data_4R4B # _entry.id 4R4B # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4R4B RCSB RCSB086881 WWPDB D_1000086881 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 4R4F . unspecified PDB 4R4H . unspecified PDB 4R4N . unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 4R4B _pdbx_database_status.recvd_initial_deposition_date 2014-08-19 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'McLellan, J.S.' 1 'Acharya, P.' 2 'Huang, C.-C.' 3 'Robinson, J.' 4 'Kwong, P.D.' 5 # _citation.id primary _citation.title 'Structural Definition of an Antibody-Dependent Cellular Cytotoxicity Response Implicated in Reduced Risk for HIV-1 Infection.' _citation.journal_abbrev J.Virol. _citation.journal_volume 88 _citation.page_first 12895 _citation.page_last 12906 _citation.year 2014 _citation.journal_id_ASTM JOVIAM _citation.country US _citation.journal_id_ISSN 0022-538X _citation.journal_id_CSD 0825 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 25165110 _citation.pdbx_database_id_DOI 10.1128/JVI.02194-14 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Acharya, P.' 1 primary 'Tolbert, W.D.' 2 primary 'Gohain, N.' 3 primary 'Wu, X.' 4 primary 'Yu, L.' 5 primary 'Liu, T.' 6 primary 'Huang, W.' 7 primary 'Huang, C.C.' 8 primary 'Kwon, Y.D.' 9 primary 'Louder, R.K.' 10 primary 'Luongo, T.S.' 11 primary 'McLellan, J.S.' 12 primary 'Pancera, M.' 13 primary 'Yang, Y.' 14 primary 'Zhang, B.' 15 primary 'Flinko, R.' 16 primary 'Foulke, J.S.' 17 primary 'Sajadi, M.M.' 18 primary 'Kamin-Lewis, R.' 19 primary 'Robinson, J.E.' 20 primary 'Martin, L.' 21 primary 'Kwong, P.D.' 22 primary 'Guan, Y.' 23 primary 'DeVico, A.L.' 24 primary 'Lewis, G.K.' 25 primary 'Pazgier, M.' 26 # _cell.entry_id 4R4B _cell.length_a 195.011 _cell.length_b 133.559 _cell.length_c 90.774 _cell.angle_alpha 90.00 _cell.angle_beta 91.36 _cell.angle_gamma 90.00 _cell.Z_PDB 16 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 4R4B _symmetry.space_group_name_H-M 'C 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'FAB 2.2C LIGHT CHAIN' 22912.578 4 ? ? ? ? 2 polymer man 'FAB 2.2C HEAVY CHAIN' 23704.703 4 ? ? ? ? 3 non-polymer syn 'SULFATE ION' 96.063 36 ? ? ? ? 4 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 4 ? ? ? ? 5 water nat water 18.015 1233 ? ? ? ? # 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 ;DIQMTQSPSFVSASVGDRVTITCRASQGISSYLAWYQQKPGKAPKLVIYAASTLQSGVPSRFSGSGSGTEFTLTISSLQP EDFATYYCQHLIGLRSFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQE SVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR ; ;DIQMTQSPSFVSASVGDRVTITCRASQGISSYLAWYQQKPGKAPKLVIYAASTLQSGVPSRFSGSGSGTEFTLTISSLQP EDFATYYCQHLIGLRSFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQE SVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR ; L,A,C,E ? 2 'polypeptide(L)' no no ;QVQLQQWGAGLLKPSETLSLTCGVYGESLSGHYWSWVRQPPGKRLEWIGEIKHNGSPNYHPSLKSRVTISLDMSKNQFSL NLTSVTAADTAVYFCARRSNWPYLPFDPWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSW NSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPK ; ;QVQLQQWGAGLLKPSETLSLTCGVYGESLSGHYWSWVRQPPGKRLEWIGEIKHNGSPNYHPSLKSRVTISLDMSKNQFSL NLTSVTAADTAVYFCARRSNWPYLPFDPWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSW NSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPK ; H,B,D,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 GLN n 1 4 MET n 1 5 THR n 1 6 GLN n 1 7 SER n 1 8 PRO n 1 9 SER n 1 10 PHE n 1 11 VAL n 1 12 SER n 1 13 ALA n 1 14 SER n 1 15 VAL n 1 16 GLY n 1 17 ASP n 1 18 ARG n 1 19 VAL n 1 20 THR n 1 21 ILE n 1 22 THR n 1 23 CYS n 1 24 ARG n 1 25 ALA n 1 26 SER n 1 27 GLN n 1 28 GLY n 1 29 ILE n 1 30 SER n 1 31 SER n 1 32 TYR n 1 33 LEU n 1 34 ALA n 1 35 TRP n 1 36 TYR n 1 37 GLN n 1 38 GLN n 1 39 LYS n 1 40 PRO n 1 41 GLY n 1 42 LYS n 1 43 ALA n 1 44 PRO n 1 45 LYS n 1 46 LEU n 1 47 VAL n 1 48 ILE n 1 49 TYR n 1 50 ALA n 1 51 ALA n 1 52 SER n 1 53 THR n 1 54 LEU n 1 55 GLN n 1 56 SER n 1 57 GLY n 1 58 VAL 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 GLU n 1 71 PHE n 1 72 THR n 1 73 LEU n 1 74 THR n 1 75 ILE n 1 76 SER n 1 77 SER n 1 78 LEU n 1 79 GLN n 1 80 PRO n 1 81 GLU n 1 82 ASP n 1 83 PHE n 1 84 ALA n 1 85 THR n 1 86 TYR n 1 87 TYR n 1 88 CYS n 1 89 GLN n 1 90 HIS n 1 91 LEU n 1 92 ILE n 1 93 GLY n 1 94 LEU n 1 95 ARG n 1 96 SER n 1 97 PHE n 1 98 GLY n 1 99 GLN n 1 100 GLY n 1 101 THR n 1 102 LYS n 1 103 LEU n 1 104 GLU n 1 105 ILE n 1 106 LYS n 1 107 ARG n 1 108 THR n 1 109 VAL n 1 110 ALA n 1 111 ALA n 1 112 PRO n 1 113 SER n 1 114 VAL n 1 115 PHE n 1 116 ILE n 1 117 PHE n 1 118 PRO n 1 119 PRO n 1 120 SER n 1 121 ASP n 1 122 GLU n 1 123 GLN n 1 124 LEU n 1 125 LYS n 1 126 SER n 1 127 GLY n 1 128 THR n 1 129 ALA n 1 130 SER n 1 131 VAL n 1 132 VAL n 1 133 CYS n 1 134 LEU n 1 135 LEU n 1 136 ASN n 1 137 ASN n 1 138 PHE n 1 139 TYR n 1 140 PRO n 1 141 ARG n 1 142 GLU n 1 143 ALA n 1 144 LYS n 1 145 VAL n 1 146 GLN n 1 147 TRP n 1 148 LYS n 1 149 VAL n 1 150 ASP n 1 151 ASN n 1 152 ALA n 1 153 LEU n 1 154 GLN n 1 155 SER n 1 156 GLY n 1 157 ASN n 1 158 SER n 1 159 GLN n 1 160 GLU n 1 161 SER n 1 162 VAL n 1 163 THR n 1 164 GLU n 1 165 GLN n 1 166 ASP n 1 167 SER n 1 168 LYS n 1 169 ASP n 1 170 SER n 1 171 THR n 1 172 TYR n 1 173 SER n 1 174 LEU n 1 175 SER n 1 176 SER n 1 177 THR n 1 178 LEU n 1 179 THR n 1 180 LEU n 1 181 SER n 1 182 LYS n 1 183 ALA n 1 184 ASP n 1 185 TYR n 1 186 GLU n 1 187 LYS n 1 188 HIS n 1 189 LYS n 1 190 VAL n 1 191 TYR n 1 192 ALA n 1 193 CYS n 1 194 GLU n 1 195 VAL n 1 196 THR n 1 197 HIS n 1 198 GLN n 1 199 GLY n 1 200 LEU n 1 201 SER n 1 202 SER n 1 203 PRO n 1 204 VAL n 1 205 THR n 1 206 LYS n 1 207 SER n 1 208 PHE n 1 209 ASN n 1 210 ARG n 2 1 GLN n 2 2 VAL n 2 3 GLN n 2 4 LEU n 2 5 GLN n 2 6 GLN n 2 7 TRP n 2 8 GLY n 2 9 ALA n 2 10 GLY n 2 11 LEU n 2 12 LEU n 2 13 LYS n 2 14 PRO n 2 15 SER n 2 16 GLU n 2 17 THR n 2 18 LEU n 2 19 SER n 2 20 LEU n 2 21 THR n 2 22 CYS n 2 23 GLY n 2 24 VAL n 2 25 TYR n 2 26 GLY n 2 27 GLU n 2 28 SER n 2 29 LEU n 2 30 SER n 2 31 GLY n 2 32 HIS n 2 33 TYR n 2 34 TRP n 2 35 SER n 2 36 TRP n 2 37 VAL n 2 38 ARG n 2 39 GLN n 2 40 PRO n 2 41 PRO n 2 42 GLY n 2 43 LYS n 2 44 ARG n 2 45 LEU n 2 46 GLU n 2 47 TRP n 2 48 ILE n 2 49 GLY n 2 50 GLU n 2 51 ILE n 2 52 LYS n 2 53 HIS n 2 54 ASN n 2 55 GLY n 2 56 SER n 2 57 PRO n 2 58 ASN n 2 59 TYR n 2 60 HIS n 2 61 PRO n 2 62 SER n 2 63 LEU n 2 64 LYS n 2 65 SER n 2 66 ARG n 2 67 VAL n 2 68 THR n 2 69 ILE n 2 70 SER n 2 71 LEU n 2 72 ASP n 2 73 MET n 2 74 SER n 2 75 LYS n 2 76 ASN n 2 77 GLN n 2 78 PHE n 2 79 SER n 2 80 LEU n 2 81 ASN n 2 82 LEU n 2 83 THR n 2 84 SER n 2 85 VAL n 2 86 THR n 2 87 ALA n 2 88 ALA n 2 89 ASP n 2 90 THR n 2 91 ALA n 2 92 VAL n 2 93 TYR n 2 94 PHE n 2 95 CYS n 2 96 ALA n 2 97 ARG n 2 98 ARG n 2 99 SER n 2 100 ASN n 2 101 TRP n 2 102 PRO n 2 103 TYR n 2 104 LEU n 2 105 PRO n 2 106 PHE n 2 107 ASP n 2 108 PRO 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 SER 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 LYS n 2 217 VAL n 2 218 GLU n 2 219 PRO n 2 220 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 ? ? ? human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? HYBRIDOMA ? ? ? ? ? ? ? ? ? ? ? ? 2 1 sample ? ? ? human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? HYBRIDOMA ? ? ? ? ? ? ? ? ? ? ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.entity_id _struct_ref.pdbx_align_begin _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_db_isoform 1 PDB 4R4B 4R4B 1 ? ;DIQMTQSPSFVSASVGDRVTITCRASQGISSYLAWYQQKPGKAPKLVIYAASTLQSGVPSRFSGSGSGTEFTLTISSLQP EDFATYYCQHLIGLRSFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQE SVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR ; ? 2 PDB 4R4B 4R4B 2 ? ;QVQLQQWGAGLLKPSETLSLTCGVYGESLSGHYWSWVRQPPGKRLEWIGEIKHNGSPNYHPSLKSRVTISLDMSKNQFSL NLTSVTAADTAVYFCARRSNWPYLPFDPWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSW NSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPK ; ? # 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 4R4B L 1 ? 210 ? 4R4B 1 ? 211 ? 1 211 2 1 4R4B A 1 ? 210 ? 4R4B 1 ? 211 ? 1 211 3 1 4R4B C 1 ? 210 ? 4R4B 1 ? 211 ? 1 211 4 1 4R4B E 1 ? 210 ? 4R4B 1 ? 211 ? 1 211 5 2 4R4B H 1 ? 220 ? 4R4B 1 ? 214 ? 1 214 6 2 4R4B B 1 ? 220 ? 4R4B 1 ? 214 ? 1 214 7 2 4R4B D 1 ? 220 ? 4R4B 1 ? 214 ? 1 214 8 2 4R4B F 1 ? 220 ? 4R4B 1 ? 214 ? 1 214 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 SO4 non-polymer . 'SULFATE ION' ? 'O4 S -2' 96.063 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 4R4B _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.17 _exptl_crystal.density_percent_sol 61.18 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method ? _exptl_crystal_grow.temp ? _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 4.5 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details '100 MM NAOAC PH 4.5, 0-2 % V/V ISOPROPANOL, 2 M LI2SO4, 100 MM MGSO4, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K' # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'MARMOSAIC 300 mm CCD' _diffrn_detector.pdbx_collection_date ? _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.000 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'APS BEAMLINE 22-ID' _diffrn_source.pdbx_synchrotron_site APS _diffrn_source.pdbx_synchrotron_beamline 22-ID _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.000 # _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 4R4B _reflns.observed_criterion_sigma_I 1.000 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 50.000 _reflns.d_resolution_high 2.199 _reflns.number_obs 110015 _reflns.number_all ? _reflns.percent_possible_obs 93.6 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.09000 _reflns.pdbx_netI_over_sigmaI 12.6000 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 3.500 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? # _reflns_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_ordinal 1 _reflns_shell.d_res_high 2.20 _reflns_shell.d_res_low 2.28 _reflns_shell.percent_possible_all 67.8 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value 0.40000 _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy 2.30 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 4R4B _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.ls_number_reflns_obs 103915 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.00 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 48.662 _refine.ls_d_res_high 2.199 _refine.ls_percent_reflns_obs 88.20 _refine.ls_R_factor_obs 0.1679 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.1655 _refine.ls_R_factor_R_free 0.2144 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.02 _refine.ls_number_reflns_R_free 5221 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean ? _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.11 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.90 _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model 1U6A _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.24 _refine.pdbx_overall_phase_error 22.68 _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 13054 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 236 _refine_hist.number_atoms_solvent 1233 _refine_hist.number_atoms_total 14523 _refine_hist.d_res_high 2.199 _refine_hist.d_res_low 48.662 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function f_bond_d 0.004 ? ? 13602 'X-RAY DIFFRACTION' ? f_angle_d 0.897 ? ? 18528 'X-RAY DIFFRACTION' ? f_dihedral_angle_d 12.460 ? ? 4812 'X-RAY DIFFRACTION' ? f_chiral_restr 0.032 ? ? 2080 'X-RAY DIFFRACTION' ? f_plane_restr 0.004 ? ? 2322 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.number_reflns_obs 'X-RAY DIFFRACTION' . 2.1991 2.2241 1787 0.2190 48.00 0.2751 . . 101 . . . . 'X-RAY DIFFRACTION' . 2.2241 2.2503 2164 0.2215 59.00 0.2764 . . 117 . . . . 'X-RAY DIFFRACTION' . 2.2503 2.2777 2282 0.2140 61.00 0.3064 . . 111 . . . . 'X-RAY DIFFRACTION' . 2.2777 2.3066 2425 0.2212 65.00 0.2756 . . 128 . . . . 'X-RAY DIFFRACTION' . 2.3066 2.3369 2504 0.2120 68.00 0.3007 . . 130 . . . . 'X-RAY DIFFRACTION' . 2.3369 2.3689 2712 0.2092 73.00 0.2634 . . 160 . . . . 'X-RAY DIFFRACTION' . 2.3689 2.4028 2845 0.2110 77.00 0.2937 . . 139 . . . . 'X-RAY DIFFRACTION' . 2.4028 2.4386 2966 0.2051 80.00 0.2740 . . 163 . . . . 'X-RAY DIFFRACTION' . 2.4386 2.4767 3107 0.2131 84.00 0.2668 . . 181 . . . . 'X-RAY DIFFRACTION' . 2.4767 2.5173 3294 0.2114 88.00 0.2693 . . 162 . . . . 'X-RAY DIFFRACTION' . 2.5173 2.5607 3340 0.2075 90.00 0.2681 . . 175 . . . . 'X-RAY DIFFRACTION' . 2.5607 2.6073 3416 0.2084 92.00 0.2998 . . 188 . . . . 'X-RAY DIFFRACTION' . 2.6073 2.6574 3419 0.2016 93.00 0.2541 . . 209 . . . . 'X-RAY DIFFRACTION' . 2.6574 2.7117 3503 0.2030 94.00 0.2605 . . 180 . . . . 'X-RAY DIFFRACTION' . 2.7117 2.7706 3543 0.1935 96.00 0.2550 . . 201 . . . . 'X-RAY DIFFRACTION' . 2.7706 2.8351 3591 0.1908 96.00 0.2458 . . 212 . . . . 'X-RAY DIFFRACTION' . 2.8351 2.9060 3533 0.1875 96.00 0.2564 . . 203 . . . . 'X-RAY DIFFRACTION' . 2.9060 2.9845 3598 0.1839 97.00 0.2552 . . 190 . . . . 'X-RAY DIFFRACTION' . 2.9845 3.0723 3691 0.1789 98.00 0.2091 . . 202 . . . . 'X-RAY DIFFRACTION' . 3.0723 3.1715 3668 0.1753 98.00 0.2169 . . 183 . . . . 'X-RAY DIFFRACTION' . 3.1715 3.2848 3679 0.1620 98.00 0.2088 . . 200 . . . . 'X-RAY DIFFRACTION' . 3.2848 3.4163 3667 0.1537 99.00 0.2024 . . 192 . . . . 'X-RAY DIFFRACTION' . 3.4163 3.5717 3701 0.1480 99.00 0.1881 . . 199 . . . . 'X-RAY DIFFRACTION' . 3.5717 3.7600 3747 0.1447 100.00 0.2118 . . 190 . . . . 'X-RAY DIFFRACTION' . 3.7600 3.9955 3727 0.1381 99.00 0.2015 . . 162 . . . . 'X-RAY DIFFRACTION' . 3.9955 4.3038 3724 0.1205 99.00 0.1468 . . 183 . . . . 'X-RAY DIFFRACTION' . 4.3038 4.7366 3773 0.1103 100.00 0.1341 . . 174 . . . . 'X-RAY DIFFRACTION' . 4.7366 5.4212 3744 0.1267 100.00 0.1591 . . 187 . . . . 'X-RAY DIFFRACTION' . 5.4212 6.8271 3749 0.1692 100.00 0.2079 . . 189 . . . . 'X-RAY DIFFRACTION' . 6.8271 48.6738 3795 0.1910 99.00 0.2119 . . 210 . . . . # _struct.entry_id 4R4B _struct.title 'Crystal structure of the anti-hiv-1 antibody 2.2c' _struct.pdbx_descriptor 'FAB 2.2C LIGHT CHAIN, FAB 2.2C HEAVY CHAIN' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 4R4B _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' _struct_keywords.text 'IGG, FAB, HIV, IMMUNOGLOBULIN DOMAIN, 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 1 ? F N N 2 ? G N N 1 ? H N N 2 ? I N N 3 ? J N N 3 ? K N N 3 ? L N N 3 ? M N N 3 ? N N N 3 ? O N N 4 ? P N N 3 ? Q N N 3 ? R N N 3 ? S N N 3 ? T N N 3 ? U N N 3 ? V N N 3 ? W N N 3 ? X N N 3 ? Y N N 3 ? Z N N 4 ? AA N N 3 ? BA N N 3 ? CA N N 3 ? DA N N 3 ? EA N N 3 ? FA N N 3 ? GA N N 3 ? HA N N 3 ? IA N N 3 ? JA N N 3 ? KA N N 3 ? LA N N 4 ? MA N N 3 ? NA N N 3 ? OA N N 3 ? PA N N 4 ? QA N N 3 ? RA N N 3 ? SA N N 3 ? TA N N 3 ? UA N N 3 ? VA N N 3 ? WA N N 5 ? XA N N 5 ? YA N N 5 ? ZA N N 5 ? AB N N 5 ? BB N N 5 ? CB N N 5 ? DB N N 5 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLN A 79 ? PHE A 83 ? GLN L 79 PHE L 83 5 ? 5 HELX_P HELX_P2 2 SER A 120 ? SER A 126 ? SER L 121 SER L 127 1 ? 7 HELX_P HELX_P3 3 LYS A 182 ? LYS A 187 ? LYS L 183 LYS L 188 1 ? 6 HELX_P HELX_P4 13 PRO B 61 ? LYS B 64 ? PRO H 61 LYS H 64 5 ? 4 HELX_P HELX_P5 14 THR B 86 ? THR B 90 ? THR H 83 THR H 87 5 ? 5 HELX_P HELX_P6 15 SER B 133 ? THR B 137 ? SER H 127 THR H 131 5 ? 5 HELX_P HELX_P7 16 SER B 162 ? ALA B 164 ? SER H 156 ALA H 158 5 ? 3 HELX_P HELX_P8 17 SER B 193 ? LEU B 195 ? SER H 187 LEU H 189 5 ? 3 HELX_P HELX_P9 18 LYS B 207 ? ASN B 210 ? LYS H 201 ASN H 204 5 ? 4 HELX_P HELX_P10 4 GLN C 79 ? PHE C 83 ? GLN A 79 PHE A 83 5 ? 5 HELX_P HELX_P11 5 SER C 120 ? LYS C 125 ? SER A 121 LYS A 126 1 ? 6 HELX_P HELX_P12 6 LYS C 182 ? LYS C 187 ? LYS A 183 LYS A 188 1 ? 6 HELX_P HELX_P13 19 MET D 73 ? LYS D 75 ? MET B 73 LYS B 75 5 ? 3 HELX_P HELX_P14 20 THR D 86 ? THR D 90 ? THR B 83 THR B 87 5 ? 5 HELX_P HELX_P15 21 SER D 133 ? THR D 137 ? SER B 127 THR B 131 5 ? 5 HELX_P HELX_P16 22 SER D 162 ? ALA D 164 ? SER B 156 ALA B 158 5 ? 3 HELX_P HELX_P17 23 SER D 193 ? LEU D 195 ? SER B 187 LEU B 189 5 ? 3 HELX_P HELX_P18 24 LYS D 207 ? ASN D 210 ? LYS B 201 ASN B 204 5 ? 4 HELX_P HELX_P19 7 GLN E 79 ? PHE E 83 ? GLN C 79 PHE C 83 5 ? 5 HELX_P HELX_P20 8 SER E 120 ? LYS E 125 ? SER C 121 LYS C 126 1 ? 6 HELX_P HELX_P21 9 LYS E 182 ? HIS E 188 ? LYS C 183 HIS C 189 1 ? 7 HELX_P HELX_P22 25 PRO F 61 ? LYS F 64 ? PRO D 61 LYS D 64 5 ? 4 HELX_P HELX_P23 26 THR F 86 ? THR F 90 ? THR D 83 THR D 87 5 ? 5 HELX_P HELX_P24 27 SER F 133 ? THR F 137 ? SER D 127 THR D 131 5 ? 5 HELX_P HELX_P25 28 SER F 162 ? ALA F 164 ? SER D 156 ALA D 158 5 ? 3 HELX_P HELX_P26 29 SER F 193 ? LEU F 195 ? SER D 187 LEU D 189 5 ? 3 HELX_P HELX_P27 30 LYS F 207 ? ASN F 210 ? LYS D 201 ASN D 204 5 ? 4 HELX_P HELX_P28 10 GLN G 79 ? PHE G 83 ? GLN E 79 PHE E 83 5 ? 5 HELX_P HELX_P29 11 SER G 120 ? LYS G 125 ? SER E 121 LYS E 126 1 ? 6 HELX_P HELX_P30 12 LYS G 182 ? HIS G 188 ? LYS E 183 HIS E 189 1 ? 7 HELX_P HELX_P31 31 PRO H 61 ? LYS H 64 ? PRO F 61 LYS F 64 5 ? 4 HELX_P HELX_P32 32 THR H 86 ? THR H 90 ? THR F 83 THR F 87 5 ? 5 HELX_P HELX_P33 33 SER H 133 ? THR H 137 ? SER F 127 THR F 131 5 ? 5 HELX_P HELX_P34 34 SER H 162 ? ALA H 164 ? SER F 156 ALA F 158 5 ? 3 HELX_P HELX_P35 35 SER H 193 ? LEU H 195 ? SER F 187 LEU F 189 5 ? 3 HELX_P HELX_P36 36 LYS H 207 ? ASN H 210 ? LYS F 201 ASN F 204 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 ? ? L CYS 23 L CYS 88 1_555 ? ? ? ? ? ? ? 2.050 ? disulf2 disulf ? ? A CYS 133 SG ? ? ? 1_555 A CYS 193 SG ? ? L CYS 134 L CYS 194 1_555 ? ? ? ? ? ? ? 2.038 ? disulf3 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 95 SG ? ? H CYS 22 H CYS 92 1_555 ? ? ? ? ? ? ? 2.052 ? disulf4 disulf ? ? B CYS 146 SG ? ? ? 1_555 B CYS 202 SG ? ? H CYS 140 H CYS 196 1_555 ? ? ? ? ? ? ? 2.035 ? disulf5 disulf ? ? C CYS 23 SG ? ? ? 1_555 C CYS 88 SG ? ? A CYS 23 A CYS 88 1_555 ? ? ? ? ? ? ? 2.045 ? disulf6 disulf ? ? C CYS 133 SG ? ? ? 1_555 C CYS 193 SG ? ? A CYS 134 A CYS 194 1_555 ? ? ? ? ? ? ? 2.042 ? disulf7 disulf ? ? D CYS 22 SG ? ? ? 1_555 D CYS 95 SG ? ? B CYS 22 B CYS 92 1_555 ? ? ? ? ? ? ? 2.047 ? disulf8 disulf ? ? D CYS 146 SG ? ? ? 1_555 D CYS 202 SG ? ? B CYS 140 B CYS 196 1_555 ? ? ? ? ? ? ? 2.032 ? disulf9 disulf ? ? E CYS 23 SG ? ? ? 1_555 E CYS 88 SG ? ? C CYS 23 C CYS 88 1_555 ? ? ? ? ? ? ? 2.041 ? disulf10 disulf ? ? E CYS 133 SG ? ? ? 1_555 E CYS 193 SG ? ? C CYS 134 C CYS 194 1_555 ? ? ? ? ? ? ? 2.030 ? disulf11 disulf ? ? F CYS 22 SG ? ? ? 1_555 F CYS 95 SG ? ? D CYS 22 D CYS 92 1_555 ? ? ? ? ? ? ? 2.052 ? disulf12 disulf ? ? F CYS 146 SG ? ? ? 1_555 F CYS 202 SG ? ? D CYS 140 D CYS 196 1_555 ? ? ? ? ? ? ? 2.033 ? disulf13 disulf ? ? G CYS 23 SG ? ? ? 1_555 G CYS 88 SG ? ? E CYS 23 E CYS 88 1_555 ? ? ? ? ? ? ? 2.042 ? disulf14 disulf ? ? G CYS 133 SG ? ? ? 1_555 G CYS 193 SG ? ? E CYS 134 E CYS 194 1_555 ? ? ? ? ? ? ? 2.033 ? disulf15 disulf ? ? H CYS 22 SG ? ? ? 1_555 H CYS 95 SG ? ? F CYS 22 F CYS 92 1_555 ? ? ? ? ? ? ? 2.057 ? disulf16 disulf ? ? H CYS 146 SG ? ? ? 1_555 H CYS 202 SG ? ? F CYS 140 F CYS 196 1_555 ? ? ? ? ? ? ? 2.032 ? covale1 covale ? ? F ASN 81 ND2 ? ? ? 1_555 LA NAG . C1 ? ? D ASN 81 D NAG 301 1_555 ? ? ? ? ? ? ? 1.436 ? covale2 covale ? ? H ASN 81 ND2 ? ? ? 1_555 PA NAG . C1 ? ? F ASN 81 F NAG 301 1_555 ? ? ? ? ? ? ? 1.436 ? covale3 covale ? ? B ASN 81 ND2 ? ? ? 1_555 O NAG . C1 ? ? H ASN 81 H NAG 301 1_555 ? ? ? ? ? ? ? 1.440 ? covale4 covale ? ? D ASN 81 ND2 ? ? ? 1_555 Z NAG . C1 ? ? B ASN 81 B NAG 301 1_555 ? ? ? ? ? ? ? 1.444 ? covale5 covale ? ? E CYS 133 SG ? ? ? 1_555 E CYS 193 SG ? ? C CYS 134 C CYS 194 1_555 ? ? ? ? ? ? ? 2.030 ? covale6 covale ? ? H CYS 146 SG ? ? ? 1_555 H CYS 202 SG ? ? F CYS 140 F CYS 196 1_555 ? ? ? ? ? ? ? 2.032 ? covale7 covale ? ? D CYS 146 SG ? ? ? 1_555 D CYS 202 SG ? ? B CYS 140 B CYS 196 1_555 ? ? ? ? ? ? ? 2.032 ? covale8 covale ? ? F CYS 146 SG ? ? ? 1_555 F CYS 202 SG ? ? D CYS 140 D CYS 196 1_555 ? ? ? ? ? ? ? 2.033 ? covale9 covale ? ? G CYS 133 SG ? ? ? 1_555 G CYS 193 SG ? ? E CYS 134 E CYS 194 1_555 ? ? ? ? ? ? ? 2.033 ? covale10 covale ? ? B CYS 146 SG ? ? ? 1_555 B CYS 202 SG ? ? H CYS 140 H CYS 196 1_555 ? ? ? ? ? ? ? 2.035 ? covale11 covale ? ? A CYS 133 SG ? ? ? 1_555 A CYS 193 SG ? ? L CYS 134 L CYS 194 1_555 ? ? ? ? ? ? ? 2.038 ? covale12 covale ? ? E CYS 23 SG ? ? ? 1_555 E CYS 88 SG ? ? C CYS 23 C CYS 88 1_555 ? ? ? ? ? ? ? 2.041 ? covale13 covale ? ? C CYS 133 SG ? ? ? 1_555 C CYS 193 SG ? ? A CYS 134 A CYS 194 1_555 ? ? ? ? ? ? ? 2.042 ? covale14 covale ? ? G CYS 23 SG ? ? ? 1_555 G CYS 88 SG ? ? E CYS 23 E CYS 88 1_555 ? ? ? ? ? ? ? 2.042 ? covale15 covale ? ? C CYS 23 SG ? ? ? 1_555 C CYS 88 SG ? ? A CYS 23 A CYS 88 1_555 ? ? ? ? ? ? ? 2.045 ? covale16 covale ? ? D CYS 22 SG ? ? ? 1_555 D CYS 95 SG ? ? B CYS 22 B CYS 92 1_555 ? ? ? ? ? ? ? 2.047 ? covale17 covale ? ? A CYS 23 SG ? ? ? 1_555 A CYS 88 SG ? ? L CYS 23 L CYS 88 1_555 ? ? ? ? ? ? ? 2.050 ? covale18 covale ? ? B CYS 22 SG ? ? ? 1_555 B CYS 95 SG ? ? H CYS 22 H CYS 92 1_555 ? ? ? ? ? ? ? 2.052 ? covale19 covale ? ? F CYS 22 SG ? ? ? 1_555 F CYS 95 SG ? ? D CYS 22 D CYS 92 1_555 ? ? ? ? ? ? ? 2.052 ? covale20 covale ? ? H CYS 22 SG ? ? ? 1_555 H CYS 95 SG ? ? F CYS 22 F CYS 92 1_555 ? ? ? ? ? ? ? 2.057 ? # 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 L PRO 8 A ? PRO 8 L 1 -8.28 2 TYR 139 A . ? TYR 140 L PRO 140 A ? PRO 141 L 1 -0.17 3 TRP 101 B . ? TRP 98 H PRO 102 B ? PRO 99 H 1 7.96 4 ASP 107 B . ? ASP 101 H PRO 108 B ? PRO 102 H 1 -1.50 5 PHE 152 B . ? PHE 146 H PRO 153 B ? PRO 147 H 1 -3.67 6 GLU 154 B . ? GLU 148 H PRO 155 B ? PRO 149 H 1 -5.79 7 SER 7 C . ? SER 7 A PRO 8 C ? PRO 8 A 1 -5.90 8 TYR 139 C . ? TYR 140 A PRO 140 C ? PRO 141 A 1 -1.89 9 TRP 101 D . ? TRP 98 B PRO 102 D ? PRO 99 B 1 7.53 10 ASP 107 D . ? ASP 101 B PRO 108 D ? PRO 102 B 1 -1.54 11 PHE 152 D . ? PHE 146 B PRO 153 D ? PRO 147 B 1 -4.49 12 GLU 154 D . ? GLU 148 B PRO 155 D ? PRO 149 B 1 -1.34 13 SER 7 E . ? SER 7 C PRO 8 E ? PRO 8 C 1 -3.60 14 TYR 139 E . ? TYR 140 C PRO 140 E ? PRO 141 C 1 3.75 15 ASP 107 F . ? ASP 101 D PRO 108 F ? PRO 102 D 1 -3.51 16 PHE 152 F . ? PHE 146 D PRO 153 F ? PRO 147 D 1 -4.27 17 GLU 154 F . ? GLU 148 D PRO 155 F ? PRO 149 D 1 -6.94 18 SER 7 G . ? SER 7 E PRO 8 G ? PRO 8 E 1 -1.38 19 TYR 139 G . ? TYR 140 E PRO 140 G ? PRO 141 E 1 1.01 20 ASP 107 H . ? ASP 101 F PRO 108 H ? PRO 102 F 1 -4.99 21 PHE 152 H . ? PHE 146 F PRO 153 H ? PRO 147 F 1 -1.34 22 GLU 154 H . ? GLU 148 F PRO 155 H ? PRO 149 F 1 -3.94 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 4 ? B ? 6 ? C ? 4 ? D ? 4 ? E ? 4 ? F ? 6 ? G ? 4 ? H ? 4 ? I ? 4 ? J ? 5 ? K ? 4 ? L ? 3 ? M ? 4 ? N ? 5 ? O ? 4 ? P ? 3 ? Q ? 4 ? R ? 6 ? S ? 4 ? T ? 4 ? U ? 4 ? V ? 3 ? W ? 4 ? X ? 6 ? Y ? 4 ? Z ? 4 ? AA ? 4 ? AB ? 3 ? AC ? 4 ? AD ? 6 ? AE ? 4 ? AF ? 4 ? AG ? 4 ? AH ? 3 ? AI ? 4 ? AJ ? 6 ? AK ? 4 ? AL ? 4 ? AM ? 4 ? AN ? 3 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel B 1 2 ? parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel B 4 5 ? anti-parallel B 5 6 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel F 1 2 ? parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel F 4 5 ? anti-parallel F 5 6 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel G 3 4 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? parallel J 2 3 ? anti-parallel J 3 4 ? anti-parallel J 4 5 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel N 1 2 ? parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel N 4 5 ? anti-parallel O 1 2 ? anti-parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel Q 1 2 ? anti-parallel Q 2 3 ? anti-parallel Q 3 4 ? anti-parallel R 1 2 ? parallel R 2 3 ? anti-parallel R 3 4 ? anti-parallel R 4 5 ? anti-parallel R 5 6 ? anti-parallel S 1 2 ? parallel S 2 3 ? anti-parallel S 3 4 ? anti-parallel T 1 2 ? anti-parallel T 2 3 ? anti-parallel T 3 4 ? anti-parallel U 1 2 ? anti-parallel U 2 3 ? anti-parallel U 3 4 ? anti-parallel V 1 2 ? anti-parallel V 2 3 ? anti-parallel W 1 2 ? anti-parallel W 2 3 ? anti-parallel W 3 4 ? anti-parallel X 1 2 ? parallel X 2 3 ? anti-parallel X 3 4 ? anti-parallel X 4 5 ? anti-parallel X 5 6 ? anti-parallel Y 1 2 ? parallel Y 2 3 ? anti-parallel Y 3 4 ? anti-parallel Z 1 2 ? anti-parallel Z 2 3 ? anti-parallel Z 3 4 ? anti-parallel AA 1 2 ? anti-parallel AA 2 3 ? anti-parallel AA 3 4 ? anti-parallel AB 1 2 ? anti-parallel AB 2 3 ? anti-parallel AC 1 2 ? anti-parallel AC 2 3 ? anti-parallel AC 3 4 ? anti-parallel AD 1 2 ? parallel AD 2 3 ? anti-parallel AD 3 4 ? anti-parallel AD 4 5 ? anti-parallel AD 5 6 ? anti-parallel AE 1 2 ? parallel AE 2 3 ? anti-parallel AE 3 4 ? anti-parallel AF 1 2 ? anti-parallel AF 2 3 ? anti-parallel AF 3 4 ? anti-parallel AG 1 2 ? anti-parallel AG 2 3 ? anti-parallel AG 3 4 ? anti-parallel AH 1 2 ? anti-parallel AH 2 3 ? anti-parallel AI 1 2 ? anti-parallel AI 2 3 ? anti-parallel AI 3 4 ? anti-parallel AJ 1 2 ? parallel AJ 2 3 ? anti-parallel AJ 3 4 ? anti-parallel AJ 4 5 ? anti-parallel AJ 5 6 ? anti-parallel AK 1 2 ? parallel AK 2 3 ? anti-parallel AK 3 4 ? anti-parallel AL 1 2 ? anti-parallel AL 2 3 ? anti-parallel AL 3 4 ? anti-parallel AM 1 2 ? anti-parallel AM 2 3 ? anti-parallel AM 3 4 ? anti-parallel AN 1 2 ? anti-parallel AN 2 3 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 MET A 4 ? SER A 7 ? MET L 4 SER L 7 A 2 VAL A 19 ? ALA A 25 ? VAL L 19 ALA L 25 A 3 GLU A 70 ? ILE A 75 ? GLU L 70 ILE L 75 A 4 PHE A 62 ? SER A 67 ? PHE L 62 SER L 67 B 1 PHE A 10 ? ALA A 13 ? PHE L 10 ALA L 13 B 2 THR A 101 ? ILE A 105 ? THR L 102 ILE L 106 B 3 THR A 85 ? HIS A 90 ? THR L 85 HIS L 90 B 4 LEU A 33 ? GLN A 38 ? LEU L 33 GLN L 38 B 5 LYS A 45 ? TYR A 49 ? LYS L 45 TYR L 49 B 6 THR A 53 ? LEU A 54 ? THR L 53 LEU L 54 C 1 SER A 113 ? PHE A 117 ? SER L 114 PHE L 118 C 2 THR A 128 ? PHE A 138 ? THR L 129 PHE L 139 C 3 TYR A 172 ? SER A 181 ? TYR L 173 SER L 182 C 4 SER A 158 ? VAL A 162 ? SER L 159 VAL L 163 D 1 ALA A 152 ? LEU A 153 ? ALA L 153 LEU L 154 D 2 LYS A 144 ? VAL A 149 ? LYS L 145 VAL L 150 D 3 VAL A 190 ? THR A 196 ? VAL L 191 THR L 197 D 4 VAL A 204 ? ASN A 209 ? VAL L 205 ASN L 210 E 1 MET C 4 ? SER C 7 ? MET A 4 SER A 7 E 2 VAL C 19 ? ALA C 25 ? VAL A 19 ALA A 25 E 3 GLU C 70 ? ILE C 75 ? GLU A 70 ILE A 75 E 4 PHE C 62 ? SER C 67 ? PHE A 62 SER A 67 F 1 PHE C 10 ? ALA C 13 ? PHE A 10 ALA A 13 F 2 THR C 101 ? ILE C 105 ? THR A 102 ILE A 106 F 3 THR C 85 ? HIS C 90 ? THR A 85 HIS A 90 F 4 LEU C 33 ? GLN C 38 ? LEU A 33 GLN A 38 F 5 LYS C 45 ? TYR C 49 ? LYS A 45 TYR A 49 F 6 THR C 53 ? LEU C 54 ? THR A 53 LEU A 54 G 1 SER C 113 ? PHE C 117 ? SER A 114 PHE A 118 G 2 THR C 128 ? PHE C 138 ? THR A 129 PHE A 139 G 3 TYR C 172 ? SER C 181 ? TYR A 173 SER A 182 G 4 SER C 158 ? VAL C 162 ? SER A 159 VAL A 163 H 1 ALA C 152 ? LEU C 153 ? ALA A 153 LEU A 154 H 2 LYS C 144 ? VAL C 149 ? LYS A 145 VAL A 150 H 3 VAL C 190 ? THR C 196 ? VAL A 191 THR A 197 H 4 VAL C 204 ? ASN C 209 ? VAL A 205 ASN A 210 I 1 MET E 4 ? SER E 7 ? MET C 4 SER C 7 I 2 VAL E 19 ? ALA E 25 ? VAL C 19 ALA C 25 I 3 GLU E 70 ? ILE E 75 ? GLU C 70 ILE C 75 I 4 PHE E 62 ? SER E 67 ? PHE C 62 SER C 67 J 1 PHE E 10 ? SER E 14 ? PHE C 10 SER C 14 J 2 THR E 101 ? LYS E 106 ? THR C 102 LYS C 107 J 3 ALA E 84 ? HIS E 90 ? ALA C 84 HIS C 90 J 4 LEU E 33 ? GLN E 38 ? LEU C 33 GLN C 38 J 5 LYS E 45 ? TYR E 49 ? LYS C 45 TYR C 49 K 1 SER E 113 ? PHE E 117 ? SER C 114 PHE C 118 K 2 THR E 128 ? PHE E 138 ? THR C 129 PHE C 139 K 3 TYR E 172 ? SER E 181 ? TYR C 173 SER C 182 K 4 SER E 158 ? VAL E 162 ? SER C 159 VAL C 163 L 1 LYS E 144 ? VAL E 149 ? LYS C 145 VAL C 150 L 2 VAL E 190 ? THR E 196 ? VAL C 191 THR C 197 L 3 VAL E 204 ? ASN E 209 ? VAL C 205 ASN C 210 M 1 MET G 4 ? SER G 7 ? MET E 4 SER E 7 M 2 VAL G 19 ? ALA G 25 ? VAL E 19 ALA E 25 M 3 GLU G 70 ? ILE G 75 ? GLU E 70 ILE E 75 M 4 PHE G 62 ? SER G 67 ? PHE E 62 SER E 67 N 1 PHE G 10 ? SER G 14 ? PHE E 10 SER E 14 N 2 THR G 101 ? LYS G 106 ? THR E 102 LYS E 107 N 3 ALA G 84 ? HIS G 90 ? ALA E 84 HIS E 90 N 4 LEU G 33 ? GLN G 38 ? LEU E 33 GLN E 38 N 5 LYS G 45 ? ILE G 48 ? LYS E 45 ILE E 48 O 1 SER G 113 ? PHE G 117 ? SER E 114 PHE E 118 O 2 THR G 128 ? PHE G 138 ? THR E 129 PHE E 139 O 3 TYR G 172 ? SER G 181 ? TYR E 173 SER E 182 O 4 SER G 158 ? VAL G 162 ? SER E 159 VAL E 163 P 1 LYS G 144 ? VAL G 149 ? LYS E 145 VAL E 150 P 2 VAL G 190 ? THR G 196 ? VAL E 191 THR E 197 P 3 VAL G 204 ? ASN G 209 ? VAL E 205 ASN E 210 Q 1 GLN B 3 ? GLY B 8 ? GLN H 3 GLY H 8 Q 2 LEU B 18 ? TYR B 25 ? LEU H 18 TYR H 25 Q 3 GLN B 77 ? LEU B 82 ? GLN H 77 LEU H 82 Q 4 VAL B 67 ? ASP B 72 ? VAL H 67 ASP H 72 R 1 LEU B 11 ? LEU B 12 ? LEU H 11 LEU H 12 R 2 THR B 113 ? VAL B 117 ? THR H 107 VAL H 111 R 3 ALA B 91 ? ARG B 98 ? ALA H 88 ARG H 95 R 4 TYR B 33 ? GLN B 39 ? TYR H 33 GLN H 39 R 5 GLU B 46 ? ILE B 51 ? GLU H 46 ILE H 51 R 6 PRO B 57 ? TYR B 59 ? PRO H 57 TYR H 59 S 1 LEU B 11 ? LEU B 12 ? LEU H 11 LEU H 12 S 2 THR B 113 ? VAL B 117 ? THR H 107 VAL H 111 S 3 ALA B 91 ? ARG B 98 ? ALA H 88 ARG H 95 S 4 PHE B 106 C TRP B 109 ? PHE H 100 TRP H 103 T 1 SER B 126 ? LEU B 130 ? SER H 120 LEU H 124 T 2 THR B 141 ? TYR B 151 ? THR H 135 TYR H 145 T 3 TYR B 182 ? PRO B 191 ? TYR H 176 PRO H 185 T 4 VAL B 169 ? THR B 171 ? VAL H 163 THR H 165 U 1 SER B 126 ? LEU B 130 ? SER H 120 LEU H 124 U 2 THR B 141 ? TYR B 151 ? THR H 135 TYR H 145 U 3 TYR B 182 ? PRO B 191 ? TYR H 176 PRO H 185 U 4 VAL B 175 ? LEU B 176 ? VAL H 169 LEU H 170 V 1 THR B 157 ? TRP B 160 ? THR H 151 TRP H 154 V 2 ILE B 201 ? HIS B 206 ? ILE H 195 HIS H 200 V 3 THR B 211 ? LYS B 216 ? THR H 205 LYS H 210 W 1 GLN D 3 ? TRP D 7 ? GLN B 3 TRP B 7 W 2 LEU D 18 ? TYR D 25 ? LEU B 18 TYR B 25 W 3 GLN D 77 ? LEU D 82 ? GLN B 77 LEU B 82 W 4 VAL D 67 ? ASP D 72 ? VAL B 67 ASP B 72 X 1 LEU D 11 ? LEU D 12 ? LEU B 11 LEU B 12 X 2 THR D 113 ? VAL D 117 ? THR B 107 VAL B 111 X 3 ALA D 91 ? ARG D 98 ? ALA B 88 ARG B 95 X 4 TYR D 33 ? GLN D 39 ? TYR B 33 GLN B 39 X 5 GLU D 46 ? ILE D 51 ? GLU B 46 ILE B 51 X 6 PRO D 57 ? TYR D 59 ? PRO B 57 TYR B 59 Y 1 LEU D 11 ? LEU D 12 ? LEU B 11 LEU B 12 Y 2 THR D 113 ? VAL D 117 ? THR B 107 VAL B 111 Y 3 ALA D 91 ? ARG D 98 ? ALA B 88 ARG B 95 Y 4 PHE D 106 C TRP D 109 ? PHE B 100 TRP B 103 Z 1 SER D 126 ? LEU D 130 ? SER B 120 LEU B 124 Z 2 THR D 141 ? TYR D 151 ? THR B 135 TYR B 145 Z 3 TYR D 182 ? PRO D 191 ? TYR B 176 PRO B 185 Z 4 VAL D 169 ? THR D 171 ? VAL B 163 THR B 165 AA 1 SER D 126 ? LEU D 130 ? SER B 120 LEU B 124 AA 2 THR D 141 ? TYR D 151 ? THR B 135 TYR B 145 AA 3 TYR D 182 ? PRO D 191 ? TYR B 176 PRO B 185 AA 4 VAL D 175 ? LEU D 176 ? VAL B 169 LEU B 170 AB 1 THR D 157 ? TRP D 160 ? THR B 151 TRP B 154 AB 2 ILE D 201 ? HIS D 206 ? ILE B 195 HIS B 200 AB 3 THR D 211 ? LYS D 216 ? THR B 205 LYS B 210 AC 1 GLN F 3 ? TRP F 7 ? GLN D 3 TRP D 7 AC 2 LEU F 18 ? TYR F 25 ? LEU D 18 TYR D 25 AC 3 GLN F 77 ? LEU F 82 ? GLN D 77 LEU D 82 AC 4 VAL F 67 ? ASP F 72 ? VAL D 67 ASP D 72 AD 1 LEU F 11 ? LEU F 12 ? LEU D 11 LEU D 12 AD 2 THR F 113 ? VAL F 117 ? THR D 107 VAL D 111 AD 3 ALA F 91 ? ARG F 98 ? ALA D 88 ARG D 95 AD 4 TYR F 33 ? GLN F 39 ? TYR D 33 GLN D 39 AD 5 GLU F 46 ? ILE F 51 ? GLU D 46 ILE D 51 AD 6 ASN F 58 ? TYR F 59 ? ASN D 58 TYR D 59 AE 1 LEU F 11 ? LEU F 12 ? LEU D 11 LEU D 12 AE 2 THR F 113 ? VAL F 117 ? THR D 107 VAL D 111 AE 3 ALA F 91 ? ARG F 98 ? ALA D 88 ARG D 95 AE 4 PHE F 106 C TRP F 109 ? PHE D 100 TRP D 103 AF 1 SER F 126 ? LEU F 130 ? SER D 120 LEU D 124 AF 2 THR F 141 ? TYR F 151 ? THR D 135 TYR D 145 AF 3 TYR F 182 ? PRO F 191 ? TYR D 176 PRO D 185 AF 4 VAL F 169 ? THR F 171 ? VAL D 163 THR D 165 AG 1 SER F 126 ? LEU F 130 ? SER D 120 LEU D 124 AG 2 THR F 141 ? TYR F 151 ? THR D 135 TYR D 145 AG 3 TYR F 182 ? PRO F 191 ? TYR D 176 PRO D 185 AG 4 VAL F 175 ? LEU F 176 ? VAL D 169 LEU D 170 AH 1 THR F 157 ? TRP F 160 ? THR D 151 TRP D 154 AH 2 ILE F 201 ? HIS F 206 ? ILE D 195 HIS D 200 AH 3 THR F 211 ? LYS F 216 ? THR D 205 LYS D 210 AI 1 GLN H 3 ? TRP H 7 ? GLN F 3 TRP F 7 AI 2 LEU H 18 ? TYR H 25 ? LEU F 18 TYR F 25 AI 3 GLN H 77 ? LEU H 82 ? GLN F 77 LEU F 82 AI 4 VAL H 67 ? ASP H 72 ? VAL F 67 ASP F 72 AJ 1 LEU H 11 ? LEU H 12 ? LEU F 11 LEU F 12 AJ 2 THR H 113 ? VAL H 117 ? THR F 107 VAL F 111 AJ 3 ALA H 91 ? ARG H 98 ? ALA F 88 ARG F 95 AJ 4 TYR H 33 ? GLN H 39 ? TYR F 33 GLN F 39 AJ 5 GLU H 46 ? ILE H 51 ? GLU F 46 ILE F 51 AJ 6 ASN H 58 ? TYR H 59 ? ASN F 58 TYR F 59 AK 1 LEU H 11 ? LEU H 12 ? LEU F 11 LEU F 12 AK 2 THR H 113 ? VAL H 117 ? THR F 107 VAL F 111 AK 3 ALA H 91 ? ARG H 98 ? ALA F 88 ARG F 95 AK 4 PHE H 106 C TRP H 109 ? PHE F 100 TRP F 103 AL 1 SER H 126 ? LEU H 130 ? SER F 120 LEU F 124 AL 2 THR H 141 ? TYR H 151 ? THR F 135 TYR F 145 AL 3 TYR H 182 ? PRO H 191 ? TYR F 176 PRO F 185 AL 4 VAL H 169 ? THR H 171 ? VAL F 163 THR F 165 AM 1 SER H 126 ? LEU H 130 ? SER F 120 LEU F 124 AM 2 THR H 141 ? TYR H 151 ? THR F 135 TYR F 145 AM 3 TYR H 182 ? PRO H 191 ? TYR F 176 PRO F 185 AM 4 VAL H 175 ? LEU H 176 ? VAL F 169 LEU F 170 AN 1 THR H 157 ? TRP H 160 ? THR F 151 TRP F 154 AN 2 TYR H 200 ? HIS H 206 ? TYR F 194 HIS F 200 AN 3 THR H 211 ? VAL H 217 ? THR F 205 VAL F 211 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N THR A 5 ? N THR L 5 O ARG A 24 ? O ARG L 24 A 2 3 N ILE A 21 ? N ILE L 21 O LEU A 73 ? O LEU L 73 A 3 4 O THR A 74 ? O THR L 74 N SER A 63 ? N SER L 63 B 1 2 N VAL A 11 ? N VAL L 11 O GLU A 104 ? O GLU L 105 B 2 3 O THR A 101 ? O THR L 102 N TYR A 86 ? N TYR L 86 B 3 4 O TYR A 87 ? O TYR L 87 N TYR A 36 ? N TYR L 36 B 4 5 N GLN A 37 ? N GLN L 37 O LYS A 45 ? O LYS L 45 B 5 6 N TYR A 49 ? N TYR L 49 O THR A 53 ? O THR L 53 C 1 2 N PHE A 115 ? N PHE L 116 O LEU A 134 ? O LEU L 135 C 2 3 N ALA A 129 ? N ALA L 130 O LEU A 180 ? O LEU L 181 C 3 4 O THR A 177 ? O THR L 178 N GLN A 159 ? N GLN L 160 D 1 2 O ALA A 152 ? O ALA L 153 N VAL A 149 ? N VAL L 150 D 2 3 N GLN A 146 ? N GLN L 147 O GLU A 194 ? O GLU L 195 D 3 4 N VAL A 195 ? N VAL L 196 O VAL A 204 ? O VAL L 205 E 1 2 N THR C 5 ? N THR A 5 O ARG C 24 ? O ARG A 24 E 2 3 N CYS C 23 ? N CYS A 23 O PHE C 71 ? O PHE A 71 E 3 4 O THR C 72 ? O THR A 72 N SER C 65 ? N SER A 65 F 1 2 N VAL C 11 ? N VAL A 11 O GLU C 104 ? O GLU A 105 F 2 3 O THR C 101 ? O THR A 102 N TYR C 86 ? N TYR A 86 F 3 4 O THR C 85 ? O THR A 85 N GLN C 38 ? N GLN A 38 F 4 5 N TRP C 35 ? N TRP A 35 O VAL C 47 ? O VAL A 47 F 5 6 N TYR C 49 ? N TYR A 49 O THR C 53 ? O THR A 53 G 1 2 N PHE C 115 ? N PHE A 116 O LEU C 134 ? O LEU A 135 G 2 3 N LEU C 135 ? N LEU A 136 O LEU C 174 ? O LEU A 175 G 3 4 O THR C 177 ? O THR A 178 N GLN C 159 ? N GLN A 160 H 1 2 O ALA C 152 ? O ALA A 153 N VAL C 149 ? N VAL A 150 H 2 3 N GLN C 146 ? N GLN A 147 O GLU C 194 ? O GLU A 195 H 3 4 N TYR C 191 ? N TYR A 192 O PHE C 208 ? O PHE A 209 I 1 2 N THR E 5 ? N THR C 5 O ARG E 24 ? O ARG C 24 I 2 3 N VAL E 19 ? N VAL C 19 O ILE E 75 ? O ILE C 75 I 3 4 O THR E 74 ? O THR C 74 N SER E 63 ? N SER C 63 J 1 2 N VAL E 11 ? N VAL C 11 O GLU E 104 ? O GLU C 105 J 2 3 O LEU E 103 ? O LEU C 104 N ALA E 84 ? N ALA C 84 J 3 4 O TYR E 87 ? O TYR C 87 N TYR E 36 ? N TYR C 36 J 4 5 N TRP E 35 ? N TRP C 35 O ILE E 48 ? O ILE C 48 K 1 2 N PHE E 117 ? N PHE C 118 O VAL E 132 ? O VAL C 133 K 2 3 N LEU E 135 ? N LEU C 136 O LEU E 174 ? O LEU C 175 K 3 4 O SER E 175 ? O SER C 176 N SER E 161 ? N SER C 162 L 1 2 N GLN E 146 ? N GLN C 147 O GLU E 194 ? O GLU C 195 L 2 3 N CYS E 193 ? N CYS C 194 O LYS E 206 ? O LYS C 207 M 1 2 N THR G 5 ? N THR E 5 O ARG G 24 ? O ARG E 24 M 2 3 N ILE G 21 ? N ILE E 21 O LEU G 73 ? O LEU E 73 M 3 4 O THR G 74 ? O THR E 74 N SER G 63 ? N SER E 63 N 1 2 N ALA G 13 ? N ALA E 13 O LYS G 106 ? O LYS E 107 N 2 3 O LEU G 103 ? O LEU E 104 N ALA G 84 ? N ALA E 84 N 3 4 O TYR G 87 ? O TYR E 87 N TYR G 36 ? N TYR E 36 N 4 5 N TRP G 35 ? N TRP E 35 O ILE G 48 ? O ILE E 48 O 1 2 N PHE G 117 ? N PHE E 118 O VAL G 132 ? O VAL E 133 O 2 3 N VAL G 131 ? N VAL E 132 O LEU G 178 ? O LEU E 179 O 3 4 O SER G 175 ? O SER E 176 N SER G 161 ? N SER E 162 P 1 2 N LYS G 148 ? N LYS E 149 O ALA G 192 ? O ALA E 193 P 2 3 N VAL G 195 ? N VAL E 196 O VAL G 204 ? O VAL E 205 Q 1 2 N GLN B 5 ? N GLN H 5 O GLY B 23 ? O GLY H 23 Q 2 3 N CYS B 22 ? N CYS H 22 O PHE B 78 ? O PHE H 78 Q 3 4 O GLN B 77 ? O GLN H 77 N ASP B 72 ? N ASP H 72 R 1 2 N LEU B 12 ? N LEU H 12 O THR B 116 ? O THR H 110 R 2 3 O VAL B 115 ? O VAL H 109 N ALA B 91 ? N ALA H 88 R 3 4 O PHE B 94 ? O PHE H 91 N VAL B 37 ? N VAL H 37 R 4 5 N ARG B 38 ? N ARG H 38 O GLU B 46 ? O GLU H 46 R 5 6 N GLU B 50 ? N GLU H 50 O ASN B 58 ? O ASN H 58 S 1 2 N LEU B 12 ? N LEU H 12 O THR B 116 ? O THR H 110 S 2 3 O VAL B 115 ? O VAL H 109 N ALA B 91 ? N ALA H 88 S 3 4 N ARG B 97 ? N ARG H 94 O ASP B 107 ? O ASP H 101 T 1 2 N PHE B 128 ? N PHE H 122 O LEU B 147 ? O LEU H 141 T 2 3 N VAL B 148 ? N VAL H 142 O LEU B 184 ? O LEU H 178 T 3 4 O VAL B 187 ? O VAL H 181 N HIS B 170 ? N HIS H 164 U 1 2 N PHE B 128 ? N PHE H 122 O LEU B 147 ? O LEU H 141 U 2 3 N VAL B 148 ? N VAL H 142 O LEU B 184 ? O LEU H 178 U 3 4 O SER B 183 ? O SER H 177 N VAL B 175 ? N VAL H 169 V 1 2 N SER B 159 ? N SER H 153 O ASN B 203 ? O ASN H 197 V 2 3 N VAL B 204 ? N VAL H 198 O VAL B 213 ? O VAL H 207 W 1 2 N GLN D 5 ? N GLN B 5 O GLY D 23 ? O GLY B 23 W 2 3 N LEU D 18 ? N LEU B 18 O LEU D 82 ? O LEU B 82 W 3 4 O GLN D 77 ? O GLN B 77 N ASP D 72 ? N ASP B 72 X 1 2 N LEU D 12 ? N LEU B 12 O THR D 116 ? O THR B 110 X 2 3 O VAL D 115 ? O VAL B 109 N ALA D 91 ? N ALA B 88 X 3 4 O PHE D 94 ? O PHE B 91 N VAL D 37 ? N VAL B 37 X 4 5 N ARG D 38 ? N ARG B 38 O GLU D 46 ? O GLU B 46 X 5 6 N GLU D 50 ? N GLU B 50 O ASN D 58 ? O ASN B 58 Y 1 2 N LEU D 12 ? N LEU B 12 O THR D 116 ? O THR B 110 Y 2 3 O VAL D 115 ? O VAL B 109 N ALA D 91 ? N ALA B 88 Y 3 4 N ARG D 97 ? N ARG B 94 O ASP D 107 ? O ASP B 101 Z 1 2 N PHE D 128 ? N PHE B 122 O LEU D 147 ? O LEU B 141 Z 2 3 N VAL D 148 ? N VAL B 142 O LEU D 184 ? O LEU B 178 Z 3 4 O VAL D 187 ? O VAL B 181 N HIS D 170 ? N HIS B 164 AA 1 2 N PHE D 128 ? N PHE B 122 O LEU D 147 ? O LEU B 141 AA 2 3 N VAL D 148 ? N VAL B 142 O LEU D 184 ? O LEU B 178 AA 3 4 O SER D 183 ? O SER B 177 N VAL D 175 ? N VAL B 169 AB 1 2 N SER D 159 ? N SER B 153 O ASN D 203 ? O ASN B 197 AB 2 3 N VAL D 204 ? N VAL B 198 O VAL D 213 ? O VAL B 207 AC 1 2 N GLN F 5 ? N GLN D 5 O GLY F 23 ? O GLY D 23 AC 2 3 N CYS F 22 ? N CYS D 22 O PHE F 78 ? O PHE D 78 AC 3 4 O GLN F 77 ? O GLN D 77 N ASP F 72 ? N ASP D 72 AD 1 2 N LEU F 12 ? N LEU D 12 O THR F 116 ? O THR D 110 AD 2 3 O VAL F 115 ? O VAL D 109 N ALA F 91 ? N ALA D 88 AD 3 4 O PHE F 94 ? O PHE D 91 N VAL F 37 ? N VAL D 37 AD 4 5 N ARG F 38 ? N ARG D 38 O GLU F 46 ? O GLU D 46 AD 5 6 N GLU F 50 ? N GLU D 50 O ASN F 58 ? O ASN D 58 AE 1 2 N LEU F 12 ? N LEU D 12 O THR F 116 ? O THR D 110 AE 2 3 O VAL F 115 ? O VAL D 109 N ALA F 91 ? N ALA D 88 AE 3 4 N ARG F 97 ? N ARG D 94 O ASP F 107 ? O ASP D 101 AF 1 2 N PHE F 128 ? N PHE D 122 O LEU F 147 ? O LEU D 141 AF 2 3 N TYR F 151 ? N TYR D 145 O TYR F 182 ? O TYR D 176 AF 3 4 O VAL F 187 ? O VAL D 181 N HIS F 170 ? N HIS D 164 AG 1 2 N PHE F 128 ? N PHE D 122 O LEU F 147 ? O LEU D 141 AG 2 3 N TYR F 151 ? N TYR D 145 O TYR F 182 ? O TYR D 176 AG 3 4 O SER F 183 ? O SER D 177 N VAL F 175 ? N VAL D 169 AH 1 2 N SER F 159 ? N SER D 153 O ASN F 203 ? O ASN D 197 AH 2 3 N VAL F 204 ? N VAL D 198 O VAL F 213 ? O VAL D 207 AI 1 2 N GLN H 5 ? N GLN F 5 O GLY H 23 ? O GLY F 23 AI 2 3 N LEU H 18 ? N LEU F 18 O LEU H 82 ? O LEU F 82 AI 3 4 O GLN H 77 ? O GLN F 77 N ASP H 72 ? N ASP F 72 AJ 1 2 N LEU H 12 ? N LEU F 12 O THR H 116 ? O THR F 110 AJ 2 3 O VAL H 115 ? O VAL F 109 N ALA H 91 ? N ALA F 88 AJ 3 4 O PHE H 94 ? O PHE F 91 N VAL H 37 ? N VAL F 37 AJ 4 5 N TRP H 34 ? N TRP F 34 O ILE H 51 ? O ILE F 51 AJ 5 6 N GLU H 50 ? N GLU F 50 O ASN H 58 ? O ASN F 58 AK 1 2 N LEU H 12 ? N LEU F 12 O THR H 116 ? O THR F 110 AK 2 3 O VAL H 115 ? O VAL F 109 N ALA H 91 ? N ALA F 88 AK 3 4 N ARG H 97 ? N ARG F 94 O PRO H 108 ? O PRO F 102 AL 1 2 N PHE H 128 ? N PHE F 122 O LEU H 147 ? O LEU F 141 AL 2 3 N LEU H 144 ? N LEU F 138 O VAL H 188 ? O VAL F 182 AL 3 4 O VAL H 187 ? O VAL F 181 N HIS H 170 ? N HIS F 164 AM 1 2 N PHE H 128 ? N PHE F 122 O LEU H 147 ? O LEU F 141 AM 2 3 N LEU H 144 ? N LEU F 138 O VAL H 188 ? O VAL F 182 AM 3 4 O SER H 183 ? O SER F 177 N VAL H 175 ? N VAL F 169 AN 1 2 N SER H 159 ? N SER F 153 O ASN H 203 ? O ASN F 197 AN 2 3 N VAL H 204 ? N VAL F 198 O VAL H 213 ? O VAL F 207 # 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 ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 L 301' AC2 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 L 302' AC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 L 303' AC4 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 L 304' AC5 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 L 305' AC6 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE SO4 L 306' AC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG H 301' AC8 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE SO4 H 302' AC9 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 H 303' BC1 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE SO4 H 304' BC2 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE SO4 H 305' BC3 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 H 306' BC4 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 A 301' BC5 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 A 302' BC6 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 A 303' BC7 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 A 304' BC8 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 A 305' BC9 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG B 301' CC1 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE SO4 B 302' CC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 B 303' CC3 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE SO4 B 304' CC4 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 B 305' CC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 B 306' CC6 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE SO4 B 307' CC7 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 B 308' CC8 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE SO4 B 309' CC9 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE SO4 C 301' DC1 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 C 302' DC2 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 C 303' DC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG D 301' DC4 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE SO4 D 302' DC5 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SO4 E 301' DC6 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 E 302' DC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG F 301' DC8 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE SO4 F 302' DC9 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE SO4 F 303' EC1 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 F 304' EC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 F 305' EC3 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 F 306' EC4 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 F 307' # 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 6 ASP A 1 ? ASP L 1 . ? 1_555 ? 2 AC1 6 ILE A 2 ? ILE L 2 . ? 1_555 ? 3 AC1 6 HIS A 90 ? HIS L 90 . ? 1_555 ? 4 AC1 6 LEU A 94 ? LEU L 94 . ? 1_555 ? 5 AC1 6 HOH WA . ? HOH L 503 . ? 1_555 ? 6 AC1 6 HOH WA . ? HOH L 606 . ? 1_555 ? 7 AC2 6 LYS B 220 ? LYS H 214 . ? 1_555 ? 8 AC2 6 SER A 120 ? SER L 121 . ? 1_555 ? 9 AC2 6 ASP A 121 ? ASP L 122 . ? 1_555 ? 10 AC2 6 GLU A 122 ? GLU L 123 . ? 1_555 ? 11 AC2 6 HOH WA . ? HOH L 455 . ? 1_555 ? 12 AC2 6 HOH WA . ? HOH L 510 . ? 1_555 ? 13 AC3 5 SER C 76 ? SER A 76 . ? 4_555 ? 14 AC3 5 HOH YA . ? HOH A 506 . ? 4_555 ? 15 AC3 5 ARG A 107 ? ARG L 108 . ? 1_555 ? 16 AC3 5 HOH WA . ? HOH L 545 . ? 1_555 ? 17 AC3 5 HOH WA . ? HOH L 582 . ? 1_555 ? 18 AC4 5 ARG A 18 ? ARG L 18 . ? 1_555 ? 19 AC4 5 ARG A 18 ? ARG L 18 . ? 2_555 ? 20 AC4 5 THR A 20 ? THR L 20 . ? 2_555 ? 21 AC4 5 THR A 20 ? THR L 20 . ? 1_555 ? 22 AC4 5 HOH WA . ? HOH L 560 . ? 2_555 ? 23 AC5 6 PRO A 59 ? PRO L 59 . ? 1_555 ? 24 AC5 6 SER A 60 ? SER L 60 . ? 1_555 ? 25 AC5 6 HOH WA . ? HOH L 575 . ? 1_555 ? 26 AC5 6 HOH WA . ? HOH L 576 . ? 1_555 ? 27 AC5 6 HOH WA . ? HOH L 613 . ? 1_555 ? 28 AC5 6 HOH WA . ? HOH L 614 . ? 1_555 ? 29 AC6 7 GLY A 28 ? GLY L 28 . ? 1_555 ? 30 AC6 7 ILE A 29 ? ILE L 29 . ? 1_555 ? 31 AC6 7 SER A 30 ? SER L 30 . ? 1_555 ? 32 AC6 7 GLY A 68 ? GLY L 68 . ? 1_555 ? 33 AC6 7 HOH WA . ? HOH L 581 . ? 1_555 ? 34 AC6 7 HOH WA . ? HOH L 586 . ? 1_555 ? 35 AC6 7 HOH WA . ? HOH L 595 . ? 1_555 ? 36 AC7 3 THR B 17 ? THR H 17 . ? 1_555 ? 37 AC7 3 SER B 19 ? SER H 19 . ? 1_555 ? 38 AC7 3 ASN B 81 ? ASN H 81 . ? 1_555 ? 39 AC8 7 LYS F 212 ? LYS D 206 . ? 1_555 ? 40 AC8 7 HOH BB . ? HOH D 402 . ? 1_555 ? 41 AC8 7 TYR B 33 ? TYR H 33 . ? 1_555 ? 42 AC8 7 ARG B 98 ? ARG H 95 . ? 1_555 ? 43 AC8 7 ASN B 100 ? ASN H 97 . ? 1_555 ? 44 AC8 7 TRP B 101 ? TRP H 98 . ? 1_555 ? 45 AC8 7 HOH XA . ? HOH H 505 . ? 1_555 ? 46 AC9 4 LYS B 43 ? LYS H 43 . ? 1_555 ? 47 AC9 4 ARG B 44 ? ARG H 44 . ? 1_555 ? 48 AC9 4 HOH XA . ? HOH H 551 . ? 1_555 ? 49 AC9 4 HOH XA . ? HOH H 561 . ? 1_555 ? 50 BC1 7 GLN F 5 ? GLN D 5 . ? 1_555 ? 51 BC1 7 GLY B 31 ? GLY H 31 . ? 1_555 ? 52 BC1 7 LYS B 52 ? LYS H 52 . ? 1_555 ? 53 BC1 7 ASN B 100 ? ASN H 97 . ? 1_555 ? 54 BC1 7 HOH XA . ? HOH H 455 . ? 1_555 ? 55 BC1 7 HOH XA . ? HOH H 480 . ? 1_555 ? 56 BC1 7 HOH XA . ? HOH H 525 . ? 1_555 ? 57 BC2 2 ARG B 97 ? ARG H 94 . ? 1_555 ? 58 BC2 2 HOH XA . ? HOH H 436 . ? 1_555 ? 59 BC3 6 SO4 GA . ? SO4 B 308 . ? 1_555 ? 60 BC3 6 SER F 28 ? SER D 28 . ? 1_555 ? 61 BC3 6 SER H 28 ? SER F 28 . ? 1_555 ? 62 BC3 6 SER B 74 ? SER H 74 . ? 1_555 ? 63 BC3 6 LYS B 75 ? LYS H 75 . ? 1_555 ? 64 BC3 6 HOH XA . ? HOH H 482 . ? 1_555 ? 65 BC4 5 ILE C 2 ? ILE A 2 . ? 1_555 ? 66 BC4 5 HIS C 90 ? HIS A 90 . ? 1_555 ? 67 BC4 5 GLY C 93 ? GLY A 93 . ? 1_555 ? 68 BC4 5 LEU C 94 ? LEU A 94 . ? 1_555 ? 69 BC4 5 HOH YA . ? HOH A 488 . ? 1_555 ? 70 BC5 6 SER C 120 ? SER A 121 . ? 1_555 ? 71 BC5 6 ASP C 121 ? ASP A 122 . ? 1_555 ? 72 BC5 6 GLU C 122 ? GLU A 123 . ? 1_555 ? 73 BC5 6 HOH YA . ? HOH A 439 . ? 1_555 ? 74 BC5 6 PRO D 129 ? PRO B 123 . ? 1_555 ? 75 BC5 6 LYS D 220 ? LYS B 214 . ? 1_555 ? 76 BC6 4 SER C 181 ? SER A 182 . ? 1_555 ? 77 BC6 4 HOH YA . ? HOH A 411 . ? 1_555 ? 78 BC6 4 SER B 178 ? SER H 172 . ? 4_544 ? 79 BC6 4 GLY A 156 ? GLY L 157 . ? 4_544 ? 80 BC7 6 THR C 108 ? THR A 109 . ? 1_555 ? 81 BC7 6 VAL C 109 ? VAL A 110 . ? 1_555 ? 82 BC7 6 HOH YA . ? HOH A 440 . ? 1_555 ? 83 BC7 6 HOH YA . ? HOH A 532 . ? 1_555 ? 84 BC7 6 HOH WA . ? HOH L 475 . ? 3_545 ? 85 BC7 6 HOH WA . ? HOH L 558 . ? 4_545 ? 86 BC8 6 VAL C 11 ? VAL A 11 . ? 1_555 ? 87 BC8 6 SER C 12 ? SER A 12 . ? 1_555 ? 88 BC8 6 HOH YA . ? HOH A 510 . ? 1_555 ? 89 BC8 6 THR A 108 ? THR L 109 . ? 3_545 ? 90 BC8 6 VAL A 109 ? VAL L 110 . ? 3_545 ? 91 BC8 6 HOH WA . ? HOH L 437 . ? 3_545 ? 92 BC9 6 THR D 17 ? THR B 17 . ? 1_555 ? 93 BC9 6 SER D 19 ? SER B 19 . ? 1_555 ? 94 BC9 6 ASN D 81 ? ASN B 81 . ? 1_555 ? 95 BC9 6 HOH ZA . ? HOH B 526 . ? 1_555 ? 96 BC9 6 HOH ZA . ? HOH B 529 . ? 1_555 ? 97 BC9 6 HOH ZA . ? HOH B 532 . ? 1_555 ? 98 CC1 7 TYR D 33 ? TYR B 33 . ? 1_555 ? 99 CC1 7 ARG D 98 ? ARG B 95 . ? 1_555 ? 100 CC1 7 ASN D 100 ? ASN B 97 . ? 1_555 ? 101 CC1 7 TRP D 101 ? TRP B 98 . ? 1_555 ? 102 CC1 7 HOH ZA . ? HOH B 456 . ? 1_555 ? 103 CC1 7 LYS H 212 ? LYS F 206 . ? 1_555 ? 104 CC1 7 HOH DB . ? HOH F 402 . ? 1_555 ? 105 CC2 4 LYS D 43 ? LYS B 43 . ? 1_555 ? 106 CC2 4 ARG D 44 ? ARG B 44 . ? 1_555 ? 107 CC2 4 HOH ZA . ? HOH B 428 . ? 1_555 ? 108 CC2 4 HOH ZA . ? HOH B 533 . ? 1_555 ? 109 CC3 3 SER D 178 ? SER B 172 . ? 1_555 ? 110 CC3 3 HOH ZA . ? HOH B 406 . ? 1_555 ? 111 CC3 3 SER A 181 ? SER L 182 . ? 4_544 ? 112 CC4 5 LYS D 13 ? LYS B 13 . ? 1_555 ? 113 CC4 5 SER D 121 ? SER B 115 . ? 1_555 ? 114 CC4 5 THR D 122 ? THR B 116 . ? 1_555 ? 115 CC4 5 HOH ZA . ? HOH B 481 . ? 1_555 ? 116 CC4 5 HOH ZA . ? HOH B 489 . ? 1_555 ? 117 CC5 5 PRO D 14 ? PRO B 14 . ? 1_555 ? 118 CC5 5 SER D 119 ? SER B 113 . ? 1_555 ? 119 CC5 5 HOH ZA . ? HOH B 502 . ? 1_555 ? 120 CC5 5 LYS A 182 ? LYS L 183 . ? 4_544 ? 121 CC5 5 GLU A 186 ? GLU L 187 . ? 4_544 ? 122 CC6 2 ARG D 97 ? ARG B 94 . ? 1_555 ? 123 CC6 2 HOH ZA . ? HOH B 415 . ? 1_555 ? 124 CC7 5 SER D 74 ? SER B 74 . ? 1_555 ? 125 CC7 5 LYS D 75 ? LYS B 75 . ? 1_555 ? 126 CC7 5 SER F 28 ? SER D 28 . ? 1_555 ? 127 CC7 5 SER H 28 ? SER F 28 . ? 1_555 ? 128 CC7 5 SO4 T . ? SO4 H 306 . ? 1_555 ? 129 CC8 7 GLY D 31 ? GLY B 31 . ? 1_555 ? 130 CC8 7 LYS D 52 ? LYS B 52 . ? 1_555 ? 131 CC8 7 ASN D 100 ? ASN B 97 . ? 1_555 ? 132 CC8 7 HOH ZA . ? HOH B 430 . ? 1_555 ? 133 CC8 7 HOH ZA . ? HOH B 522 . ? 1_555 ? 134 CC8 7 HOH ZA . ? HOH B 523 . ? 1_555 ? 135 CC8 7 GLN H 5 ? GLN F 5 . ? 1_555 ? 136 CC9 9 ASP E 1 ? ASP C 1 . ? 1_555 ? 137 CC9 9 ILE E 2 ? ILE C 2 . ? 1_555 ? 138 CC9 9 HIS E 90 ? HIS C 90 . ? 1_555 ? 139 CC9 9 GLY E 93 ? GLY C 93 . ? 1_555 ? 140 CC9 9 LEU E 94 ? LEU C 94 . ? 1_555 ? 141 CC9 9 HOH AB . ? HOH C 407 . ? 1_555 ? 142 CC9 9 HOH AB . ? HOH C 428 . ? 1_555 ? 143 CC9 9 HOH AB . ? HOH C 457 . ? 1_555 ? 144 CC9 9 HOH AB . ? HOH C 470 . ? 1_555 ? 145 DC1 5 GLY E 28 ? GLY C 28 . ? 1_555 ? 146 DC1 5 ILE E 29 ? ILE C 29 . ? 1_555 ? 147 DC1 5 SER E 30 ? SER C 30 . ? 1_555 ? 148 DC1 5 GLY E 68 ? GLY C 68 . ? 1_555 ? 149 DC1 5 HOH XA . ? HOH H 467 . ? 4_545 ? 150 DC2 6 SER E 120 ? SER C 121 . ? 1_555 ? 151 DC2 6 ASP E 121 ? ASP C 122 . ? 1_555 ? 152 DC2 6 GLU E 122 ? GLU C 123 . ? 1_555 ? 153 DC2 6 HOH AB . ? HOH C 472 . ? 1_555 ? 154 DC2 6 HOH AB . ? HOH C 473 . ? 1_555 ? 155 DC2 6 LYS F 220 ? LYS D 214 . ? 1_555 ? 156 DC3 2 SER F 19 ? SER D 19 . ? 1_555 ? 157 DC3 2 ASN F 81 ? ASN D 81 . ? 1_555 ? 158 DC4 9 TYR D 25 ? TYR B 25 . ? 1_555 ? 159 DC4 9 GLN D 77 ? GLN B 77 . ? 1_555 ? 160 DC4 9 SER F 30 ? SER D 30 . ? 1_555 ? 161 DC4 9 GLY F 31 ? GLY D 31 . ? 1_555 ? 162 DC4 9 LYS F 52 ? LYS D 52 . ? 1_555 ? 163 DC4 9 HIS F 53 ? HIS D 53 . ? 1_555 ? 164 DC4 9 ASN F 54 ? ASN D 54 . ? 1_555 ? 165 DC4 9 HOH BB . ? HOH D 405 . ? 1_555 ? 166 DC4 9 HOH BB . ? HOH D 459 . ? 1_555 ? 167 DC5 6 ASP G 1 ? ASP E 1 . ? 1_555 ? 168 DC5 6 ILE G 2 ? ILE E 2 . ? 1_555 ? 169 DC5 6 HIS G 90 ? HIS E 90 . ? 1_555 ? 170 DC5 6 GLY G 93 ? GLY E 93 . ? 1_555 ? 171 DC5 6 LEU G 94 ? LEU E 94 . ? 1_555 ? 172 DC5 6 HOH CB . ? HOH E 415 . ? 1_555 ? 173 DC6 4 ILE G 92 ? ILE E 92 . ? 1_555 ? 174 DC6 4 GLY G 93 ? GLY E 93 . ? 1_555 ? 175 DC6 4 ARG G 95 ? ARG E 96 . ? 1_555 ? 176 DC6 4 HOH CB . ? HOH E 441 . ? 1_555 ? 177 DC7 3 SER H 19 ? SER F 19 . ? 1_555 ? 178 DC7 3 ASN H 81 ? ASN F 81 . ? 1_555 ? 179 DC7 3 HOH DB . ? HOH F 521 . ? 1_555 ? 180 DC8 9 SER H 30 ? SER F 30 . ? 1_555 ? 181 DC8 9 GLY H 31 ? GLY F 31 . ? 1_555 ? 182 DC8 9 LYS H 52 ? LYS F 52 . ? 1_555 ? 183 DC8 9 HIS H 53 ? HIS F 53 . ? 1_555 ? 184 DC8 9 ASN H 54 ? ASN F 54 . ? 1_555 ? 185 DC8 9 HOH DB . ? HOH F 409 . ? 1_555 ? 186 DC8 9 HOH DB . ? HOH F 437 . ? 1_555 ? 187 DC8 9 TYR B 25 ? TYR H 25 . ? 1_555 ? 188 DC8 9 GLN B 77 ? GLN H 77 . ? 1_555 ? 189 DC9 9 GLN F 1 ? GLN D 1 . ? 1_555 ? 190 DC9 9 VAL F 2 ? VAL D 2 . ? 1_555 ? 191 DC9 9 GLN H 1 ? GLN F 1 . ? 1_555 ? 192 DC9 9 VAL H 2 ? VAL F 2 . ? 1_555 ? 193 DC9 9 ARG H 97 ? ARG F 94 . ? 1_555 ? 194 DC9 9 HOH DB . ? HOH F 403 . ? 1_555 ? 195 DC9 9 HOH DB . ? HOH F 405 . ? 1_555 ? 196 DC9 9 HOH DB . ? HOH F 408 . ? 1_555 ? 197 DC9 9 HOH DB . ? HOH F 510 . ? 1_555 ? 198 EC1 4 GLN G 99 ? GLN E 100 . ? 1_555 ? 199 EC1 4 LYS H 43 ? LYS F 43 . ? 1_555 ? 200 EC1 4 ARG H 44 ? ARG F 44 . ? 1_555 ? 201 EC1 4 HOH DB . ? HOH F 443 . ? 1_555 ? 202 EC2 4 LYS H 13 ? LYS F 13 . ? 1_555 ? 203 EC2 4 SER H 121 ? SER F 115 . ? 1_555 ? 204 EC2 4 THR H 122 ? THR F 116 . ? 1_555 ? 205 EC2 4 HOH DB . ? HOH F 456 . ? 1_555 ? 206 EC3 4 ASP H 214 ? ASP F 208 . ? 1_555 ? 207 EC3 4 LYS H 215 ? LYS F 209 . ? 1_555 ? 208 EC3 4 LYS H 216 ? LYS F 210 . ? 1_555 ? 209 EC3 4 HOH DB . ? HOH F 531 . ? 1_555 ? 210 EC4 5 SER C 30 ? SER A 30 . ? 1_555 ? 211 EC4 5 ASP H 214 ? ASP F 208 . ? 1_555 ? 212 EC4 5 HOH DB . ? HOH F 442 . ? 1_555 ? 213 EC4 5 HOH DB . ? HOH F 528 . ? 1_555 ? 214 EC4 5 HOH DB . ? HOH F 539 . ? 1_555 ? # _database_PDB_matrix.entry_id 4R4B _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 4R4B _atom_sites.fract_transf_matrix[1][1] 0.005128 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000122 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.007487 _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] 0.011019 _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 ? 6.462 -10.109 -23.226 1.00 67.94 ? 1 ASP L N 1 ATOM 2 C CA . ASP A 1 1 ? 7.399 -9.198 -22.573 1.00 66.07 ? 1 ASP L CA 1 ATOM 3 C C . ASP A 1 1 ? 6.720 -8.418 -21.454 1.00 56.62 ? 1 ASP L C 1 ATOM 4 O O . ASP A 1 1 ? 5.614 -7.907 -21.627 1.00 58.60 ? 1 ASP L O 1 ATOM 5 C CB . ASP A 1 1 ? 8.004 -8.229 -23.592 1.00 71.72 ? 1 ASP L CB 1 ATOM 6 C CG . ASP A 1 1 ? 9.068 -8.879 -24.458 1.00 78.53 ? 1 ASP L CG 1 ATOM 7 O OD1 . ASP A 1 1 ? 9.154 -10.126 -24.471 1.00 77.16 ? 1 ASP L OD1 1 ATOM 8 O OD2 . ASP A 1 1 ? 9.817 -8.137 -25.129 1.00 83.06 ? 1 ASP L OD2 1 ATOM 9 N N . ILE A 1 2 ? 7.387 -8.323 -20.308 1.00 46.26 ? 2 ILE L N 1 ATOM 10 C CA . ILE A 1 2 ? 6.834 -7.594 -19.171 1.00 46.67 ? 2 ILE L CA 1 ATOM 11 C C . ILE A 1 2 ? 7.119 -6.096 -19.275 1.00 42.45 ? 2 ILE L C 1 ATOM 12 O O . ILE A 1 2 ? 8.240 -5.678 -19.556 1.00 40.38 ? 2 ILE L O 1 ATOM 13 C CB . ILE A 1 2 ? 7.373 -8.147 -17.842 1.00 45.81 ? 2 ILE L CB 1 ATOM 14 C CG1 . ILE A 1 2 ? 6.757 -9.528 -17.584 1.00 46.98 ? 2 ILE L CG1 1 ATOM 15 C CG2 . ILE A 1 2 ? 7.065 -7.191 -16.698 1.00 40.29 ? 2 ILE L CG2 1 ATOM 16 C CD1 . ILE A 1 2 ? 7.052 -10.107 -16.223 1.00 47.05 ? 2 ILE L CD1 1 ATOM 17 N N . GLN A 1 3 ? 6.080 -5.299 -19.058 1.00 42.66 ? 3 GLN L N 1 ATOM 18 C CA . GLN A 1 3 ? 6.146 -3.855 -19.229 1.00 38.63 ? 3 GLN L CA 1 ATOM 19 C C . GLN A 1 3 ? 5.991 -3.121 -17.900 1.00 36.84 ? 3 GLN L C 1 ATOM 20 O O . GLN A 1 3 ? 5.103 -3.447 -17.110 1.00 32.94 ? 3 GLN L O 1 ATOM 21 C CB . GLN A 1 3 ? 5.053 -3.400 -20.197 1.00 51.84 ? 3 GLN L CB 1 ATOM 22 C CG . GLN A 1 3 ? 5.343 -2.098 -20.908 1.00 68.76 ? 3 GLN L CG 1 ATOM 23 C CD . GLN A 1 3 ? 6.083 -2.316 -22.210 1.00 78.59 ? 3 GLN L CD 1 ATOM 24 O OE1 . GLN A 1 3 ? 6.343 -3.456 -22.602 1.00 77.18 ? 3 GLN L OE1 1 ATOM 25 N NE2 . GLN A 1 3 ? 6.422 -1.225 -22.892 1.00 80.51 ? 3 GLN L NE2 1 ATOM 26 N N . MET A 1 4 ? 6.845 -2.126 -17.661 1.00 32.36 ? 4 MET L N 1 ATOM 27 C CA . MET A 1 4 ? 6.736 -1.285 -16.471 1.00 28.77 ? 4 MET L CA 1 ATOM 28 C C . MET A 1 4 ? 6.154 0.074 -16.816 1.00 28.85 ? 4 MET L C 1 ATOM 29 O O . MET A 1 4 ? 6.696 0.793 -17.655 1.00 27.39 ? 4 MET L O 1 ATOM 30 C CB . MET A 1 4 ? 8.098 -1.090 -15.803 1.00 32.36 ? 4 MET L CB 1 ATOM 31 C CG . MET A 1 4 ? 8.835 -2.370 -15.501 1.00 43.41 ? 4 MET L CG 1 ATOM 32 S SD . MET A 1 4 ? 7.740 -3.569 -14.740 1.00 71.65 ? 4 MET L SD 1 ATOM 33 C CE . MET A 1 4 ? 7.574 -2.876 -13.103 1.00 209.41 ? 4 MET L CE 1 ATOM 34 N N . THR A 1 5 ? 5.059 0.437 -16.159 1.00 24.55 ? 5 THR L N 1 ATOM 35 C CA . THR A 1 5 ? 4.446 1.736 -16.407 1.00 29.13 ? 5 THR L CA 1 ATOM 36 C C . THR A 1 5 ? 4.427 2.578 -15.141 1.00 27.65 ? 5 THR L C 1 ATOM 37 O O . THR A 1 5 ? 3.885 2.167 -14.113 1.00 31.49 ? 5 THR L O 1 ATOM 38 C CB . THR A 1 5 ? 3.013 1.585 -16.953 1.00 33.46 ? 5 THR L CB 1 ATOM 39 O OG1 . THR A 1 5 ? 3.051 0.886 -18.204 1.00 39.77 ? 5 THR L OG1 1 ATOM 40 C CG2 . THR A 1 5 ? 2.383 2.950 -17.166 1.00 33.06 ? 5 THR L CG2 1 ATOM 41 N N . GLN A 1 6 ? 5.025 3.761 -15.220 1.00 19.03 ? 6 GLN L N 1 ATOM 42 C CA . GLN A 1 6 ? 5.111 4.642 -14.068 1.00 18.14 ? 6 GLN L CA 1 ATOM 43 C C . GLN A 1 6 ? 4.075 5.758 -14.152 1.00 28.17 ? 6 GLN L C 1 ATOM 44 O O . GLN A 1 6 ? 3.843 6.323 -15.220 1.00 26.74 ? 6 GLN L O 1 ATOM 45 C CB . GLN A 1 6 ? 6.516 5.243 -13.956 1.00 19.84 ? 6 GLN L CB 1 ATOM 46 C CG . GLN A 1 6 ? 7.611 4.240 -13.669 1.00 24.90 ? 6 GLN L CG 1 ATOM 47 C CD . GLN A 1 6 ? 8.972 4.894 -13.487 1.00 26.93 ? 6 GLN L CD 1 ATOM 48 O OE1 . GLN A 1 6 ? 9.939 4.516 -14.147 1.00 25.84 ? 6 GLN L OE1 1 ATOM 49 N NE2 . GLN A 1 6 ? 9.056 5.874 -12.585 1.00 20.25 ? 6 GLN L NE2 1 ATOM 50 N N . SER A 1 7 ? 3.454 6.076 -13.025 1.00 25.37 ? 7 SER L N 1 ATOM 51 C CA . SER A 1 7 ? 2.576 7.230 -12.963 1.00 30.10 ? 7 SER L CA 1 ATOM 52 C C . SER A 1 7 ? 2.869 8.031 -11.698 1.00 30.78 ? 7 SER L C 1 ATOM 53 O O . SER A 1 7 ? 3.278 7.467 -10.680 1.00 27.34 ? 7 SER L O 1 ATOM 54 C CB . SER A 1 7 ? 1.106 6.803 -13.013 1.00 36.51 ? 7 SER L CB 1 ATOM 55 O OG . SER A 1 7 ? 0.770 5.997 -11.900 1.00 43.40 ? 7 SER L OG 1 ATOM 56 N N . PRO A 1 8 ? 2.703 9.358 -11.769 1.00 26.26 ? 8 PRO L N 1 ATOM 57 C CA . PRO A 1 8 ? 2.433 10.097 -13.007 1.00 28.93 ? 8 PRO L CA 1 ATOM 58 C C . PRO A 1 8 ? 3.710 10.242 -13.826 1.00 31.35 ? 8 PRO L C 1 ATOM 59 O O . PRO A 1 8 ? 4.782 9.865 -13.348 1.00 27.02 ? 8 PRO L O 1 ATOM 60 C CB . PRO A 1 8 ? 1.936 11.463 -12.513 1.00 26.71 ? 8 PRO L CB 1 ATOM 61 C CG . PRO A 1 8 ? 1.689 11.304 -11.043 1.00 35.89 ? 8 PRO L CG 1 ATOM 62 C CD . PRO A 1 8 ? 2.621 10.226 -10.587 1.00 28.32 ? 8 PRO L CD 1 ATOM 63 N N . SER A 1 9 ? 3.609 10.774 -15.037 1.00 28.10 ? 9 SER L N 1 ATOM 64 C CA . SER A 1 9 ? 4.802 11.006 -15.843 1.00 34.17 ? 9 SER L CA 1 ATOM 65 C C . SER A 1 9 ? 5.603 12.177 -15.273 1.00 30.90 ? 9 SER L C 1 ATOM 66 O O . SER A 1 9 ? 6.826 12.254 -15.421 1.00 29.08 ? 9 SER L O 1 ATOM 67 C CB . SER A 1 9 ? 4.423 11.281 -17.299 1.00 36.56 ? 9 SER L CB 1 ATOM 68 O OG . SER A 1 9 ? 3.526 12.377 -17.392 1.00 42.26 ? 9 SER L OG 1 ATOM 69 N N . PHE A 1 10 ? 4.893 13.065 -14.590 1.00 21.86 ? 10 PHE L N 1 ATOM 70 C CA . PHE A 1 10 ? 5.424 14.354 -14.187 1.00 35.40 ? 10 PHE L CA 1 ATOM 71 C C . PHE A 1 10 ? 4.750 14.794 -12.886 1.00 34.42 ? 10 PHE L C 1 ATOM 72 O O . PHE A 1 10 ? 3.528 14.888 -12.817 1.00 39.96 ? 10 PHE L O 1 ATOM 73 C CB . PHE A 1 10 ? 5.196 15.355 -15.327 1.00 46.58 ? 10 PHE L CB 1 ATOM 74 C CG . PHE A 1 10 ? 5.580 16.769 -15.012 1.00 58.69 ? 10 PHE L CG 1 ATOM 75 C CD1 . PHE A 1 10 ? 4.640 17.662 -14.514 1.00 58.97 ? 10 PHE L CD1 1 ATOM 76 C CD2 . PHE A 1 10 ? 6.863 17.225 -15.268 1.00 72.35 ? 10 PHE L CD2 1 ATOM 77 C CE1 . PHE A 1 10 ? 4.981 18.971 -14.246 1.00 58.90 ? 10 PHE L CE1 1 ATOM 78 C CE2 . PHE A 1 10 ? 7.213 18.539 -15.001 1.00 72.63 ? 10 PHE L CE2 1 ATOM 79 C CZ . PHE A 1 10 ? 6.266 19.412 -14.495 1.00 66.28 ? 10 PHE L CZ 1 ATOM 80 N N . VAL A 1 11 ? 5.542 15.034 -11.847 1.00 28.97 ? 11 VAL L N 1 ATOM 81 C CA . VAL A 1 11 ? 5.002 15.472 -10.561 1.00 28.28 ? 11 VAL L CA 1 ATOM 82 C C . VAL A 1 11 ? 5.582 16.822 -10.158 1.00 23.39 ? 11 VAL L C 1 ATOM 83 O O . VAL A 1 11 ? 6.795 17.016 -10.187 1.00 26.44 ? 11 VAL L O 1 ATOM 84 C CB . VAL A 1 11 ? 5.300 14.451 -9.429 1.00 36.76 ? 11 VAL L CB 1 ATOM 85 C CG1 . VAL A 1 11 ? 4.719 14.934 -8.107 1.00 36.52 ? 11 VAL L CG1 1 ATOM 86 C CG2 . VAL A 1 11 ? 4.758 13.079 -9.778 1.00 31.47 ? 11 VAL L CG2 1 ATOM 87 N N . SER A 1 12 ? 4.719 17.757 -9.780 1.00 24.42 ? 12 SER L N 1 ATOM 88 C CA . SER A 1 12 ? 5.190 19.033 -9.267 1.00 27.26 ? 12 SER L CA 1 ATOM 89 C C . SER A 1 12 ? 4.874 19.105 -7.780 1.00 29.58 ? 12 SER L C 1 ATOM 90 O O . SER A 1 12 ? 3.719 19.007 -7.377 1.00 28.37 ? 12 SER L O 1 ATOM 91 C CB . SER A 1 12 ? 4.554 20.201 -10.025 1.00 34.40 ? 12 SER L CB 1 ATOM 92 O OG . SER A 1 12 ? 3.176 20.320 -9.728 1.00 55.73 ? 12 SER L OG 1 ATOM 93 N N . ALA A 1 13 ? 5.906 19.253 -6.960 1.00 27.19 ? 13 ALA L N 1 ATOM 94 C CA . ALA A 1 13 ? 5.705 19.258 -5.520 1.00 25.33 ? 13 ALA L CA 1 ATOM 95 C C . ALA A 1 13 ? 6.597 20.281 -4.840 1.00 26.52 ? 13 ALA L C 1 ATOM 96 O O . ALA A 1 13 ? 7.697 20.567 -5.304 1.00 25.08 ? 13 ALA L O 1 ATOM 97 C CB . ALA A 1 13 ? 5.951 17.880 -4.953 1.00 13.31 ? 13 ALA L CB 1 ATOM 98 N N . SER A 1 14 ? 6.109 20.839 -3.740 1.00 30.50 ? 14 SER L N 1 ATOM 99 C CA . SER A 1 14 ? 6.872 21.829 -2.998 1.00 34.59 ? 14 SER L CA 1 ATOM 100 C C . SER A 1 14 ? 7.900 21.150 -2.109 1.00 30.02 ? 14 SER L C 1 ATOM 101 O O . SER A 1 14 ? 7.729 20.000 -1.714 1.00 28.91 ? 14 SER L O 1 ATOM 102 C CB . SER A 1 14 ? 5.947 22.705 -2.149 1.00 31.65 ? 14 SER L CB 1 ATOM 103 O OG . SER A 1 14 ? 4.887 23.227 -2.929 1.00 40.71 ? 14 SER L OG 1 ATOM 104 N N . VAL A 1 15 ? 8.976 21.865 -1.814 1.00 23.17 ? 15 VAL L N 1 ATOM 105 C CA . VAL A 1 15 ? 9.904 21.451 -0.780 1.00 19.90 ? 15 VAL L CA 1 ATOM 106 C C . VAL A 1 15 ? 9.125 21.242 0.516 1.00 23.64 ? 15 VAL L C 1 ATOM 107 O O . VAL A 1 15 ? 8.264 22.050 0.859 1.00 23.31 ? 15 VAL L O 1 ATOM 108 C CB . VAL A 1 15 ? 11.006 22.497 -0.578 1.00 25.45 ? 15 VAL L CB 1 ATOM 109 C CG1 . VAL A 1 15 ? 11.974 22.063 0.523 1.00 20.35 ? 15 VAL L CG1 1 ATOM 110 C CG2 . VAL A 1 15 ? 11.736 22.733 -1.893 1.00 25.44 ? 15 VAL L CG2 1 ATOM 111 N N . GLY A 1 16 ? 9.402 20.148 1.218 1.00 22.77 ? 16 GLY L N 1 ATOM 112 C CA . GLY A 1 16 ? 8.672 19.830 2.431 1.00 23.45 ? 16 GLY L CA 1 ATOM 113 C C . GLY A 1 16 ? 7.449 18.953 2.193 1.00 24.14 ? 16 GLY L C 1 ATOM 114 O O . GLY A 1 16 ? 6.933 18.335 3.119 1.00 27.21 ? 16 GLY L O 1 ATOM 115 N N . ASP A 1 17 ? 6.983 18.894 0.951 1.00 19.99 ? 17 ASP L N 1 ATOM 116 C CA . ASP A 1 17 ? 5.832 18.061 0.617 1.00 22.24 ? 17 ASP L CA 1 ATOM 117 C C . ASP A 1 17 ? 6.152 16.567 0.601 1.00 23.79 ? 17 ASP L C 1 ATOM 118 O O . ASP A 1 17 ? 7.301 16.155 0.456 1.00 27.78 ? 17 ASP L O 1 ATOM 119 C CB . ASP A 1 17 ? 5.259 18.455 -0.746 1.00 29.19 ? 17 ASP L CB 1 ATOM 120 C CG . ASP A 1 17 ? 4.298 19.624 -0.662 1.00 50.98 ? 17 ASP L CG 1 ATOM 121 O OD1 . ASP A 1 17 ? 4.229 20.264 0.410 1.00 59.53 ? 17 ASP L OD1 1 ATOM 122 O OD2 . ASP A 1 17 ? 3.616 19.906 -1.675 1.00 57.06 ? 17 ASP L OD2 1 ATOM 123 N N . ARG A 1 18 ? 5.100 15.773 0.751 1.00 26.04 ? 18 ARG L N 1 ATOM 124 C CA . ARG A 1 18 ? 5.144 14.330 0.584 1.00 26.07 ? 18 ARG L CA 1 ATOM 125 C C . ARG A 1 18 ? 4.840 13.992 -0.868 1.00 23.50 ? 18 ARG L C 1 ATOM 126 O O . ARG A 1 18 ? 4.043 14.672 -1.506 1.00 26.21 ? 18 ARG L O 1 ATOM 127 C CB . ARG A 1 18 ? 4.126 13.667 1.515 1.00 27.96 ? 18 ARG L CB 1 ATOM 128 C CG . ARG A 1 18 ? 3.879 12.197 1.270 1.00 31.66 ? 18 ARG L CG 1 ATOM 129 C CD . ARG A 1 18 ? 2.713 11.698 2.115 1.00 37.59 ? 18 ARG L CD 1 ATOM 130 N NE . ARG A 1 18 ? 2.581 10.242 2.064 1.00 44.74 ? 18 ARG L NE 1 ATOM 131 C CZ . ARG A 1 18 ? 3.145 9.409 2.935 1.00 43.96 ? 18 ARG L CZ 1 ATOM 132 N NH1 . ARG A 1 18 ? 3.881 9.887 3.932 1.00 43.80 ? 18 ARG L NH1 1 ATOM 133 N NH2 . ARG A 1 18 ? 2.974 8.098 2.811 1.00 40.60 ? 18 ARG L NH2 1 ATOM 134 N N . VAL A 1 19 ? 5.477 12.956 -1.398 1.00 18.81 ? 19 VAL L N 1 ATOM 135 C CA . VAL A 1 19 ? 5.175 12.526 -2.751 1.00 24.66 ? 19 VAL L CA 1 ATOM 136 C C . VAL A 1 19 ? 5.234 11.005 -2.836 1.00 26.60 ? 19 VAL L C 1 ATOM 137 O O . VAL A 1 19 ? 6.077 10.362 -2.210 1.00 24.12 ? 19 VAL L O 1 ATOM 138 C CB . VAL A 1 19 ? 6.134 13.169 -3.780 1.00 27.40 ? 19 VAL L CB 1 ATOM 139 C CG1 . VAL A 1 19 ? 7.573 12.815 -3.469 1.00 26.11 ? 19 VAL L CG1 1 ATOM 140 C CG2 . VAL A 1 19 ? 5.767 12.749 -5.195 1.00 29.49 ? 19 VAL L CG2 1 ATOM 141 N N . THR A 1 20 ? 4.299 10.433 -3.583 1.00 23.81 ? 20 THR L N 1 ATOM 142 C CA . THR A 1 20 ? 4.286 9.000 -3.826 1.00 27.66 ? 20 THR L CA 1 ATOM 143 C C . THR A 1 20 ? 4.169 8.762 -5.315 1.00 27.96 ? 20 THR L C 1 ATOM 144 O O . THR A 1 20 ? 3.258 9.277 -5.961 1.00 25.72 ? 20 THR L O 1 ATOM 145 C CB . THR A 1 20 ? 3.121 8.300 -3.101 1.00 27.34 ? 20 THR L CB 1 ATOM 146 O OG1 . THR A 1 20 ? 3.253 8.498 -1.691 1.00 30.05 ? 20 THR L OG1 1 ATOM 147 C CG2 . THR A 1 20 ? 3.121 6.807 -3.395 1.00 27.39 ? 20 THR L CG2 1 ATOM 148 N N . ILE A 1 21 ? 5.099 7.992 -5.863 1.00 18.88 ? 21 ILE L N 1 ATOM 149 C CA . ILE A 1 21 ? 5.041 7.658 -7.275 1.00 21.73 ? 21 ILE L CA 1 ATOM 150 C C . ILE A 1 21 ? 4.888 6.157 -7.428 1.00 21.30 ? 21 ILE L C 1 ATOM 151 O O . ILE A 1 21 ? 5.411 5.378 -6.629 1.00 20.92 ? 21 ILE L O 1 ATOM 152 C CB . ILE A 1 21 ? 6.287 8.150 -8.033 1.00 28.74 ? 21 ILE L CB 1 ATOM 153 C CG1 . ILE A 1 21 ? 7.549 7.494 -7.488 1.00 25.68 ? 21 ILE L CG1 1 ATOM 154 C CG2 . ILE A 1 21 ? 6.406 9.663 -7.919 1.00 35.55 ? 21 ILE L CG2 1 ATOM 155 C CD1 . ILE A 1 21 ? 8.803 7.969 -8.169 1.00 33.14 ? 21 ILE L CD1 1 ATOM 156 N N . THR A 1 22 ? 4.161 5.754 -8.458 1.00 21.94 ? 22 THR L N 1 ATOM 157 C CA . THR A 1 22 ? 3.797 4.358 -8.602 1.00 30.72 ? 22 THR L CA 1 ATOM 158 C C . THR A 1 22 ? 4.387 3.729 -9.844 1.00 27.49 ? 22 THR L C 1 ATOM 159 O O . THR A 1 22 ? 4.629 4.393 -10.855 1.00 22.80 ? 22 THR L O 1 ATOM 160 C CB . THR A 1 22 ? 2.275 4.178 -8.640 1.00 31.27 ? 22 THR L CB 1 ATOM 161 O OG1 . THR A 1 22 ? 1.742 4.919 -9.740 1.00 47.02 ? 22 THR L OG1 1 ATOM 162 C CG2 . THR A 1 22 ? 1.656 4.680 -7.352 1.00 28.51 ? 22 THR L CG2 1 ATOM 163 N N . CYS A 1 23 ? 4.615 2.429 -9.736 1.00 26.04 ? 23 CYS L N 1 ATOM 164 C CA . CYS A 1 23 ? 5.121 1.621 -10.823 1.00 29.73 ? 23 CYS L CA 1 ATOM 165 C C . CYS A 1 23 ? 4.200 0.419 -10.949 1.00 28.95 ? 23 CYS L C 1 ATOM 166 O O . CYS A 1 23 ? 3.962 -0.292 -9.974 1.00 28.30 ? 23 CYS L O 1 ATOM 167 C CB . CYS A 1 23 ? 6.569 1.189 -10.556 1.00 31.31 ? 23 CYS L CB 1 ATOM 168 S SG . CYS A 1 23 ? 7.405 0.343 -11.930 1.00 42.97 ? 23 CYS L SG 1 ATOM 169 N N . ARG A 1 24 ? 3.661 0.207 -12.141 1.00 25.06 ? 24 ARG L N 1 ATOM 170 C CA . ARG A 1 24 ? 2.779 -0.925 -12.377 1.00 25.87 ? 24 ARG L CA 1 ATOM 171 C C . ARG A 1 24 ? 3.404 -1.860 -13.398 1.00 26.61 ? 24 ARG L C 1 ATOM 172 O O . ARG A 1 24 ? 3.789 -1.429 -14.485 1.00 35.65 ? 24 ARG L O 1 ATOM 173 C CB . ARG A 1 24 ? 1.398 -0.455 -12.850 1.00 34.17 ? 24 ARG L CB 1 ATOM 174 C CG . ARG A 1 24 ? 0.434 -1.589 -13.153 1.00 45.41 ? 24 ARG L CG 1 ATOM 175 C CD . ARG A 1 24 ? -0.862 -1.083 -13.770 1.00 64.81 ? 24 ARG L CD 1 ATOM 176 N NE . ARG A 1 24 ? -1.398 -2.043 -14.734 1.00 89.31 ? 24 ARG L NE 1 ATOM 177 C CZ . ARG A 1 24 ? -2.557 -1.906 -15.374 1.00 105.36 ? 24 ARG L CZ 1 ATOM 178 N NH1 . ARG A 1 24 ? -3.322 -0.843 -15.156 1.00 110.74 ? 24 ARG L NH1 1 ATOM 179 N NH2 . ARG A 1 24 ? -2.954 -2.836 -16.235 1.00 107.07 ? 24 ARG L NH2 1 ATOM 180 N N . ALA A 1 25 ? 3.533 -3.133 -13.035 1.00 28.61 ? 25 ALA L N 1 ATOM 181 C CA . ALA A 1 25 ? 4.036 -4.143 -13.959 1.00 26.37 ? 25 ALA L CA 1 ATOM 182 C C . ALA A 1 25 ? 2.875 -4.822 -14.678 1.00 27.02 ? 25 ALA L C 1 ATOM 183 O O . ALA A 1 25 ? 1.813 -5.031 -14.089 1.00 31.29 ? 25 ALA L O 1 ATOM 184 C CB . ALA A 1 25 ? 4.885 -5.169 -13.221 1.00 22.22 ? 25 ALA L CB 1 ATOM 185 N N . SER A 1 26 ? 3.080 -5.168 -15.947 1.00 26.15 ? 26 SER L N 1 ATOM 186 C CA . SER A 1 26 ? 2.018 -5.756 -16.762 1.00 35.98 ? 26 SER L CA 1 ATOM 187 C C . SER A 1 26 ? 1.693 -7.191 -16.339 1.00 37.57 ? 26 SER L C 1 ATOM 188 O O . SER A 1 26 ? 0.580 -7.664 -16.545 1.00 41.23 ? 26 SER L O 1 ATOM 189 C CB . SER A 1 26 ? 2.400 -5.717 -18.242 1.00 31.31 ? 26 SER L CB 1 ATOM 190 O OG . SER A 1 26 ? 3.632 -6.375 -18.464 1.00 36.00 ? 26 SER L OG 1 ATOM 191 N N . GLN A 1 27 ? 2.670 -7.878 -15.758 1.00 39.25 ? 27 GLN L N 1 ATOM 192 C CA . GLN A 1 27 ? 2.443 -9.173 -15.116 1.00 39.65 ? 27 GLN L CA 1 ATOM 193 C C . GLN A 1 27 ? 3.121 -9.150 -13.750 1.00 36.39 ? 27 GLN L C 1 ATOM 194 O O . GLN A 1 27 ? 3.967 -8.296 -13.498 1.00 41.28 ? 27 GLN L O 1 ATOM 195 C CB . GLN A 1 27 ? 2.995 -10.327 -15.956 1.00 41.42 ? 27 GLN L CB 1 ATOM 196 C CG . GLN A 1 27 ? 2.556 -10.354 -17.415 1.00 49.46 ? 27 GLN L CG 1 ATOM 197 C CD . GLN A 1 27 ? 3.298 -11.419 -18.220 1.00 62.87 ? 27 GLN L CD 1 ATOM 198 O OE1 . GLN A 1 27 ? 3.594 -12.505 -17.715 1.00 63.24 ? 27 GLN L OE1 1 ATOM 199 N NE2 . GLN A 1 27 ? 3.612 -11.104 -19.474 1.00 65.38 ? 27 GLN L NE2 1 ATOM 200 N N . GLY A 1 28 ? 2.761 -10.082 -12.874 1.00 35.49 ? 28 GLY L N 1 ATOM 201 C CA . GLY A 1 28 ? 3.387 -10.170 -11.563 1.00 35.69 ? 28 GLY L CA 1 ATOM 202 C C . GLY A 1 28 ? 4.889 -10.413 -11.626 1.00 33.05 ? 28 GLY L C 1 ATOM 203 O O . GLY A 1 28 ? 5.365 -11.197 -12.445 1.00 38.50 ? 28 GLY L O 1 ATOM 204 N N . ILE A 1 29 ? 5.639 -9.727 -10.767 1.00 26.12 ? 29 ILE L N 1 ATOM 205 C CA . ILE A 1 29 ? 7.090 -9.899 -10.698 1.00 28.76 ? 29 ILE L CA 1 ATOM 206 C C . ILE A 1 29 ? 7.561 -10.038 -9.249 1.00 28.23 ? 29 ILE L C 1 ATOM 207 O O . ILE A 1 29 ? 8.713 -9.734 -8.937 1.00 24.76 ? 29 ILE L O 1 ATOM 208 C CB . ILE A 1 29 ? 7.841 -8.716 -11.350 1.00 30.49 ? 29 ILE L CB 1 ATOM 209 C CG1 . ILE A 1 29 ? 7.406 -7.393 -10.710 1.00 28.27 ? 29 ILE L CG1 1 ATOM 210 C CG2 . ILE A 1 29 ? 7.600 -8.687 -12.845 1.00 30.31 ? 29 ILE L CG2 1 ATOM 211 C CD1 . ILE A 1 29 ? 8.218 -6.200 -11.147 1.00 28.93 ? 29 ILE L CD1 1 ATOM 212 N N . SER A 1 30 ? 6.664 -10.510 -8.382 1.00 27.19 ? 30 SER L N 1 ATOM 213 C CA . SER A 1 30 ? 6.889 -10.576 -6.933 1.00 23.12 ? 30 SER L CA 1 ATOM 214 C C . SER A 1 30 ? 7.589 -9.324 -6.422 1.00 19.37 ? 30 SER L C 1 ATOM 215 O O . SER A 1 30 ? 7.032 -8.237 -6.515 1.00 25.72 ? 30 SER L O 1 ATOM 216 C CB . SER A 1 30 ? 7.680 -11.833 -6.546 1.00 35.20 ? 30 SER L CB 1 ATOM 217 O OG . SER A 1 30 ? 8.814 -12.025 -7.368 1.00 49.27 ? 30 SER L OG 1 ATOM 218 N N . SER A 1 31 ? 8.805 -9.472 -5.901 1.00 18.22 ? 31 SER L N 1 ATOM 219 C CA . SER A 1 31 ? 9.546 -8.335 -5.344 1.00 27.92 ? 31 SER L CA 1 ATOM 220 C C . SER A 1 31 ? 10.815 -8.018 -6.125 1.00 27.47 ? 31 SER L C 1 ATOM 221 O O . SER A 1 31 ? 11.745 -7.419 -5.592 1.00 24.34 ? 31 SER L O 1 ATOM 222 C CB . SER A 1 31 ? 9.911 -8.594 -3.878 1.00 28.40 ? 31 SER L CB 1 ATOM 223 O OG . SER A 1 31 ? 8.762 -8.534 -3.051 1.00 37.85 ? 31 SER L OG 1 ATOM 224 N N . TYR A 1 32 ? 10.855 -8.420 -7.389 1.00 24.76 ? 32 TYR L N 1 ATOM 225 C CA . TYR A 1 32 ? 12.031 -8.182 -8.213 1.00 18.35 ? 32 TYR L CA 1 ATOM 226 C C . TYR A 1 32 ? 11.979 -6.799 -8.847 1.00 22.78 ? 32 TYR L C 1 ATOM 227 O O . TYR A 1 32 ? 11.913 -6.647 -10.070 1.00 23.44 ? 32 TYR L O 1 ATOM 228 C CB . TYR A 1 32 ? 12.163 -9.272 -9.276 1.00 22.04 ? 32 TYR L CB 1 ATOM 229 C CG . TYR A 1 32 ? 12.584 -10.595 -8.683 1.00 21.68 ? 32 TYR L CG 1 ATOM 230 C CD1 . TYR A 1 32 ? 13.895 -10.801 -8.284 1.00 28.38 ? 32 TYR L CD1 1 ATOM 231 C CD2 . TYR A 1 32 ? 11.669 -11.623 -8.496 1.00 23.83 ? 32 TYR L CD2 1 ATOM 232 C CE1 . TYR A 1 32 ? 14.295 -11.999 -7.727 1.00 35.96 ? 32 TYR L CE1 1 ATOM 233 C CE2 . TYR A 1 32 ? 12.060 -12.837 -7.936 1.00 25.68 ? 32 TYR L CE2 1 ATOM 234 C CZ . TYR A 1 32 ? 13.378 -13.013 -7.556 1.00 28.75 ? 32 TYR L CZ 1 ATOM 235 O OH . TYR A 1 32 ? 13.793 -14.197 -7.000 1.00 31.74 ? 32 TYR L OH 1 ATOM 236 N N . LEU A 1 33 ? 12.012 -5.784 -7.994 1.00 22.13 ? 33 LEU L N 1 ATOM 237 C CA . LEU A 1 33 ? 11.922 -4.412 -8.459 1.00 22.50 ? 33 LEU L CA 1 ATOM 238 C C . LEU A 1 33 ? 12.863 -3.507 -7.681 1.00 21.56 ? 33 LEU L C 1 ATOM 239 O O . LEU A 1 33 ? 13.008 -3.649 -6.463 1.00 23.95 ? 33 LEU L O 1 ATOM 240 C CB . LEU A 1 33 ? 10.485 -3.902 -8.345 1.00 20.01 ? 33 LEU L CB 1 ATOM 241 C CG . LEU A 1 33 ? 10.306 -2.472 -8.851 1.00 26.80 ? 33 LEU L CG 1 ATOM 242 C CD1 . LEU A 1 33 ? 9.651 -2.452 -10.212 1.00 23.66 ? 33 LEU L CD1 1 ATOM 243 C CD2 . LEU A 1 33 ? 9.535 -1.641 -7.850 1.00 27.97 ? 33 LEU L CD2 1 ATOM 244 N N . ALA A 1 34 ? 13.506 -2.588 -8.398 1.00 22.77 ? 34 ALA L N 1 ATOM 245 C CA . ALA A 1 34 ? 14.356 -1.571 -7.789 1.00 22.19 ? 34 ALA L CA 1 ATOM 246 C C . ALA A 1 34 ? 13.967 -0.173 -8.266 1.00 21.37 ? 34 ALA L C 1 ATOM 247 O O . ALA A 1 34 ? 13.364 -0.026 -9.328 1.00 24.19 ? 34 ALA L O 1 ATOM 248 C CB . ALA A 1 34 ? 15.820 -1.845 -8.099 1.00 20.74 ? 34 ALA L CB 1 ATOM 249 N N . TRP A 1 35 ? 14.306 0.845 -7.477 1.00 17.17 ? 35 TRP L N 1 ATOM 250 C CA . TRP A 1 35 ? 14.107 2.246 -7.866 1.00 18.18 ? 35 TRP L CA 1 ATOM 251 C C . TRP A 1 35 ? 15.427 3.007 -7.961 1.00 22.33 ? 35 TRP L C 1 ATOM 252 O O . TRP A 1 35 ? 16.270 2.909 -7.068 1.00 24.96 ? 35 TRP L O 1 ATOM 253 C CB . TRP A 1 35 ? 13.205 2.976 -6.866 1.00 17.77 ? 35 TRP L CB 1 ATOM 254 C CG . TRP A 1 35 ? 11.790 2.511 -6.829 1.00 21.42 ? 35 TRP L CG 1 ATOM 255 C CD1 . TRP A 1 35 ? 11.275 1.500 -6.064 1.00 19.54 ? 35 TRP L CD1 1 ATOM 256 C CD2 . TRP A 1 35 ? 10.690 3.056 -7.569 1.00 20.72 ? 35 TRP L CD2 1 ATOM 257 N NE1 . TRP A 1 35 ? 9.923 1.380 -6.290 1.00 19.76 ? 35 TRP L NE1 1 ATOM 258 C CE2 . TRP A 1 35 ? 9.538 2.328 -7.210 1.00 20.80 ? 35 TRP L CE2 1 ATOM 259 C CE3 . TRP A 1 35 ? 10.566 4.096 -8.500 1.00 24.54 ? 35 TRP L CE3 1 ATOM 260 C CZ2 . TRP A 1 35 ? 8.276 2.600 -7.750 1.00 18.82 ? 35 TRP L CZ2 1 ATOM 261 C CZ3 . TRP A 1 35 ? 9.312 4.367 -9.039 1.00 24.48 ? 35 TRP L CZ3 1 ATOM 262 C CH2 . TRP A 1 35 ? 8.186 3.623 -8.661 1.00 22.65 ? 35 TRP L CH2 1 ATOM 263 N N . TYR A 1 36 ? 15.590 3.787 -9.025 1.00 22.01 ? 36 TYR L N 1 ATOM 264 C CA . TYR A 1 36 ? 16.772 4.626 -9.182 1.00 18.48 ? 36 TYR L CA 1 ATOM 265 C C . TYR A 1 36 ? 16.423 6.107 -9.280 1.00 18.37 ? 36 TYR L C 1 ATOM 266 O O . TYR A 1 36 ? 15.361 6.481 -9.783 1.00 16.08 ? 36 TYR L O 1 ATOM 267 C CB . TYR A 1 36 ? 17.570 4.220 -10.422 1.00 16.54 ? 36 TYR L CB 1 ATOM 268 C CG . TYR A 1 36 ? 17.984 2.766 -10.461 1.00 17.12 ? 36 TYR L CG 1 ATOM 269 C CD1 . TYR A 1 36 ? 17.136 1.800 -10.986 1.00 16.87 ? 36 TYR L CD1 1 ATOM 270 C CD2 . TYR A 1 36 ? 19.231 2.364 -9.998 1.00 21.22 ? 36 TYR L CD2 1 ATOM 271 C CE1 . TYR A 1 36 ? 17.512 0.465 -11.038 1.00 18.40 ? 36 TYR L CE1 1 ATOM 272 C CE2 . TYR A 1 36 ? 19.618 1.029 -10.048 1.00 20.20 ? 36 TYR L CE2 1 ATOM 273 C CZ . TYR A 1 36 ? 18.751 0.087 -10.569 1.00 22.83 ? 36 TYR L CZ 1 ATOM 274 O OH . TYR A 1 36 ? 19.115 -1.240 -10.623 1.00 27.65 ? 36 TYR L OH 1 ATOM 275 N N . GLN A 1 37 ? 17.346 6.936 -8.802 1.00 22.04 ? 37 GLN L N 1 ATOM 276 C CA . GLN A 1 37 ? 17.261 8.390 -8.900 1.00 22.18 ? 37 GLN L CA 1 ATOM 277 C C . GLN A 1 37 ? 18.254 8.879 -9.944 1.00 23.69 ? 37 GLN L C 1 ATOM 278 O O . GLN A 1 37 ? 19.424 8.499 -9.905 1.00 23.66 ? 37 GLN L O 1 ATOM 279 C CB . GLN A 1 37 ? 17.562 9.042 -7.544 1.00 16.21 ? 37 GLN L CB 1 ATOM 280 C CG . GLN A 1 37 ? 17.551 10.567 -7.549 1.00 15.17 ? 37 GLN L CG 1 ATOM 281 C CD . GLN A 1 37 ? 18.222 11.142 -6.314 1.00 20.75 ? 37 GLN L CD 1 ATOM 282 O OE1 . GLN A 1 37 ? 19.442 11.281 -6.273 1.00 21.03 ? 37 GLN L OE1 1 ATOM 283 N NE2 . GLN A 1 37 ? 17.430 11.460 -5.293 1.00 15.84 ? 37 GLN L NE2 1 ATOM 284 N N . GLN A 1 38 ? 17.812 9.715 -10.877 1.00 19.66 ? 38 GLN L N 1 ATOM 285 C CA . GLN A 1 38 ? 18.749 10.245 -11.864 1.00 17.06 ? 38 GLN L CA 1 ATOM 286 C C . GLN A 1 38 ? 18.566 11.729 -12.114 1.00 15.23 ? 38 GLN L C 1 ATOM 287 O O . GLN A 1 38 ? 17.459 12.190 -12.399 1.00 18.15 ? 38 GLN L O 1 ATOM 288 C CB . GLN A 1 38 ? 18.635 9.497 -13.192 1.00 21.15 ? 38 GLN L CB 1 ATOM 289 C CG . GLN A 1 38 ? 19.734 9.880 -14.181 1.00 21.02 ? 38 GLN L CG 1 ATOM 290 C CD . GLN A 1 38 ? 19.549 9.235 -15.544 1.00 22.35 ? 38 GLN L CD 1 ATOM 291 O OE1 . GLN A 1 38 ? 18.425 8.990 -15.980 1.00 19.95 ? 38 GLN L OE1 1 ATOM 292 N NE2 . GLN A 1 38 ? 20.657 8.957 -16.221 1.00 19.48 ? 38 GLN L NE2 1 ATOM 293 N N . LYS A 1 39 ? 19.674 12.461 -12.012 1.00 17.01 ? 39 LYS L N 1 ATOM 294 C CA . LYS A 1 39 ? 19.717 13.890 -12.291 1.00 23.33 ? 39 LYS L CA 1 ATOM 295 C C . LYS A 1 39 ? 20.347 14.096 -13.664 1.00 28.94 ? 39 LYS L C 1 ATOM 296 O O . LYS A 1 39 ? 21.068 13.218 -14.150 1.00 24.30 ? 39 LYS L O 1 ATOM 297 C CB . LYS A 1 39 ? 20.491 14.619 -11.191 1.00 17.82 ? 39 LYS L CB 1 ATOM 298 C CG . LYS A 1 39 ? 19.900 14.357 -9.826 1.00 26.53 ? 39 LYS L CG 1 ATOM 299 C CD . LYS A 1 39 ? 20.561 15.156 -8.733 1.00 28.76 ? 39 LYS L CD 1 ATOM 300 C CE . LYS A 1 39 ? 19.985 14.748 -7.387 1.00 27.23 ? 39 LYS L CE 1 ATOM 301 N NZ . LYS A 1 39 ? 20.553 15.538 -6.268 1.00 32.41 ? 39 LYS L NZ 1 ATOM 302 N N . PRO A 1 40 ? 20.056 15.238 -14.311 1.00 26.57 ? 40 PRO L N 1 ATOM 303 C CA . PRO A 1 40 ? 20.520 15.434 -15.689 1.00 25.07 ? 40 PRO L CA 1 ATOM 304 C C . PRO A 1 40 ? 22.035 15.359 -15.826 1.00 26.00 ? 40 PRO L C 1 ATOM 305 O O . PRO A 1 40 ? 22.762 15.871 -14.974 1.00 32.07 ? 40 PRO L O 1 ATOM 306 C CB . PRO A 1 40 ? 20.015 16.840 -16.028 1.00 31.15 ? 40 PRO L CB 1 ATOM 307 C CG . PRO A 1 40 ? 18.832 17.039 -15.126 1.00 31.17 ? 40 PRO L CG 1 ATOM 308 C CD . PRO A 1 40 ? 19.223 16.364 -13.847 1.00 31.72 ? 40 PRO L CD 1 ATOM 309 N N . GLY A 1 41 ? 22.496 14.715 -16.893 1.00 25.21 ? 41 GLY L N 1 ATOM 310 C CA . GLY A 1 41 ? 23.918 14.577 -17.158 1.00 29.20 ? 41 GLY L CA 1 ATOM 311 C C . GLY A 1 41 ? 24.635 13.599 -16.243 1.00 33.37 ? 41 GLY L C 1 ATOM 312 O O . GLY A 1 41 ? 25.860 13.491 -16.283 1.00 42.21 ? 41 GLY L O 1 ATOM 313 N N . LYS A 1 42 ? 23.879 12.878 -15.419 1.00 25.50 ? 42 LYS L N 1 ATOM 314 C CA . LYS A 1 42 ? 24.488 11.991 -14.432 1.00 25.23 ? 42 LYS L CA 1 ATOM 315 C C . LYS A 1 42 ? 23.957 10.562 -14.498 1.00 17.70 ? 42 LYS L C 1 ATOM 316 O O . LYS A 1 42 ? 22.935 10.286 -15.125 1.00 17.21 ? 42 LYS L O 1 ATOM 317 C CB . LYS A 1 42 ? 24.282 12.553 -13.023 1.00 32.21 ? 42 LYS L CB 1 ATOM 318 C CG . LYS A 1 42 ? 24.951 13.899 -12.794 1.00 45.59 ? 42 LYS L CG 1 ATOM 319 C CD . LYS A 1 42 ? 24.680 14.407 -11.389 1.00 65.87 ? 42 LYS L CD 1 ATOM 320 C CE . LYS A 1 42 ? 25.226 15.814 -11.188 1.00 75.17 ? 42 LYS L CE 1 ATOM 321 N NZ . LYS A 1 42 ? 24.892 16.345 -9.836 1.00 75.52 ? 42 LYS L NZ 1 ATOM 322 N N . ALA A 1 43 ? 24.668 9.655 -13.843 1.00 24.47 ? 43 ALA L N 1 ATOM 323 C CA . ALA A 1 43 ? 24.288 8.253 -13.814 1.00 22.70 ? 43 ALA L CA 1 ATOM 324 C C . ALA A 1 43 ? 23.195 8.036 -12.784 1.00 21.90 ? 43 ALA L C 1 ATOM 325 O O . ALA A 1 43 ? 23.100 8.793 -11.824 1.00 17.45 ? 43 ALA L O 1 ATOM 326 C CB . ALA A 1 43 ? 25.494 7.383 -13.505 1.00 23.80 ? 43 ALA L CB 1 ATOM 327 N N . PRO A 1 44 ? 22.361 7.003 -12.980 1.00 18.15 ? 44 PRO L N 1 ATOM 328 C CA . PRO A 1 44 ? 21.351 6.702 -11.961 1.00 23.80 ? 44 PRO L CA 1 ATOM 329 C C . PRO A 1 44 ? 21.999 6.336 -10.633 1.00 25.39 ? 44 PRO L C 1 ATOM 330 O O . PRO A 1 44 ? 23.129 5.850 -10.621 1.00 25.31 ? 44 PRO L O 1 ATOM 331 C CB . PRO A 1 44 ? 20.593 5.505 -12.544 1.00 20.01 ? 44 PRO L CB 1 ATOM 332 C CG . PRO A 1 44 ? 20.865 5.543 -14.001 1.00 17.38 ? 44 PRO L CG 1 ATOM 333 C CD . PRO A 1 44 ? 22.235 6.132 -14.160 1.00 15.82 ? 44 PRO L CD 1 ATOM 334 N N . LYS A 1 45 ? 21.295 6.590 -9.534 1.00 19.32 ? 45 LYS L N 1 ATOM 335 C CA . LYS A 1 45 ? 21.738 6.156 -8.214 1.00 17.28 ? 45 LYS L CA 1 ATOM 336 C C . LYS A 1 45 ? 20.683 5.252 -7.622 1.00 21.87 ? 45 LYS L C 1 ATOM 337 O O . LYS A 1 45 ? 19.487 5.558 -7.683 1.00 21.29 ? 45 LYS L O 1 ATOM 338 C CB . LYS A 1 45 ? 21.990 7.339 -7.271 1.00 17.59 ? 45 LYS L CB 1 ATOM 339 C CG . LYS A 1 45 ? 23.191 8.191 -7.628 1.00 32.67 ? 45 LYS L CG 1 ATOM 340 C CD . LYS A 1 45 ? 23.386 9.304 -6.611 1.00 41.75 ? 45 LYS L CD 1 ATOM 341 C CE . LYS A 1 45 ? 24.550 10.211 -6.985 1.00 53.76 ? 45 LYS L CE 1 ATOM 342 N NZ . LYS A 1 45 ? 24.684 11.360 -6.042 1.00 62.72 ? 45 LYS L NZ 1 ATOM 343 N N . LEU A 1 46 ? 21.138 4.146 -7.043 1.00 13.54 ? 46 LEU L N 1 ATOM 344 C CA . LEU A 1 46 ? 20.261 3.161 -6.429 1.00 16.67 ? 46 LEU L CA 1 ATOM 345 C C . LEU A 1 46 ? 19.610 3.699 -5.166 1.00 22.08 ? 46 LEU L C 1 ATOM 346 O O . LEU A 1 46 ? 20.289 4.208 -4.275 1.00 15.17 ? 46 LEU L O 1 ATOM 347 C CB . LEU A 1 46 ? 21.040 1.895 -6.097 1.00 18.56 ? 46 LEU L CB 1 ATOM 348 C CG . LEU A 1 46 ? 20.249 0.843 -5.327 1.00 21.05 ? 46 LEU L CG 1 ATOM 349 C CD1 . LEU A 1 46 ? 19.045 0.387 -6.144 1.00 19.19 ? 46 LEU L CD1 1 ATOM 350 C CD2 . LEU A 1 46 ? 21.155 -0.332 -4.979 1.00 18.70 ? 46 LEU L CD2 1 ATOM 351 N N . VAL A 1 47 ? 18.292 3.563 -5.082 1.00 18.75 ? 47 VAL L N 1 ATOM 352 C CA . VAL A 1 47 ? 17.558 4.048 -3.926 1.00 20.47 ? 47 VAL L CA 1 ATOM 353 C C . VAL A 1 47 ? 17.008 2.877 -3.129 1.00 16.46 ? 47 VAL L C 1 ATOM 354 O O . VAL A 1 47 ? 17.260 2.747 -1.932 1.00 19.80 ? 47 VAL L O 1 ATOM 355 C CB . VAL A 1 47 ? 16.399 4.976 -4.344 1.00 23.42 ? 47 VAL L CB 1 ATOM 356 C CG1 . VAL A 1 47 ? 15.665 5.489 -3.118 1.00 26.67 ? 47 VAL L CG1 1 ATOM 357 C CG2 . VAL A 1 47 ? 16.928 6.129 -5.174 1.00 27.16 ? 47 VAL L CG2 1 ATOM 358 N N . ILE A 1 48 ? 16.258 2.023 -3.813 1.00 20.53 ? 48 ILE L N 1 ATOM 359 C CA . ILE A 1 48 ? 15.577 0.906 -3.181 1.00 13.02 ? 48 ILE L CA 1 ATOM 360 C C . ILE A 1 48 ? 15.681 -0.333 -4.059 1.00 19.09 ? 48 ILE L C 1 ATOM 361 O O . ILE A 1 48 ? 15.607 -0.226 -5.280 1.00 19.27 ? 48 ILE L O 1 ATOM 362 C CB . ILE A 1 48 ? 14.100 1.259 -2.909 1.00 22.08 ? 48 ILE L CB 1 ATOM 363 C CG1 . ILE A 1 48 ? 13.991 2.080 -1.624 1.00 26.89 ? 48 ILE L CG1 1 ATOM 364 C CG2 . ILE A 1 48 ? 13.240 0.007 -2.819 1.00 25.22 ? 48 ILE L CG2 1 ATOM 365 C CD1 . ILE A 1 48 ? 12.651 2.716 -1.418 1.00 32.77 ? 48 ILE L CD1 1 ATOM 366 N N . TYR A 1 49 ? 15.896 -1.496 -3.440 1.00 21.06 ? 49 TYR L N 1 ATOM 367 C CA . TYR A 1 49 ? 15.847 -2.772 -4.151 1.00 19.10 ? 49 TYR L CA 1 ATOM 368 C C . TYR A 1 49 ? 14.937 -3.750 -3.416 1.00 24.01 ? 49 TYR L C 1 ATOM 369 O O . TYR A 1 49 ? 14.511 -3.479 -2.293 1.00 27.70 ? 49 TYR L O 1 ATOM 370 C CB . TYR A 1 49 ? 17.244 -3.367 -4.312 1.00 18.31 ? 49 TYR L CB 1 ATOM 371 C CG . TYR A 1 49 ? 17.981 -3.575 -3.017 1.00 18.31 ? 49 TYR L CG 1 ATOM 372 C CD1 . TYR A 1 49 ? 18.657 -2.530 -2.418 1.00 21.50 ? 49 TYR L CD1 1 ATOM 373 C CD2 . TYR A 1 49 ? 18.015 -4.823 -2.400 1.00 25.43 ? 49 TYR L CD2 1 ATOM 374 C CE1 . TYR A 1 49 ? 19.346 -2.706 -1.233 1.00 28.57 ? 49 TYR L CE1 1 ATOM 375 C CE2 . TYR A 1 49 ? 18.705 -5.013 -1.211 1.00 25.48 ? 49 TYR L CE2 1 ATOM 376 C CZ . TYR A 1 49 ? 19.369 -3.947 -0.633 1.00 30.96 ? 49 TYR L CZ 1 ATOM 377 O OH . TYR A 1 49 ? 20.061 -4.107 0.548 1.00 28.06 ? 49 TYR L OH 1 ATOM 378 N N . ALA A 1 50 ? 14.638 -4.875 -4.065 1.00 24.29 ? 50 ALA L N 1 ATOM 379 C CA . ALA A 1 50 ? 13.673 -5.856 -3.564 1.00 22.86 ? 50 ALA L CA 1 ATOM 380 C C . ALA A 1 50 ? 12.375 -5.169 -3.120 1.00 25.77 ? 50 ALA L C 1 ATOM 381 O O . ALA A 1 50 ? 11.809 -5.498 -2.075 1.00 21.30 ? 50 ALA L O 1 ATOM 382 C CB . ALA A 1 50 ? 14.279 -6.669 -2.421 1.00 22.99 ? 50 ALA L CB 1 ATOM 383 N N . ALA A 1 51 ? 11.944 -4.191 -3.919 1.00 24.44 ? 51 ALA L N 1 ATOM 384 C CA . ALA A 1 51 ? 10.700 -3.428 -3.725 1.00 25.22 ? 51 ALA L CA 1 ATOM 385 C C . ALA A 1 51 ? 10.675 -2.488 -2.515 1.00 28.01 ? 51 ALA L C 1 ATOM 386 O O . ALA A 1 51 ? 10.152 -1.380 -2.617 1.00 29.00 ? 51 ALA L O 1 ATOM 387 C CB . ALA A 1 51 ? 9.507 -4.370 -3.657 1.00 26.03 ? 51 ALA L CB 1 ATOM 388 N N . SER A 1 52 ? 11.228 -2.903 -1.381 1.00 29.26 ? 52 SER L N 1 ATOM 389 C CA . SER A 1 52 ? 11.036 -2.126 -0.157 1.00 26.76 ? 52 SER L CA 1 ATOM 390 C C . SER A 1 52 ? 12.299 -1.916 0.671 1.00 21.97 ? 52 SER L C 1 ATOM 391 O O . SER A 1 52 ? 12.257 -1.306 1.735 1.00 31.28 ? 52 SER L O 1 ATOM 392 C CB . SER A 1 52 ? 9.976 -2.802 0.711 1.00 26.56 ? 52 SER L CB 1 ATOM 393 O OG . SER A 1 52 ? 10.311 -4.159 0.940 1.00 43.00 ? 52 SER L OG 1 ATOM 394 N N . THR A 1 53 ? 13.424 -2.412 0.183 1.00 21.89 ? 53 THR L N 1 ATOM 395 C CA . THR A 1 53 ? 14.660 -2.344 0.952 1.00 21.65 ? 53 THR L CA 1 ATOM 396 C C . THR A 1 53 ? 15.544 -1.178 0.505 1.00 21.91 ? 53 THR L C 1 ATOM 397 O O . THR A 1 53 ? 15.902 -1.072 -0.669 1.00 27.26 ? 53 THR L O 1 ATOM 398 C CB . THR A 1 53 ? 15.436 -3.671 0.844 1.00 24.38 ? 53 THR L CB 1 ATOM 399 O OG1 . THR A 1 53 ? 14.633 -4.730 1.378 1.00 27.82 ? 53 THR L OG1 1 ATOM 400 C CG2 . THR A 1 53 ? 16.738 -3.602 1.615 1.00 24.41 ? 53 THR L CG2 1 ATOM 401 N N . LEU A 1 54 ? 15.885 -0.303 1.448 1.00 23.96 ? 54 LEU L N 1 ATOM 402 C CA . LEU A 1 54 ? 16.741 0.850 1.167 1.00 24.75 ? 54 LEU L CA 1 ATOM 403 C C . LEU A 1 54 ? 18.190 0.457 0.943 1.00 22.34 ? 54 LEU L C 1 ATOM 404 O O . LEU A 1 54 ? 18.735 -0.372 1.664 1.00 26.73 ? 54 LEU L O 1 ATOM 405 C CB . LEU A 1 54 ? 16.686 1.868 2.310 1.00 29.10 ? 54 LEU L CB 1 ATOM 406 C CG . LEU A 1 54 ? 15.580 2.918 2.306 1.00 29.49 ? 54 LEU L CG 1 ATOM 407 C CD1 . LEU A 1 54 ? 14.232 2.278 2.603 1.00 24.58 ? 54 LEU L CD1 1 ATOM 408 C CD2 . LEU A 1 54 ? 15.903 3.995 3.317 1.00 21.87 ? 54 LEU L CD2 1 ATOM 409 N N . GLN A 1 55 ? 18.818 1.067 -0.054 1.00 24.46 ? 55 GLN L N 1 ATOM 410 C CA . GLN A 1 55 ? 20.252 0.917 -0.237 1.00 18.02 ? 55 GLN L CA 1 ATOM 411 C C . GLN A 1 55 ? 20.963 1.671 0.887 1.00 25.54 ? 55 GLN L C 1 ATOM 412 O O . GLN A 1 55 ? 20.470 2.698 1.355 1.00 26.07 ? 55 GLN L O 1 ATOM 413 C CB . GLN A 1 55 ? 20.672 1.434 -1.618 1.00 16.75 ? 55 GLN L CB 1 ATOM 414 C CG . GLN A 1 55 ? 22.171 1.528 -1.845 1.00 20.62 ? 55 GLN L CG 1 ATOM 415 C CD . GLN A 1 55 ? 22.857 0.171 -1.797 1.00 30.34 ? 55 GLN L CD 1 ATOM 416 O OE1 . GLN A 1 55 ? 22.203 -0.873 -1.857 1.00 36.99 ? 55 GLN L OE1 1 ATOM 417 N NE2 . GLN A 1 55 ? 24.181 0.181 -1.688 1.00 22.16 ? 55 GLN L NE2 1 ATOM 418 N N . SER A 1 56 ? 22.101 1.155 1.341 1.00 31.88 ? 56 SER L N 1 ATOM 419 C CA . SER A 1 56 ? 22.830 1.797 2.436 1.00 32.92 ? 56 SER L CA 1 ATOM 420 C C . SER A 1 56 ? 23.199 3.233 2.086 1.00 22.82 ? 56 SER L C 1 ATOM 421 O O . SER A 1 56 ? 23.586 3.532 0.954 1.00 24.28 ? 56 SER L O 1 ATOM 422 C CB . SER A 1 56 ? 24.087 1.000 2.789 1.00 38.79 ? 56 SER L CB 1 ATOM 423 O OG . SER A 1 56 ? 24.875 0.773 1.638 1.00 50.01 ? 56 SER L OG 1 ATOM 424 N N . GLY A 1 57 ? 23.063 4.125 3.060 1.00 24.62 ? 57 GLY L N 1 ATOM 425 C CA . GLY A 1 57 ? 23.352 5.529 2.842 1.00 23.33 ? 57 GLY L CA 1 ATOM 426 C C . GLY A 1 57 ? 22.138 6.347 2.435 1.00 25.09 ? 57 GLY L C 1 ATOM 427 O O . GLY A 1 57 ? 22.139 7.569 2.562 1.00 30.90 ? 57 GLY L O 1 ATOM 428 N N . VAL A 1 58 ? 21.101 5.681 1.938 1.00 24.85 ? 58 VAL L N 1 ATOM 429 C CA . VAL A 1 58 ? 19.887 6.379 1.525 1.00 25.22 ? 58 VAL L CA 1 ATOM 430 C C . VAL A 1 58 ? 19.114 6.860 2.756 1.00 26.55 ? 58 VAL L C 1 ATOM 431 O O . VAL A 1 58 ? 18.909 6.095 3.702 1.00 25.65 ? 58 VAL L O 1 ATOM 432 C CB . VAL A 1 58 ? 18.990 5.477 0.646 1.00 24.74 ? 58 VAL L CB 1 ATOM 433 C CG1 . VAL A 1 58 ? 17.660 6.157 0.347 1.00 17.07 ? 58 VAL L CG1 1 ATOM 434 C CG2 . VAL A 1 58 ? 19.712 5.109 -0.653 1.00 18.05 ? 58 VAL L CG2 1 ATOM 435 N N . PRO A 1 59 ? 18.698 8.138 2.751 1.00 24.01 ? 59 PRO L N 1 ATOM 436 C CA . PRO A 1 59 ? 17.999 8.752 3.888 1.00 25.24 ? 59 PRO L CA 1 ATOM 437 C C . PRO A 1 59 ? 16.638 8.123 4.181 1.00 24.50 ? 59 PRO L C 1 ATOM 438 O O . PRO A 1 59 ? 15.952 7.664 3.269 1.00 28.46 ? 59 PRO L O 1 ATOM 439 C CB . PRO A 1 59 ? 17.830 10.213 3.450 1.00 20.98 ? 59 PRO L CB 1 ATOM 440 C CG . PRO A 1 59 ? 18.836 10.420 2.381 1.00 25.88 ? 59 PRO L CG 1 ATOM 441 C CD . PRO A 1 59 ? 18.957 9.114 1.678 1.00 23.88 ? 59 PRO L CD 1 ATOM 442 N N . SER A 1 60 ? 16.250 8.140 5.452 1.00 25.33 ? 60 SER L N 1 ATOM 443 C CA . SER A 1 60 ? 15.049 7.457 5.924 1.00 30.28 ? 60 SER L CA 1 ATOM 444 C C . SER A 1 60 ? 13.734 8.036 5.386 1.00 26.13 ? 60 SER L C 1 ATOM 445 O O . SER A 1 60 ? 12.691 7.382 5.472 1.00 24.75 ? 60 SER L O 1 ATOM 446 C CB . SER A 1 60 ? 15.018 7.475 7.454 1.00 31.94 ? 60 SER L CB 1 ATOM 447 O OG . SER A 1 60 ? 15.033 8.810 7.937 1.00 38.03 ? 60 SER L OG 1 ATOM 448 N N . ARG A 1 61 ? 13.774 9.248 4.835 1.00 19.13 ? 61 ARG L N 1 ATOM 449 C CA . ARG A 1 61 ? 12.559 9.851 4.283 1.00 23.54 ? 61 ARG L CA 1 ATOM 450 C C . ARG A 1 61 ? 12.096 9.112 3.021 1.00 27.49 ? 61 ARG L C 1 ATOM 451 O O . ARG A 1 61 ? 10.952 9.263 2.591 1.00 29.17 ? 61 ARG L O 1 ATOM 452 C CB . ARG A 1 61 ? 12.763 11.345 3.991 1.00 23.51 ? 61 ARG L CB 1 ATOM 453 C CG . ARG A 1 61 ? 13.776 11.684 2.901 1.00 17.49 ? 61 ARG L CG 1 ATOM 454 C CD . ARG A 1 61 ? 14.006 13.202 2.841 1.00 20.24 ? 61 ARG L CD 1 ATOM 455 N NE . ARG A 1 61 ? 14.980 13.589 1.823 1.00 18.00 ? 61 ARG L NE 1 ATOM 456 C CZ . ARG A 1 61 ? 16.294 13.628 2.026 1.00 20.62 ? 61 ARG L CZ 1 ATOM 457 N NH1 . ARG A 1 61 ? 16.794 13.294 3.210 1.00 24.78 ? 61 ARG L NH1 1 ATOM 458 N NH2 . ARG A 1 61 ? 17.110 13.995 1.047 1.00 21.43 ? 61 ARG L NH2 1 ATOM 459 N N . PHE A 1 62 ? 12.988 8.309 2.443 1.00 25.75 ? 62 PHE L N 1 ATOM 460 C CA . PHE A 1 62 ? 12.638 7.414 1.343 1.00 26.19 ? 62 PHE L CA 1 ATOM 461 C C . PHE A 1 62 ? 12.087 6.087 1.856 1.00 28.55 ? 62 PHE L C 1 ATOM 462 O O . PHE A 1 62 ? 12.609 5.520 2.811 1.00 30.95 ? 62 PHE L O 1 ATOM 463 C CB . PHE A 1 62 ? 13.857 7.131 0.463 1.00 23.94 ? 62 PHE L CB 1 ATOM 464 C CG . PHE A 1 62 ? 14.278 8.288 -0.391 1.00 21.84 ? 62 PHE L CG 1 ATOM 465 C CD1 . PHE A 1 62 ? 15.102 9.280 0.121 1.00 23.24 ? 62 PHE L CD1 1 ATOM 466 C CD2 . PHE A 1 62 ? 13.866 8.372 -1.716 1.00 21.51 ? 62 PHE L CD2 1 ATOM 467 C CE1 . PHE A 1 62 ? 15.499 10.349 -0.667 1.00 22.38 ? 62 PHE L CE1 1 ATOM 468 C CE2 . PHE A 1 62 ? 14.260 9.431 -2.513 1.00 21.27 ? 62 PHE L CE2 1 ATOM 469 C CZ . PHE A 1 62 ? 15.077 10.426 -1.987 1.00 22.56 ? 62 PHE L CZ 1 ATOM 470 N N . SER A 1 63 ? 11.039 5.590 1.213 1.00 20.24 ? 63 SER L N 1 ATOM 471 C CA . SER A 1 63 ? 10.545 4.249 1.491 1.00 27.81 ? 63 SER L CA 1 ATOM 472 C C . SER A 1 63 ? 9.855 3.707 0.251 1.00 26.54 ? 63 SER L C 1 ATOM 473 O O . SER A 1 63 ? 9.494 4.464 -0.650 1.00 25.95 ? 63 SER L O 1 ATOM 474 C CB . SER A 1 63 ? 9.587 4.245 2.681 1.00 33.73 ? 63 SER L CB 1 ATOM 475 O OG . SER A 1 63 ? 8.400 4.960 2.382 1.00 39.08 ? 63 SER L OG 1 ATOM 476 N N . GLY A 1 64 ? 9.691 2.392 0.197 1.00 26.51 ? 64 GLY L N 1 ATOM 477 C CA . GLY A 1 64 ? 8.998 1.765 -0.911 1.00 25.38 ? 64 GLY L CA 1 ATOM 478 C C . GLY A 1 64 ? 8.174 0.591 -0.434 1.00 30.49 ? 64 GLY L C 1 ATOM 479 O O . GLY A 1 64 ? 8.471 -0.001 0.605 1.00 35.85 ? 64 GLY L O 1 ATOM 480 N N . SER A 1 65 ? 7.126 0.258 -1.177 1.00 30.48 ? 65 SER L N 1 ATOM 481 C CA . SER A 1 65 ? 6.365 -0.954 -0.886 1.00 37.34 ? 65 SER L CA 1 ATOM 482 C C . SER A 1 65 ? 5.675 -1.495 -2.128 1.00 29.78 ? 65 SER L C 1 ATOM 483 O O . SER A 1 65 ? 5.684 -0.864 -3.185 1.00 25.26 ? 65 SER L O 1 ATOM 484 C CB . SER A 1 65 ? 5.331 -0.704 0.214 1.00 42.23 ? 65 SER L CB 1 ATOM 485 O OG . SER A 1 65 ? 4.398 0.278 -0.179 1.00 40.94 ? 65 SER L OG 1 ATOM 486 N N . GLY A 1 66 ? 5.080 -2.674 -1.985 1.00 31.46 ? 66 GLY L N 1 ATOM 487 C CA . GLY A 1 66 ? 4.398 -3.320 -3.085 1.00 26.80 ? 66 GLY L CA 1 ATOM 488 C C . GLY A 1 66 ? 4.972 -4.686 -3.401 1.00 34.68 ? 66 GLY L C 1 ATOM 489 O O . GLY A 1 66 ? 6.102 -5.003 -3.033 1.00 39.30 ? 66 GLY L O 1 ATOM 490 N N . SER A 1 67 ? 4.172 -5.501 -4.077 1.00 34.08 ? 67 SER L N 1 ATOM 491 C CA . SER A 1 67 ? 4.607 -6.801 -4.565 1.00 39.04 ? 67 SER L CA 1 ATOM 492 C C . SER A 1 67 ? 3.630 -7.263 -5.638 1.00 42.26 ? 67 SER L C 1 ATOM 493 O O . SER A 1 67 ? 2.443 -6.937 -5.593 1.00 47.50 ? 67 SER L O 1 ATOM 494 C CB . SER A 1 67 ? 4.695 -7.824 -3.428 1.00 39.84 ? 67 SER L CB 1 ATOM 495 O OG . SER A 1 67 ? 3.456 -7.947 -2.753 1.00 49.55 ? 67 SER L OG 1 ATOM 496 N N . GLY A 1 68 ? 4.133 -8.009 -6.613 1.00 37.99 ? 68 GLY L N 1 ATOM 497 C CA . GLY A 1 68 ? 3.296 -8.466 -7.703 1.00 33.21 ? 68 GLY L CA 1 ATOM 498 C C . GLY A 1 68 ? 3.288 -7.500 -8.869 1.00 32.70 ? 68 GLY L C 1 ATOM 499 O O . GLY A 1 68 ? 4.173 -7.542 -9.721 1.00 33.61 ? 68 GLY L O 1 ATOM 500 N N . THR A 1 69 ? 2.295 -6.617 -8.906 1.00 25.54 ? 69 THR L N 1 ATOM 501 C CA . THR A 1 69 ? 2.123 -5.736 -10.053 1.00 32.05 ? 69 THR L CA 1 ATOM 502 C C . THR A 1 69 ? 2.096 -4.253 -9.689 1.00 34.75 ? 69 THR L C 1 ATOM 503 O O . THR A 1 69 ? 2.291 -3.406 -10.553 1.00 37.58 ? 69 THR L O 1 ATOM 504 C CB . THR A 1 69 ? 0.829 -6.064 -10.813 1.00 30.31 ? 69 THR L CB 1 ATOM 505 O OG1 . THR A 1 69 ? -0.292 -5.870 -9.943 1.00 31.64 ? 69 THR L OG1 1 ATOM 506 C CG2 . THR A 1 69 ? 0.849 -7.512 -11.300 1.00 29.94 ? 69 THR L CG2 1 ATOM 507 N N . GLU A 1 70 ? 1.850 -3.941 -8.420 1.00 30.84 ? 70 GLU L N 1 ATOM 508 C CA . GLU A 1 70 ? 1.744 -2.546 -7.992 1.00 31.47 ? 70 GLU L CA 1 ATOM 509 C C . GLU A 1 70 ? 2.820 -2.186 -6.977 1.00 30.19 ? 70 GLU L C 1 ATOM 510 O O . GLU A 1 70 ? 2.924 -2.810 -5.921 1.00 29.57 ? 70 GLU L O 1 ATOM 511 C CB . GLU A 1 70 ? 0.358 -2.265 -7.406 1.00 33.27 ? 70 GLU L CB 1 ATOM 512 C CG . GLU A 1 70 ? -0.789 -2.473 -8.390 1.00 52.85 ? 70 GLU L CG 1 ATOM 513 C CD . GLU A 1 70 ? -0.859 -1.396 -9.464 1.00 69.27 ? 70 GLU L CD 1 ATOM 514 O OE1 . GLU A 1 70 ? -0.163 -0.364 -9.328 1.00 75.87 ? 