? 0.4157 0.4345 0.2813 0.1347 -0.0032 -0.0556 151 ASP C CB 4446 C CG . ASP C 151 ? 0.4069 0.4612 0.2637 0.1543 0.0142 -0.0447 151 ASP C CG 4447 O OD1 . ASP C 151 ? 0.4374 0.4930 0.2720 0.1756 0.0148 -0.0503 151 ASP C OD1 4448 O OD2 . ASP C 151 ? 0.3561 0.4382 0.2294 0.1491 0.0270 -0.0289 151 ASP C OD2 4449 N N . ASN C 152 ? 0.4474 0.3838 0.3083 0.1196 -0.0503 -0.0856 152 ASN C N 4450 C CA . ASN C 152 ? 0.4896 0.3916 0.3528 0.1094 -0.0756 -0.0920 152 ASN C CA 4451 C C . ASN C 152 ? 0.4568 0.3629 0.3534 0.0840 -0.0749 -0.0805 152 ASN C C 4452 O O . ASN C 152 ? 0.3863 0.2694 0.2875 0.0757 -0.0961 -0.0809 152 ASN C O 4453 C CB . ASN C 152 ? 0.4888 0.3604 0.3151 0.1287 -0.0995 -0.1048 152 ASN C CB 4454 C CG . ASN C 152 ? 0.7486 0.5999 0.5524 0.1460 -0.1130 -0.1149 152 ASN C CG 4455 O OD1 . ASN C 152 ? 0.8813 0.7403 0.6607 0.1691 -0.1082 -0.1163 152 ASN C OD1 4456 N ND2 . ASN C 152 ? 0.8114 0.6433 0.6320 0.1325 -0.1281 -0.1153 152 ASN C ND2 4457 N N . ALA C 153 ? 0.3657 0.3000 0.2864 0.0721 -0.0526 -0.0694 153 ALA C N 4458 C CA . ALA C 153 ? 0.2786 0.2182 0.2298 0.0511 -0.0495 -0.0588 153 ALA C CA 4459 C C . ALA C 153 ? 0.3120 0.2569 0.2838 0.0387 -0.0426 -0.0550 153 ALA C C 4460 O O . ALA C 153 ? 0.3065 0.2669 0.2798 0.0404 -0.0273 -0.0545 153 ALA C O 4461 C CB . ALA C 153 ? 0.3089 0.2715 0.2698 0.0481 -0.0321 -0.0500 153 ALA C CB 4462 N N . LEU C 154 ? 0.3137 0.2471 0.3022 0.0264 -0.0549 -0.0505 154 LEU C N 4463 C CA . LEU C 154 ? 0.2583 0.1981 0.2654 0.0155 -0.0488 -0.0454 154 LEU C CA 4464 C C . LEU C 154 ? 0.3336 0.2955 0.3563 0.0080 -0.0270 -0.0377 154 LEU C C 4465 O O . LEU C 154 ? 0.3328 0.3013 0.3666 0.0031 -0.0227 -0.0306 154 LEU C O 4466 C CB . LEU C 154 ? 0.2340 0.1617 0.2589 0.0043 -0.0668 -0.0374 154 LEU C CB 4467 C CG . LEU C 154 ? 0.2163 0.1550 0.2632 -0.0070 -0.0604 -0.0278 154 LEU C CG 4468 C CD1 . LEU C 154 ? 0.2994 0.2304 0.3373 -0.0033 -0.0643 -0.0352 154 LEU C CD1 4469 C CD2 . LEU C 154 ? 0.2187 0.1557 0.2904 -0.0188 -0.0745 -0.0124 154 LEU C CD2 4470 N N . GLN C 155 ? 0.3190 0.2902 0.3418 0.0078 -0.0148 -0.0393 155 GLN C N 4471 C CA . GLN C 155 ? 0.2450 0.2309 0.2785 0.0020 0.0020 -0.0342 155 GLN C CA 4472 C C . GLN C 155 ? 0.3355 0.3234 0.3847 -0.0072 0.0039 -0.0273 155 GLN C C 4473 O O . GLN C 155 ? 0.4711 0.4540 0.5233 -0.0100 -0.0038 -0.0265 155 GLN C O 4474 C CB . GLN C 155 ? 0.1701 0.1638 0.1966 0.0058 0.0114 -0.0376 155 GLN C CB 4475 C CG . GLN C 155 ? 0.2283 0.2269 0.2405 0.0176 0.0119 -0.0407 155 GLN C CG 4476 C CD . GLN C 155 ? 0.2241 0.2314 0.2384 0.0188 0.0175 -0.0358 155 GLN C CD 4477 O OE1 . GLN C 155 ? 0.1605 0.1753 0.1869 0.0117 0.0262 -0.0302 155 GLN C OE1 4478 N NE2 . GLN C 155 ? 0.2791 0.2837 0.2802 0.0287 0.0109 -0.0383 155 GLN C NE2 4479 N N . SER C 156 ? 0.2117 0.2078 0.2704 -0.0105 0.0140 -0.0213 156 SER C N 4480 C CA . SER C 156 ? 0.1834 0.1857 0.2541 -0.0150 0.0191 -0.0134 156 SER C CA 4481 C C . SER C 156 ? 0.2421 0.2495 0.3109 -0.0131 0.0332 -0.0139 156 SER C C 4482 O O . SER C 156 ? 0.3511 0.3593 0.4206 -0.0113 0.0369 -0.0138 156 SER C O 4483 C CB . SER C 156 ? 0.1507 0.1561 0.2377 -0.0185 0.0120 -0.0016 156 SER C CB 4484 O OG . SER C 156 ? 0.1678 0.1852 0.2671 -0.0202 0.0192 0.0093 156 SER C OG 4485 N N . GLY C 157 ? 0.1751 0.1837 0.2402 -0.0130 0.0392 -0.0148 157 GLY C N 4486 C CA . GLY C 157 ? 0.1470 0.1548 0.2065 -0.0095 0.0490 -0.0166 157 GLY C CA 4487 C C . GLY C 157 ? 0.1491 0.1490 0.1982 -0.0099 0.0494 -0.0248 157 GLY C C 4488 O O . GLY C 157 ? 0.2318 0.2254 0.2746 -0.0073 0.0534 -0.0274 157 GLY C O 4489 N N . ASN C 158 ? 0.1453 0.1455 0.1927 -0.0121 0.0442 -0.0277 158 ASN C N 4490 C CA . ASN C 158 ? 0.1928 0.1909 0.2360 -0.0133 0.0440 -0.0304 158 ASN C CA 4491 C C . ASN C 158 ? 0.2234 0.2225 0.2626 -0.0148 0.0406 -0.0326 158 ASN C C 4492 O O . ASN C 158 ? 0.2193 0.2234 0.2589 -0.0143 0.0390 -0.0316 158 ASN C O 4493 C CB . ASN C 158 ? 0.1539 0.1579 0.2012 -0.0119 0.0433 -0.0276 158 ASN C CB 4494 C CG . ASN C 158 ? 0.1604 0.1693 0.2060 -0.0081 0.0393 -0.0279 158 ASN C CG 4495 O OD1 . ASN C 158 ? 0.2417 0.2472 0.2851 -0.0078 0.0348 -0.0302 158 ASN C OD1 4496 N ND2 . ASN C 158 ? 0.2271 0.2427 0.2726 -0.0043 0.0393 -0.0252 158 ASN C ND2 4497 N N . SER C 159 ? 0.2092 0.2061 0.2460 -0.0159 0.0399 -0.0335 159 SER C N 4498 C CA . SER C 159 ? 0.2785 0.2758 0.3125 -0.0176 0.0363 -0.0352 159 SER C CA 4499 C C . SER C 159 ? 0.3134 0.3072 0.3427 -0.0195 0.0377 -0.0354 159 SER C C 4500 O O . SER C 159 ? 0.2345 0.2293 0.2638 -0.0175 0.0414 -0.0327 159 SER C O 4501 C CB . SER C 159 ? 0.2318 0.2309 0.2679 -0.0154 0.0301 -0.0356 159 SER C CB 4502 O OG . SER C 159 ? 0.1934 0.1916 0.2351 -0.0168 0.0273 -0.0321 159 SER C OG 4503 N N . GLN C 160 ? 0.2704 0.2621 0.2955 -0.0222 0.0350 -0.0370 160 GLN C N 4504 C CA . GLN C 160 ? 0.2299 0.2183 0.2475 -0.0233 0.0352 -0.0374 160 GLN C CA 4505 C C . GLN C 160 ? 0.1585 0.1500 0.1785 -0.0265 0.0302 -0.0366 160 GLN C C 4506 O O . GLN C 160 ? 0.1632 0.1566 0.1867 -0.0273 0.0271 -0.0371 160 GLN C O 4507 C CB . GLN C 160 ? 0.1747 0.1515 0.1808 -0.0233 0.0344 -0.0410 160 GLN C CB 4508 C CG . GLN C 160 ? 0.2538 0.2237 0.2538 -0.0178 0.0385 -0.0429 160 GLN C CG 4509 C CD . GLN C 160 ? 0.4167 0.3683 0.4012 -0.0162 0.0335 -0.0484 160 GLN C CD 4510 O OE1 . GLN C 160 ? 0.5944 0.5383 0.5823 -0.0218 0.0257 -0.0486 160 GLN C OE1 4511 N NE2 . GLN C 160 ? 0.3218 0.2665 0.2890 -0.0076 0.0368 -0.0518 160 GLN C NE2 4512 N N . GLU C 161 ? 0.2311 0.2253 0.2504 -0.0272 0.0299 -0.0336 161 GLU C N 4513 C CA . GLU C 161 ? 0.2647 0.2610 0.2871 -0.0305 0.0243 -0.0321 161 GLU C CA 4514 C C . GLU C 161 ? 0.2088 0.2017 0.2205 -0.0326 0.0242 -0.0326 161 GLU C C 4515 O O . GLU C 161 ? 0.2559 0.2445 0.2554 -0.0295 0.0282 -0.0338 161 GLU C O 4516 C CB . GLU C 161 ? 0.2801 0.2823 0.3129 -0.0313 0.0206 -0.0257 161 GLU C CB 4517 C CG . GLU C 161 ? 0.2558 0.2565 0.2972 -0.0295 0.0158 -0.0257 161 GLU C CG 4518 C CD . GLU C 161 ? 0.4793 0.4826 0.5337 -0.0323 0.0074 -0.0173 161 GLU C CD 4519 O OE1 . GLU C 161 ? 0.5094 0.5207 0.5681 -0.0354 0.0085 -0.0087 161 GLU C OE1 4520 O OE2 . GLU C 161 ? 0.5860 0.5829 0.6461 -0.0312 -0.0019 -0.0181 161 GLU C OE2 4521 N N . SER C 162 ? 0.2664 0.2601 0.2810 -0.0363 0.0188 -0.0319 162 SER C N 4522 C CA . SER C 162 ? 0.2341 0.2246 0.2393 -0.0392 0.0164 -0.0315 162 SER C CA 4523 C C . SER C 162 ? 0.2755 0.2719 0.2899 -0.0426 0.0111 -0.0273 162 SER C C 4524 O O . SER C 162 ? 0.3482 0.3464 0.3726 -0.0423 0.0076 -0.0278 162 SER C O 4525 C CB . SER C 162 ? 0.2096 0.1908 0.2087 -0.0420 0.0124 -0.0348 162 SER C CB 4526 O OG . SER C 162 ? 0.3979 0.3718 0.3842 -0.0445 0.0077 -0.0353 162 SER C OG 4527 N N . VAL C 163 ? 0.1758 0.1755 0.1859 -0.0442 0.0105 -0.0228 163 VAL C N 4528 C CA . VAL C 163 ? 0.2841 0.2895 0.3049 -0.0479 0.0045 -0.0170 163 VAL C CA 4529 C C . VAL C 163 ? 0.2878 0.2915 0.2992 -0.0515 0.0015 -0.0160 163 VAL C C 4530 O O . VAL C 163 ? 0.3138 0.3160 0.3089 -0.0494 0.0045 -0.0157 163 VAL C O 4531 C CB . VAL C 163 ? 0.2333 0.2486 0.2639 -0.0477 0.0046 -0.0075 163 VAL C CB 4532 C CG1 . VAL C 163 ? 0.2699 0.2890 0.3136 -0.0526 -0.0045 -0.0005 163 VAL C CG1 4533 C CG2 . VAL C 163 ? 0.1640 0.1789 0.2043 -0.0452 0.0048 -0.0078 163 VAL C CG2 4534 N N . THR C 164 ? 0.2663 0.2698 0.2862 -0.0554 -0.0050 -0.0153 164 THR C N 4535 C CA . THR C 164 ? 0.2404 0.2429 0.2542 -0.0601 -0.0098 -0.0125 164 THR C CA 4536 C C . THR C 164 ? 0.2983 0.3093 0.3118 -0.0611 -0.0100 -0.0045 164 THR C C 4537 O O . THR C 164 ? 0.2704 0.2893 0.2961 -0.0602 -0.0094 0.0014 164 THR C O 4538 C CB . THR C 164 ? 0.2609 0.2651 0.2880 -0.0629 -0.0160 -0.0110 164 THR C CB 4539 O OG1 . THR C 164 ? 0.3319 0.3402 0.3736 -0.0602 -0.0185 -0.0091 164 THR C OG1 4540 C CG2 . THR C 164 ? 0.1756 0.1774 0.2048 -0.0616 -0.0150 -0.0140 164 THR C CG2 4541 N N . GLU C 165 ? 0.3340 0.3437 0.3342 -0.0633 -0.0125 -0.0025 165 GLU C N 4542 C CA . GLU C 165 ? 0.3120 0.3335 0.3146 -0.0647 -0.0135 0.0080 165 GLU C CA 4543 C C . GLU C 165 ? 0.2619 0.2876 0.2873 -0.0709 -0.0218 0.0137 165 GLU C C 4544 O O . GLU C 165 ? 0.2988 0.3183 0.3336 -0.0719 -0.0258 0.0086 165 GLU C O 4545 C CB . GLU C 165 ? 0.4562 0.4741 0.4342 -0.0636 -0.0146 0.0079 165 GLU C CB 4546 C CG . GLU C 165 ? 0.5170 0.5299 0.4677 -0.0531 -0.0071 0.0026 165 GLU C CG 4547 C CD . GLU C 165 ? 0.4800 0.5127 0.4342 -0.0457 0.0031 0.0135 165 GLU C CD 4548 O OE1 . GLU C 165 ? 0.4861 0.5358 0.4627 -0.0508 0.0016 0.0270 165 GLU C OE1 4549 O OE2 . GLU C 165 ? 0.4075 0.4395 0.3439 -0.0347 0.0116 0.0104 165 GLU C OE2 4550 N N . GLN C 166 ? 0.1947 0.2322 0.2291 -0.0736 -0.0245 0.0258 166 GLN C N 4551 C CA . GLN C 166 ? 0.1869 0.2260 0.2438 -0.0786 -0.0347 0.0317 166 GLN C CA 4552 C C . GLN C 166 ? 0.2819 0.3151 0.3373 -0.0822 -0.0403 0.0283 166 GLN C C 4553 O O . GLN C 166 ? 0.3050 0.3382 0.3449 -0.0845 -0.0398 0.0289 166 GLN C O 4554 C CB . GLN C 166 ? 0.2547 0.3092 0.3238 -0.0823 -0.0380 0.0487 166 GLN C CB 4555 C CG . GLN C 166 ? 0.2852 0.3393 0.3814 -0.0851 -0.0486 0.0558 166 GLN C CG 4556 C CD . GLN C 166 ? 0.3087 0.3808 0.4222 -0.0907 -0.0538 0.0773 166 GLN C CD 4557 O OE1 . GLN C 166 ? 0.2911 0.3811 0.3946 -0.0893 -0.0448 0.0877 166 GLN C OE1 4558 N NE2 . GLN C 166 ? 0.2912 0.3587 0.4304 -0.0958 -0.0694 0.0849 166 GLN C NE2 4559 N N . ASP C 167 ? 0.2450 0.2726 0.3152 -0.0812 -0.0462 0.0249 167 ASP C N 4560 C CA . ASP C 167 ? 0.2818 0.3073 0.3545 -0.0832 -0.0506 0.0240 167 ASP C CA 4561 C C . ASP C 167 ? 0.2380 0.2696 0.3176 -0.0898 -0.0580 0.0345 167 ASP C C 4562 O O . ASP C 167 ? 0.2038 0.2392 0.2970 -0.0914 -0.0638 0.0421 167 ASP C O 4563 C CB . ASP C 167 ? 0.3182 0.3393 0.4033 -0.0760 -0.0531 0.0188 167 ASP C CB 4564 C CG . ASP C 167 ? 0.3399 0.3639 0.4293 -0.0758 -0.0547 0.0203 167 ASP C CG 4565 O OD1 . ASP C 167 ? 0.2825 0.3075 0.3662 -0.0749 -0.0496 0.0178 167 ASP C OD1 4566 O OD2 . ASP C 167 ? 0.3004 0.3266 0.4011 -0.0769 -0.0618 0.0260 167 ASP C OD2 4567 N N . SER C 168 ? 0.1920 0.2240 0.2636 -0.0946 -0.0599 0.0362 168 SER C N 4568 C CA . SER C 168 ? 0.3649 0.4034 0.4396 -0.1012 -0.0667 0.0466 168 SER C CA 4569 C C . SER C 168 ? 0.3880 0.4277 0.4857 -0.1022 -0.0754 0.0517 168 SER C C 4570 O O . SER C 168 ? 0.3549 0.4005 0.4590 -0.1082 -0.0821 0.0615 168 SER C O 4571 C CB . SER C 168 ? 0.2110 0.2462 0.2668 -0.1060 -0.0686 0.0464 168 SER C CB 4572 O OG . SER C 168 ? 0.2416 0.2724 0.3050 -0.1077 -0.0726 0.0443 168 SER C OG 4573 N N . LYS C 169 ? 0.4011 0.4356 0.5100 -0.0946 -0.0757 0.0453 169 LYS C N 4574 C CA . LYS C 169 ? 0.1857 0.2189 0.3129 -0.0910 -0.0840 0.0482 169 LYS C CA 4575 C C . LYS C 169 ? 0.3061 0.3305 0.4440 -0.0844 -0.0908 0.0457 169 LYS C C 4576 O O . LYS C 169 ? 0.3762 0.3978 0.5276 -0.0855 -0.1017 0.0522 169 LYS C O 4577 C CB . LYS C 169 ? 0.1835 0.2182 0.3135 -0.0837 -0.0806 0.0445 169 LYS C CB 4578 N N . ASP C 170 ? 0.2469 0.2645 0.3784 -0.0772 -0.0864 0.0367 170 ASP C N 4579 C CA . ASP C 170 ? 0.2388 0.2436 0.3786 -0.0712 -0.0966 0.0338 170 ASP C CA 4580 C C . ASP C 170 ? 0.2214 0.2272 0.3606 -0.0767 -0.0960 0.0372 170 ASP C C 4581 O O . ASP C 170 ? 0.2229 0.2166 0.3702 -0.0736 -0.1071 0.0362 170 ASP C O 4582 C CB . ASP C 170 ? 0.2635 0.2574 0.3974 -0.0546 -0.0955 0.0207 170 ASP C CB 4583 C CG . ASP C 170 ? 0.3236 0.3232 0.4432 -0.0510 -0.0807 0.0137 170 ASP C CG 4584 O OD1 . ASP C 170 ? 0.2677 0.2736 0.3808 -0.0601 -0.0735 0.0160 170 ASP C OD1 4585 O OD2 . ASP C 170 ? 0.3193 0.3179 0.4340 -0.0375 -0.0763 0.0066 170 ASP C OD2 4586 N N . SER C 171 ? 0.1854 0.2040 0.3144 -0.0836 -0.0848 0.0416 171 SER C N 4587 C CA . SER C 171 ? 0.2904 0.3163 0.4201 -0.0878 -0.0822 0.0491 171 SER C CA 4588 C C . SER C 171 ? 0.2641 0.2810 0.3903 -0.0812 -0.0799 0.0401 171 SER C C 4589 O O . SER C 171 ? 0.2066 0.2271 0.3413 -0.0840 -0.0827 0.0481 171 SER C O 4590 C CB . SER C 171 ? 0.2597 0.2895 0.4060 -0.0921 -0.0930 0.0648 171 SER C CB 4591 O OG . SER C 171 ? 0.2292 0.2672 0.3755 -0.0961 -0.0938 0.0732 171 SER C OG 4592 N N . THR C 172 ? 0.1821 0.1899 0.2976 -0.0724 -0.0748 0.0259 172 THR C N 4593 C CA . THR C 172 ? 0.2084 0.2078 0.3187 -0.0652 -0.0726 0.0169 172 THR C CA 4594 C C . THR C 172 ? 0.1780 0.1852 0.2732 -0.0655 -0.0569 0.0134 172 THR C C 4595 O O . THR C 172 ? 0.2795 0.2947 0.3654 -0.0695 -0.0491 0.0151 172 THR C O 4596 C CB . THR C 172 ? 0.2152 0.2017 0.3214 -0.0524 -0.0762 0.0048 172 THR C CB 4597 O OG1 . THR C 172 ? 0.2017 0.1967 0.2996 -0.0496 -0.0651 0.0015 172 THR C OG1 4598 C CG2 . THR C 172 ? 0.2009 0.1755 0.3186 -0.0491 -0.0931 0.0063 172 THR C CG2 4599 N N . TYR C 173 ? 0.1936 0.1959 0.2858 -0.0609 -0.0545 0.0080 173 TYR C N 4600 C CA . TYR C 173 ? 0.2370 0.2432 0.3159 -0.0592 -0.0413 0.0031 173 TYR C CA 4601 C C . TYR C 173 ? 0.2588 0.2578 0.3314 -0.0500 -0.0385 -0.0082 173 TYR C C 4602 O O . TYR C 173 ? 0.2400 0.2301 0.3161 -0.0424 -0.0466 -0.0128 173 TYR C O 4603 C CB . TYR C 173 ? 0.2244 0.2352 0.3065 -0.0611 -0.0391 0.0091 173 TYR C CB 4604 C CG . TYR C 173 ? 0.3262 0.3507 0.4154 -0.0678 -0.0395 0.0242 173 TYR C CG 4605 C CD1 . TYR C 173 ? 0.3592 0.3857 0.4689 -0.0729 -0.0528 0.0365 173 TYR C CD1 4606 C CD2 . TYR C 173 ? 0.3917 0.4272 0.4667 -0.0677 -0.0276 0.0273 173 TYR C CD2 4607 C CE1 . TYR C 173 ? 0.3207 0.3652 0.4398 -0.0787 -0.0523 0.0545 173 TYR C CE1 4608 C CE2 . TYR C 173 ? 0.3743 0.4263 0.4533 -0.0706 -0.0261 0.0427 173 TYR C CE2 4609 C CZ . TYR C 173 ? 0.2962 0.3554 0.3990 -0.0765 -0.0375 0.0578 173 TYR C CZ 4610 O OH . TYR C 173 ? 0.3097 0.3906 0.4193 -0.0791 -0.0352 0.0771 173 TYR C OH 4611 N N . SER C 174 ? 0.1649 0.1674 0.2269 -0.0492 -0.0278 -0.0121 174 SER C N 4612 C CA . SER C 174 ? 0.1902 0.1907 0.2479 -0.0409 -0.0236 -0.0193 174 SER C CA 4613 C C . SER C 174 ? 0.1605 0.1616 0.2109 -0.0417 -0.0153 -0.0215 174 SER C C 4614 O O . SER C 174 ? 0.3628 0.3663 0.4073 -0.0473 -0.0108 -0.0189 174 SER C O 4615 C CB . SER C 174 ? 0.1625 0.1692 0.2202 -0.0387 -0.0206 -0.0187 174 SER C CB 4616 O OG . SER C 174 ? 0.1670 0.1733 0.2312 -0.0328 -0.0272 -0.0179 174 SER C OG 4617 N N . LEU C 175 ? 0.1448 0.2716 0.1929 0.0265 -0.0632 -0.0115 175 LEU C N 4618 C CA . LEU C 175 ? 0.1371 0.2688 0.1795 0.0276 -0.0496 -0.0160 175 LEU C CA 4619 C C . LEU C 175 ? 0.1946 0.3465 0.2592 0.0284 -0.0527 -0.0199 175 LEU C C 4620 O O . LEU C 175 ? 0.0980 0.2639 0.1884 0.0299 -0.0553 -0.0197 175 LEU C O 4621 C CB . LEU C 175 ? 0.1784 0.3216 0.2326 0.0293 -0.0344 -0.0161 175 LEU C CB 4622 C CG . LEU C 175 ? 0.2535 0.4057 0.3099 0.0321 -0.0195 -0.0164 175 LEU C CG 4623 C CD1 . LEU C 175 ? 0.1235 0.2797 0.1868 0.0314 -0.0063 -0.0094 175 LEU C CD1 4624 C CD2 . LEU C 175 ? 0.0906 0.2664 0.1723 0.0331 -0.0213 -0.0214 175 LEU C CD2 4625 N N . SER C 176 ? 0.1885 0.3339 0.2381 0.0278 -0.0488 -0.0221 176 SER C N 4626 C CA . SER C 176 ? 0.1779 0.3400 0.2449 0.0281 -0.0487 -0.0252 176 SER C CA 4627 C C . SER C 176 ? 0.2742 0.4366 0.3334 0.0323 -0.0343 -0.0280 176 SER C C 4628 O O . SER C 176 ? 0.3118 0.4515 0.3421 0.0343 -0.0276 -0.0271 176 SER C O 4629 C CB . SER C 176 ? 0.1174 0.2687 0.1763 0.0212 -0.0638 -0.0223 176 SER C CB 4630 O OG . SER C 176 ? 0.3683 0.4862 0.3850 0.0187 -0.0636 -0.0234 176 SER C OG 4631 N N . SER C 177 ? 0.3251 0.5004 0.4027 0.0332 -0.0277 -0.0291 177 SER C N 4632 C CA . SER C 177 ? 0.1516 0.3300 0.2285 0.0368 -0.0181 -0.0291 177 SER C CA 4633 C C . SER C 177 ? 0.1347 0.3088 0.2093 0.0347 -0.0199 -0.0304 177 SER C C 4634 O O . SER C 177 ? 0.1541 0.3224 0.2339 0.0298 -0.0219 -0.0291 177 SER C O 4635 C CB . SER C 177 ? 0.1635 0.3393 0.2500 0.0336 -0.0135 -0.0250 177 SER C CB 4636 O OG . SER C 177 ? 0.2550 0.4336 0.3456 0.0361 -0.0077 -0.0215 177 SER C OG 4637 N N . THR C 178 ? 0.2303 0.4097 0.2983 0.0413 -0.0172 -0.0325 178 THR C N 4638 C CA . THR C 178 ? 0.0812 0.2586 0.1470 0.0396 -0.0199 -0.0336 178 THR C CA 4639 C C . THR C 178 ? 0.2083 0.3860 0.2757 0.0451 -0.0110 -0.0312 178 THR C C 4640 O O . THR C 178 ? 0.1300 0.3051 0.1919 0.0547 -0.0018 -0.0291 178 THR C O 4641 C CB . THR C 178 ? 0.1118 0.2585 0.1476 0.0352 -0.0254 -0.0337 178 THR C CB 4642 O OG1 . THR C 178 ? 0.3788 0.5200 0.4127 0.0268 -0.0383 -0.0323 178 THR C OG1 4643 C CG2 . THR C 178 ? 0.1472 0.2914 0.1829 0.0309 -0.0293 -0.0334 178 THR C CG2 4644 N N . LEU C 179 ? 0.2167 0.3905 0.2879 0.0394 -0.0122 -0.0294 179 LEU C N 4645 C CA . LEU C 179 ? 0.1486 0.3234 0.2216 0.0429 -0.0098 -0.0262 179 LEU C CA 4646 C C . LEU C 179 ? 0.0813 0.2594 0.1489 0.0469 -0.0106 -0.0285 179 LEU C C 4647 O O . LEU C 179 ? 0.1508 0.3312 0.2188 0.0410 -0.0144 -0.0305 179 LEU C O 4648 C CB . LEU C 179 ? 0.0741 0.2480 0.1510 0.0375 -0.0132 -0.0249 179 LEU C CB 4649 C CG . LEU C 179 ? 0.1449 0.3243 0.2254 0.0402 -0.0159 -0.0214 179 LEU C CG 4650 C CD1 . LEU C 179 ? 0.1846 0.3688 0.2810 0.0425 -0.0158 -0.0135 179 LEU C CD1 4651 C CD2 . LEU C 179 ? 0.0794 0.2622 0.1557 0.0369 -0.0215 -0.0246 179 LEU C CD2 4652 N N . THR C 180 ? 0.1684 0.3469 0.2333 0.0584 -0.0053 -0.0264 180 THR C N 4653 C CA . THR C 180 ? 0.1725 0.3294 0.2175 0.0585 -0.0052 -0.0262 180 THR C CA 4654 C C . THR C 180 ? 0.1879 0.3525 0.2406 0.0645 -0.0051 -0.0212 180 THR C C 4655 O O . THR C 180 ? 0.2287 0.4021 0.2944 0.0751 -0.0008 -0.0149 180 THR C O 4656 C CB . THR C 180 ? 0.2804 0.4038 0.2967 0.0649 0.0020 -0.0264 180 THR C CB 4657 O OG1 . THR C 180 ? 0.3445 0.4560 0.3476 0.0575 -0.0020 -0.0303 180 THR C OG1 4658 C CG2 . THR C 180 ? 0.2803 0.3739 0.2709 0.0625 -0.0004 -0.0266 180 THR C CG2 4659 N N . LEU C 181 ? 0.2478 0.4096 0.2945 0.0577 -0.0099 -0.0217 181 LEU C N 4660 C CA . LEU C 181 ? 0.1854 0.3477 0.2310 0.0614 -0.0124 -0.0166 181 LEU C CA 4661 C C . LEU C 181 ? 0.2677 0.4050 0.2914 0.0583 -0.0114 -0.0155 181 LEU C C 4662 O O . LEU C 181 ? 0.3672 0.4944 0.3827 0.0482 -0.0120 -0.0183 181 LEU C O 4663 C CB . LEU C 181 ? 0.2170 0.3940 0.2681 0.0551 -0.0183 -0.0175 181 LEU C CB 4664 C CG . LEU C 181 ? 0.2067 0.4003 0.2735 0.0541 -0.0228 -0.0182 181 LEU C CG 4665 C CD1 . LEU C 181 ? 0.0983 0.2925 0.1553 0.0480 -0.0272 -0.0216 181 LEU C CD1 4666 C CD2 . LEU C 181 ? 0.1001 0.2950 0.1793 0.0588 -0.0267 -0.0091 181 LEU C CD2 4667 N N . SER C 182 ? 0.1579 0.2851 0.1743 0.0660 -0.0119 -0.0094 182 SER C N 4668 C CA . SER C 182 ? 0.2016 0.3037 0.1956 0.0614 -0.0121 -0.0073 182 SER C CA 4669 C C . SER C 182 ? 0.1768 0.2874 0.1702 0.0489 -0.0138 -0.0075 182 SER C C 4670 O O . SER C 182 ? 0.1621 0.2917 0.1650 0.0480 -0.0154 -0.0088 182 SER C O 4671 C CB . SER C 182 ? 0.3631 0.4521 0.3500 0.0740 -0.0127 0.0008 182 SER C CB 4672 O OG . SER C 182 ? 0.2392 0.3449 0.2346 0.0742 -0.0208 0.0059 182 SER C OG 4673 N N . LYS C 183 ? 0.2937 0.3868 0.2737 0.0392 -0.0122 -0.0052 183 LYS C N 4674 C CA . LYS C 183 ? 0.2521 0.3524 0.2325 0.0296 -0.0081 -0.0023 183 LYS C CA 4675 C C . LYS C 183 ? 0.2730 0.3703 0.2389 0.0354 -0.0090 0.0010 183 LYS C C 4676 O O . LYS C 183 ? 0.2909 0.3959 0.2536 0.0329 -0.0046 0.0003 183 LYS C O 4677 C CB . LYS C 183 ? 0.2692 0.3516 0.2416 0.0170 -0.0064 0.0036 183 LYS C CB 4678 C CG . LYS C 183 ? 0.3953 0.4866 0.3721 0.0082 0.0036 0.0101 183 LYS C CG 4679 C CD . LYS C 183 ? 0.5042 0.5764 0.4739 -0.0051 0.0047 0.0196 183 LYS C CD 4680 C CE . LYS C 183 ? 0.4202 0.5025 0.3962 -0.0121 0.0200 0.0290 183 LYS C CE 4681 N NZ . LYS C 183 ? 0.3424 0.4068 0.3139 -0.0267 0.0213 0.0411 183 LYS C NZ 4682 N N . ALA C 184 ? 0.2794 0.3613 0.2332 0.0441 -0.0153 0.0054 184 ALA C N 4683 C CA . ALA C 184 ? 0.3793 0.4556 0.3179 0.0486 -0.0221 0.0108 184 ALA C CA 4684 C C . ALA C 184 ? 0.3678 0.4640 0.3173 0.0509 -0.0295 0.0076 184 ALA C C 4685 O O . ALA C 184 ? 0.3318 0.4218 0.2618 0.0463 -0.0314 0.0072 184 ALA C O 4686 C CB . ALA C 184 ? 0.4279 0.4882 0.3608 0.0597 -0.0291 0.0187 184 ALA C CB 4687 N N . ASP C 185 ? 0.3531 0.4682 0.3293 0.0574 -0.0331 0.0058 185 ASP C N 4688 C CA . ASP C 185 ? 0.4205 0.5538 0.4098 0.0569 -0.0422 0.0043 185 ASP C CA 4689 C C . ASP C 185 ? 0.3567 0.4915 0.3368 0.0482 -0.0357 -0.0043 185 ASP C C 4690 O O . ASP C 185 ? 0.2995 0.4278 0.2631 0.0447 -0.0431 -0.0054 185 ASP C O 4691 C CB . ASP C 185 ? 0.4714 0.6259 0.4940 0.0645 -0.0420 0.0053 185 ASP C CB 4692 C CG . ASP C 185 ? 0.6171 0.7751 0.6557 0.0769 -0.0479 0.0174 185 ASP C CG 4693 O OD1 . ASP C 185 ? 0.7057 0.8545 0.7335 0.0778 -0.0595 0.0258 185 ASP C OD1 4694 O OD2 . ASP C 185 ? 0.6563 0.8248 0.7178 0.0869 -0.0397 0.0200 185 ASP C OD2 4695 N N . TYR C 186 ? 0.1700 0.3094 0.1585 0.0450 -0.0228 -0.0094 186 TYR C N 4696 C CA . TYR C 186 ? 0.1649 0.3093 0.1530 0.0401 -0.0140 -0.0151 186 TYR C CA 4697 C C . TYR C 186 ? 0.3641 0.4888 0.3210 0.0374 -0.0064 -0.0134 186 TYR C C 4698 O O . TYR C 186 ? 0.3143 0.4330 0.2577 0.0374 -0.0014 -0.0177 186 TYR C O 4699 C CB . TYR C 186 ? 0.1465 0.3016 0.1553 0.0365 -0.0050 -0.0165 186 TYR C CB 4700 C CG . TYR C 186 ? 0.1419 0.3060 0.1592 0.0338 0.0061 -0.0186 186 TYR C CG 4701 C CD1 . TYR C 186 ? 0.1285 0.3027 0.1557 0.0364 0.0048 -0.0243 186 TYR C CD1 4702 C CD2 . TYR C 186 ? 0.1538 0.3166 0.1724 0.0294 0.0194 -0.0130 186 TYR C CD2 4703 C CE1 . TYR C 186 ? 0.1285 0.3088 0.1643 0.0373 0.0168 -0.0251 186 TYR C CE1 4704 C CE2 . TYR C 186 ? 0.3783 0.5523 0.4115 0.0303 0.0331 -0.0119 186 TYR C CE2 4705 C CZ . TYR C 186 ? 0.3643 0.5458 0.4050 0.0355 0.0319 -0.0184 186 TYR C CZ 4706 O OH . TYR C 186 ? 0.1420 0.3326 0.1980 0.0395 0.0473 -0.0162 186 TYR C OH 4707 N N . GLU C 187 ? 0.3885 0.4973 0.3280 0.0359 -0.0039 -0.0070 187 GLU C N 4708 C CA . GLU C 187 ? 0.3557 0.4418 0.2607 0.0337 0.0072 -0.0040 187 GLU C CA 4709 C C . GLU C 187 ? 0.3972 0.4582 0.2625 0.0351 -0.0062 -0.0040 187 GLU C C 4710 O O . GLU C 187 ? 0.4144 0.4480 0.2389 0.0342 0.0036 -0.0036 187 GLU C O 4711 C CB . GLU C 187 ? 0.4156 0.4904 0.3138 0.0297 0.0144 0.0046 187 GLU C CB 4712 C CG . GLU C 187 ? 0.4497 0.5427 0.3815 0.0234 0.0250 0.0073 187 GLU C CG 4713 C CD . GLU C 187 ? 0.5822 0.6873 0.5270 0.0212 0.0456 0.0094 187 GLU C CD 4714 O OE1 . GLU C 187 ? 0.6888 0.7812 0.6080 0.0264 0.0564 0.0073 187 GLU C OE1 4715 O OE2 . GLU C 187 ? 0.5854 0.7102 0.5654 0.0144 0.0507 0.0142 187 GLU C OE2 4716 N N . LYS C 188 ? 0.3692 0.4369 0.2444 0.0371 -0.0285 -0.0028 188 LYS C N 4717 C CA . LYS C 188 ? 0.4163 0.4616 0.2586 0.0352 -0.0488 0.0002 188 LYS C CA 4718 C C . LYS C 188 ? 0.4172 0.4583 0.2503 0.0317 -0.0565 -0.0071 188 LYS C C 4719 O O . LYS C 188 ? 0.5250 0.5416 0.3254 0.0267 -0.0775 -0.0047 188 LYS C O 4720 C CB . LYS C 188 ? 0.4046 0.4626 0.2704 0.0387 -0.0708 0.0099 188 LYS C CB 4721 C CG . LYS C 188 ? 0.5640 0.6111 0.4232 0.0428 -0.0680 0.0185 188 LYS C CG 4722 C CD . LYS C 188 ? 0.7125 0.7747 0.6023 0.0508 -0.0858 0.0293 188 LYS C CD 4723 C CE . LYS C 188 ? 0.7179 0.7632 0.5976 0.0567 -0.0823 0.0378 188 LYS C CE 4724 N NZ . LYS C 188 ? 0.6099 0.6545 0.4952 0.0566 -0.0596 0.0317 188 LYS C NZ 4725 N N . HIS C 189 ? 0.3527 0.4127 0.2106 0.0331 -0.0428 -0.0150 189 HIS C N 4726 C CA . HIS C 189 ? 0.3722 0.4266 0.2233 0.0301 -0.0504 -0.0218 189 HIS C CA 4727 C C . HIS C 189 ? 0.3954 0.4416 0.2360 0.0339 -0.0245 -0.0299 189 HIS C C 4728 O O . HIS C 189 ? 0.4804 0.5392 0.3372 0.0379 -0.0025 -0.0284 189 HIS C O 4729 C CB . HIS C 189 ? 0.4462 0.5364 0.3480 0.0296 -0.0634 -0.0204 189 HIS C CB 4730 C CG . HIS C 189 ? 0.4859 0.5884 0.4068 0.0288 -0.0860 -0.0092 189 HIS C CG 4731 N ND1 . HIS C 189 ? 0.5162 0.6443 0.4743 0.0361 -0.0818 -0.0026 189 HIS C ND1 4732 C CD2 . HIS C 189 ? 0.4501 0.5413 0.3589 0.0220 -0.1134 -0.0014 189 HIS C CD2 4733 C CE1 . HIS C 189 ? 0.5081 0.6440 0.4814 0.0368 -0.1020 0.0094 189 HIS C CE1 4734 N NE2 . HIS C 189 ? 0.4063 0.5235 0.3541 0.0271 -0.1236 0.0115 189 HIS C NE2 4735 N N . LYS C 190 ? 0.3319 0.3559 0.1469 0.0323 -0.0282 -0.0369 190 LYS C N 4736 C CA . LYS C 190 ? 0.3545 0.3592 0.1480 0.0392 -0.0020 -0.0434 190 LYS C CA 4737 C C . LYS C 190 ? 0.3739 0.3959 0.1974 0.0413 -0.0005 -0.0493 190 LYS C C 4738 O O . LYS C 190 ? 0.4061 0.4504 0.2615 0.0487 0.0208 -0.0492 190 LYS C O 4739 C CB . LYS C 190 ? 0.4357 0.3786 0.1507 0.0384 -0.0018 -0.0473 190 LYS C CB 4740 C CG . LYS C 190 ? 0.6610 0.5763 0.3463 0.0502 0.0333 -0.0522 190 LYS C CG 4741 C CD . LYS C 190 ? 0.8430 0.6910 0.4511 0.0483 0.0280 -0.0596 190 LYS C CD 4742 C CE . LYS C 190 ? 0.8717 0.6944 0.4627 0.0605 0.0660 -0.0596 190 LYS C CE 4743 N NZ . LYS C 190 ? 0.8596 0.6200 0.3910 0.0576 0.0588 -0.0650 190 LYS C NZ 4744 N N . VAL C 191 ? 0.3352 0.3471 0.1507 0.0340 -0.0239 -0.0526 191 VAL C N 4745 C CA . VAL C 191 ? 0.3209 0.3390 0.1541 0.0352 -0.0229 -0.0582 191 VAL C CA 4746 C C . VAL C 191 ? 0.2564 0.3255 0.1536 0.0330 -0.0312 -0.0538 191 VAL C C 4747 O O . VAL C 191 ? 0.3802 0.4668 0.2966 0.0263 -0.0507 -0.0476 191 VAL C O 4748 C CB . VAL C 191 ? 0.3718 0.3467 0.1592 0.0258 -0.0448 -0.0630 191 VAL C CB 4749 C CG1 . VAL C 191 ? 0.3628 0.3385 0.1644 0.0272 -0.0422 -0.0686 191 VAL C CG1 4750 C CG2 . VAL C 191 ? 0.5436 0.4553 0.2522 0.0279 -0.0372 -0.0679 191 VAL C CG2 4751 N N . TYR C 192 ? 0.2259 0.3164 0.1547 0.0395 -0.0157 -0.0555 192 TYR C N 4752 C CA . TYR C 192 ? 0.2521 0.3809 0.2301 0.0381 -0.0212 -0.0522 192 TYR C CA 4753 C C . TYR C 192 ? 0.2322 0.3591 0.2185 0.0391 -0.0204 -0.0564 192 TYR C C 4754 O O . TYR C 192 ? 0.3138 0.4272 0.2901 0.0469 -0.0046 -0.0599 192 TYR C O 4755 C CB . TYR C 192 ? 0.2292 0.3836 0.2362 0.0427 -0.0075 -0.0482 192 TYR C CB 4756 C CG . TYR C 192 ? 0.3036 0.4587 0.3040 0.0411 -0.0096 -0.0433 192 TYR C CG 4757 C CD1 . TYR C 192 ? 0.1796 0.3141 0.1505 0.0430 0.0012 -0.0425 192 TYR C CD1 4758 C CD2 . TYR C 192 ? 0.1264 0.2987 0.1471 0.0390 -0.0201 -0.0388 192 TYR C CD2 4759 C CE1 . TYR C 192 ? 0.1859 0.3178 0.1483 0.0410 -0.0016 -0.0372 192 TYR C CE1 4760 C CE2 . TYR C 192 ? 