70 GLU L OE1 1 ATOM 515 O OE2 . GLU A 1 70 ? -1.617 -1.583 -10.443 1.00 68.43 ? 70 GLU L OE2 1 ATOM 516 N N . PHE A 1 71 ? 3.619 -1.176 -7.307 1.00 24.55 ? 71 PHE L N 1 ATOM 517 C CA . PHE A 1 71 ? 4.727 -0.773 -6.454 1.00 25.21 ? 71 PHE L CA 1 ATOM 518 C C . PHE A 1 71 ? 4.713 0.726 -6.195 1.00 24.42 ? 71 PHE L C 1 ATOM 519 O O . PHE A 1 71 ? 4.215 1.504 -7.007 1.00 24.53 ? 71 PHE L O 1 ATOM 520 C CB . PHE A 1 71 ? 6.058 -1.179 -7.079 1.00 22.48 ? 71 PHE L CB 1 ATOM 521 C CG . PHE A 1 71 ? 6.193 -2.653 -7.298 1.00 22.74 ? 71 PHE L CG 1 ATOM 522 C CD1 . PHE A 1 71 ? 5.642 -3.254 -8.424 1.00 20.37 ? 71 PHE L CD1 1 ATOM 523 C CD2 . PHE A 1 71 ? 6.864 -3.442 -6.376 1.00 22.38 ? 71 PHE L CD2 1 ATOM 524 C CE1 . PHE A 1 71 ? 5.761 -4.617 -8.630 1.00 19.80 ? 71 PHE L CE1 1 ATOM 525 C CE2 . PHE A 1 71 ? 6.990 -4.815 -6.576 1.00 25.32 ? 71 PHE L CE2 1 ATOM 526 C CZ . PHE A 1 71 ? 6.437 -5.400 -7.705 1.00 22.93 ? 71 PHE L CZ 1 ATOM 527 N N . THR A 1 72 ? 5.293 1.120 -5.069 1.00 26.04 ? 72 THR L N 1 ATOM 528 C CA . THR A 1 72 ? 5.232 2.500 -4.612 1.00 24.17 ? 72 THR L CA 1 ATOM 529 C C . THR A 1 72 ? 6.604 2.979 -4.164 1.00 27.12 ? 72 THR L C 1 ATOM 530 O O . THR A 1 72 ? 7.326 2.244 -3.491 1.00 21.54 ? 72 THR L O 1 ATOM 531 C CB . THR A 1 72 ? 4.218 2.637 -3.451 1.00 28.66 ? 72 THR L CB 1 ATOM 532 O OG1 . THR A 1 72 ? 2.958 3.068 -3.975 1.00 41.13 ? 72 THR L OG1 1 ATOM 533 C CG2 . THR A 1 72 ? 4.695 3.629 -2.404 1.00 45.90 ? 72 THR L CG2 1 ATOM 534 N N . LEU A 1 73 ? 6.972 4.192 -4.574 1.00 19.65 ? 73 LEU L N 1 ATOM 535 C CA . LEU A 1 73 ? 8.111 4.892 -3.994 1.00 19.66 ? 73 LEU L CA 1 ATOM 536 C C . LEU A 1 73 ? 7.588 6.159 -3.321 1.00 21.45 ? 73 LEU L C 1 ATOM 537 O O . LEU A 1 73 ? 6.836 6.917 -3.926 1.00 21.23 ? 73 LEU L O 1 ATOM 538 C CB . LEU A 1 73 ? 9.162 5.237 -5.051 1.00 22.40 ? 73 LEU L CB 1 ATOM 539 C CG . LEU A 1 73 ? 10.345 6.049 -4.517 1.00 30.50 ? 73 LEU L CG 1 ATOM 540 C CD1 . LEU A 1 73 ? 11.207 5.191 -3.616 1.00 33.91 ? 73 LEU L CD1 1 ATOM 541 C CD2 . LEU A 1 73 ? 11.175 6.639 -5.643 1.00 38.37 ? 73 LEU L CD2 1 ATOM 542 N N . THR A 1 74 ? 7.969 6.372 -2.067 1.00 22.44 ? 74 THR L N 1 ATOM 543 C CA . THR A 1 74 ? 7.475 7.510 -1.302 1.00 21.26 ? 74 THR L CA 1 ATOM 544 C C . THR A 1 74 ? 8.611 8.322 -0.697 1.00 20.57 ? 74 THR L C 1 ATOM 545 O O . THR A 1 74 ? 9.562 7.763 -0.169 1.00 26.22 ? 74 THR L O 1 ATOM 546 C CB . THR A 1 74 ? 6.535 7.058 -0.158 1.00 24.80 ? 74 THR L CB 1 ATOM 547 O OG1 . THR A 1 74 ? 5.370 6.432 -0.710 1.00 28.22 ? 74 THR L OG1 1 ATOM 548 C CG2 . THR A 1 74 ? 6.108 8.249 0.703 1.00 20.26 ? 74 THR L CG2 1 ATOM 549 N N . ILE A 1 75 ? 8.508 9.645 -0.786 1.00 18.40 ? 75 ILE L N 1 ATOM 550 C CA . ILE A 1 75 ? 9.384 10.536 -0.038 1.00 16.81 ? 75 ILE L CA 1 ATOM 551 C C . ILE A 1 75 ? 8.527 11.334 0.944 1.00 23.99 ? 75 ILE L C 1 ATOM 552 O O . ILE A 1 75 ? 7.671 12.112 0.533 1.00 22.33 ? 75 ILE L O 1 ATOM 553 C CB . ILE A 1 75 ? 10.163 11.487 -0.968 1.00 18.64 ? 75 ILE L CB 1 ATOM 554 C CG1 . ILE A 1 75 ? 10.962 10.679 -1.994 1.00 16.18 ? 75 ILE L CG1 1 ATOM 555 C CG2 . ILE A 1 75 ? 11.088 12.372 -0.164 1.00 18.84 ? 75 ILE L CG2 1 ATOM 556 C CD1 . ILE A 1 75 ? 11.609 11.518 -3.076 1.00 17.43 ? 75 ILE L CD1 1 ATOM 557 N N . SER A 1 76 ? 8.760 11.139 2.239 1.00 22.31 ? 76 SER L N 1 ATOM 558 C CA . SER A 1 76 ? 7.862 11.664 3.267 1.00 21.19 ? 76 SER L CA 1 ATOM 559 C C . SER A 1 76 ? 7.905 13.187 3.402 1.00 26.09 ? 76 SER L C 1 ATOM 560 O O . SER A 1 76 ? 6.924 13.796 3.828 1.00 22.38 ? 76 SER L O 1 ATOM 561 C CB . SER A 1 76 ? 8.183 11.027 4.620 1.00 20.35 ? 76 SER L CB 1 ATOM 562 O OG . SER A 1 76 ? 9.487 11.382 5.044 1.00 24.08 ? 76 SER L OG 1 ATOM 563 N N . SER A 1 77 ? 9.040 13.789 3.053 1.00 27.22 ? 77 SER L N 1 ATOM 564 C CA . SER A 1 77 ? 9.208 15.243 3.103 1.00 22.93 ? 77 SER L CA 1 ATOM 565 C C . SER A 1 77 ? 10.381 15.648 2.215 1.00 26.07 ? 77 SER L C 1 ATOM 566 O O . SER A 1 77 ? 11.540 15.423 2.562 1.00 29.01 ? 77 SER L O 1 ATOM 567 C CB . SER A 1 77 ? 9.436 15.721 4.541 1.00 20.07 ? 77 SER L CB 1 ATOM 568 O OG . SER A 1 77 ? 9.461 17.138 4.614 1.00 23.35 ? 77 SER L OG 1 ATOM 569 N N . LEU A 1 78 ? 10.075 16.235 1.063 1.00 19.33 ? 78 LEU L N 1 ATOM 570 C CA . LEU A 1 78 ? 11.093 16.513 0.050 1.00 25.86 ? 78 LEU L CA 1 ATOM 571 C C . LEU A 1 78 ? 12.119 17.571 0.455 1.00 25.77 ? 78 LEU L C 1 ATOM 572 O O . LEU A 1 78 ? 11.766 18.610 1.005 1.00 26.46 ? 78 LEU L O 1 ATOM 573 C CB . LEU A 1 78 ? 10.429 16.961 -1.252 1.00 21.81 ? 78 LEU L CB 1 ATOM 574 C CG . LEU A 1 78 ? 9.574 15.949 -2.008 1.00 27.34 ? 78 LEU L CG 1 ATOM 575 C CD1 . LEU A 1 78 ? 8.727 16.677 -3.031 1.00 27.18 ? 78 LEU L CD1 1 ATOM 576 C CD2 . LEU A 1 78 ? 10.452 14.914 -2.682 1.00 20.17 ? 78 LEU L CD2 1 ATOM 577 N N . GLN A 1 79 ? 13.387 17.301 0.159 1.00 20.81 ? 79 GLN L N 1 ATOM 578 C CA . GLN A 1 79 ? 14.433 18.317 0.238 1.00 20.22 ? 79 GLN L CA 1 ATOM 579 C C . GLN A 1 79 ? 14.898 18.628 -1.187 1.00 22.56 ? 79 GLN L C 1 ATOM 580 O O . GLN A 1 79 ? 14.698 17.811 -2.082 1.00 24.99 ? 79 GLN L O 1 ATOM 581 C CB . GLN A 1 79 ? 15.581 17.837 1.127 1.00 15.26 ? 79 GLN L CB 1 ATOM 582 C CG . GLN A 1 79 ? 15.138 17.563 2.557 1.00 18.61 ? 79 GLN L CG 1 ATOM 583 C CD . GLN A 1 79 ? 16.245 17.015 3.432 1.00 26.42 ? 79 GLN L CD 1 ATOM 584 O OE1 . GLN A 1 79 ? 17.425 17.228 3.164 1.00 30.74 ? 79 GLN L OE1 1 ATOM 585 N NE2 . GLN A 1 79 ? 15.867 16.296 4.487 1.00 21.76 ? 79 GLN L NE2 1 ATOM 586 N N . PRO A 1 80 ? 15.485 19.821 -1.412 1.00 24.10 ? 80 PRO L N 1 ATOM 587 C CA . PRO A 1 80 ? 15.848 20.245 -2.773 1.00 21.48 ? 80 PRO L CA 1 ATOM 588 C C . PRO A 1 80 ? 16.644 19.217 -3.564 1.00 23.23 ? 80 PRO L C 1 ATOM 589 O O . PRO A 1 80 ? 16.462 19.116 -4.777 1.00 28.71 ? 80 PRO L O 1 ATOM 590 C CB . PRO A 1 80 ? 16.698 21.493 -2.530 1.00 25.04 ? 80 PRO L CB 1 ATOM 591 C CG . PRO A 1 80 ? 16.166 22.055 -1.264 1.00 23.51 ? 80 PRO L CG 1 ATOM 592 C CD . PRO A 1 80 ? 15.786 20.867 -0.417 1.00 21.75 ? 80 PRO L CD 1 ATOM 593 N N . GLU A 1 81 ? 17.500 18.457 -2.890 1.00 21.96 ? 81 GLU L N 1 ATOM 594 C CA . GLU A 1 81 ? 18.338 17.478 -3.571 1.00 24.43 ? 81 GLU L CA 1 ATOM 595 C C . GLU A 1 81 ? 17.539 16.287 -4.097 1.00 24.31 ? 81 GLU L C 1 ATOM 596 O O . GLU A 1 81 ? 18.032 15.545 -4.940 1.00 23.85 ? 81 GLU L O 1 ATOM 597 C CB . GLU A 1 81 ? 19.448 16.986 -2.639 1.00 31.84 ? 81 GLU L CB 1 ATOM 598 C CG . GLU A 1 81 ? 18.948 16.271 -1.397 1.00 41.36 ? 81 GLU L CG 1 ATOM 599 C CD . GLU A 1 81 ? 20.079 15.801 -0.495 1.00 60.47 ? 81 GLU L CD 1 ATOM 600 O OE1 . GLU A 1 81 ? 21.176 16.398 -0.553 1.00 68.34 ? 81 GLU L OE1 1 ATOM 601 O OE2 . GLU A 1 81 ? 19.873 14.831 0.268 1.00 65.80 ? 81 GLU L OE2 1 ATOM 602 N N . ASP A 1 82 ? 16.307 16.114 -3.620 1.00 22.80 ? 82 ASP L N 1 ATOM 603 C CA . ASP A 1 82 ? 15.485 14.960 -4.008 1.00 18.30 ? 82 ASP L CA 1 ATOM 604 C C . ASP A 1 82 ? 14.816 15.116 -5.373 1.00 21.48 ? 82 ASP L C 1 ATOM 605 O O . ASP A 1 82 ? 14.328 14.147 -5.951 1.00 21.91 ? 82 ASP L O 1 ATOM 606 C CB . ASP A 1 82 ? 14.409 14.697 -2.953 1.00 17.53 ? 82 ASP L CB 1 ATOM 607 C CG . ASP A 1 82 ? 14.996 14.342 -1.596 1.00 28.43 ? 82 ASP L CG 1 ATOM 608 O OD1 . ASP A 1 82 ? 16.117 13.791 -1.549 1.00 25.81 ? 82 ASP L OD1 1 ATOM 609 O OD2 . ASP A 1 82 ? 14.331 14.609 -0.575 1.00 27.16 ? 82 ASP L OD2 1 ATOM 610 N N . PHE A 1 83 ? 14.778 16.338 -5.887 1.00 15.68 ? 83 PHE L N 1 ATOM 611 C CA . PHE A 1 83 ? 14.123 16.568 -7.166 1.00 19.42 ? 83 PHE L CA 1 ATOM 612 C C . PHE A 1 83 ? 14.975 16.022 -8.300 1.00 21.00 ? 83 PHE L C 1 ATOM 613 O O . PHE A 1 83 ? 16.159 16.350 -8.430 1.00 25.12 ? 83 PHE L O 1 ATOM 614 C CB . PHE A 1 83 ? 13.808 18.055 -7.336 1.00 24.71 ? 83 PHE L CB 1 ATOM 615 C CG . PHE A 1 83 ? 12.735 18.523 -6.398 1.00 27.30 ? 83 PHE L CG 1 ATOM 616 C CD1 . PHE A 1 83 ? 11.401 18.413 -6.746 1.00 20.25 ? 83 PHE L CD1 1 ATOM 617 C CD2 . PHE A 1 83 ? 13.054 18.995 -5.137 1.00 31.12 ? 83 PHE L CD2 1 ATOM 618 C CE1 . PHE A 1 83 ? 10.406 18.808 -5.867 1.00 29.06 ? 83 PHE L CE1 1 ATOM 619 C CE2 . PHE A 1 83 ? 12.062 19.396 -4.254 1.00 30.54 ? 83 PHE L CE2 1 ATOM 620 C CZ . PHE A 1 83 ? 10.740 19.301 -4.617 1.00 24.10 ? 83 PHE L CZ 1 ATOM 621 N N . ALA A 1 84 ? 14.358 15.160 -9.101 1.00 19.19 ? 84 ALA L N 1 ATOM 622 C CA . ALA A 1 84 ? 15.081 14.335 -10.063 1.00 21.46 ? 84 ALA L CA 1 ATOM 623 C C . ALA A 1 84 ? 14.102 13.476 -10.840 1.00 19.55 ? 84 ALA L C 1 ATOM 624 O O . ALA A 1 84 ? 12.899 13.534 -10.599 1.00 23.39 ? 84 ALA L O 1 ATOM 625 C CB . ALA A 1 84 ? 16.100 13.448 -9.348 1.00 19.10 ? 84 ALA L CB 1 ATOM 626 N N . THR A 1 85 ? 14.618 12.664 -11.757 1.00 19.72 ? 85 THR L N 1 ATOM 627 C CA . THR A 1 85 ? 13.789 11.659 -12.418 1.00 23.25 ? 85 THR L CA 1 ATOM 628 C C . THR A 1 85 ? 13.999 10.299 -11.761 1.00 19.59 ? 85 THR L C 1 ATOM 629 O O . THR A 1 85 ? 15.133 9.866 -11.560 1.00 21.88 ? 85 THR L O 1 ATOM 630 C CB . THR A 1 85 ? 14.095 11.557 -13.918 1.00 22.09 ? 85 THR L CB 1 ATOM 631 O OG1 . THR A 1 85 ? 13.809 12.813 -14.543 1.00 21.48 ? 85 THR L OG1 1 ATOM 632 C CG2 . THR A 1 85 ? 13.235 10.478 -14.565 1.00 15.97 ? 85 THR L CG2 1 ATOM 633 N N . TYR A 1 86 ? 12.900 9.637 -11.417 1.00 25.01 ? 86 TYR L N 1 ATOM 634 C CA . TYR A 1 86 ? 12.962 8.333 -10.774 1.00 18.36 ? 86 TYR L CA 1 ATOM 635 C C . TYR A 1 86 ? 12.522 7.225 -11.717 1.00 19.42 ? 86 TYR L C 1 ATOM 636 O O . TYR A 1 86 ? 11.485 7.331 -12.364 1.00 24.91 ? 86 TYR L O 1 ATOM 637 C CB . TYR A 1 86 ? 12.111 8.333 -9.501 1.00 12.96 ? 86 TYR L CB 1 ATOM 638 C CG . TYR A 1 86 ? 12.720 9.192 -8.412 1.00 21.26 ? 86 TYR L CG 1 ATOM 639 C CD1 . TYR A 1 86 ? 12.502 10.564 -8.383 1.00 18.51 ? 86 TYR L CD1 1 ATOM 640 C CD2 . TYR A 1 86 ? 13.545 8.635 -7.437 1.00 18.00 ? 86 TYR L CD2 1 ATOM 641 C CE1 . TYR A 1 86 ? 13.072 11.361 -7.404 1.00 23.23 ? 86 TYR L CE1 1 ATOM 642 C CE2 . TYR A 1 86 ? 14.116 9.418 -6.452 1.00 18.54 ? 86 TYR L CE2 1 ATOM 643 C CZ . TYR A 1 86 ? 13.879 10.784 -6.443 1.00 29.04 ? 86 TYR L CZ 1 ATOM 644 O OH . TYR A 1 86 ? 14.444 11.577 -5.474 1.00 24.11 ? 86 TYR L OH 1 ATOM 645 N N . TYR A 1 87 ? 13.335 6.174 -11.801 1.00 20.28 ? 87 TYR L N 1 ATOM 646 C CA . TYR A 1 87 ? 13.024 4.995 -12.612 1.00 20.24 ? 87 TYR L CA 1 ATOM 647 C C . TYR A 1 87 ? 12.813 3.766 -11.756 1.00 20.60 ? 87 TYR L C 1 ATOM 648 O O . TYR A 1 87 ? 13.572 3.519 -10.819 1.00 21.82 ? 87 TYR L O 1 ATOM 649 C CB . TYR A 1 87 ? 14.148 4.684 -13.606 1.00 17.80 ? 87 TYR L CB 1 ATOM 650 C CG . TYR A 1 87 ? 14.324 5.694 -14.706 1.00 21.21 ? 87 TYR L CG 1 ATOM 651 C CD1 . TYR A 1 87 ? 13.577 5.611 -15.874 1.00 21.57 ? 87 TYR L CD1 1 ATOM 652 C CD2 . TYR A 1 87 ? 15.255 6.722 -14.586 1.00 18.06 ? 87 TYR L CD2 1 ATOM 653 C CE1 . TYR A 1 87 ? 13.736 6.530 -16.883 1.00 25.31 ? 87 TYR L CE1 1 ATOM 654 C CE2 . TYR A 1 87 ? 15.426 7.646 -15.592 1.00 17.44 ? 87 TYR L CE2 1 ATOM 655 C CZ . TYR A 1 87 ? 14.663 7.547 -16.738 1.00 25.86 ? 87 TYR L CZ 1 ATOM 656 O OH . TYR A 1 87 ? 14.832 8.468 -17.743 1.00 31.84 ? 87 TYR L OH 1 ATOM 657 N N . CYS A 1 88 ? 11.803 2.973 -12.090 1.00 21.40 ? 88 CYS L N 1 ATOM 658 C CA . CYS A 1 88 ? 11.707 1.638 -11.522 1.00 19.29 ? 88 CYS L CA 1 ATOM 659 C C . CYS A 1 88 ? 12.316 0.649 -12.513 1.00 19.43 ? 88 CYS L C 1 ATOM 660 O O . CYS A 1 88 ? 12.412 0.947 -13.705 1.00 18.99 ? 88 CYS L O 1 ATOM 661 C CB . CYS A 1 88 ? 10.256 1.275 -11.189 1.00 20.56 ? 88 CYS L CB 1 ATOM 662 S SG . CYS A 1 88 ? 9.105 1.287 -12.578 1.00 30.23 ? 88 CYS L SG 1 ATOM 663 N N . GLN A 1 89 ? 12.744 -0.512 -12.015 1.00 17.93 ? 89 GLN L N 1 ATOM 664 C CA . GLN A 1 89 ? 13.395 -1.522 -12.847 1.00 19.11 ? 89 GLN L CA 1 ATOM 665 C C . GLN A 1 89 ? 13.048 -2.940 -12.414 1.00 23.22 ? 89 GLN L C 1 ATOM 666 O O . GLN A 1 89 ? 13.146 -3.279 -11.234 1.00 25.26 ? 89 GLN L O 1 ATOM 667 C CB . GLN A 1 89 ? 14.921 -1.361 -12.821 1.00 14.57 ? 89 GLN L CB 1 ATOM 668 C CG . GLN A 1 89 ? 15.641 -2.323 -13.778 1.00 20.11 ? 89 GLN L CG 1 ATOM 669 C CD . GLN A 1 89 ? 16.907 -2.944 -13.194 1.00 28.24 ? 89 GLN L CD 1 ATOM 670 O OE1 . GLN A 1 89 ? 17.658 -2.294 -12.468 1.00 28.91 ? 89 GLN L OE1 1 ATOM 671 N NE2 . GLN A 1 89 ? 17.146 -4.217 -13.517 1.00 23.02 ? 89 GLN L NE2 1 ATOM 672 N N . HIS A 1 90 ? 12.651 -3.761 -13.380 1.00 21.14 ? 90 HIS L N 1 ATOM 673 C CA . HIS A 1 90 ? 12.478 -5.197 -13.176 1.00 17.05 ? 90 HIS L CA 1 ATOM 674 C C . HIS A 1 90 ? 13.858 -5.846 -13.068 1.00 23.97 ? 90 HIS L C 1 ATOM 675 O O . HIS A 1 90 ? 14.694 -5.683 -13.957 1.00 21.16 ? 90 HIS L O 1 ATOM 676 C CB . HIS A 1 90 ? 11.669 -5.795 -14.330 1.00 18.18 ? 90 HIS L CB 1 ATOM 677 C CG . HIS A 1 90 ? 11.335 -7.244 -14.160 1.00 19.66 ? 90 HIS L CG 1 ATOM 678 N ND1 . HIS A 1 90 ? 11.051 -8.066 -15.227 1.00 24.25 ? 90 HIS L ND1 1 ATOM 679 C CD2 . HIS A 1 90 ? 11.229 -8.014 -13.049 1.00 21.54 ? 90 HIS L CD2 1 ATOM 680 C CE1 . HIS A 1 90 ? 10.793 -9.286 -14.784 1.00 23.38 ? 90 HIS L CE1 1 ATOM 681 N NE2 . HIS A 1 90 ? 10.893 -9.280 -13.467 1.00 24.03 ? 90 HIS L NE2 1 ATOM 682 N N . LEU A 1 91 ? 14.101 -6.574 -11.982 1.00 23.54 ? 91 LEU L N 1 ATOM 683 C CA . LEU A 1 91 ? 15.457 -7.010 -11.655 1.00 22.84 ? 91 LEU L CA 1 ATOM 684 C C . LEU A 1 91 ? 15.906 -8.288 -12.367 1.00 30.20 ? 91 LEU L C 1 ATOM 685 O O . LEU A 1 91 ? 17.094 -8.618 -12.369 1.00 26.35 ? 91 LEU L O 1 ATOM 686 C CB . LEU A 1 91 ? 15.582 -7.189 -10.142 1.00 23.80 ? 91 LEU L CB 1 ATOM 687 C CG . LEU A 1 91 ? 15.493 -5.860 -9.395 1.00 22.56 ? 91 LEU L CG 1 ATOM 688 C CD1 . LEU A 1 91 ? 15.639 -6.045 -7.893 1.00 21.81 ? 91 LEU L CD1 1 ATOM 689 C CD2 . LEU A 1 91 ? 16.552 -4.911 -9.931 1.00 13.47 ? 91 LEU L CD2 1 ATOM 690 N N . ILE A 1 92 ? 14.965 -9.008 -12.965 1.00 26.68 ? 92 ILE L N 1 ATOM 691 C CA . ILE A 1 92 ? 15.305 -10.191 -13.748 1.00 28.12 ? 92 ILE L CA 1 ATOM 692 C C . ILE A 1 92 ? 14.608 -10.138 -15.108 1.00 31.50 ? 92 ILE L C 1 ATOM 693 O O . ILE A 1 92 ? 14.035 -9.113 -15.470 1.00 32.88 ? 92 ILE L O 1 ATOM 694 C CB . ILE A 1 92 ? 14.921 -11.491 -13.013 1.00 27.55 ? 92 ILE L CB 1 ATOM 695 C CG1 . ILE A 1 92 ? 13.423 -11.512 -12.703 1.00 25.48 ? 92 ILE L CG1 1 ATOM 696 C CG2 . ILE A 1 92 ? 15.728 -11.640 -11.724 1.00 25.74 ? 92 ILE L CG2 1 ATOM 697 C CD1 . ILE A 1 92 ? 12.958 -12.816 -12.087 1.00 31.24 ? 92 ILE L CD1 1 ATOM 698 N N . GLY A 1 93 ? 14.661 -11.234 -15.860 1.00 31.99 ? 93 GLY L N 1 ATOM 699 C CA . GLY A 1 93 ? 14.035 -11.281 -17.172 1.00 28.58 ? 93 GLY L CA 1 ATOM 700 C C . GLY A 1 93 ? 14.732 -10.381 -18.173 1.00 25.78 ? 93 GLY L C 1 ATOM 701 O O . GLY A 1 93 ? 15.944 -10.468 -18.351 1.00 25.89 ? 93 GLY L O 1 ATOM 702 N N . LEU A 1 94 ? 13.969 -9.510 -18.826 1.00 30.29 ? 94 LEU L N 1 ATOM 703 C CA . LEU A 1 94 ? 14.540 -8.544 -19.766 1.00 32.37 ? 94 LEU L CA 1 ATOM 704 C C . LEU A 1 94 ? 15.117 -7.315 -19.071 1.00 27.68 ? 94 LEU L C 1 ATOM 705 O O . LEU A 1 94 ? 15.625 -6.412 -19.735 1.00 29.68 ? 94 LEU L O 1 ATOM 706 C CB . LEU A 1 94 ? 13.492 -8.095 -20.785 1.00 33.57 ? 94 LEU L CB 1 ATOM 707 C CG . LEU A 1 94 ? 13.104 -9.123 -21.845 1.00 50.79 ? 94 LEU L CG 1 ATOM 708 C CD1 . LEU A 1 94 ? 12.241 -8.478 -22.916 1.00 56.99 ? 94 LEU L CD1 1 ATOM 709 C CD2 . LEU A 1 94 ? 14.346 -9.745 -22.452 1.00 54.63 ? 94 LEU L CD2 1 ATOM 710 N N . ARG A 1 95 ? 15.029 -7.284 -17.743 1.00 27.07 ? 96 ARG L N 1 ATOM 711 C CA . ARG A 1 95 ? 15.530 -6.159 -16.950 1.00 23.92 ? 96 ARG L CA 1 ATOM 712 C C . ARG A 1 95 ? 15.000 -4.811 -17.446 1.00 21.25 ? 96 ARG L C 1 ATOM 713 O O . ARG A 1 95 ? 15.752 -3.841 -17.542 1.00 25.05 ? 96 ARG L O 1 ATOM 714 C CB . ARG A 1 95 ? 17.065 -6.130 -16.955 1.00 24.41 ? 96 ARG L CB 1 ATOM 715 C CG . ARG A 1 95 ? 17.757 -7.121 -16.016 1.00 27.53 ? 96 ARG L CG 1 ATOM 716 C CD . ARG A 1 95 ? 17.812 -8.521 -16.595 1.00 28.79 ? 96 ARG L CD 1 ATOM 717 N NE . ARG A 1 95 ? 18.883 -9.316 -15.998 1.00 32.50 ? 96 ARG L NE 1 ATOM 718 C CZ . ARG A 1 95 ? 19.057 -10.620 -16.202 1.00 39.27 ? 96 ARG L CZ 1 ATOM 719 N NH1 . ARG A 1 95 ? 18.221 -11.295 -16.984 1.00 34.65 ? 96 ARG L NH1 1 ATOM 720 N NH2 . ARG A 1 95 ? 20.067 -11.254 -15.619 1.00 38.02 ? 96 ARG L NH2 1 ATOM 721 N N . SER A 1 96 ? 13.713 -4.742 -17.766 1.00 22.58 ? 97 SER L N 1 ATOM 722 C CA . SER A 1 96 ? 13.171 -3.521 -18.351 1.00 22.36 ? 97 SER L CA 1 ATOM 723 C C . SER A 1 96 ? 12.929 -2.448 -17.284 1.00 22.37 ? 97 SER L C 1 ATOM 724 O O . SER A 1 96 ? 12.634 -2.758 -16.125 1.00 17.93 ? 97 SER L O 1 ATOM 725 C CB . SER A 1 96 ? 11.880 -3.826 -19.123 1.00 25.99 ? 97 SER L CB 1 ATOM 726 O OG . SER A 1 96 ? 10.811 -4.124 -18.244 1.00 31.26 ? 97 SER L OG 1 ATOM 727 N N . PHE A 1 97 ? 13.085 -1.186 -17.678 1.00 18.85 ? 98 PHE L N 1 ATOM 728 C CA . PHE A 1 97 ? 12.816 -0.057 -16.793 1.00 21.02 ? 98 PHE L CA 1 ATOM 729 C C . PHE A 1 97 ? 11.463 0.563 -17.114 1.00 25.72 ? 98 PHE L C 1 ATOM 730 O O . PHE A 1 97 ? 10.945 0.397 -18.220 1.00 21.88 ? 98 PHE L O 1 ATOM 731 C CB . PHE A 1 97 ? 13.890 1.028 -16.923 1.00 20.19 ? 98 PHE L CB 1 ATOM 732 C CG . PHE A 1 97 ? 15.276 0.591 -16.530 1.00 25.56 ? 98 PHE L CG 1 ATOM 733 C CD1 . PHE A 1 97 ? 16.020 -0.232 -17.356 1.00 25.00 ? 98 PHE L CD1 1 ATOM 734 C CD2 . PHE A 1 97 ? 15.856 1.057 -15.357 1.00 22.13 ? 98 PHE L CD2 1 ATOM 735 C CE1 . PHE A 1 97 ? 17.307 -0.610 -17.008 1.00 25.54 ? 98 PHE L CE1 1 ATOM 736 C CE2 . PHE A 1 97 ? 17.145 0.684 -15.004 1.00 21.30 ? 98 PHE L CE2 1 ATOM 737 C CZ . PHE A 1 97 ? 17.868 -0.151 -15.830 1.00 21.51 ? 98 PHE L CZ 1 ATOM 738 N N . GLY A 1 98 ? 10.907 1.301 -16.155 1.00 23.94 ? 99 GLY L N 1 ATOM 739 C CA . GLY A 1 98 ? 9.751 2.138 -16.424 1.00 21.32 ? 99 GLY L CA 1 ATOM 740 C C . GLY A 1 98 ? 10.197 3.325 -17.260 1.00 27.58 ? 99 GLY L C 1 ATOM 741 O O . GLY A 1 98 ? 11.396 3.501 -17.500 1.00 25.48 ? 99 GLY L O 1 ATOM 742 N N . GLN A 1 99 ? 9.251 4.147 -17.704 1.00 17.19 ? 100 GLN L N 1 ATOM 743 C CA . GLN A 1 99 ? 9.593 5.278 -18.565 1.00 28.32 ? 100 GLN L CA 1 ATOM 744 C C . GLN A 1 99 ? 10.076 6.481 -17.762 1.00 26.10 ? 100 GLN L C 1 ATOM 745 O O . GLN A 1 99 ? 10.506 7.479 -18.329 1.00 27.37 ? 100 GLN L O 1 ATOM 746 C CB . GLN A 1 99 ? 8.398 5.680 -19.438 1.00 23.21 ? 100 GLN L CB 1 ATOM 747 C CG . GLN A 1 99 ? 7.401 6.598 -18.757 1.00 32.11 ? 100 GLN L CG 1 ATOM 748 C CD . GLN A 1 99 ? 6.568 5.896 -17.699 1.00 49.93 ? 100 GLN L CD 1 ATOM 749 O OE1 . GLN A 1 99 ? 6.614 4.669 -17.555 1.00 51.01 ? 100 GLN L OE1 1 ATOM 750 N NE2 . GLN A 1 99 ? 5.794 6.677 -16.952 1.00 50.88 ? 100 GLN L NE2 1 ATOM 751 N N . GLY A 1 100 ? 10.002 6.387 -16.439 1.00 25.52 ? 101 GLY L N 1 ATOM 752 C CA . GLY A 1 100 ? 10.506 7.444 -15.585 1.00 15.27 ? 101 GLY L CA 1 ATOM 753 C C . GLY A 1 100 ? 9.457 8.433 -15.113 1.00 26.06 ? 101 GLY L C 1 ATOM 754 O O . GLY A 1 100 ? 8.496 8.738 -15.821 1.00 24.36 ? 101 GLY L O 1 ATOM 755 N N . THR A 1 101 ? 9.642 8.926 -13.895 1.00 23.63 ? 102 THR L N 1 ATOM 756 C CA . THR A 1 101 ? 8.800 9.980 -13.358 1.00 26.15 ? 102 THR L CA 1 ATOM 757 C C . THR A 1 101 ? 9.660 11.167 -12.967 1.00 23.86 ? 102 THR L C 1 ATOM 758 O O . THR A 1 101 ? 10.509 11.052 -12.084 1.00 21.58 ? 102 THR L O 1 ATOM 759 C CB . THR A 1 101 ? 8.005 9.512 -12.133 1.00 22.79 ? 102 THR L CB 1 ATOM 760 O OG1 . THR A 1 101 ? 7.074 8.498 -12.526 1.00 29.00 ? 102 THR L OG1 1 ATOM 761 C CG2 . THR A 1 101 ? 7.253 10.689 -11.512 1.00 16.52 ? 102 THR L CG2 1 ATOM 762 N N . LYS A 1 102 ? 9.446 12.301 -13.628 1.00 20.95 ? 103 LYS L N 1 ATOM 763 C CA . LYS A 1 102 ? 10.202 13.501 -13.314 1.00 25.82 ? 103 LYS L CA 1 ATOM 764 C C . LYS A 1 102 ? 9.527 14.273 -12.196 1.00 27.90 ? 103 LYS L C 1 ATOM 765 O O . LYS A 1 102 ? 8.362 14.653 -12.294 1.00 32.51 ? 103 LYS L O 1 ATOM 766 C CB . LYS A 1 102 ? 10.362 14.389 -14.548 1.00 32.68 ? 103 LYS L CB 1 ATOM 767 C CG . LYS A 1 102 ? 11.470 15.425 -14.419 1.00 39.15 ? 103 LYS L CG 1 ATOM 768 C CD . LYS A 1 102 ? 11.767 16.065 -15.766 1.00 47.88 ? 103 LYS L CD 1 ATOM 769 C CE . LYS A 1 102 ? 12.997 16.951 -15.705 1.00 53.26 ? 103 LYS L CE 1 ATOM 770 N NZ . LYS A 1 102 ? 12.847 18.025 -14.686 1.00 60.09 ? 103 LYS L NZ 1 ATOM 771 N N . LEU A 1 103 ? 10.274 14.493 -11.129 1.00 24.53 ? 104 LEU L N 1 ATOM 772 C CA . LEU A 1 103 ? 9.779 15.209 -9.970 1.00 21.56 ? 104 LEU L CA 1 ATOM 773 C C . LEU A 1 103 ? 10.312 16.642 -9.973 1.00 27.83 ? 104 LEU L C 1 ATOM 774 O O . LEU A 1 103 ? 11.502 16.859 -9.773 1.00 31.95 ? 104 LEU L O 1 ATOM 775 C CB . LEU A 1 103 ? 10.191 14.454 -8.707 1.00 22.93 ? 104 LEU L CB 1 ATOM 776 C CG . LEU A 1 103 ? 9.972 15.065 -7.334 1.00 35.10 ? 104 LEU L CG 1 ATOM 777 C CD1 . LEU A 1 103 ? 8.521 15.467 -7.160 1.00 41.57 ? 104 LEU L CD1 1 ATOM 778 C CD2 . LEU A 1 103 ? 10.387 14.048 -6.283 1.00 30.41 ? 104 LEU L CD2 1 ATOM 779 N N . GLU A 1 104 ? 9.435 17.615 -10.223 1.00 28.27 ? 105 GLU L N 1 ATOM 780 C CA . GLU A 1 104 ? 9.852 19.014 -10.349 1.00 23.34 ? 105 GLU L CA 1 ATOM 781 C C . GLU A 1 104 ? 9.366 19.873 -9.180 1.00 25.93 ? 105 GLU L C 1 ATOM 782 O O . GLU A 1 104 ? 8.392 19.530 -8.512 1.00 26.44 ? 105 GLU L O 1 ATOM 783 C CB . GLU A 1 104 ? 9.345 19.611 -11.666 1.00 32.13 ? 105 GLU L CB 1 ATOM 784 C CG . GLU A 1 104 ? 7.858 19.949 -11.655 1.00 48.52 ? 105 GLU L CG 1 ATOM 785 C CD . GLU A 1 104 ? 7.551 21.410 -12.000 1.00 49.40 ? 105 GLU L CD 1 ATOM 786 O OE1 . GLU A 1 104 ? 8.079 21.934 -13.007 1.00 44.66 ? 105 GLU L OE1 1 ATOM 787 O OE2 . GLU A 1 104 ? 6.768 22.039 -11.257 1.00 47.62 ? 105 GLU L OE2 1 ATOM 788 N N . ILE A 1 105 ? 10.040 21.000 -8.950 1.00 27.54 ? 106 ILE L N 1 ATOM 789 C CA . ILE A 1 105 ? 9.717 21.875 -7.824 1.00 22.30 ? 106 ILE L CA 1 ATOM 790 C C . ILE A 1 105 ? 8.537 22.799 -8.112 1.00 26.12 ? 106 ILE L C 1 ATOM 791 O O . ILE A 1 105 ? 8.544 23.543 -9.091 1.00 24.27 ? 106 ILE L O 1 ATOM 792 C CB . ILE A 1 105 ? 10.918 22.748 -7.429 1.00 31.11 ? 106 ILE L CB 1 ATOM 793 C CG1 . ILE A 1 105 ? 12.132 21.877 -7.122 1.00 31.13 ? 106 ILE L CG1 1 ATOM 794 C CG2 . ILE A 1 105 ? 10.576 23.607 -6.221 1.00 24.22 ? 106 ILE L CG2 1 ATOM 795 C CD1 . ILE A 1 105 ? 13.373 22.667 -6.822 1.00 39.03 ? 106 ILE L CD1 1 ATOM 796 N N . LYS A 1 106 ? 7.531 22.751 -7.245 1.00 21.89 ? 107 LYS L N 1 ATOM 797 C CA . LYS A 1 106 ? 6.365 23.613 -7.369 1.00 26.81 ? 107 LYS L CA 1 ATOM 798 C C . LYS A 1 106 ? 6.652 24.999 -6.797 1.00 33.50 ? 107 LYS L C 1 ATOM 799 O O . LYS A 1 106 ? 7.341 25.135 -5.788 1.00 32.93 ? 107 LYS L O 1 ATOM 800 C CB . LYS A 1 106 ? 5.159 22.988 -6.662 1.00 30.68 ? 107 LYS L CB 1 ATOM 801 C CG . LYS A 1 106 ? 3.843 23.722 -6.900 1.00 39.43 ? 107 LYS L CG 1 ATOM 802 C CD . LYS A 1 106 ? 2.742 23.212 -5.981 1.00 50.13 ? 107 LYS L CD 1 ATOM 803 C CE . LYS A 1 106 ? 1.969 22.059 -6.601 1.00 57.01 ? 107 LYS L CE 1 ATOM 804 N NZ . LYS A 1 106 ? 1.139 22.515 -7.752 1.00 60.04 ? 107 LYS L NZ 1 ATOM 805 N N . ARG A 1 107 ? 6.130 26.026 -7.459 1.00 23.25 ? 108 ARG L N 1 ATOM 806 C CA . ARG A 1 107 ? 6.201 27.393 -6.953 1.00 21.58 ? 108 ARG L CA 1 ATOM 807 C C . ARG A 1 107 ? 5.041 28.178 -7.560 1.00 24.14 ? 108 ARG L C 1 ATOM 808 O O . ARG A 1 107 ? 4.242 27.609 -8.310 1.00 24.00 ? 108 ARG L O 1 ATOM 809 C CB . ARG A 1 107 ? 7.558 28.039 -7.268 1.00 17.30 ? 108 ARG L CB 1 ATOM 810 C CG . ARG A 1 107 ? 7.952 28.038 -8.742 1.00 23.27 ? 108 ARG L CG 1 ATOM 811 C CD . ARG A 1 107 ? 7.710 29.395 -9.375 1.00 33.19 ? 108 ARG L CD 1 ATOM 812 N NE . ARG A 1 107 ? 8.850 30.292 -9.244 1.00 38.57 ? 108 ARG L NE 1 ATOM 813 C CZ . ARG A 1 107 ? 8.763 31.617 -9.199 1.00 26.12 ? 108 ARG L CZ 1 ATOM 814 N NH1 . ARG A 1 107 ? 7.581 32.221 -9.249 1.00 23.09 ? 108 ARG L NH1 1 ATOM 815 N NH2 . ARG A 1 107 ? 9.867 32.336 -9.090 1.00 33.56 ? 108 ARG L NH2 1 ATOM 816 N N . THR A 1 108 ? 4.928 29.463 -7.222 1.00 24.41 ? 109 THR L N 1 ATOM 817 C CA . THR A 1 108 ? 3.804 30.270 -7.688 1.00 20.64 ? 109 THR L CA 1 ATOM 818 C C . THR A 1 108 ? 3.858 30.471 -9.192 1.00 18.35 ? 109 THR L C 1 ATOM 819 O O . THR A 1 108 ? 4.932 30.455 -9.784 1.00 17.22 ? 109 THR L O 1 ATOM 820 C CB . THR A 1 108 ? 3.764 31.661 -7.016 1.00 31.23 ? 109 THR L CB 1 ATOM 821 O OG1 . THR A 1 108 ? 5.052 32.285 -7.111 1.00 34.91 ? 109 THR L OG1 1 ATOM 822 C CG2 . THR A 1 108 ? 3.362 31.541 -5.563 1.00 36.06 ? 109 THR L CG2 1 ATOM 823 N N . VAL A 1 109 ? 2.697 30.674 -9.804 1.00 17.67 ? 110 VAL L N 1 ATOM 824 C CA . VAL A 1 109 ? 2.632 30.959 -11.226 1.00 20.61 ? 110 VAL L CA 1 ATOM 825 C C . VAL A 1 109 ? 3.383 32.258 -11.508 1.00 30.85 ? 110 VAL L C 1 ATOM 826 O O . VAL A 1 109 ? 3.245 33.233 -10.771 1.00 32.41 ? 110 VAL L O 1 ATOM 827 C CB . VAL A 1 109 ? 1.170 31.056 -11.711 1.00 26.27 ? 110 VAL L CB 1 ATOM 828 C CG1 . VAL A 1 109 ? 1.091 31.682 -13.092 1.00 20.27 ? 110 VAL L CG1 1 ATOM 829 C CG2 . VAL A 1 109 ? 0.521 29.673 -11.713 1.00 35.25 ? 110 VAL L CG2 1 ATOM 830 N N . ALA A 1 110 ? 4.203 32.247 -12.554 1.00 30.47 ? 111 ALA L N 1 ATOM 831 C CA . ALA A 1 110 ? 4.971 33.420 -12.954 1.00 26.51 ? 111 ALA L CA 1 ATOM 832 C C . ALA A 1 110 ? 4.890 33.603 -14.460 1.00 23.21 ? 111 ALA L C 1 ATOM 833 O O . ALA A 1 110 ? 5.257 32.710 -15.218 1.00 20.97 ? 111 ALA L O 1 ATOM 834 C CB . ALA A 1 110 ? 6.426 33.293 -12.511 1.00 21.24 ? 111 ALA L CB 1 ATOM 835 N N . ALA A 1 111 ? 4.413 34.768 -14.887 1.00 24.95 ? 112 ALA L N 1 ATOM 836 C CA . ALA A 1 111 ? 4.261 35.059 -16.305 1.00 26.48 ? 112 ALA L CA 1 ATOM 837 C C . ALA A 1 111 ? 5.617 35.224 -16.985 1.00 25.95 ? 112 ALA L C 1 ATOM 838 O O . ALA A 1 111 ? 6.561 35.735 -16.389 1.00 28.54 ? 112 ALA L O 1 ATOM 839 C CB . ALA A 1 111 ? 3.412 36.315 -16.499 1.00 21.31 ? 112 ALA L CB 1 ATOM 840 N N . PRO A 1 112 ? 5.720 34.790 -18.246 1.00 27.08 ? 113 PRO L N 1 ATOM 841 C CA . PRO A 1 112 ? 6.971 34.984 -18.981 1.00 22.71 ? 113 PRO L CA 1 ATOM 842 C C . PRO A 1 112 ? 7.152 36.417 -19.450 1.00 28.47 ? 113 PRO L C 1 ATOM 843 O O . PRO A 1 112 ? 6.171 37.086 -19.773 1.00 21.54 ? 113 PRO L O 1 ATOM 844 C CB . PRO A 1 112 ? 6.817 34.052 -20.182 1.00 22.06 ? 113 PRO L CB 1 ATOM 845 C CG . PRO A 1 112 ? 5.343 34.008 -20.415 1.00 26.72 ? 113 PRO L CG 1 ATOM 846 C CD . PRO A 1 112 ? 4.719 34.057 -19.040 1.00 21.65 ? 113 PRO L CD 1 ATOM 847 N N . SER A 1 113 ? 8.398 36.875 -19.469 1.00 26.82 ? 114 SER L N 1 ATOM 848 C CA . SER A 1 113 ? 8.757 38.073 -20.210 1.00 30.36 ? 114 SER L CA 1 ATOM 849 C C . SER A 1 113 ? 9.079 37.636 -21.630 1.00 26.49 ? 114 SER L C 1 ATOM 850 O O . SER A 1 113 ? 9.866 36.710 -21.828 1.00 30.25 ? 114 SER L O 1 ATOM 851 C CB . SER A 1 113 ? 9.951 38.782 -19.572 1.00 34.72 ? 114 SER L CB 1 ATOM 852 O OG . SER A 1 113 ? 9.741 38.974 -18.185 1.00 45.19 ? 114 SER L OG 1 ATOM 853 N N . VAL A 1 114 ? 8.467 38.284 -22.616 1.00 25.50 ? 115 VAL L N 1 ATOM 854 C CA . VAL A 1 114 ? 8.594 37.842 -24.001 1.00 19.86 ? 115 VAL L CA 1 ATOM 855 C C . VAL A 1 114 ? 9.418 38.811 -24.842 1.00 27.31 ? 115 VAL L C 1 ATOM 856 O O . VAL A 1 114 ? 9.171 40.014 -24.841 1.00 30.68 ? 115 VAL L O 1 ATOM 857 C CB . VAL A 1 114 ? 7.213 37.658 -24.651 1.00 23.31 ? 115 VAL L CB 1 ATOM 858 C CG1 . VAL A 1 114 ? 7.362 37.102 -26.062 1.00 16.22 ? 115 VAL L CG1 1 ATOM 859 C CG2 . VAL A 1 114 ? 6.352 36.733 -23.803 1.00 19.87 ? 115 VAL L CG2 1 ATOM 860 N N . PHE A 1 115 ? 10.399 38.277 -25.562 1.00 28.42 ? 116 PHE L N 1 ATOM 861 C CA . PHE A 1 115 ? 11.243 39.091 -26.431 1.00 25.77 ? 116 PHE L CA 1 ATOM 862 C C . PHE A 1 115 ? 11.341 38.471 -27.821 1.00 27.89 ? 116 PHE L C 1 ATOM 863 O O . PHE A 1 115 ? 11.426 37.251 -27.958 1.00 22.86 ? 116 PHE L O 1 ATOM 864 C CB . PHE A 1 115 ? 12.641 39.249 -25.832 1.00 24.21 ? 116 PHE L CB 1 ATOM 865 C CG . PHE A 1 115 ? 12.641 39.723 -24.407 1.00 26.98 ? 116 PHE L CG 1 ATOM 866 C CD1 . PHE A 1 115 ? 12.523 38.819 -23.363 1.00 25.91 ? 116 PHE L CD1 1 ATOM 867 C CD2 . PHE A 1 115 ? 12.766 41.068 -24.110 1.00 27.01 ? 116 PHE L CD2 1 ATOM 868 C CE1 . PHE A 1 115 ? 12.523 39.248 -22.050 1.00 29.77 ? 116 PHE L CE1 1 ATOM 869 C CE2 . PHE A 1 115 ? 12.769 41.501 -22.794 1.00 29.14 ? 116 PHE L CE2 1 ATOM 870 C CZ . PHE A 1 115 ? 12.646 40.591 -21.767 1.00 27.88 ? 116 PHE L CZ 1 ATOM 871 N N . ILE A 1 116 ? 11.322 39.307 -28.852 1.00 27.03 ? 117 ILE L N 1 ATOM 872 C CA . ILE A 1 116 ? 11.521 38.811 -30.205 1.00 22.89 ? 117 ILE L CA 1 ATOM 873 C C . ILE A 1 116 ? 12.797 39.417 -30.793 1.00 26.65 ? 117 ILE L C 1 ATOM 874 O O . ILE A 1 116 ? 13.149 40.558 -30.497 1.00 29.31 ? 117 ILE L O 1 ATOM 875 C CB . ILE A 1 116 ? 10.293 39.106 -31.107 1.00 22.95 ? 117 ILE L CB 1 ATOM 876 C CG1 . ILE A 1 116 ? 10.365 38.289 -32.404 1.00 25.23 ? 117 ILE L CG1 1 ATOM 877 C CG2 . ILE A 1 116 ? 10.135 40.612 -31.366 1.00 20.17 ? 117 ILE L CG2 1 ATOM 878 C CD1 . ILE A 1 116 ? 9.087 38.333 -33.247 1.00 26.15 ? 117 ILE L CD1 1 ATOM 879 N N . PHE A 1 117 ? 13.510 38.628 -31.590 1.00 25.69 ? 118 PHE L N 1 ATOM 880 C CA . PHE A 1 117 ? 14.752 39.074 -32.214 1.00 21.06 ? 118 PHE L CA 1 ATOM 881 C C . PHE A 1 117 ? 14.719 38.846 -33.714 1.00 23.90 ? 118 PHE L C 1 ATOM 882 O O . PHE A 1 117 ? 14.593 37.710 -34.164 1.00 22.34 ? 118 PHE L O 1 ATOM 883 C CB . PHE A 1 117 ? 15.960 38.336 -31.636 1.00 15.21 ? 118 PHE L CB 1 ATOM 884 C CG . PHE A 1 117 ? 16.164 38.550 -30.167 1.00 26.06 ? 118 PHE L CG 1 ATOM 885 C CD1 . PHE A 1 117 ? 16.857 39.663 -29.702 1.00 20.98 ? 118 PHE L CD1 1 ATOM 886 C CD2 . PHE A 1 117 ? 15.682 37.632 -29.248 1.00 19.96 ? 118 PHE L CD2 1 ATOM 887 C CE1 . PHE A 1 117 ? 17.054 39.856 -28.345 1.00 26.83 ? 118 PHE L CE1 1 ATOM 888 C CE2 . PHE A 1 117 ? 15.875 37.820 -27.889 1.00 26.76 ? 118 PHE L CE2 1 ATOM 889 C CZ . PHE A 1 117 ? 16.562 38.933 -27.438 1.00 26.61 ? 118 PHE L CZ 1 ATOM 890 N N . PRO A 1 118 ? 14.844 39.922 -34.500 1.00 24.25 ? 119 PRO L N 1 ATOM 891 C CA . PRO A 1 118 ? 14.935 39.732 -35.950 1.00 24.92 ? 119 PRO L CA 1 ATOM 892 C C . PRO A 1 118 ? 16.277 39.108 -36.316 1.00 25.79 ? 119 PRO L C 1 ATOM 893 O O . PRO A 1 118 ? 17.216 39.211 -35.537 1.00 31.49 ? 119 PRO L O 1 ATOM 894 C CB . PRO A 1 118 ? 14.816 41.158 -36.503 1.00 22.14 ? 119 PRO L CB 1 ATOM 895 C CG . PRO A 1 118 ? 14.258 41.974 -35.373 1.00 24.52 ? 119 PRO L CG 1 ATOM 896 C CD . PRO A 1 118 ? 14.805 41.345 -34.135 1.00 22.94 ? 119 PRO L CD 1 ATOM 897 N N . PRO A 1 119 ? 16.369 38.462 -37.483 1.00 20.94 ? 120 PRO L N 1 ATOM 898 C CA . PRO A 1 119 ? 17.673 37.945 -37.903 1.00 24.84 ? 120 PRO L CA 1 ATOM 899 C C . PRO A 1 119 ? 18.681 39.067 -38.111 1.00 31.56 ? 120 PRO L C 1 ATOM 900 O O . PRO A 1 119 ? 18.306 40.175 -38.497 1.00 35.09 ? 120 PRO L O 1 ATOM 901 C CB . PRO A 1 119 ? 17.363 37.247 -39.224 1.00 22.91 ? 120 PRO L CB 1 ATOM 902 C CG . PRO A 1 119 ? 16.147 37.970 -39.738 1.00 28.80 ? 120 PRO L CG 1 ATOM 903 C CD . PRO A 1 119 ? 15.338 38.273 -38.517 1.00 26.45 ? 120 PRO L CD 1 ATOM 904 N N . SER A 1 120 ? 19.949 38.778 -37.848 1.00 32.08 ? 121 SER L N 1 ATOM 905 C CA . SER A 1 120 ? 21.021 39.730 -38.098 1.00 28.45 ? 121 SER L CA 1 ATOM 906 C C . SER A 1 120 ? 21.270 39.873 -39.592 1.00 30.11 ? 121 SER L C 1 ATOM 907 O O . SER A 1 120 ? 20.956 38.969 -40.371 1.00 31.95 ? 121 SER L O 1 ATOM 908 C CB . SER A 1 120 ? 22.302 39.285 -37.395 1.00 27.96 ? 121 SER L CB 1 ATOM 909 O OG . SER A 1 120 ? 22.725 38.018 -37.874 1.00 31.55 ? 121 SER L OG 1 ATOM 910 N N . ASP A 1 121 ? 21.838 41.004 -39.995 1.00 30.84 ? 122 ASP L N 1 ATOM 911 C CA . ASP A 1 121 ? 22.203 41.199 -41.391 1.00 31.21 ? 122 ASP L CA 1 ATOM 912 C C . ASP A 1 121 ? 23.295 40.212 -41.779 1.00 31.80 ? 122 ASP L C 1 ATOM 913 O O . ASP A 1 121 ? 23.349 39.749 -42.921 1.00 26.45 ? 122 ASP L O 1 ATOM 914 C CB . ASP A 1 121 ? 22.659 42.636 -41.642 1.00 36.68 ? 122 ASP L CB 1 ATOM 915 C CG . ASP A 1 121 ? 21.505 43.623 -41.637 1.00 49.89 ? 122 ASP L CG 1 ATOM 916 O OD1 . ASP A 1 121 ? 20.393 43.246 -42.067 1.00 52.70 ? 122 ASP L OD1 1 ATOM 917 O OD2 . ASP A 1 121 ? 21.708 44.775 -41.201 1.00 55.82 ? 122 ASP L OD2 1 ATOM 918 N N . GLU A 1 122 ? 24.151 39.880 -40.816 1.00 27.63 ? 123 GLU L N 1 ATOM 919 C CA . GLU A 1 122 ? 25.224 38.924 -41.050 1.00 33.86 ? 123 GLU L CA 1 ATOM 920 C C . GLU A 1 122 ? 24.661 37.565 -41.467 1.00 34.17 ? 123 GLU L C 1 ATOM 921 O O . GLU A 1 122 ? 25.186 36.931 -42.381 1.00 33.39 ? 123 GLU L O 1 ATOM 922 C CB . GLU A 1 122 ? 26.106 38.770 -39.805 1.00 35.62 ? 123 GLU L CB 1 ATOM 923 C CG . GLU A 1 122 ? 27.382 37.968 -40.057 1.00 45.53 ? 123 GLU L CG 1 ATOM 924 C CD . GLU A 1 122 ? 28.136 37.612 -38.777 1.00 57.21 ? 123 GLU L CD 1 ATOM 925 O OE1 . GLU A 1 122 ? 27.836 38.202 -37.715 1.00 53.83 ? 123 GLU L OE1 1 ATOM 926 O OE2 . GLU A 1 122 ? 29.029 36.734 -38.834 1.00 57.37 ? 123 GLU L OE2 1 ATOM 927 N N . GLN A 1 123 ? 23.589 37.124 -40.812 1.00 29.04 ? 124 GLN L N 1 ATOM 928 C CA . GLN A 1 123 ? 23.006 35.826 -41.150 1.00 28.48 ? 124 GLN L CA 1 ATOM 929 C C . GLN A 1 123 ? 22.305 35.866 -42.506 1.00 23.73 ? 124 GLN L C 1 ATOM 930 O O . GLN A 1 123 ? 22.264 34.867 -43.215 1.00 25.64 ? 124 GLN L O 1 ATOM 931 C CB . GLN A 1 123 ? 22.023 35.350 -40.074 1.00 31.00 ? 124 GLN L CB 1 ATOM 932 C CG . GLN A 1 123 ? 21.607 33.877 -40.238 1.00 32.94 ? 124 GLN L CG 1 ATOM 933 C CD . GLN A 1 123 ? 20.419 33.473 -39.371 1.00 29.04 ? 124 GLN L CD 1 ATOM 934 O OE1 . GLN A 1 123 ? 19.737 34.317 -38.786 1.00 28.46 ? 124 GLN L OE1 1 ATOM 935 N NE2 . GLN A 1 123 ? 20.170 32.171 -39.286 1.00 24.44 ? 124 GLN L NE2 1 ATOM 936 N N . LEU A 1 124 ? 21.755 37.017 -42.870 1.00 28.95 ? 125 LEU L N 1 ATOM 937 C CA . LEU A 1 124 ? 21.069 37.137 -44.152 1.00 34.56 ? 125 LEU L CA 1 ATOM 938 C C . LEU A 1 124 ? 22.027 36.973 -45.337 1.00 39.35 ? 125 LEU L C 1 ATOM 939 O O . LEU A 1 124 ? 21.623 36.529 -46.410 1.00 43.28 ? 125 LEU L O 1 ATOM 940 C CB . LEU A 1 124 ? 20.336 38.475 -44.231 1.00 35.48 ? 125 LEU L CB 1 ATOM 941 C CG . LEU A 1 124 ? 19.173 38.553 -43.238 1.00 37.49 ? 125 LEU L CG 1 ATOM 942 C CD1 . LEU A 1 124 ? 18.496 39.909 -43.261 1.00 35.74 ? 125 LEU L CD1 1 ATOM 943 C CD2 . LEU A 1 124 ? 18.167 37.445 -43.518 1.00 31.67 ? 125 LEU L CD2 1 ATOM 944 N N . LYS A 1 125 ? 23.293 37.323 -45.137 1.00 39.19 ? 126 LYS L N 1 ATOM 945 C CA . LYS A 1 125 ? 24.324 37.091 -46.146 1.00 45.02 ? 126 LYS L CA 1 ATOM 946 C C . LYS A 1 125 ? 24.473 35.609 -46.484 1.00 56.34 ? 126 LYS L C 1 ATOM 947 O O . LYS A 1 125 ? 24.772 35.250 -47.622 1.00 58.10 ? 126 LYS L O 1 ATOM 948 C CB . LYS A 1 125 ? 25.675 37.623 -45.671 1.00 45.60 ? 126 LYS L CB 1 ATOM 949 C CG . LYS A 1 125 ? 25.755 39.122 -45.479 1.00 49.00 ? 126 LYS L CG 1 ATOM 950 C CD . LYS A 1 125 ? 27.103 39.500 -44.877 1.00 54.37 ? 126 LYS L CD 1 ATOM 951 C CE . LYS A 1 125 ? 28.246 38.819 -45.619 1.00 64.96 ? 126 LYS L CE 1 ATOM 952 N NZ . LYS A 1 125 ? 29.563 39.078 -44.974 1.00 74.35 ? 126 LYS L NZ 1 ATOM 953 N N . SER A 1 126 ? 24.272 34.757 -45.481 1.00 58.80 ? 127 SER L N 1 ATOM 954 C CA . SER A 1 126 ? 24.534 33.327 -45.611 1.00 57.67 ? 127 SER L CA 1 ATOM 955 C C . SER A 1 126 ? 23.419 32.570 -46.335 1.00 52.99 ? 127 SER L C 1 ATOM 956 O O . SER A 1 126 ? 23.657 31.494 -46.888 1.00 57.22 ? 127 SER L O 1 ATOM 957 C CB . SER A 1 126 ? 24.762 32.709 -44.229 1.00 65.49 ? 127 SER L CB 1 ATOM 958 O OG . SER A 1 126 ? 23.588 32.778 -43.434 1.00 68.46 ? 127 SER L OG 1 ATOM 959 N N . GLY A 1 127 ? 22.206 33.115 -46.319 1.00 32.13 ? 128 GLY L N 1 ATOM 960 C CA . GLY A 1 127 ? 21.106 32.497 -47.038 1.00 34.44 ? 128 GLY L CA 1 ATOM 961 C C . GLY A 1 127 ? 19.993 31.925 -46.181 1.00 35.20 ? 128 GLY L C 1 ATOM 962 O O . GLY A 1 127 ? 19.072 31.289 -46.685 1.00 36.75 ? 128 GLY L O 1 ATOM 963 N N . THR A 1 128 ? 20.070 32.160 -44.879 1.00 40.74 ? 129 THR L N 1 ATOM 964 C CA . THR A 1 128 ? 19.063 31.663 -43.954 1.00 35.84 ? 129 THR L CA 1 ATOM 965 C C . THR A 1 128 ? 18.705 32.774 -42.975 1.00 28.02 ? 129 THR L C 1 ATOM 966 O O . THR A 1 128 ? 19.552 33.593 -42.628 1.00 27.27 ? 129 THR L O 1 ATOM 967 C CB . THR A 1 128 ? 19.566 30.413 -43.201 1.00 43.82 ? 129 THR L CB 1 ATOM 968 O OG1 . THR A 1 128 ? 19.993 29.429 -44.151 1.00 59.17 ? 129 THR L OG1 1 ATOM 969 C CG2 . THR A 1 128 ? 18.481 29.812 -42.327 1.00 36.46 ? 129 THR L CG2 1 ATOM 970 N N . ALA A 1 129 ? 17.443 32.822 -42.559 1.00 23.65 ? 130 ALA L N 1 ATOM 971 C CA . ALA A 1 129 ? 17.000 33.800 -41.574 1.00 25.11 ? 130 ALA L CA 1 ATOM 972 C C . ALA A 1 129 ? 16.401 33.101 -40.363 1.00 29.06 ? 130 ALA L C 1 ATOM 973 O O . ALA A 1 129 ? 15.441 32.340 -40.485 1.00 27.15 ? 130 ALA L O 1 ATOM 974 C CB . ALA A 1 129 ? 15.988 34.758 -42.184 1.00 20.33 ? 130 ALA L CB 1 ATOM 975 N N . SER A 1 130 ? 16.974 33.360 -39.193 1.00 24.46 ? 131 SER L N 1 ATOM 976 C CA . SER A 1 130 ? 16.424 32.836 -37.952 1.00 19.49 ? 131 SER L CA 1 ATOM 977 C C . SER A 1 130 ? 15.757 33.948 -37.154 1.00 23.91 ? 131 SER L C 1 ATOM 978 O O . SER A 1 130 ? 16.379 34.954 -36.832 1.00 24.34 ? 131 SER L O 1 ATOM 979 C CB . SER A 1 130 ? 17.515 32.176 -37.108 1.00 22.40 ? 131 SER L CB 1 ATOM 980 O OG . SER A 1 130 ? 18.152 31.135 -37.823 1.00 21.80 ? 131 SER L OG 1 ATOM 981 N N . VAL A 1 131 ? 14.483 33.763 -36.844 1.00 24.95 ? 132 VAL L N 1 ATOM 982 C CA . VAL A 1 131 ? 13.775 34.680 -35.970 1.00 22.24 ? 132 VAL L CA 1 ATOM 983 C C . VAL A 1 131 ? 13.613 33.995 -34.622 1.00 22.60 ? 132 VAL L C 1 ATOM 984 O O . VAL A 1 131 ? 13.121 32.873 -34.546 1.00 21.16 ? 132 VAL L O 1 ATOM 985 C CB . VAL A 1 131 ? 12.402 35.065 -36.540 1.00 18.95 ? 132 VAL L CB 1 ATOM 986 C CG1 . VAL A 1 131 ? 11.833 36.255 -35.795 1.00 19.64 ? 132 VAL L CG1 1 ATOM 987 C CG2 . VAL A 1 131 ? 12.515 35.369 -38.022 1.00 20.90 ? 132 VAL L CG2 1 ATOM 988 N N . VAL A 1 132 ? 14.046 34.657 -33.558 1.00 22.83 ? 133 VAL L N 1 ATOM 989 C CA . VAL A 1 132 ? 14.032 34.034 -32.244 1.00 18.42 ? 133 VAL L CA 1 ATOM 990 C C . VAL A 1 132 ? 13.048 34.724 -31.309 1.00 21.67 ? 133 VAL L C 1 ATOM 991 O O . VAL A 1 132 ? 13.025 35.954 -31.197 1.00 22.11 ? 133 VAL L O 1 ATOM 992 C CB . VAL A 1 132 ? 15.436 34.034 -31.617 1.00 22.01 ? 133 VAL L CB 1 ATOM 993 C CG1 . VAL A 1 132 ? 15.397 33.444 -30.218 1.00 19.21 ? 133 VAL L CG1 1 ATOM 994 C CG2 . VAL A 1 132 ? 16.402 33.253 -32.497 1.00 15.04 ? 133 VAL L CG2 1 ATOM 995 N N . CYS A 1 133 ? 12.221 33.911 -30.662 1.00 18.55 ? 134 CYS L N 1 ATOM 996 C CA . CYS A 1 133 ? 11.270 34.377 -29.666 1.00 20.65 ? 134 CYS L CA 1 ATOM 997 C C . CYS A 1 133 ? 11.672 33.812 -28.315 1.00 26.51 ? 134 CYS L C 1 ATOM 998 O O . CYS A 1 133 ? 11.793 32.597 -28.157 1.00 32.05 ? 134 CYS L O 1 ATOM 999 C CB . CYS A 1 133 ? 9.844 33.949 -30.029 1.00 20.17 ? 134 CYS L CB 1 ATOM 1000 S SG . CYS A 1 133 ? 8.536 34.559 -28.936 1.00 40.17 ? 134 CYS L SG 1 ATOM 1001 N N . LEU A 1 134 ? 11.888 34.693 -27.347 1.00 21.17 ? 135 LEU L N 1 ATOM 1002 C CA . LEU A 1 134 ? 12.311 34.277 -26.019 1.00 20.51 ? 135 LEU L CA 1 ATOM 1003 C C . LEU A 1 134 ? 11.206 34.478 -24.989 1.00 24.60 ? 135 LEU L C 1 ATOM 1004 O O . LEU A 1 134 ? 10.595 35.546 -24.915 1.00 23.31 ? 135 LEU L O 1 ATOM 1005 C CB . LEU A 1 134 ? 13.565 35.046 -25.592 1.00 15.90 ? 135 LEU L CB 1 ATOM 1006 C CG . LEU A 1 134 ? 14.010 34.921 -24.129 1.00 21.83 ? 135 LEU L CG 1 ATOM 1007 C CD1 . LEU A 1 134 ? 14.498 33.519 -23.808 1.00 21.56 ? 135 LEU L CD1 1 ATOM 1008 C CD2 . LEU A 1 134 ? 15.084 35.945 -23.806 1.00 20.83 ? 135 LEU L CD2 1 ATOM 1009 N N . LEU A 1 135 ? 10.954 33.431 -24.208 1.00 20.31 ? 136 LEU L N 1 ATOM 1010 C CA . LEU A 1 135 ? 10.091 33.508 -23.038 1.00 18.14 ? 136 LEU L CA 1 ATOM 1011 C C . LEU A 1 135 ? 10.973 33.320 -21.810 1.00 20.46 ? 136 LEU L C 1 ATOM 1012 O O . LEU A 1 135 ? 11.565 32.261 -21.629 1.00 21.73 ? 136 LEU L O 1 ATOM 1013 C CB . LEU A 1 135 ? 9.001 32.442 -23.073 1.00 20.80 ? 136 LEU L CB 1 ATOM 1014 C CG . LEU A 1 135 ? 7.828 32.540 -24.047 1.00 20.80 ? 136 LEU L CG 1 ATOM 1015 C CD1 . LEU A 1 135 ? 8.282 32.605 -25.497 1.00 16.94 ? 136 LEU L CD1 1 ATOM 1016 C CD2 . LEU A 1 135 ? 6.935 31.335 -23.821 1.00 21.27 ? 136 LEU L CD2 1 ATOM 1017 N N . ASN A 1 136 ? 11.070 34.343 -20.974 1.00 21.48 ? 137 ASN L N 1 ATOM 1018 C CA . ASN A 1 136 ? 12.028 34.314 -19.882 1.00 25.14 ? 137 ASN L CA 1 ATOM 1019 C C . ASN A 1 136 ? 11.392 34.170 -18.500 1.00 25.48 ? 137 ASN L C 1 ATOM 1020 O O . ASN A 1 136 ? 10.436 34.872 -18.172 1.00 27.67 ? 137 ASN L O 1 ATOM 1021 C CB . ASN A 1 136 ? 12.888 35.575 -19.931 1.00 23.78 ? 137 ASN L CB 1 ATOM 1022 C CG . ASN A 1 136 ? 14.219 35.392 -19.241 1.00 35.93 ? 137 ASN L CG 1 ATOM 1023 O OD1 . ASN A 1 136 ? 15.008 34.523 -19.614 1.00 40.70 ? 137 ASN L OD1 1 ATOM 1024 N ND2 . ASN A 1 136 ? 14.479 36.210 -18.231 1.00 33.82 ? 137 ASN L ND2 1 ATOM 1025 N N . ASN A 1 137 ? 11.926 33.235 -17.713 1.00 25.80 ? 138 ASN L N 1 ATOM 1026 C CA . ASN A 1 137 ? 11.601 33.076 -16.291 1.00 22.02 ? 138 ASN L CA 1 ATOM 1027 C C . ASN A 1 137 ? 10.121 32.907 -15.961 1.00 25.03 ? 138 ASN L C 1 ATOM 1028 O O . ASN A 1 137 ? 9.529 33.762 -15.305 1.00 29.25 ? 138 ASN L O 1 ATOM 1029 C CB . ASN A 1 137 ? 12.154 34.264 -15.503 1.00 21.68 ? 138 ASN L CB 1 ATOM 1030 C CG . ASN A 1 137 ? 13.668 34.328 -15.543 1.00 31.81 ? 138 ASN L CG 1 ATOM 1031 O OD1 . ASN A 1 137 ? 14.332 33.353 -15.897 1.00 27.95 ? 138 ASN L OD1 1 ATOM 1032 N ND2 . ASN A 1 137 ? 14.222 35.475 -15.175 1.00 34.94 ? 138 ASN L ND2 1 ATOM 1033 N N . PHE A 1 138 ? 9.533 31.791 -16.381 1.00 22.26 ? 139 PHE L N 1 ATOM 1034 C CA . PHE A 1 138 ? 8.113 31.561 -16.147 1.00 19.33 ? 139 PHE L CA 1 ATOM 1035 C C . PHE A 1 138 ? 7.829 30.236 -15.450 1.00 22.92 ? 139 PHE L C 1 ATOM 1036 O O . PHE A 1 138 ? 8.670 29.340 -15.413 1.00 20.93 ? 139 PHE L O 1 ATOM 1037 C CB . PHE A 1 138 ? 7.346 31.622 -17.466 1.00 20.58 ? 139 PHE L CB 1 ATOM 1038 C CG . PHE A 1 138 ? 7.805 30.614 -18.487 1.00 24.99 ? 139 PHE L CG 1 ATOM 1039 C CD1 . PHE A 1 138 ? 8.877 30.889 -19.325 1.00 23.13 ? 139 PHE L CD1 1 ATOM 1040 C CD2 . PHE A 1 138 ? 7.155 29.399 -18.618 1.00 22.41 ? 139 PHE L CD2 1 ATOM 1041 C CE1 . PHE A 1 138 ? 9.295 29.960 -20.271 1.00 24.51 ? 139 PHE L CE1 1 ATOM 1042 C CE2 . PHE A 1 138 ? 7.564 28.468 -19.560 1.00 24.26 ? 139 PHE L CE2 1 ATOM 1043 C CZ . PHE A 1 138 ? 8.635 28.748 -20.388 1.00 23.26 ? 139 PHE L CZ 1 ATOM 1044 N N . TYR A 1 139 ? 6.630 30.133 -14.890 1.00 25.67 ? 140 TYR L N 1 ATOM 1045 C CA . TYR A 1 139 ? 6.155 28.902 -14.276 1.00 23.70 ? 140 TYR L CA 1 ATOM 1046 C C . TYR A 1 139 ? 4.627 28.917 -14.328 1.00 24.41 ? 140 TYR L C 1 ATOM 1047 O O . TYR A 1 139 ? 4.019 29.959 -14.115 1.00 26.58 ? 140 TYR L O 1 ATOM 1048 C CB . TYR A 1 139 ? 6.661 28.768 -12.832 1.00 21.32 ? 140 TYR L CB 1 ATOM 1049 C CG . TYR A 1 139 ? 6.315 27.431 -12.225 1.00 26.56 ? 140 TYR L CG 1 ATOM 1050 C CD1 . TYR A 1 139 ? 5.086 27.224 -11.601 1.00 23.30 ? 140 TYR L CD1 1 ATOM 1051 C CD2 . TYR A 1 139 ? 7.200 26.361 -12.308 1.00 20.71 ? 140 TYR L CD2 1 ATOM 1052 C CE1 . TYR A 1 139 ? 4.757 25.990 -11.071 1.00 23.21 ? 140 TYR L CE1 1 ATOM 1053 C CE2 . TYR A 1 139 ? 6.881 25.126 -11.779 1.00 21.63 ? 140 TYR L CE2 1 ATOM 1054 C CZ . TYR A 1 139 ? 5.660 24.946 -11.159 1.00 24.15 ? 140 TYR L CZ 1 ATOM 1055 O OH . TYR A 1 139 ? 5.329 23.720 -10.631 1.00 32.26 ? 140 TYR L OH 1 ATOM 1056 N N . PRO A 1 140 ? 3.996 27.769 -14.627 1.00 24.01 ? 141 PRO L N 1 ATOM 1057 C CA . PRO A 1 140 ? 4.587 26.459 -14.924 1.00 25.73 ? 141 PRO L CA 1 ATOM 1058 C C . PRO A 1 140 ? 5.230 26.354 -16.305 1.00 24.77 ? 141 PRO L C 1 ATOM 1059 O O . PRO A 1 140 ? 5.261 27.318 -17.075 1.00 26.69 ? 141 PRO L O 1 ATOM 1060 C CB . PRO A 1 140 ? 3.390 25.508 -14.817 1.00 22.72 ? 141 PRO L CB 1 ATOM 1061 C CG . PRO A 1 140 ? 2.226 26.344 -15.185 1.00 24.25 ? 141 PRO L CG 1 ATOM 1062 C CD . PRO A 1 140 ? 2.524 27.709 -14.617 1.00 25.68 ? 141 PRO L CD 1 ATOM 1063 N N . ARG A 1 141 ? 5.730 25.159 -16.599 1.00 19.58 ? 142 ARG L N 1 ATOM 1064 C CA . ARG A 1 141 ? 6.537 24.896 -17.781 1.00 22.31 ? 142 ARG L CA 1 ATOM 1065 C C . ARG A 1 141 ? 5.740 25.026 -19.079 1.00 22.22 ? 142 ARG L C 1 ATOM 1066 O O . ARG A 1 141 ? 6.278 25.435 -20.103 1.00 26.68 ? 142 ARG L O 1 ATOM 1067 C CB . ARG A 1 141 ? 7.147 23.495 -17.673 1.00 22.26 ? 142 ARG L CB 1 ATOM 1068 C CG . ARG A 1 141 ? 8.225 23.172 -18.695 1.00 28.68 ? 142 ARG L CG 1 ATOM 1069 C CD . ARG A 1 141 ? 8.766 21.761 -18.461 1.00 34.26 ? 142 ARG L CD 1 ATOM 1070 N NE . ARG A 1 141 ? 9.721 21.339 -19.485 1.00 42.98 ? 142 ARG L NE 1 ATOM 1071 C CZ . ARG A 1 141 ? 9.375 20.902 -20.692 1.00 50.71 ? 142 ARG L CZ 1 ATOM 1072 N NH1 . ARG A 1 141 ? 8.095 20.837 -21.033 1.00 54.43 ? 142 ARG L NH1 1 ATOM 1073 N NH2 . ARG A 1 141 ? 10.309 20.538 -21.562 1.00 56.81 ? 142 ARG L NH2 1 ATOM 1074 N N . GLU A 1 142 ? 4.457 24.685 -19.025 1.00 19.85 ? 143 GLU L N 1 ATOM 1075 C CA . GLU A 1 142 ? 3.622 24.655 -20.224 1.00 28.69 ? 143 GLU L CA 1 ATOM 1076 C C . GLU A 1 142 ? 3.351 26.046 -20.789 1.00 30.98 ? 143 GLU L C 1 ATOM 1077 O O . GLU A 1 142 ? 2.885 26.940 -20.086 1.00 35.55 ? 143 GLU L O 1 ATOM 1078 C CB . GLU A 1 142 ? 2.295 23.952 -19.932 1.00 34.59 ? 143 GLU L CB 1 ATOM 1079 C CG . GLU A 1 142 ? 2.443 22.489 -19.504 1.00 48.77 ? 143 GLU L CG 1 ATOM 1080 C CD . GLU A 1 142 ? 2.767 22.322 -18.020 1.00 56.14 ? 143 GLU L CD 1 ATOM 1081 O OE1 . GLU A 1 142 ? 2.690 23.320 -17.272 1.00 53.64 ? 143 GLU L OE1 1 ATOM 1082 O OE2 . GLU A 1 142 ? 3.096 21.189 -17.603 1.00 61.20 ? 143 GLU L OE2 1 ATOM 1083 N N . ALA A 1 143 ? 3.648 26.219 -22.070 1.00 23.68 ? 144 ALA L N 1 ATOM 1084 C CA . ALA A 1 143 ? 3.383 27.472 -22.763 1.00 28.65 ? 144 ALA L CA 1 ATOM 1085 C C . ALA A 1 143 ? 3.146 27.185 -24.233 1.00 24.06 ? 144 ALA L C 1 ATOM 1086 O O . ALA A 1 143 ? 3.750 26.277 -24.791 1.00 27.20 ? 144 ALA L O 1 ATOM 1087 C CB . ALA A 1 143 ? 4.539 28.446 -22.587 1.00 29.01 ? 144 ALA L CB 1 ATOM 1088 N N . LYS A 1 144 ? 2.258 27.944 -24.860 1.00 28.41 ? 145 LYS L N 1 ATOM 1089 C CA . LYS A 1 144 ? 2.045 27.791 -26.289 1.00 22.87 ? 145 LYS L CA 1 ATOM 1090 C C . LYS A 1 144 ? 2.683 28.954 -27.031 1.00 26.35 ? 145 LYS L C 1 ATOM 1091 O O . LYS A 1 144 ? 2.437 30.113 -26.713 1.00 25.49 ? 145 LYS L O 1 ATOM 1092 C CB . LYS A 1 144 ? 0.557 27.701 -26.624 1.00 28.19 ? 145 LYS L CB 1 ATOM 1093 C CG . LYS A 1 144 ? 0.296 27.555 -28.117 1.00 33.74 ? 145 LYS L CG 1 ATOM 1094 C CD . LYS A 1 144 ? -1.127 27.110 -28.414 1.00 47.05 ? 145 LYS L CD 1 ATOM 1095 C CE . LYS A 1 144 ? -2.129 28.212 -28.140 1.00 57.46 ? 145 LYS L CE 1 ATOM 1096 N NZ . LYS A 1 144 ? -3.513 27.800 -28.516 1.00 65.41 ? 145 LYS L NZ 1 ATOM 1097 N N . VAL A 1 145 ? 3.517 28.636 -28.011 1.00 23.40 ? 146 VAL L N 1 ATOM 1098 C CA . VAL A 1 145 ? 4.152 29.661 -28.815 1.00 25.05 ? 146 VAL L CA 1 ATOM 1099 C C . VAL A 1 145 ? 3.744 29.499 -30.272 1.00 25.45 ? 146 VAL L C 1 ATOM 1100 O O . VAL A 1 145 ? 3.962 28.454 -30.880 1.00 34.53 ? 146 VAL L O 1 ATOM 1101 C CB . VAL A 1 145 ? 5.681 29.612 -28.690 1.00 31.66 ? 146 VAL L CB 1 ATOM 1102 C CG1 . VAL A 1 145 ? 6.311 30.752 -29.473 1.00 32.38 ? 146 VAL L CG1 1 ATOM 1103 C CG2 . VAL A 1 145 ? 6.088 29.680 -27.227 1.00 25.70 ? 146 VAL L CG2 1 ATOM 1104 N N . GLN A 1 146 ? 3.134 30.542 -30.818 1.00 24.00 ? 147 GLN L N 1 ATOM 1105 C CA . GLN A 1 146 ? 2.710 30.541 -32.208 1.00 26.73 ? 147 GLN L CA 1 ATOM 1106 C C . GLN A 1 146 ? 3.436 31.614 -32.998 1.00 24.42 ? 147 GLN L C 1 ATOM 1107 O O . GLN A 1 146 ? 3.546 32.761 -32.558 1.00 21.39 ? 147 GLN L O 1 ATOM 1108 C CB . GLN A 1 146 ? 1.205 30.769 -32.317 1.00 27.34 ? 147 GLN L CB 1 ATOM 1109 C CG . GLN A 1 146 ? 0.365 29.677 -31.711 1.00 37.18 ? 147 GLN L CG 1 ATOM 1110 C CD . GLN A 1 146 ? -1.092 30.058 -31.666 1.00 45.34 ? 147 GLN L CD 1 ATOM 1111 O OE1 . GLN A 1 146 ? -1.485 30.971 -30.937 1.00 50.70 ? 147 GLN L OE1 1 ATOM 1112 N NE2 . GLN A 1 146 ? -1.905 29.372 -32.459 1.00 43.36 ? 147 GLN L NE2 1 ATOM 1113 N N . TRP A 1 147 ? 3.919 31.234 -34.173 1.00 16.16 ? 148 TRP L N 1 ATOM 1114 C CA . TRP A 1 147 ? 4.548 32.179 -35.081 1.00 20.58 ? 148 TRP L CA 1 ATOM 1115 C C . TRP A 1 147 ? 3.551 32.665 -36.110 1.00 23.56 ? 148 TRP L C 1 ATOM 1116 O O . TRP A 1 147 ? 2.762 31.881 -36.635 1.00 27.63 ? 148 TRP L O 1 ATOM 1117 C CB . TRP A 1 147 ? 5.740 31.539 -35.780 1.00 18.38 ? 148 TRP L CB 1 ATOM 1118 C CG . TRP A 1 147 ? 6.939 31.462 -34.917 1.00 18.97 ? 148 TRP L CG 1 ATOM 1119 C CD1 . TRP A 1 147 ? 7.411 30.362 -34.263 1.00 15.31 ? 148 TRP L CD1 1 ATOM 1120 C CD2 . TRP A 1 147 ? 7.827 32.535 -34.597 1.00 19.00 ? 148 TRP L CD2 1 ATOM 1121 N NE1 . TRP A 1 147 ? 8.549 30.685 -33.560 1.00 24.31 ? 148 TRP L NE1 1 ATOM 1122 C CE2 . TRP A 1 147 ? 8.822 32.012 -33.746 1.00 20.72 ? 148 TRP L CE2 1 ATOM 1123 C CE3 . TRP A 1 147 ? 7.878 33.885 -34.948 1.00 19.57 ? 148 TRP L CE3 1 ATOM 1124 C CZ2 . TRP A 1 147 ? 9.862 32.794 -33.248 1.00 23.90 ? 148 TRP L CZ2 1 ATOM 1125 C CZ3 . TRP A 1 147 ? 8.905 34.659 -34.447 1.00 21.61 ? 148 TRP L CZ3 1 ATOM 1126 C CH2 . TRP A 1 147 ? 9.885 34.111 -33.607 1.00 25.33 ? 148 TRP L CH2 1 ATOM 1127 N N . LYS A 1 148 ? 3.589 33.961 -36.395 1.00 22.56 ? 149 LYS L N 1 ATOM 1128 C CA . LYS A 1 148 ? 2.747 34.537 -37.430 1.00 23.27 ? 149 LYS L CA 1 ATOM 1129 C C . LYS A 1 148 ? 3.581 35.377 -38.381 1.00 29.36 ? 149 LYS L C 1 ATOM 1130 O O . LYS A 1 148 ? 4.313 36.275 -37.956 1.00 29.48 ? 149 LYS L O 1 ATOM 1131 C CB . LYS A 1 148 ? 1.632 35.382 -36.818 1.00 22.79 ? 149 LYS L CB 1 ATOM 1132 C CG . LYS A 1 148 ? 0.520 34.570 -36.181 1.00 25.74 ? 149 LYS L CG 1 ATOM 1133 C CD . LYS A 1 148 ? -0.417 35.468 -35.394 1.00 34.24 ? 149 LYS L CD 1 ATOM 1134 C CE . LYS A 1 148 ? -1.523 34.670 -34.724 1.00 39.80 ? 149 LYS L CE 1 ATOM 1135 N NZ . LYS A 1 148 ? -2.395 35.551 -33.893 1.00 46.17 ? 149 LYS L NZ 1 ATOM 1136 N N . VAL A 1 149 ? 3.478 35.069 -39.668 1.00 23.02 ? 150 VAL L N 1 ATOM 1137 C CA . VAL A 1 149 ? 4.150 35.847 -40.694 1.00 26.15 ? 150 VAL L CA 1 ATOM 1138 C C . VAL A 1 149 ? 3.103 36.487 -41.595 1.00 24.79 ? 150 VAL L C 1 ATOM 1139 O O . VAL A 1 149 ? 2.340 35.783 -42.260 1.00 26.71 ? 150 VAL L O 1 ATOM 1140 C CB . VAL A 1 149 ? 5.108 34.983 -41.525 1.00 25.26 ? 150 VAL L CB 1 ATOM 1141 C CG1 . VAL A 1 149 ? 5.768 35.823 -42.599 1.00 22.21 ? 150 VAL L CG1 1 ATOM 1142 C CG2 . VAL A 1 149 ? 6.161 34.351 -40.622 1.00 21.21 ? 150 VAL L CG2 1 ATOM 1143 N N . ASP A 1 150 ? 3.078 37.820 -41.607 1.00 22.27 ? 151 ASP L N 1 ATOM 1144 C CA . ASP A 1 150 ? 2.001 38.589 -42.232 1.00 22.29 ? 151 ASP L CA 1 ATOM 1145 C C . ASP A 1 150 ? 0.652 38.016 -41.811 1.00 25.00 ? 151 ASP L C 1 ATOM 1146 O O . ASP A 1 150 ? -0.229 37.803 -42.647 1.00 27.72 ? 151 ASP L O 1 ATOM 1147 C CB . ASP A 1 150 ? 2.130 38.593 -43.756 1.00 22.75 ? 151 ASP L CB 1 ATOM 1148 C CG . ASP A 1 150 ? 3.267 39.474 -44.246 1.00 30.50 ? 151 ASP L CG 1 ATOM 1149 O OD1 . ASP A 1 150 ? 3.560 40.498 -43.596 1.00 28.88 ? 151 ASP L OD1 1 ATOM 1150 O OD2 . ASP A 1 150 ? 3.867 39.145 -45.288 1.00 31.93 ? 151 ASP L OD2 1 ATOM 1151 N N . ASN A 1 151 ? 0.535 37.727 -40.514 1.00 17.63 ? 152 ASN L N 1 ATOM 1152 C CA . ASN A 1 151 ? -0.694 37.241 -39.890 1.00 26.30 ? 152 ASN L CA 1 ATOM 1153 C C . ASN A 1 151 ? -1.094 35.819 -40.297 1.00 24.03 ? 152 ASN L C 1 ATOM 1154 O O . ASN A 1 151 ? -2.216 35.385 -40.033 1.00 29.94 ? 152 ASN L O 1 ATOM 1155 C CB . ASN A 1 151 ? -1.849 38.203 -40.186 1.00 29.64 ? 152 ASN L CB 1 ATOM 1156 C CG . ASN A 1 151 ? -2.670 38.509 -38.963 1.00 38.15 ? 152 ASN L CG 1 ATOM 1157 O OD1 . ASN A 1 151 ? -2.161 38.501 -37.844 1.00 41.26 ? 152 ASN L OD1 1 ATOM 1158 N ND2 . ASN A 1 151 ? -3.955 38.777 -39.165 1.00 43.48 ? 152 ASN L ND2 1 ATOM 1159 N N . ALA A 1 152 ? -0.182 35.094 -40.933 1.00 19.15 ? 153 ALA L N 1 ATOM 1160 C CA . ALA A 1 152 ? -0.425 33.686 -41.242 1.00 24.73 ? 153 ALA L CA 1 ATOM 1161 C C . ALA A 1 152 ? 0.298 32.781 -40.246 1.00 30.27 ? 153 ALA L C 1 ATOM 1162 O O . ALA A 1 152 ? 1.515 32.901 -40.041 1.00 23.12 ? 153 ALA L O 1 ATOM 1163 C CB . ALA A 1 152 ? 0.005 33.361 -42.662 1.00 18.95 ? 153 ALA L CB 1 ATOM 1164 N N . LEU A 1 153 ? -0.461 31.882 -39.626 1.00 24.81 ? 154 LEU L N 1 ATOM 1165 C CA . LEU A 1 153 ? 0.098 30.945 -38.660 1.00 32.76 ? 154 LEU L CA 1 ATOM 1166 C C . LEU A 1 153 ? 1.087 30.013 -39.345 1.00 26.03 ? 154 LEU L C 1 ATOM 1167 O O . LEU A 1 153 ? 0.785 29.430 -40.384 1.00 31.23 ? 154 LEU L O 1 ATOM 1168 C CB . LEU A 1 153 ? -1.008 30.134 -37.980 1.00 39.89 ? 154 LEU L CB 1 ATOM 1169 C CG . LEU A 1 153 ? -0.526 29.090 -36.967 1.00 51.70 ? 154 LEU L CG 1 ATOM 1170 C CD1 . LEU A 1 153 ? -0.042 29.756 -35.683 1.00 49.45 ? 154 LEU L CD1 1 ATOM 1171 C CD2 . LEU A 1 153 ? -1.612 28.062 -36.673 1.00 52.39 ? 154 LEU L CD2 1 ATOM 1172 N N . GLN A 1 154 ? 2.272 29.887 -38.762 1.00 23.99 ? 155 GLN L N 1 ATOM 1173 C CA . GLN A 1 154 ? 3.315 29.041 -39.324 1.00 26.20 ? 155 GLN L CA 1 ATOM 1174 C C . GLN A 1 154 ? 3.250 27.640 -38.744 1.00 29.99 ? 155 GLN L C 1 ATOM 1175 O O . GLN A 1 154 ? 2.857 27.450 -37.595 1.00 29.24 ? 155 GLN L O 1 ATOM 1176 C CB . GLN A 1 154 ? 4.696 29.646 -39.067 1.00 18.77 ? 155 GLN L CB 1 ATOM 1177 C CG . GLN A 1 154 ? 4.850 31.044 -39.625 1.00 20.55 ? 155 GLN L CG 1 ATOM 1178 C CD . GLN A 1 154 ? 4.723 31.077 -41.136 1.00 25.07 ? 155 GLN L CD 1 ATOM 1179 O OE1 . GLN A 1 154 ? 5.576 30.547 -41.847 1.00 26.41 ? 155 GLN L OE1 1 ATOM 1180 N NE2 . GLN A 1 154 ? 3.654 31.698 -41.635 1.00 21.77 ? 155 GLN L NE2 1 ATOM 1181 N N . SER A 1 155 ? 3.646 26.660 -39.546 1.00 29.69 ? 156 SER L N 1 ATOM 1182 C CA . SER A 1 155 ? 3.665 25.281 -39.100 1.00 31.80 ? 156 SER L CA 1 ATOM 1183 C C . SER A 1 155 ? 4.872 24.545 -39.672 1.00 29.98 ? 156 SER L C 1 ATOM 1184 O O . SER A 1 155 ? 5.156 24.639 -40.862 1.00 36.32 ? 156 SER L O 1 ATOM 1185 C CB . SER A 1 155 ? 2.369 24.579 -39.506 1.00 38.33 ? 156 SER L CB 1 ATOM 1186 O OG . SER A 1 155 ? 2.331 23.259 -38.998 1.00 47.73 ? 156 SER L OG 1 ATOM 1187 N N . GLY A 1 156 ? 5.591 23.829 -38.814 1.00 27.52 ? 157 GLY L N 1 ATOM 1188 C CA . GLY A 1 156 ? 6.661 22.957 -39.263 1.00 23.45 ? 157 GLY L CA 1 ATOM 1189 C C . GLY A 1 156 ? 7.998 23.611 -39.568 1.00 28.30 ? 157 GLY L C 1 ATOM 1190 O O . GLY A 1 156 ? 8.911 22.947 -40.055 1.00 34.58 ? 157 GLY L O 1 ATOM 1191 N N . ASN A 1 157 ? 8.130 24.904 -39.291 1.00 21.12 ? 158 ASN L N 1 ATOM 1192 C CA . ASN A 1 157 ? 9.406 25.574 -39.520 1.00 20.86 ? 158 ASN L CA 1 ATOM 1193 C C . ASN A 1 157 ? 9.967 26.261 -38.278 1.00 26.02 ? 158 ASN L C 1 ATOM 1194 O O . ASN A 1 157 ? 10.691 27.248 -38.379 1.00 28.27 ? 158 ASN L O 1 ATOM 1195 C CB . ASN A 1 157 ? 9.278 26.591 -40.655 1.00 24.02 ? 158 ASN L CB 1 ATOM 1196 C CG . ASN A 1 157 ? 8.089 27.513 -40.483 1.00 26.61 ? 158 ASN L CG 1 ATOM 1197 O OD1 . ASN A 1 157 ? 7.397 27.470 -39.468 1.00 25.16 ? 158 ASN L OD1 1 ATOM 1198 N ND2 . ASN A 1 157 ? 7.845 28.357 -41.481 1.00 24.72 ? 158 ASN L ND2 1 ATOM 1199 N N . SER A 1 158 ? 9.647 25.727 -37.106 1.00 21.55 ? 159 SER L N 1 ATOM 1200 C CA . SER A 1 158 ? 10.190 26.274 -35.874 1.00 19.72 ? 159 SER L CA 1 ATOM 1201 C C . SER A 1 158 ? 10.600 25.164 -34.921 1.00 24.64 ? 159 SER L C 1 ATOM 1202 O O . SER A 1 158 ? 10.036 24.076 -34.951 1.00 25.94 ? 159 SER L O 1 ATOM 1203 C CB . SER A 1 158 ? 9.173 27.197 -35.200 1.00 18.41 ? 159 SER L CB 1 ATOM 1204 O OG . SER A 1 158 ? 8.071 26.466 -34.686 1.00 26.22 ? 159 SER L OG 1 ATOM 1205 N N . GLN A 1 159 ? 11.591 25.443 -34.083 1.00 26.10 ? 160 GLN L N 1 ATOM 1206 C CA . GLN A 1 159 ? 11.996 24.512 -33.038 1.00 20.64 ? 160 GLN L CA 1 ATOM 1207 C C . GLN A 1 159 ? 12.078 25.225 -31.696 1.00 24.76 ? 160 GLN L C 1 ATOM 1208 O O . GLN A 1 159 ? 12.466 26.396 -31.622 1.00 24.02 ? 160 GLN L O 1 ATOM 1209 C CB . GLN A 1 159 ? 13.341 23.863 -33.371 1.00 20.64 ? 160 GLN L CB 1 ATOM 1210 C CG . GLN A 1 159 ? 13.269 22.831 -34.481 1.00 21.28 ? 160 GLN L CG 1 ATOM 1211 C CD . GLN A 1 159 ? 14.591 22.105 -34.689 1.00 30.90 ? 160 GLN L CD 1 ATOM 1212 O OE1 . GLN A 1 159 ? 15.565 22.687 -35.172 1.00 29.63 ? 160 GLN L OE1 1 ATOM 1213 N NE2 . GLN A 1 159 ? 14.629 20.828 -34.325 1.00 25.52 ? 160 GLN L NE2 1 ATOM 1214 N N . GLU A 1 160 ? 11.700 24.513 -30.642 1.00 23.69 ? 161 GLU L N 1 ATOM 1215 C CA . GLU A 1 160 ? 11.765 25.039 -29.286 1.00 27.50 ? 161 GLU L CA 1 ATOM 1216 C C . GLU A 1 160 ? 12.868 24.377 -28.473 1.00 27.68 ? 161 GLU L C 1 ATOM 1217 O O . GLU A 1 160 ? 13.234 23.232 -28.719 1.00 20.21 ? 161 GLU L O 1 ATOM 1218 C CB . GLU A 1 160 ? 10.435 24.841 -28.559 1.00 25.83 ? 161 GLU L CB 1 ATOM 1219 C CG . GLU A 1 160 ? 9.259 25.527 -29.196 1.00 36.45 ? 161 GLU L CG 1 ATOM 1220 C CD . GLU A 1 160 ? 8.013 25.408 -28.346 1.00 45.51 ? 161 GLU L CD 1 ATOM 1221 O OE1 . GLU A 1 160 ? 8.006 24.561 -27.429 1.00 48.38 ? 161 GLU L OE1 1 ATOM 1222 O OE2 . GLU A 1 160 ? 7.045 26.162 -28.585 1.00 51.20 ? 161 GLU L OE2 1 ATOM 1223 N N . SER A 1 161 ? 13.375 25.107 -27.489 1.00 23.79 ? 162 SER L N 1 ATOM 1224 C CA . SER A 1 161 ? 14.317 24.564 -26.523 1.00 20.17 ? 162 SER L CA 1 ATOM 1225 C C . SER A 1 161 ? 13.953 25.122 -25.151 1.00 21.93 ? 162 SER L C 1 ATOM 1226 O O . SER A 1 161 ? 13.689 26.316 -25.014 1.00 29.43 ? 162 SER L O 1 ATOM 1227 C CB . SER A 1 161 ? 15.758 24.919 -26.905 1.00 27.86 ? 162 SER L CB 1 ATOM 1228 O OG . SER A 1 161 ? 16.684 24.413 -25.955 1.00 34.74 ? 162 SER L OG 1 ATOM 1229 N N . VAL A 1 162 ? 13.913 24.260 -24.142 1.00 22.65 ? 163 VAL L N 1 ATOM 1230 C CA . VAL A 1 162 ? 13.538 24.681 -22.796 1.00 23.85 ? 163 VAL L CA 1 ATOM 1231 C C . VAL A 1 162 ? 14.668 24.384 -21.813 1.00 24.58 ? 163 VAL L C 1 ATOM 1232 O O . VAL A 1 162 ? 15.276 23.320 -21.883 1.00 23.85 ? 163 VAL L O 1 ATOM 1233 C CB . VAL A 1 162 ? 12.248 23.972 -22.324 1.00 26.78 ? 163 VAL L CB 1 ATOM 1234 C CG1 . VAL A 1 162 ? 11.722 24.611 -21.047 1.00 24.52 ? 163 VAL L CG1 1 ATOM 1235 C CG2 . VAL A 1 162 ? 11.187 24.008 -23.409 1.00 25.77 ? 163 VAL L CG2 1 ATOM 1236 N N . THR A 1 163 ? 14.956 25.315 -20.904 1.00 18.20 ? 164 THR L N 1 ATOM 1237 C CA . THR A 1 163 ? 15.983 25.081 -19.885 1.00 23.36 ? 164 THR L CA 1 ATOM 1238 C C . THR A 1 163 ? 15.460 24.186 -18.768 1.00 24.08 ? 164 THR L C 1 ATOM 1239 O O . THR A 1 163 ? 14.253 24.069 -18.578 1.00 21.77 ? 164 THR L O 1 ATOM 1240 C CB . THR A 1 163 ? 16.473 26.386 -19.236 1.00 25.09 ? 164 THR L CB 1 ATOM 1241 O OG1 . THR A 1 163 ? 15.368 27.026 -18.588 1.00 27.45 ? 164 THR L OG1 1 ATOM 1242 C CG2 . THR A 1 163 ? 17.081 27.324 -20.272 1.00 25.08 ? 164 THR L CG2 1 ATOM 1243 N N . GLU A 1 164 ? 16.367 23.565 -18.020 1.00 24.14 ? 165 GLU L N 1 ATOM 1244 C CA . GLU A 1 164 ? 15.963 22.871 -16.806 1.00 26.76 ? 165 GLU L CA 1 ATOM 1245 C C . GLU A 1 164 ? 15.523 23.926 -15.799 1.00 27.97 ? 165 GLU L C 1 ATOM 1246 O O . GLU A 1 164 ? 15.838 25.107 -15.955 1.00 26.79 ? 165 GLU L O 1 ATOM 1247 C CB . GLU A 1 164 ? 17.102 22.015 -16.238 1.00 24.89 ? 165 GLU L CB 1 ATOM 1248 C CG . GLU A 1 164 ? 17.590 20.882 -17.147 1.00 36.00 ? 165 GLU L CG 1 ATOM 1249 C CD . GLU A 1 164 ? 16.611 19.711 -17.256 1.00 55.56 ? 165 GLU L CD 1 ATOM 1250 O OE1 . GLU A 1 164 ? 15.506 19.777 -16.676 1.00 62.70 ? 165 GLU L OE1 1 ATOM 1251 O OE2 . GLU A 1 164 ? 16.955 18.715 -17.928 1.00 64.54 ? 165 GLU L OE2 1 ATOM 1252 N N . GLN A 1 165 ? 14.784 23.511 -14.778 1.00 25.86 ? 166 GLN L N 1 ATOM 1253 C CA . GLN A 1 165 ? 14.368 24.439 -13.737 1.00 23.19 ? 166 GLN L CA 1 ATOM 1254 C C . GLN A 1 165 ? 15.582 25.119 -13.125 1.00 23.62 ? 166 GLN L C 1 ATOM 1255 O O . GLN A 1 165 ? 16.559 24.460 -12.777 1.00 38.26 ? 166 GLN L O 1 ATOM 1256 C CB . GLN A 1 165 ? 13.565 23.720 -12.656 1.00 29.17 ? 166 GLN L CB 1 ATOM 1257 C CG . GLN A 1 165 ? 12.094 24.065 -12.659 1.00 28.89 ? 166 GLN L CG 1 ATOM 1258 C CD . GLN A 1 165 ? 11.338 23.437 -11.509 1.00 28.40 ? 166 GLN L CD 1 ATOM 1259 O OE1 . GLN A 1 165 ? 11.645 22.323 -11.081 1.00 27.66 ? 166 GLN L OE1 1 ATOM 1260 N NE2 . GLN A 1 165 ? 10.345 24.155 -10.993 1.00 22.54 ? 166 GLN L NE2 1 ATOM 1261 N N . ASP A 1 166 ? 15.525 26.443 -13.032 1.00 25.33 ? 167 ASP L N 1 ATOM 1262 C CA . ASP A 1 166 ? 16.585 27.212 -12.397 1.00 26.20 ? 167 ASP L CA 1 ATOM 1263 C C . ASP A 1 166 ? 16.739 26.748 -10.949 1.00 33.36 ? 167 ASP L C 1 ATOM 1264 O O . ASP A 1 166 ? 15.749 26.582 -10.235 1.00 35.68 ? 167 ASP L O 1 ATOM 1265 C CB . ASP A 1 166 ? 16.277 28.710 -12.470 1.00 33.64 ? 167 ASP L CB 1 ATOM 1266 C CG . ASP A 1 166 ? 17.342 29.562 -11.804 1.00 45.64 ? 167 ASP L CG 1 ATOM 1267 O OD1 . ASP A 1 166 ? 18.312 29.951 -12.493 1.00 56.64 ? 167 ASP L OD1 1 ATOM 1268 O OD2 . ASP A 1 166 ? 17.204 29.847 -10.594 1.00 41.62 ? 167 ASP L OD2 1 ATOM 1269 N N . SER A 1 167 ? 17.979 26.531 -10.522 1.00 38.23 ? 168 SER L N 1 ATOM 1270 C CA . SER A 1 167 ? 18.247 25.956 -9.204 1.00 43.07 ? 168 SER L CA 1 ATOM 1271 C C . SER A 1 167 ? 17.886 26.886 -8.043 1.00 42.09 ? 168 SER L C 1 ATOM 1272 O O . SER A 1 167 ? 17.828 26.445 -6.896 1.00 45.77 ? 168 SER L O 1 ATOM 1273 C CB . SER A 1 167 ? 19.720 25.550 -9.094 1.00 40.88 ? 168 SER L CB 1 ATOM 1274 O OG . SER A 1 167 ? 20.570 26.668 -9.267 1.00 35.50 ? 168 SER L OG 1 ATOM 1275 N N . LYS A 1 168 ? 17.637 28.161 -8.331 1.00 41.29 ? 169 LYS L N 1 ATOM 1276 C CA . LYS A 1 168 ? 17.279 29.108 -7.276 1.00 43.36 ? 169 LYS L CA 1 ATOM 1277 C C . LYS A 1 168 ? 15.793 29.485 -7.286 1.00 44.26 ? 169 LYS L C 1 ATOM 1278 O O . LYS A 1 168 ? 15.099 29.286 -6.284 1.00 40.08 ? 169 LYS L O 1 ATOM 1279 C CB . LYS A 1 168 ? 18.135 30.373 -7.380 1.00 47.96 ? 169 LYS L CB 1 ATOM 1280 C CG . LYS A 1 168 ? 19.524 30.252 -6.762 1.00 52.78 ? 169 LYS L CG 1 ATOM 1281 C CD . LYS A 1 168 ? 20.385 31.461 -7.120 1.00 60.65 ? 169 LYS L CD 1 ATOM 1282 C CE . LYS A 1 168 ? 21.697 31.489 -6.342 1.00 71.79 ? 169 LYS L CE 1 ATOM 1283 N NZ . LYS A 1 168 ? 21.521 31.973 -4.940 1.00 75.11 ? 169 LYS L NZ 1 ATOM 1284 N N . ASP A 1 169 ? 15.301 30.028 -8.403 1.00 35.31 ? 170 ASP L N 1 ATOM 1285 C CA . ASP A 1 169 ? 13.916 30.511 -8.446 1.00 31.16 ? 170 ASP L CA 1 ATOM 1286 C C . ASP A 1 169 ? 12.928 29.511 -9.057 1.00 28.22 ? 170 ASP L C 1 ATOM 1287 O O . ASP A 1 169 ? 11.721 29.773 -9.098 1.00 26.93 ? 170 ASP L O 1 ATOM 1288 C CB . ASP A 1 169 ? 13.830 31.852 -9.195 1.00 29.18 ? 170 ASP L CB 1 ATOM 1289 C CG . ASP A 1 169 ? 14.302 31.766 -10.642 1.00 41.93 ? 170 ASP L CG 1 ATOM 1290 O OD1 . ASP A 1 169 ? 14.044 30.752 -11.325 1.00 40.64 ? 170 ASP L OD1 1 ATOM 1291 O OD2 . ASP A 1 169 ? 14.930 32.740 -11.106 1.00 50.87 ? 170 ASP L OD2 1 ATOM 1292 N N . SER A 1 170 ? 13.447 28.384 -9.540 1.00 22.21 ? 171 SER L N 1 ATOM 1293 C CA . SER A 1 170 ? 12.622 27.293 -10.051 1.00 20.66 ? 171 SER L CA 1 ATOM 1294 C C . SER A 1 170 ? 11.757 27.672 -11.250 1.00 24.43 ? 171 SER L C 1 ATOM 1295 O O . SER A 1 170 ? 10.707 27.071 -11.466 1.00 25.29 ? 171 SER L O 1 ATOM 1296 C CB . SER A 1 170 ? 11.724 26.750 -8.936 1.00 16.44 ? 171 SER L CB 1 ATOM 1297 O OG . SER A 1 170 ? 12.504 26.338 -7.832 1.00 31.93 ? 171 SER L OG 1 ATOM 1298 N N . THR A 1 171 ? 12.184 28.663 -12.027 1.00 15.87 ? 172 THR L N 1 ATOM 1299 C CA . THR A 1 171 ? 11.443 29.034 -13.225 1.00 21.92 ? 172 THR L CA 1 ATOM 1300 C C . THR A 1 171 ? 12.034 28.375 -14.464 1.00 23.06 ? 172 THR L C 1 ATOM 1301 O O . THR A 1 171 ? 13.109 27.773 -14.413 1.00 18.34 ? 172 THR L O 1 ATOM 1302 C CB . THR A 1 171 ? 11.430 30.554 -13.445 1.00 27.33 ? 172 THR L CB 1 ATOM 1303 O OG1 . THR A 1 171 ? 12.771 31.010 -13.654 1.00 34.76 ? 172 THR L OG1 1 ATOM 1304 C CG2 . THR A 1 171 ? 10.827 31.267 -12.241 1.00 17.37 ? 172 THR L CG2 1 ATOM 1305 N N . TYR A 1 172 ? 11.320 28.504 -15.574 1.00 21.86 ? 173 TYR L N 1 ATOM 1306 C CA . TYR A 1 172 ? 11.788 28.013 -16.860 1.00 24.62 ? 173 TYR L CA 1 ATOM 1307 C C . TYR A 1 172 ? 12.025 29.169 -17.808 1.00 23.19 ? 173 TYR L C 1 ATOM 1308 O O . TYR A 1 172 ? 11.445 30.240 -17.648 1.00 22.59 ? 173 TYR L O 1 ATOM 1309 C CB . TYR A 1 172 ? 10.773 27.053 -17.481 1.00 20.53 ? 173 TYR L CB 1 ATOM 1310 C CG . TYR A 1 172 ? 10.531 25.813 -16.666 1.00 22.46 ? 173 TYR L CG 1 ATOM 1311 C CD1 . TYR A 1 172 ? 9.585 25.802 -15.652 1.00 18.00 ? 173 TYR L CD1 1 ATOM 1312 C CD2 . TYR A 1 172 ? 11.244 24.645 -16.914 1.00 26.61 ? 173 TYR L CD2 1 ATOM 1313 C CE1 . TYR A 1 172 ? 9.357 24.668 -14.907 1.00 26.46 ? 173 TYR L CE1 1 ATOM 1314 C CE2 . TYR A 1 172 ? 11.025 23.505 -16.174 1.00 23.94 ? 173 TYR L CE2 1 ATOM 1315 C CZ . TYR A 1 172 ? 10.076 23.519 -15.176 1.00 27.56 ? 173 TYR L CZ 1 ATOM 1316 O OH . TYR A 1 172 ? 9.855 22.386 -14.435 1.00 27.83 ? 173 TYR L OH 1 ATOM 1317 N N . SER A 1 173 ? 12.883 28.947 -18.793 1.00 22.62 ? 174 SER L N 1 ATOM 1318 C CA . SER A 1 173 ? 12.975 29.847 -19.931 1.00 20.11 ? 174 SER L CA 1 ATOM 1319 C C . SER A 1 173 ? 12.876 29.024 -21.204 1.00 23.14 ? 174 SER L C 1 ATOM 1320 O O . SER A 1 173 ? 13.235 27.847 -21.222 1.00 23.45 ? 174 SER L O 1 ATOM 1321 C CB . SER A 1 173 ? 14.267 30.656 -19.894 1.00 14.59 ? 174 SER L CB 1 ATOM 1322 O OG . SER A 1 173 ? 14.203 31.623 -18.860 1.00 24.04 ? 174 SER L OG 1 ATOM 1323 N N . LEU A 1 174 ? 12.361 29.638 -22.261 1.00 24.99 ? 175 LEU L N 1 ATOM 1324 C CA . LEU A 1 174 ? 12.073 28.915 -23.491 1.00 22.33 ? 175 LEU L CA 1 ATOM 1325 C C . LEU A 1 174 ? 12.430 29.767 -24.693 1.00 25.89 ? 175 LEU L C 1 ATOM 1326 O O . LEU A 1 174 ? 12.120 30.961 -24.738 1.00 24.21 ? 175 LEU L O 1 ATOM 1327 C CB . LEU A 1 174 ? 10.594 28.506 -23.550 1.00 20.59 ? 175 LEU L CB 1 ATOM 1328 C CG . LEU A 1 174 ? 10.116 27.600 -24.694 1.00 28.97 ? 175 LEU L CG 1 ATOM 1329 C CD1 . LEU A 1 174 ? 8.921 26.758 -24.251 1.00 23.75 ? 175 LEU L CD1 1 ATOM 1330 C CD2 . LEU A 1 174 ? 9.756 28.401 -25.940 1.00 25.19 ? 175 LEU L CD2 1 ATOM 1331 N N . SER A 1 175 ? 13.083 29.147 -25.667 1.00 21.55 ? 176 SER L N 1 ATOM 1332 C CA . SER A 1 175 ? 13.334 29.812 -26.935 1.00 25.20 ? 176 SER L CA 1 ATOM 1333 C C . SER A 1 175 ? 12.579 29.090 -28.037 1.00 22.33 ? 176 SER L C 1 ATOM 1334 O O . SER A 1 175 ? 12.522 27.865 -28.065 1.00 22.98 ? 176 SER L O 1 ATOM 1335 C CB . SER A 1 175 ? 14.827 29.842 -27.257 1.00 20.32 ? 176 SER L CB 1 ATOM 1336 O OG . SER A 1 175 ? 15.271 28.544 -27.618 1.00 26.79 ? 176 SER L OG 1 ATOM 1337 N N . SER A 1 176 ? 11.979 29.862 -28.927 1.00 14.58 ? 177 SER L N 1 ATOM 1338 C CA . SER A 1 176 ? 11.411 29.321 -30.144 1.00 17.10 ? 177 SER L CA 1 ATOM 1339 C C . SER A 1 176 ? 12.093 30.005 -31.314 1.00 25.75 ? 177 SER L C 1 ATOM 1340 O O . SER A 1 176 ? 12.146 31.235 -31.380 1.00 24.60 ? 177 SER L O 1 ATOM 1341 C CB . SER A 1 176 ? 9.899 29.528 -30.201 1.00 13.01 ? 177 SER L CB 1 ATOM 1342 O OG . SER A 1 176 ? 9.382 29.059 -31.436 1.00 22.55 ? 177 SER L OG 1 ATOM 1343 N N . THR A 1 177 ? 12.623 29.203 -32.229 1.00 21.65 ? 178 THR L N 1 ATOM 1344 C CA . THR A 1 177 ? 13.362 29.729 -33.362 1.00 20.78 ? 178 THR L CA 1 ATOM 1345 C C . THR A 1 177 ? 12.641 29.395 -34.647 1.00 19.99 ? 178 THR L C 1 ATOM 1346 O O . THR A 1 177 ? 12.410 28.232 -34.945 1.00 18.92 ? 178 THR L O 1 ATOM 1347 C CB . THR A 1 177 ? 14.790 29.167 -33.415 1.00 19.94 ? 178 THR L CB 1 ATOM 1348 O OG1 . THR A 1 177 ? 15.418 29.348 -32.142 1.00 23.59 ? 178 THR L OG1 1 ATOM 1349 C CG2 . THR A 1 177 ? 15.602 29.878 -34.479 1.00 21.83 ? 178 THR L CG2 1 ATOM 1350 N N . LEU A 1 178 ? 12.267 30.429 -35.390 1.00 24.79 ? 179 LEU L N 1 ATOM 1351 C CA . LEU A 1 178 ? 11.655 30.259 -36.698 1.00 23.93 ? 179 LEU L CA 1 ATOM 1352 C C . LEU A 1 178 ? 12.738 30.341 -37.762 1.00 21.95 ? 179 LEU L C 1 ATOM 1353 O O . LEU A 1 178 ? 13.501 31.308 -37.807 1.00 23.79 ? 179 LEU L O 1 ATOM 1354 C CB . LEU A 1 178 ? 10.581 31.322 -36.933 1.00 26.23 ? 179 LEU L CB 1 ATOM 1355 C CG . LEU A 1 178 ? 9.883 31.377 -38.293 1.00 28.59 ? 179 LEU L CG 1 ATOM 1356 C CD1 . LEU A 1 178 ? 8.882 30.246 -38.449 1.00 24.85 ? 179 LEU L CD1 1 ATOM 1357 C CD2 . LEU A 1 178 ? 9.205 32.724 -38.477 1.00 20.25 ? 179 LEU L CD2 1 ATOM 1358 N N . THR A 1 179 ? 12.822 29.323 -38.610 1.00 18.73 ? 180 THR L N 1 ATOM 1359 C CA . THR A 1 179 ? 13.857 29.300 -39.632 1.00 23.25 ? 180 THR L CA 1 ATOM 1360 C C . THR A 1 179 ? 13.259 29.451 -41.021 1.00 23.03 ? 180 THR L C 1 ATOM 1361 O O . THR A 1 179 ? 12.424 28.655 -41.431 1.00 27.19 ? 180 THR L O 1 ATOM 1362 C CB . THR A 1 179 ? 14.684 28.000 -39.576 1.00 32.41 ? 180 THR L CB 1 ATOM 1363 O OG1 . THR A 1 179 ? 15.225 27.835 -38.261 1.00 32.59 ? 180 THR L OG1 1 ATOM 1364 C CG2 . THR A 1 179 ? 15.831 28.056 -40.581 1.00 29.97 ? 180 THR L CG2 1 ATOM 1365 N N . LEU A 1 180 ? 13.688 30.485 -41.735 1.00 24.92 ? 181 LEU L N 1 ATOM 1366 C CA . LEU A 1 180 ? 13.238 30.717 -43.103 1.00 17.51 ? 181 LEU L CA 1 ATOM 1367 C C . LEU A 1 180 ? 14.428 30.892 -44.029 1.00 15.51 ? 181 LEU L C 1 ATOM 1368 O O . LEU A 1 180 ? 15.520 31.244 -43.587 1.00 24.14 ? 181 LEU L O 1 ATOM 1369 C CB . LEU A 1 180 ? 12.349 31.958 -43.186 1.00 24.77 ? 181 LEU L CB 1 ATOM 1370 C CG . LEU A 1 180 ? 11.213 32.105 -42.175 1.00 34.50 ? 181 LEU L CG 1 ATOM 1371 C CD1 . LEU A 1 180 ? 10.554 33.461 -42.341 1.00 38.07 ? 181 LEU L CD1 1 ATOM 1372 C CD2 . LEU A 1 180 ? 10.202 30.986 -42.342 1.00 32.60 ? 181 LEU L CD2 1 ATOM 1373 N N . SER A 1 181 ? 14.215 30.651 -45.317 1.00 19.18 ? 182 SER L N 1 ATOM 1374 C CA . SER A 1 181 ? 15.209 31.005 -46.318 1.00 23.25 ? 182 SER L CA 1 ATOM 1375 C C . SER A 1 181 ? 15.267 32.528 -46.437 1.00 26.11 ? 182 SER L C 1 ATOM 1376 O O . SER A 1 181 ? 14.308 33.219 -46.079 1.00 19.31 ? 182 SER L O 1 ATOM 1377 C CB . SER A 1 181 ? 14.871 30.378 -47.669 1.00 23.59 ? 182 SER L CB 1 ATOM 1378 O OG . SER A 1 181 ? 13.700 30.967 -48.215 1.00 24.47 ? 182 SER L OG 1 ATOM 1379 N N . LYS A 1 182 ? 16.386 33.046 -46.940 1.00 19.97 ? 183 LYS L N 1 ATOM 1380 C CA . LYS A 1 182 ? 16.541 34.482 -47.145 1.00 23.83 ? 183 LYS L CA 1 ATOM 1381 C C . LYS A 1 182 ? 15.439 35.050 -48.044 1.00 23.83 ? 183 LYS L C 1 ATOM 1382 O O . LYS A 1 182 ? 14.851 36.083 -47.732 1.00 26.42 ? 183 LYS L O 1 ATOM 1383 C CB . LYS A 1 182 ? 17.918 34.787 -47.741 1.00 29.32 ? 183 LYS L CB 1 ATOM 1384 C CG . LYS A 1 182 ? 18.121 36.239 -48.161 1.00 25.44 ? 183 LYS L CG 1 ATOM 1385 C CD . LYS A 1 182 ? 19.476 36.415 -48.826 1.00 33.46 ? 183 LYS L CD 1 ATOM 1386 C CE . LYS A 1 182 ? 19.686 37.829 -49.349 1.00 36.30 ? 183 LYS L CE 1 ATOM 1387 N NZ . LYS A 1 182 ? 20.924 37.915 -50.185 1.00 34.51 ? 183 LYS L NZ 1 ATOM 1388 N N . ALA A 1 183 ? 15.152 34.367 -49.149 1.00 19.52 ? 184 ALA L N 1 ATOM 1389 C CA . ALA A 1 183 ? 14.130 34.832 -50.086 1.00 24.24 ? 184 ALA L CA 1 ATOM 1390 C C . ALA A 1 183 ? 12.765 34.917 -49.411 1.00 24.24 ? 184 ALA L C 1 ATOM 1391 O O . ALA A 1 183 ? 12.050 35.906 -49.553 1.00 27.63 ? 184 ALA L O 1 ATOM 1392 C CB . ALA A 1 183 ? 14.065 33.914 -51.298 1.00 17.31 ? 184 ALA L CB 1 ATOM 1393 N N . ASP A 1 184 ? 12.419 33.872 -48.668 1.00 20.86 ? 185 ASP L N 1 ATOM 1394 C CA . ASP A 1 184 ? 11.150 33.816 -47.954 1.00 20.00 ? 185 ASP L CA 1 ATOM 1395 C C . ASP A 1 184 ? 11.042 34.930 -46.914 1.00 29.16 ? 185 ASP L C 1 ATOM 1396 O O . ASP A 1 184 ? 10.015 35.598 -46.812 1.00 28.61 ? 185 ASP L O 1 ATOM 1397 C CB . ASP A 1 184 ? 10.985 32.454 -47.280 1.00 20.27 ? 185 ASP L CB 1 ATOM 1398 C CG . ASP A 1 184 ? 9.546 32.146 -46.915 1.00 42.03 ? 185 ASP L CG 1 ATOM 1399 O OD1 . ASP A 1 184 ? 8.683 33.041 -47.034 1.00 49.40 ? 185 ASP L OD1 1 ATOM 1400 O OD2 . ASP A 1 184 ? 9.277 31.000 -46.499 1.00 53.52 ? 185 ASP L OD2 1 ATOM 1401 N N . TYR A 1 185 ? 12.101 35.122 -46.135 1.00 26.64 ? 186 TYR L N 1 ATOM 1402 C CA . TYR A 1 185 ? 12.088 36.161 -45.118 1.00 24.40 ? 186 TYR L CA 1 ATOM 1403 C C . TYR A 1 185 ? 11.856 37.523 -45.765 1.00 25.23 ? 186 TYR L C 1 ATOM 1404 O O . TYR A 1 185 ? 11.045 38.316 -45.290 1.00 25.01 ? 186 TYR L O 1 ATOM 1405 C CB . TYR A 1 185 ? 13.392 36.162 -44.311 1.00 18.38 ? 186 TYR L CB 1 ATOM 1406 C CG . TYR A 1 185 ? 13.495 37.310 -43.323 1.00 24.21 ? 186 TYR L CG 1 ATOM 1407 C CD1 . TYR A 1 185 ? 12.779 37.293 -42.131 1.00 22.48 ? 186 TYR L CD1 1 ATOM 1408 C CD2 . TYR A 1 185 ? 14.308 38.411 -43.585 1.00 21.20 ? 186 TYR L CD2 1 ATOM 1409 C CE1 . TYR A 1 185 ? 12.867 38.344 -41.226 1.00 19.94 ? 186 TYR L CE1 1 ATOM 1410 C CE2 . TYR A 1 185 ? 14.403 39.466 -42.685 1.00 22.90 ? 186 TYR L CE2 1 ATOM 1411 C CZ . TYR A 1 185 ? 13.678 39.429 -41.511 1.00 23.63 ? 186 TYR L CZ 1 ATOM 1412 O OH . TYR A 1 185 ? 13.770 40.477 -40.619 1.00 26.17 ? 186 TYR L OH 1 ATOM 1413 N N . GLU A 1 186 ? 12.536 37.777 -46.873 1.00 22.67 ? 187 GLU L N 1 ATOM 1414 C CA . GLU A 1 186 ? 12.480 39.094 -47.490 1.00 26.03 ? 187 GLU L CA 1 ATOM 1415 C C . GLU A 1 186 ? 11.235 39.351 -48.339 1.00 28.37 ? 187 GLU L C 1 ATOM 1416 O O . GLU A 1 186 ? 11.077 40.444 -48.868 1.00 32.41 ? 187 GLU L O 1 ATOM 1417 C CB . GLU A 1 186 ? 13.736 39.321 -48.329 1.00 29.15 ? 187 GLU L CB 1 ATOM 1418 C CG . GLU A 1 186 ? 14.904 39.819 -47.491 1.00 41.93 ? 187 GLU L CG 1 ATOM 1419 C CD . GLU A 1 186 ? 16.223 39.791 -48.230 1.00 66.73 ? 187 GLU L CD 1 ATOM 1420 O OE1 . GLU A 1 186 ? 16.231 39.463 -49.438 1.00 70.08 ? 187 GLU L OE1 1 ATOM 1421 O OE2 . GLU A 1 186 ? 17.254 40.097 -47.592 1.00 79.38 ? 187 GLU L OE2 1 ATOM 1422 N N . LYS A 1 187 ? 10.340 38.376 -48.469 1.00 26.34 ? 188 LYS L N 1 ATOM 1423 C CA . LYS A 1 187 ? 9.101 38.650 -49.192 1.00 30.37 ? 188 LYS L CA 1 ATOM 1424 C C . LYS A 1 187 ? 7.940 38.936 -48.236 1.00 24.38 ? 188 LYS L C 1 ATOM 1425 O O . LYS A 1 187 ? 6.809 39.133 -48.667 1.00 28.11 ? 188 LYS L O 1 ATOM 1426 C CB . LYS A 1 187 ? 8.745 37.500 -50.145 1.00 31.92 ? 188 LYS L CB 1 ATOM 1427 C CG . LYS A 1 187 ? 8.592 36.144 -49.509 1.00 43.95 ? 188 LYS L CG 1 ATOM 1428 C CD . LYS A 1 187 ? 8.126 35.115 -50.535 1.00 51.60 ? 188 LYS L CD 1 ATOM 1429 C CE . LYS A 1 187 ? 9.001 35.129 -51.780 1.00 55.42 ? 188 LYS L CE 1 ATOM 1430 N NZ . LYS A 1 187 ? 8.582 34.089 -52.762 1.00 59.40 ? 188 LYS L NZ 1 ATOM 1431 N N . HIS A 1 188 ? 8.227 38.994 -46.941 1.00 19.73 ? 189 HIS L N 1 ATOM 1432 C CA . HIS A 1 188 ? 7.187 39.305 -45.966 1.00 22.09 ? 189 HIS L CA 1 ATOM 1433 C C . HIS A 1 188 ? 7.574 40.487 -45.080 1.00 25.94 ? 189 HIS L C 1 ATOM 1434 O O . HIS A 1 188 ? 8.748 40.849 -44.986 1.00 26.05 ? 189 HIS L O 1 ATOM 1435 C CB . HIS A 1 188 ? 6.877 38.072 -45.119 1.00 20.47 ? 189 HIS L CB 1 ATOM 1436 C CG . HIS A 1 188 ? 6.299 36.943 -45.912 1.00 27.77 ? 189 HIS L CG 1 ATOM 1437 N ND1 . HIS A 1 188 ? 5.033 36.991 -46.454 1.00 27.62 ? 189 HIS L ND1 1 ATOM 1438 C CD2 . HIS A 1 188 ? 6.824 35.751 -46.282 1.00 30.01 ? 189 HIS L CD2 1 ATOM 1439 C CE1 . HIS A 1 188 ? 4.798 35.873 -47.118 1.00 29.45 ? 189 HIS L CE1 1 ATOM 1440 N NE2 . HIS A 1 188 ? 5.867 35.104 -47.028 1.00 31.91 ? 189 HIS L NE2 1 ATOM 1441 N N . LYS A 1 189 ? 6.578 41.082 -44.431 1.00 27.83 ? 190 LYS L N 1 ATOM 1442 C CA . LYS A 1 189 ? 6.787 42.307 -43.673 1.00 25.66 ? 190 LYS L CA 1 ATOM 1443 C C . LYS A 1 189 ? 6.674 42.110 -42.159 1.00 27.62 ? 190 LYS L C 1 ATOM 1444 O O . LYS A 1 189 ? 7.588 42.467 -41.416 1.00 35.55 ? 190 LYS L O 1 ATOM 1445 C CB . LYS A 1 189 ? 5.794 43.379 -44.128 1.00 26.45 ? 190 LYS L CB 1 ATOM 1446 C CG . LYS A 1 189 ? 5.932 44.698 -43.372 1.00 44.21 ? 190 LYS L CG 1 ATOM 1447 C CD . LYS A 1 189 ? 4.721 45.602 -43.593 1.00 58.73 ? 190 LYS L CD 1 ATOM 1448 C CE . LYS A 1 189 ? 4.728 46.798 -42.647 1.00 64.05 ? 190 LYS L CE 1 ATOM 1449 N NZ . LYS A 1 189 ? 5.917 47.671 -42.853 1.00 75.12 ? 190 LYS L NZ 1 ATOM 1450 N N . VAL A 1 190 ? 5.558 41.550 -41.701 1.00 22.74 ? 191 VAL L N 1 ATOM 1451 C CA . VAL A 1 190 ? 5.294 41.456 -40.264 1.00 22.20 ? 191 VAL L CA 1 ATOM 1452 C C . VAL A 1 190 ? 5.646 40.093 -39.675 1.00 21.50 ? 191 VAL L C 1 ATOM 1453 O O . VAL A 1 190 ? 5.153 39.061 -40.124 1.00 22.64 ? 191 VAL L O 1 ATOM 1454 C CB . VAL A 1 190 ? 3.813 41.746 -39.941 1.00 23.66 ? 191 VAL L CB 1 ATOM 1455 C CG1 . VAL A 1 190 ? 3.576 41.702 -38.437 1.00 19.82 ? 191 VAL L CG1 1 ATOM 1456 C CG2 . VAL A 1 190 ? 3.393 43.092 -40.508 1.00 23.70 ? 191 VAL L CG2 1 ATOM 1457 N N . TYR A 1 191 ? 6.483 40.105 -38.645 1.00 18.25 ? 192 TYR L N 1 ATOM 1458 C CA . TYR A 1 191 ? 6.859 38.887 -37.946 1.00 20.86 ? 192 TYR L CA 1 ATOM 1459 C C . TYR A 1 191 ? 6.422 38.983 -36.500 1.00 26.61 ? 192 TYR L C 1 ATOM 1460 O O . TYR A 1 191 ? 6.771 39.927 -35.803 1.00 27.56 ? 192 TYR L O 1 ATOM 1461 C CB . TYR A 1 191 ? 8.370 38.645 -38.058 1.00 16.46 ? 192 TYR L CB 1 ATOM 1462 C CG . TYR A 1 191 ? 8.750 38.307 -39.472 1.00 24.77 ? 192 TYR L CG 1 ATOM 1463 C CD1 . TYR A 1 191 ? 8.981 39.310 -40.408 1.00 22.85 ? 192 TYR L CD1 1 ATOM 1464 C CD2 . TYR A 1 191 ? 8.815 36.983 -39.893 1.00 19.47 ? 192 TYR L CD2 1 ATOM 1465 C CE1 . TYR A 1 191 ? 9.294 39.004 -41.716 1.00 22.14 ? 192 TYR L CE1 1 ATOM 1466 C CE2 . TYR A 1 191 ? 9.128 36.667 -41.198 1.00 22.03 ? 192 TYR L CE2 1 ATOM 1467 C CZ . TYR A 1 191 ? 9.363 37.683 -42.105 1.00 21.77 ? 192 TYR L CZ 1 ATOM 1468 O OH . TYR A 1 191 ? 9.678 37.374 -43.403 1.00 27.85 ? 192 TYR L OH 1 ATOM 1469 N N . ALA A 1 192 ? 5.656 38.001 -36.049 1.00 21.16 ? 193 ALA L N 1 ATOM 1470 C CA . ALA A 1 192 ? 5.105 38.041 -34.709 1.00 18.95 ? 193 ALA L CA 1 ATOM 1471 C C . ALA A 1 192 ? 5.189 36.682 -34.043 1.00 22.21 ? 193 ALA L C 1 ATOM 1472 O O . ALA A 1 192 ? 5.023 35.654 -34.698 1.00 22.92 ? 193 ALA L O 1 ATOM 1473 C CB . ALA A 1 192 ? 3.660 38.520 -34.753 1.00 20.88 ? 193 ALA L CB 1 ATOM 1474 N N . CYS A 1 193 ? 5.465 36.670 -32.745 1.00 18.90 ? 194 CYS L N 1 ATOM 1475 C CA . CYS A 1 193 ? 5.251 35.455 -31.981 1.00 21.45 ? 194 CYS L CA 1 ATOM 1476 C C . CYS A 1 193 ? 4.226 35.740 -30.889 1.00 23.20 ? 194 CYS L C 1 ATOM 1477 O O . CYS A 1 193 ? 4.267 36.779 -30.229 1.00 22.26 ? 194 CYS L O 1 ATOM 1478 C CB . CYS A 1 193 ? 6.562 34.901 -31.404 1.00 25.62 ? 194 CYS L CB 1 ATOM 1479 S SG . CYS A 1 193 ? 7.261 35.746 -29.994 1.00 48.41 ? 194 CYS L SG 1 ATOM 1480 N N . GLU A 1 194 ? 3.281 34.819 -30.743 1.00 20.94 ? 195 GLU L N 1 ATOM 1481 C CA . GLU A 1 194 ? 2.191 34.973 -29.796 1.00 26.17 ? 195 GLU L CA 1 ATOM 1482 C C . GLU A 1 194 ? 2.312 33.937 -28.698 1.00 29.27 ? 195 GLU L C 1 ATOM 1483 O O . GLU A 1 194 ? 2.398 32.739 -28.974 1.00 27.54 ? 195 GLU L O 1 ATOM 1484 C CB . GLU A 1 194 ? 0.841 34.839 -30.495 1.00 32.94 ? 195 GLU L CB 1 ATOM 1485 C CG . GLU A 1 194 ? -0.342 34.979 -29.555 1.00 40.79 ? 195 GLU L CG 1 ATOM 1486 C CD . GLU A 1 194 ? -1.677 34.861 -30.267 1.00 48.83 ? 195 GLU L CD 1 ATOM 1487 O OE1 . GLU A 1 194 ? -1.689 34.587 -31.487 1.00 44.24 ? 195 GLU L OE1 1 ATOM 1488 O OE2 . GLU A 1 194 ? -2.718 35.045 -29.602 1.00 56.38 ? 195 GLU L OE2 1 ATOM 1489 N N . VAL A 1 195 ? 2.312 34.400 -27.455 1.00 24.30 ? 196 VAL L N 1 ATOM 1490 C CA . VAL A 1 195 ? 2.552 33.516 -26.329 1.00 26.68 ? 196 VAL L CA 1 ATOM 1491 C C . VAL A 1 195 ? 1.327 33.377 -25.435 1.00 28.55 ? 196 VAL L C 1 ATOM 1492 O O . VAL A 1 195 ? 0.763 34.364 -24.965 1.00 24.92 ? 196 VAL L O 1 ATOM 1493 C CB . VAL A 1 195 ? 3.734 34.007 -25.483 1.00 22.96 ? 196 VAL L CB 1 ATOM 1494 C CG1 . VAL A 1 195 ? 3.918 33.110 -24.261 1.00 18.31 ? 196 VAL L CG1 1 ATOM 1495 C CG2 . VAL A 1 195 ? 4.997 34.040 -26.327 1.00 21.05 ? 196 VAL L CG2 1 ATOM 1496 N N . THR A 1 196 ? 0.926 32.133 -25.207 1.00 24.00 ? 197 THR L N 1 ATOM 1497 C CA . THR A 1 196 ? -0.156 31.832 -24.291 1.00 26.42 ? 197 THR L CA 1 ATOM 1498 C C . THR A 1 196 ? 0.413 31.104 -23.076 1.00 25.18 ? 197 THR L C 1 ATOM 1499 O O . THR A 1 196 ? 1.168 30.144 -23.210 1.00 25.67 ? 197 THR L O 1 ATOM 1500 C CB . THR A 1 196 ? -1.239 30.989 -24.972 1.00 27.65 ? 197 THR L CB 1 ATOM 1501 O OG1 . THR A 1 196 ? -1.766 31.720 -26.086 1.00 31.63 ? 197 THR L OG1 1 ATOM 1502 C CG2 . THR A 1 196 ? -2.365 30.667 -24.000 1.00 28.60 ? 197 THR L CG2 1 ATOM 1503 N N . HIS A 1 197 ? 0.070 31.588 -21.890 1.00 23.90 ? 198 HIS L N 1 ATOM 1504 C CA . HIS A 1 197 ? 0.589 31.014 -20.659 1.00 24.31 ? 198 HIS L CA 1 ATOM 1505 C C . HIS A 1 197 ? -0.337 31.352 -19.501 1.00 24.22 ? 198 HIS L C 1 ATOM 1506 O O . HIS A 1 197 ? -0.913 32.440 -19.456 1.00 22.29 ? 198 HIS L O 1 ATOM 1507 C CB . HIS A 1 197 ? 2.007 31.522 -20.377 1.00 18.37 ? 198 HIS L CB 1 ATOM 1508 C CG . HIS A 1 197 ? 2.626 30.922 -19.157 1.00 18.64 ? 198 HIS L CG 1 ATOM 1509 N ND1 . HIS A 1 197 ? 2.485 31.475 -17.903 1.00 22.28 ? 198 HIS L ND1 1 ATOM 1510 C CD2 . HIS A 1 197 ? 3.375 29.805 -18.994 1.00 15.35 ? 198 HIS L CD2 1 ATOM 1511 C CE1 . HIS A 1 197 ? 3.123 30.726 -17.020 1.00 23.77 ? 198 HIS L CE1 1 ATOM 1512 N NE2 . HIS A 1 197 ? 3.671 29.707 -17.657 1.00 18.01 ? 198 HIS L NE2 1 ATOM 1513 N N . GLN A 1 198 ? -0.467 30.417 -18.566 1.00 23.63 ? 199 GLN L N 1 ATOM 1514 C CA . GLN A 1 198 ? -1.379 30.559 -17.435 1.00 22.16 ? 199 GLN L CA 1 ATOM 1515 C C . GLN A 1 198 ? -1.154 31.838 -16.623 1.00 26.51 ? 199 GLN L C 1 ATOM 1516 O O . GLN A 1 198 ? -2.056 32.310 -15.938 1.00 28.99 ? 199 GLN L O 1 ATOM 1517 C CB . GLN A 1 198 ? -1.258 29.342 -16.516 1.00 26.06 ? 199 GLN L CB 1 ATOM 1518 C CG . GLN A 1 198 ? -2.366 29.253 -15.486 1.00 44.49 ? 199 GLN L CG 1 ATOM 1519 C CD . GLN A 1 198 ? -2.295 27.992 -14.658 1.00 55.33 ? 199 GLN L CD 1 ATOM 1520 O OE1 . GLN A 1 198 ? -3.277 27.253 -14.546 1.00 65.65 ? 199 GLN L OE1 1 ATOM 1521 N NE2 . GLN A 1 198 ? -1.134 27.736 -14.069 1.00 47.32 ? 199 GLN L NE2 1 ATOM 1522 N N . GLY A 1 199 ? 0.047 32.397 -16.703 1.00 28.98 ? 200 GLY L N 1 ATOM 1523 C CA . GLY A 1 199 ? 0.379 33.596 -15.957 1.00 26.88 ? 200 GLY L CA 1 ATOM 1524 C C . GLY A 1 199 ? -0.042 34.889 -16.625 1.00 28.28 ? 200 GLY L C 1 ATOM 1525 O O . GLY A 1 199 ? 0.050 35.960 -16.030 1.00 26.59 ? 200 GLY L O 1 ATOM 1526 N N . LEU A 1 200 ? -0.504 34.793 -17.866 1.00 30.35 ? 201 LEU L N 1 ATOM 1527 C CA . LEU A 1 200 ? -0.912 35.973 -18.616 1.00 30.47 ? 201 LEU L CA 1 ATOM 1528 C C . LEU A 1 200 ? -2.431 36.104 -18.632 1.00 35.33 ? 201 LEU L C 1 ATOM 1529 O O . LEU A 1 200 ? -3.140 35.102 -18.721 1.00 35.21 ? 201 LEU L O 1 ATOM 1530 C CB . LEU A 1 200 ? -0.368 35.902 -20.043 1.00 28.76 ? 201 LEU L CB 1 ATOM 1531 C CG . LEU A 1 200 ? 1.158 35.836 -20.157 1.00 26.87 ? 201 LEU L CG 1 ATOM 1532 C CD1 . LEU A 1 200 ? 1.584 35.476 -21.573 1.00 17.52 ? 201 LEU L CD1 1 ATOM 1533 C CD2 . LEU A 1 200 ? 1.780 37.161 -19.736 1.00 23.71 ? 201 LEU L CD2 1 ATOM 1534 N N . SER A 1 201 ? -2.929 37.335 -18.543 1.00 32.67 ? 202 SER L N 1 ATOM 1535 C CA . SER A 1 201 ? -4.372 37.570 -18.578 1.00 33.99 ? 202 SER L CA 1 ATOM 1536 C C . SER A 1 201 ? -4.919 37.269 -19.966 1.00 35.10 ? 202 SER L C 1 ATOM 1537 O O . SER A 1 201 ? -6.060 36.834 -20.112 1.00 43.18 ? 202 SER L O 1 ATOM 1538 C CB . SER A 1 201 ? -4.709 39.008 -18.171 1.00 32.23 ? 202 SER L CB 1 ATOM 1539 O OG . SER A 1 201 ? -4.034 39.941 -18.993 1.00 40.93 ? 202 SER L OG 1 ATOM 1540 N N . SER A 1 202 ? -4.089 37.484 -20.980 1.00 27.75 ? 203 SER L N 1 ATOM 1541 C CA . SER A 1 202 ? -4.451 37.170 -22.355 1.00 28.64 ? 203 SER L CA 1 ATOM 1542 C C . SER A 1 202 ? -3.173 36.943 -23.159 1.00 31.05 ? 203 SER L C 1 ATOM 1543 O O . SER A 1 202 ? -2.090 37.319 -22.711 1.00 33.20 ? 203 SER L O 1 ATOM 1544 C CB . SER A 1 202 ? -5.301 38.295 -22.962 1.00 29.83 ? 203 SER L CB 1 ATOM 1545 O OG . SER A 1 202 ? -4.562 39.494 -23.069 1.00 38.00 ? 203 SER L OG 1 ATOM 1546 N N . PRO A 1 203 ? -3.285 36.309 -24.338 1.00 38.07 ? 204 PRO L N 1 ATOM 1547 C CA . PRO A 1 203 ? -2.087 36.063 -25.149 1.00 37.56 ? 204 PRO L CA 1 ATOM 1548 C C . PRO A 1 203 ? -1.306 37.332 -25.456 1.00 34.57 ? 204 PRO L C 1 ATOM 1549 O O . PRO A 1 203 ? -1.892 38.355 -25.801 1.00 40.80 ? 204 PRO L O 1 ATOM 1550 C CB . PRO A 1 203 ? -2.657 35.454 -26.430 1.00 35.37 ? 204 PRO L CB 1 ATOM 1551 C CG . PRO A 1 203 ? -3.901 34.772 -25.982 1.00 36.85 ? 204 PRO L CG 1 ATOM 1552 C CD . PRO A 1 203 ? -4.475 35.646 -24.902 1.00 34.44 ? 204 PRO L CD 1 ATOM 1553 N N . VAL A 1 204 ? 0.011 37.258 -25.317 1.00 36.75 ? 205 VAL L N 1 ATOM 1554 C CA . VAL A 1 204 ? 0.881 38.397 -25.574 1.00 31.60 ? 205 VAL L CA 1 ATOM 1555 C C . VAL A 1 204 ? 1.586 38.221 -26.913 1.00 30.63 ? 205 VAL L C 1 ATOM 1556 O O . VAL A 1 204 ? 2.105 37.149 -27.218 1.00 30.26 ? 205 VAL L O 1 ATOM 1557 C CB . VAL A 1 204 ? 1.930 38.571 -24.450 1.00 34.65 ? 205 VAL L CB 1 ATOM 1558 C CG1 . VAL A 1 204 ? 2.960 39.629 -24.824 1.00 32.65 ? 205 VAL L CG1 1 ATOM 1559 C CG2 . VAL A 1 204 ? 1.247 38.922 -23.136 1.00 34.20 ? 205 VAL L CG2 1 ATOM 1560 N N . THR A 1 205 ? 1.599 39.274 -27.718 1.00 31.90 ? 206 THR L N 1 ATOM 1561 C CA . THR A 1 205 ? 2.231 39.204 -29.022 1.00 30.70 ? 206 THR L CA 1 ATOM 1562 C C . THR A 1 205 ? 3.364 40.211 -29.108 1.00 30.29 ? 206 THR L C 1 ATOM 1563 O O . THR A 1 205 ? 3.193 41.377 -28.771 1.00 28.23 ? 206 THR L O 1 ATOM 1564 C CB . THR A 1 205 ? 1.218 39.457 -30.148 1.00 32.91 ? 206 THR L CB 1 ATOM 1565 O OG1 . THR A 1 205 ? 0.129 38.535 -30.021 1.00 38.50 ? 206 THR L OG1 1 ATOM 1566 C CG2 . THR A 1 205 ? 1.874 39.278 -31.507 1.00 31.80 ? 206 THR L CG2 1 ATOM 1567 N N . LYS A 1 206 ? 4.533 39.739 -29.520 1.00 32.07 ? 207 LYS L N 1 ATOM 1568 C CA . LYS A 1 206 ? 5.661 40.612 -29.795 1.00 26.68 ? 207 LYS L CA 1 ATOM 1569 C C . LYS A 1 206 ? 5.946 40.544 -31.281 1.00 33.54 ? 207 LYS L C 1 ATOM 1570 O O . LYS A 1 206 ? 5.967 39.459 -31.862 1.00 32.91 ? 207 LYS L O 1 ATOM 1571 C CB . LYS A 1 206 ? 6.891 40.198 -28.987 1.00 25.81 ? 207 LYS L CB 1 ATOM 1572 C CG . LYS A 1 206 ? 6.720 40.347 -27.486 1.00 30.77 ? 207 LYS L CG 1 ATOM 1573 C CD . LYS A 1 206 ? 6.554 41.803 -27.087 1.00 33.36 ? 207 LYS L CD 1 ATOM 1574 C CE . LYS A 1 206 ? 6.432 41.950 -25.575 1.00 43.38 ? 207 LYS L CE 1 ATOM 1575 N NZ . LYS A 1 206 ? 6.233 43.371 -25.175 1.00 47.28 ? 207 LYS L NZ 1 ATOM 1576 N N . SER A 1 207 ? 6.154 41.692 -31.909 1.00 28.54 ? 208 SER L N 1 ATOM 1577 C CA . SER A 1 207 ? 6.359 41.683 -33.344 1.00 32.72 ? 208 SER L CA 1 ATOM 1578 C C . SER A 1 207 ? 7.294 42.768 -33.827 1.00 26.44 ? 208 SER L C 1 ATOM 1579 O O . SER A 1 207 ? 7.617 43.707 -33.106 1.00 30.41 ? 208 SER L O 1 ATOM 1580 C CB . SER A 1 207 ? 5.017 41.808 -34.072 1.00 28.35 ? 208 SER L CB 1 ATOM 1581 O OG . SER A 1 207 ? 4.333 42.978 -33.687 1.00 34.12 ? 208 SER L OG 1 ATOM 1582 N N . PHE A 1 208 ? 7.731 42.618 -35.067 1.00 22.79 ? 209 PHE L N 1 ATOM 1583 C CA . PHE A 1 208 ? 8.497 43.657 -35.721 1.00 25.52 ? 209 PHE L CA 1 ATOM 1584 C C . PHE A 1 208 ? 8.176 43.660 -37.202 1.00 28.35 ? 209 PHE L C 1 ATOM 1585 O O . PHE A 1 208 ? 7.636 42.686 -37.732 1.00 22.06 ? 209 PHE L O 1 ATOM 1586 C CB . PHE A 1 208 ? 10.003 43.465 -35.496 1.00 17.83 ? 209 PHE L CB 1 ATOM 1587 C CG . PHE A 1 208 ? 10.567 42.219 -36.129 1.00 20.38 ? 209 PHE L CG 1 ATOM 1588 C CD1 . PHE A 1 208 ? 10.980 42.219 -37.456 1.00 23.15 ? 209 PHE L CD1 1 ATOM 1589 C CD2 . PHE A 1 208 ? 10.708 41.055 -35.388 1.00 18.78 ? 209 PHE L CD2 1 ATOM 1590 C CE1 . PHE A 1 208 ? 11.504 41.076 -38.034 1.00 21.07 ? 209 PHE L CE1 1 ATOM 1591 C CE2 . PHE A 1 208 ? 11.238 39.912 -35.955 1.00 17.95 ? 209 PHE L CE2 1 ATOM 1592 C CZ . PHE A 1 208 ? 11.631 39.919 -37.282 1.00 22.81 ? 209 PHE L CZ 1 ATOM 1593 N N . ASN A 1 209 ? 8.507 44.766 -37.858 1.00 25.73 ? 210 ASN L N 1 ATOM 1594 C CA . ASN A 1 209 ? 8.442 44.853 -39.306 1.00 27.60 ? 210 ASN L CA 1 ATOM 1595 C C . ASN A 1 209 ? 9.849 44.763 -39.859 1.00 29.67 ? 210 ASN L C 1 ATOM 1596 O O . ASN A 1 209 ? 10.756 45.424 -39.354 1.00 33.53 ? 210 ASN L O 1 ATOM 1597 C CB . ASN A 1 209 ? 7.772 46.154 -39.747 1.00 35.44 ? 210 ASN L CB 1 ATOM 1598 C CG . ASN A 1 209 ? 6.390 46.317 -39.164 1.00 38.52 ? 210 ASN L CG 1 ATOM 1599 O OD1 . ASN A 1 209 ? 5.563 45.410 -39.233 1.00 44.32 ? 210 ASN L OD1 1 ATOM 1600 N ND2 . ASN A 1 209 ? 6.137 47.470 -38.565 1.00 40.19 ? 210 ASN L ND2 1 ATOM 1601 N N . ARG A 1 210 ? 10.034 43.927 -40.875 1.00 30.09 ? 211 ARG L N 1 ATOM 1602 C CA . ARG A 1 210 ? 11.334 43.776 -41.514 1.00 34.56 ? 211 ARG L CA 1 ATOM 1603 C C . ARG A 1 210 ? 11.815 45.116 -42.070 1.00 42.75 ? 211 ARG L C 1 ATOM 1604 O O . ARG A 1 210 ? 12.961 45.532 -41.858 1.00 39.86 ? 211 ARG L O 1 ATOM 1605 C CB . ARG A 1 210 ? 11.261 42.731 -42.628 1.00 30.98 ? 211 ARG L CB 1 ATOM 1606 C CG . ARG A 1 210 ? 12.533 42.600 -43.442 1.00 32.17 ? 211 ARG L CG 1 ATOM 1607 C CD . ARG A 1 210 ? 12.357 41.622 -44.590 1.00 30.70 ? 211 ARG L CD 1 ATOM 1608 N NE . ARG A 1 210 ? 11.156 41.906 -45.370 1.00 32.71 ? 211 ARG L NE 1 ATOM 1609 C CZ . ARG A 1 210 ? 11.065 42.872 -46.278 1.00 34.48 ? 211 ARG L CZ 1 ATOM 1610 N NH1 . ARG A 1 210 ? 12.105 43.660 -46.521 1.00 36.26 ? 211 ARG L NH1 1 ATOM 1611 N NH2 . ARG A 1 210 ? 9.932 43.056 -46.937 1.00 24.59 ? 211 ARG L NH2 1 ATOM 1612 O OXT . ARG A 1 210 ? 11.047 45.820 -42.730 1.00 42.56 ? 211 ARG L OXT 1 ATOM 1613 N N . GLN B 2 1 ? 36.058 2.124 -1.261 1.00 64.70 ? 1 GLN H N 1 ATOM 1614 C CA . GLN B 2 1 ? 35.012 2.472 -2.207 1.00 55.40 ? 1 GLN H CA 1 ATOM 1615 C C . GLN B 2 1 ? 35.449 2.152 -3.622 1.00 44.79 ? 1 GLN H C 1 ATOM 1616 O O . GLN B 2 1 ? 36.638 1.978 -3.898 1.00 35.64 ? 1 GLN H O 1 ATOM 1617 C CB . GLN B 2 1 ? 34.645 3.946 -2.090 1.00 62.65 ? 1 GLN H CB 1 ATOM 1618 C CG . GLN B 2 1 ? 33.172 4.244 -2.297 1.00 68.42 ? 1 GLN H CG 1 ATOM 1619 C CD . GLN B 2 1 ? 32.305 3.698 -1.181 1.00 75.44 ? 1 GLN H CD 1 ATOM 1620 O OE1 . GLN B 2 1 ? 32.795 3.049 -0.256 1.00 71.33 ? 1 GLN H OE1 1 ATOM 1621 N NE2 . GLN B 2 1 ? 31.006 3.966 -1.260 1.00 84.47 ? 1 GLN H NE2 1 ATOM 1622 N N . VAL B 2 2 ? 34.472 2.082 -4.515 1.00 37.66 ? 2 VAL H N 1 ATOM 1623 C CA . VAL B 2 2 ? 34.686 1.541 -5.841 1.00 28.09 ? 2 VAL H CA 1 ATOM 1624 C C . VAL B 2 2 ? 34.295 2.551 -6.909 1.00 32.84 ? 2 VAL H C 1 ATOM 1625 O O . VAL B 2 2 ? 33.250 3.195 -6.820 1.00 37.04 ? 2 VAL H O 1 ATOM 1626 C CB . VAL B 2 2 ? 33.883 0.246 -6.028 1.00 25.54 ? 2 VAL H CB 1 ATOM 1627 C CG1 . VAL B 2 2 ? 34.138 -0.356 -7.396 1.00 31.61 ? 2 VAL H CG1 1 ATOM 1628 C CG2 . VAL B 2 2 ? 34.227 -0.746 -4.924 1.00 22.53 ? 2 VAL H CG2 1 ATOM 1629 N N . GLN B 2 3 ? 35.151 2.704 -7.910 1.00 27.29 ? 3 GLN H N 1 ATOM 1630 C CA . GLN B 2 3 ? 34.849 3.588 -9.020 1.00 27.80 ? 3 GLN H CA 1 ATOM 1631 C C . GLN B 2 3 ? 34.849 2.800 -10.323 1.00 26.10 ? 3 GLN H C 1 ATOM 1632 O O . GLN B 2 3 ? 35.733 1.980 -10.562 1.00 30.91 ? 3 GLN H O 1 ATOM 1633 C CB . GLN B 2 3 ? 35.859 4.735 -9.085 1.00 30.26 ? 3 GLN H CB 1 ATOM 1634 C CG . GLN B 2 3 ? 35.447 5.872 -10.007 1.00 51.23 ? 3 GLN H CG 1 ATOM 1635 C CD . GLN B 2 3 ? 36.394 7.054 -9.924 1.00 69.93 ? 3 GLN H CD 1 ATOM 1636 O OE1 . GLN B 2 3 ? 37.547 6.914 -9.506 1.00 75.02 ? 3 GLN H OE1 1 ATOM 1637 N NE2 . GLN B 2 3 ? 35.910 8.230 -10.314 1.00 71.30 ? 3 GLN H NE2 1 ATOM 1638 N N . LEU B 2 4 ? 33.838 3.029 -11.147 1.00 22.52 ? 4 LEU H N 1 ATOM 1639 C CA . LEU B 2 4 ? 33.847 2.515 -12.505 1.00 23.49 ? 4 LEU H CA 1 ATOM 1640 C C . LEU B 2 4 ? 34.158 3.676 -13.436 1.00 27.82 ? 4 LEU H C 1 ATOM 1641 O O . LEU B 2 4 ? 33.422 4.655 -13.473 1.00 29.63 ? 4 LEU H O 1 ATOM 1642 C CB . LEU B 2 4 ? 32.507 1.867 -12.879 1.00 19.91 ? 4 LEU H CB 1 ATOM 1643 C CG . LEU B 2 4 ? 31.901 0.749 -12.016 1.00 23.05 ? 4 LEU H CG 1 ATOM 1644 C CD1 . LEU B 2 4 ? 30.948 -0.113 -12.836 1.00 15.23 ? 4 LEU H CD1 1 ATOM 1645 C CD2 . LEU B 2 4 ? 32.954 -0.110 -11.357 1.00 20.43 ? 4 LEU H CD2 1 ATOM 1646 N N . GLN B 2 5 ? 35.258 3.582 -14.173 1.00 29.58 ? 5 GLN H N 1 ATOM 1647 C CA . GLN B 2 5 ? 35.602 4.628 -15.128 1.00 28.37 ? 5 GLN H CA 1 ATOM 1648 C C . GLN B 2 5 ? 35.493 4.096 -16.544 1.00 25.28 ? 5 GLN H C 1 ATOM 1649 O O . GLN B 2 5 ? 35.948 2.990 -16.827 1.00 27.59 ? 5 GLN H O 1 ATOM 1650 C CB . GLN B 2 5 ? 37.011 5.162 -14.869 1.00 37.07 ? 5 GLN H CB 1 ATOM 1651 C CG . GLN B 2 5 ? 37.212 5.730 -13.472 1.00 47.90 ? 5 GLN H CG 1 ATOM 1652 C CD . GLN B 2 5 ? 38.650 6.137 -13.218 1.00 56.90 ? 5 GLN H CD 1 ATOM 1653 O OE1 . GLN B 2 5 ? 39.427 6.312 -14.156 1.00 59.33 ? 5 GLN H OE1 1 ATOM 1654 N NE2 . GLN B 2 5 ? 39.014 6.280 -11.946 1.00 56.68 ? 5 GLN H NE2 1 ATOM 1655 N N . GLN B 2 6 ? 34.889 4.884 -17.429 1.00 19.68 ? 6 GLN H N 1 ATOM 1656 C CA . GLN B 2 6 ? 34.687 4.463 -18.813 1.00 26.69 ? 6 GLN H CA 1 ATOM 1657 C C . GLN B 2 6 ? 35.485 5.316 -19.781 1.00 25.64 ? 6 GLN H C 1 ATOM 1658 O O . GLN B 2 6 ? 35.725 6.498 -19.538 1.00 28.48 ? 6 GLN H O 1 ATOM 1659 C CB . GLN B 2 6 ? 33.208 4.529 -19.210 1.00 30.97 ? 6 GLN H CB 1 ATOM 1660 C CG . GLN B 2 6 ? 32.241 4.184 -18.113 1.00 35.01 ? 6 GLN H CG 1 ATOM 1661 C CD . GLN B 2 6 ? 30.798 4.238 -18.573 1.00 31.54 ? 6 GLN H CD 1 ATOM 1662 O OE1 . GLN B 2 6 ? 29.881 4.209 -17.756 1.00 27.31 ? 6 GLN H OE1 1 ATOM 1663 N NE2 . GLN B 2 6 ? 30.590 4.320 -19.887 1.00 28.06 ? 6 GLN H NE2 1 ATOM 1664 N N . TRP B 2 7 ? 35.886 4.696 -20.885 1.00 22.51 ? 7 TRP H N 1 ATOM 1665 C CA . TRP B 2 7 ? 36.523 5.400 -21.982 1.00 23.89 ? 7 TRP H CA 1 ATOM 1666 C C . TRP B 2 7 ? 36.200 4.666 -23.283 1.00 26.09 ? 7 TRP H C 1 ATOM 1667 O O . TRP B 2 7 ? 35.606 3.587 -23.258 1.00 24.14 ? 7 TRP H O 1 ATOM 1668 C CB . TRP B 2 7 ? 38.034 5.516 -21.756 1.00 21.33 ? 7 TRP H CB 1 ATOM 1669 C CG . TRP B 2 7 ? 38.747 4.209 -21.545 1.00 27.18 ? 7 TRP H CG 1 ATOM 1670 C CD1 . TRP B 2 7 ? 39.260 3.395 -22.508 1.00 26.87 ? 7 TRP H CD1 1 ATOM 1671 C CD2 . TRP B 2 7 ? 39.048 3.582 -20.287 1.00 29.03 ? 7 TRP H CD2 1 ATOM 1672 N NE1 . TRP B 2 7 ? 39.855 2.292 -21.933 1.00 30.82 ? 7 TRP H NE1 1 ATOM 1673 C CE2 . TRP B 2 7 ? 39.739 2.385 -20.568 1.00 27.16 ? 7 TRP H CE2 1 ATOM 1674 C CE3 . TRP B 2 7 ? 38.797 3.916 -18.950 1.00 26.87 ? 7 TRP H CE3 1 ATOM 1675 C CZ2 . TRP B 2 7 ? 40.183 1.517 -19.564 1.00 24.21 ? 7 TRP H CZ2 1 ATOM 1676 C CZ3 . TRP B 2 7 ? 39.241 3.053 -17.949 1.00 31.74 ? 7 TRP H CZ3 1 ATOM 1677 C CH2 . TRP B 2 7 ? 39.923 1.868 -18.262 1.00 21.50 ? 7 TRP H CH2 1 ATOM 1678 N N . GLY B 2 8 ? 36.580 5.258 -24.411 1.00 27.56 ? 8 GLY H N 1 ATOM 1679 C CA . GLY B 2 8 ? 36.232 4.730 -25.720 1.00 22.53 ? 8 GLY H CA 1 ATOM 1680 C C . GLY B 2 8 ? 35.692 5.838 -26.605 1.00 26.33 ? 8 GLY H C 1 ATOM 1681 O O . GLY B 2 8 ? 35.200 6.845 -26.103 1.00 29.69 ? 8 GLY H O 1 ATOM 1682 N N . ALA B 2 9 ? 35.784 5.658 -27.920 1.00 30.71 ? 9 ALA H N 1 ATOM 1683 C CA . ALA B 2 9 ? 35.356 6.686 -28.872 1.00 29.92 ? 9 ALA H CA 1 ATOM 1684 C C . ALA B 2 9 ? 33.834 6.831 -28.912 1.00 29.11 ? 9 ALA H C 1 ATOM 1685 O O . ALA B 2 9 ? 33.112 5.850 -29.076 1.00 29.98 ? 9 ALA H O 1 ATOM 1686 C CB . ALA B 2 9 ? 35.890 6.368 -30.262 1.00 26.03 ? 9 ALA H CB 1 ATOM 1687 N N . GLY B 2 10 ? 33.351 8.061 -28.782 1.00 34.44 ? 10 GLY H N 1 ATOM 1688 C CA . GLY B 2 10 ? 31.922 8.311 -28.731 1.00 36.34 ? 10 GLY H CA 1 ATOM 1689 C C . GLY B 2 10 ? 31.325 8.927 -29.987 1.00 39.96 ? 10 GLY H C 1 ATOM 1690 O O . GLY B 2 10 ? 30.104 9.001 -30.127 1.00 45.48 ? 10 GLY H O 1 ATOM 1691 N N . LEU B 2 11 ? 32.173 9.381 -30.901 1.00 35.40 ? 11 LEU H N 1 ATOM 1692 C CA . LEU B 2 11 ? 31.681 9.932 -32.159 1.00 29.27 ? 11 LEU H CA 1 ATOM 1693 C C . LEU B 2 11 ? 31.864 8.916 -33.276 1.00 28.00 ? 11 LEU H C 1 ATOM 1694 O O . LEU B 2 11 ? 32.988 8.589 -33.644 1.00 26.46 ? 11 LEU H O 1 ATOM 1695 C CB . LEU B 2 11 ? 32.394 11.236 -32.502 1.00 28.13 ? 11 LEU H CB 1 ATOM 1696 C CG . LEU B 2 11 ? 31.952 11.881 -33.818 1.00 39.67 ? 11 LEU H CG 1 ATOM 1697 C CD1 . LEU B 2 11 ? 30.434 12.060 -33.852 1.00 41.38 ? 11 LEU H CD1 1 ATOM 1698 C CD2 . LEU B 2 11 ? 32.660 13.210 -34.020 1.00 30.87 ? 11 LEU H CD2 1 ATOM 1699 N N . LEU B 2 12 ? 30.753 8.419 -33.811 1.00 26.47 ? 12 LEU H N 1 ATOM 1700 C CA . LEU B 2 12 ? 30.803 7.327 -34.777 1.00 25.73 ? 12 LEU H CA 1 ATOM 1701 C C . LEU B 2 12 ? 30.028 7.615 -36.055 1.00 23.52 ? 12 LEU H C 1 ATOM 1702 O O . LEU B 2 12 ? 29.070 8.383 -36.058 1.00 28.09 ? 12 LEU H O 1 ATOM 1703 C CB . LEU B 2 12 ? 30.258 6.046 -34.148 1.00 24.65 ? 12 LEU H CB 1 ATOM 1704 C CG . LEU B 2 12 ? 30.937 5.528 -32.882 1.00 35.19 ? 12 LEU H CG 1 ATOM 1705 C CD1 . LEU B 2 12 ? 30.262 4.245 -32.439 1.00 33.02 ? 12 LEU H CD1 1 ATOM 1706 C CD2 . LEU B 2 12 ? 32.424 5.306 -33.118 1.00 38.49 ? 12 LEU H CD2 1 ATOM 1707 N N . LYS B 2 13 ? 30.448 6.972 -37.139 1.00 28.05 ? 13 LYS H N 1 ATOM 1708 C CA . LYS B 2 13 ? 29.709 7.000 -38.392 1.00 29.34 ? 13 LYS H CA 1 ATOM 1709 C C . LYS B 2 13 ? 28.905 5.714 -38.530 1.00 33.27 ? 13 LYS H C 1 ATOM 1710 O O . LYS B 2 13 ? 29.277 4.693 -37.955 1.00 36.73 ? 13 LYS H O 1 ATOM 1711 C CB . LYS B 2 13 ? 30.664 7.176 -39.572 1.00 34.13 ? 13 LYS H CB 1 ATOM 1712 C CG . LYS B 2 13 ? 31.453 8.466 -39.499 1.00 42.44 ? 13 LYS H CG 1 ATOM 1713 C CD . LYS B 2 13 ? 32.283 8.704 -40.740 1.00 47.75 ? 13 LYS H CD 1 ATOM 1714 C CE . LYS B 2 13 ? 33.150 9.939 -40.554 1.00 50.63 ? 13 LYS H CE 1 ATOM 1715 N NZ . LYS B 2 13 ? 32.364 11.085 -40.008 1.00 52.24 ? 13 LYS H NZ 1 ATOM 1716 N N . PRO B 2 14 ? 27.795 5.760 -39.285 1.00 29.72 ? 14 PRO H N 1 ATOM 1717 C CA . PRO B 2 14 ? 26.984 4.556 -39.498 1.00 30.53 ? 14 PRO H CA 1 ATOM 1718 C C . PRO B 2 14 ? 27.808 3.386 -40.035 1.00 34.30 ? 14 PRO H C 1 ATOM 1719 O O . PRO B 2 14 ? 28.714 3.611 -40.838 1.00 42.00 ? 14 PRO H O 1 ATOM 1720 C CB . PRO B 2 14 ? 25.943 5.010 -40.525 1.00 34.07 ? 14 PRO H CB 1 ATOM 1721 C CG . PRO B 2 14 ? 25.822 6.494 -40.300 1.00 33.62 ? 14 PRO H CG 1 ATOM 1722 C CD . PRO B 2 14 ? 27.200 6.955 -39.914 1.00 27.52 ? 14 PRO H CD 1 ATOM 1723 N N . SER B 2 15 ? 27.493 2.179 -39.558 1.00 33.60 ? 15 SER H N 1 ATOM 1724 C CA . SER B 2 15 ? 28.138 0.908 -39.927 1.00 31.44 ? 15 SER H CA 1 ATOM 1725 C C . SER B 2 15 ? 29.491 0.670 -39.240 1.00 30.18 ? 15 SER H C 1 ATOM 1726 O O . SER B 2 15 ? 30.083 -0.397 -39.398 1.00 32.90 ? 15 SER H O 1 ATOM 1727 C CB . SER B 2 15 ? 28.313 0.792 -41.446 1.00 32.44 ? 15 SER H CB 1 ATOM 1728 O OG . SER B 2 15 ? 29.477 1.475 -41.880 1.00 39.30 ? 15 SER H OG 1 ATOM 1729 N N . GLU B 2 16 ? 29.978 1.636 -38.469 1.00 27.03 ? 16 GLU H N 1 ATOM 1730 C CA . GLU B 2 16 ? 31.197 1.406 -37.691 1.00 29.11 ? 16 GLU H CA 1 ATOM 1731 C C . GLU B 2 16 ? 30.890 0.622 -36.419 1.00 30.58 ? 16 GLU H C 1 ATOM 1732 O O . GLU B 2 16 ? 29.738 0.270 -36.159 1.00 34.29 ? 16 GLU H O 1 ATOM 1733 C CB . GLU B 2 16 ? 31.885 2.726 -37.343 1.00 25.65 ? 16 GLU H CB 1 ATOM 1734 C CG . GLU B 2 16 ? 32.506 3.416 -38.543 1.00 33.69 ? 16 GLU H CG 1 ATOM 1735 C CD . GLU B 2 16 ? 33.203 4.712 -38.180 1.00 43.51 ? 16 GLU H CD 1 ATOM 1736 O OE1 . GLU B 2 16 ? 32.992 5.211 -37.055 1.00 41.93 ? 16 GLU H OE1 1 ATOM 1737 O OE2 . GLU B 2 16 ? 33.963 5.235 -39.022 1.00 52.12 ? 16 GLU H OE2 1 ATOM 1738 N N . THR B 2 17 ? 31.925 0.349 -35.631 1.00 26.16 ? 17 THR H N 1 ATOM 1739 C CA . THR B 2 17 ? 31.770 -0.438 -34.411 1.00 23.28 ? 17 THR H CA 1 ATOM 1740 C C . THR B 2 17 ? 31.983 0.392 -33.154 1.00 22.13 ? 17 THR H C 1 ATOM 1741 O O . THR B 2 17 ? 33.047 0.971 -32.962 1.00 28.11 ? 17 THR H O 1 ATOM 1742 C CB . THR B 2 17 ? 32.757 -1.615 -34.370 1.00 27.68 ? 17 THR H CB 1 ATOM 1743 O OG1 . THR B 2 17 ? 32.471 -2.518 -35.441 1.00 32.63 ? 17 THR H OG1 1 ATOM 1744 C CG2 . THR B 2 17 ? 32.650 -2.354 -33.040 1.00 29.41 ? 17 THR H CG2 1 ATOM 1745 N N . LEU B 2 18 ? 30.970 0.440 -32.297 1.00 22.04 ? 18 LEU H N 1 ATOM 1746 C CA . LEU B 2 18 ? 31.117 1.058 -30.988 1.00 18.86 ? 18 LEU H CA 1 ATOM 1747 C C . LEU B 2 18 ? 31.956 0.150 -30.104 1.00 26.84 ? 18 LEU H C 1 ATOM 1748 O O . LEU B 2 18 ? 31.665 -1.043 -29.973 1.00 25.62 ? 18 LEU H O 1 ATOM 1749 C CB . LEU B 2 18 ? 29.756 1.318 -30.347 1.00 23.62 ? 18 LEU H CB 1 ATOM 1750 C CG . LEU B 2 18 ? 29.786 1.747 -28.880 1.00 27.81 ? 18 LEU H CG 1 ATOM 1751 C CD1 . LEU B 2 18 ? 30.519 3.071 -28.712 1.00 23.71 ? 18 LEU H CD1 1 ATOM 1752 C CD2 . LEU B 2 18 ? 28.377 1.836 -28.327 1.00 30.08 ? 18 LEU H CD2 1 ATOM 1753 N N . SER B 2 19 ? 33.005 0.710 -29.512 1.00 24.91 ? 19 SER H N 1 ATOM 1754 C CA . SER B 2 19 ? 33.899 -0.058 -28.655 1.00 26.64 ? 19 SER H CA 1 ATOM 1755 C C . SER B 2 19 ? 34.224 0.708 -27.371 1.00 29.50 ? 19 SER H C 1 ATOM 1756 O O . SER B 2 19 ? 35.086 1.589 -27.359 1.00 28.47 ? 19 SER H O 1 ATOM 1757 C CB . SER B 2 19 ? 35.185 -0.409 -29.408 1.00 29.98 ? 19 SER H CB 1 ATOM 1758 O OG . SER B 2 19 ? 36.094 -1.091 -28.565 1.00 41.38 ? 19 SER H OG 1 ATOM 1759 N N . LEU B 2 20 ? 33.526 0.364 -26.293 1.00 26.37 ? 20 LEU H N 1 ATOM 1760 C CA . LEU B 2 20 ? 33.696 1.035 -25.009 1.00 24.00 ? 20 LEU H CA 1 ATOM 1761 C C . LEU B 2 20 ? 34.327 0.110 -23.978 1.00 24.58 ? 20 LEU H C 1 ATOM 1762 O O . LEU B 2 20 ? 34.151 -1.105 -24.032 1.00 20.89 ? 20 LEU H O 1 ATOM 1763 C CB . LEU B 2 20 ? 32.352 1.542 -24.489 1.00 22.05 ? 20 LEU H CB 1 ATOM 1764 C CG . LEU B 2 20 ? 31.632 2.529 -25.402 1.00 18.25 ? 20 LEU H CG 1 ATOM 1765 C CD1 . LEU B 2 20 ? 30.287 2.878 -24.822 1.00 12.87 ? 20 LEU H CD1 1 ATOM 1766 C CD2 . LEU B 2 20 ? 32.487 3.782 -25.606 1.00 12.29 ? 20 LEU H CD2 1 ATOM 1767 N N . THR B 2 21 ? 35.053 0.696 -23.036 1.00 22.31 ? 21 THR H N 1 ATOM 1768 C CA . THR B 2 21 ? 35.706 -0.070 -21.981 1.00 21.62 ? 21 THR H CA 1 ATOM 1769 C C . THR B 2 21 ? 35.410 0.540 -20.615 1.00 23.21 ? 21 THR H C 1 ATOM 1770 O O . THR B 2 21 ? 35.372 1.760 -20.457 1.00 24.98 ? 21 THR H O 1 ATOM 1771 C CB . THR B 2 21 ? 37.235 -0.147 -22.201 1.00 23.83 ? 21 THR H CB 1 ATOM 1772 O OG1 . THR B 2 21 ? 37.506 -0.860 -23.413 1.00 24.69 ? 21 THR H OG1 1 ATOM 1773 C CG2 . THR B 2 21 ? 37.928 -0.871 -21.041 1.00 22.65 ? 21 THR H CG2 1 ATOM 1774 N N . CYS B 2 22 ? 35.188 -0.324 -19.635 1.00 22.09 ? 22 CYS H N 1 ATOM 1775 C CA . CYS B 2 22 ? 34.912 0.091 -18.272 1.00 20.78 ? 22 CYS H CA 1 ATOM 1776 C C . CYS B 2 22 ? 36.001 -0.446 -17.353 1.00 27.19 ? 22 CYS H C 1 ATOM 1777 O O . CYS B 2 22 ? 36.238 -1.653 -17.306 1.00 25.11 ? 22 CYS H O 1 ATOM 1778 C CB . CYS B 2 22 ? 33.535 -0.421 -17.841 1.00 20.80 ? 22 CYS H CB 1 ATOM 1779 S SG . CYS B 2 22 ? 32.956 0.116 -16.227 1.00 35.93 ? 22 CYS H SG 1 ATOM 1780 N N . GLY B 2 23 ? 36.677 0.451 -16.643 1.00 23.78 ? 23 GLY H N 1 ATOM 1781 C CA . GLY B 2 23 ? 37.691 0.052 -15.686 1.00 21.12 ? 23 GLY H CA 1 ATOM 1782 C C . GLY B 2 23 ? 37.144 0.072 -14.272 1.00 22.48 ? 23 GLY H C 1 ATOM 1783 O O . GLY B 2 23 ? 36.432 0.996 -13.897 1.00 26.83 ? 23 GLY H O 1 ATOM 1784 N N . VAL B 2 24 ? 37.476 -0.947 -13.484 1.00 25.20 ? 24 VAL H N 1 ATOM 1785 C CA . VAL B 2 24 ? 36.983 -1.039 -12.112 1.00 25.96 ? 24 VAL H CA 1 ATOM 1786 C C . VAL B 2 24 ? 38.107 -0.798 -11.108 1.00 26.95 ? 24 VAL H C 1 ATOM 1787 O O . VAL B 2 24 ? 39.111 -1.511 -11.109 1.00 27.13 ? 24 VAL H O 1 ATOM 1788 C CB . VAL B 2 24 ? 36.343 -2.414 -11.836 1.00 24.47 ? 24 VAL H CB 1 ATOM 1789 C CG1 . VAL B 2 24 ? 35.876 -2.500 -10.394 1.00 22.34 ? 24 VAL H CG1 1 ATOM 1790 C CG2 . VAL B 2 24 ? 35.184 -2.666 -12.794 1.00 30.10 ? 24 VAL H CG2 1 ATOM 1791 N N . TYR B 2 25 ? 37.941 0.201 -10.249 1.00 21.21 ? 25 TYR H N 1 ATOM 1792 C CA . TYR B 2 25 ? 38.991 0.558 -9.301 1.00 23.74 ? 25 TYR H CA 1 ATOM 1793 C C . TYR B 2 25 ? 38.477 0.542 -7.870 1.00 20.67 ? 25 TYR H C 1 ATOM 1794 O O . TYR B 2 25 ? 37.558 1.280 -7.520 1.00 24.66 ? 25 TYR H O 1 ATOM 1795 C CB . TYR B 2 25 ? 39.572 1.927 -9.653 1.00 24.37 ? 25 TYR H CB 1 ATOM 1796 C CG . TYR B 2 25 ? 40.046 1.988 -11.081 1.00 21.92 ? 25 TYR H CG 1 ATOM 1797 C CD1 . TYR B 2 25 ? 39.178 2.347 -12.102 1.00 21.58 ? 25 TYR H CD1 1 ATOM 1798 C CD2 . TYR B 2 25 ? 41.352 1.660 -11.415 1.00 27.10 ? 25 TYR H CD2 1 ATOM 1799 C CE1 . TYR B 2 25 ? 39.596 2.393 -13.414 1.00 22.94 ? 25 TYR H CE1 1 ATOM 1800 C CE2 . TYR B 2 25 ? 41.781 1.704 -12.727 1.00 27.27 ? 25 TYR H CE2 1 ATOM 1801 C CZ . TYR B 2 25 ? 40.895 2.067 -13.721 1.00 23.39 ? 25 TYR H CZ 1 ATOM 1802 O OH . TYR B 2 25 ? 41.311 2.117 -15.028 1.00 28.44 ? 25 TYR H OH 1 ATOM 1803 N N . GLY B 2 26 ? 39.073 -0.315 -7.049 1.00 19.53 ? 26 GLY H N 1 ATOM 1804 C CA . GLY B 2 26 ? 38.668 -0.452 -5.662 1.00 22.98 ? 26 GLY H CA 1 ATOM 1805 C C . GLY B 2 26 ? 38.040 -1.805 -5.414 1.00 26.91 ? 26 GLY H C 1 ATOM 1806 O O . GLY B 2 26 ? 37.734 -2.163 -4.278 1.00 30.34 ? 26 GLY H O 1 ATOM 1807 N N . GLU B 2 27 ? 37.864 -2.563 -6.492 1.00 28.04 ? 27 GLU H N 1 ATOM 1808 C CA . GLU B 2 27 ? 37.245 -3.879 -6.430 1.00 24.73 ? 27 GLU H CA 1 ATOM 1809 C C . GLU B 2 27 ? 37.712 -4.728 -7.606 1.00 24.10 ? 27 GLU H C 1 ATOM 1810 O O . GLU B 2 27 ? 38.077 -4.201 -8.661 1.00 18.09 ? 27 GLU H O 1 ATOM 1811 C CB . GLU B 2 27 ? 35.716 -3.753 -6.439 1.00 31.87 ? 27 GLU H CB 1 ATOM 1812 C CG . GLU B 2 27 ? 34.952 -5.059 -6.264 1.00 39.02 ? 27 GLU H CG 1 ATOM 1813 C CD . GLU B 2 27 ? 33.445 -4.884 -6.412 1.00 43.70 ? 27 GLU H CD 1 ATOM 1814 O OE1 . GLU B 2 27 ? 32.998 -3.751 -6.691 1.00 46.46 ? 27 GLU H OE1 1 ATOM 1815 O OE2 . GLU B 2 27 ? 32.707 -5.880 -6.250 1.00 45.50 ? 27 GLU H OE2 1 ATOM 1816 N N . SER B 2 28 ? 37.707 -6.041 -7.406 1.00 18.63 ? 28 SER H N 1 ATOM 1817 C CA . SER B 2 28 ? 38.006 -7.008 -8.451 1.00 22.71 ? 28 SER H CA 1 ATOM 1818 C C . SER B 2 28 ? 36.738 -7.387 -9.219 1.00 24.81 ? 28 SER H C 1 ATOM 1819 O O . SER B 2 28 ? 35.631 -7.245 -8.702 1.00 19.71 ? 28 SER H O 1 ATOM 1820 C CB . SER B 2 28 ? 38.642 -8.255 -7.833 1.00 25.33 ? 28 SER H CB 1 ATOM 1821 O OG . SER B 2 28 ? 38.660 -9.325 -8.751 1.00 28.03 ? 28 SER H OG 1 ATOM 1822 N N . LEU B 2 29 ? 36.901 -7.871 -10.448 1.00 25.29 ? 29 LEU H N 1 ATOM 1823 C CA . LEU B 2 29 ? 35.773 -8.369 -11.234 1.00 23.68 ? 29 LEU H CA 1 ATOM 1824 C C . LEU B 2 29 ? 35.156 -9.640 -10.641 1.00 26.32 ? 29 LEU H C 1 ATOM 1825 O O . LEU B 2 29 ? 34.015 -9.985 -10.946 1.00 20.46 ? 29 LEU H O 1 ATOM 1826 C CB . LEU B 2 29 ? 36.204 -8.652 -12.672 1.00 19.67 ? 29 LEU H CB 1 ATOM 1827 C CG . LEU B 2 29 ? 36.592 -7.449 -13.526 1.00 25.67 ? 29 LEU H CG 1 ATOM 1828 C CD1 . LEU B 2 29 ? 37.148 -7.921 -14.856 1.00 30.28 ? 29 LEU H CD1 1 ATOM 1829 C CD2 . LEU B 2 29 ? 35.393 -6.532 -13.732 1.00 24.87 ? 29 LEU H CD2 1 ATOM 1830 N N . SER B 2 30 ? 35.918 -10.336 -9.805 1.00 18.82 ? 30 SER H N 1 ATOM 1831 C CA . SER B 2 30 ? 35.500 -11.641 -9.284 1.00 20.85 ? 30 SER H CA 1 ATOM 1832 C C . SER B 2 30 ? 34.173 -11.606 -8.527 1.00 26.00 ? 30 SER H C 1 ATOM 1833 O O . SER B 2 30 ? 33.875 -10.648 -7.811 1.00 27.98 ? 30 SER H O 1 ATOM 1834 C CB . SER B 2 30 ? 36.581 -12.207 -8.363 1.00 24.99 ? 30 SER H CB 1 ATOM 1835 O OG . SER B 2 30 ? 36.630 -11.465 -7.160 1.00 37.17 ? 30 SER H OG 1 ATOM 1836 N N . GLY B 2 31 ? 33.378 -12.658 -8.705 1.00 23.97 ? 31 GLY H N 1 ATOM 1837 C CA . GLY B 2 31 ? 32.175 -12.872 -7.919 1.00 22.05 ? 31 GLY H CA 1 ATOM 1838 C C . GLY B 2 31 ? 31.010 -11.960 -8.233 1.00 24.77 ? 31 GLY H C 1 ATOM 1839 O O . GLY B 2 31 ? 30.039 -11.920 -7.483 1.00 32.47 ? 31 GLY H O 1 ATOM 1840 N N . HIS B 2 32 ? 31.101 -11.227 -9.336 1.00 23.27 ? 32 HIS H N 1 ATOM 1841 C CA . HIS B 2 32 ? 30.051 -10.281 -9.710 1.00 21.54 ? 32 HIS H CA 1 ATOM 1842 C C . HIS B 2 32 ? 29.756 -10.314 -11.204 1.00 21.91 ? 32 HIS H C 1 ATOM 1843 O O . HIS B 2 32 ? 30.580 -10.766 -12.008 1.00 21.15 ? 32 HIS H O 1 ATOM 1844 C CB . HIS B 2 32 ? 30.434 -8.844 -9.314 1.00 16.04 ? 32 HIS H CB 1 ATOM 1845 C CG . HIS B 2 32 ? 30.455 -8.601 -7.836 1.00 26.43 ? 32 HIS H CG 1 ATOM 1846 N ND1 . HIS B 2 32 ? 31.531 -8.933 -7.041 1.00 29.19 ? 32 HIS H ND1 1 ATOM 1847 C CD2 . HIS B 2 32 ? 29.533 -8.053 -7.009 1.00 28.52 ? 32 HIS H CD2 1 ATOM 1848 C CE1 . HIS B 2 32 ? 31.269 -8.607 -5.788 1.00 26.05 ? 32 HIS H CE1 1 ATOM 1849 N NE2 . HIS B 2 32 ? 30.063 -8.068 -5.741 1.00 25.11 ? 32 HIS H NE2 1 ATOM 1850 N N . TYR B 2 33 ? 28.579 -9.816 -11.564 1.00 14.82 ? 33 TYR H N 1 ATOM 1851 C CA . TYR B 2 33 ? 28.222 -9.590 -12.956 1.00 19.31 ? 33 TYR H CA 1 ATOM 1852 C C . TYR B 2 33 ? 28.564 -8.157 -13.334 1.00 24.08 ? 33 TYR H C 1 ATOM 1853 O O . TYR B 2 33 ? 28.460 -7.245 -12.513 1.00 21.36 ? 33 TYR H O 1 ATOM 1854 C CB . TYR B 2 33 ? 26.732 -9.849 -13.200 1.00 20.76 ? 33 TYR H CB 1 ATOM 1855 C CG . TYR B 2 33 ? 26.296 -11.293 -13.047 1.00 24.51 ? 33 TYR H CG 1 ATOM 1856 C CD1 . TYR B 2 33 ? 25.945 -11.804 -11.804 1.00 21.55 ? 33 TYR H CD1 1 ATOM 1857 C CD2 . TYR B 2 33 ? 26.222 -12.137 -14.149 1.00 21.90 ? 33 TYR H CD2 1 ATOM 1858 C CE1 . TYR B 2 33 ? 25.539 -13.124 -11.661 1.00 22.25 ? 33 TYR H CE1 1 ATOM 1859 C CE2 . TYR B 2 33 ? 25.820 -13.454 -14.015 1.00 19.96 ? 33 TYR H CE2 1 ATOM 1860 C CZ . TYR B 2 33 ? 25.479 -13.939 -12.770 1.00 22.55 ? 33 TYR H CZ 1 ATOM 1861 O OH . TYR B 2 33 ? 25.074 -15.244 -12.634 1.00 25.49 ? 33 TYR H OH 1 ATOM 1862 N N . TRP B 2 34 ? 28.956 -7.956 -14.585 1.00 27.29 ? 34 TRP H N 1 ATOM 1863 C CA . TRP B 2 34 ? 29.330 -6.630 -15.054 1.00 24.71 ? 34 TRP H CA 1 ATOM 1864 C C . TRP B 2 34 ? 28.540 -6.314 -16.310 1.00 24.54 ? 34 TRP H C 1 ATOM 1865 O O . TRP B 2 34 ? 28.500 -7.108 -17.246 1.00 23.60 ? 34 TRP H O 1 ATOM 1866 C CB . TRP B 2 34 ? 30.837 -6.563 -15.268 1.00 22.54 ? 34 TRP H CB 1 ATOM 1867 C CG . TRP B 2 34 ? 31.539 -6.891 -13.983 1.00 22.39 ? 34 TRP H CG 1 ATOM 1868 C CD1 . TRP B 2 34 ? 31.970 -8.124 -13.571 1.00 17.11 ? 34 TRP H CD1 1 ATOM 1869 C CD2 . TRP B 2 34 ? 31.832 -5.984 -12.911 1.00 16.30 ? 34 TRP H CD2 1 ATOM 1870 N NE1 . TRP B 2 34 ? 32.532 -8.031 -12.321 1.00 18.19 ? 34 TRP H NE1 1 ATOM 1871 C CE2 . TRP B 2 34 ? 32.460 -6.731 -11.894 1.00 14.50 ? 34 TRP H CE2 1 ATOM 1872 C CE3 . TRP B 2 34 ? 31.631 -4.613 -12.718 1.00 12.63 ? 34 TRP H CE3 1 ATOM 1873 C CZ2 . TRP B 2 34 ? 32.894 -6.149 -10.700 1.00 18.57 ? 34 TRP H CZ2 1 ATOM 1874 C CZ3 . TRP B 2 34 ? 32.063 -4.037 -11.537 1.00 18.04 ? 34 TRP H CZ3 1 ATOM 1875 C CH2 . TRP B 2 34 ? 32.689 -4.807 -10.539 1.00 22.57 ? 34 TRP H CH2 1 ATOM 1876 N N . SER B 2 35 ? 27.896 -5.151 -16.305 1.00 21.40 ? 35 SER H N 1 ATOM 1877 C CA . SER B 2 35 ? 26.770 -4.895 -17.191 1.00 19.92 ? 35 SER H CA 1 ATOM 1878 C C . SER B 2 35 ? 26.888 -3.585 -17.970 1.00 18.99 ? 35 SER H C 1 ATOM 1879 O O . SER B 2 35 ? 27.649 -2.696 -17.600 1.00 20.92 ? 35 SER H O 1 ATOM 1880 C CB . SER B 2 35 ? 25.479 -4.900 -16.365 1.00 23.21 ? 35 SER H CB 1 ATOM 1881 O OG . SER B 2 35 ? 24.363 -4.510 -17.140 1.00 37.73 ? 35 SER H OG 1 ATOM 1882 N N . TRP B 2 36 ? 26.136 -3.487 -19.061 1.00 20.71 ? 36 TRP H N 1 ATOM 1883 C CA . TRP B 2 36 ? 26.043 -2.251 -19.830 1.00 21.90 ? 36 TRP H CA 1 ATOM 1884 C C . TRP B 2 36 ? 24.583 -1.863 -20.001 1.00 21.54 ? 36 TRP H C 1 ATOM 1885 O O . TRP B 2 36 ? 23.729 -2.708 -20.266 1.00 22.08 ? 36 TRP H O 1 ATOM 1886 C CB . TRP B 2 36 ? 26.715 -2.391 -21.205 1.00 20.43 ? 36 TRP H CB 1 ATOM 1887 C CG . TRP B 2 36 ? 28.213 -2.504 -21.153 1.00 19.29 ? 36 TRP H CG 1 ATOM 1888 C CD1 . TRP B 2 36 ? 28.951 -3.654 -21.144 1.00 20.02 ? 36 TRP H CD1 1 ATOM 1889 C CD2 . TRP B 2 36 ? 29.156 -1.422 -21.116 1.00 20.88 ? 36 TRP H CD2 1 ATOM 1890 N NE1 . TRP B 2 36 ? 30.294 -3.354 -21.098 1.00 24.65 ? 36 TRP H NE1 1 ATOM 1891 C CE2 . TRP B 2 36 ? 30.446 -1.992 -21.077 1.00 18.97 ? 36 TRP H CE2 1 ATOM 1892 C CE3 . TRP B 2 36 ? 29.033 -0.028 -21.111 1.00 24.01 ? 36 TRP H CE3 1 ATOM 1893 C CZ2 . TRP B 2 36 ? 31.605 -1.215 -21.034 1.00 23.57 ? 36 TRP H CZ2 1 ATOM 1894 C CZ3 . TRP B 2 36 ? 30.186 0.742 -21.064 1.00 26.47 ? 36 TRP H CZ3 1 ATOM 1895 C CH2 . TRP B 2 36 ? 31.453 0.147 -21.027 1.00 25.05 ? 36 TRP H CH2 1 ATOM 1896 N N . VAL B 2 37 ? 24.311 -0.575 -19.842 1.00 21.03 ? 37 VAL H N 1 ATOM 1897 C CA . VAL B 2 37 ? 22.963 -0.028 -19.914 1.00 21.13 ? 37 VAL H CA 1 ATOM 1898 C C . VAL B 2 37 ? 23.022 1.248 -20.740 1.00 16.88 ? 37 VAL H C 1 ATOM 1899 O O . VAL B 2 37 ? 23.947 2.035 -20.578 1.00 27.59 ? 37 VAL H O 1 ATOM 1900 C CB . VAL B 2 37 ? 22.399 0.284 -18.513 1.00 26.58 ? 37 VAL H CB 1 ATOM 1901 C CG1 . VAL B 2 37 ? 21.061 1.006 -18.614 1.00 22.38 ? 37 VAL H CG1 1 ATOM 1902 C CG2 . VAL B 2 37 ? 22.278 -0.992 -17.691 1.00 24.38 ? 37 VAL H CG2 1 ATOM 1903 N N . ARG B 2 38 ? 22.070 1.459 -21.638 1.00 17.51 ? 38 ARG H N 1 ATOM 1904 C CA . ARG B 2 38 ? 22.138 2.661 -22.454 1.00 18.33 ? 38 ARG H CA 1 ATOM 1905 C C . ARG B 2 38 ? 20.880 3.506 -22.345 1.00 20.70 ? 38 ARG H C 1 ATOM 1906 O O . ARG B 2 38 ? 19.821 3.025 -21.943 1.00 24.77 ? 38 ARG H O 1 ATOM 1907 C CB . ARG B 2 38 ? 22.417 2.303 -23.914 1.00 18.54 ? 38 ARG H CB 1 ATOM 1908 C CG . ARG B 2 38 ? 21.241 1.743 -24.672 1.00 23.72 ? 38 ARG H CG 1 ATOM 1909 C CD . ARG B 2 38 ? 21.609 1.572 -26.140 1.00 28.98 ? 38 ARG H CD 1 ATOM 1910 N NE . ARG B 2 38 ? 20.528 0.966 -26.913 1.00 30.18 ? 38 ARG H NE 1 ATOM 1911 C CZ . ARG B 2 38 ? 20.632 0.604 -28.187 1.00 31.47 ? 38 ARG H CZ 1 ATOM 1912 N NH1 . ARG B 2 38 ? 21.772 0.784 -28.839 1.00 26.95 ? 38 ARG H NH1 1 ATOM 1913 N NH2 . ARG B 2 38 ? 19.596 0.058 -28.810 1.00 35.71 ? 38 ARG H NH2 1 ATOM 1914 N N . GLN B 2 39 ? 21.012 4.778 -22.705 1.00 19.59 ? 39 GLN H N 1 ATOM 1915 C CA . GLN B 2 39 ? 19.928 5.732 -22.559 1.00 21.52 ? 39 GLN H CA 1 ATOM 1916 C C . GLN B 2 39 ? 19.881 6.692 -23.740 1.00 21.76 ? 39 GLN H C 1 ATOM 1917 O O . GLN B 2 39 ? 20.639 7.660 -23.785 1.00 23.11 ? 39 GLN H O 1 ATOM 1918 C CB . GLN B 2 39 ? 20.081 6.512 -21.250 1.00 23.97 ? 39 GLN H CB 1 ATOM 1919 C CG . GLN B 2 39 ? 18.823 7.249 -20.809 1.00 21.92 ? 39 GLN H CG 1 ATOM 1920 C CD . GLN B 2 39 ? 18.961 7.843 -19.415 1.00 27.85 ? 39 GLN H CD 1 ATOM 1921 O OE1 . GLN B 2 39 ? 20.067 8.156 -18.966 1.00 23.67 ? 39 GLN H OE1 1 ATOM 1922 N NE2 . GLN B 2 39 ? 17.838 7.993 -18.722 1.00 18.79 ? 39 GLN H NE2 1 ATOM 1923 N N . PRO B 2 40 ? 18.994 6.417 -24.708 1.00 24.85 ? 40 PRO H N 1 ATOM 1924 C CA . PRO B 2 40 ? 18.776 7.343 -25.824 1.00 26.64 ? 40 PRO H CA 1 ATOM 1925 C C . PRO B 2 40 ? 18.338 8.710 -25.308 1.00 28.95 ? 40 PRO H C 1 ATOM 1926 O O . PRO B 2 40 ? 17.724 8.784 -24.238 1.00 25.93 ? 40 PRO H O 1 ATOM 1927 C CB . PRO B 2 40 ? 17.657 6.674 -26.633 1.00 20.83 ? 40 PRO H CB 1 ATOM 1928 C CG . PRO B 2 40 ? 17.692 5.229 -26.232 1.00 19.48 ? 40 PRO H CG 1 ATOM 1929 C CD . PRO B 2 40 ? 18.137 5.221 -24.799 1.00 19.77 ? 40 PRO H CD 1 ATOM 1930 N N . PRO B 2 41 ? 18.664 9.780 -26.047 1.00 34.48 ? 41 PRO H N 1 ATOM 1931 C CA . PRO B 2 41 ? 18.305 11.151 -25.665 1.00 36.21 ? 41 PRO H CA 1 ATOM 1932 C C . PRO B 2 41 ? 16.817 11.304 -25.351 1.00 34.75 ? 41 PRO H C 1 ATOM 1933 O O . PRO B 2 41 ? 15.975 11.073 -26.219 1.00 38.03 ? 41 PRO H O 1 ATOM 1934 C CB . PRO B 2 41 ? 18.686 11.968 -26.904 1.00 33.30 ? 41 PRO H CB 1 ATOM 1935 C CG . PRO B 2 41 ? 19.782 11.189 -27.538 1.00 33.20 ? 41 PRO H CG 1 ATOM 1936 C CD . PRO B 2 41 ? 19.434 9.742 -27.303 1.00 34.80 ? 41 PRO H CD 1 ATOM 1937 N N . GLY B 2 42 ? 16.506 11.674 -24.113 1.00 28.81 ? 42 GLY H N 1 ATOM 1938 C CA . GLY B 2 42 ? 15.133 11.894 -23.701 1.00 25.07 ? 42 GLY H CA 1 ATOM 1939 C C . GLY B 2 42 ? 14.320 10.628 -23.512 1.00 35.81 ? 42 GLY H C 1 ATOM 1940 O O . GLY B 2 42 ? 13.096 10.689 -23.427 1.00 34.29 ? 42 GLY H O 1 ATOM 1941 N N . LYS B 2 43 ? 14.985 9.476 -23.443 1.00 35.95 ? 43 LYS H N 1 ATOM 1942 C CA . LYS B 2 43 ? 14.266 8.217 -23.259 1.00 30.81 ? 43 LYS H CA 1 ATOM 1943 C C . LYS B 2 43 ? 14.764 7.440 -22.042 1.00 30.58 ? 43 LYS H C 1 ATOM 1944 O O . LYS B 2 43 ? 15.656 7.890 -21.325 1.00 31.25 ? 43 LYS H O 1 ATOM 1945 C CB . LYS B 2 43 ? 14.366 7.356 -24.520 1.00 34.29 ? 43 LYS H CB 1 ATOM 1946 C CG . LYS B 2 43 ? 13.728 8.003 -25.738 1.00 43.86 ? 43 LYS H CG 1 ATOM 1947 C CD . LYS B 2 43 ? 13.699 7.065 -26.929 1.00 56.24 ? 43 LYS H CD 1 ATOM 1948 C CE . LYS B 2 43 ? 12.920 7.680 -28.084 1.00 68.38 ? 43 LYS H CE 1 ATOM 1949 N NZ . LYS B 2 43 ? 12.882 6.791 -29.281 1.00 74.98 ? 43 LYS H NZ 1 ATOM 1950 N N . ARG B 2 44 ? 14.172 6.273 -21.816 1.00 28.18 ? 44 ARG H N 1 ATOM 1951 C CA . ARG B 2 44 ? 14.418 5.511 -20.601 1.00 29.34 ? 44 ARG H CA 1 ATOM 1952 C C . ARG B 2 44 ? 15.687 4.678 -20.705 1.00 33.07 ? 44 ARG H C 1 ATOM 1953 O O . ARG B 2 44 ? 16.217 4.461 -21.794 1.00 31.54 ? 44 ARG H O 1 ATOM 1954 C CB . ARG B 2 44 ? 13.228 4.596 -20.300 1.00 33.15 ? 44 ARG H CB 1 ATOM 1955 C CG . ARG B 2 44 ? 13.217 3.306 -21.118 1.00 34.73 ? 44 ARG H CG 1 ATOM 1956 C CD . ARG B 2 44 ? 11.991 2.461 -20.810 1.00 32.98 ? 44 ARG H CD 1 ATOM 1957 N NE . ARG B 2 44 ? 10.793 2.988 -21.455 1.00 28.32 ? 44 ARG H NE 1 ATOM 1958 C CZ . ARG B 2 44 ? 9.557 2.583 -21.181 1.00 29.01 ? 44 ARG H CZ 1 ATOM 1959 N NH1 . ARG B 2 44 ? 9.349 1.651 -20.260 1.00 26.66 ? 44 ARG H NH1 1 ATOM 1960 N NH2 . ARG B 2 44 ? 8.525 3.116 -21.821 1.00 27.66 ? 44 ARG H NH2 1 ATOM 1961 N N . LEU B 2 45 ? 16.159 4.200 -19.561 1.00 27.02 ? 45 LEU H N 1 ATOM 1962 C CA . LEU B 2 45 ? 17.298 3.301 -19.531 1.00 25.82 ? 45 LEU H CA 1 ATOM 1963 C C . LEU B 2 45 ? 16.938 1.954 -20.157 1.00 28.43 ? 45 LEU H C 1 ATOM 1964 O O . LEU B 2 45 ? 15.820 1.454 -19.986 1.00 23.32 ? 45 LEU H O 1 ATOM 1965 C CB . LEU B 2 45 ? 17.778 3.117 -18.096 1.00 22.96 ? 45 LEU H CB 1 ATOM 1966 C CG . LEU B 2 45 ? 18.228 4.419 -17.437 1.00 27.28 ? 45 LEU H CG 1 ATOM 1967 C CD1 . LEU B 2 45 ? 18.053 4.342 -15.934 1.00 29.59 ? 45 LEU H CD1 1 ATOM 1968 C CD2 . LEU B 2 45 ? 19.677 4.720 -17.798 1.00 27.41 ? 45 LEU H CD2 1 ATOM 1969 N N . GLU B 2 46 ? 17.891 1.385 -20.891 1.00 24.25 ? 46 GLU H N 1 ATOM 1970 C CA . GLU B 2 46 ? 17.724 0.080 -21.525 1.00 22.69 ? 46 GLU H CA 1 ATOM 1971 C C . GLU B 2 46 ? 18.912 -0.842 -21.247 1.00 25.02 ? 46 GLU H C 1 ATOM 1972 O O . GLU B 2 46 ? 20.050 -0.523 -21.598 1.00 25.30 ? 46 GLU H O 1 ATOM 1973 C CB . GLU B 2 46 ? 17.551 0.223 -23.039 1.00 24.91 ? 46 GLU H CB 1 ATOM 1974 C CG . GLU B 2 46 ? 17.342 -1.125 -23.733 1.00 41.59 ? 46 GLU H CG 1 ATOM 1975 C CD . GLU B 2 46 ? 17.684 -1.114 -25.216 1.00 49.96 ? 46 GLU H CD 1 ATOM 1976 O OE1 . GLU B 2 46 ? 18.143 -0.070 -25.725 1.00 48.05 ? 46 GLU H OE1 1 ATOM 1977 O OE2 . GLU B 2 46 ? 17.495 -2.161 -25.873 1.00 51.86 ? 46 GLU H OE2 1 ATOM 1978 N N . TRP B 2 47 ? 18.636 -1.983 -20.622 1.00 24.54 ? 47 TRP H N 1 ATOM 1979 C CA . TRP B 2 47 ? 19.646 -3.013 -20.361 1.00 28.10 ? 47 TRP H CA 1 ATOM 1980 C C . TRP B 2 47 ? 20.138 -3.636 -21.663 1.00 25.46 ? 47 TRP H C 1 ATOM 1981 O O . TRP B 2 47 ? 19.342 -4.024 -22.518 1.00 23.21 ? 47 TRP H O 1 ATOM 1982 C CB . TRP B 2 47 ? 19.065 -4.094 -19.440 1.00 27.36 ? 47 TRP H CB 1 ATOM 1983 C CG . TRP B 2 47 ? 19.993 -5.232 -19.089 1.00 27.77 ? 47 TRP H CG 1 ATOM 1984 C CD1 . TRP B 2 47 ? 21.081 -5.181 -18.269 1.00 25.67 ? 47 TRP H CD1 1 ATOM 1985 C CD2 . TRP B 2 47 ? 19.873 -6.601 -19.508 1.00 33.71 ? 47 TRP H CD2 1 ATOM 1986 N NE1 . TRP B 2 47 ? 21.658 -6.425 -18.166 1.00 23.77 ? 47 TRP H NE1 1 ATOM 1987 C CE2 . TRP B 2 47 ? 20.937 -7.313 -18.919 1.00 27.06 ? 47 TRP H CE2 1 ATOM 1988 C CE3 . TRP B 2 47 ? 18.976 -7.289 -20.335 1.00 26.80 ? 47 TRP H CE3 1 ATOM 1989 C CZ2 . TRP B 2 47 ? 21.127 -8.678 -19.126 1.00 27.85 ? 47 TRP H CZ2 1 ATOM 1990 C CZ3 . TRP B 2 47 ? 19.168 -8.644 -20.542 1.00 27.11 ? 47 TRP H CZ3 1 ATOM 1991 C CH2 . TRP B 2 47 ? 20.235 -9.324 -19.942 1.00 31.72 ? 47 TRP H CH2 1 ATOM 1992 N N . ILE B 2 48 ? 21.455 -3.721 -21.809 1.00 22.02 ? 48 ILE H N 1 ATOM 1993 C CA . ILE B 2 48 ? 22.064 -4.277 -23.013 1.00 19.47 ? 48 ILE H CA 1 ATOM 1994 C C . ILE B 2 48 ? 22.495 -5.718 -22.781 1.00 23.59 ? 48 ILE H C 1 ATOM 1995 O O . ILE B 2 48 ? 22.262 -6.599 -23.612 1.00 23.43 ? 48 ILE H O 1 ATOM 1996 C CB . ILE B 2 48 ? 23.289 -3.450 -23.454 1.00 18.18 ? 48 ILE H CB 1 ATOM 1997 C CG1 . ILE B 2 48 ? 22.863 -2.027 -23.815 1.00 15.83 ? 48 ILE H CG1 1 ATOM 1998 C CG2 . ILE B 2 48 ? 23.993 -4.116 -24.625 1.00 21.78 ? 48 ILE H CG2 1 ATOM 1999 C CD1 . ILE B 2 48 ? 24.017 -1.096 -24.072 1.00 18.92 ? 48 ILE H CD1 1 ATOM 2000 N N . GLY B 2 49 ? 23.132 -5.947 -21.639 1.00 20.65 ? 49 GLY H N 1 ATOM 2001 C CA . GLY B 2 49 ? 23.624 -7.264 -21.299 1.00 23.11 ? 49 GLY H CA 1 ATOM 2002 C C . GLY B 2 49 ? 24.594 -7.201 -20.143 1.00 24.18 ? 49 GLY H C 1 ATOM 2003 O O . GLY B 2 49 ? 24.919 -6.120 -19.649 1.00 26.25 ? 49 GLY H O 1 ATOM 2004 N N . GLU B 2 50 ? 25.061 -8.367 -19.719 1.00 22.64 ? 50 GLU H N 1 ATOM 2005 C CA . GLU B 2 50 ? 25.972 -8.480 -18.590 1.00 27.24 ? 50 GLU H CA 1 ATOM 2006 C C . GLU B 2 50 ? 26.732 -9.795 -18.687 1.00 28.67 ? 50 GLU H C 1 ATOM 2007 O O . GLU B 2 50 ? 26.331 -10.692 -19.424 1.00 28.22 ? 50 GLU H O 1 ATOM 2008 C CB . GLU B 2 50 ? 25.208 -8.409 -17.271 1.00 27.10 ? 50 GLU H CB 1 ATOM 2009 C CG . GLU B 2 50 ? 24.253 -9.581 -17.062 1.00 23.72 ? 50 GLU H CG 1 ATOM 2010 C CD . GLU B 2 50 ? 23.260 -9.335 -15.940 1.00 29.48 ? 50 GLU H CD 1 ATOM 2011 O OE1 . GLU B 2 50 ? 22.984 -8.154 -15.628 1.00 32.53 ? 50 GLU H OE1 1 ATOM 2012 O OE2 . GLU B 2 50 ? 22.756 -10.325 -15.369 1.00 36.27 ? 50 GLU H OE2 1 ATOM 2013 N N . ILE B 2 51 ? 27.823 -9.914 -17.940 1.00 23.14 ? 51 ILE H N 1 ATOM 2014 C CA . ILE B 2 51 ? 28.606 -11.142 -17.946 1.00 22.90 ? 51 ILE H CA 1 ATOM 2015 C C . ILE B 2 51 ? 29.335 -11.335 -16.619 1.00 25.72 ? 51 ILE H C 1 ATOM 2016 O O . ILE B 2 51 ? 29.707 -10.356 -15.967 1.00 20.93 ? 51 ILE H O 1 ATOM 2017 C CB . ILE B 2 51 ? 29.634 -11.137 -19.105 1.00 29.43 ? 51 ILE H CB 1 ATOM 2018 C CG1 . ILE B 2 51 ? 30.261 -12.520 -19.294 1.00 25.21 ? 51 ILE H CG1 1 ATOM 2019 C CG2 . ILE B 2 51 ? 30.707 -10.078 -18.876 1.00 21.09 ? 51 ILE H CG2 1 ATOM 2020 C CD1 . ILE B 2 51 ? 31.223 -12.588 -20.456 1.00 27.60 ? 51 ILE H CD1 1 ATOM 2021 N N . LYS B 2 52 ? 29.526 -12.590 -16.213 1.00 20.84 ? 52 LYS H N 1 ATOM 2022 C CA . LYS B 2 52 ? 30.371 -12.893 -15.058 1.00 23.21 ? 52 LYS H CA 1 ATOM 2023 C C . LYS B 2 52 ? 31.576 -13.727 -15.473 1.00 27.43 ? 52 LYS H C 1 ATOM 2024 O O . LYS B 2 52 ? 32.694 -13.475 -15.030 1.00 31.86 ? 52 LYS H O 1 ATOM 2025 C CB . LYS B 2 52 ? 29.595 -13.633 -13.970 1.00 30.00 ? 52 LYS H CB 1 ATOM 2026 C CG . LYS B 2 52 ? 30.472 -13.986 -12.770 1.00 34.54 ? 52 LYS H CG 1 ATOM 2027 C CD . LYS B 2 52 ? 29.810 -14.975 -11.829 1.00 40.36 ? 52 LYS H CD 1 ATOM 2028 C CE . LYS B 2 52 ? 28.777 -14.313 -10.938 1.00 38.44 ? 52 LYS H CE 1 ATOM 2029 N NZ . LYS B 2 52 ? 28.050 -15.331 -10.121 1.00 40.54 ? 52 LYS H NZ 1 ATOM 2030 N N . HIS B 2 53 ? 31.334 -14.737 -16.303 1.00 23.56 ? 53 HIS H N 1 ATOM 2031 C CA . HIS B 2 53 ? 32.403 -15.564 -16.853 1.00 26.78 ? 53 HIS H CA 1 ATOM 2032 C C . HIS B 2 53 ? 32.444 -15.409 -18.356 1.00 26.44 ? 53 HIS H C 1 ATOM 2033 O O . HIS B 2 53 ? 31.409 -15.517 -19.018 1.00 28.35 ? 53 HIS H O 1 ATOM 2034 C CB . HIS B 2 53 ? 32.203 -17.045 -16.511 1.00 34.58 ? 53 HIS H CB 1 ATOM 2035 C CG . HIS B 2 53 ? 31.986 -17.310 -15.057 1.00 36.61 ? 53 HIS H CG 1 ATOM 2036 N ND1 . HIS B 2 53 ? 30.979 -18.133 -14.597 1.00 32.57 ? 53 HIS H ND1 1 ATOM 2037 C CD2 . HIS B 2 53 ? 32.643 -16.868 -13.960 1.00 37.92 ? 53 HIS H CD2 1 ATOM 2038 C CE1 . HIS B 2 53 ? 31.023 -18.181 -13.278 1.00 37.44 ? 53 HIS H CE1 1 ATOM 2039 N NE2 . HIS B 2 53 ? 32.025 -17.424 -12.866 1.00 37.41 ? 53 HIS H NE2 1 ATOM 2040 N N . ASN B 2 54 ? 33.633 -15.160 -18.894 1.00 32.93 ? 54 ASN H N 1 ATOM 2041 C CA . ASN B 2 54 ? 33.826 -15.176 -20.340 1.00 41.90 ? 54 ASN H CA 1 ATOM 2042 C C . ASN B 2 54 ? 33.262 -16.465 -20.929 1.00 40.31 ? 54 ASN H C 1 ATOM 2043 O O . ASN B 2 54 ? 33.495 -17.551 -20.398 1.00 38.77 ? 54 ASN H O 1 ATOM 2044 C CB . ASN B 2 54 ? 35.309 -15.029 -20.694 1.00 42.02 ? 54 ASN H CB 1 ATOM 2045 C CG . ASN B 2 54 ? 35.788 -13.589 -20.625 1.00 44.21 ? 54 ASN H CG 1 ATOM 2046 O OD1 . ASN B 2 54 ? 35.058 -12.658 -20.976 1.00 41.94 ? 54 ASN H OD1 1 ATOM 2047 N ND2 . ASN B 2 54 ? 37.023 -13.399 -20.174 1.00 42.68 ? 54 ASN H ND2 1 ATOM 2048 N N . GLY B 2 55 ? 32.501 -16.345 -22.009 1.00 37.48 ? 55 GLY H N 1 ATOM 2049 C CA . GLY B 2 55 ? 31.870 -17.513 -22.594 1.00 36.79 ? 55 GLY H CA 1 ATOM 2050 C C . GLY B 2 55 ? 30.421 -17.670 -22.167 1.00 36.95 ? 55 GLY H C 1 ATOM 2051 O O . GLY B 2 55 ? 29.659 -18.388 -22.813 1.00 36.31 ? 55 GLY H O 1 ATOM 2052 N N . SER B 2 56 ? 30.034 -16.994 -21.085 1.00 35.97 ? 56 SER H N 1 ATOM 2053 C CA . SER B 2 56 ? 28.638 -17.004 -20.638 1.00 28.97 ? 56 SER H CA 1 ATOM 2054 C C . SER B 2 56 ? 28.033 -15.603 -20.534 1.00 27.61 ? 56 SER H C 1 ATOM 2055 O O . SER B 2 56 ? 27.637 -15.172 -19.447 1.00 26.77 ? 56 SER H O 1 ATOM 2056 C CB . SER B 2 56 ? 28.509 -17.703 -19.282 1.00 30.44 ? 56 SER H CB 1 ATOM 2057 O OG . SER B 2 56 ? 29.036 -19.017 -19.325 1.00 40.87 ? 56 SER H OG 1 ATOM 2058 N N . PRO B 2 57 ? 27.953 -14.883 -21.663 1.00 26.37 ? 57 PRO H N 1 ATOM 2059 C CA . PRO B 2 57 ? 27.276 -13.592 -21.580 1.00 26.95 ? 57 PRO H CA 1 ATOM 2060 C C . PRO B 2 57 ? 25.767 -13.768 -21.563 1.00 28.50 ? 57 PRO H C 1 ATOM 2061 O O . PRO B 2 57 ? 25.269 -14.817 -21.959 1.00 30.11 ? 57 PRO H O 1 ATOM 2062 C CB . PRO B 2 57 ? 27.730 -12.882 -22.852 1.00 26.39 ? 57 PRO H CB 1 ATOM 2063 C CG . PRO B 2 57 ? 27.938 -13.986 -23.830 1.00 27.63 ? 57 PRO H CG 1 ATOM 2064 C CD . PRO B 2 57 ? 28.448 -15.156 -23.026 1.00 30.97 ? 57 PRO H CD 1 ATOM 2065 N N . ASN B 2 58 ? 25.054 -12.750 -21.101 1.00 30.94 ? 58 ASN H N 1 ATOM 2066 C CA . ASN B 2 58 ? 23.602 -12.722 -21.193 1.00 29.18 ? 58 ASN H CA 1 ATOM 2067 C C . ASN B 2 58 ? 23.172 -11.410 -21.846 1.00 31.26 ? 58 ASN H C 1 ATOM 2068 O O . ASN B 2 58 ? 23.390 -10.342 -21.282 1.00 29.27 ? 58 ASN H O 1 ATOM 2069 C CB . ASN B 2 58 ? 22.974 -12.877 -19.805 1.00 33.42 ? 58 ASN H CB 1 ATOM 2070 C CG . ASN B 2 58 ? 21.473 -13.054 -19.859 1.00 38.08 ? 58 ASN H CG 1 ATOM 2071 O OD1 . ASN B 2 58 ? 20.901 -13.288 -20.924 1.00 40.53 ? 58 ASN H OD1 1 ATOM 2072 N ND2 . ASN B 2 58 ? 20.825 -12.955 -18.704 1.00 39.76 ? 58 ASN H ND2 1 ATOM 2073 N N . TYR B 2 59 ? 22.582 -11.488 -23.038 1.00 28.30 ? 59 TYR H N 1 ATOM 2074 C CA . TYR B 2 59 ? 22.229 -10.288 -23.794 1.00 27.33 ? 59 TYR H CA 1 ATOM 2075 C C . TYR B 2 59 ? 20.735 -10.027 -23.901 1.00 36.41 ? 59 TYR H C 1 ATOM 2076 O O . TYR B 2 59 ? 19.917 -10.948 -23.832 1.00 36.72 ? 59 TYR H O 1 ATOM 2077 C CB . TYR B 2 59 ? 22.788 -10.364 -25.212 1.00 23.09 ? 59 TYR H CB 1 ATOM 2078 C CG . TYR B 2 59 ? 24.276 -10.536 -25.284 1.00 27.98 ? 59 TYR H CG 1 ATOM 2079 C CD1 . TYR B 2 59 ? 25.122 -9.684 -24.604 1.00 25.91 ? 59 TYR H CD1 1 ATOM 2080 C CD2 . TYR B 2 59 ? 24.836 -11.562 -26.031 1.00 31.96 ? 59 TYR H CD2 1 ATOM 2081 C CE1 . TYR B 2 59 ? 26.488 -9.843 -24.666 1.00 28.71 ? 59 TYR H CE1 1 ATOM 2082 C CE2 . TYR B 2 59 ? 26.194 -11.728 -26.101 1.00 29.91 ? 59 TYR H CE2 1 ATOM 2083 C CZ . TYR B 2 59 ? 27.018 -10.866 -25.418 1.00 26.51 ? 59 TYR H CZ 1 ATOM 2084 O OH . TYR B 2 59 ? 28.381 -11.033 -25.478 1.00 30.55 ? 59 TYR H OH 1 ATOM 2085 N N . HIS B 2 60 ? 20.399 -8.754 -24.082 1.00 40.14 ? 60 HIS H N 1 ATOM 2086 C CA . HIS B 2 60 ? 19.071 -8.347 -24.511 1.00 33.47 ? 60 HIS H CA 1 ATOM 2087 C C . HIS B 2 60 ? 18.857 -8.892 -25.921 1.00 37.30 ? 60 HIS H C 1 ATOM 2088 O O . HIS B 2 60 ? 19.624 -8.567 -26.828 1.00 43.81 ? 60 HIS H O 1 ATOM 2089 C CB . HIS B 2 60 ? 18.947 -6.823 -24.480 1.00 32.35 ? 60 HIS H CB 1 ATOM 2090 C CG . HIS B 2 60 ? 17.550 -6.320 -24.658 1.00 43.98 ? 60 HIS H CG 1 ATOM 2091 N ND1 . HIS B 2 60 ? 16.940 -6.231 -25.892 1.00 51.55 ? 60 HIS H ND1 1 ATOM 2092 C CD2 . HIS B 2 60 ? 16.647 -5.859 -23.760 1.00 49.80 ? 60 HIS H CD2 1 ATOM 2093 C CE1 . HIS B 2 60 ? 15.720 -5.750 -25.744 1.00 55.15 ? 60 HIS H CE1 1 ATOM 2094 N NE2 . HIS B 2 60 ? 15.517 -5.515 -24.459 1.00 56.40 ? 60 HIS H NE2 1 ATOM 2095 N N . PRO B 2 61 ? 17.824 -9.730 -26.106 1.00 36.53 ? 61 PRO H N 1 ATOM 2096 C CA . PRO B 2 61 ? 17.611 -10.507 -27.337 1.00 32.44 ? 61 PRO H CA 1 ATOM 2097 C C . PRO B 2 61 ? 17.678 -9.694 -28.633 1.00 35.51 ? 61 PRO H C 1 ATOM 2098 O O . PRO B 2 61 ? 18.214 -10.185 -29.629 1.00 41.77 ? 61 PRO H O 1 ATOM 2099 C CB . PRO B 2 61 ? 16.206 -11.083 -27.138 1.00 37.19 ? 61 PRO H CB 1 ATOM 2100 C CG . PRO B 2 61 ? 16.073 -11.205 -25.668 1.00 40.11 ? 61 PRO H CG 1 ATOM 2101 C CD . PRO B 2 61 ? 16.775 -9.997 -25.107 1.00 31.92 ? 61 PRO H CD 1 ATOM 2102 N N . SER B 2 62 ? 17.165 -8.469 -28.620 1.00 34.82 ? 62 SER H N 1 ATOM 2103 C CA . SER B 2 62 ? 17.113 -7.662 -29.837 1.00 40.64 ? 62 SER H CA 1 ATOM 2104 C C . SER B 2 62 ? 18.490 -7.141 -30.255 1.00 44.93 ? 62 SER H C 1 ATOM 2105 O O . SER B 2 62 ? 18.634 -6.547 -31.324 1.00 50.86 ? 62 SER H O 1 ATOM 2106 C CB . SER B 2 62 ? 16.144 -6.487 -29.656 1.00 41.76 ? 62 SER H CB 1 ATOM 2107 O OG . SER B 2 62 ? 16.662 -5.518 -28.757 1.00 46.67 ? 62 SER H OG 1 ATOM 2108 N N . LEU B 2 63 ? 19.499 -7.364 -29.416 1.00 39.38 ? 63 LEU H N 1 ATOM 2109 C CA . LEU B 2 63 ? 20.838 -6.833 -29.666 1.00 40.90 ? 63 LEU H CA 1 ATOM 2110 C C . LEU B 2 63 ? 21.890 -7.929 -29.761 1.00 44.26 ? 63 LEU H C 1 ATOM 2111 O O . LEU B 2 63 ? 23.062 -7.649 -30.014 1.00 43.37 ? 63 LEU H O 1 ATOM 2112 C CB . LEU B 2 63 ? 21.232 -5.848 -28.564 1.00 34.84 ? 63 LEU H CB 1 ATOM 2113 C CG . LEU B 2 63 ? 20.520 -4.499 -28.581 1.00 34.79 ? 63 LEU H CG 1 ATOM 2114 C CD1 . LEU B 2 63 ? 20.787 -3.750 -27.291 1.00 40.38 ? 63 LEU H CD1 1 ATOM 2115 C CD2 . LEU B 2 63 ? 20.980 -3.689 -29.776 1.00 33.65 ? 63 LEU H CD2 1 ATOM 2116 N N . LYS B 2 64 ? 21.459 -9.170 -29.559 1.00 43.23 ? 64 LYS H N 1 ATOM 2117 C CA . LYS B 2 64 ? 22.364 -10.309 -29.438 1.00 46.16 ? 64 LYS H CA 1 ATOM 2118 C C . LYS B 2 64 ? 23.336 -10.442 -30.613 1.00 42.40 ? 64 LYS H C 1 ATOM 2119 O O . LYS B 2 64 ? 24.537 -10.638 -30.417 1.00 43.91 ? 64 LYS H O 1 ATOM 2120 C CB . LYS B 2 64 ? 21.553 -11.599 -29.285 1.00 57.02 ? 64 LYS H CB 1 ATOM 2121 C CG . LYS B 2 64 ? 22.394 -12.847 -29.054 1.00 68.25 ? 64 LYS H CG 1 ATOM 2122 C CD . LYS B 2 64 ? 21.554 -14.109 -29.201 1.00 75.13 ? 64 LYS H CD 1 ATOM 2123 C CE . LYS B 2 64 ? 22.428 -15.355 -29.210 1.00 79.87 ? 64 LYS H CE 1 ATOM 2124 N NZ . LYS B 2 64 ? 21.655 -16.586 -29.535 1.00 83.07 ? 64 LYS H NZ 1 ATOM 2125 N N . SER B 2 65 ? 22.820 -10.315 -31.831 1.00 40.90 ? 65 SER H N 1 ATOM 2126 C CA . SER B 2 65 ? 23.631 -10.528 -33.025 1.00 40.58 ? 65 SER H CA 1 ATOM 2127 C C . SER B 2 65 ? 24.653 -9.416 -33.275 1.00 39.29 ? 65 SER H C 1 ATOM 2128 O O . SER B 2 65 ? 25.567 -9.583 -34.084 1.00 41.18 ? 65 SER H O 1 ATOM 2129 C CB . SER B 2 65 ? 22.728 -10.677 -34.251 1.00 46.38 ? 65 SER H CB 1 ATOM 2130 O OG . SER B 2 65 ? 22.048 -9.468 -34.533 1.00 53.28 ? 65 SER H OG 1 ATOM 2131 N N . ARG B 2 66 ? 24.504 -8.287 -32.587 1.00 32.71 ? 66 ARG H N 1 ATOM 2132 C CA . ARG B 2 66 ? 25.409 -7.159 -32.791 1.00 34.11 ? 66 ARG H CA 1 ATOM 2133 C C . ARG B 2 66 ? 26.324 -6.907 -31.597 1.00 32.27 ? 66 ARG H C 1 ATOM 2134 O O . ARG B 2 66 ? 27.360 -6.255 -31.734 1.00 32.79 ? 66 ARG H O 1 ATOM 2135 C CB . ARG B 2 66 ? 24.621 -5.880 -33.094 1.00 37.34 ? 66 ARG H CB 1 ATOM 2136 C CG . ARG B 2 66 ? 23.898 -5.883 -34.430 1.00 38.63 ? 66 ARG H CG 1 ATOM 2137 C CD . ARG B 2 66 ? 23.539 -4.466 -34.861 1.00 34.32 ? 66 ARG H CD 1 ATOM 2138 N NE . ARG B 2 66 ? 22.582 -3.833 -33.956 1.00 33.54 ? 66 ARG H NE 1 ATOM 2139 C CZ . ARG B 2 66 ? 22.655 -2.567 -33.553 1.00 32.48 ? 66 ARG H CZ 1 ATOM 2140 N NH1 . ARG B 2 66 ? 23.650 -1.791 -33.964 1.00 32.86 ? 66 ARG H NH1 1 ATOM 2141 N NH2 . ARG B 2 66 ? 21.733 -2.074 -32.736 1.00 25.64 ? 66 ARG H NH2 1 ATOM 2142 N N . VAL B 2 67 ? 25.943 -7.430 -30.435 1.00 27.04 ? 67 VAL H N 1 ATOM 2143 C CA . VAL B 2 67 ? 26.613 -7.095 -29.183 1.00 31.68 ? 67 VAL H CA 1 ATOM 2144 C C . VAL B 2 67 ? 27.580 -8.164 -28.690 1.00 33.12 ? 67 VAL H C 1 ATOM 2145 O O . VAL B 2 67 ? 27.246 -9.348 -28.625 1.00 30.87 ? 67 VAL H O 1 ATOM 2146 C CB . VAL B 2 67 ? 25.586 -6.834 -28.057 1.00 35.62 ? 67 VAL H CB 1 ATOM 2147 C CG1 . VAL B 2 67 ? 26.268 -6.777 -26.696 1.00 40.03 ? 67 VAL H CG1 1 ATOM 2148 C CG2 . VAL B 2 67 ? 24.820 -5.555 -28.320 1.00 44.79 ? 67 VAL H CG2 1 ATOM 2149 N N . THR B 2 68 ? 28.780 -7.729 -28.328 1.00 24.10 ? 68 THR H N 1 ATOM 2150 C CA . THR B 2 68 ? 29.702 -8.569 -27.584 1.00 23.75 ? 68 THR H CA 1 ATOM 2151 C C . THR B 2 68 ? 30.099 -7.870 -26.287 1.00 32.01 ? 68 THR H C 1 ATOM 2152 O O . THR B 2 68 ? 30.498 -6.704 -26.297 1.00 31.40 ? 68 THR H O 1 ATOM 2153 C CB . THR B 2 68 ? 30.962 -8.889 -28.404 1.00 31.12 ? 68 THR H CB 1 ATOM 2154 O OG1 . THR B 2 68 ? 30.586 -9.547 -29.618 1.00 37.16 ? 68 THR H OG1 1 ATOM 2155 C CG2 . THR B 2 68 ? 31.901 -9.792 -27.616 1.00 37.57 ? 68 THR H CG2 1 ATOM 2156 N N . ILE B 2 69 ? 29.972 -8.576 -25.169 1.00 28.85 ? 69 ILE H N 1 ATOM 2157 C CA . ILE B 2 69 ? 30.483 -8.088 -23.891 1.00 25.49 ? 69 ILE H CA 1 ATOM 2158 C C . ILE B 2 69 ? 31.545 -9.057 -23.386 1.00 27.53 ? 69 ILE H C 1 ATOM 2159 O O . ILE B 2 69 ? 31.329 -10.266 -23.372 1.00 29.68 ? 69 ILE H O 1 ATOM 2160 C CB . ILE B 2 69 ? 29.370 -7.939 -22.842 1.00 21.68 ? 69 ILE H CB 1 ATOM 2161 C CG1 . ILE B 2 69 ? 28.379 -6.858 -23.270 1.00 21.82 ? 69 ILE H CG1 1 ATOM 2162 C CG2 . ILE B 2 69 ? 29.962 -7.596 -21.488 1.00 23.71 ? 69 ILE H CG2 1 ATOM 2163 C CD1 . ILE B 2 69 ? 27.167 -6.754 -22.373 1.00 21.20 ? 69 ILE H CD1 1 ATOM 2164 N N . SER B 2 70 ? 32.695 -8.532 -22.983 1.00 29.30 ? 70 SER H N 1 ATOM 2165 C CA . SER B 2 70 ? 33.812 -9.384 -22.598 1.00 26.68 ? 70 SER H CA 1 ATOM 2166 C C . SER B 2 70 ? 34.573 -8.838 -21.396 1.00 31.83 ? 70 SER H C 1 ATOM 2167 O O . SER B 2 70 ? 34.545 -7.642 -21.125 1.00 31.73 ? 70 SER H O 1 ATOM 2168 C CB . SER B 2 70 ? 34.769 -9.553 -23.776 1.00 27.06 ? 70 SER H CB 1 ATOM 2169 O OG . SER B 2 70 ? 35.245 -8.289 -24.212 1.00 34.58 ? 70 SER H OG 1 ATOM 2170 N N . LEU B 2 71 ? 35.260 -9.727 -20.684 1.00 31.84 ? 71 LEU H N 1 ATOM 2171 C CA . LEU B 2 71 ? 36.069 -9.336 -19.541 1.00 31.46 ? 71 LEU H CA 1 ATOM 2172 C C . LEU B 2 71 ? 37.561 -9.373 -19.871 1.00 32.40 ? 71 LEU H C 1 ATOM 2173 O O . LEU B 2 71 ? 38.038 -10.303 -20.517 1.00 26.99 ? 71 LEU H O 1 ATOM 2174 C CB . LEU B 2 71 ? 35.796 -10.253 -18.348 1.00 30.18 ? 71 LEU H CB 1 ATOM 2175 C CG . LEU B 2 71 ? 34.385 -10.307 -17.763 1.00 33.41 ? 71 LEU H CG 1 ATOM 2176 C CD1 . LEU B 2 71 ? 34.310 -11.392 -16.715 1.00 36.32 ? 71 LEU H CD1 1 ATOM 2177 C CD2 . LEU B 2 71 ? 33.995 -8.979 -17.156 1.00 27.53 ? 71 LEU H CD2 1 ATOM 2178 N N . ASP B 2 72 ? 38.287 -8.349 -19.434 1.00 28.74 ? 72 ASP H N 1 ATOM 2179 C CA . ASP B 2 72 ? 39.744 -8.374 -19.437 1.00 27.15 ? 72 ASP H CA 1 ATOM 2180 C C . ASP B 2 72 ? 40.189 -8.564 -17.996 1.00 27.06 ? 72 ASP H C 1 ATOM 2181 O O . ASP B 2 72 ? 40.399 -7.595 -17.265 1.00 26.83 ? 72 ASP H O 1 ATOM 2182 C CB . ASP B 2 72 ? 40.333 -7.089 -20.026 1.00 27.38 ? 72 ASP H CB 1 ATOM 2183 C CG . ASP B 2 72 ? 41.844 -7.170 -20.221 1.00 39.49 ? 72 ASP H CG 1 ATOM 2184 O OD1 . ASP B 2 72 ? 42.475 -8.114 -19.689 1.00 36.38 ? 72 ASP H OD1 1 ATOM 2185 O OD2 . ASP B 2 72 ? 42.400 -6.280 -20.905 1.00 43.82 ? 72 ASP H OD2 1 ATOM 2186 N N . MET B 2 73 ? 40.334 -9.821 -17.597 1.00 24.86 ? 73 MET H N 1 ATOM 2187 C CA . MET B 2 73 ? 40.481 -10.164 -16.190 1.00 26.76 ? 73 MET H CA 1 ATOM 2188 C C . MET B 2 73 ? 41.817 -9.763 -15.580 1.00 28.63 ? 73 MET H C 1 ATOM 2189 O O . MET B 2 73 ? 41.889 -9.493 -14.382 1.00 34.65 ? 73 MET H O 1 ATOM 2190 C CB . MET B 2 73 ? 40.246 -11.660 -16.011 1.00 22.35 ? 73 MET H CB 1 ATOM 2191 C CG . MET B 2 73 ? 38.782 -12.013 -16.204 1.00 33.50 ? 73 MET H CG 1 ATOM 2192 S SD . MET B 2 73 ? 38.500 -13.705 -16.712 1.00 37.36 ? 73 MET H SD 1 ATOM 2193 C CE . MET B 2 73 ? 38.896 -14.573 -15.200 1.00 16.89 ? 73 MET H CE 1 ATOM 2194 N N . SER B 2 74 ? 42.869 -9.705 -16.390 1.00 24.43 ? 74 SER H N 1 ATOM 2195 C CA . SER B 2 74 ? 44.181 -9.349 -15.854 1.00 27.36 ? 74 SER H CA 1 ATOM 2196 C C . SER B 2 74 ? 44.235 -7.869 -15.489 1.00 27.97 ? 74 SER H C 1 ATOM 2197 O O . SER B 2 74 ? 45.038 -7.464 -14.653 1.00 27.83 ? 74 SER H O 1 ATOM 2198 C CB . SER B 2 74 ? 45.295 -9.703 -16.845 1.00 25.67 ? 74 SER H CB 1 ATOM 2199 O OG . SER B 2 74 ? 44.976 -9.287 -18.160 1.00 31.21 ? 74 SER H OG 1 ATOM 2200 N N . LYS B 2 75 ? 43.363 -7.068 -16.096 1.00 28.45 ? 75 LYS H N 1 ATOM 2201 C CA . LYS B 2 75 ? 43.326 -5.630 -15.824 1.00 30.59 ? 75 LYS H CA 1 ATOM 2202 C C . LYS B 2 75 ? 42.116 -5.181 -14.998 1.00 30.98 ? 75 LYS H C 1 ATOM 2203 O O . LYS B 2 75 ? 42.003 -4.001 -14.664 1.00 28.71 ? 75 LYS H O 1 ATOM 2204 C CB . LYS B 2 75 ? 43.344 -4.848 -17.139 1.00 28.37 ? 75 LYS H CB 1 ATOM 2205 C CG . LYS B 2 75 ? 44.542 -5.154 -18.010 1.00 27.96 ? 75 LYS H CG 1 ATOM 2206 C CD . LYS B 2 75 ? 44.544 -4.305 -19.266 1.00 27.73 ? 75 LYS H CD 1 ATOM 2207 C CE . LYS B 2 75 ? 45.471 -4.906 -20.308 1.00 39.29 ? 75 LYS H CE 1 ATOM 2208 N NZ . LYS B 2 75 ? 45.484 -4.101 -21.555 1.00 52.96 ? 75 LYS H NZ 1 ATOM 2209 N N . ASN B 2 76 ? 41.219 -6.117 -14.679 1.00 24.20 ? 76 ASN H N 1 ATOM 2210 C CA . ASN B 2 76 ? 39.949 -5.794 -14.024 1.00 19.28 ? 76 ASN H CA 1 ATOM 2211 C C . ASN B 2 76 ? 39.154 -4.776 -14.834 1.00 23.43 ? 76 ASN H C 1 ATOM 2212 O O . ASN B 2 76 ? 38.688 -3.768 -14.307 1.00 19.24 ? 76 ASN H O 1 ATOM 2213 C CB . ASN B 2 76 ? 40.170 -5.278 -12.596 1.00 21.24 ? 76 ASN H CB 1 ATOM 2214 C CG . ASN B 2 76 ? 40.263 -6.404 -11.577 1.00 32.48 ? 76 ASN H CG 1 ATOM 2215 O OD1 . ASN B 2 76 ? 39.384 -7.265 -11.505 1.00 34.19 ? 76 ASN H OD1 1 ATOM 2216 N ND2 . ASN B 2 76 ? 41.339 -6.413 -10.796 1.00 28.36 ? 76 ASN H ND2 1 ATOM 2217 N N . GLN B 2 77 ? 39.014 -5.054 -16.125 1.00 18.76 ? 77 GLN H N 1 ATOM 2218 C CA . GLN B 2 77 ? 38.266 -4.197 -17.027 1.00 23.72 ? 77 GLN H CA 1 ATOM 2219 C C . GLN B 2 77 ? 37.291 -5.048 -17.821 1.00 24.25 ? 77 GLN H C 1 ATOM 2220 O O . GLN B 2 77 ? 37.501 -6.249 -17.992 1.00 27.37 ? 77 GLN H O 1 ATOM 2221 C CB . GLN B 2 77 ? 39.211 -3.433 -17.967 1.00 23.70 ? 77 GLN H CB 1 ATOM 2222 C CG . GLN B 2 77 ? 40.232 -2.573 -17.236 1.00 20.10 ? 77 GLN H CG 1 ATOM 2223 C CD . GLN B 2 77 ? 41.204 -1.863 -18.164 1.00 26.64 ? 77 GLN H CD 1 ATOM 2224 O OE1 . GLN B 2 77 ? 41.239 -2.118 -19.372 1.00 26.80 ? 77 GLN H OE1 1 ATOM 2225 N NE2 . GLN B 2 77 ? 42.006 -0.967 -17.597 1.00 22.55 ? 77 GLN H NE2 1 ATOM 2226 N N . PHE B 2 78 ? 36.207 -4.440 -18.281 1.00 19.36 ? 78 PHE H N 1 ATOM 2227 C CA . PHE B 2 78 ? 35.327 -5.135 -19.206 1.00 20.70 ? 78 PHE H CA 1 ATOM 2228 C C . PHE B 2 78 ? 34.877 -4.177 -20.291 1.00 24.47 ? 78 PHE H C 1 ATOM 2229 O O . PHE B 2 78 ? 34.934 -2.957 -20.128 1.00 24.44 ? 78 PHE H O 1 ATOM 2230 C CB . PHE B 2 78 ? 34.131 -5.778 -18.485 1.00 19.18 ? 78 PHE H CB 1 ATOM 2231 C CG . PHE B 2 78 ? 33.221 -4.809 -17.774 1.00 15.29 ? 78 PHE H CG 1 ATOM 2232 C CD1 . PHE B 2 78 ? 33.593 -4.238 -16.568 1.00 15.07 ? 78 PHE H CD1 1 ATOM 2233 C CD2 . PHE B 2 78 ? 31.962 -4.526 -18.284 1.00 14.79 ? 78 PHE H CD2 1 ATOM 2234 C CE1 . PHE B 2 78 ? 32.749 -3.374 -15.904 1.00 18.84 ? 78 PHE H CE1 1 ATOM 2235 C CE2 . PHE B 2 78 ? 31.106 -3.662 -17.624 1.00 19.86 ? 78 PHE H CE2 1 ATOM 2236 C CZ . PHE B 2 78 ? 31.495 -3.083 -16.435 1.00 24.22 ? 78 PHE H CZ 1 ATOM 2237 N N . SER B 2 79 ? 34.464 -4.741 -21.417 1.00 22.14 ? 79 SER H N 1 ATOM 2238 C CA . SER B 2 79 ? 34.250 -3.956 -22.616 1.00 22.11 ? 79 SER H CA 1 ATOM 2239 C C . SER B 2 79 ? 32.937 -4.285 -23.291 1.00 25.39 ? 79 SER H C 1 ATOM 2240 O O . SER B 2 79 ? 32.393 -5.377 -23.122 1.00 23.40 ? 79 SER H O 1 ATOM 2241 C CB . SER B 2 79 ? 35.404 -4.175 -23.597 1.00 30.26 ? 79 SER H CB 1 ATOM 2242 O OG . SER B 2 79 ? 36.572 -3.493 -23.170 1.00 33.51 ? 79 SER H OG 1 ATOM 2243 N N . LEU B 2 80 ? 32.444 -3.323 -24.062 1.00 21.31 ? 80 LEU H N 1 ATOM 2244 C CA . LEU B 2 80 ? 31.243 -3.491 -24.864 1.00 23.88 ? 80 LEU H CA 1 ATOM 2245 C C . LEU B 2 80 ? 31.560 -3.247 -26.328 1.00 28.71 ? 80 LEU H C 1 ATOM 2246 O O . LEU B 2 80 ? 32.198 -2.254 -26.682 1.00 22.37 ? 80 LEU H O 1 ATOM 2247 C CB . LEU B 2 80 ? 30.140 -2.531 -24.411 1.00 22.86 ? 80 LEU H CB 1 ATOM 2248 C CG . LEU B 2 80 ? 28.988 -2.322 -25.402 1.00 24.61 ? 80 LEU H CG 1 ATOM 2249 C CD1 . LEU B 2 80 ? 28.107 -3.558 -25.511 1.00 22.03 ? 80 LEU H CD1 1 ATOM 2250 C CD2 . LEU B 2 80 ? 28.157 -1.097 -25.041 1.00 25.10 ? 80 LEU H CD2 1 ATOM 2251 N N . ASN B 2 81 ? 31.110 -4.158 -27.177 1.00 27.05 ? 81 ASN H N 1 ATOM 2252 C CA . ASN B 2 81 ? 31.229 -3.983 -28.610 1.00 21.89 ? 81 ASN H CA 1 ATOM 2253 C C . ASN B 2 81 ? 29.858 -4.049 -29.260 1.00 28.43 ? 81 ASN H C 1 ATOM 2254 O O . ASN B 2 81 ? 29.066 -4.949 -28.974 1.00 30.87 ? 81 ASN H O 1 ATOM 2255 C CB . ASN B 2 81 ? 32.161 -5.036 -29.197 1.00 34.94 ? 81 ASN H CB 1 ATOM 2256 C CG . ASN B 2 81 ? 33.541 -4.492 -29.482 1.00 55.86 ? 81 ASN H CG 1 ATOM 2257 O OD1 . ASN B 2 81 ? 33.953 -3.473 -28.923 1.00 57.09 ? 81 ASN H OD1 1 ATOM 2258 N ND2 . ASN B 2 81 ? 34.269 -5.172 -30.357 1.00 78.91 ? 81 ASN H ND2 1 ATOM 2259 N N . LEU B 2 82 ? 29.580 -3.078 -30.120 1.00 25.52 ? 82 LEU H N 1 ATOM 2260 C CA . LEU B 2 82 ? 28.318 -3.006 -30.836 1.00 33.12 ? 82 LEU H CA 1 ATOM 2261 C C . LEU B 2 82 ? 28.587 -2.689 -32.305 1.00 36.02 ? 82 LEU H C 1 ATOM 2262 O O . LEU B 2 82 ? 29.024 -1.585 -32.640 1.00 33.09 ? 82 LEU H O 1 ATOM 2263 C CB . LEU B 2 82 ? 27.402 -1.950 -30.205 1.00 28.79 ? 82 LEU H CB 1 ATOM 2264 C CG . LEU B 2 82 ? 26.014 -1.726 -30.816 1.00 31.17 ? 82 LEU H CG 1 ATOM 2265 C CD1 . LEU B 2 82 ? 25.142 -2.967 -30.698 1.00 33.05 ? 82 LEU H CD1 1 ATOM 2266 C CD2 . LEU B 2 82 ? 25.316 -0.515 -30.196 1.00 30.20 ? 82 LEU H CD2 1 ATOM 2267 N N . THR B 2 83 A 28.331 -3.667 -33.172 1.00 31.40 ? 82 THR H N 1 ATOM 2268 C CA . THR B 2 83 A 28.662 -3.562 -34.592 1.00 27.28 ? 82 THR H CA 1 ATOM 2269 C C . THR B 2 83 A 27.541 -2.949 -35.421 1.00 30.22 ? 82 THR H C 1 ATOM 2270 O O . THR B 2 83 A 26.385 -2.931 -35.000 1.00 26.36 ? 82 THR H O 1 ATOM 2271 C CB . THR B 2 83 A 29.004 -4.946 -35.197 1.00 28.28 ? 82 THR H CB 1 ATOM 2272 O OG1 . THR B 2 83 A 27.923 -5.857 -34.960 1.00 30.71 ? 82 THR H OG1 1 ATOM 2273 C CG2 . THR B 2 83 A 30.277 -5.505 -34.583 1.00 23.86 ? 82 THR H CG2 1 ATOM 2274 N N . SER B 2 84 B 27.907 -2.463 -36.606 1.00 33.89 ? 82 SER H N 1 ATOM 2275 C CA . SER B 2 84 B 26.975 -1.870 -37.565 1.00 29.14 ? 82 SER H CA 1 ATOM 2276 C C . SER B 2 84 B 26.036 -0.863 -36.924 1.00 28.95 ? 82 SER H C 1 ATOM 2277 O O . SER B 2 84 B 24.815 -1.005 -37.000 1.00 24.70 ? 82 SER H O 1 ATOM 2278 C CB . SER B 2 84 B 26.163 -2.964 -38.260 1.00 31.04 ? 82 SER H CB 1 ATOM 2279 O OG . SER B 2 84 B 27.024 -3.904 -38.878 1.00 35.36 ? 82 SER H OG 1 ATOM 2280 N N . VAL B 2 85 C 26.603 0.151 -36.280 1.00 23.66 ? 82 VAL H N 1 ATOM 2281 C CA . VAL B 2 85 C 25.774 1.115 -35.578 1.00 25.68 ? 82 VAL H CA 1 ATOM 2282 C C . VAL B 2 85 C 25.034 2.001 -36.569 1.00 31.78 ? 82 VAL H C 1 ATOM 2283 O O . VAL B 2 85 C 25.515 2.265 -37.673 1.00 35.44 ? 82 VAL H O 1 ATOM 2284 C CB . VAL B 2 85 C 26.600 1.988 -34.609 1.00 23.10 ? 82 VAL H CB 1 ATOM 2285 C CG1 . VAL B 2 85 C 27.232 1.118 -33.527 1.00 24.28 ? 82 VAL H CG1 1 ATOM 2286 C CG2 . VAL B 2 85 C 27.666 2.772 -35.362 1.00 21.76 ? 82 VAL H CG2 1 ATOM 2287 N N . THR B 2 86 ? 23.838 2.419 -36.176 1.00 30.35 ? 83 THR H N 1 ATOM 2288 C CA . THR B 2 86 ? 23.075 3.402 -36.926 1.00 33.77 ? 83 THR H CA 1 ATOM 2289 C C . THR B 2 86 ? 22.769 4.548 -35.986 1.00 31.92 ? 83 THR H C 1 ATOM 2290 O O . THR B 2 86 ? 23.138 4.500 -34.811 1.00 27.99 ? 83 THR H O 1 ATOM 2291 C CB . THR B 2 86 ? 21.763 2.834 -37.480 1.00 31.72 ? 83 THR H CB 1 ATOM 2292 O OG1 . THR B 2 86 ? 20.805 2.726 -36.419 1.00 33.24 ? 83 THR H OG1 1 ATOM 2293 C CG2 . THR B 2 86 ? 21.993 1.468 -38.113 1.00 33.30 ? 83 THR H CG2 1 ATOM 2294 N N . ALA B 2 87 ? 22.079 5.564 -36.495 1.00 29.22 ? 84 ALA H N 1 ATOM 2295 C CA . ALA B 2 87 ? 21.723 6.725 -35.688 1.00 29.48 ? 84 ALA H CA 1 ATOM 2296 C C . ALA B 2 87 ? 20.910 6.327 -34.462 1.00 29.28 ? 84 ALA H C 1 ATOM 2297 O O . ALA B 2 87 ? 20.981 6.984 -33.430 1.00 32.40 ? 84 ALA H O 1 ATOM 2298 C CB . ALA B 2 87 ? 20.954 7.737 -36.526 1.00 29.22 ? 84 ALA H CB 1 ATOM 2299 N N . ALA B 2 88 ? 20.157 5.237 -34.577 1.00 31.68 ? 85 ALA H N 1 ATOM 2300 C CA . ALA B 2 88 ? 19.326 4.742 -33.481 1.00 32.42 ? 85 ALA H CA 1 ATOM 2301 C C . ALA B 2 88 ? 20.137 4.238 -32.285 1.00 30.90 ? 85 ALA H C 1 ATOM 2302 O O . ALA B 2 88 ? 19.579 3.980 -31.221 1.00 34.67 ? 85 ALA H O 1 ATOM 2303 C CB . ALA B 2 88 ? 18.411 3.635 -33.982 1.00 30.11 ? 85 ALA H CB 1 ATOM 2304 N N . ASP B 2 89 ? 21.446 4.086 -32.458 1.00 23.63 ? 86 ASP H N 1 ATOM 2305 C CA . ASP B 2 89 ? 22.300 3.628 -31.367 1.00 23.96 ? 86 ASP H CA 1 ATOM 2306 C C . ASP B 2 89 ? 22.887 4.819 -30.621 1.00 30.22 ? 86 ASP H C 1 ATOM 2307 O O . ASP B 2 89 ? 23.701 4.659 -29.709 1.00 29.97 ? 86 ASP H O 1 ATOM 2308 C CB . ASP B 2 89 ? 23.417 2.727 -31.893 1.00 25.57 ? 86 ASP H CB 1 ATOM 2309 C CG . ASP B 2 89 ? 22.894 1.411 -32.440 1.00 33.40 ? 86 ASP H CG 1 ATOM 2310 O OD1 . ASP B 2 89 ? 22.045 0.785 -31.769 1.00 32.98 ? 86 ASP H OD1 1 ATOM 2311 O OD2 . ASP B 2 89 ? 23.325 1.009 -33.544 1.00 33.72 ? 86 ASP H OD2 1 ATOM 2312 N N . THR B 2 90 ? 22.472 6.015 -31.027 1.00 27.01 ? 87 THR H N 1 ATOM 2313 C CA . THR B 2 90 ? 22.879 7.236 -30.351 1.00 22.99 ? 87 THR H CA 1 ATOM 2314 C C . THR B 2 90 ? 22.281 7.246 -28.957 1.00 20.49 ? 87 THR H C 1 ATOM 2315 O O . THR B 2 90 ? 21.068 7.116 -28.796 1.00 21.84 ? 87 THR H O 1 ATOM 2316 C CB . THR B 2 90 ? 22.436 8.491 -31.125 1.00 28.21 ? 87 THR H CB 1 ATOM 2317 O OG1 . THR B 2 90 ? 23.129 8.542 -32.378 1.00 26.17 ? 87 THR H OG1 1 ATOM 2318 C CG2 . THR B 2 90 ? 22.743 9.752 -30.335 1.00 28.95 ? 87 THR H CG2 1 ATOM 2319 N N . ALA B 2 91 ? 23.142 7.387 -27.953 1.00 23.12 ? 88 ALA H N 1 ATOM 2320 C CA . ALA B 2 91 ? 22.725 7.278 -26.558 1.00 15.36 ? 88 ALA H CA 1 ATOM 2321 C C . ALA B 2 91 ? 23.881 7.562 -25.616 1.00 21.41 ? 88 ALA H C 1 ATOM 2322 O O . ALA B 2 91 ? 25.046 7.612 -26.037 1.00 20.05 ? 88 ALA H O 1 ATOM 2323 C CB . ALA B 2 91 ? 22.158 5.874 -26.278 1.00 19.41 ? 88 ALA H CB 1 ATOM 2324 N N . VAL B 2 92 ? 23.563 7.747 -24.337 1.00 18.86 ? 89 VAL H N 1 ATOM 2325 C CA . VAL B 2 92 ? 24.586 7.643 -23.308 1.00 18.99 ? 89 VAL H CA 1 ATOM 2326 C C . VAL B 2 92 ? 24.673 6.181 -22.872 1.00 21.07 ? 89 VAL H C 1 ATOM 2327 O O . VAL B 2 92 ? 23.660 5.564 -22.526 1.00 17.87 ? 89 VAL H O 1 ATOM 2328 C CB . VAL B 2 92 ? 24.301 8.530 -22.087 1.00 23.68 ? 89 VAL H CB 1 ATOM 2329 C CG1 . VAL B 2 92 ? 25.394 8.336 -21.036 1.00 21.09 ? 89 VAL H CG1 1 ATOM 2330 C CG2 . VAL B 2 92 ? 24.216 10.000 -22.498 1.00 22.78 ? 89 VAL H CG2 1 ATOM 2331 N N . TYR B 2 93 ? 25.882 5.630 -22.908 1.00 20.45 ? 90 TYR H N 1 ATOM 2332 C CA . TYR B 2 93 ? 26.124 4.253 -22.499 1.00 21.96 ? 90 TYR H CA 1 ATOM 2333 C C . TYR B 2 93 ? 26.756 4.195 -21.110 1.00 25.05 ? 90 TYR H C 1 ATOM 2334 O O . TYR B 2 93 ? 27.780 4.832 -20.863 1.00 22.20 ? 90 TYR H O 1 ATOM 2335 C CB . TYR B 2 93 ? 27.020 3.550 -23.528 1.00 20.89 ? 90 TYR H CB 1 ATOM 2336 C CG . TYR B 2 93 ? 26.298 3.224 -24.818 1.00 24.08 ? 90 TYR H CG 1 ATOM 2337 C CD1 . TYR B 2 93 ? 25.922 4.230 -25.701 1.00 21.01 ? 90 TYR H CD1 1 ATOM 2338 C CD2 . TYR B 2 93 ? 25.985 1.914 -25.148 1.00 17.48 ? 90 TYR H CD2 1 ATOM 2339 C CE1 . TYR B 2 93 ? 25.252 3.942 -26.873 1.00 24.08 ? 90 TYR H CE1 1 ATOM 2340 C CE2 . TYR B 2 93 ? 25.315 1.614 -26.321 1.00 23.02 ? 90 TYR H CE2 1 ATOM 2341 C CZ . TYR B 2 93 ? 24.949 2.633 -27.179 1.00 27.20 ? 90 TYR H CZ 1 ATOM 2342 O OH . TYR B 2 93 ? 24.281 2.348 -28.349 1.00 27.02 ? 90 TYR H OH 1 ATOM 2343 N N . PHE B 2 94 ? 26.142 3.431 -20.209 1.00 17.87 ? 91 PHE H N 1 ATOM 2344 C CA . PHE B 2 94 ? 26.663 3.248 -18.854 1.00 20.00 ? 91 PHE H CA 1 ATOM 2345 C C . PHE B 2 94 ? 27.176 1.830 -18.644 1.00 22.66 ? 91 PHE H C 1 ATOM 2346 O O . PHE B 2 94 ? 26.602 0.882 -19.169 1.00 20.23 ? 91 PHE H O 1 ATOM 2347 C CB . PHE B 2 94 ? 25.585 3.513 -17.796 1.00 22.47 ? 91 PHE H CB 1 ATOM 2348 C CG . PHE B 2 94 ? 25.010 4.896 -17.824 1.00 18.73 ? 91 PHE H CG 1 ATOM 2349 C CD1 . PHE B 2 94 ? 25.673 5.951 -17.215 1.00 14.60 ? 91 PHE H CD1 1 ATOM 2350 C CD2 . PHE B 2 94 ? 23.777 5.133 -18.418 1.00 21.82 ? 91 PHE H CD2 1 ATOM 2351 C CE1 . PHE B 2 94 ? 25.131 7.236 -17.226 1.00 15.61 ? 91 PHE H CE1 1 ATOM 2352 C CE2 . PHE B 2 94 ? 23.230 6.409 -18.431 1.00 23.65 ? 91 PHE H CE2 1 ATOM 2353 C CZ . PHE B 2 94 ? 23.906 7.461 -17.835 1.00 19.16 ? 91 PHE H CZ 1 ATOM 2354 N N . CYS B 2 95 ? 28.235 1.683 -17.857 1.00 19.77 ? 92 CYS H N 1 ATOM 2355 C CA . CYS B 2 95 ? 28.598 0.378 -17.323 1.00 23.70 ? 92 CYS H CA 1 ATOM 2356 C C . CYS B 2 95 ? 28.182 0.339 -15.849 1.00 24.35 ? 92 CYS H C 1 ATOM 2357 O O . CYS B 2 95 ? 28.021 1.387 -15.218 1.00 21.96 ? 92 CYS H O 1 ATOM 2358 C CB . CYS B 2 95 ? 30.099 0.091 -17.496 1.00 25.62 ? 92 CYS H CB 1 ATOM 2359 S SG . CYS B 2 95 ? 31.282 1.222 -16.656 1.00 31.32 ? 92 CYS H SG 1 ATOM 2360 N N . ALA B 2 96 ? 27.989 -0.863 -15.310 1.00 16.60 ? 93 ALA H N 1 ATOM 2361 C CA . ALA B 2 96 ? 27.532 -1.015 -13.931 1.00 17.11 ? 93 ALA H CA 1 ATOM 2362 C C . ALA B 2 96 ? 27.845 -2.395 -13.380 1.00 22.63 ? 93 ALA H C 1 ATOM 2363 O O . ALA B 2 96 ? 27.998 -3.355 -14.137 1.00 26.23 ? 93 ALA H O 1 ATOM 2364 C CB . ALA B 2 96 ? 26.033 -0.749 -13.834 1.00 11.93 ? 93 ALA H CB 1 ATOM 2365 N N . ARG B 2 97 ? 27.931 -2.487 -12.056 1.00 14.85 ? 94 ARG H N 1 ATOM 2366 C CA . ARG B 2 97 ? 28.078 -3.777 -11.389 1.00 17.29 ? 94 ARG H CA 1 ATOM 2367 C C . ARG B 2 97 ? 26.706 -4.353 -11.045 1.00 21.57 ? 94 ARG H C 1 ATOM 2368 O O . ARG B 2 97 ? 25.777 -3.614 -10.715 1.00 23.53 ? 94 ARG H O 1 ATOM 2369 C CB . ARG B 2 97 ? 28.919 -3.645 -10.117 1.00 18.01 ? 94 ARG H CB 1 ATOM 2370 C CG . ARG B 2 97 ? 29.163 -4.969 -9.394 1.00 19.95 ? 94 ARG H CG 1 ATOM 2371 C CD . ARG B 2 97 ? 29.835 -4.745 -8.047 1.00 18.06 ? 94 ARG H CD 1 ATOM 2372 N NE . ARG B 2 97 ? 28.910 -4.170 -7.073 1.00 22.79 ? 94 ARG H NE 1 ATOM 2373 C CZ . ARG B 2 97 ? 29.099 -4.201 -5.759 1.00 27.79 ? 94 ARG H CZ 1 ATOM 2374 N NH1 . ARG B 2 97 ? 30.180 -4.784 -5.260 1.00 29.31 ? 94 ARG H NH1 1 ATOM 2375 N NH2 . ARG B 2 97 ? 28.204 -3.659 -4.941 1.00 26.06 ? 94 ARG H NH2 1 ATOM 2376 N N . ARG B 2 98 ? 26.578 -5.671 -11.126 1.00 19.46 ? 95 ARG H N 1 ATOM 2377 C CA . ARG B 2 98 ? 25.340 -6.337 -10.739 1.00 18.02 ? 95 ARG H CA 1 ATOM 2378 C C . ARG B 2 98 ? 25.700 -7.536 -9.881 1.00 20.49 ? 95 ARG H C 1 ATOM 2379 O O . ARG B 2 98 ? 26.414 -8.427 -10.336 1.00 26.99 ? 95 ARG H O 1 ATOM 2380 C CB . ARG B 2 98 ? 24.543 -6.757 -11.976 1.00 21.90 ? 95 ARG H CB 1 ATOM 2381 C CG . ARG B 2 98 ? 23.055 -6.977 -11.747 1.00 24.72 ? 95 ARG H CG 1 ATOM 2382 C CD . ARG B 2 98 ? 22.650 -8.349 -12.260 1.00 34.54 ? 95 ARG H CD 1 ATOM 2383 N NE . ARG B 2 98 ? 22.820 -9.377 -11.246 1.00 26.21 ? 95 ARG H NE 1 ATOM 2384 C CZ . ARG B 2 98 ? 22.788 -10.685 -11.482 1.00 30.38 ? 95 ARG H CZ 1 ATOM 2385 N NH1 . ARG B 2 98 ? 22.608 -11.155 -12.713 1.00 30.67 ? 95 ARG H NH1 1 ATOM 2386 N NH2 . ARG B 2 98 ? 22.948 -11.526 -10.475 1.00 24.69 ? 95 ARG H NH2 1 ATOM 2387 N N . SER B 2 99 ? 25.224 -7.552 -8.640 1.00 28.21 ? 96 SER H N 1 ATOM 2388 C CA . SER B 2 99 ? 25.645 -8.567 -7.676 1.00 29.90 ? 96 SER H CA 1 ATOM 2389 C C . SER B 2 99 ? 24.758 -9.806 -7.689 1.00 26.88 ? 96 SER H C 1 ATOM 2390 O O . SER B 2 99 ? 23.689 -9.807 -8.290 1.00 26.90 ? 96 SER H O 1 ATOM 2391 C CB . SER B 2 99 ? 25.687 -7.974 -6.267 1.00 30.49 ? 96 SER H CB 1 ATOM 2392 O OG . SER B 2 99 ? 26.754 -7.050 -6.157 1.00 32.92 ? 96 SER H OG 1 ATOM 2393 N N . ASN B 2 100 ? 25.218 -10.866 -7.030 1.00 24.13 ? 97 ASN H N 1 ATOM 2394 C CA . ASN B 2 100 ? 24.501 -12.130 -7.038 1.00 23.39 ? 97 ASN H CA 1 ATOM 2395 C C . ASN B 2 100 ? 23.202 -12.044 -6.261 1.00 27.95 ? 97 ASN H C 1 ATOM 2396 O O . ASN B 2 100 ? 23.099 -11.299 -5.283 1.00 20.40 ? 97 ASN H O 1 ATOM 2397 C CB . ASN B 2 100 ? 25.363 -13.262 -6.458 1.00 24.62 ? 97 ASN H CB 1 ATOM 2398 C CG . ASN B 2 100 ? 26.575 -13.581 -7.317 1.00 28.29 ? 97 ASN H CG 1 ATOM 2399 O OD1 . ASN B 2 100 ? 26.610 -13.274 -8.508 1.00 32.46 ? 97 ASN H OD1 1 ATOM 2400 N ND2 . ASN B 2 100 ? 27.577 -14.210 -6.711 1.00 29.24 ? 97 ASN H ND2 1 ATOM 2401 N N . TRP B 2 101 ? 22.215 -12.807 -6.722 1.00 25.42 ? 98 TRP H N 1 ATOM 2402 C CA . TRP B 2 101 ? 20.968 -13.026 -5.999 1.00 29.39 ? 98 TRP H CA 1 ATOM 2403 C C . TRP B 2 101 ? 21.278 -13.282 -4.526 1.00 28.61 ? 98 TRP H C 1 ATOM 2404 O O . TRP B 2 101 ? 22.210 -14.020 -4.209 1.00 27.36 ? 98 TRP H O 1 ATOM 2405 C CB . TRP B 2 101 ? 20.216 -14.207 -6.620 1.00 26.18 ? 98 TRP H CB 1 ATOM 2406 C CG . TRP B 2 101 ? 18.814 -14.378 -6.161 1.00 23.06 ? 98 TRP H CG 1 ATOM 2407 C CD1 . TRP B 2 101 ? 17.689 -13.965 -6.807 1.00 25.49 ? 98 TRP H CD1 1 ATOM 2408 C CD2 . TRP B 2 101 ? 18.376 -15.027 -4.964 1.00 18.16 ? 98 TRP H CD2 1 ATOM 2409 N NE1 . TRP B 2 101 ? 16.573 -14.310 -6.085 1.00 25.82 ? 98 TRP H NE1 1 ATOM 2410 C CE2 . TRP B 2 101 ? 16.968 -14.962 -4.943 1.00 22.40 ? 98 TRP H CE2 1 ATOM 2411 C CE3 . TRP B 2 101 ? 19.038 -15.652 -3.899 1.00 22.11 ? 98 TRP H CE3 1 ATOM 2412 C CZ2 . TRP B 2 101 ? 16.205 -15.498 -3.905 1.00 21.12 ? 98 TRP H CZ2 1 ATOM 2413 C CZ3 . TRP B 2 101 ? 18.278 -16.187 -2.865 1.00 29.36 ? 98 TRP H CZ3 1 ATOM 2414 C CH2 . TRP B 2 101 ? 16.876 -16.107 -2.878 1.00 24.33 ? 98 TRP H CH2 1 ATOM 2415 N N . PRO B 2 102 ? 20.499 -12.680 -3.617 1.00 23.75 ? 99 PRO H N 1 ATOM 2416 C CA . PRO B 2 102 ? 19.270 -11.919 -3.853 1.00 16.29 ? 99 PRO H CA 1 ATOM 2417 C C . PRO B 2 102 ? 19.477 -10.415 -3.982 1.00 22.94 ? 99 PRO H C 1 ATOM 2418 O O . PRO B 2 102 ? 18.506 -9.663 -3.875 1.00 23.69 ? 99 PRO H O 1 ATOM 2419 C CB . PRO B 2 102 ? 18.457 -12.218 -2.601 1.00 17.86 ? 99 PRO H CB 1 ATOM 2420 C CG . PRO B 2 102 ? 19.528 -12.243 -1.515 1.00 23.04 ? 99 PRO H CG 1 ATOM 2421 C CD . PRO B 2 102 ? 20.785 -12.809 -2.174 1.00 19.90 ? 99 PRO H CD 1 ATOM 2422 N N . TYR B 2 103 ? 20.715 -9.982 -4.182 1.00 29.25 ? 100 TYR H N 1 ATOM 2423 C CA . TYR B 2 103 ? 21.009 -8.559 -4.264 1.00 22.39 ? 100 TYR H CA 1 ATOM 2424 C C . TYR B 2 103 ? 21.251 -8.167 -5.721 1.00 21.89 ? 100 TYR H C 1 ATOM 2425 O O . TYR B 2 103 ? 22.391 -8.030 -6.168 1.00 23.07 ? 100 TYR H O 1 ATOM 2426 C CB . TYR B 2 103 ? 22.212 -8.217 -3.385 1.00 21.23 ? 100 TYR H CB 1 ATOM 2427 C CG . TYR B 2 103 ? 22.556 -6.747 -3.355 1.00 25.38 ? 100 TYR H CG 1 ATOM 2428 C CD1 . TYR B 2 103 ? 21.585 -5.790 -3.078 1.00 24.85 ? 100 TYR H CD1 1 ATOM 2429 C CD2 . TYR B 2 103 ? 23.855 -6.316 -3.591 1.00 25.28 ? 100 TYR H CD2 1 ATOM 2430 C CE1 . TYR B 2 103 ? 21.898 -4.445 -3.050 1.00 24.51 ? 100 TYR H CE1 1 ATOM 2431 C CE2 . TYR B 2 103 ? 24.179 -4.975 -3.565 1.00 21.06 ? 100 TYR H CE2 1 ATOM 2432 C CZ . TYR B 2 103 ? 23.197 -4.044 -3.294 1.00 27.33 ? 100 TYR H CZ 1 ATOM 2433 O OH . TYR B 2 103 ? 23.519 -2.708 -3.264 1.00 31.80 ? 100 TYR H OH 1 ATOM 2434 N N . LEU B 2 104 A 20.161 -7.979 -6.460 1.00 19.61 ? 100 LEU H N 1 ATOM 2435 C CA . LEU B 2 104 A 20.241 -7.827 -7.911 1.00 18.21 ? 100 LEU H CA 1 ATOM 2436 C C . LEU B 2 104 A 20.279 -6.407 -8.528 1.00 18.39 ? 100 LEU H C 1 ATOM 2437 O O . LEU B 2 104 A 20.345 -6.292 -9.755 1.00 23.11 ? 100 LEU H O 1 ATOM 2438 C CB . LEU B 2 104 A 19.062 -8.586 -8.536 1.00 24.30 ? 100 LEU H CB 1 ATOM 2439 C CG . LEU B 2 104 A 18.923 -10.066 -8.160 1.00 20.73 ? 100 LEU H CG 1 ATOM 2440 C CD1 . LEU B 2 104 A 17.541 -10.604 -8.538 1.00 21.40 ? 100 LEU H CD1 1 ATOM 2441 C CD2 . LEU B 2 104 A 20.021 -10.889 -8.818 1.00 22.34 ? 100 LEU H CD2 1 ATOM 2442 N N . PRO B 2 105 B 20.246 -5.327 -7.721 1.00 17.91 ? 100 PRO H N 1 ATOM 2443 C CA . PRO B 2 105 B 20.196 -4.071 -8.485 1.00 22.37 ? 100 PRO H CA 1 ATOM 2444 C C . PRO B 2 105 B 21.536 -3.691 -9.117 1.00 25.27 ? 100 PRO H C 1 ATOM 2445 O O . PRO B 2 105 B 22.562 -4.307 -8.819 1.00 23.57 ? 100 PRO H O 1 ATOM 2446 C CB . PRO B 2 105 B 19.799 -3.045 -7.429 1.00 19.83 ? 100 PRO H CB 1 ATOM 2447 C CG . PRO B 2 105 B 20.433 -3.562 -6.192 1.00 22.99 ? 100 PRO H CG 1 ATOM 2448 C CD . PRO B 2 105 B 20.265 -5.062 -6.269 1.00 20.97 ? 100 PRO H CD 1 ATOM 2449 N N . PHE B 2 106 C 21.512 -2.692 -9.993 1.00 23.86 ? 100 PHE H N 1 ATOM 2450 C CA . PHE B 2 106 C 22.731 -2.148 -10.581 1.00 23.61 ? 100 PHE H CA 1 ATOM 2451 C C . PHE B 2 106 C 23.381 -1.163 -9.616 1.00 25.50 ? 100 PHE H C 1 ATOM 2452 O O . PHE B 2 106 C 22.764 -0.158 -9.256 1.00 19.89 ? 100 PHE H O 1 ATOM 2453 C CB . PHE B 2 106 C 22.428 -1.463 -11.915 1.00 21.80 ? 100 PHE H CB 1 ATOM 2454 C CG . PHE B 2 106 C 22.030 -2.417 -13.010 1.00 24.44 ? 100 PHE H CG 1 ATOM 2455 C CD1 . PHE B 2 106 C 22.797 -3.535 -13.286 1.00 26.67 ? 100 PHE H CD1 1 ATOM 2456 C CD2 . PHE B 2 106 C 20.879 -2.203 -13.752 1.00 25.59 ? 100 PHE H CD2 1 ATOM 2457 C CE1 . PHE B 2 106 C 22.427 -4.422 -14.293 1.00 28.60 ? 100 PHE H CE1 1 ATOM 2458 C CE2 . PHE B 2 106 C 20.502 -3.084 -14.758 1.00 29.47 ? 100 PHE H CE2 1 ATOM 2459 C CZ . PHE B 2 106 C 21.274 -4.195 -15.027 1.00 25.83 ? 100 PHE H CZ 1 ATOM 2460 N N . ASP B 2 107 ? 24.620 -1.452 -9.209 1.00 19.19 ? 101 ASP H N 1 ATOM 2461 C CA . ASP B 2 107 ? 25.361 -0.598 -8.278 1.00 21.24 ? 101 ASP H CA 1 ATOM 2462 C C . ASP B 2 107 ? 26.778 -1.133 -8.038 1.00 21.92 ? 101 ASP H C 1 ATOM 2463 O O . ASP B 2 107 ? 26.937 -2.291 -7.675 1.00 23.36 ? 101 ASP H O 1 ATOM 2464 C CB . ASP B 2 107 ? 24.619 -0.496 -6.942 1.00 25.15 ? 101 ASP H CB 1 ATOM 2465 C CG . ASP B 2 107 ? 25.162 0.605 -6.055 1.00 38.39 ? 101 ASP H CG 1 ATOM 2466 O OD1 . ASP B 2 107 ? 25.404 1.718 -6.565 1.00 42.07 ? 101 ASP H OD1 1 ATOM 2467 O OD2 . ASP B 2 107 ? 25.344 0.359 -4.847 1.00 48.50 ? 101 ASP H OD2 1 ATOM 2468 N N . PRO B 2 108 ? 27.814 -0.299 -8.236 1.00 23.08 ? 102 PRO H N 1 ATOM 2469 C CA . PRO B 2 108 ? 27.819 1.099 -8.693 1.00 18.99 ? 102 PRO H CA 1 ATOM 2470 C C . PRO B 2 108 ? 27.671 1.247 -10.204 1.00 21.14 ? 102 PRO H C 1 ATOM 2471 O O . PRO B 2 108 ? 27.552 0.253 -10.921 1.00 23.35 ? 102 PRO H O 1 ATOM 2472 C CB . PRO B 2 108 ? 29.201 1.614 -8.259 1.00 11.79 ? 102 PRO H CB 1 ATOM 2473 C CG . PRO B 2 108 ? 29.874 0.479 -7.532 1.00 19.22 ? 102 PRO H CG 1 ATOM 2474 C CD . PRO B 2 108 ? 29.175 -0.770 -7.926 1.00 17.07 ? 102 PRO H CD 1 ATOM 2475 N N . TRP B 2 109 ? 27.699 2.496 -10.666 1.00 20.55 ? 103 TRP H N 1 ATOM 2476 C CA . TRP B 2 109 ? 27.567 2.842 -12.080 1.00 22.14 ? 103 TRP H CA 1 ATOM 2477 C C . TRP B 2 109 ? 28.789 3.620 -12.556 1.00 21.62 ? 103 TRP H C 1 ATOM 2478 O O . TRP B 2 109 ? 29.364 4.396 -11.795 1.00 20.03 ? 103 TRP H O 1 ATOM 2479 C CB . TRP B 2 109 ? 26.323 3.706 -12.330 1.00 22.65 ? 103 TRP H CB 1 ATOM 2480 C CG . TRP B 2 109 ? 24.976 3.061 -12.145 1.00 18.09 ? 103 TRP H CG 1 ATOM 2481 C CD1 . TRP B 2 109 ? 24.407 2.664 -10.968 1.00 21.73 ? 103 TRP H CD1 1 ATOM 2482 C CD2 . TRP B 2 109 ? 23.998 2.812 -13.168 1.00 17.10 ? 103 TRP H CD2 1 ATOM 2483 N NE1 . TRP B 2 109 ? 23.147 2.154 -11.200 1.00 21.85 ? 103 TRP H NE1 1 ATOM 2484 C CE2 . TRP B 2 109 ? 22.872 2.238 -12.539 1.00 20.09 ? 103 TRP H CE2 1 ATOM 2485 C CE3 . TRP B 2 109 ? 23.973 3.007 -14.552 1.00 21.98 ? 103 TRP H CE3 1 ATOM 2486 C CZ2 . TRP B 2 109 ? 21.732 1.853 -13.255 1.00 18.80 ? 103 TRP H CZ2 1 ATOM 2487 C CZ3 . TRP B 2 109 ? 22.839 2.626 -15.260 1.00 21.25 ? 103 TRP H CZ3 1 ATOM 2488 C CH2 . TRP B 2 109 ? 21.735 2.057 -14.609 1.00 20.90 ? 103 TRP H CH2 1 ATOM 2489 N N . GLY B 2 110 ? 29.170 3.435 -13.816 1.00 22.03 ? 104 GLY H N 1 ATOM 2490 C CA . GLY B 2 110 ? 30.135 4.323 -14.445 1.00 16.35 ? 104 GLY H CA 1 ATOM 2491 C C . GLY B 2 110 ? 29.483 5.669 -14.723 1.00 20.33 ? 104 GLY H C 1 ATOM 2492 O O . GLY B 2 110 ? 28.271 5.820 -14.568 1.00 25.66 ? 104 GLY H O 1 ATOM 2493 N N . GLN B 2 111 ? 30.278 6.648 -15.145 1.00 24.26 ? 105 GLN H N 1 ATOM 2494 C CA . GLN B 2 111 ? 29.776 8.005 -15.339 1.00 28.66 ? 105 GLN H CA 1 ATOM 2495 C C . GLN B 2 111 ? 29.033 8.148 -16.663 1.00 28.18 ? 105 GLN H C 1 ATOM 2496 O O . GLN B 2 111 ? 28.374 9.156 -16.905 1.00 35.84 ? 105 GLN H O 1 ATOM 2497 C CB . GLN B 2 111 ? 30.923 9.017 -15.275 1.00 33.06 ? 105 GLN H CB 1 ATOM 2498 C CG . GLN B 2 111 ? 31.780 9.091 -16.547 1.00 40.02 ? 105 GLN H CG 1 ATOM 2499 C CD . GLN B 2 111 ? 32.822 7.978 -16.644 1.00 43.77 ? 105 GLN H CD 1 ATOM 2500 O OE1 . GLN B 2 111 ? 32.875 7.077 -15.803 1.00 44.87 ? 105 GLN H OE1 1 ATOM 2501 N NE2 . GLN B 2 111 ? 33.658 8.045 -17.675 1.00 40.84 ? 105 GLN H NE2 1 ATOM 2502 N N . GLY B 2 112 ? 29.142 7.136 -17.517 1.00 27.23 ? 106 GLY H N 1 ATOM 2503 C CA . GLY B 2 112 ? 28.490 7.158 -18.814 1.00 20.10 ? 106 GLY H CA 1 ATOM 2504 C C . GLY B 2 112 ? 29.359 7.732 -19.919 1.00 24.48 ? 106 GLY H C 1 ATOM 2505 O O . GLY B 2 112 ? 30.206 8.590 -19.680 1.00 23.78 ? 106 GLY H O 1 ATOM 2506 N N . THR B 2 113 ? 29.150 7.242 -21.134 1.00 27.19 ? 107 THR H N 1 ATOM 2507 C CA . THR B 2 113 ? 29.809 7.784 -22.313 1.00 27.18 ? 107 THR H CA 1 ATOM 2508 C C . THR B 2 113 ? 28.760 8.238 -23.316 1.00 34.81 ? 107 THR H C 1 ATOM 2509 O O . THR B 2 113 ? 27.887 7.460 -23.703 1.00 29.68 ? 107 THR H O 1 ATOM 2510 C CB . THR B 2 113 ? 30.735 6.752 -22.986 1.00 25.48 ? 107 THR H CB 1 ATOM 2511 O OG1 . THR B 2 113 ? 31.849 6.474 -22.131 1.00 31.92 ? 107 THR H OG1 1 ATOM 2512 C CG2 . THR B 2 113 ? 31.251 7.287 -24.317 1.00 26.95 ? 107 THR H CG2 1 ATOM 2513 N N . LEU B 2 114 ? 28.837 9.495 -23.733 1.00 30.73 ? 108 LEU H N 1 ATOM 2514 C CA . LEU B 2 114 ? 27.936 9.982 -24.764 1.00 29.57 ? 108 LEU H CA 1 ATOM 2515 C C . LEU B 2 114 ? 28.366 9.424 -26.108 1.00 29.53 ? 108 LEU H C 1 ATOM 2516 O O . LEU B 2 114 ? 29.501 9.626 -26.535 1.00 31.40 ? 108 LEU H O 1 ATOM 2517 C CB . LEU B 2 114 ? 27.914 11.508 -24.806 1.00 38.21 ? 108 LEU H CB 1 ATOM 2518 C CG . LEU B 2 114 ? 27.082 12.112 -25.940 1.00 47.19 ? 108 LEU H CG 1 ATOM 2519 C CD1 . LEU B 2 114 ? 25.668 11.534 -25.960 1.00 42.18 ? 108 LEU H CD1 1 ATOM 2520 C CD2 . LEU B 2 114 ? 27.042 13.628 -25.813 1.00 56.53 ? 108 LEU H CD2 1 ATOM 2521 N N . VAL B 2 115 ? 27.462 8.710 -26.768 1.00 21.97 ? 109 VAL H N 1 ATOM 2522 C CA . VAL B 2 115 ? 27.766 8.151 -28.077 1.00 24.54 ? 109 VAL H CA 1 ATOM 2523 C C . VAL B 2 115 ? 26.827 8.714 -29.131 1.00 23.45 ? 109 VAL H C 1 ATOM 2524 O O . VAL B 2 115 ? 25.606 8.595 -29.027 1.00 28.07 ? 109 VAL H O 1 ATOM 2525 C CB . VAL B 2 115 ? 27.681 6.616 -28.077 1.00 26.64 ? 109 VAL H CB 1 ATOM 2526 C CG1 . VAL B 2 115 ? 27.736 6.083 -29.497 1.00 21.76 ? 109 VAL H CG1 1 ATOM 2527 C CG2 . VAL B 2 115 ? 28.807 6.027 -27.235 1.00 21.88 ? 109 VAL H CG2 1 ATOM 2528 N N . THR B 2 116 ? 27.415 9.341 -30.141 1.00 24.36 ? 110 THR H N 1 ATOM 2529 C CA . THR B 2 116 ? 26.659 9.937 -31.233 1.00 24.09 ? 110 THR H CA 1 ATOM 2530 C C . THR B 2 116 ? 27.004 9.248 -32.538 1.00 23.75 ? 110 THR H C 1 ATOM 2531 O O . THR B 2 116 ? 28.169 9.195 -32.932 1.00 23.31 ? 110 THR H O 1 ATOM 2532 C CB . THR B 2 116 ? 26.946 11.439 -31.371 1.00 30.78 ? 110 THR H CB 1 ATOM 2533 O OG1 . THR B 2 116 ? 26.700 12.090 -30.120 1.00 33.60 ? 110 THR H OG1 1 ATOM 2534 C CG2 . THR B 2 116 ? 26.059 12.052 -32.448 1.00 29.20 ? 110 THR H CG2 1 ATOM 2535 N N . VAL B 2 117 ? 25.991 8.707 -33.202 1.00 28.05 ? 111 VAL H N 1 ATOM 2536 C CA . VAL B 2 117 ? 26.190 8.089 -34.500 1.00 22.23 ? 111 VAL H CA 1 ATOM 2537 C C . VAL B 2 117 ? 25.568 8.964 -35.574 1.00 26.98 ? 111 VAL H C 1 ATOM 2538 O O . VAL B 2 117 ? 24.353 9.159 -35.600 1.00 22.97 ? 111 VAL H O 1 ATOM 2539 C CB . VAL B 2 117 ? 25.577 6.681 -34.572 1.00 25.17 ? 111 VAL H CB 1 ATOM 2540 C CG1 . VAL B 2 117 ? 25.813 6.072 -35.950 1.00 24.40 ? 111 VAL H CG1 1 ATOM 2541 C CG2 . VAL B 2 117 ? 26.165 5.793 -33.487 1.00 17.66 ? 111 VAL H CG2 1 ATOM 2542 N N . SER B 2 118 ? 26.402 9.504 -36.454 1.00 22.24 ? 112 SER H N 1 ATOM 2543 C CA . SER B 2 118 ? 25.898 10.310 -37.558 1.00 24.40 ? 112 SER H CA 1 ATOM 2544 C C . SER B 2 118 ? 26.886 10.330 -38.705 1.00 28.77 ? 112 SER H C 1 ATOM 2545 O O . SER B 2 118 ? 28.081 10.104 -38.512 1.00 31.49 ? 112 SER H O 1 ATOM 2546 C CB . SER B 2 118 ? 25.603 11.741 -37.106 1.00 26.65 ? 112 SER H CB 1 ATOM 2547 O OG . SER B 2 118 ? 25.249 12.557 -38.213 1.00 30.77 ? 112 SER H OG 1 ATOM 2548 N N . SER B 2 119 ? 26.377 10.603 -39.900 1.00 24.43 ? 113 SER H N 1 ATOM 2549 C CA . SER B 2 119 ? 27.223 10.755 -41.072 1.00 29.66 ? 113 SER H CA 1 ATOM 2550 C C . SER B 2 119 ? 27.703 12.203 -41.192 1.00 30.47 ? 113 SER H C 1 ATOM 2551 O O . SER B 2 119 ? 28.535 12.520 -42.040 1.00 29.35 ? 113 SER H O 1 ATOM 2552 C CB . SER B 2 119 ? 26.470 10.336 -42.337 1.00 27.85 ? 113 SER H CB 1 ATOM 2553 O OG . SER B 2 119 ? 25.347 11.174 -42.539 1.00 33.69 ? 113 SER H OG 1 ATOM 2554 N N . ALA B 2 120 ? 27.178 13.075 -40.335 1.00 24.29 ? 114 ALA H N 1 ATOM 2555 C CA . ALA B 2 120 ? 27.508 14.494 -40.396 1.00 31.33 ? 114 ALA H CA 1 ATOM 2556 C C . ALA B 2 120 ? 29.006 14.724 -40.249 1.00 36.93 ? 114 ALA H C 1 ATOM 2557 O O . ALA B 2 120 ? 29.674 14.043 -39.474 1.00 38.67 ? 114 ALA H O 1 ATOM 2558 C CB . ALA B 2 120 ? 26.749 15.264 -39.329 1.00 30.80 ? 114 ALA H CB 1 ATOM 2559 N N . SER B 2 121 ? 29.527 15.674 -41.017 1.00 40.66 ? 115 SER H N 1 ATOM 2560 C CA . SER B 2 121 ? 30.932 16.042 -40.939 1.00 45.31 ? 115 SER H CA 1 ATOM 2561 C C . SER B 2 121 ? 31.129 17.082 -39.844 1.00 45.22 ? 115 SER H C 1 ATOM 2562 O O . SER B 2 121 ? 30.220 17.860 -39.554 1.00 37.57 ? 115 SER H O 1 ATOM 2563 C CB . SER B 2 121 ? 31.422 16.588 -42.283 1.00 54.37 ? 115 SER H CB 1 ATOM 2564 O OG . SER B 2 121 ? 31.103 15.706 -43.346 1.00 60.00 ? 115 SER H OG 1 ATOM 2565 N N . THR B 2 122 ? 32.313 17.093 -39.239 1.00 44.84 ? 116 THR H N 1 ATOM 2566 C CA . THR B 2 122 ? 32.632 18.085 -38.219 1.00 47.11 ? 116 THR H CA 1 ATOM 2567 C C . THR B 2 122 ? 32.571 19.491 -38.806 1.00 45.67 ? 116 THR H C 1 ATOM 2568 O O . THR B 2 122 ? 33.180 19.771 -39.837 1.00 55.82 ? 116 THR H O 1 ATOM 2569 C CB . THR B 2 122 ? 34.026 17.845 -37.605 1.00 43.09 ? 116 THR H CB 1 ATOM 2570 O OG1 . THR B 2 122 ? 34.035 16.587 -36.916 1.00 46.91 ? 116 THR H OG1 1 ATOM 2571 C CG2 . THR B 2 122 ? 34.378 18.956 -36.626 1.00 38.20 ? 116 THR H CG2 1 ATOM 2572 N N . LYS B 2 123 ? 31.816 20.366 -38.152 1.00 42.18 ? 117 LYS H N 1 ATOM 2573 C CA . LYS B 2 123 ? 31.665 21.740 -38.610 1.00 37.58 ? 117 LYS H CA 1 ATOM 2574 C C . LYS B 2 123 ? 31.625 22.700 -37.432 1.00 37.57 ? 117 LYS H C 1 ATOM 2575 O O . LYS B 2 123 ? 30.989 22.419 -36.416 1.00 38.76 ? 117 LYS H O 1 ATOM 2576 C CB . LYS B 2 123 ? 30.398 21.892 -39.453 1.00 32.73 ? 117 LYS H CB 1 ATOM 2577 C CG . LYS B 2 123 ? 30.196 23.281 -40.031 1.00 31.83 ? 117 LYS H CG 1 ATOM 2578 C CD . LYS B 2 123 ? 28.954 23.345 -40.905 1.00 42.42 ? 117 LYS H CD 1 ATOM 2579 C CE . LYS B 2 123 ? 28.755 24.738 -41.495 1.00 54.71 ? 117 LYS H CE 1 ATOM 2580 N NZ . LYS B 2 123 ? 28.607 25.783 -40.436 1.00 63.63 ? 117 LYS H NZ 1 ATOM 2581 N N . GLY B 2 124 ? 32.315 23.828 -37.574 1.00 35.91 ? 118 GLY H N 1 ATOM 2582 C CA . GLY B 2 124 ? 32.302 24.866 -36.563 1.00 32.45 ? 118 GLY H CA 1 ATOM 2583 C C . GLY B 2 124 ? 31.054 25.720 -36.657 1.00 39.34 ? 118 GLY H C 1 ATOM 2584 O O . GLY B 2 124 ? 30.468 25.863 -37.733 1.00 38.69 ? 118 GLY H O 1 ATOM 2585 N N . PRO B 2 125 ? 30.639 26.300 -35.525 1.00 33.41 ? 119 PRO H N 1 ATOM 2586 C CA . PRO B 2 125 ? 29.408 27.090 -35.448 1.00 34.46 ? 119 PRO H CA 1 ATOM 2587 C C . PRO B 2 125 ? 29.544 28.476 -36.054 1.00 36.58 ? 119 PRO H C 1 ATOM 2588 O O . PRO B 2 125 ? 30.625 29.064 -36.012 1.00 32.67 ? 119 PRO H O 1 ATOM 2589 C CB . PRO B 2 125 ? 29.164 27.198 -33.943 1.00 35.36 ? 119 PRO H CB 1 ATOM 2590 C CG . PRO B 2 125 ? 30.530 27.178 -33.355 1.00 32.46 ? 119 PRO H CG 1 ATOM 2591 C CD . PRO B 2 125 ? 31.328 26.232 -34.224 1.00 34.47 ? 119 PRO H CD 1 ATOM 2592 N N . SER B 2 126 ? 28.450 28.980 -36.617 1.00 27.58 ? 120 SER H N 1 ATOM 2593 C CA . SER B 2 126 ? 28.341 30.390 -36.947 1.00 31.11 ? 120 SER H CA 1 ATOM 2594 C C . SER B 2 126 ? 27.717 31.086 -35.751 1.00 31.85 ? 120 SER H C 1 ATOM 2595 O O . SER B 2 126 ? 26.761 30.579 -35.166 1.00 37.09 ? 120 SER H O 1 ATOM 2596 C CB . SER B 2 126 ? 27.490 30.614 -38.200 1.00 35.83 ? 120 SER H CB 1 ATOM 2597 O OG . SER B 2 126 ? 27.913 29.778 -39.263 1.00 46.64 ? 120 SER H OG 1 ATOM 2598 N N . VAL B 2 127 ? 28.255 32.238 -35.379 1.00 31.58 ? 121 VAL H N 1 ATOM 2599 C CA . VAL B 2 127 ? 27.718 32.972 -34.245 1.00 30.87 ? 121 VAL H CA 1 ATOM 2600 C C . VAL B 2 127 ? 27.085 34.278 -34.704 1.00 32.77 ? 121 VAL H C 1 ATOM 2601 O O . VAL B 2 127 ? 27.742 35.125 -35.314 1.00 31.84 ? 121 VAL H O 1 ATOM 2602 C CB . VAL B 2 127 ? 28.803 33.259 -33.195 1.00 30.09 ? 121 VAL H CB 1 ATOM 2603 C CG1 . VAL B 2 127 ? 28.232 34.089 -32.054 1.00 35.13 ? 121 VAL H CG1 1 ATOM 2604 C CG2 . VAL B 2 127 ? 29.384 31.954 -32.673 1.00 22.93 ? 121 VAL H CG2 1 ATOM 2605 N N . PHE B 2 128 ? 25.799 34.431 -34.415 1.00 23.08 ? 122 PHE H N 1 ATOM 2606 C CA . PHE B 2 128 ? 25.075 35.624 -34.812 1.00 21.84 ? 122 PHE H CA 1 ATOM 2607 C C . PHE B 2 128 ? 24.571 36.350 -33.577 1.00 26.11 ? 122 PHE H C 1 ATOM 2608 O O . PHE B 2 128 ? 24.223 35.717 -32.578 1.00 24.69 ? 122 PHE H O 1 ATOM 2609 C CB . PHE B 2 128 ? 23.907 35.276 -35.743 1.00 26.33 ? 122 PHE H CB 1 ATOM 2610 C CG . PHE B 2 128 ? 24.312 34.498 -36.970 1.00 28.89 ? 122 PHE H CG 1 ATOM 2611 C CD1 . PHE B 2 128 ? 25.118 35.077 -37.941 1.00 29.51 ? 122 PHE H CD1 1 ATOM 2612 C CD2 . PHE B 2 128 ? 23.871 33.200 -37.159 1.00 28.99 ? 122 PHE H CD2 1 ATOM 2613 C CE1 . PHE B 2 128 ? 25.488 34.373 -39.070 1.00 28.51 ? 122 PHE H CE1 1 ATOM 2614 C CE2 . PHE B 2 128 ? 24.235 32.486 -38.290 1.00 37.00 ? 122 PHE H CE2 1 ATOM 2615 C CZ . PHE B 2 128 ? 25.048 33.075 -39.247 1.00 35.31 ? 122 PHE H CZ 1 ATOM 2616 N N . PRO B 2 129 ? 24.531 37.688 -33.641 1.00 33.53 ? 123 PRO H N 1 ATOM 2617 C CA . PRO B 2 129 ? 24.053 38.472 -32.502 1.00 29.90 ? 123 PRO H CA 1 ATOM 2618 C C . PRO B 2 129 ? 22.538 38.441 -32.390 1.00 26.33 ? 123 PRO H C 1 ATOM 2619 O O . PRO B 2 129 ? 21.845 38.424 -33.405 1.00 30.11 ? 123 PRO H O 1 ATOM 2620 C CB . PRO B 2 129 ? 24.548 39.884 -32.823 1.00 33.65 ? 123 PRO H CB 1 ATOM 2621 C CG . PRO B 2 129 ? 24.555 39.935 -34.312 1.00 33.34 ? 123 PRO H CG 1 ATOM 2622 C CD . PRO B 2 129 ? 24.932 38.545 -34.772 1.00 30.39 ? 123 PRO H CD 1 ATOM 2623 N N . LEU B 2 130 ? 22.038 38.399 -31.163 1.00 23.75 ? 124 LEU H N 1 ATOM 2624 C CA . LEU B 2 130 ? 20.632 38.655 -30.898 1.00 26.75 ? 124 LEU H CA 1 ATOM 2625 C C . LEU B 2 130 ? 20.576 40.032 -30.258 1.00 28.32 ? 124 LEU H C 1 ATOM 2626 O O . LEU B 2 130 ? 20.719 40.172 -29.043 1.00 29.48 ? 124 LEU H O 1 ATOM 2627 C CB . LEU B 2 130 ? 20.025 37.579 -29.996 1.00 21.44 ? 124 LEU H CB 1 ATOM 2628 C CG . LEU B 2 130 ? 19.942 36.187 -30.633 1.00 27.46 ? 124 LEU H CG 1 ATOM 2629 C CD1 . LEU B 2 130 ? 19.603 35.113 -29.599 1.00 19.40 ? 124 LEU H CD1 1 ATOM 2630 C CD2 . LEU B 2 130 ? 18.921 36.183 -31.761 1.00 24.07 ? 124 LEU H CD2 1 ATOM 2631 N N . ALA B 2 131 ? 20.401 41.050 -31.091 1.00 27.39 ? 125 ALA H N 1 ATOM 2632 C CA . ALA B 2 131 ? 20.596 42.427 -30.658 1.00 30.64 ? 125 ALA H CA 1 ATOM 2633 C C . ALA B 2 131 ? 19.448 42.926 -29.797 1.00 31.36 ? 125 ALA H C 1 ATOM 2634 O O . ALA B 2 131 ? 18.283 42.676 -30.097 1.00 34.88 ? 125 ALA H O 1 ATOM 2635 C CB . ALA B 2 131 ? 20.779 43.331 -31.863 1.00 29.53 ? 125 ALA H CB 1 ATOM 2636 N N . PRO B 2 132 ? 19.779 43.641 -28.716 1.00 34.39 ? 126 PRO H N 1 ATOM 2637 C CA . PRO B 2 132 ? 18.753 44.261 -27.878 1.00 40.37 ? 126 PRO H CA 1 ATOM 2638 C C . PRO B 2 132 ? 18.143 45.453 -28.601 1.00 46.49 ? 126 PRO H C 1 ATOM 2639 O O . PRO B 2 132 ? 18.826 46.088 -29.402 1.00 46.76 ? 126 PRO H O 1 ATOM 2640 C CB . PRO B 2 132 ? 19.534 44.701 -26.639 1.00 35.88 ? 126 PRO H CB 1 ATOM 2641 C CG . PRO B 2 132 ? 20.911 44.990 -27.171 1.00 31.08 ? 126 PRO H CG 1 ATOM 2642 C CD . PRO B 2 132 ? 21.143 43.991 -28.277 1.00 32.96 ? 126 PRO H CD 1 ATOM 2643 N N . SER B 2 133 ? 16.878 45.746 -28.330 1.00 54.59 ? 127 SER H N 1 ATOM 2644 C CA . SER B 2 133 ? 16.226 46.895 -28.942 1.00 68.93 ? 127 SER H CA 1 ATOM 2645 C C . SER B 2 133 ? 15.167 47.472 -28.015 1.00 84.63 ? 127 SER H C 1 ATOM 2646 O O . SER B 2 133 ? 14.775 46.834 -27.040 1.00 88.78 ? 127 SER H O 1 ATOM 2647 C CB . SER B 2 133 ? 15.608 46.504 -30.281 1.00 69.67 ? 127 SER H CB 1 ATOM 2648 O OG . SER B 2 133 ? 14.863 45.305 -30.161 1.00 74.13 ? 127 SER H OG 1 ATOM 2649 N N . SER B 2 134 ? 14.706 48.679 -28.326 1.00 96.98 ? 128 SER H N 1 ATOM 2650 C CA . SER B 2 134 ? 13.740 49.368 -27.476 1.00 104.05 ? 128 SER H CA 1 ATOM 2651 C C . SER B 2 134 ? 12.374 48.687 -27.507 1.00 110.06 ? 128 SER H C 1 ATOM 2652 O O . SER B 2 134 ? 11.526 48.947 -26.653 1.00 106.20 ? 128 SER H O 1 ATOM 2653 C CB . SER B 2 134 ? 13.615 50.833 -27.889 1.00 100.51 ? 128 SER H CB 1 ATOM 2654 O OG . SER B 2 134 ? 14.826 51.526 -27.641 1.00 96.22 ? 128 SER H OG 1 ATOM 2655 N N . LYS B 2 135 ? 12.167 47.818 -28.494 1.00 120.99 ? 129 LYS H N 1 ATOM 2656 C CA . LYS B 2 135 ? 11.006 46.934 -28.493 1.00 129.77 ? 129 LYS H CA 1 ATOM 2657 C C . LYS B 2 135 ? 11.427 45.577 -27.912 1.00 128.89 ? 129 LYS H C 1 ATOM 2658 O O . LYS B 2 135 ? 11.109 44.510 -28.443 1.00 131.05 ? 129 LYS H O 1 ATOM 2659 C CB . LYS B 2 135 ? 10.397 46.800 -29.902 1.00 136.67 ? 129 LYS H CB 1 ATOM 2660 C CG . LYS B 2 135 ? 11.239 46.078 -30.963 1.00 140.58 ? 129 LYS H CG 1 ATOM 2661 C CD . LYS B 2 135 ? 12.276 46.970 -31.627 1.00 141.38 ? 129 LYS H CD 1 ATOM 2662 C CE . LYS B 2 135 ? 13.032 46.200 -32.705 1.00 138.30 ? 129 LYS H CE 1 ATOM 2663 N NZ . LYS B 2 135 ? 12.118 45.608 -33.722 1.00 135.81 ? 129 LYS H NZ 1 ATOM 2664 N N . SER B 2 136 ? 12.159 45.653 -26.803 1.00 128.05 ? 130 SER H N 1 ATOM 2665 C CA . SER B 2 136 ? 12.579 44.491 -26.027 1.00 122.97 ? 130 SER H CA 1 ATOM 2666 C C . SER B 2 136 ? 12.951 44.958 -24.627 1.00 116.06 ? 130 SER H C 1 ATOM 2667 O O . SER B 2 136 ? 13.645 44.265 -23.885 1.00 114.97 ? 130 SER H O 1 ATOM 2668 C CB . SER B 2 136 ? 13.758 43.772 -26.683 1.00 122.74 ? 130 SER H CB 1 ATOM 2669 O OG . SER B 2 136 ? 13.350 43.097 -27.859 1.00 121.41 ? 130 SER H OG 1 ATOM 2670 N N . THR B 2 137 ? 12.488 46.154 -24.285 1.00 109.54 ? 131 THR H N 1 ATOM 2671 C CA . THR B 2 137 ? 12.740 46.735 -22.978 1.00 106.78 ? 131 THR H CA 1 ATOM 2672 C C . THR B 2 137 ? 11.543 46.456 -22.080 1.00 99.07 ? 131 THR H C 1 ATOM 2673 O O . THR B 2 137 ? 10.637 47.280 -21.956 1.00 98.74 ? 131 THR H O 1 ATOM 2674 C CB . THR B 2 137 ? 13.003 48.248 -23.079 1.00 112.16 ? 131 THR H CB 1 ATOM 2675 O OG1 . THR B 2 137 ? 14.062 48.487 -24.016 1.00 113.57 ? 131 THR H OG1 1 ATOM 2676 C CG2 . THR B 2 137 ? 13.390 48.822 -21.729 1.00 114.63 ? 131 THR H CG2 1 ATOM 2677 N N . SER B 2 138 ? 11.535 45.273 -21.476 1.00 96.17 ? 132 SER H N 1 ATOM 2678 C CA . SER B 2 138 ? 10.446 44.858 -20.599 1.00 89.99 ? 132 SER H CA 1 ATOM 2679 C C . SER B 2 138 ? 10.551 45.538 -19.235 1.00 84.98 ? 132 SER H C 1 ATOM 2680 O O . SER B 2 138 ? 11.131 44.986 -18.297 1.00 84.44 ? 132 SER H O 1 ATOM 2681 C CB . SER B 2 138 ? 10.443 43.333 -20.438 1.00 88.79 ? 132 SER H CB 1 ATOM 2682 O OG . SER B 2 138 ? 9.382 42.903 -19.601 1.00 87.65 ? 132 SER H OG 1 ATOM 2683 N N . GLY B 2 139 ? 9.992 46.743 -19.142 1.00 77.55 ? 133 GLY H N 1 ATOM 2684 C CA . GLY B 2 139 ? 9.965 47.498 -17.900 1.00 78.37 ? 133 GLY H CA 1 ATOM 2685 C C . GLY B 2 139 ? 11.324 47.756 -17.272 1.00 77.88 ? 133 GLY H C 1 ATOM 2686 O O . GLY B 2 139 ? 11.539 47.458 -16.097 1.00 78.09 ? 133 GLY H O 1 ATOM 2687 N N . GLY B 2 140 ? 12.244 48.313 -18.053 1.00 76.51 ? 134 GLY H N 1 ATOM 2688 C CA . GLY B 2 140 ? 13.577 48.600 -17.556 1.00 71.28 ? 134 GLY H CA 1 ATOM 2689 C C . GLY B 2 140 ? 14.547 47.442 -17.706 1.00 62.39 ? 134 GLY H C 1 ATOM 2690 O O . GLY B 2 140 ? 15.707 47.542 -17.308 1.00 60.09 ? 134 GLY H O 1 ATOM 2691 N N . THR B 2 141 ? 14.077 46.344 -18.292 1.00 48.89 ? 135 THR H N 1 ATOM 2692 C CA . THR B 2 141 ? 14.931 45.188 -18.542 1.00 44.76 ? 135 THR H CA 1 ATOM 2693 C C . THR B 2 141 ? 15.021 44.870 -20.033 1.00 40.97 ? 135 THR H C 1 ATOM 2694 O O . THR B 2 141 ? 14.008 44.632 -20.691 1.00 35.91 ? 135 THR H O 1 ATOM 2695 C CB . THR B 2 141 ? 14.426 43.937 -17.794 1.00 47.97 ? 135 THR H CB 1 ATOM 2696 O OG1 . THR B 2 141 ? 14.568 44.131 -16.381 1.00 53.53 ? 135 THR H OG1 1 ATOM 2697 C CG2 . THR B 2 141 ? 15.217 42.705 -18.212 1.00 39.38 ? 135 THR H CG2 1 ATOM 2698 N N . ALA B 2 142 ? 16.240 44.870 -20.561 1.00 35.92 ? 136 ALA H N 1 ATOM 2699 C CA . ALA B 2 142 ? 16.468 44.485 -21.949 1.00 32.86 ? 136 ALA H CA 1 ATOM 2700 C C . ALA B 2 142 ? 16.962 43.042 -22.024 1.00 32.59 ? 136 ALA H C 1 ATOM 2701 O O . ALA B 2 142 ? 17.554 42.535 -21.074 1.00 40.22 ? 136 ALA H O 1 ATOM 2702 C CB . ALA B 2 142 ? 17.476 45.430 -22.610 1.00 26.83 ? 136 ALA H CB 1 ATOM 2703 N N . ALA B 2 143 ? 16.716 42.381 -23.150 1.00 27.57 ? 137 ALA H N 1 ATOM 2704 C CA . ALA B 2 143 ? 17.275 41.054 -23.382 1.00 24.58 ? 137 ALA H CA 1 ATOM 2705 C C . ALA B 2 143 ? 18.154 41.060 -24.627 1.00 25.22 ? 137 ALA H C 1 ATOM 2706 O O . ALA B 2 143 ? 17.871 41.756 -25.599 1.00 28.78 ? 137 ALA H O 1 ATOM 2707 C CB . ALA B 2 143 ? 16.171 40.021 -23.512 1.00 27.90 ? 137 ALA H CB 1 ATOM 2708 N N . LEU B 2 144 ? 19.234 40.294 -24.581 1.00 26.25 ? 138 LEU H N 1 ATOM 2709 C CA . LEU B 2 144 ? 20.127 40.162 -25.720 1.00 28.62 ? 138 LEU H CA 1 ATOM 2710 C C . LEU B 2 144 ? 20.758 38.783 -25.688 1.00 30.15 ? 138 LEU H C 1 ATOM 2711 O O . LEU B 2 144 ? 20.648 38.066 -24.691 1.00 30.30 ? 138 LEU H O 1 ATOM 2712 C CB . LEU B 2 144 ? 21.200 41.253 -25.711 1.00 31.21 ? 138 LEU H CB 1 ATOM 2713 C CG . LEU B 2 144 ? 22.150 41.342 -24.510 1.00 37.61 ? 138 LEU H CG 1 ATOM 2714 C CD1 . LEU B 2 144 ? 23.473 40.648 -24.790 1.00 37.74 ? 138 LEU H CD1 1 ATOM 2715 C CD2 . LEU B 2 144 ? 22.385 42.793 -24.122 1.00 40.54 ? 138 LEU H CD2 1 ATOM 2716 N N . GLY B 2 145 ? 21.419 38.405 -26.773 1.00 24.64 ? 139 GLY H N 1 ATOM 2717 C CA . GLY B 2 145 ? 22.059 37.108 -26.803 1.00 23.71 ? 139 GLY H CA 1 ATOM 2718 C C . GLY B 2 145 ? 22.894 36.807 -28.027 1.00 23.52 ? 139 GLY H C 1 ATOM 2719 O O . GLY B 2 145 ? 23.242 37.693 -28.809 1.00 24.52 ? 139 GLY H O 1 ATOM 2720 N N . CYS B 2 146 ? 23.220 35.530 -28.175 1.00 22.67 ? 140 CYS H N 1 ATOM 2721 C CA . CYS B 2 146 ? 23.987 35.041 -29.305 1.00 26.94 ? 140 CYS H CA 1 ATOM 2722 C C . CYS B 2 146 ? 23.337 33.783 -29.841 1.00 25.86 ? 140 CYS H C 1 ATOM 2723 O O . CYS B 2 146 ? 22.965 32.903 -29.073 1.00 25.59 ? 140 CYS H O 1 ATOM 2724 C CB . CYS B 2 146 ? 25.439 34.745 -28.904 1.00 32.30 ? 140 CYS H CB 1 ATOM 2725 S SG . CYS B 2 146 ? 26.500 36.198 -28.730 1.00 79.59 ? 140 CYS H SG 1 ATOM 2726 N N . LEU B 2 147 ? 23.205 33.705 -31.158 1.00 27.55 ? 141 LEU H N 1 ATOM 2727 C CA . LEU B 2 147 ? 22.728 32.497 -31.809 1.00 25.29 ? 141 LEU H CA 1 ATOM 2728 C C . LEU B 2 147 ? 23.924 31.690 -32.304 1.00 25.58 ? 141 LEU H C 1 ATOM 2729 O O . LEU B 2 147 ? 24.699 32.161 -33.133 1.00 30.52 ? 141 LEU H O 1 ATOM 2730 C CB . LEU B 2 147 ? 21.786 32.847 -32.960 1.00 17.98 ? 141 LEU H CB 1 ATOM 2731 C CG . LEU B 2 147 ? 21.257 31.702 -33.824 1.00 25.41 ? 141 LEU H CG 1 ATOM 2732 C CD1 . LEU B 2 147 ? 20.490 30.688 -32.986 1.00 21.32 ? 141 LEU H CD1 1 ATOM 2733 C CD2 . LEU B 2 147 ? 20.374 32.263 -34.931 1.00 21.33 ? 141 LEU H CD2 1 ATOM 2734 N N . VAL B 2 148 ? 24.079 30.482 -31.774 1.00 24.89 ? 142 VAL H N 1 ATOM 2735 C CA . VAL B 2 148 ? 25.198 29.619 -32.134 1.00 27.65 ? 142 VAL H CA 1 ATOM 2736 C C . VAL B 2 148 ? 24.687 28.483 -33.020 1.00 27.61 ? 142 VAL H C 1 ATOM 2737 O O . VAL B 2 148 ? 24.055 27.548 -32.537 1.00 30.85 ? 142 VAL H O 1 ATOM 2738 C CB . VAL B 2 148 ? 25.896 29.060 -30.874 1.00 27.70 ? 142 VAL H CB 1 ATOM 2739 C CG1 . VAL B 2 148 ? 27.107 28.220 -31.248 1.00 25.13 ? 142 VAL H CG1 1 ATOM 2740 C CG2 . VAL B 2 148 ? 26.302 30.200 -29.950 1.00 26.18 ? 142 VAL H CG2 1 ATOM 2741 N N . LYS B 2 149 ? 24.964 28.567 -34.317 1.00 34.73 ? 143 LYS H N 1 ATOM 2742 C CA . LYS B 2 149 ? 24.233 27.765 -35.297 1.00 34.77 ? 143 LYS H CA 1 ATOM 2743 C C . LYS B 2 149 ? 25.107 26.861 -36.173 1.00 31.53 ? 143 LYS H C 1 ATOM 2744 O O . LYS B 2 149 ? 26.248 27.200 -36.491 1.00 30.04 ? 143 LYS H O 1 ATOM 2745 C CB . LYS B 2 149 ? 23.407 28.701 -36.187 1.00 31.96 ? 143 LYS H CB 1 ATOM 2746 C CG . LYS B 2 149 ? 22.310 28.025 -36.999 1.00 35.53 ? 143 LYS H CG 1 ATOM 2747 C CD . LYS B 2 149 ? 21.384 29.068 -37.616 1.00 36.23 ? 143 LYS H CD 1 ATOM 2748 C CE . LYS B 2 149 ? 20.315 28.432 -38.497 1.00 35.94 ? 143 LYS H CE 1 ATOM 2749 N NZ . LYS B 2 149 ? 20.902 27.731 -39.664 1.00 43.36 ? 143 LYS H NZ 1 ATOM 2750 N N . ASP B 2 150 ? 24.548 25.708 -36.545 1.00 29.76 ? 144 ASP H N 1 ATOM 2751 C CA . ASP B 2 150 ? 25.138 24.783 -37.518 1.00 27.13 ? 144 ASP H CA 1 ATOM 2752 C C . ASP B 2 150 ? 26.510 24.253 -37.124 1.00 30.07 ? 144 ASP H C 1 ATOM 2753 O O . ASP B 2 150 ? 27.484 24.447 -37.848 1.00 35.68 ? 144 ASP H O 1 ATOM 2754 C CB . ASP B 2 150 ? 25.249 25.444 -38.897 1.00 31.04 ? 144 ASP H CB 1 ATOM 2755 C CG . ASP B 2 150 ? 23.901 25.834 -39.473 1.00 36.36 ? 144 ASP H CG 1 ATOM 2756 O OD1 . ASP B 2 150 ? 22.868 25.319 -38.993 1.00 38.31 ? 144 ASP H OD1 1 ATOM 2757 O OD2 . ASP B 2 150 ? 23.877 26.653 -40.415 1.00 38.52 ? 144 ASP H OD2 1 ATOM 2758 N N . TYR B 2 151 ? 26.589 23.575 -35.988 1.00 25.36 ? 145 TYR H N 1 ATOM 2759 C CA . TYR B 2 151 ? 27.840 22.952 -35.593 1.00 31.24 ? 145 TYR H CA 1 ATOM 2760 C C . TYR B 2 151 ? 27.651 21.468 -35.327 1.00 30.14 ? 145 TYR H C 1 ATOM 2761 O O . TYR B 2 151 ? 26.534 20.999 -35.071 1.00 24.47 ? 145 TYR H O 1 ATOM 2762 C CB . TYR B 2 151 ? 28.424 23.639 -34.360 1.00 29.22 ? 145 TYR H CB 1 ATOM 2763 C CG . TYR B 2 151 ? 27.577 23.498 -33.119 1.00 28.25 ? 145 TYR H CG 1 ATOM 2764 C CD1 . TYR B 2 151 ? 26.525 24.374 -32.871 1.00 27.77 ? 145 TYR H CD1 1 ATOM 2765 C CD2 . TYR B 2 151 ? 27.830 22.495 -32.192 1.00 23.72 ? 145 TYR H CD2 1 ATOM 2766 C CE1 . TYR B 2 151 ? 25.748 24.254 -31.733 1.00 21.79 ? 145 TYR H CE1 1 ATOM 2767 C CE2 . TYR B 2 151 ? 27.059 22.366 -31.053 1.00 27.30 ? 145 TYR H CE2 1 ATOM 2768 C CZ . TYR B 2 151 ? 26.021 23.251 -30.828 1.00 27.68 ? 145 TYR H CZ 1 ATOM 2769 O OH . TYR B 2 151 ? 25.250 23.131 -29.699 1.00 29.21 ? 145 TYR H OH 1 ATOM 2770 N N . PHE B 2 152 ? 28.758 20.738 -35.397 1.00 33.71 ? 146 PHE H N 1 ATOM 2771 C CA . PHE B 2 152 ? 28.763 19.304 -35.156 1.00 30.39 ? 146 PHE H CA 1 ATOM 2772 C C . PHE B 2 152 ? 30.177 18.834 -34.833 1.00 32.08 ? 146 PHE H C 1 ATOM 2773 O O . PHE B 2 152 ? 31.129 19.219 -35.506 1.00 37.51 ? 146 PHE H O 1 ATOM 2774 C CB . PHE B 2 152 ? 28.216 18.540 -36.368 1.00 31.68 ? 146 PHE H CB 1 ATOM 2775 C CG . PHE B 2 152 ? 28.123 17.055 -36.150 1.00 32.08 ? 146 PHE H CG 1 ATOM 2776 C CD1 . PHE B 2 152 ? 29.207 16.225 -36.415 1.00 30.62 ? 146 PHE H CD1 1 ATOM 2777 C CD2 . PHE B 2 152 ? 26.954 16.490 -35.661 1.00 28.00 ? 146 PHE H CD2 1 ATOM 2778 C CE1 . PHE B 2 152 ? 29.120 14.858 -36.199 1.00 35.53 ? 146 PHE H CE1 1 ATOM 2779 C CE2 . PHE B 2 152 ? 26.860 15.129 -35.446 1.00 29.21 ? 146 PHE H CE2 1 ATOM 2780 C CZ . PHE B 2 152 ? 27.942 14.311 -35.714 1.00 33.35 ? 146 PHE H CZ 1 ATOM 2781 N N . PRO B 2 153 ? 30.317 17.995 -33.798 1.00 32.06 ? 147 PRO H N 1 ATOM 2782 C CA . PRO B 2 153 ? 29.211 17.582 -32.936 1.00 27.99 ? 147 PRO H CA 1 ATOM 2783 C C . PRO B 2 153 ? 29.097 18.469 -31.708 1.00 26.84 ? 147 PRO H C 1 ATOM 2784 O O . PRO B 2 153 ? 29.688 19.548 -31.656 1.00 31.34 ? 147 PRO H O 1 ATOM 2785 C CB . PRO B 2 153 ? 29.608 16.167 -32.537 1.00 33.34 ? 147 PRO H CB 1 ATOM 2786 C CG . PRO B 2 153 ? 31.099 16.258 -32.426 1.00 33.19 ? 147 PRO H CG 1 ATOM 2787 C CD . PRO B 2 153 ? 31.546 17.239 -33.495 1.00 31.37 ? 147 PRO H CD 1 ATOM 2788 N N . GLU B 2 154 ? 28.337 18.005 -30.726 1.00 27.39 ? 148 GLU H N 1 ATOM 2789 C CA . GLU B 2 154 ? 28.294 18.649 -29.424 1.00 34.05 ? 148 GLU H CA 1 ATOM 2790 C C . GLU B 2 154 ? 29.630 18.437 -28.725 1.00 38.28 ? 148 GLU H C 1 ATOM 2791 O O . GLU B 2 154 ? 30.373 17.527 -29.086 1.00 40.09 ? 148 GLU H O 1 ATOM 2792 C CB . GLU B 2 154 ? 27.148 18.080 -28.588 1.00 35.54 ? 148 GLU H CB 1 ATOM 2793 C CG . GLU B 2 154 ? 25.790 18.209 -29.239 1.00 44.23 ? 148 GLU H CG 1 ATOM 2794 C CD . GLU B 2 154 ? 24.667 18.005 -28.249 1.00 56.34 ? 148 GLU H CD 1 ATOM 2795 O OE1 . GLU B 2 154 ? 24.441 18.912 -27.417 1.00 60.27 ? 148 GLU H OE1 1 ATOM 2796 O OE2 . GLU B 2 154 ? 24.021 16.935 -28.297 1.00 59.79 ? 148 GLU H OE2 1 ATOM 2797 N N . PRO B 2 155 ? 29.950 19.276 -27.727 1.00 40.89 ? 149 PRO H N 1 ATOM 2798 C CA . PRO B 2 155 ? 29.201 20.460 -27.305 1.00 42.27 ? 149 PRO H CA 1 ATOM 2799 C C . PRO B 2 155 ? 29.870 21.758 -27.720 1.00 36.73 ? 149 PRO H C 1 ATOM 2800 O O . PRO B 2 155 ? 30.960 21.750 -28.291 1.00 32.35 ? 149 PRO H O 1 ATOM 2801 C CB . PRO B 2 155 ? 29.204 20.330 -25.784 1.00 40.10 ? 149 PRO H CB 1 ATOM 2802 C CG . PRO B 2 155 ? 30.569 19.750 -25.498 1.00 36.89 ? 149 PRO H CG 1 ATOM 2803 C CD . PRO B 2 155 ? 30.942 18.888 -26.708 1.00 40.78 ? 149 PRO H CD 1 ATOM 2804 N N . VAL B 2 156 ? 29.201 22.866 -27.435 1.00 37.00 ? 150 VAL H N 1 ATOM 2805 C CA . VAL B 2 156 ? 29.839 24.169 -27.444 1.00 36.41 ? 150 VAL H CA 1 ATOM 2806 C C . VAL B 2 156 ? 29.743 24.733 -26.039 1.00 41.17 ? 150 VAL H C 1 ATOM 2807 O O . VAL B 2 156 ? 28.833 24.384 -25.290 1.00 39.64 ? 150 VAL H O 1 ATOM 2808 C CB . VAL B 2 156 ? 29.183 25.141 -28.437 1.00 34.13 ? 150 VAL H CB 1 ATOM 2809 C CG1 . VAL B 2 156 ? 29.499 24.740 -29.867 1.00 34.25 ? 150 VAL H CG1 1 ATOM 2810 C CG2 . VAL B 2 156 ? 27.688 25.200 -28.203 1.00 36.03 ? 150 VAL H CG2 1 ATOM 2811 N N . THR B 2 157 ? 30.690 25.586 -25.669 1.00 43.24 ? 151 THR H N 1 ATOM 2812 C CA . THR B 2 157 ? 30.584 26.321 -24.418 1.00 40.33 ? 151 THR H CA 1 ATOM 2813 C C . THR B 2 157 ? 30.318 27.783 -24.728 1.00 37.86 ? 151 THR H C 1 ATOM 2814 O O . THR B 2 157 ? 30.828 28.316 -25.712 1.00 38.87 ? 151 THR H O 1 ATOM 2815 C CB . THR B 2 157 ? 31.856 26.197 -23.560 1.00 42.53 ? 151 THR H CB 1 ATOM 2816 O OG1 . THR B 2 157 ? 33.010 26.392 -24.387 1.00 51.42 ? 151 THR H OG1 1 ATOM 2817 C CG2 . THR B 2 157 ? 31.932 24.827 -22.905 1.00 40.09 ? 151 THR H CG2 1 ATOM 2818 N N . VAL B 2 158 ? 29.506 28.424 -23.895 1.00 33.03 ? 152 VAL H N 1 ATOM 2819 C CA . VAL B 2 158 ? 