0.1335 0.3024 0.1466 0.0391 -0.0219 -0.0338 192 TYR C CE2 4761 C CZ . TYR C 192 ? 0.2961 0.4451 0.2804 0.0392 -0.0142 -0.0331 192 TYR C CZ 4762 O OH . TYR C 192 ? 0.4127 0.5555 0.3873 0.0389 -0.0167 -0.0273 192 TYR C OH 4763 N N . ALA C 193 ? 0.2095 0.3497 0.2155 0.0322 -0.0357 -0.0541 193 ALA C N 4764 C CA . ALA C 193 ? 0.2799 0.4141 0.2901 0.0312 -0.0374 -0.0570 193 ALA C CA 4765 C C . ALA C 193 ? 0.2324 0.3968 0.2807 0.0276 -0.0436 -0.0512 193 ALA C C 4766 O O . ALA C 193 ? 0.1941 0.3771 0.2597 0.0241 -0.0507 -0.0447 193 ALA C O 4767 C CB . ALA C 193 ? 0.2025 0.2996 0.1757 0.0227 -0.0522 -0.0605 193 ALA C CB 4768 N N . CYS C 194 ? 0.1132 0.2796 0.1725 0.0300 -0.0388 -0.0526 194 CYS C N 4769 C CA . CYS C 194 ? 0.3690 0.5506 0.4519 0.0254 -0.0434 -0.0468 194 CYS C CA 4770 C C . CYS C 194 ? 0.3078 0.4714 0.3815 0.0198 -0.0512 -0.0489 194 CYS C C 4771 O O . CYS C 194 ? 0.2387 0.3822 0.2971 0.0258 -0.0447 -0.0545 194 CYS C O 4772 C CB . CYS C 194 ? 0.3760 0.5536 0.4653 0.0286 -0.0301 -0.0413 194 CYS C CB 4773 S SG . CYS C 194 ? 0.4934 0.6712 0.5858 0.0377 -0.0228 -0.0459 194 CYS C SG 4774 N N . GLU C 195 ? 0.3030 0.4716 0.3872 0.0085 -0.0644 -0.0422 195 GLU C N 4775 C CA . GLU C 195 ? 0.2753 0.4240 0.3514 -0.0011 -0.0744 -0.0416 195 GLU C CA 4776 C C . GLU C 195 ? 0.1692 0.3359 0.2714 -0.0011 -0.0686 -0.0351 195 GLU C C 4777 O O . GLU C 195 ? 0.1663 0.3528 0.2914 -0.0018 -0.0627 -0.0242 195 GLU C O 4778 C CB . GLU C 195 ? 0.2150 0.3581 0.2901 -0.0173 -0.0959 -0.0348 195 GLU C CB 4779 C CG . GLU C 195 ? 0.2958 0.4054 0.3504 -0.0307 -0.1108 -0.0355 195 GLU C CG 4780 C CD . GLU C 195 ? 0.4577 0.5617 0.5134 -0.0507 -0.1380 -0.0262 195 GLU C CD 4781 O OE1 . GLU C 195 ? 0.5557 0.6922 0.6414 -0.0493 -0.1338 -0.0161 195 GLU C OE1 4782 O OE2 . GLU C 195 ? 0.5254 0.5866 0.5465 -0.0638 -0.1549 -0.0292 195 GLU C OE2 4783 N N . VAL C 196 ? 0.1335 0.2800 0.2238 0.0009 -0.0660 -0.0389 196 VAL C N 4784 C CA . VAL C 196 ? 0.1210 0.2771 0.2271 0.0018 -0.0603 -0.0331 196 VAL C CA 4785 C C . VAL C 196 ? 0.1435 0.2846 0.2490 -0.0119 -0.0708 -0.0273 196 VAL C C 4786 O O . VAL C 196 ? 0.3785 0.4861 0.4587 -0.0166 -0.0798 -0.0329 196 VAL C O 4787 C CB . VAL C 196 ? 0.1196 0.2668 0.2177 0.0149 -0.0511 -0.0385 196 VAL C CB 4788 C CG1 . VAL C 196 ? 0.1178 0.2658 0.2231 0.0139 -0.0494 -0.0320 196 VAL C CG1 4789 C CG2 . VAL C 196 ? 0.0978 0.2634 0.2029 0.0244 -0.0430 -0.0407 196 VAL C CG2 4790 N N . THR C 197 ? 0.2540 0.4160 0.3846 -0.0183 -0.0681 -0.0153 197 THR C N 4791 C CA . THR C 197 ? 0.2439 0.3974 0.3818 -0.0331 -0.0760 -0.0058 197 THR C CA 4792 C C . THR C 197 ? 0.2884 0.4437 0.4299 -0.0284 -0.0632 -0.0003 197 THR C C 4793 O O . THR C 197 ? 0.4759 0.6524 0.6292 -0.0208 -0.0494 0.0047 197 THR C O 4794 C CB . THR C 197 ? 0.1464 0.3266 0.3179 -0.0472 -0.0841 0.0089 197 THR C CB 4795 O OG1 . THR C 197 ? 0.1661 0.3320 0.3251 -0.0568 -0.1041 0.0050 197 THR C OG1 4796 C CG2 . THR C 197 ? 0.3033 0.4858 0.4950 -0.0622 -0.0866 0.0241 197 THR C CG2 4797 N N . HIS C 198 ? 0.2235 0.3499 0.3480 -0.0324 -0.0679 -0.0012 198 HIS C N 4798 C CA . HIS C 198 ? 0.3050 0.4255 0.4254 -0.0284 -0.0585 0.0043 198 HIS C CA 4799 C C . HIS C 198 ? 0.3813 0.4736 0.4927 -0.0413 -0.0674 0.0097 198 HIS C C 4800 O O . HIS C 198 ? 0.3900 0.4561 0.4863 -0.0483 -0.0810 0.0038 198 HIS C O 4801 C CB . HIS C 198 ? 0.1695 0.2803 0.2720 -0.0112 -0.0540 -0.0051 198 HIS C CB 4802 C CG . HIS C 198 ? 0.2419 0.3412 0.3342 -0.0079 -0.0492 0.0011 198 HIS C CG 4803 N ND1 . HIS C 198 ? 0.2747 0.3444 0.3514 -0.0074 -0.0553 0.0015 198 HIS C ND1 4804 C CD2 . HIS C 198 ? 0.3193 0.4263 0.4080 -0.0047 -0.0396 0.0076 198 HIS C CD2 4805 C CE1 . HIS C 198 ? 0.2741 0.3369 0.3409 -0.0050 -0.0516 0.0088 198 HIS C CE1 4806 N NE2 . HIS C 198 ? 0.2727 0.3553 0.3430 -0.0037 -0.0420 0.0121 198 HIS C NE2 4807 N N . GLN C 199 ? 0.3086 0.4003 0.4232 -0.0447 -0.0591 0.0211 199 GLN C N 4808 C CA . GLN C 199 ? 0.3989 0.4642 0.5069 -0.0591 -0.0665 0.0292 199 GLN C CA 4809 C C . GLN C 199 ? 0.4641 0.4857 0.5394 -0.0536 -0.0775 0.0173 199 GLN C C 4810 O O . GLN C 199 ? 0.5685 0.5593 0.6317 -0.0672 -0.0901 0.0186 199 GLN C O 4811 C CB . GLN C 199 ? 0.3551 0.4216 0.4633 -0.0595 -0.0522 0.0426 199 GLN C CB 4812 C CG . GLN C 199 ? 0.4551 0.4909 0.5535 -0.0739 -0.0586 0.0521 199 GLN C CG 4813 C CD . GLN C 199 ? 0.4854 0.5175 0.5770 -0.0735 -0.0425 0.0659 199 GLN C CD 4814 O OE1 . GLN C 199 ? 0.5289 0.5828 0.6255 -0.0653 -0.0248 0.0709 199 GLN C OE1 4815 N NE2 . GLN C 199 ? 0.4156 0.4133 0.4889 -0.0818 -0.0479 0.0722 199 GLN C NE2 4816 N N . GLY C 200 ? 0.4299 0.4466 0.4915 -0.0337 -0.0728 0.0072 200 GLY C N 4817 C CA . GLY C 200 ? 0.4295 0.4086 0.4661 -0.0227 -0.0779 -0.0020 200 GLY C CA 4818 C C . GLY C 200 ? 0.4657 0.4277 0.4879 -0.0194 -0.0827 -0.0146 200 GLY C C 4819 O O . GLY C 200 ? 0.4619 0.3907 0.4617 -0.0057 -0.0815 -0.0223 200 GLY C O 4820 N N . LEU C 201 ? 0.4421 0.4226 0.4739 -0.0302 -0.0872 -0.0159 201 LEU C N 4821 C CA . LEU C 201 ? 0.4940 0.4517 0.5027 -0.0289 -0.0931 -0.0275 201 LEU C CA 4822 C C . LEU C 201 ? 0.5579 0.4866 0.5513 -0.0533 -0.1124 -0.0243 201 LEU C C 4823 O O . LEU C 201 ? 0.5231 0.4793 0.5458 -0.0724 -0.1204 -0.0115 201 LEU C O 4824 C CB . LEU C 201 ? 0.4729 0.4679 0.4984 -0.0230 -0.0876 -0.0311 201 LEU C CB 4825 C CG . LEU C 201 ? 0.4096 0.4235 0.4430 -0.0004 -0.0723 -0.0361 201 LEU C CG 4826 C CD1 . LEU C 201 ? 0.3271 0.3744 0.3753 0.0020 -0.0684 -0.0385 201 LEU C CD1 4827 C CD2 . LEU C 201 ? 0.2850 0.2615 0.2916 0.0164 -0.0659 -0.0450 201 LEU C CD2 4828 N N . SER C 202 ? 0.7011 0.5717 0.6481 -0.0526 -0.1197 -0.0346 202 SER C N 4829 C CA . SER C 202 ? 0.7290 0.5608 0.6513 -0.0786 -0.1435 -0.0326 202 SER C CA 4830 C C . SER C 202 ? 0.6979 0.5469 0.6247 -0.0906 -0.1566 -0.0329 202 SER C C 4831 O O . SER C 202 ? 0.5955 0.4527 0.5392 -0.1173 -0.1786 -0.0210 202 SER C O 4832 C CB . SER C 202 ? 0.7352 0.4872 0.5937 -0.0725 -0.1464 -0.0450 202 SER C CB 4833 O OG . SER C 202 ? 0.7854 0.5211 0.6163 -0.0462 -0.1290 -0.0594 202 SER C OG 4834 N N . SER C 203 ? 0.6553 0.5107 0.5702 -0.0718 -0.1445 -0.0440 203 SER C N 4835 C CA . SER C 203 ? 0.5856 0.4605 0.5052 -0.0791 -0.1544 -0.0439 203 SER C CA 4836 C C . SER C 203 ? 0.4561 0.3790 0.4031 -0.0562 -0.1313 -0.0471 203 SER C C 4837 O O . SER C 203 ? 0.5128 0.4392 0.4617 -0.0351 -0.1108 -0.0521 203 SER C O 4838 C CB . SER C 203 ? 0.5054 0.3116 0.3563 -0.0839 -0.1682 -0.0563 203 SER C CB 4839 O OG . SER C 203 ? 0.5110 0.3012 0.3317 -0.0572 -0.1451 -0.0702 203 SER C OG 4840 N N . PRO C 204 ? 0.4458 0.4056 0.4161 -0.0608 -0.1361 -0.0426 204 PRO C N 4841 C CA . PRO C 204 ? 0.2928 0.2968 0.2898 -0.0418 -0.1158 -0.0441 204 PRO C CA 4842 C C . PRO C 204 ? 0.4255 0.4042 0.3885 -0.0207 -0.0990 -0.0580 204 PRO C C 4843 O O . PRO C 204 ? 0.5634 0.4910 0.4765 -0.0202 -0.1028 -0.0672 204 PRO C O 4844 C CB . PRO C 204 ? 0.2749 0.3101 0.2943 -0.0526 -0.1279 -0.0364 204 PRO C CB 4845 C CG . PRO C 204 ? 0.3018 0.3288 0.3292 -0.0784 -0.1537 -0.0247 204 PRO C CG 4846 C CD . PRO C 204 ? 0.3608 0.3248 0.3381 -0.0845 -0.1624 -0.0333 204 PRO C CD 4847 N N . VAL C 205 ? 0.2655 0.2781 0.2548 -0.0034 -0.0799 -0.0580 205 VAL C N 4848 C CA . VAL C 205 ? 0.3204 0.3241 0.2948 0.0168 -0.0615 -0.0660 205 VAL C CA 4849 C C . VAL C 205 ? 0.3859 0.4207 0.3738 0.0188 -0.0577 -0.0654 205 VAL C C 4850 O O . VAL C 205 ? 0.1996 0.2751 0.2223 0.0138 -0.0606 -0.0581 205 VAL C O 4851 C CB . VAL C 205 ? 0.2490 0.2678 0.2468 0.0327 -0.0469 -0.0634 205 VAL C CB 4852 C CG1 . VAL C 205 ? 0.2462 0.2700 0.2456 0.0523 -0.0276 -0.0665 205 VAL C CG1 4853 C CG2 . VAL C 205 ? 0.2861 0.2666 0.2647 0.0334 -0.0495 -0.0642 205 VAL C CG2 4854 N N . THR C 206 ? 0.3846 0.3950 0.3404 0.0269 -0.0494 -0.0725 206 THR C N 4855 C CA . THR C 206 ? 0.3099 0.3420 0.2715 0.0286 -0.0457 -0.0718 206 THR C CA 4856 C C . THR C 206 ? 0.3253 0.3579 0.2852 0.0480 -0.0212 -0.0745 206 THR C C 4857 O O . THR C 206 ? 0.3653 0.3595 0.2926 0.0594 -0.0078 -0.0799 206 THR C O 4858 C CB . THR C 206 ? 0.2920 0.2927 0.2137 0.0161 -0.0620 -0.0745 206 THR C CB 4859 O OG1 . THR C 206 ? 0.4153 0.4210 0.3492 -0.0036 -0.0867 -0.0679 206 THR C OG1 4860 C CG2 . THR C 206 ? 0.2730 0.2963 0.2014 0.0179 -0.0591 -0.0723 206 THR C CG2 4861 N N . LYS C 207 ? 0.3566 0.4309 0.3518 0.0517 -0.0143 -0.0692 207 LYS C N 4862 C CA . LYS C 207 ? 0.3403 0.4240 0.3444 0.0663 0.0068 -0.0677 207 LYS C CA 4863 C C . LYS C 207 ? 0.3152 0.4092 0.3139 0.0623 0.0071 -0.0668 207 LYS C C 4864 O O . LYS C 207 ? 0.2563 0.3751 0.2733 0.0524 -0.0059 -0.0634 207 LYS C O 4865 C CB . LYS C 207 ? 0.3133 0.4341 0.3652 0.0720 0.0112 -0.0599 207 LYS C CB 4866 C CG . LYS C 207 ? 0.3212 0.4310 0.3792 0.0781 0.0114 -0.0589 207 LYS C CG 4867 C CD . LYS C 207 ? 0.3269 0.4041 0.3633 0.0951 0.0310 -0.0614 207 LYS C CD 4868 C CE . LYS C 207 ? 0.3475 0.4132 0.3927 0.1036 0.0317 -0.0588 207 LYS C CE 4869 N NZ . LYS C 207 ? 0.4418 0.4686 0.4616 0.1236 0.0542 -0.0611 207 LYS C NZ 4870 N N . SER C 208 ? 0.3014 0.3734 0.2728 0.0713 0.0241 -0.0688 208 SER C N 4871 C CA . SER C 208 ? 0.3329 0.4038 0.2876 0.0670 0.0239 -0.0681 208 SER C CA 4872 C C . SER C 208 ? 0.3429 0.4226 0.3070 0.0793 0.0501 -0.0630 208 SER C C 4873 O O . SER C 208 ? 0.6083 0.6867 0.5840 0.0932 0.0706 -0.0602 208 SER C O 4874 C CB . SER C 208 ? 0.4332 0.4537 0.3264 0.0606 0.0137 -0.0751 208 SER C CB 4875 O OG . SER C 208 ? 0.5396 0.5523 0.4292 0.0473 -0.0115 -0.0770 208 SER C OG 4876 N N . PHE C 209 ? 0.2869 0.3772 0.2500 0.0743 0.0495 -0.0596 209 PHE C N 4877 C CA . PHE C 209 ? 0.3440 0.4334 0.3040 0.0829 0.0741 -0.0538 209 PHE C CA 4878 C C . PHE C 209 ? 0.4079 0.4757 0.3274 0.0756 0.0676 -0.0553 209 PHE C C 4879 O O . PHE C 209 ? 0.3595 0.4296 0.2739 0.0638 0.0425 -0.0574 209 PHE C O 4880 C CB . PHE C 209 ? 0.2042 0.3421 0.2253 0.0833 0.0807 -0.0424 209 PHE C CB 4881 C CG . PHE C 209 ? 0.2902 0.4524 0.3300 0.0700 0.0611 -0.0400 209 PHE C CG 4882 C CD1 . PHE C 209 ? 0.3460 0.5059 0.3740 0.0658 0.0645 -0.0361 209 PHE C CD1 4883 C CD2 . PHE C 209 ? 0.2576 0.4400 0.3229 0.0631 0.0418 -0.0409 209 PHE C CD2 4884 C CE1 . PHE C 209 ? 0.3485 0.5243 0.3898 0.0559 0.0483 -0.0339 209 PHE C CE1 4885 C CE2 . PHE C 209 ? 0.2172 0.4140 0.2931 0.0541 0.0281 -0.0388 209 PHE C CE2 4886 C CZ . PHE C 209 ? 0.3187 0.5118 0.3830 0.0510 0.0311 -0.0355 209 PHE C CZ 4887 N N . ASN C 210 ? 0.3863 0.4329 0.2783 0.0836 0.0917 -0.0523 210 ASN C N 4888 C CA . ASN C 210 ? 0.3575 0.3820 0.2097 0.0775 0.0882 -0.0514 210 ASN C CA 4889 C C . ASN C 210 ? 0.3935 0.4536 0.2855 0.0767 0.1009 -0.0398 210 ASN C C 4890 O O . ASN C 210 ? 0.4790 0.5538 0.3970 0.0861 0.1282 -0.0315 210 ASN C O 4891 C CB . ASN C 210 ? 0.4624 0.4248 0.2397 0.0859 0.1065 -0.0561 210 ASN C CB 4892 C CG . ASN C 210 ? 0.4642 0.3798 0.1902 0.0823 0.0878 -0.0677 210 ASN C CG 4893 O OD1 . ASN C 210 ? 0.4390 0.3657 0.1767 0.0686 0.0547 -0.0705 210 ASN C OD1 4894 N ND2 . ASN C 210 ? 0.5245 0.3944 0.2123 0.0883 0.1037 -0.0700 210 ASN C ND2 4895 N N . ARG C 211 ? 0.3686 0.4422 0.2681 0.0655 0.0809 -0.0375 211 ARG C N 4896 C CA . ARG C 211 ? 0.2695 0.3681 0.1984 0.0620 0.0892 -0.0269 211 ARG C CA 4897 C C . ARG C 211 ? 0.4085 0.4825 0.3059 0.0683 0.1181 -0.0204 211 ARG C C 4898 O O . ARG C 211 ? 0.5093 0.5394 0.3449 0.0689 0.1182 -0.0244 211 ARG C O 4899 C CB . ARG C 211 ? 0.2522 0.3554 0.1797 0.0518 0.0643 -0.0265 211 ARG C CB 4900 C CG . ARG C 211 ? 0.2409 0.3599 0.1896 0.0465 0.0704 -0.0162 211 ARG C CG 4901 C CD . ARG C 211 ? 0.2433 0.3521 0.1743 0.0405 0.0505 -0.0155 211 ARG C CD 4902 N NE . ARG C 211 ? 0.2872 0.3594 0.1643 0.0417 0.0436 -0.0185 211 ARG C NE 4903 C CZ . ARG C 211 ? 0.4507 0.4919 0.2849 0.0427 0.0574 -0.0144 211 ARG C CZ 4904 N NH1 . ARG C 211 ? 0.3954 0.4432 0.2415 0.0432 0.0821 -0.0058 211 ARG C NH1 4905 N NH2 . ARG C 211 ? 0.4332 0.4352 0.2117 0.0421 0.0455 -0.0172 211 ARG C NH2 4906 N N . GLY C 212 ? 0.4505 0.5518 0.3905 0.0722 0.1422 -0.0085 212 GLY C N 4907 C CA . GLY C 212 ? 0.6304 0.7124 0.5535 0.0754 0.1694 0.0002 212 GLY C CA 4908 C C . GLY C 212 ? 0.8181 0.8847 0.7402 0.0857 0.1874 -0.0006 212 GLY C C 4909 O O . GLY C 212 ? 0.9278 1.0101 0.8837 0.0888 0.2068 0.0117 212 GLY C O 4910 N N . ALA C 213 ? 0.8364 0.8709 0.7188 0.0917 0.1806 -0.0135 213 ALA C N 4911 C CA . ALA C 213 ? 0.7719 0.7852 0.6460 0.1036 0.1973 -0.0144 213 ALA C CA 4912 C C . ALA C 213 ? 0.7243 0.7836 0.6715 0.1068 0.1996 -0.0069 213 ALA C C 4913 O O . ALA C 213 ? 0.6858 0.7661 0.6590 0.1034 0.1806 -0.0125 213 ALA C O 4914 C CB . ALA C 213 ? 0.7513 0.7168 0.5651 0.1060 0.1844 -0.0297 213 ALA C CB 4915 O OXT . ALA C 213 ? 0.6960 0.7707 0.6765 0.1126 0.2188 0.0061 213 ALA C OXT 4916 N N . GLN D 1 ? 0.3054 0.6523 0.3052 0.0873 -0.1027 -0.0207 1 GLN D N 4917 C CA . GLN D 1 ? 0.3888 0.6843 0.3848 0.0920 -0.1111 -0.0314 1 GLN D CA 4918 C C . GLN D 1 ? 0.3716 0.6496 0.3759 0.0526 -0.0921 -0.0203 1 GLN D C 4919 O O . GLN D 1 ? 0.4401 0.7543 0.4454 0.0381 -0.0722 -0.0134 1 GLN D O 4920 C CB . GLN D 1 ? 0.3718 0.6930 0.3548 0.1310 -0.1145 -0.0469 1 GLN D CB 4921 N N . VAL D 2 ? 0.3281 0.5527 0.3382 0.0364 -0.1002 -0.0163 2 VAL D N 4922 C CA . VAL D 2 ? 0.3616 0.5703 0.3769 0.0066 -0.0831 -0.0065 2 VAL D CA 4923 C C . VAL D 2 ? 0.3916 0.5915 0.4061 0.0156 -0.0817 -0.0153 2 VAL D C 4924 O O . VAL D 2 ? 0.2927 0.4625 0.3071 0.0347 -0.1029 -0.0248 2 VAL D O 4925 C CB . VAL D 2 ? 0.3992 0.5693 0.4236 -0.0109 -0.0908 0.0063 2 VAL D CB 4926 C CG1 . VAL D 2 ? 0.2640 0.4235 0.2917 -0.0328 -0.0730 0.0156 2 VAL D CG1 4927 C CG2 . VAL D 2 ? 0.3074 0.4887 0.3298 -0.0208 -0.0900 0.0159 2 VAL D CG2 4928 N N . GLN D 3 ? 0.2518 0.4731 0.2636 0.0014 -0.0605 -0.0119 3 GLN D N 4929 C CA . GLN D 3 ? 0.3566 0.5747 0.3668 0.0088 -0.0570 -0.0187 3 GLN D CA 4930 C C . GLN D 3 ? 0.3336 0.5455 0.3438 -0.0181 -0.0375 -0.0095 3 GLN D C 4931 O O . GLN D 3 ? 0.2259 0.4488 0.2308 -0.0378 -0.0259 -0.0006 3 GLN D O 4932 C CB . GLN D 3 ? 0.4214 0.6869 0.4232 0.0325 -0.0548 -0.0263 3 GLN D CB 4933 C CG . GLN D 3 ? 0.5225 0.7901 0.5159 0.0719 -0.0765 -0.0413 3 GLN D CG 4934 C CD . GLN D 3 ? 0.6315 0.9615 0.6146 0.1009 -0.0705 -0.0458 3 GLN D CD 4935 O OE1 . GLN D 3 ? 0.7228 1.0971 0.7096 0.0860 -0.0508 -0.0336 3 GLN D OE1 4936 N NE2 . GLN D 3 ? 0.7069 1.0422 0.6753 0.1442 -0.0895 -0.0617 3 GLN D NE2 4937 N N . LEU D 4 ? 0.2721 0.4624 0.2852 -0.0166 -0.0373 -0.0125 4 LEU D N 4938 C CA . LEU D 4 ? 0.2706 0.4539 0.2806 -0.0346 -0.0208 -0.0065 4 LEU D CA 4939 C C . LEU D 4 ? 0.3142 0.5079 0.3215 -0.0235 -0.0192 -0.0133 4 LEU D C 4940 O O . LEU D 4 ? 0.4408 0.6213 0.4520 -0.0053 -0.0326 -0.0222 4 LEU D O 4941 C CB . LEU D 4 ? 0.3608 0.5118 0.3791 -0.0445 -0.0198 0.0012 4 LEU D CB 4942 C CG . LEU D 4 ? 0.4048 0.5498 0.4236 -0.0557 -0.0181 0.0119 4 LEU D CG 4943 C CD1 . LEU D 4 ? 0.3442 0.4804 0.3770 -0.0478 -0.0385 0.0144 4 LEU D CD1 4944 C CD2 . LEU D 4 ? 0.4088 0.5410 0.4272 -0.0653 -0.0058 0.0227 4 LEU D CD2 4945 N N . LYS D 5 ? 0.2141 0.4288 0.2133 -0.0352 -0.0064 -0.0079 5 LYS D N 4946 C CA . LYS D 5 ? 0.2906 0.5237 0.2867 -0.0270 -0.0033 -0.0101 5 LYS D CA 4947 C C . LYS D 5 ? 0.2890 0.5004 0.2799 -0.0465 0.0071 -0.0035 5 LYS D C 4948 O O . LYS D 5 ? 0.3471 0.5535 0.3292 -0.0671 0.0125 0.0052 5 LYS D O 4949 C CB . LYS D 5 ? 0.3328 0.6229 0.3257 -0.0217 -0.0008 -0.0039 5 LYS D CB 4950 C CG . LYS D 5 ? 0.5139 0.8305 0.5075 0.0061 -0.0112 -0.0122 5 LYS D CG 4951 C CD . LYS D 5 ? 0.6452 1.0103 0.6415 -0.0025 -0.0074 0.0010 5 LYS D CD 4952 C CE . LYS D 5 ? 0.6512 0.9852 0.6491 -0.0283 -0.0075 0.0064 5 LYS D CE 4953 N NZ . LYS D 5 ? 0.5298 0.9062 0.5300 -0.0455 -0.0055 0.0227 5 LYS D NZ 4954 N N . GLN D 6 ? 0.2580 0.4526 0.2513 -0.0384 0.0065 -0.0084 6 GLN D N 4955 C CA . GLN D 6 ? 0.2882 0.4586 0.2762 -0.0514 0.0148 -0.0038 6 GLN D CA 4956 C C . GLN D 6 ? 0.3338 0.5252 0.3152 -0.0530 0.0179 0.0005 6 GLN D C 4957 O O . GLN D 6 ? 0.2588 0.4839 0.2421 -0.0372 0.0145 -0.0021 6 GLN D O 4958 C CB . GLN D 6 ? 0.2957 0.4371 0.2945 -0.0436 0.0117 -0.0076 6 GLN D CB 4959 C CG . GLN D 6 ? 0.3239 0.4530 0.3349 -0.0420 0.0049 -0.0062 6 GLN D CG 4960 C CD . GLN D 6 ? 0.3468 0.4563 0.3747 -0.0386 -0.0013 -0.0022 6 GLN D CD 4961 O OE1 . GLN D 6 ? 0.4444 0.5464 0.4876 -0.0378 -0.0133 0.0029 6 GLN D OE1 4962 N NE2 . GLN D 6 ? 0.3205 0.4234 0.3476 -0.0385 0.0046 -0.0013 6 GLN D NE2 4963 N N . SER D 7 ? 0.3644 0.5355 0.3353 -0.0698 0.0229 0.0078 7 SER D N 4964 C CA . SER D 7 ? 0.3358 0.5215 0.3015 -0.0749 0.0237 0.0158 7 SER D CA 4965 C C . SER D 7 ? 0.4028 0.5870 0.3748 -0.0555 0.0233 0.0073 7 SER D C 4966 O O . SER D 7 ? 0.2203 0.3789 0.2001 -0.0450 0.0211 -0.0022 7 SER D O 4967 C CB . SER D 7 ? 0.2516 0.4008 0.2008 -0.0955 0.0232 0.0237 7 SER D CB 4968 O OG . SER D 7 ? 0.4614 0.5675 0.4058 -0.0883 0.0268 0.0147 7 SER D OG 4969 N N . GLY D 8 ? 0.4022 0.6170 0.3713 -0.0521 0.0237 0.0137 8 GLY D N 4970 C CA . GLY D 8 ? 0.3354 0.5565 0.3063 -0.0299 0.0206 0.0046 8 GLY D CA 4971 C C . GLY D 8 ? 0.3366 0.5148 0.3094 -0.0303 0.0203 0.0000 8 GLY D C 4972 O O . GLY D 8 ? 0.2430 0.3892 0.2129 -0.0455 0.0246 0.0046 8 GLY D O 4973 N N . PRO D 9 ? 0.4096 0.5869 0.3851 -0.0106 0.0133 -0.0096 9 PRO D N 4974 C CA . PRO D 9 ? 0.4486 0.5923 0.4298 -0.0105 0.0115 -0.0115 9 PRO D CA 4975 C C . PRO D 9 ? 0.5143 0.6584 0.4855 -0.0202 0.0180 -0.0011 9 PRO D C 4976 O O . PRO D 9 ? 0.6372 0.8112 0.5988 -0.0268 0.0213 0.0092 9 PRO D O 4977 C CB . PRO D 9 ? 0.4668 0.6099 0.4510 0.0130 -0.0040 -0.0245 9 PRO D CB 4978 C CG . PRO D 9 ? 0.4200 0.6048 0.3894 0.0298 -0.0055 -0.0284 9 PRO D CG 4979 C CD . PRO D 9 ? 0.4019 0.6086 0.3718 0.0160 0.0041 -0.0199 9 PRO D CD 4980 N N . GLY D 10 ? 0.4733 0.5869 0.4486 -0.0214 0.0185 -0.0009 10 GLY D N 4981 C CA . GLY D 10 ? 0.5096 0.6148 0.4739 -0.0295 0.0218 0.0084 10 GLY D CA 4982 C C . GLY D 10 ? 0.4081 0.4825 0.3788 -0.0245 0.0218 0.0068 10 GLY D C 4983 O O . GLY D 10 ? 0.3308 0.3957 0.3176 -0.0176 0.0200 0.0024 10 GLY D O 4984 N N . LEU D 11 ? 0.3495 0.4123 0.3088 -0.0288 0.0225 0.0140 11 LEU D N 4985 C CA . LEU D 11 ? 0.3322 0.3705 0.2950 -0.0216 0.0226 0.0144 11 LEU D CA 4986 C C . LEU D 11 ? 0.3640 0.3679 0.3106 -0.0269 0.0270 0.0179 11 LEU D C 4987 O O . LEU D 11 ? 0.3811 0.3718 0.3074 -0.0408 0.0243 0.0231 11 LEU D O 4988 C CB . LEU D 11 ? 0.2873 0.3323 0.2441 -0.0188 0.0179 0.0190 11 LEU D CB 4989 C CG . LEU D 11 ? 0.4320 0.4536 0.3894 -0.0119 0.0168 0.0216 11 LEU D CG 4990 C CD1 . LEU D 11 ? 0.4919 0.5197 0.4736 0.0020 0.0124 0.0161 11 LEU D CD1 4991 C CD2 . LEU D 11 ? 0.4830 0.5096 0.4265 -0.0157 0.0123 0.0303 11 LEU D CD2 4992 N N . VAL D 12 ? 0.4210 0.4117 0.3755 -0.0141 0.0312 0.0162 12 VAL D N 4993 C CA . VAL D 12 ? 0.5201 0.4782 0.4529 -0.0082 0.0348 0.0162 12 VAL D CA 4994 C C . VAL D 12 ? 0.5352 0.4826 0.4695 0.0082 0.0356 0.0188 12 VAL D C 4995 O O . VAL D 12 ? 0.6470 0.6194 0.6100 0.0174 0.0378 0.0220 12 VAL D O 4996 C CB . VAL D 12 ? 0.6536 0.6178 0.5910 -0.0019 0.0427 0.0138 12 VAL D CB 4997 C CG1 . VAL D 12 ? 0.6403 0.5723 0.5483 0.0136 0.0461 0.0114 12 VAL D CG1 4998 C CG2 . VAL D 12 ? 0.7113 0.6840 0.6457 -0.0178 0.0408 0.0114 12 VAL D CG2 4999 N N . GLN D 13 ? 0.5245 0.4332 0.4281 0.0114 0.0304 0.0187 13 GLN D N 5000 C CA . GLN D 13 ? 0.5389 0.4351 0.4398 0.0305 0.0304 0.0205 13 GLN D CA 5001 C C . GLN D 13 ? 0.5380 0.4416 0.4409 0.0564 0.0414 0.0194 13 GLN D C 5002 O O . GLN D 13 ? 0.6277 0.5252 0.5160 0.0604 0.0458 0.0149 13 GLN D O 5003 C CB . GLN D 13 ? 0.5490 0.3944 0.4121 0.0275 0.0169 0.0209 13 GLN D CB 5004 C CG . GLN D 13 ? 0.7063 0.5518 0.5658 -0.0009 0.0058 0.0292 13 GLN D CG 5005 C CD . GLN D 13 ? 0.8591 0.7388 0.7431 -0.0028 0.0069 0.0354 13 GLN D CD 5006 O OE1 . GLN D 13 ? 0.9806 0.8582 0.8713 0.0132 0.0077 0.0357 13 GLN D OE1 5007 N NE2 . GLN D 13 ? 0.7729 0.6868 0.6681 -0.0194 0.0063 0.0404 13 GLN D NE2 5008 N N . PRO D 14 ? 0.5058 0.4295 0.4277 0.0752 0.0461 0.0258 14 PRO D N 5009 C CA . PRO D 14 ? 0.5481 0.4926 0.4731 0.1036 0.0583 0.0301 14 PRO D CA 5010 C C . PRO D 14 ? 0.6332 0.5307 0.5049 0.1262 0.0569 0.0186 14 PRO D C 5011 O O . PRO D 14 ? 0.5952 0.4370 0.4298 0.1225 0.0424 0.0100 14 PRO D O 5012 C CB . PRO D 14 ? 0.4507 0.4217 0.4021 0.1179 0.0594 0.0412 14 PRO D CB 5013 C CG . PRO D 14 ? 0.4305 0.4084 0.4067 0.0921 0.0488 0.0432 14 PRO D CG 5014 C CD . PRO D 14 ? 0.4811 0.4204 0.4270 0.0716 0.0406 0.0321 14 PRO D CD 5015 N N . SER D 15 ? 0.6367 0.5566 0.5029 0.1500 0.0695 0.0198 15 SER D N 5016 C CA . SER D 15 ? 0.6990 0.5770 0.5088 0.1800 0.0676 0.0063 15 SER D CA 5017 C C . SER D 15 ? 0.7283 0.5537 0.5025 0.1580 0.0537 -0.0071 15 SER D C 5018 O O . SER D 15 ? 0.7474 0.5383 0.4748 0.1796 0.0496 -0.0193 15 SER D O 5019 C CB . SER D 15 ? 0.7970 0.6312 0.5703 0.2092 0.0578 -0.0011 15 SER D CB 5020 O OG . SER D 15 ? 0.9099 0.7983 0.7082 0.2410 0.0728 0.0115 15 SER D OG 5021 N N . GLN D 16 ? 0.7465 0.5685 0.5407 0.1175 0.0453 -0.0043 16 GLN D N 5022 C CA . GLN D 16 ? 0.8328 0.6134 0.5992 0.0930 0.0306 -0.0116 16 GLN D CA 5023 C C . GLN D 16 ? 0.8053 0.6227 0.5905 0.0827 0.0416 -0.0101 16 GLN D C 5024 O O . GLN D 16 ? 0.8095 0.6811 0.6288 0.0927 0.0588 -0.0021 16 GLN D O 5025 C CB . GLN D 16 ? 0.8722 0.6407 0.6492 0.0580 0.0166 -0.0051 16 GLN D CB 5026 C CG . GLN D 16 ? 0.9664 0.7088 0.7344 0.0651 0.0069 -0.0022 16 GLN D CG 5027 C CD . GLN D 16 ? 1.0744 0.7379 0.7840 0.0789 -0.0157 -0.0111 16 GLN D CD 5028 O OE1 . GLN D 16 ? 1.0856 0.7144 0.7570 0.0966 -0.0213 -0.0231 16 GLN D OE1 5029 N NE2 . GLN D 16 ? 1.1407 0.7713 0.8398 0.0721 -0.0319 -0.0054 16 GLN D NE2 5030 N N . SER D 17 ? 0.8001 0.5886 0.5647 0.0602 0.0291 -0.0148 17 SER D N 5031 C CA . SER D 17 ? 0.7834 0.5941 0.5537 0.0536 0.0361 -0.0158 17 SER D CA 5032 C C . SER D 17 ? 0.7011 0.5525 0.5136 0.0216 0.0386 -0.0074 17 SER D C 5033 O O . SER D 17 ? 0.8242 0.6794 0.6512 0.0024 0.0318 -0.0022 17 SER D O 5034 C CB . SER D 17 ? 0.8305 0.5821 0.5474 0.0524 0.0179 -0.0270 17 SER D CB 5035 O OG . SER D 17 ? 0.8534 0.6273 0.5744 0.0478 0.0248 -0.0279 17 SER D OG 5036 N N . LEU D 18 ? 0.4865 0.3697 0.3157 0.0193 0.0479 -0.0059 18 LEU D N 5037 C CA . LEU D 18 ? 0.4178 0.3377 0.2820 -0.0037 0.0490 -0.0005 18 LEU D CA 5038 C C . LEU D 18 ? 0.4966 0.4103 0.3456 -0.0150 0.0452 -0.0037 18 LEU D C 5039 O O . LEU D 18 ? 0.5909 0.4983 0.4217 0.0002 0.0503 -0.0071 18 LEU D O 5040 C CB . LEU D 18 ? 0.3420 0.3092 0.2496 0.0038 0.0602 0.0075 18 LEU D CB 5041 C CG . LEU D 18 ? 0.3060 0.3045 0.2419 -0.0100 0.0596 0.0107 18 LEU D CG 5042 C CD1 . LEU D 18 ? 0.2958 0.2996 0.2396 -0.0272 0.0503 0.0078 18 LEU D CD1 5043 C CD2 . LEU D 18 ? 0.3173 0.3509 0.2916 -0.0026 0.0639 0.0220 18 LEU D CD2 5044 N N . SER D 19 ? 0.4291 0.3503 0.2851 -0.0396 0.0366 -0.0011 19 SER D N 5045 C CA . SER D 19 ? 0.4569 0.3766 0.3022 -0.0535 0.0309 -0.0018 19 SER D CA 5046 C C . SER D 19 ? 0.3881 0.3546 0.2681 -0.0661 0.0336 0.0032 19 SER D C 5047 O O . SER D 19 ? 0.4702 0.4571 0.3661 -0.0736 0.0311 0.0077 19 SER D O 5048 C CB . SER D 19 ? 0.4297 0.3071 0.2406 -0.0715 0.0111 -0.0004 19 SER D CB 5049 O OG . SER D 19 ? 0.5235 0.3460 0.2941 -0.0553 0.0030 -0.0084 19 SER D OG 5050 N N . ILE D 20 ? 0.3789 0.3625 0.2673 -0.0650 0.0377 0.0021 20 ILE D N 5051 C CA . ILE D 20 ? 0.3777 0.3997 0.2930 -0.0720 0.0374 0.0045 20 ILE D CA 5052 C C . ILE D 20 ? 0.4635 0.4857 0.3667 -0.0829 0.0329 0.0050 20 ILE D C 5053 O O . ILE D 20 ? 0.4280 0.4292 0.3118 -0.0776 0.0346 0.0022 20 ILE D O 5054 C CB . ILE D 20 ? 0.3925 0.4359 0.3376 -0.0587 0.0430 0.0048 20 ILE D CB 5055 C CG1 . ILE D 20 ? 0.2601 0.3012 0.2169 -0.0485 0.0452 0.0058 20 ILE D CG1 5056 C CG2 . ILE D 20 ? 0.2417 0.3142 0.2076 -0.0610 0.0368 0.0038 20 ILE D CG2 5057 C CD1 . ILE D 20 ? 0.2923 0.3506 0.2796 -0.0400 0.0449 0.0110 20 ILE D CD1 5058 N N . THR D 21 ? 0.4422 0.4925 0.3556 -0.0955 0.0271 0.0095 21 THR D N 5059 C CA . THR D 21 ? 0.4092 0.4670 0.3156 -0.1076 0.0212 0.0125 21 THR D CA 5060 C C . THR D 21 ? 0.3947 0.4887 0.3261 -0.0994 0.0243 0.0108 21 THR D C 5061 O O . THR D 21 ? 0.3964 0.5208 0.3464 -0.0922 0.0240 0.0106 21 THR D O 5062 C CB . THR D 21 ? 0.3743 0.4430 0.2741 -0.1299 0.0095 0.0243 21 THR D CB 5063 O OG1 . THR D 21 ? 0.3824 0.4026 0.2526 -0.1405 -0.0012 0.0261 21 THR D OG1 5064 C CG2 . THR D 21 ? 0.3691 0.4595 0.2705 -0.1424 0.0029 0.0302 21 THR D CG2 5065 N N . CYS D 22 ? 0.3646 0.4527 0.2923 -0.0978 0.0251 0.0092 22 CYS D N 5066 C CA . CYS D 22 ? 0.2911 0.4052 0.2388 -0.0912 0.0238 0.0086 22 CYS D CA 5067 C C . CYS D 22 ? 0.3597 0.4892 0.3001 -0.1039 0.0174 0.0129 22 CYS D C 5068 O O . CYS D 22 ? 0.4344 0.5417 0.3537 -0.1128 0.0152 0.0139 22 CYS D O 5069 C CB . CYS D 22 ? 0.2463 0.3483 0.2001 -0.0815 0.0282 0.0090 22 CYS D CB 5070 S SG . CYS D 22 ? 0.3563 0.4784 0.3355 -0.0744 0.0202 0.0109 22 CYS D SG 5071 N N . THR D 23 ? 0.3778 0.5470 0.3334 -0.1019 0.0134 0.0154 23 THR D N 5072 C CA . THR D 23 ? 0.4279 0.6247 0.3826 -0.1132 0.0070 0.0232 23 THR D CA 5073 C C . THR D 23 ? 0.4508 0.6660 0.4192 -0.0982 0.0047 0.0185 23 THR D C 5074 O O . THR D 23 ? 0.3814 0.6169 0.3637 -0.0785 0.0028 0.0128 23 THR D O 5075 C CB . THR D 23 ? 0.3452 0.5867 0.3073 -0.1202 0.0043 0.0348 23 THR D CB 5076 O OG1 . THR D 23 ? 0.3920 0.6105 0.3409 -0.1379 0.0020 0.0421 23 THR D OG1 5077 C CG2 . THR D 23 ? 0.2449 0.5259 0.2118 -0.1324 -0.0029 0.0476 23 THR D CG2 5078 N N . VAL D 24 ? 0.2400 0.4448 0.2011 -0.1056 0.0018 0.0204 24 VAL D N 5079 C CA . VAL D 24 ? 0.3961 0.6096 0.3684 -0.0929 -0.0025 0.0175 24 VAL D CA 5080 C C . VAL D 24 ? 0.3950 0.6492 0.3716 -0.0957 -0.0090 0.0236 24 VAL D C 5081 O O . VAL D 24 ? 0.4269 0.6966 0.3964 -0.1147 -0.0111 0.0337 24 VAL D O 5082 C CB . VAL D 24 ? 