29.230 29.844 -24.044 1.00 31.00 ? 152 VAL H CA 1 ATOM 2820 C C . VAL B 2 158 ? 29.405 30.588 -22.724 1.00 33.63 ? 152 VAL H C 1 ATOM 2821 O O . VAL B 2 158 ? 28.828 30.205 -21.706 1.00 33.60 ? 152 VAL H O 1 ATOM 2822 C CB . VAL B 2 158 ? 27.799 30.098 -24.562 1.00 31.62 ? 152 VAL H CB 1 ATOM 2823 C CG1 . VAL B 2 158 ? 27.517 31.594 -24.611 1.00 34.15 ? 152 VAL H CG1 1 ATOM 2824 C CG2 . VAL B 2 158 ? 27.596 29.469 -25.931 1.00 23.28 ? 152 VAL H CG2 1 ATOM 2825 N N . SER B 2 159 ? 30.204 31.651 -22.745 1.00 27.94 ? 153 SER H N 1 ATOM 2826 C CA . SER B 2 159 ? 30.300 32.555 -21.604 1.00 27.42 ? 153 SER H CA 1 ATOM 2827 C C . SER B 2 159 ? 29.985 33.980 -22.047 1.00 32.58 ? 153 SER H C 1 ATOM 2828 O O . SER B 2 159 ? 29.855 34.250 -23.242 1.00 33.75 ? 153 SER H O 1 ATOM 2829 C CB . SER B 2 159 ? 31.688 32.478 -20.960 1.00 36.48 ? 153 SER H CB 1 ATOM 2830 O OG . SER B 2 159 ? 32.708 32.695 -21.919 1.00 43.60 ? 153 SER H OG 1 ATOM 2831 N N . TRP B 2 160 ? 29.845 34.885 -21.083 1.00 35.22 ? 154 TRP H N 1 ATOM 2832 C CA . TRP B 2 160 ? 29.575 36.288 -21.382 1.00 30.67 ? 154 TRP H CA 1 ATOM 2833 C C . TRP B 2 160 ? 30.572 37.196 -20.677 1.00 28.53 ? 154 TRP H C 1 ATOM 2834 O O . TRP B 2 160 ? 30.761 37.093 -19.465 1.00 32.61 ? 154 TRP H O 1 ATOM 2835 C CB . TRP B 2 160 ? 28.148 36.663 -20.981 1.00 30.29 ? 154 TRP H CB 1 ATOM 2836 C CG . TRP B 2 160 ? 27.130 36.151 -21.937 1.00 29.45 ? 154 TRP H CG 1 ATOM 2837 C CD1 . TRP B 2 160 ? 26.453 34.970 -21.857 1.00 31.29 ? 154 TRP H CD1 1 ATOM 2838 C CD2 . TRP B 2 160 ? 26.682 36.792 -23.138 1.00 21.91 ? 154 TRP H CD2 1 ATOM 2839 N NE1 . TRP B 2 160 ? 25.605 34.839 -22.930 1.00 31.00 ? 154 TRP H NE1 1 ATOM 2840 C CE2 . TRP B 2 160 ? 25.727 35.944 -23.730 1.00 33.95 ? 154 TRP H CE2 1 ATOM 2841 C CE3 . TRP B 2 160 ? 26.993 38.001 -23.766 1.00 25.55 ? 154 TRP H CE3 1 ATOM 2842 C CZ2 . TRP B 2 160 ? 25.080 36.268 -24.923 1.00 31.94 ? 154 TRP H CZ2 1 ATOM 2843 C CZ3 . TRP B 2 160 ? 26.352 38.319 -24.950 1.00 28.31 ? 154 TRP H CZ3 1 ATOM 2844 C CH2 . TRP B 2 160 ? 25.405 37.457 -25.513 1.00 32.66 ? 154 TRP H CH2 1 ATOM 2845 N N . ASN B 2 161 ? 31.191 38.087 -21.449 1.00 30.66 ? 155 ASN H N 1 ATOM 2846 C CA . ASN B 2 161 ? 32.286 38.931 -20.969 1.00 34.53 ? 155 ASN H CA 1 ATOM 2847 C C . ASN B 2 161 ? 33.333 38.119 -20.216 1.00 35.14 ? 155 ASN H C 1 ATOM 2848 O O . ASN B 2 161 ? 33.706 38.456 -19.088 1.00 27.84 ? 155 ASN H O 1 ATOM 2849 C CB . ASN B 2 161 ? 31.752 40.062 -20.087 1.00 36.50 ? 155 ASN H CB 1 ATOM 2850 C CG . ASN B 2 161 ? 30.885 41.040 -20.860 1.00 40.23 ? 155 ASN H CG 1 ATOM 2851 O OD1 . ASN B 2 161 ? 30.862 41.020 -22.092 1.00 38.66 ? 155 ASN H OD1 1 ATOM 2852 N ND2 . ASN B 2 161 ? 30.176 41.909 -20.142 1.00 35.05 ? 155 ASN H ND2 1 ATOM 2853 N N . SER B 2 162 ? 33.769 37.030 -20.848 1.00 37.53 ? 156 SER H N 1 ATOM 2854 C CA . SER B 2 162 ? 34.843 36.178 -20.340 1.00 37.08 ? 156 SER H CA 1 ATOM 2855 C C . SER B 2 162 ? 34.562 35.612 -18.952 1.00 36.14 ? 156 SER H C 1 ATOM 2856 O O . SER B 2 162 ? 35.490 35.267 -18.221 1.00 36.90 ? 156 SER H O 1 ATOM 2857 C CB . SER B 2 162 ? 36.164 36.950 -20.324 1.00 37.81 ? 156 SER H CB 1 ATOM 2858 O OG . SER B 2 162 ? 36.493 37.407 -21.624 1.00 42.79 ? 156 SER H OG 1 ATOM 2859 N N . GLY B 2 163 ? 33.287 35.517 -18.593 1.00 31.68 ? 157 GLY H N 1 ATOM 2860 C CA . GLY B 2 163 ? 32.909 34.929 -17.321 1.00 31.43 ? 157 GLY H CA 1 ATOM 2861 C C . GLY B 2 163 ? 32.566 35.947 -16.249 1.00 35.08 ? 157 GLY H C 1 ATOM 2862 O O . GLY B 2 163 ? 32.226 35.579 -15.121 1.00 33.29 ? 157 GLY H O 1 ATOM 2863 N N . ALA B 2 164 ? 32.652 37.228 -16.591 1.00 31.69 ? 158 ALA H N 1 ATOM 2864 C CA . ALA B 2 164 ? 32.289 38.280 -15.648 1.00 42.72 ? 158 ALA H CA 1 ATOM 2865 C C . ALA B 2 164 ? 30.770 38.429 -15.556 1.00 39.74 ? 158 ALA H C 1 ATOM 2866 O O . ALA B 2 164 ? 30.229 38.737 -14.493 1.00 35.92 ? 158 ALA H O 1 ATOM 2867 C CB . ALA B 2 164 ? 32.935 39.608 -16.047 1.00 40.83 ? 158 ALA H CB 1 ATOM 2868 N N . LEU B 2 165 ? 30.086 38.208 -16.674 1.00 35.77 ? 159 LEU H N 1 ATOM 2869 C CA . LEU B 2 165 ? 28.631 38.323 -16.706 1.00 37.99 ? 159 LEU H CA 1 ATOM 2870 C C . LEU B 2 165 ? 27.998 36.955 -16.516 1.00 37.82 ? 159 LEU H C 1 ATOM 2871 O O . LEU B 2 165 ? 28.110 36.077 -17.374 1.00 34.84 ? 159 LEU H O 1 ATOM 2872 C CB . LEU B 2 165 ? 28.158 38.954 -18.017 1.00 35.51 ? 159 LEU H CB 1 ATOM 2873 C CG . LEU B 2 165 ? 26.646 39.102 -18.218 1.00 34.32 ? 159 LEU H CG 1 ATOM 2874 C CD1 . LEU B 2 165 ? 26.004 39.890 -17.080 1.00 31.04 ? 159 LEU H CD1 1 ATOM 2875 C CD2 . LEU B 2 165 ? 26.361 39.765 -19.555 1.00 28.93 ? 159 LEU H CD2 1 ATOM 2876 N N . THR B 2 166 ? 27.325 36.778 -15.387 1.00 36.54 ? 160 THR H N 1 ATOM 2877 C CA . THR B 2 166 ? 26.846 35.462 -15.013 1.00 35.25 ? 160 THR H CA 1 ATOM 2878 C C . THR B 2 166 ? 25.367 35.504 -14.603 1.00 31.00 ? 160 THR H C 1 ATOM 2879 O O . THR B 2 166 ? 24.629 34.548 -14.817 1.00 36.51 ? 160 THR H O 1 ATOM 2880 C CB . THR B 2 166 ? 27.738 34.884 -13.878 1.00 34.38 ? 160 THR H CB 1 ATOM 2881 O OG1 . THR B 2 166 ? 27.792 33.457 -13.971 1.00 42.45 ? 160 THR H OG1 1 ATOM 2882 C CG2 . THR B 2 166 ? 27.253 35.308 -12.497 1.00 27.11 ? 160 THR H CG2 1 ATOM 2883 N N . SER B 2 167 ? 24.933 36.633 -14.054 1.00 36.03 ? 161 SER H N 1 ATOM 2884 C CA . SER B 2 167 ? 23.566 36.797 -13.575 1.00 34.74 ? 161 SER H CA 1 ATOM 2885 C C . SER B 2 167 ? 22.584 37.035 -14.723 1.00 34.83 ? 161 SER H C 1 ATOM 2886 O O . SER B 2 167 ? 22.854 37.826 -15.625 1.00 36.01 ? 161 SER H O 1 ATOM 2887 C CB . SER B 2 167 ? 23.504 37.957 -12.575 1.00 43.69 ? 161 SER H CB 1 ATOM 2888 O OG . SER B 2 167 ? 22.174 38.240 -12.181 1.00 53.50 ? 161 SER H OG 1 ATOM 2889 N N . GLY B 2 168 ? 21.448 36.343 -14.685 1.00 39.01 ? 162 GLY H N 1 ATOM 2890 C CA . GLY B 2 168 ? 20.416 36.500 -15.698 1.00 37.60 ? 162 GLY H CA 1 ATOM 2891 C C . GLY B 2 168 ? 20.724 35.818 -17.022 1.00 39.43 ? 162 GLY H C 1 ATOM 2892 O O . GLY B 2 168 ? 20.026 36.039 -18.017 1.00 40.62 ? 162 GLY H O 1 ATOM 2893 N N . VAL B 2 169 ? 21.768 34.991 -17.035 1.00 28.90 ? 163 VAL H N 1 ATOM 2894 C CA . VAL B 2 169 ? 22.184 34.273 -18.238 1.00 28.32 ? 163 VAL H CA 1 ATOM 2895 C C . VAL B 2 169 ? 21.467 32.933 -18.384 1.00 31.61 ? 163 VAL H C 1 ATOM 2896 O O . VAL B 2 169 ? 21.432 32.138 -17.445 1.00 33.88 ? 163 VAL H O 1 ATOM 2897 C CB . VAL B 2 169 ? 23.709 34.012 -18.246 1.00 31.24 ? 163 VAL H CB 1 ATOM 2898 C CG1 . VAL B 2 169 ? 24.087 33.073 -19.389 1.00 32.94 ? 163 VAL H CG1 1 ATOM 2899 C CG2 . VAL B 2 169 ? 24.480 35.319 -18.343 1.00 23.38 ? 163 VAL H CG2 1 ATOM 2900 N N . HIS B 2 170 ? 20.892 32.691 -19.560 1.00 26.89 ? 164 HIS H N 1 ATOM 2901 C CA . HIS B 2 170 ? 20.321 31.387 -19.882 1.00 26.31 ? 164 HIS H CA 1 ATOM 2902 C C . HIS B 2 170 ? 20.902 30.859 -21.189 1.00 34.74 ? 164 HIS H C 1 ATOM 2903 O O . HIS B 2 170 ? 20.674 31.431 -22.256 1.00 31.41 ? 164 HIS H O 1 ATOM 2904 C CB . HIS B 2 170 ? 18.795 31.454 -19.990 1.00 26.26 ? 164 HIS H CB 1 ATOM 2905 C CG . HIS B 2 170 ? 18.107 31.792 -18.705 1.00 29.64 ? 164 HIS H CG 1 ATOM 2906 N ND1 . HIS B 2 170 ? 18.224 31.017 -17.572 1.00 37.06 ? 164 HIS H ND1 1 ATOM 2907 C CD2 . HIS B 2 170 ? 17.287 32.819 -18.377 1.00 28.15 ? 164 HIS H CD2 1 ATOM 2908 C CE1 . HIS B 2 170 ? 17.510 31.555 -16.598 1.00 40.08 ? 164 HIS H CE1 1 ATOM 2909 N NE2 . HIS B 2 170 ? 16.933 32.650 -17.061 1.00 37.15 ? 164 HIS H NE2 1 ATOM 2910 N N . THR B 2 171 ? 21.655 29.769 -21.098 1.00 33.59 ? 165 THR H N 1 ATOM 2911 C CA . THR B 2 171 ? 22.170 29.094 -22.280 1.00 23.83 ? 165 THR H CA 1 ATOM 2912 C C . THR B 2 171 ? 21.355 27.835 -22.519 1.00 25.69 ? 165 THR H C 1 ATOM 2913 O O . THR B 2 171 ? 21.462 26.860 -21.778 1.00 30.49 ? 165 THR H O 1 ATOM 2914 C CB . THR B 2 171 ? 23.658 28.740 -22.134 1.00 26.52 ? 165 THR H CB 1 ATOM 2915 O OG1 . THR B 2 171 ? 24.422 29.946 -22.044 1.00 28.96 ? 165 THR H OG1 1 ATOM 2916 C CG2 . THR B 2 171 ? 24.145 27.937 -23.329 1.00 19.60 ? 165 THR H CG2 1 ATOM 2917 N N . PHE B 2 172 ? 20.532 27.869 -23.558 1.00 21.11 ? 166 PHE H N 1 ATOM 2918 C CA . PHE B 2 172 ? 19.605 26.785 -23.843 1.00 18.04 ? 166 PHE H CA 1 ATOM 2919 C C . PHE B 2 172 ? 20.304 25.505 -24.271 1.00 22.61 ? 166 PHE H C 1 ATOM 2920 O O . PHE B 2 172 ? 21.400 25.546 -24.827 1.00 28.17 ? 166 PHE H O 1 ATOM 2921 C CB . PHE B 2 172 ? 18.610 27.224 -24.920 1.00 17.71 ? 166 PHE H CB 1 ATOM 2922 C CG . PHE B 2 172 ? 17.647 28.261 -24.440 1.00 29.63 ? 166 PHE H CG 1 ATOM 2923 C CD1 . PHE B 2 172 ? 16.454 27.887 -23.845 1.00 33.03 ? 166 PHE H CD1 1 ATOM 2924 C CD2 . PHE B 2 172 ? 17.947 29.606 -24.544 1.00 25.35 ? 166 PHE H CD2 1 ATOM 2925 C CE1 . PHE B 2 172 ? 15.573 28.836 -23.375 1.00 30.66 ? 166 PHE H CE1 1 ATOM 2926 C CE2 . PHE B 2 172 ? 17.066 30.558 -24.078 1.00 25.32 ? 166 PHE H CE2 1 ATOM 2927 C CZ . PHE B 2 172 ? 15.879 30.170 -23.491 1.00 24.94 ? 166 PHE H CZ 1 ATOM 2928 N N . PRO B 2 173 ? 19.672 24.359 -23.989 1.00 27.40 ? 167 PRO H N 1 ATOM 2929 C CA . PRO B 2 173 ? 20.095 23.062 -24.525 1.00 31.59 ? 167 PRO H CA 1 ATOM 2930 C C . PRO B 2 173 ? 20.136 23.091 -26.046 1.00 29.18 ? 167 PRO H C 1 ATOM 2931 O O . PRO B 2 173 ? 19.260 23.692 -26.665 1.00 28.94 ? 167 PRO H O 1 ATOM 2932 C CB . PRO B 2 173 ? 19.008 22.102 -24.035 1.00 29.19 ? 167 PRO H CB 1 ATOM 2933 C CG . PRO B 2 173 ? 18.457 22.751 -22.817 1.00 38.20 ? 167 PRO H CG 1 ATOM 2934 C CD . PRO B 2 173 ? 18.542 24.232 -23.053 1.00 28.93 ? 167 PRO H CD 1 ATOM 2935 N N . ALA B 2 174 ? 21.144 22.459 -26.633 1.00 24.50 ? 168 ALA H N 1 ATOM 2936 C CA . ALA B 2 174 ? 21.236 22.346 -28.079 1.00 25.35 ? 168 ALA H CA 1 ATOM 2937 C C . ALA B 2 174 ? 20.044 21.576 -28.640 1.00 25.00 ? 168 ALA H C 1 ATOM 2938 O O . ALA B 2 174 ? 19.533 20.665 -27.997 1.00 26.03 ? 168 ALA H O 1 ATOM 2939 C CB . ALA B 2 174 ? 22.538 21.661 -28.469 1.00 22.44 ? 168 ALA H CB 1 ATOM 2940 N N . VAL B 2 175 ? 19.596 21.953 -29.831 1.00 23.08 ? 169 VAL H N 1 ATOM 2941 C CA . VAL B 2 175 ? 18.597 21.163 -30.537 1.00 23.84 ? 169 VAL H CA 1 ATOM 2942 C C . VAL B 2 175 ? 19.208 20.651 -31.833 1.00 26.76 ? 169 VAL H C 1 ATOM 2943 O O . VAL B 2 175 ? 20.037 21.325 -32.455 1.00 23.41 ? 169 VAL H O 1 ATOM 2944 C CB . VAL B 2 175 ? 17.303 21.968 -30.838 1.00 34.40 ? 169 VAL H CB 1 ATOM 2945 C CG1 . VAL B 2 175 ? 16.733 22.556 -29.558 1.00 29.94 ? 169 VAL H CG1 1 ATOM 2946 C CG2 . VAL B 2 175 ? 17.562 23.073 -31.863 1.00 37.00 ? 169 VAL H CG2 1 ATOM 2947 N N . LEU B 2 176 ? 18.815 19.444 -32.219 1.00 27.54 ? 170 LEU H N 1 ATOM 2948 C CA . LEU B 2 176 ? 19.267 18.859 -33.470 1.00 24.62 ? 170 LEU H CA 1 ATOM 2949 C C . LEU B 2 176 ? 18.353 19.304 -34.608 1.00 28.59 ? 170 LEU H C 1 ATOM 2950 O O . LEU B 2 176 ? 17.166 18.983 -34.622 1.00 32.05 ? 170 LEU H O 1 ATOM 2951 C CB . LEU B 2 176 ? 19.304 17.332 -33.372 1.00 27.70 ? 170 LEU H CB 1 ATOM 2952 C CG . LEU B 2 176 ? 19.768 16.583 -34.623 1.00 36.48 ? 170 LEU H CG 1 ATOM 2953 C CD1 . LEU B 2 176 ? 21.148 17.061 -35.053 1.00 28.28 ? 170 LEU H CD1 1 ATOM 2954 C CD2 . LEU B 2 176 ? 19.770 15.084 -34.372 1.00 38.08 ? 170 LEU H CD2 1 ATOM 2955 N N . GLN B 2 177 ? 18.911 20.055 -35.552 1.00 25.67 ? 171 GLN H N 1 ATOM 2956 C CA . GLN B 2 177 ? 18.147 20.557 -36.690 1.00 21.04 ? 171 GLN H CA 1 ATOM 2957 C C . GLN B 2 177 ? 17.953 19.468 -37.739 1.00 21.17 ? 171 GLN H C 1 ATOM 2958 O O . GLN B 2 177 ? 18.642 18.452 -37.720 1.00 24.36 ? 171 GLN H O 1 ATOM 2959 C CB . GLN B 2 177 ? 18.849 21.769 -37.310 1.00 20.17 ? 171 GLN H CB 1 ATOM 2960 C CG . GLN B 2 177 ? 19.087 22.925 -36.344 1.00 24.10 ? 171 GLN H CG 1 ATOM 2961 C CD . GLN B 2 177 ? 19.983 24.005 -36.932 1.00 33.48 ? 171 GLN H CD 1 ATOM 2962 O OE1 . GLN B 2 177 ? 19.523 25.095 -37.268 1.00 37.11 ? 171 GLN H OE1 1 ATOM 2963 N NE2 . GLN B 2 177 ? 21.274 23.709 -37.048 1.00 35.67 ? 171 GLN H NE2 1 ATOM 2964 N N . SER B 2 178 ? 17.031 19.691 -38.672 1.00 20.10 ? 172 SER H N 1 ATOM 2965 C CA . SER B 2 178 ? 16.742 18.706 -39.707 1.00 25.91 ? 172 SER H CA 1 ATOM 2966 C C . SER B 2 178 ? 17.922 18.526 -40.663 1.00 29.27 ? 172 SER H C 1 ATOM 2967 O O . SER B 2 178 ? 17.923 17.619 -41.497 1.00 31.62 ? 172 SER H O 1 ATOM 2968 C CB . SER B 2 178 ? 15.484 19.104 -40.484 1.00 30.09 ? 172 SER H CB 1 ATOM 2969 O OG . SER B 2 178 ? 15.568 20.445 -40.934 1.00 35.06 ? 172 SER H OG 1 ATOM 2970 N N . SER B 2 179 ? 18.918 19.399 -40.540 1.00 20.92 ? 173 SER H N 1 ATOM 2971 C CA . SER B 2 179 ? 20.148 19.278 -41.313 1.00 22.04 ? 173 SER H CA 1 ATOM 2972 C C . SER B 2 179 ? 21.140 18.307 -40.673 1.00 29.92 ? 173 SER H C 1 ATOM 2973 O O . SER B 2 179 ? 22.125 17.923 -41.298 1.00 35.37 ? 173 SER H O 1 ATOM 2974 C CB . SER B 2 179 ? 20.813 20.644 -41.472 1.00 22.64 ? 173 SER H CB 1 ATOM 2975 O OG . SER B 2 179 ? 21.206 21.153 -40.212 1.00 25.41 ? 173 SER H OG 1 ATOM 2976 N N . GLY B 2 180 ? 20.891 17.922 -39.424 1.00 24.97 ? 174 GLY H N 1 ATOM 2977 C CA . GLY B 2 180 ? 21.806 17.043 -38.713 1.00 19.31 ? 174 GLY H CA 1 ATOM 2978 C C . GLY B 2 180 ? 22.877 17.827 -37.979 1.00 23.83 ? 174 GLY H C 1 ATOM 2979 O O . GLY B 2 180 ? 23.809 17.259 -37.410 1.00 20.52 ? 174 GLY H O 1 ATOM 2980 N N . LEU B 2 181 ? 22.739 19.147 -37.993 1.00 24.26 ? 175 LEU H N 1 ATOM 2981 C CA . LEU B 2 181 ? 23.647 20.026 -37.265 1.00 27.56 ? 175 LEU H CA 1 ATOM 2982 C C . LEU B 2 181 ? 22.952 20.575 -36.021 1.00 25.71 ? 175 LEU H C 1 ATOM 2983 O O . LEU B 2 181 ? 21.730 20.724 -36.002 1.00 23.18 ? 175 LEU H O 1 ATOM 2984 C CB . LEU B 2 181 ? 24.127 21.171 -38.163 1.00 23.48 ? 175 LEU H CB 1 ATOM 2985 C CG . LEU B 2 181 ? 24.843 20.725 -39.440 1.00 26.82 ? 175 LEU H CG 1 ATOM 2986 C CD1 . LEU B 2 181 ? 24.971 21.876 -40.426 1.00 34.10 ? 175 LEU H CD1 1 ATOM 2987 C CD2 . LEU B 2 181 ? 26.206 20.148 -39.107 1.00 20.56 ? 175 LEU H CD2 1 ATOM 2988 N N . TYR B 2 182 ? 23.728 20.861 -34.982 1.00 23.14 ? 176 TYR H N 1 ATOM 2989 C CA . TYR B 2 182 ? 23.157 21.388 -33.754 1.00 19.56 ? 176 TYR H CA 1 ATOM 2990 C C . TYR B 2 182 ? 23.055 22.896 -33.818 1.00 27.35 ? 176 TYR H C 1 ATOM 2991 O O . TYR B 2 182 ? 23.754 23.551 -34.595 1.00 23.49 ? 176 TYR H O 1 ATOM 2992 C CB . TYR B 2 182 ? 23.984 20.961 -32.540 1.00 21.42 ? 176 TYR H CB 1 ATOM 2993 C CG . TYR B 2 182 ? 23.945 19.467 -32.333 1.00 29.34 ? 176 TYR H CG 1 ATOM 2994 C CD1 . TYR B 2 182 ? 22.905 18.871 -31.627 1.00 23.84 ? 176 TYR H CD1 1 ATOM 2995 C CD2 . TYR B 2 182 ? 24.928 18.647 -32.873 1.00 31.61 ? 176 TYR H CD2 1 ATOM 2996 C CE1 . TYR B 2 182 ? 22.855 17.494 -31.454 1.00 28.54 ? 176 TYR H CE1 1 ATOM 2997 C CE2 . TYR B 2 182 ? 24.887 17.275 -32.704 1.00 34.99 ? 176 TYR H CE2 1 ATOM 2998 C CZ . TYR B 2 182 ? 23.850 16.705 -31.995 1.00 34.90 ? 176 TYR H CZ 1 ATOM 2999 O OH . TYR B 2 182 ? 23.815 15.340 -31.831 1.00 42.14 ? 176 TYR H OH 1 ATOM 3000 N N . SER B 2 183 ? 22.163 23.435 -32.998 1.00 24.99 ? 177 SER H N 1 ATOM 3001 C CA . SER B 2 183 ? 21.997 24.868 -32.883 1.00 27.97 ? 177 SER H CA 1 ATOM 3002 C C . SER B 2 183 ? 21.554 25.207 -31.474 1.00 29.86 ? 177 SER H C 1 ATOM 3003 O O . SER B 2 183 ? 20.931 24.390 -30.789 1.00 24.12 ? 177 SER H O 1 ATOM 3004 C CB . SER B 2 183 ? 20.988 25.392 -33.899 1.00 25.22 ? 177 SER H CB 1 ATOM 3005 O OG . SER B 2 183 ? 20.792 26.780 -33.719 1.00 32.48 ? 177 SER H OG 1 ATOM 3006 N N . LEU B 2 184 ? 21.870 26.426 -31.060 1.00 23.81 ? 178 LEU H N 1 ATOM 3007 C CA . LEU B 2 184 ? 21.753 26.821 -29.675 1.00 21.37 ? 178 LEU H CA 1 ATOM 3008 C C . LEU B 2 184 ? 21.710 28.344 -29.571 1.00 23.96 ? 178 LEU H C 1 ATOM 3009 O O . LEU B 2 184 ? 22.312 29.048 -30.379 1.00 28.89 ? 178 LEU H O 1 ATOM 3010 C CB . LEU B 2 184 ? 22.933 26.231 -28.895 1.00 30.68 ? 178 LEU H CB 1 ATOM 3011 C CG . LEU B 2 184 ? 23.343 26.623 -27.481 1.00 31.50 ? 178 LEU H CG 1 ATOM 3012 C CD1 . LEU B 2 184 ? 24.158 25.486 -26.900 1.00 31.21 ? 178 LEU H CD1 1 ATOM 3013 C CD2 . LEU B 2 184 ? 24.157 27.909 -27.470 1.00 30.61 ? 178 LEU H CD2 1 ATOM 3014 N N . SER B 2 185 ? 20.988 28.852 -28.583 1.00 23.44 ? 179 SER H N 1 ATOM 3015 C CA . SER B 2 185 ? 21.063 30.271 -28.255 1.00 26.12 ? 179 SER H CA 1 ATOM 3016 C C . SER B 2 185 ? 21.449 30.457 -26.799 1.00 27.45 ? 179 SER H C 1 ATOM 3017 O O . SER B 2 185 ? 21.098 29.640 -25.947 1.00 25.19 ? 179 SER H O 1 ATOM 3018 C CB . SER B 2 185 ? 19.735 30.977 -28.531 1.00 28.75 ? 179 SER H CB 1 ATOM 3019 O OG . SER B 2 185 ? 19.510 31.115 -29.922 1.00 42.40 ? 179 SER H OG 1 ATOM 3020 N N . SER B 2 186 ? 22.185 31.529 -26.530 1.00 25.43 ? 180 SER H N 1 ATOM 3021 C CA . SER B 2 186 ? 22.458 31.959 -25.168 1.00 24.84 ? 180 SER H CA 1 ATOM 3022 C C . SER B 2 186 ? 21.975 33.388 -25.005 1.00 25.99 ? 180 SER H C 1 ATOM 3023 O O . SER B 2 186 ? 22.327 34.256 -25.796 1.00 25.33 ? 180 SER H O 1 ATOM 3024 C CB . SER B 2 186 ? 23.941 31.864 -24.842 1.00 25.94 ? 180 SER H CB 1 ATOM 3025 O OG . SER B 2 186 ? 24.182 32.312 -23.522 1.00 25.22 ? 180 SER H OG 1 ATOM 3026 N N . VAL B 2 187 ? 21.163 33.625 -23.983 1.00 21.67 ? 181 VAL H N 1 ATOM 3027 C CA . VAL B 2 187 ? 20.593 34.943 -23.757 1.00 25.88 ? 181 VAL H CA 1 ATOM 3028 C C . VAL B 2 187 ? 20.899 35.448 -22.354 1.00 28.58 ? 181 VAL H C 1 ATOM 3029 O O . VAL B 2 187 ? 21.263 34.679 -21.465 1.00 27.09 ? 181 VAL H O 1 ATOM 3030 C CB . VAL B 2 187 ? 19.074 34.934 -23.951 1.00 24.37 ? 181 VAL H CB 1 ATOM 3031 C CG1 . VAL B 2 187 ? 18.732 34.529 -25.375 1.00 29.66 ? 181 VAL H CG1 1 ATOM 3032 C CG2 . VAL B 2 187 ? 18.435 33.984 -22.948 1.00 24.17 ? 181 VAL H CG2 1 ATOM 3033 N N . VAL B 2 188 ? 20.739 36.749 -22.165 1.00 24.05 ? 182 VAL H N 1 ATOM 3034 C CA . VAL B 2 188 ? 20.935 37.361 -20.862 1.00 28.75 ? 182 VAL H CA 1 ATOM 3035 C C . VAL B 2 188 ? 20.020 38.581 -20.753 1.00 33.51 ? 182 VAL H C 1 ATOM 3036 O O . VAL B 2 188 ? 19.789 39.288 -21.741 1.00 28.09 ? 182 VAL H O 1 ATOM 3037 C CB . VAL B 2 188 ? 22.418 37.754 -20.643 1.00 29.81 ? 182 VAL H CB 1 ATOM 3038 C CG1 . VAL B 2 188 ? 22.896 38.686 -21.747 1.00 30.66 ? 182 VAL H CG1 1 ATOM 3039 C CG2 . VAL B 2 188 ? 22.625 38.376 -19.261 1.00 26.81 ? 182 VAL H CG2 1 ATOM 3040 N N . THR B 2 189 ? 19.455 38.804 -19.572 1.00 30.94 ? 183 THR H N 1 ATOM 3041 C CA . THR B 2 189 ? 18.661 40.007 -19.350 1.00 34.38 ? 183 THR H CA 1 ATOM 3042 C C . THR B 2 189 ? 19.474 41.010 -18.541 1.00 38.78 ? 183 THR H C 1 ATOM 3043 O O . THR B 2 189 ? 20.017 40.678 -17.488 1.00 41.40 ? 183 THR H O 1 ATOM 3044 C CB . THR B 2 189 ? 17.331 39.703 -18.632 1.00 36.34 ? 183 THR H CB 1 ATOM 3045 O OG1 . THR B 2 189 ? 17.580 38.898 -17.475 1.00 36.98 ? 183 THR H OG1 1 ATOM 3046 C CG2 . THR B 2 189 ? 16.378 38.961 -19.560 1.00 38.24 ? 183 THR H CG2 1 ATOM 3047 N N . VAL B 2 190 ? 19.568 42.233 -19.048 1.00 40.12 ? 184 VAL H N 1 ATOM 3048 C CA . VAL B 2 190 ? 20.368 43.270 -18.405 1.00 38.07 ? 184 VAL H CA 1 ATOM 3049 C C . VAL B 2 190 ? 19.533 44.530 -18.207 1.00 40.98 ? 184 VAL H C 1 ATOM 3050 O O . VAL B 2 190 ? 18.485 44.682 -18.841 1.00 46.80 ? 184 VAL H O 1 ATOM 3051 C CB . VAL B 2 190 ? 21.626 43.602 -19.237 1.00 35.29 ? 184 VAL H CB 1 ATOM 3052 C CG1 . VAL B 2 190 ? 22.473 42.351 -19.437 1.00 35.37 ? 184 VAL H CG1 1 ATOM 3053 C CG2 . VAL B 2 190 ? 21.232 44.208 -20.579 1.00 31.05 ? 184 VAL H CG2 1 ATOM 3054 N N . PRO B 2 191 ? 19.973 45.429 -17.310 1.00 41.49 ? 185 PRO H N 1 ATOM 3055 C CA . PRO B 2 191 ? 19.271 46.713 -17.224 1.00 40.66 ? 185 PRO H CA 1 ATOM 3056 C C . PRO B 2 191 ? 19.369 47.477 -18.539 1.00 42.59 ? 185 PRO H C 1 ATOM 3057 O O . PRO B 2 191 ? 20.438 47.500 -19.148 1.00 49.71 ? 185 PRO H O 1 ATOM 3058 C CB . PRO B 2 191 ? 20.011 47.450 -16.101 1.00 35.45 ? 185 PRO H CB 1 ATOM 3059 C CG . PRO B 2 191 ? 20.627 46.374 -15.284 1.00 39.50 ? 185 PRO H CG 1 ATOM 3060 C CD . PRO B 2 191 ? 20.992 45.286 -16.253 1.00 38.79 ? 185 PRO H CD 1 ATOM 3061 N N . SER B 2 192 ? 18.266 48.081 -18.969 1.00 48.63 ? 186 SER H N 1 ATOM 3062 C CA . SER B 2 192 ? 18.239 48.868 -20.200 1.00 53.70 ? 186 SER H CA 1 ATOM 3063 C C . SER B 2 192 ? 19.212 50.036 -20.156 1.00 49.95 ? 186 SER H C 1 ATOM 3064 O O . SER B 2 192 ? 19.868 50.344 -21.149 1.00 48.09 ? 186 SER H O 1 ATOM 3065 C CB . SER B 2 192 ? 16.832 49.391 -20.462 1.00 50.84 ? 186 SER H CB 1 ATOM 3066 O OG . SER B 2 192 ? 15.886 48.421 -20.076 1.00 59.46 ? 186 SER H OG 1 ATOM 3067 N N . SER B 2 193 ? 19.303 50.679 -18.997 1.00 59.41 ? 187 SER H N 1 ATOM 3068 C CA . SER B 2 193 ? 20.149 51.858 -18.834 1.00 63.61 ? 187 SER H CA 1 ATOM 3069 C C . SER B 2 193 ? 21.613 51.548 -19.138 1.00 64.97 ? 187 SER H C 1 ATOM 3070 O O . SER B 2 193 ? 22.383 52.440 -19.493 1.00 67.38 ? 187 SER H O 1 ATOM 3071 C CB . SER B 2 193 ? 20.010 52.418 -17.416 1.00 65.46 ? 187 SER H CB 1 ATOM 3072 O OG . SER B 2 193 ? 20.302 51.426 -16.445 1.00 66.83 ? 187 SER H OG 1 ATOM 3073 N N . SER B 2 194 ? 21.983 50.276 -19.014 1.00 60.16 ? 188 SER H N 1 ATOM 3074 C CA . SER B 2 194 ? 23.364 49.851 -19.212 1.00 54.63 ? 188 SER H CA 1 ATOM 3075 C C . SER B 2 194 ? 23.724 49.672 -20.687 1.00 50.36 ? 188 SER H C 1 ATOM 3076 O O . SER B 2 194 ? 24.902 49.576 -21.031 1.00 50.70 ? 188 SER H O 1 ATOM 3077 C CB . SER B 2 194 ? 23.624 48.543 -18.458 1.00 56.25 ? 188 SER H CB 1 ATOM 3078 O OG . SER B 2 194 ? 22.836 47.484 -18.978 1.00 50.46 ? 188 SER H OG 1 ATOM 3079 N N . LEU B 2 195 ? 22.712 49.629 -21.551 1.00 46.26 ? 189 LEU H N 1 ATOM 3080 C CA . LEU B 2 195 ? 22.916 49.346 -22.974 1.00 48.93 ? 189 LEU H CA 1 ATOM 3081 C C . LEU B 2 195 ? 23.867 50.312 -23.677 1.00 56.15 ? 189 LEU H C 1 ATOM 3082 O O . LEU B 2 195 ? 24.667 49.905 -24.521 1.00 55.00 ? 189 LEU H O 1 ATOM 3083 C CB . LEU B 2 195 ? 21.575 49.348 -23.707 1.00 40.99 ? 189 LEU H CB 1 ATOM 3084 C CG . LEU B 2 195 ? 20.682 48.146 -23.422 1.00 39.74 ? 189 LEU H CG 1 ATOM 3085 C CD1 . LEU B 2 195 ? 19.481 48.153 -24.353 1.00 32.71 ? 189 LEU H CD1 1 ATOM 3086 C CD2 . LEU B 2 195 ? 21.483 46.859 -23.558 1.00 37.38 ? 189 LEU H CD2 1 ATOM 3087 N N . GLY B 2 196 ? 23.776 51.591 -23.333 1.00 62.64 ? 190 GLY H N 1 ATOM 3088 C CA . GLY B 2 196 ? 24.602 52.595 -23.972 1.00 68.74 ? 190 GLY H CA 1 ATOM 3089 C C . GLY B 2 196 ? 25.967 52.768 -23.335 1.00 75.18 ? 190 GLY H C 1 ATOM 3090 O O . GLY B 2 196 ? 26.807 53.494 -23.861 1.00 81.68 ? 190 GLY H O 1 ATOM 3091 N N . THR B 2 197 ? 26.201 52.103 -22.206 1.00 73.48 ? 191 THR H N 1 ATOM 3092 C CA . THR B 2 197 ? 27.439 52.309 -21.457 1.00 74.76 ? 191 THR H CA 1 ATOM 3093 C C . THR B 2 197 ? 28.176 51.021 -21.081 1.00 76.18 ? 191 THR H C 1 ATOM 3094 O O . THR B 2 197 ? 29.210 51.071 -20.414 1.00 82.91 ? 191 THR H O 1 ATOM 3095 C CB . THR B 2 197 ? 27.175 53.093 -20.154 1.00 76.71 ? 191 THR H CB 1 ATOM 3096 O OG1 . THR B 2 197 ? 26.278 52.351 -19.319 1.00 75.57 ? 191 THR H OG1 1 ATOM 3097 C CG2 . THR B 2 197 ? 26.573 54.459 -20.458 1.00 79.08 ? 191 THR H CG2 1 ATOM 3098 N N . GLN B 2 198 ? 27.652 49.874 -21.502 1.00 65.78 ? 192 GLN H N 1 ATOM 3099 C CA . GLN B 2 198 ? 28.250 48.593 -21.137 1.00 52.92 ? 192 GLN H CA 1 ATOM 3100 C C . GLN B 2 198 ? 28.412 47.678 -22.346 1.00 50.27 ? 192 GLN H C 1 ATOM 3101 O O . GLN B 2 198 ? 27.500 47.547 -23.160 1.00 54.13 ? 192 GLN H O 1 ATOM 3102 C CB . GLN B 2 198 ? 27.404 47.900 -20.068 1.00 52.99 ? 192 GLN H CB 1 ATOM 3103 C CG . GLN B 2 198 ? 27.844 46.484 -19.735 1.00 54.14 ? 192 GLN H CG 1 ATOM 3104 C CD . GLN B 2 198 ? 29.102 46.440 -18.891 1.00 56.98 ? 192 GLN H CD 1 ATOM 3105 O OE1 . GLN B 2 198 ? 29.198 47.113 -17.864 1.00 59.75 ? 192 GLN H OE1 1 ATOM 3106 N NE2 . GLN B 2 198 ? 30.074 45.642 -19.320 1.00 53.57 ? 192 GLN H NE2 1 ATOM 3107 N N . THR B 2 199 ? 29.575 47.043 -22.457 1.00 45.51 ? 193 THR H N 1 ATOM 3108 C CA . THR B 2 199 ? 29.850 46.146 -23.576 1.00 44.97 ? 193 THR H CA 1 ATOM 3109 C C . THR B 2 199 ? 29.432 44.710 -23.263 1.00 41.17 ? 193 THR H C 1 ATOM 3110 O O . THR B 2 199 ? 29.715 44.197 -22.181 1.00 45.79 ? 193 THR H O 1 ATOM 3111 C CB . THR B 2 199 ? 31.343 46.169 -23.954 1.00 48.39 ? 193 THR H CB 1 ATOM 3112 O OG1 . THR B 2 199 ? 31.696 47.479 -24.409 1.00 56.70 ? 193 THR H OG1 1 ATOM 3113 C CG2 . THR B 2 199 ? 31.635 45.170 -25.061 1.00 49.86 ? 193 THR H CG2 1 ATOM 3114 N N . TYR B 2 200 ? 28.753 44.066 -24.207 1.00 38.34 ? 194 TYR H N 1 ATOM 3115 C CA . TYR B 2 200 ? 28.372 42.667 -24.043 1.00 40.48 ? 194 TYR H CA 1 ATOM 3116 C C . TYR B 2 200 ? 28.954 41.793 -25.146 1.00 40.51 ? 194 TYR H C 1 ATOM 3117 O O . TYR B 2 200 ? 28.617 41.947 -26.322 1.00 40.67 ? 194 TYR H O 1 ATOM 3118 C CB . TYR B 2 200 ? 26.850 42.530 -24.002 1.00 33.55 ? 194 TYR H CB 1 ATOM 3119 C CG . TYR B 2 200 ? 26.240 43.243 -22.827 1.00 26.99 ? 194 TYR H CG 1 ATOM 3120 C CD1 . TYR B 2 200 ? 26.272 42.680 -21.563 1.00 28.03 ? 194 TYR H CD1 1 ATOM 3121 C CD2 . TYR B 2 200 ? 25.649 44.490 -22.976 1.00 28.49 ? 194 TYR H CD2 1 ATOM 3122 C CE1 . TYR B 2 200 ? 25.720 43.331 -20.478 1.00 32.82 ? 194 TYR H CE1 1 ATOM 3123 C CE2 . TYR B 2 200 ? 25.095 45.150 -21.897 1.00 32.35 ? 194 TYR H CE2 1 ATOM 3124 C CZ . TYR B 2 200 ? 25.133 44.566 -20.651 1.00 34.36 ? 194 TYR H CZ 1 ATOM 3125 O OH . TYR B 2 200 ? 24.587 45.221 -19.571 1.00 40.71 ? 194 TYR H OH 1 ATOM 3126 N N . ILE B 2 201 ? 29.837 40.880 -24.753 1.00 33.98 ? 195 ILE H N 1 ATOM 3127 C CA . ILE B 2 201 ? 30.465 39.952 -25.683 1.00 32.45 ? 195 ILE H CA 1 ATOM 3128 C C . ILE B 2 201 ? 30.188 38.512 -25.276 1.00 35.43 ? 195 ILE H C 1 ATOM 3129 O O . ILE B 2 201 ? 30.418 38.138 -24.126 1.00 38.34 ? 195 ILE H O 1 ATOM 3130 C CB . ILE B 2 201 ? 31.991 40.162 -25.745 1.00 35.82 ? 195 ILE H CB 1 ATOM 3131 C CG1 . ILE B 2 201 ? 32.318 41.605 -26.130 1.00 36.20 ? 195 ILE H CG1 1 ATOM 3132 C CG2 . ILE B 2 201 ? 32.633 39.182 -26.723 1.00 35.19 ? 195 ILE H CG2 1 ATOM 3133 C CD1 . ILE B 2 201 ? 33.797 41.928 -26.067 1.00 36.12 ? 195 ILE H CD1 1 ATOM 3134 N N . CYS B 2 202 ? 29.686 37.704 -26.204 1.00 33.18 ? 196 CYS H N 1 ATOM 3135 C CA . CYS B 2 202 ? 29.554 36.279 -25.932 1.00 33.38 ? 196 CYS H CA 1 ATOM 3136 C C . CYS B 2 202 ? 30.808 35.565 -26.419 1.00 30.14 ? 196 CYS H C 1 ATOM 3137 O O . CYS B 2 202 ? 31.310 35.842 -27.507 1.00 27.43 ? 196 CYS H O 1 ATOM 3138 C CB . CYS B 2 202 ? 28.298 35.688 -26.586 1.00 36.83 ? 196 CYS H CB 1 ATOM 3139 S SG . CYS B 2 202 ? 28.360 35.453 -28.374 1.00 60.96 ? 196 CYS H SG 1 ATOM 3140 N N . ASN B 2 203 ? 31.327 34.667 -25.592 1.00 30.33 ? 197 ASN H N 1 ATOM 3141 C CA . ASN B 2 203 ? 32.503 33.891 -25.952 1.00 30.03 ? 197 ASN H CA 1 ATOM 3142 C C . ASN B 2 203 ? 32.095 32.460 -26.272 1.00 29.50 ? 197 ASN H C 1 ATOM 3143 O O . ASN B 2 203 ? 31.530 31.770 -25.424 1.00 33.50 ? 197 ASN H O 1 ATOM 3144 C CB . ASN B 2 203 ? 33.536 33.921 -24.822 1.00 26.06 ? 197 ASN H CB 1 ATOM 3145 C CG . ASN B 2 203 ? 33.562 35.252 -24.091 1.00 35.97 ? 197 ASN H CG 1 ATOM 3146 O OD1 . ASN B 2 203 ? 33.015 35.384 -22.994 1.00 39.65 ? 197 ASN H OD1 1 ATOM 3147 N ND2 . ASN B 2 203 ? 34.190 36.251 -24.704 1.00 32.04 ? 197 ASN H ND2 1 ATOM 3148 N N . VAL B 2 204 ? 32.379 32.022 -27.495 1.00 31.01 ? 198 VAL H N 1 ATOM 3149 C CA . VAL B 2 204 ? 31.937 30.713 -27.963 1.00 31.23 ? 198 VAL H CA 1 ATOM 3150 C C . VAL B 2 204 ? 33.094 29.820 -28.380 1.00 33.71 ? 198 VAL H C 1 ATOM 3151 O O . VAL B 2 204 ? 33.914 30.198 -29.215 1.00 39.80 ? 198 VAL H O 1 ATOM 3152 C CB . VAL B 2 204 ? 30.979 30.836 -29.157 1.00 31.31 ? 198 VAL H CB 1 ATOM 3153 C CG1 . VAL B 2 204 ? 30.518 29.453 -29.603 1.00 29.50 ? 198 VAL H CG1 1 ATOM 3154 C CG2 . VAL B 2 204 ? 29.792 31.714 -28.798 1.00 31.12 ? 198 VAL H CG2 1 ATOM 3155 N N . ASN B 2 205 ? 33.144 28.625 -27.807 1.00 31.99 ? 199 ASN H N 1 ATOM 3156 C CA . ASN B 2 205 ? 34.202 27.683 -28.129 1.00 42.47 ? 199 ASN H CA 1 ATOM 3157 C C . ASN B 2 205 ? 33.657 26.327 -28.571 1.00 40.15 ? 199 ASN H C 1 ATOM 3158 O O . ASN B 2 205 ? 32.822 25.730 -27.895 1.00 34.77 ? 199 ASN H O 1 ATOM 3159 C CB . ASN B 2 205 ? 35.134 27.507 -26.928 1.00 52.78 ? 199 ASN H CB 1 ATOM 3160 C CG . ASN B 2 205 ? 36.320 26.612 -27.238 1.00 70.60 ? 199 ASN H CG 1 ATOM 3161 O OD1 . ASN B 2 205 ? 36.769 26.528 -28.383 1.00 76.90 ? 199 ASN H OD1 1 ATOM 3162 N ND2 . ASN B 2 205 ? 36.831 25.934 -26.217 1.00 75.06 ? 199 ASN H ND2 1 ATOM 3163 N N . HIS B 2 206 ? 34.135 25.852 -29.716 1.00 40.55 ? 200 HIS H N 1 ATOM 3164 C CA . HIS B 2 206 ? 33.779 24.529 -30.210 1.00 36.52 ? 200 HIS H CA 1 ATOM 3165 C C . HIS B 2 206 ? 35.051 23.729 -30.438 1.00 41.69 ? 200 HIS H C 1 ATOM 3166 O O . HIS B 2 206 ? 35.638 23.785 -31.517 1.00 44.87 ? 200 HIS H O 1 ATOM 3167 C CB . HIS B 2 206 ? 32.964 24.631 -31.499 1.00 28.77 ? 200 HIS H CB 1 ATOM 3168 C CG . HIS B 2 206 ? 32.489 23.312 -32.022 1.00 33.32 ? 200 HIS H CG 1 ATOM 3169 N ND1 . HIS B 2 206 ? 32.775 22.870 -33.296 1.00 35.63 ? 200 HIS H ND1 1 ATOM 3170 C CD2 . HIS B 2 206 ? 31.745 22.340 -31.445 1.00 35.70 ? 200 HIS H CD2 1 ATOM 3171 C CE1 . HIS B 2 206 ? 32.226 21.683 -33.482 1.00 35.75 ? 200 HIS H CE1 1 ATOM 3172 N NE2 . HIS B 2 206 ? 31.596 21.338 -32.373 1.00 36.15 ? 200 HIS H NE2 1 ATOM 3173 N N . LYS B 2 207 ? 35.476 22.998 -29.413 1.00 45.68 ? 201 LYS H N 1 ATOM 3174 C CA . LYS B 2 207 ? 36.743 22.268 -29.454 1.00 55.55 ? 201 LYS H CA 1 ATOM 3175 C C . LYS B 2 207 ? 36.884 21.255 -30.605 1.00 60.44 ? 201 LYS H C 1 ATOM 3176 O O . LYS B 2 207 ? 37.959 21.178 -31.205 1.00 62.89 ? 201 LYS H O 1 ATOM 3177 C CB . LYS B 2 207 ? 36.986 21.561 -28.114 1.00 63.22 ? 201 LYS H CB 1 ATOM 3178 C CG . LYS B 2 207 ? 37.258 22.515 -26.957 1.00 75.40 ? 201 LYS H CG 1 ATOM 3179 C CD . LYS B 2 207 ? 38.075 21.847 -25.858 1.00 84.83 ? 201 LYS H CD 1 ATOM 3180 C CE . LYS B 2 207 ? 39.457 21.447 -26.361 1.00 90.81 ? 201 LYS H CE 1 ATOM 3181 N NZ . LYS B 2 207 ? 40.301 20.850 -25.287 1.00 95.11 ? 201 LYS H NZ 1 ATOM 3182 N N . PRO B 2 208 ? 35.822 20.479 -30.923 1.00 52.94 ? 202 PRO H N 1 ATOM 3183 C CA . PRO B 2 208 ? 35.964 19.518 -32.028 1.00 49.54 ? 202 PRO H CA 1 ATOM 3184 C C . PRO B 2 208 ? 36.459 20.112 -33.350 1.00 54.44 ? 202 PRO H C 1 ATOM 3185 O O . PRO B 2 208 ? 37.003 19.375 -34.171 1.00 56.27 ? 202 PRO H O 1 ATOM 3186 C CB . PRO B 2 208 ? 34.545 18.976 -32.188 1.00 43.64 ? 202 PRO H CB 1 ATOM 3187 C CG . PRO B 2 208 ? 34.004 19.005 -30.807 1.00 43.10 ? 202 PRO H CG 1 ATOM 3188 C CD . PRO B 2 208 ? 34.554 20.267 -30.196 1.00 46.46 ? 202 PRO H CD 1 ATOM 3189 N N . SER B 2 209 ? 36.286 21.415 -33.547 1.00 53.99 ? 203 SER H N 1 ATOM 3190 C CA . SER B 2 209 ? 36.793 22.075 -34.745 1.00 47.12 ? 203 SER H CA 1 ATOM 3191 C C . SER B 2 209 ? 37.770 23.200 -34.410 1.00 54.31 ? 203 SER H C 1 ATOM 3192 O O . SER B 2 209 ? 38.119 23.997 -35.283 1.00 56.06 ? 203 SER H O 1 ATOM 3193 C CB . SER B 2 209 ? 35.637 22.630 -35.577 1.00 46.36 ? 203 SER H CB 1 ATOM 3194 O OG . SER B 2 209 ? 34.977 23.683 -34.895 1.00 48.58 ? 203 SER H OG 1 ATOM 3195 N N . ASN B 2 210 ? 38.204 23.251 -33.149 1.00 60.39 ? 204 ASN H N 1 ATOM 3196 C CA . ASN B 2 210 ? 39.058 24.329 -32.637 1.00 66.57 ? 204 ASN H CA 1 ATOM 3197 C C . ASN B 2 210 ? 38.577 25.716 -33.044 1.00 65.99 ? 204 ASN H C 1 ATOM 3198 O O . ASN B 2 210 ? 39.315 26.490 -33.653 1.00 63.22 ? 204 ASN H O 1 ATOM 3199 C CB . ASN B 2 210 ? 40.504 24.135 -33.093 1.00 74.22 ? 204 ASN H CB 1 ATOM 3200 C CG . ASN B 2 210 ? 41.260 23.163 -32.216 1.00 83.33 ? 204 ASN H CG 1 ATOM 3201 O OD1 . ASN B 2 210 ? 41.847 22.197 -32.702 1.00 87.69 ? 204 ASN H OD1 1 ATOM 3202 N ND2 . ASN B 2 210 ? 41.248 23.412 -30.911 1.00 84.93 ? 204 ASN H ND2 1 ATOM 3203 N N . THR B 2 211 ? 37.331 26.018 -32.706 1.00 66.84 ? 205 THR H N 1 ATOM 3204 C CA . THR B 2 211 ? 36.730 27.290 -33.064 1.00 64.32 ? 205 THR H CA 1 ATOM 3205 C C . THR B 2 211 ? 36.549 28.169 -31.834 1.00 60.40 ? 205 THR H C 1 ATOM 3206 O O . THR B 2 211 ? 35.938 27.756 -30.849 1.00 57.94 ? 205 THR H O 1 ATOM 3207 C CB . THR B 2 211 ? 35.373 27.083 -33.759 1.00 68.50 ? 205 THR H CB 1 ATOM 3208 O OG1 . THR B 2 211 ? 35.576 26.405 -35.006 1.00 75.70 ? 205 THR H OG1 1 ATOM 3209 C CG2 . THR B 2 211 ? 34.691 28.416 -34.015 1.00 65.06 ? 205 THR H CG2 1 ATOM 3210 N N . LYS B 2 212 ? 37.102 29.374 -31.892 1.00 60.94 ? 206 LYS H N 1 ATOM 3211 C CA . LYS B 2 212 ? 36.932 30.355 -30.828 1.00 61.98 ? 206 LYS H CA 1 ATOM 3212 C C . LYS B 2 212 ? 36.364 31.647 -31.396 1.00 61.08 ? 206 LYS H C 1 ATOM 3213 O O . LYS B 2 212 ? 36.986 32.288 -32.243 1.00 67.12 ? 206 LYS H O 1 ATOM 3214 C CB . LYS B 2 212 ? 38.258 30.631 -30.118 1.00 64.71 ? 206 LYS H CB 1 ATOM 3215 C CG . LYS B 2 212 ? 38.541 29.731 -28.930 1.00 73.34 ? 206 LYS H CG 1 ATOM 3216 C CD . LYS B 2 212 ? 39.760 30.227 -28.162 1.00 84.60 ? 206 LYS H CD 1 ATOM 3217 C CE . LYS B 2 212 ? 39.857 29.590 -26.784 1.00 89.07 ? 206 LYS H CE 1 ATOM 3218 N NZ . LYS B 2 212 ? 40.950 30.195 -25.971 1.00 92.47 ? 206 LYS H NZ 1 ATOM 3219 N N . VAL B 2 213 ? 35.181 32.028 -30.930 1.00 54.29 ? 207 VAL H N 1 ATOM 3220 C CA . VAL B 2 213 ? 34.527 33.228 -31.432 1.00 47.99 ? 207 VAL H CA 1 ATOM 3221 C C . VAL B 2 213 ? 34.146 34.186 -30.311 1.00 47.82 ? 207 VAL H C 1 ATOM 3222 O O . VAL B 2 213 ? 33.534 33.795 -29.319 1.00 52.18 ? 207 VAL H O 1 ATOM 3223 C CB . VAL B 2 213 ? 33.257 32.881 -32.241 1.00 41.69 ? 207 VAL H CB 1 ATOM 3224 C CG1 . VAL B 2 213 ? 32.506 34.147 -32.633 1.00 38.10 ? 207 VAL H CG1 1 ATOM 3225 C CG2 . VAL B 2 213 ? 33.619 32.073 -33.472 1.00 38.22 ? 207 VAL H CG2 1 ATOM 3226 N N . ASP B 2 214 ? 34.529 35.445 -30.475 1.00 41.53 ? 208 ASP H N 1 ATOM 3227 C CA . ASP B 2 214 ? 34.050 36.509 -29.611 1.00 43.93 ? 208 ASP H CA 1 ATOM 3228 C C . ASP B 2 214 ? 33.201 37.445 -30.452 1.00 46.56 ? 208 ASP H C 1 ATOM 3229 O O . ASP B 2 214 ? 33.690 38.042 -31.408 1.00 56.78 ? 208 ASP H O 1 ATOM 3230 C CB . ASP B 2 214 ? 35.215 37.257 -28.963 1.00 47.30 ? 208 ASP H CB 1 ATOM 3231 C CG . ASP B 2 214 ? 36.078 36.354 -28.107 1.00 54.36 ? 208 ASP H CG 1 ATOM 3232 O OD1 . ASP B 2 214 ? 35.517 35.593 -27.291 1.00 53.61 ? 208 ASP H OD1 1 ATOM 3233 O OD2 . ASP B 2 214 ? 37.316 36.396 -28.259 1.00 58.76 ? 208 ASP H OD2 1 ATOM 3234 N N . LYS B 2 215 ? 31.921 37.549 -30.116 1.00 35.71 ? 209 LYS H N 1 ATOM 3235 C CA . LYS B 2 215 ? 31.024 38.411 -30.867 1.00 33.32 ? 209 LYS H CA 1 ATOM 3236 C C . LYS B 2 215 ? 30.377 39.431 -29.950 1.00 40.37 ? 209 LYS H C 1 ATOM 3237 O O . LYS B 2 215 ? 29.593 39.081 -29.068 1.00 44.39 ? 209 LYS H O 1 ATOM 3238 C CB . LYS B 2 215 ? 29.952 37.592 -31.590 1.00 42.33 ? 209 LYS H CB 1 ATOM 3239 C CG . LYS B 2 215 ? 29.107 38.416 -32.554 1.00 56.53 ? 209 LYS H CG 1 ATOM 3240 C CD . LYS B 2 215 ? 29.292 37.969 -33.999 1.00 62.73 ? 209 LYS H CD 1 ATOM 3241 C CE . LYS B 2 215 ? 29.607 39.152 -34.910 1.00 68.75 ? 209 LYS H CE 1 ATOM 3242 N NZ . LYS B 2 215 ? 28.655 40.289 -34.733 1.00 69.03 ? 209 LYS H NZ 1 ATOM 3243 N N . LYS B 2 216 ? 30.725 40.696 -30.158 1.00 43.72 ? 210 LYS H N 1 ATOM 3244 C CA . LYS B 2 216 ? 30.127 41.789 -29.411 1.00 40.47 ? 210 LYS H CA 1 ATOM 3245 C C . LYS B 2 216 ? 28.686 41.979 -29.874 1.00 40.11 ? 210 LYS H C 1 ATOM 3246 O O . LYS B 2 216 ? 28.398 41.916 -31.068 1.00 46.38 ? 210 LYS H O 1 ATOM 3247 C CB . LYS B 2 216 ? 30.941 43.073 -29.594 1.00 39.54 ? 210 LYS H CB 1 ATOM 3248 C CG . LYS B 2 216 ? 30.453 44.246 -28.766 1.00 51.19 ? 210 LYS H CG 1 ATOM 3249 C CD . LYS B 2 216 ? 31.301 45.488 -29.010 1.00 59.99 ? 210 LYS H CD 1 ATOM 3250 C CE . LYS B 2 216 ? 30.735 46.694 -28.273 1.00 70.11 ? 210 LYS H CE 1 ATOM 3251 N NZ . LYS B 2 216 ? 31.602 47.901 -28.393 1.00 75.62 ? 210 LYS H NZ 1 ATOM 3252 N N . VAL B 2 217 ? 27.778 42.186 -28.928 1.00 37.54 ? 211 VAL H N 1 ATOM 3253 C CA . VAL B 2 217 ? 26.367 42.341 -29.251 1.00 32.64 ? 211 VAL H CA 1 ATOM 3254 C C . VAL B 2 217 ? 25.915 43.765 -28.973 1.00 33.40 ? 211 VAL H C 1 ATOM 3255 O O . VAL B 2 217 ? 25.829 44.180 -27.821 1.00 38.43 ? 211 VAL H O 1 ATOM 3256 C CB . VAL B 2 217 ? 25.493 41.360 -28.451 1.00 30.63 ? 211 VAL H CB 1 ATOM 3257 C CG1 . VAL B 2 217 ? 24.033 41.510 -28.843 1.00 25.05 ? 211 VAL H CG1 1 ATOM 3258 C CG2 . VAL B 2 217 ? 25.967 39.928 -28.670 1.00 30.30 ? 211 VAL H CG2 1 ATOM 3259 N N . GLU B 2 218 ? 25.628 44.510 -30.034 1.00 39.17 ? 212 GLU H N 1 ATOM 3260 C CA . GLU B 2 218 ? 25.279 45.920 -29.907 1.00 40.99 ? 212 GLU H CA 1 ATOM 3261 C C . GLU B 2 218 ? 23.811 46.177 -30.226 1.00 45.34 ? 212 GLU H C 1 ATOM 3262 O O . GLU B 2 218 ? 23.213 45.470 -31.036 1.00 45.39 ? 212 GLU H O 1 ATOM 3263 C CB . GLU B 2 218 ? 26.172 46.761 -30.818 1.00 51.46 ? 212 GLU H CB 1 ATOM 3264 C CG . GLU B 2 218 ? 27.640 46.720 -30.431 1.00 63.65 ? 212 GLU H CG 1 ATOM 3265 C CD . GLU B 2 218 ? 28.532 47.407 -31.446 1.00 74.62 ? 212 GLU H CD 1 ATOM 3266 O OE1 . GLU B 2 218 ? 28.015 48.222 -32.241 1.00 75.72 ? 212 GLU H OE1 1 ATOM 3267 O OE2 . GLU B 2 218 ? 29.749 47.126 -31.453 1.00 79.27 ? 212 GLU H OE2 1 ATOM 3268 N N . PRO B 2 219 ? 23.221 47.194 -29.580 1.00 49.34 ? 213 PRO H N 1 ATOM 3269 C CA . PRO B 2 219 ? 21.809 47.535 -29.787 1.00 51.07 ? 213 PRO H CA 1 ATOM 3270 C C . PRO B 2 219 ? 21.485 47.985 -31.212 1.00 63.99 ? 213 PRO H C 1 ATOM 3271 O O . PRO B 2 219 ? 22.383 48.163 -32.037 1.00 60.96 ? 213 PRO H O 1 ATOM 3272 C CB . PRO B 2 219 ? 21.580 48.683 -28.797 1.00 43.34 ? 213 PRO H CB 1 ATOM 3273 C CG . PRO B 2 219 ? 22.617 48.493 -27.754 1.00 48.02 ? 213 PRO H CG 1 ATOM 3274 C CD . PRO B 2 219 ? 23.818 47.983 -28.490 1.00 48.72 ? 213 PRO H CD 1 ATOM 3275 N N . LYS B 2 220 ? 20.194 48.157 -31.485 1.00 76.45 ? 214 LYS H N 1 ATOM 3276 C CA . LYS B 2 220 ? 19.727 48.636 -32.779 1.00 80.60 ? 214 LYS H CA 1 ATOM 3277 C C . LYS B 2 220 ? 18.376 49.332 -32.643 1.00 81.44 ? 214 LYS H C 1 ATOM 3278 O O . LYS B 2 220 ? 18.248 50.325 -31.926 1.00 84.58 ? 214 LYS H O 1 ATOM 3279 C CB . LYS B 2 220 ? 19.630 47.484 -33.780 1.00 79.59 ? 214 LYS H CB 1 ATOM 3280 C CG . LYS B 2 220 ? 20.620 47.588 -34.924 1.00 82.38 ? 214 LYS H CG 1 ATOM 3281 C CD . LYS B 2 220 ? 20.388 46.506 -35.964 1.00 84.28 ? 214 LYS H CD 1 ATOM 3282 C CE . LYS B 2 220 ? 21.261 46.733 -37.187 1.00 87.45 ? 214 LYS H CE 1 ATOM 3283 N NZ . LYS B 2 220 ? 21.084 45.666 -38.207 1.00 88.84 ? 214 LYS H NZ 1 ATOM 3284 N N . ASP C 1 1 ? 94.192 -8.173 -21.144 1.00 76.67 ? 1 ASP A N 1 ATOM 3285 C CA . ASP C 1 1 ? 93.134 -8.763 -20.332 1.00 75.69 ? 1 ASP A CA 1 ATOM 3286 C C . ASP C 1 1 ? 93.716 -9.630 -19.219 1.00 68.10 ? 1 ASP A C 1 ATOM 3287 O O . ASP C 1 1 ? 94.713 -10.327 -19.420 1.00 71.73 ? 1 ASP A O 1 ATOM 3288 C CB . ASP C 1 1 ? 92.184 -9.590 -21.202 1.00 83.81 ? 1 ASP A CB 1 ATOM 3289 C CG . ASP C 1 1 ? 91.497 -8.758 -22.272 1.00 94.04 ? 1 ASP A CG 1 ATOM 3290 O OD1 . ASP C 1 1 ? 91.364 -7.531 -22.082 1.00 97.86 ? 1 ASP A OD1 1 ATOM 3291 O OD2 . ASP C 1 1 ? 91.086 -9.334 -23.300 1.00 96.80 ? 1 ASP A OD2 1 ATOM 3292 N N . ILE C 1 2 ? 93.090 -9.585 -18.047 1.00 49.55 ? 2 ILE A N 1 ATOM 3293 C CA . ILE C 1 2 ? 93.559 -10.353 -16.899 1.00 40.64 ? 2 ILE A CA 1 ATOM 3294 C C . ILE C 1 2 ? 93.246 -11.842 -17.062 1.00 36.36 ? 2 ILE A C 1 ATOM 3295 O O . ILE C 1 2 ? 92.108 -12.231 -17.324 1.00 33.35 ? 2 ILE A O 1 ATOM 3296 C CB . ILE C 1 2 ? 92.944 -9.831 -15.588 1.00 39.65 ? 2 ILE A CB 1 ATOM 3297 C CG1 . ILE C 1 2 ? 93.601 -8.508 -15.195 1.00 44.76 ? 2 ILE A CG1 1 ATOM 3298 C CG2 . ILE C 1 2 ? 93.123 -10.842 -14.466 1.00 37.92 ? 2 ILE A CG2 1 ATOM 3299 C CD1 . ILE C 1 2 ? 93.004 -7.875 -13.959 1.00 48.03 ? 2 ILE A CD1 1 ATOM 3300 N N . GLN C 1 3 ? 94.278 -12.665 -16.915 1.00 39.02 ? 3 GLN A N 1 ATOM 3301 C CA . GLN C 1 3 ? 94.153 -14.109 -17.052 1.00 41.49 ? 3 GLN A CA 1 ATOM 3302 C C . GLN C 1 3 ? 94.162 -14.793 -15.686 1.00 33.20 ? 3 GLN A C 1 ATOM 3303 O O . GLN C 1 3 ? 94.980 -14.455 -14.827 1.00 28.92 ? 3 GLN A O 1 ATOM 3304 C CB . GLN C 1 3 ? 95.292 -14.650 -17.919 1.00 53.08 ? 3 GLN A CB 1 ATOM 3305 C CG . GLN C 1 3 ? 95.190 -16.123 -18.266 1.00 71.57 ? 3 GLN A CG 1 ATOM 3306 C CD . GLN C 1 3 ? 94.641 -16.352 -19.661 1.00 85.04 ? 3 GLN A CD 1 ATOM 3307 O OE1 . GLN C 1 3 ? 93.947 -15.498 -20.214 1.00 92.08 ? 3 GLN A OE1 1 ATOM 3308 N NE2 . GLN C 1 3 ? 94.957 -17.506 -20.241 1.00 84.05 ? 3 GLN A NE2 1 ATOM 3309 N N . MET C 1 4 ? 93.249 -15.742 -15.485 1.00 25.08 ? 4 MET A N 1 ATOM 3310 C CA . MET C 1 4 ? 93.274 -16.593 -14.295 1.00 20.01 ? 4 MET A CA 1 ATOM 3311 C C . MET C 1 4 ? 93.813 -17.964 -14.659 1.00 28.63 ? 4 MET A C 1 ATOM 3312 O O . MET C 1 4 ? 93.310 -18.609 -15.585 1.00 25.90 ? 4 MET A O 1 ATOM 3313 C CB . MET C 1 4 ? 91.882 -16.755 -13.671 1.00 26.52 ? 4 MET A CB 1 ATOM 3314 C CG . MET C 1 4 ? 91.129 -15.468 -13.425 1.00 38.70 ? 4 MET A CG 1 ATOM 3315 S SD . MET C 1 4 ? 92.103 -14.257 -12.533 1.00 80.42 ? 4 MET A SD 1 ATOM 3316 C CE . MET C 1 4 ? 92.284 -15.070 -10.953 1.00 150.26 ? 4 MET A CE 1 ATOM 3317 N N . THR C 1 5 ? 94.825 -18.417 -13.929 1.00 23.47 ? 5 THR A N 1 ATOM 3318 C CA . THR C 1 5 ? 95.367 -19.745 -14.157 1.00 23.67 ? 5 THR A CA 1 ATOM 3319 C C . THR C 1 5 ? 95.379 -20.542 -12.861 1.00 26.98 ? 5 THR A C 1 ATOM 3320 O O . THR C 1 5 ? 95.922 -20.095 -11.847 1.00 27.08 ? 5 THR A O 1 ATOM 3321 C CB . THR C 1 5 ? 96.786 -19.681 -14.752 1.00 29.00 ? 5 THR A CB 1 ATOM 3322 O OG1 . THR C 1 5 ? 96.737 -19.011 -16.019 1.00 35.44 ? 5 THR A OG1 1 ATOM 3323 C CG2 . THR C 1 5 ? 97.345 -21.081 -14.956 1.00 27.02 ? 5 THR A CG2 1 ATOM 3324 N N . GLN C 1 6 ? 94.764 -21.720 -12.901 1.00 26.17 ? 6 GLN A N 1 ATOM 3325 C CA . GLN C 1 6 ? 94.674 -22.581 -11.726 1.00 24.47 ? 6 GLN A CA 1 ATOM 3326 C C . GLN C 1 6 ? 95.748 -23.658 -11.759 1.00 24.63 ? 6 GLN A C 1 ATOM 3327 O O . GLN C 1 6 ? 96.206 -24.056 -12.833 1.00 22.54 ? 6 GLN A O 1 ATOM 3328 C CB . GLN C 1 6 ? 93.284 -23.218 -11.633 1.00 23.80 ? 6 GLN A CB 1 ATOM 3329 C CG . GLN C 1 6 ? 92.159 -22.197 -11.584 1.00 26.31 ? 6 GLN A CG 1 ATOM 3330 C CD . GLN C 1 6 ? 90.771 -22.821 -11.540 1.00 29.93 ? 6 GLN A CD 1 ATOM 3331 O OE1 . GLN C 1 6 ? 89.845 -22.325 -12.179 1.00 31.57 ? 6 GLN A OE1 1 ATOM 3332 N NE2 . GLN C 1 6 ? 90.619 -23.900 -10.774 1.00 26.75 ? 6 GLN A NE2 1 ATOM 3333 N N . SER C 1 7 ? 96.168 -24.109 -10.581 1.00 24.15 ? 7 SER A N 1 ATOM 3334 C CA . SER C 1 7 ? 97.065 -25.252 -10.486 1.00 32.06 ? 7 SER A CA 1 ATOM 3335 C C . SER C 1 7 ? 96.805 -26.018 -9.194 1.00 30.63 ? 7 SER A C 1 ATOM 3336 O O . SER C 1 7 ? 96.520 -25.413 -8.159 1.00 25.86 ? 7 SER A O 1 ATOM 3337 C CB . SER C 1 7 ? 98.530 -24.818 -10.573 1.00 42.03 ? 7 SER A CB 1 ATOM 3338 O OG . SER C 1 7 ? 98.860 -23.932 -9.526 1.00 51.10 ? 7 SER A OG 1 ATOM 3339 N N . PRO C 1 8 ? 96.856 -27.362 -9.263 1.00 28.59 ? 8 PRO A N 1 ATOM 3340 C CA . PRO C 1 8 ? 97.019 -28.139 -10.501 1.00 28.93 ? 8 PRO A CA 1 ATOM 3341 C C . PRO C 1 8 ? 95.760 -28.064 -11.361 1.00 26.57 ? 8 PRO A C 1 ATOM 3342 O O . PRO C 1 8 ? 94.788 -27.447 -10.941 1.00 28.18 ? 8 PRO A O 1 ATOM 3343 C CB . PRO C 1 8 ? 97.256 -29.575 -10.001 1.00 25.31 ? 8 PRO A CB 1 ATOM 3344 C CG . PRO C 1 8 ? 97.559 -29.446 -8.529 1.00 30.37 ? 8 PRO A CG 1 ATOM 3345 C CD . PRO C 1 8 ? 96.804 -28.230 -8.078 1.00 26.76 ? 8 PRO A CD 1 ATOM 3346 N N . SER C 1 9 ? 95.786 -28.652 -12.549 1.00 24.14 ? 9 SER A N 1 ATOM 3347 C CA . SER C 1 9 ? 94.587 -28.720 -13.370 1.00 26.48 ? 9 SER A CA 1 ATOM 3348 C C . SER C 1 9 ? 93.817 -29.980 -13.025 1.00 27.28 ? 9 SER A C 1 ATOM 3349 O O . SER C 1 9 ? 92.641 -30.119 -13.362 1.00 21.10 ? 9 SER A O 1 ATOM 3350 C CB . SER C 1 9 ? 94.936 -28.705 -14.857 1.00 24.35 ? 9 SER A CB 1 ATOM 3351 O OG . SER C 1 9 ? 95.497 -27.463 -15.234 1.00 29.35 ? 9 SER A OG 1 ATOM 3352 N N . PHE C 1 10 ? 94.494 -30.893 -12.337 1.00 20.95 ? 10 PHE A N 1 ATOM 3353 C CA . PHE C 1 10 ? 93.932 -32.201 -12.042 1.00 22.58 ? 10 PHE A CA 1 ATOM 3354 C C . PHE C 1 10 ? 94.553 -32.753 -10.762 1.00 28.91 ? 10 PHE A C 1 ATOM 3355 O O . PHE C 1 10 ? 95.773 -32.743 -10.596 1.00 31.22 ? 10 PHE A O 1 ATOM 3356 C CB . PHE C 1 10 ? 94.165 -33.150 -13.219 1.00 21.01 ? 10 PHE A CB 1 ATOM 3357 C CG . PHE C 1 10 ? 93.584 -34.523 -13.030 1.00 22.93 ? 10 PHE A CG 1 ATOM 3358 C CD1 . PHE C 1 10 ? 94.281 -35.500 -12.330 1.00 25.99 ? 10 PHE A CD1 1 ATOM 3359 C CD2 . PHE C 1 10 ? 92.357 -34.846 -13.579 1.00 27.84 ? 10 PHE A CD2 1 ATOM 3360 C CE1 . PHE C 1 10 ? 93.755 -36.765 -12.161 1.00 29.63 ? 10 PHE A CE1 1 ATOM 3361 C CE2 . PHE C 1 10 ? 91.824 -36.115 -13.417 1.00 33.96 ? 10 PHE A CE2 1 ATOM 3362 C CZ . PHE C 1 10 ? 92.527 -37.076 -12.707 1.00 29.91 ? 10 PHE A CZ 1 ATOM 3363 N N . VAL C 1 11 ? 93.704 -33.222 -9.856 1.00 28.35 ? 11 VAL A N 1 ATOM 3364 C CA . VAL C 1 11 ? 94.161 -33.804 -8.601 1.00 25.80 ? 11 VAL A CA 1 ATOM 3365 C C . VAL C 1 11 ? 93.411 -35.096 -8.339 1.00 27.99 ? 11 VAL A C 1 ATOM 3366 O O . VAL C 1 11 ? 92.182 -35.137 -8.404 1.00 28.98 ? 11 VAL A O 1 ATOM 3367 C CB . VAL C 1 11 ? 93.953 -32.847 -7.409 1.00 34.51 ? 11 VAL A CB 1 ATOM 3368 C CG1 . VAL C 1 11 ? 94.382 -33.513 -6.114 1.00 27.51 ? 11 VAL A CG1 1 ATOM 3369 C CG2 . VAL C 1 11 ? 94.709 -31.540 -7.624 1.00 31.72 ? 11 VAL A CG2 1 ATOM 3370 N N . SER C 1 12 ? 94.153 -36.159 -8.067 1.00 29.93 ? 12 SER A N 1 ATOM 3371 C CA . SER C 1 12 ? 93.544 -37.425 -7.698 1.00 33.13 ? 12 SER A CA 1 ATOM 3372 C C . SER C 1 12 ? 93.763 -37.660 -6.207 1.00 31.72 ? 12 SER A C 1 ATOM 3373 O O . SER C 1 12 ? 94.897 -37.759 -5.752 1.00 35.90 ? 12 SER A O 1 ATOM 3374 C CB . SER C 1 12 ? 94.128 -38.569 -8.529 1.00 28.42 ? 12 SER A CB 1 ATOM 3375 O OG . SER C 1 12 ? 93.491 -39.792 -8.216 1.00 35.17 ? 12 SER A OG 1 ATOM 3376 N N . ALA C 1 13 ? 92.675 -37.734 -5.446 1.00 27.46 ? 13 ALA A N 1 ATOM 3377 C CA . ALA C 1 13 ? 92.778 -37.809 -3.991 1.00 24.17 ? 13 ALA A CA 1 ATOM 3378 C C . ALA C 1 13 ? 91.780 -38.788 -3.384 1.00 29.99 ? 13 ALA A C 1 ATOM 3379 O O . ALA C 1 13 ? 90.673 -38.967 -3.891 1.00 30.76 ? 13 ALA A O 1 ATOM 3380 C CB . ALA C 1 13 ? 92.585 -36.425 -3.379 1.00 15.64 ? 13 ALA A CB 1 ATOM 3381 N N . SER C 1 14 ? 92.183 -39.416 -2.287 1.00 29.90 ? 14 SER A N 1 ATOM 3382 C CA . SER C 1 14 ? 91.291 -40.289 -1.545 1.00 29.99 ? 14 SER A CA 1 ATOM 3383 C C . SER C 1 14 ? 90.275 -39.462 -0.781 1.00 28.61 ? 14 SER A C 1 ATOM 3384 O O . SER C 1 14 ? 90.540 -38.312 -0.428 1.00 23.50 ? 14 SER A O 1 ATOM 3385 C CB . SER C 1 14 ? 92.075 -41.170 -0.568 1.00 24.19 ? 14 SER A CB 1 ATOM 3386 O OG . SER C 1 14 ? 93.126 -41.847 -1.230 1.00 32.97 ? 14 SER A OG 1 ATOM 3387 N N . VAL C 1 15 ? 89.111 -40.050 -0.530 1.00 28.88 ? 15 VAL A N 1 ATOM 3388 C CA . VAL C 1 15 ? 88.179 -39.494 0.438 1.00 24.49 ? 15 VAL A CA 1 ATOM 3389 C C . VAL C 1 15 ? 88.919 -39.316 1.761 1.00 27.85 ? 15 VAL A C 1 ATOM 3390 O O . VAL C 1 15 ? 89.693 -40.186 2.159 1.00 22.15 ? 15 VAL A O 1 ATOM 3391 C CB . VAL C 1 15 ? 86.959 -40.403 0.634 1.00 26.16 ? 15 VAL A CB 1 ATOM 3392 C CG1 . VAL C 1 15 ? 86.100 -39.903 1.787 1.00 22.99 ? 15 VAL A CG1 1 ATOM 3393 C CG2 . VAL C 1 15 ? 86.154 -40.480 -0.656 1.00 25.47 ? 15 VAL A CG2 1 ATOM 3394 N N . GLY C 1 16 ? 88.719 -38.176 2.416 1.00 26.64 ? 16 GLY A N 1 ATOM 3395 C CA . GLY C 1 16 ? 89.370 -37.920 3.688 1.00 28.19 ? 16 GLY A CA 1 ATOM 3396 C C . GLY C 1 16 ? 90.667 -37.139 3.571 1.00 29.77 ? 16 GLY A C 1 ATOM 3397 O O . GLY C 1 16 ? 91.164 -36.610 4.564 1.00 32.73 ? 16 GLY A O 1 ATOM 3398 N N . ASP C 1 17 ? 91.220 -37.060 2.363 1.00 24.82 ? 17 ASP A N 1 ATOM 3399 C CA . ASP C 1 17 ? 92.449 -36.301 2.149 1.00 24.86 ? 17 ASP A CA 1 ATOM 3400 C C . ASP C 1 17 ? 92.203 -34.800 2.233 1.00 23.77 ? 17 ASP A C 1 ATOM 3401 O O . ASP C 1 17 ? 91.093 -34.321 1.999 1.00 22.92 ? 17 ASP A O 1 ATOM 3402 C CB . ASP C 1 17 ? 93.070 -36.640 0.794 1.00 32.11 ? 17 ASP A CB 1 ATOM 3403 C CG . ASP C 1 17 ? 93.738 -38.003 0.778 1.00 48.82 ? 17 ASP A CG 1 ATOM 3404 O OD1 . ASP C 1 17 ? 93.650 -38.725 1.796 1.00 52.22 ? 17 ASP A OD1 1 ATOM 3405 O OD2 . ASP C 1 17 ? 94.342 -38.354 -0.260 1.00 49.21 ? 17 ASP A OD2 1 ATOM 3406 N N . ARG C 1 18 ? 93.252 -34.067 2.580 1.00 28.57 ? 18 ARG A N 1 ATOM 3407 C CA . ARG C 1 18 ? 93.251 -32.614 2.507 1.00 32.96 ? 18 ARG A CA 1 ATOM 3408 C C . ARG C 1 18 ? 93.778 -32.190 1.140 1.00 36.28 ? 18 ARG A C 1 ATOM 3409 O O . ARG C 1 18 ? 94.747 -32.763 0.642 1.00 33.54 ? 18 ARG A O 1 ATOM 3410 C CB . ARG C 1 18 ? 94.108 -32.017 3.627 1.00 35.11 ? 18 ARG A CB 1 ATOM 3411 C CG . ARG C 1 18 ? 94.527 -30.571 3.408 1.00 36.69 ? 18 ARG A CG 1 ATOM 3412 C CD . ARG C 1 18 ? 95.520 -30.120 4.473 1.00 45.39 ? 18 ARG A CD 1 ATOM 3413 N NE . ARG C 1 18 ? 94.890 -29.303 5.505 1.00 50.80 ? 18 ARG A NE 1 ATOM 3414 C CZ . ARG C 1 18 ? 95.091 -27.998 5.646 1.00 55.00 ? 18 ARG A CZ 1 ATOM 3415 N NH1 . ARG C 1 18 ? 95.919 -27.360 4.827 1.00 55.01 ? 18 ARG A NH1 1 ATOM 3416 N NH2 . ARG C 1 18 ? 94.470 -27.331 6.611 1.00 58.73 ? 18 ARG A NH2 1 ATOM 3417 N N . VAL C 1 19 ? 93.139 -31.202 0.523 1.00 32.88 ? 19 VAL A N 1 ATOM 3418 C CA . VAL C 1 19 ? 93.621 -30.700 -0.755 1.00 27.97 ? 19 VAL A CA 1 ATOM 3419 C C . VAL C 1 19 ? 93.530 -29.176 -0.818 1.00 27.99 ? 19 VAL A C 1 ATOM 3420 O O . VAL C 1 19 ? 92.588 -28.564 -0.302 1.00 25.15 ? 19 VAL A O 1 ATOM 3421 C CB . VAL C 1 19 ? 92.852 -31.332 -1.945 1.00 40.42 ? 19 VAL A CB 1 ATOM 3422 C CG1 . VAL C 1 19 ? 91.390 -30.920 -1.940 1.00 37.13 ? 19 VAL A CG1 1 ATOM 3423 C CG2 . VAL C 1 19 ? 93.512 -30.966 -3.267 1.00 41.00 ? 19 VAL A CG2 1 ATOM 3424 N N . THR C 1 20 ? 94.550 -28.574 -1.419 1.00 25.66 ? 20 THR A N 1 ATOM 3425 C CA . THR C 1 20 ? 94.594 -27.140 -1.643 1.00 26.88 ? 20 THR A CA 1 ATOM 3426 C C . THR C 1 20 ? 94.863 -26.875 -3.109 1.00 32.40 ? 20 THR A C 1 ATOM 3427 O O . THR C 1 20 ? 95.866 -27.334 -3.645 1.00 40.10 ? 20 THR A O 1 ATOM 3428 C CB . THR C 1 20 ? 95.687 -26.449 -0.810 1.00 27.85 ? 20 THR A CB 1 ATOM 3429 O OG1 . THR C 1 20 ? 95.453 -26.682 0.582 1.00 42.99 ? 20 THR A OG1 1 ATOM 3430 C CG2 . THR C 1 20 ? 95.684 -24.946 -1.071 1.00 30.97 ? 20 THR A CG2 1 ATOM 3431 N N . ILE C 1 21 ? 93.971 -26.143 -3.763 1.00 25.68 ? 21 ILE A N 1 ATOM 3432 C CA . ILE C 1 21 ? 94.215 -25.750 -5.139 1.00 25.31 ? 21 ILE A CA 1 ATOM 3433 C C . ILE C 1 21 ? 94.417 -24.252 -5.191 1.00 26.48 ? 21 ILE A C 1 ATOM 3434 O O . ILE C 1 21 ? 93.889 -23.517 -4.354 1.00 27.17 ? 21 ILE A O 1 ATOM 3435 C CB . ILE C 1 21 ? 93.069 -26.169 -6.065 1.00 32.60 ? 21 ILE A CB 1 ATOM 3436 C CG1 . ILE C 1 21 ? 91.745 -25.591 -5.577 1.00 33.62 ? 21 ILE A CG1 1 ATOM 3437 C CG2 . ILE C 1 21 ? 92.979 -27.688 -6.132 1.00 36.06 ? 21 ILE A CG2 1 ATOM 3438 C CD1 . ILE C 1 21 ? 90.536 -26.236 -6.232 1.00 37.93 ? 21 ILE A CD1 1 ATOM 3439 N N . THR C 1 22 ? 95.200 -23.790 -6.155 1.00 21.25 ? 22 THR A N 1 ATOM 3440 C CA . THR C 1 22 ? 95.483 -22.368 -6.216 1.00 26.14 ? 22 THR A CA 1 ATOM 3441 C C . THR C 1 22 ? 95.027 -21.743 -7.524 1.00 26.89 ? 22 THR A C 1 ATOM 3442 O O . THR C 1 22 ? 94.857 -22.422 -8.543 1.00 19.36 ? 22 THR A O 1 ATOM 3443 C CB . THR C 1 22 ? 96.981 -22.075 -6.021 1.00 27.86 ? 22 THR A CB 1 ATOM 3444 O OG1 . THR C 1 22 ? 97.714 -22.581 -7.138 1.00 37.94 ? 22 THR A OG1 1 ATOM 3445 C CG2 . THR C 1 22 ? 97.487 -22.729 -4.754 1.00 24.92 ? 22 THR A CG2 1 ATOM 3446 N N . CYS C 1 23 ? 94.818 -20.434 -7.460 1.00 22.59 ? 23 CYS A N 1 ATOM 3447 C CA . CYS C 1 23 ? 94.442 -19.627 -8.605 1.00 25.81 ? 23 CYS A CA 1 ATOM 3448 C C . CYS C 1 23 ? 95.410 -18.457 -8.700 1.00 20.75 ? 23 CYS A C 1 ATOM 3449 O O . CYS C 1 23 ? 95.614 -17.742 -7.718 1.00 23.08 ? 23 CYS A O 1 ATOM 3450 C CB . CYS C 1 23 ? 93.002 -19.126 -8.461 1.00 33.95 ? 23 CYS A CB 1 ATOM 3451 S SG . CYS C 1 23 ? 92.288 -18.366 -9.942 1.00 52.68 ? 23 CYS A SG 1 ATOM 3452 N N . ARG C 1 24 ? 96.015 -18.260 -9.865 1.00 24.96 ? 24 ARG A N 1 ATOM 3453 C CA . ARG C 1 24 ? 96.881 -17.099 -10.056 1.00 28.30 ? 24 ARG A CA 1 ATOM 3454 C C . ARG C 1 24 ? 96.331 -16.140 -11.105 1.00 25.81 ? 24 ARG A C 1 ATOM 3455 O O . ARG C 1 24 ? 95.964 -16.550 -12.204 1.00 28.52 ? 24 ARG A O 1 ATOM 3456 C CB . ARG C 1 24 ? 98.301 -17.525 -10.443 1.00 30.67 ? 24 ARG A CB 1 ATOM 3457 C CG . ARG C 1 24 ? 99.273 -16.358 -10.423 1.00 37.84 ? 24 ARG A CG 1 ATOM 3458 C CD . ARG C 1 24 ? 100.712 -16.780 -10.652 1.00 47.28 ? 24 ARG A CD 1 ATOM 3459 N NE . ARG C 1 24 ? 101.637 -15.742 -10.201 1.00 59.20 ? 24 ARG A NE 1 ATOM 3460 C CZ . ARG C 1 24 ? 101.881 -14.614 -10.864 1.00 74.25 ? 24 ARG A CZ 1 ATOM 3461 N NH1 . ARG C 1 24 ? 101.273 -14.368 -12.018 1.00 76.65 ? 24 ARG A NH1 1 ATOM 3462 N NH2 . ARG C 1 24 ? 102.738 -13.729 -10.375 1.00 80.15 ? 24 ARG A NH2 1 ATOM 3463 N N . ALA C 1 25 ? 96.268 -14.859 -10.752 1.00 26.31 ? 25 ALA A N 1 ATOM 3464 C CA . ALA C 1 25 ? 95.864 -13.820 -11.696 1.00 30.24 ? 25 ALA A CA 1 ATOM 3465 C C . ALA C 1 25 ? 97.099 -13.155 -12.296 1.00 28.54 ? 25 ALA A C 1 ATOM 3466 O O . ALA C 1 25 ? 98.098 -12.960 -11.607 1.00 29.05 ? 25 ALA A O 1 ATOM 3467 C CB . ALA C 1 25 ? 94.980 -12.786 -11.014 1.00 23.35 ? 25 ALA A CB 1 ATOM 3468 N N . SER C 1 26 ? 97.029 -12.807 -13.576 1.00 26.38 ? 26 SER A N 1 ATOM 3469 C CA . SER C 1 26 ? 98.182 -12.233 -14.262 1.00 31.96 ? 26 SER A CA 1 ATOM 3470 C C . SER C 1 26 ? 98.491 -10.819 -13.760 1.00 37.87 ? 26 SER A C 1 ATOM 3471 O O . SER C 1 26 ? 99.607 -10.331 -13.919 1.00 38.24 ? 26 SER A O 1 ATOM 3472 C CB . SER C 1 26 ? 97.951 -12.226 -15.773 1.00 28.99 ? 26 SER A CB 1 ATOM 3473 O OG . SER C 1 26 ? 96.745 -11.563 -16.096 1.00 30.38 ? 26 SER A OG 1 ATOM 3474 N N . GLN C 1 27 ? 97.495 -10.164 -13.169 1.00 37.03 ? 27 GLN A N 1 ATOM 3475 C CA . GLN C 1 27 ? 97.701 -8.897 -12.468 1.00 40.90 ? 27 GLN A CA 1 ATOM 3476 C C . GLN C 1 27 ? 96.944 -8.934 -11.150 1.00 36.26 ? 27 GLN A C 1 ATOM 3477 O O . GLN C 1 27 ? 96.070 -9.777 -10.964 1.00 32.32 ? 27 GLN A O 1 ATOM 3478 C CB . GLN C 1 27 ? 97.220 -7.704 -13.293 1.00 47.98 ? 27 GLN A CB 1 ATOM 3479 C CG . GLN C 1 27 ? 97.512 -7.772 -14.778 1.00 61.66 ? 27 GLN A CG 1 ATOM 3480 C CD . GLN C 1 27 ? 96.877 -6.619 -15.525 1.00 66.58 ? 27 GLN A CD 1 ATOM 3481 O OE1 . GLN C 1 27 ? 96.504 -5.614 -14.921 1.00 67.45 ? 27 GLN A OE1 1 ATOM 3482 N NE2 . GLN C 1 27 ? 96.746 -6.756 -16.843 1.00 66.63 ? 27 GLN A NE2 1 ATOM 3483 N N . GLY C 1 28 ? 97.260 -8.008 -10.250 1.00 32.30 ? 28 GLY A N 1 ATOM 3484 C CA . GLY C 1 28 ? 96.572 -7.926 -8.974 1.00 34.28 ? 28 GLY A CA 1 ATOM 3485 C C . GLY C 1 28 ? 95.088 -7.643 -9.129 1.00 30.00 ? 28 GLY A C 1 ATOM 3486 O O . GLY C 1 28 ? 94.698 -6.765 -9.894 1.00 28.19 ? 28 GLY A O 1 ATOM 3487 N N . ILE C 1 29 ? 94.259 -8.398 -8.410 1.00 27.04 ? 29 ILE A N 1 ATOM 3488 C CA . ILE C 1 29 ? 92.813 -8.185 -8.417 1.00 24.40 ? 29 ILE A CA 1 ATOM 3489 C C . ILE C 1 29 ? 92.286 -8.029 -6.995 1.00 21.08 ? 29 ILE A C 1 ATOM 3490 O O . ILE C 1 29 ? 91.107 -8.275 -6.730 1.00 27.98 ? 29 ILE A O 1 ATOM 3491 C CB . ILE C 1 29 ? 92.067 -9.346 -9.114 1.00 21.79 ? 29 ILE A CB 1 ATOM 3492 C CG1 . ILE C 1 29 ? 92.442 -10.686 -8.470 1.00 23.64 ? 29 ILE A CG1 1 ATOM 3493 C CG2 . ILE C 1 29 ? 92.381 -9.363 -10.601 1.00 23.96 ? 29 ILE A CG2 1 ATOM 3494 C CD1 . ILE C 1 29 ? 91.651 -11.869 -8.992 1.00 14.73 ? 29 ILE A CD1 1 ATOM 3495 N N . SER C 1 30 ? 93.175 -7.618 -6.096 1.00 25.56 ? 30 SER A N 1 ATOM 3496 C CA . SER C 1 30 ? 92.900 -7.505 -4.661 1.00 28.42 ? 30 SER A CA 1 ATOM 3497 C C . SER C 1 30 ? 92.084 -8.684 -4.142 1.00 22.05 ? 30 SER A C 1 ATOM 3498 O O . SER C 1 30 ? 92.550 -9.821 -4.179 1.00 26.97 ? 30 SER A O 1 ATOM 3499 C CB . SER C 1 30 ? 92.205 -6.176 -4.340 1.00 35.03 ? 30 SER A CB 1 ATOM 3500 O OG . SER C 1 30 ? 91.124 -5.921 -5.214 1.00 49.70 ? 30 SER A OG 1 ATOM 3501 N N . SER C 1 31 ? 90.872 -8.433 -3.665 1.00 24.76 ? 31 SER A N 1 ATOM 3502 C CA . SER C 1 31 ? 90.067 -9.522 -3.124 1.00 35.21 ? 31 SER A CA 1 ATOM 3503 C C . SER C 1 31 ? 88.827 -9.819 -3.962 1.00 32.02 ? 31 SER A C 1 ATOM 3504 O O . SER C 1 31 ? 87.885 -10.453 -3.483 1.00 34.79 ? 31 SER A O 1 ATOM 3505 C CB . SER C 1 31 ? 89.661 -9.214 -1.682 1.00 41.84 ? 31 SER A CB 1 ATOM 3506 O OG . SER C 1 31 ? 90.711 -9.539 -0.790 1.00 47.19 ? 31 SER A OG 1 ATOM 3507 N N . TYR C 1 32 ? 88.831 -9.374 -5.215 1.00 21.58 ? 32 TYR A N 1 ATOM 3508 C CA . TYR C 1 32 ? 87.690 -9.604 -6.101 1.00 22.79 ? 32 TYR A CA 1 ATOM 3509 C C . TYR C 1 32 ? 87.748 -10.984 -6.759 1.00 24.28 ? 32 TYR A C 1 ATOM 3510 O O . TYR C 1 32 ? 87.895 -11.115 -7.979 1.00 22.03 ? 32 TYR A O 1 ATOM 3511 C CB . TYR C 1 32 ? 87.617 -8.501 -7.153 1.00 22.76 ? 32 TYR A CB 1 ATOM 3512 C CG . TYR C 1 32 ? 87.215 -7.173 -6.554 1.00 19.48 ? 32 TYR A CG 1 ATOM 3513 C CD1 . TYR C 1 32 ? 85.882 -6.884 -6.310 1.00 23.53 ? 32 TYR A CD1 1 ATOM 3514 C CD2 . TYR C 1 32 ? 88.165 -6.222 -6.210 1.00 29.89 ? 32 TYR A CD2 1 ATOM 3515 C CE1 . TYR C 1 32 ? 85.498 -5.685 -5.755 1.00 27.14 ? 32 TYR A CE1 1 ATOM 3516 C CE2 . TYR C 1 32 ? 87.788 -5.006 -5.652 1.00 36.53 ? 32 TYR A CE2 1 ATOM 3517 C CZ . TYR C 1 32 ? 86.449 -4.748 -5.426 1.00 35.42 ? 32 TYR A CZ 1 ATOM 3518 O OH . TYR C 1 32 ? 86.044 -3.555 -4.872 1.00 33.66 ? 32 TYR A OH 1 ATOM 3519 N N . LEU C 1 33 ? 87.628 -12.018 -5.934 1.00 20.19 ? 33 LEU A N 1 ATOM 3520 C CA . LEU C 1 33 ? 87.733 -13.386 -6.423 1.00 18.31 ? 33 LEU A CA 1 ATOM 3521 C C . LEU C 1 33 ? 86.730 -14.302 -5.742 1.00 20.71 ? 33 LEU A C 1 ATOM 3522 O O . LEU C 1 33 ? 86.513 -14.205 -4.534 1.00 24.35 ? 33 LEU A O 1 ATOM 3523 C CB . LEU C 1 33 ? 89.152 -13.930 -6.215 1.00 22.37 ? 33 LEU A CB 1 ATOM 3524 C CG . LEU C 1 33 ? 89.358 -15.345 -6.768 1.00 24.11 ? 33 LEU A CG 1 ATOM 3525 C CD1 . LEU C 1 33 ? 90.351 -15.357 -7.914 1.00 20.99 ? 33 LEU A CD1 1 ATOM 3526 C CD2 . LEU C 1 33 ? 89.780 -16.303 -5.671 1.00 25.80 ? 33 LEU A CD2 1 ATOM 3527 N N . ALA C 1 34 ? 86.128 -15.196 -6.523 1.00 15.65 ? 34 ALA A N 1 ATOM 3528 C CA . ALA C 1 34 ? 85.207 -16.192 -5.993 1.00 20.04 ? 34 ALA A CA 1 ATOM 3529 C C . ALA C 1 34 ? 85.576 -17.594 -6.475 1.00 26.40 ? 34 ALA A C 1 ATOM 3530 O O . ALA C 1 34 ? 86.273 -17.748 -7.479 1.00 23.93 ? 34 ALA A O 1 ATOM 3531 C CB . ALA C 1 34 ? 83.766 -15.857 -6.394 1.00 22.72 ? 34 ALA A CB 1 ATOM 3532 N N . TRP C 1 35 ? 85.098 -18.606 -5.756 1.00 22.99 ? 35 TRP A N 1 ATOM 3533 C CA . TRP C 1 35 ? 85.268 -20.003 -6.154 1.00 23.73 ? 35 TRP A CA 1 ATOM 3534 C C . TRP C 1 35 ? 83.926 -20.691 -6.379 1.00 27.37 ? 35 TRP A C 1 ATOM 3535 O O . TRP C 1 35 ? 82.983 -20.503 -5.607 1.00 28.70 ? 35 TRP A O 1 ATOM 3536 C CB . TRP C 1 35 ? 86.052 -20.780 -5.097 1.00 14.74 ? 35 TRP A CB 1 ATOM 3537 C CG . TRP C 1 35 ? 87.483 -20.385 -4.992 1.00 16.49 ? 35 TRP A CG 1 ATOM 3538 C CD1 . TRP C 1 35 ? 88.008 -19.405 -4.198 1.00 19.19 ? 35 TRP A CD1 1 ATOM 3539 C CD2 . TRP C 1 35 ? 88.587 -20.972 -5.693 1.00 18.37 ? 35 TRP A CD2 1 ATOM 3540 N NE1 . TRP C 1 35 ? 89.376 -19.346 -4.362 1.00 20.89 ? 35 TRP A NE1 1 ATOM 3541 C CE2 . TRP C 1 35 ? 89.756 -20.293 -5.278 1.00 16.56 ? 35 TRP A CE2 1 ATOM 3542 C CE3 . TRP C 1 35 ? 88.702 -22.004 -6.634 1.00 23.51 ? 35 TRP A CE3 1 ATOM 3543 C CZ2 . TRP C 1 35 ? 91.026 -20.615 -5.771 1.00 19.70 ? 35 TRP A CZ2 1 ATOM 3544 C CZ3 . TRP C 1 35 ? 89.967 -22.323 -7.125 1.00 19.92 ? 35 TRP A CZ3 1 ATOM 3545 C CH2 . TRP C 1 35 ? 91.111 -21.629 -6.691 1.00 22.30 ? 35 TRP A CH2 1 ATOM 3546 N N . TYR C 1 36 ? 83.855 -21.506 -7.426 1.00 21.26 ? 36 TYR A N 1 ATOM 3547 C CA . TYR C 1 36 ? 82.649 -22.261 -7.729 1.00 19.10 ? 36 TYR A CA 1 ATOM 3548 C C . TYR C 1 36 ? 82.941 -23.747 -7.831 1.00 23.82 ? 36 TYR A C 1 ATOM 3549 O O . TYR C 1 36 ? 84.036 -24.161 -8.216 1.00 20.18 ? 36 TYR A O 1 ATOM 3550 C CB . TYR C 1 36 ? 82.018 -21.779 -9.034 1.00 15.03 ? 36 TYR A CB 1 ATOM 3551 C CG . TYR C 1 36 ? 81.627 -20.322 -9.028 1.00 12.68 ? 36 TYR A CG 1 ATOM 3552 C CD1 . TYR C 1 36 ? 80.350 -19.927 -8.644 1.00 18.34 ? 36 TYR A CD1 1 ATOM 3553 C CD2 . TYR C 1 36 ? 82.533 -19.343 -9.405 1.00 18.48 ? 36 TYR A CD2 1 ATOM 3554 C CE1 . TYR C 1 36 ? 79.989 -18.588 -8.641 1.00 17.22 ? 36 TYR A CE1 1 ATOM 3555 C CE2 . TYR C 1 36 ? 82.187 -18.009 -9.405 1.00 22.23 ? 36 TYR A CE2 1 ATOM 3556 C CZ . TYR C 1 36 ? 80.916 -17.635 -9.024 1.00 22.55 ? 36 TYR A CZ 1 ATOM 3557 O OH . TYR C 1 36 ? 80.581 -16.298 -9.030 1.00 22.12 ? 36 TYR A OH 1 ATOM 3558 N N . GLN C 1 37 ? 81.939 -24.543 -7.490 1.00 21.17 ? 37 GLN A N 1 ATOM 3559 C CA . GLN C 1 37 ? 82.009 -25.984 -7.638 1.00 19.80 ? 37 GLN A CA 1 ATOM 3560 C C . GLN C 1 37 ? 81.062 -26.405 -8.754 1.00 21.16 ? 37 GLN A C 1 ATOM 3561 O O . GLN C 1 37 ? 79.901 -26.000 -8.761 1.00 26.67 ? 37 GLN A O 1 ATOM 3562 C CB . GLN C 1 37 ? 81.644 -26.668 -6.324 1.00 15.71 ? 37 GLN A CB 1 ATOM 3563 C CG . GLN C 1 37 ? 81.514 -28.178 -6.408 1.00 12.97 ? 37 GLN A CG 1 ATOM 3564 C CD . GLN C 1 37 ? 80.802 -28.743 -5.198 1.00 20.25 ? 37 GLN A CD 1 ATOM 3565 O OE1 . GLN C 1 37 ? 79.575 -28.746 -5.140 1.00 24.54 ? 37 GLN A OE1 1 ATOM 3566 N NE2 . GLN C 1 37 ? 81.570 -29.200 -4.211 1.00 23.43 ? 37 GLN A NE2 1 ATOM 3567 N N . GLN C 1 38 ? 81.549 -27.195 -9.706 1.00 17.02 ? 38 GLN A N 1 ATOM 3568 C CA . GLN C 1 38 ? 80.685 -27.662 -10.789 1.00 16.49 ? 38 GLN A CA 1 ATOM 3569 C C . GLN C 1 38 ? 80.806 -29.161 -11.027 1.00 22.22 ? 38 GLN A C 1 ATOM 3570 O O . GLN C 1 38 ? 81.904 -29.692 -11.184 1.00 21.02 ? 38 GLN A O 1 ATOM 3571 C CB . GLN C 1 38 ? 80.981 -26.920 -12.097 1.00 13.89 ? 38 GLN A CB 1 ATOM 3572 C CG . GLN C 1 38 ? 79.901 -27.144 -13.159 1.00 26.02 ? 38 GLN A CG 1 ATOM 3573 C CD . GLN C 1 38 ? 80.239 -26.514 -14.502 1.00 30.19 ? 38 GLN A CD 1 ATOM 3574 O OE1 . GLN C 1 38 ? 81.408 -26.412 -14.880 1.00 26.44 ? 38 GLN A OE1 1 ATOM 3575 N NE2 . GLN C 1 38 ? 79.211 -26.090 -15.231 1.00 21.49 ? 38 GLN A NE2 1 ATOM 3576 N N . LYS C 1 39 ? 79.654 -29.826 -11.058 1.00 23.48 ? 39 LYS A N 1 ATOM 3577 C CA . LYS C 1 39 ? 79.561 -31.242 -11.371 1.00 21.59 ? 39 LYS A CA 1 ATOM 3578 C C . LYS C 1 39 ? 79.041 -31.413 -12.801 1.00 26.55 ? 39 LYS A C 1 ATOM 3579 O O . LYS C 1 39 ? 78.382 -30.514 -13.330 1.00 24.05 ? 39 LYS A O 1 ATOM 3580 C CB . LYS C 1 39 ? 78.657 -31.935 -10.349 1.00 22.92 ? 39 LYS A CB 1 ATOM 3581 C CG . LYS C 1 39 ? 79.261 -31.905 -8.954 1.00 23.75 ? 39 LYS A CG 1 ATOM 3582 C CD . LYS C 1 39 ? 78.330 -32.450 -7.899 1.00 26.43 ? 39 LYS A CD 1 ATOM 3583 C CE . LYS C 1 39 ? 79.044 -32.514 -6.560 1.00 26.85 ? 39 LYS A CE 1 ATOM 3584 N NZ . LYS C 1 39 ? 78.102 -32.723 -5.430 1.00 32.16 ? 39 LYS A NZ 1 ATOM 3585 N N . PRO C 1 40 ? 79.355 -32.554 -13.440 1.00 27.35 ? 40 PRO A N 1 ATOM 3586 C CA . PRO C 1 40 ? 78.996 -32.775 -14.847 1.00 26.35 ? 40 PRO A CA 1 ATOM 3587 C C . PRO C 1 40 ? 77.499 -32.616 -15.130 1.00 31.20 ? 40 PRO A C 1 ATOM 3588 O O . PRO C 1 40 ? 76.672 -33.173 -14.408 1.00 34.00 ? 40 PRO A O 1 ATOM 3589 C CB . PRO C 1 40 ? 79.444 -34.218 -15.093 1.00 26.75 ? 40 PRO A CB 1 ATOM 3590 C CG . PRO C 1 40 ? 80.540 -34.436 -14.119 1.00 29.91 ? 40 PRO A CG 1 ATOM 3591 C CD . PRO C 1 40 ? 80.115 -33.693 -12.892 1.00 31.76 ? 40 PRO A CD 1 ATOM 3592 N N . GLY C 1 41 ? 77.168 -31.845 -16.165 1.00 34.00 ? 41 GLY A N 1 ATOM 3593 C CA . GLY C 1 41 ? 75.785 -31.622 -16.557 1.00 27.00 ? 41 GLY A CA 1 ATOM 3594 C C . GLY C 1 41 ? 75.032 -30.625 -15.692 1.00 29.52 ? 41 GLY A C 1 ATOM 3595 O O . GLY C 1 41 ? 73.854 -30.362 -15.921 1.00 32.48 ? 41 GLY A O 1 ATOM 3596 N N . LYS C 1 42 ? 75.710 -30.059 -14.698 1.00 29.06 ? 42 LYS A N 1 ATOM 3597 C CA . LYS C 1 42 ? 75.061 -29.150 -13.759 1.00 23.42 ? 42 LYS A CA 1 ATOM 3598 C C . LYS C 1 42 ? 75.640 -27.744 -13.848 1.00 21.34 ? 42 LYS A C 1 ATOM 3599 O O . LYS C 1 42 ? 76.687 -27.534 -14.458 1.00 23.93 ? 42 LYS A O 1 ATOM 3600 C CB . LYS C 1 42 ? 75.200 -29.677 -12.330 1.00 33.73 ? 42 LYS A CB 1 ATOM 3601 C CG . LYS C 1 42 ? 74.858 -31.154 -12.167 1.00 37.03 ? 42 LYS A CG 1 ATOM 3602 C CD . LYS C 1 42 ? 73.391 -31.365 -11.831 1.00 44.89 ? 42 LYS A CD 1 ATOM 3603 C CE . LYS C 1 42 ? 73.123 -32.822 -11.472 1.00 55.53 ? 42 LYS A CE 1 ATOM 3604 N NZ . LYS C 1 42 ? 71.762 -33.028 -10.904 1.00 63.04 ? 42 LYS A NZ 1 ATOM 3605 N N . ALA C 1 43 ? 74.953 -26.784 -13.236 1.00 17.97 ? 43 ALA A N 1 ATOM 3606 C CA . ALA C 1 43 ? 75.436 -25.410 -13.166 1.00 20.65 ? 43 ALA A CA 1 ATOM 3607 C C . ALA C 1 43 ? 76.443 -25.275 -12.028 1.00 18.34 ? 43 ALA A C 1 ATOM 3608 O O . ALA C 1 43 ? 76.411 -26.059 -11.083 1.00 20.13 ? 43 ALA A O 1 ATOM 3609 C CB . ALA C 1 43 ? 74.270 -24.446 -12.973 1.00 20.03 ? 43 ALA A CB 1 ATOM 3610 N N . PRO C 1 44 ? 77.350 -24.289 -12.116 1.00 17.88 ? 44 PRO A N 1 ATOM 3611 C CA . PRO C 1 44 ? 78.302 -24.097 -11.015 1.00 23.24 ? 44 PRO A CA 1 ATOM 3612 C C . PRO C 1 44 ? 77.594 -23.753 -9.703 1.00 27.08 ? 44 PRO A C 1 ATOM 3613 O O . PRO C 1 44 ? 76.462 -23.274 -9.727 1.00 30.26 ? 44 PRO A O 1 ATOM 3614 C CB . PRO C 1 44 ? 79.168 -22.923 -11.492 1.00 26.56 ? 44 PRO A CB 1 ATOM 3615 C CG . PRO C 1 44 ? 78.975 -22.875 -12.983 1.00 26.00 ? 44 PRO A CG 1 ATOM 3616 C CD . PRO C 1 44 ? 77.571 -23.331 -13.214 1.00 21.57 ? 44 PRO A CD 1 ATOM 3617 N N . LYS C 1 45 ? 78.246 -24.013 -8.575 1.00 22.77 ? 45 LYS A N 1 ATOM 3618 C CA . LYS C 1 45 ? 77.693 -23.646 -7.278 1.00 21.79 ? 45 LYS A CA 1 ATOM 3619 C C . LYS C 1 45 ? 78.696 -22.802 -6.507 1.00 21.06 ? 45 LYS A C 1 ATOM 3620 O O . LYS C 1 45 ? 79.854 -23.189 -6.342 1.00 24.33 ? 45 LYS A O 1 ATOM 3621 C CB . LYS C 1 45 ? 77.311 -24.888 -6.461 1.00 24.64 ? 45 LYS A CB 1 ATOM 3622 C CG . LYS C 1 45 ? 76.044 -25.588 -6.924 1.00 42.51 ? 45 LYS A CG 1 ATOM 3623 C CD . LYS C 1 45 ? 75.696 -26.757 -6.009 1.00 59.45 ? 45 LYS A CD 1 ATOM 3624 C CE . LYS C 1 45 ? 74.457 -27.508 -6.490 1.00 71.59 ? 45 LYS A CE 1 ATOM 3625 N NZ . LYS C 1 45 ? 74.169 -28.713 -5.650 1.00 76.37 ? 45 LYS A NZ 1 ATOM 3626 N N . LEU C 1 46 ? 78.244 -21.645 -6.038 1.00 18.29 ? 46 LEU A N 1 ATOM 3627 C CA . LEU C 1 46 ? 79.108 -20.730 -5.310 1.00 18.93 ? 46 LEU A CA 1 ATOM 3628 C C . LEU C 1 46 ? 79.633 -21.370 -4.035 1.00 18.61 ? 46 LEU A C 1 ATOM 3629 O O . LEU C 1 46 ? 78.858 -21.888 -3.231 1.00 16.19 ? 46 LEU A O 1 ATOM 3630 C CB . LEU C 1 46 ? 78.355 -19.444 -4.976 1.00 17.32 ? 46 LEU A CB 1 ATOM 3631 C CG . LEU C 1 46 ? 79.134 -18.467 -4.102 1.00 22.94 ? 46 LEU A CG 1 ATOM 3632 C CD1 . LEU C 1 46 ? 80.428 -18.048 -4.788 1.00 19.91 ? 46 LEU A CD1 1 ATOM 3633 C CD2 . LEU C 1 46 ? 78.274 -17.264 -3.779 1.00 20.98 ? 46 LEU A CD2 1 ATOM 3634 N N . VAL C 1 47 ? 80.948 -21.341 -3.856 1.00 17.89 ? 47 VAL A N 1 ATOM 3635 C CA . VAL C 1 47 ? 81.549 -21.867 -2.637 1.00 21.38 ? 47 VAL A CA 1 ATOM 3636 C C . VAL C 1 47 ? 82.060 -20.738 -1.748 1.00 20.81 ? 47 VAL A C 1 ATOM 3637 O O . VAL C 1 47 ? 81.717 -20.657 -0.572 1.00 24.50 ? 47 VAL A O 1 ATOM 3638 C CB . VAL C 1 47 ? 82.707 -22.831 -2.947 1.00 27.78 ? 47 VAL A CB 1 ATOM 3639 C CG1 . VAL C 1 47 ? 83.414 -23.232 -1.665 1.00 27.33 ? 47 VAL A CG1 1 ATOM 3640 C CG2 . VAL C 1 47 ? 82.189 -24.056 -3.687 1.00 23.70 ? 47 VAL A CG2 1 ATOM 3641 N N . ILE C 1 48 ? 82.866 -19.858 -2.327 1.00 17.87 ? 48 ILE A N 1 ATOM 3642 C CA . ILE C 1 48 ? 83.530 -18.798 -1.578 1.00 15.96 ? 48 ILE A CA 1 ATOM 3643 C C . ILE C 1 48 ? 83.507 -17.490 -2.367 1.00 18.51 ? 48 ILE A C 1 ATOM 3644 O O . ILE C 1 48 ? 83.584 -17.507 -3.593 1.00 18.73 ? 48 ILE A O 1 ATOM 3645 C CB . ILE C 1 48 ? 84.987 -19.213 -1.244 1.00 29.63 ? 48 ILE A CB 1 ATOM 3646 C CG1 . ILE C 1 48 ? 84.983 -20.212 -0.089 1.00 30.39 ? 48 ILE A CG1 1 ATOM 3647 C CG2 . ILE C 1 48 ? 85.867 -18.017 -0.921 1.00 20.08 ? 48 ILE A CG2 1 ATOM 3648 C CD1 . ILE C 1 48 ? 86.340 -20.647 0.349 1.00 29.96 ? 48 ILE A CD1 1 ATOM 3649 N N . TYR C 1 49 ? 83.376 -16.360 -1.676 1.00 23.55 ? 49 TYR A N 1 ATOM 3650 C CA . TYR C 1 49 ? 83.453 -15.066 -2.347 1.00 19.74 ? 49 TYR A CA 1 ATOM 3651 C C . TYR C 1 49 ? 84.336 -14.094 -1.572 1.00 19.56 ? 49 TYR A C 1 ATOM 3652 O O . TYR C 1 49 ? 84.655 -14.330 -0.406 1.00 24.79 ? 49 TYR A O 1 ATOM 3653 C CB . TYR C 1 49 ? 82.055 -14.478 -2.555 1.00 22.03 ? 49 TYR A CB 1 ATOM 3654 C CG . TYR C 1 49 ? 81.298 -14.165 -1.287 1.00 30.13 ? 49 TYR A CG 1 ATOM 3655 C CD1 . TYR C 1 49 ? 80.588 -15.154 -0.618 1.00 33.55 ? 49 TYR A CD1 1 ATOM 3656 C CD2 . TYR C 1 49 ? 81.272 -12.872 -0.770 1.00 32.23 ? 49 TYR A CD2 1 ATOM 3657 C CE1 . TYR C 1 49 ? 79.883 -14.870 0.539 1.00 36.53 ? 49 TYR A CE1 1 ATOM 3658 C CE2 . TYR C 1 49 ? 80.570 -12.576 0.386 1.00 34.84 ? 49 TYR A CE2 1 ATOM 3659 C CZ . TYR C 1 49 ? 79.875 -13.580 1.035 1.00 41.13 ? 49 TYR A CZ 1 ATOM 3660 O OH . TYR C 1 49 ? 79.174 -13.296 2.186 1.00 44.84 ? 49 TYR A OH 1 ATOM 3661 N N . ALA C 1 50 ? 84.741 -13.017 -2.239 1.00 18.45 ? 50 ALA A N 1 ATOM 3662 C CA . ALA C 1 50 ? 85.669 -12.040 -1.670 1.00 27.00 ? 50 ALA A CA 1 ATOM 3663 C C . ALA C 1 50 ? 86.882 -12.743 -1.075 1.00 30.12 ? 50 ALA A C 1 ATOM 3664 O O . ALA C 1 50 ? 87.358 -12.372 -0.001 1.00 32.29 ? 50 ALA A O 1 ATOM 3665 C CB . ALA C 1 50 ? 84.975 -11.182 -0.618 1.00 23.21 ? 50 ALA A CB 1 ATOM 3666 N N . ALA C 1 51 ? 87.326 -13.787 -1.774 1.00 31.32 ? 51 ALA A N 1 ATOM 3667 C CA . ALA C 1 51 ? 88.559 -14.529 -1.498 1.00 32.09 ? 51 ALA A CA 1 ATOM 3668 C C . ALA C 1 51 ? 88.485 -15.469 -0.296 1.00 29.82 ? 51 ALA A C 1 ATOM 3669 O O . ALA C 1 51 ? 89.056 -16.555 -0.340 1.00 29.20 ? 51 ALA A O 1 ATOM 3670 C CB . ALA C 1 51 ? 89.744 -13.561 -1.326 1.00 30.81 ? 51 ALA A CB 1 ATOM 3671 N N . SER C 1 52 ? 87.802 -15.073 0.773 1.00 29.45 ? 52 SER A N 1 ATOM 3672 C CA . SER C 1 52 ? 87.894 -15.840 2.015 1.00 30.50 ? 52 SER A CA 1 ATOM 3673 C C . SER C 1 52 ? 86.560 -16.087 2.717 1.00 31.35 ? 52 SER A C 1 ATOM 3674 O O . SER C 1 52 ? 86.504 -16.827 3.700 1.00 40.42 ? 52 SER A O 1 ATOM 3675 C CB . SER C 1 52 ? 88.846 -15.134 2.985 1.00 34.26 ? 52 SER A CB 1 ATOM 3676 O OG . SER C 1 52 ? 88.314 -13.890 3.400 1.00 39.24 ? 52 SER A OG 1 ATOM 3677 N N . THR C 1 53 ? 85.493 -15.476 2.216 1.00 26.60 ? 53 THR A N 1 ATOM 3678 C CA . THR C 1 53 ? 84.183 -15.589 2.849 1.00 28.77 ? 53 THR A CA 1 ATOM 3679 C C . THR C 1 53 ? 83.357 -16.748 2.282 1.00 31.74 ? 53 THR A C 1 ATOM 3680 O O . THR C 1 53 ? 83.094 -16.801 1.078 1.00 31.97 ? 53 THR A O 1 ATOM 3681 C CB . THR C 1 53 ? 83.378 -14.283 2.685 1.00 35.86 ? 53 THR A CB 1 ATOM 3682 O OG1 . THR C 1 53 ? 84.161 -13.171 3.130 1.00 44.16 ? 53 THR A OG1 1 ATOM 3683 C CG2 . THR C 1 53 ? 82.090 -14.342 3.482 1.00 41.07 ? 53 THR A CG2 1 ATOM 3684 N N . LEU C 1 54 ? 82.937 -17.664 3.151 1.00 30.38 ? 54 LEU A N 1 ATOM 3685 C CA . LEU C 1 54 ? 82.086 -18.775 2.734 1.00 32.09 ? 54 LEU A CA 1 ATOM 3686 C C . LEU C 1 54 ? 80.667 -18.313 2.432 1.00 33.40 ? 54 LEU A C 1 ATOM 3687 O O . LEU C 1 54 ? 80.080 -17.543 3.190 1.00 32.58 ? 54 LEU A O 1 ATOM 3688 C CB . LEU C 1 54 ? 82.023 -19.864 3.809 1.00 33.74 ? 54 LEU A CB 1 ATOM 3689 C CG . LEU C 1 54 ? 83.286 -20.556 4.315 1.00 39.99 ? 54 LEU A CG 1 ATOM 3690 C CD1 . LEU C 1 54 ? 82.898 -21.680 5.259 1.00 44.79 ? 54 LEU A CD1 1 ATOM 3691 C CD2 . LEU C 1 54 ? 84.105 -21.086 3.169 1.00 42.09 ? 54 LEU A CD2 1 ATOM 3692 N N . GLN C 1 55 ? 80.113 -18.797 1.328 1.00 29.13 ? 55 GLN A N 1 ATOM 3693 C CA . GLN C 1 55 ? 78.688 -18.650 1.082 1.00 27.42 ? 55 GLN A CA 1 ATOM 3694 C C . GLN C 1 55 ? 77.937 -19.402 2.181 1.00 34.67 ? 55 GLN A C 1 ATOM 3695 O O . GLN C 1 55 ? 78.398 -20.442 2.645 1.00 35.56 ? 55 GLN A O 1 ATOM 3696 C CB . GLN C 1 55 ? 78.319 -19.182 -0.305 1.00 19.61 ? 55 GLN A CB 1 ATOM 3697 C CG . GLN C 1 55 ? 76.826 -19.287 -0.581 1.00 23.56 ? 55 GLN A CG 1 ATOM 3698 C CD . GLN C 1 55 ? 76.174 -17.938 -0.814 1.00 34.78 ? 55 GLN A CD 1 ATOM 3699 O OE1 . GLN C 1 55 ? 76.830 -16.895 -0.766 1.00 35.61 ? 55 GLN A OE1 1 ATOM 3700 N NE2 . GLN C 1 55 ? 74.873 -17.953 -1.073 1.00 39.19 ? 55 GLN A NE2 1 ATOM 3701 N N . SER C 1 56 ? 76.803 -18.866 2.617 1.00 34.17 ? 56 SER A N 1 ATOM 3702 C CA . SER C 1 56 ? 76.006 -19.531 3.642 1.00 36.65 ? 56 SER A CA 1 ATOM 3703 C C . SER C 1 56 ? 75.546 -20.899 3.152 1.00 36.86 ? 56 SER A C 1 ATOM 3704 O O . SER C 1 56 ? 75.130 -21.051 2.001 1.00 34.37 ? 56 SER A O 1 ATOM 3705 C CB . SER C 1 56 ? 74.807 -18.669 4.037 1.00 44.16 ? 56 SER A CB 1 ATOM 3706 O OG . SER C 1 56 ? 74.164 -18.143 2.891 1.00 50.72 ? 56 SER A OG 1 ATOM 3707 N N . GLY C 1 57 ? 75.639 -21.898 4.024 1.00 39.76 ? 57 GLY A N 1 ATOM 3708 C CA . GLY C 1 57 ? 75.283 -23.257 3.659 1.00 38.75 ? 57 GLY A CA 1 ATOM 3709 C C . GLY C 1 57 ? 76.496 -24.125 3.375 1.00 37.80 ? 57 GLY A C 1 ATOM 3710 O O . GLY C 1 57 ? 76.453 -25.343 3.543 1.00 46.65 ? 57 GLY A O 1 ATOM 3711 N N . VAL C 1 58 ? 77.581 -23.495 2.938 1.00 27.37 ? 58 VAL A N 1 ATOM 3712 C CA . VAL C 1 58 ? 78.824 -24.208 2.661 1.00 26.45 ? 58 VAL A CA 1 ATOM 3713 C C . VAL C 1 58 ? 79.451 -24.701 3.969 1.00 26.05 ? 58 VAL A C 1 ATOM 3714 O O . VAL C 1 58 ? 79.564 -23.938 4.927 1.00 31.57 ? 58 VAL A O 1 ATOM 3715 C CB . VAL C 1 58 ? 79.817 -23.304 1.893 1.00 30.93 ? 58 VAL A CB 1 ATOM 3716 C CG1 . VAL C 1 58 ? 81.182 -23.964 1.767 1.00 33.55 ? 58 VAL A CG1 1 ATOM 3717 C CG2 . VAL C 1 58 ? 79.256 -22.955 0.521 1.00 27.83 ? 58 VAL A CG2 1 ATOM 3718 N N . PRO C 1 59 ? 79.845 -25.985 4.017 1.00 32.08 ? 59 PRO A N 1 ATOM 3719 C CA . PRO C 1 59 ? 80.413 -26.602 5.224 1.00 31.67 ? 59 PRO A CA 1 ATOM 3720 C C . PRO C 1 59 ? 81.780 -26.029 5.588 1.00 29.67 ? 59 PRO A C 1 ATOM 3721 O O . PRO C 1 59 ? 82.503 -25.567 4.707 1.00 25.48 ? 59 PRO A O 1 ATOM 3722 C CB . PRO C 1 59 ? 80.540 -28.084 4.846 1.00 34.22 ? 59 PRO A CB 1 ATOM 3723 C CG . PRO C 1 59 ? 79.721 -28.260 3.610 1.00 35.15 ? 59 PRO A CG 1 ATOM 3724 C CD . PRO C 1 59 ? 79.732 -26.947 2.908 1.00 31.49 ? 59 PRO A CD 1 ATOM 3725 N N . SER C 1 60 ? 82.135 -26.097 6.869 1.00 33.05 ? 60 SER A N 1 ATOM 3726 C CA . SER C 1 60 ? 83.355 -25.475 7.382 1.00 31.65 ? 60 SER A CA 1 ATOM 3727 C C . SER C 1 60 ? 84.662 -26.098 6.873 1.00 33.38 ? 60 SER A C 1 ATOM 3728 O O . SER C 1 60 ? 85.734 -25.516 7.051 1.00 28.13 ? 60 SER A O 1 ATOM 3729 C CB . SER C 1 60 ? 83.342 -25.507 8.913 1.00 32.75 ? 60 SER A CB 1 ATOM 3730 O OG . SER C 1 60 ? 83.085 -26.814 9.390 1.00 38.78 ? 60 SER A OG 1 ATOM 3731 N N . ARG C 1 61 ? 84.584 -27.268 6.243 1.00 33.07 ? 61 ARG A N 1 ATOM 3732 C CA . ARG C 1 61 ? 85.786 -27.907 5.709 1.00 24.80 ? 61 ARG A CA 1 ATOM 3733 C C . ARG C 1 61 ? 86.348 -27.129 4.518 1.00 25.68 ? 61 ARG A C 1 ATOM 3734 O O . ARG C 1 61 ? 87.502 -27.316 4.130 1.00 28.86 ? 61 ARG A O 1 ATOM 3735 C CB . ARG C 1 61 ? 85.505 -29.359 5.311 1.00 25.29 ? 61 ARG A CB 1 ATOM 3736 C CG . ARG C 1 61 ? 84.474 -29.557 4.208 1.00 19.25 ? 61 ARG A CG 1 ATOM 3737 C CD . ARG C 1 61 ? 84.233 -31.050 3.989 1.00 25.94 ? 61 ARG A CD 1 ATOM 3738 N NE . ARG C 1 61 ? 83.312 -31.321 2.889 1.00 28.33 ? 61 ARG A NE 1 ATOM 3739 C CZ . ARG C 1 61 ? 81.994 -31.422 3.028 1.00 29.57 ? 61 ARG A CZ 1 ATOM 3740 N NH1 . ARG C 1 61 ? 81.433 -31.267 4.224 1.00 26.80 ? 61 ARG A NH1 1 ATOM 3741 N NH2 . ARG C 1 61 ? 81.236 -31.670 1.969 1.00 27.41 ? 61 ARG A NH2 1 ATOM 3742 N N . PHE C 1 62 ? 85.523 -26.258 3.944 1.00 23.42 ? 62 PHE A N 1 ATOM 3743 C CA . PHE C 1 62 ? 85.968 -25.345 2.895 1.00 20.78 ? 62 PHE A CA 1 ATOM 3744 C C . PHE C 1 62 ? 86.515 -24.056 3.486 1.00 21.23 ? 62 PHE A C 1 ATOM 3745 O O . PHE C 1 62 ? 85.887 -23.449 4.349 1.00 26.18 ? 62 PHE A O 1 ATOM 3746 C CB . PHE C 1 62 ? 84.818 -25.003 1.946 1.00 16.43 ? 62 PHE A CB 1 ATOM 3747 C CG . PHE C 1 62 ? 84.387 -26.141 1.071 1.00 23.47 ? 62 PHE A CG 1 ATOM 3748 C CD1 . PHE C 1 62 ? 83.437 -27.052 1.510 1.00 23.28 ? 62 PHE A CD1 1 ATOM 3749 C CD2 . PHE C 1 62 ? 84.918 -26.288 -0.205 1.00 23.76 ? 62 PHE A CD2 1 ATOM 3750 C CE1 . PHE C 1 62 ? 83.032 -28.100 0.696 1.00 27.56 ? 62 PHE A CE1 1 ATOM 3751 C CE2 . PHE C 1 62 ? 84.516 -27.330 -1.024 1.00 25.49 ? 62 PHE A CE2 1 ATOM 3752 C CZ . PHE C 1 62 ? 83.574 -28.237 -0.574 1.00 26.82 ? 62 PHE A CZ 1 ATOM 3753 N N . SER C 1 63 ? 87.679 -23.629 3.011 1.00 23.30 ? 63 SER A N 1 ATOM 3754 C CA . SER C 1 63 ? 88.200 -22.316 3.358 1.00 22.52 ? 63 SER A CA 1 ATOM 3755 C C . SER C 1 63 ? 88.942 -21.718 2.173 1.00 25.35 ? 63 SER A C 1 ATOM 3756 O O . SER C 1 63 ? 89.371 -22.431 1.271 1.00 27.56 ? 63 SER A O 1 ATOM 3757 C CB . SER C 1 63 ? 89.119 -22.396 4.575 1.00 25.59 ? 63 SER A CB 1 ATOM 3758 O OG . SER C 1 63 ? 90.268 -23.174 4.298 1.00 31.05 ? 63 SER A OG 1 ATOM 3759 N N . GLY C 1 64 ? 89.082 -20.401 2.173 1.00 28.58 ? 64 GLY A N 1 ATOM 3760 C CA . GLY C 1 64 ? 89.784 -19.724 1.105 1.00 28.24 ? 64 GLY A CA 1 ATOM 3761 C C . GLY C 1 64 ? 90.604 -18.572 1.635 1.00 32.73 ? 64 GLY A C 1 ATOM 3762 O O . GLY C 1 64 ? 90.297 -18.007 2.686 1.00 34.74 ? 64 GLY A O 1 ATOM 3763 N N . SER C 1 65 ? 91.656 -18.223 0.908 1.00 27.88 ? 65 SER A N 1 ATOM 3764 C CA . SER C 1 65 ? 92.456 -17.068 1.274 1.00 34.34 ? 65 SER A CA 1 ATOM 3765 C C . SER C 1 65 ? 93.248 -16.557 0.086 1.00 30.10 ? 65 SER A C 1 ATOM 3766 O O . SER C 1 65 ? 93.287 -17.186 -0.973 1.00 30.88 ? 65 SER A O 1 ATOM 3767 C CB . SER C 1 65 ? 93.405 -17.408 2.424 1.00 43.92 ? 65 SER A CB 1 ATOM 3768 O OG . SER C 1 65 ? 94.349 -18.386 2.025 1.00 55.12 ? 65 SER A OG 1 ATOM 3769 N N . GLY C 1 66 ? 93.884 -15.410 0.276 1.00 28.14 ? 66 GLY A N 1 ATOM 3770 C CA . GLY C 1 66 ? 94.719 -14.835 -0.753 1.00 31.73 ? 66 GLY A CA 1 ATOM 3771 C C . GLY C 1 66 ? 94.267 -13.442 -1.115 1.00 37.42 ? 66 GLY A C 1 ATOM 3772 O O . GLY C 1 66 ? 93.101 -13.084 -0.945 1.00 42.44 ? 66 GLY A O 1 ATOM 3773 N N . SER C 1 67 ? 95.205 -12.645 -1.605 1.00 37.11 ? 67 SER A N 1 ATOM 3774 C CA . SER C 1 67 ? 94.879 -11.327 -2.124 1.00 44.14 ? 67 SER A CA 1 ATOM 3775 C C . SER C 1 67 ? 95.865 -10.961 -3.217 1.00 39.76 ? 67 SER A C 1 ATOM 3776 O O . SER C 1 67 ? 97.017 -11.399 -3.205 1.00 47.20 ? 67 SER A O 1 ATOM 3777 C CB . SER C 1 67 ? 94.892 -10.276 -1.011 1.00 43.98 ? 67 SER A CB 1 ATOM 3778 O OG . SER C 1 67 ? 96.143 -10.251 -0.344 1.00 51.84 ? 67 SER A OG 1 ATOM 3779 N N . GLY C 1 68 ? 95.400 -10.170 -4.173 1.00 29.75 ? 68 GLY A N 1 ATOM 3780 C CA . GLY C 1 68 ? 96.266 -9.685 -5.226 1.00 30.94 ? 68 GLY A CA 1 ATOM 3781 C C . GLY C 1 68 ? 96.340 -10.629 -6.401 1.00 28.34 ? 68 GLY A C 1 ATOM 3782 O O . GLY C 1 68 ? 95.466 -10.614 -7.266 1.00 31.95 ? 68 GLY A O 1 ATOM 3783 N N . THR C 1 69 ? 97.380 -11.456 -6.429 1.00 27.78 ? 69 THR A N 1 ATOM 3784 C CA . THR C 1 69 ? 97.626 -12.324 -7.577 1.00 32.48 ? 69 THR A CA 1 ATOM 3785 C C . THR C 1 69 ? 97.564 -13.816 -7.273 1.00 27.95 ? 69 THR A C 1 ATOM 3786 O O . THR C 1 69 ? 97.505 -14.624 -8.193 1.00 35.44 ? 69 THR A O 1 ATOM 3787 C CB . THR C 1 69 ? 99.006 -12.044 -8.204 1.00 34.78 ? 69 THR A CB 1 ATOM 3788 O OG1 . THR C 1 69 ? 100.017 -12.153 -7.195 1.00 39.66 ? 69 THR A OG1 1 ATOM 3789 C CG2 . THR C 1 69 ? 99.046 -10.653 -8.818 1.00 29.83 ? 69 THR A CG2 1 ATOM 3790 N N . GLU C 1 70 ? 97.599 -14.194 -5.999 1.00 25.24 ? 70 GLU A N 1 ATOM 3791 C CA . GLU C 1 70 ? 97.622 -15.616 -5.662 1.00 29.89 ? 70 GLU A CA 1 ATOM 3792 C C . GLU C 1 70 ? 96.551 -15.961 -4.636 1.00 26.49 ? 70 GLU A C 1 ATOM 3793 O O . GLU C 1 70 ? 96.494 -15.369 -3.560 1.00 29.63 ? 70 GLU A O 1 ATOM 3794 C CB . GLU C 1 70 ? 99.004 -16.028 -5.144 1.00 32.96 ? 70 GLU A CB 1 ATOM 3795 C CG . GLU C 1 70 ? 99.242 -17.533 -5.150 1.00 47.34 ? 70 GLU A CG 1 ATOM 3796 C CD . GLU C 1 70 ? 99.728 -18.052 -6.492 1.00 64.58 ? 70 GLU A CD 1 ATOM 3797 O OE1 . GLU C 1 70 ? 99.364 -19.194 -6.853 1.00 69.16 ? 70 GLU A OE1 1 ATOM 3798 O OE2 . GLU C 1 70 ? 100.483 -17.324 -7.178 1.00 69.17 ? 70 GLU A OE2 1 ATOM 3799 N N . PHE C 1 71 ? 95.703 -16.924 -4.983 1.00 24.95 ? 71 PHE A N 1 ATOM 3800 C CA . PHE C 1 71 ? 94.579 -17.313 -4.136 1.00 25.28 ? 71 PHE A CA 1 ATOM 3801 C C . PHE C 1 71 ? 94.548 -18.818 -3.948 1.00 27.92 ? 71 PHE A C 1 ATOM 3802 O O . PHE C 1 71 ? 94.911 -19.566 -4.852 1.00 31.16 ? 71 PHE A O 1 ATOM 3803 C CB . PHE C 1 71 ? 93.252 -16.849 -4.741 1.00 21.45 ? 71 PHE A CB 1 ATOM 3804 C CG . PHE C 1 71 ? 93.169 -15.368 -4.959 1.00 20.79 ? 71 PHE A CG 1 ATOM 3805 C CD1 . PHE C 1 71 ? 93.720 -14.785 -6.096 1.00 24.44 ? 71 PHE A CD1 1 ATOM 3806 C CD2 . PHE C 1 71 ? 92.535 -14.555 -4.028 1.00 16.95 ? 71 PHE A CD2 1 ATOM 3807 C CE1 . PHE C 1 71 ? 93.646 -13.414 -6.299 1.00 19.28 ? 71 PHE A CE1 1 ATOM 3808 C CE2 . PHE C 1 71 ? 92.456 -13.181 -4.222 1.00 22.69 ? 71 PHE A CE2 1 ATOM 3809 C CZ . PHE C 1 71 ? 93.012 -12.612 -5.361 1.00 22.69 ? 71 PHE A CZ 1 ATOM 3810 N N . THR C 1 72 ? 94.102 -19.262 -2.779 1.00 23.65 ? 72 THR A N 1 ATOM 3811 C CA . THR C 1 72 ? 93.992 -20.690 -2.518 1.00 27.11 ? 72 THR A CA 1 ATOM 3812 C C . THR C 1 72 ? 92.603 -21.085 -2.045 1.00 28.11 ? 72 THR A C 1 ATOM 3813 O O . THR C 1 72 ? 91.887 -20.304 -1.416 1.00 35.68 ? 72 THR A O 1 ATOM 3814 C CB . THR C 1 72 ? 95.004 -21.158 -1.461 1.00 23.41 ? 72 THR A CB 1 ATOM 3815 O OG1 . THR C 1 72 ? 94.696 -20.546 -0.205 1.00 29.16 ? 72 THR A OG1 1 ATOM 3816 C CG2 . THR C 1 72 ? 96.417 -20.793 -1.871 1.00 26.36 ? 72 THR A CG2 1 ATOM 3817 N N . LEU C 1 73 ? 92.234 -22.315 -2.366 1.00 28.14 ? 73 LEU A N 1 ATOM 3818 C CA . LEU C 1 73 ? 91.029 -22.926 -1.844 1.00 26.98 ? 73 LEU A CA 1 ATOM 3819 C C . LEU C 1 73 ? 91.423 -24.256 -1.218 1.00 25.73 ? 73 LEU A C 1 ATOM 3820 O O . LEU C 1 73 ? 92.105 -25.067 -1.846 1.00 22.81 ? 73 LEU A O 1 ATOM 3821 C CB . LEU C 1 73 ? 89.990 -23.124 -2.945 1.00 25.77 ? 73 LEU A CB 1 ATOM 3822 C CG . LEU C 1 73 ? 88.785 -23.986 -2.566 1.00 28.76 ? 73 LEU A CG 1 ATOM 3823 C CD1 . LEU C 1 73 ? 87.944 -23.296 -1.513 1.00 29.55 ? 73 LEU A CD1 1 ATOM 3824 C CD2 . LEU C 1 73 ? 87.949 -24.314 -3.792 1.00 28.62 ? 73 LEU A CD2 1 ATOM 3825 N N . THR C 1 74 ? 91.006 -24.472 0.023 1.00 16.28 ? 74 THR A N 1 ATOM 3826 C CA . THR C 1 74 ? 91.397 -25.667 0.746 1.00 19.00 ? 74 THR A CA 1 ATOM 3827 C C . THR C 1 74 ? 90.190 -26.436 1.263 1.00 27.34 ? 74 THR A C 1 ATOM 3828 O O . THR C 1 74 ? 89.266 -25.861 1.838 1.00 28.87 ? 74 THR A O 1 ATOM 3829 C CB . THR C 1 74 ? 92.322 -25.325 1.928 1.00 23.97 ? 74 THR A CB 1 ATOM 3830 O OG1 . THR C 1 74 ? 93.507 -24.687 1.434 1.00 31.17 ? 74 THR A OG1 1 ATOM 3831 C CG2 . THR C 1 74 ? 92.714 -26.585 2.689 1.00 22.43 ? 74 THR A CG2 1 ATOM 3832 N N . ILE C 1 75 ? 90.198 -27.742 1.021 1.00 27.86 ? 75 ILE A N 1 ATOM 3833 C CA . ILE C 1 75 ? 89.248 -28.646 1.642 1.00 25.92 ? 75 ILE A CA 1 ATOM 3834 C C . ILE C 1 75 ? 90.012 -29.443 2.691 1.00 21.25 ? 75 ILE A C 1 ATOM 3835 O O . ILE C 1 75 ? 90.946 -30.173 2.359 1.00 24.64 ? 75 ILE A O 1 ATOM 3836 C CB . ILE C 1 75 ? 88.592 -29.582 0.614 1.00 25.07 ? 75 ILE A CB 1 ATOM 3837 C CG1 . ILE C 1 75 ? 88.020 -28.763 -0.545 1.00 22.82 ? 75 ILE A CG1 1 ATOM 3838 C CG2 . ILE C 1 75 ? 87.508 -30.429 1.273 1.00 21.31 ? 75 ILE A CG2 1 ATOM 3839 C CD1 . ILE C 1 75 ? 87.313 -29.590 -1.586 1.00 23.20 ? 75 ILE A CD1 1 ATOM 3840 N N . SER C 1 76 ? 89.633 -29.290 3.956 1.00 20.89 ? 76 SER A N 1 ATOM 3841 C CA . SER C 1 76 ? 90.429 -29.850 5.047 1.00 26.31 ? 76 SER A CA 1 ATOM 3842 C C . SER C 1 76 ? 90.378 -31.375 5.062 1.00 30.57 ? 76 SER A C 1 ATOM 3843 O O . SER C 1 76 ? 91.317 -32.028 5.517 1.00 31.88 ? 76 SER A O 1 ATOM 3844 C CB . SER C 1 76 ? 89.962 -29.295 6.395 1.00 25.71 ? 76 SER A CB 1 ATOM 3845 O OG . SER C 1 76 ? 88.612 -29.643 6.654 1.00 30.23 ? 76 SER A OG 1 ATOM 3846 N N . SER C 1 77 ? 89.283 -31.935 4.557 1.00 30.28 ? 77 SER A N 1 ATOM 3847 C CA . SER C 1 77 ? 89.109 -33.383 4.499 1.00 23.06 ? 77 SER A CA 1 ATOM 3848 C C . SER C 1 77 ? 87.985 -33.710 3.525 1.00 22.14 ? 77 SER A C 1 ATOM 3849 O O . SER C 1 77 ? 86.814 -33.483 3.823 1.00 21.67 ? 77 SER A O 1 ATOM 3850 C CB . SER C 1 77 ? 88.808 -33.952 5.889 1.00 25.24 ? 77 SER A CB 1 ATOM 3851 O OG . SER C 1 77 ? 88.841 -35.370 5.883 1.00 28.85 ? 77 SER A OG 1 ATOM 3852 N N . LEU C 1 78 ? 88.349 -34.231 2.356 1.00 23.26 ? 78 LEU A N 1 ATOM 3853 C CA . LEU C 1 78 ? 87.390 -34.469 1.277 1.00 22.59 ? 78 LEU A CA 1 ATOM 3854 C C . LEU C 1 78 ? 86.305 -35.466 1.641 1.00 25.72 ? 78 LEU A C 1 ATOM 3855 O O . LEU C 1 78 ? 86.587 -36.544 2.166 1.00 27.07 ? 78 LEU A O 1 ATOM 3856 C CB . LEU C 1 78 ? 88.115 -34.962 0.022 1.00 19.61 ? 78 LEU A CB 1 ATOM 3857 C CG . LEU C 1 78 ? 88.901 -33.934 -0.788 1.00 24.75 ? 78 LEU A CG 1 ATOM 3858 C CD1 . LEU C 1 78 ? 89.958 -34.632 -1.613 1.00 25.63 ? 78 LEU A CD1 1 ATOM 3859 C CD2 . LEU C 1 78 ? 87.964 -33.150 -1.684 1.00 23.25 ? 78 LEU A CD2 1 ATOM 3860 N N . GLN C 1 79 ? 85.061 -35.096 1.356 1.00 22.94 ? 79 GLN A N 1 ATOM 3861 C CA . GLN C 1 79 ? 83.950 -36.035 1.422 1.00 26.35 ? 79 GLN A CA 1 ATOM 3862 C C . GLN C 1 79 ? 83.562 -36.378 -0.020 1.00 23.98 ? 79 GLN A C 1 ATOM 3863 O O . GLN C 1 79 ? 83.917 -35.640 -0.934 1.00 29.09 ? 79 GLN A O 1 ATOM 3864 C CB . GLN C 1 79 ? 82.787 -35.439 2.222 1.00 25.41 ? 79 GLN A CB 1 ATOM 3865 C CG . GLN C 1 79 ? 83.146 -35.199 3.677 1.00 29.66 ? 79 GLN A CG 1 ATOM 3866 C CD . GLN C 1 79 ? 81.986 -34.674 4.502 1.00 35.28 ? 79 GLN A CD 1 ATOM 3867 O OE1 . GLN C 1 79 ? 80.819 -34.872 4.162 1.00 40.31 ? 79 GLN A OE1 1 ATOM 3868 N NE2 . GLN C 1 79 ? 82.306 -33.999 5.600 1.00 27.14 ? 79 GLN A NE2 1 ATOM 3869 N N . PRO C 1 80 ? 82.879 -37.516 -0.235 1.00 31.11 ? 80 PRO A N 1 ATOM 3870 C CA . PRO C 1 80 ? 82.602 -37.965 -1.608 1.00 29.19 ? 80 PRO A CA 1 ATOM 3871 C C . PRO C 1 80 ? 81.903 -36.927 -2.489 1.00 28.37 ? 80 PRO A C 1 ATOM 3872 O O . PRO C 1 80 ? 82.203 -36.843 -3.677 1.00 25.22 ? 80 PRO A O 1 ATOM 3873 C CB . PRO C 1 80 ? 81.703 -39.186 -1.391 1.00 29.38 ? 80 PRO A CB 1 ATOM 3874 C CG . PRO C 1 80 ? 82.168 -39.736 -0.085 1.00 30.68 ? 80 PRO A CG 1 ATOM 3875 C CD . PRO C 1 80 ? 82.467 -38.524 0.760 1.00 26.77 ? 80 PRO A CD 1 ATOM 3876 N N . GLU C 1 81 ? 81.007 -36.133 -1.916 1.00 29.97 ? 81 GLU A N 1 ATOM 3877 C CA . GLU C 1 81 ? 80.288 -35.130 -2.695 1.00 31.83 ? 81 GLU A CA 1 ATOM 3878 C C . GLU C 1 81 ? 81.160 -33.924 -3.070 1.00 36.03 ? 81 GLU A C 1 ATOM 3879 O O . GLU C 1 81 ? 80.715 -33.043 -3.805 1.00 36.38 ? 81 GLU A O 1 ATOM 3880 C CB . GLU C 1 81 ? 79.053 -34.652 -1.928 1.00 30.57 ? 81 GLU A CB 1 ATOM 3881 C CG . GLU C 1 81 ? 79.368 -33.978 -0.600 1.00 42.49 ? 81 GLU A CG 1 ATOM 3882 C CD . GLU C 1 81 ? 78.118 -33.525 0.135 1.00 62.35 ? 81 GLU A CD 1 ATOM 3883 O OE1 . GLU C 1 81 ? 77.019 -34.016 -0.203 1.00 73.00 ? 81 GLU A OE1 1 ATOM 3884 O OE2 . GLU C 1 81 ? 78.231 -32.676 1.047 1.00 65.50 ? 81 GLU A OE2 1 ATOM 3885 N N . ASP C 1 82 ? 82.392 -33.875 -2.569 1.00 27.25 ? 82 ASP A N 1 ATOM 3886 C CA . ASP C 1 82 ? 83.263 -32.731 -2.837 1.00 22.16 ? 82 ASP A CA 1 ATOM 3887 C C . ASP C 1 82 ? 84.016 -32.875 -4.154 1.00 24.66 ? 82 ASP A C 1 ATOM 3888 O O . ASP C 1 82 ? 84.572 -31.905 -4.668 1.00 23.33 ? 82 ASP A O 1 ATOM 3889 C CB . ASP C 1 82 ? 84.260 -32.531 -1.695 1.00 22.20 ? 82 ASP A CB 1 ATOM 3890 C CG . ASP C 1 82 ? 83.580 -32.227 -0.381 1.00 30.27 ? 82 ASP A CG 1 ATOM 3891 O OD1 . ASP C 1 82 ? 82.462 -31.666 -0.408 1.00 32.22 ? 82 ASP A OD1 1 ATOM 3892 O OD2 . ASP C 1 82 ? 84.164 -32.552 0.677 1.00 26.23 ? 82 ASP A OD2 1 ATOM 3893 N N . PHE C 1 83 ? 84.034 -34.083 -4.703 1.00 22.86 ? 83 PHE A N 1 ATOM 3894 C CA . PHE C 1 83 ? 84.762 -34.320 -5.939 1.00 23.96 ? 83 PHE A CA 1 ATOM 3895 C C . PHE C 1 83 ? 84.001 -33.731 -7.121 1.00 28.82 ? 83 PHE A C 1 ATOM 3896 O O . PHE C 1 83 ? 82.882 -34.144 -7.433 1.00 33.74 ? 83 PHE A O 1 ATOM 3897 C CB . PHE C 1 83 ? 85.030 -35.816 -6.126 1.00 25.18 ? 83 PHE A CB 1 ATOM 3898 C CG . PHE C 1 83 ? 86.036 -36.366 -5.148 1.00 25.00 ? 83 PHE A CG 1 ATOM 3899 C CD1 . PHE C 1 83 ? 85.642 -36.777 -3.885 1.00 21.60 ? 83 PHE A CD1 1 ATOM 3900 C CD2 . PHE C 1 83 ? 87.377 -36.448 -5.486 1.00 17.58 ? 83 PHE A CD2 1 ATOM 3901 C CE1 . PHE C 1 83 ? 86.567 -37.269 -2.979 1.00 27.43 ? 83 PHE A CE1 1 ATOM 3902 C CE2 . PHE C 1 83 ? 88.310 -36.936 -4.586 1.00 23.29 ? 83 PHE A CE2 1 ATOM 3903 C CZ . PHE C 1 83 ? 87.907 -37.349 -3.330 1.00 23.79 ? 83 PHE A CZ 1 ATOM 3904 N N . ALA C 1 84 ? 84.623 -32.741 -7.753 1.00 26.22 ? 84 ALA A N 1 ATOM 3905 C CA . ALA C 1 84 ? 84.023 -32.009 -8.858 1.00 21.54 ? 84 ALA A CA 1 ATOM 3906 C C . ALA C 1 84 ? 85.097 -31.199 -9.559 1.00 21.71 ? 84 ALA A C 1 ATOM 3907 O O . ALA C 1 84 ? 86.283 -31.378 -9.301 1.00 20.33 ? 84 ALA A O 1 ATOM 3908 C CB . ALA C 1 84 ? 82.912 -31.097 -8.361 1.00 22.91 ? 84 ALA A CB 1 ATOM 3909 N N . THR C 1 85 ? 84.677 -30.312 -10.454 1.00 16.49 ? 85 THR A N 1 ATOM 3910 C CA . THR C 1 85 ? 85.586 -29.330 -11.018 1.00 21.21 ? 85 THR A CA 1 ATOM 3911 C C . THR C 1 85 ? 85.374 -28.000 -10.302 1.00 22.76 ? 85 THR A C 1 ATOM 3912 O O . THR C 1 85 ? 84.237 -27.575 -10.091 1.00 24.03 ? 85 THR A O 1 ATOM 3913 C CB . THR C 1 85 ? 85.379 -29.159 -12.526 1.00 24.95 ? 85 THR A CB 1 ATOM 3914 O OG1 . THR C 1 85 ? 85.681 -30.395 -13.183 1.00 27.61 ? 85 THR A OG1 1 ATOM 3915 C CG2 . THR C 1 85 ? 86.299 -28.070 -13.072 1.00 16.91 ? 85 THR A CG2 1 ATOM 3916 N N . TYR C 1 86 ? 86.470 -27.361 -9.913 1.00 23.66 ? 86 TYR A N 1 ATOM 3917 C CA . TYR C 1 86 ? 86.411 -26.080 -9.221 1.00 18.19 ? 86 TYR A CA 1 ATOM 3918 C C . TYR C 1 86 ? 86.957 -24.961 -10.103 1.00 22.82 ? 86 TYR A C 1 ATOM 3919 O O . TYR C 1 86 ? 88.005 -25.113 -10.730 1.00 19.98 ? 86 TYR A O 1 ATOM 3920 C CB . TYR C 1 86 ? 87.183 -26.158 -7.899 1.00 20.96 ? 86 TYR A CB 1 ATOM 3921 C CG . TYR C 1 86 ? 86.495 -27.039 -6.887 1.00 23.39 ? 86 TYR A CG 1 ATOM 3922 C CD1 . TYR C 1 86 ? 86.720 -28.416 -6.858 1.00 17.94 ? 86 TYR A CD1 1 ATOM 3923 C CD2 . TYR C 1 86 ? 85.591 -26.502 -5.982 1.00 19.11 ? 86 TYR A CD2 1 ATOM 3924 C CE1 . TYR C 1 86 ? 86.076 -29.225 -5.938 1.00 15.06 ? 86 TYR A CE1 1 ATOM 3925 C CE2 . TYR C 1 86 ? 84.940 -27.299 -5.065 1.00 21.77 ? 86 TYR A CE2 1 ATOM 3926 C CZ . TYR C 1 86 ? 85.182 -28.659 -5.046 1.00 22.14 ? 86 TYR A CZ 1 ATOM 3927 O OH . TYR C 1 86 ? 84.526 -29.445 -4.125 1.00 20.82 ? 86 TYR A OH 1 ATOM 3928 N N . TYR C 1 87 ? 86.222 -23.852 -10.157 1.00 21.23 ? 87 TYR A N 1 ATOM 3929 C CA . TYR C 1 87 ? 86.602 -22.677 -10.941 1.00 18.07 ? 87 TYR A CA 1 ATOM 3930 C C . TYR C 1 87 ? 86.809 -21.460 -10.050 1.00 24.33 ? 87 TYR A C 1 ATOM 3931 O O . TYR C 1 87 ? 86.023 -21.215 -9.133 1.00 23.14 ? 87 TYR A O 1 ATOM 3932 C CB . TYR C 1 87 ? 85.529 -22.336 -11.981 1.00 16.42 ? 87 TYR A CB 1 ATOM 3933 C CG . TYR C 1 87 ? 85.386 -23.329 -13.106 1.00 20.60 ? 87 TYR A CG 1 ATOM 3934 C CD1 . TYR C 1 87 ? 86.203 -23.256 -14.224 1.00 16.71 ? 87 TYR A CD1 1 ATOM 3935 C CD2 . TYR C 1 87 ? 84.424 -24.329 -13.059 1.00 19.79 ? 87 TYR A CD2 1 ATOM 3936 C CE1 . TYR C 1 87 ? 86.077 -24.159 -15.260 1.00 20.60 ? 87 TYR A CE1 1 ATOM 3937 C CE2 . TYR C 1 87 ? 84.290 -25.238 -14.093 1.00 27.48 ? 87 TYR A CE2 1 ATOM 3938 C CZ . TYR C 1 87 ? 85.119 -25.146 -15.192 1.00 27.96 ? 87 TYR A CZ 1 ATOM 3939 O OH . TYR C 1 87 ? 84.994 -26.044 -16.227 1.00 35.26 ? 87 TYR A OH 1 ATOM 3940 N N . CYS C 1 88 ? 87.853 -20.688 -10.324 1.00 20.48 ? 88 CYS A N 1 ATOM 3941 C CA . CYS C 1 88 ? 87.994 -19.375 -9.706 1.00 17.58 ? 88 CYS A CA 1 ATOM 3942 C C . CYS C 1 88 ? 87.493 -18.322 -10.686 1.00 18.02 ? 88 CYS A C 1 ATOM 3943 O O . CYS C 1 88 ? 87.506 -18.550 -11.895 1.00 20.32 ? 88 CYS A O 1 ATOM 3944 C CB . CYS C 1 88 ? 89.447 -19.107 -9.319 1.00 17.16 ? 88 CYS A CB 1 ATOM 3945 S SG . CYS C 1 88 ? 90.588 -19.196 -10.719 1.00 30.91 ? 88 CYS A SG 1 ATOM 3946 N N . GLN C 1 89 ? 87.055 -17.173 -10.176 1.00 20.98 ? 89 GLN A N 1 ATOM 3947 C CA . GLN C 1 89 ? 86.523 -16.120 -11.038 1.00 15.81 ? 89 GLN A CA 1 ATOM 3948 C C . GLN C 1 89 ? 86.852 -14.721 -10.531 1.00 22.07 ? 89 GLN A C 1 ATOM 3949 O O . GLN C 1 89 ? 86.651 -14.413 -9.356 1.00 21.80 ? 89 GLN A O 1 ATOM 3950 C CB . GLN C 1 89 ? 84.999 -16.260 -11.181 1.00 15.59 ? 89 GLN A CB 1 ATOM 3951 C CG . GLN C 1 89 ? 84.370 -15.249 -12.136 1.00 22.57 ? 89 GLN A CG 1 ATOM 3952 C CD . GLN C 1 89 ? 83.050 -14.690 -11.628 1.00 26.98 ? 89 GLN A CD 1 ATOM 3953 O OE1 . GLN C 1 89 ? 82.311 -15.361 -10.912 1.00 28.89 ? 89 GLN A OE1 1 ATOM 3954 N NE2 . GLN C 1 89 ? 82.757 -13.445 -11.987 1.00 32.06 ? 89 GLN A NE2 1 ATOM 3955 N N . HIS C 1 90 ? 87.356 -13.884 -11.437 1.00 20.11 ? 90 HIS A N 1 ATOM 3956 C CA . HIS C 1 90 ? 87.524 -12.458 -11.191 1.00 21.25 ? 90 HIS A CA 1 ATOM 3957 C C . HIS C 1 90 ? 86.144 -11.816 -11.107 1.00 20.12 ? 90 HIS A C 1 ATOM 3958 O O . HIS C 1 90 ? 85.348 -11.933 -12.030 1.00 21.89 ? 90 HIS A O 1 ATOM 3959 C CB . HIS C 1 90 ? 88.358 -11.819 -12.304 1.00 18.52 ? 90 HIS A CB 1 ATOM 3960 C CG . HIS C 1 90 ? 88.729 -10.391 -12.046 1.00 24.58 ? 90 HIS A CG 1 ATOM 3961 N ND1 . HIS C 1 90 ? 89.053 -9.512 -13.062 1.00 22.51 ? 90 HIS A ND1 1 ATOM 3962 C CD2 . HIS C 1 90 ? 88.841 -9.688 -10.894 1.00 22.89 ? 90 HIS A CD2 1 ATOM 3963 C CE1 . HIS C 1 90 ? 89.336 -8.331 -12.546 1.00 21.17 ? 90 HIS A CE1 1 ATOM 3964 N NE2 . HIS C 1 90 ? 89.217 -8.410 -11.231 1.00 27.25 ? 90 HIS A NE2 1 ATOM 3965 N N . LEU C 1 91 ? 85.852 -11.150 -9.998 1.00 20.46 ? 91 LEU A N 1 ATOM 3966 C CA . LEU C 1 91 ? 84.490 -10.687 -9.751 1.00 21.97 ? 91 LEU A CA 1 ATOM 3967 C C . LEU C 1 91 ? 84.134 -9.371 -10.453 1.00 28.13 ? 91 LEU A C 1 ATOM 3968 O O . LEU C 1 91 ? 82.960 -9.006 -10.534 1.00 33.90 ? 91 LEU A O 1 ATOM 3969 C CB . LEU C 1 91 ? 84.261 -10.554 -8.250 1.00 19.28 ? 91 LEU A CB 1 ATOM 3970 C CG . LEU C 1 91 ? 84.186 -11.901 -7.537 1.00 19.98 ? 91 LEU A CG 1 ATOM 3971 C CD1 . LEU C 1 91 ? 84.022 -11.713 -6.044 1.00 17.92 ? 91 LEU A CD1 1 ATOM 3972 C CD2 . LEU C 1 91 ? 83.043 -12.742 -8.113 1.00 16.43 ? 91 LEU A CD2 1 ATOM 3973 N N . ILE C 1 92 ? 85.137 -8.659 -10.956 1.00 23.47 ? 92 ILE A N 1 ATOM 3974 C CA . ILE C 1 92 ? 84.879 -7.453 -11.741 1.00 20.79 ? 92 ILE A CA 1 ATOM 3975 C C . ILE C 1 92 ? 85.653 -7.478 -13.052 1.00 20.04 ? 92 ILE A C 1 ATOM 3976 O O . ILE C 1 92 ? 86.215 -8.507 -13.437 1.00 20.86 ? 92 ILE A O 1 ATOM 3977 C CB . ILE C 1 92 ? 85.250 -6.169 -10.973 1.00 28.06 ? 92 ILE A CB 1 ATOM 3978 C CG1 . ILE C 1 92 ? 86.738 -6.173 -10.604 1.00 26.89 ? 92 ILE A CG1 1 ATOM 3979 C CG2 . ILE C 1 92 ? 84.385 -6.015 -9.734 1.00 24.15 ? 92 ILE A CG2 1 ATOM 3980 C CD1 . ILE C 1 92 ? 87.240 -4.833 -10.079 1.00 24.02 ? 92 ILE A CD1 1 ATOM 3981 N N . GLY C 1 93 ? 85.685 -6.339 -13.736 1.00 25.41 ? 93 GLY A N 1 ATOM 3982 C CA . GLY C 1 93 ? 86.409 -6.238 -14.988 1.00 22.20 ? 93 GLY A CA 1 ATOM 3983 C C . GLY C 1 93 ? 85.738 -7.073 -16.055 1.00 25.82 ? 93 GLY A C 1 ATOM 3984 O O . GLY C 1 93 ? 84.546 -6.916 -16.303 1.00 25.72 ? 93 GLY A O 1 ATOM 3985 N N . LEU C 1 94 ? 86.496 -7.973 -16.674 1.00 26.61 ? 94 LEU A N 1 ATOM 3986 C CA . LEU C 1 94 ? 85.945 -8.863 -17.689 1.00 32.45 ? 94 LEU A CA 1 ATOM 3987 C C . LEU C 1 94 ? 85.371 -10.145 -17.092 1.00 29.58 ? 94 LEU A C 1 ATOM 3988 O O . LEU C 1 94 ? 84.946 -11.034 -17.828 1.00 32.38 ? 94 LEU A O 1 ATOM 3989 C CB . LEU C 1 94 ? 87.009 -9.215 -18.729 1.00 35.30 ? 94 LEU A CB 1 ATOM 3990 C CG . LEU C 1 94 ? 87.435 -8.066 -19.641 1.00 37.99 ? 94 LEU A CG 1 ATOM 3991 C CD1 . LEU C 1 94 ? 88.276 -8.580 -20.798 1.00 39.13 ? 94 LEU A CD1 1 ATOM 3992 C CD2 . LEU C 1 94 ? 86.220 -7.312 -20.142 1.00 39.27 ? 94 LEU A CD2 1 ATOM 3993 N N . ARG C 1 95 ? 85.370 -10.234 -15.765 1.00 27.56 ? 96 ARG A N 1 ATOM 3994 C CA . ARG C 1 95 ? 84.778 -11.371 -15.054 1.00 27.82 ? 96 ARG A CA 1 ATOM 3995 C C . ARG C 1 95 ? 85.287 -12.724 -15.554 1.00 28.12 ? 96 ARG A C 1 ATOM 3996 O O . ARG C 1 95 ? 84.517 -13.678 -15.670 1.00 27.15 ? 96 ARG A O 1 ATOM 3997 C CB . ARG C 1 95 ? 83.247 -11.335 -15.164 1.00 29.43 ? 96 ARG A CB 1 ATOM 3998 C CG . ARG C 1 95 ? 82.532 -10.381 -14.204 1.00 30.11 ? 96 ARG A CG 1 ATOM 3999 C CD . ARG C 1 95 ? 82.564 -8.939 -14.696 1.00 29.43 ? 96 ARG A CD 1 ATOM 4000 N NE . ARG C 1 95 ? 81.474 -8.139 -14.142 1.00 31.23 ? 96 ARG A NE 1 ATOM 4001 C CZ . ARG C 1 95 ? 81.331 -6.832 -14.342 1.00 35.94 ? 96 ARG A CZ 1 ATOM 4002 N NH1 . ARG C 1 95 ? 82.218 -6.167 -15.073 1.00 31.86 ? 96 ARG A NH1 1 ATOM 4003 N NH2 . ARG C 1 95 ? 80.305 -6.185 -13.803 1.00 31.78 ? 96 ARG A NH2 1 ATOM 4004 N N . SER C 1 96 ? 86.579 -12.808 -15.848 1.00 24.74 ? 97 SER A N 1 ATOM 4005 C CA . SER C 1 96 ? 87.142 -14.027 -16.411 1.00 28.02 ? 97 SER A CA 1 ATOM 4006 C C . SER C 1 96 ? 87.251 -15.145 -15.377 1.00 28.09 ? 97 SER A C 1 ATOM 4007 O O . SER C 1 96 ? 87.367 -14.897 -14.173 1.00 26.76 ? 97 SER A O 1 ATOM 4008 C CB . SER C 1 96 ? 88.513 -13.746 -17.032 1.00 28.38 ? 97 SER A CB 1 ATOM 4009 O OG . SER C 1 96 ? 89.353 -13.063 -16.126 1.00 39.12 ? 97 SER A OG 1 ATOM 4010 N N . PHE C 1 97 ? 87.195 -16.378 -15.869 1.00 22.45 ? 98 PHE A N 1 ATOM 4011 C CA . PHE C 1 97 ? 87.304 -17.568 -15.038 1.00 21.80 ? 98 PHE A CA 1 ATOM 4012 C C . PHE C 1 97 ? 88.650 -18.251 -15.262 1.00 24.88 ? 98 PHE A C 1 ATOM 4013 O O . PHE C 1 97 ? 89.269 -18.082 -16.315 1.00 20.01 ? 98 PHE A O 1 ATOM 4014 C CB . PHE C 1 97 ? 86.178 -18.561 -15.352 1.00 21.03 ? 98 PHE A CB 1 ATOM 4015 C CG . PHE C 1 97 ? 84.799 -18.103 -14.934 1.00 28.03 ? 98 PHE A CG 1 ATOM 4016 C CD1 . PHE C 1 97 ? 84.093 -17.184 -15.697 1.00 22.38 ? 98 PHE A CD1 1 ATOM 4017 C CD2 . PHE C 1 97 ? 84.193 -18.633 -13.802 1.00 24.88 ? 98 PHE A CD2 1 ATOM 4018 C CE1 . PHE C 1 97 ? 82.817 -16.783 -15.325 1.00 24.55 ? 98 PHE A CE1 1 ATOM 4019 C CE2 . PHE C 1 97 ? 82.917 -18.237 -13.426 1.00 23.99 ? 98 PHE A CE2 1 ATOM 4020 C CZ . PHE C 1 97 ? 82.231 -17.310 -14.187 1.00 18.98 ? 98 PHE A CZ 1 ATOM 4021 N N . GLY C 1 98 ? 89.094 -19.029 -14.277 1.00 17.86 ? 99 GLY A N 1 ATOM 4022 C CA . GLY C 1 98 ? 90.235 -19.907 -14.461 1.00 16.66 ? 99 GLY A CA 1 ATOM 4023 C C . GLY C 1 98 ? 89.828 -21.084 -15.328 1.00 24.17 ? 99 GLY A C 1 ATOM 4024 O O . GLY C 1 98 ? 88.653 -21.216 -15.680 1.00 24.47 ? 99 GLY A O 1 ATOM 4025 N N . GLN C 1 99 ? 90.779 -21.949 -15.669 1.00 24.12 ? 100 GLN A N 1 ATOM 4026 C CA . GLN C 1 99 ? 90.493 -23.054 -16.580 1.00 24.61 ? 100 GLN A CA 1 ATOM 4027 C C . GLN C 1 99 ? 89.834 -24.242 -15.871 1.00 26.86 ? 100 GLN A C 1 ATOM 4028 O O . GLN C 1 99 ? 89.366 -25.178 -16.522 1.00 25.19 ? 100 GLN A O 1 ATOM 4029 C CB . GLN C 1 99 ? 91.776 -23.519 -17.281 1.00 26.00 ? 100 GLN A CB 1 ATOM 4030 C CG . GLN C 1 99 ? 92.632 -24.493 -16.467 1.00 23.03 ? 100 GLN A CG 1 ATOM 4031 C CD . GLN C 1 99 ? 93.526 -23.793 -15.457 1.00 29.46 ? 100 GLN A CD 1 ATOM 4032 O OE1 . GLN C 1 99 ? 93.378 -22.595 -15.200 1.00 23.05 ? 100 GLN A OE1 1 ATOM 4033 N NE2 . GLN C 1 99 ? 94.465 -24.539 -14.883 1.00 21.32 ? 100 GLN A NE2 1 ATOM 4034 N N . GLY C 1 100 ? 89.800 -24.208 -14.543 1.00 19.13 ? 101 GLY A N 1 ATOM 4035 C CA . GLY C 1 100 ? 89.191 -25.287 -13.782 1.00 18.00 ? 101 GLY A CA 1 ATOM 4036 C C . GLY C 1 100 ? 90.194 -26.309 -13.265 1.00 23.69 ? 101 GLY A C 1 ATOM 4037 O O . GLY C 1 100 ? 91.204 -26.588 -13.902 1.00 23.01 ? 101 GLY A O 1 ATOM 4038 N N . THR C 1 101 ? 89.906 -26.857 -12.092 1.00 17.26 ? 102 THR A N 1 ATOM 4039 C CA . THR C 1 101 ? 90.720 -27.896 -11.482 1.00 18.33 ? 102 THR A CA 1 ATOM 4040 C C . THR C 1 101 ? 89.826 -29.071 -11.152 1.00 21.84 ? 102 THR A C 1 ATOM 4041 O O . THR C 1 101 ? 88.861 -28.922 -10.403 1.00 21.99 ? 102 THR A O 1 ATOM 4042 C CB . THR C 1 101 ? 91.411 -27.405 -10.199 1.00 23.69 ? 102 THR A CB 1 ATOM 4043 O OG1 . THR C 1 101 ? 92.324 -26.352 -10.519 1.00 25.92 ? 102 THR A OG1 1 ATOM 4044 C CG2 . THR C 1 101 ? 92.175 -28.540 -9.534 1.00 22.60 ? 102 THR A CG2 1 ATOM 4045 N N . LYS C 1 102 ? 90.132 -30.234 -11.718 1.00 22.85 ? 103 LYS A N 1 ATOM 4046 C CA . LYS C 1 102 ? 89.289 -31.400 -11.515 1.00 24.69 ? 103 LYS A CA 1 ATOM 4047 C C . LYS C 1 102 ? 89.829 -32.290 -10.404 1.00 27.96 ? 103 LYS A C 1 ATOM 4048 O O . LYS C 1 102 ? 91.017 -32.623 -10.389 1.00 24.66 ? 103 LYS A O 1 ATOM 4049 C CB . LYS C 1 102 ? 89.161 -32.204 -12.811 1.00 32.63 ? 103 LYS A CB 1 ATOM 4050 C CG . LYS C 1 102 ? 88.006 -33.193 -12.803 1.00 38.83 ? 103 LYS A CG 1 ATOM 4051 C CD . LYS C 1 102 ? 88.066 -34.126 -14.001 1.00 52.15 ? 103 LYS A CD 1 ATOM 4052 C CE . LYS C 1 102 ? 86.742 -34.843 -14.217 1.00 59.54 ? 103 LYS A CE 1 ATOM 4053 N NZ . LYS C 1 102 ? 86.233 -35.464 -12.964 1.00 64.68 ? 103 LYS A NZ 1 ATOM 4054 N N . LEU C 1 103 ? 88.951 -32.664 -9.474 1.00 27.64 ? 104 LEU A N 1 ATOM 4055 C CA . LEU C 1 103 ? 89.292 -33.619 -8.423 1.00 29.46 ? 104 LEU A CA 1 ATOM 4056 C C . LEU C 1 103 ? 88.713 -34.987 -8.747 1.00 31.39 ? 104 LEU A C 1 ATOM 4057 O O . LEU C 1 103 ? 87.499 -35.140 -8.858 1.00 36.02 ? 104 LEU A O 1 ATOM 4058 C CB . LEU C 1 103 ? 88.774 -33.164 -7.058 1.00 28.56 ? 104 LEU A CB 1 ATOM 4059 C CG . LEU C 1 103 ? 89.143 -31.776 -6.542 1.00 32.95 ? 104 LEU A CG 1 ATOM 4060 C CD1 . LEU C 1 103 ? 88.729 -31.650 -5.085 1.00 26.74 ? 104 LEU A CD1 1 ATOM 4061 C CD2 . LEU C 1 103 ? 90.627 -31.499 -6.711 1.00 34.17 ? 104 LEU A CD2 1 ATOM 4062 N N . GLU C 1 104 ? 89.583 -35.978 -8.895 1.00 28.17 ? 105 GLU A N 1 ATOM 4063 C CA . GLU C 1 104 ? 89.156 -37.350 -9.137 1.00 23.01 ? 105 GLU A CA 1 ATOM 4064 C C . GLU C 1 104 ? 89.216 -38.158 -7.837 1.00 27.98 ? 105 GLU A C 1 ATOM 4065 O O . GLU C 1 104 ? 90.076 -37.909 -6.991 1.00 27.52 ? 105 GLU A O 1 ATOM 4066 C CB . GLU C 1 104 ? 90.037 -37.993 -10.213 1.00 30.94 ? 105 GLU A CB 1 ATOM 4067 C CG . GLU C 1 104 ? 89.788 -39.477 -10.455 1.00 35.79 ? 105 GLU A CG 1 ATOM 4068 C CD . GLU C 1 104 ? 90.996 -40.184 -11.036 1.00 45.07 ? 105 GLU A CD 1 ATOM 4069 O OE1 . GLU C 1 104 ? 92.047 -40.197 -10.359 1.00 45.09 ? 105 GLU A OE1 1 ATOM 4070 O OE2 . GLU C 1 104 ? 90.895 -40.724 -12.163 1.00 41.64 ? 105 GLU A OE2 1 ATOM 4071 N N . ILE C 1 105 ? 88.309 -39.117 -7.670 1.00 27.60 ? 106 ILE A N 1 ATOM 4072 C CA . ILE C 1 105 ? 88.370 -40.012 -6.516 1.00 28.21 ? 106 ILE A CA 1 ATOM 4073 C C . ILE C 1 105 ? 89.410 -41.100 -6.743 1.00 31.15 ? 106 ILE A C 1 ATOM 4074 O O . ILE C 1 105 ? 89.365 -41.806 -7.750 1.00 30.80 ? 106 ILE A O 1 ATOM 4075 C CB . ILE C 1 105 ? 87.017 -40.692 -6.224 1.00 33.83 ? 106 ILE A CB 1 ATOM 4076 C CG1 . ILE C 1 105 ? 85.933 -39.653 -5.949 1.00 45.10 ? 106 ILE A CG1 1 ATOM 4077 C CG2 . ILE C 1 105 ? 87.142 -41.639 -5.040 1.00 22.29 ? 106 ILE A CG2 1 ATOM 4078 C CD1 . ILE C 1 105 ? 84.568 -40.255 -5.684 1.00 50.95 ? 106 ILE A CD1 1 ATOM 4079 N N . LYS C 1 106 ? 90.334 -41.246 -5.801 1.00 24.82 ? 107 LYS A N 1 ATOM 4080 C CA . LYS C 1 106 ? 91.367 -42.258 -5.917 1.00 30.28 ? 107 LYS A CA 1 ATOM 4081 C C . LYS C 1 106 ? 90.865 -43.608 -5.420 1.00 28.22 ? 107 LYS A C 1 ATOM 4082 O O . LYS C 1 106 ? 90.085 -43.682 -4.478 1.00 26.41 ? 107 LYS A O 1 ATOM 4083 C CB . LYS C 1 106 ? 92.617 -41.843 -5.138 1.00 34.79 ? 107 LYS A CB 1 ATOM 4084 C CG . LYS C 1 106 ? 93.825 -42.726 -5.420 1.00 45.75 ? 107 LYS A CG 1 ATOM 4085 C CD . LYS C 1 106 ? 94.935 -42.526 -4.400 1.00 50.74 ? 107 LYS A CD 1 ATOM 4086 C CE . LYS C 1 106 ? 95.564 -41.156 -4.519 1.00 54.37 ? 107 LYS A CE 1 ATOM 4087 N NZ . LYS C 1 106 ? 96.705 -41.013 -3.578 1.00 54.53 ? 107 LYS A NZ 1 ATOM 4088 N N . ARG C 1 107 ? 91.312 -44.672 -6.072 1.00 17.70 ? 108 ARG A N 1 ATOM 4089 C CA . ARG C 1 107 ? 91.030 -46.032 -5.630 1.00 18.92 ? 108 ARG A CA 1 ATOM 4090 C C . ARG C 1 107 ? 92.077 -46.975 -6.202 1.00 21.45 ? 108 ARG A C 1 ATOM 4091 O O . ARG C 1 107 ? 92.977 -46.549 -6.926 1.00 28.63 ? 108 ARG A O 1 ATOM 4092 C CB . ARG C 1 107 ? 89.620 -46.468 -6.040 1.00 20.97 ? 108 ARG A CB 1 ATOM 4093 C CG . ARG C 1 107 ? 89.301 -46.286 -7.511 1.00 23.15 ? 108 ARG A CG 1 ATOM 4094 C CD . ARG C 1 107 ? 89.270 -47.610 -8.232 1.00 35.87 ? 108 ARG A CD 1 ATOM 4095 N NE . ARG C 1 107 ? 88.030 -48.348 -8.038 1.00 41.68 ? 108 ARG A NE 1 ATOM 4096 C CZ . ARG C 1 107 ? 87.952 -49.672 -7.942 1.00 29.30 ? 108 ARG A CZ 1 ATOM 4097 N NH1 . ARG C 1 107 ? 89.047 -50.421 -7.987 1.00 29.69 ? 108 ARG A NH1 1 ATOM 4098 N NH2 . ARG C 1 107 ? 86.771 -50.240 -7.784 1.00 24.15 ? 108 ARG A NH2 1 ATOM 4099 N N . THR C 1 108 ? 91.973 -48.253 -5.860 1.00 21.69 ? 109 THR A N 1 ATOM 4100 C CA . THR C 1 108 ? 92.942 -49.239 -6.313 1.00 24.12 ? 109 THR A CA 1 ATOM 4101 C C . THR C 1 108 ? 92.814 -49.477 -7.807 1.00 29.01 ? 109 THR A C 1 ATOM 4102 O O . THR C 1 108 ? 91.808 -49.131 -8.418 1.00 22.48 ? 109 THR A O 1 ATOM 4103 C CB . THR C 1 108 ? 92.769 -50.575 -5.583 1.00 25.52 ? 109 THR A CB 1 ATOM 4104 O OG1 . THR C 1 108 ? 91.399 -50.988 -5.679 1.00 22.69 ? 109 THR A OG1 1 ATOM 4105 C CG2 . THR C 1 108 ? 93.162 -50.436 -4.116 1.00 23.98 ? 109 THR A CG2 1 ATOM 4106 N N . VAL C 1 109 ? 93.839 -50.075 -8.394 1.00 27.46 ? 110 VAL A N 1 ATOM 4107 C CA . VAL C 1 109 ? 93.803 -50.407 -9.805 1.00 25.32 ? 110 VAL A CA 1 ATOM 4108 C C . VAL C 1 109 ? 92.704 -51.434 -10.070 1.00 27.07 ? 110 VAL A C 1 ATOM 4109 O O . VAL C 1 109 ? 92.488 -52.347 -9.274 1.00 26.75 ? 110 VAL A O 1 ATOM 4110 C CB . VAL C 1 109 ? 95.169 -50.934 -10.276 1.00 26.53 ? 110 VAL A CB 1 ATOM 4111 C CG1 . VAL C 1 109 ? 95.088 -51.462 -11.693 1.00 24.86 ? 110 VAL A CG1 1 ATOM 4112 C CG2 . VAL C 1 109 ? 96.212 -49.827 -10.174 1.00 30.11 ? 110 VAL A CG2 1 ATOM 4113 N N . ALA C 1 110 ? 91.985 -51.246 -11.170 1.00 25.36 ? 111 ALA A N 1 ATOM 4114 C CA . ALA C 1 110 ? 91.002 -52.210 -11.633 1.00 25.48 ? 111 ALA A CA 1 ATOM 4115 C C . ALA C 1 110 ? 91.206 -52.445 -13.124 1.00 25.51 ? 111 ALA A C 1 ATOM 4116 O O . ALA C 1 110 ? 91.163 -51.508 -13.912 1.00 24.83 ? 111 ALA A O 1 ATOM 4117 C CB . ALA C 1 110 ? 89.594 -51.720 -11.353 1.00 20.45 ? 111 ALA A CB 1 ATOM 4118 N N . ALA C 1 111 ? 91.449 -53.693 -13.505 1.00 26.34 ? 112 ALA A N 1 ATOM 4119 C CA . ALA C 1 111 ? 91.662 -54.032 -14.908 1.00 29.92 ? 112 ALA A CA 1 ATOM 4120 C C . ALA C 1 111 ? 90.350 -53.970 -15.683 1.00 27.92 ? 112 ALA A C 1 ATOM 4121 O O . ALA C 1 111 ? 89.298 -54.308 -15.147 1.00 35.09 ? 112 ALA A O 1 ATOM 4122 C CB . ALA C 1 111 ? 92.286 -55.421 -15.032 1.00 27.99 ? 112 ALA A CB 1 ATOM 4123 N N . PRO C 1 112 ? 90.404 -53.537 -16.950 1.00 24.39 ? 113 PRO A N 1 ATOM 4124 C CA . PRO C 1 112 ? 89.179 -53.523 -17.753 1.00 22.12 ? 113 PRO A CA 1 ATOM 4125 C C . PRO C 1 112 ? 88.756 -54.912 -18.211 1.00 29.78 ? 113 PRO A C 1 ATOM 4126 O O . PRO C 1 112 ? 89.599 -55.763 -18.485 1.00 29.80 ? 113 PRO A O 1 ATOM 4127 C CB . PRO C 1 112 ? 89.560 -52.661 -18.957 1.00 19.80 ? 113 PRO A CB 1 ATOM 4128 C CG . PRO C 1 112 ? 91.032 -52.866 -19.099 1.00 16.42 ? 113 PRO A CG 1 ATOM 4129 C CD . PRO C 1 112 ? 91.557 -52.997 -17.691 1.00 20.55 ? 113 PRO A CD 1 ATOM 4130 N N . SER C 1 113 ? 87.450 -55.135 -18.271 1.00 26.62 ? 114 SER A N 1 ATOM 4131 C CA . SER C 1 113 ? 86.906 -56.241 -19.037 1.00 29.36 ? 114 SER A CA 1 ATOM 4132 C C . SER C 1 113 ? 86.724 -55.751 -20.469 1.00 29.23 ? 114 SER A C 1 ATOM 4133 O O . SER C 1 113 ? 86.154 -54.682 -20.692 1.00 28.55 ? 114 SER A O 1 ATOM 4134 C CB . SER C 1 113 ? 85.578 -56.718 -18.454 1.00 33.16 ? 114 SER A CB 1 ATOM 4135 O OG . SER C 1 113 ? 85.725 -57.102 -17.100 1.00 44.78 ? 114 SER A OG 1 ATOM 4136 N N . VAL C 1 114 ? 87.210 -56.520 -21.436 1.00 21.66 ? 115 VAL A N 1 ATOM 4137 C CA . VAL C 1 114 ? 87.183 -56.079 -22.825 1.00 26.27 ? 115 VAL A CA 1 ATOM 4138 C C . VAL C 1 114 ? 86.202 -56.887 -23.664 1.00 31.85 ? 115 VAL A C 1 ATOM 4139 O O . VAL C 1 114 ? 86.147 -58.114 -23.573 1.00 24.57 ? 115 VAL A O 1 ATOM 4140 C CB . VAL C 1 114 ? 88.575 -56.165 -23.469 1.00 28.08 ? 115 VAL A CB 1 ATOM 4141 C CG1 . VAL C 1 114 ? 88.562 -55.501 -24.843 1.00 32.44 ? 115 VAL A CG1 1 ATOM 4142 C CG2 . VAL C 1 114 ? 89.604 -55.504 -22.575 1.00 26.10 ? 115 VAL A CG2 1 ATOM 4143 N N . PHE C 1 115 ? 85.426 -56.180 -24.477 1.00 29.69 ? 116 PHE A N 1 ATOM 4144 C CA . PHE C 1 115 ? 84.459 -56.802 -25.369 1.00 27.73 ? 116 PHE A CA 1 ATOM 4145 C C . PHE C 1 115 ? 84.568 -56.192 -26.757 1.00 32.43 ? 116 PHE A C 1 ATOM 4146 O O . PHE C 1 115 ? 84.852 -54.998 -26.898 1.00 26.20 ? 116 PHE A O 1 ATOM 4147 C CB . PHE C 1 115 ? 83.040 -56.630 -24.830 1.00 24.99 ? 116 PHE A CB 1 ATOM 4148 C CG . PHE C 1 115 ? 82.867 -57.123 -23.424 1.00 32.34 ? 116 PHE A CG 1 ATOM 4149 C CD1 . PHE C 1 115 ? 83.145 -56.299 -22.346 1.00 31.29 ? 116 PHE A CD1 1 ATOM 4150 C CD2 . PHE C 1 115 ? 82.427 -58.415 -23.178 1.00 35.96 ? 116 PHE A CD2 1 ATOM 4151 C CE1 . PHE C 1 115 ? 82.988 -56.754 -21.045 1.00 33.36 ? 116 PHE A CE1 1 ATOM 4152 C CE2 . PHE C 1 115 ? 82.267 -58.875 -21.880 1.00 36.37 ? 116 PHE A CE2 1 ATOM 4153 C CZ . PHE C 1 115 ? 82.546 -58.043 -20.813 1.00 31.10 ? 116 PHE A CZ 1 ATOM 4154 N N . ILE C 1 116 ? 84.348 -57.005 -27.784 1.00 32.10 ? 117 ILE A N 1 ATOM 4155 C CA . ILE C 1 116 ? 84.343 -56.492 -29.144 1.00 28.44 ? 117 ILE A CA 1 ATOM 4156 C C . ILE C 1 116 ? 83.005 -56.817 -29.805 1.00 30.63 ? 117 ILE A C 1 ATOM 4157 O O . ILE C 1 116 ? 82.409 -57.860 -29.538 1.00 34.34 ? 117 ILE A O 1 ATOM 4158 C CB . ILE C 1 116 ? 85.524 -57.058 -29.970 1.00 24.08 ? 117 ILE A CB 1 ATOM 4159 C CG1 . ILE C 1 116 ? 85.686 -56.281 -31.279 1.00 26.93 ? 117 ILE A CG1 1 ATOM 4160 C CG2 . ILE C 1 116 ? 85.365 -58.572 -30.221 1.00 20.40 ? 117 ILE A CG2 1 ATOM 4161 C CD1 . ILE C 1 116 ? 86.930 -56.661 -32.071 1.00 27.45 ? 117 ILE A CD1 1 ATOM 4162 N N . PHE C 1 117 ? 82.523 -55.902 -30.640 1.00 30.36 ? 118 PHE A N 1 ATOM 4163 C CA . PHE C 1 117 ? 81.235 -56.065 -31.313 1.00 30.99 ? 118 PHE A CA 1 ATOM 4164 C C . PHE C 1 117 ? 81.357 -55.869 -32.814 1.00 31.02 ? 118 PHE A C 1 ATOM 4165 O O . PHE C 1 117 ? 81.866 -54.845 -33.270 1.00 33.76 ? 118 PHE A O 1 ATOM 4166 C CB . PHE C 1 117 ? 80.200 -55.076 -30.771 1.00 31.21 ? 118 PHE A CB 1 ATOM 4167 C CG . PHE C 1 117 ? 79.937 -55.213 -29.304 1.00 34.66 ? 118 PHE A CG 1 ATOM 4168 C CD1 . PHE C 1 117 ? 79.031 -56.149 -28.835 1.00 32.88 ? 118 PHE A CD1 1 ATOM 4169 C CD2 . PHE C 1 117 ? 80.587 -54.395 -28.391 1.00 35.40 ? 118 PHE A CD2 1 ATOM 4170 C CE1 . PHE C 1 117 ? 78.785 -56.273 -27.479 1.00 33.76 ? 118 PHE A CE1 1 ATOM 4171 C CE2 . PHE C 1 117 ? 80.344 -54.514 -27.035 1.00 34.22 ? 118 PHE A CE2 1 ATOM 4172 C CZ . PHE C 1 117 ? 79.443 -55.453 -26.579 1.00 33.02 ? 118 PHE A CZ 1 ATOM 4173 N N . PRO C 1 118 ? 80.880 -56.849 -33.591 1.00 28.97 ? 119 PRO A N 1 ATOM 4174 C CA . PRO C 1 118 ? 80.823 -56.700 -35.049 1.00 25.72 ? 119 PRO A CA 1 ATOM 4175 C C . PRO C 1 118 ? 79.814 -55.641 -35.466 1.00 28.35 ? 119 PRO A C 1 ATOM 4176 O O . PRO C 1 118 ? 78.924 -55.306 -34.690 1.00 32.76 ? 119 PRO A O 1 ATOM 4177 C CB . PRO C 1 118 ? 80.375 -58.090 -35.532 1.00 30.90 ? 119 PRO A CB 1 ATOM 4178 C CG . PRO C 1 118 ? 80.670 -59.019 -34.392 1.00 32.44 ? 119 PRO A CG 1 ATOM 4179 C CD . PRO C 1 118 ? 80.482 -58.199 -33.154 1.00 27.44 ? 119 PRO A CD 1 ATOM 4180 N N . PRO C 1 119 ? 79.941 -55.118 -36.690 1.00 29.48 ? 120 PRO A N 1 ATOM 4181 C CA . PRO C 1 119 ? 78.850 -54.285 -37.195 1.00 31.02 ? 120 PRO A CA 1 ATOM 4182 C C . PRO C 1 119 ? 77.633 -55.156 -37.477 1.00 31.54 ? 120 PRO A C 1 ATOM 4183 O O . PRO C 1 119 ? 77.802 -56.321 -37.826 1.00 31.48 ? 120 PRO A O 1 ATOM 4184 C CB . PRO C 1 119 ? 79.424 -53.696 -38.482 1.00 22.87 ? 120 PRO A CB 1 ATOM 4185 C CG . PRO C 1 119 ? 80.410 -54.730 -38.937 1.00 26.28 ? 120 PRO A CG 1 ATOM 4186 C CD . PRO C 1 119 ? 81.015 -55.293 -37.682 1.00 23.29 ? 120 PRO A CD 1 ATOM 4187 N N . SER C 1 120 ? 76.434 -54.609 -37.310 1.00 30.53 ? 121 SER A N 1 ATOM 4188 C CA . SER C 1 120 ? 75.212 -55.352 -37.593 1.00 30.91 ? 121 SER A CA 1 ATOM 4189 C C . SER C 1 120 ? 74.994 -55.495 -39.097 1.00 29.53 ? 121 SER A C 1 ATOM 4190 O O . SER C 1 120 ? 75.465 -54.669 -39.881 1.00 30.81 ? 121 SER A O 1 ATOM 4191 C CB . SER C 1 120 ? 74.005 -54.656 -36.961 1.00 32.26 ? 121 SER A CB 1 ATOM 4192 O OG . SER C 1 120 ? 73.727 -53.431 -37.624 1.00 27.32 ? 121 SER A OG 1 ATOM 4193 N N . ASP C 1 121 ? 74.269 -56.536 -39.496 1.00 30.60 ? 122 ASP A N 1 ATOM 4194 C CA . ASP C 1 121 ? 73.909 -56.713 -40.898 1.00 28.82 ? 122 ASP A CA 1 ATOM 4195 C C . ASP C 1 121 ? 73.065 -55.547 -41.386 1.00 28.15 ? 122 ASP A C 1 ATOM 4196 O O . ASP C 1 121 ? 73.166 -55.140 -42.543 1.00 31.84 ? 122 ASP A O 1 ATOM 4197 C CB . ASP C 1 121 ? 73.154 -58.029 -41.105 1.00 34.94 ? 122 ASP A CB 1 ATOM 4198 C CG . ASP C 1 121 ? 74.057 -59.247 -40.990 1.00 50.73 ? 122 ASP A CG 1 ATOM 4199 O OD1 . ASP C 1 121 ? 75.233 -59.164 -41.408 1.00 52.37 ? 122 ASP A OD1 1 ATOM 4200 O OD2 . ASP C 1 121 ? 73.591 -60.290 -40.482 1.00 58.61 ? 122 ASP A OD2 1 ATOM 4201 N N . GLU C 1 122 ? 72.238 -55.009 -40.494 1.00 26.59 ? 123 GLU A N 1 ATOM 4202 C CA . GLU C 1 122 ? 71.359 -53.900 -40.836 1.00 35.63 ? 123 GLU A CA 1 ATOM 4203 C C . GLU C 1 122 ? 72.137 -52.636 -41.192 1.00 40.10 ? 123 GLU A C 1 ATOM 4204 O O . GLU C 1 122 ? 71.746 -51.906 -42.103 1.00 39.89 ? 123 GLU A O 1 ATOM 4205 C CB . GLU C 1 122 ? 70.397 -53.603 -39.684 1.00 37.23 ? 123 GLU A CB 1 ATOM 4206 C CG . GLU C 1 122 ? 69.391 -52.507 -39.993 1.00 45.98 ? 123 GLU A CG 1 ATOM 4207 C CD . GLU C 1 122 ? 68.645 -52.034 -38.757 1.00 65.92 ? 123 GLU A CD 1 ATOM 4208 O OE1 . GLU C 1 122 ? 68.826 -52.641 -37.678 1.00 68.16 ? 123 GLU A OE1 1 ATOM 4209 O OE2 . GLU C 1 122 ? 67.882 -51.051 -38.866 1.00 74.86 ? 123 GLU A OE2 1 ATOM 4210 N N . GLN C 1 123 ? 73.229 -52.368 -40.478 1.00 34.83 ? 124 GLN A N 1 ATOM 4211 C CA . GLN C 1 123 ? 74.009 -51.161 -40.748 1.00 28.99 ? 124 GLN A CA 1 ATOM 4212 C C . GLN C 1 123 ? 74.721 -51.268 -42.087 1.00 24.59 ? 124 GLN A C 1 ATOM 4213 O O . GLN C 1 123 ? 74.784 -50.297 -42.837 1.00 26.55 ? 124 GLN A O 1 ATOM 4214 C CB . GLN C 1 123 ? 75.034 -50.894 -39.642 1.00 27.40 ? 124 GLN A CB 1 ATOM 4215 C CG . GLN C 1 123 ? 75.756 -49.556 -39.800 1.00 18.53 ? 124 GLN A CG 1 ATOM 4216 C CD . GLN C 1 123 ? 76.926 -49.390 -38.842 1.00 26.39 ? 124 GLN A CD 1 ATOM 4217 O OE1 . GLN C 1 123 ? 77.370 -50.347 -38.203 1.00 30.69 ? 124 GLN A OE1 1 ATOM 4218 N NE2 . GLN C 1 123 ? 77.429 -48.168 -38.739 1.00 21.23 ? 124 GLN A NE2 1 ATOM 4219 N N . LEU C 1 124 ? 75.249 -52.452 -42.383 1.00 24.83 ? 125 LEU A N 1 ATOM 4220 C CA . LEU C 1 124 ? 75.956 -52.692 -43.640 1.00 36.05 ? 125 LEU A CA 1 ATOM 4221 C C . LEU C 1 124 ? 75.099 -52.372 -44.868 1.00 37.88 ? 125 LEU A C 1 ATOM 4222 O O . LEU C 1 124 ? 75.615 -51.998 -45.921 1.00 38.45 ? 125 LEU A O 1 ATOM 4223 C CB . LEU C 1 124 ? 76.436 -54.142 -43.702 1.00 30.37 ? 125 LEU A CB 1 ATOM 4224 C CG . LEU C 1 124 ? 77.524 -54.491 -42.688 1.00 32.29 ? 125 LEU A CG 1 ATOM 4225 C CD1 . LEU C 1 124 ? 77.863 -55.974 -42.737 1.00 33.85 ? 125 LEU A CD1 1 ATOM 4226 C CD2 . LEU C 1 124 ? 78.760 -53.654 -42.946 1.00 29.92 ? 125 LEU A CD2 1 ATOM 4227 N N . LYS C 1 125 ? 73.787 -52.503 -44.719 1.00 32.42 ? 126 LYS A N 1 ATOM 4228 C CA . LYS C 1 125 ? 72.861 -52.229 -45.810 1.00 37.64 ? 126 LYS A CA 1 ATOM 4229 C C . LYS C 1 125 ? 72.853 -50.753 -46.222 1.00 40.81 ? 126 LYS A C 1 ATOM 4230 O O . LYS C 1 125 ? 72.417 -50.420 -47.324 1.00 42.93 ? 126 LYS A O 1 ATOM 4231 C CB . LYS C 1 125 ? 71.450 -52.676 -45.419 1.00 34.56 ? 126 LYS A CB 1 ATOM 4232 C CG . LYS C 1 125 ? 71.306 -54.180 -45.310 1.00 42.41 ? 126 LYS A CG 1 ATOM 4233 C CD . LYS C 1 125 ? 70.130 -54.574 -44.434 1.00 57.07 ? 126 LYS A CD 1 ATOM 4234 C CE . LYS C 1 125 ? 68.821 -54.019 -44.960 1.00 65.81 ? 126 LYS A CE 1 ATOM 4235 N NZ . LYS C 1 125 ? 67.672 -54.518 -44.155 1.00 73.14 ? 126 LYS A NZ 1 ATOM 4236 N N . SER C 1 126 ? 73.327 -49.872 -45.343 1.00 33.49 ? 127 SER A N 1 ATOM 4237 C CA . SER C 1 126 ? 73.382 -48.450 -45.671 1.00 34.14 ? 127 SER A CA 1 ATOM 4238 C C . SER C 1 126 ? 74.809 -47.975 -45.963 1.00 36.14 ? 127 SER A C 1 ATOM 4239 O O . SER C 1 126 ? 75.023 -46.802 -46.260 1.00 42.50 ? 127 SER A O 1 ATOM 4240 C CB . SER C 1 126 ? 72.765 -47.610 -44.548 1.00 34.15 ? 127 SER A CB 1 ATOM 4241 O OG . SER C 1 126 ? 73.322 -47.939 -43.290 1.00 38.81 ? 127 SER A OG 1 ATOM 4242 N N . GLY C 1 127 ? 75.781 -48.878 -45.871 1.00 31.13 ? 128 GLY A N 1 ATOM 4243 C CA . GLY C 1 127 ? 77.100 -48.623 -46.431 1.00 29.08 ? 128 GLY A CA 1 ATOM 4244 C C . GLY C 1 127 ? 78.266 -48.335 -45.498 1.00 33.82 ? 128 GLY A C 1 ATOM 4245 O O . GLY C 1 127 ? 79.383 -48.095 -45.958 1.00 31.18 ? 128 GLY A O 1 ATOM 4246 N N . THR C 1 128 ? 78.026 -48.355 -44.194 1.00 31.31 ? 129 THR A N 1 ATOM 4247 C CA . THR C 1 128 ? 79.091 -48.079 -43.238 1.00 26.81 ? 129 THR A CA 1 ATOM 4248 C C . THR C 1 128 ? 79.169 -49.207 -42.221 1.00 28.55 ? 129 THR A C 1 ATOM 4249 O O . THR C 1 128 ? 78.147 -49.770 -41.840 1.00 28.38 ? 129 THR A O 1 ATOM 4250 C CB . THR C 1 128 ? 78.865 -46.725 -42.530 1.00 35.17 ? 129 THR A CB 1 ATOM 4251 O OG1 . THR C 1 128 ? 78.956 -45.670 -43.492 1.00 47.69 ? 129 THR A OG1 1 ATOM 4252 C CG2 . THR C 1 128 ? 79.903 -46.479 -41.444 1.00 32.60 ? 129 THR A CG2 1 ATOM 4253 N N . ALA C 1 129 ? 80.380 -49.555 -41.798 1.00 24.41 ? 130 ALA A N 1 ATOM 4254 C CA . ALA C 1 129 ? 80.556 -50.594 -40.792 1.00 21.55 ? 130 ALA A CA 1 ATOM 4255 C C . ALA C 1 129 ? 81.182 -50.011 -39.534 1.00 27.55 ? 130 ALA A C 1 ATOM 4256 O O . ALA C 1 129 ? 82.287 -49.469 -39.575 1.00 30.18 ? 130 ALA A O 1 ATOM 4257 C CB . ALA C 1 129 ? 81.411 -51.730 -41.337 1.00 20.90 ? 130 ALA A CB 1 ATOM 4258 N N . SER C 1 130 ? 80.466 -50.107 -38.420 1.00 19.45 ? 131 SER A N 1 ATOM 4259 C CA . SER C 1 130 ? 80.997 -49.657 -37.143 1.00 20.90 ? 131 SER A CA 1 ATOM 4260 C C . SER C 1 130 ? 81.415 -50.849 -36.295 1.00 26.79 ? 131 SER A C 1 ATOM 4261 O O . SER C 1 130 ? 80.602 -51.723 -35.995 1.00 30.46 ? 131 SER A O 1 ATOM 4262 C CB . SER C 1 130 ? 79.972 -48.809 -36.389 1.00 20.56 ? 131 SER A CB 1 ATOM 4263 O OG . SER C 1 130 ? 79.696 -47.601 -37.072 1.00 20.87 ? 131 SER A OG 1 ATOM 4264 N N . VAL C 1 131 ? 82.687 -50.885 -35.918 1.00 15.90 ? 132 VAL A N 1 ATOM 4265 C CA . VAL C 1 131 ? 83.178 -51.924 -35.021 1.00 23.64 ? 132 VAL A CA 1 ATOM 4266 C C . VAL C 1 131 ? 83.451 -51.294 -33.658 1.00 26.67 ? 132 VAL A C 1 ATOM 4267 O O . VAL C 1 131 ? 84.146 -50.287 -33.565 1.00 32.88 ? 132 VAL A O 1 ATOM 4268 C CB . VAL C 1 131 ? 84.455 -52.592 -35.564 1.00 25.01 ? 132 VAL A CB 1 ATOM 4269 C CG1 . VAL C 1 131 ? 84.744 -53.880 -34.809 1.00 22.90 ? 132 VAL A CG1 1 ATOM 4270 C CG2 . VAL C 1 131 ? 84.306 -52.877 -37.051 1.00 26.62 ? 132 VAL A CG2 1 ATOM 4271 N N . VAL C 1 132 ? 82.890 -51.871 -32.604 1.00 24.51 ? 133 VAL A N 1 ATOM 4272 C CA . VAL C 1 132 ? 82.992 -51.260 -31.284 1.00 25.16 ? 133 VAL A CA 1 ATOM 4273 C C . VAL C 1 132 ? 83.786 -52.125 -30.303 1.00 27.75 ? 133 VAL A C 1 ATOM 4274 O O . VAL C 1 132 ? 83.597 -53.341 -30.225 1.00 24.83 ? 133 VAL A O 1 ATOM 4275 C CB . VAL C 1 132 ? 81.593 -50.971 -30.697 1.00 22.41 ? 133 VAL A CB 1 ATOM 4276 C CG1 . VAL C 1 132 ? 81.711 -50.348 -29.312 1.00 27.76 ? 133 VAL A CG1 1 ATOM 4277 C CG2 . VAL C 1 132 ? 80.806 -50.057 -31.627 1.00 18.86 ? 133 VAL A CG2 1 ATOM 4278 N N . CYS C 1 133 ? 84.691 -51.480 -29.576 1.00 27.96 ? 134 CYS A N 1 ATOM 4279 C CA . CYS C 1 133 ? 85.453 -52.119 -28.517 1.00 25.84 ? 134 CYS A CA 1 ATOM 4280 C C . CYS C 1 133 ? 85.048 -51.501 -27.185 1.00 28.01 ? 134 CYS A C 1 ATOM 4281 O O . CYS C 1 133 ? 85.041 -50.279 -27.048 1.00 30.88 ? 134 CYS A O 1 ATOM 4282 C CB . CYS C 1 133 ? 86.954 -51.950 -28.758 1.00 29.25 ? 134 CYS A CB 1 ATOM 4283 S SG . CYS C 1 133 ? 88.038 -52.929 -27.691 1.00 44.34 ? 134 CYS A SG 1 ATOM 4284 N N . LEU C 1 134 ? 84.700 -52.336 -26.211 1.00 26.10 ? 135 LEU A N 1 ATOM 4285 C CA . LEU C 1 134 ? 84.276 -51.840 -24.903 1.00 23.36 ? 135 LEU A CA 1 ATOM 4286 C C . LEU C 1 134 ? 85.254 -52.214 -23.794 1.00 24.62 ? 135 LEU A C 1 ATOM 4287 O O . LEU C 1 134 ? 85.643 -53.377 -23.658 1.00 27.95 ? 135 LEU A O 1 ATOM 4288 C CB . LEU C 1 134 ? 82.885 -52.372 -24.558 1.00 18.26 ? 135 LEU A CB 1 ATOM 4289 C CG . LEU C 1 134 ? 82.452 -52.225 -23.094 1.00 24.47 ? 135 LEU A CG 1 ATOM 4290 C CD1 . LEU C 1 134 ? 82.355 -50.764 -22.674 1.00 20.16 ? 135 LEU A CD1 1 ATOM 4291 C CD2 . LEU C 1 134 ? 81.132 -52.939 -22.846 1.00 19.94 ? 135 LEU A CD2 1 ATOM 4292 N N . LEU C 1 135 ? 85.648 -51.219 -23.008 1.00 21.65 ? 136 LEU A N 1 ATOM 4293 C CA . LEU C 1 135 ? 86.487 -51.438 -21.829 1.00 22.17 ? 136 LEU A CA 1 ATOM 4294 C C . LEU C 1 135 ? 85.672 -51.127 -20.591 1.00 21.32 ? 136 LEU A C 1 ATOM 4295 O O . LEU C 1 135 ? 85.372 -49.963 -20.321 1.00 26.51 ? 136 LEU A O 1 ATOM 4296 C CB . LEU C 1 135 ? 87.737 -50.560 -21.858 1.00 22.66 ? 136 LEU A CB 1 ATOM 4297 C CG . LEU C 1 135 ? 88.901 -50.900 -22.788 1.00 28.85 ? 136 LEU A CG 1 ATOM 4298 C CD1 . LEU C 1 135 ? 88.479 -50.907 -24.250 1.00 25.11 ? 136 LEU A CD1 1 ATOM 4299 C CD2 . LEU C 1 135 ? 90.023 -49.895 -22.561 1.00 26.70 ? 136 LEU A CD2 1 ATOM 4300 N N . ASN C 1 136 ? 85.312 -52.158 -19.836 1.00 26.25 ? 137 ASN A N 1 ATOM 4301 C CA . ASN C 1 136 ? 84.353 -51.979 -18.754 1.00 26.85 ? 137 ASN A CA 1 ATOM 4302 C C . ASN C 1 136 ? 84.974 -51.958 -17.363 1.00 27.11 ? 137 ASN A C 1 ATOM 4303 O O . ASN C 1 136 ? 85.751 -52.843 -17.005 1.00 28.43 ? 137 ASN A O 1 ATOM 4304 C CB . ASN C 1 136 ? 83.289 -53.075 -18.812 1.00 30.88 ? 137 ASN A CB 1 ATOM 4305 C CG . ASN C 1 136 ? 81.928 -52.579 -18.372 1.00 35.74 ? 137 ASN A CG 1 ATOM 4306 O OD1 . ASN C 1 136 ? 81.517 -51.470 -18.714 1.00 38.62 ? 137 ASN A OD1 1 ATOM 4307 N ND2 . ASN C 1 136 ? 81.227 -53.391 -17.597 1.00 37.01 ? 137 ASN A ND2 1 ATOM 4308 N N . ASN C 1 137 ? 84.615 -50.935 -16.592 1.00 25.32 ? 138 ASN A N 1 ATOM 4309 C CA . ASN C 1 137 ? 84.960 -50.831 -15.176 1.00 23.06 ? 138 ASN A CA 1 ATOM 4310 C C . ASN C 1 137 ? 86.451 -50.917 -14.884 1.00 24.39 ? 138 ASN A C 1 ATOM 4311 O O . ASN C 1 137 ? 86.905 -51.858 -14.247 1.00 26.11 ? 138 ASN A O 1 ATOM 4312 C CB . ASN C 1 137 ? 84.232 -51.913 -14.382 1.00 25.21 ? 138 ASN A CB 1 ATOM 4313 C CG . ASN C 1 137 ? 82.737 -51.892 -14.613 1.00 33.19 ? 138 ASN A CG 1 ATOM 4314 O OD1 . ASN C 1 137 ? 82.149 -50.837 -14.847 1.00 23.87 ? 138 ASN A OD1 1 ATOM 4315 N ND2 . ASN C 1 137 ? 82.114 -53.062 -14.561 1.00 41.48 ? 138 ASN A ND2 1 ATOM 4316 N N . PHE C 1 138 ? 87.212 -49.927 -15.330 1.00 22.65 ? 139 PHE A N 1 ATOM 4317 C CA . PHE C 1 138 ? 88.639 -49.936 -15.064 1.00 25.40 ? 139 PHE A CA 1 ATOM 4318 C C . PHE C 1 138 ? 89.085 -48.688 -14.315 1.00 29.37 ? 139 PHE A C 1 ATOM 4319 O O . PHE C 1 138 ? 88.383 -47.680 -14.283 1.00 26.64 ? 139 PHE A O 1 ATOM 4320 C CB . PHE C 1 138 ? 89.429 -50.083 -16.369 1.00 20.81 ? 139 PHE A CB 1 ATOM 4321 C CG . PHE C 1 138 ? 89.207 -48.967 -17.353 1.00 24.27 ? 139 PHE A CG 1 ATOM 4322 C CD1 . PHE C 1 138 ? 88.183 -49.036 -18.285 1.00 24.21 ? 139 PHE A CD1 1 ATOM 4323 C CD2 . PHE C 1 138 ? 90.042 -47.862 -17.364 1.00 28.35 ? 139 PHE A CD2 1 ATOM 4324 C CE1 . PHE C 1 138 ? 87.984 -48.011 -19.195 1.00 25.83 ? 139 PHE A CE1 1 ATOM 4325 C CE2 . PHE C 1 138 ? 89.851 -46.836 -18.269 1.00 31.35 ? 139 PHE A CE2 1 ATOM 4326 C CZ . PHE C 1 138 ? 88.820 -46.911 -19.189 1.00 26.31 ? 139 PHE A CZ 1 ATOM 4327 N N . TYR C 1 139 ? 90.259 -48.780 -13.705 1.00 30.02 ? 140 TYR A N 1 ATOM 4328 C CA . TYR C 1 139 ? 90.905 -47.643 -13.066 1.00 24.81 ? 140 TYR A CA 1 ATOM 4329 C C . TYR C 1 139 ? 92.402 -47.926 -12.999 1.00 22.59 ? 140 TYR A C 1 ATOM 4330 O O . TYR C 1 139 ? 92.800 -49.064 -12.750 1.00 26.32 ? 140 TYR A O 1 ATOM 4331 C CB . TYR C 1 139 ? 90.329 -47.389 -11.666 1.00 18.65 ? 140 TYR A CB 1 ATOM 4332 C CG . TYR C 1 139 ? 90.916 -46.172 -10.991 1.00 21.73 ? 140 TYR A CG 1 ATOM 4333 C CD1 . TYR C 1 139 ? 92.120 -46.249 -10.301 1.00 20.22 ? 140 TYR A CD1 1 ATOM 4334 C CD2 . TYR C 1 139 ? 90.279 -44.940 -11.060 1.00 20.37 ? 140 TYR A CD2 1 ATOM 4335 C CE1 . TYR C 1 139 ? 92.674 -45.141 -9.703 1.00 19.93 ? 140 TYR A CE1 1 ATOM 4336 C CE2 . TYR C 1 139 ? 90.827 -43.819 -10.457 1.00 24.08 ? 140 TYR A CE2 1 ATOM 4337 C CZ . TYR C 1 139 ? 92.024 -43.930 -9.777 1.00 26.61 ? 140 TYR A CZ 1 ATOM 4338 O OH . TYR C 1 139 ? 92.582 -42.829 -9.169 1.00 32.72 ? 140 TYR A OH 1 ATOM 4339 N N . PRO C 1 140 ? 93.243 -46.900 -13.218 1.00 25.35 ? 141 PRO A N 1 ATOM 4340 C CA . PRO C 1 140 ? 92.924 -45.505 -13.560 1.00 25.45 ? 141 PRO A CA 1 ATOM 4341 C C . PRO C 1 140 ? 92.448 -45.313 -14.999 1.00 33.41 ? 141 PRO A C 1 ATOM 4342 O O . PRO C 1 140 ? 92.307 -46.282 -15.751 1.00 34.18 ? 141 PRO A O 1 ATOM 4343 C CB . PRO C 1 140 ? 94.252 -44.781 -13.334 1.00 27.18 ? 141 PRO A CB 1 ATOM 4344 C CG . PRO C 1 140 ? 95.291 -45.829 -13.559 1.00 26.64 ? 141 PRO A CG 1 ATOM 4345 C CD . PRO C 1 140 ? 94.691 -47.096 -13.019 1.00 24.07 ? 141 PRO A CD 1 ATOM 4346 N N . ARG C 1 141 ? 92.212 -44.057 -15.364 1.00 38.08 ? 142 ARG A N 1 ATOM 4347 C CA . ARG C 1 141 ? 91.599 -43.697 -16.640 1.00 36.45 ? 142 ARG A CA 1 ATOM 4348 C C . ARG C 1 141 ? 92.494 -44.021 -17.833 1.00 34.72 ? 142 ARG A C 1 ATOM 4349 O O . ARG C 1 141 ? 91.999 -44.336 -18.918 1.00 39.76 ? 142 ARG A O 1 ATOM 4350 C CB . ARG C 1 141 ? 91.245 -42.207 -16.636 1.00 46.35 ? 142 ARG A CB 1 ATOM 4351 C CG . ARG C 1 141 ? 90.301 -41.742 -17.738 1.00 51.86 ? 142 ARG A CG 1 ATOM 4352 C CD . ARG C 1 141 ? 89.763 -40.356 -17.384 1.00 58.50 ? 142 ARG A CD 1 ATOM 4353 N NE . ARG C 1 141 ? 88.919 -39.760 -18.418 1.00 59.05 ? 142 ARG A NE 1 ATOM 4354 C CZ . ARG C 1 141 ? 89.382 -39.025 -19.425 1.00 63.35 ? 142 ARG A CZ 1 ATOM 4355 N NH1 . ARG C 1 141 ? 90.685 -38.805 -19.544 1.00 67.41 ? 142 ARG A NH1 1 ATOM 4356 N NH2 . ARG C 1 141 ? 88.547 -38.511 -20.317 1.00 62.42 ? 142 ARG A NH2 1 ATOM 4357 N N . GLU C 1 142 ? 93.807 -43.943 -17.624 1.00 30.08 ? 143 GLU A N 1 ATOM 4358 C CA . GLU C 1 142 ? 94.784 -44.204 -18.681 1.00 28.75 ? 143 GLU A CA 1 ATOM 4359 C C . GLU C 1 142 ? 94.649 -45.596 -19.276 1.00 33.52 ? 143 GLU A C 1 ATOM 4360 O O . GLU C 1 142 ? 94.771 -46.600 -18.578 1.00 36.54 ? 143 GLU A O 1 ATOM 4361 C CB . GLU C 1 142 ? 96.213 -44.023 -18.164 1.00 32.06 ? 143 GLU A CB 1 ATOM 4362 C CG . GLU C 1 142 ? 96.658 -42.581 -18.052 1.00 47.73 ? 143 GLU A CG 1 ATOM 4363 C CD . GLU C 1 142 ? 96.385 -41.987 -16.686 1.00 62.29 ? 143 GLU A CD 1 ATOM 4364 O OE1 . GLU C 1 142 ? 96.039 -42.747 -15.753 1.00 60.30 ? 143 GLU A OE1 1 ATOM 4365 O OE2 . GLU C 1 142 ? 96.522 -40.756 -16.547 1.00 70.46 ? 143 GLU A OE2 1 ATOM 4366 N N . ALA C 1 143 ? 94.402 -45.642 -20.577 1.00 27.51 ? 144 ALA A N 1 ATOM 4367 C CA . ALA C 1 143 ? 94.336 -46.894 -21.304 1.00 24.80 ? 144 ALA A CA 1 ATOM 4368 C C . ALA C 1 143 ? 94.656 -46.627 -22.761 1.00 28.76 ? 144 ALA A C 1 ATOM 4369 O O . ALA C 1 143 ? 94.433 -45.526 -23.257 1.00 38.50 ? 144 ALA A O 1 ATOM 4370 C CB . ALA C 1 143 ? 92.971 -47.529 -21.160 1.00 27.02 ? 144 ALA A CB 1 ATOM 4371 N N . LYS C 1 144 ? 95.203 -47.623 -23.443 1.00 28.86 ? 145 LYS A N 1 ATOM 4372 C CA . LYS C 1 144 ? 95.487 -47.483 -24.859 1.00 31.40 ? 145 LYS A CA 1 ATOM 4373 C C . LYS C 1 144 ? 94.738 -48.549 -25.640 1.00 36.08 ? 145 LYS A C 1 ATOM 4374 O O . LYS C 1 144 ? 94.784 -49.731 -25.297 1.00 43.25 ? 145 LYS A O 1 ATOM 4375 C CB . LYS C 1 144 ? 96.991 -47.570 -25.128 1.00 35.66 ? 145 LYS A CB 1 ATOM 4376 C CG . LYS C 1 144 ? 97.360 -47.441 -26.598 1.00 44.92 ? 145 LYS A CG 1 ATOM 4377 C CD . LYS C 1 144 ? 98.823 -47.061 -26.786 1.00 52.82 ? 145 LYS A CD 1 ATOM 4378 C CE . LYS C 1 144 ? 99.758 -48.197 -26.403 1.00 61.88 ? 145 LYS A CE 1 ATOM 4379 N NZ . LYS C 1 144 ? 101.192 -47.803 -26.525 1.00 67.89 ? 145 LYS A NZ 1 ATOM 4380 N N . VAL C 1 145 ? 94.034 -48.120 -26.680 1.00 32.39 ? 146 VAL A N 1 ATOM 4381 C CA . VAL C 1 145 ? 93.310 -49.037 -27.546 1.00 25.54 ? 146 VAL A CA 1 ATOM 4382 C C . VAL C 1 145 ? 93.841 -48.961 -28.973 1.00 32.97 ? 146 VAL A C 1 ATOM 4383 O O . VAL C 1 145 ? 93.907 -47.882 -29.567 1.00 32.67 ? 146 VAL A O 1 ATOM 4384 C CB . VAL C 1 145 ? 91.805 -48.736 -27.551 1.00 31.86 ? 146 VAL A CB 1 ATOM 4385 C CG1 . VAL C 1 145 ? 91.072 -49.723 -28.451 1.00 34.80 ? 146 VAL A CG1 1 ATOM 4386 C CG2 . VAL C 1 145 ? 91.254 -48.781 -26.133 1.00 30.03 ? 146 VAL A CG2 1 ATOM 4387 N N . GLN C 1 146 ? 94.229 -50.110 -29.514 1.00 34.57 ? 147 GLN A N 1 ATOM 4388 C CA . GLN C 1 146 ? 94.700 -50.184 -30.889 1.00 37.10 ? 147 GLN A CA 1 ATOM 4389 C C . GLN C 1 146 ? 93.820 -51.106 -31.719 1.00 32.25 ? 147 GLN A C 1 ATOM 4390 O O . GLN C 1 146 ? 93.480 -52.205 -31.291 1.00 34.04 ? 147 GLN A O 1 ATOM 4391 C CB . GLN C 1 146 ? 96.147 -50.668 -30.938 1.00 40.76 ? 147 GLN A CB 1 ATOM 4392 C CG . GLN C 1 146 ? 97.158 -49.654 -30.448 1.00 49.45 ? 147 GLN A CG 1 ATOM 4393 C CD . GLN C 1 146 ? 98.563 -50.215 -30.425 1.00 60.20 ? 147 GLN A CD 1 ATOM 4394 O OE1 . GLN C 1 146 ? 98.787 -51.334 -29.961 1.00 65.67 ? 147 GLN A OE1 1 ATOM 4395 N NE2 . GLN C 1 146 ? 99.518 -49.446 -30.936 1.00 63.54 ? 147 GLN A NE2 1 ATOM 4396 N N . TRP C 1 147 ? 93.449 -50.653 -32.909 1.00 30.78 ? 148 TRP A N 1 ATOM 4397 C CA . TRP C 1 147 ? 92.668 -51.476 -33.817 1.00 26.31 ? 148 TRP A CA 1 ATOM 4398 C C . TRP C 1 147 ? 93.557 -52.127 -34.859 1.00 30.03 ? 148 TRP A C 1 ATOM 4399 O O . TRP C 1 147 ? 94.502 -51.512 -35.354 1.00 34.80 ? 148 TRP A O 1 ATOM 4400 C CB . TRP C 1 147 ? 91.589 -50.650 -34.507 1.00 24.99 ? 148 TRP A CB 1 ATOM 4401 C CG . TRP C 1 147 ? 90.423 -50.319 -33.635 1.00 25.30 ? 148 TRP A CG 1 ATOM 4402 C CD1 . TRP C 1 147 ? 90.214 -49.158 -32.952 1.00 23.36 ? 148 TRP A CD1 1 ATOM 4403 C CD2 . TRP C 1 147 ? 89.290 -51.154 -33.365 1.00 24.95 ? 148 TRP A CD2 1 ATOM 4404 N NE1 . TRP C 1 147 ? 89.021 -49.217 -32.270 1.00 25.85 ? 148 TRP A NE1 1 ATOM 4405 C CE2 . TRP C 1 147 ? 88.434 -50.432 -32.507 1.00 26.69 ? 148 TRP A CE2 1 ATOM 4406 C CE3 . TRP C 1 147 ? 88.916 -52.442 -33.765 1.00 24.30 ? 148 TRP A CE3 1 ATOM 4407 C CZ2 . TRP C 1 147 ? 87.223 -50.954 -32.041 1.00 26.19 ? 148 TRP A CZ2 1 ATOM 4408 C CZ3 . TRP C 1 147 ? 87.715 -52.961 -33.300 1.00 26.82 ? 148 TRP A CZ3 1 ATOM 4409 C CH2 . TRP C 1 147 ? 86.882 -52.216 -32.448 1.00 26.83 ? 148 TRP A CH2 1 ATOM 4410 N N . LYS C 1 148 ? 93.247 -53.375 -35.191 1.00 28.67 ? 149 LYS A N 1 ATOM 4411 C CA . LYS C 1 148 ? 93.942 -54.074 -36.258 1.00 37.96 ? 149 LYS A CA 1 ATOM 4412 C C . LYS C 1 148 ? 92.949 -54.723 -37.208 1.00 39.76 ? 149 LYS A C 1 ATOM 4413 O O . LYS C 1 148 ? 91.995 -55.376 -36.784 1.00 43.08 ? 149 LYS A O 1 ATOM 4414 C CB . LYS C 1 148 ? 94.892 -55.130 -35.690 1.00 40.30 ? 149 LYS A CB 1 ATOM 4415 C CG . LYS C 1 148 ? 96.108 -54.556 -34.988 1.00 47.89 ? 149 LYS A CG 1 ATOM 4416 C CD . LYS C 1 148 ? 96.895 -55.652 -34.287 1.00 56.33 ? 149 LYS A CD 1 ATOM 4417 C CE . LYS C 1 148 ? 98.154 -55.105 -33.641 1.00 59.58 ? 149 LYS A CE 1 ATOM 4418 N NZ . LYS C 1 148 ? 98.902 -56.177 -32.931 1.00 66.61 ? 149 LYS A NZ 1 ATOM 4419 N N . VAL C 1 149 ? 93.178 -54.534 -38.498 1.00 33.36 ? 150 VAL A N 1 ATOM 4420 C CA . VAL C 1 149 ? 92.369 -55.182 -39.513 1.00 34.02 ? 150 VAL A CA 1 ATOM 4421 C C . VAL C 1 149 ? 93.291 -56.022 -40.385 1.00 42.30 ? 150 VAL A C 1 ATOM 4422 O O . VAL C 1 149 ? 94.144 -55.480 -41.091 1.00 45.63 ? 150 VAL A O 1 ATOM 4423 C CB . VAL C 1 149 ? 91.601 -54.160 -40.361 1.00 31.27 ? 150 VAL A CB 1 ATOM 4424 C CG1 . VAL C 1 149 ? 90.821 -54.862 -41.455 1.00 36.58 ? 150 VAL A CG1 1 ATOM 4425 C CG2 . VAL C 1 149 ? 90.672 -53.341 -39.480 1.00 24.90 ? 150 VAL A CG2 1 ATOM 4426 N N . ASP C 1 150 ? 93.116 -57.340 -40.324 1.00 47.30 ? 151 ASP A N 1 ATOM 4427 C CA . ASP C 1 150 ? 94.070 -58.280 -40.911 1.00 51.38 ? 151 ASP A CA 1 ATOM 4428 C C . ASP C 1 150 ? 95.477 -57.925 -40.451 1.00 53.61 ? 151 ASP A C 1 ATOM 4429 O O . ASP C 1 150 ? 96.403 -57.839 -41.261 1.00 57.87 ? 151 ASP A O 1 ATOM 4430 C CB . ASP C 1 150 ? 93.992 -58.288 -42.440 1.00 51.51 ? 151 ASP A CB 1 ATOM 4431 C CG . ASP C 1 150 ? 92.779 -59.035 -42.960 1.00 49.49 ? 151 ASP A CG 1 ATOM 4432 O OD1 . ASP C 1 150 ? 92.103 -59.713 -42.160 1.00 43.90 ? 151 ASP A OD1 1 ATOM 4433 O OD2 . ASP C 1 150 ? 92.508 -58.953 -44.176 1.00 54.86 ? 151 ASP A OD2 1 ATOM 4434 N N . ASN C 1 151 ? 95.602 -57.681 -39.147 1.00 48.59 ? 152 ASN A N 1 ATOM 4435 C CA . ASN C 1 151 ? 96.881 -57.402 -38.496 1.00 49.49 ? 152 ASN A CA 1 ATOM 4436 C C . ASN C 1 151 ? 97.514 -56.082 -38.945 1.00 49.26 ? 152 ASN A C 1 ATOM 4437 O O . ASN C 1 151 ? 98.686 -55.822 -38.673 1.00 54.59 ? 152 ASN A O 1 ATOM 4438 C CB . ASN C 1 151 ? 97.856 -58.561 -38.731 1.00 53.54 ? 152 ASN A CB 1 ATOM 4439 C CG . ASN C 1 151 ? 98.972 -58.603 -37.709 1.00 65.06 ? 152 ASN A CG 1 ATOM 4440 O OD1 . ASN C 1 151 ? 98.881 -57.986 -36.647 1.00 66.68 ? 152 ASN A OD1 1 ATOM 4441 N ND2 . ASN C 1 151 ? 100.035 -59.338 -38.022 1.00 71.62 ? 152 ASN A ND2 1 ATOM 4442 N N . ALA C 1 152 ? 96.739 -55.246 -39.627 1.00 41.36 ? 153 ALA A N 1 ATOM 4443 C CA . ALA C 1 152 ? 97.216 -53.924 -40.007 1.00 40.72 ? 153 ALA A CA 1 ATOM 4444 C C . ALA C 1 152 ? 96.728 -52.877 -39.006 1.00 44.19 ? 153 ALA A C 1 ATOM 4445 O O . ALA C 1 152 ? 95.527 -52.737 -38.772 1.00 47.62 ? 153 ALA A O 1 ATOM 4446 C CB . ALA C 1 152 ? 96.759 -53.574 -41.414 1.00 39.29 ? 153 ALA A CB 1 ATOM 4447 N N . LEU C 1 153 ? 97.668 -52.150 -38.412 1.00 39.19 ? 154 LEU A N 1 ATOM 4448 C CA . LEU C 1 153 ? 97.334 -51.112 -37.448 1.00 39.35 ? 154 LEU A CA 1 ATOM 4449 C C . LEU C 1 153 ? 96.563 -49.975 -38.113 1.00 41.44 ? 154 LEU A C 1 ATOM 4450 O O . LEU C 1 153 ? 96.997 -49.433 -39.131 1.00 38.09 ? 154 LEU A O 1 ATOM 4451 C CB . LEU C 1 153 ? 98.601 -50.571 -36.784 1.00 42.30 ? 154 LEU A CB 1 ATOM 4452 C CG . LEU C 1 153 ? 98.406 -49.492 -35.716 1.00 45.00 ? 154 LEU A CG 1 ATOM 4453 C CD1 . LEU C 1 153 ? 97.684 -50.059 -34.499 1.00 40.30 ? 154 LEU A CD1 1 ATOM 4454 C CD2 . LEU C 1 153 ? 99.737 -48.871 -35.314 1.00 45.85 ? 154 LEU A CD2 1 ATOM 4455 N N . GLN C 1 154 ? 95.422 -49.618 -37.525 1.00 38.74 ? 155 GLN A N 1 ATOM 4456 C CA . GLN C 1 154 ? 94.561 -48.571 -38.067 1.00 31.50 ? 155 GLN A CA 1 ATOM 4457 C C . GLN C 1 154 ? 94.857 -47.219 -37.439 1.00 35.82 ? 155 GLN A C 1 ATOM 4458 O O . GLN C 1 154 ? 95.194 -47.134 -36.259 1.00 41.62 ? 155 GLN A O 1 ATOM 4459 C CB . GLN C 1 154 ? 93.089 -48.924 -37.851 1.00 25.51 ? 155 GLN A CB 1 ATOM 4460 C CG . GLN C 1 154 ? 92.690 -50.263 -38.425 1.00 28.60 ? 155 GLN A CG 1 ATOM 4461 C CD . GLN C 1 154 ? 92.700 -50.261 -39.934 1.00 30.91 ? 155 GLN A CD 1 ATOM 4462 O OE1 . GLN C 1 154 ? 91.911 -49.562 -40.568 1.00 32.24 ? 155 GLN A OE1 1 ATOM 4463 N NE2 . GLN C 1 154 ? 93.601 -51.037 -40.522 1.00 34.88 ? 155 GLN A NE2 1 ATOM 4464 N N . SER C 1 155 ? 94.709 -46.161 -38.230 1.00 34.79 ? 156 SER A N 1 ATOM 4465 C CA . SER C 1 155 ? 94.985 -44.813 -37.760 1.00 35.11 ? 156 SER A CA 1 ATOM 4466 C C . SER C 1 155 ? 93.994 -43.807 -38.336 1.00 35.11 ? 156 SER A C 1 ATOM 4467 O O . SER C 1 155 ? 93.709 -43.819 -39.531 1.00 46.83 ? 156 SER A O 1 ATOM 4468 C CB . SER C 1 155 ? 96.419 -44.411 -38.123 1.00 42.99 ? 156 SER A CB 1 ATOM 4469 O OG . SER C 1 155 ? 96.718 -43.103 -37.667 1.00 53.77 ? 156 SER A OG 1 ATOM 4470 N N . GLY C 1 156 ? 93.459 -42.945 -37.479 1.00 29.50 ? 157 GLY A N 1 ATOM 4471 C CA . GLY C 1 156 ? 92.605 -41.860 -37.927 1.00 28.25 ? 157 GLY A CA 1 ATOM 4472 C C . GLY C 1 156 ? 91.136 -42.196 -38.118 1.00 34.64 ? 157 GLY A C 1 ATOM 4473 O O . GLY C 1 156 ? 90.326 -41.292 -38.329 1.00 38.41 ? 157 GLY A O 1 ATOM 4474 N N . ASN C 1 157 ? 90.779 -43.477 -38.044 1.00 27.60 ? 158 ASN A N 1 ATOM 4475 C CA . ASN C 1 157 ? 89.392 -43.883 -38.281 1.00 29.38 ? 158 ASN A CA 1 ATOM 4476 C C . ASN C 1 157 ? 88.680 -44.457 -37.055 1.00 28.81 ? 158 ASN A C 1 ATOM 4477 O O . ASN C 1 157 ? 87.775 -45.280 -37.188 1.00 28.78 ? 158 ASN A O 1 ATOM 4478 C CB . ASN C 1 157 ? 89.324 -44.900 -39.430 1.00 25.08 ? 158 ASN A CB 1 ATOM 4479 C CG . ASN C 1 157 ? 90.262 -46.084 -39.231 1.00 27.16 ? 158 ASN A CG 1 ATOM 4480 O OD1 . ASN C 1 157 ? 90.976 -46.171 -38.228 1.00 27.51 ? 158 ASN A OD1 1 ATOM 4481 N ND2 . ASN C 1 157 ? 90.257 -47.008 -40.189 1.00 28.21 ? 158 ASN A ND2 1 ATOM 4482 N N . SER C 1 158 ? 89.074 -44.019 -35.864 1.00 32.05 ? 159 SER A N 1 ATOM 4483 C CA . SER C 1 158 ? 88.369 -44.422 -34.649 1.00 27.29 ? 159 SER A CA 1 ATOM 4484 C C . SER C 1 158 ? 88.183 -43.255 -33.682 1.00 24.68 ? 159 SER A C 1 ATOM 4485 O O . SER C 1 158 ? 88.973 -42.314 -33.674 1.00 24.43 ? 159 SER A O 1 ATOM 4486 C CB . SER C 1 158 ? 89.107 -45.568 -33.951 1.00 32.96 ? 159 SER A CB 1 ATOM 4487 O OG . SER C 1 158 ? 90.396 -45.167 -33.525 1.00 39.90 ? 159 SER A OG 1 ATOM 4488 N N . GLN C 1 159 ? 87.128 -43.320 -32.875 1.00 22.20 ? 160 GLN A N 1 ATOM 4489 C CA . GLN C 1 159 ? 86.870 -42.308 -31.857 1.00 23.39 ? 160 GLN A CA 1 ATOM 4490 C C . GLN C 1 159 ? 86.569 -42.959 -30.516 1.00 21.86 ? 160 GLN A C 1 ATOM 4491 O O . GLN C 1 159 ? 85.920 -44.000 -30.461 1.00 26.87 ? 160 GLN A O 1 ATOM 4492 C CB . GLN C 1 159 ? 85.705 -41.405 -32.264 1.00 26.66 ? 160 GLN A CB 1 ATOM 4493 C CG . GLN C 1 159 ? 85.984 -40.501 -33.457 1.00 28.29 ? 160 GLN A CG 1 ATOM 4494 C CD . GLN C 1 159 ? 84.808 -39.587 -33.772 1.00 33.97 ? 160 GLN A CD 1 ATOM 4495 O OE1 . GLN C 1 159 ? 83.813 -40.020 -34.351 1.00 32.45 ? 160 GLN A OE1 1 ATOM 4496 N NE2 . GLN C 1 159 ? 84.914 -38.318 -33.378 1.00 27.92 ? 160 GLN A NE2 1 ATOM 4497 N N . GLU C 1 160 ? 87.034 -42.337 -29.437 1.00 23.54 ? 161 GLU A N 1 ATOM 4498 C CA . GLU C 1 160 ? 86.799 -42.858 -28.097 1.00 25.35 ? 161 GLU A CA 1 ATOM 4499 C C . GLU C 1 160 ? 85.823 -42.002 -27.305 1.00 28.24 ? 161 GLU A C 1 ATOM 4500 O O . GLU C 1 160 ? 85.725 -40.792 -27.505 1.00 20.52 ? 161 GLU A O 1 ATOM 4501 C CB . GLU C 1 160 ? 88.114 -42.974 -27.325 1.00 21.79 ? 161 GLU A CB 1 ATOM 4502 C CG . GLU C 1 160 ? 89.031 -44.055 -27.864 1.00 40.18 ? 161 GLU A CG 1 ATOM 4503 C CD . GLU C 1 160 ? 90.301 -44.207 -27.055 1.00 48.79 ? 161 GLU A CD 1 ATOM 4504 O OE1 . GLU C 1 160 ? 90.544 -43.372 -26.156 1.00 51.19 ? 161 GLU A OE1 1 ATOM 4505 O OE2 . GLU C 1 160 ? 91.056 -45.166 -27.323 1.00 52.55 ? 161 GLU A OE2 1 ATOM 4506 N N . SER C 1 161 ? 85.105 -42.649 -26.398 1.00 23.38 ? 162 SER A N 1 ATOM 4507 C CA . SER C 1 161 ? 84.273 -41.948 -25.437 1.00 21.63 ? 162 SER A CA 1 ATOM 4508 C C . SER C 1 161 ? 84.452 -42.625 -24.087 1.00 22.88 ? 162 SER A C 1 ATOM 4509 O O . SER C 1 161 ? 84.587 -43.844 -24.020 1.00 27.50 ? 162 SER A O 1 ATOM 4510 C CB . SER C 1 161 ? 82.805 -41.955 -25.872 1.00 29.13 ? 162 SER A CB 1 ATOM 4511 O OG . SER C 1 161 ? 81.985 -41.299 -24.922 1.00 30.84 ? 162 SER A OG 1 ATOM 4512 N N . VAL C 1 162 ? 84.472 -41.839 -23.015 1.00 24.46 ? 163 VAL A N 1 ATOM 4513 C CA . VAL C 1 162 ? 84.657 -42.389 -21.674 1.00 28.44 ? 163 VAL A CA 1 ATOM 4514 C C . VAL C 1 162 ? 83.591 -41.834 -20.723 1.00 27.89 ? 163 VAL A C 1 ATOM 4515 O O . VAL C 1 162 ? 83.205 -40.672 -20.826 1.00 25.60 ? 163 VAL A O 1 ATOM 4516 C CB . VAL C 1 162 ? 86.076 -42.081 -21.136 1.00 25.50 ? 163 VAL A CB 1 ATOM 4517 C CG1 . VAL C 1 162 ? 86.342 -40.596 -21.169 1.00 34.06 ? 163 VAL A CG1 1 ATOM 4518 C CG2 . VAL C 1 162 ? 86.260 -42.630 -19.724 1.00 18.83 ? 163 VAL A CG2 1 ATOM 4519 N N . THR C 1 163 ? 83.089 -42.672 -19.820 1.00 23.54 ? 164 THR A N 1 ATOM 4520 C CA . THR C 1 163 ? 82.091 -42.218 -18.854 1.00 23.32 ? 164 THR A CA 1 ATOM 4521 C C . THR C 1 163 ? 82.738 -41.428 -17.727 1.00 28.33 ? 164 THR A C 1 ATOM 4522 O O . THR C 1 163 ? 83.960 -41.425 -17.580 1.00 32.45 ? 164 THR A O 1 ATOM 4523 C CB . THR C 1 163 ? 81.310 -43.394 -18.232 1.00 19.75 ? 164 THR A CB 1 ATOM 4524 O OG1 . THR C 1 163 ? 82.219 -44.250 -17.529 1.00 27.37 ? 164 THR A OG1 1 ATOM 4525 C CG2 . THR C 1 163 ? 80.594 -44.198 -19.305 1.00 17.69 ? 164 THR A CG2 1 ATOM 4526 N N . GLU C 1 164 ? 81.910 -40.757 -16.935 1.00 26.80 ? 165 GLU A N 1 ATOM 4527 C CA . GLU C 1 164 ? 82.361 -40.154 -15.690 1.00 22.83 ? 165 GLU A CA 1 ATOM 4528 C C . GLU C 1 164 ? 82.613 -41.274 -14.686 1.00 28.38 ? 165 GLU A C 1 ATOM 4529 O O . GLU C 1 164 ? 82.165 -42.405 -14.892 1.00 26.45 ? 165 GLU A O 1 ATOM 4530 C CB . GLU C 1 164 ? 81.321 -39.163 -15.154 1.00 26.31 ? 165 GLU A CB 1 ATOM 4531 C CG . GLU C 1 164 ? 80.974 -38.019 -16.114 1.00 31.33 ? 165 GLU A CG 1 ATOM 4532 C CD . GLU C 1 164 ? 82.069 -36.960 -16.200 1.00 44.25 ? 165 GLU A CD 1 ATOM 4533 O OE1 . GLU C 1 164 ? 82.843 -36.814 -15.229 1.00 40.43 ? 165 GLU A OE1 1 ATOM 4534 O OE2 . GLU C 1 164 ? 82.156 -36.271 -17.241 1.00 51.52 ? 165 GLU A OE2 1 ATOM 4535 N N . GLN C 1 165 ? 83.333 -40.971 -13.610 1.00 31.64 ? 166 GLN A N 1 ATOM 4536 C CA . GLN C 1 165 ? 83.577 -41.962 -12.565 1.00 32.18 ? 166 GLN A CA 1 ATOM 4537 C C . GLN C 1 165 ? 82.276 -42.482 -11.972 1.00 28.74 ? 166 GLN A C 1 ATOM 4538 O O . GLN C 1 165 ? 81.440 -41.707 -11.516 1.00 33.46 ? 166 GLN A O 1 ATOM 4539 C CB . GLN C 1 165 ? 84.443 -41.382 -11.447 1.00 28.50 ? 166 GLN A CB 1 ATOM 4540 C CG . GLN C 1 165 ? 85.919 -41.632 -11.610 1.00 27.24 ? 166 GLN A CG 1 ATOM 4541 C CD . GLN C 1 165 ? 86.701 -41.289 -10.361 1.00 31.17 ? 166 GLN A CD 1 ATOM 4542 O OE1 . GLN C 1 165 ? 86.677 -40.148 -9.884 1.00 29.76 ? 166 GLN A OE1 1 ATOM 4543 N NE2 . GLN C 1 165 ? 87.399 -42.277 -9.817 1.00 17.81 ? 166 GLN A NE2 1 ATOM 4544 N N . ASP C 1 166 ? 82.117 -43.801 -11.992 1.00 28.68 ? 167 ASP A N 1 ATOM 4545 C CA . ASP C 1 166 ? 80.970 -44.457 -11.377 1.00 32.56 ? 167 ASP A CA 1 ATOM 4546 C C . ASP C 1 166 ? 80.828 -44.009 -9.923 1.00 33.95 ? 167 ASP A C 1 ATOM 4547 O O . ASP C 1 166 ? 81.817 -43.914 -9.202 1.00 35.61 ? 167 ASP A O 1 ATOM 4548 C CB . ASP C 1 166 ? 81.129 -45.975 -11.470 1.00 30.51 ? 167 ASP A CB 1 ATOM 4549 C CG . ASP C 1 166 ? 79.890 -46.719 -11.032 1.00 45.89 ? 167 ASP A CG 1 ATOM 4550 O OD1 . ASP C 1 166 ? 79.785 -47.052 -9.829 1.00 42.44 ? 167 ASP A OD1 1 ATOM 4551 O OD2 . ASP C 1 166 ? 79.026 -46.971 -11.898 1.00 58.19 ? 167 ASP A OD2 1 ATOM 4552 N N . SER C 1 167 ? 79.602 -43.723 -9.495 1.00 38.75 ? 168 SER A N 1 ATOM 4553 C CA . SER C 1 167 ? 79.381 -43.093 -8.193 1.00 37.44 ? 168 SER A CA 1 ATOM 4554 C C . SER C 1 167 ? 79.541 -44.061 -7.024 1.00 37.24 ? 168 SER A C 1 ATOM 4555 O O . SER C 1 167 ? 79.666 -43.633 -5.877 1.00 40.60 ? 168 SER A O 1 ATOM 4556 C CB . SER C 1 167 ? 77.993 -42.450 -8.140 1.00 33.62 ? 168 SER A CB 1 ATOM 4557 O OG . SER C 1 167 ? 76.981 -43.420 -8.328 1.00 39.34 ? 168 SER A OG 1 ATOM 4558 N N . LYS C 1 168 ? 79.539 -45.360 -7.310 1.00 37.67 ? 169 LYS A N 1 ATOM 4559 C CA . LYS C 1 168 ? 79.683 -46.360 -6.255 1.00 39.00 ? 169 LYS A CA 1 ATOM 4560 C C . LYS C 1 168 ? 81.090 -46.963 -6.183 1.00 29.88 ? 169 LYS A C 1 ATOM 4561 O O . LYS C 1 168 ? 81.648 -47.088 -5.096 1.00 30.46 ? 169 LYS A O 1 ATOM 4562 C CB . LYS C 1 168 ? 78.650 -47.477 -6.432 1.00 42.22 ? 169 LYS A CB 1 ATOM 4563 C CG . LYS C 1 168 ? 77.258 -47.100 -5.948 1.00 55.79 ? 169 LYS A CG 1 ATOM 4564 C CD . LYS C 1 168 ? 76.234 -48.161 -6.314 1.00 65.24 ? 169 LYS A CD 1 ATOM 4565 C CE . LYS C 1 168 ? 74.832 -47.739 -5.896 1.00 69.57 ? 169 LYS A CE 1 ATOM 4566 N NZ . LYS C 1 168 ? 73.787 -48.657 -6.434 1.00 67.70 ? 169 LYS A NZ 1 ATOM 4567 N N . ASP C 1 169 ? 81.668 -47.335 -7.322 1.00 25.15 ? 170 ASP A N 1 ATOM 4568 C CA . ASP C 1 169 ? 82.956 -48.027 -7.286 1.00 22.47 ? 170 ASP A CA 1 ATOM 4569 C C . ASP C 1 169 ? 84.088 -47.219 -7.920 1.00 21.97 ? 170 ASP A C 1 ATOM 4570 O O . ASP C 1 169 ? 85.226 -47.682 -7.971 1.00 28.32 ? 170 ASP A O 1 ATOM 4571 C CB . ASP C 1 169 ? 82.851 -49.413 -7.954 1.00 26.60 ? 170 ASP A CB 1 ATOM 4572 C CG . ASP C 1 169 ? 82.518 -49.347 -9.449 1.00 27.55 ? 170 ASP A CG 1 ATOM 4573 O OD1 . ASP C 1 169 ? 82.658 -48.282 -10.080 1.00 37.00 ? 170 ASP A OD1 1 ATOM 4574 O OD2 . ASP C 1 169 ? 82.128 -50.391 -10.011 1.00 38.68 ? 170 ASP A OD2 1 ATOM 4575 N N . SER C 1 170 ? 83.758 -46.027 -8.413 1.00 21.99 ? 171 SER A N 1 ATOM 4576 C CA . SER C 1 170 ? 84.746 -45.043 -8.876 1.00 19.96 ? 171 SER A CA 1 ATOM 4577 C C . SER C 1 170 ? 85.564 -45.499 -10.077 1.00 26.23 ? 171 SER A C 1 ATOM 4578 O O . SER C 1 170 ? 86.674 -45.016 -10.292 1.00 24.02 ? 171 SER A O 1 ATOM 4579 C CB . SER C 1 170 ? 85.695 -44.667 -7.740 1.00 16.49 ? 171 SER A CB 1 ATOM 4580 O OG . SER C 1 170 ? 84.988 -44.076 -6.670 1.00 26.01 ? 171 SER A OG 1 ATOM 4581 N N . THR C 1 171 ? 85.020 -46.420 -10.862 1.00 25.93 ? 172 THR A N 1 ATOM 4582 C CA . THR C 1 171 ? 85.722 -46.904 -12.039 1.00 22.88 ? 172 THR A CA 1 ATOM 4583 C C . THR C 1 171 ? 85.264 -46.162 -13.290 1.00 24.61 ? 172 THR A C 1 ATOM 4584 O O . THR C 1 171 ? 84.259 -45.461 -13.271 1.00 25.14 ? 172 THR A O 1 ATOM 4585 C CB . THR C 1 171 ? 85.511 -48.419 -12.248 1.00 28.34 ? 172 THR A CB 1 ATOM 4586 O OG1 . THR C 1 171 ? 84.108 -48.700 -12.369 1.00 26.70 ? 172 THR A OG1 1 ATOM 4587 C CG2 . THR C 1 171 ? 86.097 -49.204 -11.082 1.00 23.05 ? 172 THR A CG2 1 ATOM 4588 N N . TYR C 1 172 ? 86.015 -46.324 -14.374 1.00 21.86 ? 173 TYR A N 1 ATOM 4589 C CA . TYR C 1 172 ? 85.658 -45.738 -15.658 1.00 20.36 ? 173 TYR A CA 1 ATOM 4590 C C . TYR C 1 172 ? 85.220 -46.811 -16.630 1.00 24.40 ? 173 TYR A C 1 ATOM 4591 O O . TYR C 1 172 ? 85.644 -47.965 -16.523 1.00 23.88 ? 173 TYR A O 1 ATOM 4592 C CB . TYR C 1 172 ? 86.839 -44.988 -16.267 1.00 24.23 ? 173 TYR A CB 1 ATOM 4593 C CG . TYR C 1 172 ? 87.307 -43.798 -15.476 1.00 24.70 ? 173 TYR A CG 1 ATOM 4594 C CD1 . TYR C 1 172 ? 86.741 -42.548 -15.676 1.00 19.71 ? 173 TYR A CD1 1 ATOM 4595 C CD2 . TYR C 1 172 ? 88.327 -43.919 -14.540 1.00 16.82 ? 173 TYR A CD2 1 ATOM 4596 C CE1 . TYR C 1 172 ? 87.168 -41.452 -14.961 1.00 20.25 ? 173 TYR A CE1 1 ATOM 4597 C CE2 . TYR C 1 172 ? 88.762 -42.830 -13.822 1.00 17.13 ? 173 TYR A CE2 1 ATOM 4598 C CZ . TYR C 1 172 ? 88.183 -41.596 -14.039 1.00 24.60 ? 173 TYR A CZ 1 ATOM 4599 O OH . TYR C 1 172 ? 88.610 -40.499 -13.322 1.00 29.52 ? 173 TYR A OH 1 ATOM 4600 N N . SER C 1 173 ? 84.387 -46.433 -17.590 1.00 19.39 ? 174 SER A N 1 ATOM 4601 C CA . SER C 1 173 ? 84.160 -47.297 -18.739 1.00 21.04 ? 174 SER A CA 1 ATOM 4602 C C . SER C 1 173 ? 84.457 -46.526 -20.015 1.00 26.25 ? 174 SER A C 1 ATOM 4603 O O . SER C 1 173 ? 84.220 -45.320 -20.094 1.00 30.05 ? 174 SER A O 1 ATOM 4604 C CB . SER C 1 173 ? 82.737 -47.850 -18.744 1.00 24.03 ? 174 SER A CB 1 ATOM 4605 O OG . SER C 1 173 ? 82.604 -48.877 -17.775 1.00 26.57 ? 174 SER A OG 1 ATOM 4606 N N . LEU C 1 174 ? 85.005 -47.224 -21.004 1.00 25.41 ? 175 LEU A N 1 ATOM 4607 C CA . LEU C 1 174 ? 85.404 -46.585 -22.248 1.00 19.48 ? 175 LEU A CA 1 ATOM 4608 C C . LEU C 1 174 ? 84.932 -47.394 -23.451 1.00 26.96 ? 175 LEU A C 1 ATOM 4609 O O . LEU C 1 174 ? 84.885 -48.622 -23.408 1.00 23.74 ? 175 LEU A O 1 ATOM 4610 C CB . LEU C 1 174 ? 86.923 -46.397 -22.289 1.00 15.93 ? 175 LEU A CB 1 ATOM 4611 C CG . LEU C 1 174 ? 87.561 -45.660 -23.476 1.00 21.27 ? 175 LEU A CG 1 ATOM 4612 C CD1 . LEU C 1 174 ? 88.831 -44.955 -23.031 1.00 21.63 ? 175 LEU A CD1 1 ATOM 4613 C CD2 . LEU C 1 174 ? 87.869 -46.601 -24.634 1.00 19.50 ? 175 LEU A CD2 1 ATOM 4614 N N . SER C 1 175 ? 84.575 -46.690 -24.521 1.00 26.31 ? 176 SER A N 1 ATOM 4615 C CA . SER C 1 175 ? 84.278 -47.333 -25.792 1.00 28.05 ? 176 SER A CA 1 ATOM 4616 C C . SER C 1 175 ? 85.160 -46.734 -26.877 1.00 29.68 ? 176 SER A C 1 ATOM 4617 O O . SER C 1 175 ? 85.456 -45.536 -26.859 1.00 24.94 ? 176 SER A O 1 ATOM 4618 C CB . SER C 1 175 ? 82.806 -47.169 -26.166 1.00 29.47 ? 176 SER A CB 1 ATOM 4619 O OG . SER C 1 175 ? 82.555 -45.842 -26.603 1.00 36.69 ? 176 SER A OG 1 ATOM 4620 N N . SER C 1 176 ? 85.596 -47.577 -27.805 1.00 14.16 ? 177 SER A N 1 ATOM 4621 C CA . SER C 1 176 ? 86.304 -47.115 -28.984 1.00 17.72 ? 177 SER A CA 1 ATOM 4622 C C . SER C 1 176 ? 85.564 -47.622 -30.216 1.00 23.12 ? 177 SER A C 1 ATOM 4623 O O . SER C 1 176 ? 85.228 -48.800 -30.306 1.00 23.67 ? 177 SER A O 1 ATOM 4624 C CB . SER C 1 176 ? 87.757 -47.593 -28.979 1.00 18.04 ? 177 SER A CB 1 ATOM 4625 O OG . SER C 1 176 ? 88.424 -47.167 -30.154 1.00 25.53 ? 177 SER A OG 1 ATOM 4626 N N . THR C 1 177 ? 85.289 -46.725 -31.154 1.00 24.11 ? 178 THR A N 1 ATOM 4627 C CA . THR C 1 177 ? 84.502 -47.085 -32.324 1.00 25.43 ? 178 THR A CA 1 ATOM 4628 C C . THR C 1 177 ? 85.309 -46.938 -33.602 1.00 25.14 ? 178 THR A C 1 ATOM 4629 O O . THR C 1 177 ? 85.739 -45.843 -33.944 1.00 24.10 ? 178 THR A O 1 ATOM 4630 C CB . THR C 1 177 ? 83.234 -46.222 -32.437 1.00 30.38 ? 178 THR A CB 1 ATOM 4631 O OG1 . THR C 1 177 ? 82.444 -46.381 -31.253 1.00 31.85 ? 178 THR A OG1 1 ATOM 4632 C CG2 . THR C 1 177 ? 82.414 -46.639 -33.653 1.00 24.27 ? 178 THR A CG2 1 ATOM 4633 N N . LEU C 1 178 ? 85.512 -48.052 -34.298 1.00 24.26 ? 179 LEU A N 1 ATOM 4634 C CA . LEU C 1 178 ? 86.197 -48.054 -35.582 1.00 20.65 ? 179 LEU A CA 1 ATOM 4635 C C . LEU C 1 178 ? 85.180 -47.908 -36.707 1.00 27.36 ? 179 LEU A C 1 ATOM 4636 O O . LEU C 1 178 ? 84.264 -48.721 -36.833 1.00 24.57 ? 179 LEU A O 1 ATOM 4637 C CB . LEU C 1 178 ? 87.002 -49.342 -35.757 1.00 21.70 ? 179 LEU A CB 1 ATOM 4638 C CG . LEU C 1 178 ? 87.734 -49.553 -37.085 1.00 30.37 ? 179 LEU A CG 1 ATOM 4639 C CD1 . LEU C 1 178 ? 88.927 -48.604 -37.210 1.00 17.79 ? 179 LEU A CD1 1 ATOM 4640 C CD2 . LEU C 1 178 ? 88.176 -51.012 -37.232 1.00 20.74 ? 179 LEU A CD2 1 ATOM 4641 N N . THR C 1 179 ? 85.333 -46.871 -37.519 1.00 24.56 ? 180 THR A N 1 ATOM 4642 C CA . THR C 1 179 ? 84.399 -46.644 -38.612 1.00 21.11 ? 180 THR A CA 1 ATOM 4643 C C . THR C 1 179 ? 85.018 -47.005 -39.955 1.00 25.59 ? 180 THR A C 1 ATOM 4644 O O . THR C 1 179 ? 86.016 -46.415 -40.372 1.00 20.60 ? 180 THR A O 1 ATOM 4645 C CB . THR C 1 179 ? 83.919 -45.186 -38.649 1.00 29.63 ? 180 THR A CB 1 ATOM 4646 O OG1 . THR C 1 179 ? 83.173 -44.907 -37.459 1.00 35.31 ? 180 THR A OG1 1 ATOM 4647 C CG2 . THR C 1 179 ? 83.025 -44.952 -39.864 1.00 28.92 ? 180 THR A CG2 1 ATOM 4648 N N . LEU C 1 180 ? 84.422 -47.987 -40.624 1.00 23.24 ? 181 LEU A N 1 ATOM 4649 C CA . LEU C 1 180 ? 84.903 -48.432 -41.923 1.00 22.61 ? 181 LEU A CA 1 ATOM 4650 C C . LEU C 1 180 ? 83.819 -48.281 -42.983 1.00 23.34 ? 181 LEU A C 1 ATOM 4651 O O . LEU C 1 180 ? 82.633 -48.224 -42.665 1.00 24.33 ? 181 LEU A O 1 ATOM 4652 C CB . LEU C 1 180 ? 85.353 -49.893 -41.856 1.00 24.10 ? 181 LEU A CB 1 ATOM 4653 C CG . LEU C 1 180 ? 86.446 -50.233 -40.845 1.00 32.60 ? 181 LEU A CG 1 ATOM 4654 C CD1 . LEU C 1 180 ? 86.658 -51.739 -40.784 1.00 31.97 ? 181 LEU A CD1 1 ATOM 4655 C CD2 . LEU C 1 180 ? 87.743 -49.519 -41.201 1.00 24.69 ? 181 LEU A CD2 1 ATOM 4656 N N . SER C 1 181 ? 84.228 -48.213 -44.243 1.00 17.24 ? 182 SER A N 1 ATOM 4657 C CA . SER C 1 181 ? 83.283 -48.335 -45.335 1.00 15.28 ? 182 SER A CA 1 ATOM 4658 C C . SER C 1 181 ? 82.878 -49.800 -45.457 1.00 27.46 ? 182 SER A C 1 ATOM 4659 O O . SER C 1 181 ? 83.586 -50.688 -44.978 1.00 27.36 ? 182 SER A O 1 ATOM 4660 C CB . SER C 1 181 ? 83.888 -47.831 -46.643 1.00 25.49 ? 182 SER A CB 1 ATOM 4661 O OG . SER C 1 181 ? 84.886 -48.721 -47.113 1.00 22.22 ? 182 SER A OG 1 ATOM 4662 N N . LYS C 1 182 ? 81.736 -50.048 -46.088 1.00 26.63 ? 183 LYS A N 1 ATOM 4663 C CA . LYS C 1 182 ? 81.254 -51.406 -46.285 1.00 24.82 ? 183 LYS A CA 1 ATOM 4664 C C . LYS C 1 182 ? 82.248 -52.228 -47.091 1.00 24.53 ? 183 LYS A C 1 ATOM 4665 O O . LYS C 1 182 ? 82.575 -53.355 -46.723 1.00 28.72 ? 183 LYS A O 1 ATOM 4666 C CB . LYS C 1 182 ? 79.894 -51.399 -46.987 1.00 24.97 ? 183 LYS A CB 1 ATOM 4667 C CG . LYS C 1 182 ? 79.453 -52.774 -47.493 1.00 18.81 ? 183 LYS A CG 1 ATOM 4668 C CD . LYS C 1 182 ? 78.116 -52.677 -48.206 1.00 23.44 ? 183 LYS A CD 1 ATOM 4669 C CE . LYS C 1 182 ? 77.674 -54.013 -48.797 1.00 28.42 ? 183 LYS A CE 1 ATOM 4670 N NZ . LYS C 1 182 ? 76.581 -53.802 -49.802 1.00 31.63 ? 183 LYS A NZ 1 ATOM 4671 N N . ALA C 1 183 ? 82.730 -51.656 -48.190 1.00 24.03 ? 184 ALA A N 1 ATOM 4672 C CA . ALA C 1 183 ? 83.672 -52.352 -49.058 1.00 29.87 ? 184 ALA A CA 1 ATOM 4673 C C . ALA C 1 183 ? 84.953 -52.698 -48.307 1.00 31.34 ? 184 ALA A C 1 ATOM 4674 O O . ALA C 1 183 ? 85.467 -53.809 -48.421 1.00 30.97 ? 184 ALA A O 1 ATOM 4675 C CB . ALA C 1 183 ? 83.983 -51.517 -50.280 1.00 28.05 ? 184 ALA A CB 1 ATOM 4676 N N . ASP C 1 184 ? 85.459 -51.747 -47.529 1.00 27.22 ? 185 ASP A N 1 ATOM 4677 C CA . ASP C 1 184 ? 86.666 -51.980 -46.739 1.00 26.58 ? 185 ASP A CA 1 ATOM 4678 C C . ASP C 1 184 ? 86.439 -53.130 -45.759 1.00 36.16 ? 185 ASP A C 1 ATOM 4679 O O . ASP C 1 184 ? 87.284 -54.018 -45.611 1.00 33.87 ? 185 ASP A O 1 ATOM 4680 C CB . ASP C 1 184 ? 87.074 -50.705 -45.994 1.00 32.34 ? 185 ASP A CB 1 ATOM 4681 C CG . ASP C 1 184 ? 88.440 -50.814 -45.331 1.00 41.23 ? 185 ASP A CG 1 ATOM 4682 O OD1 . ASP C 1 184 ? 89.231 -51.701 -45.718 1.00 46.08 ? 185 ASP A OD1 1 ATOM 4683 O OD2 . ASP C 1 184 ? 88.724 -49.999 -44.428 1.00 45.81 ? 185 ASP A OD2 1 ATOM 4684 N N . TYR C 1 185 ? 85.285 -53.114 -45.099 1.00 33.43 ? 186 TYR A N 1 ATOM 4685 C CA . TYR C 1 185 ? 84.943 -54.162 -44.151 1.00 27.88 ? 186 TYR A CA 1 ATOM 4686 C C . TYR C 1 185 ? 84.832 -55.530 -44.825 1.00 34.09 ? 186 TYR A C 1 ATOM 4687 O O . TYR C 1 185 ? 85.330 -56.530 -44.303 1.00 25.73 ? 186 TYR A O 1 ATOM 4688 C CB . TYR C 1 185 ? 83.635 -53.832 -43.434 1.00 27.05 ? 186 TYR A CB 1 ATOM 4689 C CG . TYR C 1 185 ? 83.225 -54.884 -42.427 1.00 25.99 ? 186 TYR A CG 1 ATOM 4690 C CD1 . TYR C 1 185 ? 83.926 -55.044 -41.233 1.00 31.62 ? 186 TYR A CD1 1 ATOM 4691 C CD2 . TYR C 1 185 ? 82.140 -55.710 -42.664 1.00 28.53 ? 186 TYR A CD2 1 ATOM 4692 C CE1 . TYR C 1 185 ? 83.557 -56.008 -40.308 1.00 30.23 ? 186 TYR A CE1 1 ATOM 4693 C CE2 . TYR C 1 185 ? 81.762 -56.672 -41.746 1.00 33.58 ? 186 TYR A CE2 1 ATOM 4694 C CZ . TYR C 1 185 ? 82.475 -56.817 -40.572 1.00 32.78 ? 186 TYR A CZ 1 ATOM 4695 O OH . TYR C 1 185 ? 82.096 -57.774 -39.660 1.00 31.01 ? 186 TYR A OH 1 ATOM 4696 N N . GLU C 1 186 ? 84.186 -55.569 -45.987 1.00 34.42 ? 187 GLU A N 1 ATOM 4697 C CA . GLU C 1 186 ? 83.919 -56.839 -46.660 1.00 34.27 ? 187 GLU A CA 1 ATOM 4698 C C . GLU C 1 186 ? 85.158 -57.471 -47.289 1.00 38.40 ? 187 GLU A C 1 ATOM 4699 O O . GLU C 1 186 ? 85.162 -58.666 -47.571 1.00 42.15 ? 187 GLU A O 1 ATOM 4700 C CB . GLU C 1 186 ? 82.842 -56.664 -47.737 1.00 29.37 ? 187 GLU A CB 1 ATOM 4701 C CG . GLU C 1 186 ? 81.476 -56.243 -47.211 1.00 33.02 ? 187 GLU A CG 1 ATOM 4702 C CD . GLU C 1 186 ? 80.849 -57.260 -46.273 1.00 53.33 ? 187 GLU A CD 1 ATOM 4703 O OE1 . GLU C 1 186 ? 81.332 -58.410 -46.208 1.00 64.80 ? 187 GLU A OE1 1 ATOM 4704 O OE2 . GLU C 1 186 ? 79.859 -56.906 -45.599 1.00 58.43 ? 187 GLU A OE2 1 ATOM 4705 N N . LYS C 1 187 ? 86.209 -56.685 -47.504 1.00 41.15 ? 188 LYS A N 1 ATOM 4706 C CA . LYS C 1 187 ? 87.401 -57.217 -48.153 1.00 44.18 ? 188 LYS A CA 1 ATOM 4707 C C . LYS C 1 187 ? 88.461 -57.643 -47.143 1.00 43.66 ? 188 LYS A C 1 ATOM 4708 O O . LYS C 1 187 ? 89.592 -57.947 -47.518 1.00 44.80 ? 188 LYS A O 1 ATOM 4709 C CB . LYS C 1 187 ? 87.992 -56.196 -49.129 1.00 53.69 ? 188 LYS A CB 1 ATOM 4710 C CG . LYS C 1 187 ? 88.662 -55.008 -48.468 1.00 64.92 ? 188 LYS A CG 1 ATOM 4711 C CD . LYS C 1 187 ? 89.396 -54.150 -49.490 1.00 76.12 ? 188 LYS A CD 1 ATOM 4712 C CE . LYS C 1 187 ? 88.439 -53.560 -50.515 1.00 80.92 ? 188 LYS A CE 1 ATOM 4713 N NZ . LYS C 1 187 ? 89.135 -52.661 -51.481 1.00 82.96 ? 188 LYS A NZ 1 ATOM 4714 N N . HIS C 1 188 ? 88.096 -57.670 -45.864 1.00 38.24 ? 189 HIS A N 1 ATOM 4715 C CA . HIS C 1 188 ? 89.008 -58.156 -44.831 1.00 36.10 ? 189 HIS A CA 1 ATOM 4716 C C . HIS C 1 188 ? 88.307 -59.144 -43.910 1.00 37.07 ? 189 HIS A C 1 ATOM 4717 O O . HIS C 1 188 ? 87.077 -59.208 -43.876 1.00 40.17 ? 189 HIS A O 1 ATOM 4718 C CB . HIS C 1 188 ? 89.588 -56.994 -44.028 1.00 37.66 ? 189 HIS A CB 1 ATOM 4719 C CG . HIS C 1 188 ? 90.435 -56.067 -44.840 1.00 41.17 ? 189 HIS A CG 1 ATOM 4720 N ND1 . HIS C 1 188 ? 89.973 -54.853 -45.307 1.00 46.38 ? 189 HIS A ND1 1 ATOM 4721 C CD2 . HIS C 1 188 ? 91.710 -56.176 -45.281 1.00 40.57 ? 189 HIS A CD2 1 ATOM 4722 C CE1 . HIS C 1 188 ? 90.929 -54.254 -45.992 1.00 43.77 ? 189 HIS A CE1 1 ATOM 4723 N NE2 . HIS C 1 188 ? 91.995 -55.036 -45.992 1.00 42.44 ? 189 HIS A NE2 1 ATOM 4724 N N . LYS C 1 189 ? 89.094 -59.908 -43.159 1.00 38.20 ? 190 LYS A N 1 ATOM 4725 C CA . LYS C 1 189 ? 88.563 -61.068 -42.454 1.00 43.99 ? 190 LYS A CA 1 ATOM 4726 C C . LYS C 1 189 ? 88.621 -60.962 -40.930 1.00 42.20 ? 190 LYS A C 1 ATOM 4727 O O . LYS C 1 189 ? 87.613 -61.186 -40.258 1.00 41.92 ? 190 LYS A O 1 ATOM 4728 C CB . LYS C 1 189 ? 89.305 -62.329 -42.906 1.00 56.67 ? 190 LYS A CB 1 ATOM 4729 C CG . LYS C 1 189 ? 88.740 -63.620 -42.341 1.00 73.11 ? 190 LYS A CG 1 ATOM 4730 C CD . LYS C 1 189 ? 89.592 -64.814 -42.747 1.00 92.12 ? 190 LYS A CD 1 ATOM 4731 C CE . LYS C 1 189 ? 89.091 -66.100 -42.107 1.00 104.31 ? 190 LYS A CE 1 ATOM 4732 N NZ . LYS C 1 189 ? 89.968 -67.260 -42.427 1.00 112.63 ? 190 LYS A NZ 1 ATOM 4733 N N . VAL C 1 190 ? 89.792 -60.639 -40.383 1.00 36.12 ? 191 VAL A N 1 ATOM 4734 C CA . VAL C 1 190 ? 89.956 -60.630 -38.931 1.00 43.64 ? 191 VAL A CA 1 ATOM 4735 C C . VAL C 1 190 ? 90.007 -59.215 -38.362 1.00 37.22 ? 191 VAL A C 1 ATOM 4736 O O . VAL C 1 190 ? 90.737 -58.351 -38.853 1.00 34.79 ? 191 VAL A O 1 ATOM 4737 C CB . VAL C 1 190 ? 91.224 -61.407 -38.496 1.00 65.80 ? 191 VAL A CB 1 ATOM 4738 C CG1 . VAL C 1 190 ? 92.422 -61.000 -39.324 1.00 68.57 ? 191 VAL A CG1 1 ATOM 4739 C CG2 . VAL C 1 190 ? 91.497 -61.208 -37.007 1.00 61.43 ? 191 VAL A CG2 1 ATOM 4740 N N . TYR C 1 191 ? 89.212 -58.995 -37.320 1.00 28.66 ? 192 TYR A N 1 ATOM 4741 C CA . TYR C 1 191 ? 89.076 -57.680 -36.713 1.00 29.60 ? 192 TYR A CA 1 ATOM 4742 C C . TYR C 1 191 ? 89.365 -57.736 -35.224 1.00 34.87 ? 192 TYR A C 1 ATOM 4743 O O . TYR C 1 191 ? 88.725 -58.482 -34.491 1.00 33.22 ? 192 TYR A O 1 ATOM 4744 C CB . TYR C 1 191 ? 87.673 -57.134 -36.971 1.00 28.16 ? 192 TYR A CB 1 ATOM 4745 C CG . TYR C 1 191 ? 87.456 -56.795 -38.422 1.00 32.14 ? 192 TYR A CG 1 ATOM 4746 C CD1 . TYR C 1 191 ? 87.108 -57.778 -39.346 1.00 27.89 ? 192 TYR A CD1 1 ATOM 4747 C CD2 . TYR C 1 191 ? 87.635 -55.499 -38.879 1.00 32.39 ? 192 TYR A CD2 1 ATOM 4748 C CE1 . TYR C 1 191 ? 86.931 -57.466 -40.678 1.00 28.09 ? 192 TYR A CE1 1 ATOM 4749 C CE2 . TYR C 1 191 ? 87.456 -55.182 -40.206 1.00 28.15 ? 192 TYR A CE2 1 ATOM 4750 C CZ . TYR C 1 191 ? 87.107 -56.167 -41.097 1.00 24.58 ? 192 TYR A CZ 1 ATOM 4751 O OH . TYR C 1 191 ? 86.936 -55.840 -42.414 1.00 30.43 ? 192 TYR A OH 1 ATOM 4752 N N . ALA C 1 192 ? 90.327 -56.938 -34.777 1.00 38.28 ? 193 ALA A N 1 ATOM 4753 C CA . ALA C 1 192 ? 90.783 -57.021 -33.397 1.00 34.27 ? 193 ALA A CA 1 ATOM 4754 C C . ALA C 1 192 ? 90.981 -55.652 -32.776 1.00 32.57 ? 193 ALA A C 1 ATOM 4755 O O . ALA C 1 192 ? 91.380 -54.703 -33.451 1.00 35.07 ? 193 ALA A O 1 ATOM 4756 C CB . ALA C 1 192 ? 92.086 -57.819 -33.318 1.00 29.39 ? 193 ALA A CB 1 ATOM 4757 N N . CYS C 1 193 ? 90.693 -55.549 -31.485 1.00 30.88 ? 194 CYS A N 1 ATOM 4758 C CA . CYS C 1 193 ? 91.116 -54.386 -30.728 1.00 36.34 ? 194 CYS A CA 1 ATOM 4759 C C . CYS C 1 193 ? 92.037 -54.865 -29.613 1.00 37.56 ? 194 CYS A C 1 ATOM 4760 O O . CYS C 1 193 ? 91.749 -55.835 -28.912 1.00 31.86 ? 194 CYS A O 1 ATOM 4761 C CB . CYS C 1 193 ? 89.921 -53.583 -30.184 1.00 38.10 ? 194 CYS A CB 1 ATOM 4762 S SG . CYS C 1 193 ? 88.886 -54.339 -28.900 1.00 51.09 ? 194 CYS A SG 1 ATOM 4763 N N . GLU C 1 194 ? 93.172 -54.195 -29.490 1.00 35.92 ? 195 GLU A N 1 ATOM 4764 C CA . GLU C 1 194 ? 94.156 -54.534 -28.484 1.00 36.52 ? 195 GLU A CA 1 ATOM 4765 C C . GLU C 1 194 ? 94.180 -53.438 -27.432 1.00 31.76 ? 195 GLU A C 1 ATOM 4766 O O . GLU C 1 194 ? 94.302 -52.257 -27.758 1.00 31.17 ? 195 GLU A O 1 ATOM 4767 C CB . GLU C 1 194 ? 95.528 -54.715 -29.126 1.00 48.02 ? 195 GLU A CB 1 ATOM 4768 C CG . GLU C 1 194 ? 96.662 -54.970 -28.156 1.00 62.84 ? 195 GLU A CG 1 ATOM 4769 C CD . GLU C 1 194 ? 97.979 -55.173 -28.874 1.00 72.61 ? 195 GLU A CD 1 ATOM 4770 O OE1 . GLU C 1 194 ? 97.957 -55.706 -30.005 1.00 71.06 ? 195 GLU A OE1 1 ATOM 4771 O OE2 . GLU C 1 194 ? 99.030 -54.793 -28.316 1.00 80.45 ? 195 GLU A OE2 1 ATOM 4772 N N . VAL C 1 195 ? 94.051 -53.835 -26.172 1.00 26.04 ? 196 VAL A N 1 ATOM 4773 C CA . VAL C 1 195 ? 93.944 -52.885 -25.076 1.00 25.70 ? 196 VAL A CA 1 ATOM 4774 C C . VAL C 1 195 ? 95.128 -52.990 -24.127 1.00 35.15 ? 196 VAL A C 1 ATOM 4775 O O . VAL C 1 195 ? 95.445 -54.075 -23.633 1.00 32.84 ? 196 VAL A O 1 ATOM 4776 C CB . VAL C 1 195 ? 92.640 -53.100 -24.283 1.00 25.74 ? 196 VAL A CB 1 ATOM 4777 C CG1 . VAL C 1 195 ? 92.653 -52.291 -22.997 1.00 26.09 ? 196 VAL A CG1 1 ATOM 4778 C CG2 . VAL C 1 195 ? 91.440 -52.744 -25.140 1.00 27.75 ? 196 VAL A CG2 1 ATOM 4779 N N . THR C 1 196 ? 95.781 -51.858 -23.882 1.00 34.57 ? 197 THR A N 1 ATOM 4780 C CA . THR C 1 196 ? 96.866 -51.793 -22.912 1.00 34.34 ? 197 THR A CA 1 ATOM 4781 C C . THR C 1 196 ? 96.401 -51.063 -21.663 1.00 34.71 ? 197 THR A C 1 ATOM 4782 O O . THR C 1 196 ? 95.899 -49.942 -21.739 1.00 36.01 ? 197 THR A O 1 ATOM 4783 C CB . THR C 1 196 ? 98.105 -51.083 -23.482 1.00 37.82 ? 197 THR A CB 1 ATOM 4784 O OG1 . THR C 1 196 ? 98.622 -51.839 -24.583 1.00 47.84 ? 197 THR A OG1 1 ATOM 4785 C CG2 . THR C 1 196 ? 99.184 -50.958 -22.418 1.00 35.59 ? 197 THR A CG2 1 ATOM 4786 N N . HIS C 1 197 ? 96.559 -51.710 -20.516 1.00 30.92 ? 198 HIS A N 1 ATOM 4787 C CA . HIS C 1 197 ? 96.209 -51.108 -19.235 1.00 28.62 ? 198 HIS A CA 1 ATOM 4788 C C . HIS C 1 197 ? 97.095 -51.714 -18.157 1.00 27.70 ? 198 HIS A C 1 ATOM 4789 O O . HIS C 1 197 ? 97.429 -52.898 -18.221 1.00 31.05 ? 198 HIS A O 1 ATOM 4790 C CB . HIS C 1 197 ? 94.730 -51.330 -18.909 1.00 28.07 ? 198 HIS A CB 1 ATOM 4791 C CG . HIS C 1 197 ? 94.249 -50.547 -17.727 1.00 29.79 ? 198 HIS A CG 1 ATOM 4792 N ND1 . HIS C 1 197 ? 94.385 -50.996 -16.431 1.00 27.54 ? 198 HIS A ND1 1 ATOM 4793 C CD2 . HIS C 1 197 ? 93.635 -49.342 -17.647 1.00 24.74 ? 198 HIS A CD2 1 ATOM 4794 C CE1 . HIS C 1 197 ? 93.874 -50.102 -15.602 1.00 27.12 ? 198 HIS A CE1 1 ATOM 4795 N NE2 . HIS C 1 197 ? 93.413 -49.090 -16.314 1.00 26.95 ? 198 HIS A NE2 1 ATOM 4796 N N . GLN C 1 198 ? 97.465 -50.914 -17.162 1.00 26.02 ? 199 GLN A N 1 ATOM 4797 C CA . GLN C 1 198 ? 98.438 -51.361 -16.173 1.00 31.16 ? 199 GLN A CA 1 ATOM 4798 C C . GLN C 1 198 ? 97.921 -52.529 -15.336 1.00 36.13 ? 199 GLN A C 1 ATOM 4799 O O . GLN C 1 198 ? 98.702 -53.385 -14.909 1.00 37.81 ? 199 GLN A O 1 ATOM 4800 C CB . GLN C 1 198 ? 98.853 -50.200 -15.268 1.00 29.99 ? 199 GLN A CB 1 ATOM 4801 C CG . GLN C 1 198 ? 97.769 -49.654 -14.375 1.00 29.04 ? 199 GLN A CG 1 ATOM 4802 C CD . GLN C 1 198 ? 98.196 -48.370 -13.698 1.00 37.52 ? 199 GLN A CD 1 ATOM 4803 O OE1 . GLN C 1 198 ? 98.522 -48.361 -12.512 1.00 41.98 ? 199 GLN A OE1 1 ATOM 4804 N NE2 . GLN C 1 198 ? 98.200 -47.275 -14.454 1.00 39.99 ? 199 GLN A NE2 1 ATOM 4805 N N . GLY C 1 199 ? 96.608 -52.579 -15.130 1.00 27.25 ? 200 GLY A N 1 ATOM 4806 C CA . GLY C 1 199 ? 95.996 -53.649 -14.362 1.00 28.09 ? 200 GLY A CA 1 ATOM 4807 C C . GLY C 1 199 ? 95.988 -54.995 -15.066 1.00 29.51 ? 200 GLY A C 1 ATOM 4808 O O . GLY C 1 199 ? 95.688 -56.015 -14.454 1.00 30.68 ? 200 GLY A O 1 ATOM 4809 N N . LEU C 1 200 ? 96.312 -54.999 -16.355 1.00 30.09 ? 201 LEU A N 1 ATOM 4810 C CA . LEU C 1 200 ? 96.377 -56.239 -17.122 1.00 27.51 ? 201 LEU A CA 1 ATOM 4811 C C . LEU C 1 200 ? 97.773 -56.845 -17.062 1.00 33.89 ? 201 LEU A C 1 ATOM 4812 O O . LEU C 1 200 ? 98.757 -56.130 -16.873 1.00 36.34 ? 201 LEU A O 1 ATOM 4813 C CB . LEU C 1 200 ? 95.980 -55.990 -18.575 1.00 28.26 ? 201 LEU A CB 1 ATOM 4814 C CG . LEU C 1 200 ? 94.574 -55.436 -18.813 1.00 31.45 ? 201 LEU A CG 1 ATOM 4815 C CD1 . LEU C 1 200 ? 94.447 -54.935 -20.241 1.00 34.13 ? 201 LEU A CD1 1 ATOM 4816 C CD2 . LEU C 1 200 ? 93.515 -56.491 -18.515 1.00 27.97 ? 201 LEU A CD2 1 ATOM 4817 N N . SER C 1 201 ? 97.855 -58.162 -17.230 1.00 32.83 ? 202 SER A N 1 ATOM 4818 C CA . SER C 1 201 ? 99.135 -58.865 -17.189 1.00 36.75 ? 202 SER A CA 1 ATOM 4819 C C . SER C 1 201 ? 99.959 -58.560 -18.440 1.00 40.19 ? 202 SER A C 1 ATOM 4820 O O . SER C 1 201 ? 101.191 -58.531 -18.401 1.00 43.99 ? 202 SER A O 1 ATOM 4821 C CB . SER C 1 201 ? 98.918 -60.375 -17.046 1.00 35.28 ? 202 SER A CB 1 ATOM 4822 O OG . SER C 1 201 ? 98.456 -60.956 -18.253 1.00 43.51 ? 202 SER A OG 1 ATOM 4823 N N . SER C 1 202 ? 99.258 -58.328 -19.546 1.00 36.10 ? 203 SER A N 1 ATOM 4824 C CA . SER C 1 202 ? 99.871 -57.953 -20.816 1.00 45.07 ? 203 SER A CA 1 ATOM 4825 C C . SER C 1 202 ? 98.762 -57.390 -21.706 1.00 43.49 ? 203 SER A C 1 ATOM 4826 O O . SER C 1 202 ? 97.587 -57.569 -21.385 1.00 41.25 ? 203 SER A O 1 ATOM 4827 C CB . SER C 1 202 ? 100.568 -59.157 -21.472 1.00 48.92 ? 203 SER A CB 1 ATOM 4828 O OG . SER C 1 202 ? 99.636 -60.124 -21.926 1.00 50.22 ? 203 SER A OG 1 ATOM 4829 N N . PRO C 1 203 ? 99.123 -56.692 -22.804 1.00 42.18 ? 204 PRO A N 1 ATOM 4830 C CA . PRO C 1 203 ? 98.105 -56.195 -23.739 1.00 38.44 ? 204 PRO A CA 1 ATOM 4831 C C . PRO C 1 203 ? 97.086 -57.258 -24.116 1.00 36.37 ? 204 PRO A C 1 ATOM 4832 O O . PRO C 1 203 ? 97.463 -58.362 -24.494 1.00 41.18 ? 204 PRO A O 1 ATOM 4833 C CB . PRO C 1 203 ? 98.929 -55.781 -24.956 1.00 39.05 ? 204 PRO A CB 1 ATOM 4834 C CG . PRO C 1 203 ? 100.212 -55.325 -24.370 1.00 41.42 ? 204 PRO A CG 1 ATOM 4835 C CD . PRO C 1 203 ? 100.469 -56.214 -23.172 1.00 40.85 ? 204 PRO A CD 1 ATOM 4836 N N . VAL C 1 204 ? 95.807 -56.926 -23.995 1.00 35.29 ? 205 VAL A N 1 ATOM 4837 C CA . VAL C 1 204 ? 94.744 -57.890 -24.237 1.00 40.28 ? 205 VAL A CA 1 ATOM 4838 C C . VAL C 1 204 ? 94.086 -57.667 -25.593 1.00 42.92 ? 205 VAL A C 1 ATOM 4839 O O . VAL C 1 204 ? 93.646 -56.563 -25.907 1.00 44.04 ? 205 VAL A O 1 ATOM 4840 C CB . VAL C 1 204 ? 93.675 -57.823 -23.135 1.00 41.91 ? 205 VAL A CB 1 ATOM 4841 C CG1 . VAL C 1 204 ? 92.508 -58.736 -23.467 1.00 44.73 ? 205 VAL A CG1 1 ATOM 4842 C CG2 . VAL C 1 204 ? 94.288 -58.200 -21.795 1.00 52.51 ? 205 VAL A CG2 1 ATOM 4843 N N . THR C 1 205 ? 94.028 -58.723 -26.394 1.00 39.83 ? 206 THR A N 1 ATOM 4844 C CA . THR C 1 205 ? 93.410 -58.645 -27.708 1.00 38.83 ? 206 THR A CA 1 ATOM 4845 C C . THR C 1 205 ? 92.087 -59.398 -27.750 1.00 39.68 ? 206 THR A C 1 ATOM 4846 O O . THR C 1 205 ? 92.025 -60.586 -27.440 1.00 37.95 ? 206 THR A O 1 ATOM 4847 C CB . THR C 1 205 ? 94.334 -59.204 -28.802 1.00 38.74 ? 206 THR A CB 1 ATOM 4848 O OG1 . THR C 1 205 ? 95.450 -58.325 -28.981 1.00 40.19 ? 206 THR A OG1 1 ATOM 4849 C CG2 . THR C 1 205 ? 93.582 -59.319 -30.119 1.00 47.49 ? 206 THR A CG2 1 ATOM 4850 N N . LYS C 1 206 ? 91.026 -58.689 -28.112 1.00 31.04 ? 207 LYS A N 1 ATOM 4851 C CA . LYS C 1 206 ? 89.752 -59.320 -28.411 1.00 39.17 ? 207 LYS A CA 1 ATOM 4852 C C . LYS C 1 206 ? 89.532 -59.225 -29.912 1.00 40.79 ? 207 LYS A C 1 ATOM 4853 O O . LYS C 1 206 ? 89.813 -58.192 -30.515 1.00 48.60 ? 207 LYS A O 1 ATOM 4854 C CB . LYS C 1 206 ? 88.611 -58.655 -27.640 1.00 40.40 ? 207 LYS A CB 1 ATOM 4855 C CG . LYS C 1 206 ? 88.652 -58.905 -26.143 1.00 42.14 ? 207 LYS A CG 1 ATOM 4856 C CD . LYS C 1 206 ? 88.319 -60.354 -25.813 1.00 49.76 ? 207 LYS A CD 1 ATOM 4857 C CE . LYS C 1 206 ? 88.370 -60.612 -24.311 1.00 50.59 ? 207 LYS A CE 1 ATOM 4858 N NZ . LYS C 1 206 ? 87.892 -61.982 -23.963 1.00 48.16 ? 207 LYS A NZ 1 ATOM 4859 N N . SER C 1 207 ? 89.050 -60.301 -30.523 1.00 41.67 ? 208 SER A N 1 ATOM 4860 C CA . SER C 1 207 ? 88.905 -60.313 -31.973 1.00 38.78 ? 208 SER A CA 1 ATOM 4861 C C . SER C 1 207 ? 87.721 -61.138 -32.469 1.00 38.46 ? 208 SER A C 1 ATOM 4862 O O . SER C 1 207 ? 87.099 -61.888 -31.714 1.00 35.47 ? 208 SER A O 1 ATOM 4863 C CB . SER C 1 207 ? 90.192 -60.830 -32.623 1.00 39.68 ? 208 SER A CB 1 ATOM 4864 O OG . SER C 1 207 ? 90.344 -62.223 -32.423 1.00 45.14 ? 208 SER A OG 1 ATOM 4865 N N . PHE C 1 208 ? 87.409 -60.966 -33.750 1.00 34.36 ? 209 PHE A N 1 ATOM 4866 C CA . PHE C 1 208 ? 86.444 -61.811 -34.436 1.00 34.44 ? 209 PHE A CA 1 ATOM 4867 C C . PHE C 1 208 ? 86.799 -61.934 -35.912 1.00 38.73 ? 209 PHE A C 1 ATOM 4868 O O . PHE C 1 208 ? 87.579 -61.143 -36.449 1.00 34.90 ? 209 PHE A O 1 ATOM 4869 C CB . PHE C 1 208 ? 85.019 -61.272 -34.280 1.00 28.06 ? 209 PHE A CB 1 ATOM 4870 C CG . PHE C 1 208 ? 84.747 -60.002 -35.050 1.00 29.45 ? 209 PHE A CG 1 ATOM 4871 C CD1 . PHE C 1 208 ? 84.270 -60.049 -36.353 1.00 31.14 ? 209 PHE A CD1 1 ATOM 4872 C CD2 . PHE C 1 208 ? 84.941 -58.764 -34.460 1.00 27.58 ? 209 PHE A CD2 1 ATOM 4873 C CE1 . PHE C 1 208 ? 84.013 -58.887 -37.061 1.00 28.93 ? 209 PHE A CE1 1 ATOM 4874 C CE2 . PHE C 1 208 ? 84.683 -57.597 -35.161 1.00 32.26 ? 209 PHE A CE2 1 ATOM 4875 C CZ . PHE C 1 208 ? 84.219 -57.660 -36.465 1.00 28.40 ? 209 PHE A CZ 1 ATOM 4876 N N . ASN C 1 209 ? 86.223 -62.939 -36.558 1.00 44.23 ? 210 ASN A N 1 ATOM 4877 C CA . ASN C 1 209 ? 86.345 -63.093 -37.997 1.00 45.76 ? 210 ASN A CA 1 ATOM 4878 C C . ASN C 1 209 ? 85.018 -62.770 -38.658 1.00 42.82 ? 210 ASN A C 1 ATOM 4879 O O . ASN C 1 209 ? 83.973 -63.257 -38.229 1.00 49.47 ? 210 ASN A O 1 ATOM 4880 C CB . ASN C 1 209 ? 86.790 -64.512 -38.362 1.00 52.14 ? 210 ASN A CB 1 ATOM 4881 C CG . ASN C 1 209 ? 88.194 -64.826 -37.881 1.00 58.40 ? 210 ASN A CG 1 ATOM 4882 O OD1 . ASN C 1 209 ? 89.088 -63.980 -37.937 1.00 61.60 ? 210 ASN A OD1 1 ATOM 4883 N ND2 . ASN C 1 209 ? 88.394 -66.047 -37.403 1.00 62.88 ? 210 ASN A ND2 1 ATOM 4884 N N . ARG C 1 210 ? 85.053 -61.937 -39.689 1.00 38.66 ? 211 ARG A N 1 ATOM 4885 C CA . ARG C 1 210 ? 83.846 -61.646 -40.450 1.00 39.17 ? 211 ARG A CA 1 ATOM 4886 C C . ARG C 1 210 ? 83.331 -62.934 -41.091 1.00 45.60 ? 211 ARG A C 1 ATOM 4887 O O . ARG C 1 210 ? 82.134 -63.234 -41.074 1.00 49.36 ? 211 ARG A O 1 ATOM 4888 C CB . ARG C 1 210 ? 84.119 -60.578 -41.512 1.00 34.25 ? 211 ARG A CB 1 ATOM 4889 C CG . ARG C 1 210 ? 82.916 -60.232 -42.369 1.00 36.65 ? 211 ARG A CG 1 ATOM 4890 C CD . ARG C 1 210 ? 83.303 -59.286 -43.494 1.00 37.16 ? 211 ARG A CD 1 ATOM 4891 N NE . ARG C 1 210 ? 84.478 -59.764 -44.216 1.00 39.75 ? 211 ARG A NE 1 ATOM 4892 C CZ . ARG C 1 210 ? 84.464 -60.777 -45.077 1.00 40.30 ? 211 ARG A CZ 1 ATOM 4893 N NH1 . ARG C 1 210 ? 83.335 -61.427 -45.325 1.00 38.52 ? 211 ARG A NH1 1 ATOM 4894 N NH2 . ARG C 1 210 ? 85.582 -61.146 -45.689 1.00 40.62 ? 211 ARG A NH2 1 ATOM 4895 O OXT . ARG C 1 210 ? 84.121 -63.720 -41.618 1.00 45.36 ? 211 ARG A OXT 1 ATOM 4896 N N . GLN D 2 1 ? 63.613 -20.091 -0.951 1.00 65.40 ? 1 GLN B N 1 ATOM 4897 C CA . GLN D 2 1 ? 64.635 -20.180 -1.979 1.00 54.94 ? 1 GLN B CA 1 ATOM 4898 C C . GLN D 2 1 ? 64.171 -19.584 -3.288 1.00 44.93 ? 1 GLN B C 1 ATOM 4899 O O . GLN D 2 1 ? 63.004 -19.225 -3.463 1.00 38.28 ? 1 GLN B O 1 ATOM 4900 C CB . GLN D 2 1 ? 65.063 -21.631 -2.208 1.00 58.53 ? 1 GLN B CB 1 ATOM 4901 C CG . GLN D 2 1 ? 65.939 -22.204 -1.116 1.00 62.21 ? 1 GLN B CG 1 ATOM 4902 C CD . GLN D 2 1 ? 67.067 -21.277 -0.740 1.00 62.93 ? 1 GLN B CD 1 ATOM 4903 O OE1 . GLN D 2 1 ? 66.892 -20.364 0.069 1.00 68.74 ? 1 GLN B OE1 1 ATOM 4904 N NE2 . GLN D 2 1 ? 68.238 -21.504 -1.321 1.00 63.55 ? 1 GLN B NE2 1 ATOM 4905 N N . VAL D 2 2 ? 65.116 -19.501 -4.209 1.00 39.30 ? 2 VAL B N 1 ATOM 4906 C CA . VAL D 2 2 ? 64.908 -18.867 -5.487 1.00 29.97 ? 2 VAL B CA 1 ATOM 4907 C C . VAL D 2 2 ? 65.395 -19.808 -6.566 1.00 33.73 ? 2 VAL B C 1 ATOM 4908 O O . VAL D 2 2 ? 66.449 -20.431 -6.424 1.00 31.07 ? 2 VAL B O 1 ATOM 4909 C CB . VAL D 2 2 ? 65.659 -17.530 -5.571 1.00 26.00 ? 2 VAL B CB 1 ATOM 4910 C CG1 . VAL D 2 2 ? 65.403 -16.849 -6.904 1.00 27.19 ? 2 VAL B CG1 1 ATOM 4911 C CG2 . VAL D 2 2 ? 65.257 -16.631 -4.412 1.00 23.66 ? 2 VAL B CG2 1 ATOM 4912 N N . GLN D 2 3 ? 64.619 -19.932 -7.634 1.00 26.69 ? 3 GLN B N 1 ATOM 4913 C CA . GLN D 2 3 ? 65.003 -20.771 -8.749 1.00 24.84 ? 3 GLN B CA 1 ATOM 4914 C C . GLN D 2 3 ? 65.030 -19.933 -10.019 1.00 28.21 ? 3 GLN B C 1 ATOM 4915 O O . GLN D 2 3 ? 64.153 -19.095 -10.229 1.00 27.91 ? 3 GLN B O 1 ATOM 4916 C CB . GLN D 2 3 ? 64.034 -21.947 -8.887 1.00 34.69 ? 3 GLN B CB 1 ATOM 4917 C CG . GLN D 2 3 ? 64.416 -22.945 -9.963 1.00 54.10 ? 3 GLN B CG 1 ATOM 4918 C CD . GLN D 2 3 ? 63.336 -23.982 -10.203 1.00 68.20 ? 3 GLN B CD 1 ATOM 4919 O OE1 . GLN D 2 3 ? 62.250 -23.907 -9.626 1.00 73.59 ? 3 GLN B OE1 1 ATOM 4920 N NE2 . GLN D 2 3 ? 63.627 -24.955 -11.060 1.00 71.01 ? 3 GLN B NE2 1 ATOM 4921 N N . LEU D 2 4 ? 66.049 -20.130 -10.849 1.00 25.44 ? 4 LEU B N 1 ATOM 4922 C CA . LEU D 2 4 ? 66.050 -19.533 -12.178 1.00 21.97 ? 4 LEU B CA 1 ATOM 4923 C C . LEU D 2 4 ? 65.765 -20.627 -13.195 1.00 27.99 ? 4 LEU B C 1 ATOM 4924 O O . LEU D 2 4 ? 66.435 -21.658 -13.201 1.00 26.13 ? 4 LEU B O 1 ATOM 4925 C CB . LEU D 2 4 ? 67.381 -18.860 -12.498 1.00 18.72 ? 4 LEU B CB 1 ATOM 4926 C CG . LEU D 2 4 ? 67.995 -17.885 -11.496 1.00 25.11 ? 4 LEU B CG 1 ATOM 4927 C CD1 . LEU D 2 4 ? 69.062 -17.038 -12.179 1.00 21.92 ? 4 LEU B CD1 1 ATOM 4928 C CD2 . LEU D 2 4 ? 66.938 -17.016 -10.868 1.00 19.21 ? 4 LEU B CD2 1 ATOM 4929 N N . GLN D 2 5 ? 64.770 -20.417 -14.046 1.00 29.98 ? 5 GLN B N 1 ATOM 4930 C CA . GLN D 2 5 ? 64.450 -21.413 -15.061 1.00 29.15 ? 5 GLN B CA 1 ATOM 4931 C C . GLN D 2 5 ? 64.665 -20.839 -16.451 1.00 31.32 ? 5 GLN B C 1 ATOM 4932 O O . GLN D 2 5 ? 64.341 -19.680 -16.707 1.00 26.55 ? 5 GLN B O 1 ATOM 4933 C CB . GLN D 2 5 ? 63.015 -21.909 -14.893 1.00 37.58 ? 5 GLN B CB 1 ATOM 4934 C CG . GLN D 2 5 ? 62.794 -22.715 -13.620 1.00 51.52 ? 5 GLN B CG 1 ATOM 4935 C CD . GLN D 2 5 ? 61.328 -23.002 -13.361 1.00 68.12 ? 5 GLN B CD 1 ATOM 4936 O OE1 . GLN D 2 5 ? 60.555 -23.212 -14.295 1.00 78.75 ? 5 GLN B OE1 1 ATOM 4937 N NE2 . GLN D 2 5 ? 60.934 -22.998 -12.088 1.00 67.94 ? 5 GLN B NE2 1 ATOM 4938 N N . GLN D 2 6 ? 65.221 -21.654 -17.342 1.00 26.93 ? 6 GLN B N 1 ATOM 4939 C CA . GLN D 2 6 ? 65.615 -21.187 -18.666 1.00 30.42 ? 6 GLN B CA 1 ATOM 4940 C C . GLN D 2 6 ? 64.832 -21.862 -19.774 1.00 27.76 ? 6 GLN B C 1 ATOM 4941 O O . GLN D 2 6 ? 64.515 -23.043 -19.680 1.00 25.57 ? 6 GLN B O 1 ATOM 4942 C CB . GLN D 2 6 ? 67.107 -21.433 -18.898 1.00 31.15 ? 6 GLN B CB 1 ATOM 4943 C CG . GLN D 2 6 ? 67.993 -20.996 -17.755 1.00 32.34 ? 6 GLN B CG 1 ATOM 4944 C CD . GLN D 2 6 ? 69.455 -20.950 -18.140 1.00 33.36 ? 6 GLN B CD 1 ATOM 4945 O OE1 . GLN D 2 6 ? 70.339 -21.134 -17.300 1.00 36.44 ? 6 GLN B OE1 1 ATOM 4946 N NE2 . GLN D 2 6 ? 69.721 -20.695 -19.416 1.00 27.21 ? 6 GLN B NE2 1 ATOM 4947 N N . TRP D 2 7 ? 64.540 -21.108 -20.831 1.00 21.58 ? 7 TRP B N 1 ATOM 4948 C CA . TRP D 2 7 ? 63.980 -21.687 -22.044 1.00 26.88 ? 7 TRP B CA 1 ATOM 4949 C C . TRP D 2 7 ? 64.393 -20.866 -23.262 1.00 32.27 ? 7 TRP B C 1 ATOM 4950 O O . TRP D 2 7 ? 65.037 -19.825 -23.129 1.00 27.67 ? 7 TRP B O 1 ATOM 4951 C CB . TRP D 2 7 ? 62.454 -21.796 -21.951 1.00 27.28 ? 7 TRP B CB 1 ATOM 4952 C CG . TRP D 2 7 ? 61.745 -20.503 -21.670 1.00 34.65 ? 7 TRP B CG 1 ATOM 4953 C CD1 . TRP D 2 7 ? 61.266 -19.612 -22.589 1.00 29.97 ? 7 TRP B CD1 1 ATOM 4954 C CD2 . TRP D 2 7 ? 61.419 -19.966 -20.382 1.00 35.80 ? 7 TRP B CD2 1 ATOM 4955 N NE1 . TRP D 2 7 ? 60.667 -18.550 -21.950 1.00 31.23 ? 7 TRP B NE1 1 ATOM 4956 C CE2 . TRP D 2 7 ? 60.746 -18.745 -20.596 1.00 31.27 ? 7 TRP B CE2 1 ATOM 4957 C CE3 . TRP D 2 7 ? 61.632 -20.398 -19.068 1.00 34.07 ? 7 TRP B CE3 1 ATOM 4958 C CZ2 . TRP D 2 7 ? 60.283 -17.953 -19.545 1.00 31.25 ? 7 TRP B CZ2 1 ATOM 4959 C CZ3 . TRP D 2 7 ? 61.173 -19.610 -18.027 1.00 36.31 ? 7 TRP B CZ3 1 ATOM 4960 C CH2 . TRP D 2 7 ? 60.508 -18.401 -18.272 1.00 32.80 ? 7 TRP B CH2 1 ATOM 4961 N N . GLY D 2 8 ? 64.026 -21.352 -24.444 1.00 30.24 ? 8 GLY B N 1 ATOM 4962 C CA . GLY D 2 8 ? 64.453 -20.758 -25.698 1.00 26.72 ? 8 GLY B CA 1 ATOM 4963 C C . GLY D 2 8 ? 64.988 -21.836 -26.623 1.00 29.57 ? 8 GLY B C 1 ATOM 4964 O O . GLY D 2 8 ? 65.479 -22.872 -26.165 1.00 31.19 ? 8 GLY B O 1 ATOM 4965 N N . ALA D 2 9 ? 64.891 -21.601 -27.927 1.00 34.63 ? 9 ALA B N 1 ATOM 4966 C CA . ALA D 2 9 ? 65.360 -22.575 -28.909 1.00 36.61 ? 9 ALA B CA 1 ATOM 4967 C C . ALA D 2 9 ? 66.881 -22.601 -28.962 1.00 36.17 ? 9 ALA B C 1 ATOM 4968 O O . ALA D 2 9 ? 67.518 -21.573 -29.188 1.00 38.89 ? 9 ALA B O 1 ATOM 4969 C CB . ALA D 2 9 ? 64.783 -22.264 -30.285 1.00 32.06 ? 9 ALA B CB 1 ATOM 4970 N N . GLY D 2 10 ? 67.460 -23.780 -28.760 1.00 34.05 ? 10 GLY B N 1 ATOM 4971 C CA . GLY D 2 10 ? 68.904 -23.923 -28.724 1.00 37.73 ? 10 GLY B CA 1 ATOM 4972 C C . GLY D 2 10 ? 69.560 -24.323 -30.036 1.00 47.12 ? 10 GLY B C 1 ATOM 4973 O O . GLY D 2 10 ? 70.772 -24.181 -30.194 1.00 57.14 ? 10 GLY B O 1 ATOM 4974 N N . LEU D 2 11 ? 68.774 -24.822 -30.983 1.00 39.52 ? 11 LEU B N 1 ATOM 4975 C CA . LEU D 2 11 ? 69.334 -25.249 -32.263 1.00 38.30 ? 11 LEU B CA 1 ATOM 4976 C C . LEU D 2 11 ? 69.302 -24.137 -33.307 1.00 36.40 ? 11 LEU B C 1 ATOM 4977 O O . LEU D 2 11 ? 68.232 -23.667 -33.691 1.00 30.18 ? 11 LEU B O 1 ATOM 4978 C CB . LEU D 2 11 ? 68.592 -26.469 -32.799 1.00 37.22 ? 11 LEU B CB 1 ATOM 4979 C CG . LEU D 2 11 ? 69.078 -26.895 -34.184 1.00 43.39 ? 11 LEU B CG 1 ATOM 4980 C CD1 . LEU D 2 11 ? 70.560 -27.250 -34.141 1.00 38.78 ? 11 LEU B CD1 1 ATOM 4981 C CD2 . LEU D 2 11 ? 68.253 -28.055 -34.707 1.00 40.71 ? 11 LEU B CD2 1 ATOM 4982 N N . LEU D 2 12 ? 70.479 -23.732 -33.777 1.00 34.73 ? 12 LEU B N 1 ATOM 4983 C CA . LEU D 2 12 ? 70.575 -22.618 -34.711 1.00 34.00 ? 12 LEU B CA 1 ATOM 4984 C C . LEU D 2 12 ? 71.488 -22.906 -35.896 1.00 35.82 ? 12 LEU B C 1 ATOM 4985 O O . LEU D 2 12 ? 72.427 -23.697 -35.801 1.00 41.24 ? 12 LEU B O 1 ATOM 4986 C CB . LEU D 2 12 ? 71.084 -21.367 -33.995 1.00 34.18 ? 12 LEU B CB 1 ATOM 4987 C CG . LEU D 2 12 ? 70.336 -20.880 -32.756 1.00 37.59 ? 12 LEU B CG 1 ATOM 4988 C CD1 . LEU D 2 12 ? 71.112 -19.743 -32.125 1.00 33.34 ? 12 LEU B CD1 1 ATOM 4989 C CD2 . LEU D 2 12 ? 68.922 -20.443 -33.106 1.00 32.42 ? 12 LEU B CD2 1 ATOM 4990 N N . LYS D 2 13 ? 71.210 -22.238 -37.009 1.00 25.20 ? 13 LYS B N 1 ATOM 4991 C CA . LYS D 2 13 ? 72.101 -22.248 -38.157 1.00 31.80 ? 13 LYS B CA 1 ATOM 4992 C C . LYS D 2 13 ? 72.904 -20.955 -38.168 1.00 34.40 ? 13 LYS B C 1 ATOM 4993 O O . LYS D 2 13 ? 72.427 -19.931 -37.678 1.00 34.86 ? 13 LYS B O 1 ATOM 4994 C CB . LYS D 2 13 ? 71.307 -22.418 -39.457 1.00 36.46 ? 13 LYS B CB 1 ATOM 4995 C CG . LYS D 2 13 ? 70.943 -23.864 -39.739 1.00 44.62 ? 13 LYS B CG 1 ATOM 4996 C CD . LYS D 2 13 ? 69.748 -24.002 -40.667 1.00 55.05 ? 13 LYS B CD 1 ATOM 4997 C CE . LYS D 2 13 ? 69.500 -25.474 -40.989 1.00 62.86 ? 13 LYS B CE 1 ATOM 4998 N NZ . LYS D 2 13 ? 68.149 -25.715 -41.566 1.00 70.69 ? 13 LYS B NZ 1 ATOM 4999 N N . PRO D 2 14 ? 74.132 -21.002 -38.713 1.00 36.44 ? 14 PRO B N 1 ATOM 5000 C CA . PRO D 2 14 ? 74.970 -19.803 -38.813 1.00 33.82 ? 14 PRO B CA 1 ATOM 5001 C C . PRO D 2 14 ? 74.206 -18.610 -39.376 1.00 37.06 ? 14 PRO B C 1 ATOM 5002 O O . PRO D 2 14 ? 73.361 -18.788 -40.260 1.00 42.57 ? 14 PRO B O 1 ATOM 5003 C CB . PRO D 2 14 ? 76.089 -20.237 -39.763 1.00 27.86 ? 14 PRO B CB 1 ATOM 5004 C CG . PRO D 2 14 ? 76.195 -21.712 -39.554 1.00 26.11 ? 14 PRO B CG 1 ATOM 5005 C CD . PRO D 2 14 ? 74.797 -22.193 -39.276 1.00 27.75 ? 14 PRO B CD 1 ATOM 5006 N N . SER D 2 15 ? 74.500 -17.434 -38.823 1.00 34.83 ? 15 SER B N 1 ATOM 5007 C CA . SER D 2 15 ? 73.905 -16.136 -39.175 1.00 35.97 ? 15 SER B CA 1 ATOM 5008 C C . SER D 2 15 ? 72.561 -15.880 -38.479 1.00 43.17 ? 15 SER B C 1 ATOM 5009 O O . SER D 2 15 ? 72.082 -14.747 -38.476 1.00 44.97 ? 15 SER B O 1 ATOM 5010 C CB . SER D 2 15 ? 73.738 -15.978 -40.695 1.00 30.76 ? 15 SER B CB 1 ATOM 5011 O OG . SER D 2 15 ? 72.555 -16.615 -41.154 1.00 34.90 ? 15 SER B OG 1 ATOM 5012 N N . GLU D 2 16 ? 71.963 -16.905 -37.875 1.00 40.99 ? 16 GLU B N 1 ATOM 5013 C CA . GLU D 2 16 ? 70.690 -16.711 -37.177 1.00 36.07 ? 16 GLU B CA 1 ATOM 5014 C C . GLU D 2 16 ? 70.882 -16.035 -35.819 1.00 35.05 ? 16 GLU B C 1 ATOM 5015 O O . GLU D 2 16 ? 71.999 -15.682 -35.437 1.00 34.18 ? 16 GLU B O 1 ATOM 5016 C CB . GLU D 2 16 ? 69.951 -18.041 -37.007 1.00 33.68 ? 16 GLU B CB 1 ATOM 5017 C CG . GLU D 2 16 ? 69.235 -18.507 -38.274 1.00 40.30 ? 16 GLU B CG 1 ATOM 5018 C CD . GLU D 2 16 ? 68.666 -19.917 -38.166 1.00 45.73 ? 16 GLU B CD 1 ATOM 5019 O OE1 . GLU D 2 16 ? 68.702 -20.504 -37.063 1.00 40.22 ? 16 GLU B OE1 1 ATOM 5020 O OE2 . GLU D 2 16 ? 68.182 -20.444 -39.191 1.00 49.93 ? 16 GLU B OE2 1 ATOM 5021 N N . THR D 2 17 ? 69.783 -15.852 -35.096 1.00 32.36 ? 17 THR B N 1 ATOM 5022 C CA . THR D 2 17 ? 69.813 -15.143 -33.824 1.00 29.66 ? 17 THR B CA 1 ATOM 5023 C C . THR D 2 17 ? 69.411 -16.040 -32.661 1.00 28.37 ? 17 THR B C 1 ATOM 5024 O O . THR D 2 17 ? 68.334 -16.637 -32.662 1.00 30.25 ? 17 THR B O 1 ATOM 5025 C CB . THR D 2 17 ? 68.888 -13.905 -33.849 1.00 32.98 ? 17 THR B CB 1 ATOM 5026 O OG1 . THR D 2 17 ? 69.394 -12.950 -34.788 1.00 37.24 ? 17 THR B OG1 1 ATOM 5027 C CG2 . THR D 2 17 ? 68.814 -13.252 -32.472 1.00 31.85 ? 17 THR B CG2 1 ATOM 5028 N N . LEU D 2 18 ? 70.294 -16.129 -31.673 1.00 29.33 ? 18 LEU B N 1 ATOM 5029 C CA . LEU D 2 18 ? 70.005 -16.834 -30.433 1.00 26.30 ? 18 LEU B CA 1 ATOM 5030 C C . LEU D 2 18 ? 69.114 -15.982 -29.538 1.00 28.67 ? 18 LEU B C 1 ATOM 5031 O O . LEU D 2 18 ? 69.422 -14.820 -29.274 1.00 25.52 ? 18 LEU B O 1 ATOM 5032 C CB . LEU D 2 18 ? 71.307 -17.190 -29.708 1.00 24.59 ? 18 LEU B CB 1 ATOM 5033 C CG . LEU D 2 18 ? 71.176 -17.774 -28.302 1.00 22.88 ? 18 LEU B CG 1 ATOM 5034 C CD1 . LEU D 2 18 ? 70.434 -19.102 -28.333 1.00 26.76 ? 18 LEU B CD1 1 ATOM 5035 C CD2 . LEU D 2 18 ? 72.548 -17.928 -27.671 1.00 22.75 ? 18 LEU B CD2 1 ATOM 5036 N N . SER D 2 19 ? 68.006 -16.557 -29.084 1.00 27.12 ? 19 SER B N 1 ATOM 5037 C CA . SER D 2 19 ? 67.109 -15.865 -28.163 1.00 24.10 ? 19 SER B CA 1 ATOM 5038 C C . SER D 2 19 ? 66.748 -16.751 -26.982 1.00 27.49 ? 19 SER B C 1 ATOM 5039 O O . SER D 2 19 ? 66.027 -17.737 -27.135 1.00 32.96 ? 19 SER B O 1 ATOM 5040 C CB . SER D 2 19 ? 65.836 -15.416 -28.879 1.00 28.25 ? 19 SER B CB 1 ATOM 5041 O OG . SER D 2 19 ? 66.115 -14.380 -29.798 1.00 40.68 ? 19 SER B OG 1 ATOM 5042 N N . LEU D 2 20 ? 67.250 -16.394 -25.806 1.00 23.63 ? 20 LEU B N 1 ATOM 5043 C CA . LEU D 2 20 ? 67.001 -17.178 -24.600 1.00 23.85 ? 20 LEU B CA 1 ATOM 5044 C C . LEU D 2 20 ? 66.298 -16.343 -23.543 1.00 22.16 ? 20 LEU B C 1 ATOM 5045 O O . LEU D 2 20 ? 66.484 -15.130 -23.478 1.00 20.50 ? 20 LEU B O 1 ATOM 5046 C CB . LEU D 2 20 ? 68.311 -17.725 -24.035 1.00 17.12 ? 20 LEU B CB 1 ATOM 5047 C CG . LEU D 2 20 ? 69.075 -18.721 -24.902 1.00 25.80 ? 20 LEU B CG 1 ATOM 5048 C CD1 . LEU D 2 20 ? 70.387 -19.085 -24.237 1.00 25.13 ? 20 LEU B CD1 1 ATOM 5049 C CD2 . LEU D 2 20 ? 68.243 -19.964 -25.153 1.00 21.20 ? 20 LEU B CD2 1 ATOM 5050 N N . THR D 2 21 ? 65.501 -16.993 -22.706 1.00 28.23 ? 21 THR B N 1 ATOM 5051 C CA . THR D 2 21 ? 64.817 -16.290 -21.630 1.00 24.92 ? 21 THR B CA 1 ATOM 5052 C C . THR D 2 21 ? 65.039 -17.017 -20.307 1.00 27.40 ? 21 THR B C 1 ATOM 5053 O O . THR D 2 21 ? 65.173 -18.240 -20.272 1.00 23.15 ? 21 THR B O 1 ATOM 5054 C CB . THR D 2 21 ? 63.312 -16.151 -21.927 1.00 29.84 ? 21 THR B CB 1 ATOM 5055 O OG1 . THR D 2 21 ? 63.142 -15.399 -23.135 1.00 35.62 ? 21 THR B OG1 1 ATOM 5056 C CG2 . THR D 2 21 ? 62.584 -15.426 -20.797 1.00 27.13 ? 21 THR B CG2 1 ATOM 5057 N N . CYS D 2 22 ? 65.110 -16.244 -19.229 1.00 22.39 ? 22 CYS B N 1 ATOM 5058 C CA . CYS D 2 22 ? 65.292 -16.770 -17.886 1.00 24.24 ? 22 CYS B CA 1 ATOM 5059 C C . CYS D 2 22 ? 64.158 -16.254 -16.997 1.00 28.29 ? 22 CYS B C 1 ATOM 5060 O O . CYS D 2 22 ? 63.942 -15.051 -16.897 1.00 29.79 ? 22 CYS B O 1 ATOM 5061 C CB . CYS D 2 22 ? 66.661 -16.344 -17.334 1.00 26.62 ? 22 CYS B CB 1 ATOM 5062 S SG . CYS D 2 22 ? 67.249 -17.172 -15.822 1.00 51.18 ? 22 CYS B SG 1 ATOM 5063 N N . GLY D 2 23 ? 63.420 -17.162 -16.372 1.00 24.97 ? 23 GLY B N 1 ATOM 5064 C CA . GLY D 2 23 ? 62.404 -16.772 -15.413 1.00 16.97 ? 23 GLY B CA 1 ATOM 5065 C C . GLY D 2 23 ? 62.976 -16.826 -14.007 1.00 24.43 ? 23 GLY B C 1 ATOM 5066 O O . GLY D 2 23 ? 63.795 -17.689 -13.706 1.00 27.88 ? 23 GLY B O 1 ATOM 5067 N N . VAL D 2 24 ? 62.558 -15.895 -13.154 1.00 19.95 ? 24 VAL B N 1 ATOM 5068 C CA . VAL D 2 24 ? 62.988 -15.868 -11.762 1.00 20.13 ? 24 VAL B CA 1 ATOM 5069 C C . VAL D 2 24 ? 61.817 -16.139 -10.824 1.00 21.67 ? 24 VAL B C 1 ATOM 5070 O O . VAL D 2 24 ? 60.842 -15.389 -10.806 1.00 26.02 ? 24 VAL B O 1 ATOM 5071 C CB . VAL D 2 24 ? 63.616 -14.515 -11.387 1.00 21.45 ? 24 VAL B CB 1 ATOM 5072 C CG1 . VAL D 2 24 ? 64.083 -14.537 -9.946 1.00 18.00 ? 24 VAL B CG1 1 ATOM 5073 C CG2 . VAL D 2 24 ? 64.773 -14.183 -12.323 1.00 31.64 ? 24 VAL B CG2 1 ATOM 5074 N N . TYR D 2 25 ? 61.925 -17.199 -10.033 1.00 19.32 ? 25 TYR B N 1 ATOM 5075 C CA . TYR D 2 25 ? 60.844 -17.603 -9.145 1.00 18.17 ? 25 TYR B CA 1 ATOM 5076 C C . TYR D 2 25 ? 61.311 -17.660 -7.690 1.00 22.01 ? 25 TYR B C 1 ATOM 5077 O O . TYR D 2 25 ? 62.272 -18.353 -7.357 1.00 24.81 ? 25 TYR B O 1 ATOM 5078 C CB . TYR D 2 25 ? 60.283 -18.956 -9.600 1.00 22.35 ? 25 TYR B CB 1 ATOM 5079 C CG . TYR D 2 25 ? 59.908 -18.949 -11.067 1.00 21.92 ? 25 TYR B CG 1 ATOM 5080 C CD1 . TYR D 2 25 ? 58.655 -18.518 -11.483 1.00 29.19 ? 25 TYR B CD1 1 ATOM 5081 C CD2 . TYR D 2 25 ? 60.818 -19.344 -12.040 1.00 27.05 ? 25 TYR B CD2 1 ATOM 5082 C CE1 . TYR D 2 25 ? 58.313 -18.496 -12.824 1.00 28.92 ? 25 TYR B CE1 1 ATOM 5083 C CE2 . TYR D 2 25 ? 60.486 -19.321 -13.384 1.00 21.69 ? 25 TYR B CE2 1 ATOM 5084 C CZ . TYR D 2 25 ? 59.235 -18.896 -13.767 1.00 27.60 ? 25 TYR B CZ 1 ATOM 5085 O OH . TYR D 2 25 ? 58.903 -18.874 -15.102 1.00 37.64 ? 25 TYR B OH 1 ATOM 5086 N N . GLY D 2 26 ? 60.628 -16.917 -6.827 1.00 20.32 ? 26 GLY B N 1 ATOM 5087 C CA . GLY D 2 26 ? 60.987 -16.849 -5.423 1.00 21.74 ? 26 GLY B CA 1 ATOM 5088 C C . GLY D 2 26 ? 61.568 -15.489 -5.099 1.00 28.04 ? 26 GLY B C 1 ATOM 5089 O O . GLY D 2 26 ? 61.807 -15.152 -3.936 1.00 28.35 ? 26 GLY B O 1 ATOM 5090 N N . GLU D 2 27 ? 61.783 -14.701 -6.146 1.00 29.10 ? 27 GLU B N 1 ATOM 5091 C CA . GLU D 2 27 ? 62.404 -13.391 -6.019 1.00 30.20 ? 27 GLU B CA 1 ATOM 5092 C C . GLU D 2 27 ? 61.970 -12.476 -7.162 1.00 27.21 ? 27 GLU B C 1 ATOM 5093 O O . GLU D 2 27 ? 