0.2426 0.4237 0.2058 -0.0964 -0.0006 0.0184 24 VAL D CB 5083 C CG1 . VAL D 24 ? 0.2445 0.3973 0.2048 -0.0927 0.0075 0.0169 24 VAL D CG1 5084 C CG2 . VAL D 24 ? 0.2622 0.4354 0.2030 -0.1132 -0.0025 0.0229 24 VAL D CG2 5085 N N . SER D 25 ? 0.3857 0.6565 0.3740 -0.0766 -0.0153 0.0192 25 SER D N 5086 C CA . SER D 25 ? 0.3844 0.6970 0.3778 -0.0736 -0.0215 0.0248 25 SER D CA 5087 C C . SER D 25 ? 0.3541 0.6546 0.3527 -0.0559 -0.0312 0.0183 25 SER D C 5088 O O . SER D 25 ? 0.2599 0.5289 0.2623 -0.0429 -0.0364 0.0104 25 SER D O 5089 C CB . SER D 25 ? 0.3609 0.7314 0.3631 -0.0597 -0.0206 0.0285 25 SER D CB 5090 O OG . SER D 25 ? 0.4399 0.8098 0.4451 -0.0273 -0.0244 0.0144 25 SER D OG 5091 N N . GLY D 26 ? 0.2365 0.5610 0.2362 -0.0578 -0.0368 0.0242 26 GLY D N 5092 C CA . GLY D 26 ? 0.2450 0.5549 0.2477 -0.0446 -0.0482 0.0209 26 GLY D CA 5093 C C . GLY D 26 ? 0.2511 0.5242 0.2465 -0.0633 -0.0474 0.0270 26 GLY D C 5094 O O . GLY D 26 ? 0.2910 0.5522 0.2900 -0.0562 -0.0580 0.0285 26 GLY D O 5095 N N . PHE D 27 ? 0.2519 0.5068 0.2343 -0.0841 -0.0367 0.0309 27 PHE D N 5096 C CA . PHE D 27 ? 0.3104 0.5373 0.2786 -0.0965 -0.0339 0.0365 27 PHE D CA 5097 C C . PHE D 27 ? 0.3353 0.5475 0.2805 -0.1136 -0.0262 0.0367 27 PHE D C 5098 O O . PHE D 27 ? 0.4354 0.6487 0.3805 -0.1167 -0.0221 0.0338 27 PHE D O 5099 C CB . PHE D 27 ? 0.2754 0.4757 0.2515 -0.0891 -0.0331 0.0390 27 PHE D CB 5100 C CG . PHE D 27 ? 0.3225 0.5071 0.2993 -0.0885 -0.0235 0.0360 27 PHE D CG 5101 C CD1 . PHE D 27 ? 0.2950 0.4824 0.2869 -0.0769 -0.0277 0.0288 27 PHE D CD1 5102 C CD2 . PHE D 27 ? 0.2923 0.4595 0.2514 -0.0958 -0.0115 0.0395 27 PHE D CD2 5103 C CE1 . PHE D 27 ? 0.3326 0.5063 0.3259 -0.0769 -0.0198 0.0268 27 PHE D CE1 5104 C CE2 . PHE D 27 ? 0.2730 0.4284 0.2333 -0.0930 -0.0030 0.0373 27 PHE D CE2 5105 C CZ . PHE D 27 ? 0.2829 0.4418 0.2623 -0.0857 -0.0071 0.0318 27 PHE D CZ 5106 N N . SER D 28 ? 0.3251 0.5199 0.2473 -0.1231 -0.0270 0.0400 28 SER D N 5107 C CA . SER D 28 ? 0.4155 0.5839 0.3065 -0.1356 -0.0265 0.0374 28 SER D CA 5108 C C . SER D 28 ? 0.4876 0.6256 0.3626 -0.1254 -0.0148 0.0338 28 SER D C 5109 O O . SER D 28 ? 0.5123 0.6519 0.3928 -0.1146 -0.0084 0.0391 28 SER D O 5110 C CB . SER D 28 ? 0.3969 0.5581 0.2629 -0.1475 -0.0379 0.0403 28 SER D CB 5111 O OG . SER D 28 ? 0.3868 0.5103 0.2156 -0.1575 -0.0444 0.0355 28 SER D OG 5112 N N . LEU D 29 ? 0.4596 0.5737 0.3159 -0.1287 -0.0131 0.0278 29 LEU D N 5113 C CA . LEU D 29 ? 0.4874 0.5761 0.3242 -0.1149 -0.0019 0.0242 29 LEU D CA 5114 C C . LEU D 29 ? 0.5317 0.6034 0.3319 -0.1059 -0.0011 0.0239 29 LEU D C 5115 O O . LEU D 29 ? 0.5252 0.5934 0.3139 -0.0880 0.0115 0.0258 29 LEU D O 5116 C CB . LEU D 29 ? 0.5036 0.5642 0.3217 -0.1189 -0.0044 0.0166 29 LEU D CB 5117 C CG . LEU D 29 ? 0.3477 0.4259 0.1979 -0.1215 -0.0005 0.0175 29 LEU D CG 5118 C CD1 . LEU D 29 ? 0.3715 0.4187 0.2001 -0.1270 -0.0050 0.0125 29 LEU D CD1 5119 C CD2 . LEU D 29 ? 0.3205 0.4135 0.1973 -0.1055 0.0126 0.0204 29 LEU D CD2 5120 N N . THR D 30 ? 0.6282 0.6945 0.4095 -0.1162 -0.0146 0.0233 30 THR D N 5121 C CA . THR D 30 ? 0.6289 0.6794 0.3703 -0.1053 -0.0160 0.0219 30 THR D CA 5122 C C . THR D 30 ? 0.5108 0.5949 0.2728 -0.0945 -0.0040 0.0356 30 THR D C 5123 O O . THR D 30 ? 0.5466 0.6275 0.2769 -0.0803 0.0000 0.0380 30 THR D O 5124 C CB . THR D 30 ? 0.6744 0.7082 0.3912 -0.1224 -0.0381 0.0185 30 THR D CB 5125 O OG1 . THR D 30 ? 0.5497 0.6226 0.3075 -0.1371 -0.0425 0.0285 30 THR D OG1 5126 C CG2 . THR D 30 ? 0.6754 0.6711 0.3694 -0.1374 -0.0563 0.0103 30 THR D CG2 5127 N N . ASN D 31 ? 0.3949 0.5094 0.2061 -0.0997 -0.0011 0.0455 31 ASN D N 5128 C CA . ASN D 31 ? 0.4713 0.6122 0.3050 -0.0946 0.0028 0.0621 31 ASN D CA 5129 C C . ASN D 31 ? 0.5228 0.6798 0.3908 -0.0880 0.0122 0.0747 31 ASN D C 5130 O O . ASN D 31 ? 0.5488 0.7266 0.4354 -0.0861 0.0129 0.0941 31 ASN D O 5131 C CB . ASN D 31 ? 0.3634 0.5199 0.2222 -0.1057 -0.0111 0.0652 31 ASN D CB 5132 C CG . ASN D 31 ? 0.4931 0.6420 0.3238 -0.1148 -0.0226 0.0588 31 ASN D CG 5133 O OD1 . ASN D 31 ? 0.6301 0.7618 0.4199 -0.1106 -0.0224 0.0562 31 ASN D OD1 5134 N ND2 . ASN D 31 ? 0.4623 0.6260 0.3128 -0.1253 -0.0344 0.0569 31 ASN D ND2 5135 N N . TYR D 32 ? 0.5774 0.7260 0.4558 -0.0868 0.0165 0.0671 32 TYR D N 5136 C CA . TYR D 32 ? 0.4311 0.5930 0.3425 -0.0825 0.0219 0.0796 32 TYR D CA 5137 C C . TYR D 32 ? 0.3804 0.5313 0.2775 -0.0733 0.0340 0.0722 32 TYR D C 5138 O O . TYR D 32 ? 0.4310 0.5587 0.3075 -0.0757 0.0321 0.0544 32 TYR D O 5139 C CB . TYR D 32 ? 0.3703 0.5333 0.3195 -0.0893 0.0080 0.0777 32 TYR D CB 5140 C CG . TYR D 32 ? 0.3886 0.5598 0.3554 -0.0936 -0.0072 0.0865 32 TYR D CG 5141 C CD1 . TYR D 32 ? 0.2970 0.4686 0.2539 -0.0969 -0.0157 0.0760 32 TYR D CD1 5142 C CD2 . TYR D 32 ? 0.2946 0.4736 0.2895 -0.0952 -0.0161 0.1080 32 TYR D CD2 5143 C CE1 . TYR D 32 ? 0.4208 0.5988 0.3920 -0.0974 -0.0307 0.0832 32 TYR D CE1 5144 C CE2 . TYR D 32 ? 0.2996 0.4786 0.3082 -0.0986 -0.0344 0.1162 32 TYR D CE2 5145 C CZ . TYR D 32 ? 0.4672 0.6447 0.4623 -0.0975 -0.0407 0.1020 32 TYR D CZ 5146 O OH . TYR D 32 ? 0.4314 0.6079 0.4384 -0.0975 -0.0597 0.1093 32 TYR D OH 5147 N N . GLY D 33 ? 0.4148 0.5854 0.3245 -0.0636 0.0448 0.0891 33 GLY D N 5148 C CA . GLY D 33 ? 0.4036 0.5683 0.3072 -0.0531 0.0554 0.0841 33 GLY D CA 5149 C C . GLY D 33 ? 0.3900 0.5501 0.3299 -0.0621 0.0479 0.0813 33 GLY D C 5150 O O . GLY D 33 ? 0.5342 0.7021 0.5089 -0.0718 0.0353 0.0900 33 GLY D O 5151 N N . VAL D 34 ? 0.3310 0.3068 0.2656 -0.0826 -0.0487 0.0363 34 VAL D N 5152 C CA . VAL D 34 ? 0.3604 0.3507 0.3115 -0.0766 -0.0407 0.0370 34 VAL D CA 5153 C C . VAL D 34 ? 0.3828 0.3411 0.3243 -0.0780 -0.0298 0.0402 34 VAL D C 5154 O O . VAL D 34 ? 0.2680 0.2069 0.2007 -0.0890 -0.0250 0.0402 34 VAL D O 5155 C CB . VAL D 34 ? 0.3524 0.3761 0.3189 -0.0897 -0.0361 0.0345 34 VAL D CB 5156 C CG1 . VAL D 34 ? 0.2600 0.2875 0.2323 -0.0878 -0.0271 0.0367 34 VAL D CG1 5157 C CG2 . VAL D 34 ? 0.3127 0.3827 0.2991 -0.0864 -0.0461 0.0240 34 VAL D CG2 5158 N N . HIS D 35 ? 0.4372 0.3917 0.3822 -0.0657 -0.0272 0.0400 35 HIS D N 5159 C CA . HIS D 35 ? 0.4083 0.3416 0.3505 -0.0646 -0.0184 0.0381 35 HIS D CA 5160 C C . HIS D 35 ? 0.3793 0.3232 0.3333 -0.0617 -0.0154 0.0400 35 HIS D C 5161 O O . HIS D 35 ? 0.3436 0.3103 0.3047 -0.0633 -0.0169 0.0428 35 HIS D O 5162 C CB . HIS D 35 ? 0.3779 0.2969 0.3111 -0.0572 -0.0166 0.0347 35 HIS D CB 5163 C CG . HIS D 35 ? 0.3726 0.2686 0.2804 -0.0632 -0.0207 0.0341 35 HIS D CG 5164 N ND1 . HIS D 35 ? 0.3395 0.2083 0.2273 -0.0732 -0.0118 0.0276 35 HIS D ND1 5165 C CD2 . HIS D 35 ? 0.3038 0.1989 0.1996 -0.0619 -0.0338 0.0376 35 HIS D CD2 5166 C CE1 . HIS D 35 ? 0.4284 0.2735 0.2856 -0.0803 -0.0185 0.0299 35 HIS D CE1 5167 N NE2 . HIS D 35 ? 0.4330 0.2922 0.2948 -0.0712 -0.0341 0.0365 35 HIS D NE2 5168 N N . TRP D 36 ? 0.3755 0.3034 0.3303 -0.0582 -0.0116 0.0360 36 TRP D N 5169 C CA . TRP D 36 ? 0.3498 0.2786 0.3085 -0.0535 -0.0128 0.0380 36 TRP D CA 5170 C C . TRP D 36 ? 0.4624 0.3884 0.4298 -0.0422 -0.0102 0.0294 36 TRP D C 5171 O O . TRP D 36 ? 0.3710 0.2865 0.3416 -0.0413 -0.0075 0.0186 36 TRP D O 5172 C CB . TRP D 36 ? 0.3178 0.2248 0.2650 -0.0607 -0.0173 0.0404 36 TRP D CB 5173 C CG . TRP D 36 ? 0.3450 0.2572 0.2814 -0.0771 -0.0177 0.0477 36 TRP D CG 5174 C CD1 . TRP D 36 ? 0.4098 0.3222 0.3427 -0.0874 -0.0173 0.0468 36 TRP D CD1 5175 C CD2 . TRP D 36 ? 0.2942 0.2153 0.2206 -0.0888 -0.0172 0.0542 36 TRP D CD2 5176 N NE1 . TRP D 36 ? 0.4080 0.3325 0.3335 -0.1040 -0.0169 0.0511 36 TRP D NE1 5177 C CE2 . TRP D 36 ? 0.3416 0.2721 0.2622 -0.1069 -0.0153 0.0550 36 TRP D CE2 5178 C CE3 . TRP D 36 ? 0.3269 0.2496 0.2461 -0.0886 -0.0170 0.0578 36 TRP D CE3 5179 C CZ2 . TRP D 36 ? 0.3061 0.2508 0.2159 -0.1272 -0.0111 0.0571 36 TRP D CZ2 5180 C CZ3 . TRP D 36 ? 0.4104 0.3426 0.3142 -0.1092 -0.0127 0.0615 36 TRP D CZ3 5181 C CH2 . TRP D 36 ? 0.3805 0.3253 0.2807 -0.1294 -0.0087 0.0601 36 TRP D CH2 5182 N N . VAL D 37 ? 0.5529 0.4923 0.5255 -0.0352 -0.0098 0.0312 37 VAL D N 5183 C CA . VAL D 37 ? 0.4258 0.3672 0.4073 -0.0259 -0.0075 0.0223 37 VAL D CA 5184 C C . VAL D 37 ? 0.4800 0.4220 0.4603 -0.0204 -0.0140 0.0258 37 VAL D C 5185 O O . VAL D 37 ? 0.5362 0.4816 0.5063 -0.0264 -0.0160 0.0359 37 VAL D O 5186 C CB . VAL D 37 ? 0.3606 0.3107 0.3423 -0.0233 -0.0020 0.0207 37 VAL D CB 5187 C CG1 . VAL D 37 ? 0.3574 0.3092 0.3464 -0.0185 0.0028 0.0091 37 VAL D CG1 5188 C CG2 . VAL D 37 ? 0.3815 0.3199 0.3511 -0.0299 -0.0001 0.0208 37 VAL D CG2 5189 N N . ARG D 38 ? 0.4542 0.3935 0.4431 -0.0109 -0.0176 0.0153 38 ARG D N 5190 C CA . ARG D 38 ? 0.4224 0.3578 0.4053 -0.0039 -0.0271 0.0181 38 ARG D CA 5191 C C . ARG D 38 ? 0.3602 0.3131 0.3580 0.0046 -0.0240 0.0066 38 ARG D C 5192 O O . ARG D 38 ? 0.3020 0.2652 0.3146 0.0045 -0.0154 -0.0069 38 ARG D O 5193 C CB . ARG D 38 ? 0.3282 0.2367 0.3023 0.0031 -0.0429 0.0155 38 ARG D CB 5194 C CG . ARG D 38 ? 0.3222 0.2361 0.3200 0.0178 -0.0483 -0.0065 38 ARG D CG 5195 C CD . ARG D 38 ? 0.2911 0.1734 0.2784 0.0303 -0.0697 -0.0101 38 ARG D CD 5196 N NE . ARG D 38 ? 0.3393 0.2354 0.3569 0.0489 -0.0782 -0.0374 38 ARG D NE 5197 C CZ . ARG D 38 ? 0.4434 0.3154 0.4601 0.0675 -0.1011 -0.0484 38 ARG D CZ 5198 N NH1 . ARG D 38 ? 0.4346 0.2571 0.4124 0.0671 -0.1175 -0.0306 38 ARG D NH1 5199 N NH2 . ARG D 38 ? 0.5407 0.4372 0.5940 0.0859 -0.1084 -0.0797 38 ARG D NH2 5200 N N . GLN D 39 ? 0.3226 0.2771 0.3120 0.0082 -0.0298 0.0113 39 GLN D N 5201 C CA . GLN D 39 ? 0.2903 0.2619 0.2912 0.0148 -0.0274 0.0011 39 GLN D CA 5202 C C . GLN D 39 ? 0.2329 0.1942 0.2249 0.0246 -0.0447 -0.0002 39 GLN D C 5203 O O . GLN D 39 ? 0.3631 0.3120 0.3296 0.0197 -0.0502 0.0133 39 GLN D O 5204 C CB . GLN D 39 ? 0.3175 0.3030 0.3144 0.0090 -0.0164 0.0076 39 GLN D CB 5205 C CG . GLN D 39 ? 0.4085 0.4079 0.4168 0.0123 -0.0089 -0.0047 39 GLN D CG 5206 C CD . GLN D 39 ? 0.4703 0.4769 0.4739 0.0096 0.0002 -0.0002 39 GLN D CD 5207 O OE1 . GLN D 39 ? 0.4480 0.4586 0.4450 0.0068 0.0003 0.0095 39 GLN D OE1 5208 N NE2 . GLN D 39 ? 0.4753 0.4838 0.4822 0.0101 0.0074 -0.0102 39 GLN D NE2 5209 N N . SER D 40 ? 0.3118 0.2784 0.3228 0.0375 -0.0541 -0.0186 40 SER D N 5210 C CA . SER D 40 ? 0.3856 0.3396 0.3893 0.0525 -0.0772 -0.0236 40 SER D CA 5211 C C . SER D 40 ? 0.4162 0.3988 0.4391 0.0593 -0.0769 -0.0400 40 SER D C 5212 O O . SER D 40 ? 0.3134 0.3239 0.3591 0.0524 -0.0584 -0.0526 40 SER D O 5213 C CB . SER D 40 ? 0.4034 0.3445 0.4191 0.0676 -0.0941 -0.0379 40 SER D CB 5214 O OG . SER D 40 ? 0.3343 0.3115 0.3919 0.0730 -0.0859 -0.0665 40 SER D OG 5215 N N . PRO D 41 ? 0.5389 0.5109 0.5476 0.0708 -0.0980 -0.0404 41 PRO D N 5216 C CA . PRO D 41 ? 0.4284 0.4310 0.4578 0.0776 -0.0996 -0.0592 41 PRO D CA 5217 C C . PRO D 41 ? 0.4070 0.4439 0.4819 0.0879 -0.1000 -0.0923 41 PRO D C 5218 O O . PRO D 41 ? 0.4116 0.4834 0.5100 0.0836 -0.0887 -0.1111 41 PRO D O 5219 C CB . PRO D 41 ? 0.4571 0.4321 0.4545 0.0894 -0.1283 -0.0516 41 PRO D CB 5220 C CG . PRO D 41 ? 0.5464 0.4765 0.4964 0.0774 -0.1306 -0.0227 41 PRO D CG 5221 C CD . PRO D 41 ? 0.5874 0.5142 0.5517 0.0738 -0.1204 -0.0219 41 PRO D CD 5222 N N . GLY D 42 ? 0.4988 0.5285 0.5871 0.0992 -0.1110 -0.1029 42 GLY D N 5223 C CA . GLY D 42 ? 0.5539 0.6231 0.6895 0.1089 -0.1115 -0.1406 42 GLY D CA 5224 C C . GLY D 42 ? 0.4479 0.5425 0.6046 0.0873 -0.0791 -0.1527 42 GLY D C 5225 O O . GLY D 42 ? 0.3855 0.5207 0.5709 0.0783 -0.0640 -0.1798 42 GLY D O 5226 N N . LYS D 43 ? 0.3762 0.4449 0.5142 0.0762 -0.0681 -0.1335 43 LYS D N 5227 C CA . LYS D 43 ? 0.3665 0.4491 0.5149 0.0555 -0.0411 -0.1435 43 LYS D CA 5228 C C . LYS D 43 ? 0.3313 0.3972 0.4506 0.0339 -0.0201 -0.1185 43 LYS D C 5229 O O . LYS D 43 ? 0.3358 0.4005 0.4511 0.0159 -0.0007 -0.1218 43 LYS D O 5230 C CB . LYS D 43 ? 0.4903 0.5583 0.6420 0.0596 -0.0454 -0.1464 43 LYS D CB 5231 C CG . LYS D 43 ? 0.5243 0.6195 0.7161 0.0783 -0.0592 -0.1846 43 LYS D CG 5232 C CD . LYS D 43 ? 0.7165 0.8007 0.9122 0.0765 -0.0557 -0.1913 43 LYS D CD 5233 C CE . LYS D 43 ? 0.7830 0.9047 1.0193 0.0871 -0.0654 -0.2277 43 LYS D CE 5234 N NZ . LYS D 43 ? 0.7400 0.8521 0.9783 0.0835 -0.0611 -0.2323 43 LYS D NZ 5235 N N . GLY D 44 ? 0.1916 0.2436 0.2886 0.0356 -0.0246 -0.0958 44 GLY D N 5236 C CA . GLY D 44 ? 0.2206 0.2603 0.2953 0.0202 -0.0079 -0.0775 44 GLY D CA 5237 C C . GLY D 44 ? 0.3226 0.3395 0.3802 0.0138 -0.0045 -0.0590 44 GLY D C 5238 O O . GLY D 44 ? 0.3491 0.3522 0.4012 0.0208 -0.0170 -0.0489 44 GLY D O 5239 N N . LEU D 45 ? 0.2612 0.2698 0.3060 -0.0001 0.0107 -0.0547 45 LEU D N 5240 C CA . LEU D 45 ? 0.2190 0.2085 0.2478 -0.0061 0.0126 -0.0393 45 LEU D CA 5241 C C . LEU D 45 ? 0.1921 0.1798 0.2282 -0.0121 0.0159 -0.0517 45 LEU D C 5242 O O . LEU D 45 ? 0.1962 0.1943 0.2415 -0.0216 0.0268 -0.0733 45 LEU D O 5243 C CB . LEU D 45 ? 0.2442 0.2193 0.2522 -0.0152 0.0221 -0.0319 45 LEU D CB 5244 C CG . LEU D 45 ? 0.2460 0.2220 0.2467 -0.0074 0.0179 -0.0186 45 LEU D CG 5245 C CD1 . LEU D 45 ? 0.2047 0.1621 0.1858 -0.0123 0.0244 -0.0189 45 LEU D CD1 5246 C CD2 . LEU D 45 ? 0.1856 0.1621 0.1836 -0.0034 0.0100 -0.0027 45 LEU D CD2 5247 N N . GLU D 46 ? 0.3224 0.2979 0.3531 -0.0095 0.0081 -0.0400 46 GLU D N 5248 C CA . GLU D 46 ? 0.3204 0.2941 0.3602 -0.0118 0.0084 -0.0529 46 GLU D CA 5249 C C . GLU D 46 ? 0.3639 0.3179 0.3851 -0.0190 0.0076 -0.0361 46 GLU D C 5250 O O . GLU D 46 ? 0.3219 0.2669 0.3345 -0.0143 -0.0026 -0.0188 46 GLU D O 5251 C CB . GLU D 46 ? 0.3118 0.2908 0.3703 0.0059 -0.0079 -0.0635 46 GLU D CB 5252 C CG . GLU D 46 ? 0.4295 0.4217 0.5123 0.0085 -0.0067 -0.0926 46 GLU D CG 5253 C CD . GLU D 46 ? 0.4867 0.4845 0.5902 0.0326 -0.0284 -0.1076 46 GLU D CD 5254 O OE1 . GLU D 46 ? 0.4556 0.4392 0.5459 0.0442 -0.0445 -0.0913 46 GLU D OE1 5255 O OE2 . GLU D 46 ? 0.5239 0.5393 0.6553 0.0402 -0.0306 -0.1377 46 GLU D OE2 5256 N N . TRP D 47 ? 0.3112 0.2584 0.3233 -0.0335 0.0188 -0.0425 47 TRP D N 5257 C CA . TRP D 47 ? 0.3312 0.2614 0.3259 -0.0411 0.0171 -0.0295 47 TRP D CA 5258 C C . TRP D 47 ? 0.3897 0.3160 0.3946 -0.0366 0.0103 -0.0362 47 TRP D C 5259 O O . TRP D 47 ? 0.4343 0.3689 0.4559 -0.0359 0.0144 -0.0592 47 TRP D O 5260 C CB . TRP D 47 ? 0.3201 0.2371 0.2929 -0.0593 0.0293 -0.0339 47 TRP D CB 5261 C CG . TRP D 47 ? 0.3696 0.2695 0.3225 -0.0670 0.0254 -0.0215 47 TRP D CG 5262 C CD1 . TRP D 47 ? 0.3846 0.2767 0.3219 -0.0648 0.0166 -0.0027 47 TRP D CD1 5263 C CD2 . TRP D 47 ? 0.3604 0.2530 0.3095 -0.0774 0.0293 -0.0303 47 TRP D CD2 5264 N NE1 . TRP D 47 ? 0.2887 0.1696 0.2123 -0.0736 0.0138 0.0016 47 TRP D NE1 5265 C CE2 . TRP D 47 ? 0.3342 0.2126 0.2624 -0.0824 0.0222 -0.0139 47 TRP D CE2 5266 C CE3 . TRP D 47 ? 0.3484 0.2487 0.3126 -0.0821 0.0376 -0.0537 47 TRP D CE3 5267 C CZ2 . TRP D 47 ? 0.2903 0.1580 0.2078 -0.0939 0.0238 -0.0174 47 TRP D CZ2 5268 C CZ3 . TRP D 47 ? 0.3235 0.2131 0.2781 -0.0928 0.0401 -0.0584 47 TRP D CZ3 5269 C CH2 . TRP D 47 ? 0.3849 0.2563 0.3142 -0.0996 0.0336 -0.0389 47 TRP D CH2 5270 N N . LEU D 48 ? 0.3481 0.2620 0.3429 -0.0345 0.0002 -0.0188 48 LEU D N 5271 C CA . LEU D 48 ? 0.3678 0.2667 0.3639 -0.0300 -0.0092 -0.0222 48 LEU D CA 5272 C C . LEU D 48 ? 0.3640 0.2511 0.3487 -0.0434 -0.0044 -0.0224 48 LEU D C 5273 O O . LEU D 48 ? 0.4455 0.3279 0.4387 -0.0427 -0.0032 -0.0402 48 LEU D O 5274 C CB . LEU D 48 ? 0.3186 0.2034 0.3016 -0.0250 -0.0225 -0.0043 48 LEU D CB 5275 C CG . LEU D 48 ? 0.3321 0.2224 0.3208 -0.0116 -0.0303 -0.0045 48 LEU D CG 5276 C CD1 . LEU D 48 ? 0.2811 0.1509 0.2449 -0.0139 -0.0413 0.0140 48 LEU D CD1 5277 C CD2 . LEU D 48 ? 0.3252 0.2167 0.3343 0.0049 -0.0385 -0.0276 48 LEU D CD2 5278 N N . GLY D 49 ? 0.3383 0.2233 0.3059 -0.0546 -0.0027 -0.0057 49 GLY D N 5279 C CA . GLY D 49 ? 0.2741 0.1480 0.2288 -0.0677 -0.0004 -0.0054 49 GLY D CA 5280 C C . GLY D 49 ? 0.4600 0.3386 0.3997 -0.0765 -0.0018 0.0102 49 GLY D C 5281 O O . GLY D 49 ? 0.4510 0.3423 0.3922 -0.0711 -0.0037 0.0183 49 GLY D O 5282 N N . VAL D 50 ? 0.2854 0.1553 0.2123 -0.0884 -0.0026 0.0118 50 VAL D N 5283 C CA . VAL D 50 ? 0.3675 0.2445 0.2822 -0.0950 -0.0076 0.0222 50 VAL D CA 5284 C C . VAL D 50 ? 0.3991 0.2689 0.3043 -0.1080 -0.0104 0.0232 50 VAL D C 5285 O O . VAL D 50 ? 0.3170 0.1696 0.2175 -0.1143 -0.0057 0.0136 50 VAL D O 5286 C CB . VAL D 50 ? 0.4348 0.3031 0.3323 -0.0976 -0.0054 0.0198 50 VAL D CB 5287 C CG1 . VAL D 50 ? 0.3319 0.1813 0.2158 -0.1107 0.0050 0.0062 50 VAL D CG1 5288 C CG2 . VAL D 50 ? 0.4522 0.3242 0.3360 -0.0987 -0.0175 0.0289 50 VAL D CG2 5289 N N . ILE D 51 ? 0.3187 0.2052 0.2236 -0.1125 -0.0176 0.0316 51 ILE D N 5290 C CA . ILE D 51 ? 0.3406 0.2260 0.2351 -0.1274 -0.0211 0.0317 51 ILE D CA 5291 C C . ILE D 51 ? 0.3915 0.2910 0.2794 -0.1265 -0.0305 0.0334 51 ILE D C 5292 O O . ILE D 51 ? 0.3111 0.2337 0.2104 -0.1154 -0.0375 0.0361 51 ILE D O 5293 C CB . ILE D 51 ? 0.4278 0.3221 0.3259 -0.1374 -0.0221 0.0358 51 ILE D CB 5294 C CG1 . ILE D 51 ? 0.4675 0.3610 0.3542 -0.1560 -0.0245 0.0337 51 ILE D CG1 5295 C CG2 . ILE D 51 ? 0.3936 0.3224 0.3066 -0.1329 -0.0247 0.0398 51 ILE D CG2 5296 C CD1 . ILE D 51 ? 0.3587 0.2487 0.2390 -0.1707 -0.0222 0.0354 51 ILE D CD1 5297 N N . TRP D 52 ? 0.2594 0.2230 0.3223 -0.0392 -0.0247 0.0627 52 TRP D N 5298 C CA . TRP D 52 ? 0.2411 0.2257 0.3335 -0.0493 -0.0398 0.0791 52 TRP D CA 5299 C C . TRP D 52 ? 0.2667 0.2590 0.3612 -0.0633 -0.0462 0.0820 52 TRP D C 5300 O O . TRP D 52 ? 0.4394 0.4198 0.5107 -0.0672 -0.0375 0.0705 52 TRP D O 5301 C CB . TRP D 52 ? 0.2512 0.2398 0.3232 -0.0586 -0.0436 0.0914 52 TRP D CB 5302 C CG . TRP D 52 ? 0.2420 0.2317 0.3212 -0.0473 -0.0388 0.0905 52 TRP D CG 5303 C CD1 . TRP D 52 ? 0.4547 0.4354 0.5045 -0.0405 -0.0254 0.0797 52 TRP D CD1 5304 C CD2 . TRP D 52 ? 0.3066 0.3079 0.4290 -0.0419 -0.0477 0.1002 52 TRP D CD2 5305 N NE1 . TRP D 52 ? 0.2789 0.2701 0.3502 -0.0326 -0.0254 0.0827 52 TRP D NE1 5306 C CE2 . TRP D 52 ? 0.3130 0.3145 0.4266 -0.0347 -0.0389 0.0951 52 TRP D CE2 5307 C CE3 . TRP D 52 ? 0.2158 0.2267 0.3876 -0.0421 -0.0625 0.1118 52 TRP D CE3 5308 C CZ2 . TRP D 52 ? 0.2687 0.2788 0.4163 -0.0311 -0.0444 0.1017 52 TRP D CZ2 5309 C CZ3 . TRP D 52 ? 0.3123 0.3262 0.5192 -0.0366 -0.0680 0.1176 52 TRP D CZ3 5310 C CH2 . TRP D 52 ? 0.3121 0.3253 0.5043 -0.0328 -0.0589 0.1127 52 TRP D CH2 5311 N N . SER D 53 ? 0.2447 0.2584 0.3691 -0.0724 -0.0635 0.0999 53 SER D N 5312 C CA . SER D 53 ? 0.2741 0.3039 0.4110 -0.0857 -0.0730 0.1050 53 SER D CA 5313 C C . SER D 53 ? 0.3219 0.3393 0.4021 -0.1042 -0.0673 0.0998 53 SER D C 5314 O O . SER D 53 ? 0.2908 0.3060 0.3631 -0.1112 -0.0621 0.0898 53 SER D O 5315 C CB . SER D 53 ? 0.3571 0.4117 0.5347 -0.0924 -0.0966 0.1302 53 SER D CB 5316 O OG . SER D 53 ? 0.5127 0.5733 0.7485 -0.0749 -0.1023 0.1333 53 SER D OG 5317 N N . GLY D 54 ? 0.3573 0.3666 0.3972 -0.1142 -0.0669 0.1045 54 GLY D N 5318 C CA . GLY D 54 ? 0.3318 0.3265 0.3175 -0.1327 -0.0603 0.0956 54 GLY D CA 5319 C C . GLY D 54 ? 0.4423 0.4009 0.3923 -0.1239 -0.0399 0.0731 54 GLY D C 5320 O O . GLY D 54 ? 0.4916 0.4309 0.3978 -0.1381 -0.0330 0.0626 54 GLY D O 5321 N N . GLY D 55 ? 0.4174 0.3650 0.3848 -0.1020 -0.0311 0.0657 55 GLY D N 5322 C CA . GLY D 55 ? 0.3362 0.2496 0.2740 -0.0928 -0.0158 0.0497 55 GLY D CA 5323 C C . GLY D 55 ? 0.4747 0.3723 0.3968 -0.0767 -0.0059 0.0429 55 GLY D C 5324 O O . GLY D 55 ? 0.4997 0.3689 0.4043 -0.0652 0.0041 0.0324 55 GLY D O 5325 N N . ASN D 56 ? 0.5052 0.4221 0.4347 -0.0767 -0.0093 0.0501 56 ASN D N 5326 C CA . ASN D 56 ? 0.5391 0.4503 0.4612 -0.0616 0.0009 0.0429 56 ASN D CA 5327 C C . ASN D 56 ? 0.4902 0.4010 0.4400 -0.0396 0.0024 0.0420 56 ASN D C 5328 O O . ASN D 56 ? 0.5063 0.4280 0.4853 -0.0375 -0.0048 0.0476 56 ASN D O 5329 C CB . ASN D 56 ? 0.6322 0.5709 0.5583 -0.0710 -0.0033 0.0532 56 ASN D CB 5330 C CG . ASN D 56 ? 0.6624 0.6009 0.5480 -0.0924 0.0010 0.0476 56 ASN D CG 5331 O OD1 . ASN D 56 ? 0.6657 0.5777 0.5198 -0.0935 0.0125 0.0294 56 ASN D OD1 5332 N ND2 . ASN D 56 ? 0.7823 0.7495 0.6677 -0.1112 -0.0088 0.0633 56 ASN D ND2 5333 N N . THR D 57 ? 0.4906 0.3913 0.4325 -0.0235 0.0119 0.0331 57 THR D N 5334 C CA . THR D 57 ? 0.3787 0.2813 0.3420 -0.0044 0.0122 0.0321 57 THR D CA 5335 C C . THR D 57 ? 0.3413 0.2620 0.3170 0.0062 0.0160 0.0312 57 THR D C 5336 O O . THR D 57 ? 0.4687 0.3884 0.4274 0.0064 0.0250 0.0239 57 THR D O 5337 C CB . THR D 57 ? 0.4235 0.2944 0.3670 0.0063 0.0172 0.0243 57 THR D CB 5338 O OG1 . THR D 57 ? 0.5504 0.3980 0.4676 0.0098 0.0263 0.0143 57 THR D OG1 5339 C CG2 . THR D 57 ? 0.3222 0.1804 0.2571 -0.0063 0.0139 0.0262 57 THR D CG2 5340 N N . ASP D 58 ? 0.3563 0.2958 0.3628 0.0135 0.0106 0.0363 58 ASP D N 5341 C CA . ASP D 58 ? 0.2557 0.2140 0.2777 0.0243 0.0137 0.0348 58 ASP D CA 5342 C C . ASP D 58 ? 0.2923 0.2486 0.3270 0.0399 0.0113 0.0311 58 ASP D C 5343 O O . ASP D 58 ? 0.3686 0.3237 0.4141 0.0374 0.0053 0.0325 58 ASP D O 5344 C CB . ASP D 58 ? 0.2657 0.2514 0.3131 0.0131 0.0073 0.0462 58 ASP D CB 5345 C CG . ASP D 58 ? 0.3564 0.3506 0.3870 -0.0051 0.0085 0.0531 58 ASP D CG 5346 O OD1 . ASP D 58 ? 0.4112 0.3973 0.4121 -0.0061 0.0192 0.0431 58 ASP D OD1 5347 O OD2 . ASP D 58 ? 0.3419 0.3502 0.3892 -0.0193 -0.0019 0.0686 58 ASP D OD2 5348 N N . TYR D 59 ? 0.3157 0.2749 0.3501 0.0554 0.0160 0.0257 59 TYR D N 5349 C CA . TYR D 59 ? 0.2846 0.2469 0.3294 0.0690 0.0110 0.0248 59 TYR D CA 5350 C C . TYR D 59 ? 0.3585 0.3542 0.4303 0.0755 0.0107 0.0245 59 TYR D C 5351 O O . TYR D 59 ? 0.3697 0.3801 0.4454 0.0768 0.0185 0.0218 59 TYR D O 5352 C CB . TYR D 59 ? 0.3296 0.2640 0.3535 0.0833 0.0126 0.0220 59 TYR D CB 5353 C CG . TYR D 59 ? 0.4240 0.3229 0.4185 0.0742 0.0140 0.0222 59 TYR D CG 5354 C CD1 . TYR D 59 ? 0.4119 0.3091 0.4032 0.0595 0.0098 0.0257 59 TYR D CD1 5355 C CD2 . TYR D 59 ? 0.4508 0.3194 0.4239 0.0796 0.0204 0.0169 59 TYR D CD2 5356 C CE1 . TYR D 59 ? 0.4420 0.3119 0.4083 0.0486 0.0113 0.0259 59 TYR D CE1 5357 C CE2 . TYR D 59 ? 0.5346 0.3699 0.4802 0.0680 0.0213 0.0170 59 TYR D CE2 5358 C CZ . TYR D 59 ? 0.5286 0.3667 0.4705 0.0516 0.0164 0.0226 59 TYR D CZ 5359 O OH . TYR D 59 ? 0.4661 0.2761 0.3826 0.0377 0.0175 0.0227 59 TYR D OH 5360 N N . ASN D 60 ? 0.3512 0.3619 0.4411 0.0768 0.0027 0.0256 60 ASN D N 5361 C CA . ASN D 60 ? 0.2120 0.2557 0.3278 0.0819 0.0010 0.0249 60 ASN D CA 5362 C C . ASN D 60 ? 0.3107 0.3584 0.4257 0.1018 0.0037 0.0221 60 ASN D C 5363 O O . ASN D 60 ? 0.2613 0.2850 0.3596 0.1131 0.0003 0.0232 60 ASN D O 5364 C CB . ASN D 60 ? 0.1992 0.2560 0.3308 0.0776 -0.0086 0.0238 60 ASN D CB 5365 C CG . ASN D 60 ? 0.2653 0.3571 0.4271 0.0738 -0.0109 0.0234 60 ASN D CG 5366 O OD1 . ASN D 60 ? 0.2402 0.3521 0.4117 0.0783 -0.0054 0.0244 60 ASN D OD1 5367 N ND2 . ASN D 60 ? 0.1770 0.2776 0.3548 0.0638 -0.0177 0.0197 60 ASN D ND2 5368 N N . THR D 61 ? 0.2716 0.3505 0.4074 0.1057 0.0097 0.0192 61 THR D N 5369 C CA . THR D 61 ? 0.2454 0.3317 0.3887 0.1264 0.0158 0.0130 61 THR D CA 5370 C C . THR D 61 ? 0.3628 0.4409 0.5097 0.1460 0.0039 0.0170 61 THR D C 5371 O O . THR D 61 ? 0.2865 0.3390 0.4248 0.1630 0.0061 0.0148 61 THR D O 5372 C CB . THR D 61 ? 0.3041 0.4383 0.4772 0.1248 0.0235 0.0086 61 THR D CB 5373 O OG1 . THR D 61 ? 0.2967 0.4363 0.4606 0.1034 0.0331 0.0088 61 THR D OG1 5374 C CG2 . THR D 61 ? 0.2573 0.4045 0.4461 0.1481 0.0327 -0.0020 61 THR D CG2 5375 N N . PRO D 62 ? 0.4110 0.5077 0.5689 0.1436 -0.0100 0.0233 62 PRO D N 5376 C CA . PRO D 62 ? 0.3720 0.4639 0.5300 0.1602 -0.0241 0.0310 62 PRO D CA 5377 C C . PRO D 62 ? 0.4058 0.4509 0.5275 0.1584 -0.0298 0.0382 62 PRO D C 5378 O O . PRO D 62 ? 0.4495 0.4881 0.5644 0.1662 -0.0443 0.0491 62 PRO D O 5379 C CB . PRO D 62 ? 0.3882 0.5179 0.5633 0.1506 -0.0366 0.0338 62 PRO D CB 5380 C CG . PRO D 62 ? 0.4013 0.5317 0.5726 0.1270 -0.0302 0.0281 62 PRO D CG 5381 C CD . PRO D 62 ? 0.4143 0.5386 0.5869 0.1251 -0.0144 0.0235 62 PRO D CD 5382 N N . PHE D 63 ? 0.3585 0.3731 0.4561 0.1459 -0.0199 0.0342 63 PHE D N 5383 C CA . PHE D 63 ? 0.3564 0.3291 0.4198 0.1406 -0.0234 0.0403 63 PHE D CA 5384 C C . PHE D 63 ? 0.4770 0.4115 0.5219 0.1425 -0.0122 0.0356 63 PHE D C 5385 O O . PHE D 63 ? 0.5715 0.4698 0.5875 0.1351 -0.0140 0.0405 63 PHE D O 5386 C CB . PHE D 63 ? 0.3713 0.3467 0.4220 0.1176 -0.0243 0.0391 63 PHE D CB 5387 C CG . PHE D 63 ? 0.4783 0.4879 0.5434 0.1115 -0.0337 0.0388 63 PHE D CG 5388 C CD1 . PHE D 63 ? 0.4346 0.4437 0.4825 0.1091 -0.0459 0.0464 63 PHE D CD1 5389 C CD2 . PHE D 63 ? 0.5100 0.5517 0.6032 0.1051 -0.0309 0.0313 63 PHE D CD2 5390 C CE1 . PHE D 63 ? 0.3970 0.4398 0.4547 0.1002 -0.0541 0.0432 63 PHE D CE1 5391 C CE2 . PHE D 63 ? 0.3812 0.4519 0.4873 0.0972 -0.0391 0.0280 63 PHE D CE2 5392 C CZ . PHE D 63 ? 0.3291 0.4016 0.4169 0.0947 -0.0503 0.0323 63 PHE D CZ 5393 N N . THR D 64 ? 0.4609 0.4042 0.5197 0.1495 0.0001 0.0251 64 THR D N 5394 C CA . THR D 64 ? 0.5174 0.4278 0.5555 0.1462 0.0122 0.0165 64 THR D CA 5395 C C . THR D 64 ? 0.5868 0.4503 0.6092 0.1601 0.0085 0.0194 64 THR D C 5396 O O . THR D 64 ? 0.7120 0.5368 0.7059 0.1496 0.0128 0.0173 64 THR D O 5397 C CB . THR D 64 ? 0.5151 0.4500 0.5700 0.1501 0.0271 0.0023 64 THR D CB 5398 O OG1 . THR D 64 ? 0.5927 0.5513 0.6800 0.1737 0.0264 -0.0009 64 THR D OG1 5399 C CG2 . THR D 64 ? 0.3112 0.2822 0.3739 0.1298 0.0300 0.0035 64 THR D CG2 5400 N N . SER D 65 ? 0.5768 0.4427 0.6191 0.1827 -0.0013 0.0259 65 SER D N 5401 C CA . SER D 65 ? 0.6021 0.4203 0.6371 0.1995 -0.0068 0.0308 65 SER D CA 5402 C C . SER D 65 ? 0.6654 0.4542 0.6727 0.1899 -0.0239 0.0522 65 SER D C 5403 O O . SER D 65 ? 0.7507 0.5077 0.7576 0.1952 -0.0327 0.0614 65 SER D O 5404 C CB . SER D 65 ? 0.6671 0.5093 0.7473 0.2215 -0.0113 0.0281 65 SER D CB 5405 O OG . SER D 65 ? 0.8076 0.6702 0.9095 0.2300 0.0079 0.0051 65 SER D OG 5406 N N . ARG D 66 ? 0.6142 0.4223 0.6046 0.1672 -0.0277 0.0585 66 ARG D N 5407 C CA . ARG D 66 ? 0.6384 0.4231 0.5980 0.1535 -0.0404 0.0761 66 ARG D CA 5408 C C . ARG D 66 ? 0.5368 0.3315 0.4742 0.1245 -0.0341 0.0721 66 ARG D C 5409 O O . ARG D 66 ? 0.4797 0.2692 0.3933 0.1092 -0.0421 0.0836 66 ARG D O 5410 C CB . ARG D 66 ? 0.6353 0.4440 0.6053 0.1623 -0.0599 0.0933 66 ARG D CB 5411 C CG . ARG D 66 ? 0.5520 0.4180 0.5394 0.1542 -0.0611 0.0875 66 ARG D CG 5412 C CD . ARG D 66 ? 0.5937 0.4853 0.5953 0.1657 -0.0815 0.1032 66 ARG D CD 5413 N NE . ARG D 66 ? 0.5383 0.4809 0.5501 0.1528 -0.0845 0.0975 66 ARG D NE 5414 C CZ . ARG D 66 ? 0.5227 0.4789 0.5108 0.1335 -0.0951 0.1051 66 ARG D CZ 5415 N NH1 . ARG D 66 ? 0.5107 0.4360 0.4614 0.1234 -0.1040 0.1218 66 ARG D NH1 5416 N NH2 . ARG D 66 ? 0.5076 0.5084 0.5079 0.1218 -0.0961 0.0950 66 ARG D NH2 5417 N N . LEU D 67 ? 0.4149 0.2254 0.3606 0.1157 -0.0205 0.0568 67 LEU D N 5418 C CA . LEU D 67 ? 0.4968 0.3197 0.4325 0.0918 -0.0154 0.0524 67 LEU D CA 5419 C C . LEU D 67 ? 0.5282 0.3246 0.4480 0.0803 -0.0051 0.0455 67 LEU D C 5420 O O . LEU D 67 ? 0.6184 0.4077 0.5442 0.0881 0.0024 0.0369 67 LEU D O 5421 C CB . LEU D 67 ? 0.4663 0.3353 0.4315 0.0894 -0.0129 0.0440 67 LEU D CB 5422 C CG . LEU D 67 ? 0.4453 0.3312 0.4121 0.0691 -0.0099 0.0387 67 LEU D CG 5423 C CD1 . LEU D 67 ? 0.5700 0.4536 0.5163 0.0585 -0.0155 0.0438 67 LEU D CD1 5424 C CD2 . LEU D 67 ? 0.4362 0.3600 0.4363 0.0692 -0.0096 0.0317 67 LEU D CD2 5425 N N . SER D 68 ? 0.4034 0.1896 0.3026 0.0598 -0.0042 0.0479 68 SER D N 5426 C CA . SER D 68 ? 0.4975 0.2645 0.3823 0.0447 0.0036 0.0421 68 SER D CA 5427 C C . SER D 68 ? 0.5322 0.3241 0.4211 0.0240 0.0056 0.0398 68 SER D C 5428 O O . SER D 68 ? 0.5762 0.3754 0.4574 0.0150 0.0029 0.0440 68 SER D O 5429 C CB . SER D 68 ? 0.6026 0.3179 0.4559 0.0411 0.0025 0.0480 68 SER D CB 5430 O OG . SER D 68 ? 0.7889 0.4974 0.6207 0.0201 0.0003 0.0560 68 SER D OG 5431 N N . ILE D 69 ? 0.3638 0.1711 0.2661 0.0159 0.0100 0.0331 69 ILE D N 5432 C CA . ILE D 69 ? 0.3406 0.1737 0.2576 -0.0005 0.0111 0.0302 69 ILE D CA 5433 C C . ILE D 69 ? 0.4953 0.3148 0.3985 -0.0171 0.0138 0.0291 69 ILE D C 5434 O O . ILE D 69 ? 0.4280 0.2418 0.3288 -0.0163 0.0147 0.0272 69 ILE D O 5435 C CB . ILE D 69 ? 0.3277 0.1979 0.2834 0.0049 0.0093 0.0266 69 ILE D CB 5436 C CG1 . ILE D 69 ? 0.2907 0.1747 0.2590 0.0192 0.0064 0.0260 69 ILE D CG1 5437 C CG2 . ILE D 69 ? 0.2820 0.1770 0.2611 -0.0083 0.0098 0.0223 69 ILE D CG2 5438 C CD1 . ILE D 69 ? 0.2578 0.1728 0.2641 0.0228 0.0042 0.0226 69 ILE D CD1 5439 N N . ASN D 70 ? 0.5540 0.3723 0.4473 -0.0346 0.0154 0.0296 70 ASN D N 5440 C CA . ASN D 70 ? 0.4947 0.3077 0.3787 -0.0543 0.0168 0.0285 70 ASN D CA 5441 C C . ASN D 70 ? 0.4844 0.3357 0.3959 -0.0674 0.0177 0.0254 70 ASN D C 5442 O O . ASN D 70 ? 0.5458 0.4208 0.4773 -0.0623 0.0195 0.0215 70 ASN D O 5443 C CB . ASN D 70 ? 0.6113 0.3792 0.4539 -0.0655 0.0189 0.0316 70 ASN D CB 5444 C CG . ASN D 70 ? 0.7505 0.4787 0.5738 -0.0473 0.0183 0.0332 70 ASN D CG 5445 O OD1 . ASN D 70 ? 0.7662 0.4840 0.5849 -0.0349 0.0154 0.0396 70 ASN D OD1 5446 N ND2 . ASN D 70 ? 0.7595 0.4684 0.5734 -0.0461 0.0207 0.0264 70 ASN D ND2 5447 N N . LYS D 71 ? 0.4621 0.3219 0.3769 -0.0850 0.0167 0.0251 71 LYS D N 5448 C CA . LYS D 71 ? 0.3694 0.2701 0.3190 -0.0958 0.0176 0.0208 71 LYS D CA 5449 C C . LYS D 71 ? 0.3598 0.2590 0.2953 -0.1209 0.0181 0.0217 71 LYS D C 5450 O O . LYS D 71 ? 0.4049 0.2686 0.3028 -0.1307 0.0173 0.0249 71 LYS D O 5451 C CB . LYS D 71 ? 0.3397 0.2745 0.3382 -0.0851 0.0102 0.0212 71 LYS D CB 5452 C CG . LYS D 71 ? 0.3038 0.2375 0.3010 -0.0909 0.0007 0.0295 71 LYS D CG 5453 C CD . LYS D 71 ? 0.3264 0.2935 0.3744 -0.0823 -0.0095 0.0350 71 LYS D CD 5454 C CE . LYS D 71 ? 0.3415 0.3091 0.3818 -0.0899 -0.0207 0.0469 71 LYS D CE 5455 N NZ . LYS D 71 ? 0.3449 0.3437 0.4364 -0.0845 -0.0344 0.0579 71 LYS D NZ 5456 N N . ASP D 72 ? 0.3450 0.2850 0.3146 -0.1318 0.0203 0.0166 72 ASP D N 5457 C CA . ASP D 72 ? 0.4569 0.4102 0.4256 -0.1571 0.0200 0.0168 72 ASP D CA 5458 C C . ASP D 72 ? 0.5155 0.5239 0.5479 -0.1544 0.0142 0.0140 72 ASP D C 5459 O O . ASP D 72 ? 0.3763 0.4199 0.4452 -0.1522 0.0219 0.0035 72 ASP D O 5460 C CB . ASP D 72 ? 0.5054 0.4528 0.4478 -0.1769 0.0314 0.0134 72 ASP D CB 5461 C CG . ASP D 72 ? 0.5985 0.5586 0.5370 -0.2067 0.0317 0.0138 72 ASP D CG 5462 O OD1 . ASP D 72 ? 0.5952 0.6033 0.5806 -0.2112 0.0275 0.0105 72 ASP D OD1 5463 O OD2 . ASP D 72 ? 0.7077 0.6293 0.5985 -0.2263 0.0349 0.0182 72 ASP D OD2 5464 N N . ASN D 73 ? 0.6927 0.5913 0.5666 -0.1016 -0.0221 -0.0410 73 ASN D N 5465 C CA . ASN D 73 ? 0.6022 0.5355 0.4896 -0.1022 -0.0193 -0.0341 73 ASN D CA 5466 C C . ASN D 73 ? 0.6486 0.5980 0.5372 -0.1152 -0.0222 -0.0268 73 ASN D C 5467 O O . ASN D 73 ? 0.6168 0.5911 0.5190 -0.1116 -0.0201 -0.0193 73 ASN D O 5468 C CB . ASN D 73 ? 0.5342 0.4792 0.4170 -0.1029 -0.0184 -0.0387 73 ASN D CB 5469 C CG . ASN D 73 ? 0.5450 0.4865 0.4305 -0.0889 -0.0148 -0.0439 73 ASN D CG 5470 O OD1 . ASN D 73 ? 0.5485 0.4946 0.4460 -0.0783 -0.0116 -0.0400 73 ASN D OD1 5471 N ND2 . ASN D 73 ? 0.4491 0.3841 0.3226 -0.0892 -0.0155 -0.0527 73 ASN D ND2 5472 N N . SER D 74 ? 0.7636 0.6995 0.6368 -0.1303 -0.0273 -0.0290 74 SER D N 5473 C CA . SER D 74 ? 0.6764 0.6326 0.5495 -0.1448 -0.0304 -0.0218 74 SER D CA 5474 C C . SER D 74 ? 0.5514 0.5118 0.4351 -0.1419 -0.0301 -0.0149 74 SER D C 5475 O O . SER D 74 ? 0.4481 0.4391 0.3413 -0.1442 -0.0297 -0.0074 74 SER D O 5476 C CB . SER D 74 ? 0.7346 0.6727 0.5859 -0.1642 -0.0369 -0.0253 74 SER D CB 5477 O OG . SER D 74 ? 0.8046 0.7019 0.6430 -0.1642 -0.0402 -0.0304 74 SER D OG 5478 N N . LYS D 75 ? 0.5276 0.4594 0.4095 -0.1357 -0.0303 -0.0174 75 LYS D N 5479 C CA . LYS D 75 ? 0.4553 0.3898 0.3469 -0.1329 -0.0300 -0.0113 75 LYS D CA 5480 C C . LYS D 75 ? 0.3960 0.3428 0.3058 -0.1149 -0.0242 -0.0088 75 LYS D C 5481 O O . LYS D 75 ? 0.3713 0.3237 0.2901 -0.1115 -0.0236 -0.0039 75 LYS D O 5482 C CB . LYS D 75 ? 0.4753 0.3730 0.3553 -0.1359 -0.0335 -0.0143 75 LYS D CB 5483 C CG . LYS D 75 ? 0.5628 0.4447 0.4227 -0.1564 -0.0409 -0.0145 75 LYS D CG 5484 C CD . LYS D 75 ? 0.7472 0.5926 0.5962 -0.1582 -0.0451 -0.0154 75 LYS D CD 5485 C CE . LYS D 75 ? 0.9080 0.7213 0.7512 -0.1423 -0.0434 -0.0244 75 LYS D CE 5486 N NZ . LYS D 75 ? 0.9205 0.6963 0.7509 -0.1427 -0.0481 -0.0254 75 LYS D NZ 5487 N N . SER D 76 ? 0.3943 0.3452 0.3084 -0.1045 -0.0205 -0.0119 76 SER D N 5488 C CA . SER D 76 ? 0.3548 0.3144 0.2831 -0.0894 -0.0160 -0.0093 76 SER D CA 5489 C C . SER D 76 ? 0.3915 0.3300 0.3225 -0.0817 -0.0148 -0.0104 76 SER D C 5490 O O . SER D 76 ? 0.2875 0.2328 0.2295 -0.0742 -0.0127 -0.0060 76 SER D O 5491 C CB . SER D 76 ? 0.2865 0.2749 0.2256 -0.0873 -0.0154 -0.0017 76 SER D CB 5492 O OG . SER D 76 ? 0.4609 0.4719 0.3989 -0.0910 -0.0159 -0.0002 76 SER D OG 5493 N N . GLN D 77 ? 0.4362 0.3486 0.3562 -0.0829 -0.0164 -0.0167 77 GLN D N 5494 C CA . GLN D 77 ? 0.4749 0.3668 0.3954 -0.0759 -0.0158 -0.0179 77 GLN D CA 5495 C C . GLN D 77 ? 0.4550 0.3333 0.3711 -0.0654 -0.0137 -0.0251 77 GLN D C 5496 O O . GLN D 77 ? 0.5154 0.3833 0.4189 -0.0678 -0.0155 -0.0317 77 GLN D O 5497 C CB . GLN D 77 ? 0.5951 0.4664 0.5043 -0.0864 -0.0209 -0.0179 77 GLN D CB 5498 C CG . GLN D 77 ? 0.6274 0.5169 0.5409 -0.0977 -0.0232 -0.0104 77 GLN D CG 5499 C CD . GLN D 77 ? 0.6057 0.4763 0.5108 -0.1069 -0.0279 -0.0083 77 GLN D CD 5500 O OE1 . GLN D 77 ? 0.7056 0.5881 0.6193 -0.1086 -0.0279 -0.0022 77 GLN D OE1 5501 N NE2 . GLN D 77 ? 0.5319 0.3720 0.4187 -0.1129 -0.0324 -0.0136 77 GLN D NE2 5502 N N . VAL D 78 ? 0.3883 0.2687 0.3139 -0.0540 -0.0100 -0.0238 78 VAL D N 5503 C CA . VAL D 78 ? 0.4521 0.3246 0.3746 -0.0429 -0.0078 -0.0298 78 VAL D CA 5504 C C . VAL D 78 ? 0.4863 0.3382 0.4057 -0.0374 -0.0086 -0.0310 78 VAL D C 5505 O O . VAL D 78 ? 0.5501 0.4042 0.4783 -0.0378 -0.0081 -0.0251 78 VAL D O 5506 C CB . VAL D 78 ? 0.3695 0.2633 0.3039 -0.0354 -0.0033 -0.0266 78 VAL D CB 5507 C CG1 . VAL D 78 ? 0.3085 0.1996 0.2398 -0.0247 -0.0010 -0.0322 78 VAL D CG1 5508 C CG2 . VAL D 78 ? 0.2967 0.2094 0.2329 -0.0405 -0.0031 -0.0247 78 VAL D CG2 5509 N N . PHE D 79 ? 0.4755 0.3077 0.3819 -0.0315 -0.0102 -0.0389 79 PHE D N 5510 C CA . PHE D 79 ? 0.4897 0.2987 0.3897 -0.0254 -0.0121 -0.0407 79 PHE D CA 5511 C C . PHE D 79 ? 0.5808 0.3950 0.4835 -0.0093 -0.0083 -0.0445 79 PHE D C 5512 O O . PHE D 79 ? 0.6332 0.4511 0.5295 -0.0024 -0.0073 -0.0514 79 PHE D O 5513 C CB . PHE D 79 ? 0.4823 0.2597 0.3611 -0.0306 -0.0184 -0.0467 79 PHE D CB 5514 C CG . PHE D 79 ? 0.4655 0.2421 0.3397 -0.0486 -0.0224 -0.0432 79 PHE D CG 5515 C CD1 . PHE D 79 ? 0.5224 0.3029 0.4033 -0.0586 -0.0240 -0.0348 79 PHE D CD1 5516 C CD2 . PHE D 79 ? 0.4205 0.1956 0.2836 -0.0558 -0.0247 -0.0481 79 PHE D CD2 5517 C CE1 . PHE D 79 ? 0.4653 0.2505 0.3419 -0.0755 -0.0278 -0.0310 79 PHE D CE1 5518 C CE2 . PHE D 79 ? 0.5613 0.3395 0.4198 -0.0734 -0.0285 -0.0443 79 PHE D CE2 5519 C CZ . PHE D 79 ? 0.4160 0.2005 0.2813 -0.0833 -0.0301 -0.0356 79 PHE D CZ 5520 N N . PHE D 80 ? 0.5467 0.3639 0.4585 -0.0038 -0.0062 -0.0399 80 PHE D N 5521 C CA . PHE D 80 ? 0.4324 0.2591 0.3480 0.0103 -0.0025 -0.0417 80 PHE D CA 5522 C C . PHE D 80 ? 0.5215 0.3237 0.4270 0.0190 -0.0052 -0.0449 80 PHE D C 5523 O O . PHE D 80 ? 0.6269 0.4138 0.5320 0.0129 -0.0080 -0.0405 80 PHE D O 5524 C CB . PHE D 80 ? 0.4329 0.2832 0.3661 0.0091 0.0017 -0.0334 80 PHE D CB 5525 C CG . PHE D 80 ? 0.4833 0.3467 0.4209 0.0208 0.0053 -0.0336 80 PHE D CG 5526 C CD1 . PHE D 80 ? 0.5417 0.3964 0.4799 0.0272 0.0053 -0.0322 80 PHE D CD1 5527 C CD2 . PHE D 80 ? 0.4015 0.2889 0.3428 0.0244 0.0086 -0.0343 80 PHE D CD2 5528 C CE1 . PHE D 80 ? 0.5230 0.3938 0.4654 0.0375 0.0086 -0.0320 80 PHE D CE1 5529 C CE2 . PHE D 80 ? 0.3002 0.2042 0.2453 0.0334 0.0117 -0.0337 80 PHE D CE2 5530 C CZ . PHE D 80 ? 0.4674 0.3638 0.4131 0.0402 0.0118 -0.0326 80 PHE D CZ 5531 N N . LYS D 81 ? 0.5528 0.3526 0.4498 0.0337 -0.0046 -0.0523 81 LYS D N 5532 C CA . LYS D 81 ? 0.5068 0.2821 0.3921 0.0450 -0.0076 -0.0559 81 LYS D CA 5533 C C . LYS D 81 ? 0.5279 0.3208 0.4141 0.0635 -0.0039 -0.0602 81 LYS D C 5534 O O . LYS D 81 ? 0.5793 0.3858 0.4614 0.0705 -0.0023 -0.0668 81 LYS D O 5535 C CB . LYS D 81 ? 0.5288 0.2672 0.3911 0.0439 -0.0145 -0.0635 81 LYS D CB 5536 C CG . LYS D 81 ? 0.6262 0.3324 0.4727 0.0555 -0.0192 -0.0669 81 LYS D CG 5537 C CD . LYS D 81 ? 0.7037 0.3671 0.5270 0.0469 -0.0278 -0.0706 81 LYS D CD 5538 C CE . LYS D 81 ? 0.8323 0.4597 0.6352 0.0617 -0.0334 -0.0756 81 LYS D CE 5539 N NZ . LYS D 81 ? 0.8681 0.4671 0.6570 0.0475 -0.0411 -0.0732 81 LYS D NZ 5540 N N . MET D 82 ? 0.5070 0.3019 0.3982 0.0710 -0.0027 -0.0563 82 MET D N 5541 C CA . MET D 82 ? 0.5129 0.3256 0.4041 0.0893 0.0004 -0.0596 82 MET D CA 5542 C C . MET D 82 ? 0.5932 0.3785 0.4728 0.1011 -0.0035 -0.0613 82 MET D C 5543 O O . MET D 82 ? 0.6911 0.4603 0.5738 0.0926 -0.0057 -0.0546 82 MET D O 5544 C CB . MET D 82 ? 0.3974 0.2478 0.3085 0.0858 0.0064 -0.0514 82 MET D CB 5545 C CG . MET D 82 ? 0.4909 0.3699 0.4034 0.1019 0.0101 -0.0538 82 MET D CG 5546 S SD . MET D 82 ? 0.4709 0.3889 0.4043 0.0926 0.0158 -0.0424 82 MET D SD 5547 C CE . MET D 82 ? 0.5450 0.4756 0.4850 0.0755 0.0169 -0.0397 82 MET D CE 5548 N N . ASN D 83 ? 0.6221 0.4028 0.4877 0.1213 -0.0047 -0.0702 83 ASN D N 5549 C CA A ASN D 83 ? 0.6533 0.4039 0.5030 0.1365 -0.0094 -0.0735 83 ASN D CA 5550 C CA B ASN D 83 ? 0.6507 0.4021 0.5023 0.1348 -0.0092 -0.0721 83 ASN D CA 5551 C C . ASN D 83 ? 0.6541 0.4345 0.5118 0.1536 -0.0050 -0.0717 83 ASN D C 5552 O O . ASN D 83 ? 0.6912 0.5137 0.5615 0.1562 0.0010 -0.0709 83 ASN D O 5553 C CB A ASN D 83 ? 0.6402 0.3599 0.4638 0.1498 -0.0152 -0.0863 83 ASN D CB 5554 C CB B ASN D 83 ? 0.6435 0.3536 0.4676 0.1443 -0.0165 -0.0833 83 ASN D CB 5555 C CG A ASN D 83 ? 0.5813 0.2722 0.3946 0.1321 -0.0200 -0.0885 83 ASN D CG 5556 C CG B ASN D 83 ? 0.6089 0.3361 0.4243 0.1629 -0.0149 -0.0944 83 ASN D CG 5557 O OD1 A ASN D 83 ? 0.5202 0.2316 0.3417 0.1216 -0.0170 -0.0890 83 ASN D OD1 5558 O OD1 B ASN D 83 ? 0.6781 0.3854 0.4768 0.1705 -0.0201 -0.1004 83 ASN D OD1 5559 N ND2 A ASN D 83 ? 0.5652 0.2208 0.3660 0.1241 -0.0272 -0.0864 83 ASN D ND2 5560 N ND2 B ASN D 83 ? 0.5085 0.2819 0.3400 0.1642 -0.0078 -0.0933 83 ASN D ND2 5561 N N . SER D 84 ? 0.7442 0.5015 0.5923 0.1652 -0.0087 -0.0712 84 SER D N 5562 C CA . SER D 84 ? 0.8461 0.6283 0.6988 0.1833 -0.0054 -0.0697 84 SER D CA 5563 C C . SER D 84 ? 0.7889 0.6161 0.6673 0.1715 0.0020 -0.0595 84 SER D C 5564 O O . SER D 84 ? 0.8920 0.7609 0.7786 0.1796 0.0072 -0.0598 84 SER D O 5565 C CB . SER D 84 ? 0.8890 0.6907 0.7322 0.2034 -0.0049 -0.0789 84 SER D CB 5566 O OG . SER D 84 ? 0.9019 0.7237 0.7467 0.2188 -0.0039 -0.0765 84 SER D OG 5567 N N . LEU D 85 ? 0.6651 0.4833 0.5548 0.1515 0.0018 -0.0504 85 LEU D N 5568 C CA . LEU D 85 ? 0.5757 0.4290 0.4870 0.1395 0.0076 -0.0409 85 LEU D CA 5569 C C . LEU D 85 ? 0.5132 0.3836 0.4291 0.1512 0.0097 -0.0366 85 LEU D C 5570 O O . LEU D 85 ? 0.6302 0.4759 0.5359 0.1619 0.0057 -0.0371 85 LEU D O 5571 C CB . LEU D 85 ? 0.5484 0.3868 0.4688 0.1175 0.0064 -0.0334 85 LEU D CB 5572 C CG . LEU D 85 ? 0.6022 0.4543 0.5310 0.1020 0.0086 -0.0325 85 LEU D CG 5573 C CD1 . LEU D 85 ? 0.5442 0.3723 0.4586 0.1017 0.0046 -0.0405 85 LEU D CD1 5574 C CD2 . LEU D 85 ? 0.6852 0.5374 0.6272 0.0832 0.0092 -0.0237 85 LEU D CD2 5575 N N . GLN D 86 ? 0.4473 0.3603 0.3778 0.1481 0.0156 -0.0317 86 GLN D N 5576 C CA . GLN D 86 ? 0.4821 0.4193 0.4194 0.1558 0.0184 -0.0263 86 GLN D CA 5577 C C . GLN D 86 ? 0.4916 0.4440 0.4463 0.1359 0.0215 -0.0159 86 GLN D C 5578 O O . GLN D 86 ? 0.5321 0.4756 0.4927 0.1184 0.0212 -0.0133 86 GLN D O 5579 C CB . GLN D 86 ? 0.3558 0.3345 0.2921 0.1714 0.0222 -0.0299 86 GLN D CB 5580 C CG . GLN D 86 ? 0.6317 0.6003 0.5505 0.1914 0.0195 -0.0417 86 GLN D CG 5581 C CD . GLN D 86 ? 0.8319 0.7646 0.7336 0.2116 0.0140 -0.0468 86 GLN D CD 5582 O OE1 . GLN D 86 ? 0.8879 0.8058 0.7916 0.2109 0.0124 -0.0408 86 GLN D OE1 5583 N NE2 . GLN D 86 ? 0.8802 0.7983 0.7641 0.2283 0.0105 -0.0576 86 GLN D NE2 5584 N N . SER D 87 ? 0.4361 0.4082 0.3970 0.1403 0.0237 -0.0104 87 SER D N 5585 C CA . SER D 87 ? 0.3918 0.3717 0.3664 0.1234 0.0256 -0.0012 87 SER D CA 5586 C C . SER D 87 ? 0.4303 0.4337 0.4144 0.1068 0.0289 0.0020 87 SER D C 5587 O O . SER D 87 ? 0.4191 0.4135 0.4106 0.0902 0.0287 0.0068 87 SER D O 5588 C CB . SER D 87 ? 0.3136 0.3154 0.2923 0.1319 0.0278 0.0036 87 SER D CB 5589 O OG . SER D 87 ? 0.4409 0.4523 0.4320 0.1154 0.0297 0.0119 87 SER D OG 5590 N N . ASN D 88 ? 0.4626 0.4963 0.4453 0.1112 0.0315 -0.0003 88 ASN D N 5591 C CA . ASN D 88 ? 0.5055 0.5606 0.4946 0.0949 0.0337 0.0036 88 ASN D CA 5592 C C . ASN D 88 ? 0.4552 0.4908 0.4416 0.0868 0.0317 0.0000 88 ASN D C 5593 O O . ASN D 88 ? 0.5255 0.5743 0.5157 0.0733 0.0327 0.0034 88 ASN D O 5594 C CB . ASN D 88 ? 0.4690 0.5683 0.4575 0.1005 0.0368 0.0039 88 ASN D CB 5595 C CG . ASN D 88 ? 0.5812 0.6862 0.5604 0.1144 0.0363 -0.0047 88 ASN D CG 5596 O OD1 . ASN D 88 ? 0.5714 0.6461 0.5423 0.1253 0.0335 -0.0120 88 ASN D OD1 5597 N ND2 . ASN D 88 ? 0.8679 1.0129 0.8474 0.1132 0.0388 -0.0038 88 ASN D ND2 5598 N N . ASP D 89 ? 0.3341 0.3381 0.3126 0.0940 0.0285 -0.0063 89 ASP D N 5599 C CA . ASP D 89 ? 0.3585 0.3419 0.3353 0.0840 0.0263 -0.0087 89 ASP D CA 5600 C C . ASP D 89 ? 0.4157 0.3800 0.3994 0.0690 0.0249 -0.0031 89 ASP D C 5601 O O . ASP D 89 ? 0.3248 0.2747 0.3080 0.0600 0.0231 -0.0039 89 ASP D O 5602 C CB . ASP D 89 ? 0.3940 0.3508 0.3578 0.0954 0.0228 -0.0175 89 ASP D CB 5603 C CG . ASP D 89 ? 0.5430 0.5189 0.4990 0.1086 0.0240 -0.0247 89 ASP D CG 5604 O OD1 . ASP D 89 ? 0.5398 0.5443 0.5005 0.1022 0.0267 -0.0231 89 ASP D OD1 5605 O OD2 . ASP D 89 ? 0.6167 0.5788 0.5606 0.1257 0.0217 -0.0321 89 ASP D OD2 5606 N N . THR D 90 ? 0.4635 0.4296 0.4534 0.0670 0.0256 0.0024 90 THR D N 5607 C CA . THR D 90 ? 0.4302 0.3847 0.4273 0.0534 0.0247 0.0077 90 THR D CA 5608 C C . THR D 90 ? 0.4385 0.4062 0.4403 0.0407 0.0259 0.0110 90 THR D C 5609 O O . THR D 90 ? 0.4446 0.4363 0.4490 0.0379 0.0283 0.0144 90 THR D O 5610 C CB . THR D 90 ? 0.3938 0.3537 0.3966 0.0543 0.0257 0.0129 90 THR D CB 5611 O OG1 . THR D 90 ? 0.4990 0.4402 0.4959 0.0650 0.0233 0.0106 90 THR D OG1 5612 C CG2 . THR D 90 ? 0.3273 0.2815 0.3377 0.0406 0.0252 0.0181 90 THR D CG2 5613 N N . ALA D 91 ? 0.4344 0.3866 0.4360 0.0329 0.0238 0.0103 91 ALA D N 5614 C CA . ALA D 91 ? 0.3292 0.2894 0.3324 0.0227 0.0241 0.0128 91 ALA D CA 5615 C C . ALA D 91 ? 0.3617 0.3030 0.3654 0.0161 0.0214 0.0125 91 ALA D C 5616 O O . ALA D 91 ? 0.3238 0.2483 0.3260 0.0181 0.0194 0.0102 91 ALA D O 5617 C CB . ALA D 91 ? 0.2204 0.1958 0.2187 0.0254 0.0250 0.0099 91 ALA D CB 5618 N N . ILE D 92 ? 0.2088 0.1536 0.2134 0.0079 0.0209 0.0153 92 ILE D N 5619 C CA . ILE D 92 ? 0.3851 0.3174 0.3893 0.0030 0.0184 0.0148 92 ILE D CA 5620 C C . ILE D 92 ? 0.4278 0.3618 0.4267 0.0038 0.0179 0.0112 92 ILE D C 5621 O O . ILE D 92 ? 0.4142 0.3615 0.4110 0.0025 0.0189 0.0122 92 ILE D O 5622 C CB . ILE D 92 ? 0.3883 0.3210 0.3945 -0.0041 0.0174 0.0195 92 ILE D CB 5623 C CG1 . ILE D 92 ? 0.4427 0.3742 0.4537 -0.0048 0.0179 0.0222 92 ILE D CG1 5624 C CG2 . ILE D 92 ? 0.3138 0.2374 0.3190 -0.0068 0.0149 0.0188 92 ILE D CG2 5625 C CD1 . ILE D 92 ? 0.5093 0.4388 0.5201 -0.0103 0.0164 0.0258 92 ILE D CD1 5626 N N . TYR D 93 ? 0.3889 0.3106 0.3851 0.0048 0.0161 0.0073 93 TYR D N 5627 C CA . TYR D 93 ? 0.3339 0.2561 0.3244 0.0056 0.0155 0.0031 93 TYR D CA 5628 C C . TYR D 93 ? 0.2745 0.1937 0.2654 -0.0013 0.0135 0.0048 93 TYR D C 5629 O O . TYR D 93 ? 0.3014 0.2124 0.2946 -0.0044 0.0118 0.0061 93 TYR D O 5630 C CB . TYR D 93 ? 0.3143 0.2235 0.2984 0.0115 0.0143 -0.0030 93 TYR D CB 5631 C CG . TYR D 93 ? 0.3760 0.2895 0.3573 0.0217 0.0160 -0.0059 93 TYR D CG 5632 C CD1 . TYR D 93 ? 0.4138 0.3246 0.3982 0.0251 0.0166 -0.0034 93 TYR D CD1 5633 C CD2 . TYR D 93 ? 0.3817 0.3044 0.3569 0.0288 0.0170 -0.0111 93 TYR D CD2 5634 C CE1 . TYR D 93 ? 0.3889 0.3058 0.3704 0.0361 0.0180 -0.0058 93 TYR D CE1 5635 C CE2 . TYR D 93 ? 0.3874 0.3172 0.3593 0.0404 0.0185 -0.0140 93 TYR D CE2 5636 C CZ . TYR D 93 ? 0.3691 0.2959 0.3441 0.0443 0.0189 -0.0113 93 TYR D CZ 5637 O OH . TYR D 93 ? 0.3770 0.3130 0.3484 0.0574 0.0203 -0.0140 93 TYR D OH 5638 N N . TYR D 94 ? 0.3166 0.2448 0.3051 -0.0034 0.0135 0.0051 94 TYR D N 5639 C CA . TYR D 94 ? 0.3357 0.2632 0.3238 -0.0084 0.0115 0.0070 94 TYR D CA 5640 C C . TYR D 94 ? 0.3478 0.2766 0.3307 -0.0086 0.0108 0.0025 94 TYR D C 5641 O O . TYR D 94 ? 0.3661 0.3002 0.3453 -0.0049 0.0121 -0.0015 94 TYR D O 5642 C CB . TYR D 94 ? 0.3037 0.2384 0.2915 -0.0120 0.0111 0.0126 94 TYR D CB 5643 C CG . TYR D 94 ? 0.3327 0.2658 0.3232 -0.0131 0.0112 0.0170 94 TYR D CG 5644 C CD1 . TYR D 94 ? 0.2785 0.2199 0.2692 -0.0127 0.0132 0.0182 94 TYR D CD1 5645 C CD2 . TYR D 94 ? 0.3186 0.2437 0.3105 -0.0142 0.0093 0.0197 94 TYR D CD2 5646 C CE1 . TYR D 94 ? 0.3653 0.3055 0.3574 -0.0151 0.0132 0.0223 94 TYR D CE1 5647 C CE2 . TYR D 94 ? 0.2098 0.1322 0.2027 -0.0152 0.0091 0.0231 94 TYR D CE2 5648 C CZ . TYR D 94 ? 0.2678 0.1969 0.2607 -0.0165 0.0111 0.0245 94 TYR D CZ 5649 O OH . TYR D 94 ? 0.2693 0.1961 0.2622 -0.0189 0.0108 0.0278 94 TYR D OH 5650 N N . CYS D 95 ? 0.3339 0.2600 0.3162 -0.0125 0.0088 0.0031 95 CYS D N 5651 C CA . CYS D 95 ? 0.4222 0.3536 0.4002 -0.0146 0.0079 0.0008 95 CYS D CA 5652 C C . CYS D 95 ? 0.3926 0.3314 0.3715 -0.0174 0.0067 0.0064 95 CYS D C 5653 O O . CYS D 95 ? 0.4326 0.3684 0.4143 -0.0177 0.0055 0.0106 95 CYS D O 5654 C CB . CYS D 95 ? 0.3954 0.3191 0.3698 -0.0175 0.0060 -0.0030 95 CYS D CB 5655 S SG . CYS D 95 ? 0.4414 0.3633 0.4199 -0.0220 0.0037 0.0011 95 CYS D SG 5656 N N . ALA D 96 ? 0.2324 0.1805 0.2078 -0.0188 0.0066 0.0063 96 ALA D N 5657 C CA . ALA D 96 ? 0.2312 0.1842 0.2054 -0.0213 0.0048 0.0123 96 ALA D CA 5658 C C . ALA D 96 ? 0.2985 0.2607 0.2690 -0.0237 0.0039 0.0112 96 ALA D C 5659 O O . ALA D 96 ? 0.4148 0.3813 0.3831 -0.0235 0.0053 0.0054 96 ALA D O 5660 C CB . ALA D 96 ? 0.2570 0.2135 0.2299 -0.0226 0.0051 0.0167 96 ALA D CB 5661 N N . ARG D 97 ? 0.2879 0.2521 0.2566 -0.0251 0.0014 0.0166 97 ARG D N 5662 C CA . ARG D 97 ? 0.3149 0.2893 0.2802 -0.0275 0.0002 0.0171 97 ARG D CA 5663 C C . ARG D 97 ? 0.2690 0.2461 0.2299 -0.0298 -0.0022 0.0243 97 ARG D C 5664 O O . ARG D 97 ? 0.3954 0.3624 0.3544 -0.0289 -0.0044 0.0297 97 ARG D O 5665 C CB . ARG D 97 ? 0.2434 0.2189 0.2092 -0.0269 -0.0016 0.0173 97 ARG D CB 5666 C CG . ARG D 97 ? 0.2425 0.2303 0.2055 -0.0301 -0.0020 0.0155 97 ARG D CG 5667 C CD . ARG D 97 ? 0.2433 0.2373 0.2055 -0.0290 -0.0048 0.0200 97 ARG D CD 5668 N NE . ARG D 97 ? 0.2943 0.2885 0.2525 -0.0272 -0.0075 0.0271 97 ARG D NE 5669 C CZ . ARG D 97 ? 0.3657 0.3650 0.3212 -0.0242 -0.0105 0.0318 97 ARG D CZ 5670 N NH1 . ARG D 97 ? 0.3799 0.3890 0.3374 -0.0229 -0.0108 0.0302 97 ARG D NH1 5671 N NH2 . ARG D 97 ? 0.3459 0.3407 0.2953 -0.0227 -0.0138 0.0386 97 ARG D NH2 5672 N N . ALA D 98 ? 0.3136 0.3032 0.2713 -0.0333 -0.0022 0.0245 98 ALA D N 5673 C CA . ALA D 98 ? 0.3514 0.3444 0.3033 -0.0376 -0.0051 0.0321 98 ALA D CA 5674 C C . ALA D 98 ? 0.3977 0.3888 0.3457 -0.0368 -0.0089 0.0372 98 ALA D C 5675 O O . ALA D 98 ? 0.4445 0.4381 0.3951 -0.0336 -0.0086 0.0342 98 ALA D O 5676 C CB . ALA D 98 ? 0.2995 0.3108 0.2498 -0.0420 -0.0034 0.0305 98 ALA D CB 5677 N N . LEU D 99 ? 0.4360 0.4228 0.3764 -0.0400 -0.0130 0.0455 99 LEU D N 5678 C CA . LEU D 99 ? 0.4538 0.4377 0.3884 -0.0379 -0.0174 0.0511 99 LEU D CA 5679 C C . LEU D 99 ? 0.4285 0.4319 0.3648 -0.0400 -0.0162 0.0488 99 LEU D C 5680 O O . LEU D 99 ? 0.3384 0.3458 0.2757 -0.0358 -0.0170 0.0483 99 LEU D O 5681 C CB . LEU D 99 ? 0.4647 0.4366 0.3878 -0.0422 -0.0231 0.0608 99 LEU D CB 5682 C CG . LEU D 99 ? 0.5425 0.4889 0.4581 -0.0367 -0.0277 0.0652 99 LEU D CG 5683 C CD1 . LEU D 99 ? 0.4676 0.3995 0.3679 -0.0426 -0.0347 0.0753 99 LEU D CD1 5684 C CD2 . LEU D 99 ? 0.5547 0.4990 0.4723 -0.0254 -0.0287 0.0632 99 LEU D CD2 5685 N N . THR D 100 ? 0.4072 0.4255 0.3436 -0.0465 -0.0143 0.0474 100 THR D N 5686 C CA . THR D 100 ? 0.4542 0.4919 0.3916 -0.0490 -0.0129 0.0443 100 THR D CA 5687 C C . THR D 100 ? 0.4125 0.4593 0.3555 -0.0485 -0.0078 0.0335 100 THR D C 5688 O O . THR D 100 ? 0.4027 0.4448 0.3480 -0.0473 -0.0054 0.0299 100 THR D O 5689 C CB . THR D 100 ? 0.5140 0.5638 0.4450 -0.0564 -0.0156 0.0513 100 THR D CB 5690 O OG1 . THR D 100 ? 0.6123 0.6741 0.5445 -0.0608 -0.0127 0.0481 100 THR D OG1 5691 C CG2 . THR D 100 ? 0.4797 0.5123 0.4017 -0.0580 -0.0217 0.0625 100 THR D CG2 5692 N N . TYR D 101 ? 0.2612 0.3200 0.2048 -0.0491 -0.0065 0.0282 101 TYR D N 5693 C CA . TYR D 101 ? 0.3900 0.4512 0.3358 -0.0478 -0.0028 0.0172 101 TYR D CA 5694 C C . TYR D 101 ? 0.4451 0.5146 0.3900 -0.0478 -0.0003 0.0125 101 TYR D C 5695 O O . TYR D 101 ? 0.4290 0.4938 0.3743 -0.0440 0.0023 0.0035 101 TYR D O 5696 C CB . TYR D 101 ? 0.2614 0.3342 0.2054 -0.0504 -0.0028 0.0130 101 TYR D CB 5697 C CG . TYR D 101 ? 0.3330 0.4264 0.2737 -0.0547 -0.0028 0.0133 101 TYR D CG 5698 C CD1 . TYR D 101 ? 0.2758 0.3789 0.2143 -0.0546 -0.0001 0.0042 101 TYR D CD1 5699 C CD2 . TYR D 101 ? 0.3478 0.4512 0.2866 -0.0580 -0.0058 0.0225 101 TYR D CD2 5700 C CE1 . TYR D 101 ? 0.3516 0.4767 0.2872 -0.0582 -0.0001 0.0041 101 TYR D CE1 5701 C CE2 . TYR D 101 ? 0.3483 0.4723 0.2842 -0.0628 -0.0061 0.0234 101 TYR D CE2 5702 C CZ . TYR D 101 ? 0.4063 0.5426 0.3411 -0.0632 -0.0030 0.0141 101 TYR D CZ 5703 O OH . TYR D 101 ? 0.4024 0.5624 0.3344 -0.0678 -0.0031 0.0146 101 TYR D OH 5704 N N . TYR D 102 ? 0.4720 0.5544 0.4146 -0.0518 -0.0014 0.0187 102 TYR D N 5705 C CA . TYR D 102 ? 0.4203 0.5192 0.3619 -0.0519 0.0009 0.0147 102 TYR D CA 5706 C C . TYR D 102 ? 0.3823 0.4797 0.3242 -0.0532 0.0006 0.0204 102 TYR D C 5707 O O . TYR D 102 ? 0.3940 0.5073 0.3354 -0.0521 0.0029 0.0168 102 TYR D O 5708 C CB . TYR D 102 ? 0.3357 0.4591 0.2737 -0.0576 0.0000 0.0170 102 TYR D CB 5709 C CG . TYR D 102 ? 0.2682 0.3921 0.2031 -0.0650 -0.0046 0.0304 102 TYR D CG 5710 C CD1 . TYR D 102 ? 0.2713 0.4005 0.2030 -0.0710 -0.0067 0.0388 102 TYR D CD1 5711 C CD2 . TYR D 102 ? 0.3283 0.4467 0.2620 -0.0661 -0.0074 0.0349 102 TYR D CD2 5712 C CE1 . TYR D 102 ? 0.3035 0.4278 0.2291 -0.0784 -0.0121 0.0515 102 TYR D CE1 5713 C CE2 . TYR D 102 ? 0.3969 0.5119 0.3254 -0.0712 -0.0124 0.0472 102 TYR D CE2 5714 C CZ . TYR D 102 ? 0.3162 0.4319 0.2399 -0.0776 -0.0151 0.0555 102 TYR D CZ 5715 O OH . TYR D 102 ? 0.2942 0.4016 0.2096 -0.0835 -0.0213 0.0681 102 TYR D OH 5716 N N . ASP D 103 ? 0.2715 0.3514 0.2130 -0.0552 -0.0022 0.0288 103 ASP D N 5717 C CA . ASP D 103 ? 0.4244 0.5029 0.3635 -0.0598 -0.0038 0.0362 103 ASP D CA 5718 C C . ASP D 103 ? 0.4573 0.5232 0.4007 -0.0541 -0.0012 0.0318 103 ASP D C 5719 O O . ASP D 103 ? 0.5651 0.6238 0.5129 -0.0467 0.0017 0.0231 103 ASP D O 5720 C CB . ASP D 103 ? 0.4904 0.5538 0.4234 -0.0652 -0.0095 0.0477 103 ASP D CB 5721 C CG . ASP D 103 ? 0.4594 0.5297 0.3848 -0.0757 -0.0129 0.0575 103 ASP D CG 5722 O OD1 . ASP D 103 ? 0.3941 0.4792 0.3209 -0.0780 -0.0105 0.0557 103 ASP D OD1 5723 O OD2 . ASP D 103 ? 0.4114 0.4725 0.3284 -0.0818 -0.0186 0.0672 103 ASP D OD2 5724 N N . TYR D 104 ? 0.3740 0.4369 0.3150 -0.0586 -0.0027 0.0384 104 TYR D N 5725 C CA . TYR D 104 ? 0.2582 0.3129 0.2031 -0.0542 -0.0002 0.0354 104 TYR D CA 5726 C C . TYR D 104 ? 0.3519 0.3848 0.2937 -0.0578 -0.0037 0.0432 104 TYR D C 5727 O O . TYR D 104 ? 0.4135 0.4428 0.3569 -0.0574 -0.0025 0.0433 104 TYR D O 5728 C CB . TYR D 104 ? 0.2842 0.3633 0.2291 -0.0554 0.0024 0.0339 104 TYR D CB 5729 C CG . TYR D 104 ? 