61.593 -12.943 -8.235 1.00 24.85 ? 27 GLU B O 1 ATOM 5094 C CB . GLU D 2 27 ? 63.929 -13.533 -6.005 1.00 30.34 ? 27 GLU B CB 1 ATOM 5095 C CG . GLU D 2 27 ? 64.695 -12.266 -5.673 1.00 35.90 ? 27 GLU B CG 1 ATOM 5096 C CD . GLU D 2 27 ? 66.195 -12.470 -5.745 1.00 38.68 ? 27 GLU B CD 1 ATOM 5097 O OE1 . GLU D 2 27 ? 66.627 -13.610 -6.006 1.00 43.10 ? 27 GLU B OE1 1 ATOM 5098 O OE2 . GLU D 2 27 ? 66.945 -11.494 -5.547 1.00 41.63 ? 27 GLU B OE2 1 ATOM 5099 N N . SER D 2 28 ? 62.023 -11.174 -6.917 1.00 24.69 ? 28 SER B N 1 ATOM 5100 C CA . SER D 2 28 ? 61.795 -10.172 -7.944 1.00 30.00 ? 28 SER B CA 1 ATOM 5101 C C . SER D 2 28 ? 63.119 -9.771 -8.606 1.00 29.09 ? 28 SER B C 1 ATOM 5102 O O . SER D 2 28 ? 64.196 -10.031 -8.060 1.00 21.88 ? 28 SER B O 1 ATOM 5103 C CB . SER D 2 28 ? 61.102 -8.957 -7.325 1.00 27.87 ? 28 SER B CB 1 ATOM 5104 O OG . SER D 2 28 ? 61.576 -7.759 -7.889 1.00 28.21 ? 28 SER B OG 1 ATOM 5105 N N . LEU D 2 29 ? 63.042 -9.152 -9.783 1.00 26.96 ? 29 LEU B N 1 ATOM 5106 C CA . LEU D 2 29 ? 64.236 -8.662 -10.470 1.00 23.85 ? 29 LEU B CA 1 ATOM 5107 C C . LEU D 2 29 ? 64.839 -7.460 -9.744 1.00 26.49 ? 29 LEU B C 1 ATOM 5108 O O . LEU D 2 29 ? 66.018 -7.133 -9.918 1.00 19.41 ? 29 LEU B O 1 ATOM 5109 C CB . LEU D 2 29 ? 63.911 -8.281 -11.917 1.00 24.26 ? 29 LEU B CB 1 ATOM 5110 C CG . LEU D 2 29 ? 63.625 -9.434 -12.882 1.00 26.97 ? 29 LEU B CG 1 ATOM 5111 C CD1 . LEU D 2 29 ? 63.326 -8.923 -14.284 1.00 26.61 ? 29 LEU B CD1 1 ATOM 5112 C CD2 . LEU D 2 29 ? 64.790 -10.403 -12.906 1.00 26.31 ? 29 LEU B CD2 1 ATOM 5113 N N . SER D 2 30 ? 64.012 -6.815 -8.930 1.00 20.84 ? 30 SER B N 1 ATOM 5114 C CA . SER D 2 30 ? 64.383 -5.601 -8.205 1.00 26.15 ? 30 SER B CA 1 ATOM 5115 C C . SER D 2 30 ? 65.703 -5.689 -7.433 1.00 27.23 ? 30 SER B C 1 ATOM 5116 O O . SER D 2 30 ? 65.967 -6.670 -6.743 1.00 30.91 ? 30 SER B O 1 ATOM 5117 C CB . SER D 2 30 ? 63.252 -5.235 -7.239 1.00 28.78 ? 30 SER B CB 1 ATOM 5118 O OG . SER D 2 30 ? 63.667 -4.272 -6.292 1.00 49.25 ? 30 SER B OG 1 ATOM 5119 N N . GLY D 2 31 ? 66.530 -4.655 -7.566 1.00 27.87 ? 31 GLY B N 1 ATOM 5120 C CA . GLY D 2 31 ? 67.713 -4.498 -6.738 1.00 25.84 ? 31 GLY B CA 1 ATOM 5121 C C . GLY D 2 31 ? 68.889 -5.413 -7.031 1.00 26.88 ? 31 GLY B C 1 ATOM 5122 O O . GLY D 2 31 ? 69.807 -5.526 -6.219 1.00 25.60 ? 31 GLY B O 1 ATOM 5123 N N . HIS D 2 32 ? 68.879 -6.073 -8.183 1.00 19.82 ? 32 HIS B N 1 ATOM 5124 C CA . HIS D 2 32 ? 69.987 -6.957 -8.528 1.00 22.20 ? 32 HIS B CA 1 ATOM 5125 C C . HIS D 2 32 ? 70.371 -6.826 -9.987 1.00 24.42 ? 32 HIS B C 1 ATOM 5126 O O . HIS D 2 32 ? 69.610 -6.286 -10.793 1.00 22.49 ? 32 HIS B O 1 ATOM 5127 C CB . HIS D 2 32 ? 69.638 -8.421 -8.231 1.00 21.34 ? 32 HIS B CB 1 ATOM 5128 C CG . HIS D 2 32 ? 69.363 -8.697 -6.785 1.00 27.92 ? 32 HIS B CG 1 ATOM 5129 N ND1 . HIS D 2 32 ? 68.173 -8.360 -6.179 1.00 26.95 ? 32 HIS B ND1 1 ATOM 5130 C CD2 . HIS D 2 32 ? 70.126 -9.277 -5.828 1.00 28.67 ? 32 HIS B CD2 1 ATOM 5131 C CE1 . HIS D 2 32 ? 68.215 -8.719 -4.906 1.00 29.55 ? 32 HIS B CE1 1 ATOM 5132 N NE2 . HIS D 2 32 ? 69.385 -9.279 -4.669 1.00 30.13 ? 32 HIS B NE2 1 ATOM 5133 N N . TYR D 2 33 ? 71.555 -7.331 -10.317 1.00 17.28 ? 33 TYR B N 1 ATOM 5134 C CA . TYR D 2 33 ? 71.952 -7.504 -11.701 1.00 17.99 ? 33 TYR B CA 1 ATOM 5135 C C . TYR D 2 33 ? 71.572 -8.913 -12.135 1.00 23.46 ? 33 TYR B C 1 ATOM 5136 O O . TYR D 2 33 ? 71.472 -9.827 -11.313 1.00 22.19 ? 33 TYR B O 1 ATOM 5137 C CB . TYR D 2 33 ? 73.453 -7.266 -11.889 1.00 18.15 ? 33 TYR B CB 1 ATOM 5138 C CG . TYR D 2 33 ? 73.895 -5.833 -11.670 1.00 24.22 ? 33 TYR B CG 1 ATOM 5139 C CD1 . TYR D 2 33 ? 74.188 -5.363 -10.393 1.00 22.01 ? 33 TYR B CD1 1 ATOM 5140 C CD2 . TYR D 2 33 ? 74.032 -4.953 -12.741 1.00 22.35 ? 33 TYR B CD2 1 ATOM 5141 C CE1 . TYR D 2 33 ? 74.604 -4.050 -10.183 1.00 22.31 ? 33 TYR B CE1 1 ATOM 5142 C CE2 . TYR D 2 33 ? 74.445 -3.639 -12.543 1.00 20.94 ? 33 TYR B CE2 1 ATOM 5143 C CZ . TYR D 2 33 ? 74.729 -3.198 -11.263 1.00 22.92 ? 33 TYR B CZ 1 ATOM 5144 O OH . TYR D 2 33 ? 75.136 -1.902 -11.058 1.00 31.10 ? 33 TYR B OH 1 ATOM 5145 N N . TRP D 2 34 ? 71.352 -9.081 -13.431 1.00 21.54 ? 34 TRP B N 1 ATOM 5146 C CA . TRP D 2 34 ? 70.953 -10.362 -13.974 1.00 19.84 ? 34 TRP B CA 1 ATOM 5147 C C . TRP D 2 34 ? 71.822 -10.660 -15.176 1.00 21.62 ? 34 TRP B C 1 ATOM 5148 O O . TRP D 2 34 ? 71.949 -9.846 -16.083 1.00 27.52 ? 34 TRP B O 1 ATOM 5149 C CB . TRP D 2 34 ? 69.470 -10.344 -14.307 1.00 18.81 ? 34 TRP B CB 1 ATOM 5150 C CG . TRP D 2 34 ? 68.712 -10.076 -13.068 1.00 18.10 ? 34 TRP B CG 1 ATOM 5151 C CD1 . TRP D 2 34 ? 68.286 -8.863 -12.612 1.00 16.84 ? 34 TRP B CD1 1 ATOM 5152 C CD2 . TRP D 2 34 ? 68.354 -11.033 -12.066 1.00 17.08 ? 34 TRP B CD2 1 ATOM 5153 N NE1 . TRP D 2 34 ? 67.654 -9.011 -11.402 1.00 22.66 ? 34 TRP B NE1 1 ATOM 5154 C CE2 . TRP D 2 34 ? 67.684 -10.335 -11.044 1.00 20.30 ? 34 TRP B CE2 1 ATOM 5155 C CE3 . TRP D 2 34 ? 68.519 -12.417 -11.943 1.00 14.65 ? 34 TRP B CE3 1 ATOM 5156 C CZ2 . TRP D 2 34 ? 67.181 -10.970 -9.913 1.00 21.56 ? 34 TRP B CZ2 1 ATOM 5157 C CZ3 . TRP D 2 34 ? 68.012 -13.046 -10.824 1.00 15.39 ? 34 TRP B CZ3 1 ATOM 5158 C CH2 . TRP D 2 34 ? 67.357 -12.322 -9.820 1.00 19.53 ? 34 TRP B CH2 1 ATOM 5159 N N . SER D 2 35 ? 72.442 -11.830 -15.158 1.00 20.16 ? 35 SER B N 1 ATOM 5160 C CA . SER D 2 35 ? 73.605 -12.060 -15.992 1.00 26.50 ? 35 SER B CA 1 ATOM 5161 C C . SER D 2 35 ? 73.525 -13.330 -16.836 1.00 24.06 ? 35 SER B C 1 ATOM 5162 O O . SER D 2 35 ? 72.772 -14.253 -16.532 1.00 20.64 ? 35 SER B O 1 ATOM 5163 C CB . SER D 2 35 ? 74.848 -12.106 -15.101 1.00 26.46 ? 35 SER B CB 1 ATOM 5164 O OG . SER D 2 35 ? 75.992 -12.483 -15.838 1.00 39.99 ? 35 SER B OG 1 ATOM 5165 N N . TRP D 2 36 ? 74.310 -13.355 -17.906 1.00 18.78 ? 36 TRP B N 1 ATOM 5166 C CA . TRP D 2 36 ? 74.446 -14.539 -18.731 1.00 16.76 ? 36 TRP B CA 1 ATOM 5167 C C . TRP D 2 36 ? 75.905 -14.959 -18.797 1.00 26.12 ? 36 TRP B C 1 ATOM 5168 O O . TRP D 2 36 ? 76.813 -14.123 -18.864 1.00 27.04 ? 36 TRP B O 1 ATOM 5169 C CB . TRP D 2 36 ? 73.893 -14.295 -20.137 1.00 20.50 ? 36 TRP B CB 1 ATOM 5170 C CG . TRP D 2 36 ? 72.405 -14.163 -20.164 1.00 19.72 ? 36 TRP B CG 1 ATOM 5171 C CD1 . TRP D 2 36 ? 71.680 -13.009 -20.073 1.00 17.12 ? 36 TRP B CD1 1 ATOM 5172 C CD2 . TRP D 2 36 ? 71.452 -15.230 -20.271 1.00 24.45 ? 36 TRP B CD2 1 ATOM 5173 N NE1 . TRP D 2 36 ? 70.335 -13.292 -20.123 1.00 20.10 ? 36 TRP B NE1 1 ATOM 5174 C CE2 . TRP D 2 36 ? 70.170 -14.643 -20.246 1.00 21.53 ? 36 TRP B CE2 1 ATOM 5175 C CE3 . TRP D 2 36 ? 71.561 -16.620 -20.390 1.00 26.94 ? 36 TRP B CE3 1 ATOM 5176 C CZ2 . TRP D 2 36 ? 69.002 -15.406 -20.334 1.00 18.73 ? 36 TRP B CZ2 1 ATOM 5177 C CZ3 . TRP D 2 36 ? 70.400 -17.372 -20.481 1.00 22.28 ? 36 TRP B CZ3 1 ATOM 5178 C CH2 . TRP D 2 36 ? 69.139 -16.762 -20.453 1.00 18.69 ? 36 TRP B CH2 1 ATOM 5179 N N . VAL D 2 37 ? 76.110 -16.269 -18.760 1.00 18.26 ? 37 VAL B N 1 ATOM 5180 C CA . VAL D 2 37 ? 77.427 -16.879 -18.764 1.00 23.44 ? 37 VAL B CA 1 ATOM 5181 C C . VAL D 2 37 ? 77.336 -18.111 -19.647 1.00 23.51 ? 37 VAL B C 1 ATOM 5182 O O . VAL D 2 37 ? 76.349 -18.842 -19.574 1.00 28.41 ? 37 VAL B O 1 ATOM 5183 C CB . VAL D 2 37 ? 77.883 -17.274 -17.337 1.00 24.76 ? 37 VAL B CB 1 ATOM 5184 C CG1 . VAL D 2 37 ? 79.143 -18.122 -17.384 1.00 23.91 ? 37 VAL B CG1 1 ATOM 5185 C CG2 . VAL D 2 37 ? 78.090 -16.035 -16.475 1.00 22.35 ? 37 VAL B CG2 1 ATOM 5186 N N . ARG D 2 38 ? 78.329 -18.344 -20.499 1.00 20.46 ? 38 ARG B N 1 ATOM 5187 C CA . ARG D 2 38 ? 78.275 -19.534 -21.345 1.00 23.73 ? 38 ARG B CA 1 ATOM 5188 C C . ARG D 2 38 ? 79.490 -20.427 -21.145 1.00 21.99 ? 38 ARG B C 1 ATOM 5189 O O . ARG D 2 38 ? 80.520 -19.999 -20.622 1.00 22.46 ? 38 ARG B O 1 ATOM 5190 C CB . ARG D 2 38 ? 78.137 -19.154 -22.822 1.00 25.09 ? 38 ARG B CB 1 ATOM 5191 C CG . ARG D 2 38 ? 79.376 -18.535 -23.453 1.00 28.46 ? 38 ARG B CG 1 ATOM 5192 C CD . ARG D 2 38 ? 79.089 -18.138 -24.897 1.00 23.54 ? 38 ARG B CD 1 ATOM 5193 N NE . ARG D 2 38 ? 80.207 -17.427 -25.506 1.00 27.22 ? 38 ARG B NE 1 ATOM 5194 C CZ . ARG D 2 38 ? 80.230 -17.016 -26.769 1.00 31.43 ? 38 ARG B CZ 1 ATOM 5195 N NH1 . ARG D 2 38 ? 79.189 -17.246 -27.564 1.00 29.59 ? 38 ARG B NH1 1 ATOM 5196 N NH2 . ARG D 2 38 ? 81.293 -16.374 -27.237 1.00 34.46 ? 38 ARG B NH2 1 ATOM 5197 N N . GLN D 2 39 ? 79.351 -21.679 -21.562 1.00 21.11 ? 39 GLN B N 1 ATOM 5198 C CA . GLN D 2 39 ? 80.400 -22.666 -21.387 1.00 19.62 ? 39 GLN B CA 1 ATOM 5199 C C . GLN D 2 39 ? 80.462 -23.580 -22.604 1.00 24.24 ? 39 GLN B C 1 ATOM 5200 O O . GLN D 2 39 ? 79.618 -24.463 -22.765 1.00 23.09 ? 39 GLN B O 1 ATOM 5201 C CB . GLN D 2 39 ? 80.165 -23.480 -20.111 1.00 23.84 ? 39 GLN B CB 1 ATOM 5202 C CG . GLN D 2 39 ? 81.335 -24.382 -19.729 1.00 24.90 ? 39 GLN B CG 1 ATOM 5203 C CD . GLN D 2 39 ? 81.173 -25.014 -18.357 1.00 26.97 ? 39 GLN B CD 1 ATOM 5204 O OE1 . GLN D 2 39 ? 80.063 -25.358 -17.945 1.00 24.52 ? 39 GLN B OE1 1 ATOM 5205 N NE2 . GLN D 2 39 ? 82.285 -25.173 -17.642 1.00 21.23 ? 39 GLN B NE2 1 ATOM 5206 N N . PRO D 2 40 ? 81.444 -23.345 -23.486 1.00 25.15 ? 40 PRO B N 1 ATOM 5207 C CA . PRO D 2 40 ? 81.652 -24.207 -24.655 1.00 32.01 ? 40 PRO B CA 1 ATOM 5208 C C . PRO D 2 40 ? 82.044 -25.613 -24.226 1.00 36.31 ? 40 PRO B C 1 ATOM 5209 O O . PRO D 2 40 ? 82.638 -25.763 -23.155 1.00 37.01 ? 40 PRO B O 1 ATOM 5210 C CB . PRO D 2 40 ? 82.796 -23.517 -25.405 1.00 32.11 ? 40 PRO B CB 1 ATOM 5211 C CG . PRO D 2 40 ? 82.760 -22.090 -24.930 1.00 27.54 ? 40 PRO B CG 1 ATOM 5212 C CD . PRO D 2 40 ? 82.353 -22.188 -23.486 1.00 24.02 ? 40 PRO B CD 1 ATOM 5213 N N . PRO D 2 41 ? 81.715 -26.627 -25.045 1.00 38.03 ? 41 PRO B N 1 ATOM 5214 C CA . PRO D 2 41 ? 81.990 -28.031 -24.711 1.00 42.26 ? 41 PRO B CA 1 ATOM 5215 C C . PRO D 2 41 ? 83.432 -28.248 -24.251 1.00 39.56 ? 41 PRO B C 1 ATOM 5216 O O . PRO D 2 41 ? 84.366 -27.853 -24.948 1.00 39.48 ? 41 PRO B O 1 ATOM 5217 C CB . PRO D 2 41 ? 81.717 -28.764 -26.028 1.00 44.62 ? 41 PRO B CB 1 ATOM 5218 C CG . PRO D 2 41 ? 80.729 -27.900 -26.737 1.00 45.53 ? 41 PRO B CG 1 ATOM 5219 C CD . PRO D 2 41 ? 81.086 -26.487 -26.371 1.00 39.26 ? 41 PRO B CD 1 ATOM 5220 N N . GLY D 2 42 ? 83.598 -28.838 -23.071 1.00 39.24 ? 42 GLY B N 1 ATOM 5221 C CA . GLY D 2 42 ? 84.915 -29.119 -22.527 1.00 41.46 ? 42 GLY B CA 1 ATOM 5222 C C . GLY D 2 42 ? 85.785 -27.905 -22.232 1.00 49.91 ? 42 GLY B C 1 ATOM 5223 O O . GLY D 2 42 ? 86.996 -28.039 -22.057 1.00 45.62 ? 42 GLY B O 1 ATOM 5224 N N . LYS D 2 43 ? 85.179 -26.721 -22.168 1.00 54.09 ? 43 LYS B N 1 ATOM 5225 C CA . LYS D 2 43 ? 85.937 -25.495 -21.911 1.00 42.69 ? 43 LYS B CA 1 ATOM 5226 C C . LYS D 2 43 ? 85.445 -24.758 -20.667 1.00 31.34 ? 43 LYS B C 1 ATOM 5227 O O . LYS D 2 43 ? 84.536 -25.220 -19.976 1.00 37.09 ? 43 LYS B O 1 ATOM 5228 C CB . LYS D 2 43 ? 85.877 -24.560 -23.119 1.00 43.62 ? 43 LYS B CB 1 ATOM 5229 C CG . LYS D 2 43 ? 86.630 -25.059 -24.332 1.00 48.12 ? 43 LYS B CG 1 ATOM 5230 C CD . LYS D 2 43 ? 86.743 -23.963 -25.372 1.00 62.01 ? 43 LYS B CD 1 ATOM 5231 C CE . LYS D 2 43 ? 87.676 -24.359 -26.503 1.00 73.67 ? 43 LYS B CE 1 ATOM 5232 N NZ . LYS D 2 43 ? 87.948 -23.205 -27.410 1.00 78.79 ? 43 LYS B NZ 1 ATOM 5233 N N . ARG D 2 44 ? 86.052 -23.611 -20.386 1.00 28.76 ? 44 ARG B N 1 ATOM 5234 C CA . ARG D 2 44 ? 85.736 -22.870 -19.170 1.00 34.24 ? 44 ARG B CA 1 ATOM 5235 C C . ARG D 2 44 ? 84.570 -21.918 -19.378 1.00 36.28 ? 44 ARG B C 1 ATOM 5236 O O . ARG D 2 44 ? 84.151 -21.665 -20.508 1.00 35.92 ? 44 ARG B O 1 ATOM 5237 C CB . ARG D 2 44 ? 86.953 -22.084 -18.682 1.00 32.42 ? 44 ARG B CB 1 ATOM 5238 C CG . ARG D 2 44 ? 87.153 -20.754 -19.390 1.00 26.96 ? 44 ARG B CG 1 ATOM 5239 C CD . ARG D 2 44 ? 88.412 -20.055 -18.896 1.00 27.84 ? 44 ARG B CD 1 ATOM 5240 N NE . ARG D 2 44 ? 89.617 -20.627 -19.486 1.00 27.80 ? 44 ARG B NE 1 ATOM 5241 C CZ . ARG D 2 44 ? 90.853 -20.315 -19.114 1.00 31.19 ? 44 ARG B CZ 1 ATOM 5242 N NH1 . ARG D 2 44 ? 91.055 -19.437 -18.137 1.00 22.92 ? 44 ARG B NH1 1 ATOM 5243 N NH2 . ARG D 2 44 ? 91.889 -20.886 -19.716 1.00 29.35 ? 44 ARG B NH2 1 ATOM 5244 N N . LEU D 2 45 ? 84.061 -21.387 -18.273 1.00 33.40 ? 45 LEU B N 1 ATOM 5245 C CA . LEU D 2 45 ? 82.946 -20.453 -18.303 1.00 29.53 ? 45 LEU B CA 1 ATOM 5246 C C . LEU D 2 45 ? 83.390 -19.084 -18.824 1.00 30.36 ? 45 LEU B C 1 ATOM 5247 O O . LEU D 2 45 ? 84.505 -18.641 -18.543 1.00 27.69 ? 45 LEU B O 1 ATOM 5248 C CB . LEU D 2 45 ? 82.342 -20.338 -16.904 1.00 27.73 ? 45 LEU B CB 1 ATOM 5249 C CG . LEU D 2 45 ? 81.890 -21.686 -16.340 1.00 28.47 ? 45 LEU B CG 1 ATOM 5250 C CD1 . LEU D 2 45 ? 82.153 -21.783 -14.845 1.00 25.67 ? 45 LEU B CD1 1 ATOM 5251 C CD2 . LEU D 2 45 ? 80.417 -21.909 -16.641 1.00 30.09 ? 45 LEU B CD2 1 ATOM 5252 N N . GLU D 2 46 ? 82.529 -18.431 -19.602 1.00 29.50 ? 46 GLU B N 1 ATOM 5253 C CA . GLU D 2 46 ? 82.794 -17.067 -20.064 1.00 27.69 ? 46 GLU B CA 1 ATOM 5254 C C . GLU D 2 46 ? 81.615 -16.137 -19.794 1.00 22.72 ? 46 GLU B C 1 ATOM 5255 O O . GLU D 2 46 ? 80.485 -16.409 -20.201 1.00 29.88 ? 46 GLU B O 1 ATOM 5256 C CB . GLU D 2 46 ? 83.122 -17.033 -21.560 1.00 33.28 ? 46 GLU B CB 1 ATOM 5257 C CG . GLU D 2 46 ? 83.437 -15.614 -22.056 1.00 49.81 ? 46 GLU B CG 1 ATOM 5258 C CD . GLU D 2 46 ? 83.301 -15.434 -23.565 1.00 59.15 ? 46 GLU B CD 1 ATOM 5259 O OE1 . GLU D 2 46 ? 82.817 -16.361 -24.249 1.00 60.82 ? 46 GLU B OE1 1 ATOM 5260 O OE2 . GLU D 2 46 ? 83.679 -14.351 -24.063 1.00 58.76 ? 46 GLU B OE2 1 ATOM 5261 N N . TRP D 2 47 ? 81.892 -15.033 -19.110 1.00 22.42 ? 47 TRP B N 1 ATOM 5262 C CA . TRP D 2 47 ? 80.893 -14.008 -18.839 1.00 24.60 ? 47 TRP B CA 1 ATOM 5263 C C . TRP D 2 47 ? 80.480 -13.303 -20.132 1.00 26.29 ? 47 TRP B C 1 ATOM 5264 O O . TRP D 2 47 ? 81.331 -12.883 -20.912 1.00 30.05 ? 47 TRP B O 1 ATOM 5265 C CB . TRP D 2 47 ? 81.451 -13.010 -17.822 1.00 26.13 ? 47 TRP B CB 1 ATOM 5266 C CG . TRP D 2 47 ? 80.551 -11.855 -17.473 1.00 25.38 ? 47 TRP B CG 1 ATOM 5267 C CD1 . TRP D 2 47 ? 79.422 -11.892 -16.705 1.00 24.73 ? 47 TRP B CD1 1 ATOM 5268 C CD2 . TRP D 2 47 ? 80.737 -10.484 -17.844 1.00 24.79 ? 47 TRP B CD2 1 ATOM 5269 N NE1 . TRP D 2 47 ? 78.885 -10.631 -16.590 1.00 25.20 ? 47 TRP B NE1 1 ATOM 5270 C CE2 . TRP D 2 47 ? 79.675 -9.748 -17.281 1.00 25.00 ? 47 TRP B CE2 1 ATOM 5271 C CE3 . TRP D 2 47 ? 81.694 -9.807 -18.608 1.00 24.48 ? 47 TRP B CE3 1 ATOM 5272 C CZ2 . TRP D 2 47 ? 79.543 -8.373 -17.455 1.00 27.87 ? 47 TRP B CZ2 1 ATOM 5273 C CZ3 . TRP D 2 47 ? 81.563 -8.437 -18.779 1.00 27.06 ? 47 TRP B CZ3 1 ATOM 5274 C CH2 . TRP D 2 47 ? 80.497 -7.737 -18.206 1.00 29.66 ? 47 TRP B CH2 1 ATOM 5275 N N . ILE D 2 48 ? 79.174 -13.195 -20.359 1.00 23.10 ? 48 ILE B N 1 ATOM 5276 C CA . ILE D 2 48 ? 78.645 -12.530 -21.549 1.00 21.21 ? 48 ILE B CA 1 ATOM 5277 C C . ILE D 2 48 ? 78.237 -11.092 -21.253 1.00 26.19 ? 48 ILE B C 1 ATOM 5278 O O . ILE D 2 48 ? 78.547 -10.180 -22.021 1.00 22.24 ? 48 ILE B O 1 ATOM 5279 C CB . ILE D 2 48 ? 77.428 -13.274 -22.118 1.00 20.70 ? 48 ILE B CB 1 ATOM 5280 C CG1 . ILE D 2 48 ? 77.845 -14.630 -22.681 1.00 22.65 ? 48 ILE B CG1 1 ATOM 5281 C CG2 . ILE D 2 48 ? 76.747 -12.455 -23.207 1.00 15.52 ? 48 ILE B CG2 1 ATOM 5282 C CD1 . ILE D 2 48 ? 76.666 -15.472 -23.145 1.00 24.68 ? 48 ILE B CD1 1 ATOM 5283 N N . GLY D 2 49 ? 77.535 -10.900 -20.138 1.00 22.41 ? 49 GLY B N 1 ATOM 5284 C CA . GLY D 2 49 ? 77.056 -9.588 -19.749 1.00 18.97 ? 49 GLY B CA 1 ATOM 5285 C C . GLY D 2 49 ? 76.036 -9.640 -18.628 1.00 22.36 ? 49 GLY B C 1 ATOM 5286 O O . GLY D 2 49 ? 75.720 -10.715 -18.112 1.00 25.44 ? 49 GLY B O 1 ATOM 5287 N N . GLU D 2 50 ? 75.512 -8.477 -18.258 1.00 22.32 ? 50 GLU B N 1 ATOM 5288 C CA . GLU D 2 50 ? 74.509 -8.376 -17.197 1.00 25.47 ? 50 GLU B CA 1 ATOM 5289 C C . GLU D 2 50 ? 73.756 -7.055 -17.264 1.00 29.23 ? 50 GLU B C 1 ATOM 5290 O O . GLU D 2 50 ? 74.155 -6.139 -17.986 1.00 25.44 ? 50 GLU B O 1 ATOM 5291 C CB . GLU D 2 50 ? 75.160 -8.518 -15.821 1.00 25.37 ? 50 GLU B CB 1 ATOM 5292 C CG . GLU D 2 50 ? 76.133 -7.391 -15.480 1.00 21.37 ? 50 GLU B CG 1 ATOM 5293 C CD . GLU D 2 50 ? 77.046 -7.751 -14.318 1.00 34.19 ? 50 GLU B CD 1 ATOM 5294 O OE1 . GLU D 2 50 ? 77.274 -8.965 -14.090 1.00 30.08 ? 50 GLU B OE1 1 ATOM 5295 O OE2 . GLU D 2 50 ? 77.533 -6.826 -13.633 1.00 41.04 ? 50 GLU B OE2 1 ATOM 5296 N N . ILE D 2 51 ? 72.675 -6.952 -16.497 1.00 24.29 ? 51 ILE B N 1 ATOM 5297 C CA . ILE D 2 51 ? 71.870 -5.742 -16.496 1.00 29.51 ? 51 ILE B CA 1 ATOM 5298 C C . ILE D 2 51 ? 71.070 -5.617 -15.200 1.00 30.79 ? 51 ILE B C 1 ATOM 5299 O O . ILE D 2 51 ? 70.693 -6.626 -14.600 1.00 27.86 ? 51 ILE B O 1 ATOM 5300 C CB . ILE D 2 51 ? 70.918 -5.724 -17.717 1.00 32.70 ? 51 ILE B CB 1 ATOM 5301 C CG1 . ILE D 2 51 ? 70.316 -4.335 -17.930 1.00 37.56 ? 51 ILE B CG1 1 ATOM 5302 C CG2 . ILE D 2 51 ? 69.833 -6.785 -17.581 1.00 25.83 ? 51 ILE B CG2 1 ATOM 5303 C CD1 . ILE D 2 51 ? 69.541 -4.213 -19.223 1.00 40.49 ? 51 ILE B CD1 1 ATOM 5304 N N . LYS D 2 52 ? 70.832 -4.384 -14.755 1.00 25.10 ? 52 LYS B N 1 ATOM 5305 C CA . LYS D 2 52 ? 69.901 -4.138 -13.648 1.00 22.25 ? 52 LYS B CA 1 ATOM 5306 C C . LYS D 2 52 ? 68.768 -3.211 -14.084 1.00 33.09 ? 52 LYS B C 1 ATOM 5307 O O . LYS D 2 52 ? 67.636 -3.333 -13.614 1.00 38.72 ? 52 LYS B O 1 ATOM 5308 C CB . LYS D 2 52 ? 70.624 -3.539 -12.438 1.00 33.57 ? 52 LYS B CB 1 ATOM 5309 C CG . LYS D 2 52 ? 69.689 -3.222 -11.267 1.00 43.49 ? 52 LYS B CG 1 ATOM 5310 C CD . LYS D 2 52 ? 70.288 -2.221 -10.287 1.00 53.39 ? 52 LYS B CD 1 ATOM 5311 C CE . LYS D 2 52 ? 71.413 -2.828 -9.477 1.00 56.07 ? 52 LYS B CE 1 ATOM 5312 N NZ . LYS D 2 52 ? 72.016 -1.826 -8.554 1.00 57.72 ? 52 LYS B NZ 1 ATOM 5313 N N . HIS D 2 53 ? 69.089 -2.270 -14.970 1.00 38.10 ? 53 HIS B N 1 ATOM 5314 C CA . HIS D 2 53 ? 68.100 -1.370 -15.560 1.00 31.44 ? 53 HIS B CA 1 ATOM 5315 C C . HIS D 2 53 ? 68.161 -1.446 -17.074 1.00 30.73 ? 53 HIS B C 1 ATOM 5316 O O . HIS D 2 53 ? 69.245 -1.322 -17.657 1.00 36.27 ? 53 HIS B O 1 ATOM 5317 C CB . HIS D 2 53 ? 68.335 0.083 -15.140 1.00 35.95 ? 53 HIS B CB 1 ATOM 5318 C CG . HIS D 2 53 ? 68.419 0.293 -13.664 1.00 41.61 ? 53 HIS B CG 1 ATOM 5319 N ND1 . HIS D 2 53 ? 69.369 1.108 -13.088 1.00 37.73 ? 53 HIS B ND1 1 ATOM 5320 C CD2 . HIS D 2 53 ? 67.660 -0.180 -12.647 1.00 47.53 ? 53 HIS B CD2 1 ATOM 5321 C CE1 . HIS D 2 53 ? 69.200 1.120 -11.778 1.00 44.58 ? 53 HIS B CE1 1 ATOM 5322 N NE2 . HIS D 2 53 ? 68.170 0.345 -11.484 1.00 50.34 ? 53 HIS B NE2 1 ATOM 5323 N N . ASN D 2 54 ? 67.008 -1.636 -17.707 1.00 32.70 ? 54 ASN B N 1 ATOM 5324 C CA . ASN D 2 54 ? 66.910 -1.553 -19.162 1.00 41.90 ? 54 ASN B CA 1 ATOM 5325 C C . ASN D 2 54 ? 67.531 -0.251 -19.662 1.00 53.69 ? 54 ASN B C 1 ATOM 5326 O O . ASN D 2 54 ? 67.183 0.833 -19.187 1.00 54.19 ? 54 ASN B O 1 ATOM 5327 C CB . ASN D 2 54 ? 65.448 -1.653 -19.620 1.00 37.30 ? 54 ASN B CB 1 ATOM 5328 C CG . ASN D 2 54 ? 64.904 -3.073 -19.554 1.00 44.98 ? 54 ASN B CG 1 ATOM 5329 O OD1 . ASN D 2 54 ? 65.601 -4.033 -19.884 1.00 40.51 ? 54 ASN B OD1 1 ATOM 5330 N ND2 . ASN D 2 54 ? 63.653 -3.211 -19.123 1.00 44.78 ? 54 ASN B ND2 1 ATOM 5331 N N . GLY D 2 55 ? 68.464 -0.357 -20.602 1.00 56.70 ? 55 GLY B N 1 ATOM 5332 C CA . GLY D 2 55 ? 69.144 0.819 -21.116 1.00 61.57 ? 55 GLY B CA 1 ATOM 5333 C C . GLY D 2 55 ? 70.499 1.058 -20.474 1.00 62.74 ? 55 GLY B C 1 ATOM 5334 O O . GLY D 2 55 ? 71.242 1.943 -20.898 1.00 58.68 ? 55 GLY B O 1 ATOM 5335 N N . SER D 2 56 ? 70.820 0.277 -19.444 1.00 62.13 ? 56 SER B N 1 ATOM 5336 C CA . SER D 2 56 ? 72.150 0.316 -18.835 1.00 46.70 ? 56 SER B CA 1 ATOM 5337 C C . SER D 2 56 ? 72.760 -1.079 -18.734 1.00 40.12 ? 56 SER B C 1 ATOM 5338 O O . SER D 2 56 ? 72.994 -1.578 -17.634 1.00 39.01 ? 56 SER B O 1 ATOM 5339 C CB . SER D 2 56 ? 72.095 0.954 -17.446 1.00 43.65 ? 56 SER B CB 1 ATOM 5340 O OG . SER D 2 56 ? 71.646 2.297 -17.513 1.00 52.72 ? 56 SER B OG 1 ATOM 5341 N N . PRO D 2 57 ? 73.018 -1.720 -19.881 1.00 29.20 ? 57 PRO B N 1 ATOM 5342 C CA . PRO D 2 57 ? 73.616 -3.052 -19.813 1.00 31.92 ? 57 PRO B CA 1 ATOM 5343 C C . PRO D 2 57 ? 75.133 -2.989 -19.714 1.00 33.51 ? 57 PRO B C 1 ATOM 5344 O O . PRO D 2 57 ? 75.737 -1.941 -19.941 1.00 37.52 ? 57 PRO B O 1 ATOM 5345 C CB . PRO D 2 57 ? 73.182 -3.685 -21.130 1.00 36.55 ? 57 PRO B CB 1 ATOM 5346 C CG . PRO D 2 57 ? 73.163 -2.533 -22.079 1.00 35.32 ? 57 PRO B CG 1 ATOM 5347 C CD . PRO D 2 57 ? 72.762 -1.311 -21.274 1.00 32.09 ? 57 PRO B CD 1 ATOM 5348 N N . ASN D 2 58 ? 75.741 -4.115 -19.374 1.00 29.76 ? 58 ASN B N 1 ATOM 5349 C CA . ASN D 2 58 ? 77.189 -4.216 -19.329 1.00 33.64 ? 58 ASN B CA 1 ATOM 5350 C C . ASN D 2 58 ? 77.627 -5.478 -20.057 1.00 31.32 ? 58 ASN B C 1 ATOM 5351 O O . ASN D 2 58 ? 77.362 -6.579 -19.592 1.00 34.27 ? 58 ASN B O 1 ATOM 5352 C CB . ASN D 2 58 ? 77.678 -4.221 -17.881 1.00 39.33 ? 58 ASN B CB 1 ATOM 5353 C CG . ASN D 2 58 ? 79.176 -4.048 -17.771 1.00 54.87 ? 58 ASN B CG 1 ATOM 5354 O OD1 . ASN D 2 58 ? 79.849 -3.709 -18.746 1.00 62.33 ? 58 ASN B OD1 1 ATOM 5355 N ND2 . ASN D 2 58 ? 79.708 -4.274 -16.576 1.00 59.21 ? 58 ASN B ND2 1 ATOM 5356 N N . TYR D 2 59 ? 78.285 -5.316 -21.200 1.00 25.03 ? 59 TYR B N 1 ATOM 5357 C CA . TYR D 2 59 ? 78.615 -6.448 -22.060 1.00 29.53 ? 59 TYR B CA 1 ATOM 5358 C C . TYR D 2 59 ? 80.105 -6.761 -22.095 1.00 33.56 ? 59 TYR B C 1 ATOM 5359 O O . TYR D 2 59 ? 80.938 -5.890 -21.850 1.00 38.72 ? 59 TYR B O 1 ATOM 5360 C CB . TYR D 2 59 ? 78.139 -6.181 -23.487 1.00 25.44 ? 59 TYR B CB 1 ATOM 5361 C CG . TYR D 2 59 ? 76.655 -5.966 -23.629 1.00 32.29 ? 59 TYR B CG 1 ATOM 5362 C CD1 . TYR D 2 59 ? 75.749 -6.689 -22.869 1.00 31.62 ? 59 TYR B CD1 1 ATOM 5363 C CD2 . TYR D 2 59 ? 76.158 -5.036 -24.531 1.00 33.88 ? 59 TYR B CD2 1 ATOM 5364 C CE1 . TYR D 2 59 ? 74.384 -6.492 -23.008 1.00 34.52 ? 59 TYR B CE1 1 ATOM 5365 C CE2 . TYR D 2 59 ? 74.803 -4.835 -24.676 1.00 34.82 ? 59 TYR B CE2 1 ATOM 5366 C CZ . TYR D 2 59 ? 73.919 -5.564 -23.914 1.00 32.93 ? 59 TYR B CZ 1 ATOM 5367 O OH . TYR D 2 59 ? 72.565 -5.358 -24.059 1.00 36.32 ? 59 TYR B OH 1 ATOM 5368 N N . HIS D 2 60 ? 80.433 -8.009 -22.411 1.00 32.42 ? 60 HIS B N 1 ATOM 5369 C CA . HIS D 2 60 ? 81.807 -8.377 -22.726 1.00 34.09 ? 60 HIS B CA 1 ATOM 5370 C C . HIS D 2 60 ? 82.168 -7.726 -24.058 1.00 36.13 ? 60 HIS B C 1 ATOM 5371 O O . HIS D 2 60 ? 81.442 -7.888 -25.037 1.00 33.54 ? 60 HIS B O 1 ATOM 5372 C CB . HIS D 2 60 ? 81.971 -9.896 -22.798 1.00 34.94 ? 60 HIS B CB 1 ATOM 5373 C CG . HIS D 2 60 ? 83.397 -10.355 -22.799 1.00 42.68 ? 60 HIS B CG 1 ATOM 5374 N ND1 . HIS D 2 60 ? 84.281 -10.044 -23.810 1.00 43.57 ? 60 HIS B ND1 1 ATOM 5375 C CD2 . HIS D 2 60 ? 84.090 -11.110 -21.914 1.00 45.45 ? 60 HIS B CD2 1 ATOM 5376 C CE1 . HIS D 2 60 ? 85.458 -10.579 -23.543 1.00 44.34 ? 60 HIS B CE1 1 ATOM 5377 N NE2 . HIS D 2 60 ? 85.369 -11.234 -22.399 1.00 45.69 ? 60 HIS B NE2 1 ATOM 5378 N N . PRO D 2 61 ? 83.285 -6.980 -24.094 1.00 40.01 ? 61 PRO B N 1 ATOM 5379 C CA . PRO D 2 61 ? 83.704 -6.157 -25.240 1.00 40.82 ? 61 PRO B CA 1 ATOM 5380 C C . PRO D 2 61 ? 83.747 -6.904 -26.569 1.00 43.93 ? 61 PRO B C 1 ATOM 5381 O O . PRO D 2 61 ? 83.304 -6.369 -27.585 1.00 51.58 ? 61 PRO B O 1 ATOM 5382 C CB . PRO D 2 61 ? 85.107 -5.700 -24.840 1.00 44.42 ? 61 PRO B CB 1 ATOM 5383 C CG . PRO D 2 61 ? 85.070 -5.674 -23.353 1.00 48.80 ? 61 PRO B CG 1 ATOM 5384 C CD . PRO D 2 61 ? 84.211 -6.844 -22.958 1.00 43.74 ? 61 PRO B CD 1 ATOM 5385 N N . SER D 2 62 ? 84.261 -8.128 -26.561 1.00 44.97 ? 62 SER B N 1 ATOM 5386 C CA . SER D 2 62 ? 84.391 -8.907 -27.788 1.00 50.93 ? 62 SER B CA 1 ATOM 5387 C C . SER D 2 62 ? 83.032 -9.301 -28.368 1.00 54.65 ? 62 SER B C 1 ATOM 5388 O O . SER D 2 62 ? 82.946 -9.740 -29.515 1.00 58.11 ? 62 SER B O 1 ATOM 5389 C CB . SER D 2 62 ? 85.229 -10.160 -27.534 1.00 51.78 ? 62 SER B CB 1 ATOM 5390 O OG . SER D 2 62 ? 84.583 -11.023 -26.614 1.00 59.12 ? 62 SER B OG 1 ATOM 5391 N N . LEU D 2 63 ? 81.977 -9.135 -27.577 1.00 50.55 ? 63 LEU B N 1 ATOM 5392 C CA . LEU D 2 63 ? 80.638 -9.553 -27.978 1.00 53.22 ? 63 LEU B CA 1 ATOM 5393 C C . LEU D 2 63 ? 79.670 -8.384 -28.137 1.00 58.83 ? 63 LEU B C 1 ATOM 5394 O O . LEU D 2 63 ? 78.588 -8.550 -28.694 1.00 57.06 ? 63 LEU B O 1 ATOM 5395 C CB . LEU D 2 63 ? 80.066 -10.538 -26.956 1.00 45.74 ? 63 LEU B CB 1 ATOM 5396 C CG . LEU D 2 63 ? 80.675 -11.934 -26.834 1.00 42.17 ? 63 LEU B CG 1 ATOM 5397 C CD1 . LEU D 2 63 ? 80.036 -12.668 -25.668 1.00 43.02 ? 63 LEU B CD1 1 ATOM 5398 C CD2 . LEU D 2 63 ? 80.488 -12.715 -28.121 1.00 39.53 ? 63 LEU B CD2 1 ATOM 5399 N N . LYS D 2 64 ? 80.079 -7.213 -27.651 1.00 65.45 ? 64 LYS B N 1 ATOM 5400 C CA . LYS D 2 64 ? 79.208 -6.042 -27.497 1.00 64.02 ? 64 LYS B CA 1 ATOM 5401 C C . LYS D 2 64 ? 78.258 -5.776 -28.667 1.00 53.25 ? 64 LYS B C 1 ATOM 5402 O O . LYS D 2 64 ? 77.083 -5.460 -28.462 1.00 54.41 ? 64 LYS B O 1 ATOM 5403 C CB . LYS D 2 64 ? 80.066 -4.798 -27.253 1.00 75.66 ? 64 LYS B CB 1 ATOM 5404 C CG . LYS D 2 64 ? 79.267 -3.526 -27.020 1.00 87.77 ? 64 LYS B CG 1 ATOM 5405 C CD . LYS D 2 64 ? 80.180 -2.334 -26.784 1.00 98.56 ? 64 LYS B CD 1 ATOM 5406 C CE . LYS D 2 64 ? 79.381 -1.061 -26.549 1.00 106.06 ? 64 LYS B CE 1 ATOM 5407 N NZ . LYS D 2 64 ? 80.265 0.107 -26.277 1.00 111.01 ? 64 LYS B NZ 1 ATOM 5408 N N . SER D 2 65 ? 78.762 -5.919 -29.888 1.00 44.51 ? 65 SER B N 1 ATOM 5409 C CA . SER D 2 65 ? 77.981 -5.598 -31.078 1.00 45.83 ? 65 SER B CA 1 ATOM 5410 C C . SER D 2 65 ? 76.844 -6.587 -31.362 1.00 49.31 ? 65 SER B C 1 ATOM 5411 O O . SER D 2 65 ? 75.802 -6.202 -31.894 1.00 54.81 ? 65 SER B O 1 ATOM 5412 C CB . SER D 2 65 ? 78.902 -5.516 -32.295 1.00 51.84 ? 65 SER B CB 1 ATOM 5413 O OG . SER D 2 65 ? 79.703 -6.677 -32.396 1.00 60.17 ? 65 SER B OG 1 ATOM 5414 N N . ARG D 2 66 ? 77.035 -7.854 -31.009 1.00 35.09 ? 66 ARG B N 1 ATOM 5415 C CA . ARG D 2 66 ? 76.042 -8.877 -31.328 1.00 36.07 ? 66 ARG B CA 1 ATOM 5416 C C . ARG D 2 66 ? 75.087 -9.165 -30.176 1.00 33.74 ? 66 ARG B C 1 ATOM 5417 O O . ARG D 2 66 ? 74.127 -9.912 -30.339 1.00 42.28 ? 66 ARG B O 1 ATOM 5418 C CB . ARG D 2 66 ? 76.729 -10.186 -31.734 1.00 32.78 ? 66 ARG B CB 1 ATOM 5419 C CG . ARG D 2 66 ? 77.786 -10.039 -32.807 1.00 31.44 ? 66 ARG B CG 1 ATOM 5420 C CD . ARG D 2 66 ? 78.224 -11.393 -33.338 1.00 34.02 ? 66 ARG B CD 1 ATOM 5421 N NE . ARG D 2 66 ? 79.049 -12.136 -32.390 1.00 34.24 ? 66 ARG B NE 1 ATOM 5422 C CZ . ARG D 2 66 ? 78.808 -13.388 -32.012 1.00 39.01 ? 66 ARG B CZ 1 ATOM 5423 N NH1 . ARG D 2 66 ? 77.757 -14.041 -32.491 1.00 40.54 ? 66 ARG B NH1 1 ATOM 5424 N NH2 . ARG D 2 66 ? 79.620 -13.989 -31.153 1.00 38.15 ? 66 ARG B NH2 1 ATOM 5425 N N . VAL D 2 67 ? 75.349 -8.582 -29.013 1.00 31.36 ? 67 VAL B N 1 ATOM 5426 C CA . VAL D 2 67 ? 74.646 -8.989 -27.800 1.00 28.82 ? 67 VAL B CA 1 ATOM 5427 C C . VAL D 2 67 ? 73.598 -7.990 -27.339 1.00 30.05 ? 67 VAL B C 1 ATOM 5428 O O . VAL D 2 67 ? 73.834 -6.780 -27.329 1.00 30.55 ? 67 VAL B O 1 ATOM 5429 C CB . VAL D 2 67 ? 75.643 -9.225 -26.645 1.00 34.99 ? 67 VAL B CB 1 ATOM 5430 C CG1 . VAL D 2 67 ? 74.914 -9.538 -25.349 1.00 35.66 ? 67 VAL B CG1 1 ATOM 5431 C CG2 . VAL D 2 67 ? 76.582 -10.352 -26.996 1.00 39.70 ? 67 VAL B CG2 1 ATOM 5432 N N . THR D 2 68 ? 72.434 -8.506 -26.958 1.00 25.29 ? 68 THR B N 1 ATOM 5433 C CA . THR D 2 68 ? 71.439 -7.692 -26.277 1.00 30.54 ? 68 THR B CA 1 ATOM 5434 C C . THR D 2 68 ? 70.893 -8.435 -25.070 1.00 30.15 ? 68 THR B C 1 ATOM 5435 O O . THR D 2 68 ? 70.497 -9.595 -25.170 1.00 33.03 ? 68 THR B O 1 ATOM 5436 C CB . THR D 2 68 ? 70.273 -7.306 -27.204 1.00 31.77 ? 68 THR B CB 1 ATOM 5437 O OG1 . THR D 2 68 ? 70.789 -6.685 -28.384 1.00 35.98 ? 68 THR B OG1 1 ATOM 5438 C CG2 . THR D 2 68 ? 69.339 -6.333 -26.499 1.00 26.33 ? 68 THR B CG2 1 ATOM 5439 N N . ILE D 2 69 ? 70.889 -7.764 -23.926 1.00 27.68 ? 69 ILE B N 1 ATOM 5440 C CA . ILE D 2 69 ? 70.277 -8.301 -22.721 1.00 24.28 ? 69 ILE B CA 1 ATOM 5441 C C . ILE D 2 69 ? 69.211 -7.325 -22.235 1.00 31.42 ? 69 ILE B C 1 ATOM 5442 O O . ILE D 2 69 ? 69.471 -6.131 -22.106 1.00 27.56 ? 69 ILE B O 1 ATOM 5443 C CB . ILE D 2 69 ? 71.314 -8.543 -21.610 1.00 24.88 ? 69 ILE B CB 1 ATOM 5444 C CG1 . ILE D 2 69 ? 72.395 -9.514 -22.090 1.00 26.37 ? 69 ILE B CG1 1 ATOM 5445 C CG2 . ILE D 2 69 ? 70.638 -9.069 -20.353 1.00 23.51 ? 69 ILE B CG2 1 ATOM 5446 C CD1 . ILE D 2 69 ? 73.500 -9.765 -21.068 1.00 26.07 ? 69 ILE B CD1 1 ATOM 5447 N N . SER D 2 70 ? 68.009 -7.824 -21.982 1.00 31.07 ? 70 SER B N 1 ATOM 5448 C CA . SER D 2 70 ? 66.929 -6.958 -21.527 1.00 34.19 ? 70 SER B CA 1 ATOM 5449 C C . SER D 2 70 ? 66.076 -7.622 -20.455 1.00 35.48 ? 70 SER B C 1 ATOM 5450 O O . SER D 2 70 ? 66.083 -8.847 -20.304 1.00 35.34 ? 70 SER B O 1 ATOM 5451 C CB . SER D 2 70 ? 66.049 -6.535 -22.707 1.00 31.95 ? 70 SER B CB 1 ATOM 5452 O OG . SER D 2 70 ? 65.590 -7.660 -23.433 1.00 35.17 ? 70 SER B OG 1 ATOM 5453 N N . LEU D 2 71 ? 65.341 -6.796 -19.718 1.00 30.02 ? 71 LEU B N 1 ATOM 5454 C CA . LEU D 2 71 ? 64.465 -7.267 -18.656 1.00 34.52 ? 71 LEU B CA 1 ATOM 5455 C C . LEU D 2 71 ? 63.009 -7.208 -19.087 1.00 35.12 ? 71 LEU B C 1 ATOM 5456 O O . LEU D 2 71 ? 62.585 -6.236 -19.708 1.00 31.57 ? 71 LEU B O 1 ATOM 5457 C CB . LEU D 2 71 ? 64.643 -6.423 -17.393 1.00 36.05 ? 71 LEU B CB 1 ATOM 5458 C CG . LEU D 2 71 ? 66.026 -6.281 -16.762 1.00 34.15 ? 71 LEU B CG 1 ATOM 5459 C CD1 . LEU D 2 71 ? 65.971 -5.237 -15.669 1.00 35.53 ? 71 LEU B CD1 1 ATOM 5460 C CD2 . LEU D 2 71 ? 66.496 -7.606 -16.201 1.00 32.14 ? 71 LEU B CD2 1 ATOM 5461 N N . ASP D 2 72 ? 62.246 -8.244 -18.759 1.00 28.03 ? 72 ASP B N 1 ATOM 5462 C CA . ASP D 2 72 ? 60.793 -8.162 -18.857 1.00 29.88 ? 72 ASP B CA 1 ATOM 5463 C C . ASP D 2 72 ? 60.243 -8.024 -17.445 1.00 26.93 ? 72 ASP B C 1 ATOM 5464 O O . ASP D 2 72 ? 59.865 -9.007 -16.806 1.00 26.79 ? 72 ASP B O 1 ATOM 5465 C CB . ASP D 2 72 ? 60.202 -9.383 -19.558 1.00 29.77 ? 72 ASP B CB 1 ATOM 5466 C CG . ASP D 2 72 ? 58.701 -9.259 -19.787 1.00 35.55 ? 72 ASP B CG 1 ATOM 5467 O OD1 . ASP D 2 72 ? 58.082 -8.328 -19.228 1.00 32.77 ? 72 ASP B OD1 1 ATOM 5468 O OD2 . ASP D 2 72 ? 58.138 -10.100 -20.523 1.00 40.03 ? 72 ASP B OD2 1 ATOM 5469 N N . MET D 2 73 ? 60.189 -6.784 -16.981 1.00 26.49 ? 73 MET B N 1 ATOM 5470 C CA . MET D 2 73 ? 59.939 -6.492 -15.582 1.00 28.81 ? 73 MET B CA 1 ATOM 5471 C C . MET D 2 73 ? 58.559 -6.906 -15.093 1.00 25.82 ? 73 MET B C 1 ATOM 5472 O O . MET D 2 73 ? 58.406 -7.289 -13.934 1.00 27.75 ? 73 MET B O 1 ATOM 5473 C CB . MET D 2 73 ? 60.165 -5.006 -15.341 1.00 27.46 ? 73 MET B CB 1 ATOM 5474 C CG . MET D 2 73 ? 61.632 -4.633 -15.434 1.00 25.30 ? 73 MET B CG 1 ATOM 5475 S SD . MET D 2 73 ? 61.908 -2.918 -15.878 1.00 46.16 ? 73 MET B SD 1 ATOM 5476 C CE . MET D 2 73 ? 61.215 -2.096 -14.456 1.00 22.40 ? 73 MET B CE 1 ATOM 5477 N N . SER D 2 74 ? 57.558 -6.842 -15.966 1.00 25.51 ? 74 SER B N 1 ATOM 5478 C CA . SER D 2 74 ? 56.207 -7.240 -15.575 1.00 24.42 ? 74 SER B CA 1 ATOM 5479 C C . SER D 2 74 ? 56.155 -8.728 -15.235 1.00 23.20 ? 74 SER B C 1 ATOM 5480 O O . SER D 2 74 ? 55.360 -9.151 -14.399 1.00 26.24 ? 74 SER B O 1 ATOM 5481 C CB . SER D 2 74 ? 55.194 -6.909 -16.676 1.00 21.95 ? 74 SER B CB 1 ATOM 5482 O OG . SER D 2 74 ? 55.498 -7.584 -17.883 1.00 34.43 ? 74 SER B OG 1 ATOM 5483 N N . LYS D 2 75 ? 57.017 -9.519 -15.863 1.00 20.96 ? 75 LYS B N 1 ATOM 5484 C CA . LYS D 2 75 ? 57.001 -10.960 -15.640 1.00 25.08 ? 75 LYS B CA 1 ATOM 5485 C C . LYS D 2 75 ? 58.176 -11.479 -14.811 1.00 27.30 ? 75 LYS B C 1 ATOM 5486 O O . LYS D 2 75 ? 58.300 -12.687 -14.611 1.00 33.09 ? 75 LYS B O 1 ATOM 5487 C CB . LYS D 2 75 ? 56.980 -11.693 -16.979 1.00 28.44 ? 75 LYS B CB 1 ATOM 5488 C CG . LYS D 2 75 ? 55.821 -11.318 -17.878 1.00 23.65 ? 75 LYS B CG 1 ATOM 5489 C CD . LYS D 2 75 ? 55.884 -12.144 -19.142 1.00 28.39 ? 75 LYS B CD 1 ATOM 5490 C CE . LYS D 2 75 ? 54.885 -11.677 -20.172 1.00 32.56 ? 75 LYS B CE 1 ATOM 5491 N NZ . LYS D 2 75 ? 54.885 -12.636 -21.313 1.00 38.81 ? 75 LYS B NZ 1 ATOM 5492 N N . ASN D 2 76 ? 59.025 -10.573 -14.331 1.00 25.99 ? 76 ASN B N 1 ATOM 5493 C CA . ASN D 2 76 ? 60.255 -10.945 -13.630 1.00 22.30 ? 76 ASN B CA 1 ATOM 5494 C C . ASN D 2 76 ? 61.074 -11.928 -14.454 1.00 27.06 ? 76 ASN B C 1 ATOM 5495 O O . ASN D 2 76 ? 61.486 -12.978 -13.972 1.00 25.22 ? 76 ASN B O 1 ATOM 5496 C CB . ASN D 2 76 ? 59.947 -11.525 -12.248 1.00 25.59 ? 76 ASN B CB 1 ATOM 5497 C CG . ASN D 2 76 ? 59.744 -10.443 -11.195 1.00 32.40 ? 76 ASN B CG 1 ATOM 5498 O OD1 . ASN D 2 76 ? 60.497 -9.469 -11.138 1.00 30.95 ? 76 ASN B OD1 1 ATOM 5499 N ND2 . ASN D 2 76 ? 58.716 -10.604 -10.365 1.00 30.66 ? 76 ASN B ND2 1 ATOM 5500 N N . GLN D 2 77 ? 61.288 -11.570 -15.713 1.00 29.60 ? 77 GLN B N 1 ATOM 5501 C CA . GLN D 2 77 ? 62.060 -12.384 -16.636 1.00 30.41 ? 77 GLN B CA 1 ATOM 5502 C C . GLN D 2 77 ? 63.107 -11.514 -17.319 1.00 30.52 ? 77 GLN B C 1 ATOM 5503 O O . GLN D 2 77 ? 62.949 -10.295 -17.402 1.00 24.71 ? 77 GLN B O 1 ATOM 5504 C CB . GLN D 2 77 ? 61.139 -13.043 -17.669 1.00 25.86 ? 77 GLN B CB 1 ATOM 5505 C CG . GLN D 2 77 ? 60.121 -13.985 -17.039 1.00 29.58 ? 77 GLN B CG 1 ATOM 5506 C CD . GLN D 2 77 ? 59.180 -14.625 -18.046 1.00 33.96 ? 77 GLN B CD 1 ATOM 5507 O OE1 . GLN D 2 77 ? 59.201 -14.301 -19.238 1.00 29.19 ? 77 GLN B OE1 1 ATOM 5508 N NE2 . GLN D 2 77 ? 58.342 -15.541 -17.565 1.00 26.45 ? 77 GLN B NE2 1 ATOM 5509 N N . PHE D 2 78 ? 64.189 -12.126 -17.783 1.00 23.21 ? 78 PHE B N 1 ATOM 5510 C CA . PHE D 2 78 ? 65.156 -11.383 -18.581 1.00 24.28 ? 78 PHE B CA 1 ATOM 5511 C C . PHE D 2 78 ? 65.680 -12.257 -19.712 1.00 27.75 ? 78 PHE B C 1 ATOM 5512 O O . PHE D 2 78 ? 65.609 -13.488 -19.646 1.00 19.61 ? 78 PHE B O 1 ATOM 5513 C CB . PHE D 2 78 ? 66.297 -10.836 -17.715 1.00 21.72 ? 78 PHE B CB 1 ATOM 5514 C CG . PHE D 2 78 ? 67.129 -11.887 -17.027 1.00 25.12 ? 78 PHE B CG 1 ATOM 5515 C CD1 . PHE D 2 78 ? 66.691 -12.484 -15.854 1.00 19.90 ? 78 PHE B CD1 1 ATOM 5516 C CD2 . PHE D 2 78 ? 68.379 -12.229 -17.520 1.00 23.91 ? 78 PHE B CD2 1 ATOM 5517 C CE1 . PHE D 2 78 ? 67.470 -13.426 -15.208 1.00 19.40 ? 78 PHE B CE1 1 ATOM 5518 C CE2 . PHE D 2 78 ? 69.166 -13.179 -16.878 1.00 20.03 ? 78 PHE B CE2 1 ATOM 5519 C CZ . PHE D 2 78 ? 68.715 -13.775 -15.725 1.00 16.93 ? 78 PHE B CZ 1 ATOM 5520 N N . SER D 2 79 ? 66.165 -11.615 -20.769 1.00 23.99 ? 79 SER B N 1 ATOM 5521 C CA . SER D 2 79 ? 66.485 -12.336 -21.991 1.00 25.58 ? 79 SER B CA 1 ATOM 5522 C C . SER D 2 79 ? 67.872 -12.028 -22.542 1.00 29.92 ? 79 SER B C 1 ATOM 5523 O O . SER D 2 79 ? 68.449 -10.970 -22.275 1.00 28.78 ? 79 SER B O 1 ATOM 5524 C CB . SER D 2 79 ? 65.433 -12.035 -23.061 1.00 27.58 ? 79 SER B CB 1 ATOM 5525 O OG . SER D 2 79 ? 64.239 -12.757 -22.814 1.00 34.98 ? 79 SER B OG 1 ATOM 5526 N N . LEU D 2 80 ? 68.392 -12.972 -23.318 1.00 21.66 ? 80 LEU B N 1 ATOM 5527 C CA . LEU D 2 80 ? 69.648 -12.803 -24.029 1.00 21.02 ? 80 LEU B CA 1 ATOM 5528 C C . LEU D 2 80 ? 69.421 -12.900 -25.529 1.00 23.46 ? 80 LEU B C 1 ATOM 5529 O O . LEU D 2 80 ? 68.858 -13.876 -26.014 1.00 26.55 ? 80 LEU B O 1 ATOM 5530 C CB . LEU D 2 80 ? 70.670 -13.857 -23.593 1.00 21.47 ? 80 LEU B CB 1 ATOM 5531 C CG . LEU D 2 80 ? 71.907 -13.968 -24.496 1.00 22.93 ? 80 LEU B CG 1 ATOM 5532 C CD1 . LEU D 2 80 ? 72.747 -12.695 -24.449 1.00 20.08 ? 80 LEU B CD1 1 ATOM 5533 C CD2 . LEU D 2 80 ? 72.763 -15.199 -24.160 1.00 16.26 ? 80 LEU B CD2 1 ATOM 5534 N N . ASN D 2 81 ? 69.864 -11.884 -26.256 1.00 28.53 ? 81 ASN B N 1 ATOM 5535 C CA . ASN D 2 81 ? 69.880 -11.921 -27.710 1.00 32.38 ? 81 ASN B CA 1 ATOM 5536 C C . ASN D 2 81 ? 71.308 -11.879 -28.231 1.00 36.01 ? 81 ASN B C 1 ATOM 5537 O O . ASN D 2 81 ? 72.106 -11.039 -27.816 1.00 38.15 ? 81 ASN B O 1 ATOM 5538 C CB . ASN D 2 81 ? 69.074 -10.761 -28.285 1.00 42.17 ? 81 ASN B CB 1 ATOM 5539 C CG . ASN D 2 81 ? 67.693 -11.175 -28.698 1.00 59.21 ? 81 ASN B CG 1 ATOM 5540 O OD1 . ASN D 2 81 ? 67.083 -12.053 -28.087 1.00 55.12 ? 81 ASN B OD1 1 ATOM 5541 N ND2 . ASN D 2 81 ? 67.185 -10.548 -29.749 1.00 87.91 ? 81 ASN B ND2 1 ATOM 5542 N N . LEU D 2 82 ? 71.624 -12.798 -29.134 1.00 34.07 ? 82 LEU B N 1 ATOM 5543 C CA . LEU D 2 82 ? 72.948 -12.872 -29.726 1.00 29.65 ? 82 LEU B CA 1 ATOM 5544 C C . LEU D 2 82 ? 72.802 -13.075 -31.227 1.00 31.03 ? 82 LEU B C 1 ATOM 5545 O O . LEU D 2 82 ? 72.324 -14.117 -31.674 1.00 33.87 ? 82 LEU B O 1 ATOM 5546 C CB . LEU D 2 82 ? 73.749 -14.003 -29.086 1.00 26.11 ? 82 LEU B CB 1 ATOM 5547 C CG . LEU D 2 82 ? 75.176 -14.277 -29.563 1.00 35.12 ? 82 LEU B CG 1 ATOM 5548 C CD1 . LEU D 2 82 ? 76.087 -13.067 -29.370 1.00 27.78 ? 82 LEU B CD1 1 ATOM 5549 C CD2 . LEU D 2 82 ? 75.719 -15.494 -28.831 1.00 32.65 ? 82 LEU B CD2 1 ATOM 5550 N N . THR D 2 83 A 73.188 -12.062 -32.000 1.00 33.51 ? 82 THR B N 1 ATOM 5551 C CA . THR D 2 83 A 72.986 -12.081 -33.447 1.00 36.65 ? 82 THR B CA 1 ATOM 5552 C C . THR D 2 83 A 74.179 -12.674 -34.183 1.00 35.08 ? 82 THR B C 1 ATOM 5553 O O . THR D 2 83 A 75.254 -12.844 -33.603 1.00 36.20 ? 82 THR B O 1 ATOM 5554 C CB . THR D 2 83 A 72.726 -10.666 -34.000 1.00 37.92 ? 82 THR B CB 1 ATOM 5555 O OG1 . THR D 2 83 A 73.880 -9.843 -33.780 1.00 36.88 ? 82 THR B OG1 1 ATOM 5556 C CG2 . THR D 2 83 A 71.518 -10.039 -33.321 1.00 33.02 ? 82 THR B CG2 1 ATOM 5557 N N . SER D 2 84 B 73.965 -12.990 -35.459 1.00 30.96 ? 82 SER B N 1 ATOM 5558 C CA . SER D 2 84 B 75.015 -13.457 -36.362 1.00 35.57 ? 82 SER B CA 1 ATOM 5559 C C . SER D 2 84 B 75.864 -14.578 -35.774 1.00 33.87 ? 82 SER B C 1 ATOM 5560 O O . SER D 2 84 B 77.092 -14.505 -35.797 1.00 33.52 ? 82 SER B O 1 ATOM 5561 C CB . SER D 2 84 B 75.920 -12.286 -36.759 1.00 39.64 ? 82 SER B CB 1 ATOM 5562 O OG . SER D 2 84 B 75.155 -11.175 -37.201 1.00 45.24 ? 82 SER B OG 1 ATOM 5563 N N . VAL D 2 85 C 75.213 -15.611 -35.249 1.00 37.11 ? 82 VAL B N 1 ATOM 5564 C CA . VAL D 2 85 C 75.931 -16.699 -34.591 1.00 35.17 ? 82 VAL B CA 1 ATOM 5565 C C . VAL D 2 85 C 76.751 -17.533 -35.577 1.00 41.21 ? 82 VAL B C 1 ATOM 5566 O O . VAL D 2 85 C 76.383 -17.678 -36.745 1.00 44.21 ? 82 VAL B O 1 ATOM 5567 C CB . VAL D 2 85 C 74.966 -17.638 -33.827 1.00 24.87 ? 82 VAL B CB 1 ATOM 5568 C CG1 . VAL D 2 85 C 74.267 -16.886 -32.707 1.00 20.07 ? 82 VAL B CG1 1 ATOM 5569 C CG2 . VAL D 2 85 C 73.942 -18.258 -34.782 1.00 19.18 ? 82 VAL B CG2 1 ATOM 5570 N N . THR D 2 86 ? 77.874 -18.060 -35.094 1.00 39.40 ? 83 THR B N 1 ATOM 5571 C CA . THR D 2 86 ? 78.680 -19.030 -35.831 1.00 37.88 ? 83 THR B CA 1 ATOM 5572 C C . THR D 2 86 ? 78.881 -20.253 -34.945 1.00 37.20 ? 83 THR B C 1 ATOM 5573 O O . THR D 2 86 ? 78.404 -20.276 -33.810 1.00 36.32 ? 83 THR B O 1 ATOM 5574 C CB . THR D 2 86 ? 80.050 -18.455 -36.246 1.00 42.02 ? 83 THR B CB 1 ATOM 5575 O OG1 . THR D 2 86 ? 80.891 -18.323 -35.092 1.00 39.27 ? 83 THR B OG1 1 ATOM 5576 C CG2 . THR D 2 86 ? 79.882 -17.094 -36.921 1.00 37.02 ? 83 THR B CG2 1 ATOM 5577 N N . ALA D 2 87 ? 79.597 -21.257 -35.445 1.00 36.28 ? 84 ALA B N 1 ATOM 5578 C CA . ALA D 2 87 ? 79.814 -22.494 -34.689 1.00 33.34 ? 84 ALA B CA 1 ATOM 5579 C C . ALA D 2 87 ? 80.589 -22.238 -33.398 1.00 32.30 ? 84 ALA B C 1 ATOM 5580 O O . ALA D 2 87 ? 80.565 -23.054 -32.476 1.00 35.52 ? 84 ALA B O 1 ATOM 5581 C CB . ALA D 2 87 ? 80.541 -23.521 -35.543 1.00 27.87 ? 84 ALA B CB 1 ATOM 5582 N N . ALA D 2 88 ? 81.266 -21.097 -33.337 1.00 34.35 ? 85 ALA B N 1 ATOM 5583 C CA . ALA D 2 88 ? 82.020 -20.711 -32.151 1.00 36.40 ? 85 ALA B CA 1 ATOM 5584 C C . ALA D 2 88 ? 81.109 -20.311 -30.988 1.00 38.83 ? 85 ALA B C 1 ATOM 5585 O O . ALA D 2 88 ? 81.578 -20.134 -29.863 1.00 43.78 ? 85 ALA B O 1 ATOM 5586 C CB . ALA D 2 88 ? 82.975 -19.570 -32.484 1.00 31.45 ? 85 ALA B CB 1 ATOM 5587 N N . ASP D 2 89 ? 79.813 -20.168 -31.255 1.00 30.01 ? 86 ASP B N 1 ATOM 5588 C CA . ASP D 2 89 ? 78.867 -19.790 -30.208 1.00 28.18 ? 86 ASP B CA 1 ATOM 5589 C C . ASP D 2 89 ? 78.181 -21.015 -29.601 1.00 28.77 ? 86 ASP B C 1 ATOM 5590 O O . ASP D 2 89 ? 77.345 -20.889 -28.710 1.00 28.34 ? 86 ASP B O 1 ATOM 5591 C CB . ASP D 2 89 ? 77.826 -18.811 -30.756 1.00 30.10 ? 86 ASP B CB 1 ATOM 5592 C CG . ASP D 2 89 ? 78.439 -17.482 -31.176 1.00 39.26 ? 86 ASP B CG 1 ATOM 5593 O OD1 . ASP D 2 89 ? 79.168 -16.869 -30.365 1.00 40.82 ? 86 ASP B OD1 1 ATOM 5594 O OD2 . ASP D 2 89 ? 78.200 -17.050 -32.323 1.00 45.54 ? 86 ASP B OD2 1 ATOM 5595 N N . THR D 2 90 ? 78.546 -22.198 -30.082 1.00 27.65 ? 87 THR B N 1 ATOM 5596 C CA . THR D 2 90 ? 78.050 -23.444 -29.505 1.00 30.62 ? 87 THR B CA 1 ATOM 5597 C C . THR D 2 90 ? 78.515 -23.573 -28.058 1.00 28.30 ? 87 THR B C 1 ATOM 5598 O O . THR D 2 90 ? 79.711 -23.544 -27.785 1.00 29.42 ? 87 THR B O 1 ATOM 5599 C CB . THR D 2 90 ? 78.525 -24.672 -30.308 1.00 31.05 ? 87 THR B CB 1 ATOM 5600 O OG1 . THR D 2 90 ? 78.025 -24.589 -31.647 1.00 32.54 ? 87 THR B OG1 1 ATOM 5601 C CG2 . THR D 2 90 ? 78.030 -25.965 -29.668 1.00 24.86 ? 87 THR B CG2 1 ATOM 5602 N N . ALA D 2 91 ? 77.560 -23.708 -27.141 1.00 26.32 ? 88 ALA B N 1 ATOM 5603 C CA . ALA D 2 91 ? 77.852 -23.758 -25.711 1.00 21.70 ? 88 ALA B CA 1 ATOM 5604 C C . ALA D 2 91 ? 76.591 -24.021 -24.903 1.00 21.58 ? 88 ALA B C 1 ATOM 5605 O O . ALA D 2 91 ? 75.477 -23.941 -25.424 1.00 20.99 ? 88 ALA B O 1 ATOM 5606 C CB . ALA D 2 91 ? 78.499 -22.448 -25.244 1.00 23.40 ? 88 ALA B CB 1 ATOM 5607 N N . VAL D 2 92 ? 76.780 -24.342 -23.626 1.00 20.92 ? 89 VAL B N 1 ATOM 5608 C CA . VAL D 2 92 ? 75.696 -24.279 -22.658 1.00 26.40 ? 89 VAL B CA 1 ATOM 5609 C C . VAL D 2 92 ? 75.631 -22.843 -22.139 1.00 27.27 ? 89 VAL B C 1 ATOM 5610 O O . VAL D 2 92 ? 76.634 -22.299 -21.679 1.00 23.37 ? 89 VAL B O 1 ATOM 5611 C CB . VAL D 2 92 ? 75.897 -25.266 -21.485 1.00 27.25 ? 89 VAL B CB 1 ATOM 5612 C CG1 . VAL D 2 92 ? 74.850 -25.025 -20.392 1.00 14.52 ? 89 VAL B CG1 1 ATOM 5613 C CG2 . VAL D 2 92 ? 75.841 -26.707 -21.986 1.00 13.02 ? 89 VAL B CG2 1 ATOM 5614 N N . TYR D 2 93 ? 74.463 -22.220 -22.245 1.00 28.33 ? 90 TYR B N 1 ATOM 5615 C CA . TYR D 2 93 ? 74.290 -20.852 -21.774 1.00 23.80 ? 90 TYR B CA 1 ATOM 5616 C C . TYR D 2 93 ? 73.566 -20.843 -20.436 1.00 24.85 ? 90 TYR B C 1 ATOM 5617 O O . TYR D 2 93 ? 72.466 -21.379 -20.309 1.00 29.08 ? 90 TYR B O 1 ATOM 5618 C CB . TYR D 2 93 ? 73.523 -20.013 -22.802 1.00 18.86 ? 90 TYR B CB 1 ATOM 5619 C CG . TYR D 2 93 ? 74.333 -19.646 -24.022 1.00 21.73 ? 90 TYR B CG 1 ATOM 5620 C CD1 . TYR D 2 93 ? 74.768 -20.624 -24.913 1.00 19.32 ? 90 TYR B CD1 1 ATOM 5621 C CD2 . TYR D 2 93 ? 74.658 -18.321 -24.291 1.00 17.34 ? 90 TYR B CD2 1 ATOM 5622 C CE1 . TYR D 2 93 ? 75.511 -20.293 -26.037 1.00 21.33 ? 90 TYR B CE1 1 ATOM 5623 C CE2 . TYR D 2 93 ? 75.402 -17.977 -25.411 1.00 15.11 ? 90 TYR B CE2 1 ATOM 5624 C CZ . TYR D 2 93 ? 75.824 -18.969 -26.282 1.00 24.39 ? 90 TYR B CZ 1 ATOM 5625 O OH . TYR D 2 93 ? 76.565 -18.642 -27.398 1.00 26.44 ? 90 TYR B OH 1 ATOM 5626 N N . PHE D 2 94 ? 74.205 -20.237 -19.442 1.00 17.84 ? 91 PHE B N 1 ATOM 5627 C CA . PHE D 2 94 ? 73.655 -20.117 -18.099 1.00 19.32 ? 91 PHE B CA 1 ATOM 5628 C C . PHE D 2 94 ? 73.199 -18.693 -17.827 1.00 23.67 ? 91 PHE B C 1 ATOM 5629 O O . PHE D 2 94 ? 73.867 -17.737 -18.220 1.00 23.57 ? 91 PHE B O 1 ATOM 5630 C CB . PHE D 2 94 ? 74.695 -20.495 -17.037 1.00 19.32 ? 91 PHE B CB 1 ATOM 5631 C CG . PHE D 2 94 ? 75.139 -21.934 -17.074 1.00 18.88 ? 91 PHE B CG 1 ATOM 5632 C CD1 . PHE D 2 94 ? 74.352 -22.934 -16.524 1.00 16.48 ? 91 PHE B CD1 1 ATOM 5633 C CD2 . PHE D 2 94 ? 76.376 -22.275 -17.595 1.00 23.21 ? 91 PHE B CD2 1 ATOM 5634 C CE1 . PHE D 2 94 ? 74.772 -24.260 -16.533 1.00 12.84 ? 91 PHE B CE1 1 ATOM 5635 C CE2 . PHE D 2 94 ? 76.807 -23.596 -17.605 1.00 23.89 ? 91 PHE B CE2 1 ATOM 5636 C CZ . PHE D 2 94 ? 76.001 -24.591 -17.074 1.00 18.69 ? 91 PHE B CZ 1 ATOM 5637 N N . CYS D 2 95 ? 72.072 -18.553 -17.139 1.00 21.69 ? 92 CYS B N 1 ATOM 5638 C CA . CYS D 2 95 ? 71.688 -17.269 -16.573 1.00 19.81 ? 92 CYS B CA 1 ATOM 5639 C C . CYS D 2 95 ? 71.972 -17.314 -15.075 1.00 20.39 ? 92 CYS B C 1 ATOM 5640 O O . CYS D 2 95 ? 71.995 -18.391 -14.478 1.00 22.39 ? 92 CYS B O 1 ATOM 5641 C CB . CYS D 2 95 ? 70.214 -16.957 -16.849 1.00 21.36 ? 92 CYS B CB 1 ATOM 5642 S SG . CYS D 2 95 ? 69.030 -18.133 -16.131 1.00 26.71 ? 92 CYS B SG 1 ATOM 5643 N N . ALA D 2 96 ? 72.199 -16.156 -14.464 1.00 19.48 ? 93 ALA B N 1 ATOM 5644 C CA . ALA D 2 96 ? 72.520 -16.122 -13.040 1.00 21.53 ? 93 ALA B CA 1 ATOM 5645 C C . ALA D 2 96 ? 72.216 -14.762 -12.426 1.00 25.11 ? 93 ALA B C 1 ATOM 5646 O O . ALA D 2 96 ? 72.089 -13.762 -13.129 1.00 28.25 ? 93 ALA B O 1 ATOM 5647 C CB . ALA D 2 96 ? 73.992 -16.487 -12.816 1.00 12.14 ? 93 ALA B CB 1 ATOM 5648 N N . ARG D 2 97 ? 72.096 -14.736 -11.106 1.00 27.45 ? 94 ARG B N 1 ATOM 5649 C CA . ARG D 2 97 ? 71.894 -13.492 -10.386 1.00 18.15 ? 94 ARG B CA 1 ATOM 5650 C C . ARG D 2 97 ? 73.226 -12.962 -9.898 1.00 15.50 ? 94 ARG B C 1 ATOM 5651 O O . ARG D 2 97 ? 74.072 -13.723 -9.428 1.00 18.12 ? 94 ARG B O 1 ATOM 5652 C CB . ARG D 2 97 ? 70.952 -13.687 -9.203 1.00 20.46 ? 94 ARG B CB 1 ATOM 5653 C CG . ARG D 2 97 ? 70.603 -12.391 -8.494 1.00 22.07 ? 94 ARG B CG 1 ATOM 5654 C CD . ARG D 2 97 ? 69.864 -12.643 -7.197 1.00 22.82 ? 94 ARG B CD 1 ATOM 5655 N NE . ARG D 2 97 ? 70.705 -13.348 -6.237 1.00 27.14 ? 94 ARG B NE 1 ATOM 5656 C CZ . ARG D 2 97 ? 70.488 -13.370 -4.926 1.00 27.57 ? 94 ARG B CZ 1 ATOM 5657 N NH1 . ARG D 2 97 ? 69.454 -12.720 -4.412 1.00 23.02 ? 94 ARG B NH1 1 ATOM 5658 N NH2 . ARG D 2 97 ? 71.309 -14.039 -4.130 1.00 28.81 ? 94 ARG B NH2 1 ATOM 5659 N N . ARG D 2 98 ? 73.406 -11.654 -10.005 1.00 13.77 ? 95 ARG B N 1 ATOM 5660 C CA . ARG D 2 98 ? 74.607 -11.007 -9.502 1.00 12.33 ? 95 ARG B CA 1 ATOM 5661 C C . ARG D 2 98 ? 74.201 -9.847 -8.604 1.00 26.17 ? 95 ARG B C 1 ATOM 5662 O O . ARG D 2 98 ? 73.523 -8.922 -9.052 1.00 33.28 ? 95 ARG B O 1 ATOM 5663 C CB . ARG D 2 98 ? 75.476 -10.529 -10.667 1.00 14.87 ? 95 ARG B CB 1 ATOM 5664 C CG . ARG D 2 98 ? 76.924 -10.277 -10.317 1.00 22.40 ? 95 ARG B CG 1 ATOM 5665 C CD . ARG D 2 98 ? 77.319 -8.882 -10.753 1.00 26.05 ? 95 ARG B CD 1 ATOM 5666 N NE . ARG D 2 98 ? 77.102 -7.922 -9.688 1.00 29.65 ? 95 ARG B NE 1 ATOM 5667 C CZ . ARG D 2 98 ? 77.178 -6.606 -9.841 1.00 27.70 ? 95 ARG B CZ 1 ATOM 5668 N NH1 . ARG D 2 98 ? 77.442 -6.076 -11.030 1.00 23.53 ? 95 ARG B NH1 1 ATOM 5669 N NH2 . ARG D 2 98 ? 76.975 -5.824 -8.798 1.00 25.94 ? 95 ARG B NH2 1 ATOM 5670 N N . SER D 2 99 ? 74.605 -9.897 -7.339 1.00 23.51 ? 96 SER B N 1 ATOM 5671 C CA . SER D 2 99 ? 74.150 -8.913 -6.362 1.00 27.51 ? 96 SER B CA 1 ATOM 5672 C C . SER D 2 99 ? 75.045 -7.677 -6.319 1.00 28.17 ? 96 SER B C 1 ATOM 5673 O O . SER D 2 99 ? 76.112 -7.635 -6.934 1.00 23.52 ? 96 SER B O 1 ATOM 5674 C CB . SER D 2 99 ? 74.070 -9.541 -4.968 1.00 33.37 ? 96 SER B CB 1 ATOM 5675 O OG . SER D 2 99 ? 73.236 -10.686 -4.966 1.00 31.19 ? 96 SER B OG 1 ATOM 5676 N N . ASN D 2 100 ? 74.597 -6.666 -5.586 1.00 26.08 ? 97 ASN B N 1 ATOM 5677 C CA . ASN D 2 100 ? 75.313 -5.404 -5.519 1.00 29.49 ? 97 ASN B CA 1 ATOM 5678 C C . ASN D 2 100 ? 76.567 -5.499 -4.662 1.00 29.65 ? 97 ASN B C 1 ATOM 5679 O O . ASN D 2 100 ? 76.628 -6.290 -3.715 1.00 23.29 ? 97 ASN B O 1 ATOM 5680 C CB . ASN D 2 100 ? 74.401 -4.303 -4.975 1.00 28.25 ? 97 ASN B CB 1 ATOM 5681 C CG . ASN D 2 100 ? 73.148 -4.113 -5.811 1.00 39.55 ? 97 ASN B CG 1 ATOM 5682 O OD1 . ASN D 2 100 ? 73.155 -4.336 -7.021 1.00 46.53 ? 97 ASN B OD1 1 ATOM 5683 N ND2 . ASN D 2 100 ? 72.065 -3.692 -5.167 1.00 38.92 ? 97 ASN B ND2 1 ATOM 5684 N N . TRP D 2 101 ? 77.561 -4.688 -5.016 1.00 30.93 ? 98 TRP B N 1 ATOM 5685 C CA . TRP D 2 101 ? 78.764 -4.508 -4.212 1.00 29.91 ? 98 TRP B CA 1 ATOM 5686 C C . TRP D 2 101 ? 78.374 -4.294 -2.757 1.00 25.70 ? 98 TRP B C 1 ATOM 5687 O O . TRP D 2 101 ? 77.449 -3.536 -2.477 1.00 31.87 ? 98 TRP B O 1 ATOM 5688 C CB . TRP D 2 101 ? 79.574 -3.319 -4.738 1.00 24.61 ? 98 TRP B CB 1 ATOM 5689 C CG . TRP D 2 101 ? 80.952 -3.225 -4.173 1.00 24.99 ? 98 TRP B CG 1 ATOM 5690 C CD1 . TRP D 2 101 ? 82.099 -3.685 -4.743 1.00 26.72 ? 98 TRP B CD1 1 ATOM 5691 C CD2 . TRP D 2 101 ? 81.332 -2.634 -2.924 1.00 21.08 ? 98 TRP B CD2 1 ATOM 5692 N NE1 . TRP D 2 101 ? 83.172 -3.418 -3.929 1.00 26.22 ? 98 TRP B NE1 1 ATOM 5693 C CE2 . TRP D 2 101 ? 82.727 -2.773 -2.804 1.00 25.74 ? 98 TRP B CE2 1 ATOM 5694 C CE3 . TRP D 2 101 ? 80.626 -2.000 -1.896 1.00 20.28 ? 98 TRP B CE3 1 ATOM 5695 C CZ2 . TRP D 2 101 ? 83.435 -2.301 -1.696 1.00 26.36 ? 98 TRP B CZ2 1 ATOM 5696 C CZ3 . TRP D 2 101 ? 81.326 -1.536 -0.794 1.00 24.99 ? 98 TRP B CZ3 1 ATOM 5697 C CH2 . TRP D 2 101 ? 82.718 -1.685 -0.704 1.00 26.25 ? 98 TRP B CH2 1 ATOM 5698 N N . PRO D 2 102 ? 79.080 -4.948 -1.822 1.00 23.16 ? 99 PRO B N 1 ATOM 5699 C CA . PRO D 2 102 ? 80.296 -5.743 -2.009 1.00 25.45 ? 99 PRO B CA 1 ATOM 5700 C C . PRO D 2 102 ? 80.071 -7.244 -2.180 1.00 29.60 ? 99 PRO B C 1 ATOM 5701 O O . PRO D 2 102 ? 81.041 -7.998 -2.093 1.00 27.20 ? 99 PRO B O 1 ATOM 5702 C CB . PRO D 2 102 ? 81.055 -5.481 -0.712 1.00 22.32 ? 99 PRO B CB 1 ATOM 5703 C CG . PRO D 2 102 ? 79.951 -5.440 0.305 1.00 23.46 ? 99 PRO B CG 1 ATOM 5704 C CD . PRO D 2 102 ? 78.748 -4.816 -0.391 1.00 21.05 ? 99 PRO B CD 1 ATOM 5705 N N . TYR D 2 103 ? 78.830 -7.670 -2.404 1.00 27.96 ? 100 TYR B N 1 ATOM 5706 C CA . TYR D 2 103 ? 78.529 -9.092 -2.564 1.00 23.22 ? 100 TYR B CA 1 ATOM 5707 C C . TYR D 2 103 ? 78.359 -9.439 -4.044 1.00 25.15 ? 100 TYR B C 1 ATOM 5708 O O . TYR D 2 103 ? 77.242 -9.498 -4.550 1.00 22.88 ? 100 TYR B O 1 ATOM 5709 C CB . TYR D 2 103 ? 77.273 -9.457 -1.767 1.00 23.91 ? 100 TYR B CB 1 ATOM 5710 C CG . TYR D 2 103 ? 76.853 -10.910 -1.872 1.00 29.73 ? 100 TYR B CG 1 ATOM 5711 C CD1 . TYR D 2 103 ? 77.727 -11.937 -1.534 1.00 30.80 ? 100 TYR B CD1 1 ATOM 5712 C CD2 . TYR D 2 103 ? 75.574 -11.253 -2.288 1.00 33.77 ? 100 TYR B CD2 1 ATOM 5713 C CE1 . TYR D 2 103 ? 77.341 -13.267 -1.625 1.00 34.43 ? 100 TYR B CE1 1 ATOM 5714 C CE2 . TYR D 2 103 ? 75.177 -12.582 -2.381 1.00 33.01 ? 100 TYR B CE2 1 ATOM 5715 C CZ . TYR D 2 103 ? 76.066 -13.581 -2.048 1.00 35.48 ? 100 TYR B CZ 1 ATOM 5716 O OH . TYR D 2 103 ? 75.676 -14.899 -2.141 1.00 36.52 ? 100 TYR B OH 1 ATOM 5717 N N . LEU D 2 104 A 79.474 -9.688 -4.729 1.00 26.83 ? 100 LEU B N 1 ATOM 5718 C CA . LEU D 2 104 A 79.485 -9.764 -6.195 1.00 18.95 ? 100 LEU B CA 1 ATOM 5719 C C . LEU D 2 104 A 79.394 -11.131 -6.917 1.00 23.62 ? 100 LEU B C 1 ATOM 5720 O O . LEU D 2 104 A 79.337 -11.152 -8.147 1.00 22.24 ? 100 LEU B O 1 ATOM 5721 C CB . LEU D 2 104 A 80.755 -9.073 -6.698 1.00 21.54 ? 100 LEU B CB 1 ATOM 5722 C CG . LEU D 2 104 A 80.898 -7.592 -6.345 1.00 23.65 ? 100 LEU B CG 1 ATOM 5723 C CD1 . LEU D 2 104 A 82.305 -7.118 -6.646 1.00 21.97 ? 100 LEU B CD1 1 ATOM 5724 C CD2 . LEU D 2 104 A 79.875 -6.760 -7.105 1.00 18.81 ? 100 LEU B CD2 1 ATOM 5725 N N . PRO D 2 105 B 79.387 -12.268 -6.194 1.00 18.69 ? 100 PRO B N 1 ATOM 5726 C CA . PRO D 2 105 B 79.438 -13.490 -7.007 1.00 17.79 ? 100 PRO B CA 1 ATOM 5727 C C . PRO D 2 105 B 78.129 -13.804 -7.733 1.00 23.74 ? 100 PRO B C 1 ATOM 5728 O O . PRO D 2 105 B 77.104 -13.178 -7.459 1.00 27.10 ? 100 PRO B O 1 ATOM 5729 C CB . PRO D 2 105 B 79.735 -14.569 -5.972 1.00 23.65 ? 100 PRO B CB 1 ATOM 5730 C CG . PRO D 2 105 B 79.042 -14.075 -4.763 1.00 22.96 ? 100 PRO B CG 1 ATOM 5731 C CD . PRO D 2 105 B 79.233 -12.589 -4.762 1.00 20.16 ? 100 PRO B CD 1 ATOM 5732 N N . PHE D 2 106 C 78.173 -14.769 -8.649 1.00 26.46 ? 100 PHE B N 1 ATOM 5733 C CA . PHE D 2 106 C 76.970 -15.253 -9.320 1.00 23.98 ? 100 PHE B CA 1 ATOM 5734 C C . PHE D 2 106 C 76.261 -16.298 -8.457 1.00 24.81 ? 100 PHE B C 1 ATOM 5735 O O . PHE D 2 106 C 76.834 -17.349 -8.160 1.00 21.83 ? 100 PHE B O 1 ATOM 5736 C CB . PHE D 2 106 C 77.308 -15.857 -10.688 1.00 22.55 ? 100 PHE B CB 1 ATOM 5737 C CG . PHE D 2 106 C 77.911 -14.881 -11.660 1.00 26.05 ? 100 PHE B CG 1 ATOM 5738 C CD1 . PHE D 2 106 C 77.205 -13.762 -12.070 1.00 28.35 ? 100 PHE B CD1 1 ATOM 5739 C CD2 . PHE D 2 106 C 79.177 -15.098 -12.183 1.00 29.07 ? 100 PHE B CD2 1 ATOM 5740 C CE1 . PHE D 2 106 C 77.757 -12.863 -12.970 1.00 26.49 ? 100 PHE B CE1 1 ATOM 5741 C CE2 . PHE D 2 106 C 79.733 -14.208 -13.084 1.00 25.92 ? 100 PHE B CE2 1 ATOM 5742 C CZ . PHE D 2 106 C 79.022 -13.086 -13.477 1.00 26.52 ? 100 PHE B CZ 1 ATOM 5743 N N . ASP D 2 107 ? 75.022 -16.003 -8.065 1.00 22.55 ? 101 ASP B N 1 ATOM 5744 C CA . ASP D 2 107 ? 74.201 -16.924 -7.277 1.00 22.02 ? 101 ASP B CA 1 ATOM 5745 C C . ASP D 2 107 ? 72.791 -16.361 -7.090 1.00 22.84 ? 101 ASP B C 1 ATOM 5746 O O . ASP D 2 107 ? 72.639 -15.222 -6.664 1.00 22.83 ? 101 ASP B O 1 ATOM 5747 C CB . ASP D 2 107 ? 74.837 -17.189 -5.908 1.00 23.33 ? 101 ASP B CB 1 ATOM 5748 C CG . ASP D 2 107 ? 74.122 -18.276 -5.139 1.00 28.27 ? 101 ASP B CG 1 ATOM 5749 O OD1 . ASP D 2 107 ? 73.945 -19.377 -5.696 1.00 34.12 ? 101 ASP B OD1 1 ATOM 5750 O OD2 . ASP D 2 107 ? 73.724 -18.033 -3.981 1.00 40.21 ? 101 ASP B OD2 1 ATOM 5751 N N . PRO D 2 108 ? 71.749 -17.154 -7.404 1.00 24.96 ? 102 PRO B N 1 ATOM 5752 C CA . PRO D 2 108 ? 71.779 -18.516 -7.946 1.00 15.67 ? 102 PRO B CA 1 ATOM 5753 C C . PRO D 2 108 ? 72.013 -18.548 -9.454 1.00 21.60 ? 102 PRO B C 1 ATOM 5754 O O . PRO D 2 108 ? 72.090 -17.496 -10.098 1.00 18.29 ? 102 PRO B O 1 ATOM 5755 C CB . PRO D 2 108 ? 70.378 -19.065 -7.620 1.00 19.39 ? 102 PRO B CB 1 ATOM 5756 C CG . PRO D 2 108 ? 69.672 -17.996 -6.835 1.00 24.08 ? 102 PRO B CG 1 ATOM 5757 C CD . PRO D 2 108 ? 70.369 -16.715 -7.143 1.00 27.54 ? 102 PRO B CD 1 ATOM 5758 N N . TRP D 2 109 ? 72.109 -19.760 -9.996 1.00 16.31 ? 103 TRP B N 1 ATOM 5759 C CA . TRP D 2 109 ? 72.308 -19.996 -11.421 1.00 21.31 ? 103 TRP B CA 1 ATOM 5760 C C . TRP D 2 109 ? 71.112 -20.711 -12.033 1.00 23.07 ? 103 TRP B C 1 ATOM 5761 O O . TRP D 2 109 ? 70.457 -21.504 -11.363 1.00 22.29 ? 103 TRP B O 1 ATOM 5762 C CB . TRP D 2 109 ? 73.544 -20.864 -11.660 1.00 22.84 ? 103 TRP B CB 1 ATOM 5763 C CG . TRP D 2 109 ? 74.866 -20.262 -11.336 1.00 22.06 ? 103 TRP B CG 1 ATOM 5764 C CD1 . TRP D 2 109 ? 75.341 -19.930 -10.101 1.00 16.62 ? 103 TRP B CD1 1 ATOM 5765 C CD2 . TRP D 2 109 ? 75.918 -19.978 -12.262 1.00 18.58 ? 103 TRP B CD2 1 ATOM 5766 N NE1 . TRP D 2 109 ? 76.616 -19.431 -10.207 1.00 21.72 ? 103 TRP B NE1 1 ATOM 5767 C CE2 . TRP D 2 109 ? 76.996 -19.455 -11.525 1.00 15.89 ? 103 TRP B CE2 1 ATOM 5768 C CE3 . TRP D 2 109 ? 76.050 -20.110 -13.649 1.00 20.46 ? 103 TRP B CE3 1 ATOM 5769 C CZ2 . TRP D 2 109 ? 78.190 -19.058 -12.122 1.00 20.59 ? 103 TRP B CZ2 1 ATOM 5770 C CZ3 . TRP D 2 109 ? 77.233 -19.715 -14.244 1.00 23.81 ? 103 TRP B CZ3 1 ATOM 5771 C CH2 . TRP D 2 109 ? 78.291 -19.197 -13.480 1.00 19.85 ? 103 TRP B CH2 1 ATOM 5772 N N . GLY D 2 110 ? 70.854 -20.469 -13.315 1.00 25.38 ? 104 GLY B N 1 ATOM 5773 C CA . GLY D 2 110 ? 69.876 -21.258 -14.048 1.00 25.24 ? 104 GLY B CA 1 ATOM 5774 C C . GLY D 2 110 ? 70.462 -22.619 -14.382 1.00 27.40 ? 104 GLY B C 1 ATOM 5775 O O . GLY D 2 110 ? 71.655 -22.839 -14.187 1.00 26.89 ? 104 GLY B O 1 ATOM 5776 N N . GLN D 2 111 ? 69.638 -23.534 -14.887 1.00 30.25 ? 105 GLN B N 1 ATOM 5777 C CA . GLN D 2 111 ? 70.093 -24.904 -15.133 1.00 27.35 ? 105 GLN B CA 1 ATOM 5778 C C . GLN D 2 111 ? 70.907 -25.001 -16.421 1.00 27.91 ? 105 GLN B C 1 ATOM 5779 O O . GLN D 2 111 ? 71.543 -26.017 -16.681 1.00 30.21 ? 105 GLN B O 1 ATOM 5780 C CB . GLN D 2 111 ? 68.903 -25.875 -15.187 1.00 35.40 ? 105 GLN B CB 1 ATOM 5781 C CG . GLN D 2 111 ? 68.155 -25.924 -16.535 1.00 47.04 ? 105 GLN B CG 1 ATOM 5782 C CD . GLN D 2 111 ? 67.079 -24.849 -16.680 1.00 56.52 ? 105 GLN B CD 1 ATOM 5783 O OE1 . GLN D 2 111 ? 66.993 -23.920 -15.876 1.00 55.74 ? 105 GLN B OE1 1 ATOM 5784 N NE2 . GLN D 2 111 ? 66.248 -24.983 -17.709 1.00 56.71 ? 105 GLN B NE2 1 ATOM 5785 N N . GLY D 2 112 ? 70.885 -23.942 -17.227 1.00 27.71 ? 106 GLY B N 1 ATOM 5786 C CA . GLY D 2 112 ? 71.631 -23.922 -18.471 1.00 27.41 ? 106 GLY B CA 1 ATOM 5787 C C . GLY D 2 112 ? 70.811 -24.387 -19.659 1.00 31.48 ? 106 GLY B C 1 ATOM 5788 O O . GLY D 2 112 ? 69.924 -25.228 -19.531 1.00 29.98 ? 106 GLY B O 1 ATOM 5789 N N . THR D 2 113 ? 71.107 -23.826 -20.824 1.00 30.57 ? 107 THR B N 1 ATOM 5790 C CA . THR D 2 113 ? 70.455 -24.237 -22.057 1.00 24.81 ? 107 THR B CA 1 ATOM 5791 C C . THR D 2 113 ? 71.487 -24.589 -23.105 1.00 22.11 ? 107 THR B C 1 ATOM 5792 O O . THR D 2 113 ? 72.347 -23.773 -23.435 1.00 26.24 ? 107 THR B O 1 ATOM 5793 C CB . THR D 2 113 ? 69.546 -23.142 -22.619 1.00 30.29 ? 107 THR B CB 1 ATOM 5794 O OG1 . THR D 2 113 ? 68.530 -22.829 -21.660 1.00 41.31 ? 107 THR B OG1 1 ATOM 5795 C CG2 . THR D 2 113 ? 68.898 -23.615 -23.913 1.00 32.29 ? 107 THR B CG2 1 ATOM 5796 N N . LEU D 2 114 ? 71.394 -25.803 -23.635 1.00 24.09 ? 108 LEU B N 1 ATOM 5797 C CA . LEU D 2 114 ? 72.314 -26.244 -24.672 1.00 28.65 ? 108 LEU B CA 1 ATOM 5798 C C . LEU D 2 114 ? 72.027 -25.525 -25.989 1.00 27.66 ? 108 LEU B C 1 ATOM 5799 O O . LEU D 2 114 ? 70.927 -25.623 -26.541 1.00 22.08 ? 108 LEU B O 1 ATOM 5800 C CB . LEU D 2 114 ? 72.224 -27.758 -24.861 1.00 33.49 ? 108 LEU B CB 1 ATOM 5801 C CG . LEU D 2 114 ? 73.117 -28.344 -25.955 1.00 38.08 ? 108 LEU B CG 1 ATOM 5802 C CD1 . LEU D 2 114 ? 74.581 -28.097 -25.634 1.00 35.19 ? 108 LEU B CD1 1 ATOM 5803 C CD2 . LEU D 2 114 ? 72.836 -29.830 -26.129 1.00 39.92 ? 108 LEU B CD2 1 ATOM 5804 N N . VAL D 2 115 ? 73.018 -24.788 -26.479 1.00 31.67 ? 109 VAL B N 1 ATOM 5805 C CA . VAL D 2 115 ? 72.888 -24.098 -27.755 1.00 30.75 ? 109 VAL B CA 1 ATOM 5806 C C . VAL D 2 115 ? 73.873 -24.668 -28.768 1.00 35.23 ? 109 VAL B C 1 ATOM 5807 O O . VAL D 2 115 ? 75.088 -24.666 -28.547 1.00 32.60 ? 109 VAL B O 1 ATOM 5808 C CB . VAL D 2 115 ? 73.112 -22.584 -27.613 1.00 29.23 ? 109 VAL B CB 1 ATOM 5809 C CG1 . VAL D 2 115 ? 73.048 -21.907 -28.976 1.00 23.61 ? 109 VAL B CG1 1 ATOM 5810 C CG2 . VAL D 2 115 ? 72.072 -21.987 -26.674 1.00 32.11 ? 109 VAL B CG2 1 ATOM 5811 N N . THR D 2 116 ? 73.328 -25.159 -29.877 1.00 28.85 ? 110 THR B N 1 ATOM 5812 C CA . THR D 2 116 ? 74.119 -25.767 -30.935 1.00 27.72 ? 110 THR B CA 1 ATOM 5813 C C . THR D 2 116 ? 74.017 -24.934 -32.198 1.00 26.25 ? 110 THR B C 1 ATOM 5814 O O . THR D 2 116 ? 72.921 -24.715 -32.714 1.00 27.35 ? 110 THR B O 1 ATOM 5815 C CB . THR D 2 116 ? 73.649 -27.203 -31.237 1.00 29.50 ? 110 THR B CB 1 ATOM 5816 O OG1 . THR D 2 116 ? 73.530 -27.935 -30.013 1.00 34.18 ? 110 THR B OG1 1 ATOM 5817 C CG2 . THR D 2 116 ? 74.631 -27.909 -32.164 1.00 29.49 ? 110 THR B CG2 1 ATOM 5818 N N . VAL D 2 117 ? 75.153 -24.453 -32.688 1.00 28.86 ? 111 VAL B N 1 ATOM 5819 C CA . VAL D 2 117 ? 75.160 -23.694 -33.930 1.00 31.61 ? 111 VAL B CA 1 ATOM 5820 C C . VAL D 2 117 ? 75.870 -24.496 -35.006 1.00 33.52 ? 111 VAL B C 1 ATOM 5821 O O . VAL D 2 117 ? 77.069 -24.750 -34.909 1.00 30.98 ? 111 VAL B O 1 ATOM 5822 C CB . VAL D 2 117 ? 75.846 -22.326 -33.775 1.00 28.93 ? 111 VAL B CB 1 ATOM 5823 C CG1 . VAL D 2 117 ? 75.715 -21.526 -35.063 1.00 28.34 ? 111 VAL B CG1 1 ATOM 5824 C CG2 . VAL D 2 117 ? 75.237 -21.563 -32.614 1.00 29.35 ? 111 VAL B CG2 1 ATOM 5825 N N . SER D 2 118 ? 75.122 -24.901 -36.025 1.00 28.21 ? 112 SER B N 1 ATOM 5826 C CA . SER D 2 118 ? 75.682 -25.715 -37.094 1.00 28.93 ? 112 SER B CA 1 ATOM 5827 C C . SER D 2 118 ? 74.823 -25.628 -38.342 1.00 26.57 ? 112 SER B C 1 ATOM 5828 O O . SER D 2 118 ? 73.644 -25.300 -38.267 1.00 38.48 ? 112 SER B O 1 ATOM 5829 C CB . SER D 2 118 ? 75.812 -27.173 -36.643 1.00 31.98 ? 112 SER B CB 1 ATOM 5830 O OG . SER D 2 118 ? 76.075 -28.022 -37.746 1.00 36.50 ? 112 SER B OG 1 ATOM 5831 N N . SER D 2 119 ? 75.414 -25.921 -39.492 1.00 30.69 ? 113 SER B N 1 ATOM 5832 C CA . SER D 2 119 ? 74.660 -25.920 -40.739 1.00 34.18 ? 113 SER B CA 1 ATOM 5833 C C . SER D 2 119 ? 73.933 -27.250 -40.925 1.00 32.72 ? 113 SER B C 1 ATOM 5834 O O . SER D 2 119 ? 73.102 -27.390 -41.822 1.00 34.29 ? 113 SER B O 1 ATOM 5835 C CB . SER D 2 119 ? 75.578 -25.650 -41.934 1.00 42.81 ? 113 SER B CB 1 ATOM 5836 O OG . SER D 2 119 ? 76.543 -26.683 -42.082 1.00 51.15 ? 113 SER B OG 1 ATOM 5837 N N . ALA D 2 120 ? 74.252 -28.223 -40.074 1.00 28.27 ? 114 ALA B N 1 ATOM 5838 C CA . ALA D 2 120 ? 73.621 -29.540 -40.148 1.00 32.13 ? 114 ALA B CA 1 ATOM 5839 C C . ALA D 2 120 ? 72.111 -29.437 -39.955 1.00 39.11 ? 114 ALA B C 1 ATOM 5840 O O . ALA D 2 120 ? 71.618 -28.511 -39.310 1.00 36.51 ? 114 ALA B O 1 ATOM 5841 C CB . ALA D 2 120 ? 74.222 -30.482 -39.111 1.00 29.72 ? 114 ALA B CB 1 ATOM 5842 N N . SER D 2 121 ? 71.376 -30.388 -40.518 1.00 37.79 ? 115 SER B N 1 ATOM 5843 C CA . SER D 2 121 ? 69.933 -30.401 -40.354 1.00 39.25 ? 115 SER B CA 1 ATOM 5844 C C . SER D 2 121 ? 69.526 -31.412 -39.291 1.00 30.43 ? 115 SER B C 1 ATOM 5845 O O . SER D 2 121 ? 70.212 -32.415 -39.087 1.00 34.95 ? 115 SER B O 1 ATOM 5846 C CB . SER D 2 121 ? 69.247 -30.715 -41.685 1.00 53.36 ? 115 SER B CB 1 ATOM 5847 O OG . SER D 2 121 ? 68.025 -30.008 -41.799 1.00 63.08 ? 115 SER B OG 1 ATOM 5848 N N . THR D 2 122 ? 68.416 -31.135 -38.613 1.00 31.28 ? 116 THR B N 1 ATOM 5849 C CA . THR D 2 122 ? 67.878 -32.044 -37.608 1.00 38.49 ? 116 THR B CA 1 ATOM 5850 C C . THR D 2 122 ? 67.678 -33.427 -38.216 1.00 38.98 ? 116 THR B C 1 ATOM 5851 O O . THR D 2 122 ? 67.155 -33.564 -39.322 1.00 33.83 ? 116 THR B O 1 ATOM 5852 C CB . THR D 2 122 ? 66.543 -31.532 -37.027 1.00 39.99 ? 116 THR B CB 1 ATOM 5853 O OG1 . THR D 2 122 ? 66.762 -30.293 -36.339 1.00 41.86 ? 116 THR B OG1 1 ATOM 5854 C CG2 . THR D 2 122 ? 65.956 -32.542 -36.051 1.00 35.36 ? 116 THR B CG2 1 ATOM 5855 N N . LYS D 2 123 ? 68.123 -34.448 -37.497 1.00 36.82 ? 117 LYS B N 1 ATOM 5856 C CA . LYS D 2 123 ? 68.098 -35.806 -38.012 1.00 36.68 ? 117 LYS B CA 1 ATOM 5857 C C . LYS D 2 123 ? 67.981 -36.807 -36.871 1.00 37.41 ? 117 LYS B C 1 ATOM 5858 O O . LYS D 2 123 ? 68.705 -36.718 -35.879 1.00 38.17 ? 117 LYS B O 1 ATOM 5859 C CB . LYS D 2 123 ? 69.357 -36.074 -38.840 1.00 36.83 ? 117 LYS B CB 1 ATOM 5860 C CG . LYS D 2 123 ? 69.358 -37.390 -39.593 1.00 36.81 ? 117 LYS B CG 1 ATOM 5861 C CD . LYS D 2 123 ? 70.521 -37.431 -40.568 1.00 45.18 ? 117 LYS B CD 1 ATOM 5862 C CE . LYS D 2 123 ? 70.520 -38.706 -41.387 1.00 51.54 ? 117 LYS B CE 1 ATOM 5863 N NZ . LYS D 2 123 ? 70.704 -39.900 -40.524 1.00 56.71 ? 117 LYS B NZ 1 ATOM 5864 N N . GLY D 2 124 ? 67.056 -37.751 -37.014 1.00 36.37 ? 118 GLY B N 1 ATOM 5865 C CA . GLY D 2 124 ? 66.872 -38.801 -36.028 1.00 40.90 ? 118 GLY B CA 1 ATOM 5866 C C . GLY D 2 124 ? 67.920 -39.886 -36.171 1.00 39.02 ? 118 GLY B C 1 ATOM 5867 O O . GLY D 2 124 ? 68.495 -40.054 -37.242 1.00 31.68 ? 118 GLY B O 1 ATOM 5868 N N . PRO D 2 125 ? 68.163 -40.642 -35.092 1.00 33.87 ? 119 PRO B N 1 ATOM 5869 C CA . PRO D 2 125 ? 69.242 -41.632 -35.038 1.00 29.68 ? 119 PRO B CA 1 ATOM 5870 C C . PRO D 2 125 ? 68.918 -42.951 -35.722 1.00 36.71 ? 119 PRO B C 1 ATOM 5871 O O . PRO D 2 125 ? 67.761 -43.373 -35.774 1.00 37.59 ? 119 PRO B O 1 ATOM 5872 C CB . PRO D 2 125 ? 69.428 -41.868 -33.536 1.00 32.72 ? 119 PRO B CB 1 ATOM 5873 C CG . PRO D 2 125 ? 68.310 -41.114 -32.839 1.00 32.85 ? 119 PRO B CG 1 ATOM 5874 C CD . PRO D 2 125 ? 67.342 -40.671 -33.873 1.00 35.72 ? 119 PRO B CD 1 ATOM 5875 N N . SER D 2 126 ? 69.952 -43.596 -36.244 1.00 32.93 ? 120 SER B N 1 ATOM 5876 C CA . SER D 2 126 ? 69.853 -44.989 -36.641 1.00 31.21 ? 120 SER B CA 1 ATOM 5877 C C . SER D 2 126 ? 70.299 -45.824 -35.454 1.00 33.01 ? 120 SER B C 1 ATOM 5878 O O . SER D 2 126 ? 71.332 -45.539 -34.850 1.00 34.28 ? 120 SER B O 1 ATOM 5879 C CB . SER D 2 126 ? 70.712 -45.276 -37.872 1.00 34.15 ? 120 SER B CB 1 ATOM 5880 O OG . SER D 2 126 ? 70.456 -44.331 -38.897 1.00 37.71 ? 120 SER B OG 1 ATOM 5881 N N . VAL D 2 127 ? 69.523 -46.842 -35.103 1.00 28.49 ? 121 VAL B N 1 ATOM 5882 C CA . VAL D 2 127 ? 69.858 -47.653 -33.944 1.00 23.45 ? 121 VAL B CA 1 ATOM 5883 C C . VAL D 2 127 ? 70.225 -49.073 -34.340 1.00 34.77 ? 121 VAL B C 1 ATOM 5884 O O . VAL D 2 127 ? 69.412 -49.803 -34.899 1.00 38.58 ? 121 VAL B O 1 ATOM 5885 C CB . VAL D 2 127 ? 68.707 -47.699 -32.934 1.00 28.54 ? 121 VAL B CB 1 ATOM 5886 C CG1 . VAL D 2 127 ? 69.118 -48.517 -31.707 1.00 29.67 ? 121 VAL B CG1 1 ATOM 5887 C CG2 . VAL D 2 127 ? 68.305 -46.289 -32.529 1.00 22.73 ? 121 VAL B CG2 1 ATOM 5888 N N . PHE D 2 128 ? 71.459 -49.460 -34.040 1.00 30.45 ? 122 PHE B N 1 ATOM 5889 C CA . PHE D 2 128 ? 71.951 -50.778 -34.400 1.00 28.18 ? 122 PHE B CA 1 ATOM 5890 C C . PHE D 2 128 ? 72.316 -51.573 -33.153 1.00 29.69 ? 122 PHE B C 1 ATOM 5891 O O . PHE D 2 128 ? 72.805 -51.012 -32.172 1.00 27.46 ? 122 PHE B O 1 ATOM 5892 C CB . PHE D 2 128 ? 73.160 -50.663 -35.329 1.00 22.78 ? 122 PHE B CB 1 ATOM 5893 C CG . PHE D 2 128 ? 72.925 -49.787 -36.530 1.00 25.54 ? 122 PHE B CG 1 ATOM 5894 C CD1 . PHE D 2 128 ? 72.034 -50.171 -37.522 1.00 24.87 ? 122 PHE B CD1 1 ATOM 5895 C CD2 . PHE D 2 128 ? 73.606 -48.588 -36.673 1.00 27.75 ? 122 PHE B CD2 1 ATOM 5896 C CE1 . PHE D 2 128 ? 71.821 -49.368 -38.632 1.00 29.32 ? 122 PHE B CE1 1 ATOM 5897 C CE2 . PHE D 2 128 ? 73.400 -47.782 -37.779 1.00 30.34 ? 122 PHE B CE2 1 ATOM 5898 C CZ . PHE D 2 128 ? 72.509 -48.173 -38.761 1.00 30.41 ? 122 PHE B CZ 1 ATOM 5899 N N . PRO D 2 129 ? 72.069 -52.887 -33.184 1.00 34.23 ? 123 PRO B N 1 ATOM 5900 C CA . PRO D 2 129 ? 72.407 -53.742 -32.045 1.00 29.13 ? 123 PRO B CA 1 ATOM 5901 C C . PRO D 2 129 ? 73.906 -53.957 -31.891 1.00 28.01 ? 123 PRO B C 1 ATOM 5902 O O . PRO D 2 129 ? 74.636 -54.065 -32.878 1.00 31.27 ? 123 PRO B O 1 ATOM 5903 C CB . PRO D 2 129 ? 71.708 -55.064 -32.380 1.00 27.48 ? 123 PRO B CB 1 ATOM 5904 C CG . PRO D 2 129 ? 71.615 -55.064 -33.873 1.00 27.41 ? 123 PRO B CG 1 ATOM 5905 C CD . PRO D 2 129 ? 71.380 -53.631 -34.252 1.00 28.80 ? 123 PRO B CD 1 ATOM 5906 N N . LEU D 2 130 ? 74.351 -53.991 -30.641 1.00 21.53 ? 124 LEU B N 1 ATOM 5907 C CA . LEU D 2 130 ? 75.664 -54.511 -30.297 1.00 25.94 ? 124 LEU B CA 1 ATOM 5908 C C . LEU D 2 130 ? 75.410 -55.886 -29.685 1.00 31.99 ? 124 LEU B C 1 ATOM 5909 O O . LEU D 2 130 ? 75.104 -56.011 -28.495 1.00 26.66 ? 124 LEU B O 1 ATOM 5910 C CB . LEU D 2 130 ? 76.402 -53.578 -29.335 1.00 30.56 ? 124 LEU B CB 1 ATOM 5911 C CG . LEU D 2 130 ? 76.723 -52.184 -29.884 1.00 31.55 ? 124 LEU B CG 1 ATOM 5912 C CD1 . LEU D 2 130 ? 77.167 -51.230 -28.781 1.00 21.35 ? 124 LEU B CD1 1 ATOM 5913 C CD2 . LEU D 2 130 ? 77.786 -52.275 -30.971 1.00 26.73 ? 124 LEU B CD2 1 ATOM 5914 N N . ALA D 2 131 ? 75.493 -56.913 -30.522 1.00 33.78 ? 125 ALA B N 1 ATOM 5915 C CA . ALA D 2 131 ? 75.034 -58.243 -30.141 1.00 38.97 ? 125 ALA B CA 1 ATOM 5916 C C . ALA D 2 131 ? 76.012 -58.952 -29.213 1.00 41.53 ? 125 ALA B C 1 ATOM 5917 O O . ALA D 2 131 ? 77.222 -58.915 -29.427 1.00 38.54 ? 125 ALA B O 1 ATOM 5918 C CB . ALA D 2 131 ? 74.781 -59.087 -31.385 1.00 34.71 ? 125 ALA B CB 1 ATOM 5919 N N . PRO D 2 132 ? 75.477 -59.610 -28.176 1.00 52.36 ? 126 PRO B N 1 ATOM 5920 C CA . PRO D 2 132 ? 76.276 -60.436 -27.273 1.00 60.69 ? 126 PRO B CA 1 ATOM 5921 C C . PRO D 2 132 ? 76.659 -61.733 -27.965 1.00 75.71 ? 126 PRO B C 1 ATOM 5922 O O . PRO D 2 132 ? 75.931 -62.188 -28.847 1.00 75.64 ? 126 PRO B O 1 ATOM 5923 C CB . PRO D 2 132 ? 75.326 -60.691 -26.106 1.00 55.38 ? 126 PRO B CB 1 ATOM 5924 C CG . PRO D 2 132 ? 73.979 -60.700 -26.746 1.00 53.47 ? 126 PRO B CG 1 ATOM 5925 C CD . PRO D 2 132 ? 74.039 -59.682 -27.859 1.00 55.25 ? 126 PRO B CD 1 ATOM 5926 N N . SER D 2 133 ? 77.785 -62.316 -27.581 1.00 97.57 ? 127 SER B N 1 ATOM 5927 C CA . SER D 2 133 ? 78.233 -63.556 -28.196 1.00 120.21 ? 127 SER B CA 1 ATOM 5928 C C . SER D 2 133 ? 79.139 -64.327 -27.251 1.00 132.78 ? 127 SER B C 1 ATOM 5929 O O . SER D 2 133 ? 79.594 -63.788 -26.243 1.00 132.64 ? 127 SER B O 1 ATOM 5930 C CB . SER D 2 133 ? 78.949 -63.268 -29.516 1.00 128.23 ? 127 SER B CB 1 ATOM 5931 O OG . SER D 2 133 ? 79.804 -62.143 -29.399 1.00 130.36 ? 127 SER B OG 1 ATOM 5932 N N . SER D 2 134 ? 79.398 -65.589 -27.581 1.00 147.57 ? 128 SER B N 1 ATOM 5933 C CA . SER D 2 134 ? 80.197 -66.456 -26.722 1.00 161.59 ? 128 SER B CA 1 ATOM 5934 C C . SER D 2 134 ? 81.641 -65.975 -26.620 1.00 179.08 ? 128 SER B C 1 ATOM 5935 O O . SER D 2 134 ? 82.358 -66.345 -25.691 1.00 177.74 ? 128 SER B O 1 ATOM 5936 C CB . SER D 2 134 ? 80.153 -67.897 -27.228 1.00 155.29 ? 128 SER B CB 1 ATOM 5937 O OG . SER D 2 134 ? 78.863 -68.456 -27.046 1.00 152.37 ? 128 SER B OG 1 ATOM 5938 N N . LYS D 2 135 ? 82.064 -65.152 -27.577 1.00 200.98 ? 129 LYS B N 1 ATOM 5939 C CA . LYS D 2 135 ? 83.344 -64.462 -27.465 1.00 221.85 ? 129 LYS B CA 1 ATOM 5940 C C . LYS D 2 135 ? 83.101 -63.077 -26.850 1.00 217.25 ? 129 LYS B C 1 ATOM 5941 O O . LYS D 2 135 ? 83.591 -62.053 -27.333 1.00 225.12 ? 129 LYS B O 1 ATOM 5942 C CB . LYS D 2 135 ? 84.061 -64.377 -28.825 1.00 232.98 ? 129 LYS B CB 1 ATOM 5943 C CG . LYS D 2 135 ? 83.385 -63.547 -29.917 1.00 233.78 ? 129 LYS B CG 1 ATOM 5944 C CD . LYS D 2 135 ? 82.295 -64.302 -30.658 1.00 237.39 ? 129 LYS B CD 1 ATOM 5945 C CE . LYS D 2 135 ? 81.705 -63.436 -31.761 1.00 238.55 ? 129 LYS B CE 1 ATOM 5946 N NZ . LYS D 2 135 ? 82.749 -62.972 -32.712 1.00 239.10 ? 129 LYS B NZ 1 ATOM 5947 N N . SER D 2 136 ? 82.322 -63.079 -25.769 1.00 208.25 ? 130 SER B N 1 ATOM 5948 C CA . SER D 2 136 ? 82.057 -61.898 -24.952 1.00 195.69 ? 130 SER B CA 1 ATOM 5949 C C . SER D 2 136 ? 81.555 -62.344 -23.578 1.00 188.05 ? 130 SER B C 1 ATOM 5950 O O . SER D 2 136 ? 80.991 -61.555 -22.821 1.00 184.92 ? 130 SER B O 1 ATOM 5951 C CB . SER D 2 136 ? 81.040 -60.973 -25.622 1.00 189.08 ? 130 SER B CB 1 ATOM 5952 O OG . SER D 2 136 ? 81.610 -60.315 -26.741 1.00 184.46 ? 130 SER B OG 1 ATOM 5953 N N . THR D 2 137 ? 81.760 -63.623 -23.275 1.00 184.69 ? 131 THR B N 1 ATOM 5954 C CA . THR D 2 137 ? 81.404 -64.186 -21.977 1.00 180.21 ? 131 THR B CA 1 ATOM 5955 C C . THR D 2 137 ? 82.595 -64.058 -21.034 1.00 174.05 ? 131 THR B C 1 ATOM 5956 O O . THR D 2 137 ? 83.394 -64.985 -20.897 1.00 173.58 ? 131 THR B O 1 ATOM 5957 C CB . THR D 2 137 ? 80.979 -65.668 -22.095 1.00 181.20 ? 131 THR B CB 1 ATOM 5958 O OG1 . THR D 2 137 ? 79.902 -65.787 -23.034 1.00 181.24 ? 131 THR B OG1 1 ATOM 5959 C CG2 . THR D 2 137 ? 80.536 -66.222 -20.743 1.00 181.59 ? 131 THR B CG2 1 ATOM 5960 N N . SER D 2 138 ? 82.721 -62.895 -20.403 1.00 168.44 ? 132 SER B N 1 ATOM 5961 C CA . SER D 2 138 ? 83.840 -62.626 -19.507 1.00 163.08 ? 132 SER B CA 1 ATOM 5962 C C . SER D 2 138 ? 83.564 -63.172 -18.111 1.00 158.38 ? 132 SER B C 1 ATOM 5963 O O . SER D 2 138 ? 83.102 -62.447 -17.228 1.00 158.93 ? 132 SER B O 1 ATOM 5964 C CB . SER D 2 138 ? 84.129 -61.122 -19.442 1.00 160.45 ? 132 SER B CB 1 ATOM 5965 O OG . SER D 2 138 ? 85.270 -60.852 -18.644 1.00 158.61 ? 132 SER B OG 1 ATOM 5966 N N . GLY D 2 139 ? 83.850 -64.456 -17.922 1.00 150.92 ? 133 GLY B N 1 ATOM 5967 C CA . GLY D 2 139 ? 83.637 -65.112 -16.645 1.00 140.68 ? 133 GLY B CA 1 ATOM 5968 C C . GLY D 2 139 ? 82.174 -65.193 -16.255 1.00 132.47 ? 133 GLY B C 1 ATOM 5969 O O . GLY D 2 139 ? 81.793 -64.771 -15.163 1.00 135.41 ? 133 GLY B O 1 ATOM 5970 N N . GLY D 2 140 ? 81.350 -65.733 -17.150 1.00 119.16 ? 134 GLY B N 1 ATOM 5971 C CA . GLY D 2 140 ? 79.926 -65.877 -16.896 1.00 101.14 ? 134 GLY B CA 1 ATOM 5972 C C . GLY D 2 140 ? 79.143 -64.594 -17.111 1.00 77.51 ? 134 GLY B C 1 ATOM 5973 O O . GLY D 2 140 ? 77.926 -64.558 -16.927 1.00 67.34 ? 134 GLY B O 1 ATOM 5974 N N . THR D 2 141 ? 79.847 -63.538 -17.506 1.00 69.65 ? 135 THR B N 1 ATOM 5975 C CA . THR D 2 141 ? 79.236 -62.232 -17.724 1.00 60.75 ? 135 THR B CA 1 ATOM 5976 C C . THR D 2 141 ? 79.305 -61.834 -19.193 1.00 52.49 ? 135 THR B C 1 ATOM 5977 O O . THR D 2 141 ? 80.384 -61.810 -19.783 1.00 53.80 ? 135 THR B O 1 ATOM 5978 C CB . THR D 2 141 ? 79.921 -61.139 -16.875 1.00 65.13 ? 135 THR B CB 1 ATOM 5979 O OG1 . THR D 2 141 ? 79.695 -61.399 -15.484 1.00 67.12 ? 135 THR B OG1 1 ATOM 5980 C CG2 . THR D 2 141 ? 79.375 -59.760 -17.229 1.00 65.20 ? 135 THR B CG2 1 ATOM 5981 N N . ALA D 2 142 ? 78.154 -61.527 -19.781 1.00 43.42 ? 136 ALA B N 1 ATOM 5982 C CA . ALA D 2 142 ? 78.108 -61.100 -21.173 1.00 37.45 ? 136 ALA B CA 1 ATOM 5983 C C . ALA D 2 142 ? 77.837 -59.604 -21.269 1.00 41.41 ? 136 ALA B C 1 ATOM 5984 O O . ALA D 2 142 ? 77.241 -59.013 -20.368 1.00 42.39 ? 136 ALA B O 1 ATOM 5985 C CB . ALA D 2 142 ? 77.048 -61.877 -21.935 1.00 29.65 ? 136 ALA B CB 1 ATOM 5986 N N . ALA D 2 143 ? 78.282 -58.992 -22.360 1.00 33.54 ? 137 ALA B N 1 ATOM 5987 C CA . ALA D 2 143 ? 77.986 -57.589 -22.610 1.00 31.21 ? 137 ALA B CA 1 ATOM 5988 C C . ALA D 2 143 ? 77.217 -57.443 -23.913 1.00 32.36 ? 137 ALA B C 1 ATOM 5989 O O . ALA D 2 143 ? 77.511 -58.118 -24.900 1.00 32.94 ? 137 ALA B O 1 ATOM 5990 C CB . ALA D 2 143 ? 79.262 -56.767 -22.652 1.00 25.97 ? 137 ALA B CB 1 ATOM 5991 N N . LEU D 2 144 ? 76.225 -56.565 -23.906 1.00 33.48 ? 138 LEU B N 1 ATOM 5992 C CA . LEU D 2 144 ? 75.486 -56.242 -25.115 1.00 30.84 ? 138 LEU B CA 1 ATOM 5993 C C . LEU D 2 144 ? 75.165 -54.760 -25.098 1.00 28.94 ? 138 LEU B C 1 ATOM 5994 O O . LEU D 2 144 ? 75.379 -54.089 -24.086 1.00 28.94 ? 138 LEU B O 1 ATOM 5995 C CB . LEU D 2 144 ? 74.214 -57.087 -25.222 1.00 31.81 ? 138 LEU B CB 1 ATOM 5996 C CG . LEU D 2 144 ? 73.232 -57.053 -24.048 1.00 37.82 ? 138 LEU B CG 1 ATOM 5997 C CD1 . LEU D 2 144 ? 72.141 -56.019 -24.276 1.00 38.43 ? 138 LEU B CD1 1 ATOM 5998 C CD2 . LEU D 2 144 ? 72.627 -58.428 -23.828 1.00 41.75 ? 138 LEU B CD2 1 ATOM 5999 N N . GLY D 2 145 ? 74.666 -54.240 -26.214 1.00 26.03 ? 139 GLY B N 1 ATOM 6000 C CA . GLY D 2 145 ? 74.300 -52.841 -26.259 1.00 31.26 ? 139 GLY B CA 1 ATOM 6001 C C . GLY D 2 145 ? 73.655 -52.348 -27.537 1.00 31.90 ? 139 GLY B C 1 ATOM 6002 O O . GLY D 2 145 ? 73.274 -53.132 -28.410 1.00 29.34 ? 139 GLY B O 1 ATOM 6003 N N . CYS D 2 146 ? 73.531 -51.026 -27.630 1.00 31.68 ? 140 CYS B N 1 ATOM 6004 C CA . CYS D 2 146 ? 72.933 -50.369 -28.788 1.00 30.78 ? 140 CYS B CA 1 ATOM 6005 C C . CYS D 2 146 ? 73.841 -49.273 -29.322 1.00 29.25 ? 140 CYS B C 1 ATOM 6006 O O . CYS D 2 146 ? 74.376 -48.469 -28.557 1.00 28.21 ? 140 CYS B O 1 ATOM 6007 C CB . CYS D 2 146 ? 71.568 -49.773 -28.430 1.00 29.98 ? 140 CYS B CB 1 ATOM 6008 S SG . CYS D 2 146 ? 70.204 -50.956 -28.425 1.00 85.83 ? 140 CYS B SG 1 ATOM 6009 N N . LEU D 2 147 ? 74.016 -49.246 -30.638 1.00 28.22 ? 141 LEU B N 1 ATOM 6010 C CA . LEU D 2 147 ? 74.761 -48.174 -31.279 1.00 28.26 ? 141 LEU B CA 1 ATOM 6011 C C . LEU D 2 147 ? 73.788 -47.129 -31.816 1.00 34.05 ? 141 LEU B C 1 ATOM 6012 O O . LEU D 2 147 ? 72.973 -47.423 -32.692 1.00 27.01 ? 141 LEU B O 1 ATOM 6013 C CB . LEU D 2 147 ? 75.642 -48.721 -32.403 1.00 25.55 ? 141 LEU B CB 1 ATOM 6014 C CG . LEU D 2 147 ? 76.362 -47.722 -33.311 1.00 25.93 ? 141 LEU B CG 1 ATOM 6015 C CD1 . LEU D 2 147 ? 77.343 -46.849 -32.536 1.00 27.17 ? 141 LEU B CD1 1 ATOM 6016 C CD2 . LEU D 2 147 ? 77.078 -48.478 -34.406 1.00 30.51 ? 141 LEU B CD2 1 ATOM 6017 N N . VAL D 2 148 ? 73.868 -45.914 -31.283 1.00 24.80 ? 142 VAL B N 1 ATOM 6018 C CA . VAL D 2 148 ? 72.972 -44.842 -31.699 1.00 26.33 ? 142 VAL B CA 1 ATOM 6019 C C . VAL D 2 148 ? 73.728 -43.862 -32.595 1.00 25.67 ? 142 VAL B C 1 ATOM 6020 O O . VAL D 2 148 ? 74.458 -43.002 -32.112 1.00 30.86 ? 142 VAL B O 1 ATOM 6021 C CB . VAL D 2 148 ? 72.381 -44.115 -30.480 1.00 29.89 ? 142 VAL B CB 1 ATOM 6022 C CG1 . VAL D 2 148 ? 71.336 -43.113 -30.913 1.00 28.61 ? 142 VAL B CG1 1 ATOM 6023 C CG2 . VAL D 2 148 ? 71.775 -45.128 -29.512 1.00 30.82 ? 142 VAL B CG2 1 ATOM 6024 N N . LYS D 2 149 ? 73.552 -43.997 -33.904 1.00 26.93 ? 143 LYS B N 1 ATOM 6025 C CA . LYS D 2 149 ? 74.442 -43.341 -34.857 1.00 28.46 ? 143 LYS B CA 1 ATOM 6026 C C . LYS D 2 149 ? 73.764 -42.292 -35.741 1.00 28.15 ? 143 LYS B C 1 ATOM 6027 O O . LYS D 2 149 ? 72.614 -42.451 -36.150 1.00 31.29 ? 143 LYS B O 1 ATOM 6028 C CB . LYS D 2 149 ? 75.110 -44.403 -35.739 1.00 28.57 ? 143 LYS B CB 1 ATOM 6029 C CG . LYS D 2 149 ? 76.167 -43.860 -36.686 1.00 32.76 ? 143 LYS B CG 1 ATOM 6030 C CD . LYS D 2 149 ? 76.983 -44.977 -37.311 1.00 28.51 ? 143 LYS B CD 1 ATOM 6031 C CE . LYS D 2 149 ? 78.149 -44.422 -38.112 1.00 30.86 ? 143 LYS B CE 1 ATOM 6032 N NZ . LYS D 2 149 ? 77.720 -43.801 -39.395 1.00 40.98 ? 143 LYS B NZ 1 ATOM 6033 N N . ASP D 2 150 ? 74.498 -41.216 -36.013 1.00 26.43 ? 144 ASP B N 1 ATOM 6034 C CA . ASP D 2 150 ? 74.114 -40.195 -36.987 1.00 24.97 ? 144 ASP B CA 1 ATOM 6035 C C . ASP D 2 150 ? 72.821 -39.453 -36.651 1.00 30.88 ? 144 ASP B C 1 ATOM 6036 O O . ASP D 2 150 ? 71.910 -39.381 -37.475 1.00 31.85 ? 144 ASP B O 1 ATOM 6037 C CB . ASP D 2 150 ? 73.987 -40.811 -38.386 1.00 28.86 ? 144 ASP B CB 1 ATOM 6038 C CG . ASP D 2 150 ? 75.307 -41.345 -38.911 1.00 37.60 ? 144 ASP B CG 1 ATOM 6039 O OD1 . ASP D 2 150 ? 76.364 -40.928 -38.393 1.00 39.62 ? 144 ASP B OD1 1 ATOM 6040 O OD2 . ASP D 2 150 ? 75.289 -42.180 -39.843 1.00 37.68 ? 144 ASP B OD2 1 ATOM 6041 N N . TYR D 2 151 ? 72.751 -38.884 -35.454 1.00 25.18 ? 145 TYR B N 1 ATOM 6042 C CA . TYR D 2 151 ? 71.645 -38.001 -35.110 1.00 26.76 ? 145 TYR B CA 1 ATOM 6043 C C . TYR D 2 151 ? 72.141 -36.574 -34.907 1.00 27.01 ? 145 TYR B C 1 ATOM 6044 O O . TYR D 2 151 ? 73.342 -36.332 -34.747 1.00 25.41 ? 145 TYR B O 1 ATOM 6045 C CB . TYR D 2 151 ? 70.919 -38.491 -33.854 1.00 28.86 ? 145 TYR B CB 1 ATOM 6046 C CG . TYR D 2 151 ? 71.776 -38.520 -32.604 1.00 23.54 ? 145 TYR B CG 1 ATOM 6047 C CD1 . TYR D 2 151 ? 72.533 -39.640 -32.287 1.00 25.42 ? 145 TYR B CD1 1 ATOM 6048 C CD2 . TYR D 2 151 ? 71.817 -37.432 -31.734 1.00 15.98 ? 145 TYR B CD2 1 ATOM 6049 C CE1 . TYR D 2 151 ? 73.312 -39.677 -31.144 1.00 25.02 ? 145 TYR B CE1 1 ATOM 6050 C CE2 . TYR D 2 151 ? 72.592 -37.461 -30.591 1.00 22.95 ? 145 TYR B CE2 1 ATOM 6051 C CZ . TYR D 2 151 ? 73.337 -38.585 -30.304 1.00 26.90 ? 145 TYR B CZ 1 ATOM 6052 O OH . TYR D 2 151 ? 74.107 -38.620 -29.172 1.00 32.23 ? 145 TYR B OH 1 ATOM 6053 N N . PHE D 2 152 ? 71.201 -35.638 -34.906 1.00 29.25 ? 146 PHE B N 1 ATOM 6054 C CA . PHE D 2 152 ? 71.506 -34.230 -34.721 1.00 27.76 ? 146 PHE B CA 1 ATOM 6055 C C . PHE D 2 152 ? 70.219 -33.453 -34.474 1.00 25.83 ? 146 PHE B C 1 ATOM 6056 O O . PHE D 2 152 ? 69.222 -33.674 -35.155 1.00 33.16 ? 146 PHE B O 1 ATOM 6057 C CB . PHE D 2 152 ? 72.236 -33.670 -35.941 1.00 28.85 ? 146 PHE B CB 1 ATOM 6058 C CG . PHE D 2 152 ? 72.606 -32.222 -35.812 1.00 28.14 ? 146 PHE B CG 1 ATOM 6059 C CD1 . PHE D 2 152 ? 71.733 -31.228 -36.228 1.00 32.30 ? 146 PHE B CD1 1 ATOM 6060 C CD2 . PHE D 2 152 ? 73.829 -31.855 -35.283 1.00 21.42 ? 146 PHE B CD2 1 ATOM 6061 C CE1 . PHE D 2 152 ? 72.071 -29.893 -36.110 1.00 38.41 ? 146 PHE B CE1 1 ATOM 6062 C CE2 . PHE D 2 152 ? 74.176 -30.522 -35.164 1.00 32.34 ? 146 PHE B CE2 1 ATOM 6063 C CZ . PHE D 2 152 ? 73.294 -29.538 -35.579 1.00 37.39 ? 146 PHE B CZ 1 ATOM 6064 N N . PRO D 2 153 ? 70.231 -32.550 -33.485 1.00 24.49 ? 147 PRO B N 1 ATOM 6065 C CA . PRO D 2 153 ? 71.347 -32.320 -32.570 1.00 28.94 ? 147 PRO B CA 1 ATOM 6066 C C . PRO D 2 153 ? 71.223 -33.182 -31.322 1.00 31.93 ? 147 PRO B C 1 ATOM 6067 O O . PRO D 2 153 ? 70.336 -34.036 -31.244 1.00 29.83 ? 147 PRO B O 1 ATOM 6068 C CB . PRO D 2 153 ? 71.194 -30.844 -32.217 1.00 25.89 ? 147 PRO B CB 1 ATOM 6069 C CG . PRO D 2 153 ? 69.707 -30.671 -32.171 1.00 28.29 ? 147 PRO B CG 1 ATOM 6070 C CD . PRO D 2 153 ? 69.141 -31.586 -33.251 1.00 28.14 ? 147 PRO B CD 1 ATOM 6071 N N . GLU D 2 154 ? 72.099 -32.944 -30.354 1.00 28.43 ? 148 GLU B N 1 ATOM 6072 C CA . GLU D 2 154 ? 71.935 -33.509 -29.023 1.00 30.67 ? 148 GLU B CA 1 ATOM 6073 C C . GLU D 2 154 ? 70.672 -32.944 -28.371 1.00 29.39 ? 148 GLU B C 1 ATOM 6074 O O . GLU D 2 154 ? 70.218 -31.864 -28.743 1.00 28.90 ? 148 GLU B O 1 ATOM 6075 C CB . GLU D 2 154 ? 73.157 -33.203 -28.164 1.00 31.76 ? 148 GLU B CB 1 ATOM 6076 C CG . GLU D 2 154 ? 74.409 -33.918 -28.601 1.00 38.09 ? 148 GLU B CG 1 ATOM 6077 C CD . GLU D 2 154 ? 75.447 -33.943 -27.507 1.00 49.26 ? 148 GLU B CD 1 ATOM 6078 O OE1 . GLU D 2 154 ? 75.247 -34.693 -26.526 1.00 52.61 ? 148 GLU B OE1 1 ATOM 6079 O OE2 . GLU D 2 154 ? 76.451 -33.207 -27.622 1.00 52.07 ? 148 GLU B OE2 1 ATOM 6080 N N . PRO D 2 155 ? 70.101 -33.669 -27.393 1.00 30.21 ? 149 PRO B N 1 ATOM 6081 C CA . PRO D 2 155 ? 70.539 -34.972 -26.888 1.00 29.57 ? 149 PRO B CA 1 ATOM 6082 C C . PRO D 2 155 ? 69.625 -36.132 -27.270 1.00 34.04 ? 149 PRO B C 1 ATOM 6083 O O . PRO D 2 155 ? 68.518 -35.927 -27.769 1.00 31.36 ? 149 PRO B O 1 ATOM 6084 C CB . PRO D 2 155 ? 70.503 -34.764 -25.378 1.00 32.04 ? 149 PRO B CB 1 ATOM 6085 C CG . PRO D 2 155 ? 69.360 -33.742 -25.174 1.00 35.07 ? 149 PRO B CG 1 ATOM 6086 C CD . PRO D 2 155 ? 69.060 -33.101 -26.522 1.00 28.05 ? 149 PRO B CD 1 ATOM 6087 N N . VAL D 2 156 ? 70.102 -37.348 -27.025 1.00 36.70 ? 150 VAL B N 1 ATOM 6088 C CA . VAL D 2 156 ? 69.244 -38.523 -27.027 1.00 37.78 ? 150 VAL B CA 1 ATOM 6089 C C . VAL D 2 156 ? 69.188 -39.073 -25.614 1.00 37.17 ? 150 VAL B C 1 ATOM 6090 O O . VAL D 2 156 ? 70.088 -38.835 -24.815 1.00 32.67 ? 150 VAL B O 1 ATOM 6091 C CB . VAL D 2 156 ? 69.744 -39.632 -27.975 1.00 33.77 ? 150 VAL B CB 1 ATOM 6092 C CG1 . VAL D 2 156 ? 69.489 -39.261 -29.423 1.00 32.54 ? 150 VAL B CG1 1 ATOM 6093 C CG2 . VAL D 2 156 ? 71.216 -39.918 -27.725 1.00 37.42 ? 150 VAL B CG2 1 ATOM 6094 N N . THR D 2 157 ? 68.121 -39.796 -25.299 1.00 42.52 ? 151 THR B N 1 ATOM 6095 C CA . THR D 2 157 ? 68.051 -40.507 -24.034 1.00 40.34 ? 151 THR B CA 1 ATOM 6096 C C . THR D 2 157 ? 67.930 -41.990 -24.329 1.00 33.60 ? 151 THR B C 1 ATOM 6097 O O . THR D 2 157 ? 67.248 -42.392 -25.268 1.00 32.50 ? 151 THR B O 1 ATOM 6098 C CB . THR D 2 157 ? 66.876 -40.033 -23.167 1.00 46.31 ? 151 THR B CB 1 ATOM 6099 O OG1 . THR D 2 157 ? 65.662 -40.108 -23.923 1.00 48.69 ? 151 THR B OG1 1 ATOM 6100 C CG2 . THR D 2 157 ? 67.097 -38.596 -22.716 1.00 43.23 ? 151 THR B CG2 1 ATOM 6101 N N . VAL D 2 158 ? 68.627 -42.798 -23.545 1.00 32.41 ? 152 VAL B N 1 ATOM 6102 C CA . VAL D 2 158 ? 68.609 -44.237 -23.740 1.00 32.49 ? 152 VAL B CA 1 ATOM 6103 C C . VAL D 2 158 ? 68.210 -44.932 -22.451 1.00 33.33 ? 152 VAL B C 1 ATOM 6104 O O . VAL D 2 158 ? 68.686 -44.579 -21.375 1.00 36.48 ? 152 VAL B O 1 ATOM 6105 C CB . VAL D 2 158 ? 69.979 -44.772 -24.204 1.00 30.76 ? 152 VAL B CB 1 ATOM 6106 C CG1 . VAL D 2 158 ? 69.875 -46.249 -24.572 1.00 25.31 ? 152 VAL B CG1 1 ATOM 6107 C CG2 . VAL D 2 158 ? 70.488 -43.967 -25.384 1.00 35.98 ? 152 VAL B CG2 1 ATOM 6108 N N . SER D 2 159 ? 67.321 -45.911 -22.567 1.00 40.49 ? 153 SER B N 1 ATOM 6109 C CA . SER D 2 159 ? 66.937 -46.739 -21.434 1.00 41.08 ? 153 SER B CA 1 ATOM 6110 C C . SER D 2 159 ? 66.858 -48.190 -21.891 1.00 39.97 ? 153 SER B C 1 ATOM 6111 O O . SER D 2 159 ? 66.751 -48.462 -23.084 1.00 42.87 ? 153 SER B O 1 ATOM 6112 C CB . SER D 2 159 ? 65.600 -46.280 -20.846 1.00 42.36 ? 153 SER B CB 1 ATOM 6113 O OG . SER D 2 159 ? 64.549 -46.430 -21.787 1.00 50.94 ? 153 SER B OG 1 ATOM 6114 N N . TRP D 2 160 ? 66.923 -49.115 -20.940 1.00 34.85 ? 154 TRP B N 1 ATOM 6115 C CA . TRP D 2 160 ? 66.830 -50.537 -21.247 1.00 35.10 ? 154 TRP B CA 1 ATOM 6116 C C . TRP D 2 160 ? 65.601 -51.163 -20.602 1.00 43.10 ? 154 TRP B C 1 ATOM 6117 O O . TRP D 2 160 ? 65.336 -50.951 -19.416 1.00 49.46 ? 154 TRP B O 1 ATOM 6118 C CB . TRP D 2 160 ? 68.093 -51.266 -20.790 1.00 31.51 ? 154 TRP B CB 1 ATOM 6119 C CG . TRP D 2 160 ? 69.268 -50.949 -21.644 1.00 33.91 ? 154 TRP B CG 1 ATOM 6120 C CD1 . TRP D 2 160 ? 70.154 -49.927 -21.474 1.00 36.19 ? 154 TRP B CD1 1 ATOM 6121 C CD2 . TRP D 2 160 ? 69.676 -51.646 -22.825 1.00 36.30 ? 154 TRP B CD2 1 ATOM 6122 N NE1 . TRP D 2 160 ? 71.097 -49.951 -22.472 1.00 35.88 ? 154 TRP B NE1 1 ATOM 6123 C CE2 . TRP D 2 160 ? 70.826 -50.995 -23.313 1.00 35.90 ? 154 TRP B CE2 1 ATOM 6124 C CE3 . TRP D 2 160 ? 69.184 -52.759 -23.512 1.00 32.17 ? 154 TRP B CE3 1 ATOM 6125 C CZ2 . TRP D 2 160 ? 71.492 -51.425 -24.458 1.00 39.02 ? 154 TRP B CZ2 1 ATOM 6126 C CZ3 . TRP D 2 160 ? 69.846 -53.181 -24.647 1.00 33.93 ? 154 TRP B CZ3 1 ATOM 6127 C CH2 . TRP D 2 160 ? 70.986 -52.515 -25.111 1.00 36.72 ? 154 TRP B CH2 1 ATOM 6128 N N . ASN D 2 161 ? 64.866 -51.937 -21.397 1.00 40.99 ? 155 ASN B N 1 ATOM 6129 C CA . ASN D 2 161 ? 63.608 -52.546 -20.976 1.00 49.99 ? 155 ASN B CA 1 ATOM 6130 C C . ASN D 2 161 ? 62.675 -51.533 -20.318 1.00 53.55 ? 155 ASN B C 1 ATOM 6131 O O . ASN D 2 161 ? 62.070 -51.807 -19.286 1.00 52.17 ? 155 ASN B O 1 ATOM 6132 C CB . ASN D 2 161 ? 63.877 -53.727 -20.044 1.00 45.61 ? 155 ASN B CB 1 ATOM 6133 C CG . ASN D 2 161 ? 64.633 -54.845 -20.740 1.00 50.94 ? 155 ASN B CG 1 ATOM 6134 O OD1 . ASN D 2 161 ? 64.753 -54.856 -21.966 1.00 51.28 ? 155 ASN B OD1 1 ATOM 6135 N ND2 . ASN D 2 161 ? 65.141 -55.794 -19.964 1.00 52.77 ? 155 ASN B ND2 1 ATOM 6136 N N . SER D 2 162 ? 62.586 -50.358 -20.938 1.00 55.19 ? 156 SER B N 1 ATOM 6137 C CA . SER D 2 162 ? 61.681 -49.287 -20.527 1.00 56.15 ? 156 SER B CA 1 ATOM 6138 C C . SER D 2 162 ? 61.896 -48.836 -19.086 1.00 57.91 ? 156 SER B C 1 ATOM 6139 O O . SER D 2 162 ? 60.940 -48.525 -18.381 1.00 65.59 ? 156 SER B O 1 ATOM 6140 C CB . SER D 2 162 ? 60.229 -49.723 -20.724 1.00 56.87 ? 156 SER B CB 1 ATOM 6141 O OG . SER D 2 162 ? 60.011 -50.143 -22.060 1.00 59.76 ? 156 SER B OG 1 ATOM 6142 N N . GLY D 2 163 ? 63.153 -48.794 -18.656 1.00 52.31 ? 157 GLY B N 1 ATOM 6143 C CA . GLY D 2 163 ? 63.480 -48.332 -17.320 1.00 45.78 ? 157 GLY B CA 1 ATOM 6144 C C . GLY D 2 163 ? 63.745 -49.469 -16.355 1.00 50.61 ? 157 GLY B C 1 ATOM 6145 O O . GLY D 2 163 ? 64.334 -49.267 -15.293 1.00 55.43 ? 157 GLY B O 1 ATOM 6146 N N . ALA D 2 164 ? 63.308 -50.669 -16.725 1.00 50.17 ? 158 ALA B N 1 ATOM 6147 C CA . ALA D 2 164 ? 63.497 -51.847 -15.885 1.00 54.31 ? 158 ALA B CA 1 ATOM 6148 C C . ALA D 2 164 ? 64.972 -52.097 -15.597 1.00 56.58 ? 158 ALA B C 1 ATOM 6149 O O . ALA D 2 164 ? 65.391 -52.112 -14.441 1.00 62.15 ? 158 ALA B O 1 ATOM 6150 C CB . ALA D 2 164 ? 62.879 -53.071 -16.540 1.00 49.62 ? 158 ALA B CB 1 ATOM 6151 N N . LEU D 2 165 ? 65.753 -52.288 -16.655 1.00 52.32 ? 159 LEU B N 1 ATOM 6152 C CA . LEU D 2 165 ? 67.170 -52.604 -16.519 1.00 46.97 ? 159 LEU B CA 1 ATOM 6153 C C . LEU D 2 165 ? 67.997 -51.336 -16.322 1.00 50.16 ? 159 LEU B C 1 ATOM 6154 O O . LEU D 2 165 ? 68.029 -50.465 -17.192 1.00 52.22 ? 159 LEU B O 1 ATOM 6155 C CB . LEU D 2 165 ? 67.655 -53.380 -17.744 1.00 42.47 ? 159 LEU B CB 1 ATOM 6156 C CG . LEU D 2 165 ? 69.103 -53.868 -17.729 1.00 44.09 ? 159 LEU B CG 1 ATOM 6157 C CD1 . LEU D 2 165 ? 69.400 -54.648 -16.458 1.00 42.55 ? 159 LEU B CD1 1 ATOM 6158 C CD2 . LEU D 2 165 ? 69.389 -54.716 -18.958 1.00 44.58 ? 159 LEU B CD2 1 ATOM 6159 N N . THR D 2 166 ? 68.661 -51.233 -15.173 1.00 46.60 ? 160 THR B N 1 ATOM 6160 C CA . THR D 2 166 ? 69.426 -50.036 -14.844 1.00 43.68 ? 160 THR B CA 1 ATOM 6161 C C . THR D 2 166 ? 70.814 -50.391 -14.304 1.00 44.13 ? 160 THR B C 1 ATOM 6162 O O . THR D 2 166 ? 71.750 -49.596 -14.391 1.00 38.00 ? 160 THR B O 1 ATOM 6163 C CB . THR D 2 166 ? 68.671 -49.157 -13.818 1.00 46.80 ? 160 THR B CB 1 ATOM 6164 O OG1 . THR D 2 166 ? 69.249 -47.848 -13.789 1.00 61.46 ? 160 THR B OG1 1 ATOM 6165 C CG2 . THR D 2 166 ? 68.726 -49.764 -12.422 1.00 39.20 ? 160 THR B CG2 1 ATOM 6166 N N . SER D 2 167 ? 70.946 -51.600 -13.770 1.00 45.46 ? 161 SER B N 1 ATOM 6167 C CA . SER D 2 167 ? 72.203 -52.048 -13.191 1.00 47.02 ? 161 SER B CA 1 ATOM 6168 C C . SER D 2 167 ? 73.188 -52.486 -14.271 1.00 43.45 ? 161 SER B C 1 ATOM 6169 O O . SER D 2 167 ? 72.875 -53.337 -15.102 1.00 41.89 ? 161 SER B O 1 ATOM 6170 C CB . SER D 2 167 ? 71.951 -53.193 -12.205 1.00 53.42 ? 161 SER B CB 1 ATOM 6171 O OG . SER D 2 167 ? 73.164 -53.805 -11.800 1.00 59.54 ? 161 SER B OG 1 ATOM 6172 N N . GLY D 2 168 ? 74.379 -51.899 -14.255 1.00 40.96 ? 162 GLY B N 1 ATOM 6173 C CA . GLY D 2 168 ? 75.420 -52.272 -15.194 1.00 41.88 ? 162 GLY B CA 1 ATOM 6174 C C . GLY D 2 168 ? 75.323 -51.539 -16.517 1.00 37.74 ? 162 GLY B C 1 ATOM 6175 O O . GLY D 2 168 ? 76.060 -51.834 -17.459 1.00 39.00 ? 162 GLY B O 1 ATOM 6176 N N . VAL D 2 169 ? 74.408 -50.581 -16.587 1.00 29.36 ? 163 VAL B N 1 ATOM 6177 C CA . VAL D 2 169 ? 74.238 -49.775 -17.786 1.00 29.33 ? 163 VAL B CA 1 ATOM 6178 C C . VAL D 2 169 ? 75.267 -48.654 -17.856 1.00 35.40 ? 163 VAL B C 1 ATOM 6179 O O . VAL D 2 169 ? 75.409 -47.866 -16.920 1.00 36.85 ? 163 VAL B O 1 ATOM 6180 C CB . VAL D 2 169 ? 72.830 -49.149 -17.857 1.00 27.82 ? 163 VAL B CB 1 ATOM 6181 C CG1 . VAL D 2 169 ? 72.724 -48.209 -19.062 1.00 23.71 ? 163 VAL B CG1 1 ATOM 6182 C CG2 . VAL D 2 169 ? 71.766 -50.235 -17.919 1.00 30.82 ? 163 VAL B CG2 1 ATOM 6183 N N . HIS D 2 170 ? 75.990 -48.592 -18.970 1.00 35.78 ? 164 HIS B N 1 ATOM 6184 C CA . HIS D 2 170 ? 76.857 -47.456 -19.250 1.00 29.93 ? 164 HIS B CA 1 ATOM 6185 C C . HIS D 2 170 ? 76.443 -46.810 -20.562 1.00 28.10 ? 164 HIS B C 1 ATOM 6186 O O . HIS D 2 170 ? 76.635 -47.379 -21.636 1.00 28.71 ? 164 HIS B O 1 ATOM 6187 C CB . HIS D 2 170 ? 78.329 -47.871 -19.317 1.00 27.47 ? 164 HIS B CB 1 ATOM 6188 C CG . HIS D 2 170 ? 78.865 -48.419 -18.031 1.00 36.04 ? 164 HIS B CG 1 ATOM 6189 N ND1 . HIS D 2 170 ? 79.084 -47.634 -16.921 1.00 36.43 ? 164 HIS B ND1 1 ATOM 6190 C CD2 . HIS D 2 170 ? 79.234 -49.674 -17.684 1.00 37.31 ? 164 HIS B CD2 1 ATOM 6191 C CE1 . HIS D 2 170 ? 79.561 -48.382 -15.942 1.00 38.50 ? 164 HIS B CE1 1 ATOM 6192 N NE2 . HIS D 2 170 ? 79.662 -49.624 -16.379 1.00 37.17 ? 164 HIS B NE2 1 ATOM 6193 N N . THR D 2 171 ? 75.859 -45.626 -20.469 1.00 28.59 ? 165 THR B N 1 ATOM 6194 C CA . THR D 2 171 ? 75.545 -44.849 -21.652 1.00 32.00 ? 165 THR B CA 1 ATOM 6195 C C . THR D 2 171 ? 76.615 -43.779 -21.811 1.00 28.34 ? 165 THR B C 1 ATOM 6196 O O . THR D 2 171 ? 76.746 -42.886 -20.978 1.00 30.36 ? 165 THR B O 1 ATOM 6197 C CB . THR D 2 171 ? 74.145 -44.222 -21.565 1.00 33.28 ? 165 THR B CB 1 ATOM 6198 O OG1 . THR D 2 171 ? 73.166 -45.267 -21.522 1.00 35.78 ? 165 THR B OG1 1 ATOM 6199 C CG2 . THR D 2 171 ? 73.874 -43.340 -22.777 1.00 35.88 ? 165 THR B CG2 1 ATOM 6200 N N . PHE D 2 172 ? 77.393 -43.892 -22.880 1.00 18.48 ? 166 PHE B N 1 ATOM 6201 C CA . PHE D 2 172 ? 78.551 -43.035 -23.076 1.00 17.54 ? 166 PHE B CA 1 ATOM 6202 C C . PHE D 2 172 ? 78.156 -41.633 -23.531 1.00 24.85 ? 166 PHE B C 1 ATOM 6203 O O . PHE D 2 172 ? 77.082 -41.442 -24.099 1.00 24.50 ? 166 PHE B O 1 ATOM 6204 C CB . PHE D 2 172 ? 79.503 -43.686 -24.082 1.00 15.97 ? 166 PHE B CB 1 ATOM 6205 C CG . PHE D 2 172 ? 80.129 -44.946 -23.573 1.00 21.91 ? 166 PHE B CG 1 ATOM 6206 C CD1 . PHE D 2 172 ? 81.281 -44.898 -22.800 1.00 22.84 ? 166 PHE B CD1 1 ATOM 6207 C CD2 . PHE D 2 172 ? 79.556 -46.182 -23.842 1.00 22.60 ? 166 PHE B CD2 1 ATOM 6208 C CE1 . PHE D 2 172 ? 81.860 -46.059 -22.315 1.00 27.42 ? 166 PHE B CE1 1 ATOM 6209 C CE2 . PHE D 2 172 ? 80.127 -47.345 -23.362 1.00 26.99 ? 166 PHE B CE2 1 ATOM 6210 C CZ . PHE D 2 172 ? 81.282 -47.285 -22.597 1.00 26.05 ? 166 PHE B CZ 1 ATOM 6211 N N . PRO D 2 173 ? 79.009 -40.639 -23.249 1.00 27.10 ? 167 PRO B N 1 ATOM 6212 C CA . PRO D 2 173 ? 78.779 -39.299 -23.793 1.00 25.11 ? 167 PRO B CA 1 ATOM 6213 C C . PRO D 2 173 ? 78.803 -39.351 -25.308 1.00 22.83 ? 167 PRO B C 1 ATOM 6214 O O . PRO D 2 173 ? 79.535 -40.161 -25.866 1.00 29.49 ? 167 PRO B O 1 ATOM 6215 C CB . PRO D 2 173 ? 79.961 -38.483 -23.250 1.00 22.18 ? 167 PRO B CB 1 ATOM 6216 C CG . PRO D 2 173 ? 80.421 -39.233 -22.053 1.00 28.59 ? 167 PRO B CG 1 ATOM 6217 C CD . PRO D 2 173 ? 80.179 -40.679 -22.356 1.00 31.59 ? 167 PRO B CD 1 ATOM 6218 N N . ALA D 2 174 ? 78.012 -38.512 -25.959 1.00 21.40 ? 168 ALA B N 1 ATOM 6219 C CA . ALA D 2 174 ? 78.025 -38.436 -27.406 1.00 23.33 ? 168 ALA B CA 1 ATOM 6220 C C . ALA D 2 174 ? 79.383 -37.953 -27.893 1.00 27.83 ? 168 ALA B C 1 ATOM 6221 O O . ALA D 2 174 ? 80.066 -37.202 -27.200 1.00 29.72 ? 168 ALA B O 1 ATOM 6222 C CB . ALA D 2 174 ? 76.929 -37.512 -27.891 1.00 25.24 ? 168 ALA B CB 1 ATOM 6223 N N . VAL D 2 175 ? 79.788 -38.398 -29.075 1.00 23.38 ? 169 VAL B N 1 ATOM 6224 C CA . VAL D 2 175 ? 80.939 -37.799 -29.730 1.00 21.58 ? 169 VAL B CA 1 ATOM 6225 C C . VAL D 2 175 ? 80.461 -37.189 -31.038 1.00 26.18 ? 169 VAL B C 1 ATOM 6226 O O . VAL D 2 175 ? 79.533 -37.701 -31.666 1.00 25.14 ? 169 VAL B O 1 ATOM 6227 C CB . VAL D 2 175 ? 82.080 -38.812 -29.994 1.00 25.25 ? 