0.3281 0.4258 0.2754 -0.0476 0.0063 0.0234 104 TYR D CG 5730 C CD1 . TYR D 104 ? 0.3541 0.4689 0.2988 -0.0499 0.0058 0.0220 104 TYR D CD1 5731 C CD2 . TYR D 104 ? 0.4167 0.5140 0.3675 -0.0375 0.0100 0.0147 104 TYR D CD2 5732 C CE1 . TYR D 104 ? 0.4675 0.5975 0.4123 -0.0420 0.0090 0.0115 104 TYR D CE1 5733 C CE2 . TYR D 104 ? 0.4323 0.5426 0.3823 -0.0288 0.0127 0.0043 104 TYR D CE2 5734 C CZ . TYR D 104 ? 0.4339 0.5603 0.3806 -0.0310 0.0122 0.0024 104 TYR D CZ 5735 O OH . TYR D 104 ? 0.3749 0.5126 0.3189 -0.0217 0.0145 -0.0089 104 TYR D OH 5736 N N . GLU D 105 ? 0.3944 0.4128 0.3307 -0.0606 -0.0084 0.0496 105 GLU D N 5737 C CA . GLU D 105 ? 0.4168 0.4109 0.3477 -0.0618 -0.0125 0.0558 105 GLU D CA 5738 C C . GLU D 105 ? 0.4796 0.4581 0.4170 -0.0517 -0.0109 0.0501 105 GLU D C 5739 O O . GLU D 105 ? 0.4153 0.3885 0.3526 -0.0473 -0.0124 0.0496 105 GLU D O 5740 C CB . GLU D 105 ? 0.4347 0.4189 0.3539 -0.0681 -0.0191 0.0654 105 GLU D CB 5741 C CG . GLU D 105 ? 0.4899 0.4944 0.4075 -0.0726 -0.0196 0.0670 105 GLU D CG 5742 C CD . GLU D 105 ? 0.5914 0.5928 0.5112 -0.0655 -0.0200 0.0646 105 GLU D CD 5743 O OE1 . GLU D 105 ? 0.7136 0.7067 0.6246 -0.0678 -0.0254 0.0721 105 GLU D OE1 5744 O OE2 . GLU D 105 ? 0.5447 0.5517 0.4739 -0.0580 -0.0154 0.0557 105 GLU D OE2 5745 N N . PHE D 106 ? 0.4982 0.4718 0.4410 -0.0483 -0.0080 0.0463 106 PHE D N 5746 C CA . PHE D 106 ? 0.3993 0.3626 0.3490 -0.0399 -0.0060 0.0405 106 PHE D CA 5747 C C . PHE D 106 ? 0.4241 0.3674 0.3692 -0.0371 -0.0102 0.0448 106 PHE D C 5748 O O . PHE D 106 ? 0.4057 0.3366 0.3483 -0.0376 -0.0114 0.0470 106 PHE D O 5749 C CB . PHE D 106 ? 0.3035 0.2691 0.2597 -0.0375 -0.0019 0.0357 106 PHE D CB 5750 C CG . PHE D 106 ? 0.3276 0.3126 0.2859 -0.0381 0.0016 0.0314 106 PHE D CG 5751 C CD1 . PHE D 106 ? 0.3364 0.3302 0.2967 -0.0348 0.0034 0.0251 106 PHE D CD1 5752 C CD2 . PHE D 106 ? 0.3072 0.3028 0.2646 -0.0414 0.0028 0.0334 106 PHE D CD2 5753 C CE1 . PHE D 106 ? 0.3851 0.3959 0.3457 -0.0331 0.0063 0.0200 106 PHE D CE1 5754 C CE2 . PHE D 106 ? 0.2898 0.3064 0.2486 -0.0395 0.0060 0.0289 106 PHE D CE2 5755 C CZ . PHE D 106 ? 0.3724 0.3956 0.3325 -0.0345 0.0077 0.0218 106 PHE D CZ 5756 N N . ALA D 107 ? 0.3778 0.3188 0.3208 -0.0334 -0.0126 0.0457 107 ALA D N 5757 C CA . ALA D 107 ? 0.3304 0.2546 0.2680 -0.0276 -0.0169 0.0488 107 ALA D CA 5758 C C . ALA D 107 ? 0.3296 0.2524 0.2751 -0.0197 -0.0148 0.0435 107 ALA D C 5759 O O . ALA D 107 ? 0.3687 0.2788 0.3103 -0.0136 -0.0178 0.0450 107 ALA D O 5760 C CB . ALA D 107 ? 0.3774 0.3024 0.3083 -0.0257 -0.0209 0.0529 107 ALA D CB 5761 N N . TYR D 108 ? 0.3868 0.3219 0.3417 -0.0198 -0.0102 0.0373 108 TYR D N 5762 C CA . TYR D 108 ? 0.3752 0.3110 0.3368 -0.0148 -0.0087 0.0331 108 TYR D CA 5763 C C . TYR D 108 ? 0.3276 0.2648 0.2960 -0.0171 -0.0046 0.0284 108 TYR D C 5764 O O . TYR D 108 ? 0.3040 0.2484 0.2736 -0.0206 -0.0022 0.0255 108 TYR D O 5765 C CB . TYR D 108 ? 0.2963 0.2445 0.2599 -0.0134 -0.0088 0.0310 108 TYR D CB 5766 C CG . TYR D 108 ? 0.4030 0.3521 0.3598 -0.0095 -0.0129 0.0359 108 TYR D CG 5767 C CD1 . TYR D 108 ? 0.2720 0.2156 0.2257 -0.0010 -0.0161 0.0380 108 TYR D CD1 5768 C CD2 . TYR D 108 ? 0.4565 0.4121 0.4091 -0.0133 -0.0139 0.0383 108 TYR D CD2 5769 C CE1 . TYR D 108 ? 0.2915 0.2346 0.2374 0.0047 -0.0204 0.0424 108 TYR D CE1 5770 C CE2 . TYR D 108 ? 0.4316 0.3870 0.3772 -0.0093 -0.0181 0.0434 108 TYR D CE2 5771 C CZ . TYR D 108 ? 0.4398 0.3879 0.3815 0.0003 -0.0215 0.0454 108 TYR D CZ 5772 O OH . TYR D 108 ? 0.4263 0.3729 0.3593 0.0065 -0.0262 0.0504 108 TYR D OH 5773 N N . TRP D 109 ? 0.2819 0.2124 0.2537 -0.0143 -0.0041 0.0277 109 TRP D N 5774 C CA . TRP D 109 ? 0.2485 0.1784 0.2258 -0.0156 -0.0008 0.0242 109 TRP D CA 5775 C C . TRP D 109 ? 0.2912 0.2219 0.2739 -0.0135 -0.0004 0.0214 109 TRP D C 5776 O O . TRP D 109 ? 0.3893 0.3217 0.3720 -0.0102 -0.0025 0.0227 109 TRP D O 5777 C CB . TRP D 109 ? 0.2276 0.1500 0.2038 -0.0164 -0.0007 0.0269 109 TRP D CB 5778 C CG . TRP D 109 ? 0.2841 0.2084 0.2545 -0.0212 -0.0012 0.0303 109 TRP D CG 5779 C CD1 . TRP D 109 ? 0.3177 0.2389 0.2799 -0.0237 -0.0048 0.0351 109 TRP D CD1 5780 C CD2 . TRP D 109 ? 0.2841 0.2158 0.2555 -0.0245 0.0015 0.0298 109 TRP D CD2 5781 N NE1 . TRP D 109 ? 0.3352 0.2621 0.2933 -0.0302 -0.0046 0.0381 109 TRP D NE1 5782 C CE2 . TRP D 109 ? 0.2749 0.2105 0.2391 -0.0304 -0.0006 0.0346 109 TRP D CE2 5783 C CE3 . TRP D 109 ? 0.2959 0.2324 0.2730 -0.0226 0.0050 0.0259 109 TRP D CE3 5784 C CZ2 . TRP D 109 ? 0.2383 0.1864 0.2014 -0.0350 0.0012 0.0357 109 TRP D CZ2 5785 C CZ3 . TRP D 109 ? 0.2909 0.2387 0.2669 -0.0251 0.0069 0.0265 109 TRP D CZ3 5786 C CH2 . TRP D 109 ? 0.3729 0.3284 0.3423 -0.0315 0.0052 0.0314 109 TRP D CH2 5787 N N . GLY D 110 ? 0.3043 0.2344 0.2906 -0.0151 0.0020 0.0177 110 GLY D N 5788 C CA . GLY D 110 ? 0.2614 0.1903 0.2519 -0.0149 0.0021 0.0163 110 GLY D CA 5789 C C . GLY D 110 ? 0.3441 0.2679 0.3377 -0.0127 0.0026 0.0182 110 GLY D C 5790 O O . GLY D 110 ? 0.4185 0.3384 0.4103 -0.0121 0.0030 0.0203 110 GLY D O 5791 N N . GLN D 111 ? 0.3522 0.2770 0.3498 -0.0126 0.0022 0.0179 111 GLN D N 5792 C CA . GLN D 111 ? 0.3283 0.2498 0.3291 -0.0104 0.0027 0.0195 111 GLN D CA 5793 C C . GLN D 111 ? 0.3107 0.2272 0.3136 -0.0115 0.0052 0.0187 111 GLN D C 5794 O O . GLN D 111 ? 0.2781 0.1927 0.2833 -0.0105 0.0059 0.0203 111 GLN D O 5795 C CB . GLN D 111 ? 0.2015 0.1295 0.2061 -0.0100 0.0014 0.0197 111 GLN D CB 5796 C CG . GLN D 111 ? 0.2003 0.1278 0.2082 -0.0144 0.0020 0.0187 111 GLN D CG 5797 C CD . GLN D 111 ? 0.3593 0.2889 0.3642 -0.0197 0.0007 0.0170 111 GLN D CD 5798 O OE1 . GLN D 111 ? 0.3311 0.2616 0.3322 -0.0200 0.0005 0.0158 111 GLN D OE1 5799 N NE2 . GLN D 111 ? 0.4897 0.4198 0.4953 -0.0250 -0.0006 0.0173 111 GLN D NE2 5800 N N . GLY D 112 ? 0.2749 0.1898 0.2761 -0.0127 0.0064 0.0160 112 GLY D N 5801 C CA . GLY D 112 ? 0.3079 0.2200 0.3099 -0.0113 0.0087 0.0150 112 GLY D CA 5802 C C . GLY D 112 ? 0.3454 0.2521 0.3497 -0.0114 0.0084 0.0139 112 GLY D C 5803 O O . GLY D 112 ? 0.4675 0.3748 0.4743 -0.0138 0.0068 0.0153 112 GLY D O 5804 N N . THR D 113 ? 0.3038 0.2059 0.3060 -0.0086 0.0097 0.0116 113 THR D N 5805 C CA . THR D 113 ? 0.2320 0.1252 0.2339 -0.0081 0.0088 0.0110 113 THR D CA 5806 C C . THR D 113 ? 0.2470 0.1419 0.2508 -0.0027 0.0112 0.0117 113 THR D C 5807 O O . THR D 113 ? 0.3293 0.2275 0.3300 0.0023 0.0129 0.0093 113 THR D O 5808 C CB . THR D 113 ? 0.2833 0.1647 0.2769 -0.0087 0.0066 0.0067 113 THR D CB 5809 O OG1 . THR D 113 ? 0.4422 0.3249 0.4341 -0.0153 0.0042 0.0068 113 THR D OG1 5810 C CG2 . THR D 113 ? 0.2665 0.1340 0.2567 -0.0081 0.0047 0.0067 113 THR D CG2 5811 N N . LEU D 114 ? 0.2655 0.1613 0.2745 -0.0035 0.0114 0.0150 114 LEU D N 5812 C CA . LEU D 114 ? 0.2950 0.1946 0.3062 0.0012 0.0136 0.0163 114 LEU D CA 5813 C C . LEU D 114 ? 0.3742 0.2619 0.3803 0.0063 0.0124 0.0141 114 LEU D C 5814 O O . LEU D 114 ? 0.5049 0.3814 0.5095 0.0030 0.0095 0.0151 114 LEU D O 5815 C CB . LEU D 114 ? 0.3503 0.2557 0.3685 -0.0018 0.0141 0.0206 114 LEU D CB 5816 C CG . LEU D 114 ? 0.3434 0.2550 0.3647 0.0018 0.0163 0.0228 114 LEU D CG 5817 C CD1 . LEU D 114 ? 0.4267 0.3484 0.4456 0.0059 0.0189 0.0219 114 LEU D CD1 5818 C CD2 . LEU D 114 ? 0.3114 0.2298 0.3386 -0.0024 0.0168 0.0264 114 LEU D CD2 5819 N N . VAL D 115 ? 0.3820 0.2723 0.3840 0.0144 0.0140 0.0112 115 VAL D N 5820 C CA . VAL D 115 ? 0.4361 0.3124 0.4300 0.0224 0.0122 0.0079 115 VAL D CA 5821 C C . VAL D 115 ? 0.4453 0.3311 0.4421 0.0302 0.0146 0.0100 115 VAL D C 5822 O O . VAL D 115 ? 0.4175 0.3228 0.4173 0.0337 0.0180 0.0103 115 VAL D O 5823 C CB . VAL D 115 ? 0.4642 0.3364 0.4489 0.0282 0.0118 0.0014 115 VAL D CB 5824 C CG1 . VAL D 115 ? 0.5894 0.4476 0.5637 0.0401 0.0100 -0.0028 115 VAL D CG1 5825 C CG2 . VAL D 115 ? 0.4801 0.3411 0.4606 0.0199 0.0089 -0.0005 115 VAL D CG2 5826 N N . THR D 116 ? 0.3688 0.2422 0.3639 0.0323 0.0124 0.0120 116 THR D N 5827 C CA . THR D 116 ? 0.2548 0.1366 0.2520 0.0405 0.0141 0.0143 116 THR D CA 5828 C C . THR D 116 ? 0.3371 0.2016 0.3219 0.0535 0.0114 0.0101 116 THR D C 5829 O O . THR D 116 ? 0.3677 0.2058 0.3434 0.0518 0.0065 0.0090 116 THR D O 5830 C CB . THR D 116 ? 0.3977 0.2795 0.4023 0.0338 0.0135 0.0205 116 THR D CB 5831 O OG1 . THR D 116 ? 0.3851 0.2817 0.3992 0.0240 0.0157 0.0233 116 THR D OG1 5832 C CG2 . THR D 116 ? 0.3555 0.2470 0.3620 0.0425 0.0153 0.0232 116 THR D CG2 5833 N N . VAL D 117 ? 0.2899 0.1695 0.2729 0.0663 0.0141 0.0078 117 VAL D N 5834 C CA . VAL D 117 ? 0.3445 0.2100 0.3146 0.0826 0.0116 0.0033 117 VAL D CA 5835 C C . VAL D 117 ? 0.4168 0.2883 0.3901 0.0892 0.0121 0.0083 117 VAL D C 5836 O O . VAL D 117 ? 0.4004 0.3019 0.3828 0.0913 0.0167 0.0115 117 VAL D O 5837 C CB . VAL D 117 ? 0.4576 0.3399 0.4227 0.0950 0.0140 -0.0031 117 VAL D CB 5838 C CG1 . VAL D 117 ? 0.3671 0.2347 0.3174 0.1150 0.0111 -0.0086 117 VAL D CG1 5839 C CG2 . VAL D 117 ? 0.5733 0.4501 0.5354 0.0878 0.0134 -0.0078 117 VAL D CG2 5840 N N . SER D 118 ? 0.4511 0.2942 0.4160 0.0913 0.0070 0.0097 118 SER D N 5841 C CA . SER D 118 ? 0.4284 0.2744 0.3960 0.0963 0.0067 0.0155 118 SER D CA 5842 C C . SER D 118 ? 0.5103 0.3176 0.4615 0.1022 -0.0006 0.0150 118 SER D C 5843 O O . SER D 118 ? 0.4969 0.2754 0.4378 0.0950 -0.0056 0.0125 118 SER D O 5844 C CB . SER D 118 ? 0.4882 0.3487 0.4712 0.0801 0.0089 0.0231 118 SER D CB 5845 O OG . SER D 118 ? 0.5266 0.3935 0.5130 0.0847 0.0091 0.0288 118 SER D OG 5846 N N . ALA D 119 ? 0.5213 0.3279 0.4690 0.1147 -0.0017 0.0179 119 ALA D N 5847 C CA . ALA D 119 ? 0.5147 0.2825 0.4452 0.1207 -0.0095 0.0189 119 ALA D CA 5848 C C . ALA D 119 ? 0.5837 0.3418 0.5196 0.1045 -0.0126 0.0280 119 ALA D C 5849 O O . ALA D 119 ? 0.5812 0.3103 0.5047 0.1035 -0.0197 0.0302 119 ALA D O 5850 C CB . ALA D 119 ? 0.4958 0.2665 0.4176 0.1447 -0.0099 0.0173 119 ALA D CB 5851 N N . ALA D 120 ? 0.6272 0.4134 0.5823 0.0896 -0.0076 0.0330 120 ALA D N 5852 C CA . ALA D 120 ? 0.6704 0.4541 0.6321 0.0749 -0.0099 0.0414 120 ALA D CA 5853 C C . ALA D 120 ? 0.5777 0.3358 0.5319 0.0586 -0.0157 0.0418 120 ALA D C 5854 O O . ALA D 120 ? 0.5367 0.2776 0.4806 0.0584 -0.0180 0.0357 120 ALA D O 5855 C CB . ALA D 120 ? 0.7562 0.5783 0.7391 0.0660 -0.0028 0.0452 120 ALA D CB 5856 N N . SER D 121 ? 0.5815 0.3402 0.5412 0.0442 -0.0182 0.0494 121 SER D N 5857 C CA . SER D 121 ? 0.5707 0.3114 0.5241 0.0266 -0.0240 0.0518 121 SER D CA 5858 C C . SER D 121 ? 0.4602 0.2300 0.4308 0.0125 -0.0193 0.0525 121 SER D C 5859 O O . SER D 121 ? 0.3436 0.1434 0.3304 0.0138 -0.0129 0.0536 121 SER D O 5860 C CB . SER D 121 ? 0.6346 0.3644 0.5831 0.0189 -0.0293 0.0594 121 SER D CB 5861 O OG . SER D 121 ? 0.8018 0.5108 0.7367 0.0319 -0.0328 0.0578 121 SER D OG 5862 N N . THR D 122 ? 0.5422 0.3020 0.5074 -0.0007 -0.0230 0.0518 122 THR D N 5863 C CA . THR D 122 ? 0.4596 0.2452 0.4385 -0.0134 -0.0199 0.0528 122 THR D CA 5864 C C . THR D 122 ? 0.3698 0.1672 0.3556 -0.0252 -0.0221 0.0611 122 THR D C 5865 O O . THR D 122 ? 0.4061 0.1875 0.3812 -0.0322 -0.0280 0.0653 122 THR D O 5866 C CB . THR D 122 ? 0.4491 0.2238 0.4197 -0.0227 -0.0232 0.0493 122 THR D CB 5867 O OG1 . THR D 122 ? 0.5012 0.2708 0.4679 -0.0118 -0.0202 0.0413 122 THR D OG1 5868 C CG2 . THR D 122 ? 0.4065 0.2088 0.3900 -0.0348 -0.0209 0.0511 122 THR D CG2 5869 N N . LYS D 123 ? 0.3600 0.1887 0.3628 -0.0269 -0.0165 0.0622 123 LYS D N 5870 C CA . LYS D 123 ? 0.3555 0.2010 0.3663 -0.0371 -0.0178 0.0692 123 LYS D CA 5871 C C . LYS D 123 ? 0.3246 0.1991 0.3483 -0.0429 -0.0139 0.0674 123 LYS D C 5872 O O . LYS D 123 ? 0.3011 0.1885 0.3327 -0.0354 -0.0081 0.0626 123 LYS D O 5873 C CB . LYS D 123 ? 0.2679 0.1212 0.2849 -0.0295 -0.0153 0.0730 123 LYS D CB 5874 C CG . LYS D 123 ? 0.4470 0.3251 0.4755 -0.0386 -0.0148 0.0788 123 LYS D CG 5875 C CD . LYS D 123 ? 0.5185 0.4005 0.5503 -0.0326 -0.0138 0.0838 123 LYS D CD 5876 C CE . LYS D 123 ? 0.5025 0.4155 0.5486 -0.0391 -0.0110 0.0873 123 LYS D CE 5877 N NZ . LYS D 123 ? 0.5273 0.4510 0.5747 -0.0535 -0.0146 0.0898 123 LYS D NZ 5878 N N . GLY D 124 ? 0.3443 0.2290 0.3687 -0.0562 -0.0176 0.0715 124 GLY D N 5879 C CA . GLY D 124 ? 0.2257 0.1392 0.2610 -0.0601 -0.0147 0.0700 124 GLY D CA 5880 C C . GLY D 124 ? 0.2075 0.1440 0.2552 -0.0574 -0.0109 0.0718 124 GLY D C 5881 O O . GLY D 124 ? 0.4530 0.3867 0.5014 -0.0567 -0.0116 0.0765 124 GLY D O 5882 N N . PRO D 125 ? 0.1892 0.1478 0.2457 -0.0553 -0.0072 0.0680 125 PRO D N 5883 C CA . PRO D 125 ? 0.3257 0.3042 0.3922 -0.0520 -0.0036 0.0683 125 PRO D CA 5884 C C . PRO D 125 ? 0.2996 0.3012 0.3711 -0.0609 -0.0062 0.0730 125 PRO D C 5885 O O . PRO D 125 ? 0.1901 0.1975 0.2581 -0.0703 -0.0105 0.0757 125 PRO D O 5886 C CB . PRO D 125 ? 0.2239 0.2098 0.2936 -0.0450 0.0005 0.0613 125 PRO D CB 5887 C CG . PRO D 125 ? 0.2419 0.2267 0.3068 -0.0487 -0.0022 0.0593 125 PRO D CG 5888 C CD . PRO D 125 ? 0.1844 0.1478 0.2402 -0.0542 -0.0063 0.0626 125 PRO D CD 5889 N N . SER D 126 ? 0.3200 0.3371 0.3993 -0.0586 -0.0035 0.0739 126 SER D N 5890 C CA . SER D 126 ? 0.3597 0.4052 0.4454 -0.0642 -0.0046 0.0762 126 SER D CA 5891 C C . SER D 126 ? 0.2637 0.3250 0.3541 -0.0565 -0.0008 0.0687 126 SER D C 5892 O O . SER D 126 ? 0.3113 0.3626 0.4016 -0.0483 0.0030 0.0640 126 SER D O 5893 C CB . SER D 126 ? 0.1477 0.2002 0.2378 -0.0672 -0.0048 0.0824 126 SER D CB 5894 O OG . SER D 126 ? 0.1685 0.2016 0.2517 -0.0730 -0.0091 0.0894 126 SER D OG 5895 N N . VAL D 127 ? 0.1983 0.2846 0.2913 -0.0591 -0.0024 0.0677 127 VAL D N 5896 C CA . VAL D 127 ? 0.1901 0.2898 0.2847 -0.0503 -0.0001 0.0601 127 VAL D CA 5897 C C . VAL D 127 ? 0.2114 0.3393 0.3121 -0.0509 0.0000 0.0605 127 VAL D C 5898 O O . VAL D 127 ? 0.2523 0.4032 0.3556 -0.0588 -0.0032 0.0651 127 VAL D O 5899 C CB . VAL D 127 ? 0.1258 0.2321 0.2165 -0.0489 -0.0021 0.0568 127 VAL D CB 5900 C CG1 . VAL D 127 ? 0.1762 0.2930 0.2663 -0.0372 -0.0004 0.0487 127 VAL D CG1 5901 C CG2 . VAL D 127 ? 0.1337 0.2130 0.2182 -0.0490 -0.0023 0.0564 127 VAL D CG2 5902 N N . PHE D 128 ? 0.2380 0.3651 0.3401 -0.0436 0.0032 0.0557 128 PHE D N 5903 C CA . PHE D 128 ? 0.2476 0.3994 0.3545 -0.0430 0.0037 0.0548 128 PHE D CA 5904 C C . PHE D 128 ? 0.2501 0.4069 0.3529 -0.0315 0.0047 0.0450 128 PHE D C 5905 O O . PHE D 128 ? 0.1104 0.2452 0.2066 -0.0247 0.0057 0.0399 128 PHE D O 5906 C CB . PHE D 128 ? 0.1016 0.2474 0.2121 -0.0455 0.0061 0.0583 128 PHE D CB 5907 C CG . PHE D 128 ? 0.1048 0.2412 0.2171 -0.0541 0.0047 0.0676 128 PHE D CG 5908 C CD1 . PHE D 128 ? 0.1092 0.2569 0.2202 -0.0617 0.0007 0.0727 128 PHE D CD1 5909 C CD2 . PHE D 128 ? 0.1090 0.2200 0.2187 -0.0522 0.0066 0.0691 128 PHE D CD2 5910 C CE1 . PHE D 128 ? 0.1188 0.2502 0.2258 -0.0673 -0.0020 0.0797 128 PHE D CE1 5911 C CE2 . PHE D 128 ? 0.1453 0.2450 0.2544 -0.0575 0.0047 0.0769 128 PHE D CE2 5912 C CZ . PHE D 128 ? 0.1217 0.2297 0.2288 -0.0651 0.0001 0.0822 128 PHE D CZ 5913 N N . PRO D 129 ? 0.2407 0.4256 0.3459 -0.0288 0.0038 0.0421 129 PRO D N 5914 C CA . PRO D 129 ? 0.1314 0.3186 0.2299 -0.0157 0.0038 0.0319 129 PRO D CA 5915 C C . PRO D 129 ? 0.1104 0.2808 0.2046 -0.0120 0.0061 0.0275 129 PRO D C 5916 O O . PRO D 129 ? 0.1647 0.3398 0.2643 -0.0187 0.0077 0.0315 129 PRO D O 5917 C CB . PRO D 129 ? 0.1032 0.3305 0.2057 -0.0143 0.0018 0.0309 129 PRO D CB 5918 C CG . PRO D 129 ? 0.0949 0.3375 0.2068 -0.0277 0.0019 0.0401 129 PRO D CG 5919 C CD . PRO D 129 ? 0.0959 0.3127 0.2085 -0.0371 0.0020 0.0480 129 PRO D CD 5920 N N . LEU D 130 ? 0.1212 0.2715 0.2045 -0.0021 0.0057 0.0196 130 LEU D N 5921 C CA . LEU D 130 ? 0.2556 0.3905 0.3307 0.0016 0.0064 0.0139 130 LEU D CA 5922 C C . LEU D 130 ? 0.2782 0.4270 0.3460 0.0140 0.0039 0.0045 130 LEU D C 5923 O O . LEU D 130 ? 0.1523 0.2865 0.2083 0.0252 0.0015 -0.0023 130 LEU D O 5924 C CB . LEU D 130 ? 0.2218 0.3208 0.2869 0.0025 0.0068 0.0124 130 LEU D CB 5925 C CG . LEU D 130 ? 0.1965 0.2824 0.2672 -0.0075 0.0094 0.0203 130 LEU D CG 5926 C CD1 . LEU D 130 ? 0.1728 0.2284 0.2329 -0.0058 0.0092 0.0183 130 LEU D CD1 5927 C CD2 . LEU D 130 ? 0.2311 0.3241 0.3077 -0.0154 0.0120 0.0246 130 LEU D CD2 5928 N N . ALA D 131 ? 0.2277 0.4054 0.3016 0.0129 0.0041 0.0042 131 ALA D N 5929 C CA . ALA D 131 ? 0.2528 0.4522 0.3213 0.0257 0.0015 -0.0044 131 ALA D CA 5930 C C . ALA D 131 ? 0.3772 0.5680 0.4356 0.0311 0.0011 -0.0126 131 ALA D C 5931 O O . ALA D 131 ? 0.3683 0.5600 0.4316 0.0211 0.0033 -0.0090 131 ALA D O 5932 C CB . ALA D 131 ? 0.2626 0.5074 0.3443 0.0212 0.0013 0.0004 131 ALA D CB 5933 N N . PRO D 132 ? 0.4302 0.6123 0.4733 0.0470 -0.0022 -0.0236 132 PRO D N 5934 C CA . PRO D 132 ? 0.4798 0.6525 0.5102 0.0529 -0.0037 -0.0326 132 PRO D CA 5935 C C . PRO D 132 ? 0.6546 0.8705 0.6927 0.0558 -0.0034 -0.0353 132 PRO D C 5936 O O . PRO D 132 ? 0.7501 1.0041 0.7998 0.0572 -0.0033 -0.0323 132 PRO D O 5937 C CB . PRO D 132 ? 0.4758 0.6220 0.4851 0.0710 -0.0084 -0.0434 132 PRO D CB 5938 C CG . PRO D 132 ? 0.4380 0.6057 0.4541 0.0787 -0.0091 -0.0416 132 PRO D CG 5939 C CD . PRO D 132 ? 0.3804 0.5586 0.4153 0.0612 -0.0053 -0.0285 132 PRO D CD 5940 N N . SER D 133 ? 0.7307 0.9411 0.7612 0.0558 -0.0037 -0.0410 133 SER D N 5941 C CA . SER D 133 ? 0.6774 0.9284 0.7139 0.0585 -0.0035 -0.0444 133 SER D CA 5942 C C . SER D 133 ? 0.6572 0.9180 0.6789 0.0810 -0.0077 -0.0585 133 SER D C 5943 O O . SER D 133 ? 0.6813 0.9065 0.6812 0.0926 -0.0113 -0.0691 133 SER D O 5944 C CB . SER D 133 ? 0.5876 0.8319 0.6231 0.0477 -0.0016 -0.0441 133 SER D CB 5945 O OG . SER D 133 ? 0.5432 0.7419 0.5575 0.0509 -0.0040 -0.0516 133 SER D OG 5946 N N . GLY D 140 ? 0.5929 0.4171 0.3567 0.2077 -0.0685 -0.1344 140 GLY D N 5947 C CA . GLY D 140 ? 0.5723 0.4592 0.3634 0.2185 -0.0623 -0.1341 140 GLY D CA 5948 C C . GLY D 140 ? 0.5972 0.4992 0.4111 0.2067 -0.0570 -0.1211 140 GLY D C 5949 O O . GLY D 140 ? 0.5606 0.5013 0.3891 0.2184 -0.0548 -0.1198 140 GLY D O 5950 N N . THR D 141 ? 0.2631 0.2129 0.3325 -0.0048 0.0452 -0.0121 141 THR D N 5951 C CA . THR D 141 ? 0.2247 0.1905 0.3031 -0.0014 0.0374 -0.0095 141 THR D CA 5952 C C . THR D 141 ? 0.2914 0.2561 0.3596 -0.0035 0.0288 -0.0126 141 THR D C 5953 O O . THR D 141 ? 0.4192 0.3777 0.4772 -0.0070 0.0241 -0.0166 141 THR D O 5954 C CB . THR D 141 ? 0.2174 0.1928 0.3045 0.0003 0.0344 -0.0080 141 THR D CB 5955 O OG1 . THR D 141 ? 0.1541 0.1305 0.2503 0.0039 0.0428 -0.0038 141 THR D OG1 5956 C CG2 . THR D 141 ? 0.1414 0.1310 0.2345 0.0034 0.0261 -0.0060 141 THR D CG2 5957 N N . ALA D 142 ? 0.2845 0.2553 0.3559 -0.0014 0.0269 -0.0109 142 ALA D N 5958 C CA . ALA D 142 ? 0.3265 0.2956 0.3888 -0.0025 0.0202 -0.0129 142 ALA D CA 5959 C C . ALA D 142 ? 0.3427 0.3268 0.4139 -0.0001 0.0126 -0.0114 142 ALA D C 5960 O O . ALA D 142 ? 0.3226 0.3179 0.4062 0.0029 0.0134 -0.0086 142 ALA D O 5961 C CB . ALA D 142 ? 0.3303 0.2918 0.3882 -0.0026 0.0256 -0.0129 142 ALA D CB 5962 N N . ALA D 143 ? 0.2271 0.2107 0.2908 -0.0010 0.0052 -0.0134 143 ALA D N 5963 C CA . ALA D 143 ? 0.2179 0.2133 0.2881 0.0011 -0.0013 -0.0123 143 ALA D CA 5964 C C . ALA D 143 ? 0.2785 0.2706 0.3420 0.0013 -0.0031 -0.0129 143 ALA D C 5965 O O . ALA D 143 ? 0.2585 0.2388 0.3085 0.0000 -0.0033 -0.0146 143 ALA D O 5966 C CB . ALA D 143 ? 0.2226 0.2212 0.2927 0.0005 -0.0077 -0.0136 143 ALA D CB 5967 N N . LEU D 144 ? 0.2303 0.2317 0.3023 0.0030 -0.0038 -0.0116 144 LEU D N 5968 C CA . LEU D 144 ? 0.2172 0.2161 0.2848 0.0030 -0.0047 -0.0124 144 LEU D CA 5969 C C . LEU D 144 ? 0.1844 0.1953 0.2601 0.0048 -0.0094 -0.0118 144 LEU D C 5970 O O . LEU D 144 ? 0.1529 0.1737 0.2375 0.0063 -0.0108 -0.0105 144 LEU D O 5971 C CB . LEU D 144 ? 0.2570 0.2510 0.3263 0.0020 0.0027 -0.0129 144 LEU D CB 5972 C CG . LEU D 144 ? 0.2527 0.2571 0.3376 0.0027 0.0062 -0.0119 144 LEU D CG 5973 C CD1 . LEU D 144 ? 0.3058 0.3227 0.4009 0.0037 0.0027 -0.0124 144 LEU D CD1 5974 C CD2 . LEU D 144 ? 0.1374 0.1333 0.2231 0.0013 0.0151 -0.0124 144 LEU D CD2 5975 N N . GLY D 145 ? 0.1491 0.1574 0.2201 0.0048 -0.0110 -0.0127 145 GLY D N 5976 C CA . GLY D 145 ? 0.1816 0.1991 0.2583 0.0062 -0.0147 -0.0125 145 GLY D CA 5977 C C . GLY D 145 ? 0.1211 0.1332 0.1923 0.0059 -0.0142 -0.0137 145 GLY D C 5978 O O . GLY D 145 ? 0.1775 0.1785 0.2408 0.0049 -0.0103 -0.0144 145 GLY D O 5979 N N . CYS D 146 ? 0.1898 0.2084 0.2646 0.0070 -0.0172 -0.0139 146 CYS D N 5980 C CA . CYS D 146 ? 0.2313 0.2452 0.3020 0.0069 -0.0160 -0.0150 146 CYS D CA 5981 C C . CYS D 146 ? 0.2644 0.2792 0.3324 0.0095 -0.0204 -0.0135 146 CYS D C 5982 O O . CYS D 146 ? 0.2162 0.2395 0.2901 0.0108 -0.0236 -0.0126 146 CYS D O 5983 C CB . CYS D 146 ? 0.2266 0.2473 0.3057 0.0051 -0.0141 -0.0178 146 CYS D CB 5984 S SG . CYS D 146 ? 0.3407 0.3587 0.4252 0.0016 -0.0074 -0.0205 146 CYS D SG 5985 N N . LEU D 147 ? 0.2842 0.2895 0.3434 0.0108 -0.0198 -0.0130 147 LEU D N 5986 C CA . LEU D 147 ? 0.2609 0.2667 0.3186 0.0139 -0.0233 -0.0113 147 LEU D CA 5987 C C . LEU D 147 ? 0.2458 0.2504 0.3044 0.0136 -0.0197 -0.0126 147 LEU D C 5988 O O . LEU D 147 ? 0.2392 0.2343 0.2920 0.0127 -0.0148 -0.0136 147 LEU D O 5989 C CB . LEU D 147 ? 0.2836 0.2798 0.3305 0.0166 -0.0256 -0.0093 147 LEU D CB 5990 C CG . LEU D 147 ? 0.2848 0.2817 0.3313 0.0208 -0.0295 -0.0071 147 LEU D CG 5991 C CD1 . LEU D 147 ? 0.1340 0.1430 0.1920 0.0214 -0.0344 -0.0066 147 LEU D CD1 5992 C CD2 . LEU D 147 ? 0.3106 0.2971 0.3442 0.0243 -0.0323 -0.0051 147 LEU D CD2 5993 N N . VAL D 148 ? 0.2124 0.2252 0.2777 0.0142 -0.0213 -0.0129 148 VAL D N 5994 C CA . VAL D 148 ? 0.2081 0.2195 0.2736 0.0136 -0.0181 -0.0148 148 VAL D CA 5995 C C . VAL D 148 ? 0.2269 0.2348 0.2899 0.0177 -0.0189 -0.0120 148 VAL D C 5996 O O . VAL D 148 ? 0.3208 0.3353 0.3891 0.0198 -0.0218 -0.0104 148 VAL D O 5997 C CB . VAL D 148 ? 0.1906 0.2119 0.2627 0.0120 -0.0189 -0.0171 148 VAL D CB 5998 C CG1 . VAL D 148 ? 0.1250 0.1437 0.1957 0.0106 -0.0156 -0.0203 148 VAL D CG1 5999 C CG2 . VAL D 148 ? 0.1160 0.1426 0.1925 0.0092 -0.0191 -0.0191 148 VAL D CG2 6000 N N . LYS D 149 ? 0.2926 0.2897 0.3482 0.0192 -0.0157 -0.0111 149 LYS D N 6001 C CA . LYS D 149 ? 0.2394 0.2326 0.2922 0.0244 -0.0174 -0.0073 149 LYS D CA 6002 C C . LYS D 149 ? 0.1556 0.1409 0.2053 0.0256 -0.0114 -0.0075 149 LYS D C 6003 O O . LYS D 149 ? 0.1622 0.1394 0.2073 0.0228 -0.0052 -0.0102 149 LYS D O 6004 C CB . LYS D 149 ? 0.1800 0.1657 0.2238 0.0271 -0.0199 -0.0047 149 LYS D CB 6005 C CG . LYS D 149 ? 0.2954 0.2779 0.3362 0.0335 -0.0232 -0.0006 149 LYS D CG 6006 C CD . LYS D 149 ? 0.3278 0.3065 0.3602 0.0361 -0.0290 0.0014 149 LYS D CD 6007 C CE . LYS D 149 ? 0.3422 0.3158 0.3691 0.0434 -0.0323 0.0057 149 LYS D CE 6008 N NZ . LYS D 149 ? 0.3689 0.3529 0.4094 0.0463 -0.0350 0.0072 149 LYS D NZ 6009 N N . ASP D 150 ? 0.2476 0.2350 0.3010 0.0297 -0.0124 -0.0050 150 ASP D N 6010 C CA . ASP D 150 ? 0.3083 0.2870 0.3586 0.0323 -0.0064 -0.0040 150 ASP D CA 6011 C C . ASP D 150 ? 0.3748 0.3518 0.4255 0.0274 -0.0001 -0.0090 150 ASP D C 6012 O O . ASP D 150 ? 0.4234 0.3905 0.4684 0.0250 0.0063 -0.0115 150 ASP D O 6013 C CB . ASP D 150 ? 0.2630 0.2281 0.3024 0.0355 -0.0032 -0.0014 150 ASP D CB 6014 C CG . ASP D 150 ? 0.3067 0.2726 0.3436 0.0417 -0.0104 0.0036 150 ASP D CG 6015 O OD1 . ASP D 150 ? 0.2861 0.2621 0.3324 0.0447 -0.0161 0.0057 150 ASP D OD1 6016 O OD2 . ASP D 150 ? 0.3611 0.3172 0.3867 0.0436 -0.0102 0.0053 150 ASP D OD2 6017 N N . TYR D 151 ? 0.1749 0.1605 0.2316 0.0260 -0.0015 -0.0108 151 TYR D N 6018 C CA . TYR D 151 ? 0.1795 0.1636 0.2350 0.0218 0.0032 -0.0159 151 TYR D CA 6019 C C . TYR D 151 ? 0.2851 0.2709 0.3431 0.0245 0.0047 -0.0148 151 TYR D C 6020 O O . TYR D 151 ? 0.4042 0.3961 0.4681 0.0283 0.0012 -0.0108 151 TYR D O 6021 C CB . TYR D 151 ? 0.1534 0.1458 0.2109 0.0165 0.0000 -0.0206 151 TYR D CB 6022 C CG . TYR D 151 ? 0.1429 0.1467 0.2056 0.0177 -0.0060 -0.0188 151 TYR D CG 6023 C CD1 . TYR D 151 ? 0.1359 0.1448 0.2020 0.0189 -0.0108 -0.0158 151 TYR D CD1 6024 C CD2 . TYR D 151 ? 0.2436 0.2516 0.3065 0.0177 -0.0061 -0.0202 151 TYR D CD2 6025 C CE1 . TYR D 151 ? 0.1276 0.1456 0.1987 0.0199 -0.0149 -0.0143 151 TYR D CE1 6026 C CE2 . TYR D 151 ? 0.2530 0.2694 0.3197 0.0193 -0.0100 -0.0181 151 TYR D CE2 6027 C CZ . TYR D 151 ? 0.2192 0.2408 0.2909 0.0203 -0.0141 -0.0152 151 TYR D CZ 6028 O OH . TYR D 151 ? 0.1411 0.1698 0.2170 0.0216 -0.0167 -0.0133 151 TYR D OH 6029 N N . PHE D 152 ? 0.1686 0.1482 0.2223 0.0220 0.0105 -0.0189 152 PHE D N 6030 C CA . PHE D 152 ? 0.2600 0.2385 0.3136 0.0239 0.0138 -0.0186 152 PHE D CA 6031 C C . PHE D 152 ? 0.3072 0.2805 0.3535 0.0187 0.0182 -0.0257 152 PHE D C 6032 O O . PHE D 152 ? 0.3826 0.3483 0.4252 0.0151 0.0224 -0.0297 152 PHE D O 6033 C CB . PHE D 152 ? 0.2614 0.2324 0.3169 0.0299 0.0186 -0.0134 152 PHE D CB 6034 C CG . PHE D 152 ? 0.1820 0.1534 0.2407 0.0331 0.0218 -0.0115 152 PHE D CG 6035 C CD1 . PHE D 152 ? 0.2073 0.1695 0.2594 0.0317 0.0297 -0.0149 152 PHE D CD1 6036 C CD2 . PHE D 152 ? 0.1717 0.1521 0.2405 0.0373 0.0178 -0.0067 152 PHE D CD2 6037 C CE1 . PHE D 152 ? 0.2465 0.2072 0.3007 0.0349 0.0340 -0.0130 152 PHE D CE1 6038 C CE2 . PHE D 152 ? 0.2386 0.2186 0.3117 0.0403 0.0223 -0.0049 152 PHE D CE2 6039 C CZ . PHE D 152 ? 0.2010 0.1707 0.2663 0.0394 0.0307 -0.0077 152 PHE D CZ 6040 N N . PRO D 153 ? 0.2816 0.2583 0.3253 0.0183 0.0173 -0.0277 153 PRO D N 6041 C CA . PRO D 153 ? 0.2545 0.2389 0.3027 0.0223 0.0139 -0.0232 153 PRO D CA 6042 C C . PRO D 153 ? 0.2865 0.2819 0.3361 0.0203 0.0064 -0.0243 153 PRO D C 6043 O O . PRO D 153 ? 0.3500 0.3485 0.3994 0.0163 0.0031 -0.0277 153 PRO D O 6044 C CB . PRO D 153 ? 0.2755 0.2534 0.3166 0.0230 0.0196 -0.0250 153 PRO D CB 6045 C CG . PRO D 153 ? 0.2443 0.2180 0.2757 0.0170 0.0202 -0.0331 153 PRO D CG 6046 C CD . PRO D 153 ? 