169 VAL B CB 1 ATOM 6228 C CG1 . VAL D 2 175 ? 82.483 -39.506 -28.701 1.00 29.63 ? 169 VAL B CG1 1 ATOM 6229 C CG2 . VAL D 2 175 ? 81.676 -39.829 -31.048 1.00 31.73 ? 169 VAL B CG2 1 ATOM 6230 N N . LEU D 2 176 ? 81.068 -36.071 -31.424 1.00 24.46 ? 170 LEU B N 1 ATOM 6231 C CA . LEU D 2 176 ? 80.761 -35.447 -32.701 1.00 20.83 ? 170 LEU B CA 1 ATOM 6232 C C . LEU D 2 176 ? 81.615 -36.110 -33.782 1.00 25.41 ? 170 LEU B C 1 ATOM 6233 O O . LEU D 2 176 ? 82.844 -36.116 -33.700 1.00 24.83 ? 170 LEU B O 1 ATOM 6234 C CB . LEU D 2 176 ? 81.007 -33.935 -32.643 1.00 24.40 ? 170 LEU B CB 1 ATOM 6235 C CG . LEU D 2 176 ? 80.808 -33.104 -33.913 1.00 28.19 ? 170 LEU B CG 1 ATOM 6236 C CD1 . LEU D 2 176 ? 79.402 -33.282 -34.465 1.00 30.55 ? 170 LEU B CD1 1 ATOM 6237 C CD2 . LEU D 2 176 ? 81.088 -31.635 -33.626 1.00 25.07 ? 170 LEU B CD2 1 ATOM 6238 N N . GLN D 2 177 ? 80.962 -36.697 -34.779 1.00 25.14 ? 171 GLN B N 1 ATOM 6239 C CA . GLN D 2 177 ? 81.682 -37.357 -35.862 1.00 23.73 ? 171 GLN B CA 1 ATOM 6240 C C . GLN D 2 177 ? 82.192 -36.326 -36.863 1.00 19.35 ? 171 GLN B C 1 ATOM 6241 O O . GLN D 2 177 ? 81.841 -35.150 -36.787 1.00 25.44 ? 171 GLN B O 1 ATOM 6242 C CB . GLN D 2 177 ? 80.783 -38.383 -36.562 1.00 23.94 ? 171 GLN B CB 1 ATOM 6243 C CG . GLN D 2 177 ? 80.351 -39.535 -35.670 1.00 26.86 ? 171 GLN B CG 1 ATOM 6244 C CD . GLN D 2 177 ? 79.248 -40.370 -36.290 1.00 36.81 ? 171 GLN B CD 1 ATOM 6245 O OE1 . GLN D 2 177 ? 79.468 -41.518 -36.674 1.00 36.14 ? 171 GLN B OE1 1 ATOM 6246 N NE2 . GLN D 2 177 ? 78.049 -39.799 -36.380 1.00 36.39 ? 171 GLN B NE2 1 ATOM 6247 N N . SER D 2 178 ? 83.017 -36.771 -37.804 1.00 20.71 ? 172 SER B N 1 ATOM 6248 C CA . SER D 2 178 ? 83.561 -35.875 -38.814 1.00 23.53 ? 172 SER B CA 1 ATOM 6249 C C . SER D 2 178 ? 82.493 -35.491 -39.837 1.00 26.81 ? 172 SER B C 1 ATOM 6250 O O . SER D 2 178 ? 82.697 -34.598 -40.659 1.00 28.43 ? 172 SER B O 1 ATOM 6251 C CB . SER D 2 178 ? 84.765 -36.519 -39.504 1.00 24.58 ? 172 SER B CB 1 ATOM 6252 O OG . SER D 2 178 ? 84.437 -37.803 -39.997 1.00 30.67 ? 172 SER B OG 1 ATOM 6253 N N . SER D 2 179 ? 81.351 -36.171 -39.777 1.00 23.41 ? 173 SER B N 1 ATOM 6254 C CA . SER D 2 179 ? 80.200 -35.808 -40.595 1.00 29.38 ? 173 SER B CA 1 ATOM 6255 C C . SER D 2 179 ? 79.452 -34.598 -40.032 1.00 31.65 ? 173 SER B C 1 ATOM 6256 O O . SER D 2 179 ? 78.635 -33.998 -40.717 1.00 33.23 ? 173 SER B O 1 ATOM 6257 C CB . SER D 2 179 ? 79.235 -36.980 -40.699 1.00 29.10 ? 173 SER B CB 1 ATOM 6258 O OG . SER D 2 179 ? 78.733 -37.303 -39.413 1.00 31.89 ? 173 SER B OG 1 ATOM 6259 N N . GLY D 2 180 ? 79.715 -34.253 -38.777 1.00 34.31 ? 174 GLY B N 1 ATOM 6260 C CA . GLY D 2 180 ? 78.960 -33.200 -38.120 1.00 33.23 ? 174 GLY B CA 1 ATOM 6261 C C . GLY D 2 180 ? 77.721 -33.738 -37.422 1.00 32.31 ? 174 GLY B C 1 ATOM 6262 O O . GLY D 2 180 ? 76.921 -32.970 -36.886 1.00 27.49 ? 174 GLY B O 1 ATOM 6263 N N . LEU D 2 181 ? 77.564 -35.062 -37.434 1.00 27.18 ? 175 LEU B N 1 ATOM 6264 C CA . LEU D 2 181 ? 76.470 -35.727 -36.731 1.00 25.77 ? 175 LEU B CA 1 ATOM 6265 C C . LEU D 2 181 ? 77.001 -36.431 -35.488 1.00 28.47 ? 175 LEU B C 1 ATOM 6266 O O . LEU D 2 181 ? 78.176 -36.799 -35.429 1.00 27.16 ? 175 LEU B O 1 ATOM 6267 C CB . LEU D 2 181 ? 75.767 -36.737 -37.640 1.00 29.76 ? 175 LEU B CB 1 ATOM 6268 C CG . LEU D 2 181 ? 75.203 -36.235 -38.969 1.00 30.23 ? 175 LEU B CG 1 ATOM 6269 C CD1 . LEU D 2 181 ? 74.628 -37.397 -39.772 1.00 35.75 ? 175 LEU B CD1 1 ATOM 6270 C CD2 . LEU D 2 181 ? 74.144 -35.177 -38.738 1.00 25.14 ? 175 LEU B CD2 1 ATOM 6271 N N . TYR D 2 182 ? 76.142 -36.622 -34.494 1.00 25.33 ? 176 TYR B N 1 ATOM 6272 C CA . TYR D 2 182 ? 76.572 -37.263 -33.257 1.00 20.71 ? 176 TYR B CA 1 ATOM 6273 C C . TYR D 2 182 ? 76.366 -38.762 -33.294 1.00 25.25 ? 176 TYR B C 1 ATOM 6274 O O . TYR D 2 182 ? 75.508 -39.271 -34.014 1.00 24.39 ? 176 TYR B O 1 ATOM 6275 C CB . TYR D 2 182 ? 75.835 -36.684 -32.047 1.00 15.83 ? 176 TYR B CB 1 ATOM 6276 C CG . TYR D 2 182 ? 76.151 -35.231 -31.802 1.00 21.06 ? 176 TYR B CG 1 ATOM 6277 C CD1 . TYR D 2 182 ? 77.204 -34.858 -30.970 1.00 21.13 ? 176 TYR B CD1 1 ATOM 6278 C CD2 . TYR D 2 182 ? 75.407 -34.231 -32.412 1.00 18.69 ? 176 TYR B CD2 1 ATOM 6279 C CE1 . TYR D 2 182 ? 77.502 -33.522 -30.750 1.00 21.93 ? 176 TYR B CE1 1 ATOM 6280 C CE2 . TYR D 2 182 ? 75.694 -32.895 -32.195 1.00 30.21 ? 176 TYR B CE2 1 ATOM 6281 C CZ . TYR D 2 182 ? 76.740 -32.548 -31.362 1.00 28.03 ? 176 TYR B CZ 1 ATOM 6282 O OH . TYR D 2 182 ? 77.022 -31.218 -31.153 1.00 34.77 ? 176 TYR B OH 1 ATOM 6283 N N . SER D 2 183 ? 77.165 -39.459 -32.499 1.00 18.62 ? 177 SER B N 1 ATOM 6284 C CA . SER D 2 183 ? 77.010 -40.885 -32.324 1.00 22.70 ? 177 SER B CA 1 ATOM 6285 C C . SER D 2 183 ? 77.294 -41.251 -30.872 1.00 27.79 ? 177 SER B C 1 ATOM 6286 O O . SER D 2 183 ? 78.050 -40.563 -30.182 1.00 25.37 ? 177 SER B O 1 ATOM 6287 C CB . SER D 2 183 ? 77.934 -41.647 -33.264 1.00 22.27 ? 177 SER B CB 1 ATOM 6288 O OG . SER D 2 183 ? 77.827 -43.031 -33.028 1.00 36.75 ? 177 SER B OG 1 ATOM 6289 N N . LEU D 2 184 ? 76.701 -42.352 -30.431 1.00 28.22 ? 178 LEU B N 1 ATOM 6290 C CA . LEU D 2 184 ? 76.701 -42.732 -29.031 1.00 27.81 ? 178 LEU B CA 1 ATOM 6291 C C . LEU D 2 184 ? 76.474 -44.240 -28.898 1.00 29.18 ? 178 LEU B C 1 ATOM 6292 O O . LEU D 2 184 ? 75.862 -44.858 -29.770 1.00 30.96 ? 178 LEU B O 1 ATOM 6293 C CB . LEU D 2 184 ? 75.615 -41.928 -28.303 1.00 31.08 ? 178 LEU B CB 1 ATOM 6294 C CG . LEU D 2 184 ? 75.015 -42.254 -26.937 1.00 32.79 ? 178 LEU B CG 1 ATOM 6295 C CD1 . LEU D 2 184 ? 74.426 -40.980 -26.358 1.00 29.98 ? 178 LEU B CD1 1 ATOM 6296 C CD2 . LEU D 2 184 ? 73.940 -43.327 -27.028 1.00 30.20 ? 178 LEU B CD2 1 ATOM 6297 N N . SER D 2 185 ? 76.973 -44.832 -27.817 1.00 26.87 ? 179 SER B N 1 ATOM 6298 C CA . SER D 2 185 ? 76.647 -46.219 -27.497 1.00 32.12 ? 179 SER B CA 1 ATOM 6299 C C . SER D 2 185 ? 76.151 -46.360 -26.064 1.00 29.02 ? 179 SER B C 1 ATOM 6300 O O . SER D 2 185 ? 76.595 -45.647 -25.165 1.00 29.97 ? 179 SER B O 1 ATOM 6301 C CB . SER D 2 185 ? 77.856 -47.136 -27.707 1.00 36.22 ? 179 SER B CB 1 ATOM 6302 O OG . SER D 2 185 ? 78.075 -47.397 -29.082 1.00 44.16 ? 179 SER B OG 1 ATOM 6303 N N . SER D 2 186 ? 75.220 -47.282 -25.866 1.00 24.61 ? 180 SER B N 1 ATOM 6304 C CA . SER D 2 186 ? 74.793 -47.666 -24.531 1.00 27.52 ? 180 SER B CA 1 ATOM 6305 C C . SER D 2 186 ? 75.004 -49.167 -24.370 1.00 32.67 ? 180 SER B C 1 ATOM 6306 O O . SER D 2 186 ? 74.506 -49.955 -25.172 1.00 32.43 ? 180 SER B O 1 ATOM 6307 C CB . SER D 2 186 ? 73.331 -47.295 -24.296 1.00 24.16 ? 180 SER B CB 1 ATOM 6308 O OG . SER D 2 186 ? 72.920 -47.685 -23.000 1.00 25.67 ? 180 SER B OG 1 ATOM 6309 N N . VAL D 2 187 ? 75.762 -49.562 -23.353 1.00 26.78 ? 181 VAL B N 1 ATOM 6310 C CA . VAL D 2 187 ? 76.031 -50.974 -23.126 1.00 25.70 ? 181 VAL B CA 1 ATOM 6311 C C . VAL D 2 187 ? 75.582 -51.395 -21.744 1.00 28.38 ? 181 VAL B C 1 ATOM 6312 O O . VAL D 2 187 ? 75.375 -50.567 -20.856 1.00 28.77 ? 181 VAL B O 1 ATOM 6313 C CB . VAL D 2 187 ? 77.528 -51.320 -23.275 1.00 27.60 ? 181 VAL B CB 1 ATOM 6314 C CG1 . VAL D 2 187 ? 78.029 -50.943 -24.660 1.00 21.26 ? 181 VAL B CG1 1 ATOM 6315 C CG2 . VAL D 2 187 ? 78.346 -50.633 -22.189 1.00 25.75 ? 181 VAL B CG2 1 ATOM 6316 N N . VAL D 2 188 ? 75.434 -52.697 -21.569 1.00 31.98 ? 182 VAL B N 1 ATOM 6317 C CA . VAL D 2 188 ? 75.111 -53.238 -20.268 1.00 32.22 ? 182 VAL B CA 1 ATOM 6318 C C . VAL D 2 188 ? 75.682 -54.642 -20.167 1.00 37.97 ? 182 VAL B C 1 ATOM 6319 O O . VAL D 2 188 ? 75.718 -55.382 -21.153 1.00 37.10 ? 182 VAL B O 1 ATOM 6320 C CB . VAL D 2 188 ? 73.587 -53.239 -20.017 1.00 32.71 ? 182 VAL B CB 1 ATOM 6321 C CG1 . VAL D 2 188 ? 72.862 -54.021 -21.098 1.00 32.80 ? 182 VAL B CG1 1 ATOM 6322 C CG2 . VAL D 2 188 ? 73.263 -53.775 -18.627 1.00 30.53 ? 182 VAL B CG2 1 ATOM 6323 N N . THR D 2 189 ? 76.180 -54.986 -18.984 1.00 37.96 ? 183 THR B N 1 ATOM 6324 C CA . THR D 2 189 ? 76.643 -56.338 -18.715 1.00 40.75 ? 183 THR B CA 1 ATOM 6325 C C . THR D 2 189 ? 75.544 -57.115 -18.007 1.00 39.78 ? 183 THR B C 1 ATOM 6326 O O . THR D 2 189 ? 74.926 -56.610 -17.071 1.00 39.44 ? 183 THR B O 1 ATOM 6327 C CB . THR D 2 189 ? 77.913 -56.344 -17.860 1.00 43.12 ? 183 THR B CB 1 ATOM 6328 O OG1 . THR D 2 189 ? 77.710 -55.517 -16.708 1.00 46.17 ? 183 THR B OG1 1 ATOM 6329 C CG2 . THR D 2 189 ? 79.089 -55.809 -18.660 1.00 45.36 ? 183 THR B CG2 1 ATOM 6330 N N . VAL D 2 190 ? 75.297 -58.336 -18.474 1.00 43.84 ? 184 VAL B N 1 ATOM 6331 C CA . VAL D 2 190 ? 74.248 -59.194 -17.929 1.00 40.93 ? 184 VAL B CA 1 ATOM 6332 C C . VAL D 2 190 ? 74.775 -60.619 -17.755 1.00 44.79 ? 184 VAL B C 1 ATOM 6333 O O . VAL D 2 190 ? 75.791 -60.980 -18.357 1.00 38.53 ? 184 VAL B O 1 ATOM 6334 C CB . VAL D 2 190 ? 73.002 -59.212 -18.844 1.00 44.82 ? 184 VAL B CB 1 ATOM 6335 C CG1 . VAL D 2 190 ? 72.329 -57.845 -18.869 1.00 45.37 ? 184 VAL B CG1 1 ATOM 6336 C CG2 . VAL D 2 190 ? 73.380 -59.660 -20.243 1.00 46.19 ? 184 VAL B CG2 1 ATOM 6337 N N . PRO D 2 191 ? 74.101 -61.432 -16.919 1.00 53.80 ? 185 PRO B N 1 ATOM 6338 C CA . PRO D 2 191 ? 74.473 -62.850 -16.822 1.00 53.56 ? 185 PRO B CA 1 ATOM 6339 C C . PRO D 2 191 ? 74.335 -63.561 -18.164 1.00 51.01 ? 185 PRO B C 1 ATOM 6340 O O . PRO D 2 191 ? 73.305 -63.409 -18.820 1.00 47.44 ? 185 PRO B O 1 ATOM 6341 C CB . PRO D 2 191 ? 73.469 -63.412 -15.808 1.00 52.63 ? 185 PRO B CB 1 ATOM 6342 C CG . PRO D 2 191 ? 73.030 -62.240 -15.009 1.00 51.09 ? 185 PRO B CG 1 ATOM 6343 C CD . PRO D 2 191 ? 73.039 -61.077 -15.957 1.00 55.25 ? 185 PRO B CD 1 ATOM 6344 N N . SER D 2 192 ? 75.351 -64.321 -18.562 1.00 55.38 ? 186 SER B N 1 ATOM 6345 C CA . SER D 2 192 ? 75.304 -65.060 -19.823 1.00 59.35 ? 186 SER B CA 1 ATOM 6346 C C . SER D 2 192 ? 74.139 -66.039 -19.848 1.00 59.59 ? 186 SER B C 1 ATOM 6347 O O . SER D 2 192 ? 73.529 -66.271 -20.892 1.00 59.43 ? 186 SER B O 1 ATOM 6348 C CB . SER D 2 192 ? 76.614 -65.810 -20.061 1.00 62.29 ? 186 SER B CB 1 ATOM 6349 O OG . SER D 2 192 ? 77.689 -64.907 -20.228 1.00 70.20 ? 186 SER B OG 1 ATOM 6350 N N . SER D 2 193 ? 73.827 -66.596 -18.682 1.00 62.01 ? 187 SER B N 1 ATOM 6351 C CA . SER D 2 193 ? 72.777 -67.598 -18.548 1.00 64.66 ? 187 SER B CA 1 ATOM 6352 C C . SER D 2 193 ? 71.378 -67.028 -18.781 1.00 64.94 ? 187 SER B C 1 ATOM 6353 O O . SER D 2 193 ? 70.391 -67.763 -18.765 1.00 63.69 ? 187 SER B O 1 ATOM 6354 C CB . SER D 2 193 ? 72.849 -68.239 -17.163 1.00 61.68 ? 187 SER B CB 1 ATOM 6355 O OG . SER D 2 193 ? 72.793 -67.248 -16.152 1.00 61.47 ? 187 SER B OG 1 ATOM 6356 N N . SER D 2 194 ? 71.298 -65.718 -18.993 1.00 63.32 ? 188 SER B N 1 ATOM 6357 C CA . SER D 2 194 ? 70.021 -65.053 -19.221 1.00 64.28 ? 188 SER B CA 1 ATOM 6358 C C . SER D 2 194 ? 69.767 -64.828 -20.706 1.00 62.71 ? 188 SER B C 1 ATOM 6359 O O . SER D 2 194 ? 68.650 -64.510 -21.111 1.00 63.33 ? 188 SER B O 1 ATOM 6360 C CB . SER D 2 194 ? 69.979 -63.713 -18.488 1.00 61.61 ? 188 SER B CB 1 ATOM 6361 O OG . SER D 2 194 ? 70.864 -62.784 -19.092 1.00 53.54 ? 188 SER B OG 1 ATOM 6362 N N . LEU D 2 195 ? 70.811 -64.992 -21.511 1.00 60.43 ? 189 LEU B N 1 ATOM 6363 C CA . LEU D 2 195 ? 70.745 -64.672 -22.932 1.00 65.18 ? 189 LEU B CA 1 ATOM 6364 C C . LEU D 2 195 ? 69.680 -65.469 -23.680 1.00 76.79 ? 189 LEU B C 1 ATOM 6365 O O . LEU D 2 195 ? 69.078 -64.969 -24.631 1.00 79.65 ? 189 LEU B O 1 ATOM 6366 C CB . LEU D 2 195 ? 72.109 -64.898 -23.584 1.00 55.52 ? 189 LEU B CB 1 ATOM 6367 C CG . LEU D 2 195 ? 73.194 -63.911 -23.157 1.00 50.37 ? 189 LEU B CG 1 ATOM 6368 C CD1 . LEU D 2 195 ? 74.507 -64.217 -23.856 1.00 47.57 ? 189 LEU B CD1 1 ATOM 6369 C CD2 . LEU D 2 195 ? 72.741 -62.487 -23.442 1.00 44.51 ? 189 LEU B CD2 1 ATOM 6370 N N . GLY D 2 196 ? 69.443 -66.702 -23.245 1.00 83.76 ? 190 GLY B N 1 ATOM 6371 C CA . GLY D 2 196 ? 68.495 -67.570 -23.918 1.00 92.91 ? 190 GLY B CA 1 ATOM 6372 C C . GLY D 2 196 ? 67.100 -67.554 -23.323 1.00 101.37 ? 190 GLY B C 1 ATOM 6373 O O . GLY D 2 196 ? 66.253 -68.361 -23.705 1.00 111.26 ? 190 GLY B O 1 ATOM 6374 N N . THR D 2 197 ? 66.858 -66.641 -22.386 1.00 95.72 ? 191 THR B N 1 ATOM 6375 C CA . THR D 2 197 ? 65.557 -66.546 -21.727 1.00 91.35 ? 191 THR B CA 1 ATOM 6376 C C . THR D 2 197 ? 65.106 -65.100 -21.532 1.00 88.44 ? 191 THR B C 1 ATOM 6377 O O . THR D 2 197 ? 63.910 -64.810 -21.531 1.00 90.51 ? 191 THR B O 1 ATOM 6378 C CB . THR D 2 197 ? 65.565 -67.241 -20.346 1.00 86.58 ? 191 THR B CB 1 ATOM 6379 O OG1 . THR D 2 197 ? 66.668 -66.758 -19.569 1.00 84.78 ? 191 THR B OG1 1 ATOM 6380 C CG2 . THR D 2 197 ? 65.678 -68.751 -20.497 1.00 83.40 ? 191 THR B CG2 1 ATOM 6381 N N . GLN D 2 198 ? 66.067 -64.197 -21.366 1.00 86.43 ? 192 GLN B N 1 ATOM 6382 C CA . GLN D 2 198 ? 65.763 -62.808 -21.039 1.00 82.27 ? 192 GLN B CA 1 ATOM 6383 C C . GLN D 2 198 ? 65.824 -61.909 -22.274 1.00 70.59 ? 192 GLN B C 1 ATOM 6384 O O . GLN D 2 198 ? 66.767 -61.984 -23.063 1.00 67.38 ? 192 GLN B O 1 ATOM 6385 C CB . GLN D 2 198 ? 66.730 -62.299 -19.966 1.00 89.16 ? 192 GLN B CB 1 ATOM 6386 C CG . GLN D 2 198 ? 66.184 -61.183 -19.095 1.00 96.22 ? 192 GLN B CG 1 ATOM 6387 C CD . GLN D 2 198 ? 65.150 -61.669 -18.094 1.00 106.26 ? 192 GLN B CD 1 ATOM 6388 O OE1 . GLN D 2 198 ? 65.037 -62.867 -17.830 1.00 110.47 ? 192 GLN B OE1 1 ATOM 6389 N NE2 . GLN D 2 198 ? 64.390 -60.736 -17.531 1.00 108.57 ? 192 GLN B NE2 1 ATOM 6390 N N . THR D 2 199 ? 64.815 -61.059 -22.434 1.00 58.66 ? 193 THR B N 1 ATOM 6391 C CA . THR D 2 199 ? 64.749 -60.154 -23.576 1.00 53.24 ? 193 THR B CA 1 ATOM 6392 C C . THR D 2 199 ? 65.348 -58.786 -23.242 1.00 50.90 ? 193 THR B C 1 ATOM 6393 O O . THR D 2 199 ? 65.007 -58.183 -22.224 1.00 50.35 ? 193 THR B O 1 ATOM 6394 C CB . THR D 2 199 ? 63.294 -59.983 -24.062 1.00 54.64 ? 193 THR B CB 1 ATOM 6395 O OG1 . THR D 2 199 ? 62.915 -61.126 -24.837 1.00 57.38 ? 193 THR B OG1 1 ATOM 6396 C CG2 . THR D 2 199 ? 63.147 -58.741 -24.921 1.00 58.00 ? 193 THR B CG2 1 ATOM 6397 N N . TYR D 2 200 ? 66.245 -58.304 -24.099 1.00 45.93 ? 194 TYR B N 1 ATOM 6398 C CA . TYR D 2 200 ? 66.872 -57.002 -23.892 1.00 43.33 ? 194 TYR B CA 1 ATOM 6399 C C . TYR D 2 200 ? 66.538 -56.023 -25.015 1.00 42.83 ? 194 TYR B C 1 ATOM 6400 O O . TYR D 2 200 ? 66.840 -56.266 -26.184 1.00 37.68 ? 194 TYR B O 1 ATOM 6401 C CB . TYR D 2 200 ? 68.387 -57.163 -23.749 1.00 41.16 ? 194 TYR B CB 1 ATOM 6402 C CG . TYR D 2 200 ? 68.765 -57.991 -22.542 1.00 41.69 ? 194 TYR B CG 1 ATOM 6403 C CD1 . TYR D 2 200 ? 68.596 -57.489 -21.257 1.00 41.81 ? 194 TYR B CD1 1 ATOM 6404 C CD2 . TYR D 2 200 ? 69.268 -59.279 -22.685 1.00 39.95 ? 194 TYR B CD2 1 ATOM 6405 C CE1 . TYR D 2 200 ? 68.927 -58.241 -20.146 1.00 47.96 ? 194 TYR B CE1 1 ATOM 6406 C CE2 . TYR D 2 200 ? 69.603 -60.040 -21.580 1.00 46.41 ? 194 TYR B CE2 1 ATOM 6407 C CZ . TYR D 2 200 ? 69.430 -59.515 -20.312 1.00 50.90 ? 194 TYR B CZ 1 ATOM 6408 O OH . TYR D 2 200 ? 69.759 -60.260 -19.204 1.00 49.88 ? 194 TYR B OH 1 ATOM 6409 N N . ILE D 2 201 ? 65.906 -54.915 -24.641 1.00 42.75 ? 195 ILE B N 1 ATOM 6410 C CA . ILE D 2 201 ? 65.478 -53.899 -25.593 1.00 41.88 ? 195 ILE B CA 1 ATOM 6411 C C . ILE D 2 201 ? 65.957 -52.517 -25.163 1.00 45.77 ? 195 ILE B C 1 ATOM 6412 O O . ILE D 2 201 ? 65.733 -52.102 -24.023 1.00 46.19 ? 195 ILE B O 1 ATOM 6413 C CB . ILE D 2 201 ? 63.943 -53.878 -25.737 1.00 44.17 ? 195 ILE B CB 1 ATOM 6414 C CG1 . ILE D 2 201 ? 63.445 -55.202 -26.321 1.00 50.34 ? 195 ILE B CG1 1 ATOM 6415 C CG2 . ILE D 2 201 ? 63.497 -52.703 -26.600 1.00 45.13 ? 195 ILE B CG2 1 ATOM 6416 C CD1 . ILE D 2 201 ? 61.936 -55.290 -26.454 1.00 53.66 ? 195 ILE B CD1 1 ATOM 6417 N N . CYS D 2 202 ? 66.627 -51.805 -26.064 1.00 42.13 ? 196 CYS B N 1 ATOM 6418 C CA . CYS D 2 202 ? 67.012 -50.431 -25.771 1.00 43.29 ? 196 CYS B CA 1 ATOM 6419 C C . CYS D 2 202 ? 65.973 -49.486 -26.351 1.00 39.34 ? 196 CYS B C 1 ATOM 6420 O O . CYS D 2 202 ? 65.489 -49.677 -27.464 1.00 38.39 ? 196 CYS B O 1 ATOM 6421 C CB . CYS D 2 202 ? 68.404 -50.101 -26.320 1.00 37.34 ? 196 CYS B CB 1 ATOM 6422 S SG . CYS D 2 202 ? 68.487 -49.917 -28.107 1.00 58.66 ? 196 CYS B SG 1 ATOM 6423 N N . ASN D 2 203 ? 65.622 -48.473 -25.573 1.00 39.19 ? 197 ASN B N 1 ATOM 6424 C CA . ASN D 2 203 ? 64.658 -47.478 -26.002 1.00 37.87 ? 197 ASN B CA 1 ATOM 6425 C C . ASN D 2 203 ? 65.368 -46.161 -26.218 1.00 36.75 ? 197 ASN B C 1 ATOM 6426 O O . ASN D 2 203 ? 65.963 -45.607 -25.293 1.00 36.09 ? 197 ASN B O 1 ATOM 6427 C CB . ASN D 2 203 ? 63.548 -47.338 -24.968 1.00 39.16 ? 197 ASN B CB 1 ATOM 6428 C CG . ASN D 2 203 ? 63.152 -48.671 -24.373 1.00 45.47 ? 197 ASN B CG 1 ATOM 6429 O OD1 . ASN D 2 203 ? 63.432 -48.953 -23.207 1.00 49.90 ? 197 ASN B OD1 1 ATOM 6430 N ND2 . ASN D 2 203 ? 62.513 -49.509 -25.179 1.00 44.42 ? 197 ASN B ND2 1 ATOM 6431 N N . VAL D 2 204 ? 65.320 -45.670 -27.448 1.00 37.59 ? 198 VAL B N 1 ATOM 6432 C CA . VAL D 2 204 ? 66.053 -44.470 -27.802 1.00 37.33 ? 198 VAL B CA 1 ATOM 6433 C C . VAL D 2 204 ? 65.088 -43.340 -28.117 1.00 37.18 ? 198 VAL B C 1 ATOM 6434 O O . VAL D 2 204 ? 64.200 -43.485 -28.955 1.00 42.95 ? 198 VAL B O 1 ATOM 6435 C CB . VAL D 2 204 ? 66.984 -44.720 -29.000 1.00 37.02 ? 198 VAL B CB 1 ATOM 6436 C CG1 . VAL D 2 204 ? 67.756 -43.461 -29.341 1.00 37.79 ? 198 VAL B CG1 1 ATOM 6437 C CG2 . VAL D 2 204 ? 67.939 -45.869 -28.691 1.00 35.43 ? 198 VAL B CG2 1 ATOM 6438 N N . ASN D 2 205 ? 65.258 -42.218 -27.430 1.00 37.23 ? 199 ASN B N 1 ATOM 6439 C CA . ASN D 2 205 ? 64.389 -41.069 -27.632 1.00 44.18 ? 199 ASN B CA 1 ATOM 6440 C C . ASN D 2 205 ? 65.176 -39.837 -28.075 1.00 38.36 ? 199 ASN B C 1 ATOM 6441 O O . ASN D 2 205 ? 66.129 -39.425 -27.415 1.00 42.53 ? 199 ASN B O 1 ATOM 6442 C CB . ASN D 2 205 ? 63.604 -40.774 -26.351 1.00 57.22 ? 199 ASN B CB 1 ATOM 6443 C CG . ASN D 2 205 ? 62.428 -39.848 -26.586 1.00 69.42 ? 199 ASN B CG 1 ATOM 6444 O OD1 . ASN D 2 205 ? 62.019 -39.622 -27.725 1.00 78.82 ? 199 ASN B OD1 1 ATOM 6445 N ND2 . ASN D 2 205 ? 61.871 -39.312 -25.505 1.00 67.32 ? 199 ASN B ND2 1 ATOM 6446 N N . HIS D 2 206 ? 64.781 -39.265 -29.207 1.00 38.89 ? 200 HIS B N 1 ATOM 6447 C CA . HIS D 2 206 ? 65.407 -38.052 -29.726 1.00 40.72 ? 200 HIS B CA 1 ATOM 6448 C C . HIS D 2 206 ? 64.334 -37.005 -29.994 1.00 41.59 ? 200 HIS B C 1 ATOM 6449 O O . HIS D 2 206 ? 63.823 -36.899 -31.110 1.00 44.07 ? 200 HIS B O 1 ATOM 6450 C CB . HIS D 2 206 ? 66.202 -38.352 -31.003 1.00 36.32 ? 200 HIS B CB 1 ATOM 6451 C CG . HIS D 2 206 ? 66.994 -37.187 -31.520 1.00 34.55 ? 200 HIS B CG 1 ATOM 6452 N ND1 . HIS D 2 206 ? 66.713 -36.569 -32.721 1.00 33.53 ? 200 HIS B ND1 1 ATOM 6453 C CD2 . HIS D 2 206 ? 68.067 -36.539 -31.008 1.00 30.14 ? 200 HIS B CD2 1 ATOM 6454 C CE1 . HIS D 2 206 ? 67.574 -35.588 -32.923 1.00 32.19 ? 200 HIS B CE1 1 ATOM 6455 N NE2 . HIS D 2 206 ? 68.406 -35.548 -31.897 1.00 34.21 ? 200 HIS B NE2 1 ATOM 6456 N N . LYS D 2 207 ? 63.994 -36.242 -28.960 1.00 46.64 ? 201 LYS B N 1 ATOM 6457 C CA . LYS D 2 207 ? 62.909 -35.261 -29.033 1.00 55.01 ? 201 LYS B CA 1 ATOM 6458 C C . LYS D 2 207 ? 62.989 -34.262 -30.208 1.00 55.64 ? 201 LYS B C 1 ATOM 6459 O O . LYS D 2 207 ? 61.969 -34.019 -30.855 1.00 55.15 ? 201 LYS B O 1 ATOM 6460 C CB . LYS D 2 207 ? 62.814 -34.493 -27.708 1.00 53.96 ? 201 LYS B CB 1 ATOM 6461 C CG . LYS D 2 207 ? 62.383 -35.353 -26.524 1.00 61.17 ? 201 LYS B CG 1 ATOM 6462 C CD . LYS D 2 207 ? 62.244 -34.518 -25.258 1.00 68.29 ? 201 LYS B CD 1 ATOM 6463 C CE . LYS D 2 207 ? 61.703 -35.338 -24.095 1.00 73.53 ? 201 LYS B CE 1 ATOM 6464 N NZ . LYS D 2 207 ? 61.559 -34.512 -22.861 1.00 76.34 ? 201 LYS B NZ 1 ATOM 6465 N N . PRO D 2 208 ? 64.181 -33.688 -30.497 1.00 50.57 ? 202 PRO B N 1 ATOM 6466 C CA . PRO D 2 208 ? 64.266 -32.722 -31.607 1.00 47.74 ? 202 PRO B CA 1 ATOM 6467 C C . PRO D 2 208 ? 63.739 -33.210 -32.960 1.00 48.16 ? 202 PRO B C 1 ATOM 6468 O O . PRO D 2 208 ? 63.253 -32.397 -33.743 1.00 51.81 ? 202 PRO B O 1 ATOM 6469 C CB . PRO D 2 208 ? 65.767 -32.446 -31.703 1.00 44.05 ? 202 PRO B CB 1 ATOM 6470 C CG . PRO D 2 208 ? 66.248 -32.610 -30.323 1.00 42.65 ? 202 PRO B CG 1 ATOM 6471 C CD . PRO D 2 208 ? 65.455 -33.750 -29.753 1.00 45.48 ? 202 PRO B CD 1 ATOM 6472 N N . SER D 2 209 ? 63.840 -34.506 -33.233 1.00 43.26 ? 203 SER B N 1 ATOM 6473 C CA . SER D 2 209 ? 63.337 -35.056 -34.488 1.00 36.37 ? 203 SER B CA 1 ATOM 6474 C C . SER D 2 209 ? 62.031 -35.802 -34.268 1.00 38.93 ? 203 SER B C 1 ATOM 6475 O O . SER D 2 209 ? 61.491 -36.403 -35.199 1.00 37.30 ? 203 SER B O 1 ATOM 6476 C CB . SER D 2 209 ? 64.362 -35.997 -35.117 1.00 35.53 ? 203 SER B CB 1 ATOM 6477 O OG . SER D 2 209 ? 64.555 -37.139 -34.300 1.00 42.19 ? 203 SER B OG 1 ATOM 6478 N N . ASN D 2 210 ? 61.542 -35.768 -33.029 1.00 42.81 ? 204 ASN B N 1 ATOM 6479 C CA . ASN D 2 210 ? 60.320 -36.466 -32.647 1.00 50.08 ? 204 ASN B CA 1 ATOM 6480 C C . ASN D 2 210 ? 60.419 -37.958 -32.962 1.00 54.33 ? 204 ASN B C 1 ATOM 6481 O O . ASN D 2 210 ? 59.527 -38.538 -33.583 1.00 59.41 ? 204 ASN B O 1 ATOM 6482 C CB . ASN D 2 210 ? 59.112 -35.844 -33.355 1.00 57.49 ? 204 ASN B CB 1 ATOM 6483 C CG . ASN D 2 210 ? 57.853 -35.898 -32.518 1.00 68.45 ? 204 ASN B CG 1 ATOM 6484 O OD1 . ASN D 2 210 ? 57.913 -36.064 -31.299 1.00 70.18 ? 204 ASN B OD1 1 ATOM 6485 N ND2 . ASN D 2 210 ? 56.702 -35.751 -33.168 1.00 72.78 ? 204 ASN B ND2 1 ATOM 6486 N N . THR D 2 211 ? 61.519 -38.572 -32.537 1.00 54.04 ? 205 THR B N 1 ATOM 6487 C CA . THR D 2 211 ? 61.797 -39.967 -32.861 1.00 54.98 ? 205 THR B CA 1 ATOM 6488 C C . THR D 2 211 ? 61.851 -40.851 -31.616 1.00 53.01 ? 205 THR B C 1 ATOM 6489 O O . THR D 2 211 ? 62.484 -40.500 -30.618 1.00 47.20 ? 205 THR B O 1 ATOM 6490 C CB . THR D 2 211 ? 63.132 -40.104 -33.632 1.00 53.04 ? 205 THR B CB 1 ATOM 6491 O OG1 . THR D 2 211 ? 63.071 -39.337 -34.841 1.00 54.20 ? 205 THR B OG1 1 ATOM 6492 C CG2 . THR D 2 211 ? 63.415 -41.559 -33.980 1.00 55.83 ? 205 THR B CG2 1 ATOM 6493 N N . LYS D 2 212 ? 61.172 -41.994 -31.686 1.00 56.24 ? 206 LYS B N 1 ATOM 6494 C CA . LYS D 2 212 ? 61.251 -43.018 -30.650 1.00 56.94 ? 206 LYS B CA 1 ATOM 6495 C C . LYS D 2 212 ? 61.529 -44.374 -31.283 1.00 52.47 ? 206 LYS B C 1 ATOM 6496 O O . LYS D 2 212 ? 60.779 -44.829 -32.141 1.00 50.92 ? 206 LYS B O 1 ATOM 6497 C CB . LYS D 2 212 ? 59.960 -43.078 -29.832 1.00 61.67 ? 206 LYS B CB 1 ATOM 6498 C CG . LYS D 2 212 ? 59.752 -41.908 -28.890 1.00 65.22 ? 206 LYS B CG 1 ATOM 6499 C CD . LYS D 2 212 ? 58.528 -42.128 -28.019 1.00 74.26 ? 206 LYS B CD 1 ATOM 6500 C CE . LYS D 2 212 ? 58.408 -41.060 -26.948 1.00 82.42 ? 206 LYS B CE 1 ATOM 6501 N NZ . LYS D 2 212 ? 57.293 -41.348 -26.004 1.00 89.86 ? 206 LYS B NZ 1 ATOM 6502 N N . VAL D 2 213 ? 62.611 -45.016 -30.858 1.00 48.23 ? 207 VAL B N 1 ATOM 6503 C CA . VAL D 2 213 ? 63.010 -46.297 -31.425 1.00 43.23 ? 207 VAL B CA 1 ATOM 6504 C C . VAL D 2 213 ? 63.244 -47.344 -30.339 1.00 41.74 ? 207 VAL B C 1 ATOM 6505 O O . VAL D 2 213 ? 63.932 -47.084 -29.351 1.00 44.91 ? 207 VAL B O 1 ATOM 6506 C CB . VAL D 2 213 ? 64.294 -46.155 -32.275 1.00 41.89 ? 207 VAL B CB 1 ATOM 6507 C CG1 . VAL D 2 213 ? 64.741 -47.509 -32.808 1.00 43.24 ? 207 VAL B CG1 1 ATOM 6508 C CG2 . VAL D 2 213 ? 64.072 -45.177 -33.417 1.00 43.41 ? 207 VAL B CG2 1 ATOM 6509 N N . ASP D 2 214 ? 62.658 -48.523 -30.523 1.00 44.18 ? 208 ASP B N 1 ATOM 6510 C CA . ASP D 2 214 ? 62.931 -49.667 -29.661 1.00 48.23 ? 208 ASP B CA 1 ATOM 6511 C C . ASP D 2 214 ? 63.631 -50.753 -30.466 1.00 48.73 ? 208 ASP B C 1 ATOM 6512 O O . ASP D 2 214 ? 63.125 -51.189 -31.498 1.00 55.69 ? 208 ASP B O 1 ATOM 6513 C CB . ASP D 2 214 ? 61.643 -50.218 -29.043 1.00 56.15 ? 208 ASP B CB 1 ATOM 6514 C CG . ASP D 2 214 ? 60.946 -49.214 -28.142 1.00 68.50 ? 208 ASP B CG 1 ATOM 6515 O OD1 . ASP D 2 214 ? 61.537 -48.154 -27.852 1.00 72.86 ? 208 ASP B OD1 1 ATOM 6516 O OD2 . ASP D 2 214 ? 59.807 -49.492 -27.712 1.00 78.18 ? 208 ASP B OD2 1 ATOM 6517 N N . LYS D 2 215 ? 64.797 -51.188 -30.004 1.00 44.32 ? 209 LYS B N 1 ATOM 6518 C CA . LYS D 2 215 ? 65.537 -52.211 -30.729 1.00 38.95 ? 209 LYS B CA 1 ATOM 6519 C C . LYS D 2 215 ? 65.867 -53.401 -29.839 1.00 42.40 ? 209 LYS B C 1 ATOM 6520 O O . LYS D 2 215 ? 66.498 -53.253 -28.791 1.00 40.64 ? 209 LYS B O 1 ATOM 6521 C CB . LYS D 2 215 ? 66.818 -51.625 -31.325 1.00 34.41 ? 209 LYS B CB 1 ATOM 6522 C CG . LYS D 2 215 ? 67.110 -52.099 -32.746 1.00 48.23 ? 209 LYS B CG 1 ATOM 6523 C CD . LYS D 2 215 ? 67.632 -53.524 -32.763 1.00 57.73 ? 209 LYS B CD 1 ATOM 6524 C CE . LYS D 2 215 ? 67.669 -54.093 -34.173 1.00 60.24 ? 209 LYS B CE 1 ATOM 6525 N NZ . LYS D 2 215 ? 66.617 -55.127 -34.374 1.00 56.96 ? 209 LYS B NZ 1 ATOM 6526 N N . LYS D 2 216 ? 65.434 -54.582 -30.269 1.00 41.91 ? 210 LYS B N 1 ATOM 6527 C CA . LYS D 2 216 ? 65.714 -55.808 -29.541 1.00 44.60 ? 210 LYS B CA 1 ATOM 6528 C C . LYS D 2 216 ? 67.128 -56.276 -29.845 1.00 45.62 ? 210 LYS B C 1 ATOM 6529 O O . LYS D 2 216 ? 67.533 -56.347 -31.004 1.00 48.52 ? 210 LYS B O 1 ATOM 6530 C CB . LYS D 2 216 ? 64.704 -56.900 -29.900 1.00 53.72 ? 210 LYS B CB 1 ATOM 6531 C CG . LYS D 2 216 ? 64.909 -58.189 -29.123 1.00 65.55 ? 210 LYS B CG 1 ATOM 6532 C CD . LYS D 2 216 ? 63.878 -59.245 -29.488 1.00 76.56 ? 210 LYS B CD 1 ATOM 6533 C CE . LYS D 2 216 ? 64.062 -60.496 -28.639 1.00 83.56 ? 210 LYS B CE 1 ATOM 6534 N NZ . LYS D 2 216 ? 63.073 -61.559 -28.974 1.00 91.44 ? 210 LYS B NZ 1 ATOM 6535 N N . VAL D 2 217 ? 67.882 -56.586 -28.798 1.00 44.74 ? 211 VAL B N 1 ATOM 6536 C CA . VAL D 2 217 ? 69.267 -56.997 -28.967 1.00 42.68 ? 211 VAL B CA 1 ATOM 6537 C C . VAL D 2 217 ? 69.450 -58.442 -28.533 1.00 42.50 ? 211 VAL B C 1 ATOM 6538 O O . VAL D 2 217 ? 69.429 -58.754 -27.344 1.00 45.60 ? 211 VAL B O 1 ATOM 6539 C CB . VAL D 2 217 ? 70.220 -56.097 -28.170 1.00 37.98 ? 211 VAL B CB 1 ATOM 6540 C CG1 . VAL D 2 217 ? 71.659 -56.520 -28.403 1.00 40.96 ? 211 VAL B CG1 1 ATOM 6541 C CG2 . VAL D 2 217 ? 70.014 -54.644 -28.564 1.00 38.69 ? 211 VAL B CG2 1 ATOM 6542 N N . GLU D 2 218 ? 69.636 -59.321 -29.506 1.00 42.78 ? 212 GLU B N 1 ATOM 6543 C CA . GLU D 2 218 ? 69.702 -60.749 -29.232 1.00 53.62 ? 212 GLU B CA 1 ATOM 6544 C C . GLU D 2 218 ? 70.956 -61.361 -29.840 1.00 53.72 ? 212 GLU B C 1 ATOM 6545 O O . GLU D 2 218 ? 71.591 -60.750 -30.702 1.00 50.19 ? 212 GLU B O 1 ATOM 6546 C CB . GLU D 2 218 ? 68.444 -61.437 -29.764 1.00 60.05 ? 212 GLU B CB 1 ATOM 6547 C CG . GLU D 2 218 ? 68.020 -60.960 -31.138 1.00 70.10 ? 212 GLU B CG 1 ATOM 6548 C CD . GLU D 2 218 ? 66.598 -61.354 -31.466 1.00 81.79 ? 212 GLU B CD 1 ATOM 6549 O OE1 . GLU D 2 218 ? 65.985 -62.081 -30.656 1.00 85.75 ? 212 GLU B OE1 1 ATOM 6550 O OE2 . GLU D 2 218 ? 66.091 -60.934 -32.530 1.00 86.03 ? 212 GLU B OE2 1 ATOM 6551 N N . PRO D 2 219 ? 71.337 -62.560 -29.372 1.00 56.90 ? 213 PRO B N 1 ATOM 6552 C CA . PRO D 2 219 ? 72.514 -63.228 -29.940 1.00 63.84 ? 213 PRO B CA 1 ATOM 6553 C C . PRO D 2 219 ? 72.347 -63.575 -31.420 1.00 68.02 ? 213 PRO B C 1 ATOM 6554 O O . PRO D 2 219 ? 71.236 -63.866 -31.863 1.00 64.27 ? 213 PRO B O 1 ATOM 6555 C CB . PRO D 2 219 ? 72.632 -64.500 -29.096 1.00 62.82 ? 213 PRO B CB 1 ATOM 6556 C CG . PRO D 2 219 ? 71.972 -64.158 -27.805 1.00 61.16 ? 213 PRO B CG 1 ATOM 6557 C CD . PRO D 2 219 ? 70.837 -63.251 -28.170 1.00 59.44 ? 213 PRO B CD 1 ATOM 6558 N N . LYS D 2 220 ? 73.445 -63.537 -32.170 1.00 79.30 ? 214 LYS B N 1 ATOM 6559 C CA . LYS D 2 220 ? 73.419 -63.887 -33.588 1.00 90.24 ? 214 LYS B CA 1 ATOM 6560 C C . LYS D 2 220 ? 74.262 -65.126 -33.870 1.00 94.43 ? 214 LYS B C 1 ATOM 6561 O O . LYS D 2 220 ? 75.377 -65.259 -33.366 1.00 97.78 ? 214 LYS B O 1 ATOM 6562 C CB . LYS D 2 220 ? 73.906 -62.713 -34.444 1.00 94.74 ? 214 LYS B CB 1 ATOM 6563 C CG . LYS D 2 220 ? 72.936 -61.541 -34.505 1.00 99.58 ? 214 LYS B CG 1 ATOM 6564 C CD . LYS D 2 220 ? 71.597 -61.961 -35.099 1.00 103.25 ? 214 LYS B CD 1 ATOM 6565 C CE . LYS D 2 220 ? 70.587 -60.823 -35.063 1.00 100.24 ? 214 LYS B CE 1 ATOM 6566 N NZ . LYS D 2 220 ? 69.268 -61.227 -35.626 1.00 95.98 ? 214 LYS B NZ 1 ATOM 6567 N N . ASP E 1 1 ? 56.668 -41.759 1.864 1.00 48.41 ? 1 ASP C N 1 ATOM 6568 C CA . ASP E 1 1 ? 56.374 -40.336 1.722 1.00 43.73 ? 1 ASP C CA 1 ATOM 6569 C C . ASP E 1 1 ? 56.561 -39.578 3.028 1.00 43.97 ? 1 ASP C C 1 ATOM 6570 O O . ASP E 1 1 ? 56.300 -40.106 4.111 1.00 46.60 ? 1 ASP C O 1 ATOM 6571 C CB . ASP E 1 1 ? 54.950 -40.131 1.213 1.00 36.80 ? 1 ASP C CB 1 ATOM 6572 C CG . ASP E 1 1 ? 54.786 -40.558 -0.226 1.00 42.39 ? 1 ASP C CG 1 ATOM 6573 O OD1 . ASP E 1 1 ? 55.815 -40.685 -0.922 1.00 45.74 ? 1 ASP C OD1 1 ATOM 6574 O OD2 . ASP E 1 1 ? 53.633 -40.758 -0.661 1.00 44.73 ? 1 ASP C OD2 1 ATOM 6575 N N . ILE E 1 2 ? 57.009 -38.334 2.919 1.00 36.47 ? 2 ILE C N 1 ATOM 6576 C CA . ILE E 1 2 ? 57.180 -37.490 4.090 1.00 36.23 ? 2 ILE C CA 1 ATOM 6577 C C . ILE E 1 2 ? 55.821 -37.152 4.697 1.00 36.54 ? 2 ILE C C 1 ATOM 6578 O O . ILE E 1 2 ? 54.875 -36.805 3.982 1.00 33.21 ? 2 ILE C O 1 ATOM 6579 C CB . ILE E 1 2 ? 57.952 -36.209 3.734 1.00 42.45 ? 2 ILE C CB 1 ATOM 6580 C CG1 . ILE E 1 2 ? 59.434 -36.545 3.540 1.00 43.65 ? 2 ILE C CG1 1 ATOM 6581 C CG2 . ILE E 1 2 ? 57.778 -35.156 4.812 1.00 42.12 ? 2 ILE C CG2 1 ATOM 6582 C CD1 . ILE E 1 2 ? 60.246 -35.439 2.916 1.00 49.57 ? 2 ILE C CD1 1 ATOM 6583 N N . GLN E 1 3 ? 55.718 -37.287 6.016 1.00 32.28 ? 3 GLN C N 1 ATOM 6584 C CA . GLN E 1 3 ? 54.473 -36.992 6.711 1.00 35.35 ? 3 GLN C CA 1 ATOM 6585 C C . GLN E 1 3 ? 54.653 -35.876 7.738 1.00 31.19 ? 3 GLN C C 1 ATOM 6586 O O . GLN E 1 3 ? 55.602 -35.886 8.520 1.00 36.59 ? 3 GLN C O 1 ATOM 6587 C CB . GLN E 1 3 ? 53.934 -38.252 7.393 1.00 45.01 ? 3 GLN C CB 1 ATOM 6588 C CG . GLN E 1 3 ? 52.629 -38.030 8.144 1.00 63.43 ? 3 GLN C CG 1 ATOM 6589 C CD . GLN E 1 3 ? 51.957 -39.327 8.552 1.00 74.48 ? 3 GLN C CD 1 ATOM 6590 O OE1 . GLN E 1 3 ? 52.600 -40.235 9.085 1.00 82.57 ? 3 GLN C OE1 1 ATOM 6591 N NE2 . GLN E 1 3 ? 50.656 -39.423 8.298 1.00 69.67 ? 3 GLN C NE2 1 ATOM 6592 N N . MET E 1 4 ? 53.743 -34.907 7.724 1.00 28.36 ? 4 MET C N 1 ATOM 6593 C CA . MET E 1 4 ? 53.744 -33.854 8.731 1.00 34.71 ? 4 MET C CA 1 ATOM 6594 C C . MET E 1 4 ? 52.793 -34.216 9.856 1.00 33.79 ? 4 MET C C 1 ATOM 6595 O O . MET E 1 4 ? 51.683 -34.689 9.618 1.00 40.59 ? 4 MET C O 1 ATOM 6596 C CB . MET E 1 4 ? 53.343 -32.502 8.137 1.00 41.26 ? 4 MET C CB 1 ATOM 6597 C CG . MET E 1 4 ? 54.041 -32.134 6.841 1.00 47.77 ? 4 MET C CG 1 ATOM 6598 S SD . MET E 1 4 ? 55.828 -32.226 6.966 1.00 73.64 ? 4 MET C SD 1 ATOM 6599 C CE . MET E 1 4 ? 56.187 -30.810 7.991 1.00 217.30 ? 4 MET C CE 1 ATOM 6600 N N . THR E 1 5 ? 53.236 -33.987 11.084 1.00 21.58 ? 5 THR C N 1 ATOM 6601 C CA . THR E 1 5 ? 52.423 -34.246 12.263 1.00 31.64 ? 5 THR C CA 1 ATOM 6602 C C . THR E 1 5 ? 52.459 -33.030 13.170 1.00 29.44 ? 5 THR C C 1 ATOM 6603 O O . THR E 1 5 ? 53.533 -32.591 13.584 1.00 33.00 ? 5 THR C O 1 ATOM 6604 C CB . THR E 1 5 ? 52.918 -35.485 13.039 1.00 38.05 ? 5 THR C CB 1 ATOM 6605 O OG1 . THR E 1 5 ? 52.825 -36.646 12.201 1.00 40.34 ? 5 THR C OG1 1 ATOM 6606 C CG2 . THR E 1 5 ? 52.084 -35.698 14.298 1.00 34.06 ? 5 THR C CG2 1 ATOM 6607 N N . GLN E 1 6 ? 51.290 -32.480 13.471 1.00 25.90 ? 6 GLN C N 1 ATOM 6608 C CA . GLN E 1 6 ? 51.214 -31.285 14.296 1.00 33.10 ? 6 GLN C CA 1 ATOM 6609 C C . GLN E 1 6 ? 50.827 -31.621 15.723 1.00 34.61 ? 6 GLN C C 1 ATOM 6610 O O . GLN E 1 6 ? 50.137 -32.607 15.970 1.00 31.33 ? 6 GLN C O 1 ATOM 6611 C CB . GLN E 1 6 ? 50.213 -30.287 13.710 1.00 28.41 ? 6 GLN C CB 1 ATOM 6612 C CG . GLN E 1 6 ? 50.628 -29.727 12.367 1.00 32.09 ? 6 GLN C CG 1 ATOM 6613 C CD . GLN E 1 6 ? 49.605 -28.775 11.797 1.00 31.17 ? 6 GLN C CD 1 ATOM 6614 O OE1 . GLN E 1 6 ? 49.130 -28.955 10.675 1.00 31.99 ? 6 GLN C OE1 1 ATOM 6615 N NE2 . GLN E 1 6 ? 49.257 -27.752 12.567 1.00 32.71 ? 6 GLN C NE2 1 ATOM 6616 N N . SER E 1 7 ? 51.272 -30.790 16.658 1.00 36.48 ? 7 SER C N 1 ATOM 6617 C CA . SER E 1 7 ? 50.886 -30.930 18.055 1.00 42.81 ? 7 SER C CA 1 ATOM 6618 C C . SER E 1 7 ? 50.858 -29.563 18.734 1.00 45.96 ? 7 SER C C 1 ATOM 6619 O O . SER E 1 7 ? 51.699 -28.709 18.447 1.00 48.05 ? 7 SER C O 1 ATOM 6620 C CB . SER E 1 7 ? 51.834 -31.883 18.787 1.00 40.21 ? 7 SER C CB 1 ATOM 6621 O OG . SER E 1 7 ? 53.184 -31.558 18.520 1.00 45.25 ? 7 SER C OG 1 ATOM 6622 N N . PRO E 1 8 ? 49.869 -29.337 19.613 1.00 45.56 ? 8 PRO C N 1 ATOM 6623 C CA . PRO E 1 8 ? 48.767 -30.253 19.930 1.00 47.58 ? 8 PRO C CA 1 ATOM 6624 C C . PRO E 1 8 ? 47.759 -30.310 18.790 1.00 49.84 ? 8 PRO C C 1 ATOM 6625 O O . PRO E 1 8 ? 47.925 -29.583 17.814 1.00 52.20 ? 8 PRO C O 1 ATOM 6626 C CB . PRO E 1 8 ? 48.129 -29.632 21.183 1.00 42.78 ? 8 PRO C CB 1 ATOM 6627 C CG . PRO E 1 8 ? 49.057 -28.524 21.613 1.00 40.30 ? 8 PRO C CG 1 ATOM 6628 C CD . PRO E 1 8 ? 49.772 -28.088 20.384 1.00 41.54 ? 8 PRO C CD 1 ATOM 6629 N N . SER E 1 9 ? 46.744 -31.159 18.901 1.00 44.74 ? 9 SER C N 1 ATOM 6630 C CA . SER E 1 9 ? 45.686 -31.180 17.902 1.00 46.92 ? 9 SER C CA 1 ATOM 6631 C C . SER E 1 9 ? 44.633 -30.137 18.255 1.00 44.05 ? 9 SER C C 1 ATOM 6632 O O . SER E 1 9 ? 44.005 -29.547 17.373 1.00 39.70 ? 9 SER C O 1 ATOM 6633 C CB . SER E 1 9 ? 45.059 -32.571 17.799 1.00 51.18 ? 9 SER C CB 1 ATOM 6634 O OG . SER E 1 9 ? 45.957 -33.486 17.196 1.00 58.04 ? 9 SER C OG 1 ATOM 6635 N N . PHE E 1 10 ? 44.457 -29.911 19.554 1.00 44.06 ? 10 PHE C N 1 ATOM 6636 C CA . PHE E 1 10 ? 43.499 -28.932 20.057 1.00 43.94 ? 10 PHE C CA 1 ATOM 6637 C C . PHE E 1 10 ? 44.149 -28.035 21.102 1.00 46.72 ? 10 PHE C C 1 ATOM 6638 O O . PHE E 1 10 ? 44.792 -28.518 22.031 1.00 49.08 ? 10 PHE C O 1 ATOM 6639 C CB . PHE E 1 10 ? 42.274 -29.633 20.653 1.00 48.24 ? 10 PHE C CB 1 ATOM 6640 C CG . PHE E 1 10 ? 41.501 -30.451 19.657 1.00 61.73 ? 10 PHE C CG 1 ATOM 6641 C CD1 . PHE E 1 10 ? 40.485 -29.874 18.912 1.00 62.70 ? 10 PHE C CD1 1 ATOM 6642 C CD2 . PHE E 1 10 ? 41.794 -31.795 19.459 1.00 68.84 ? 10 PHE C CD2 1 ATOM 6643 C CE1 . PHE E 1 10 ? 39.772 -30.619 17.990 1.00 65.58 ? 10 PHE C CE1 1 ATOM 6644 C CE2 . PHE E 1 10 ? 41.084 -32.549 18.537 1.00 69.43 ? 10 PHE C CE2 1 ATOM 6645 C CZ . PHE E 1 10 ? 40.071 -31.960 17.802 1.00 69.48 ? 10 PHE C CZ 1 ATOM 6646 N N . VAL E 1 11 ? 43.990 -26.726 20.944 1.00 45.27 ? 11 VAL C N 1 ATOM 6647 C CA . VAL E 1 11 ? 44.505 -25.779 21.925 1.00 42.50 ? 11 VAL C CA 1 ATOM 6648 C C . VAL E 1 11 ? 43.392 -24.839 22.385 1.00 42.78 ? 11 VAL C C 1 ATOM 6649 O O . VAL E 1 11 ? 42.657 -24.290 21.565 1.00 38.63 ? 11 VAL C O 1 ATOM 6650 C CB . VAL E 1 11 ? 45.674 -24.939 21.359 1.00 42.95 ? 11 VAL C CB 1 ATOM 6651 C CG1 . VAL E 1 11 ? 46.310 -24.102 22.459 1.00 42.74 ? 11 VAL C CG1 1 ATOM 6652 C CG2 . VAL E 1 11 ? 46.712 -25.833 20.708 1.00 46.52 ? 11 VAL C CG2 1 ATOM 6653 N N . SER E 1 12 ? 43.268 -24.663 23.696 1.00 44.54 ? 12 SER C N 1 ATOM 6654 C CA . SER E 1 12 ? 42.326 -23.699 24.255 1.00 46.37 ? 12 SER C CA 1 ATOM 6655 C C . SER E 1 12 ? 43.079 -22.682 25.107 1.00 50.70 ? 12 SER C C 1 ATOM 6656 O O . SER E 1 12 ? 43.621 -23.029 26.156 1.00 52.47 ? 12 SER C O 1 ATOM 6657 C CB . SER E 1 12 ? 41.255 -24.409 25.085 1.00 47.57 ? 12 SER C CB 1 ATOM 6658 O OG . SER E 1 12 ? 40.295 -23.490 25.575 1.00 58.14 ? 12 SER C OG 1 ATOM 6659 N N . ALA E 1 13 ? 43.121 -21.432 24.656 1.00 52.52 ? 13 ALA C N 1 ATOM 6660 C CA . ALA E 1 13 ? 43.867 -20.398 25.373 1.00 54.28 ? 13 ALA C CA 1 ATOM 6661 C C . ALA E 1 13 ? 43.114 -19.068 25.442 1.00 51.62 ? 13 ALA C C 1 ATOM 6662 O O . ALA E 1 13 ? 42.250 -18.783 24.614 1.00 51.81 ? 13 ALA C O 1 ATOM 6663 C CB . ALA E 1 13 ? 45.234 -20.195 24.730 1.00 50.46 ? 13 ALA C CB 1 ATOM 6664 N N . SER E 1 14 ? 43.464 -18.257 26.436 1.00 51.79 ? 14 SER C N 1 ATOM 6665 C CA . SER E 1 14 ? 42.790 -16.985 26.688 1.00 53.55 ? 14 SER C CA 1 ATOM 6666 C C . SER E 1 14 ? 43.428 -15.830 25.925 1.00 51.39 ? 14 SER C C 1 ATOM 6667 O O . SER E 1 14 ? 44.588 -15.908 25.526 1.00 52.46 ? 14 SER C O 1 ATOM 6668 C CB . SER E 1 14 ? 42.796 -16.674 28.187 1.00 55.48 ? 14 SER C CB 1 ATOM 6669 O OG . SER E 1 14 ? 42.230 -17.737 28.935 1.00 62.56 ? 14 SER C OG 1 ATOM 6670 N N . VAL E 1 15 ? 42.664 -14.757 25.732 1.00 48.46 ? 15 VAL C N 1 ATOM 6671 C CA . VAL E 1 15 ? 43.167 -13.553 25.074 1.00 48.54 ? 15 VAL C CA 1 ATOM 6672 C C . VAL E 1 15 ? 44.388 -12.992 25.807 1.00 49.73 ? 15 VAL C C 1 ATOM 6673 O O . VAL E 1 15 ? 44.374 -12.835 27.028 1.00 54.29 ? 15 VAL C O 1 ATOM 6674 C CB . VAL E 1 15 ? 42.074 -12.465 24.982 1.00 36.77 ? 15 VAL C CB 1 ATOM 6675 C CG1 . VAL E 1 15 ? 42.644 -11.179 24.410 1.00 30.98 ? 15 VAL C CG1 1 ATOM 6676 C CG2 . VAL E 1 15 ? 40.909 -12.958 24.135 1.00 36.20 ? 15 VAL C CG2 1 ATOM 6677 N N . GLY E 1 16 ? 45.448 -12.710 25.057 1.00 52.37 ? 16 GLY C N 1 ATOM 6678 C CA . GLY E 1 16 ? 46.680 -12.211 25.639 1.00 57.11 ? 16 GLY C CA 1 ATOM 6679 C C . GLY E 1 16 ? 47.713 -13.299 25.868 1.00 61.46 ? 16 GLY C C 1 ATOM 6680 O O . GLY E 1 16 ? 48.908 -13.016 25.949 1.00 64.64 ? 16 GLY C O 1 ATOM 6681 N N . ASP E 1 17 ? 47.256 -14.544 25.976 1.00 60.97 ? 17 ASP C N 1 ATOM 6682 C CA . ASP E 1 17 ? 48.159 -15.672 26.196 1.00 57.24 ? 17 ASP C CA 1 ATOM 6683 C C . ASP E 1 17 ? 49.110 -15.867 25.027 1.00 57.91 ? 17 ASP C C 1 ATOM 6684 O O . ASP E 1 17 ? 48.799 -15.504 23.894 1.00 58.49 ? 17 ASP C O 1 ATOM 6685 C CB . ASP E 1 17 ? 47.376 -16.967 26.424 1.00 56.71 ? 17 ASP C CB 1 ATOM 6686 C CG . ASP E 1 17 ? 46.769 -17.049 27.807 1.00 66.00 ? 17 ASP C CG 1 ATOM 6687 O OD1 . ASP E 1 17 ? 46.595 -15.990 28.447 1.00 76.04 ? 17 ASP C OD1 1 ATOM 6688 O OD2 . ASP E 1 17 ? 46.458 -18.177 28.250 1.00 62.41 ? 17 ASP C OD2 1 ATOM 6689 N N . ARG E 1 18 ? 50.273 -16.440 25.315 1.00 61.94 ? 18 ARG C N 1 ATOM 6690 C CA . ARG E 1 18 ? 51.208 -16.836 24.275 1.00 56.36 ? 18 ARG C CA 1 ATOM 6691 C C . ARG E 1 18 ? 50.914 -18.271 23.860 1.00 49.95 ? 18 ARG C C 1 ATOM 6692 O O . ARG E 1 18 ? 50.821 -19.162 24.704 1.00 53.62 ? 18 ARG C O 1 ATOM 6693 C CB . ARG E 1 18 ? 52.651 -16.698 24.756 1.00 62.67 ? 18 ARG C CB 1 ATOM 6694 C CG . ARG E 1 18 ? 53.678 -17.121 23.724 1.00 71.58 ? 18 ARG C CG 1 ATOM 6695 C CD . ARG E 1 18 ? 55.100 -16.870 24.199 1.00 80.65 ? 18 ARG C CD 1 ATOM 6696 N NE . ARG E 1 18 ? 56.066 -17.173 23.147 1.00 89.01 ? 18 ARG C NE 1 ATOM 6697 C CZ . ARG E 1 18 ? 57.368 -16.918 23.225 1.00 93.88 ? 18 ARG C CZ 1 ATOM 6698 N NH1 . ARG E 1 18 ? 57.871 -16.351 24.314 1.00 100.88 ? 18 ARG C NH1 1 ATOM 6699 N NH2 . ARG E 1 18 ? 58.167 -17.230 22.213 1.00 87.17 ? 18 ARG C NH2 1 ATOM 6700 N N . VAL E 1 19 ? 50.756 -18.489 22.560 1.00 47.96 ? 19 VAL C N 1 ATOM 6701 C CA . VAL E 1 19 ? 50.419 -19.810 22.041 1.00 45.46 ? 19 VAL C CA 1 ATOM 6702 C C . VAL E 1 19 ? 51.498 -20.302 21.081 1.00 41.63 ? 19 VAL C C 1 ATOM 6703 O O . VAL E 1 19 ? 51.949 -19.554 20.213 1.00 41.28 ? 19 VAL C O 1 ATOM 6704 C CB . VAL E 1 19 ? 49.048 -19.801 21.319 1.00 43.86 ? 19 VAL C CB 1 ATOM 6705 C CG1 . VAL E 1 19 ? 48.731 -21.172 20.739 1.00 41.47 ? 19 VAL C CG1 1 ATOM 6706 C CG2 . VAL E 1 19 ? 47.948 -19.358 22.274 1.00 42.68 ? 19 VAL C CG2 1 ATOM 6707 N N . THR E 1 20 ? 51.918 -21.555 21.251 1.00 43.81 ? 20 THR C N 1 ATOM 6708 C CA . THR E 1 20 ? 52.888 -22.176 20.349 1.00 42.81 ? 20 THR C CA 1 ATOM 6709 C C . THR E 1 20 ? 52.369 -23.506 19.796 1.00 40.60 ? 20 THR C C 1 ATOM 6710 O O . THR E 1 20 ? 51.905 -24.364 20.546 1.00 44.49 ? 20 THR C O 1 ATOM 6711 C CB . THR E 1 20 ? 54.248 -22.415 21.046 1.00 46.08 ? 20 THR C CB 1 ATOM 6712 O OG1 . THR E 1 20 ? 54.032 -23.038 22.318 1.00 57.69 ? 20 THR C OG1 1 ATOM 6713 C CG2 . THR E 1 20 ? 54.977 -21.107 21.258 1.00 45.86 ? 20 THR C CG2 1 ATOM 6714 N N . ILE E 1 21 ? 52.449 -23.656 18.477 1.00 38.24 ? 21 ILE C N 1 ATOM 6715 C CA . ILE E 1 21 ? 52.057 -24.879 17.779 1.00 36.16 ? 21 ILE C CA 1 ATOM 6716 C C . ILE E 1 21 ? 53.288 -25.488 17.121 1.00 39.00 ? 21 ILE C C 1 ATOM 6717 O O . ILE E 1 21 ? 54.140 -24.760 16.611 1.00 42.02 ? 21 ILE C O 1 ATOM 6718 C CB . ILE E 1 21 ? 50.989 -24.605 16.698 1.00 35.06 ? 21 ILE C CB 1 ATOM 6719 C CG1 . ILE E 1 21 ? 49.766 -23.917 17.300 1.00 38.23 ? 21 ILE C CG1 1 ATOM 6720 C CG2 . ILE E 1 21 ? 50.572 -25.894 15.992 1.00 36.55 ? 21 ILE C CG2 1 ATOM 6721 C CD1 . ILE E 1 21 ? 48.740 -23.496 16.253 1.00 36.86 ? 21 ILE C CD1 1 ATOM 6722 N N . THR E 1 22 ? 53.396 -26.811 17.125 1.00 36.69 ? 22 THR C N 1 ATOM 6723 C CA . THR E 1 22 ? 54.562 -27.438 16.515 1.00 41.10 ? 22 THR C CA 1 ATOM 6724 C C . THR E 1 22 ? 54.188 -28.352 15.360 1.00 38.56 ? 22 THR C C 1 ATOM 6725 O O . THR E 1 22 ? 53.093 -28.910 15.300 1.00 38.97 ? 22 THR C O 1 ATOM 6726 C CB . THR E 1 22 ? 55.390 -28.251 17.540 1.00 46.78 ? 22 THR C CB 1 ATOM 6727 O OG1 . THR E 1 22 ? 54.831 -29.562 17.692 1.00 53.45 ? 22 THR C OG1 1 ATOM 6728 C CG2 . THR E 1 22 ? 55.427 -27.546 18.886 1.00 46.07 ? 22 THR C CG2 1 ATOM 6729 N N . CYS E 1 23 ? 55.127 -28.495 14.440 1.00 39.95 ? 23 CYS C N 1 ATOM 6730 C CA . CYS E 1 23 ? 54.952 -29.328 13.272 1.00 36.06 ? 23 CYS C CA 1 ATOM 6731 C C . CYS E 1 23 ? 56.193 -30.190 13.131 1.00 37.77 ? 23 CYS C C 1 ATOM 6732 O O . CYS E 1 23 ? 57.308 -29.671 13.094 1.00 41.70 ? 23 CYS C O 1 ATOM 6733 C CB . CYS E 1 23 ? 54.734 -28.463 12.028 1.00 35.80 ? 23 CYS C CB 1 ATOM 6734 S SG . CYS E 1 23 ? 54.359 -29.364 10.514 1.00 50.88 ? 23 CYS C SG 1 ATOM 6735 N N . ARG E 1 24 ? 56.006 -31.503 13.079 1.00 34.18 ? 24 ARG C N 1 ATOM 6736 C CA . ARG E 1 24 ? 57.130 -32.412 12.921 1.00 29.87 ? 24 ARG C CA 1 ATOM 6737 C C . ARG E 1 24 ? 57.070 -33.101 11.566 1.00 32.15 ? 24 ARG C C 1 ATOM 6738 O O . ARG E 1 24 ? 56.012 -33.554 11.137 1.00 41.47 ? 24 ARG C O 1 ATOM 6739 C CB . ARG E 1 24 ? 57.160 -33.453 14.042 1.00 35.48 ? 24 ARG C CB 1 ATOM 6740 C CG . ARG E 1 24 ? 58.427 -34.299 14.042 1.00 59.41 ? 24 ARG C CG 1 ATOM 6741 C CD . ARG E 1 24 ? 58.296 -35.532 14.924 1.00 79.17 ? 24 ARG C CD 1 ATOM 6742 N NE . ARG E 1 24 ? 59.065 -35.424 16.162 1.00 92.65 ? 24 ARG C NE 1 ATOM 6743 C CZ . ARG E 1 24 ? 59.302 -36.444 16.983 1.00 100.65 ? 24 ARG C CZ 1 ATOM 6744 N NH1 . ARG E 1 24 ? 58.835 -37.654 16.696 1.00 100.04 ? 24 ARG C NH1 1 ATOM 6745 N NH2 . ARG E 1 24 ? 60.010 -36.258 18.089 1.00 101.48 ? 24 ARG C NH2 1 ATOM 6746 N N . ALA E 1 25 ? 58.212 -33.161 10.891 1.00 30.99 ? 25 ALA C N 1 ATOM 6747 C CA . ALA E 1 25 ? 58.325 -33.866 9.621 1.00 31.77 ? 25 ALA C CA 1 ATOM 6748 C C . ALA E 1 25 ? 59.080 -35.183 9.817 1.00 37.12 ? 25 ALA C C 1 ATOM 6749 O O . ALA E 1 25 ? 60.104 -35.222 10.501 1.00 36.97 ? 25 ALA C O 1 ATOM 6750 C CB . ALA E 1 25 ? 59.021 -32.997 8.597 1.00 26.08 ? 25 ALA C CB 1 ATOM 6751 N N . SER E 1 26 ? 58.571 -36.256 9.217 1.00 32.38 ? 26 SER C N 1 ATOM 6752 C CA . SER E 1 26 ? 59.157 -37.584 9.382 1.00 36.05 ? 26 SER C CA 1 ATOM 6753 C C . SER E 1 26 ? 60.584 -37.670 8.833 1.00 38.78 ? 26 SER C C 1 ATOM 6754 O O . SER E 1 26 ? 61.344 -38.564 9.206 1.00 41.14 ? 26 SER C O 1 ATOM 6755 C CB . SER E 1 26 ? 58.273 -38.640 8.713 1.00 36.49 ? 26 SER C CB 1 ATOM 6756 O OG . SER E 1 26 ? 58.022 -38.320 7.359 1.00 37.60 ? 26 SER C OG 1 ATOM 6757 N N . GLN E 1 27 ? 60.931 -36.747 7.938 1.00 38.63 ? 27 GLN C N 1 ATOM 6758 C CA . GLN E 1 27 ? 62.304 -36.579 7.461 1.00 34.88 ? 27 GLN C CA 1 ATOM 6759 C C . GLN E 1 27 ? 62.618 -35.094 7.384 1.00 35.23 ? 27 GLN C C 1 ATOM 6760 O O . GLN E 1 27 ? 61.717 -34.263 7.479 1.00 41.35 ? 27 GLN C O 1 ATOM 6761 C CB . GLN E 1 27 ? 62.512 -37.217 6.088 1.00 41.45 ? 27 GLN C CB 1 ATOM 6762 C CG . GLN E 1 27 ? 62.145 -38.682 5.994 1.00 62.10 ? 27 GLN C CG 1 ATOM 6763 C CD . GLN E 1 27 ? 62.350 -39.224 4.596 1.00 80.29 ? 27 GLN C CD 1 ATOM 6764 O OE1 . GLN E 1 27 ? 63.090 -38.644 3.800 1.00 85.69 ? 27 GLN C OE1 1 ATOM 6765 N NE2 . GLN E 1 27 ? 61.688 -40.334 4.284 1.00 85.70 ? 27 GLN C NE2 1 ATOM 6766 N N . GLY E 1 28 ? 63.889 -34.758 7.190 1.00 32.82 ? 28 GLY C N 1 ATOM 6767 C CA . GLY E 1 28 ? 64.291 -33.367 7.079 1.00 33.66 ? 28 GLY C CA 1 ATOM 6768 C C . GLY E 1 28 ? 63.773 -32.697 5.818 1.00 34.21 ? 28 GLY C C 1 ATOM 6769 O O . GLY E 1 28 ? 63.845 -33.266 4.729 1.00 38.25 ? 28 GLY C O 1 ATOM 6770 N N . ILE E 1 29 ? 63.241 -31.486 5.968 1.00 31.36 ? 29 ILE C N 1 ATOM 6771 C CA . ILE E 1 29 ? 62.752 -30.714 4.828 1.00 30.94 ? 29 ILE C CA 1 ATOM 6772 C C . ILE E 1 29 ? 63.331 -29.298 4.836 1.00 35.74 ? 29 ILE C C 1 ATOM 6773 O O . ILE E 1 29 ? 62.778 -28.390 4.214 1.00 32.43 ? 29 ILE C O 1 ATOM 6774 C CB . ILE E 1 29 ? 61.208 -30.628 4.810 1.00 30.01 ? 29 ILE C CB 1 ATOM 6775 C CG1 . ILE E 1 29 ? 60.687 -29.947 6.074 1.00 34.55 ? 29 ILE C CG1 1 ATOM 6776 C CG2 . ILE E 1 29 ? 60.587 -32.011 4.665 1.00 26.83 ? 29 ILE C CG2 1 ATOM 6777 C CD1 . ILE E 1 29 ? 59.196 -29.690 6.043 1.00 36.17 ? 29 ILE C CD1 1 ATOM 6778 N N . SER E 1 30 ? 64.454 -29.134 5.535 1.00 36.49 ? 30 SER C N 1 ATOM 6779 C CA . SER E 1 30 ? 65.136 -27.846 5.708 1.00 37.75 ? 30 SER C CA 1 ATOM 6780 C C . SER E 1 30 ? 64.166 -26.707 6.036 1.00 37.91 ? 30 SER C C 1 ATOM 6781 O O . SER E 1 30 ? 63.602 -26.677 7.130 1.00 42.56 ? 30 SER C O 1 ATOM 6782 C CB . SER E 1 30 ? 65.970 -27.502 4.467 1.00 40.72 ? 30 SER C CB 1 ATOM 6783 O OG . SER E 1 30 ? 65.194 -27.536 3.287 1.00 53.66 ? 30 SER C OG 1 ATOM 6784 N N . SER E 1 31 ? 63.970 -25.775 5.105 1.00 30.87 ? 31 SER C N 1 ATOM 6785 C CA . SER E 1 31 ? 63.066 -24.654 5.357 1.00 31.18 ? 31 SER C CA 1 ATOM 6786 C C . SER E 1 31 ? 61.895 -24.608 4.382 1.00 35.93 ? 31 SER C C 1 ATOM 6787 O O . SER E 1 31 ? 61.218 -23.587 4.271 1.00 36.28 ? 31 SER C O 1 ATOM 6788 C CB . SER E 1 31 ? 63.824 -23.325 5.305 1.00 32.54 ? 31 SER C CB 1 ATOM 6789 O OG . SER E 1 31 ? 64.689 -23.195 6.418 1.00 43.34 ? 31 SER C OG 1 ATOM 6790 N N . TYR E 1 32 ? 61.649 -25.712 3.684 1.00 30.58 ? 32 TYR C N 1 ATOM 6791 C CA . TYR E 1 32 ? 60.534 -25.772 2.746 1.00 27.47 ? 32 TYR C CA 1 ATOM 6792 C C . TYR E 1 32 ? 59.219 -25.972 3.482 1.00 29.10 ? 32 TYR C C 1 ATOM 6793 O O . TYR E 1 32 ? 58.562 -27.002 3.339 1.00 27.13 ? 32 TYR C O 1 ATOM 6794 C CB . TYR E 1 32 ? 60.751 -26.887 1.726 1.00 24.46 ? 32 TYR C CB 1 ATOM 6795 C CG . TYR E 1 32 ? 61.846 -26.564 0.744 1.00 29.24 ? 32 TYR C CG 1 ATOM 6796 C CD1 . TYR E 1 32 ? 63.177 -26.829 1.045 1.00 31.53 ? 32 TYR C CD1 1 ATOM 6797 C CD2 . TYR E 1 32 ? 61.555 -25.977 -0.478 1.00 28.50 ? 32 TYR C CD2 1 ATOM 6798 C CE1 . TYR E 1 32 ? 64.186 -26.523 0.151 1.00 32.38 ? 32 TYR C CE1 1 ATOM 6799 C CE2 . TYR E 1 32 ? 62.556 -25.668 -1.379 1.00 35.51 ? 32 TYR C CE2 1 ATOM 6800 C CZ . TYR E 1 32 ? 63.870 -25.944 -1.059 1.00 39.00 ? 32 TYR C CZ 1 ATOM 6801 O OH . TYR E 1 32 ? 64.868 -25.637 -1.953 1.00 47.28 ? 32 TYR C OH 1 ATOM 6802 N N . LEU E 1 33 ? 58.837 -24.971 4.267 1.00 28.98 ? 33 LEU C N 1 ATOM 6803 C CA . LEU E 1 33 ? 57.646 -25.068 5.092 1.00 26.11 ? 33 LEU C CA 1 ATOM 6804 C C . LEU E 1 33 ? 56.871 -23.757 5.154 1.00 26.58 ? 33 LEU C C 1 ATOM 6805 O O . LEU E 1 33 ? 57.462 -22.678 5.231 1.00 26.60 ? 33 LEU C O 1 ATOM 6806 C CB . LEU E 1 33 ? 58.017 -25.500 6.510 1.00 29.05 ? 33 LEU C CB 1 ATOM 6807 C CG . LEU E 1 33 ? 56.785 -25.813 7.360 1.00 38.55 ? 33 LEU C CG 1 ATOM 6808 C CD1 . LEU E 1 33 ? 56.460 -27.296 7.318 1.00 32.02 ? 33 LEU C CD1 1 ATOM 6809 C CD2 . LEU E 1 33 ? 56.947 -25.317 8.781 1.00 41.29 ? 33 LEU C CD2 1 ATOM 6810 N N . ALA E 1 34 ? 55.546 -23.864 5.125 1.00 20.60 ? 34 ALA C N 1 ATOM 6811 C CA . ALA E 1 34 ? 54.665 -22.722 5.329 1.00 21.93 ? 34 ALA C CA 1 ATOM 6812 C C . ALA E 1 34 ? 53.566 -23.049 6.343 1.00 21.77 ? 34 ALA C C 1 ATOM 6813 O O . ALA E 1 34 ? 53.249 -24.214 6.577 1.00 22.33 ? 34 ALA C O 1 ATOM 6814 C CB . ALA E 1 34 ? 54.046 -22.275 3.999 1.00 25.43 ? 34 ALA C CB 1 ATOM 6815 N N . TRP E 1 35 ? 52.994 -22.008 6.941 1.00 18.30 ? 35 TRP C N 1 ATOM 6816 C CA . TRP E 1 35 ? 51.852 -22.147 7.836 1.00 22.11 ? 35 TRP C CA 1 ATOM 6817 C C . TRP E 1 35 ? 50.623 -21.464 7.244 1.00 26.56 ? 35 TRP C C 1 ATOM 6818 O O . TRP E 1 35 ? 50.730 -20.401 6.632 1.00 28.02 ? 35 TRP C O 1 ATOM 6819 C CB . TRP E 1 35 ? 52.167 -21.555 9.208 1.00 26.29 ? 35 TRP C CB 1 ATOM 6820 C CG . TRP E 1 35 ? 53.148 -22.355 9.989 1.00 30.23 ? 35 TRP C CG 1 ATOM 6821 C CD1 . TRP E 1 35 ? 54.511 -22.247 9.955 1.00 32.10 ? 35 TRP C CD1 1 ATOM 6822 C CD2 . TRP E 1 35 ? 52.850 -23.399 10.927 1.00 28.78 ? 35 TRP C CD2 1 ATOM 6823 N NE1 . TRP E 1 35 ? 55.077 -23.160 10.815 1.00 29.01 ? 35 TRP C NE1 1 ATOM 6824 C CE2 . TRP E 1 35 ? 54.080 -23.877 11.424 1.00 31.87 ? 35 TRP C CE2 1 ATOM 6825 C CE3 . TRP E 1 35 ? 51.663 -23.971 11.395 1.00 23.48 ? 35 TRP C CE3 1 ATOM 6826 C CZ2 . TRP E 1 35 ? 54.156 -24.901 12.367 1.00 31.51 ? 35 TRP C CZ2 1 ATOM 6827 C CZ3 . TRP E 1 35 ? 51.743 -24.990 12.332 1.00 31.11 ? 35 TRP C CZ3 1 ATOM 6828 C CH2 . TRP E 1 35 ? 52.981 -25.443 12.808 1.00 31.03 ? 35 TRP C CH2 1 ATOM 6829 N N . TYR E 1 36 ? 49.457 -22.078 7.422 1.00 22.14 ? 36 TYR C N 1 ATOM 6830 C CA . TYR E 1 36 ? 48.207 -21.491 6.954 1.00 22.97 ? 36 TYR C CA 1 ATOM 6831 C C . TYR E 1 36 ? 47.182 -21.430 8.072 1.00 29.14 ? 36 TYR C C 1 ATOM 6832 O O . TYR E 1 36 ? 47.213 -22.229 9.007 1.00 31.12 ? 36 TYR C O 1 ATOM 6833 C CB . TYR E 1 36 ? 47.639 -22.277 5.769 1.00 22.84 ? 36 TYR C CB 1 ATOM 6834 C CG . TYR E 1 36 ? 48.594 -22.371 4.604 1.00 27.12 ? 36 TYR C CG 1 ATOM 6835 C CD1 . TYR E 1 36 ? 49.581 -23.352 4.569 1.00 22.34 ? 36 TYR C CD1 1 ATOM 6836 C CD2 . TYR E 1 36 ? 48.522 -21.470 3.545 1.00 24.41 ? 36 TYR C CD2 1 ATOM 6837 C CE1 . TYR E 1 36 ? 50.464 -23.438 3.514 1.00 23.73 ? 36 TYR C CE1 1 ATOM 6838 C CE2 . TYR E 1 36 ? 49.403 -21.549 2.481 1.00 23.38 ? 36 TYR C CE2 1 ATOM 6839 C CZ . TYR E 1 36 ? 50.372 -22.536 2.470 1.00 27.89 ? 36 TYR C CZ 1 ATOM 6840 O OH . TYR E 1 36 ? 51.257 -22.628 1.416 1.00 26.54 ? 36 TYR C OH 1 ATOM 6841 N N . GLN E 1 37 ? 46.281 -20.463 7.966 1.00 29.34 ? 37 GLN C N 1 ATOM 6842 C CA . GLN E 1 37 ? 45.170 -20.314 8.891 1.00 28.30 ? 37 GLN C CA 1 ATOM 6843 C C . GLN E 1 37 ? 43.867 -20.567 8.142 1.00 33.05 ? 37 GLN C C 1 ATOM 6844 O O . GLN E 1 37 ? 43.633 -19.973 7.088 1.00 34.86 ? 37 GLN C O 1 ATOM 6845 C CB . GLN E 1 37 ? 45.175 -18.912 9.508 1.00 27.18 ? 37 GLN C CB 1 ATOM 6846 C CG . GLN E 1 37 ? 43.995 -18.614 10.411 1.00 28.50 ? 37 GLN C CG 1 ATOM 6847 C CD . GLN E 1 37 ? 43.816 -17.127 10.648 1.00 35.37 ? 37 GLN C CD 1 ATOM 6848 O OE1 . GLN E 1 37 ? 43.351 -16.400 9.767 1.00 32.49 ? 37 GLN C OE1 1 ATOM 6849 N NE2 . GLN E 1 37 ? 44.195 -16.664 11.834 1.00 31.69 ? 37 GLN C NE2 1 ATOM 6850 N N . GLN E 1 38 ? 43.023 -21.454 8.661 1.00 29.76 ? 38 GLN C N 1 ATOM 6851 C CA . GLN E 1 38 ? 41.763 -21.744 7.975 1.00 26.96 ? 38 GLN C CA 1 ATOM 6852 C C . GLN E 1 38 ? 40.545 -21.572 8.872 1.00 24.77 ? 38 GLN C C 1 ATOM 6853 O O . GLN E 1 38 ? 40.342 -22.322 9.828 1.00 29.97 ? 38 GLN C O 1 ATOM 6854 C CB . GLN E 1 38 ? 41.767 -23.163 7.389 1.00 20.64 ? 38 GLN C CB 1 ATOM 6855 C CG . GLN E 1 38 ? 40.613 -23.396 6.416 1.00 24.29 ? 38 GLN C CG 1 ATOM 6856 C CD . GLN E 1 38 ? 40.583 -24.802 5.844 1.00 28.97 ? 38 GLN C CD 1 ATOM 6857 O OE1 . GLN E 1 38 ? 40.924 -25.769 6.523 1.00 29.09 ? 38 GLN C OE1 1 ATOM 6858 N NE2 . GLN E 1 38 ? 40.168 -24.921 4.586 1.00 23.44 ? 38 GLN C NE2 1 ATOM 6859 N N . LYS E 1 39 ? 39.736 -20.570 8.551 1.00 34.88 ? 39 LYS C N 1 ATOM 6860 C CA . LYS E 1 39 ? 38.445 -20.387 9.194 1.00 37.09 ? 39 LYS C CA 1 ATOM 6861 C C . LYS E 1 39 ? 37.470 -21.423 8.651 1.00 36.70 ? 39 LYS C C 1 ATOM 6862 O O . LYS E 1 39 ? 37.608 -21.855 7.507 1.00 40.01 ? 39 LYS C O 1 ATOM 6863 C CB . LYS E 1 39 ? 37.924 -18.973 8.949 1.00 33.97 ? 39 LYS C CB 1 ATOM 6864 C CG . LYS E 1 39 ? 38.807 -17.887 9.516 1.00 36.23 ? 39 LYS C CG 1 ATOM 6865 C CD . LYS E 1 39 ? 38.721 -17.855 11.026 1.00 42.48 ? 39 LYS C CD 1 ATOM 6866 C CE . LYS E 1 39 ? 39.372 -16.601 11.590 1.00 44.04 ? 39 LYS C CE 1 ATOM 6867 N NZ . LYS E 1 39 ? 39.156 -16.511 13.064 1.00 43.70 ? 39 LYS C NZ 1 ATOM 6868 N N . PRO E 1 40 ? 36.490 -21.840 9.470 1.00 38.70 ? 40 PRO C N 1 ATOM 6869 C CA . PRO E 1 40 ? 35.501 -22.822 9.006 1.00 39.21 ? 40 PRO C CA 1 ATOM 6870 C C . PRO E 1 40 ? 34.783 -22.372 7.732 1.00 37.52 ? 40 PRO C C 1 ATOM 6871 O O . PRO E 1 40 ? 34.321 -21.231 7.654 1.00 36.95 ? 40 PRO C O 1 ATOM 6872 C CB . PRO E 1 40 ? 34.524 -22.917 10.183 1.00 38.92 ? 40 PRO C CB 1 ATOM 6873 C CG . PRO E 1 40 ? 35.348 -22.564 11.374 1.00 38.73 ? 40 PRO C CG 1 ATOM 6874 C CD . PRO E 1 40 ? 36.317 -21.514 10.897 1.00 38.23 ? 40 PRO C CD 1 ATOM 6875 N N . GLY E 1 41 ? 34.721 -23.258 6.741 1.00 34.94 ? 41 GLY C N 1 ATOM 6876 C CA . GLY E 1 41 ? 34.041 -22.972 5.490 1.00 35.66 ? 41 GLY C CA 1 ATOM 6877 C C . GLY E 1 41 ? 34.774 -22.016 4.562 1.00 43.55 ? 41 GLY C C 1 ATOM 6878 O O . GLY E 1 41 ? 34.244 -21.625 3.524 1.00 46.54 ? 41 GLY C O 1 ATOM 6879 N N . LYS E 1 42 ? 35.994 -21.637 4.926 1.00 40.20 ? 42 LYS C N 1 ATOM 6880 C CA . LYS E 1 42 ? 36.774 -20.711 4.110 1.00 35.94 ? 42 LYS C CA 1 ATOM 6881 C C . LYS E 1 42 ? 37.999 -21.400 3.519 1.00 32.00 ? 42 LYS C C 1 ATOM 6882 O O . LYS E 1 42 ? 38.311 -22.535 3.879 1.00 28.39 ? 42 LYS C O 1 ATOM 6883 C CB . LYS E 1 42 ? 37.204 -19.501 4.943 1.00 36.06 ? 42 LYS C CB 1 ATOM 6884 C CG . LYS E 1 42 ? 36.059 -18.808 5.665 1.00 39.85 ? 42 LYS C CG 1 ATOM 6885 C CD . LYS E 1 42 ? 35.121 -18.134 4.679 1.00 45.33 ? 42 LYS C CD 1 ATOM 6886 C CE . LYS E 1 42 ? 33.937 -17.497 5.383 1.00 53.68 ? 42 LYS C CE 1 ATOM 6887 N NZ . LYS E 1 42 ? 33.052 -16.787 4.420 1.00 59.96 ? 42 LYS C NZ 1 ATOM 6888 N N . ALA E 1 43 ? 38.695 -20.712 2.618 1.00 32.78 ? 43 ALA C N 1 ATOM 6889 C CA . ALA E 1 43 ? 39.972 -21.205 2.112 1.00 29.02 ? 43 ALA C CA 1 ATOM 6890 C C . ALA E 1 43 ? 41.067 -20.908 3.126 1.00 26.55 ? 43 ALA C C 1 ATOM 6891 O O . ALA E 1 43 ? 40.947 -19.970 3.910 1.00 25.26 ? 43 ALA C O 1 ATOM 6892 C CB . ALA E 1 43 ? 40.298 -20.573 0.776 1.00 23.72 ? 43 ALA C CB 1 ATOM 6893 N N . PRO E 1 44 ? 42.138 -21.712 3.129 1.00 29.52 ? 44 PRO C N 1 ATOM 6894 C CA . PRO E 1 44 ? 43.260 -21.386 4.014 1.00 30.34 ? 44 PRO C CA 1 ATOM 6895 C C . PRO E 1 44 ? 43.898 -20.057 3.633 1.00 30.48 ? 44 PRO C C 1 ATOM 6896 O O . PRO E 1 44 ? 43.843 -19.659 2.466 1.00 29.29 ? 44 PRO C O 1 ATOM 6897 C CB . PRO E 1 44 ? 44.234 -22.545 3.789 1.00 29.71 ? 44 PRO C CB 1 ATOM 6898 C CG . PRO E 1 44 ? 43.391 -23.649 3.244 1.00 29.27 ? 44 PRO C CG 1 ATOM 6899 C CD . PRO E 1 44 ? 42.351 -22.980 2.414 1.00 23.14 ? 44 PRO C CD 1 ATOM 6900 N N . LYS E 1 45 ? 44.481 -19.369 4.608 1.00 31.77 ? 45 LYS C N 1 ATOM 6901 C CA . LYS E 1 45 ? 45.213 -18.138 4.327 1.00 26.77 ? 45 LYS C CA 1 ATOM 6902 C C . LYS E 1 45 ? 46.636 -18.263 4.817 1.00 22.35 ? 45 LYS C C 1 ATOM 6903 O O . LYS E 1 45 ? 46.878 -18.685 5.954 1.00 22.87 ? 45 LYS C O 1 ATOM 6904 C CB . LYS E 1 45 ? 44.548 -16.920 4.973 1.00 28.85 ? 45 LYS C CB 1 ATOM 6905 C CG . LYS E 1 45 ? 43.250 -16.497 4.305 1.00 53.99 ? 45 LYS C CG 1 ATOM 6906 C CD . LYS E 1 45 ? 42.884 -15.059 4.656 1.00 57.78 ? 45 LYS C CD 1 ATOM 6907 C CE . LYS E 1 45 ? 41.593 -14.633 3.970 1.00 57.97 ? 45 LYS C CE 1 ATOM 6908 N NZ . LYS E 1 45 ? 41.368 -13.160 4.064 1.00 62.39 ? 45 LYS C NZ 1 ATOM 6909 N N . LEU E 1 46 ? 47.573 -17.897 3.949 1.00 24.29 ? 46 LEU C N 1 ATOM 6910 C CA . LEU E 1 46 ? 48.988 -17.920 4.287 1.00 22.73 ? 46 LEU C CA 1 ATOM 6911 C C . LEU E 1 46 ? 49.287 -17.031 5.486 1.00 26.23 ? 46 LEU C C 1 ATOM 6912 O O . LEU E 1 46 ? 48.846 -15.883 5.548 1.00 22.07 ? 46 LEU C O 1 ATOM 6913 C CB . LEU E 1 46 ? 49.835 -17.484 3.091 1.00 24.07 ? 46 LEU C CB 1 ATOM 6914 C CG . LEU E 1 46 ? 51.341 -17.430 3.342 1.00 24.99 ? 46 LEU C CG 1 ATOM 6915 C CD1 . LEU E 1 46 ? 51.855 -18.790 3.811 1.00 16.41 ? 46 LEU C CD1 1 ATOM 6916 C CD2 . LEU E 1 46 ? 52.055 -16.984 2.080 1.00 29.79 ? 46 LEU C CD2 1 ATOM 6917 N N . VAL E 1 47 ? 50.032 -17.578 6.440 1.00 28.69 ? 47 VAL C N 1 ATOM 6918 C CA . VAL E 1 47 ? 50.464 -16.829 7.606 1.00 31.61 ? 47 VAL C CA 1 ATOM 6919 C C . VAL E 1 47 ? 51.972 -16.647 7.543 1.00 39.53 ? 47 VAL C C 1 ATOM 6920 O O . VAL E 1 47 ? 52.478 -15.534 7.413 1.00 49.63 ? 47 VAL C O 1 ATOM 6921 C CB . VAL E 1 47 ? 50.083 -17.545 8.911 1.00 39.13 ? 47 VAL C CB 1 ATOM 6922 C CG1 . VAL E 1 47 ? 50.574 -16.759 10.108 1.00 40.42 ? 47 VAL C CG1 1 ATOM 6923 C CG2 . VAL E 1 47 ? 48.585 -17.747 8.980 1.00 44.46 ? 47 VAL C CG2 1 ATOM 6924 N N . ILE E 1 48 ? 52.679 -17.767 7.614 1.00 47.61 ? 48 ILE C N 1 ATOM 6925 C CA . ILE E 1 48 ? 54.136 -17.780 7.610 1.00 47.88 ? 48 ILE C CA 1 ATOM 6926 C C . ILE E 1 48 ? 54.651 -18.742 6.542 1.00 42.34 ? 48 ILE C C 1 ATOM 6927 O O . ILE E 1 48 ? 54.031 -19.770 6.287 1.00 30.96 ? 48 ILE C O 1 ATOM 6928 C CB . ILE E 1 48 ? 54.694 -18.195 8.998 1.00 47.32 ? 48 ILE C CB 1 ATOM 6929 C CG1 . ILE E 1 48 ? 54.274 -17.184 10.060 1.00 50.05 ? 48 ILE C CG1 1 ATOM 6930 C CG2 . ILE E 1 48 ? 56.209 -18.338 8.975 1.00 47.83 ? 48 ILE C CG2 1 ATOM 6931 C CD1 . ILE E 1 48 ? 54.970 -17.361 11.367 1.00 51.14 ? 48 ILE C CD1 1 ATOM 6932 N N . TYR E 1 49 ? 55.771 -18.393 5.912 1.00 49.48 ? 49 TYR C N 1 ATOM 6933 C CA . TYR E 1 49 ? 56.473 -19.294 5.006 1.00 45.67 ? 49 TYR C CA 1 ATOM 6934 C C . TYR E 1 49 ? 57.962 -19.204 5.292 1.00 45.00 ? 49 TYR C C 1 ATOM 6935 O O . TYR E 1 49 ? 58.386 -18.378 6.098 1.00 36.70 ? 49 TYR C O 1 ATOM 6936 C CB . TYR E 1 49 ? 56.176 -18.954 3.551 1.00 41.33 ? 49 TYR C CB 1 ATOM 6937 C CG . TYR E 1 49 ? 56.501 -17.533 3.186 1.00 39.26 ? 49 TYR C CG 1 ATOM 6938 C CD1 . TYR E 1 49 ? 55.600 -16.507 3.445 1.00 37.67 ? 49 TYR C CD1 1 ATOM 6939 C CD2 . TYR E 1 49 ? 57.704 -17.213 2.578 1.00 36.37 ? 49 TYR C CD2 1 ATOM 6940 C CE1 . TYR E 1 49 ? 55.889 -15.204 3.112 1.00 38.88 ? 49 TYR C CE1 1 ATOM 6941 C CE2 . TYR E 1 49 ? 58.005 -15.910 2.240 1.00 43.72 ? 49 TYR C CE2 1 ATOM 6942 C CZ . TYR E 1 49 ? 57.092 -14.907 2.508 1.00 51.29 ? 49 TYR C CZ 1 ATOM 6943 O OH . TYR E 1 49 ? 57.385 -13.601 2.175 1.00 64.91 ? 49 TYR C OH 1 ATOM 6944 N N . ALA E 1 50 ? 58.747 -20.060 4.642 1.00 62.71 ? 50 ALA C N 1 ATOM 6945 C CA . ALA E 1 50 ? 60.166 -20.209 4.958 1.00 70.27 ? 50 ALA C CA 1 ATOM 6946 C C . ALA E 1 50 ? 60.338 -20.464 6.453 1.00 74.79 ? 50 ALA C C 1 ATOM 6947 O O . ALA E 1 50 ? 61.355 -20.090 7.045 1.00 78.91 ? 50 ALA C O 1 ATOM 6948 C CB . ALA E 1 50 ? 60.954 -18.978 4.527 1.00 70.67 ? 50 ALA C CB 1 ATOM 6949 N N . ALA E 1 51 ? 59.312 -21.080 7.043 1.00 67.30 ? 51 ALA C N 1 ATOM 6950 C CA . ALA E 1 51 ? 59.240 -21.420 8.462 1.00 59.13 ? 51 ALA C CA 1 ATOM 6951 C C . ALA E 1 51 ? 59.121 -20.213 9.412 1.00 59.50 ? 51 ALA C C 1 ATOM 6952 O O . ALA E 1 51 ? 58.528 -20.346 10.482 1.00 46.64 ? 51 ALA C O 1 ATOM 6953 C CB . ALA E 1 51 ? 60.439 -22.282 8.858 1.00 53.51 ? 51 ALA C CB 1 ATOM 6954 N N . SER E 1 52 ? 59.649 -19.045 9.033 1.00 70.98 ? 52 SER C N 1 ATOM 6955 C CA . SER E 1 52 ? 59.777 -17.932 9.991 1.00 72.78 ? 52 SER C CA 1 ATOM 6956 C C . SER E 1 52 ? 59.282 -16.540 9.550 1.00 75.79 ? 52 SER C C 1 ATOM 6957 O O . SER E 1 52 ? 59.053 -15.672 10.399 1.00 71.28 ? 52 SER C O 1 ATOM 6958 C CB . SER E 1 52 ? 61.244 -17.802 10.420 1.00 67.64 ? 52 SER C CB 1 ATOM 6959 O OG . SER E 1 52 ? 62.070 -17.434 9.330 1.00 67.66 ? 52 SER C OG 1 ATOM 6960 N N . THR E 1 53 ? 59.127 -16.311 8.248 1.00 81.35 ? 53 THR C N 1 ATOM 6961 C CA . THR E 1 53 ? 58.734 -14.982 7.767 1.00 81.98 ? 53 THR C CA 1 ATOM 6962 C C . THR E 1 53 ? 57.239 -14.888 7.436 1.00 77.40 ? 53 THR C C 1 ATOM 6963 O O . THR E 1 53 ? 56.697 -15.713 6.696 1.00 73.85 ? 53 THR C O 1 ATOM 6964 C CB . THR E 1 53 ? 59.573 -14.559 6.527 1.00 68.33 ? 53 THR C CB 1 ATOM 6965 O OG1 . THR E 1 53 ? 58.903 -13.515 5.807 1.00 60.17 ? 53 THR C OG1 1 ATOM 6966 C CG2 . THR E 1 53 ? 59.800 -15.730 5.601 1.00 72.01 ? 53 THR C CG2 1 ATOM 6967 N N . LEU E 1 54 ? 56.586 -13.869 7.995 1.00 75.32 ? 54 LEU C N 1 ATOM 6968 C CA . LEU E 1 54 ? 55.147 -13.657 7.826 1.00 66.08 ? 54 LEU C CA 1 ATOM 6969 C C . LEU E 1 54 ? 54.766 -13.394 6.373 1.00 53.91 ? 54 LEU C C 1 ATOM 6970 O O . LEU E 1 54 ? 53.591 -13.206 6.054 1.00 51.49 ? 54 LEU C O 1 ATOM 6971 C CB . LEU E 1 54 ? 54.672 -12.489 8.696 1.00 65.86 ? 54 LEU C CB 1 ATOM 6972 C CG . LEU E 1 54 ? 55.040 -12.512 10.182 1.00 66.14 ? 54 LEU C CG 1 ATOM 6973 C CD1 . LEU E 1 54 ? 54.470 -11.295 10.902 1.00 73.95 ? 54 LEU C CD1 1 ATOM 6974 C CD2 . LEU E 1 54 ? 54.575 -13.798 10.846 1.00 60.92 ? 54 LEU C CD2 1 ATOM 6975 N N . ARG E 1 61 ? 53.217 -10.217 16.047 1.00 54.61 ? 61 ARG C N 1 ATOM 6976 C CA . ARG E 1 61 ? 52.395 -10.990 16.973 1.00 59.64 ? 61 ARG C CA 1 ATOM 6977 C C . ARG E 1 61 ? 52.483 -12.480 16.655 1.00 64.04 ? 61 ARG C C 1 ATOM 6978 O O . ARG E 1 61 ? 52.510 -13.321 17.556 1.00 64.81 ? 61 ARG C O 1 ATOM 6979 C CB . ARG E 1 61 ? 50.944 -10.515 16.926 1.00 62.72 ? 61 ARG C CB 1 ATOM 6980 C CG . ARG E 1 61 ? 50.033 -11.202 17.925 1.00 70.39 ? 61 ARG C CG 1 ATOM 6981 C CD . ARG E 1 61 ? 48.789 -10.366 18.205 1.00 77.88 ? 61 ARG C CD 1 ATOM 6982 N NE . ARG E 1 61 ? 47.914 -10.242 17.041 1.00 81.76 ? 61 ARG C NE 1 ATOM 6983 C CZ . ARG E 1 61 ? 46.917 -11.076 16.760 1.00 80.65 ? 61 ARG C CZ 1 ATOM 6984 N NH1 . ARG E 1 61 ? 46.671 -12.106 17.557 1.00 77.18 ? 61 ARG C NH1 1 ATOM 6985 N NH2 . ARG E 1 61 ? 46.168 -10.882 15.680 1.00 79.08 ? 61 ARG C NH2 1 ATOM 6986 N N . PHE E 1 62 ? 52.519 -12.797 15.364 1.00 65.10 ? 62 PHE C N 1 ATOM 6987 C CA . PHE E 1 62 ? 52.817 -14.149 14.907 1.00 65.52 ? 62 PHE C CA 1 ATOM 6988 C C . PHE E 1 62 ? 54.319 -14.263 14.656 1.00 67.75 ? 62 PHE C C 1 ATOM 6989 O O . PHE E 1 62 ? 54.981 -13.262 14.377 1.00 69.16 ? 62 PHE C O 1 ATOM 6990 C CB . PHE E 1 62 ? 52.040 -14.491 13.631 1.00 62.97 ? 62 PHE C CB 1 ATOM 6991 C CG . PHE E 1 62 ? 50.559 -14.689 13.840 1.00 64.90 ? 62 PHE C CG 1 ATOM 6992 C CD1 . PHE E 1 62 ? 49.725 -13.611 14.096 1.00 70.50 ? 62 PHE C CD1 1 ATOM 6993 C CD2 . PHE E 1 62 ? 49.998 -15.954 13.744 1.00 63.34 ? 62 PHE C CD2 1 ATOM 6994 C CE1 . PHE E 1 62 ? 48.359 -13.794 14.274 1.00 70.38 ? 62 PHE C CE1 1 ATOM 6995 C CE2 . PHE E 1 62 ? 48.634 -16.144 13.921 1.00 64.93 ? 62 PHE C CE2 1 ATOM 6996 C CZ . PHE E 1 62 ? 47.814 -15.062 14.185 1.00 65.12 ? 62 PHE C CZ 1 ATOM 6997 N N . SER E 1 63 ? 54.854 -15.475 14.758 1.00 66.82 ? 63 SER C N 1 ATOM 6998 C CA . SER E 1 63 ? 56.267 -15.716 14.478 1.00 66.08 ? 63 SER C CA 1 ATOM 6999 C C . SER E 1 63 ? 56.524 -17.197 14.242 1.00 64.20 ? 63 SER C C 1 ATOM 7000 O O . SER E 1 63 ? 55.784 -18.052 14.728 1.00 56.79 ? 63 SER C O 1 ATOM 7001 C CB . SER E 1 63 ? 57.147 -15.207 15.624 1.00 64.89 ? 63 SER C CB 1 ATOM 7002 O OG . SER E 1 63 ? 56.806 -15.836 16.845 1.00 67.48 ? 63 SER C OG 1 ATOM 7003 N N . GLY E 1 64 ? 57.568 -17.497 13.478 1.00 73.20 ? 64 GLY C N 1 ATOM 7004 C CA . GLY E 1 64 ? 57.915 -18.874 13.184 1.00 75.77 ? 64 GLY C CA 1 ATOM 7005 C C . GLY E 1 64 ? 59.388 -19.175 13.384 1.00 72.19 ? 64 GLY C C 1 ATOM 7006 O O . GLY E 1 64 ? 60.219 -18.267 13.389 1.00 77.97 ? 64 GLY C O 1 ATOM 7007 N N . SER E 1 65 ? 59.708 -20.455 13.547 1.00 51.61 ? 65 SER C N 1 ATOM 7008 C CA . SER E 1 65 ? 61.086 -20.892 13.731 1.00 48.25 ? 65 SER C CA 1 ATOM 7009 C C . SER E 1 65 ? 61.203 -22.407 13.641 1.00 39.09 ? 65 SER C C 1 ATOM 7010 O O . SER E 1 65 ? 60.207 -23.130 13.711 1.00 37.27 ? 65 SER C O 1 ATOM 7011 C CB . SER E 1 65 ? 61.632 -20.414 15.078 1.00 48.13 ? 65 SER C CB 1 ATOM 7012 O OG . SER E 1 65 ? 60.855 -20.924 16.144 1.00 47.61 ? 65 SER C OG 1 ATOM 7013 N N . GLY E 1 66 ? 62.431 -22.881 13.493 1.00 47.87 ? 66 GLY C N 1 ATOM 7014 C CA . GLY E 1 66 ? 62.686 -24.303 13.411 1.00 49.89 ? 66 GLY C CA 1 ATOM 7015 C C . GLY E 1 66 ? 63.394 -24.672 12.127 1.00 50.43 ? 66 GLY C C 1 ATOM 7016 O O . GLY E 1 66 ? 63.531 -23.847 11.221 1.00 51.85 ? 66 GLY C O 1 ATOM 7017 N N . SER E 1 67 ? 63.844 -25.919 12.048 1.00 51.03 ? 67 SER C N 1 ATOM 7018 C CA . SER E 1 67 ? 64.614 -26.381 10.903 1.00 45.92 ? 67 SER C CA 1 ATOM 7019 C C . SER E 1 67 ? 64.588 -27.901 10.805 1.00 41.21 ? 67 SER C C 1 ATOM 7020 O O . SER E 1 67 ? 64.460 -28.597 11.814 1.00 45.07 ? 67 SER C O 1 ATOM 7021 C CB . SER E 1 67 ? 66.057 -25.884 11.002 1.00 49.11 ? 67 SER C CB 1 ATOM 7022 O OG . SER E 1 67 ? 66.746 -26.084 9.781 1.00 57.52 ? 67 SER C OG 1 ATOM 7023 N N . GLY E 1 68 ? 64.707 -28.411 9.583 1.00 37.25 ? 68 GLY C N 1 ATOM 7024 C CA . GLY E 1 68 ? 64.804 -29.841 9.361 1.00 22.91 ? 68 GLY C CA 1 ATOM 7025 C C . GLY E 1 68 ? 63.504 -30.579 9.598 1.00 30.26 ? 68 GLY C C 1 ATOM 7026 O O . GLY E 1 68 ? 62.686 -30.727 8.692 1.00 33.93 ? 68 GLY C O 1 ATOM 7027 N N . THR E 1 69 ? 63.307 -31.044 10.825 1.00 32.81 ? 69 THR C N 1 ATOM 7028 C CA . THR E 1 69 ? 62.144 -31.861 11.138 1.00 39.33 ? 69 THR C CA 1 ATOM 7029 C C . THR E 1 69 ? 61.203 -31.192 12.129 1.00 40.40 ? 69 THR C C 1 ATOM 7030 O O . THR E 1 69 ? 60.097 -31.673 12.355 1.00 39.37 ? 69 THR C O 1 ATOM 7031 C CB . THR E 1 69 ? 62.562 -33.230 11.716 1.00 43.77 ? 69 THR C CB 1 ATOM 7032 O OG1 . THR E 1 69 ? 63.234 -33.041 12.969 1.00 41.22 ? 69 THR C OG1 1 ATOM 7033 C CG2 . THR E 1 69 ? 63.484 -33.958 10.749 1.00 46.80 ? 69 THR C CG2 1 ATOM 7034 N N . GLU E 1 70 ? 61.638 -30.085 12.721 1.00 35.91 ? 70 GLU C N 1 ATOM 7035 C CA . GLU E 1 70 ? 60.870 -29.474 13.799 1.00 34.19 ? 70 GLU C CA 1 ATOM 7036 C C . GLU E 1 70 ? 60.608 -27.993 13.543 1.00 33.31 ? 70 GLU C C 1 ATOM 7037 O O . GLU E 1 70 ? 61.535 -27.222 13.310 1.00 35.65 ? 70 GLU C O 1 ATOM 7038 C CB . GLU E 1 70 ? 61.601 -29.670 15.135 1.00 28.47 ? 70 GLU C CB 1 ATOM 7039 C CG . GLU E 1 70 ? 60.887 -29.093 16.344 1.00 31.09 ? 70 GLU C CG 1 ATOM 7040 C CD . GLU E 1 70 ? 59.615 -29.844 16.698 1.00 50.30 ? 70 GLU C CD 1 ATOM 7041 O OE1 . GLU E 1 70 ? 59.361 -30.924 16.117 1.00 54.88 ? 70 GLU C OE1 1 ATOM 7042 O OE2 . GLU E 1 70 ? 58.863 -29.349 17.565 1.00 59.39 ? 70 GLU C OE2 1 ATOM 7043 N N . PHE E 1 71 ? 59.339 -27.605 13.587 1.00 30.00 ? 71 PHE C N 1 ATOM 7044 C CA . PHE E 1 71 ? 58.953 -26.229 13.301 1.00 33.57 ? 71 PHE C CA 1 ATOM 7045 C C . PHE E 1 71 ? 57.911 -25.723 14.279 1.00 37.48 ? 71 PHE C C 1 ATOM 7046 O O . PHE E 1 71 ? 57.081 -26.485 14.777 1.00 39.21 ? 71 PHE C O 1 ATOM 7047 C CB . PHE E 1 71 ? 58.419 -26.099 11.876 1.00 27.08 ? 71 PHE C CB 1 ATOM 7048 C CG . PHE E 1 71 ? 59.394 -26.535 10.829 1.00 30.09 ? 71 PHE C CG 1 ATOM 7049 C CD1 . PHE E 1 71 ? 60.291 -25.636 10.286 1.00 23.44 ? 71 PHE C CD1 1 ATOM 7050 C CD2 . PHE E 1 71 ? 59.419 -27.852 10.392 1.00 32.66 ? 71 PHE C CD2 1 ATOM 7051 C CE1 . PHE E 1 71 ? 61.198 -26.040 9.324 1.00 29.14 ? 71 PHE C CE1 1 ATOM 7052 C CE2 . PHE E 1 71 ? 60.323 -28.260 9.429 1.00 32.80 ? 71 PHE C CE2 1 ATOM 7053 C CZ . PHE E 1 71 ? 61.213 -27.354 8.896 1.00 27.76 ? 71 PHE C CZ 1 ATOM 7054 N N . THR E 1 72 ? 57.949 -24.423 14.532 1.00 32.43 ? 72 THR C N 1 ATOM 7055 C CA . THR E 1 72 ? 57.082 -23.819 15.523 1.00 33.25 ? 72 THR C CA 1 ATOM 7056 C C . THR E 1 72 ? 56.411 -22.572 14.971 1.00 34.70 ? 72 THR C C 1 ATOM 7057 O O . THR E 1 72 ? 57.065 -21.714 14.386 1.00 37.98 ? 72 THR C O 1 ATOM 7058 C CB . THR E 1 72 ? 57.871 -23.461 16.800 1.00 39.58 ? 72 THR C CB 1 ATOM 7059 O OG1 . THR E 1 72 ? 58.439 -24.654 17.355 1.00 48.26 ? 72 THR C OG1 1 ATOM 7060 C CG2 . THR E 1 72 ? 56.968 -22.814 17.835 1.00 39.75 ? 72 THR C CG2 1 ATOM 7061 N N . LEU E 1 73 ? 55.096 -22.501 15.139 1.00 34.18 ? 73 LEU C N 1 ATOM 7062 C CA . LEU E 1 73 ? 54.339 -21.283 14.888 1.00 28.72 ? 73 LEU C CA 1 ATOM 7063 C C . LEU E 1 73 ? 53.971 -20.697 16.244 1.00 34.14 ? 73 LEU C C 1 ATOM 7064 O O . LEU E 1 73 ? 53.440 -21.397 17.101 1.00 34.03 ? 73 LEU C O 1 ATOM 7065 C CB . LEU E 1 73 ? 53.091 -21.572 14.054 1.00 29.37 ? 73 LEU C CB 1 ATOM 7066 C CG . LEU E 1 73 ? 52.032 -20.474 13.898 1.00 32.73 ? 73 LEU C CG 1 ATOM 7067 C CD1 . LEU E 1 73 ? 52.499 -19.387 12.950 1.00 28.42 ? 73 LEU C CD1 1 ATOM 7068 C CD2 . LEU E 1 73 ? 50.715 -21.070 13.422 1.00 34.11 ? 73 LEU C CD2 1 ATOM 7069 N N . THR E 1 74 ? 54.270 -19.422 16.453 1.00 38.85 ? 74 THR C N 1 ATOM 7070 C CA . THR E 1 74 ? 53.991 -18.803 17.742 1.00 37.56 ? 74 THR C CA 1 ATOM 7071 C C . THR E 1 74 ? 53.079 -17.593 17.590 1.00 34.59 ? 74 THR C C 1 ATOM 7072 O O . THR E 1 74 ? 53.270 -16.772 16.694 1.00 37.75 ? 74 THR C O 1 ATOM 7073 C CB . THR E 1 74 ? 55.300 -18.382 18.456 1.00 41.28 ? 74 THR C CB 1 ATOM 7074 O OG1 . THR E 1 74 ? 56.107 -19.540 18.702 1.00 41.93 ? 74 THR C OG1 1 ATOM 7075 C CG2 . THR E 1 74 ? 55.001 -17.699 19.784 1.00 40.76 ? 74 THR C CG2 1 ATOM 7076 N N . ILE E 1 75 ? 52.068 -17.508 18.451 1.00 35.89 ? 75 ILE C N 1 ATOM 7077 C CA . ILE E 1 75 ? 51.246 -16.308 18.568 1.00 35.65 ? 75 ILE C CA 1 ATOM 7078 C C . ILE E 1 75 ? 51.571 -15.639 19.899 1.00 45.14 ? 75 ILE C C 1 ATOM 7079 O O . ILE E 1 75 ? 51.286 -16.192 20.962 1.00 49.69 ? 75 ILE C O 1 ATOM 7080 C CB . ILE E 1 75 ? 49.739 -16.623 18.491 1.00 38.13 ? 75 ILE C CB 1 ATOM 7081 C CG1 . ILE E 1 75 ? 49.430 -17.506 17.280 1.00 38.17 ? 75 ILE C CG1 1 ATOM 7082 C CG2 . ILE E 1 75 ? 48.931 -15.338 18.436 1.00 38.09 ? 75 ILE C CG2 1 ATOM 7083 C CD1 . ILE E 1 75 ? 47.955 -17.799 17.101 1.00 40.97 ? 75 ILE C CD1 1 ATOM 7084 N N . SER E 1 76 ? 52.185 -14.461 19.842 1.00 54.25 ? 76 SER C N 1 ATOM 7085 C CA . SER E 1 76 ? 52.675 -13.802 21.051 1.00 59.65 ? 76 SER C CA 1 ATOM 7086 C C . SER E 1 76 ? 51.536 -13.401 21.987 1.00 62.95 ? 76 SER C C 1 ATOM 7087 O O . SER E 1 76 ? 51.598 -13.651 23.190 1.00 67.32 ? 76 SER C O 1 ATOM 7088 C CB . SER E 1 76 ? 53.514 -12.572 20.691 1.00 61.32 ? 76 SER C CB 1 ATOM 7089 O OG . SER E 1 76 ? 52.717 -11.557 20.108 1.00 63.40 ? 76 SER C OG 1 ATOM 7090 N N . SER E 1 77 ? 50.495 -12.787 21.433 1.00 58.86 ? 77 SER C N 1 ATOM 7091 C CA . SER E 1 77 ? 49.368 -12.340 22.243 1.00 58.05 ? 77 SER C CA 1 ATOM 7092 C C . SER E 1 77 ? 48.044 -12.640 21.551 1.00 56.15 ? 77 SER C C 1 ATOM 7093 O O . SER E 1 77 ? 47.629 -11.926 20.640 1.00 55.77 ? 77 SER C O 1 ATOM 7094 C CB . SER E 1 77 ? 49.483 -10.846 22.545 1.00 54.87 ? 77 SER C CB 1 ATOM 7095 O OG . SER E 1 77 ? 48.592 -10.474 23.580 1.00 56.90 ? 77 SER C OG 1 ATOM 7096 N N . LEU E 1 78 ? 47.384 -13.699 22.003 1.00 54.11 ? 78 LEU C N 1 ATOM 7097 C CA . LEU E 1 78 ? 46.162 -14.188 21.373 1.00 47.95 ? 78 LEU C CA 1 ATOM 7098 C C . LEU E 1 78 ? 45.041 -13.146 21.353 1.00 44.16 ? 78 LEU C C 1 ATOM 7099 O O . LEU E 1 78 ? 44.783 -12.475 22.351 1.00 46.54 ? 78 LEU C O 1 ATOM 7100 C CB . LEU E 1 78 ? 45.686 -15.453 22.092 1.00 51.24 ? 78 LEU C CB 1 ATOM 7101 C CG . LEU E 1 78 ? 44.653 -16.342 21.401 1.00 48.69 ? 78 LEU C CG 1 ATOM 7102 C CD1 . LEU E 1 78 ? 45.186 -16.841 20.070 1.00 46.86 ? 78 LEU C CD1 1 ATOM 7103 C CD2 . LEU E 1 78 ? 44.286 -17.510 22.303 1.00 46.86 ? 78 LEU C CD2 1 ATOM 7104 N N . GLN E 1 79 ? 44.386 -13.017 20.202 1.00 41.74 ? 79 GLN C N 1 ATOM 7105 C CA . GLN E 1 79 ? 43.207 -12.167 20.055 1.00 41.78 ? 79 GLN C CA 1 ATOM 7106 C C . GLN E 1 79 ? 42.022 -13.034 19.624 1.00 42.89 ? 79 GLN C C 1 ATOM 7107 O O . GLN E 1 79 ? 42.224 -14.109 19.062 1.00 43.61 ? 79 GLN C O 1 ATOM 7108 C CB . GLN E 1 79 ? 43.467 -11.047 19.038 1.00 36.31 ? 79 GLN C CB 1 ATOM 7109 C CG . GLN E 1 79 ? 44.629 -10.131 19.394 1.00 42.97 ? 79 GLN C CG 1 ATOM 7110 C CD . GLN E 1 79 ? 44.491 -9.509 20.772 1.00 56.92 ? 79 GLN C CD 1 ATOM 7111 O OE1 . GLN E 1 79 ? 45.444 -9.494 21.556 1.00 67.78 ? 79 GLN C OE1 1 ATOM 7112 N NE2 . GLN E 1 79 ? 43.306 -8.987 21.074 1.00 52.19 ? 79 GLN C NE2 1 ATOM 7113 N N . PRO E 1 80 ? 40.784 -12.579 19.893 1.00 42.22 ? 80 PRO C N 1 ATOM 7114 C CA . PRO E 1 80 ? 39.600 -13.394 19.583 1.00 44.38 ? 80 PRO C CA 1 ATOM 7115 C C . PRO E 1 80 ? 39.485 -13.780 18.110 1.00 44.09 ? 80 PRO C C 1 ATOM 7116 O O . PRO E 1 80 ? 38.867 -14.797 17.793 1.00 43.05 ? 80 PRO C O 1 ATOM 7117 C CB . PRO E 1 80 ? 38.434 -12.485 19.986 1.00 49.97 ? 80 PRO C CB 1 ATOM 7118 C CG . PRO E 1 80 ? 39.002 -11.575 21.012 1.00 48.06 ? 80 PRO C CG 1 ATOM 7119 C CD . PRO E 1 80 ? 40.421 -11.331 20.589 1.00 44.87 ? 80 PRO C CD 1 ATOM 7120 N N . GLU E 1 81 ? 40.078 -12.982 17.228 1.00 44.49 ? 81 GLU C N 1 ATOM 7121 C CA . GLU E 1 81 ? 39.990 -13.229 15.793 1.00 51.74 ? 81 GLU C CA 1 ATOM 7122 C C . GLU E 1 81 ? 40.924 -14.348 15.342 1.00 52.72 ? 81 GLU C C 1 ATOM 7123 O O . GLU E 1 81 ? 40.928 -14.719 14.169 1.00 55.33 ? 81 GLU C O 1 ATOM 7124 C CB . GLU E 1 81 ? 40.307 -11.953 15.005 1.00 61.10 ? 81 GLU C CB 1 ATOM 7125 C CG . GLU E 1 81 ? 39.480 -10.739 15.403 1.00 74.02 ? 81 GLU C CG 1 ATOM 7126 C CD . GLU E 1 81 ? 40.046 -10.017 16.611 1.00 81.47 ? 81 GLU C CD 1 ATOM 7127 O OE1 . GLU E 1 81 ? 41.245 -10.208 16.909 1.00 78.14 ? 81 GLU C OE1 1 ATOM 7128 O OE2 . GLU E 1 81 ? 39.292 -9.262 17.262 1.00 86.85 ? 81 GLU C OE2 1 ATOM 7129 N N . ASP E 1 82 ? 41.712 -14.885 16.268 1.00 46.90 ? 82 ASP C N 1 ATOM 7130 C CA . ASP E 1 82 ? 42.731 -15.869 15.915 1.00 41.65 ? 82 ASP C CA 1 ATOM 7131 C C . ASP E 1 82 ? 42.214 -17.298 15.882 1.00 39.57 ? 82 ASP C C 1 ATOM 7132 O O . ASP E 1 82 ? 42.935 -18.201 15.452 1.00 38.65 ? 82 ASP C O 1 ATOM 7133 C CB . ASP E 1 82 ? 43.909 -15.795 16.887 1.00 43.40 ? 82 ASP C CB 1 ATOM 7134 C CG . ASP E 1 82 ? 44.662 -14.490 16.790 1.00 47.98 ? 82 ASP C CG 1 ATOM 7135 O OD1 . ASP E 1 82 ? 44.496 -13.776 15.778 1.00 47.51 ? 82 ASP C OD1 1 ATOM 7136 O OD2 . ASP E 1 82 ? 45.427 -14.183 17.727 1.00 51.11 ? 82 ASP C OD2 1 ATOM 7137 N N . PHE E 1 83 ? 40.982 -17.510 16.341 1.00 33.83 ? 83 PHE C N 1 ATOM 7138 C CA . PHE E 1 83 ? 40.430 -18.858 16.370 1.00 35.33 ? 83 PHE C CA 1 ATOM 7139 C C . PHE E 1 83 ? 40.357 -19.402 14.945 1.00 32.87 ? 83 PHE C C 1 ATOM 7140 O O . PHE E 1 83 ? 39.893 -18.716 14.031 1.00 35.49 ? 83 PHE C O 1 ATOM 7141 C CB . PHE E 1 83 ? 39.050 -18.883 17.046 1.00 43.08 ? 83 PHE C CB 1 ATOM 7142 C CG . PHE E 1 83 ? 37.903 -18.624 16.111 1.00 46.08 ? 83 PHE C CG 1 ATOM 7143 C CD1 . PHE E 1 83 ? 37.521 -17.327 15.801 1.00 56.11 ? 83 PHE C CD1 1 ATOM 7144 C CD2 . PHE E 1 83 ? 37.204 -19.679 15.542 1.00 49.75 ? 83 PHE C CD2 1 ATOM 7145 C CE1 . PHE E 1 83 ? 36.464 -17.087 14.936 1.00 62.59 ? 83 PHE C CE1 1 ATOM 7146 C CE2 . PHE E 1 83 ? 36.150 -19.448 14.676 1.00 53.51 ? 83 PHE C CE2 1 ATOM 7147 C CZ . PHE E 1 83 ? 35.778 -18.151 14.373 1.00 58.31 ? 83 PHE C CZ 1 ATOM 7148 N N . ALA E 1 84 ? 40.846 -20.626 14.772 1.00 30.26 ? 84 ALA C N 1 ATOM 7149 C CA . ALA E 1 84 ? 40.885 -21.294 13.473 1.00 30.85 ? 84 ALA C CA 1 ATOM 7150 C C . ALA E 1 84 ? 41.567 -22.641 13.603 1.00 26.51 ? 84 ALA C C 1 ATOM 7151 O O . ALA E 1 84 ? 41.987 -23.032 14.687 1.00 32.88 ? 84 ALA C O 1 ATOM 7152 C CB . ALA E 1 84 ? 41.621 -20.449 12.437 1.00 25.09 ? 84 ALA C CB 1 ATOM 7153 N N . THR E 1 85 ? 41.680 -23.340 12.482 1.00 29.38 ? 85 THR C N 1 ATOM 7154 C CA . THR E 1 85 ? 42.573 -24.483 12.385 1.00 30.06 ? 85 THR C CA 1 ATOM 7155 C C . THR E 1 85 ? 43.823 -24.062 11.629 1.00 27.32 ? 85 THR C C 1 ATOM 7156 O O . THR E 1 85 ? 43.733 -23.554 10.513 1.00 29.78 ? 85 THR C O 1 ATOM 7157 C CB . THR E 1 85 ? 41.925 -25.671 11.666 1.00 31.39 ? 85 THR C CB 1 ATOM 7158 O OG1 . THR E 1 85 ? 40.733 -26.059 12.356 1.00 33.69 ? 85 THR C OG1 1 ATOM 7159 C CG2 . THR E 1 85 ? 42.895 -26.840 11.617 1.00 22.66 ? 85 THR C CG2 1 ATOM 7160 N N . TYR E 1 86 ? 44.985 -24.266 12.237 1.00 26.21 ? 86 TYR C N 1 ATOM 7161 C CA . TYR E 1 86 ? 46.249 -23.921 11.599 1.00 29.12 ? 86 TYR C CA 1 ATOM 7162 C C . TYR E 1 86 ? 46.918 -25.146 10.981 1.00 33.76 ? 86 TYR C C 1 ATOM 7163 O O . TYR E 1 86 ? 46.995 -26.201 11.611 1.00 38.43 ? 86 TYR C O 1 ATOM 7164 C CB . TYR E 1 86 ? 47.177 -23.245 12.613 1.00 30.62 ? 86 TYR C CB 1 ATOM 7165 C CG . TYR E 1 86 ? 46.659 -21.888 13.031 1.00 35.33 ? 86 TYR C CG 1 ATOM 7166 C CD1 . TYR E 1 86 ? 45.702 -21.769 14.031 1.00 34.12 ? 86 TYR C CD1 1 ATOM 7167 C CD2 . TYR E 1 86 ? 47.103 -20.729 12.404 1.00 31.62 ? 86 TYR C CD2 1 ATOM 7168 C CE1 . TYR E 1 86 ? 45.212 -20.533 14.407 1.00 36.34 ? 86 TYR C CE1 1 ATOM 7169 C CE2 . TYR E 1 86 ? 46.621 -19.484 12.774 1.00 30.19 ? 86 TYR C CE2 1 ATOM 7170 C CZ . TYR E 1 86 ? 45.673 -19.393 13.777 1.00 36.43 ? 86 TYR C CZ 1 ATOM 7171 O OH . TYR E 1 86 ? 45.179 -18.162 14.153 1.00 32.12 ? 86 TYR C OH 1 ATOM 7172 N N . TYR E 1 87 ? 47.386 -25.004 9.743 1.00 27.43 ? 87 TYR C N 1 ATOM 7173 C CA . TYR E 1 87 ? 48.059 -26.091 9.031 1.00 28.32 ? 87 TYR C CA 1 ATOM 7174 C C . TYR E 1 87 ? 49.496 -25.736 8.656 1.00 28.75 ? 87 TYR C C 1 ATOM 7175 O O . TYR E 1 87 ? 49.776 -24.610 8.250 1.00 32.13 ? 87 TYR C O 1 ATOM 7176 C CB . TYR E 1 87 ? 47.308 -26.456 7.750 1.00 22.30 ? 87 TYR C CB 1 ATOM 7177 C CG . TYR E 1 87 ? 45.965 -27.112 7.939 1.00 27.34 ? 87 TYR C CG 1 ATOM 7178 C CD1 . TYR E 1 87 ? 45.863 -28.482 8.158 1.00 29.91 ? 87 TYR C CD1 1 ATOM 7179 C CD2 . TYR E 1 87 ? 44.792 -26.370 7.854 1.00 28.15 ? 87 TYR C CD2 1 ATOM 7180 C CE1 . TYR E 1 87 ? 44.632 -29.091 8.312 1.00 34.78 ? 87 TYR C CE1 1 ATOM 7181 C CE2 . TYR E 1 87 ? 43.550 -26.971 8.009 1.00 30.82 ? 87 TYR C CE2 1 ATOM 7182 C CZ . TYR E 1 87 ? 43.478 -28.331 8.237 1.00 39.41 ? 87 TYR C CZ 1 ATOM 7183 O OH . TYR E 1 87 ? 42.248 -28.930 8.391 1.00 43.59 ? 87 TYR C OH 1 ATOM 7184 N N . CYS E 1 88 ? 50.400 -26.704 8.772 1.00 22.72 ? 88 CYS C N 1 ATOM 7185 C CA . CYS E 1 88 ? 51.734 -26.567 8.198 1.00 23.84 ? 88 CYS C CA 1 ATOM 7186 C C . CYS E 1 88 ? 51.780 -27.310 6.864 1.00 26.46 ? 88 CYS C C 1 ATOM 7187 O O . CYS E 1 88 ? 51.005 -28.245 6.644 1.00 23.49 ? 88 CYS C O 1 ATOM 7188 C CB . CYS E 1 88 ? 52.801 -27.099 9.152 1.00 23.64 ? 88 CYS C CB 1 ATOM 7189 S SG . CYS E 1 88 ? 52.620 -28.851 9.576 1.00 34.69 ? 88 CYS C SG 1 ATOM 7190 N N . GLN E 1 89 ? 52.672 -26.898 5.968 1.00 28.94 ? 89 GLN C N 1 ATOM 7191 C CA . GLN E 1 89 ? 52.754 -27.541 4.659 1.00 25.00 ? 89 GLN C CA 1 ATOM 7192 C C . GLN E 1 89 ? 54.169 -27.607 4.100 1.00 30.37 ? 89 GLN C C 1 ATOM 7193 O O . GLN E 1 89 ? 54.878 -26.601 4.039 1.00 29.23 ? 89 GLN C O 1 ATOM 7194 C CB . GLN E 1 89 ? 51.862 -26.823 3.640 1.00 22.82 ? 89 GLN C CB 1 ATOM 7195 C CG . GLN E 1 89 ? 51.771 -27.560 2.303 1.00 24.19 ? 89 GLN C CG 1 ATOM 7196 C CD . GLN E 1 89 ? 51.499 -26.639 1.127 1.00 28.08 ? 89 GLN C CD 1 ATOM 7197 O OE1 . GLN E 1 89 ? 51.645 -25.420 1.229 1.00 28.78 ? 89 GLN C OE1 1 ATOM 7198 N NE2 . GLN E 1 89 ? 51.106 -27.222 -0.001 1.00 17.70 ? 89 GLN C NE2 1 ATOM 7199 N N . HIS E 1 90 ? 54.556 -28.810 3.689 1.00 26.39 ? 90 HIS C N 1 ATOM 7200 C CA . HIS E 1 90 ? 55.779 -29.041 2.932 1.00 27.75 ? 90 HIS C CA 1 ATOM 7201 C C . HIS E 1 90 ? 55.648 -28.341 1.581 1.00 22.95 ? 90 HIS C C 1 ATOM 7202 O O . HIS E 1 90 ? 54.623 -28.475 0.923 1.00 24.46 ? 90 HIS C O 1 ATOM 7203 C CB . HIS E 1 90 ? 56.008 -30.547 2.755 1.00 26.82 ? 90 HIS C CB 1 ATOM 7204 C CG . HIS E 1 90 ? 57.341 -30.902 2.179 1.00 28.94 ? 90 HIS C CG 1 ATOM 7205 N ND1 . HIS E 1 90 ? 57.567 -32.087 1.511 1.00 26.36 ? 90 HIS C ND1 1 ATOM 7206 C CD2 . HIS E 1 90 ? 58.524 -30.244 2.186 1.00 26.30 ? 90 HIS C CD2 1 ATOM 7207 C CE1 . HIS E 1 90 ? 58.827 -32.137 1.120 1.00 25.22 ? 90 HIS C CE1 1 ATOM 7208 N NE2 . HIS E 1 90 ? 59.430 -31.031 1.519 1.00 32.03 ? 90 HIS C NE2 1 ATOM 7209 N N . LEU E 1 91 ? 56.668 -27.594 1.168 1.00 19.72 ? 91 LEU C N 1 ATOM 7210 C CA . LEU E 1 91 ? 56.523 -26.729 -0.007 1.00 24.73 ? 91 LEU C CA 1 ATOM 7211 C C . LEU E 1 91 ? 57.090 -27.333 -1.292 1.00 29.52 ? 91 LEU C C 1 ATOM 7212 O O . LEU E 1 91 ? 56.952 -26.756 -2.373 1.00 29.03 ? 91 LEU C O 1 ATOM 7213 C CB . LEU E 1 91 ? 57.167 -25.369 0.263 1.00 21.27 ? 91 LEU C CB 1 ATOM 7214 C CG . LEU E 1 91 ? 56.335 -24.506 1.211 1.00 25.49 ? 91 LEU C CG 1 ATOM 7215 C CD1 . LEU E 1 91 ? 57.035 -23.197 1.520 1.00 32.14 ? 91 LEU C CD1 1 ATOM 7216 C CD2 . LEU E 1 91 ? 54.960 -24.255 0.604 1.00 20.76 ? 91 LEU C CD2 1 ATOM 7217 N N . ILE E 1 92 ? 57.723 -28.494 -1.171 1.00 26.81 ? 92 ILE C N 1 ATOM 7218 C CA . ILE E 1 92 ? 58.112 -29.279 -2.339 1.00 28.22 ? 92 ILE C CA 1 ATOM 7219 C C . ILE E 1 92 ? 57.731 -30.735 -2.098 1.00 25.32 ? 92 ILE C C 1 ATOM 7220 O O . ILE E 1 92 ? 56.935 -31.029 -1.202 1.00 28.82 ? 92 ILE C O 1 ATOM 7221 C CB . ILE E 1 92 ? 59.617 -29.173 -2.648 1.00 27.70 ? 92 ILE C CB 1 ATOM 7222 C CG1 . ILE E 1 92 ? 60.447 -29.523 -1.412 1.00 28.99 ? 92 ILE C CG1 1 ATOM 7223 C CG2 . ILE E 1 92 ? 59.962 -27.784 -3.157 1.00 28.96 ? 92 ILE C CG2 1 ATOM 7224 C CD1 . ILE E 1 92 ? 61.919 -29.691 -1.706 1.00 35.44 ? 92 ILE C CD1 1 ATOM 7225 N N . GLY E 1 93 ? 58.295 -31.643 -2.888 1.00 25.41 ? 93 GLY C N 1 ATOM 7226 C CA . GLY E 1 93 ? 57.901 -33.041 -2.818 1.00 30.32 ? 93 GLY C CA 1 ATOM 7227 C C . GLY E 1 93 ? 56.440 -33.199 -3.208 1.00 33.00 ? 93 GLY C C 1 ATOM 7228 O O . GLY E 1 93 ? 56.029 -32.751 -4.281 1.00 36.06 ? 93 GLY C O 1 ATOM 7229 N N . LEU E 1 94 ? 55.650 -33.817 -2.334 1.00 22.44 ? 94 LEU C N 1 ATOM 7230 C CA . LEU E 1 94 ? 54.218 -33.973 -2.581 1.00 27.05 ? 94 LEU C CA 1 ATOM 7231 C C . LEU E 1 94 ? 53.415 -32.795 -2.041 1.00 26.72 ? 94 LEU C C 1 ATOM 7232 O O . LEU E 1 94 ? 52.185 -32.804 -2.100 1.00 24.26 ? 94 LEU C O 1 ATOM 7233 C CB . LEU E 1 94 ? 53.694 -35.268 -1.958 1.00 31.01 ? 94 LEU C CB 1 ATOM 7234 C CG . LEU E 1 94 ? 54.250 -36.597 -2.474 1.00 29.92 ? 94 LEU C CG 1 ATOM 7235 C CD1 . LEU E 1 94 ? 53.427 -37.755 -1.922 1.00 26.48 ? 94 LEU C CD1 1 ATOM 7236 C CD2 . LEU E 1 94 ? 54.281 -36.622 -3.992 1.00 23.61 ? 94 LEU C CD2 1 ATOM 7237 N N . ARG E 1 95 ? 54.110 -31.792 -1.508 1.00 28.65 ? 96 ARG C N 1 ATOM 7238 C CA . ARG E 1 95 ? 53.459 -30.587 -1.003 1.00 28.35 ? 96 ARG C CA 1 ATOM 7239 C C . ARG E 1 95 ? 52.400 -30.916 0.052 1.00 28.15 ? 96 ARG C C 1 ATOM 7240 O O . ARG E 1 95 ? 51.350 -30.276 0.109 1.00 29.99 ? 96 ARG C O 1 ATOM 7241 C CB . ARG E 1 95 ? 52.828 -29.793 -2.162 1.00 29.65 ? 96 ARG C CB 1 ATOM 7242 C CG . ARG E 1 95 ? 53.791 -28.854 -2.893 1.00 33.31 ? 96 ARG C CG 1 ATOM 7243 C CD . ARG E 1 95 ? 53.943 -29.192 -4.370 1.00 25.42 ? 96 ARG C CD 1 ATOM 7244 N NE . ARG E 1 95 ? 55.154 -29.961 -4.621 1.00 40.72 ? 96 ARG C NE 1 ATOM 7245 C CZ . ARG E 1 95 ? 56.059 -29.668 -5.550 1.00 43.61 ? 96 ARG C CZ 1 ATOM 7246 N NH1 . ARG E 1 95 ? 55.903 -28.612 -6.342 1.00 24.99 ? 96 ARG C NH1 1 ATOM 7247 N NH2 . ARG E 1 95 ? 57.125 -30.443 -5.690 1.00 54.03 ? 96 ARG C NH2 1 ATOM 7248 N N . SER E 1 96 ? 52.686 -31.904 0.893 1.00 27.28 ? 97 SER C N 1 ATOM 7249 C CA . SER E 1 96 ? 51.696 -32.410 1.842 1.00 30.65 ? 97 SER C CA 1 ATOM 7250 C C . SER E 1 96 ? 51.509 -31.500 3.054 1.00 26.23 ? 97 SER C C 1 ATOM 7251 O O . SER E 1 96 ? 52.392 -30.712 3.402 1.00 28.34 ? 97 SER C O 1 ATOM 7252 C CB . SER E 1 96 ? 52.082 -33.815 2.313 1.00 29.92 ? 97 SER C CB 1 ATOM 7253 O OG . SER E 1 96 ? 53.239 -33.772 3.129 1.00 26.28 ? 97 SER C OG 1 ATOM 7254 N N . PHE E 1 97 ? 50.348 -31.630 3.693 1.00 24.06 ? 98 PHE C N 1 ATOM 7255 C CA . PHE E 1 97 ? 49.988 -30.826 4.859 1.00 24.84 ? 98 PHE C CA 1 ATOM 7256 C C . PHE E 1 97 ? 50.022 -31.652 6.146 1.00 30.20 ? 98 PHE C C 1 ATOM 7257 O O . PHE E 1 97 ? 50.000 -32.879 6.102 1.00 31.32 ? 98 PHE C O 1 ATOM 7258 C CB . PHE E 1 97 ? 48.589 -30.226 4.683 1.00 21.72 ? 98 PHE C CB 1 ATOM 7259 C CG . PHE E 1 97 ? 48.473 -29.256 3.533 1.00 21.89 ? 98 PHE C CG 1 ATOM 7260 C CD1 . PHE E 1 97 ? 48.443 -29.709 2.220 1.00 20.63 ? 98 PHE C CD1 1 ATOM 7261 C CD2 . PHE E 1 97 ? 48.375 -27.890 3.771 1.00 24.95 ? 98 PHE C CD2 1 ATOM 7262 C CE1 . PHE E 1 97 ? 48.326 -28.815 1.165 1.00 19.19 ? 98 PHE C CE1 1 ATOM 7263 C CE2 . PHE E 1 97 ? 48.256 -26.986 2.722 1.00 28.33 ? 98 PHE C CE2 1 ATOM 7264 C CZ . PHE E 1 97 ? 48.229 -27.448 1.417 1.00 23.29 ? 98 PHE C CZ 1 ATOM 7265 N N . GLY E 1 98 ? 50.067 -30.970 7.288 1.00 30.61 ? 99 GLY C N 1 ATOM 7266 C CA . GLY E 1 98 ? 49.877 -31.619 8.574 1.00 25.60 ? 99 GLY C CA 1 ATOM 7267 C C . GLY E 1 98 ? 48.394 -31.832 8.829 1.00 27.91 ? 99 GLY C C 1 ATOM 7268 O O . GLY E 1 98 ? 47.562 -31.355 8.058 1.00 27.62 ? 99 GLY C O 1 ATOM 7269 N N . GLN E 1 99 ? 48.047 -32.535 9.905 1.00 30.34 ? 100 GLN C N 1 ATOM 7270 C CA . GLN E 1 99 ? 46.645 -32.868 10.154 1.00 32.32 ? 100 GLN C CA 1 ATOM 7271 C C . GLN E 1 99 ? 45.869 -31.676 10.724 1.00 35.45 ? 100 GLN C C 1 ATOM 7272 O O . GLN E 1 99 ? 44.639 -31.692 10.771 1.00 38.45 ? 100 GLN C O 1 ATOM 7273 C CB . GLN E 1 99 ? 46.526 -34.083 11.089 1.00 29.39 ? 100 GLN C CB 1 ATOM 7274 C CG . GLN E 1 99 ? 46.598 -33.776 12.577 1.00 28.96 ? 100 GLN C CG 1 ATOM 7275 C CD . GLN E 1 99 ? 48.021 -33.597 13.073 1.00 36.51 ? 100 GLN C CD 1 ATOM 7276 O OE1 . GLN E 1 99 ? 48.973 -33.643 12.294 1.00 37.61 ? 100 GLN C OE1 1 ATOM 7277 N NE2 . GLN E 1 99 ? 48.172 -33.389 14.377 1.00 39.29 ? 100 GLN C NE2 1 ATOM 7278 N N . GLY E 1 100 ? 46.587 -30.640 11.143 1.00 35.70 ? 101 GLY C N 1 ATOM 7279 C CA . GLY E 1 100 ? 45.950 -29.420 11.603 1.00 32.83 ? 101 GLY C CA 1 ATOM 7280 C C . GLY E 1 100 ? 45.843 -29.287 13.111 1.00 35.16 ? 101 GLY C C 1 ATOM 7281 O O . GLY E 1 100 ? 45.747 -30.278 13.832 1.00 33.01 ? 101 GLY C O 1 ATOM 7282 N N . THR E 1 101 ? 45.860 -28.045 13.584 1.00 33.45 ? 102 THR C N 1 ATOM 7283 C CA . THR E 1 101 ? 45.692 -27.741 14.999 1.00 33.25 ? 102 THR C CA 1 ATOM 7284 C C . THR E 1 101 ? 44.529 -26.783 15.195 1.00 35.05 ? 102 THR C C 1 ATOM 7285 O O . THR E 1 101 ? 44.549 -25.670 14.671 1.00 38.24 ? 102 THR C O 1 ATOM 7286 C CB . THR E 1 101 ? 46.955 -27.105 15.601 1.00 36.26 ? 102 THR C CB 1 ATOM 7287 O OG1 . THR E 1 101 ? 48.048 -28.026 15.511 1.00 40.32 ? 102 THR C OG1 1 ATOM 7288 C CG2 . THR E 1 101 ? 46.721 -26.736 17.057 1.00 39.50 ? 102 THR C CG2 1 ATOM 7289 N N . LYS E 1 102 ? 43.516 -27.205 15.947 1.00 31.40 ? 103 LYS C N 1 ATOM 7290 C CA . LYS E 1 102 ? 42.359 -26.346 16.178 1.00 36.25 ? 103 LYS C CA 1 ATOM 7291 C C . LYS E 1 102 ? 42.586 -25.441 17.384 1.00 34.33 ? 103 LYS C C 1 ATOM 7292 O O . LYS E 1 102 ? 42.792 -25.911 18.500 1.00 35.55 ? 103 LYS C O 1 ATOM 7293 C CB . LYS E 1 102 ? 41.085 -27.173 16.371 1.00 36.69 ? 103 LYS C CB 1 ATOM 7294 C CG . LYS E 1 102 ? 39.820 -26.324 16.373 1.00 40.26 ? 103 LYS C CG 1 ATOM 7295 C CD . LYS E 1 102 ? 38.571 -27.183 16.359 1.00 47.02 ? 103 LYS C CD 1 ATOM 7296 C CE . LYS E 1 102 ? 37.318 -26.326 16.450 1.00 50.23 ? 103 LYS C CE 1 ATOM 7297 N NZ . LYS E 1 102 ? 36.085 -27.156 16.534 1.00 57.05 ? 103 LYS C NZ 1 ATOM 7298 N N . LEU E 1 103 ? 42.551 -24.136 17.146 1.00 32.91 ? 104 LEU C N 1 ATOM 7299 C CA . LEU E 1 103 ? 42.779 -23.165 18.207 1.00 39.57 ? 104 LEU C CA 1 ATOM 7300 C C . LEU E 1 103 ? 41.465 -22.536 18.652 1.00 38.44 ? 104 LEU C C 1 ATOM 7301 O O . LEU E 1 103 ? 40.762 -21.910 17.859 1.00 39.80 ? 104 LEU C O 1 ATOM 7302 C CB . LEU E 1 103 ? 43.760 -22.086 17.744 1.00 40.36 ? 104 LEU C CB 1 ATOM 7303 C CG . LEU E 1 103 ? 43.954 -20.891 18.679 1.00 43.96 ? 104 LEU C CG 1 ATOM 7304 C CD1 . LEU E 1 103 ? 44.395 -21.350 20.059 1.00 42.83 ? 104 LEU C CD1 1 ATOM 7305 C CD2 . LEU E 1 103 ? 44.967 -19.927 18.085 1.00 45.81 ? 104 LEU C CD2 1 ATOM 7306 N N . GLU E 1 104 ? 41.140 -22.714 19.927 1.00 43.29 ? 105 GLU C N 1 ATOM 7307 C CA . GLU E 1 104 ? 39.907 -22.192 20.501 1.00 45.60 ? 105 GLU C CA 1 ATOM 7308 C C . GLU E 1 104 ? 40.224 -21.082 21.498 1.00 39.84 ? 105 GLU C C 1 ATOM 7309 O O . GLU E 1 104 ? 41.242 -21.133 22.186 1.00 42.71 ? 105 GLU C O 1 ATOM 7310 C CB . GLU E 1 104 ? 39.119 -23.316 21.179 1.00 56.56 ? 105 GLU C CB 1 ATOM 7311 C CG . GLU E 1 104 ? 37.878 -22.858 21.927 1.00 77.15 ? 105 GLU C CG 1 ATOM 7312 C CD . GLU E 1 104 ? 37.342 -23.919 22.871 1.00 93.78 ? 105 GLU C CD 1 ATOM 7313 O OE1 . GLU E 1 104 ? 37.844 -25.063 22.821 1.00 99.22 ? 105 GLU C OE1 1 ATOM 7314 O OE2 . GLU E 1 104 ? 36.425 -23.606 23.663 1.00 95.92 ? 105 GLU C OE2 1 ATOM 7315 N N . ILE E 1 105 ? 39.361 -20.076 21.570 1.00 40.16 ? 106 ILE C N 1 ATOM 7316 C CA . ILE E 1 105 ? 39.553 -18.989 22.520 1.00 47.23 ? 106 ILE C CA 1 ATOM 7317 C C . ILE E 1 105 ? 38.885 -19.295 23.856 1.00 54.82 ? 106 ILE C C 1 ATOM 7318 O O . ILE E 1 105 ? 37.734 -19.729 23.907 1.00 58.45 ? 106 ILE C O 1 ATOM 7319 C CB . ILE E 1 105 ? 39.006 -17.663 21.976 1.00 45.12 ? 106 ILE C CB 1 ATOM 7320 C CG1 . ILE E 1 105 ? 39.585 -17.387 20.590 1.00 43.32 ? 106 ILE C CG1 1 ATOM 7321 C CG2 . ILE E 1 105 ? 39.344 -16.526 22.919 1.00 42.57 ? 106 ILE C CG2 1 ATOM 7322 C CD1 . ILE E 1 105 ? 41.094 -17.368 20.566 1.00 38.93 ? 106 ILE C CD1 1 ATOM 7323 N N . LYS E 1 106 ? 39.624 -19.073 24.936 1.00 57.91 ? 107 LYS C N 1 ATOM 7324 C CA . LYS E 1 106 ? 39.103 -19.256 26.281 1.00 60.78 ? 107 LYS C CA 1 ATOM 7325 C C . LYS E 1 106 ? 38.661 -17.903 26.833 1.00 68.78 ? 107 LYS C C 1 ATOM 7326 O O . LYS E 1 106 ? 39.434 -16.947 26.824 1.00 68.69 ? 107 LYS C O 1 ATOM 7327 C CB . LYS E 1 106 ? 40.165 -19.896 27.181 1.00 63.64 ? 107 LYS C CB 1 ATOM 7328 C CG . LYS E 1 106 ? 39.638 -20.476 28.484 1.00 69.77 ? 107 LYS C CG 1 ATOM 7329 C CD . LYS E 1 106 ? 40.780 -20.903 29.403 1.00 75.93 ? 107 LYS C CD 1 ATOM 7330 C CE . LYS E 1 106 ? 41.520 -22.127 28.877 1.00 78.67 ? 107 LYS C CE 1 ATOM 7331 N NZ . LYS E 1 106 ? 40.795 -23.397 29.165 1.00 79.72 ? 107 LYS C NZ 1 ATOM 7332 N N . ARG E 1 107 ? 37.416 -17.814 27.292 1.00 54.53 ? 108 ARG C N 1 ATOM 7333 C CA . ARG E 1 107 ? 36.900 -16.566 27.857 1.00 53.25 ? 108 ARG C CA 1 ATOM 7334 C C . ARG E 1 107 ? 36.062 -16.821 29.114 1.00 46.28 ? 108 ARG C C 1 ATOM 7335 O O . ARG E 1 107 ? 35.940 -17.961 29.567 1.00 54.89 ? 108 ARG C O 1 ATOM 7336 C CB . ARG E 1 107 ? 36.080 -15.800 26.809 1.00 51.96 ? 108 ARG C CB 1 ATOM 7337 C CG . ARG E 1 107 ? 34.878 -16.557 26.263 1.00 51.78 ? 108 ARG C CG 1 ATOM 7338 C CD . ARG E 1 107 ? 33.573 -15.976 26.779 1.00 52.28 ? 108 ARG C CD 1 ATOM 7339 N NE . ARG E 1 107 ? 33.144 -14.784 26.049 1.00 54.55 ? 108 ARG C NE 1 ATOM 7340 C CZ . ARG E 1 107 ? 32.420 -13.802 26.581 1.00 51.66 ? 108 ARG C CZ 1 ATOM 7341 N NH1 . ARG E 1 107 ? 32.058 -13.856 27.855 1.00 47.75 ? 108 ARG C NH1 1 ATOM 7342 N NH2 . ARG E 1 107 ? 32.067 -12.759 25.841 1.00 56.26 ? 108 ARG C NH2 1 ATOM 7343 N N . THR E 1 108 ? 35.496 -15.758 29.679 1.00 74.03 ? 109 THR C N 1 ATOM 7344 C CA . THR E 1 108 ? 34.741 -15.871 30.924 1.00 69.65 ? 109 THR C CA 1 ATOM 7345 C C . THR E 1 108 ? 33.338 -16.427 30.678 1.00 67.33 ? 109 THR C C 1 ATOM 7346 O O . THR E 1 108 ? 32.720 -16.147 29.653 1.00 60.50 ? 109 THR C O 1 ATOM 7347 C CB . THR E 1 108 ? 34.643 -14.511 31.649 1.00 70.28 ? 109 THR C CB 1 ATOM 7348 O OG1 . THR E 1 108 ? 33.917 -14.671 32.873 1.00 79.07 ? 109 THR C OG1 1 ATOM 7349 C CG2 . THR E 1 108 ? 33.945 -13.477 30.779 1.00 65.74 ? 109 THR C CG2 1 ATOM 7350 N N . VAL E 1 109 ? 32.848 -17.222 31.627 1.00 68.00 ? 110 VAL C N 1 ATOM 7351 C CA . VAL E 1 109 ? 31.563 -17.906 31.496 1.00 67.63 ? 110 VAL C CA 1 ATOM 7352 C C . VAL E 1 109 ? 30.413 -16.947 31.187 1.00 69.04 ? 110 VAL C C 1 ATOM 7353 O O . VAL E 1 109 ? 30.253 -15.921 31.847 1.00 73.86 ? 110 VAL C O 1 ATOM 7354 C CB . VAL E 1 109 ? 31.222 -18.695 32.778 1.00 67.70 ? 110 VAL C CB 1 ATOM 7355 C CG1 . VAL E 1 109 ? 29.893 -19.416 32.624 1.00 67.03 ? 110 VAL C CG1 1 ATOM 7356 C CG2 . VAL E 1 109 ? 32.333 -19.684 33.105 1.00 68.53 ? 110 VAL C CG2 1 ATOM 7357 N N . ALA E 1 110 ? 29.624 -17.287 30.171 1.00 64.42 ? 111 ALA C N 1 ATOM 7358 C CA . ALA E 1 110 ? 28.465 -16.487 29.789 1.00 62.20 ? 111 ALA C CA 1 ATOM 7359 C C . ALA E 1 110 ? 27.234 -17.372 29.601 1.00 63.17 ? 111 ALA C C 1 ATOM 7360 O O . ALA E 1 110 ? 27.301 -18.413 28.947 1.00 64.20 ? 111 ALA C O 1 ATOM 7361 C CB . ALA E 1 110 ? 28.756 -15.700 28.519 1.00 53.96 ? 111 ALA C CB 1 ATOM 7362 N N . ALA E 1 111 ? 26.112 -16.952 30.179 1.00 62.57 ? 112 ALA C N 1 ATOM 7363 C CA . ALA E 1 111 ? 24.877 -17.731 30.130 1.00 62.72 ? 112 ALA C CA 1 ATOM 7364 C C . ALA E 1 111 ? 24.159 -17.575 28.790 1.00 59.32 ? 112 ALA C C 1 ATOM 7365 O O . ALA E 1 111 ? 24.240 -16.520 28.156 1.00 53.20 ? 112 ALA C O 1 ATOM 7366 C CB . ALA E 1 111 ? 23.955 -17.326 31.275 1.00 62.67 ? 112 ALA C CB 1 ATOM 7367 N N . PRO E 1 112 ? 23.455 -18.632 28.350 1.00 56.27 ? 113 PRO C N 1 ATOM 7368 C CA . PRO E 1 112 ? 22.697 -18.589 27.095 1.00 59.90 ? 113 PRO C CA 1 ATOM 7369 C C . PRO E 1 112 ? 21.301 -17.981 27.234 1.00 62.84 ? 113 PRO C C 1 ATOM 7370 O O . PRO E 1 112 ? 20.608 -18.247 28.216 1.00 57.67 ? 113 PRO C O 1 ATOM 7371 C CB . PRO E 1 112 ? 22.594 -20.065 26.709 1.00 55.81 ? 113 PRO C CB 1 ATOM 7372 C CG . PRO E 1 112 ? 22.565 -20.773 28.015 1.00 48.46 ? 113 PRO C CG 1 ATOM 7373 C CD . PRO E 1 112 ? 23.474 -19.988 28.930 1.00 52.04 ? 113 PRO C CD 1 ATOM 7374 N N . SER E 1 113 ? 20.903 -17.176 26.253 1.00 68.77 ? 114 SER C N 1 ATOM 7375 C CA . SER E 1 113 ? 19.530 -16.692 26.159 1.00 69.82 ? 114 SER C CA 1 ATOM 7376 C C . SER E 1 113 ? 