0.1928 0.1641 0.2276 0.0140 0.0208 -0.0347 153 PRO D CD 6047 N N . GLU D 154 ? 0.2583 0.2589 0.3099 0.0232 0.0047 -0.0212 154 GLU D N 6048 C CA . GLU D 154 ? 0.2736 0.2831 0.3252 0.0222 -0.0012 -0.0218 154 GLU D CA 6049 C C . GLU D 154 ? 0.2313 0.2399 0.2723 0.0195 -0.0020 -0.0276 154 GLU D C 6050 O O . GLU D 154 ? 0.3854 0.3856 0.4186 0.0185 0.0026 -0.0309 154 GLU D O 6051 C CB . GLU D 154 ? 0.2397 0.2532 0.2966 0.0265 -0.0011 -0.0166 154 GLU D CB 6052 C CG . GLU D 154 ? 0.3422 0.3607 0.4108 0.0280 -0.0038 -0.0124 154 GLU D CG 6053 C CD . GLU D 154 ? 0.5278 0.5539 0.6010 0.0288 -0.0070 -0.0101 154 GLU D CD 6054 O OE1 . GLU D 154 ? 0.5333 0.5593 0.6093 0.0317 -0.0038 -0.0075 154 GLU D OE1 6055 O OE2 . GLU D 154 ? 0.5742 0.6052 0.6481 0.0267 -0.0117 -0.0111 154 GLU D OE2 6056 N N . PRO D 155 ? 0.2129 0.2299 0.2532 0.0183 -0.0082 -0.0293 155 PRO D N 6057 C CA . PRO D 155 ? 0.2104 0.2365 0.2590 0.0188 -0.0131 -0.0262 155 PRO D CA 6058 C C . PRO D 155 ? 0.2873 0.3173 0.3406 0.0144 -0.0162 -0.0298 155 PRO D C 6059 O O . PRO D 155 ? 0.3262 0.3527 0.3769 0.0105 -0.0149 -0.0352 155 PRO D O 6060 C CB . PRO D 155 ? 0.1778 0.2088 0.2209 0.0212 -0.0163 -0.0257 155 PRO D CB 6061 C CG . PRO D 155 ? 0.1631 0.1914 0.1954 0.0189 -0.0172 -0.0320 155 PRO D CG 6062 C CD . PRO D 155 ? 0.2787 0.2964 0.3082 0.0172 -0.0107 -0.0341 155 PRO D CD 6063 N N . VAL D 156 ? 0.2520 0.2881 0.3123 0.0148 -0.0193 -0.0270 156 VAL D N 6064 C CA . VAL D 156 ? 0.2515 0.2919 0.3169 0.0111 -0.0217 -0.0299 156 VAL D CA 6065 C C . VAL D 156 ? 0.2194 0.2692 0.2883 0.0127 -0.0263 -0.0282 156 VAL D C 6066 O O . VAL D 156 ? 0.3183 0.3693 0.3877 0.0164 -0.0265 -0.0232 156 VAL D O 6067 C CB . VAL D 156 ? 0.2673 0.3025 0.3367 0.0102 -0.0191 -0.0279 156 VAL D CB 6068 C CG1 . VAL D 156 ? 0.2106 0.2474 0.2834 0.0136 -0.0205 -0.0221 156 VAL D CG1 6069 C CG2 . VAL D 156 ? 0.3642 0.4008 0.4379 0.0060 -0.0192 -0.0316 156 VAL D CG2 6070 N N . THR D 157 ? 0.1252 0.1818 0.1973 0.0101 -0.0297 -0.0323 157 THR D N 6071 C CA . THR D 157 ? 0.2605 0.3264 0.3369 0.0122 -0.0339 -0.0305 157 THR D CA 6072 C C . THR D 157 ? 0.2357 0.3036 0.3215 0.0098 -0.0331 -0.0302 157 THR D C 6073 O O . THR D 157 ? 0.2925 0.3572 0.3818 0.0055 -0.0307 -0.0339 157 THR D O 6074 C CB . THR D 157 ? 0.2412 0.3150 0.3156 0.0120 -0.0393 -0.0351 157 THR D CB 6075 O OG1 . THR D 157 ? 0.3619 0.4378 0.4422 0.0062 -0.0397 -0.0421 157 THR D OG1 6076 C CG2 . THR D 157 ? 0.1377 0.2071 0.1994 0.0146 -0.0395 -0.0356 157 THR D CG2 6077 N N . VAL D 158 ? 0.1838 0.2553 0.2732 0.0126 -0.0339 -0.0257 158 VAL D N 6078 C CA . VAL D 158 ? 0.1765 0.2484 0.2734 0.0108 -0.0322 -0.0250 158 VAL D CA 6079 C C . VAL D 158 ? 0.2856 0.3668 0.3883 0.0135 -0.0349 -0.0232 158 VAL D C 6080 O O . VAL D 158 ? 0.3702 0.4529 0.4696 0.0179 -0.0359 -0.0190 158 VAL D O 6081 C CB . VAL D 158 ? 0.1792 0.2430 0.2739 0.0115 -0.0289 -0.0209 158 VAL D CB 6082 C CG1 . VAL D 158 ? 0.0982 0.1607 0.1979 0.0098 -0.0268 -0.0203 158 VAL D CG1 6083 C CG2 . VAL D 158 ? 0.1042 0.1592 0.1935 0.0101 -0.0266 -0.0219 158 VAL D CG2 6084 N N . SER D 159 ? 0.2231 0.3101 0.3351 0.0111 -0.0354 -0.0262 159 SER D N 6085 C CA . SER D 159 ? 0.2002 0.2958 0.3201 0.0139 -0.0372 -0.0240 159 SER D CA 6086 C C . SER D 159 ? 0.2110 0.3034 0.3389 0.0111 -0.0321 -0.0238 159 SER D C 6087 O O . SER D 159 ? 0.3026 0.3862 0.4288 0.0071 -0.0278 -0.0257 159 SER D O 6088 C CB . SER D 159 ? 0.2390 0.3472 0.3647 0.0144 -0.0434 -0.0281 159 SER D CB 6089 O OG . SER D 159 ? 0.2836 0.3939 0.4179 0.0086 -0.0427 -0.0347 159 SER D OG 6090 N N . TRP D 160 ? 0.2223 0.3207 0.3581 0.0137 -0.0319 -0.0212 160 TRP D N 6091 C CA . TRP D 160 ? 0.1660 0.2601 0.3086 0.0117 -0.0259 -0.0205 160 TRP D CA 6092 C C . TRP D 160 ? 0.2133 0.3192 0.3716 0.0121 -0.0269 -0.0223 160 TRP D C 6093 O O . TRP D 160 ? 0.3111 0.4273 0.4734 0.0171 -0.0315 -0.0200 160 TRP D O 6094 C CB . TRP D 160 ? 0.2002 0.2872 0.3373 0.0145 -0.0225 -0.0149 160 TRP D CB 6095 C CG . TRP D 160 ? 0.2659 0.3412 0.3913 0.0129 -0.0207 -0.0141 160 TRP D CG 6096 C CD1 . TRP D 160 ? 0.2578 0.3314 0.3753 0.0149 -0.0233 -0.0123 160 TRP D CD1 6097 C CD2 . TRP D 160 ? 0.2883 0.3519 0.4090 0.0093 -0.0163 -0.0152 160 TRP D CD2 6098 N NE1 . TRP D 160 ? 0.1331 0.1967 0.2435 0.0128 -0.0215 -0.0123 160 TRP D NE1 6099 C CE2 . TRP D 160 ? 0.3325 0.3895 0.4432 0.0097 -0.0177 -0.0139 160 TRP D CE2 6100 C CE3 . TRP D 160 ? 0.2736 0.3312 0.3971 0.0063 -0.0108 -0.0169 160 TRP D CE3 6101 C CZ2 . TRP D 160 ? 0.3261 0.3717 0.4289 0.0076 -0.0154 -0.0143 160 TRP D CZ2 6102 C CZ3 . TRP D 160 ? 0.3342 0.3781 0.4473 0.0042 -0.0074 -0.0170 160 TRP D CZ3 6103 C CH2 . TRP D 160 ? 0.2875 0.3260 0.3900 0.0051 -0.0104 -0.0157 160 TRP D CH2 6104 N N . ASN D 161 ? 0.1886 0.2926 0.3559 0.0073 -0.0223 -0.0263 161 ASN D N 6105 C CA . ASN D 161 ? 0.2034 0.3193 0.3896 0.0067 -0.0223 -0.0290 161 ASN D CA 6106 C C . ASN D 161 ? 0.2001 0.3327 0.3930 0.0087 -0.0323 -0.0322 161 ASN D C 6107 O O . ASN D 161 ? 0.0926 0.2378 0.2951 0.0135 -0.0367 -0.0303 161 ASN D O 6108 C CB . ASN D 161 ? 0.0911 0.2075 0.2841 0.0105 -0.0180 -0.0238 161 ASN D CB 6109 C CG . ASN D 161 ? 0.1944 0.2937 0.3800 0.0080 -0.0083 -0.0218 161 ASN D CG 6110 O OD1 . ASN D 161 ? 0.2484 0.3370 0.4282 0.0033 -0.0040 -0.0248 161 ASN D OD1 6111 N ND2 . ASN D 161 ? 0.1797 0.2753 0.3643 0.0114 -0.0044 -0.0167 161 ASN D ND2 6112 N N . SER D 162 ? 0.2601 0.3917 0.4462 0.0055 -0.0359 -0.0370 162 SER D N 6113 C CA . SER D 162 ? 0.2257 0.3711 0.4152 0.0061 -0.0455 -0.0417 162 SER D CA 6114 C C . SER D 162 ? 0.2583 0.4107 0.4401 0.0143 -0.0528 -0.0364 162 SER D C 6115 O O . SER D 162 ? 0.2908 0.4571 0.4774 0.0171 -0.0616 -0.0388 162 SER D O 6116 C CB . SER D 162 ? 0.0998 0.2592 0.3120 0.0027 -0.0472 -0.0481 162 SER D CB 6117 O OG . SER D 162 ? 0.3779 0.5287 0.5970 -0.0046 -0.0383 -0.0527 162 SER D OG 6118 N N . GLY D 163 ? 0.2651 0.4072 0.4343 0.0183 -0.0490 -0.0292 163 GLY D N 6119 C CA . GLY D 163 ? 0.1017 0.2467 0.2619 0.0262 -0.0533 -0.0234 163 GLY D CA 6120 C C . GLY D 163 ? 0.2591 0.4086 0.4274 0.0319 -0.0514 -0.0173 163 GLY D C 6121 O O . GLY D 163 ? 0.3894 0.5379 0.5490 0.0389 -0.0525 -0.0113 163 GLY D O 6122 N N . ALA D 164 ? 0.2795 0.4325 0.4642 0.0294 -0.0473 -0.0185 164 ALA D N 6123 C CA . ALA D 164 ? 0.1981 0.3555 0.3922 0.0351 -0.0446 -0.0128 164 ALA D CA 6124 C C . ALA D 164 ? 0.2976 0.4402 0.4816 0.0367 -0.0361 -0.0064 164 ALA D C 6125 O O . ALA D 164 ? 0.3167 0.4604 0.5043 0.0425 -0.0333 -0.0006 164 ALA D O 6126 C CB . ALA D 164 ? 0.0937 0.2581 0.3093 0.0316 -0.0412 -0.0162 164 ALA D CB 6127 N N . LEU D 165 ? 0.3123 0.4413 0.4844 0.0319 -0.0320 -0.0075 165 LEU D N 6128 C CA . LEU D 165 ? 0.2491 0.3645 0.4125 0.0321 -0.0248 -0.0030 165 LEU D CA 6129 C C . LEU D 165 ? 0.2591 0.3689 0.4074 0.0338 -0.0270 -0.0012 165 LEU D C 6130 O O . LEU D 165 ? 0.3450 0.4506 0.4864 0.0298 -0.0286 -0.0047 165 LEU D O 6131 C CB . LEU D 165 ? 0.0906 0.1947 0.2536 0.0253 -0.0181 -0.0059 165 LEU D CB 6132 C CG . LEU D 165 ? 0.0916 0.1817 0.2452 0.0246 -0.0117 -0.0027 165 LEU D CG 6133 C CD1 . LEU D 165 ? 0.1085 0.1987 0.2670 0.0293 -0.0071 0.0023 165 LEU D CD1 6134 C CD2 . LEU D 165 ? 0.0932 0.1719 0.2441 0.0185 -0.0064 -0.0059 165 LEU D CD2 6135 N N . THR D 166 ? 0.2353 0.3442 0.3790 0.0400 -0.0259 0.0044 166 THR D N 6136 C CA . THR D 166 ? 0.2426 0.3460 0.3735 0.0422 -0.0265 0.0065 166 THR D CA 6137 C C . THR D 166 ? 0.3135 0.4060 0.4404 0.0430 -0.0191 0.0107 166 THR D C 6138 O O . THR D 166 ? 0.3561 0.4412 0.4760 0.0405 -0.0176 0.0100 166 THR D O 6139 C CB . THR D 166 ? 0.2597 0.3709 0.3861 0.0497 -0.0321 0.0092 166 THR D CB 6140 O OG1 . THR D 166 ? 0.2926 0.4077 0.4246 0.0562 -0.0302 0.0144 166 THR D OG1 6141 C CG2 . THR D 166 ? 0.1617 0.2835 0.2907 0.0481 -0.0407 0.0036 166 THR D CG2 6142 N N . SER D 167 ? 0.3284 0.4199 0.4605 0.0463 -0.0141 0.0147 167 SER D N 6143 C CA . SER D 167 ? 0.3803 0.4611 0.5089 0.0465 -0.0063 0.0179 167 SER D CA 6144 C C . SER D 167 ? 0.3073 0.3792 0.4351 0.0387 -0.0033 0.0139 167 SER D C 6145 O O . SER D 167 ? 0.2247 0.2966 0.3570 0.0349 -0.0030 0.0110 167 SER D O 6146 C CB . SER D 167 ? 0.3226 0.4034 0.4570 0.0519 -0.0007 0.0230 167 SER D CB 6147 O OG . SER D 167 ? 0.3928 0.4784 0.5374 0.0502 -0.0006 0.0213 167 SER D OG 6148 N N . GLY D 168 ? 0.2575 0.3220 0.3798 0.0367 -0.0010 0.0137 168 GLY D N 6149 C CA . GLY D 168 ? 0.2124 0.2693 0.3326 0.0300 -0.0001 0.0098 168 GLY D CA 6150 C C . GLY D 168 ? 0.2453 0.3037 0.3618 0.0266 -0.0060 0.0060 168 GLY D C 6151 O O . GLY D 168 ? 0.3845 0.4368 0.4981 0.0221 -0.0063 0.0032 168 GLY D O 6152 N N . VAL D 169 ? 0.1746 0.2404 0.2905 0.0289 -0.0109 0.0058 169 VAL D N 6153 C CA . VAL D 169 ? 0.1666 0.2330 0.2790 0.0260 -0.0154 0.0023 169 VAL D CA 6154 C C . VAL D 169 ? 0.2030 0.2669 0.3115 0.0268 -0.0156 0.0031 169 VAL D C 6155 O O . VAL D 169 ? 0.2480 0.3134 0.3551 0.0312 -0.0143 0.0061 169 VAL D O 6156 C CB . VAL D 169 ? 0.0917 0.1664 0.2055 0.0272 -0.0200 0.0006 169 VAL D CB 6157 C CG1 . VAL D 169 ? 0.0909 0.1647 0.2003 0.0245 -0.0234 -0.0029 169 VAL D CG1 6158 C CG2 . VAL D 169 ? 0.2913 0.3690 0.4123 0.0256 -0.0192 -0.0009 169 VAL D CG2 6159 N N . HIS D 170 ? 0.0911 0.1507 0.1980 0.0231 -0.0167 0.0006 170 HIS D N 6160 C CA . HIS D 170 ? 0.1025 0.1610 0.2084 0.0236 -0.0171 0.0008 170 HIS D CA 6161 C C . HIS D 170 ? 0.2156 0.2740 0.3185 0.0216 -0.0210 -0.0020 170 HIS D C 6162 O O . HIS D 170 ? 0.1824 0.2372 0.2842 0.0185 -0.0223 -0.0040 170 HIS D O 6163 C CB . HIS D 170 ? 0.1334 0.1873 0.2426 0.0214 -0.0148 0.0007 170 HIS D CB 6164 C CG . HIS D 170 ? 0.2634 0.3155 0.3756 0.0230 -0.0093 0.0031 170 HIS D CG 6165 N ND1 . HIS D 170 ? 0.2530 0.3058 0.3654 0.0274 -0.0055 0.0066 170 HIS D ND1 6166 C CD2 . HIS D 170 ? 0.0960 0.1439 0.2100 0.0208 -0.0062 0.0027 170 HIS D CD2 6167 C CE1 . HIS D 170 ? 0.1334 0.1827 0.2484 0.0282 0.0001 0.0086 170 HIS D CE1 6168 N NE2 . HIS D 170 ? 0.1276 0.1741 0.2441 0.0239 -0.0002 0.0060 170 HIS D NE2 6169 N N . THR D 171 ? 0.2525 0.3134 0.3525 0.0237 -0.0221 -0.0019 171 THR D N 6170 C CA . THR D 171 ? 0.1761 0.2356 0.2733 0.0223 -0.0243 -0.0043 171 THR D CA 6171 C C . THR D 171 ? 0.1558 0.2132 0.2543 0.0235 -0.0228 -0.0030 171 THR D C 6172 O O . THR D 171 ? 0.2638 0.3217 0.3613 0.0266 -0.0204 -0.0012 171 THR D O 6173 C CB . THR D 171 ? 0.2000 0.2628 0.2932 0.0231 -0.0261 -0.0061 171 THR D CB 6174 O OG1 . THR D 171 ? 0.3027 0.3689 0.3984 0.0215 -0.0274 -0.0078 171 THR D OG1 6175 C CG2 . THR D 171 ? 0.1247 0.1843 0.2147 0.0214 -0.0268 -0.0087 171 THR D CG2 6176 N N . PHE D 172 ? 0.1927 0.2476 0.2936 0.0217 -0.0241 -0.0039 172 PHE D N 6177 C CA . PHE D 172 ? 0.2479 0.3025 0.3541 0.0227 -0.0229 -0.0029 172 PHE D CA 6178 C C . PHE D 172 ? 0.2784 0.3319 0.3820 0.0246 -0.0219 -0.0029 172 PHE D C 6179 O O . PHE D 172 ? 0.2380 0.2900 0.3356 0.0240 -0.0232 -0.0046 172 PHE D O 6180 C CB . PHE D 172 ? 0.0912 0.1446 0.2010 0.0207 -0.0261 -0.0041 172 PHE D CB 6181 C CG . PHE D 172 ? 0.2092 0.2621 0.3211 0.0185 -0.0264 -0.0046 172 PHE D CG 6182 C CD1 . PHE D 172 ? 0.1261 0.1761 0.2320 0.0167 -0.0274 -0.0057 172 PHE D CD1 6183 C CD2 . PHE D 172 ? 0.1734 0.2279 0.2937 0.0181 -0.0244 -0.0043 172 PHE D CD2 6184 C CE1 . PHE D 172 ? 0.1688 0.2168 0.2755 0.0146 -0.0266 -0.0063 172 PHE D CE1 6185 C CE2 . PHE D 172 ? 0.0914 0.1443 0.2131 0.0156 -0.0239 -0.0054 172 PHE D CE2 6186 C CZ . PHE D 172 ? 0.2343 0.2836 0.3485 0.0140 -0.0251 -0.0063 172 PHE D CZ 6187 N N . PRO D 173 ? 0.2528 0.3062 0.3613 0.0266 -0.0185 -0.0013 173 PRO D N 6188 C CA . PRO D 173 ? 0.0996 0.1505 0.2062 0.0284 -0.0165 -0.0013 173 PRO D CA 6189 C C . PRO D 173 ? 0.2228 0.2726 0.3308 0.0275 -0.0197 -0.0024 173 PRO D C 6190 O O . PRO D 173 ? 0.3421 0.3937 0.4558 0.0265 -0.0230 -0.0025 173 PRO D O 6191 C CB . PRO D 173 ? 0.1010 0.1518 0.2159 0.0305 -0.0113 0.0008 173 PRO D CB 6192 C CG . PRO D 173 ? 0.1067 0.1589 0.2242 0.0302 -0.0097 0.0019 173 PRO D CG 6193 C CD . PRO D 173 ? 0.2377 0.2922 0.3544 0.0272 -0.0151 0.0003 173 PRO D CD 6194 N N . ALA D 174 ? 0.2104 0.2564 0.3120 0.0281 -0.0185 -0.0034 174 ALA D N 6195 C CA . ALA D 174 ? 0.2431 0.2863 0.3448 0.0282 -0.0201 -0.0037 174 ALA D CA 6196 C C . ALA D 174 ? 0.2691 0.3138 0.3813 0.0309 -0.0193 -0.0016 174 ALA D C 6197 O O . ALA D 174 ? 0.1975 0.2432 0.3155 0.0326 -0.0150 -0.0003 174 ALA D O 6198 C CB . ALA D 174 ? 0.1921 0.2297 0.2847 0.0278 -0.0177 -0.0056 174 ALA D CB 6199 N N . VAL D 175 ? 0.2013 0.2461 0.3163 0.0316 -0.0233 -0.0011 175 VAL D N 6200 C CA . VAL D 175 ? 0.1384 0.1861 0.2649 0.0347 -0.0241 0.0009 175 VAL D CA 6201 C C . VAL D 175 ? 0.1838 0.2256 0.3057 0.0375 -0.0226 0.0020 175 VAL D C 6202 O O . VAL D 175 ? 0.2015 0.2372 0.3120 0.0366 -0.0232 0.0010 175 VAL D O 6203 C CB . VAL D 175 ? 0.2421 0.2955 0.3761 0.0343 -0.0312 0.0007 175 VAL D CB 6204 C CG1 . VAL D 175 ? 0.1472 0.2048 0.2852 0.0310 -0.0313 -0.0008 175 VAL D CG1 6205 C CG2 . VAL D 175 ? 0.3422 0.3908 0.4650 0.0342 -0.0362 0.0003 175 VAL D CG2 6206 N N . LEU D 176 ? 0.2003 0.2430 0.3316 0.0411 -0.0194 0.0040 176 LEU D N 6207 C CA . LEU D 176 ? 0.1910 0.2276 0.3195 0.0447 -0.0168 0.0057 176 LEU D CA 6208 C C . LEU D 176 ? 0.1929 0.2326 0.3267 0.0482 -0.0238 0.0079 176 LEU D C 6209 O O . LEU D 176 ? 0.3048 0.3532 0.4541 0.0506 -0.0272 0.0092 176 LEU D O 6210 C CB . LEU D 176 ? 0.2176 0.2527 0.3535 0.0473 -0.0090 0.0071 176 LEU D CB 6211 C CG . LEU D 176 ? 0.2220 0.2496 0.3558 0.0514 -0.0045 0.0092 176 LEU D CG 6212 C CD1 . LEU D 176 ? 0.2090 0.2261 0.3249 0.0490 -0.0020 0.0070 176 LEU D CD1 6213 C CD2 . LEU D 176 ? 0.1398 0.1653 0.2813 0.0538 0.0044 0.0105 176 LEU D CD2 6214 N N . GLN D 177 ? 0.2388 0.2715 0.3598 0.0487 -0.0261 0.0081 177 GLN D N 6215 C CA . GLN D 177 ? 0.1388 0.1724 0.2604 0.0531 -0.0331 0.0106 177 GLN D CA 6216 C C . GLN D 177 ? 0.1454 0.1785 0.2752 0.0597 -0.0309 0.0144 177 GLN D C 6217 O O . GLN D 177 ? 0.2005 0.2291 0.3317 0.0605 -0.0224 0.0150 177 GLN D O 6218 C CB . GLN D 177 ? 0.1465 0.1696 0.2499 0.0524 -0.0339 0.0103 177 GLN D CB 6219 C CG . GLN D 177 ? 0.1717 0.1955 0.2683 0.0468 -0.0368 0.0070 177 GLN D CG 6220 C CD . GLN D 177 ? 0.2690 0.2808 0.3488 0.0453 -0.0339 0.0063 177 GLN D CD 6221 O OE1 . GLN D 177 ? 0.3083 0.3173 0.3801 0.0442 -0.0379 0.0057 177 GLN D OE1 6222 N NE2 . GLN D 177 ? 0.3219 0.3257 0.3964 0.0449 -0.0261 0.0059 177 GLN D NE2 6223 N N . SER D 178 ? 0.1507 0.1882 0.2853 0.0649 -0.0388 0.0171 178 SER D N 6224 C CA . SER D 178 ? 0.3069 0.3454 0.4511 0.0725 -0.0379 0.0214 178 SER D CA 6225 C C . SER D 178 ? 0.3032 0.3266 0.4333 0.0757 -0.0296 0.0240 178 SER D C 6226 O O . SER D 178 ? 0.4278 0.4496 0.5656 0.0812 -0.0246 0.0275 178 SER D O 6227 C CB . SER D 178 ? 0.5398 0.5864 0.6900 0.0780 -0.0501 0.0235 178 SER D CB 6228 O OG . SER D 178 ? 0.6545 0.6918 0.7842 0.0789 -0.0547 0.0241 178 SER D OG 6229 N N . SER D 179 ? 0.2667 0.2788 0.3778 0.0721 -0.0269 0.0222 179 SER D N 6230 C CA . SER D 179 ? 0.3076 0.3042 0.4054 0.0738 -0.0178 0.0235 179 SER D CA 6231 C C . SER D 179 ? 0.4430 0.4349 0.5407 0.0690 -0.0071 0.0203 179 SER D C 6232 O O . SER D 179 ? 0.4256 0.4043 0.5127 0.0689 0.0014 0.0200 179 SER D O 6233 C CB . SER D 179 ? 0.2868 0.2728 0.3657 0.0715 -0.0184 0.0223 179 SER D CB 6234 O OG . SER D 179 ? 0.3371 0.3252 0.4127 0.0630 -0.0179 0.0169 179 SER D OG 6235 N N . GLY D 180 ? 0.3659 0.3671 0.4738 0.0651 -0.0071 0.0177 180 GLY D N 6236 C CA . GLY D 180 ? 0.1688 0.1650 0.2736 0.0607 0.0018 0.0143 180 GLY D CA 6237 C C . GLY D 180 ? 0.1659 0.1586 0.2582 0.0533 0.0025 0.0090 180 GLY D C 6238 O O . GLY D 180 ? 0.1667 0.1557 0.2547 0.0495 0.0085 0.0055 180 GLY D O 6239 N N . LEU D 181 ? 0.2456 0.2394 0.3320 0.0513 -0.0036 0.0082 181 LEU D N 6240 C CA . LEU D 181 ? 0.2328 0.2249 0.3104 0.0446 -0.0034 0.0034 181 LEU D CA 6241 C C . LEU D 181 ? 0.2628 0.2666 0.3465 0.0417 -0.0098 0.0022 181 LEU D C 6242 O O . LEU D 181 ? 0.3230 0.3344 0.4149 0.0442 -0.0159 0.0046 181 LEU D O 6243 C CB . LEU D 181 ? 0.2937 0.2771 0.3605 0.0443 -0.0035 0.0034 181 LEU D CB 6244 C CG . LEU D 181 ? 0.2935 0.2629 0.3527 0.0474 0.0042 0.0050 181 LEU D CG 6245 C CD1 . LEU D 181 ? 0.1912 0.1509 0.2390 0.0474 0.0047 0.0054 181 LEU D CD1 6246 C CD2 . LEU D 181 ? 0.1856 0.1492 0.2422 0.0430 0.0128 0.0004 181 LEU D CD2 6247 N N . TYR D 182 ? 0.2003 0.2054 0.2802 0.0365 -0.0086 -0.0019 182 TYR D N 6248 C CA . TYR D 182 ? 0.1342 0.1487 0.2187 0.0340 -0.0132 -0.0029 182 TYR D CA 6249 C C . TYR D 182 ? 0.2522 0.2671 0.3324 0.0316 -0.0177 -0.0037 182 TYR D C 6250 O O . TYR D 182 ? 0.3101 0.3173 0.3825 0.0309 -0.0161 -0.0045 182 TYR D O 6251 C CB . TYR D 182 ? 0.1325 0.1484 0.2142 0.0308 -0.0102 -0.0061 182 TYR D CB 6252 C CG . TYR D 182 ? 0.2755 0.2917 0.3614 0.0333 -0.0060 -0.0049 182 TYR D CG 6253 C CD1 . TYR D 182 ? 0.2738 0.2969 0.3682 0.0347 -0.0071 -0.0029 182 TYR D CD1 6254 C CD2 . TYR D 182 ? 0.3165 0.3246 0.3977 0.0342 0.0005 -0.0058 182 TYR D CD2 6255 C CE1 . TYR D 182 ? 0.2723 0.2942 0.3706 0.0371 -0.0016 -0.0016 182 TYR D CE1 6256 C CE2 . TYR D 182 ? 0.2479 0.2545 0.3321 0.0367 0.0056 -0.0045 182 TYR D CE2 6257 C CZ . TYR D 182 ? 0.1962 0.2097 0.2890 0.0383 0.0047 -0.0023 182 TYR D CZ 6258 O OH . TYR D 182 ? 0.3434 0.3541 0.4392 0.0409 0.0114 -0.0009 182 TYR D OH 6259 N N . SER D 183 ? 0.1244 0.1471 0.2097 0.0304 -0.0221 -0.0037 183 SER D N 6260 C CA . SER D 183 ? 0.1229 0.1456 0.2044 0.0280 -0.0255 -0.0046 183 SER D CA 6261 C C . SER D 183 ? 0.1144 0.1452 0.2017 0.0260 -0.0276 -0.0052 183 SER D C 6262 O O . SER D 183 ? 0.1586 0.1951 0.2544 0.0275 -0.0282 -0.0039 183 SER D O 6263 C CB . SER D 183 ? 0.2924 0.3124 0.3721 0.0309 -0.0300 -0.0022 183 SER D CB 6264 O OG . SER D 183 ? 0.3147 0.3322 0.3882 0.0286 -0.0322 -0.0033 183 SER D OG 6265 N N . LEU D 184 ? 0.1759 0.2069 0.2596 0.0228 -0.0276 -0.0072 184 LEU D N 6266 C CA . LEU D 184 ? 0.1953 0.2325 0.2836 0.0215 -0.0289 -0.0072 184 LEU D CA 6267 C C . LEU D 184 ? 0.1625 0.1974 0.2467 0.0190 -0.0298 -0.0083 184 LEU D C 6268 O O . LEU D 184 ? 0.1121 0.1403 0.1897 0.0182 -0.0289 -0.0092 184 LEU D O 6269 C CB . LEU D 184 ? 0.2336 0.2748 0.3229 0.0213 -0.0264 -0.0080 184 LEU D CB 6270 C CG . LEU D 184 ? 0.2860 0.3265 0.3702 0.0192 -0.0249 -0.0109 184 LEU D CG 6271 C CD1 . LEU D 184 ? 0.1024 0.1458 0.1873 0.0170 -0.0259 -0.0120 184 LEU D CD1 6272 C CD2 . LEU D 184 ? 0.2977 0.3406 0.3808 0.0206 -0.0233 -0.0113 184 LEU D CD2 6273 N N . SER D 185 ? 0.1742 0.2135 0.2622 0.0180 -0.0304 -0.0082 185 SER D N 6274 C CA . SER D 185 ? 0.1422 0.1792 0.2273 0.0157 -0.0300 -0.0091 185 SER D CA 6275 C C . SER D 185 ? 0.1675 0.2103 0.2571 0.0152 -0.0283 -0.0090 185 SER D C 6276 O O . SER D 185 ? 0.1493 0.1969 0.2432 0.0170 -0.0279 -0.0077 185 SER D O 6277 C CB . SER D 185 ? 0.1056 0.1398 0.1896 0.0154 -0.0327 -0.0087 185 SER D CB 6278 O OG . SER D 185 ? 0.5677 0.5969 0.6467 0.0170 -0.0355 -0.0082 185 SER D OG 6279 N N . SER D 186 ? 0.0981 0.1400 0.1866 0.0135 -0.0266 -0.0101 186 SER D N 6280 C CA . SER D 186 ? 0.1925 0.2401 0.2856 0.0138 -0.0253 -0.0096 186 SER D CA 6281 C C . SER D 186 ? 0.2076 0.2512 0.3003 0.0121 -0.0233 -0.0096 186 SER D C 6282 O O . SER D 186 ? 0.1941 0.2317 0.2829 0.0101 -0.0218 -0.0111 186 SER D O 6283 C CB . SER D 186 ? 0.0942 0.1465 0.1888 0.0136 -0.0253 -0.0114 186 SER D CB 6284 O OG . SER D 186 ? 0.1173 0.1762 0.2165 0.0152 -0.0251 -0.0103 186 SER D OG 6285 N N . VAL D 187 ? 0.2128 0.2579 0.3086 0.0129 -0.0221 -0.0079 187 VAL D N 6286 C CA . VAL D 187 ? 0.2017 0.2416 0.2964 0.0112 -0.0193 -0.0079 187 VAL D CA 6287 C C . VAL D 187 ? 0.2322 0.2769 0.3331 0.0129 -0.0162 -0.0061 187 VAL D C 6288 O O . VAL D 187 ? 0.3270 0.3787 0.4317 0.0159 -0.0169 -0.0043 187 VAL D O 6289 C CB . VAL D 187 ? 0.1451 0.1801 0.2372 0.0101 -0.0204 -0.0082 187 VAL D CB 6290 C CG1 . VAL D 187 ? 0.1052 0.1362 0.1913 0.0096 -0.0246 -0.0096 187 VAL D CG1 6291 C CG2 . VAL D 187 ? 0.0975 0.1377 0.1962 0.0117 -0.0200 -0.0066 187 VAL D CG2 6292 N N . VAL D 188 ? 0.2669 0.3069 0.3678 0.0116 -0.0122 -0.0062 188 VAL D N 6293 C CA . VAL D 188 ? 0.2405 0.2840 0.3478 0.0137 -0.0084 -0.0039 188 VAL D CA 6294 C C . VAL D 188 ? 0.1739 0.2079 0.2784 0.0115 -0.0032 -0.0042 188 VAL D C 6295 O O . VAL D 188 ? 0.2251 0.2505 0.3228 0.0085 -0.0024 -0.0065 188 VAL D O 6296 C CB . VAL D 188 ? 0.3501 0.4013 0.4641 0.0150 -0.0086 -0.0041 188 VAL D CB 6297 C CG1 . VAL D 188 ? 0.1745 0.2200 0.2869 0.0115 -0.0066 -0.0071 188 VAL D CG1 6298 C CG2 . VAL D 188 ? 0.0959 0.1519 0.2176 0.0185 -0.0053 -0.0011 188 VAL D CG2 6299 N N . THR D 189 ? 0.1595 0.1935 0.2678 0.0133 0.0008 -0.0018 189 THR D N 6300 C CA . THR D 189 ? 0.1646 0.1889 0.2705 0.0114 0.0070 -0.0022 189 THR D CA 6301 C C . THR D 189 ? 0.2501 0.2763 0.3630 0.0135 0.0124 -0.0002 189 THR D C 6302 O O . THR D 189 ? 0.2182 0.2543 0.3396 0.0180 0.0119 0.0029 189 THR D O 6303 C CB . THR D 189 ? 0.1758 0.1971 0.2822 0.0115 0.0098 -0.0013 189 THR D CB 6304 O OG1 . THR D 189 ? 0.2673 0.2971 0.3804 0.0164 0.0100 0.0026 189 THR D OG1 6305 C CG2 . THR D 189 ? 0.1164 0.1344 0.2173 0.0080 0.0050 -0.0046 189 THR D CG2 6306 N N . VAL D 190 ? 0.2111 0.2279 0.3204 0.0108 0.0174 -0.0018 190 VAL D N 6307 C CA . VAL D 190 ? 0.2325 0.2507 0.3505 0.0125 0.0236 -0.0002 190 VAL D CA 6308 C C . VAL D 190 ? 0.2911 0.2949 0.4035 0.0103 0.0323 -0.0006 190 VAL D C 6309 O O . VAL D 190 ? 0.1400 0.1321 0.2396 0.0065 0.0322 -0.0035 190 VAL D O 6310 C CB . VAL D 190 ? 0.1201 0.1412 0.2413 0.0110 0.0223 -0.0024 190 VAL D CB 6311 C CG1 . VAL D 190 ? 0.1114 0.1447 0.2358 0.0122 0.0137 -0.0031 190 VAL D CG1 6312 C CG2 . VAL D 190 ? 0.1297 0.1356 0.2374 0.0065 0.0249 -0.0057 190 VAL D CG2 6313 N N . PRO D 191 ? 0.2288 0.2329 0.3504 0.0129 0.0398 0.0020 191 PRO D N 6314 C CA . PRO D 191 ? 0.2547 0.2432 0.3704 0.0106 0.0498 0.0013 191 PRO D CA 6315 C C . PRO D 191 ? 0.3578 0.3340 0.4625 0.0062 0.0521 -0.0025 191 PRO D C 6316 O O . PRO D 191 ? 0.3189 0.2996 0.4292 0.0062 0.0515 -0.0030 191 PRO D O 6317 C CB . PRO D 191 ? 0.1462 0.1405 0.2774 0.0154 0.0570 0.0056 191 PRO D CB 6318 C CG . PRO D 191 ? 0.1652 0.1778 0.3079 0.0208 0.0497 0.0089 191 PRO D CG 6319 C CD . PRO D 191 ? 0.1276 0.1465 0.2655 0.0185 0.0395 0.0059 191 PRO D CD 6320 N N . SER D 192 ? 0.3340 0.2935 0.4221 0.0023 0.0548 -0.0053 192 SER D N 6321 C CA . SER D 192 ? 0.1817 0.1267 0.2547 -0.0011 0.0567 -0.0086 192 SER D CA 6322 C C . SER D 192 ? 0.2418 0.1812 0.3208 -0.0006 0.0673 -0.0077 192 SER D C 6323 O O . SER D 192 ? 0.1921 0.1255 0.2653 -0.0020 0.0686 -0.0093 192 SER D O 6324 C CB . SER D 192 ? 0.2745 0.2022 0.3278 -0.0048 0.0579 -0.0121 192 SER D CB 6325 O OG . SER D 192 ? 0.5423 0.4750 0.5901 -0.0060 0.0471 -0.0141 192 SER D OG 6326 N N . SER D 193 ? 0.2792 0.2201 0.3705 0.0017 0.0758 -0.0049 193 SER D N 6327 C CA . SER D 193 ? 0.2850 0.2203 0.3843 0.0022 0.0873 -0.0040 193 SER D CA 6328 C C . SER D 193 ? 0.2297 0.1826 0.3498 0.0045 0.0847 -0.0028 193 SER D C 6329 O O . SER D 193 ? 0.2737 0.2252 0.4056 0.0050 0.0941 -0.0022 193 SER D O 6330 C CB . SER D 193 ? 0.3346 0.2651 0.4411 0.0044 0.0979 -0.0011 193 SER D CB 6331 O OG . SER D 193 ? 0.3249 0.2736 0.4486 0.0093 0.0937 0.0029 193 SER D OG 6332 N N . SER D 194 ? 0.2037 0.1731 0.3293 0.0057 0.0728 -0.0029 194 SER D N 6333 C CA . SER D 194 ? 0.2608 0.2466 0.4043 0.0069 0.0691 -0.0032 194 SER D CA 6334 C C . SER D 194 ? 0.2702 0.2525 0.4044 0.0033 0.0647 -0.0068 194 SER D C 6335 O O . SER D 194 ? 0.2687 0.2634 0.4166 0.0033 0.0616 -0.0082 194 SER D O 6336 C CB . SER D 194 ? 0.2539 0.2608 0.4110 0.0114 0.0596 -0.0005 194 SER D CB 6337 O OG . SER D 194 ? 0.2515 0.2606 0.3967 0.0107 0.0496 -0.0014 194 SER D OG 6338 N N . LEU D 195 ? 0.3103 0.3130 0.4299 0.0744 0.0817 0.0363 195 LEU D N 6339 C CA . LEU D 195 ? 0.3885 0.3979 0.4994 0.0593 0.0700 0.0332 195 LEU D CA 6340 C C . LEU D 195 ? 0.4487 0.4772 0.5578 0.0551 0.0731 0.0322 195 LEU D C 6341 O O . LEU D 195 ? 0.5654 0.6024 0.6704 0.0445 0.0666 0.0331 195 LEU D O 6342 C CB . LEU D 195 ? 0.3526 0.3372 0.4483 0.0504 0.0658 0.0218 195 LEU D CB 6343 C CG . LEU D 195 ? 0.3830 0.3519 0.4861 0.0485 0.0628 0.0195 195 LEU D CG 6344 C CD1 . LEU D 195 ? 0.3838 0.3382 0.4773 0.0397 0.0558 0.0034 195 LEU D CD1 6345 C CD2 . LEU D 195 ? 0.3285 0.3100 0.4378 0.0465 0.0542 0.0297 195 LEU D CD2 6346 N N . GLY D 196 ? 0.2042 0.2370 0.3168 0.0628 0.0857 0.0301 196 GLY D N 6347 C CA . GLY D 196 ? 0.3353 0.3845 0.4485 0.0575 0.0936 0.0283 196 GLY D CA 6348 C C . GLY D 196 ? 0.3624 0.4520 0.5046 0.0602 0.0942 0.0322 196 GLY D C 6349 O O . GLY D 196 ? 0.4764 0.5826 0.6249 0.0486 0.0976 0.0299 196 GLY D O 6350 N N . THR D 197 ? 0.3278 0.4331 0.4874 0.0762 0.0916 0.0369 197 THR D N 6351 C CA . THR D 197 ? 0.3133 0.4639 0.5022 0.0841 0.0898 0.0375 197 THR D CA 6352 C C . THR D 197 ? 0.3126 0.4816 0.5092 0.0856 0.0733 0.0414 197 THR D C 6353 O O . THR D 197 ? 0.2878 0.4971 0.5074 0.0827 0.0677 0.0365 197 THR D O 6354 C CB . THR D 197 ? 0.3553 0.5137 0.5533 0.1069 0.0972 0.0394 197 THR D CB 6355 O OG1 . THR D 197 ? 0.5240 0.6468 0.7024 0.1177 0.0952 0.0459 197 THR D OG1 6356 C CG2 . THR D 197 ? 0.3865 0.5375 0.5828 0.1062 0.1152 0.0337 197 THR D CG2 6357 N N . GLN D 198 ? 0.2658 0.4074 0.4451 0.0895 0.0664 0.0481 198 GLN D N 6358 C CA . GLN D 198 ? 0.3258 0.4801 0.5067 0.0936 0.0525 0.0527 198 GLN D CA 6359 C C . GLN D 198 ? 0.2401 0.3850 0.4116 0.0717 0.0443 0.0495 198 GLN D C 6360 O O . GLN D 198 ? 0.3136 0.4265 0.4679 0.0604 0.0470 0.0485 198 GLN D O 6361 C CB . GLN D 198 ? 0.3701 0.4931 0.5318 0.1078 0.0525 0.0614 198 GLN D CB 6362 C CG . GLN D 198 ? 0.4154 0.5415 0.5669 0.1107 0.0395 0.0654 198 GLN D CG 6363 C CD . GLN D 198 ? 0.4308 0.5911 0.5881 0.1226 0.0290 0.0617 198 GLN D CD 6364 O OE1 . GLN D 198 ? 0.4810 0.6453 0.6380 0.1375 0.0325 0.0623 198 GLN D OE1 6365 N NE2 . GLN D 198 ? 0.3713 0.5565 0.5349 0.1162 0.0156 0.0566 198 GLN D NE2 6366 N N . THR D 199 ? 0.2276 0.4014 0.4103 0.0675 0.0336 0.0464 199 THR D N 6367 C CA . THR D 199 ? 0.2014 0.3648 0.3745 0.0489 0.0267 0.0437 199 THR D CA 6368 C C . THR D 199 ? 0.1554 0.2987 0.3124 0.0558 0.0184 0.0515 199 THR D C 6369 O O . THR D 199 ? 0.2108 0.3611 0.3677 0.0747 0.0154 0.0579 199 THR D O 6370 C CB . THR D 199 ? 0.1828 0.3835 0.3766 0.0383 0.0212 0.0337 199 THR D CB 6371 O OG1 . THR D 199 ? 0.2875 0.4686 0.4700 0.0170 0.0223 0.0302 199 THR D OG1 6372 C CG2 . THR D 199 ? 0.1549 0.3836 0.3557 0.0519 0.0061 0.0333 199 THR D CG2 6373 N N . TYR D 200 ? 0.1175 0.2342 0.2591 0.0424 0.0166 0.0514 200 TYR D N 6374 C CA . TYR D 200 ? 0.1169 0.2137 0.2460 0.0461 0.0115 0.0574 200 TYR D CA 6375 C C . TYR D 200 ? 0.1610 0.2546 0.2827 0.0316 0.0039 0.0537 200 TYR D C 6376 O O . TYR D 200 ? 0.2769 0.3538 0.3896 0.0192 0.0059 0.0503 200 TYR D O 6377 C CB . TYR D 200 ? 0.1232 0.1881 0.2441 0.0472 0.0190 0.0593 200 TYR D CB 6378 C CG . TYR D 200 ? 0.1357 0.1954 0.2613 0.0626 0.0292 0.0635 200 TYR D CG 6379 C CD1 . TYR D 200 ? 0.2482 0.3050 0.3719 0.0797 0.0320 0.0729 200 TYR D CD1 6380 C CD2 . TYR D 200 ? 0.1429 0.1965 0.2707 0.0619 0.0378 0.0588 200 TYR D CD2 6381 C CE1 . TYR D 200 ? 0.2393 0.2834 0.3589 0.0922 0.0430 0.0759 200 TYR D CE1 6382 C CE2 . TYR D 200 ? 0.2532 0.2981 0.3841 0.0768 0.0489 0.0623 200 TYR D CE2 6383 C CZ . TYR D 200 ? 0.3167 0.3561 0.4446 0.0928 0.0520 0.0719 200 TYR D CZ 6384 O OH . TYR D 200 ? 0.1954 0.2189 0.3161 0.1037 0.0631 0.0738 200 TYR D OH 6385 N N . ILE D 201 ? 0.1584 0.2661 0.2803 0.0352 -0.0046 0.0543 201 ILE D N 6386 C CA . ILE D 201 ? 0.1752 0.2809 0.2909 0.0223 -0.0111 0.0495 201 ILE D CA 6387 C C . ILE D 201 ? 0.1522 0.2453 0.2554 0.0301 -0.0160 0.0555 201 ILE D C 6388 O O . ILE D 201 ? 0.3768 0.4800 0.4786 0.0460 -0.0182 0.0605 201 ILE D O 6389 C CB . ILE D 201 ? 0.2045 0.3436 0.3352 0.0160 -0.0161 0.0393 201 ILE D CB 6390 C CG1 . ILE D 201 ? 0.1874 0.3397 0.3344 0.0075 -0.0070 0.0331 201 ILE D CG1 6391 C CG2 . ILE D 201 ? 0.1469 0.2779 0.2697 0.0018 -0.0205 0.0331 201 ILE D CG2 6392 C CD1 . ILE D 201 ? 0.3590 0.5516 0.5313 0.0005 -0.0098 0.0196 201 ILE D CD1 6393 N N . CYS D 202 ? 0.1069 0.1775 0.1991 0.0213 -0.0166 0.0554 202 CYS D N 6394 C CA . CYS D 202 ? 0.2995 0.3600 0.3815 0.0265 -0.0198 0.0593 202 CYS D CA 6395 C C . CYS D 202 ? 0.2484 0.3197 0.3254 0.0199 -0.0278 0.0526 202 CYS D C 6396 O O . CYS D 202 ? 0.3005 0.3701 0.3783 0.0056 -0.0278 0.0453 202 CYS D O 6397 C CB . CYS D 202 ? 0.2726 0.3076 0.3494 0.0224 -0.0167 0.0608 202 CYS D CB 6398 S SG . CYS D 202 ? 0.3564 0.3774 0.4230 0.0085 -0.0200 0.0545 202 CYS D SG 6399 N N . ASN D 203 ? 0.1204 0.2002 0.1902 0.0310 -0.0328 0.0543 203 ASN D N 6400 C CA . ASN D 203 ? 0.2009 0.2928 0.2655 0.0261 -0.0416 0.0449 203 ASN D CA 6401 C C . ASN D 203 ? 0.2064 0.2738 0.2538 0.0266 -0.0406 0.0484 203 ASN D C 6402 O O . ASN D 203 ? 0.3054 0.3687 0.3406 0.0410 -0.0400 0.0551 203 ASN D O 6403 C CB . ASN D 203 ? 0.1370 0.2602 0.2025 0.0413 -0.0504 0.0417 203 ASN D CB 6404 C CG . ASN D 203 ? 0.1319 0.2812 0.2166 0.0459 -0.0503 0.0399 203 ASN D CG 6405 O OD1 . ASN D 203 ? 0.1378 0.2904 0.2192 0.0655 -0.0480 0.0496 203 ASN D OD1 6406 N ND2 . ASN D 203 ? 0.1249 0.2900 0.2292 0.0284 -0.0500 0.0279 203 ASN D ND2 6407 N N . VAL D 204 ? 0.1995 0.2485 0.2439 0.0126 -0.0386 0.0446 204 VAL D N 6408 C CA . VAL D 204 ? 0.2850 0.3120 0.3153 0.0135 -0.0374 0.0467 204 VAL D CA 6409 C C . VAL D 204 ? 0.3334 0.3640 0.3536 0.0086 -0.0433 0.0365 204 VAL D C 6410 O O . VAL D 204 ? 0.4543 0.4924 0.4804 -0.0049 -0.0451 0.0255 204 VAL D O 6411 C CB . VAL D 204 ? 0.2292 0.2338 0.2583 0.0060 -0.0331 0.0480 204 VAL D CB 6412 C CG1 . VAL D 204 ? 0.1440 0.1298 0.1611 0.0093 -0.0324 0.0492 204 VAL D CG1 6413 C CG2 . VAL D 204 ? 0.2990 0.3031 0.3392 0.0103 -0.0290 0.0538 204 VAL D CG2 6414 N N . ASN D 205 ? 0.3087 0.3328 0.3140 0.0187 -0.0444 0.0388 205 ASN D N 6415 C CA . ASN D 205 ? 0.3558 0.3808 0.3479 0.0156 -0.0502 0.0275 205 ASN D CA 6416 C C . ASN D 205 ? 0.4148 0.4155 0.3896 0.0229 -0.0453 0.0329 205 ASN D C 6417 O O . ASN D 205 ? 0.3546 0.3532 0.3226 0.0379 -0.0410 0.0428 205 ASN D O 6418 C CB . ASN D 205 ? 0.3786 0.4338 0.3679 0.0260 -0.0604 0.0207 205 ASN D CB 6419 C CG . ASN D 205 ? 0.3970 0.4548 0.3707 0.0243 -0.0680 0.0059 205 ASN D CG 6420 O OD1 . ASN D 205 ? 0.5020 0.5756 0.4606 0.0404 -0.0760 0.0033 205 ASN D OD1 6421 N ND2 . ASN D 205 ? 0.3877 0.4272 0.3616 0.0065 -0.0648 -0.0040 205 ASN D ND2 6422 N N . HIS D 206 ? 0.3670 0.3473 0.3347 0.0129 -0.0432 0.0267 206 HIS D N 6423 C CA . HIS D 206 ? 0.2779 0.2355 0.2305 0.0197 -0.0382 0.0297 206 HIS D CA 6424 C C . HIS D 206 ? 0.3363 0.2896 0.2716 0.0156 -0.0424 0.0158 206 HIS D C 6425 O O . HIS D 206 ? 0.4412 0.3790 0.3738 0.0021 -0.0409 0.0062 206 HIS D O 6426 C CB . HIS D 206 ? 0.3890 0.3245 0.3451 0.0157 -0.0325 0.0341 206 HIS D CB 6427 C CG . HIS D 206 ? 0.3245 0.2398 0.2685 0.0238 -0.0276 0.0358 206 HIS D CG 6428 N ND1 . HIS D 206 ? 0.2432 0.1340 0.1722 0.0193 -0.0254 0.0297 206 HIS D ND1 6429 C CD2 . HIS D 206 ? 0.2241 0.1389 0.1702 0.0364 -0.0220 0.0427 206 HIS D CD2 6430 C CE1 . HIS D 206 ? 0.3153 0.1937 0.2372 0.0307 -0.0207 0.0329 206 HIS D CE1 6431 N NE2 . HIS D 206 ? 0.2656 0.1601 0.1996 0.0403 -0.0183 0.0402 206 HIS D NE2 6432 N N . LYS D 207 ? 0.2731 0.2375 0.1942 0.0281 -0.0464 0.0141 207 LYS D N 6433 C CA . LYS D 207 ? 0.2929 0.2606 0.1966 0.0265 -0.0537 -0.0027 207 LYS D CA 6434 C C . LYS D 207 ? 0.3134 0.2494 0.2003 0.0227 -0.0472 -0.0083 207 LYS D C 6435 O O . LYS D 207 ? 0.4401 0.3720 0.3200 0.0113 -0.0511 -0.0268 207 LYS D O 6436 C CB . LYS D 207 ? 0.4133 0.3980 0.2983 0.0472 -0.0592 -0.0002 207 LYS D CB 6437 C CG . LYS D 207 ? 0.3209 0.3401 0.2178 0.0524 -0.0692 -0.0009 207 LYS D CG 6438 C CD . LYS D 207 ? 0.4681 0.5011 0.3383 0.0778 -0.0751 0.0019 207 LYS D CD 6439 C CE . LYS D 207 ? 0.4730 0.5416 0.3545 0.0865 -0.0861 0.0009 207 LYS D CE 6440 N NZ . LYS D 207 ? 0.4485 0.5265 0.2981 0.1165 -0.0905 0.0066 207 LYS D NZ 6441 N N . PRO D 208 ? 0.3695 0.2835 0.2514 0.0321 -0.0367 0.0049 208 PRO D N 6442 C CA . PRO D 208 ? 0.3187 0.2020 0.1850 0.0306 -0.0301 -0.0004 208 PRO D CA 6443 C C . PRO D 208 ? 0.3884 0.2521 0.2582 0.0128 -0.0281 -0.0096 208 PRO D C 6444 O O . PRO D 208 ? 0.5666 0.4052 0.4196 0.0083 -0.0239 -0.0205 208 PRO D O 6445 C CB . PRO D 208 ? 0.3067 0.1795 0.1787 0.0437 -0.0200 0.0158 208 PRO D CB 6446 C CG . PRO D 208 ? 0.2920 0.1862 0.1711 0.0545 -0.0191 0.0262 208 PRO D CG 6447 C CD . PRO D 208 ? 0.3179 0.2354 0.2072 0.0463 -0.0294 0.0226 208 PRO D CD 6448 N N . SER D 209 ? 0.3269 0.1968 0.2152 0.0032 -0.0283 -0.0051 209 SER D N 6449 C CA . SER D 209 ? 0.3235 0.1707 0.2120 -0.0131 -0.0222 -0.0117 209 SER D CA 6450 C C . SER D 209 ? 0.3966 0.2654 0.3011 -0.0316 -0.0264 -0.0257 209 SER D C 6451 O O . SER D 209 ? 0.3355 0.1861 0.2437 -0.0475 -0.0176 -0.0307 209 SER D O 6452 C CB . SER D 209 ? 0.3117 0.1446 0.2048 -0.0084 -0.0165 0.0036 209 SER D CB 6453 O OG . SER D 209 ? 0.3532 0.2149 0.2665 -0.0076 -0.0219 0.0111 209 SER D OG 6454 N N . ASN D 210 ? 0.3098 0.2169 0.2236 -0.0283 -0.0383 -0.0320 210 ASN D N 6455 C CA . ASN D 210 ? 0.4885 0.4274 0.4238 -0.0427 -0.0449 -0.0469 210 ASN D CA 6456 C C . ASN D 210 ? 0.3514 0.2886 0.3054 -0.0534 -0.0371 -0.0392 210 ASN D C 6457 O O . ASN D 210 ? 0.3506 0.2867 0.3182 -0.0734 -0.0307 -0.0522 210 ASN D O 6458 C CB . ASN D 210 ? 0.5475 0.4827 0.4818 -0.0604 -0.0450 -0.0735 210 ASN D CB 6459 C CG . ASN D 210 ? 0.6229 0.5640 0.5359 -0.0485 -0.0549 -0.0842 210 ASN D CG 6460 O OD1 . ASN D 210 ? 0.7003 0.6793 0.6142 -0.0370 -0.0699 -0.0900 210 ASN D OD1 6461 N ND2 . ASN D 210 ? 0.7130 0.6148 0.6031 -0.0485 -0.0461 -0.0864 210 ASN D ND2 6462 N N . THR D 211 ? 0.2660 0.2022 0.2209 -0.0402 -0.0360 -0.0191 211 THR D N 6463 C CA . THR D 211 ? 0.2721 0.2039 0.2384 -0.0459 -0.0291 -0.0101 211 THR D CA 6464 C C . THR D 211 ? 0.2514 0.2206 0.2371 -0.0391 -0.0368 -0.0051 211 THR D C 6465 O O . THR D 211 ? 0.2453 0.2212 0.2288 -0.0228 -0.0406 0.0071 211 THR D O 6466 C CB . THR D 211 ? 0.3385 0.2385 0.2897 -0.0354 -0.0226 0.0057 211 THR D CB 6467 O OG1 . THR D 211 ? 0.4121 0.2743 0.3427 -0.0388 -0.0142 0.0020 211 THR D OG1 6468 C CG2 . THR D 211 ? 0.2452 0.1419 0.2031 -0.0380 -0.0173 0.0141 211 THR D CG2 6469 N N . LYS D 212 ? 0.2984 0.2905 0.3044 -0.0517 -0.0367 -0.0150 212 LYS D N 6470 C CA . LYS D 212 ? 0.2576 0.2837 0.2824 -0.0448 -0.0423 -0.0107 212 LYS D CA 6471 C C . LYS D 212 ? 0.3096 0.3268 0.3439 -0.0531 -0.0316 -0.0045 212 LYS D C 6472 O O . LYS D 212 ? 0.2101 0.2131 0.2475 -0.0705 -0.0208 -0.0123 212 LYS D O 6473 C CB . LYS D 212 ? 0.2025 0.2712 0.2460 -0.0483 -0.0527 -0.0287 212 LYS D CB 6474 C CG . LYS D 212 ? 0.2061 0.2936 0.2369 -0.0290 -0.0666 -0.0297 212 LYS D CG 6475 C CD . LYS D 212 ? 0.3749 0.5101 0.4233 -0.0289 -0.0803 -0.0499 212 LYS D CD 6476 C CE . LYS D 212 ? 0.5677 0.7057 0.6280 -0.0530 -0.0795 -0.0758 212 LYS D CE 6477 N NZ . LYS D 212 ? 0.7233 0.9166 0.8081 -0.0541 -0.0951 -0.1007 212 LYS D NZ 6478 N N . VAL D 213 ? 0.2350 0.2573 0.2719 -0.0408 -0.0325 0.0090 213 VAL D N 6479 C CA . VAL D 213 ? 0.2706 0.2853 0.3126 -0.0452 -0.0236 0.0148 213 VAL D CA 6480 C C . VAL D 213 ? 0.2472 0.2909 0.3058 -0.0350 -0.0278 0.0193 213 VAL D C 6481 O O . VAL D 213 ? 0.2719 0.3206 0.3276 -0.0198 -0.0336 0.0273 213 VAL D O 6482 C CB . VAL D 213 ? 0.3073 0.2865 0.3285 -0.0391 -0.0188 0.0264 213 VAL D CB 6483 C CG1 . VAL D 213 ? 0.1737 0.1479 0.1959 -0.0395 -0.0119 0.0318 213 VAL D CG1 6484 C CG2 . VAL D 213 ? 0.2922 0.2379 0.2933 -0.0461 -0.0123 0.0236 213 VAL D CG2 6485 N N . ASP D 214 ? 0.1488 0.2089 0.2246 -0.0432 -0.0221 0.0144 214 ASP D N 6486 C CA . ASP D 214 ? 0.1517 0.2334 0.2416 -0.0332 -0.0228 0.0194 214 ASP D CA 6487 C C . ASP D 214 ? 0.1369 0.1967 0.2203 -0.0367 -0.0116 0.0258 214 ASP D C 6488 O O . ASP D 214 ? 0.2271 0.2789 0.3117 -0.0504 -0.0005 0.0209 214 ASP D O 6489 C CB . ASP D 214 ? 0.1321 0.2561 0.2490 -0.0364 -0.0258 0.0070 214 ASP D CB 6490 C CG . ASP D 214 ? 0.2722 0.4226 0.3919 -0.0279 -0.0403 -0.0009 214 ASP D CG 6491 O OD1 . ASP D 214 ? 0.1323 0.2733 0.2344 -0.0115 -0.0466 0.0091 214 ASP D OD1 6492 O OD2 . ASP D 214 ? 0.2024 0.3837 0.3422 -0.0373 -0.0446 -0.0184 214 ASP D OD2 6493 N N . LYS D 215 ? 0.2206 0.2696 0.2963 -0.0244 -0.0130 0.0355 215 LYS D N 6494 C CA . LYS D 215 ? 0.2813 0.3090 0.3456 -0.0244 -0.0058 0.0399 215 LYS D CA 6495 C C . LYS D 215 ? 0.3225 0.3651 0.3996 -0.0165 -0.0035 0.0419 215 LYS D C 6496 O O . LYS D 215 ? 0.3190 0.3699 0.4029 -0.0052 -0.0082 0.0457 215 LYS D O 6497 C CB . LYS D 215 ? 0.3147 0.3172 0.3606 -0.0175 -0.0103 0.0449 215 LYS D CB 6498 C CG . LYS D 215 ? 0.3080 0.2914 0.3389 -0.0139 -0.0069 0.0466 215 LYS D CG 6499 C CD . LYS D 215 ? 0.3891 0.3469 0.3960 -0.0199 0.0009 0.0470 215 LYS D CD 6500 C CE . LYS D 215 ? 0.4316 0.3705 0.4162 -0.0111 0.0021 0.0488 215 LYS D CE 6501 N NZ . LYS D 215 ? 0.4924 0.4080 0.4535 -0.0160 0.0169 0.0510 215 LYS D NZ 6502 N N . ARG D 216 ? 0.2954 0.3375 0.3737 -0.0218 0.0065 0.0399 216 ARG D N 6503 C CA . ARG D 216 ? 0.2285 0.2786 0.3147 -0.0136 0.0104 0.0414 216 ARG D CA 6504 C C . ARG D 216 ? 0.1878 0.2121 0.2552 -0.0076 0.0097 0.0440 216 ARG D C 6505 O O . ARG D 216 ? 0.2102 0.2116 0.2556 -0.0105 0.0107 0.0440 216 ARG D O 6506 C CB . ARG D 216 ? 0.1391 0.2007 0.2351 -0.0208 0.0230 0.0371 216 ARG D CB 6507 C CG . ARG D 216 ? 0.1371 0.2066 0.2407 -0.0106 0.0279 0.0383 216 ARG D CG 6508 C CD . ARG D 216 ? 0.2430 0.3255 0.3581 -0.0164 0.0425 0.0339 216 ARG D CD 6509 N NE . ARG D 216 ? 0.3336 0.4195 0.4526 -0.0044 0.0472 0.0352 216 ARG D NE 6510 C CZ . ARG D 216 ? 0.3422 0.4365 0.4689 -0.0053 0.0614 0.0322 216 ARG D CZ 6511 N NH1 . ARG D 216 ? 0.3637 0.4646 0.4975 -0.0190 0.0741 0.0276 216 ARG D NH1 6512 N NH2 . ARG D 216 ? 0.3459 0.4399 0.4738 0.0071 0.0655 0.0331 216 ARG D NH2 6513 N N . VAL D 217 ? 0.1290 0.1567 0.2048 0.0020 0.0082 0.0450 217 VAL D N 6514 C CA . VAL D 217 ? 0.1352 0.1445 0.2005 0.0067 0.0064 0.0425 217 VAL D CA 6515 C C . VAL D 217 ? 0.2578 0.2683 0.3267 0.0111 0.0145 0.0398 217 VAL D C 6516 O O . VAL D 217 ? 0.2736 0.2963 0.3593 0.0171 0.0187 0.0419 217 VAL D O 6517 C CB . VAL D 217 ? 0.1253 0.1326 0.1999 0.0115 0.0006 0.0433 217 VAL D CB 6518 C CG1 . VAL D 217 ? 0.1327 0.1266 0.2034 0.0136 -0.0021 0.0354 217 VAL D CG1 6519 C CG2 . VAL D 217 ? 0.1199 0.1272 0.1908 0.0086 -0.0060 0.0462 217 VAL D CG2 6520 N N . GLU D 218 ? 0.2839 0.2799 0.3336 0.0106 0.0174 0.0353 218 GLU D N 6521 C CA . GLU D 218 ? 0.3531 0.3468 0.4010 0.0150 0.0260 0.0313 218 GLU D CA 6522 C C . GLU D 218 ? 0.4380 0.4120 0.4613 0.0186 0.0215 0.0230 218 GLU D C 6523 O O . GLU D 218 ? 0.5684 0.5318 0.5724 0.0186 0.0136 0.0226 218 GLU D O 6524 C CB . GLU D 218 ? 0.2823 0.2849 0.3305 0.0112 0.0387 0.0339 218 GLU D CB 6525 C CG . GLU D 218 ? 0.3149 0.3011 0.3372 0.0049 0.0435 0.0353 218 GLU D CG 6526 C CD . GLU D 218 ? 0.5086 0.5010 0.5338 -0.0006 0.0615 0.0361 218 GLU D CD 6527 O OE1 . GLU D 218 ? 0.5939 0.5800 0.6124 -0.0103 0.0699 0.0384 218 GLU D OE1 6528 O OE2 . GLU D 218 ? 0.7146 0.7169 0.7504 0.0045 0.0694 0.0336 218 GLU D OE2 6529 N N . PRO D 219 ? 0.4078 0.3767 0.4297 0.0237 0.0255 0.0151 219 PRO D N 6530 C CA . PRO D 219 ? 0.5078 0.4619 0.5053 0.0289 0.0183 0.0033 219 PRO D CA 6531 C C . PRO D 219 ? 0.4805 0.4202 0.4402 0.0321 0.0220 0.0068 219 PRO D C 6532 O O . PRO D 219 ? 0.3459 0.2848 0.3012 0.0291 0.0368 0.0147 219 PRO D O 6533 C CB . PRO D 219 ? 0.5191 0.4706 0.5243 0.0325 0.0254 -0.0063 219 PRO D CB 6534 C CG . PRO D 219 ? 0.4294 0.3912 0.4523 0.0319 0.0399 0.0041 219 PRO D CG 6535 C CD . PRO D 219 ? 0.4398 0.4160 0.4811 0.0271 0.0361 0.0151 219 PRO D CD 6536 N N . LYS D 220 ? 0.4947 0.4230 0.4275 0.0394 0.0095 0.0006 220 LYS D N 6537 C CA . LYS D 220 ? 0.5704 0.4774 0.4584 0.0467 0.0137 0.0061 220 LYS D CA 6538 C C . LYS D 220 ? 0.5182 0.4114 0.3736 0.0576 0.0182 -0.0024 220 LYS D C 6539 O O . LYS D 220 ? 0.4292 0.3304 0.3006 0.0573 0.0191 -0.0131 220 LYS D O 6540 C CB . LYS D 220 ? 0.6322 0.5329 0.5017 0.0546 -0.0028 0.0051 220 LYS D CB 6541 C CG . LYS D 220 ? 0.6994 0.5713 0.5136 0.0680 0.0010 0.0114 220 LYS D CG 6542 C CD . LYS D 220 ? 0.7304 0.5996 0.5277 0.0808 -0.0184 0.0083 220 LYS D CD 6543 C CE . LYS D 220 ? 0.8341 0.6811 0.5728 0.1045 -0.0243 0.0049 220 LYS D CE 6544 N NZ . LYS D 220 ? 0.8516 0.7125 0.5861 0.1207 -0.0513 -0.0082 220 LYS D NZ 6545 C C . SC2 E 1 ? 0.3759 0.6145 0.5523 -0.0379 0.0092 -0.0787 1 SC2 E C 6546 C CB . SC2 E 1 ? 0.4701 0.6787 0.6498 -0.0849 0.0285 -0.0680 1 SC2 E CB 6547 C CT . SC2 E 1 ? 0.6754 1.0328 0.9329 -0.0867 0.0717 -0.1033 1 SC2 E CT 6548 C CA . SC2 E 1 ? 0.4724 0.7208 0.6612 -0.0687 0.0367 -0.0771 1 SC2 E CA 6549 N N . SC2 E 1 ? 0.6188 0.9346 0.8604 -0.0794 0.0455 -0.0953 1 SC2 E N 6550 O O . SC2 E 1 ? 0.4927 0.7567 0.6953 -0.0297 -0.0116 -0.0852 1 SC2 E O 6551 O OT . SC2 E 1 ? 0.6809 1.0262 0.9084 -0.0841 0.0905 -0.0962 1 SC2 E OT 6552 C CM . SC2 E 1 ? 0.6301 1.0238 0.9173 -0.0909 0.0705 -0.1138 1 SC2 E CM 6553 S SG . SC2 E 1 ? 0.5918 0.7773 0.7756 -0.1211 0.0576 -0.0605 1 SC2 E SG 6554 N N . GLN E 2 ? 0.3520 0.5539 0.4883 -0.0228 0.0079 -0.0722 2 GLN E N 6555 C CA . GLN E 2 ? 0.3396 0.5184 0.4615 0.0008 -0.0186 -0.0730 2 GLN E CA 6556 C C . GLN E 2 ? 0.3722 0.4989 0.4524 -0.0021 -0.0297 -0.0586 2 GLN E C 6557 O O . GLN E 2 ? 0.2017 0.3072 0.2529 -0.0096 -0.0155 -0.0503 2 GLN E O 6558 C CB . GLN E 2 ? 0.3057 0.4955 0.4252 0.0254 -0.0148 -0.0883 2 GLN E CB 6559 C CG . GLN E 2 ? 0.4281 0.6660 0.5940 0.0430 -0.0215 -0.1053 2 GLN E CG 6560 C CD . GLN E 2 ? 0.6401 0.8650 0.8028 0.0770 -0.0355 -0.1208 2 GLN E CD 6561 O OE1 . GLN E 2 ? 0.6570 0.9003 0.8522 0.0995 -0.0536 -0.1302 2 GLN E OE1 6562 N NE2 . GLN E 2 ? 0.7119 0.9034 0.8353 0.0826 -0.0295 -0.1247 2 GLN E NE2 6563 N N . PHE E 3 ? 0.3816 0.4914 0.4588 0.0032 -0.0558 -0.0543 3 PHE E N 6564 C CA . PHE E 3 ? 0.2754 0.3481 0.3196 -0.0005 -0.0680 -0.0442 3 PHE E CA 6565 C C . PHE E 3 ? 0.2429 0.2890 0.2546 0.0130 -0.0680 -0.0490 3 PHE E C 6566 O O . PHE E 3 ? 0.2922 0.3390 0.3087 0.0295 -0.0712 -0.0615 3 PHE E O 6567 C CB . PHE E 3 ? 0.1623 0.2322 0.2131 -0.0035 -0.0935 -0.0378 3 PHE E CB 6568 C CG . PHE E 3 ? 0.1648 0.2085 0.1867 -0.0108 -0.1001 -0.0283 3 PHE E CG 6569 C CD1 . PHE E 3 ? 0.1509 0.2003 0.1668 -0.0213 -0.0890 -0.0239 3 PHE E CD1 6570 C CD2 . PHE E 3 ? 0.2961 0.3129 0.3018 -0.0057 -0.1091 -0.0256 3 PHE E CD2 6571 C CE1 . PHE E 3 ? 0.1831 0.2244 0.1825 -0.0222 -0.0846 -0.0195 3 PHE E CE1 6572 C CE2 . PHE E 3 ? 0.2366 0.2435 0.2256 -0.0136 -0.1037 -0.0191 3 PHE E CE2 6573 C CZ . PHE E 3 ? 0.1940 0.2194 0.1824 -0.0198 -0.0904 -0.0170 3 PHE E CZ 6574 N N . ASP E 4 ? 0.2140 0.2393 0.1936 0.0083 -0.0661 -0.0418 4 ASP E N 6575 C CA . ASP E 4 ? 0.3021 0.3094 0.2462 0.0191 -0.0663 -0.0479 4 ASP E CA 6576 C C . ASP E 4 ? 0.3738 0.3586 0.3023 0.0167 -0.0905 -0.0469 4 ASP E C 6577 O O . ASP E 4 ? 0.4465 0.4307 0.3702 0.0068 -0.0965 -0.0367 4 ASP E O 6578 C CB . ASP E 4 ? 0.4231 0.4300 0.3389 0.0162 -0.0466 -0.0384 4 ASP E CB 6579 C CG . ASP E 4 ? 0.4798 0.4791 0.3542 0.0280 -0.0462 -0.0457 4 ASP E CG 6580 O OD1 . ASP E 4 ? 0.5392 0.5342 0.4123 0.0389 -0.0578 -0.0646 4 ASP E OD1 6581 O OD2 . ASP E 4 ? 0.5491 0.5451 0.3907 0.0268 -0.0352 -0.0329 4 ASP E OD2 6582 N N . LEU E 5 ? 0.4135 0.3812 0.3367 0.0253 -0.1041 -0.0601 5 LEU E N 6583 C CA . LEU E 5 ? 0.3587 0.3077 0.2760 0.0161 -0.1193 -0.0567 5 LEU E CA 6584 C C . LEU E 5 ? 0.3577 0.3118 0.2512 0.0132 -0.1123 -0.0544 5 LEU E C 6585 O O . LEU E 5 ? 0.3735 0.3347 0.2755 0.0014 -0.1116 -0.0463 5 LEU E O 6586 C CB . LEU E 5 ? 0.3055 0.2255 0.2249 0.0251 -0.1352 -0.0722 5 LEU E CB 6587 C CG . LEU E 5 ? 0.3261 0.2378 0.2734 0.0319 -0.1480 -0.0720 5 LEU E CG 6588 C CD1 . LEU E 5 ? 0.3542 0.2288 0.3035 0.0486 -0.1615 -0.0914 5 LEU E CD1 6589 C CD2 . LEU E 5 ? 0.3065 0.2205 0.2691 0.0122 -0.1509 -0.0456 5 LEU E CD2 6590 N N . SER E 6 ? 0.3938 0.3519 0.2561 0.0251 -0.1057 -0.0621 6 SER E N 6591 C CA . SER E 6 ? 0.4449 0.4104 0.2836 0.0247 -0.1020 -0.0575 6 SER E CA 6592 C C . SER E 6 ? 0.3976 0.3741 0.2428 0.0184 -0.0981 -0.0379 6 SER E C 6593 O O . SER E 6 ? 0.5677 0.5566 0.4190 0.0131 -0.1003 -0.0337 6 SER E O 6594 C CB . SER E 6 ? 0.5146 0.4848 0.3118 0.0397 -0.0925 -0.0675 6 SER E CB 6595 O OG . SER E 6 ? 0.5123 0.4778 0.3085 0.0490 -0.0945 -0.0934 6 SER E OG 6596 N N . THR E 7 ? 0.4378 0.4104 0.2818 0.0200 -0.0938 -0.0292 7 THR E N 6597 C CA . THR E 7 ? 0.4589 0.4319 0.3062 0.0185 -0.0930 -0.0145 7 THR E CA 6598 C C . THR E 7 ? 0.3708 0.3561 0.2606 0.0068 -0.0939 -0.0143 7 THR E C 6599 O O . THR E 7 ? 0.3180 0.3060 0.2154 0.0074 -0.0952 -0.0091 7 THR E O 6600 C CB . THR E 7 ? 0.5497 0.5093 0.3789 0.0218 -0.0749 0.0001 7 THR E CB 6601 O OG1 . THR E 7 ? 0.5591 0.5262 0.4198 0.0120 -0.0596 -0.0034 7 THR E OG1 6602 C CG2 . THR E 7 ? 0.5380 0.4964 0.3223 0.0315 -0.0663 0.0033 7 THR E CG2 6603 N N . ARG E 8 ? 0.3044 0.2975 0.2190 -0.0011 -0.0931 -0.0200 8 ARG E N 6604 C CA . ARG E 8 ? 0.3030 0.3144 0.2504 -0.0109 -0.0882 -0.0183 8 ARG E CA 6605 C C . ARG E 8 ? 0.3744 0.3849 0.3301 -0.0139 -0.0892 -0.0175 8 ARG E C 6606 O O . ARG E 8 ? 0.3930 0.4219 0.3709 -0.0197 -0.0836 -0.0193 8 ARG E O 6607 C CB . ARG E 8 ? 0.2515 0.2857 0.2100 -0.0147 -0.0824 -0.0183 8 ARG E CB 6608 C CG . ARG E 8 ? 0.2068 0.2399 0.1608 -0.0174 -0.0860 -0.0209 8 ARG E CG 6609 C CD . ARG E 8 ? 0.3189 0.3682 0.2837 -0.0231 -0.0880 -0.0230 8 ARG E CD 6610 N NE . ARG E 8 ? 0.4755 0.5184 0.4348 -0.0292 -0.0959 -0.0256 8 ARG E NE 6611 C CZ . ARG E 8 ? 0.3465 0.3991 0.3129 -0.0377 -0.1006 -0.0268 8 ARG E CZ 6612 N NH1 . ARG E 8 ? 0.3447 0.4127 0.3226 -0.0387 -0.0983 -0.0262 8 ARG E NH1 6613 N NH2 . ARG E 8 ? 0.3063 0.3509 0.2675 -0.0471 -0.1092 -0.0292 8 ARG E NH2 6614 N N . ARG E 9 ? 0.2026 0.1983 0.1468 -0.0105 -0.0790 -0.0144 9 ARG E N 6615 C CA . ARG E 9 ? 0.2044 0.1991 0.1673 -0.0181 -0.0623 -0.0110 9 ARG E CA 6616 C C . ARG E 9 ? 0.3797 0.3902 0.3609 -0.0230 -0.0472 -0.0154 9 ARG E C 6617 O O . ARG E 9 ? 0.2822 0.2980 0.2545 -0.0146 -0.0470 -0.0200 9 ARG E O 6618 C CB . ARG E 9 ? 0.3075 0.2726 0.2446 -0.0130 -0.0522 0.0028 9 ARG E CB 6619 C CG . ARG E 9 ? 0.3105 0.2645 0.2373 -0.0030 -0.0681 0.0052 9 ARG E CG 6620 C CD . ARG E 9 ? 0.2899 0.2534 0.2518 -0.0096 -0.0723 -0.0057 9 ARG E CD 6621 N NE . ARG E 9 ? 0.3315 0.2789 0.3130 -0.0215 -0.0545 -0.0042 9 ARG E NE 6622 C CZ . ARG E 9 ? 0.4407 0.3466 0.4115 -0.0196 -0.0453 0.0091 9 ARG E CZ 6623 N NH1 . ARG E 9 ? 0.3241 0.2032 0.2625 -0.0011 -0.0542 0.0236 9 ARG E NH1 6624 N NH2 . ARG E 9 ? 0.4960 0.3868 0.4886 -0.0370 -0.0286 0.0088 9 ARG E NH2 6625 N N . LEU E 10 ? 0.2209 0.2425 0.2311 -0.0361 -0.0352 -0.0179 10 LEU E N 6626 C CA . LEU E 10 ? 0.1943 0.2429 0.2290 -0.0425 -0.0199 -0.0245 10 LEU E CA 6627 C C . LEU E 10 ? 0.2552 0.2930 0.2691 -0.0453 0.0041 -0.0152 10 LEU E C 6628 O O . LEU E 10 ? 0.2760 0.2825 0.2706 -0.0521 0.0133 -0.0005 10 LEU E O 6629 C CB . LEU E 10 ? 0.1772 0.2490 0.2525 -0.0595 -0.0164 -0.0340 10 LEU E CB 6630 C CG . LEU E 10 ? 0.1763 0.2777 0.2734 -0.0584 -0.0375 -0.0440 10 LEU E CG 6631 C CD1 . LEU E 10 ? 0.2272 0.3512 0.3574 -0.0752 -0.0344 -0.0563 10 LEU E CD1 6632 C CD2 . LEU E 10 ? 0.1414 0.2701 0.2495 -0.0471 -0.0447 -0.0478 10 LEU E CD2 6633 N N . LYS E 11 ? 0.3218 0.3864 0.3384 -0.0389 0.0138 -0.0232 11 LYS E N 6634 C CA . LYS E 11 ? 0.3906 0.4605 0.3865 -0.0435 0.0397 -0.0164 11 LYS E CA 6635 C C . LYS E 11 ? 0.4172 0.5344 0.4540 -0.0582 0.0607 -0.0273 11 LYS E C 6636 O O . LYS E 11 ? 0.3117 0.4685 0.3808 -0.0474 0.0539 -0.0465 11 LYS E O 6637 C CB . LYS E 11 ? 0.5258 0.5984 0.4883 -0.0222 0.0360 -0.0231 11 LYS E CB 6638 C CG . LYS E 11 ? 0.6498 0.7127 0.5645 -0.0247 0.0552 -0.0080 11 LYS E CG 6639 C CD . LYS E 11 ? 0.7155 0.7905 0.5998 -0.0032 0.0510 -0.0236 11 LYS E CD 6640 C CE . LYS E 11 ? 0.8519 0.9070 0.6754 -0.0013 0.0558 -0.0052 11 LYS E CE 6641 N NZ . LYS E 11 ? 0.8437 0.8563 0.6494 0.0031 0.0310 0.0093 11 LYS E NZ 6642 C C . SC2 F 1 ? 0.5300 0.7370 0.6740 -0.0339 -0.1484 0.0060 1 SC2 F C 6643 C CB . SC2 F 1 ? 0.5899 0.7598 0.7252 -0.0758 -0.0902 0.0168 1 SC2 F CB 6644 C CT . SC2 F 1 ? 0.7397 1.0840 1.0128 -0.0542 -0.1202 0.0277 1 SC2 F CT 6645 C CA . SC2 F 1 ? 0.6126 0.8106 0.7619 -0.0715 -0.1349 0.0109 1 SC2 F CA 6646 N N . SC2 F 1 ? 0.6975 0.9691 0.9141 -0.0755 -0.1427 0.0174 1 SC2 F N 6647 O O . SC2 F 1 ? 0.4758 0.7487 0.6679 -0.0029 -0.1510 0.0068 1 SC2 F O 6648 O OT . SC2 F 1 ? 0.8345 1.1899 1.1049 -0.0265 -0.0942 0.0314 1 SC2 F OT 6649 C CM . SC2 F 1 ? 0.6379 1.0558 0.9812 -0.0673 -0.1295 0.0350 1 SC2 F CM 6650 S SG . SC2 F 1 ? 0.7051 0.8091 0.8071 -0.1235 -0.0792 0.0138 1 SC2 F SG 6651 N N . GLN F 2 ? 0.5298 0.6717 0.6170 -0.0367 -0.1559 0.0006 2 GLN F N 6652 C CA . GLN F 2 ? 0.4806 0.6186 0.5617 -0.0058 -0.1688 -0.0036 2 GLN F CA 6653 C C . GLN F 2 ? 0.4219 0.5012 0.4579 -0.0095 -0.1458 -0.0043 2 GLN F C 6654 O O . GLN F 2 ? 0.3678 0.3985 0.3639 -0.0374 -0.1275 -0.0034 2 GLN F O 6655 C CB . GLN F 2 ? 0.5240 0.6464 0.5874 -0.0037 -0.2000 -0.0060 2 GLN F CB 6656 C CG . GLN F 2 ? 0.5521 0.7375 0.6606 0.0177 -0.2005 -0.0044 2 GLN F CG 6657 C CD . GLN F 2 ? 0.6208 0.7845 0.7153 0.0339 -0.2104 -0.0047 2 GLN F CD 6658 O OE1 . GLN F 2 ? 0.7475 0.8522 0.8012 0.0276 -0.2204 -0.0060 2 GLN F OE1 6659 N NE2 . GLN F 2 ? 0.5363 0.7422 0.6663 0.0528 -0.2085 -0.0017 2 GLN F NE2 6660 N N . PHE F 3 ? 0.4014 0.4874 0.4473 0.0195 -0.1473 -0.0078 3 PHE F N 6661 C CA . PHE F 3 ? 0.3188 0.3618 0.3376 0.0188 -0.1262 -0.0086 3 PHE F CA 6662 C C . PHE F 3 ? 0.3894 0.3710 0.3608 0.0032 -0.1460 -0.0071 3 PHE F C 6663 O O . PHE F 3 ? 0.4513 0.4305 0.4233 0.0131 -0.1823 -0.0073 3 PHE F O 6664 C CB . PHE F 3 ? 0.2179 0.2966 0.2715 0.0553 -0.1218 -0.0143 3 PHE F CB 6665 C CG . PHE F 3 ? 0.2782 0.3214 0.3164 0.0553 -0.1032 -0.0159 3 PHE F CG 6666 C CD1 . PHE F 3 ? 0.2108 0.2428 0.2421 0.0436 -0.0662 -0.0121 3 PHE F CD1 6667 C CD2 . PHE F 3 ? 0.3132 0.3350 0.3497 0.0670 -0.1237 -0.0211 3 PHE F CD2 6668 C CE1 . PHE F 3 ? 0.2095 0.2169 0.2360 0.0447 -0.0493 -0.0140 3 PHE F CE1 6669 C CE2 . PHE F 3 ? 0.2509 0.2462 0.2830 0.0642 -0.1068 -0.0220 3 PHE F CE2 6670 C CZ . PHE F 3 ? 0.2429 0.2349 0.2719 0.0536 -0.0692 -0.0188 3 PHE F CZ 6671 N N . ASP F 4 ? 0.3462 0.2783 0.2766 -0.0200 -0.1205 -0.0045 4 ASP F N 6672 C CA . ASP F 4 ? 0.4067 0.2786 0.2838 -0.0397 -0.1298 0.0007 4 ASP F CA 6673 C C . ASP F 4 ? 0.3695 0.2261 0.2540 -0.0307 -0.1142 0.0015 4 ASP F C 6674 O O . ASP F 4 ? 0.4149 0.2770 0.3117 -0.0301 -0.0788 -0.0016 4 ASP F O 6675 C CB . ASP F 4 ? 0.6000 0.4293 0.4222 -0.0733 -0.1100 0.0013 4 ASP F CB 6676 C CG . ASP F 4 ? 0.6738 0.4439 0.4294 -0.0948 -0.1234 0.0090 4 ASP F CG 6677 O OD1 . ASP F 4 ? 0.6925 0.4439 0.4446 -0.0889 -0.1298 0.0166 4 ASP F OD1 6678 O OD2 . ASP F 4 ? 0.8002 0.5405 0.5048 -0.1187 -0.1282 0.0079 4 ASP F OD2 6679 N N . LEU F 5 ? 0.4394 0.2752 0.3196 -0.0245 -0.1425 0.0060 5 LEU F N 6680 C CA . LEU F 5 ? 0.5233 0.3429 0.4163 -0.0202 -0.1322 0.0072 5 LEU F CA 6681 C C . LEU F 5 ? 0.6317 0.4053 0.4808 -0.0510 -0.0996 0.0159 5 LEU F C 6682 O O . LEU F 5 ? 0.7007 0.4746 0.5712 -0.0506 -0.0754 0.0150 5 LEU F O 6683 C CB . LEU F 5 ? 0.5226 0.3252 0.4243 -0.0073 -0.1738 0.0105 5 LEU F CB 6684 C CG . LEU F 5 ? 0.4874 0.3364 0.4361 0.0286 -0.2030 -0.0023 5 LEU F CG 6685 C CD1 . LEU F 5 ? 0.4374 0.2599 0.3929 0.0342 -0.2226 -0.0033 5 LEU F CD1 6686 C CD2 . LEU F 5 ? 0.5044 0.4036 0.5009 0.0529 -0.1801 -0.0171 5 LEU F CD2 6687 N N . SER F 6 ? 0.7550 0.4921 0.5436 -0.0769 -0.0986 0.0231 6 SER F N 6688 C CA . SER F 6 ? 0.7962 0.4900 0.5344 -0.1049 -0.0650 0.0302 6 SER F CA 6689 C C . SER F 6 ? 0.7236 0.4345 0.4765 -0.1059 -0.0183 0.0190 6 SER F C 6690 O O . SER F 6 ? 0.8089 0.5059 0.5572 -0.1160 0.0161 0.0209 6 SER F O 6691 C CB . SER F 6 ? 0.9727 0.6231 0.6336 -0.1294 -0.0788 0.0380 6 SER F CB 6692 O OG . SER F 6 ? 1.0111 0.6553 0.6671 -0.1219 -0.1294 0.0463 6 SER F OG 6693 N N . THR F 7 ? 0.6171 0.3587 0.3914 -0.0955 -0.0160 0.0084 7 THR F N 6694 C CA . THR F 7 ? 0.5986 0.3484 0.3833 -0.0959 0.0245 -0.0010 7 THR F CA 6695 C C . THR F 7 ? 0.4903 0.2911 0.3425 -0.0676 0.0305 -0.0060 7 THR F C 6696 O O . THR F 7 ? 0.5132 0.3195 0.3795 -0.0643 0.0630 -0.0113 7 THR F O 6697 C CB . THR F 7 ? 0.5949 0.3249 0.3378 -0.1136 0.0273 -0.0077 7 THR F CB 6698 O OG1 . THR F 7 ? 0.5593 0.3171 0.3217 -0.1064 -0.0087 -0.0071 7 THR F OG1 6699 C CG2 . THR F 7 ? 0.6302 0.3057 0.2941 -0.1412 0.0284 -0.0053 7 THR F CG2 6700 N N . ARG F 8 ? 0.3460 0.1823 0.2369 -0.0452 0.0001 -0.0049 8 ARG F N 6701 C CA . ARG F 8 ? 0.3629 0.2498 0.3081 -0.0164 0.0034 -0.0092 8 ARG F CA 6702 C C . ARG F 8 ? 0.3733 0.2749 0.3215 -0.0186 0.0198 -0.0097 8 ARG F C 6703 O O . ARG F 8 ? 0.3590 0.2875 0.3389 -0.0018 0.0387 -0.0096 8 ARG F O 6704 C CB . ARG F 8 ? 0.3234 0.2195 0.3002 -0.0036 0.0245 -0.0119 8 ARG F CB 6705 C CG . ARG F 8 ? 0.4452 0.3269 0.4286 -0.0048 0.0083 -0.0107 8 ARG F CG 6706 C CD . ARG F 8 ? 0.4496 0.3594 0.4838 0.0160 0.0151 -0.0166 8 ARG F CD 6707 N NE . ARG F 8 ? 0.4627 0.3524 0.5067 0.0071 0.0039 -0.0146 8 ARG F NE 6708 C CZ . ARG F 8 ? 0.4231 0.3327 0.5143 0.0206 0.0007 -0.0208 8 ARG F CZ 6709 N NH1 . ARG F 8 ? 0.3917 0.3424 0.5188 0.0469 0.0066 -0.0295 8 ARG F NH1 6710 N NH2 . ARG F 8 ? 0.2676 0.1551 0.3702 0.0069 -0.0101 -0.0171 8 ARG F NH2 6711 N N . ARG F 9 ? 0.3142 0.1962 0.2296 -0.0400 0.0102 -0.0090 9 ARG F N 6712 C CA . ARG F 9 ? 0.4045 0.2954 0.3251 -0.0479 0.0212 -0.0091 9 ARG F CA 6713 C C . ARG F 9 ? 0.4610 0.3779 0.3901 -0.0510 -0.0117 -0.0068 9 ARG F C 6714 O O . ARG F 9 ? 0.3306 0.2414 0.2441 -0.0531 -0.0427 -0.0067 9 ARG F O 6715 C CB . ARG F 9 ? 0.3901 0.2277 0.2646 -0.0753 0.0450 -0.0151 9 ARG F CB 6716 C CG . ARG F 9 ? 0.3941 0.2149 0.2718 -0.0693 0.0831 -0.0185 9 ARG F CG 6717 C CD . ARG F 9 ? 0.4124 0.2655 0.3379 -0.0486 0.1002 -0.0143 9 ARG F CD 6718 N NE . ARG F 9 ? 0.3691 0.2192 0.2955 -0.0609 0.1009 -0.0126 9 ARG F NE 6719 C CZ . ARG F 9 ? 0.4383 0.2442 0.3390 -0.0795 0.1209 -0.0201 9 ARG F CZ 6720 N NH1 . ARG F 9 ? 0.4483 0.2132 0.3179 -0.0850 0.1450 -0.0309 9 ARG F NH1 6721 N NH2 . ARG F 9 ? 0.5307 0.3336 0.4390 -0.0930 0.1174 -0.0178 9 ARG F NH2 6722 N N . LEU F 10 ? 0.2993 0.2463 0.2573 -0.0511 -0.0049 -0.0034 10 LEU F N 6723 C CA . LEU F 10 ? 0.2991 0.2795 0.2762 -0.0563 -0.0326 -0.0010 10 LEU F CA 6724 C C . LEU F 10 ? 0.4915 0.4279 0.4245 -0.0899 -0.0482 -0.0066 10 LEU F C 6725 O O . LEU F 10 ? 0.5797 0.4719 0.4814 -0.1116 -0.0276 -0.0118 10 LEU F O 6726 C CB . LEU F 10 ? 0.4057 0.4330 0.4298 -0.0503 -0.0167 0.0076 10 LEU F CB 6727 C CG . LEU F 10 ? 0.2565 0.3397 0.3216 -0.0137 -0.0085 0.0138 10 LEU F CG 6728 C CD1 . LEU F 10 ? 0.2098 0.3343 0.3121 -0.0125 0.0112 0.0272 10 LEU F CD1 6729 C CD2 . LEU F 10 ? 0.2052 0.3266 0.2874 0.0089 -0.0408 0.0088 10 LEU F CD2 6730 N N . LYS F 11 ? 0.4524 0.3994 0.3814 -0.0921 -0.0867 -0.0070 11 LYS F N 6731 C CA . LYS F 11 ? 0.4268 0.3380 0.3134 -0.1218 -0.1103 -0.0123 11 LYS F CA 6732 C C . LYS F 11 ? 0.5619 0.5214 0.4952 -0.1296 -0.1321 -0.0109 11 LYS F C 6733 O O . LYS F 11 ? 0.5407 0.5587 0.5237 -0.1085 -0.1518 -0.0061 11 LYS F O 6734 C CB . LYS F 11 ? 0.6798 0.5625 0.5236 -0.1203 -0.1422 -0.0112 11 LYS F CB 6735 C CG . LYS F 11 ? 0.7968 0.6634 0.6094 -0.1418 -0.1825 -0.0138 11 LYS F CG 6736 C CD . LYS F 11 ? 0.8735 0.7373 0.6776 -0.1227 -0.2106 -0.0055 11 LYS F CD 6737 C CE . LYS F 11 ? 0.9209 0.7307 0.6713 -0.1236 -0.1969 -0.0001 11 LYS F CE 6738 N NZ . LYS F 11 ? 0.9552 0.7627 0.7123 -0.1033 -0.2197 0.0105 11 LYS F NZ 6767 N N . CY3 I . ? 0.5567 0.6693 0.5934 -0.0834 0.0851 -0.0142 101 CY3 E N 6768 C CA . CY3 I . ? 0.6092 0.7737 0.6888 -0.1048 0.1081 -0.0253 101 CY3 E CA 6769 C C . CY3 I . ? 0.6848 0.8712 0.7400 -0.1154 0.1399 -0.0164 101 CY3 E C 6770 O O . CY3 I . ? 0.7740 0.9213 0.7763 -0.1157 0.1467 0.0070 101 CY3 E O 6771 C CB . CY3 I . ? 0.6309 0.7774 0.7387 -0.1348 0.1127 -0.0208 101 CY3 E CB 6772 S SG . CY3 I . ? 0.6667 0.7825 0.7864 -0.1227 0.0771 -0.0286 101 CY3 E SG 6773 N N1 . CY3 I . ? 0.6687 0.9257 0.7632 -0.1230 0.1585 -0.0360 101 CY3 E N1 6774 N N . CY3 J . ? 0.7154 0.6520 0.6367 -0.1597 -0.1283 -0.0165 101 CY3 F N 6775 C CA . CY3 J . ? 0.7073 0.6910 0.6808 -0.1731 -0.1482 -0.0146 101 CY3 F CA 6776 C C . CY3 J . ? 0.6722 0.6216 0.6041 -0.2020 -0.1873 -0.0253 101 CY3 F C 6777 O O . CY3 J . ? 0.8492 0.7300 0.7073 -0.2170 -0.1838 -0.0352 101 CY3 F O 6778 C CB . CY3 J . ? 0.7897 0.7783 0.7958 -0.1864 -0.1141 -0.0107 101 CY3 F CB 6779 S SG . CY3 J . ? 0.8583 0.8506 0.8757 -0.1562 -0.0638 -0.0007 101 CY3 F SG 6780 N N1 . CY3 J . ? 0.5345 0.5381 0.5171 -0.2028 -0.2201 -0.0231 101 CY3 F N1 # 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 ? ? ? B . n B 2 135 LYS 135 135 ? ? ? B . n B 2 136 SER 136 136 ? ? ? B . n B 2 137 THR 137 137 ? ? ? 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 SC2 1 1 1 SC2 SC2 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 LEU 10 10 10 LEU LEU E . n E 3 11 LYS 11 11 11 LYS LYS E . n F 3 1 SC2 1 1 1 SC2 SC2 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 LEU 10 10 10 LEU LEU F . n F 3 11 LYS 11 11 11 LYS LYS 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 NAG 1 301 222 NAG NAG B . H 4 NAG 1 301 222 NAG NAG D . I 5 CY3 1 101 12 CY3 DRG E . J 5 CY3 1 101 12 CY3 DRG F . K 6 HOH 1 301 188 HOH HOH A . K 6 HOH 2 302 121 HOH HOH A . K 6 HOH 3 303 243 HOH HOH A . K 6 HOH 4 304 146 HOH HOH A . K 6 HOH 5 305 113 HOH HOH A . K 6 HOH 6 306 36 HOH HOH A . K 6 HOH 7 307 234 HOH HOH A . K 6 HOH 8 308 246 HOH HOH A . K 6 HOH 9 309 32 HOH HOH A . K 6 HOH 10 310 38 HOH HOH A . K 6 HOH 11 311 69 HOH HOH A . K 6 HOH 12 312 106 HOH HOH A . K 6 HOH 13 313 67 HOH HOH A . K 6 HOH 14 314 172 HOH HOH A . K 6 HOH 15 315 256 HOH HOH A . K 6 HOH 16 316 20 HOH HOH A . K 6 HOH 17 317 29 HOH HOH A . K 6 HOH 18 318 220 HOH HOH A . K 6 HOH 19 319 130 HOH HOH A . K 6 HOH 20 320 149 HOH HOH A . K 6 HOH 21 321 15 HOH HOH A . K 6 HOH 22 322 60 HOH HOH A . K 6 HOH 23 323 114 HOH HOH A . K 6 HOH 24 324 9 HOH HOH A . K 6 HOH 25 325 168 HOH HOH A . K 6 HOH 26 326 273 HOH HOH A . K 6 HOH 27 327 155 HOH HOH A . K 6 HOH 28 328 100 HOH HOH A . K 6 HOH 29 329 21 HOH HOH A . K 6 HOH 30 330 105 HOH HOH A . K 6 HOH 31 331 33 HOH HOH A . K 6 HOH 32 332 94 HOH HOH A . K 6 HOH 33 333 170 HOH HOH A . K 6 HOH 34 334 110 HOH HOH A . K 6 HOH 35 335 122 HOH HOH A . K 6 HOH 36 336 48 HOH HOH A . K 6 HOH 37 337 135 HOH HOH A . K 6 HOH 38 338 152 HOH HOH A . K 6 HOH 39 339 61 HOH HOH A . K 6 HOH 40 340 92 HOH HOH A . K 6 HOH 41 341 210 HOH HOH A . K 6 HOH 42 342 81 HOH HOH A . K 6 HOH 43 343 182 HOH HOH A . K 6 HOH 44 344 59 HOH HOH A . K 6 HOH 45 345 25 HOH HOH A . K 6 HOH 46 346 272 HOH HOH A . K 6 HOH 47 347 101 HOH HOH A . K 6 HOH 48 348 95 HOH HOH A . K 6 HOH 49 349 120 HOH HOH A . K 6 HOH 50 350 259 HOH HOH A . K 6 HOH 51 351 58 HOH HOH A . K 6 HOH 52 352 269 HOH HOH A . K 6 HOH 53 353 103 HOH HOH A . K 6 HOH 54 354 71 HOH HOH A . K 6 HOH 55 355 82 HOH HOH A . K 6 HOH 56 356 251 HOH HOH A . K 6 HOH 57 357 37 HOH HOH A . K 6 HOH 58 358 285 HOH HOH A . K 6 HOH 59 359 186 HOH HOH A . K 6 HOH 60 360 231 HOH HOH A . K 6 HOH 61 361 96 HOH HOH A . K 6 HOH 62 362 211 HOH HOH A . K 6 HOH 63 363 222 HOH HOH A . K 6 HOH 64 364 145 HOH HOH A . K 6 HOH 65 365 282 HOH HOH A . K 6 HOH 66 366 180 HOH HOH A . K 6 HOH 67 367 212 HOH HOH A . K 6 HOH 68 368 270 HOH HOH A . K 6 HOH 69 369 151 HOH HOH A . L 6 HOH 1 401 158 HOH HOH B . L 6 HOH 2 402 76 HOH HOH B . L 6 HOH 3 403 30 HOH HOH B . L 6 HOH 4 404 73 HOH HOH B . L 6 HOH 5 405 213 HOH HOH B . L 6 HOH 6 406 200 HOH HOH B . L 6 HOH 7 407 262 HOH HOH B . L 6 HOH 8 408 34 HOH HOH B . L 6 HOH 9 409 163 HOH HOH B . L 6 HOH 10 410 63 HOH HOH B . L 6 HOH 11 411 198 HOH HOH B . L 6 HOH 12 412 117 HOH HOH B . L 6 HOH 13 413 7 HOH HOH B . L 6 HOH 14 414 215 HOH HOH B . L 6 HOH 15 415 102 HOH HOH B . L 6 HOH 16 416 191 HOH HOH B . L 6 HOH 17 417 249 HOH HOH B . L 6 HOH 18 418 281 HOH HOH B . L 6 HOH 19 419 258 HOH HOH B . L 6 HOH 20 420 23 HOH HOH B . L 6 HOH 21 421 280 HOH HOH B . L 6 HOH 22 422 17 HOH HOH B . L 6 HOH 23 423 128 HOH HOH B . L 6 HOH 24 424 2 HOH HOH B . L 6 HOH 25 425 6 HOH HOH B . L 6 HOH 26 426 160 HOH HOH B . L 6 HOH 27 427 86 HOH HOH B . L 6 HOH 28 428 74 HOH HOH B . L 6 HOH 29 429 184 HOH HOH B . L 6 HOH 30 430 227 HOH HOH B . L 6 HOH 31 431 221 HOH HOH B . L 6 HOH 32 432 206 HOH HOH B . L 6 HOH 33 433 233 HOH HOH B . L 6 HOH 34 434 88 HOH HOH B . L 6 HOH 35 435 64 HOH HOH B . L 6 HOH 36 436 10 HOH HOH B . L 6 HOH 37 437 181 HOH HOH B . L 6 HOH 38 438 119 HOH HOH B . L 6 HOH 39 439 195 HOH HOH B . L 6 HOH 40 440 52 HOH HOH B . L 6 HOH 41 441 70 HOH HOH B . L 6 HOH 42 442 51 HOH HOH B . L 6 HOH 43 443 31 HOH HOH B . L 6 HOH 44 444 115 HOH HOH B . L 6 HOH 45 445 248 HOH HOH B . L 6 HOH 46 446 50 HOH HOH B . L 6 HOH 47 447 78 HOH HOH B . L 6 HOH 48 448 12 HOH HOH B . L 6 HOH 49 449 176 HOH HOH B . L 6 HOH 50 450 260 HOH HOH B . L 6 HOH 51 451 174 HOH HOH B . L 6 HOH 52 452 136 HOH HOH B . L 6 HOH 53 453 223 HOH HOH B . L 6 HOH 54 454 228 HOH HOH B . L 6 HOH 55 455 232 HOH HOH B . L 6 HOH 56 456 127 HOH HOH B . L 6 HOH 57 457 276 HOH HOH B . L 6 HOH 58 458 217 HOH HOH B . L 6 HOH 59 459 123 HOH HOH B . M 6 HOH 1 301 18 HOH HOH C . M 6 HOH 2 302 22 HOH HOH C . M 6 HOH 3 303 202 HOH HOH C . M 6 HOH 4 304 185 HOH HOH C . M 6 HOH 5 305 166 HOH HOH C . M 6 HOH 6 306 19 HOH HOH C . M 6 HOH 7 307 42 HOH HOH C . M 6 HOH 8 308 43 HOH HOH C . M 6 HOH 9 309 205 HOH HOH C . M 6 HOH 10 310 134 HOH HOH C . M 6 HOH 11 311 139 HOH HOH C . M 6 HOH 12 312 118 HOH HOH C . M 6 HOH 13 313 178 HOH HOH C . M 6 HOH 14 314 72 HOH HOH C . M 6 HOH 15 315 218 HOH HOH C . M 6 HOH 16 316 1 HOH HOH C . M 6 HOH 17 317 8 HOH HOH C . M 6 HOH 18 318 225 HOH HOH C . M 6 HOH 19 319 24 HOH HOH C . M 6 HOH 20 320 85 HOH HOH C . M 6 HOH 21 321 150 HOH HOH C . M 6 HOH 22 322 89 HOH HOH C . M 6 HOH 23 323 14 HOH HOH C . M 6 HOH 24 324 13 HOH HOH C . M 6 HOH 25 325 190 HOH HOH C . M 6 HOH 26 326 147 HOH HOH C . M 6 HOH 27 327 83 HOH HOH C . M 6 HOH 28 328 179 HOH HOH C . M 6 HOH 29 329 112 HOH HOH C . M 6 HOH 30 330 41 HOH HOH C . M 6 HOH 31 331 80 HOH HOH C . M 6 HOH 32 332 40 HOH HOH C . M 6 HOH 33 333 111 HOH HOH C . M 6 HOH 34 334 65 HOH HOH C . M 6 HOH 35 335 35 HOH HOH C . M 6 HOH 36 336 77 HOH HOH C . M 6 HOH 37 337 177 HOH HOH C . M 6 HOH 38 338 126 HOH HOH C . M 6 HOH 39 339 143 HOH HOH C . M 6 HOH 40 340 203 HOH HOH C . M 6 HOH 41 341 263 HOH HOH C . M 6 HOH 42 342 141 HOH HOH C . M 6 HOH 43 343 46 HOH HOH C . M 6 HOH 44 344 162 HOH HOH C . M 6 HOH 45 345 5 HOH HOH C . M 6 HOH 46 346 253 HOH HOH C . M 6 HOH 47 347 156 HOH HOH C . M 6 HOH 48 348 283 HOH HOH C . M 6 HOH 49 349 11 HOH HOH C . M 6 HOH 50 350 264 HOH HOH C . M 6 HOH 51 351 84 HOH HOH C . M 6 HOH 52 352 56 HOH HOH C . M 6 HOH 53 353 98 HOH HOH C . M 6 HOH 54 354 183 HOH HOH C . M 6 HOH 55 355 75 HOH HOH C . M 6 HOH 56 356 171 HOH HOH C . M 6 HOH 57 357 165 HOH HOH C . M 6 HOH 58 358 55 HOH HOH C . M 6 HOH 59 359 79 HOH HOH C . M 6 HOH 60 360 167 HOH HOH C . M 6 HOH 61 361 236 HOH HOH C . M 6 HOH 62 362 148 HOH HOH C . M 6 HOH 63 363 104 HOH HOH C . M 6 HOH 64 364 28 HOH HOH C . M 6 HOH 65 365 57 HOH HOH C . M 6 HOH 66 366 187 HOH HOH C . M 6 HOH 67 367 229 HOH HOH C . M 6 HOH 68 368 161 HOH HOH C . M 6 HOH 69 369 164 HOH HOH C . M 6 HOH 70 370 230 HOH HOH C . M 6 HOH 71 371 194 HOH HOH C . M 6 HOH 72 372 132 HOH HOH C . M 6 HOH 73 373 153 HOH HOH C . M 6 HOH 74 374 266 HOH HOH C . M 6 HOH 75 375 224 HOH HOH C . M 6 HOH 76 376 39 HOH HOH C . M 6 HOH 77 377 124 HOH HOH C . M 6 HOH 78 378 199 HOH HOH C . M 6 HOH 79 379 240 HOH HOH C . M 6 HOH 80 380 140 HOH HOH C . M 6 HOH 81 381 189 HOH HOH C . M 6 HOH 82 382 255 HOH HOH C . M 6 HOH 83 383 245 HOH HOH C . M 6 HOH 84 384 159 HOH HOH C . M 6 HOH 85 385 157 HOH HOH C . M 6 HOH 86 386 239 HOH HOH C . M 6 HOH 87 387 261 HOH HOH C . M 6 HOH 88 388 91 HOH HOH C . M 6 HOH 89 389 237 HOH HOH C . M 6 HOH 90 390 142 HOH HOH C . M 6 HOH 91 391 214 HOH HOH C . M 6 HOH 92 392 271 HOH HOH C . N 6 HOH 1 401 219 HOH HOH D . N 6 HOH 2 402 204 HOH HOH D . N 6 HOH 3 403 47 HOH HOH D . N 6 HOH 4 404 68 HOH HOH D . N 6 HOH 5 405 265 HOH HOH D . N 6 HOH 6 406 99 HOH HOH D . N 6 HOH 7 407 277 HOH HOH D . N 6 HOH 8 408 45 HOH HOH D . N 6 HOH 9 409 53 HOH HOH D . N 6 HOH 10 410 137 HOH HOH D . N 6 HOH 11 411 138 HOH HOH D . N 6 HOH 12 412 27 HOH HOH D . N 6 HOH 13 413 4 HOH HOH D . N 6 HOH 14 414 154 HOH HOH D . N 6 HOH 15 415 109 HOH HOH D . N 6 HOH 16 416 3 HOH HOH D . N 6 HOH 17 417 107 HOH HOH D . N 6 HOH 18 418 169 HOH HOH D . N 6 HOH 19 419 197 HOH HOH D . N 6 HOH 20 420 129 HOH HOH D . N 6 HOH 21 421 284 HOH HOH D . N 6 HOH 22 422 216 HOH HOH D . N 6 HOH 23 423 235 HOH HOH D . N 6 HOH 24 424 16 HOH HOH D . N 6 HOH 25 425 108 HOH HOH D . N 6 HOH 26 426 26 HOH HOH D . N 6 HOH 27 427 208 HOH HOH D . N 6 HOH 28 428 87 HOH HOH D . N 6 HOH 29 429 209 HOH HOH D . N 6 HOH 30 430 93 HOH HOH D . N 6 HOH 31 431 49 HOH HOH D . N 6 HOH 32 432 131 HOH HOH D . N 6 HOH 33 433 97 HOH HOH D . N 6 HOH 34 434 207 HOH HOH D . N 6 HOH 35 435 62 HOH HOH D . N 6 HOH 36 436 267 HOH HOH D . N 6 HOH 37 437 116 HOH HOH D . N 6 HOH 38 438 133 HOH HOH D . N 6 HOH 39 439 278 HOH HOH D . N 6 HOH 40 440 238 HOH HOH D . N 6 HOH 41 441 125 HOH HOH D . N 6 HOH 42 442 175 HOH HOH D . N 6 HOH 43 443 244 HOH HOH D . N 6 HOH 44 444 54 HOH HOH D . N 6 HOH 45 445 193 HOH HOH D . N 6 HOH 46 446 192 HOH HOH D . N 6 HOH 47 447 257 HOH HOH D . N 6 HOH 48 448 242 HOH HOH D . N 6 HOH 49 449 247 HOH HOH D . N 6 HOH 50 450 275 HOH HOH D . N 6 HOH 51 451 173 HOH HOH D . N 6 HOH 52 452 196 HOH HOH D . N 6 HOH 53 453 252 HOH HOH D . N 6 HOH 54 454 144 HOH HOH D . N 6 HOH 55 455 201 HOH HOH D . O 6 HOH 1 201 44 HOH HOH E . O 6 HOH 2 202 90 HOH HOH E . P 6 HOH 1 201 268 HOH HOH F . P 6 HOH 2 202 241 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,I,K,L,O 2 1 C,D,F,H,J,M,N,P # 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)' 5670 ? 1 MORE -30 ? 1 'SSA (A^2)' 18830 ? 2 'ABSA (A^2)' 5630 ? 2 MORE -31 ? 2 'SSA (A^2)' 18660 ? # _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 2016-06-15 2 'Structure model' 1 1 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 2 '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 2 'Structure model' citation 2 2 '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 2 'Structure model' '_citation.journal_abbrev' 2 2 'Structure model' '_citation.pdbx_database_id_PubMed' 3 2 'Structure model' '_citation.title' 4 2 'Structure model' '_pdbx_struct_oper_list.symmetry_operation' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 'X-RAY DIFFRACTION' 1 ? refined -7.0193 25.4330 15.4176 0.2492 0.1837 0.1754 0.0013 -0.0532 -0.0383 1.2821 1.9963 2.0864 0.0301 -0.6631 -0.2753 0.0783 0.1589 -0.1813 -0.0924 0.0918 0.0503 0.3789 -0.0949 -0.1798 'X-RAY DIFFRACTION' 2 ? refined -4.0220 23.9596 21.8620 0.2347 0.2016 0.2595 0.0746 -0.0537 -0.0124 1.3852 3.8130 4.2938 -0.2045 0.3990 -1.9887 0.2069 0.4248 -0.6697 0.0778 0.0168 -0.0236 0.3923 0.5509 -0.1326 'X-RAY DIFFRACTION' 3 ? refined -10.3395 38.3515 9.8122 0.3052 0.2126 0.1607 0.0258 -0.0709 0.0419 0.1543 1.6070 0.2115 0.2727 0.0505 0.5512 0.1400 0.3488 -0.0784 -0.5400 0.3680 0.3801 0.0629 -0.4028 -0.2635 'X-RAY DIFFRACTION' 4 ? refined -1.9617 28.2240 48.1529 0.1457 0.1650 0.2071 -0.0404 0.0475 0.0154 0.7834 0.7253 2.1597 -0.4199 -0.0255 -0.9286 0.0010 -0.0918 0.0537 -0.0896 0.1115 -0.0257 -0.1281 0.3234 -0.0581 'X-RAY DIFFRACTION' 5 ? refined -7.4796 27.1299 50.9992 0.0706 0.2251 0.3295 0.0412 0.0044 -0.0705 1.2955 3.3226 2.7624 -0.8254 -0.6670 2.6417 -0.0815 0.0745 0.4207 -0.2787 0.0479 0.4332 -0.0757 -0.2072 0.0922 'X-RAY DIFFRACTION' 6 ? refined -12.3248 33.5185 55.8077 0.1622 0.2700 0.3132 0.0731 0.0042 0.0221 3.3158 1.2526 2.3546 -1.1208 -1.6424 1.6573 -0.1415 -0.2028 -0.4374 0.0347 -0.0328 0.2447 -0.1189 -0.5543 0.0815 'X-RAY DIFFRACTION' 7 ? refined -5.4760 28.2782 55.2132 0.1146 0.1770 0.2500 0.0179 -0.0201 -0.0144 1.5869 2.2634 3.1598 0.9151 -0.9790 0.9842 0.0337 -0.2163 0.0892 0.1881 -0.2217 0.2439 -0.1483 -0.0095 0.1834 'X-RAY DIFFRACTION' 8 ? refined 2.8200 50.1179 26.5564 0.2989 0.2828 0.2414 0.0070 0.0472 0.0046 3.0034 5.1288 7.9090 -2.2730 -4.4704 5.1095 0.3746 -0.0741 0.3471 -0.0240 0.0128 -0.3086 -0.6452 0.3046 -0.2925 'X-RAY DIFFRACTION' 9 ? refined 1.1599 45.9984 20.3084 0.1646 0.1424 0.1852 0.0025 0.0291 -0.0217 0.4083 0.2474 4.2023 0.0435 0.2227 -0.6038 -0.0100 0.0878 0.0489 -0.0734 0.0374 -0.0201 -0.2519 0.0217 -0.0358 'X-RAY DIFFRACTION' 10 ? refined 4.2388 35.4034 45.0984 0.0882 0.1318 0.1817 0.0049 0.0012 -0.0127 0.9519 3.1306 1.3297 -0.5253 0.2733 -0.3599 -0.0154 0.0359 -0.0451 0.0030 0.0673 0.0900 0.0270 0.0221 -0.0018 'X-RAY DIFFRACTION' 11 ? refined 12.7903 38.9850 47.3287 0.1148 0.1422 0.2456 -0.0466 0.0031 0.0003 5.1242 4.2664 3.3000 -3.8261 2.3596 -1.1488 -0.0825 0.2164 -0.1753 0.0317 0.0873 0.0206 -0.0336 0.3187 0.1358 'X-RAY DIFFRACTION' 12 ? refined -20.3937 16.7253 19.2764 0.2532 0.2309 0.2706 -0.0901 -0.0126 -0.0191 4.1539 5.0839 6.6450 -4.1771 -3.5288 4.0745 0.3238 0.2313 0.3824 0.0317 -0.0581 -0.2248 -0.1380 -0.0053 -0.1537 'X-RAY DIFFRACTION' 13 ? refined -28.0169 14.5156 12.0664 0.1887 0.1962 0.1508 0.0009 0.0036 0.0120 1.0408 2.8093 4.1011 0.5722 0.6251 -0.3837 0.0578 -0.0452 0.2089 0.0074 0.2365 0.1099 -0.2898 -0.1494 -0.2608 'X-RAY DIFFRACTION' 14 ? refined -28.4135 9.8541 30.6226 0.2036 0.1640 0.1434 -0.0228 0.0026 0.0226 0.5110 0.0635 2.0736 -0.0384 -0.0168 0.2689 -0.0102 0.0344 0.0733 -0.1218 0.0302 0.0254 -0.0717 0.0116 -0.0610 'X-RAY DIFFRACTION' 15 ? refined -25.0195 10.1383 48.9272 0.1350 0.1434 0.2246 0.0122 0.0529 0.0035 0.5857 3.9564 2.4633 -0.7286 0.7371 -3.0935 -0.1332 0.1826 -0.1058 0.2088 0.0837 -0.1482 -0.2008 0.0162 0.1272 'X-RAY DIFFRACTION' 16 ? refined -25.0819 9.3965 44.9586 0.1563 0.1513 0.2005 -0.0324 -0.0037 -0.0289 2.2523 2.0379 1.9925 -1.1980 1.6883 -1.8962 -0.2356 0.0751 0.2235 0.0202 0.0417 -0.0859 -0.0771 -0.0032 0.2107 'X-RAY DIFFRACTION' 17 ? refined -25.7468 6.6291 57.9690 0.0952 0.2817 0.1580 0.0367 -0.0273 -0.0488 1.0724 5.7871 3.4027 0.1101 0.1533 -2.2762 -0.0251 -0.1532 0.1109 0.5761 -0.0465 -0.0284 -0.2683 0.0492 0.0572 'X-RAY DIFFRACTION' 18 ? refined -38.5717 -8.4475 16.7552 0.2460 0.3383 0.1996 -0.0783 0.0312 0.0063 3.5541 2.1487 5.4936 -1.6868 3.5048 -2.3823 -0.0718 -0.0041 0.0787 -0.2423 0.0359 -0.0983 0.4139 -0.3252 0.0130 'X-RAY DIFFRACTION' 19 ? refined -27.3880 -3.7741 14.5719 0.2182 0.1489 0.2132 -0.0191 -0.0093 0.0018 1.6515 3.5745 5.3215 1.5058 1.0173 3.1987 0.0026 -0.0623 -0.2313 -0.0242 0.3644 -0.3052 0.2912 0.0622 -0.2727 'X-RAY DIFFRACTION' 20 ? refined -30.1948 -11.6091 7.1307 0.2910 0.1742 0.2667 0.0383 0.0112 0.0262 5.0283 2.9799 3.4419 2.2763 0.4805 0.3075 -0.1229 0.0832 -0.0548 -0.0448 0.0887 -0.1651 0.6691 0.1460 0.0251 'X-RAY DIFFRACTION' 21 ? refined -33.7768 -5.8385 21.7547 0.2248 0.1235 0.2201 -0.0049 0.0103 0.0066 0.9433 -0.0487 2.7053 0.1383 0.6146 -0.1921 0.0224 0.1531 -0.1302 -0.1020 0.0010 -0.0021 0.2272 0.0814 -0.0333 'X-RAY DIFFRACTION' 22 ? refined -36.2240 2.0396 42.3964 0.0980 0.1432 0.1866 0.0135 -0.0261 -0.0120 0.7131 1.6643 0.7909 -0.2624 -0.7101 0.1515 0.0148 0.0785 -0.0017 0.0539 -0.0461 0.0252 0.0754 -0.0349 0.0533 'X-RAY DIFFRACTION' 23 ? refined -44.9113 -1.3273 45.0608 0.1142 0.1721 0.1942 -0.0048 -0.0194 0.0441 2.4784 3.4132 3.3691 -1.6033 -1.7474 1.4265 0.0986 0.2334 -0.0051 0.0487 -0.1668 0.2915 0.1629 -0.5070 0.0198 'X-RAY DIFFRACTION' 24 ? refined -8.7597 34.8076 30.8947 0.2147 0.2430 0.1914 -0.0072 -0.0426 -0.0285 7.0199 2.8954 6.4201 0.3133 0.9459 1.7001 -0.3055 -0.4183 -0.0745 0.6639 0.0151 0.4943 0.0551 -0.5000 0.1821 'X-RAY DIFFRACTION' 25 ? refined -23.8452 4.3681 28.3356 0.3333 0.2592 0.2520 -0.0464 -0.0794 -0.0054 4.8451 5.1352 4.0481 -0.7180 1.1420 0.1062 0.7769 -0.0438 0.0022 1.1504 -0.4021 -0.3391 -0.0236 0.6210 -0.3211 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 'X-RAY DIFFRACTION' 1 1 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 1 through 75 ) ; 'X-RAY DIFFRACTION' 2 2 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 76 through 90 ) ; 'X-RAY DIFFRACTION' 3 3 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 91 through 101 ) ; 'X-RAY DIFFRACTION' 4 4 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 102 through 128 ) ; 'X-RAY DIFFRACTION' 5 5 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 129 through 150 ) ; 'X-RAY DIFFRACTION' 6 6 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 151 through 163 ) ; 'X-RAY DIFFRACTION' 7 7 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resid 164 through 213 ) ; 'X-RAY DIFFRACTION' 8 8 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 1 through 17 ) ; 'X-RAY DIFFRACTION' 9 9 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 18 through 140 ) ; 'X-RAY DIFFRACTION' 10 10 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 141 through 195 ) ; 'X-RAY DIFFRACTION' 11 11 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resid 196 through 220 ) ; 'X-RAY DIFFRACTION' 12 12 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 1 through 18 ) ; 'X-RAY DIFFRACTION' 13 13 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 19 through 75 ) ; 'X-RAY DIFFRACTION' 14 14 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 76 through 128 ) ; 'X-RAY DIFFRACTION' 15 15 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 129 through 150 ) ; 'X-RAY DIFFRACTION' 16 16 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 151 through 174 ) ; 'X-RAY DIFFRACTION' 17 17 ? ? ? ? ? ? ? ? ? ;chain 'C' and (resid 175 through 213 ) ; 'X-RAY DIFFRACTION' 18 18 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 1 through 33 ) ; 'X-RAY DIFFRACTION' 19 19 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 34 through 51 ) ; 'X-RAY DIFFRACTION' 20 20 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 52 through 72 ) ; 'X-RAY DIFFRACTION' 21 21 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 73 through 140 ) ; 'X-RAY DIFFRACTION' 22 22 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 141 through 194 ) ; 'X-RAY DIFFRACTION' 23 23 ? ? ? ? ? ? ? ? ? ;chain 'D' and (resid 195 through 220 ) ; 'X-RAY DIFFRACTION' 24 24 ? ? ? ? ? ? ? ? ? ;chain 'E' and (resid 1 through 11 ) ; 'X-RAY DIFFRACTION' 25 25 ? ? ? ? ? ? ? ? ? ;chain 'F' and (resid 1 through 11 ) ; # 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 C HOH 313 ? ? O C HOH 382 ? ? 1.82 2 1 O D GLU 218 ? ? O D HOH 401 ? ? 1.98 3 1 O D HOH 405 ? ? O D HOH 451 ? ? 1.99 4 1 O B HOH 451 ? ? O B HOH 452 ? ? 2.00 5 1 OD1 C ASP 82 ? ? O C HOH 301 ? ? 2.01 6 1 O B HOH 454 ? ? O B HOH 455 ? ? 2.01 7 1 O A PRO 204 ? ? O A HOH 301 ? ? 2.01 8 1 OXT A ALA 213 ? ? O A HOH 302 ? ? 2.05 9 1 O C THR 178 ? ? O C HOH 302 ? ? 2.06 10 1 OE2 A GLU 123 ? ? O A HOH 303 ? ? 2.07 11 1 OE1 A GLN 27 ? ? O A HOH 304 ? ? 2.09 12 1 ND2 B ASN 83 ? ? O B HOH 401 ? ? 2.10 13 1 OD2 C ASP 185 ? ? O C HOH 303 ? ? 2.10 14 1 O A THR 178 ? ? O A HOH 305 ? ? 2.12 15 1 OE2 A GLU 161 ? ? O A HOH 306 ? ? 2.13 16 1 OD2 A ASP 85 ? ? O A HOH 307 ? ? 2.15 17 1 O B HOH 415 ? ? O B HOH 424 ? ? 2.16 18 1 O A HOH 337 ? ? O E HOH 201 ? ? 2.17 # 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 ? ? 68.09 -51.29 2 1 SER A 77 ? ? -160.55 90.90 3 1 ALA A 84 ? ? -171.15 -173.68 4 1 ASN A 91 ? ? -140.09 30.48 5 1 ASN A 138 ? ? 54.16 74.33 6 1 LYS A 190 ? ? -127.25 -54.29 7 1 ARG A 211 ? ? -56.50 101.83 8 1 SER B 84 ? ? 43.88 76.80 9 1 ASP B 150 ? ? 62.95 60.49 10 1 ALA C 51 ? ? 70.67 -46.56 11 1 ALA C 84 ? ? -170.37 -172.61 12 1 ASN C 91 ? ? -143.88 43.12 13 1 ASN C 138 ? ? 55.18 74.67 14 1 PRO C 141 ? ? -75.20 -169.82 15 1 SER D 15 ? ? 69.21 -15.00 16 1 ARG D 66 ? ? -149.32 12.63 17 1 ASP D 150 ? ? 66.62 68.76 # 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 LYS 169 ? CG ? A LYS 169 CG 2 1 Y 1 A LYS 169 ? CD ? A LYS 169 CD 3 1 Y 1 A LYS 169 ? CE ? A LYS 169 CE 4 1 Y 1 A LYS 169 ? NZ ? A LYS 169 NZ 5 1 Y 1 B GLN 1 ? CG ? B GLN 1 CG 6 1 Y 1 B GLN 1 ? CD ? B GLN 1 CD 7 1 Y 1 B GLN 1 ? OE1 ? B GLN 1 OE1 8 1 Y 1 B GLN 1 ? NE2 ? B GLN 1 NE2 9 1 Y 1 C LYS 169 ? CG ? C LYS 169 CG 10 1 Y 1 C LYS 169 ? CD ? C LYS 169 CD 11 1 Y 1 C LYS 169 ? CE ? C LYS 169 CE 12 1 Y 1 C LYS 169 ? NZ ? C LYS 169 NZ 13 1 Y 1 D GLN 1 ? CG ? D GLN 1 CG 14 1 Y 1 D GLN 1 ? CD ? D GLN 1 CD 15 1 Y 1 D GLN 1 ? OE1 ? D GLN 1 OE1 16 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 134 ? B SER 134 2 1 Y 1 B LYS 135 ? B LYS 135 3 1 Y 1 B SER 136 ? B SER 136 4 1 Y 1 B THR 137 ? B THR 137 5 1 Y 1 B SER 221 ? B SER 221 6 1 Y 1 D SER 134 ? D SER 134 7 1 Y 1 D LYS 135 ? D LYS 135 8 1 Y 1 D SER 136 ? D SER 136 9 1 Y 1 D THR 137 ? D THR 137 10 1 Y 1 D SER 138 ? D SER 138 11 1 Y 1 D GLY 139 ? D GLY 139 12 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 N-ACETYL-D-GLUCOSAMINE NAG 5 2-AMINO-3-MERCAPTO-PROPIONAMIDE CY3 6 water HOH #