18.680 -17.728 25.428 1.00 72.31 ? 114 SER C C 1 ATOM 7377 O O . SER E 1 113 ? 18.849 -17.936 24.225 1.00 72.60 ? 114 SER C O 1 ATOM 7378 C CB . SER E 1 113 ? 19.473 -15.348 25.431 1.00 70.09 ? 114 SER C CB 1 ATOM 7379 O OG . SER E 1 113 ? 20.350 -14.405 26.020 1.00 73.29 ? 114 SER C OG 1 ATOM 7380 N N . VAL E 1 114 ? 17.768 -18.373 26.150 1.00 72.33 ? 115 VAL C N 1 ATOM 7381 C CA . VAL E 1 114 ? 17.010 -19.496 25.600 1.00 67.22 ? 115 VAL C CA 1 ATOM 7382 C C . VAL E 1 114 ? 15.700 -19.078 24.932 1.00 63.03 ? 115 VAL C C 1 ATOM 7383 O O . VAL E 1 114 ? 14.862 -18.414 25.539 1.00 65.17 ? 115 VAL C O 1 ATOM 7384 C CB . VAL E 1 114 ? 16.692 -20.537 26.692 1.00 65.72 ? 115 VAL C CB 1 ATOM 7385 C CG1 . VAL E 1 114 ? 16.030 -21.763 26.081 1.00 61.01 ? 115 VAL C CG1 1 ATOM 7386 C CG2 . VAL E 1 114 ? 17.960 -20.930 27.434 1.00 67.39 ? 115 VAL C CG2 1 ATOM 7387 N N . PHE E 1 115 ? 15.531 -19.482 23.677 1.00 59.46 ? 116 PHE C N 1 ATOM 7388 C CA . PHE E 1 115 ? 14.292 -19.243 22.944 1.00 53.20 ? 116 PHE C CA 1 ATOM 7389 C C . PHE E 1 115 ? 13.687 -20.561 22.482 1.00 52.96 ? 116 PHE C C 1 ATOM 7390 O O . PHE E 1 115 ? 14.383 -21.570 22.391 1.00 58.31 ? 116 PHE C O 1 ATOM 7391 C CB . PHE E 1 115 ? 14.535 -18.340 21.735 1.00 50.27 ? 116 PHE C CB 1 ATOM 7392 C CG . PHE E 1 115 ? 15.231 -17.056 22.066 1.00 53.18 ? 116 PHE C CG 1 ATOM 7393 C CD1 . PHE E 1 115 ? 14.528 -15.992 22.598 1.00 58.19 ? 116 PHE C CD1 1 ATOM 7394 C CD2 . PHE E 1 115 ? 16.589 -16.908 21.835 1.00 53.46 ? 116 PHE C CD2 1 ATOM 7395 C CE1 . PHE E 1 115 ? 15.168 -14.806 22.900 1.00 60.42 ? 116 PHE C CE1 1 ATOM 7396 C CE2 . PHE E 1 115 ? 17.236 -15.724 22.136 1.00 52.31 ? 116 PHE C CE2 1 ATOM 7397 C CZ . PHE E 1 115 ? 16.525 -14.671 22.669 1.00 53.09 ? 116 PHE C CZ 1 ATOM 7398 N N . ILE E 1 116 ? 12.394 -20.548 22.179 1.00 51.76 ? 117 ILE C N 1 ATOM 7399 C CA . ILE E 1 116 ? 11.734 -21.742 21.670 1.00 49.33 ? 117 ILE C CA 1 ATOM 7400 C C . ILE E 1 116 ? 10.768 -21.369 20.544 1.00 48.91 ? 117 ILE C C 1 ATOM 7401 O O . ILE E 1 116 ? 10.118 -20.324 20.586 1.00 47.34 ? 117 ILE C O 1 ATOM 7402 C CB . ILE E 1 116 ? 10.996 -22.505 22.803 1.00 57.24 ? 117 ILE C CB 1 ATOM 7403 C CG1 . ILE E 1 116 ? 10.534 -23.882 22.324 1.00 54.26 ? 117 ILE C CG1 1 ATOM 7404 C CG2 . ILE E 1 116 ? 9.836 -21.686 23.363 1.00 59.08 ? 117 ILE C CG2 1 ATOM 7405 C CD1 . ILE E 1 116 ? 10.044 -24.778 23.438 1.00 54.57 ? 117 ILE C CD1 1 ATOM 7406 N N . PHE E 1 117 ? 10.707 -22.217 19.522 1.00 48.86 ? 118 PHE C N 1 ATOM 7407 C CA . PHE E 1 117 ? 9.851 -21.975 18.366 1.00 47.50 ? 118 PHE C CA 1 ATOM 7408 C C . PHE E 1 117 ? 8.985 -23.189 18.063 1.00 52.34 ? 118 PHE C C 1 ATOM 7409 O O . PHE E 1 117 ? 9.493 -24.306 17.950 1.00 52.44 ? 118 PHE C O 1 ATOM 7410 C CB . PHE E 1 117 ? 10.681 -21.631 17.126 1.00 42.22 ? 118 PHE C CB 1 ATOM 7411 C CG . PHE E 1 117 ? 11.634 -20.490 17.320 1.00 44.02 ? 118 PHE C CG 1 ATOM 7412 C CD1 . PHE E 1 117 ? 12.903 -20.710 17.838 1.00 41.59 ? 118 PHE C CD1 1 ATOM 7413 C CD2 . PHE E 1 117 ? 11.274 -19.199 16.959 1.00 42.86 ? 118 PHE C CD2 1 ATOM 7414 C CE1 . PHE E 1 117 ? 13.791 -19.668 18.009 1.00 44.01 ? 118 PHE C CE1 1 ATOM 7415 C CE2 . PHE E 1 117 ? 12.157 -18.147 17.127 1.00 46.54 ? 118 PHE C CE2 1 ATOM 7416 C CZ . PHE E 1 117 ? 13.419 -18.383 17.652 1.00 48.26 ? 118 PHE C CZ 1 ATOM 7417 N N . PRO E 1 118 ? 7.671 -22.973 17.927 1.00 54.14 ? 119 PRO C N 1 ATOM 7418 C CA . PRO E 1 118 ? 6.753 -24.038 17.517 1.00 55.86 ? 119 PRO C CA 1 ATOM 7419 C C . PRO E 1 118 ? 6.929 -24.348 16.037 1.00 52.44 ? 119 PRO C C 1 ATOM 7420 O O . PRO E 1 118 ? 7.551 -23.559 15.331 1.00 53.51 ? 119 PRO C O 1 ATOM 7421 C CB . PRO E 1 118 ? 5.362 -23.441 17.792 1.00 56.69 ? 119 PRO C CB 1 ATOM 7422 C CG . PRO E 1 118 ? 5.609 -22.193 18.607 1.00 60.99 ? 119 PRO C CG 1 ATOM 7423 C CD . PRO E 1 118 ? 6.961 -21.714 18.200 1.00 56.98 ? 119 PRO C CD 1 ATOM 7424 N N . PRO E 1 119 ? 6.399 -25.484 15.569 1.00 55.01 ? 120 PRO C N 1 ATOM 7425 C CA . PRO E 1 119 ? 6.406 -25.708 14.121 1.00 57.85 ? 120 PRO C CA 1 ATOM 7426 C C . PRO E 1 119 ? 5.458 -24.743 13.423 1.00 57.02 ? 120 PRO C C 1 ATOM 7427 O O . PRO E 1 119 ? 4.463 -24.339 14.018 1.00 58.43 ? 120 PRO C O 1 ATOM 7428 C CB . PRO E 1 119 ? 5.924 -27.153 13.986 1.00 57.18 ? 120 PRO C CB 1 ATOM 7429 C CG . PRO E 1 119 ? 5.111 -27.384 15.209 1.00 57.23 ? 120 PRO C CG 1 ATOM 7430 C CD . PRO E 1 119 ? 5.795 -26.610 16.299 1.00 54.06 ? 120 PRO C CD 1 ATOM 7431 N N . SER E 1 120 ? 5.770 -24.369 12.188 1.00 54.29 ? 121 SER C N 1 ATOM 7432 C CA . SER E 1 120 ? 4.895 -23.489 11.428 1.00 54.14 ? 121 SER C CA 1 ATOM 7433 C C . SER E 1 120 ? 3.663 -24.253 10.972 1.00 58.24 ? 121 SER C C 1 ATOM 7434 O O . SER E 1 120 ? 3.658 -25.483 10.968 1.00 61.22 ? 121 SER C O 1 ATOM 7435 C CB . SER E 1 120 ? 5.625 -22.903 10.222 1.00 54.13 ? 121 SER C CB 1 ATOM 7436 O OG . SER E 1 120 ? 5.903 -23.909 9.265 1.00 53.10 ? 121 SER C OG 1 ATOM 7437 N N . ASP E 1 121 ? 2.622 -23.524 10.586 1.00 61.59 ? 122 ASP C N 1 ATOM 7438 C CA . ASP E 1 121 ? 1.397 -24.152 10.107 1.00 68.81 ? 122 ASP C CA 1 ATOM 7439 C C . ASP E 1 121 ? 1.604 -24.812 8.748 1.00 65.66 ? 122 ASP C C 1 ATOM 7440 O O . ASP E 1 121 ? 1.003 -25.845 8.456 1.00 70.17 ? 122 ASP C O 1 ATOM 7441 C CB . ASP E 1 121 ? 0.260 -23.130 10.028 1.00 78.60 ? 122 ASP C CB 1 ATOM 7442 C CG . ASP E 1 121 ? -0.421 -22.909 11.366 1.00 85.35 ? 122 ASP C CG 1 ATOM 7443 O OD1 . ASP E 1 121 ? -0.536 -23.881 12.143 1.00 86.10 ? 122 ASP C OD1 1 ATOM 7444 O OD2 . ASP E 1 121 ? -0.844 -21.765 11.639 1.00 87.88 ? 122 ASP C OD2 1 ATOM 7445 N N . GLU E 1 122 ? 2.463 -24.224 7.921 1.00 63.65 ? 123 GLU C N 1 ATOM 7446 C CA . GLU E 1 122 ? 2.693 -24.755 6.582 1.00 64.69 ? 123 GLU C CA 1 ATOM 7447 C C . GLU E 1 122 ? 3.517 -26.043 6.600 1.00 61.32 ? 123 GLU C C 1 ATOM 7448 O O . GLU E 1 122 ? 3.401 -26.866 5.690 1.00 59.05 ? 123 GLU C O 1 ATOM 7449 C CB . GLU E 1 122 ? 3.368 -23.706 5.697 1.00 66.04 ? 123 GLU C CB 1 ATOM 7450 C CG . GLU E 1 122 ? 4.532 -22.992 6.345 1.00 75.63 ? 123 GLU C CG 1 ATOM 7451 C CD . GLU E 1 122 ? 5.116 -21.915 5.452 1.00 80.83 ? 123 GLU C CD 1 ATOM 7452 O OE1 . GLU E 1 122 ? 4.603 -20.774 5.479 1.00 84.55 ? 123 GLU C OE1 1 ATOM 7453 O OE2 . GLU E 1 122 ? 6.087 -22.209 4.723 1.00 75.71 ? 123 GLU C OE2 1 ATOM 7454 N N . GLN E 1 123 ? 4.339 -26.226 7.631 1.00 58.01 ? 124 GLN C N 1 ATOM 7455 C CA . GLN E 1 123 ? 5.094 -27.470 7.767 1.00 55.79 ? 124 GLN C CA 1 ATOM 7456 C C . GLN E 1 123 ? 4.186 -28.591 8.245 1.00 59.16 ? 124 GLN C C 1 ATOM 7457 O O . GLN E 1 123 ? 4.333 -29.738 7.830 1.00 64.59 ? 124 GLN C O 1 ATOM 7458 C CB . GLN E 1 123 ? 6.270 -27.319 8.735 1.00 51.52 ? 124 GLN C CB 1 ATOM 7459 C CG . GLN E 1 123 ? 7.184 -28.540 8.745 1.00 49.76 ? 124 GLN C CG 1 ATOM 7460 C CD . GLN E 1 123 ? 8.045 -28.650 9.992 1.00 53.22 ? 124 GLN C CD 1 ATOM 7461 O OE1 . GLN E 1 123 ? 7.848 -27.929 10.971 1.00 57.78 ? 124 GLN C OE1 1 ATOM 7462 N NE2 . GLN E 1 123 ? 9.004 -29.565 9.962 1.00 51.13 ? 124 GLN C NE2 1 ATOM 7463 N N . LEU E 1 124 ? 3.252 -28.250 9.127 1.00 60.91 ? 125 LEU C N 1 ATOM 7464 C CA . LEU E 1 124 ? 2.326 -29.224 9.693 1.00 64.19 ? 125 LEU C CA 1 ATOM 7465 C C . LEU E 1 124 ? 1.476 -29.903 8.623 1.00 68.09 ? 125 LEU C C 1 ATOM 7466 O O . LEU E 1 124 ? 1.165 -31.088 8.734 1.00 75.34 ? 125 LEU C O 1 ATOM 7467 C CB . LEU E 1 124 ? 1.425 -28.552 10.729 1.00 65.44 ? 125 LEU C CB 1 ATOM 7468 C CG . LEU E 1 124 ? 2.138 -28.100 12.005 1.00 67.66 ? 125 LEU C CG 1 ATOM 7469 C CD1 . LEU E 1 124 ? 1.264 -27.154 12.816 1.00 70.56 ? 125 LEU C CD1 1 ATOM 7470 C CD2 . LEU E 1 124 ? 2.550 -29.303 12.840 1.00 67.13 ? 125 LEU C CD2 1 ATOM 7471 N N . LYS E 1 125 ? 1.110 -29.160 7.583 1.00 68.15 ? 126 LYS C N 1 ATOM 7472 C CA . LYS E 1 125 ? 0.300 -29.729 6.510 1.00 74.50 ? 126 LYS C CA 1 ATOM 7473 C C . LYS E 1 125 ? 1.165 -30.399 5.442 1.00 76.49 ? 126 LYS C C 1 ATOM 7474 O O . LYS E 1 125 ? 0.758 -30.524 4.288 1.00 83.24 ? 126 LYS C O 1 ATOM 7475 C CB . LYS E 1 125 ? -0.591 -28.654 5.879 1.00 73.01 ? 126 LYS C CB 1 ATOM 7476 C CG . LYS E 1 125 ? 0.151 -27.483 5.265 1.00 71.29 ? 126 LYS C CG 1 ATOM 7477 C CD . LYS E 1 125 ? -0.822 -26.488 4.649 1.00 74.87 ? 126 LYS C CD 1 ATOM 7478 C CE . LYS E 1 125 ? -0.089 -25.349 3.958 1.00 79.14 ? 126 LYS C CE 1 ATOM 7479 N NZ . LYS E 1 125 ? -1.026 -24.335 3.402 1.00 81.00 ? 126 LYS C NZ 1 ATOM 7480 N N . SER E 1 126 ? 2.358 -30.833 5.836 1.00 73.47 ? 127 SER C N 1 ATOM 7481 C CA . SER E 1 126 ? 3.236 -31.577 4.942 1.00 71.69 ? 127 SER C CA 1 ATOM 7482 C C . SER E 1 126 ? 3.562 -32.944 5.539 1.00 68.80 ? 127 SER C C 1 ATOM 7483 O O . SER E 1 126 ? 4.127 -33.805 4.864 1.00 67.84 ? 127 SER C O 1 ATOM 7484 C CB . SER E 1 126 ? 4.525 -30.799 4.666 1.00 76.00 ? 127 SER C CB 1 ATOM 7485 O OG . SER E 1 126 ? 5.408 -30.855 5.775 1.00 81.06 ? 127 SER C OG 1 ATOM 7486 N N . GLY E 1 127 ? 3.213 -33.133 6.809 1.00 64.56 ? 128 GLY C N 1 ATOM 7487 C CA . GLY E 1 127 ? 3.362 -34.424 7.457 1.00 64.27 ? 128 GLY C CA 1 ATOM 7488 C C . GLY E 1 127 ? 4.355 -34.468 8.605 1.00 66.01 ? 128 GLY C C 1 ATOM 7489 O O . GLY E 1 127 ? 4.435 -35.470 9.316 1.00 62.41 ? 128 GLY C O 1 ATOM 7490 N N . THR E 1 128 ? 5.108 -33.387 8.795 1.00 72.64 ? 129 THR C N 1 ATOM 7491 C CA . THR E 1 128 ? 6.155 -33.358 9.816 1.00 70.87 ? 129 THR C CA 1 ATOM 7492 C C . THR E 1 128 ? 6.067 -32.097 10.676 1.00 60.11 ? 129 THR C C 1 ATOM 7493 O O . THR E 1 128 ? 5.551 -31.075 10.232 1.00 59.87 ? 129 THR C O 1 ATOM 7494 C CB . THR E 1 128 ? 7.559 -33.439 9.174 1.00 76.33 ? 129 THR C CB 1 ATOM 7495 O OG1 . THR E 1 128 ? 7.537 -34.368 8.083 1.00 81.42 ? 129 THR C OG1 1 ATOM 7496 C CG2 . THR E 1 128 ? 8.599 -33.886 10.192 1.00 76.08 ? 129 THR C CG2 1 ATOM 7497 N N . ALA E 1 129 ? 6.562 -32.177 11.908 1.00 54.06 ? 130 ALA C N 1 ATOM 7498 C CA . ALA E 1 129 ? 6.592 -31.024 12.804 1.00 53.43 ? 130 ALA C CA 1 ATOM 7499 C C . ALA E 1 129 ? 7.963 -30.857 13.452 1.00 55.35 ? 130 ALA C C 1 ATOM 7500 O O . ALA E 1 129 ? 8.461 -31.767 14.116 1.00 57.41 ? 130 ALA C O 1 ATOM 7501 C CB . ALA E 1 129 ? 5.519 -31.150 13.872 1.00 48.90 ? 130 ALA C CB 1 ATOM 7502 N N . SER E 1 130 ? 8.567 -29.688 13.255 1.00 51.48 ? 131 SER C N 1 ATOM 7503 C CA . SER E 1 130 ? 9.862 -29.380 13.850 1.00 49.75 ? 131 SER C CA 1 ATOM 7504 C C . SER E 1 130 ? 9.725 -28.362 14.976 1.00 53.53 ? 131 SER C C 1 ATOM 7505 O O . SER E 1 130 ? 9.140 -27.296 14.790 1.00 62.15 ? 131 SER C O 1 ATOM 7506 C CB . SER E 1 130 ? 10.833 -28.851 12.791 1.00 44.77 ? 131 SER C CB 1 ATOM 7507 O OG . SER E 1 130 ? 11.153 -29.847 11.837 1.00 47.84 ? 131 SER C OG 1 ATOM 7508 N N . VAL E 1 131 ? 10.265 -28.692 16.144 1.00 42.42 ? 132 VAL C N 1 ATOM 7509 C CA . VAL E 1 131 ? 10.267 -27.763 17.265 1.00 39.17 ? 132 VAL C CA 1 ATOM 7510 C C . VAL E 1 131 ? 11.705 -27.352 17.560 1.00 41.52 ? 132 VAL C C 1 ATOM 7511 O O . VAL E 1 131 ? 12.563 -28.205 17.793 1.00 43.65 ? 132 VAL C O 1 ATOM 7512 C CB . VAL E 1 131 ? 9.624 -28.382 18.519 1.00 40.70 ? 132 VAL C CB 1 ATOM 7513 C CG1 . VAL E 1 131 ? 9.417 -27.319 19.585 1.00 38.89 ? 132 VAL C CG1 1 ATOM 7514 C CG2 . VAL E 1 131 ? 8.298 -29.039 18.159 1.00 36.24 ? 132 VAL C CG2 1 ATOM 7515 N N . VAL E 1 132 ? 11.975 -26.051 17.541 1.00 35.49 ? 133 VAL C N 1 ATOM 7516 C CA . VAL E 1 132 ? 13.352 -25.581 17.649 1.00 37.13 ? 133 VAL C CA 1 ATOM 7517 C C . VAL E 1 132 ? 13.626 -24.820 18.943 1.00 42.46 ? 133 VAL C C 1 ATOM 7518 O O . VAL E 1 132 ? 12.894 -23.898 19.306 1.00 39.92 ? 133 VAL C O 1 ATOM 7519 C CB . VAL E 1 132 ? 13.725 -24.677 16.459 1.00 35.52 ? 133 VAL C CB 1 ATOM 7520 C CG1 . VAL E 1 132 ? 15.178 -24.244 16.562 1.00 33.44 ? 133 VAL C CG1 1 ATOM 7521 C CG2 . VAL E 1 132 ? 13.477 -25.402 15.148 1.00 32.87 ? 133 VAL C CG2 1 ATOM 7522 N N . CYS E 1 133 ? 14.686 -25.225 19.636 1.00 45.63 ? 134 CYS C N 1 ATOM 7523 C CA . CYS E 1 133 ? 15.180 -24.490 20.793 1.00 48.05 ? 134 CYS C CA 1 ATOM 7524 C C . CYS E 1 133 ? 16.482 -23.784 20.423 1.00 56.06 ? 134 CYS C C 1 ATOM 7525 O O . CYS E 1 133 ? 17.318 -24.344 19.713 1.00 57.88 ? 134 CYS C O 1 ATOM 7526 C CB . CYS E 1 133 ? 15.397 -25.425 21.979 1.00 44.36 ? 134 CYS C CB 1 ATOM 7527 S SG . CYS E 1 133 ? 15.659 -24.585 23.550 1.00 87.64 ? 134 CYS C SG 1 ATOM 7528 N N . LEU E 1 134 ? 16.654 -22.558 20.901 1.00 51.65 ? 135 LEU C N 1 ATOM 7529 C CA . LEU E 1 134 ? 17.829 -21.771 20.549 1.00 46.82 ? 135 LEU C CA 1 ATOM 7530 C C . LEU E 1 134 ? 18.580 -21.284 21.784 1.00 46.39 ? 135 LEU C C 1 ATOM 7531 O O . LEU E 1 134 ? 18.010 -20.618 22.647 1.00 50.81 ? 135 LEU C O 1 ATOM 7532 C CB . LEU E 1 134 ? 17.421 -20.581 19.675 1.00 43.54 ? 135 LEU C CB 1 ATOM 7533 C CG . LEU E 1 134 ? 18.468 -19.491 19.438 1.00 42.96 ? 135 LEU C CG 1 ATOM 7534 C CD1 . LEU E 1 134 ? 19.667 -20.031 18.672 1.00 44.91 ? 135 LEU C CD1 1 ATOM 7535 C CD2 . LEU E 1 134 ? 17.847 -18.317 18.705 1.00 44.39 ? 135 LEU C CD2 1 ATOM 7536 N N . LEU E 1 135 ? 19.862 -21.624 21.861 1.00 38.65 ? 136 LEU C N 1 ATOM 7537 C CA . LEU E 1 135 ? 20.727 -21.123 22.921 1.00 40.50 ? 136 LEU C CA 1 ATOM 7538 C C . LEU E 1 135 ? 21.689 -20.100 22.329 1.00 42.75 ? 136 LEU C C 1 ATOM 7539 O O . LEU E 1 135 ? 22.555 -20.450 21.527 1.00 39.54 ? 136 LEU C O 1 ATOM 7540 C CB . LEU E 1 135 ? 21.504 -22.261 23.583 1.00 47.26 ? 136 LEU C CB 1 ATOM 7541 C CG . LEU E 1 135 ? 20.826 -23.262 24.525 1.00 45.29 ? 136 LEU C CG 1 ATOM 7542 C CD1 . LEU E 1 135 ? 19.686 -24.026 23.860 1.00 38.16 ? 136 LEU C CD1 1 ATOM 7543 C CD2 . LEU E 1 135 ? 21.878 -24.232 25.050 1.00 43.88 ? 136 LEU C CD2 1 ATOM 7544 N N . ASN E 1 136 ? 21.540 -18.839 22.722 1.00 47.35 ? 137 ASN C N 1 ATOM 7545 C CA . ASN E 1 136 ? 22.266 -17.759 22.064 1.00 52.81 ? 137 ASN C CA 1 ATOM 7546 C C . ASN E 1 136 ? 23.369 -17.134 22.922 1.00 50.92 ? 137 ASN C C 1 ATOM 7547 O O . ASN E 1 136 ? 23.156 -16.822 24.096 1.00 52.21 ? 137 ASN C O 1 ATOM 7548 C CB . ASN E 1 136 ? 21.282 -16.670 21.622 1.00 59.99 ? 137 ASN C CB 1 ATOM 7549 C CG . ASN E 1 136 ? 21.676 -16.024 20.302 1.00 63.27 ? 137 ASN C CG 1 ATOM 7550 O OD1 . ASN E 1 136 ? 22.155 -16.696 19.386 1.00 64.70 ? 137 ASN C OD1 1 ATOM 7551 N ND2 . ASN E 1 136 ? 21.474 -14.714 20.199 1.00 59.93 ? 137 ASN C ND2 1 ATOM 7552 N N . ASN E 1 137 ? 24.542 -16.963 22.315 1.00 42.54 ? 138 ASN C N 1 ATOM 7553 C CA . ASN E 1 137 ? 25.667 -16.237 22.912 1.00 47.77 ? 138 ASN C CA 1 ATOM 7554 C C . ASN E 1 137 ? 26.045 -16.697 24.318 1.00 48.48 ? 138 ASN C C 1 ATOM 7555 O O . ASN E 1 137 ? 25.769 -16.012 25.301 1.00 54.96 ? 138 ASN C O 1 ATOM 7556 C CB . ASN E 1 137 ? 25.360 -14.741 22.928 1.00 51.00 ? 138 ASN C CB 1 ATOM 7557 C CG . ASN E 1 137 ? 24.999 -14.210 21.555 1.00 58.13 ? 138 ASN C CG 1 ATOM 7558 O OD1 . ASN E 1 137 ? 25.413 -14.761 20.533 1.00 57.08 ? 138 ASN C OD1 1 ATOM 7559 N ND2 . ASN E 1 137 ? 24.220 -13.135 21.523 1.00 59.80 ? 138 ASN C ND2 1 ATOM 7560 N N . PHE E 1 138 ? 26.685 -17.858 24.404 1.00 42.38 ? 139 PHE C N 1 ATOM 7561 C CA . PHE E 1 138 ? 27.087 -18.416 25.690 1.00 43.94 ? 139 PHE C CA 1 ATOM 7562 C C . PHE E 1 138 ? 28.499 -18.992 25.636 1.00 43.71 ? 139 PHE C C 1 ATOM 7563 O O . PHE E 1 138 ? 29.103 -19.085 24.565 1.00 40.34 ? 139 PHE C O 1 ATOM 7564 C CB . PHE E 1 138 ? 26.100 -19.499 26.138 1.00 44.77 ? 139 PHE C CB 1 ATOM 7565 C CG . PHE E 1 138 ? 26.069 -20.703 25.239 1.00 44.84 ? 139 PHE C CG 1 ATOM 7566 C CD1 . PHE E 1 138 ? 26.915 -21.779 25.474 1.00 44.92 ? 139 PHE C CD1 1 ATOM 7567 C CD2 . PHE E 1 138 ? 25.198 -20.760 24.159 1.00 45.15 ? 139 PHE C CD2 1 ATOM 7568 C CE1 . PHE E 1 138 ? 26.897 -22.886 24.650 1.00 41.74 ? 139 PHE C CE1 1 ATOM 7569 C CE2 . PHE E 1 138 ? 25.173 -21.868 23.328 1.00 41.62 ? 139 PHE C CE2 1 ATOM 7570 C CZ . PHE E 1 138 ? 26.024 -22.934 23.576 1.00 43.48 ? 139 PHE C CZ 1 ATOM 7571 N N . TYR E 1 139 ? 29.006 -19.379 26.803 1.00 44.62 ? 140 TYR C N 1 ATOM 7572 C CA . TYR E 1 139 ? 30.315 -20.017 26.934 1.00 49.54 ? 140 TYR C CA 1 ATOM 7573 C C . TYR E 1 139 ? 30.412 -20.649 28.322 1.00 59.35 ? 140 TYR C C 1 ATOM 7574 O O . TYR E 1 139 ? 29.992 -20.036 29.303 1.00 65.61 ? 140 TYR C O 1 ATOM 7575 C CB . TYR E 1 139 ? 31.453 -19.012 26.721 1.00 48.86 ? 140 TYR C CB 1 ATOM 7576 C CG . TYR E 1 139 ? 32.815 -19.666 26.670 1.00 53.16 ? 140 TYR C CG 1 ATOM 7577 C CD1 . TYR E 1 139 ? 33.556 -19.873 27.828 1.00 54.72 ? 140 TYR C CD1 1 ATOM 7578 C CD2 . TYR E 1 139 ? 33.346 -20.105 25.466 1.00 51.75 ? 140 TYR C CD2 1 ATOM 7579 C CE1 . TYR E 1 139 ? 34.792 -20.490 27.785 1.00 56.20 ? 140 TYR C CE1 1 ATOM 7580 C CE2 . TYR E 1 139 ? 34.581 -20.721 25.412 1.00 50.92 ? 140 TYR C CE2 1 ATOM 7581 C CZ . TYR E 1 139 ? 35.300 -20.911 26.574 1.00 54.67 ? 140 TYR C CZ 1 ATOM 7582 O OH . TYR E 1 139 ? 36.532 -21.525 26.524 1.00 48.32 ? 140 TYR C OH 1 ATOM 7583 N N . PRO E 1 140 ? 30.979 -21.867 28.423 1.00 60.96 ? 141 PRO C N 1 ATOM 7584 C CA . PRO E 1 140 ? 31.613 -22.704 27.394 1.00 54.32 ? 141 PRO C CA 1 ATOM 7585 C C . PRO E 1 140 ? 30.635 -23.351 26.423 1.00 50.06 ? 141 PRO C C 1 ATOM 7586 O O . PRO E 1 140 ? 29.420 -23.274 26.610 1.00 49.52 ? 141 PRO C O 1 ATOM 7587 C CB . PRO E 1 140 ? 32.327 -23.778 28.217 1.00 57.90 ? 141 PRO C CB 1 ATOM 7588 C CG . PRO E 1 140 ? 31.496 -23.906 29.439 1.00 62.27 ? 141 PRO C CG 1 ATOM 7589 C CD . PRO E 1 140 ? 31.027 -22.512 29.748 1.00 63.67 ? 141 PRO C CD 1 ATOM 7590 N N . ARG E 1 141 ? 31.184 -23.990 25.395 1.00 52.96 ? 142 ARG C N 1 ATOM 7591 C CA . ARG E 1 141 ? 30.396 -24.610 24.336 1.00 56.35 ? 142 ARG C CA 1 ATOM 7592 C C . ARG E 1 141 ? 29.530 -25.754 24.856 1.00 61.99 ? 142 ARG C C 1 ATOM 7593 O O . ARG E 1 141 ? 28.425 -25.985 24.365 1.00 59.62 ? 142 ARG C O 1 ATOM 7594 C CB . ARG E 1 141 ? 31.324 -25.115 23.229 1.00 55.08 ? 142 ARG C CB 1 ATOM 7595 C CG . ARG E 1 141 ? 30.631 -25.916 22.148 1.00 58.93 ? 142 ARG C CG 1 ATOM 7596 C CD . ARG E 1 141 ? 31.596 -26.326 21.049 1.00 63.91 ? 142 ARG C CD 1 ATOM 7597 N NE . ARG E 1 141 ? 31.042 -27.404 20.236 1.00 71.86 ? 142 ARG C NE 1 ATOM 7598 C CZ . ARG E 1 141 ? 31.589 -27.855 19.113 1.00 80.02 ? 142 ARG C CZ 1 ATOM 7599 N NH1 . ARG E 1 141 ? 32.712 -27.318 18.655 1.00 84.23 ? 142 ARG C NH1 1 ATOM 7600 N NH2 . ARG E 1 141 ? 31.007 -28.843 18.445 1.00 79.39 ? 142 ARG C NH2 1 ATOM 7601 N N . GLU E 1 142 ? 30.038 -26.464 25.857 1.00 71.08 ? 143 GLU C N 1 ATOM 7602 C CA . GLU E 1 142 ? 29.330 -27.604 26.423 1.00 73.79 ? 143 GLU C CA 1 ATOM 7603 C C . GLU E 1 142 ? 27.997 -27.175 27.031 1.00 73.06 ? 143 GLU C C 1 ATOM 7604 O O . GLU E 1 142 ? 27.947 -26.286 27.881 1.00 75.31 ? 143 GLU C O 1 ATOM 7605 C CB . GLU E 1 142 ? 30.195 -28.305 27.476 1.00 81.00 ? 143 GLU C CB 1 ATOM 7606 C CG . GLU E 1 142 ? 31.539 -28.813 26.954 1.00 87.78 ? 143 GLU C CG 1 ATOM 7607 C CD . GLU E 1 142 ? 32.615 -27.737 26.935 1.00 90.38 ? 143 GLU C CD 1 ATOM 7608 O OE1 . GLU E 1 142 ? 32.822 -27.082 27.979 1.00 93.22 ? 143 GLU C OE1 1 ATOM 7609 O OE2 . GLU E 1 142 ? 33.251 -27.544 25.877 1.00 87.21 ? 143 GLU C OE2 1 ATOM 7610 N N . ALA E 1 143 ? 26.919 -27.806 26.578 1.00 67.84 ? 144 ALA C N 1 ATOM 7611 C CA . ALA E 1 143 ? 25.584 -27.512 27.081 1.00 61.64 ? 144 ALA C CA 1 ATOM 7612 C C . ALA E 1 143 ? 24.681 -28.730 26.936 1.00 64.89 ? 144 ALA C C 1 ATOM 7613 O O . ALA E 1 143 ? 24.812 -29.503 25.986 1.00 66.68 ? 144 ALA C O 1 ATOM 7614 C CB . ALA E 1 143 ? 24.988 -26.319 26.352 1.00 57.10 ? 144 ALA C CB 1 ATOM 7615 N N . LYS E 1 144 ? 23.766 -28.892 27.886 1.00 68.01 ? 145 LYS C N 1 ATOM 7616 C CA . LYS E 1 144 ? 22.860 -30.036 27.906 1.00 70.78 ? 145 LYS C CA 1 ATOM 7617 C C . LYS E 1 144 ? 21.419 -29.596 27.678 1.00 64.22 ? 145 LYS C C 1 ATOM 7618 O O . LYS E 1 144 ? 20.823 -28.931 28.524 1.00 69.35 ? 145 LYS C O 1 ATOM 7619 C CB . LYS E 1 144 ? 22.982 -30.784 29.235 1.00 79.16 ? 145 LYS C CB 1 ATOM 7620 C CG . LYS E 1 144 ? 21.965 -31.893 29.433 1.00 88.43 ? 145 LYS C CG 1 ATOM 7621 C CD . LYS E 1 144 ? 22.127 -32.533 30.803 1.00 98.16 ? 145 LYS C CD 1 ATOM 7622 C CE . LYS E 1 144 ? 21.069 -33.593 31.054 1.00 105.74 ? 145 LYS C CE 1 ATOM 7623 N NZ . LYS E 1 144 ? 21.230 -34.235 32.389 1.00 112.08 ? 145 LYS C NZ 1 ATOM 7624 N N . VAL E 1 145 ? 20.862 -29.970 26.532 1.00 53.43 ? 146 VAL C N 1 ATOM 7625 C CA . VAL E 1 145 ? 19.502 -29.575 26.189 1.00 60.02 ? 146 VAL C CA 1 ATOM 7626 C C . VAL E 1 145 ? 18.561 -30.778 26.167 1.00 67.57 ? 146 VAL C C 1 ATOM 7627 O O . VAL E 1 145 ? 18.789 -31.745 25.440 1.00 70.52 ? 146 VAL C O 1 ATOM 7628 C CB . VAL E 1 145 ? 19.456 -28.863 24.825 1.00 59.19 ? 146 VAL C CB 1 ATOM 7629 C CG1 . VAL E 1 145 ? 18.026 -28.468 24.477 1.00 58.92 ? 146 VAL C CG1 1 ATOM 7630 C CG2 . VAL E 1 145 ? 20.364 -27.643 24.839 1.00 55.17 ? 146 VAL C CG2 1 ATOM 7631 N N . GLN E 1 146 ? 17.502 -30.711 26.968 1.00 70.58 ? 147 GLN C N 1 ATOM 7632 C CA . GLN E 1 146 ? 16.548 -31.809 27.070 1.00 67.50 ? 147 GLN C CA 1 ATOM 7633 C C . GLN E 1 146 ? 15.160 -31.410 26.586 1.00 59.29 ? 147 GLN C C 1 ATOM 7634 O O . GLN E 1 146 ? 14.662 -30.334 26.917 1.00 56.71 ? 147 GLN C O 1 ATOM 7635 C CB . GLN E 1 146 ? 16.464 -32.310 28.512 1.00 77.52 ? 147 GLN C CB 1 ATOM 7636 C CG . GLN E 1 146 ? 17.729 -32.982 29.013 1.00 86.96 ? 147 GLN C CG 1 ATOM 7637 C CD . GLN E 1 146 ? 17.498 -33.768 30.289 1.00 95.01 ? 147 GLN C CD 1 ATOM 7638 O OE1 . GLN E 1 146 ? 18.133 -34.796 30.521 1.00 98.31 ? 147 GLN C OE1 1 ATOM 7639 N NE2 . GLN E 1 146 ? 16.582 -33.287 31.124 1.00 95.50 ? 147 GLN C NE2 1 ATOM 7640 N N . TRP E 1 147 ? 14.540 -32.289 25.804 1.00 57.20 ? 148 TRP C N 1 ATOM 7641 C CA . TRP E 1 147 ? 13.184 -32.063 25.314 1.00 58.45 ? 148 TRP C CA 1 ATOM 7642 C C . TRP E 1 147 ? 12.161 -32.874 26.100 1.00 65.16 ? 148 TRP C C 1 ATOM 7643 O O . TRP E 1 147 ? 12.291 -34.090 26.236 1.00 65.41 ? 148 TRP C O 1 ATOM 7644 C CB . TRP E 1 147 ? 13.080 -32.411 23.828 1.00 54.23 ? 148 TRP C CB 1 ATOM 7645 C CG . TRP E 1 147 ? 13.694 -31.394 22.925 1.00 55.04 ? 148 TRP C CG 1 ATOM 7646 C CD1 . TRP E 1 147 ? 14.938 -31.437 22.362 1.00 56.65 ? 148 TRP C CD1 1 ATOM 7647 C CD2 . TRP E 1 147 ? 13.091 -30.176 22.474 1.00 51.61 ? 148 TRP C CD2 1 ATOM 7648 N NE1 . TRP E 1 147 ? 15.145 -30.320 21.587 1.00 51.38 ? 148 TRP C NE1 1 ATOM 7649 C CE2 . TRP E 1 147 ? 14.026 -29.531 21.640 1.00 51.01 ? 148 TRP C CE2 1 ATOM 7650 C CE3 . TRP E 1 147 ? 11.850 -29.569 22.695 1.00 46.21 ? 148 TRP C CE3 1 ATOM 7651 C CZ2 . TRP E 1 147 ? 13.759 -28.308 21.026 1.00 50.71 ? 148 TRP C CZ2 1 ATOM 7652 C CZ3 . TRP E 1 147 ? 11.589 -28.355 22.088 1.00 46.61 ? 148 TRP C CZ3 1 ATOM 7653 C CH2 . TRP E 1 147 ? 12.538 -27.737 21.263 1.00 46.60 ? 148 TRP C CH2 1 ATOM 7654 N N . LYS E 1 148 ? 11.139 -32.195 26.609 1.00 75.19 ? 149 LYS C N 1 ATOM 7655 C CA . LYS E 1 148 ? 10.074 -32.863 27.345 1.00 87.71 ? 149 LYS C CA 1 ATOM 7656 C C . LYS E 1 148 ? 8.710 -32.568 26.731 1.00 87.25 ? 149 LYS C C 1 ATOM 7657 O O . LYS E 1 148 ? 8.370 -31.414 26.471 1.00 86.17 ? 149 LYS C O 1 ATOM 7658 C CB . LYS E 1 148 ? 10.093 -32.443 28.816 1.00 101.71 ? 149 LYS C CB 1 ATOM 7659 C CG . LYS E 1 148 ? 11.388 -32.786 29.532 1.00 112.82 ? 149 LYS C CG 1 ATOM 7660 C CD . LYS E 1 148 ? 11.292 -32.525 31.026 1.00 123.86 ? 149 LYS C CD 1 ATOM 7661 C CE . LYS E 1 148 ? 12.598 -32.873 31.723 1.00 130.92 ? 149 LYS C CE 1 ATOM 7662 N NZ . LYS E 1 148 ? 12.496 -32.737 33.202 1.00 137.36 ? 149 LYS C NZ 1 ATOM 7663 N N . VAL E 1 149 ? 7.936 -33.622 26.495 1.00 84.97 ? 150 VAL C N 1 ATOM 7664 C CA . VAL E 1 149 ? 6.601 -33.484 25.925 1.00 85.01 ? 150 VAL C CA 1 ATOM 7665 C C . VAL E 1 149 ? 5.560 -34.101 26.858 1.00 93.63 ? 150 VAL C C 1 ATOM 7666 O O . VAL E 1 149 ? 5.549 -35.317 27.070 1.00 92.72 ? 150 VAL C O 1 ATOM 7667 C CB . VAL E 1 149 ? 6.514 -34.145 24.540 1.00 76.12 ? 150 VAL C CB 1 ATOM 7668 C CG1 . VAL E 1 149 ? 5.130 -33.975 23.960 1.00 73.43 ? 150 VAL C CG1 1 ATOM 7669 C CG2 . VAL E 1 149 ? 7.561 -33.557 23.607 1.00 68.37 ? 150 VAL C CG2 1 ATOM 7670 N N . ASP E 1 150 ? 4.685 -33.253 27.396 1.00 99.39 ? 151 ASP C N 1 ATOM 7671 C CA . ASP E 1 150 ? 3.782 -33.629 28.484 1.00 99.95 ? 151 ASP C CA 1 ATOM 7672 C C . ASP E 1 150 ? 4.594 -34.212 29.635 1.00 102.07 ? 151 ASP C C 1 ATOM 7673 O O . ASP E 1 150 ? 4.232 -35.239 30.210 1.00 104.63 ? 151 ASP C O 1 ATOM 7674 C CB . ASP E 1 150 ? 2.713 -34.620 28.014 1.00 96.24 ? 151 ASP C CB 1 ATOM 7675 C CG . ASP E 1 150 ? 1.667 -33.974 27.121 1.00 92.43 ? 151 ASP C CG 1 ATOM 7676 O OD1 . ASP E 1 150 ? 1.496 -32.738 27.191 1.00 88.27 ? 151 ASP C OD1 1 ATOM 7677 O OD2 . ASP E 1 150 ? 1.010 -34.708 26.354 1.00 90.67 ? 151 ASP C OD2 1 ATOM 7678 N N . ASN E 1 151 ? 5.701 -33.540 29.943 1.00 103.16 ? 152 ASN C N 1 ATOM 7679 C CA . ASN E 1 151 ? 6.623 -33.928 31.007 1.00 107.31 ? 152 ASN C CA 1 ATOM 7680 C C . ASN E 1 151 ? 7.250 -35.307 30.794 1.00 102.21 ? 152 ASN C C 1 ATOM 7681 O O . ASN E 1 151 ? 7.592 -35.993 31.757 1.00 105.69 ? 152 ASN C O 1 ATOM 7682 C CB . ASN E 1 151 ? 5.920 -33.885 32.366 1.00 119.48 ? 152 ASN C CB 1 ATOM 7683 C CG . ASN E 1 151 ? 6.855 -33.495 33.491 1.00 128.23 ? 152 ASN C CG 1 ATOM 7684 O OD1 . ASN E 1 151 ? 7.646 -32.562 33.356 1.00 127.16 ? 152 ASN C OD1 1 ATOM 7685 N ND2 . ASN E 1 151 ? 6.777 -34.214 34.606 1.00 135.75 ? 152 ASN C ND2 1 ATOM 7686 N N . ALA E 1 152 ? 7.404 -35.707 29.535 1.00 90.98 ? 153 ALA C N 1 ATOM 7687 C CA . ALA E 1 152 ? 8.070 -36.966 29.211 1.00 78.40 ? 153 ALA C CA 1 ATOM 7688 C C . ALA E 1 152 ? 9.354 -36.721 28.415 1.00 77.35 ? 153 ALA C C 1 ATOM 7689 O O . ALA E 1 152 ? 9.331 -36.092 27.355 1.00 74.61 ? 153 ALA C O 1 ATOM 7690 C CB . ALA E 1 152 ? 7.135 -37.880 28.441 1.00 64.33 ? 153 ALA C CB 1 ATOM 7691 N N . LEU E 1 153 ? 10.471 -37.218 28.939 1.00 77.67 ? 154 LEU C N 1 ATOM 7692 C CA . LEU E 1 153 ? 11.769 -37.070 28.289 1.00 77.44 ? 154 LEU C CA 1 ATOM 7693 C C . LEU E 1 153 ? 11.787 -37.744 26.920 1.00 78.35 ? 154 LEU C C 1 ATOM 7694 O O . LEU E 1 153 ? 11.447 -38.920 26.793 1.00 80.20 ? 154 LEU C O 1 ATOM 7695 C CB . LEU E 1 153 ? 12.877 -37.651 29.171 1.00 77.38 ? 154 LEU C CB 1 ATOM 7696 C CG . LEU E 1 153 ? 14.284 -37.704 28.567 1.00 80.00 ? 154 LEU C CG 1 ATOM 7697 C CD1 . LEU E 1 153 ? 14.922 -36.323 28.538 1.00 81.29 ? 154 LEU C CD1 1 ATOM 7698 C CD2 . LEU E 1 153 ? 15.167 -38.694 29.315 1.00 81.84 ? 154 LEU C CD2 1 ATOM 7699 N N . GLN E 1 154 ? 12.185 -36.990 25.901 1.00 74.54 ? 155 GLN C N 1 ATOM 7700 C CA . GLN E 1 154 ? 12.277 -37.521 24.547 1.00 74.68 ? 155 GLN C CA 1 ATOM 7701 C C . GLN E 1 154 ? 13.667 -38.089 24.289 1.00 73.29 ? 155 GLN C C 1 ATOM 7702 O O . GLN E 1 154 ? 14.643 -37.666 24.909 1.00 71.24 ? 155 GLN C O 1 ATOM 7703 C CB . GLN E 1 154 ? 11.948 -36.437 23.518 1.00 77.07 ? 155 GLN C CB 1 ATOM 7704 C CG . GLN E 1 154 ? 10.571 -35.815 23.691 1.00 79.73 ? 155 GLN C CG 1 ATOM 7705 C CD . GLN E 1 154 ? 9.449 -36.808 23.463 1.00 81.21 ? 155 GLN C CD 1 ATOM 7706 O OE1 . GLN E 1 154 ? 9.466 -37.574 22.499 1.00 80.54 ? 155 GLN C OE1 1 ATOM 7707 N NE2 . GLN E 1 154 ? 8.465 -36.803 24.355 1.00 81.33 ? 155 GLN C NE2 1 ATOM 7708 N N . SER E 1 155 ? 13.753 -39.048 23.372 1.00 73.25 ? 156 SER C N 1 ATOM 7709 C CA . SER E 1 155 ? 15.020 -39.705 23.079 1.00 74.34 ? 156 SER C CA 1 ATOM 7710 C C . SER E 1 155 ? 15.166 -40.044 21.599 1.00 71.53 ? 156 SER C C 1 ATOM 7711 O O . SER E 1 155 ? 14.241 -40.571 20.979 1.00 71.59 ? 156 SER C O 1 ATOM 7712 C CB . SER E 1 155 ? 15.162 -40.978 23.917 1.00 80.45 ? 156 SER C CB 1 ATOM 7713 O OG . SER E 1 155 ? 16.282 -41.739 23.499 1.00 83.93 ? 156 SER C OG 1 ATOM 7714 N N . GLY E 1 156 ? 16.334 -39.734 21.042 1.00 67.19 ? 157 GLY C N 1 ATOM 7715 C CA . GLY E 1 156 ? 16.666 -40.114 19.680 1.00 66.50 ? 157 GLY C CA 1 ATOM 7716 C C . GLY E 1 156 ? 15.805 -39.475 18.605 1.00 67.06 ? 157 GLY C C 1 ATOM 7717 O O . GLY E 1 156 ? 15.659 -40.019 17.508 1.00 65.02 ? 157 GLY C O 1 ATOM 7718 N N . ASN E 1 157 ? 15.233 -38.317 18.918 1.00 67.61 ? 158 ASN C N 1 ATOM 7719 C CA . ASN E 1 157 ? 14.403 -37.595 17.960 1.00 60.62 ? 158 ASN C CA 1 ATOM 7720 C C . ASN E 1 157 ? 14.735 -36.106 17.929 1.00 55.02 ? 158 ASN C C 1 ATOM 7721 O O . ASN E 1 157 ? 13.888 -35.279 17.598 1.00 54.31 ? 158 ASN C O 1 ATOM 7722 C CB . ASN E 1 157 ? 12.919 -37.802 18.276 1.00 52.48 ? 158 ASN C CB 1 ATOM 7723 C CG . ASN E 1 157 ? 12.575 -37.459 19.713 1.00 52.32 ? 158 ASN C CG 1 ATOM 7724 O OD1 . ASN E 1 157 ? 13.462 -37.271 20.546 1.00 50.06 ? 158 ASN C OD1 1 ATOM 7725 N ND2 . ASN E 1 157 ? 11.282 -37.389 20.014 1.00 51.48 ? 158 ASN C ND2 1 ATOM 7726 N N . SER E 1 158 ? 15.974 -35.775 18.281 1.00 54.99 ? 159 SER C N 1 ATOM 7727 C CA . SER E 1 158 ? 16.451 -34.398 18.207 1.00 52.83 ? 159 SER C CA 1 ATOM 7728 C C . SER E 1 158 ? 17.888 -34.354 17.702 1.00 49.30 ? 159 SER C C 1 ATOM 7729 O O . SER E 1 158 ? 18.623 -35.335 17.808 1.00 47.55 ? 159 SER C O 1 ATOM 7730 C CB . SER E 1 158 ? 16.355 -33.711 19.571 1.00 53.62 ? 159 SER C CB 1 ATOM 7731 O OG . SER E 1 158 ? 17.384 -34.150 20.438 1.00 56.05 ? 159 SER C OG 1 ATOM 7732 N N . GLN E 1 159 ? 18.282 -33.214 17.145 1.00 47.10 ? 160 GLN C N 1 ATOM 7733 C CA . GLN E 1 159 ? 19.651 -33.031 16.677 1.00 53.28 ? 160 GLN C CA 1 ATOM 7734 C C . GLN E 1 159 ? 20.159 -31.642 17.030 1.00 51.23 ? 160 GLN C C 1 ATOM 7735 O O . GLN E 1 159 ? 19.390 -30.681 17.076 1.00 49.66 ? 160 GLN C O 1 ATOM 7736 C CB . GLN E 1 159 ? 19.748 -33.263 15.167 1.00 57.56 ? 160 GLN C CB 1 ATOM 7737 C CG . GLN E 1 159 ? 19.592 -34.717 14.753 1.00 62.03 ? 160 GLN C CG 1 ATOM 7738 C CD . GLN E 1 159 ? 19.748 -34.921 13.260 1.00 65.03 ? 160 GLN C CD 1 ATOM 7739 O OE1 . GLN E 1 159 ? 20.792 -35.374 12.791 1.00 67.26 ? 160 GLN C OE1 1 ATOM 7740 N NE2 . GLN E 1 159 ? 18.705 -34.592 12.505 1.00 64.35 ? 160 GLN C NE2 1 ATOM 7741 N N . GLU E 1 160 ? 21.458 -31.540 17.284 1.00 51.58 ? 161 GLU C N 1 ATOM 7742 C CA . GLU E 1 160 ? 22.048 -30.266 17.663 1.00 48.52 ? 161 GLU C CA 1 ATOM 7743 C C . GLU E 1 160 ? 22.987 -29.728 16.594 1.00 46.75 ? 161 GLU C C 1 ATOM 7744 O O . GLU E 1 160 ? 23.634 -30.487 15.875 1.00 49.35 ? 161 GLU C O 1 ATOM 7745 C CB . GLU E 1 160 ? 22.791 -30.397 18.993 1.00 48.97 ? 161 GLU C CB 1 ATOM 7746 C CG . GLU E 1 160 ? 21.877 -30.687 20.173 1.00 58.72 ? 161 GLU C CG 1 ATOM 7747 C CD . GLU E 1 160 ? 22.627 -30.782 21.489 1.00 70.37 ? 161 GLU C CD 1 ATOM 7748 O OE1 . GLU E 1 160 ? 23.870 -30.913 21.462 1.00 78.65 ? 161 GLU C OE1 1 ATOM 7749 O OE2 . GLU E 1 160 ? 21.971 -30.723 22.551 1.00 68.15 ? 161 GLU C OE2 1 ATOM 7750 N N . SER E 1 161 ? 23.040 -28.406 16.492 1.00 47.18 ? 162 SER C N 1 ATOM 7751 C CA . SER E 1 161 ? 24.022 -27.725 15.661 1.00 37.62 ? 162 SER C CA 1 ATOM 7752 C C . SER E 1 161 ? 24.590 -26.557 16.456 1.00 36.07 ? 162 SER C C 1 ATOM 7753 O O . SER E 1 161 ? 23.885 -25.937 17.249 1.00 43.52 ? 162 SER C O 1 ATOM 7754 C CB . SER E 1 161 ? 23.396 -27.244 14.350 1.00 38.24 ? 162 SER C CB 1 ATOM 7755 O OG . SER E 1 161 ? 24.380 -26.709 13.481 1.00 39.23 ? 162 SER C OG 1 ATOM 7756 N N . VAL E 1 162 ? 25.866 -26.260 16.256 1.00 33.02 ? 163 VAL C N 1 ATOM 7757 C CA . VAL E 1 162 ? 26.523 -25.227 17.045 1.00 34.93 ? 163 VAL C CA 1 ATOM 7758 C C . VAL E 1 162 ? 27.413 -24.361 16.159 1.00 37.68 ? 163 VAL C C 1 ATOM 7759 O O . VAL E 1 162 ? 28.133 -24.866 15.299 1.00 39.80 ? 163 VAL C O 1 ATOM 7760 C CB . VAL E 1 162 ? 27.348 -25.852 18.204 1.00 43.95 ? 163 VAL C CB 1 ATOM 7761 C CG1 . VAL E 1 162 ? 28.221 -26.991 17.696 1.00 48.20 ? 163 VAL C CG1 1 ATOM 7762 C CG2 . VAL E 1 162 ? 28.179 -24.796 18.915 1.00 40.12 ? 163 VAL C CG2 1 ATOM 7763 N N . THR E 1 163 ? 27.348 -23.049 16.356 1.00 34.88 ? 164 THR C N 1 ATOM 7764 C CA . THR E 1 163 ? 28.119 -22.133 15.530 1.00 36.35 ? 164 THR C CA 1 ATOM 7765 C C . THR E 1 163 ? 29.604 -22.168 15.885 1.00 36.27 ? 164 THR C C 1 ATOM 7766 O O . THR E 1 163 ? 30.009 -22.775 16.875 1.00 37.58 ? 164 THR C O 1 ATOM 7767 C CB . THR E 1 163 ? 27.599 -20.681 15.660 1.00 42.92 ? 164 THR C CB 1 ATOM 7768 O OG1 . THR E 1 163 ? 27.713 -20.241 17.019 1.00 46.67 ? 164 THR C OG1 1 ATOM 7769 C CG2 . THR E 1 163 ? 26.144 -20.595 15.226 1.00 45.38 ? 164 THR C CG2 1 ATOM 7770 N N . GLU E 1 164 ? 30.411 -21.529 15.048 1.00 35.10 ? 165 GLU C N 1 ATOM 7771 C CA . GLU E 1 164 ? 31.799 -21.245 15.373 1.00 43.01 ? 165 GLU C CA 1 ATOM 7772 C C . GLU E 1 164 ? 31.815 -20.163 16.446 1.00 45.51 ? 165 GLU C C 1 ATOM 7773 O O . GLU E 1 164 ? 30.788 -19.538 16.709 1.00 48.56 ? 165 GLU C O 1 ATOM 7774 C CB . GLU E 1 164 ? 32.561 -20.780 14.130 1.00 46.11 ? 165 GLU C CB 1 ATOM 7775 C CG . GLU E 1 164 ? 32.116 -19.403 13.646 1.00 55.57 ? 165 GLU C CG 1 ATOM 7776 C CD . GLU E 1 164 ? 32.520 -19.101 12.215 1.00 64.54 ? 165 GLU C CD 1 ATOM 7777 O OE1 . GLU E 1 164 ? 33.462 -19.743 11.704 1.00 66.65 ? 165 GLU C OE1 1 ATOM 7778 O OE2 . GLU E 1 164 ? 31.887 -18.217 11.599 1.00 72.72 ? 165 GLU C OE2 1 ATOM 7779 N N . GLN E 1 165 ? 32.967 -19.933 17.065 1.00 46.61 ? 166 GLN C N 1 ATOM 7780 C CA . GLN E 1 165 ? 33.080 -18.840 18.024 1.00 48.54 ? 166 GLN C CA 1 ATOM 7781 C C . GLN E 1 165 ? 32.901 -17.504 17.323 1.00 49.26 ? 166 GLN C C 1 ATOM 7782 O O . GLN E 1 165 ? 33.388 -17.305 16.210 1.00 49.97 ? 166 GLN C O 1 ATOM 7783 C CB . GLN E 1 165 ? 34.427 -18.870 18.745 1.00 46.15 ? 166 GLN C CB 1 ATOM 7784 C CG . GLN E 1 165 ? 34.535 -19.962 19.778 1.00 45.77 ? 166 GLN C CG 1 ATOM 7785 C CD . GLN E 1 165 ? 35.742 -19.800 20.676 1.00 45.84 ? 166 GLN C CD 1 ATOM 7786 O OE1 . GLN E 1 165 ? 36.882 -19.901 20.226 1.00 41.62 ? 166 GLN C OE1 1 ATOM 7787 N NE2 . GLN E 1 165 ? 35.497 -19.547 21.958 1.00 45.39 ? 166 GLN C NE2 1 ATOM 7788 N N . ASP E 1 166 ? 32.190 -16.590 17.968 1.00 52.51 ? 167 ASP C N 1 ATOM 7789 C CA . ASP E 1 166 ? 32.057 -15.252 17.425 1.00 56.74 ? 167 ASP C CA 1 ATOM 7790 C C . ASP E 1 166 ? 33.410 -14.559 17.513 1.00 56.31 ? 167 ASP C C 1 ATOM 7791 O O . ASP E 1 166 ? 34.076 -14.610 18.547 1.00 55.65 ? 167 ASP C O 1 ATOM 7792 C CB . ASP E 1 166 ? 30.981 -14.464 18.166 1.00 63.87 ? 167 ASP C CB 1 ATOM 7793 C CG . ASP E 1 166 ? 30.834 -13.054 17.642 1.00 73.24 ? 167 ASP C CG 1 ATOM 7794 O OD1 . ASP E 1 166 ? 30.178 -12.880 16.593 1.00 77.02 ? 167 ASP C OD1 1 ATOM 7795 O OD2 . ASP E 1 166 ? 31.375 -12.122 18.275 1.00 74.13 ? 167 ASP C OD2 1 ATOM 7796 N N . SER E 1 167 ? 33.811 -13.919 16.422 1.00 58.59 ? 168 SER C N 1 ATOM 7797 C CA . SER E 1 167 ? 35.162 -13.379 16.294 1.00 59.62 ? 168 SER C CA 1 ATOM 7798 C C . SER E 1 167 ? 35.466 -12.239 17.263 1.00 53.29 ? 168 SER C C 1 ATOM 7799 O O . SER E 1 167 ? 36.621 -11.834 17.399 1.00 50.14 ? 168 SER C O 1 ATOM 7800 C CB . SER E 1 167 ? 35.396 -12.900 14.861 1.00 64.36 ? 168 SER C CB 1 ATOM 7801 O OG . SER E 1 167 ? 34.516 -11.837 14.537 1.00 69.42 ? 168 SER C OG 1 ATOM 7802 N N . LYS E 1 168 ? 34.443 -11.724 17.938 1.00 53.46 ? 169 LYS C N 1 ATOM 7803 C CA . LYS E 1 168 ? 34.631 -10.568 18.807 1.00 54.18 ? 169 LYS C CA 1 ATOM 7804 C C . LYS E 1 168 ? 34.466 -10.898 20.291 1.00 61.69 ? 169 LYS C C 1 ATOM 7805 O O . LYS E 1 168 ? 35.286 -10.483 21.109 1.00 64.27 ? 169 LYS C O 1 ATOM 7806 C CB . LYS E 1 168 ? 33.671 -9.447 18.400 1.00 55.48 ? 169 LYS C CB 1 ATOM 7807 C CG . LYS E 1 168 ? 33.677 -9.175 16.901 1.00 64.12 ? 169 LYS C CG 1 ATOM 7808 C CD . LYS E 1 168 ? 33.405 -7.718 16.567 1.00 71.81 ? 169 LYS C CD 1 ATOM 7809 C CE . LYS E 1 168 ? 33.555 -7.477 15.067 1.00 74.51 ? 169 LYS C CE 1 ATOM 7810 N NZ . LYS E 1 168 ? 33.550 -6.029 14.711 1.00 74.59 ? 169 LYS C NZ 1 ATOM 7811 N N . ASP E 1 169 ? 33.423 -11.646 20.647 1.00 61.93 ? 170 ASP C N 1 ATOM 7812 C CA . ASP E 1 169 ? 33.173 -11.939 22.058 1.00 61.73 ? 170 ASP C CA 1 ATOM 7813 C C . ASP E 1 169 ? 33.384 -13.414 22.416 1.00 54.59 ? 170 ASP C C 1 ATOM 7814 O O . ASP E 1 169 ? 33.194 -13.810 23.565 1.00 55.18 ? 170 ASP C O 1 ATOM 7815 C CB . ASP E 1 169 ? 31.758 -11.492 22.451 1.00 69.80 ? 170 ASP C CB 1 ATOM 7816 C CG . ASP E 1 169 ? 30.667 -12.294 21.764 1.00 76.16 ? 170 ASP C CG 1 ATOM 7817 O OD1 . ASP E 1 169 ? 30.981 -13.138 20.901 1.00 72.20 ? 170 ASP C OD1 1 ATOM 7818 O OD2 . ASP E 1 169 ? 29.481 -12.069 22.084 1.00 84.59 ? 170 ASP C OD2 1 ATOM 7819 N N . SER E 1 170 ? 33.764 -14.214 21.422 1.00 49.77 ? 171 SER C N 1 ATOM 7820 C CA . SER E 1 170 ? 34.149 -15.617 21.620 1.00 44.94 ? 171 SER C CA 1 ATOM 7821 C C . SER E 1 170 ? 33.050 -16.511 22.197 1.00 48.21 ? 171 SER C C 1 ATOM 7822 O O . SER E 1 170 ? 33.341 -17.498 22.869 1.00 53.54 ? 171 SER C O 1 ATOM 7823 C CB . SER E 1 170 ? 35.382 -15.702 22.523 1.00 35.04 ? 171 SER C CB 1 ATOM 7824 O OG . SER E 1 170 ? 36.464 -14.974 21.973 1.00 41.74 ? 171 SER C OG 1 ATOM 7825 N N . THR E 1 171 ? 31.794 -16.181 21.924 1.00 44.67 ? 172 THR C N 1 ATOM 7826 C CA . THR E 1 171 ? 30.682 -16.978 22.433 1.00 45.83 ? 172 THR C CA 1 ATOM 7827 C C . THR E 1 171 ? 30.167 -17.966 21.393 1.00 38.72 ? 172 THR C C 1 ATOM 7828 O O . THR E 1 171 ? 30.490 -17.865 20.211 1.00 33.76 ? 172 THR C O 1 ATOM 7829 C CB . THR E 1 171 ? 29.513 -16.086 22.885 1.00 51.78 ? 172 THR C CB 1 ATOM 7830 O OG1 . THR E 1 171 ? 29.097 -15.253 21.794 1.00 51.83 ? 172 THR C OG1 1 ATOM 7831 C CG2 . THR E 1 171 ? 29.934 -15.213 24.057 1.00 53.03 ? 172 THR C CG2 1 ATOM 7832 N N . TYR E 1 172 ? 29.358 -18.918 21.843 1.00 39.16 ? 173 TYR C N 1 ATOM 7833 C CA . TYR E 1 172 ? 28.737 -19.888 20.949 1.00 33.78 ? 173 TYR C CA 1 ATOM 7834 C C . TYR E 1 172 ? 27.233 -19.676 20.865 1.00 39.17 ? 173 TYR C C 1 ATOM 7835 O O . TYR E 1 172 ? 26.634 -19.067 21.748 1.00 44.08 ? 173 TYR C O 1 ATOM 7836 C CB . TYR E 1 172 ? 29.014 -21.317 21.420 1.00 39.08 ? 173 TYR C CB 1 ATOM 7837 C CG . TYR E 1 172 ? 30.466 -21.735 21.382 1.00 43.83 ? 173 TYR C CG 1 ATOM 7838 C CD1 . TYR E 1 172 ? 31.015 -22.302 20.240 1.00 42.14 ? 173 TYR C CD1 1 ATOM 7839 C CD2 . TYR E 1 172 ? 31.285 -21.581 22.496 1.00 40.30 ? 173 TYR C CD2 1 ATOM 7840 C CE1 . TYR E 1 172 ? 32.342 -22.693 20.202 1.00 45.21 ? 173 TYR C CE1 1 ATOM 7841 C CE2 . TYR E 1 172 ? 32.613 -21.970 22.467 1.00 43.84 ? 173 TYR C CE2 1 ATOM 7842 C CZ . TYR E 1 172 ? 33.133 -22.529 21.319 1.00 46.33 ? 173 TYR C CZ 1 ATOM 7843 O OH . TYR E 1 172 ? 34.453 -22.917 21.282 1.00 46.50 ? 173 TYR C OH 1 ATOM 7844 N N . SER E 1 173 ? 26.627 -20.187 19.801 1.00 38.72 ? 174 SER C N 1 ATOM 7845 C CA . SER E 1 173 ? 25.178 -20.314 19.741 1.00 45.63 ? 174 SER C CA 1 ATOM 7846 C C . SER E 1 173 ? 24.828 -21.733 19.319 1.00 49.61 ? 174 SER C C 1 ATOM 7847 O O . SER E 1 173 ? 25.530 -22.339 18.508 1.00 48.34 ? 174 SER C O 1 ATOM 7848 C CB . SER E 1 173 ? 24.565 -19.299 18.777 1.00 47.11 ? 174 SER C CB 1 ATOM 7849 O OG . SER E 1 173 ? 24.713 -17.980 19.272 1.00 46.72 ? 174 SER C OG 1 ATOM 7850 N N . LEU E 1 174 ? 23.744 -22.262 19.875 1.00 49.48 ? 175 LEU C N 1 ATOM 7851 C CA . LEU E 1 174 ? 23.355 -23.643 19.615 1.00 41.88 ? 175 LEU C CA 1 ATOM 7852 C C . LEU E 1 174 ? 21.875 -23.757 19.274 1.00 38.60 ? 175 LEU C C 1 ATOM 7853 O O . LEU E 1 174 ? 21.050 -23.009 19.800 1.00 40.77 ? 175 LEU C O 1 ATOM 7854 C CB . LEU E 1 174 ? 23.686 -24.518 20.828 1.00 37.30 ? 175 LEU C CB 1 ATOM 7855 C CG . LEU E 1 174 ? 23.387 -26.017 20.759 1.00 36.88 ? 175 LEU C CG 1 ATOM 7856 C CD1 . LEU E 1 174 ? 24.485 -26.790 21.472 1.00 41.67 ? 175 LEU C CD1 1 ATOM 7857 C CD2 . LEU E 1 174 ? 22.029 -26.338 21.374 1.00 34.88 ? 175 LEU C CD2 1 ATOM 7858 N N . SER E 1 175 ? 21.548 -24.698 18.392 1.00 33.17 ? 176 SER C N 1 ATOM 7859 C CA . SER E 1 175 ? 20.158 -25.044 18.115 1.00 39.79 ? 176 SER C CA 1 ATOM 7860 C C . SER E 1 175 ? 19.905 -26.530 18.360 1.00 40.72 ? 176 SER C C 1 ATOM 7861 O O . SER E 1 175 ? 20.748 -27.372 18.051 1.00 41.80 ? 176 SER C O 1 ATOM 7862 C CB . SER E 1 175 ? 19.782 -24.686 16.676 1.00 43.52 ? 176 SER C CB 1 ATOM 7863 O OG . SER E 1 175 ? 20.512 -25.473 15.751 1.00 49.24 ? 176 SER C OG 1 ATOM 7864 N N . SER E 1 176 ? 18.743 -26.838 18.925 1.00 41.72 ? 177 SER C N 1 ATOM 7865 C CA . SER E 1 176 ? 18.293 -28.215 19.079 1.00 41.47 ? 177 SER C CA 1 ATOM 7866 C C . SER E 1 176 ? 16.926 -28.378 18.420 1.00 42.67 ? 177 SER C C 1 ATOM 7867 O O . SER E 1 176 ? 15.985 -27.655 18.742 1.00 44.23 ? 177 SER C O 1 ATOM 7868 C CB . SER E 1 176 ? 18.232 -28.606 20.555 1.00 46.44 ? 177 SER C CB 1 ATOM 7869 O OG . SER E 1 176 ? 17.838 -29.959 20.703 1.00 48.59 ? 177 SER C OG 1 ATOM 7870 N N . THR E 1 177 ? 16.820 -29.326 17.496 1.00 45.83 ? 178 THR C N 1 ATOM 7871 C CA . THR E 1 177 ? 15.604 -29.488 16.709 1.00 43.04 ? 178 THR C CA 1 ATOM 7872 C C . THR E 1 177 ? 14.893 -30.806 16.993 1.00 51.48 ? 178 THR C C 1 ATOM 7873 O O . THR E 1 177 ? 15.383 -31.876 16.636 1.00 55.92 ? 178 THR C O 1 ATOM 7874 C CB . THR E 1 177 ? 15.906 -29.413 15.203 1.00 43.05 ? 178 THR C CB 1 ATOM 7875 O OG1 . THR E 1 177 ? 16.506 -28.148 14.895 1.00 43.03 ? 178 THR C OG1 1 ATOM 7876 C CG2 . THR E 1 177 ? 14.631 -29.582 14.395 1.00 45.50 ? 178 THR C CG2 1 ATOM 7877 N N . LEU E 1 178 ? 13.731 -30.720 17.631 1.00 54.48 ? 179 LEU C N 1 ATOM 7878 C CA . LEU E 1 178 ? 12.893 -31.892 17.864 1.00 50.66 ? 179 LEU C CA 1 ATOM 7879 C C . LEU E 1 178 ? 12.102 -32.212 16.602 1.00 52.44 ? 179 LEU C C 1 ATOM 7880 O O . LEU E 1 178 ? 11.397 -31.354 16.074 1.00 56.47 ? 179 LEU C O 1 ATOM 7881 C CB . LEU E 1 178 ? 11.944 -31.653 19.040 1.00 46.36 ? 179 LEU C CB 1 ATOM 7882 C CG . LEU E 1 178 ? 11.235 -32.880 19.617 1.00 50.90 ? 179 LEU C CG 1 ATOM 7883 C CD1 . LEU E 1 178 ? 12.220 -33.761 20.371 1.00 47.51 ? 179 LEU C CD1 1 ATOM 7884 C CD2 . LEU E 1 178 ? 10.083 -32.464 20.517 1.00 46.92 ? 179 LEU C CD2 1 ATOM 7885 N N . THR E 1 179 ? 12.223 -33.442 16.113 1.00 51.46 ? 180 THR C N 1 ATOM 7886 C CA . THR E 1 179 ? 11.518 -33.842 14.900 1.00 54.46 ? 180 THR C CA 1 ATOM 7887 C C . THR E 1 179 ? 10.426 -34.865 15.198 1.00 57.77 ? 180 THR C C 1 ATOM 7888 O O . THR E 1 179 ? 10.710 -35.999 15.587 1.00 61.47 ? 180 THR C O 1 ATOM 7889 C CB . THR E 1 179 ? 12.485 -34.424 13.854 1.00 58.93 ? 180 THR C CB 1 ATOM 7890 O OG1 . THR E 1 179 ? 13.509 -33.464 13.563 1.00 65.30 ? 180 THR C OG1 1 ATOM 7891 C CG2 . THR E 1 179 ? 11.740 -34.772 12.575 1.00 56.78 ? 180 THR C CG2 1 ATOM 7892 N N . LEU E 1 180 ? 9.176 -34.453 15.015 1.00 55.73 ? 181 LEU C N 1 ATOM 7893 C CA . LEU E 1 180 ? 8.033 -35.328 15.248 1.00 53.99 ? 181 LEU C CA 1 ATOM 7894 C C . LEU E 1 180 ? 7.155 -35.429 14.009 1.00 57.17 ? 181 LEU C C 1 ATOM 7895 O O . LEU E 1 180 ? 7.257 -34.614 13.091 1.00 54.14 ? 181 LEU C O 1 ATOM 7896 C CB . LEU E 1 180 ? 7.199 -34.821 16.425 1.00 55.30 ? 181 LEU C CB 1 ATOM 7897 C CG . LEU E 1 180 ? 7.920 -34.580 17.751 1.00 60.49 ? 181 LEU C CG 1 ATOM 7898 C CD1 . LEU E 1 180 ? 6.968 -33.962 18.760 1.00 61.42 ? 181 LEU C CD1 1 ATOM 7899 C CD2 . LEU E 1 180 ? 8.510 -35.874 18.287 1.00 60.12 ? 181 LEU C CD2 1 ATOM 7900 N N . SER E 1 181 ? 6.289 -36.435 13.989 1.00 60.39 ? 182 SER C N 1 ATOM 7901 C CA . SER E 1 181 ? 5.270 -36.536 12.955 1.00 60.69 ? 182 SER C CA 1 ATOM 7902 C C . SER E 1 181 ? 4.111 -35.615 13.316 1.00 59.35 ? 182 SER C C 1 ATOM 7903 O O . SER E 1 181 ? 3.950 -35.255 14.483 1.00 57.53 ? 182 SER C O 1 ATOM 7904 C CB . SER E 1 181 ? 4.787 -37.978 12.808 1.00 67.46 ? 182 SER C CB 1 ATOM 7905 O OG . SER E 1 181 ? 4.207 -38.443 14.015 1.00 73.47 ? 182 SER C OG 1 ATOM 7906 N N . LYS E 1 182 ? 3.313 -35.232 12.320 1.00 59.77 ? 183 LYS C N 1 ATOM 7907 C CA . LYS E 1 182 ? 2.142 -34.393 12.561 1.00 63.99 ? 183 LYS C CA 1 ATOM 7908 C C . LYS E 1 182 ? 1.209 -35.046 13.575 1.00 65.96 ? 183 LYS C C 1 ATOM 7909 O O . LYS E 1 182 ? 0.636 -34.371 14.428 1.00 70.26 ? 183 LYS C O 1 ATOM 7910 C CB . LYS E 1 182 ? 1.381 -34.122 11.259 1.00 66.08 ? 183 LYS C CB 1 ATOM 7911 C CG . LYS E 1 182 ? 0.121 -33.285 11.458 1.00 68.56 ? 183 LYS C CG 1 ATOM 7912 C CD . LYS E 1 182 ? -0.750 -33.236 10.211 1.00 69.18 ? 183 LYS C CD 1 ATOM 7913 C CE . LYS E 1 182 ? -1.963 -32.338 10.433 1.00 71.61 ? 183 LYS C CE 1 ATOM 7914 N NZ . LYS E 1 182 ? -2.900 -32.335 9.273 1.00 73.35 ? 183 LYS C NZ 1 ATOM 7915 N N . ALA E 1 183 ? 1.076 -36.365 13.475 1.00 63.09 ? 184 ALA C N 1 ATOM 7916 C CA . ALA E 1 183 ? 0.211 -37.129 14.365 1.00 64.86 ? 184 ALA C CA 1 ATOM 7917 C C . ALA E 1 183 ? 0.640 -37.002 15.824 1.00 69.25 ? 184 ALA C C 1 ATOM 7918 O O . ALA E 1 183 ? -0.150 -36.597 16.676 1.00 68.81 ? 184 ALA C O 1 ATOM 7919 C CB . ALA E 1 183 ? 0.195 -38.589 13.949 1.00 59.54 ? 184 ALA C CB 1 ATOM 7920 N N . ASP E 1 184 ? 1.895 -37.343 16.104 1.00 73.67 ? 185 ASP C N 1 ATOM 7921 C CA . ASP E 1 184 ? 2.404 -37.318 17.473 1.00 79.33 ? 185 ASP C CA 1 ATOM 7922 C C . ASP E 1 184 ? 2.430 -35.905 18.050 1.00 77.21 ? 185 ASP C C 1 ATOM 7923 O O . ASP E 1 184 ? 2.320 -35.722 19.263 1.00 79.53 ? 185 ASP C O 1 ATOM 7924 C CB . ASP E 1 184 ? 3.805 -37.937 17.538 1.00 86.85 ? 185 ASP C CB 1 ATOM 7925 C CG . ASP E 1 184 ? 3.790 -39.445 17.336 1.00 96.73 ? 185 ASP C CG 1 ATOM 7926 O OD1 . ASP E 1 184 ? 2.719 -40.066 17.505 1.00 99.42 ? 185 ASP C OD1 1 ATOM 7927 O OD2 . ASP E 1 184 ? 4.855 -40.013 17.014 1.00 98.84 ? 185 ASP C OD2 1 ATOM 7928 N N . TYR E 1 185 ? 2.569 -34.906 17.183 1.00 70.43 ? 186 TYR C N 1 ATOM 7929 C CA . TYR E 1 185 ? 2.588 -33.520 17.636 1.00 68.46 ? 186 TYR C CA 1 ATOM 7930 C C . TYR E 1 185 ? 1.201 -33.038 18.051 1.00 70.34 ? 186 TYR C C 1 ATOM 7931 O O . TYR E 1 185 ? 1.047 -32.369 19.073 1.00 67.82 ? 186 TYR C O 1 ATOM 7932 C CB . TYR E 1 185 ? 3.147 -32.595 16.553 1.00 64.75 ? 186 TYR C CB 1 ATOM 7933 C CG . TYR E 1 185 ? 3.100 -31.135 16.948 1.00 62.64 ? 186 TYR C CG 1 ATOM 7934 C CD1 . TYR E 1 185 ? 3.990 -30.623 17.884 1.00 59.69 ? 186 TYR C CD1 1 ATOM 7935 C CD2 . TYR E 1 185 ? 2.161 -30.271 16.396 1.00 60.72 ? 186 TYR C CD2 1 ATOM 7936 C CE1 . TYR E 1 185 ? 3.950 -29.295 18.258 1.00 58.91 ? 186 TYR C CE1 1 ATOM 7937 C CE2 . TYR E 1 185 ? 2.115 -28.938 16.762 1.00 59.28 ? 186 TYR C CE2 1 ATOM 7938 C CZ . TYR E 1 185 ? 3.012 -28.457 17.695 1.00 57.32 ? 186 TYR C CZ 1 ATOM 7939 O OH . TYR E 1 185 ? 2.973 -27.134 18.066 1.00 54.81 ? 186 TYR C OH 1 ATOM 7940 N N . GLU E 1 186 ? 0.196 -33.376 17.251 1.00 75.58 ? 187 GLU C N 1 ATOM 7941 C CA . GLU E 1 186 ? -1.167 -32.928 17.511 1.00 83.38 ? 187 GLU C CA 1 ATOM 7942 C C . GLU E 1 186 ? -1.782 -33.632 18.718 1.00 85.60 ? 187 GLU C C 1 ATOM 7943 O O . GLU E 1 186 ? -2.803 -33.192 19.246 1.00 86.64 ? 187 GLU C O 1 ATOM 7944 C CB . GLU E 1 186 ? -2.048 -33.149 16.277 1.00 87.80 ? 187 GLU C CB 1 ATOM 7945 C CG . GLU E 1 186 ? -1.693 -32.281 15.075 1.00 92.39 ? 187 GLU C CG 1 ATOM 7946 C CD . GLU E 1 186 ? -2.146 -30.838 15.227 1.00 98.22 ? 187 GLU C CD 1 ATOM 7947 O OE1 . GLU E 1 186 ? -1.925 -30.045 14.286 1.00 101.01 ? 187 GLU C OE1 1 ATOM 7948 O OE2 . GLU E 1 186 ? -2.724 -30.495 16.280 1.00 98.55 ? 187 GLU C OE2 1 ATOM 7949 N N . LYS E 1 187 ? -1.157 -34.721 19.154 1.00 85.47 ? 188 LYS C N 1 ATOM 7950 C CA . LYS E 1 187 ? -1.676 -35.505 20.268 1.00 89.03 ? 188 LYS C CA 1 ATOM 7951 C C . LYS E 1 187 ? -1.379 -34.863 21.622 1.00 89.19 ? 188 LYS C C 1 ATOM 7952 O O . LYS E 1 187 ? -2.229 -34.857 22.513 1.00 91.92 ? 188 LYS C O 1 ATOM 7953 C CB . LYS E 1 187 ? -1.107 -36.926 20.230 1.00 91.91 ? 188 LYS C CB 1 ATOM 7954 C CG . LYS E 1 187 ? -1.454 -37.758 21.454 1.00 102.91 ? 188 LYS C CG 1 ATOM 7955 C CD . LYS E 1 187 ? -1.439 -39.248 21.153 1.00 109.94 ? 188 LYS C CD 1 ATOM 7956 C CE . LYS E 1 187 ? -1.929 -40.047 22.353 1.00 114.53 ? 188 LYS C CE 1 ATOM 7957 N NZ . LYS E 1 187 ? -2.228 -41.463 22.006 1.00 118.77 ? 188 LYS C NZ 1 ATOM 7958 N N . HIS E 1 188 ? -0.177 -34.315 21.770 1.00 87.18 ? 189 HIS C N 1 ATOM 7959 C CA . HIS E 1 188 ? 0.258 -33.773 23.053 1.00 83.62 ? 189 HIS C CA 1 ATOM 7960 C C . HIS E 1 188 ? 0.042 -32.264 23.161 1.00 80.27 ? 189 HIS C C 1 ATOM 7961 O O . HIS E 1 188 ? -0.318 -31.606 22.184 1.00 74.56 ? 189 HIS C O 1 ATOM 7962 C CB . HIS E 1 188 ? 1.728 -34.112 23.286 1.00 83.48 ? 189 HIS C CB 1 ATOM 7963 C CG . HIS E 1 188 ? 2.010 -35.582 23.317 1.00 86.65 ? 189 HIS C CG 1 ATOM 7964 N ND1 . HIS E 1 188 ? 1.935 -36.331 24.473 1.00 88.55 ? 189 HIS C ND1 1 ATOM 7965 C CD2 . HIS E 1 188 ? 2.364 -36.444 22.334 1.00 85.79 ? 189 HIS C CD2 1 ATOM 7966 C CE1 . HIS E 1 188 ? 2.231 -37.589 24.200 1.00 88.66 ? 189 HIS C CE1 1 ATOM 7967 N NE2 . HIS E 1 188 ? 2.495 -37.684 22.909 1.00 88.58 ? 189 HIS C NE2 1 ATOM 7968 N N . LYS E 1 189 ? 0.266 -31.723 24.356 1.00 84.90 ? 190 LYS C N 1 ATOM 7969 C CA . LYS E 1 189 ? -0.010 -30.315 24.633 1.00 90.71 ? 190 LYS C CA 1 ATOM 7970 C C . LYS E 1 189 ? 1.248 -29.477 24.852 1.00 90.23 ? 190 LYS C C 1 ATOM 7971 O O . LYS E 1 189 ? 1.604 -28.648 24.014 1.00 90.78 ? 190 LYS C O 1 ATOM 7972 C CB . LYS E 1 189 ? -0.921 -30.186 25.857 1.00 94.87 ? 190 LYS C CB 1 ATOM 7973 C CG . LYS E 1 189 ? -2.397 -30.045 25.524 1.00 101.02 ? 190 LYS C CG 1 ATOM 7974 C CD . LYS E 1 189 ? -2.666 -28.760 24.753 1.00 104.24 ? 190 LYS C CD 1 ATOM 7975 C CE . LYS E 1 189 ? -4.139 -28.621 24.406 1.00 107.41 ? 190 LYS C CE 1 ATOM 7976 N NZ . LYS E 1 189 ? -4.419 -27.377 23.637 1.00 107.62 ? 190 LYS C NZ 1 ATOM 7977 N N . VAL E 1 190 ? 1.909 -29.687 25.987 1.00 88.77 ? 191 VAL C N 1 ATOM 7978 C CA . VAL E 1 190 ? 3.045 -28.857 26.377 1.00 85.79 ? 191 VAL C CA 1 ATOM 7979 C C . VAL E 1 190 ? 4.376 -29.388 25.840 1.00 81.26 ? 191 VAL C C 1 ATOM 7980 O O . VAL E 1 190 ? 4.697 -30.567 25.987 1.00 83.95 ? 191 VAL C O 1 ATOM 7981 C CB . VAL E 1 190 ? 3.128 -28.721 27.918 1.00 88.62 ? 191 VAL C CB 1 ATOM 7982 C CG1 . VAL E 1 190 ? 2.941 -30.073 28.591 1.00 92.74 ? 191 VAL C CG1 1 ATOM 7983 C CG2 . VAL E 1 190 ? 4.443 -28.076 28.338 1.00 88.46 ? 191 VAL C CG2 1 ATOM 7984 N N . TYR E 1 191 ? 5.138 -28.502 25.203 1.00 74.72 ? 192 TYR C N 1 ATOM 7985 C CA . TYR E 1 191 ? 6.470 -28.831 24.705 1.00 68.20 ? 192 TYR C CA 1 ATOM 7986 C C . TYR E 1 191 ? 7.506 -27.953 25.393 1.00 70.07 ? 192 TYR C C 1 ATOM 7987 O O . TYR E 1 191 ? 7.427 -26.726 25.331 1.00 71.05 ? 192 TYR C O 1 ATOM 7988 C CB . TYR E 1 191 ? 6.538 -28.659 23.188 1.00 59.19 ? 192 TYR C CB 1 ATOM 7989 C CG . TYR E 1 191 ? 5.591 -29.570 22.449 1.00 63.31 ? 192 TYR C CG 1 ATOM 7990 C CD1 . TYR E 1 191 ? 4.263 -29.211 22.251 1.00 66.78 ? 192 TYR C CD1 1 ATOM 7991 C CD2 . TYR E 1 191 ? 6.020 -30.797 21.960 1.00 62.15 ? 192 TYR C CD2 1 ATOM 7992 C CE1 . TYR E 1 191 ? 3.392 -30.046 21.585 1.00 67.39 ? 192 TYR C CE1 1 ATOM 7993 C CE2 . TYR E 1 191 ? 5.157 -31.639 21.290 1.00 64.21 ? 192 TYR C CE2 1 ATOM 7994 C CZ . TYR E 1 191 ? 3.843 -31.258 21.108 1.00 67.60 ? 192 TYR C CZ 1 ATOM 7995 O OH . TYR E 1 191 ? 2.976 -32.089 20.442 1.00 68.14 ? 192 TYR C OH 1 ATOM 7996 N N . ALA E 1 192 ? 8.473 -28.581 26.052 1.00 68.33 ? 193 ALA C N 1 ATOM 7997 C CA . ALA E 1 192 ? 9.427 -27.842 26.868 1.00 69.74 ? 193 ALA C CA 1 ATOM 7998 C C . ALA E 1 192 ? 10.874 -28.045 26.429 1.00 68.69 ? 193 ALA C C 1 ATOM 7999 O O . ALA E 1 192 ? 11.239 -29.093 25.897 1.00 66.22 ? 193 ALA C O 1 ATOM 8000 C CB . ALA E 1 192 ? 9.270 -28.229 28.328 1.00 70.85 ? 193 ALA C CB 1 ATOM 8001 N N . CYS E 1 193 ? 11.688 -27.023 26.666 1.00 66.30 ? 194 CYS C N 1 ATOM 8002 C CA . CYS E 1 193 ? 13.117 -27.080 26.401 1.00 62.91 ? 194 CYS C CA 1 ATOM 8003 C C . CYS E 1 193 ? 13.873 -26.847 27.704 1.00 63.19 ? 194 CYS C C 1 ATOM 8004 O O . CYS E 1 193 ? 13.787 -25.771 28.292 1.00 63.19 ? 194 CYS C O 1 ATOM 8005 C CB . CYS E 1 193 ? 13.511 -26.039 25.349 1.00 59.03 ? 194 CYS C CB 1 ATOM 8006 S SG . CYS E 1 193 ? 15.249 -26.068 24.874 1.00 127.65 ? 194 CYS C SG 1 ATOM 8007 N N . GLU E 1 194 ? 14.603 -27.859 28.160 1.00 62.41 ? 195 GLU C N 1 ATOM 8008 C CA . GLU E 1 194 ? 15.293 -27.778 29.442 1.00 68.93 ? 195 GLU C CA 1 ATOM 8009 C C . GLU E 1 194 ? 16.807 -27.732 29.261 1.00 70.98 ? 195 GLU C C 1 ATOM 8010 O O . GLU E 1 194 ? 17.432 -28.733 28.914 1.00 75.91 ? 195 GLU C O 1 ATOM 8011 C CB . GLU E 1 194 ? 14.900 -28.960 30.330 1.00 75.69 ? 195 GLU C CB 1 ATOM 8012 C CG . GLU E 1 194 ? 15.531 -28.942 31.713 1.00 85.44 ? 195 GLU C CG 1 ATOM 8013 C CD . GLU E 1 194 ? 14.883 -29.936 32.657 1.00 91.79 ? 195 GLU C CD 1 ATOM 8014 O OE1 . GLU E 1 194 ? 13.649 -29.863 32.842 1.00 93.89 ? 195 GLU C OE1 1 ATOM 8015 O OE2 . GLU E 1 194 ? 15.605 -30.793 33.210 1.00 93.18 ? 195 GLU C OE2 1 ATOM 8016 N N . VAL E 1 195 ? 17.389 -26.563 29.510 1.00 67.21 ? 196 VAL C N 1 ATOM 8017 C CA . VAL E 1 195 ? 18.808 -26.340 29.257 1.00 63.02 ? 196 VAL C CA 1 ATOM 8018 C C . VAL E 1 195 ? 19.625 -26.268 30.543 1.00 69.84 ? 196 VAL C C 1 ATOM 8019 O O . VAL E 1 195 ? 19.254 -25.575 31.490 1.00 67.65 ? 196 VAL C O 1 ATOM 8020 C CB . VAL E 1 195 ? 19.024 -25.042 28.450 1.00 53.12 ? 196 VAL C CB 1 ATOM 8021 C CG1 . VAL E 1 195 ? 20.507 -24.728 28.315 1.00 45.27 ? 196 VAL C CG1 1 ATOM 8022 C CG2 . VAL E 1 195 ? 18.371 -25.158 27.083 1.00 51.07 ? 196 VAL C CG2 1 ATOM 8023 N N . THR E 1 196 ? 20.738 -26.996 30.568 1.00 76.72 ? 197 THR C N 1 ATOM 8024 C CA . THR E 1 196 ? 21.669 -26.948 31.688 1.00 79.60 ? 197 THR C CA 1 ATOM 8025 C C . THR E 1 196 ? 23.030 -26.437 31.230 1.00 78.97 ? 197 THR C C 1 ATOM 8026 O O . THR E 1 196 ? 23.655 -27.020 30.344 1.00 78.88 ? 197 THR C O 1 ATOM 8027 C CB . THR E 1 196 ? 21.842 -28.328 32.342 1.00 81.86 ? 197 THR C CB 1 ATOM 8028 O OG1 . THR E 1 196 ? 20.558 -28.852 32.705 1.00 83.79 ? 197 THR C OG1 1 ATOM 8029 C CG2 . THR E 1 196 ? 22.715 -28.221 33.582 1.00 84.53 ? 197 THR C CG2 1 ATOM 8030 N N . HIS E 1 197 ? 23.485 -25.345 31.834 1.00 79.55 ? 198 HIS C N 1 ATOM 8031 C CA . HIS E 1 197 ? 24.755 -24.734 31.458 1.00 77.49 ? 198 HIS C CA 1 ATOM 8032 C C . HIS E 1 197 ? 25.480 -24.171 32.678 1.00 80.71 ? 198 HIS C C 1 ATOM 8033 O O . HIS E 1 197 ? 24.854 -23.852 33.689 1.00 86.17 ? 198 HIS C O 1 ATOM 8034 C CB . HIS E 1 197 ? 24.525 -23.635 30.419 1.00 71.30 ? 198 HIS C CB 1 ATOM 8035 C CG . HIS E 1 197 ? 25.787 -23.034 29.881 1.00 63.58 ? 198 HIS C CG 1 ATOM 8036 N ND1 . HIS E 1 197 ? 26.159 -21.734 30.139 1.00 58.71 ? 198 HIS C ND1 1 ATOM 8037 C CD2 . HIS E 1 197 ? 26.761 -23.558 29.100 1.00 60.24 ? 198 HIS C CD2 1 ATOM 8038 C CE1 . HIS E 1 197 ? 27.309 -21.479 29.537 1.00 53.84 ? 198 HIS C CE1 1 ATOM 8039 N NE2 . HIS E 1 197 ? 27.695 -22.569 28.901 1.00 57.86 ? 198 HIS C NE2 1 ATOM 8040 N N . GLN E 1 198 ? 26.800 -24.052 32.570 1.00 77.56 ? 199 GLN C N 1 ATOM 8041 C CA . GLN E 1 198 ? 27.643 -23.610 33.678 1.00 79.01 ? 199 GLN C CA 1 ATOM 8042 C C . GLN E 1 198 ? 27.289 -22.204 34.168 1.00 81.22 ? 199 GLN C C 1 ATOM 8043 O O . GLN E 1 198 ? 27.462 -21.891 35.347 1.00 83.48 ? 199 GLN C O 1 ATOM 8044 C CB . GLN E 1 198 ? 29.117 -23.665 33.263 1.00 78.87 ? 199 GLN C CB 1 ATOM 8045 C CG . GLN E 1 198 ? 30.104 -23.397 34.388 1.00 84.34 ? 199 GLN C CG 1 ATOM 8046 C CD . GLN E 1 198 ? 31.549 -23.533 33.944 1.00 88.26 ? 199 GLN C CD 1 ATOM 8047 O OE1 . GLN E 1 198 ? 31.838 -24.117 32.899 1.00 88.93 ? 199 GLN C OE1 1 ATOM 8048 N NE2 . GLN E 1 198 ? 32.465 -22.989 34.737 1.00 89.64 ? 199 GLN C NE2 1 ATOM 8049 N N . GLY E 1 199 ? 26.787 -21.364 33.268 1.00 80.23 ? 200 GLY C N 1 ATOM 8050 C CA . GLY E 1 199 ? 26.471 -19.985 33.602 1.00 82.50 ? 200 GLY C CA 1 ATOM 8051 C C . GLY E 1 199 ? 25.064 -19.781 34.131 1.00 86.27 ? 200 GLY C C 1 ATOM 8052 O O . GLY E 1 199 ? 24.641 -18.651 34.383 1.00 85.06 ? 200 GLY C O 1 ATOM 8053 N N . LEU E 1 200 ? 24.334 -20.878 34.299 1.00 90.47 ? 201 LEU C N 1 ATOM 8054 C CA . LEU E 1 200 ? 22.973 -20.815 34.816 1.00 93.38 ? 201 LEU C CA 1 ATOM 8055 C C . LEU E 1 200 ? 22.915 -21.353 36.240 1.00 96.33 ? 201 LEU C C 1 ATOM 8056 O O . LEU E 1 200 ? 23.427 -22.438 36.523 1.00 96.34 ? 201 LEU C O 1 ATOM 8057 C CB . LEU E 1 200 ? 22.019 -21.597 33.910 1.00 92.84 ? 201 LEU C CB 1 ATOM 8058 C CG . LEU E 1 200 ? 21.908 -21.101 32.465 1.00 91.21 ? 201 LEU C CG 1 ATOM 8059 C CD1 . LEU E 1 200 ? 21.170 -22.115 31.607 1.00 91.91 ? 201 LEU C CD1 1 ATOM 8060 C CD2 . LEU E 1 200 ? 21.219 -19.746 32.407 1.00 88.32 ? 201 LEU C CD2 1 ATOM 8061 N N . SER E 1 201 ? 22.298 -20.582 37.132 1.00 97.30 ? 202 SER C N 1 ATOM 8062 C CA . SER E 1 201 ? 22.156 -20.972 38.532 1.00 100.90 ? 202 SER C CA 1 ATOM 8063 C C . SER E 1 201 ? 21.410 -22.298 38.650 1.00 101.31 ? 202 SER C C 1 ATOM 8064 O O . SER E 1 201 ? 21.810 -23.189 39.402 1.00 99.34 ? 202 SER C O 1 ATOM 8065 C CB . SER E 1 201 ? 21.429 -19.878 39.318 1.00 102.04 ? 202 SER C CB 1 ATOM 8066 O OG . SER E 1 201 ? 21.282 -20.236 40.681 1.00 103.81 ? 202 SER C OG 1 ATOM 8067 N N . SER E 1 202 ? 20.326 -22.415 37.891 1.00 101.23 ? 203 SER C N 1 ATOM 8068 C CA . SER E 1 202 ? 19.534 -23.637 37.819 1.00 98.28 ? 203 SER C CA 1 ATOM 8069 C C . SER E 1 202 ? 18.914 -23.737 36.424 1.00 91.50 ? 203 SER C C 1 ATOM 8070 O O . SER E 1 202 ? 18.662 -22.711 35.791 1.00 84.40 ? 203 SER C O 1 ATOM 8071 C CB . SER E 1 202 ? 18.459 -23.653 38.911 1.00 98.61 ? 203 SER C CB 1 ATOM 8072 O OG . SER E 1 202 ? 17.734 -22.437 38.938 1.00 98.56 ? 203 SER C OG 1 ATOM 8073 N N . PRO E 1 203 ? 18.684 -24.971 35.936 1.00 93.08 ? 204 PRO C N 1 ATOM 8074 C CA . PRO E 1 203 ? 18.191 -25.231 34.576 1.00 94.96 ? 204 PRO C CA 1 ATOM 8075 C C . PRO E 1 203 ? 17.033 -24.340 34.107 1.00 97.33 ? 204 PRO C C 1 ATOM 8076 O O . PRO E 1 203 ? 15.976 -24.302 34.738 1.00 97.20 ? 204 PRO C O 1 ATOM 8077 C CB . PRO E 1 203 ? 17.741 -26.689 34.656 1.00 93.67 ? 204 PRO C CB 1 ATOM 8078 C CG . PRO E 1 203 ? 18.689 -27.296 35.621 1.00 92.20 ? 204 PRO C CG 1 ATOM 8079 C CD . PRO E 1 203 ? 18.969 -26.229 36.654 1.00 93.04 ? 204 PRO C CD 1 ATOM 8080 N N . VAL E 1 204 ? 17.251 -23.633 33.001 1.00 97.52 ? 205 VAL C N 1 ATOM 8081 C CA . VAL E 1 204 ? 16.225 -22.799 32.380 1.00 94.97 ? 205 VAL C CA 1 ATOM 8082 C C . VAL E 1 204 ? 15.269 -23.663 31.562 1.00 88.04 ? 205 VAL C C 1 ATOM 8083 O O . VAL E 1 204 ? 15.703 -24.545 30.821 1.00 81.33 ? 205 VAL C O 1 ATOM 8084 C CB . VAL E 1 204 ? 16.854 -21.712 31.472 1.00 70.39 ? 205 VAL C CB 1 ATOM 8085 C CG1 . VAL E 1 204 ? 15.810 -21.092 30.555 1.00 68.32 ? 205 VAL C CG1 1 ATOM 8086 C CG2 . VAL E 1 204 ? 17.541 -20.642 32.312 1.00 69.48 ? 205 VAL C CG2 1 ATOM 8087 N N . THR E 1 205 ? 13.968 -23.421 31.704 1.00 89.80 ? 206 THR C N 1 ATOM 8088 C CA . THR E 1 205 ? 12.971 -24.189 30.965 1.00 88.22 ? 206 THR C CA 1 ATOM 8089 C C . THR E 1 205 ? 11.999 -23.293 30.201 1.00 80.91 ? 206 THR C C 1 ATOM 8090 O O . THR E 1 205 ? 11.084 -22.714 30.784 1.00 84.69 ? 206 THR C O 1 ATOM 8091 C CB . THR E 1 205 ? 12.160 -25.112 31.899 1.00 93.96 ? 206 THR C CB 1 ATOM 8092 O OG1 . THR E 1 205 ? 11.596 -24.342 32.967 1.00 99.62 ? 206 THR C OG1 1 ATOM 8093 C CG2 . THR E 1 205 ? 13.049 -26.201 32.480 1.00 96.30 ? 206 THR C CG2 1 ATOM 8094 N N . LYS E 1 206 ? 12.206 -23.184 28.893 1.00 70.63 ? 207 LYS C N 1 ATOM 8095 C CA . LYS E 1 206 ? 11.280 -22.462 28.028 1.00 71.36 ? 207 LYS C CA 1 ATOM 8096 C C . LYS E 1 206 ? 10.307 -23.443 27.386 1.00 72.08 ? 207 LYS C C 1 ATOM 8097 O O . LYS E 1 206 ? 10.703 -24.522 26.945 1.00 70.11 ? 207 LYS C O 1 ATOM 8098 C CB . LYS E 1 206 ? 12.035 -21.676 26.955 1.00 69.88 ? 207 LYS C CB 1 ATOM 8099 C CG . LYS E 1 206 ? 12.740 -20.429 27.468 1.00 73.92 ? 207 LYS C CG 1 ATOM 8100 C CD . LYS E 1 206 ? 11.747 -19.323 27.794 1.00 76.13 ? 207 LYS C CD 1 ATOM 8101 C CE . LYS E 1 206 ? 12.461 -18.039 28.195 1.00 77.84 ? 207 LYS C CE 1 ATOM 8102 N NZ . LYS E 1 206 ? 11.511 -16.909 28.402 1.00 79.90 ? 207 LYS C NZ 1 ATOM 8103 N N . SER E 1 207 ? 9.032 -23.071 27.336 1.00 74.07 ? 208 SER C N 1 ATOM 8104 C CA . SER E 1 207 ? 8.005 -23.990 26.863 1.00 71.96 ? 208 SER C CA 1 ATOM 8105 C C . SER E 1 207 ? 6.812 -23.286 26.224 1.00 70.63 ? 208 SER C C 1 ATOM 8106 O O . SER E 1 207 ? 6.693 -22.059 26.269 1.00 67.78 ? 208 SER C O 1 ATOM 8107 C CB . SER E 1 207 ? 7.520 -24.868 28.019 1.00 72.86 ? 208 SER C CB 1 ATOM 8108 O OG . SER E 1 207 ? 7.024 -24.073 29.082 1.00 75.46 ? 208 SER C OG 1 ATOM 8109 N N . PHE E 1 208 ? 5.934 -24.084 25.625 1.00 69.29 ? 209 PHE C N 1 ATOM 8110 C CA . PHE E 1 208 ? 4.706 -23.576 25.030 1.00 68.71 ? 209 PHE C CA 1 ATOM 8111 C C . PHE E 1 208 ? 3.665 -24.682 24.924 1.00 71.49 ? 209 PHE C C 1 ATOM 8112 O O . PHE E 1 208 ? 4.000 -25.865 24.910 1.00 72.11 ? 209 PHE C O 1 ATOM 8113 C CB . PHE E 1 208 ? 4.974 -22.975 23.648 1.00 64.11 ? 209 PHE C CB 1 ATOM 8114 C CG . PHE E 1 208 ? 5.251 -23.998 22.580 1.00 67.18 ? 209 PHE C CG 1 ATOM 8115 C CD1 . PHE E 1 208 ? 4.230 -24.473 21.771 1.00 66.86 ? 209 PHE C CD1 1 ATOM 8116 C CD2 . PHE E 1 208 ? 6.536 -24.478 22.378 1.00 72.33 ? 209 PHE C CD2 1 ATOM 8117 C CE1 . PHE E 1 208 ? 4.483 -25.414 20.788 1.00 69.51 ? 209 PHE C CE1 1 ATOM 8118 C CE2 . PHE E 1 208 ? 6.797 -25.418 21.395 1.00 71.49 ? 209 PHE C CE2 1 ATOM 8119 C CZ . PHE E 1 208 ? 5.769 -25.886 20.599 1.00 69.16 ? 209 PHE C CZ 1 ATOM 8120 N N . ASN E 1 209 ? 2.401 -24.285 24.844 1.00 76.33 ? 210 ASN C N 1 ATOM 8121 C CA . ASN E 1 209 ? 1.313 -25.232 24.648 1.00 83.20 ? 210 ASN C CA 1 ATOM 8122 C C . ASN E 1 209 ? 0.769 -25.124 23.230 1.00 81.07 ? 210 ASN C C 1 ATOM 8123 O O . ASN E 1 209 ? 0.617 -24.022 22.701 1.00 79.95 ? 210 ASN C O 1 ATOM 8124 C CB . ASN E 1 209 ? 0.201 -24.993 25.670 1.00 88.12 ? 210 ASN C CB 1 ATOM 8125 C CG . ASN E 1 209 ? 0.703 -25.053 27.100 1.00 89.43 ? 210 ASN C CG 1 ATOM 8126 O OD1 . ASN E 1 209 ? 1.454 -25.956 27.470 1.00 87.84 ? 210 ASN C OD1 1 ATOM 8127 N ND2 . ASN E 1 209 ? 0.300 -24.080 27.910 1.00 92.08 ? 210 ASN C ND2 1 ATOM 8128 N N . ARG E 1 210 ? 0.486 -26.269 22.616 1.00 79.68 ? 211 ARG C N 1 ATOM 8129 C CA . ARG E 1 210 ? 0.016 -26.306 21.235 1.00 78.36 ? 211 ARG C CA 1 ATOM 8130 C C . ARG E 1 210 ? -1.330 -25.602 21.071 1.00 82.29 ? 211 ARG C C 1 ATOM 8131 O O . ARG E 1 210 ? -2.374 -26.129 21.450 1.00 83.70 ? 211 ARG C O 1 ATOM 8132 C CB . ARG E 1 210 ? -0.087 -27.754 20.752 1.00 74.76 ? 211 ARG C CB 1 ATOM 8133 C CG . ARG E 1 210 ? -0.570 -27.899 19.322 1.00 76.70 ? 211 ARG C CG 1 ATOM 8134 C CD . ARG E 1 210 ? -0.686 -29.362 18.930 1.00 85.25 ? 211 ARG C CD 1 ATOM 8135 N NE . ARG E 1 210 ? -1.461 -30.128 19.902 1.00 93.62 ? 211 ARG C NE 1 ATOM 8136 C CZ . ARG E 1 210 ? -2.789 -30.162 19.940 1.00 97.77 ? 211 ARG C CZ 1 ATOM 8137 N NH1 . ARG E 1 210 ? -3.499 -29.467 19.062 1.00 100.27 ? 211 ARG C NH1 1 ATOM 8138 N NH2 . ARG E 1 210 ? -3.410 -30.888 20.860 1.00 99.52 ? 211 ARG C NH2 1 ATOM 8139 O OXT . ARG E 1 210 ? -1.405 -24.489 20.549 1.00 87.24 ? 211 ARG C OXT 1 ATOM 8140 N N . GLN F 2 1 ? 44.845 -8.088 -3.942 1.00 76.55 ? 1 GLN D N 1 ATOM 8141 C CA . GLN F 2 1 ? 45.133 -7.419 -5.205 1.00 55.54 ? 1 GLN D CA 1 ATOM 8142 C C . GLN F 2 1 ? 45.025 -8.360 -6.382 1.00 46.96 ? 1 GLN D C 1 ATOM 8143 O O . GLN F 2 1 ? 44.459 -8.018 -7.417 1.00 51.77 ? 1 GLN D O 1 ATOM 8144 C CB . GLN F 2 1 ? 46.519 -6.810 -5.183 1.00 40.14 ? 1 GLN D CB 1 ATOM 8145 C CG . GLN F 2 1 ? 46.715 -5.791 -6.258 1.00 36.26 ? 1 GLN D CG 1 ATOM 8146 C CD . GLN F 2 1 ? 46.021 -4.500 -5.937 1.00 35.94 ? 1 GLN D CD 1 ATOM 8147 O OE1 . GLN F 2 1 ? 46.054 -3.559 -6.724 1.00 45.89 ? 1 GLN D OE1 1 ATOM 8148 N NE2 . GLN F 2 1 ? 45.396 -4.435 -4.767 1.00 45.85 ? 1 GLN D NE2 1 ATOM 8149 N N . VAL F 2 2 ? 45.619 -9.533 -6.235 1.00 33.19 ? 2 VAL D N 1 ATOM 8150 C CA . VAL F 2 2 ? 45.286 -10.633 -7.110 1.00 30.11 ? 2 VAL D CA 1 ATOM 8151 C C . VAL F 2 2 ? 44.192 -11.405 -6.405 1.00 26.29 ? 2 VAL D C 1 ATOM 8152 O O . VAL F 2 2 ? 44.227 -11.578 -5.189 1.00 23.43 ? 2 VAL D O 1 ATOM 8153 C CB . VAL F 2 2 ? 46.483 -11.536 -7.409 1.00 34.37 ? 2 VAL D CB 1 ATOM 8154 C CG1 . VAL F 2 2 ? 46.098 -12.592 -8.437 1.00 30.12 ? 2 VAL D CG1 1 ATOM 8155 C CG2 . VAL F 2 2 ? 47.642 -10.694 -7.910 1.00 42.33 ? 2 VAL D CG2 1 ATOM 8156 N N . GLN F 2 3 ? 43.205 -11.844 -7.167 1.00 24.65 ? 3 GLN D N 1 ATOM 8157 C CA . GLN F 2 3 ? 42.094 -12.567 -6.595 1.00 26.22 ? 3 GLN D CA 1 ATOM 8158 C C . GLN F 2 3 ? 41.795 -13.775 -7.461 1.00 25.89 ? 3 GLN D C 1 ATOM 8159 O O . GLN F 2 3 ? 41.859 -13.693 -8.688 1.00 24.36 ? 3 GLN D O 1 ATOM 8160 C CB . GLN F 2 3 ? 40.877 -11.655 -6.482 1.00 35.21 ? 3 GLN D CB 1 ATOM 8161 C CG . GLN F 2 3 ? 40.064 -11.853 -5.226 1.00 49.70 ? 3 GLN D CG 1 ATOM 8162 C CD . GLN F 2 3 ? 39.459 -10.556 -4.731 1.00 50.65 ? 3 GLN D CD 1 ATOM 8163 O OE1 . GLN F 2 3 ? 40.143 -9.539 -4.640 1.00 52.82 ? 3 GLN D OE1 1 ATOM 8164 N NE2 . GLN F 2 3 ? 38.169 -10.584 -4.411 1.00 50.07 ? 3 GLN D NE2 1 ATOM 8165 N N . LEU F 2 4 ? 41.497 -14.901 -6.824 1.00 19.03 ? 4 LEU D N 1 ATOM 8166 C CA . LEU F 2 4 ? 41.087 -16.092 -7.548 1.00 19.01 ? 4 LEU D CA 1 ATOM 8167 C C . LEU F 2 4 ? 39.645 -16.424 -7.210 1.00 22.31 ? 4 LEU D C 1 ATOM 8168 O O . LEU F 2 4 ? 39.222 -16.305 -6.058 1.00 23.85 ? 4 LEU D O 1 ATOM 8169 C CB . LEU F 2 4 ? 41.978 -17.298 -7.217 1.00 22.30 ? 4 LEU D CB 1 ATOM 8170 C CG . LEU F 2 4 ? 43.507 -17.249 -7.298 1.00 27.66 ? 4 LEU D CG 1 ATOM 8171 C CD1 . LEU F 2 4 ? 44.044 -18.657 -7.483 1.00 20.11 ? 4 LEU D CD1 1 ATOM 8172 C CD2 . LEU F 2 4 ? 44.020 -16.331 -8.392 1.00 33.29 ? 4 LEU D CD2 1 ATOM 8173 N N . GLN F 2 5 ? 38.895 -16.842 -8.222 1.00 18.64 ? 5 GLN D N 1 ATOM 8174 C CA . GLN F 2 5 ? 37.537 -17.320 -8.024 1.00 21.85 ? 5 GLN D CA 1 ATOM 8175 C C . GLN F 2 5 ? 37.305 -18.506 -8.946 1.00 21.25 ? 5 GLN D C 1 ATOM 8176 O O . GLN F 2 5 ? 37.743 -18.502 -10.097 1.00 25.21 ? 5 GLN D O 1 ATOM 8177 C CB . GLN F 2 5 ? 36.517 -16.215 -8.294 1.00 31.04 ? 5 GLN D CB 1 ATOM 8178 C CG . GLN F 2 5 ? 35.126 -16.505 -7.751 1.00 29.67 ? 5 GLN D CG 1 ATOM 8179 C CD . GLN F 2 5 ? 34.999 -16.166 -6.278 1.00 35.00 ? 5 GLN D CD 1 ATOM 8180 O OE1 . GLN F 2 5 ? 35.988 -15.848 -5.615 1.00 41.85 ? 5 GLN D OE1 1 ATOM 8181 N NE2 . GLN F 2 5 ? 33.778 -16.231 -5.758 1.00 39.79 ? 5 GLN D NE2 1 ATOM 8182 N N . GLN F 2 6 ? 36.624 -19.526 -8.442 1.00 20.30 ? 6 GLN D N 1 ATOM 8183 C CA . GLN F 2 6 ? 36.457 -20.755 -9.205 1.00 26.78 ? 6 GLN D CA 1 ATOM 8184 C C . GLN F 2 6 ? 34.994 -21.101 -9.414 1.00 22.09 ? 6 GLN D C 1 ATOM 8185 O O . GLN F 2 6 ? 34.136 -20.674 -8.642 1.00 25.62 ? 6 GLN D O 1 ATOM 8186 C CB . GLN F 2 6 ? 37.169 -21.910 -8.504 1.00 33.97 ? 6 GLN D CB 1 ATOM 8187 C CG . GLN F 2 6 ? 36.702 -22.120 -7.078 1.00 40.68 ? 6 GLN D CG 1 ATOM 8188 C CD . GLN F 2 6 ? 37.585 -23.078 -6.308 1.00 36.25 ? 6 GLN D CD 1 ATOM 8189 O OE1 . GLN F 2 6 ? 38.408 -22.661 -5.495 1.00 30.52 ? 6 GLN D OE1 1 ATOM 8190 N NE2 . GLN F 2 6 ? 37.414 -24.372 -6.556 1.00 30.10 ? 6 GLN D NE2 1 ATOM 8191 N N . TRP F 2 7 ? 34.717 -21.873 -10.462 1.00 18.42 ? 7 TRP D N 1 ATOM 8192 C CA . TRP F 2 7 ? 33.363 -22.329 -10.749 1.00 24.37 ? 7 TRP D CA 1 ATOM 8193 C C . TRP F 2 7 ? 33.371 -23.672 -11.476 1.00 26.83 ? 7 TRP D C 1 ATOM 8194 O O . TRP F 2 7 ? 34.397 -24.106 -12.008 1.00 27.33 ? 7 TRP D O 1 ATOM 8195 C CB . TRP F 2 7 ? 32.596 -21.284 -11.570 1.00 22.71 ? 7 TRP D CB 1 ATOM 8196 C CG . TRP F 2 7 ? 33.189 -20.971 -12.915 1.00 31.80 ? 7 TRP D CG 1 ATOM 8197 C CD1 . TRP F 2 7 ? 32.889 -21.573 -14.106 1.00 31.26 ? 7 TRP D CD1 1 ATOM 8198 C CD2 . TRP F 2 7 ? 34.168 -19.963 -13.211 1.00 20.86 ? 7 TRP D CD2 1 ATOM 8199 N NE1 . TRP F 2 7 ? 33.626 -21.008 -15.122 1.00 26.39 ? 7 TRP D NE1 1 ATOM 8200 C CE2 . TRP F 2 7 ? 34.418 -20.017 -14.598 1.00 23.23 ? 7 TRP D CE2 1 ATOM 8201 C CE3 . TRP F 2 7 ? 34.859 -19.024 -12.436 1.00 21.32 ? 7 TRP D CE3 1 ATOM 8202 C CZ2 . TRP F 2 7 ? 35.328 -19.167 -15.229 1.00 25.01 ? 7 TRP D CZ2 1 ATOM 8203 C CZ3 . TRP F 2 7 ? 35.764 -18.178 -13.064 1.00 26.58 ? 7 TRP D CZ3 1 ATOM 8204 C CH2 . TRP F 2 7 ? 35.993 -18.259 -14.446 1.00 30.77 ? 7 TRP D CH2 1 ATOM 8205 N N . GLY F 2 8 ? 32.218 -24.330 -11.484 1.00 26.34 ? 8 GLY D N 1 ATOM 8206 C CA . GLY F 2 8 ? 32.084 -25.644 -12.089 1.00 26.78 ? 8 GLY D CA 1 ATOM 8207 C C . GLY F 2 8 ? 31.052 -26.478 -11.353 1.00 25.16 ? 8 GLY D C 1 ATOM 8208 O O . GLY F 2 8 ? 30.687 -26.158 -10.220 1.00 31.61 ? 8 GLY D O 1 ATOM 8209 N N . ALA F 2 9 ? 30.585 -27.548 -11.993 1.00 26.68 ? 9 ALA D N 1 ATOM 8210 C CA . ALA F 2 9 ? 29.566 -28.418 -11.407 1.00 37.60 ? 9 ALA D CA 1 ATOM 8211 C C . ALA F 2 9 ? 30.034 -29.077 -10.107 1.00 36.49 ? 9 ALA D C 1 ATOM 8212 O O . ALA F 2 9 ? 31.138 -29.615 -10.036 1.00 32.15 ? 9 ALA D O 1 ATOM 8213 C CB . ALA F 2 9 ? 29.148 -29.487 -12.417 1.00 39.39 ? 9 ALA D CB 1 ATOM 8214 N N . GLY F 2 10 ? 29.181 -29.042 -9.086 1.00 34.79 ? 10 GLY D N 1 ATOM 8215 C CA . GLY F 2 10 ? 29.505 -29.619 -7.794 1.00 36.73 ? 10 GLY D CA 1 ATOM 8216 C C . GLY F 2 10 ? 28.961 -31.021 -7.541 1.00 46.72 ? 10 GLY D C 1 ATOM 8217 O O . GLY F 2 10 ? 29.463 -31.731 -6.671 1.00 51.82 ? 10 GLY D O 1 ATOM 8218 N N . LEU F 2 11 ? 27.937 -31.430 -8.286 1.00 39.97 ? 11 LEU D N 1 ATOM 8219 C CA . LEU F 2 11 ? 27.352 -32.755 -8.086 1.00 35.13 ? 11 LEU D CA 1 ATOM 8220 C C . LEU F 2 11 ? 27.609 -33.685 -9.267 1.00 34.14 ? 11 LEU D C 1 ATOM 8221 O O . LEU F 2 11 ? 27.199 -33.409 -10.395 1.00 39.62 ? 11 LEU D O 1 ATOM 8222 C CB . LEU F 2 11 ? 25.851 -32.649 -7.836 1.00 28.38 ? 11 LEU D CB 1 ATOM 8223 C CG . LEU F 2 11 ? 25.199 -33.997 -7.535 1.00 33.01 ? 11 LEU D CG 1 ATOM 8224 C CD1 . LEU F 2 11 ? 25.817 -34.633 -6.296 1.00 36.99 ? 11 LEU D CD1 1 ATOM 8225 C CD2 . LEU F 2 11 ? 23.711 -33.833 -7.355 1.00 28.95 ? 11 LEU D CD2 1 ATOM 8226 N N . LEU F 2 12 ? 28.280 -34.799 -8.995 1.00 27.74 ? 12 LEU D N 1 ATOM 8227 C CA . LEU F 2 12 ? 28.682 -35.725 -10.043 1.00 31.34 ? 12 LEU D CA 1 ATOM 8228 C C . LEU F 2 12 ? 28.264 -37.148 -9.731 1.00 32.51 ? 12 LEU D C 1 ATOM 8229 O O . LEU F 2 12 ? 28.272 -37.568 -8.573 1.00 37.71 ? 12 LEU D O 1 ATOM 8230 C CB . LEU F 2 12 ? 30.196 -35.688 -10.238 1.00 39.31 ? 12 LEU D CB 1 ATOM 8231 C CG . LEU F 2 12 ? 30.849 -34.361 -10.602 1.00 47.16 ? 12 LEU D CG 1 ATOM 8232 C CD1 . LEU F 2 12 ? 32.354 -34.532 -10.580 1.00 43.13 ? 12 LEU D CD1 1 ATOM 8233 C CD2 . LEU F 2 12 ? 30.372 -33.899 -11.969 1.00 51.69 ? 12 LEU D CD2 1 ATOM 8234 N N . LYS F 2 13 ? 27.913 -37.892 -10.772 1.00 30.72 ? 13 LYS D N 1 ATOM 8235 C CA . LYS F 2 13 ? 27.688 -39.323 -10.640 1.00 29.43 ? 13 LYS D CA 1 ATOM 8236 C C . LYS F 2 13 ? 29.015 -40.052 -10.805 1.00 31.96 ? 13 LYS D C 1 ATOM 8237 O O . LYS F 2 13 ? 29.884 -39.591 -11.545 1.00 32.37 ? 13 LYS D O 1 ATOM 8238 C CB . LYS F 2 13 ? 26.667 -39.810 -11.671 1.00 32.62 ? 13 LYS D CB 1 ATOM 8239 C CG . LYS F 2 13 ? 25.244 -39.346 -11.393 1.00 41.41 ? 13 LYS D CG 1 ATOM 8240 C CD . LYS F 2 13 ? 24.324 -39.598 -12.579 1.00 51.56 ? 13 LYS D CD 1 ATOM 8241 C CE . LYS F 2 13 ? 22.889 -39.857 -12.130 1.00 58.16 ? 13 LYS D CE 1 ATOM 8242 N NZ . LYS F 2 13 ? 22.392 -38.851 -11.152 1.00 56.60 ? 13 LYS D NZ 1 ATOM 8243 N N . PRO F 2 14 ? 29.183 -41.185 -10.103 1.00 33.45 ? 14 PRO D N 1 ATOM 8244 C CA . PRO F 2 14 ? 30.372 -42.032 -10.258 1.00 31.57 ? 14 PRO D CA 1 ATOM 8245 C C . PRO F 2 14 ? 30.686 -42.287 -11.728 1.00 37.52 ? 14 PRO D C 1 ATOM 8246 O O . PRO F 2 14 ? 29.748 -42.436 -12.514 1.00 37.97 ? 14 PRO D O 1 ATOM 8247 C CB . PRO F 2 14 ? 29.975 -43.330 -9.550 1.00 30.45 ? 14 PRO D CB 1 ATOM 8248 C CG . PRO F 2 14 ? 28.985 -42.907 -8.528 1.00 38.82 ? 14 PRO D CG 1 ATOM 8249 C CD . PRO F 2 14 ? 28.237 -41.734 -9.115 1.00 35.14 ? 14 PRO D CD 1 ATOM 8250 N N . SER F 2 15 ? 31.978 -42.305 -12.065 1.00 31.96 ? 15 SER D N 1 ATOM 8251 C CA . SER F 2 15 ? 32.505 -42.508 -13.424 1.00 35.05 ? 15 SER D CA 1 ATOM 8252 C C . SER F 2 15 ? 32.481 -41.241 -14.290 1.00 34.25 ? 15 SER D C 1 ATOM 8253 O O . SER F 2 15 ? 33.047 -41.233 -15.384 1.00 35.23 ? 15 SER D O 1 ATOM 8254 C CB . SER F 2 15 ? 31.758 -43.633 -14.157 1.00 35.03 ? 15 SER D CB 1 ATOM 8255 O OG . SER F 2 15 ? 30.547 -43.147 -14.717 1.00 39.87 ? 15 SER D OG 1 ATOM 8256 N N . GLU F 2 16 ? 31.850 -40.170 -13.818 1.00 31.43 ? 16 GLU D N 1 ATOM 8257 C CA . GLU F 2 16 ? 31.827 -38.943 -14.608 1.00 33.09 ? 16 GLU D CA 1 ATOM 8258 C C . GLU F 2 16 ? 33.114 -38.147 -14.424 1.00 33.39 ? 16 GLU D C 1 ATOM 8259 O O . GLU F 2 16 ? 33.963 -38.500 -13.607 1.00 33.89 ? 16 GLU D O 1 ATOM 8260 C CB . GLU F 2 16 ? 30.609 -38.087 -14.256 1.00 36.25 ? 16 GLU D CB 1 ATOM 8261 C CG . GLU F 2 16 ? 29.333 -38.583 -14.913 1.00 42.64 ? 16 GLU D CG 1 ATOM 8262 C CD . GLU F 2 16 ? 28.117 -37.759 -14.550 1.00 50.38 ? 16 GLU D CD 1 ATOM 8263 O OE1 . GLU F 2 16 ? 28.184 -36.987 -13.571 1.00 53.29 ? 16 GLU D OE1 1 ATOM 8264 O OE2 . GLU F 2 16 ? 27.089 -37.887 -15.247 1.00 55.62 ? 16 GLU D OE2 1 ATOM 8265 N N . THR F 2 17 ? 33.258 -37.079 -15.203 1.00 31.18 ? 17 THR D N 1 ATOM 8266 C CA . THR F 2 17 ? 34.467 -36.267 -15.171 1.00 28.65 ? 17 THR D CA 1 ATOM 8267 C C . THR F 2 17 ? 34.253 -34.952 -14.431 1.00 26.17 ? 17 THR D C 1 ATOM 8268 O O . THR F 2 17 ? 33.358 -34.180 -14.764 1.00 34.00 ? 17 THR D O 1 ATOM 8269 C CB . THR F 2 17 ? 34.972 -35.959 -16.592 1.00 27.67 ? 17 THR D CB 1 ATOM 8270 O OG1 . THR F 2 17 ? 35.243 -37.186 -17.279 1.00 35.61 ? 17 THR D OG1 1 ATOM 8271 C CG2 . THR F 2 17 ? 36.241 -35.129 -16.536 1.00 28.30 ? 17 THR D CG2 1 ATOM 8272 N N . LEU F 2 18 ? 35.083 -34.706 -13.423 1.00 27.59 ? 18 LEU D N 1 ATOM 8273 C CA . LEU F 2 18 ? 35.085 -33.433 -12.712 1.00 28.21 ? 18 LEU D CA 1 ATOM 8274 C C . LEU F 2 18 ? 35.784 -32.354 -13.537 1.00 27.12 ? 18 LEU D C 1 ATOM 8275 O O . LEU F 2 18 ? 36.889 -32.566 -14.019 1.00 29.07 ? 18 LEU D O 1 ATOM 8276 C CB . LEU F 2 18 ? 35.772 -33.583 -11.351 1.00 28.64 ? 18 LEU D CB 1 ATOM 8277 C CG . LEU F 2 18 ? 36.031 -32.284 -10.588 1.00 32.15 ? 18 LEU D CG 1 ATOM 8278 C CD1 . LEU F 2 18 ? 34.734 -31.506 -10.401 1.00 35.64 ? 18 LEU D CD1 1 ATOM 8279 C CD2 . LEU F 2 18 ? 36.683 -32.566 -9.245 1.00 30.64 ? 18 LEU D CD2 1 ATOM 8280 N N . SER F 2 19 ? 35.138 -31.202 -13.700 1.00 20.80 ? 19 SER D N 1 ATOM 8281 C CA . SER F 2 19 ? 35.726 -30.090 -14.442 1.00 30.24 ? 19 SER D CA 1 ATOM 8282 C C . SER F 2 19 ? 35.531 -28.766 -13.717 1.00 31.68 ? 19 SER D C 1 ATOM 8283 O O . SER F 2 19 ? 34.438 -28.208 -13.724 1.00 31.00 ? 19 SER D O 1 ATOM 8284 C CB . SER F 2 19 ? 35.123 -29.989 -15.845 1.00 29.81 ? 19 SER D CB 1 ATOM 8285 O OG . SER F 2 19 ? 35.424 -31.140 -16.611 1.00 42.03 ? 19 SER D OG 1 ATOM 8286 N N . LEU F 2 20 ? 36.592 -28.263 -13.098 1.00 26.78 ? 20 LEU D N 1 ATOM 8287 C CA . LEU F 2 20 ? 36.522 -26.971 -12.429 1.00 22.43 ? 20 LEU D CA 1 ATOM 8288 C C . LEU F 2 20 ? 37.388 -25.946 -13.149 1.00 29.89 ? 20 LEU D C 1 ATOM 8289 O O . LEU F 2 20 ? 38.398 -26.289 -13.772 1.00 29.27 ? 20 LEU D O 1 ATOM 8290 C CB . LEU F 2 20 ? 36.947 -27.096 -10.965 1.00 21.24 ? 20 LEU D CB 1 ATOM 8291 C CG . LEU F 2 20 ? 36.163 -28.105 -10.124 1.00 21.26 ? 20 LEU D CG 1 ATOM 8292 C CD1 . LEU F 2 20 ? 36.751 -28.181 -8.731 1.00 19.54 ? 20 LEU D CD1 1 ATOM 8293 C CD2 . LEU F 2 20 ? 34.691 -27.727 -10.056 1.00 21.02 ? 20 LEU D CD2 1 ATOM 8294 N N . THR F 2 21 ? 36.980 -24.686 -13.067 1.00 24.84 ? 21 THR D N 1 ATOM 8295 C CA . THR F 2 21 ? 37.722 -23.607 -13.695 1.00 25.40 ? 21 THR D CA 1 ATOM 8296 C C . THR F 2 21 ? 38.061 -22.552 -12.657 1.00 26.93 ? 21 THR D C 1 ATOM 8297 O O . THR F 2 21 ? 37.232 -22.232 -11.807 1.00 24.16 ? 21 THR D O 1 ATOM 8298 C CB . THR F 2 21 ? 36.922 -22.972 -14.847 1.00 25.86 ? 21 THR D CB 1 ATOM 8299 O OG1 . THR F 2 21 ? 36.699 -23.954 -15.864 1.00 25.93 ? 21 THR D OG1 1 ATOM 8300 C CG2 . THR F 2 21 ? 37.674 -21.781 -15.451 1.00 19.45 ? 21 THR D CG2 1 ATOM 8301 N N . CYS F 2 22 ? 39.281 -22.024 -12.719 1.00 21.15 ? 22 CYS D N 1 ATOM 8302 C CA . CYS F 2 22 ? 39.692 -20.948 -11.826 1.00 22.77 ? 22 CYS D CA 1 ATOM 8303 C C . CYS F 2 22 ? 39.965 -19.670 -12.609 1.00 24.73 ? 22 CYS D C 1 ATOM 8304 O O . CYS F 2 22 ? 40.774 -19.654 -13.537 1.00 24.26 ? 22 CYS D O 1 ATOM 8305 C CB . CYS F 2 22 ? 40.934 -21.358 -11.033 1.00 25.08 ? 22 CYS D CB 1 ATOM 8306 S SG . CYS F 2 22 ? 41.413 -20.240 -9.695 1.00 32.52 ? 22 CYS D SG 1 ATOM 8307 N N . GLY F 2 23 ? 39.284 -18.599 -12.228 1.00 25.46 ? 23 GLY D N 1 ATOM 8308 C CA . GLY F 2 23 ? 39.522 -17.300 -12.826 1.00 25.23 ? 23 GLY D CA 1 ATOM 8309 C C . GLY F 2 23 ? 40.524 -16.512 -12.011 1.00 26.81 ? 23 GLY D C 1 ATOM 8310 O O . GLY F 2 23 ? 40.460 -16.488 -10.780 1.00 26.86 ? 23 GLY D O 1 ATOM 8311 N N . VAL F 2 24 ? 41.464 -15.875 -12.698 1.00 19.04 ? 24 VAL D N 1 ATOM 8312 C CA . VAL F 2 24 ? 42.450 -15.038 -12.039 1.00 14.59 ? 24 VAL D CA 1 ATOM 8313 C C . VAL F 2 24 ? 42.185 -13.579 -12.407 1.00 24.61 ? 24 VAL D C 1 ATOM 8314 O O . VAL F 2 24 ? 42.043 -13.247 -13.582 1.00 22.25 ? 24 VAL D O 1 ATOM 8315 C CB . VAL F 2 24 ? 43.890 -15.446 -12.423 1.00 20.09 ? 24 VAL D CB 1 ATOM 8316 C CG1 . VAL F 2 24 ? 44.905 -14.529 -11.757 1.00 18.47 ? 24 VAL D CG1 1 ATOM 8317 C CG2 . VAL F 2 24 ? 44.146 -16.898 -12.027 1.00 20.05 ? 24 VAL D CG2 1 ATOM 8318 N N . TYR F 2 25 ? 42.106 -12.718 -11.394 1.00 17.53 ? 25 TYR D N 1 ATOM 8319 C CA . TYR F 2 25 ? 41.749 -11.320 -11.595 1.00 16.20 ? 25 TYR D CA 1 ATOM 8320 C C . TYR F 2 25 ? 42.809 -10.410 -11.005 1.00 22.50 ? 25 TYR D C 1 ATOM 8321 O O . TYR F 2 25 ? 43.225 -10.590 -9.855 1.00 26.43 ? 25 TYR D O 1 ATOM 8322 C CB . TYR F 2 25 ? 40.386 -11.015 -10.961 1.00 19.80 ? 25 TYR D CB 1 ATOM 8323 C CG . TYR F 2 25 ? 39.298 -11.986 -11.356 1.00 20.29 ? 25 TYR D CG 1 ATOM 8324 C CD1 . TYR F 2 25 ? 39.193 -13.228 -10.738 1.00 21.17 ? 25 TYR D CD1 1 ATOM 8325 C CD2 . TYR F 2 25 ? 38.371 -11.663 -12.342 1.00 20.47 ? 25 TYR D CD2 1 ATOM 8326 C CE1 . TYR F 2 25 ? 38.204 -14.119 -11.091 1.00 23.31 ? 25 TYR D CE1 1 ATOM 8327 C CE2 . TYR F 2 25 ? 37.372 -12.551 -12.703 1.00 20.35 ? 25 TYR D CE2 1 ATOM 8328 C CZ . TYR F 2 25 ? 37.298 -13.780 -12.072 1.00 21.98 ? 25 TYR D CZ 1 ATOM 8329 O OH . TYR F 2 25 ? 36.319 -14.685 -12.415 1.00 22.54 ? 25 TYR D OH 1 ATOM 8330 N N . GLY F 2 26 ? 43.253 -9.436 -11.791 1.00 26.10 ? 26 GLY D N 1 ATOM 8331 C CA . GLY F 2 26 ? 44.176 -8.433 -11.297 1.00 28.20 ? 26 GLY D CA 1 ATOM 8332 C C . GLY F 2 26 ? 45.585 -8.580 -11.834 1.00 30.96 ? 26 GLY D C 1 ATOM 8333 O O . GLY F 2 26 ? 46.385 -7.651 -11.747 1.00 32.31 ? 26 GLY D O 1 ATOM 8334 N N . GLU F 2 27 ? 45.897 -9.750 -12.381 1.00 27.73 ? 27 GLU D N 1 ATOM 8335 C CA . GLU F 2 27 ? 47.192 -9.967 -13.018 1.00 28.86 ? 27 GLU D CA 1 ATOM 8336 C C . GLU F 2 27 ? 47.077 -11.096 -14.028 1.00 24.72 ? 27 GLU D C 1 ATOM 8337 O O . GLU F 2 27 ? 46.089 -11.829 -14.034 1.00 23.09 ? 27 GLU D O 1 ATOM 8338 C CB . GLU F 2 27 ? 48.277 -10.280 -11.978 1.00 30.83 ? 27 GLU D CB 1 ATOM 8339 C CG . GLU F 2 27 ? 48.222 -11.689 -11.389 1.00 43.35 ? 27 GLU D CG 1 ATOM 8340 C CD . GLU F 2 27 ? 49.369 -11.966 -10.411 1.00 49.91 ? 27 GLU D CD 1 ATOM 8341 O OE1 . GLU F 2 27 ? 50.163 -11.040 -10.131 1.00 60.58 ? 27 GLU D OE1 1 ATOM 8342 O OE2 . GLU F 2 27 ? 49.473 -13.107 -9.909 1.00 31.23 ? 27 GLU D OE2 1 ATOM 8343 N N . SER F 2 28 ? 48.079 -11.230 -14.890 1.00 26.52 ? 28 SER D N 1 ATOM 8344 C CA . SER F 2 28 ? 48.081 -12.306 -15.871 1.00 27.81 ? 28 SER D CA 1 ATOM 8345 C C . SER F 2 28 ? 48.545 -13.601 -15.214 1.00 28.84 ? 28 SER D C 1 ATOM 8346 O O . SER F 2 28 ? 48.842 -13.628 -14.016 1.00 25.69 ? 28 SER D O 1 ATOM 8347 C CB . SER F 2 28 ? 48.974 -11.957 -17.061 1.00 31.73 ? 28 SER D CB 1 ATOM 8348 O OG . SER F 2 28 ? 50.319 -12.316 -16.809 1.00 34.28 ? 28 SER D OG 1 ATOM 8349 N N . LEU F 2 29 ? 48.603 -14.674 -15.995 1.00 25.97 ? 29 LEU D N 1 ATOM 8350 C CA . LEU F 2 29 ? 49.041 -15.963 -15.474 1.00 25.07 ? 29 LEU D CA 1 ATOM 8351 C C . LEU F 2 29 ? 50.561 -16.091 -15.488 1.00 26.39 ? 29 LEU D C 1 ATOM 8352 O O . LEU F 2 29 ? 51.118 -16.988 -14.859 1.00 27.12 ? 29 LEU D O 1 ATOM 8353 C CB . LEU F 2 29 ? 48.423 -17.102 -16.281 1.00 24.05 ? 29 LEU D CB 1 ATOM 8354 C CG . LEU F 2 29 ? 46.898 -17.108 -16.360 1.00 32.21 ? 29 LEU D CG 1 ATOM 8355 C CD1 . LEU F 2 29 ? 46.423 -18.239 -17.258 1.00 32.15 ? 29 LEU D CD1 1 ATOM 8356 C CD2 . LEU F 2 29 ? 46.294 -17.221 -14.970 1.00 31.61 ? 29 LEU D CD2 1 ATOM 8357 N N . SER F 2 30 ? 51.227 -15.189 -16.205 1.00 23.28 ? 30 SER D N 1 ATOM 8358 C CA . SER F 2 30 ? 52.675 -15.273 -16.385 1.00 25.99 ? 30 SER D CA 1 ATOM 8359 C C . SER F 2 30 ? 53.447 -15.129 -15.080 1.00 28.90 ? 30 SER D C 1 ATOM 8360 O O . SER F 2 30 ? 53.112 -14.293 -14.243 1.00 29.06 ? 30 SER D O 1 ATOM 8361 C CB . SER F 2 30 ? 53.150 -14.206 -17.371 1.00 26.00 ? 30 SER D CB 1 ATOM 8362 O OG . SER F 2 30 ? 52.678 -14.481 -18.677 1.00 35.76 ? 30 SER D OG 1 ATOM 8363 N N . GLY F 2 31 ? 54.474 -15.957 -14.911 1.00 25.07 ? 31 GLY D N 1 ATOM 8364 C CA . GLY F 2 31 ? 55.425 -15.787 -13.825 1.00 24.90 ? 31 GLY D CA 1 ATOM 8365 C C . GLY F 2 31 ? 55.125 -16.570 -12.565 1.00 27.64 ? 31 GLY D C 1 ATOM 8366 O O . GLY F 2 31 ? 55.877 -16.502 -11.587 1.00 23.92 ? 31 GLY D O 1 ATOM 8367 N N . HIS F 2 32 ? 54.031 -17.321 -12.575 1.00 21.85 ? 32 HIS D N 1 ATOM 8368 C CA . HIS F 2 32 ? 53.652 -18.086 -11.398 1.00 19.11 ? 32 HIS D CA 1 ATOM 8369 C C . HIS F 2 32 ? 53.304 -19.519 -11.720 1.00 23.20 ? 32 HIS D C 1 ATOM 8370 O O . HIS F 2 32 ? 52.914 -19.840 -12.840 1.00 19.92 ? 32 HIS D O 1 ATOM 8371 C CB . HIS F 2 32 ? 52.461 -17.435 -10.689 1.00 15.57 ? 32 HIS D CB 1 ATOM 8372 C CG . HIS F 2 32 ? 52.756 -16.079 -10.146 1.00 18.25 ? 32 HIS D CG 1 ATOM 8373 N ND1 . HIS F 2 32 ? 52.568 -14.927 -10.881 1.00 21.95 ? 32 HIS D ND1 1 ATOM 8374 C CD2 . HIS F 2 32 ? 53.240 -15.682 -8.945 1.00 21.50 ? 32 HIS D CD2 1 ATOM 8375 C CE1 . HIS F 2 32 ? 52.918 -13.883 -10.157 1.00 20.78 ? 32 HIS D CE1 1 ATOM 8376 N NE2 . HIS F 2 32 ? 53.331 -14.311 -8.977 1.00 22.51 ? 32 HIS D NE2 1 ATOM 8377 N N . TYR F 2 33 ? 53.448 -20.375 -10.716 1.00 23.62 ? 33 TYR D N 1 ATOM 8378 C CA . TYR F 2 33 ? 52.857 -21.701 -10.741 1.00 14.40 ? 33 TYR D CA 1 ATOM 8379 C C . TYR F 2 33 ? 51.411 -21.590 -10.295 1.00 28.47 ? 33 TYR D C 1 ATOM 8380 O O . TYR F 2 33 ? 51.100 -20.841 -9.367 1.00 28.06 ? 33 TYR D O 1 ATOM 8381 C CB . TYR F 2 33 ? 53.610 -22.666 -9.823 1.00 21.56 ? 33 TYR D CB 1 ATOM 8382 C CG . TYR F 2 33 ? 54.951 -23.126 -10.350 1.00 25.34 ? 33 TYR D CG 1 ATOM 8383 C CD1 . TYR F 2 33 ? 55.056 -24.288 -11.101 1.00 27.24 ? 33 TYR D CD1 1 ATOM 8384 C CD2 . TYR F 2 33 ? 56.111 -22.409 -10.088 1.00 28.76 ? 33 TYR D CD2 1 ATOM 8385 C CE1 . TYR F 2 33 ? 56.274 -24.722 -11.576 1.00 32.85 ? 33 TYR D CE1 1 ATOM 8386 C CE2 . TYR F 2 33 ? 57.340 -22.838 -10.563 1.00 31.77 ? 33 TYR D CE2 1 ATOM 8387 C CZ . TYR F 2 33 ? 57.411 -23.995 -11.307 1.00 31.66 ? 33 TYR D CZ 1 ATOM 8388 O OH . TYR F 2 33 ? 58.621 -24.428 -11.788 1.00 37.55 ? 33 TYR D OH 1 ATOM 8389 N N . TRP F 2 34 ? 50.536 -22.345 -10.949 1.00 20.34 ? 34 TRP D N 1 ATOM 8390 C CA . TRP F 2 34 ? 49.123 -22.366 -10.612 1.00 19.36 ? 34 TRP D CA 1 ATOM 8391 C C . TRP F 2 34 ? 48.751 -23.765 -10.168 1.00 25.03 ? 34 TRP D C 1 ATOM 8392 O O . TRP F 2 34 ? 49.178 -24.741 -10.779 1.00 28.05 ? 34 TRP D O 1 ATOM 8393 C CB . TRP F 2 34 ? 48.296 -21.902 -11.806 1.00 18.17 ? 34 TRP D CB 1 ATOM 8394 C CG . TRP F 2 34 ? 48.705 -20.523 -12.180 1.00 23.50 ? 34 TRP D CG 1 ATOM 8395 C CD1 . TRP F 2 34 ? 49.614 -20.165 -13.132 1.00 25.85 ? 34 TRP D CD1 1 ATOM 8396 C CD2 . TRP F 2 34 ? 48.276 -19.309 -11.556 1.00 17.89 ? 34 TRP D CD2 1 ATOM 8397 N NE1 . TRP F 2 34 ? 49.753 -18.797 -13.162 1.00 20.23 ? 34 TRP D NE1 1 ATOM 8398 C CE2 . TRP F 2 34 ? 48.939 -18.245 -12.199 1.00 20.29 ? 34 TRP D CE2 1 ATOM 8399 C CE3 . TRP F 2 34 ? 47.377 -19.013 -10.522 1.00 17.88 ? 34 TRP D CE3 1 ATOM 8400 C CZ2 . TRP F 2 34 ? 48.742 -16.909 -11.846 1.00 18.51 ? 34 TRP D CZ2 1 ATOM 8401 C CZ3 . TRP F 2 34 ? 47.172 -17.686 -10.174 1.00 20.40 ? 34 TRP D CZ3 1 ATOM 8402 C CH2 . TRP F 2 34 ? 47.854 -16.649 -10.833 1.00 21.38 ? 34 TRP D CH2 1 ATOM 8403 N N . SER F 2 35 ? 47.973 -23.858 -9.095 1.00 20.67 ? 35 SER D N 1 ATOM 8404 C CA . SER F 2 35 ? 47.808 -25.124 -8.389 1.00 24.76 ? 35 SER D CA 1 ATOM 8405 C C . SER F 2 35 ? 46.364 -25.457 -8.030 1.00 21.58 ? 35 SER D C 1 ATOM 8406 O O . SER F 2 35 ? 45.524 -24.567 -7.881 1.00 21.72 ? 35 SER D O 1 ATOM 8407 C CB . SER F 2 35 ? 48.650 -25.104 -7.108 1.00 23.35 ? 35 SER D CB 1 ATOM 8408 O OG . SER F 2 35 ? 48.606 -26.359 -6.450 1.00 31.45 ? 35 SER D OG 1 ATOM 8409 N N . TRP F 2 36 ? 46.088 -26.751 -7.889 1.00 17.63 ? 36 TRP D N 1 ATOM 8410 C CA . TRP F 2 36 ? 44.824 -27.210 -7.334 1.00 21.93 ? 36 TRP D CA 1 ATOM 8411 C C . TRP F 2 36 ? 45.095 -28.027 -6.074 1.00 21.75 ? 36 TRP D C 1 ATOM 8412 O O . TRP F 2 36 ? 46.067 -28.780 -6.001 1.00 19.97 ? 36 TRP D O 1 ATOM 8413 C CB . TRP F 2 36 ? 44.024 -28.036 -8.354 1.00 20.78 ? 36 TRP D CB 1 ATOM 8414 C CG . TRP F 2 36 ? 43.443 -27.229 -9.480 1.00 19.24 ? 36 TRP D CG 1 ATOM 8415 C CD1 . TRP F 2 36 ? 44.015 -26.985 -10.694 1.00 18.87 ? 36 TRP D CD1 1 ATOM 8416 C CD2 . TRP F 2 36 ? 42.171 -26.557 -9.493 1.00 23.60 ? 36 TRP D CD2 1 ATOM 8417 N NE1 . TRP F 2 36 ? 43.184 -26.201 -11.459 1.00 22.82 ? 36 TRP D NE1 1 ATOM 8418 C CE2 . TRP F 2 36 ? 42.051 -25.924 -10.746 1.00 19.84 ? 36 TRP D CE2 1 ATOM 8419 C CE3 . TRP F 2 36 ? 41.133 -26.427 -8.566 1.00 24.23 ? 36 TRP D CE3 1 ATOM 8420 C CZ2 . TRP F 2 36 ? 40.922 -25.176 -11.094 1.00 22.49 ? 36 TRP D CZ2 1 ATOM 8421 C CZ3 . TRP F 2 36 ? 40.016 -25.683 -8.915 1.00 19.53 ? 36 TRP D CZ3 1 ATOM 8422 C CH2 . TRP F 2 36 ? 39.918 -25.071 -10.169 1.00 16.50 ? 36 TRP D CH2 1 ATOM 8423 N N . VAL F 2 37 ? 44.224 -27.860 -5.086 1.00 20.78 ? 37 VAL D N 1 ATOM 8424 C CA . VAL F 2 37 ? 44.331 -28.526 -3.795 1.00 21.45 ? 37 VAL D CA 1 ATOM 8425 C C . VAL F 2 37 ? 42.930 -28.948 -3.354 1.00 28.15 ? 37 VAL D C 1 ATOM 8426 O O . VAL F 2 37 ? 41.987 -28.186 -3.514 1.00 30.50 ? 37 VAL D O 1 ATOM 8427 C CB . VAL F 2 37 ? 44.961 -27.597 -2.728 1.00 24.89 ? 37 VAL D CB 1 ATOM 8428 C CG1 . VAL F 2 37 ? 44.900 -28.231 -1.349 1.00 24.60 ? 37 VAL D CG1 1 ATOM 8429 C CG2 . VAL F 2 37 ? 46.409 -27.236 -3.103 1.00 13.72 ? 37 VAL D CG2 1 ATOM 8430 N N . ARG F 2 38 ? 42.777 -30.158 -2.822 1.00 24.95 ? 38 ARG D N 1 ATOM 8431 C CA . ARG F 2 38 ? 41.470 -30.573 -2.333 1.00 27.25 ? 38 ARG D CA 1 ATOM 8432 C C . ARG F 2 38 ? 41.503 -30.921 -0.850 1.00 31.16 ? 38 ARG D C 1 ATOM 8433 O O . ARG F 2 38 ? 42.566 -31.158 -0.267 1.00 27.75 ? 38 ARG D O 1 ATOM 8434 C CB . ARG F 2 38 ? 40.937 -31.763 -3.135 1.00 26.81 ? 38 ARG D CB 1 ATOM 8435 C CG . ARG F 2 38 ? 41.624 -33.088 -2.845 1.00 24.09 ? 38 ARG D CG 1 ATOM 8436 C CD . ARG F 2 38 ? 41.074 -34.159 -3.760 1.00 27.19 ? 38 ARG D CD 1 ATOM 8437 N NE . ARG F 2 38 ? 41.707 -35.453 -3.550 1.00 31.37 ? 38 ARG D NE 1 ATOM 8438 C CZ . ARG F 2 38 ? 41.351 -36.565 -4.184 1.00 34.06 ? 38 ARG D CZ 1 ATOM 8439 N NH1 . ARG F 2 38 ? 40.363 -36.535 -5.072 1.00 29.97 ? 38 ARG D NH1 1 ATOM 8440 N NH2 . ARG F 2 38 ? 41.980 -37.705 -3.929 1.00 33.35 ? 38 ARG D NH2 1 ATOM 8441 N N . GLN F 2 39 ? 40.320 -30.957 -0.251 1.00 26.39 ? 39 GLN D N 1 ATOM 8442 C CA . GLN F 2 39 ? 40.188 -31.201 1.172 1.00 26.31 ? 39 GLN D CA 1 ATOM 8443 C C . GLN F 2 39 ? 38.942 -32.034 1.453 1.00 30.20 ? 39 GLN D C 1 ATOM 8444 O O . GLN F 2 39 ? 37.837 -31.495 1.507 1.00 27.54 ? 39 GLN D O 1 ATOM 8445 C CB . GLN F 2 39 ? 40.129 -29.872 1.933 1.00 27.91 ? 39 GLN D CB 1 ATOM 8446 C CG . GLN F 2 39 ? 40.139 -30.012 3.452 1.00 26.09 ? 39 GLN D CG 1 ATOM 8447 C CD . GLN F 2 39 ? 40.244 -28.673 4.146 1.00 32.12 ? 39 GLN D CD 1 ATOM 8448 O OE1 . GLN F 2 39 ? 39.726 -27.671 3.654 1.00 30.34 ? 39 GLN D OE1 1 ATOM 8449 N NE2 . GLN F 2 39 ? 40.931 -28.641 5.286 1.00 24.44 ? 39 GLN D NE2 1 ATOM 8450 N N . PRO F 2 40 ? 39.117 -33.356 1.621 1.00 32.81 ? 40 PRO D N 1 ATOM 8451 C CA . PRO F 2 40 ? 37.999 -34.241 1.961 1.00 36.84 ? 40 PRO D CA 1 ATOM 8452 C C . PRO F 2 40 ? 37.366 -33.822 3.279 1.00 43.89 ? 40 PRO D C 1 ATOM 8453 O O . PRO F 2 40 ? 38.070 -33.297 4.142 1.00 39.85 ? 40 PRO D O 1 ATOM 8454 C CB . PRO F 2 40 ? 38.658 -35.624 2.072 1.00 39.08 ? 40 PRO D CB 1 ATOM 8455 C CG . PRO F 2 40 ? 39.923 -35.509 1.277 1.00 40.51 ? 40 PRO D CG 1 ATOM 8456 C CD . PRO F 2 40 ? 40.384 -34.096 1.483 1.00 29.22 ? 40 PRO D CD 1 ATOM 8457 N N . PRO F 2 41 ? 36.051 -34.038 3.429 1.00 55.15 ? 41 PRO D N 1 ATOM 8458 C CA . PRO F 2 41 ? 35.314 -33.607 4.623 1.00 60.37 ? 41 PRO D CA 1 ATOM 8459 C C . PRO F 2 41 ? 35.907 -34.174 5.911 1.00 59.37 ? 41 PRO D C 1 ATOM 8460 O O . PRO F 2 41 ? 35.995 -35.393 6.064 1.00 57.06 ? 41 PRO D O 1 ATOM 8461 C CB . PRO F 2 41 ? 33.904 -34.155 4.381 1.00 61.07 ? 41 PRO D CB 1 ATOM 8462 C CG . PRO F 2 41 ? 33.810 -34.309 2.899 1.00 60.97 ? 41 PRO D CG 1 ATOM 8463 C CD . PRO F 2 41 ? 35.178 -34.725 2.463 1.00 55.72 ? 41 PRO D CD 1 ATOM 8464 N N . GLY F 2 42 ? 36.317 -33.290 6.815 1.00 54.81 ? 42 GLY D N 1 ATOM 8465 C CA . GLY F 2 42 ? 36.899 -33.705 8.078 1.00 60.41 ? 42 GLY D CA 1 ATOM 8466 C C . GLY F 2 42 ? 38.287 -34.309 7.950 1.00 62.85 ? 42 GLY D C 1 ATOM 8467 O O . GLY F 2 42 ? 38.719 -35.079 8.809 1.00 70.54 ? 42 GLY D O 1 ATOM 8468 N N . LYS F 2 43 ? 38.988 -33.970 6.874 1.00 57.08 ? 43 LYS D N 1 ATOM 8469 C CA . LYS F 2 43 ? 40.357 -34.436 6.685 1.00 54.70 ? 43 LYS D CA 1 ATOM 8470 C C . LYS F 2 43 ? 41.258 -33.285 6.246 1.00 51.43 ? 43 LYS D C 1 ATOM 8471 O O . LYS F 2 43 ? 40.816 -32.136 6.167 1.00 47.48 ? 43 LYS D O 1 ATOM 8472 C CB . LYS F 2 43 ? 40.410 -35.584 5.672 1.00 55.40 ? 43 LYS D CB 1 ATOM 8473 C CG . LYS F 2 43 ? 39.824 -36.889 6.195 1.00 62.14 ? 43 LYS D CG 1 ATOM 8474 C CD . LYS F 2 43 ? 40.489 -38.105 5.554 1.00 73.35 ? 43 LYS D CD 1 ATOM 8475 C CE . LYS F 2 43 ? 39.910 -38.423 4.180 1.00 78.05 ? 43 LYS D CE 1 ATOM 8476 N NZ . LYS F 2 43 ? 38.569 -39.074 4.274 1.00 79.67 ? 43 LYS D NZ 1 ATOM 8477 N N . ARG F 2 44 ? 42.521 -33.590 5.969 1.00 48.72 ? 44 ARG D N 1 ATOM 8478 C CA . ARG F 2 44 ? 43.498 -32.544 5.697 1.00 43.62 ? 44 ARG D CA 1 ATOM 8479 C C . ARG F 2 44 ? 43.560 -32.186 4.216 1.00 38.75 ? 44 ARG D C 1 ATOM 8480 O O . ARG F 2 44 ? 43.088 -32.931 3.361 1.00 31.61 ? 44 ARG D O 1 ATOM 8481 C CB . ARG F 2 44 ? 44.884 -32.965 6.189 1.00 39.45 ? 44 ARG D CB 1 ATOM 8482 C CG . ARG F 2 44 ? 45.571 -33.989 5.312 1.00 34.64 ? 44 ARG D CG 1 ATOM 8483 C CD . ARG F 2 44 ? 46.909 -34.395 5.908 1.00 37.46 ? 44 ARG D CD 1 ATOM 8484 N NE . ARG F 2 44 ? 46.749 -35.204 7.114 1.00 43.21 ? 44 ARG D NE 1 ATOM 8485 C CZ . ARG F 2 44 ? 47.757 -35.645 7.862 1.00 41.22 ? 44 ARG D CZ 1 ATOM 8486 N NH1 . ARG F 2 44 ? 49.011 -35.352 7.537 1.00 39.46 ? 44 ARG D NH1 1 ATOM 8487 N NH2 . ARG F 2 44 ? 47.511 -36.378 8.939 1.00 42.97 ? 44 ARG D NH2 1 ATOM 8488 N N . LEU F 2 45 ? 44.144 -31.030 3.927 1.00 40.49 ? 45 LEU D N 1 ATOM 8489 C CA . LEU F 2 45 ? 44.334 -30.596 2.554 1.00 31.40 ? 45 LEU D CA 1 ATOM 8490 C C . LEU F 2 45 ? 45.295 -31.522 1.831 1.00 27.89 ? 45 LEU D C 1 ATOM 8491 O O . LEU F 2 45 ? 46.234 -32.048 2.424 1.00 26.90 ? 45 LEU D O 1 ATOM 8492 C CB . LEU F 2 45 ? 44.850 -29.163 2.521 1.00 31.59 ? 45 LEU D CB 1 ATOM 8493 C CG . LEU F 2 45 ? 43.927 -28.179 3.233 1.00 33.02 ? 45 LEU D CG 1 ATOM 8494 C CD1 . LEU F 2 45 ? 44.745 -27.160 3.998 1.00 28.32 ? 45 LEU D CD1 1 ATOM 8495 C CD2 . LEU F 2 45 ? 43.006 -27.499 2.230 1.00 34.93 ? 45 LEU D CD2 1 ATOM 8496 N N . GLU F 2 46 ? 45.048 -31.722 0.544 1.00 31.59 ? 46 GLU D N 1 ATOM 8497 C CA . GLU F 2 46 ? 45.890 -32.581 -0.272 1.00 27.67 ? 46 GLU D CA 1 ATOM 8498 C C . GLU F 2 46 ? 46.172 -31.927 -1.621 1.00 26.18 ? 46 GLU D C 1 ATOM 8499 O O . GLU F 2 46 ? 45.253 -31.547 -2.350 1.00 29.09 ? 46 GLU D O 1 ATOM 8500 C CB . GLU F 2 46 ? 45.232 -33.947 -0.471 1.00 28.44 ? 46 GLU D CB 1 ATOM 8501 C CG . GLU F 2 46 ? 45.878 -34.796 -1.560 1.00 44.91 ? 46 GLU D CG 1 ATOM 8502 C CD . GLU F 2 46 ? 45.041 -36.011 -1.935 1.00 58.50 ? 46 GLU D CD 1 ATOM 8503 O OE1 . GLU F 2 46 ? 43.882 -36.103 -1.471 1.00 54.56 ? 46 GLU D OE1 1 ATOM 8504 O OE2 . GLU F 2 46 ? 45.546 -36.870 -2.695 1.00 63.01 ? 46 GLU D OE2 1 ATOM 8505 N N . TRP F 2 47 ? 47.454 -31.804 -1.941 1.00 16.25 ? 47 TRP D N 1 ATOM 8506 C CA . TRP F 2 47 ? 47.908 -31.190 -3.181 1.00 20.81 ? 47 TRP D CA 1 ATOM 8507 C C . TRP F 2 47 ? 47.649 -32.102 -4.376 1.00 26.65 ? 47 TRP D C 1 ATOM 8508 O O . TRP F 2 47 ? 48.052 -33.268 -4.379 1.00 20.82 ? 47 TRP D O 1 ATOM 8509 C CB . TRP F 2 47 ? 49.398 -30.851 -3.056 1.00 23.87 ? 47 TRP D CB 1 ATOM 8510 C CG . TRP F 2 47 ? 50.076 -30.387 -4.300 1.00 24.52 ? 47 TRP D CG 1 ATOM 8511 C CD1 . TRP F 2 47 ? 50.064 -29.127 -4.819 1.00 25.29 ? 47 TRP D CD1 1 ATOM 8512 C CD2 . TRP F 2 47 ? 50.919 -31.168 -5.156 1.00 29.33 ? 47 TRP D CD2 1 ATOM 8513 N NE1 . TRP F 2 47 ? 50.829 -29.080 -5.961 1.00 29.00 ? 47 TRP D NE1 1 ATOM 8514 C CE2 . TRP F 2 47 ? 51.363 -30.318 -6.189 1.00 28.15 ? 47 TRP D CE2 1 ATOM 8515 C CE3 . TRP F 2 47 ? 51.327 -32.506 -5.157 1.00 32.83 ? 47 TRP D CE3 1 ATOM 8516 C CZ2 . TRP F 2 47 ? 52.205 -30.765 -7.211 1.00 26.64 ? 47 TRP D CZ2 1 ATOM 8517 C CZ3 . TRP F 2 47 ? 52.161 -32.946 -6.176 1.00 31.03 ? 47 TRP D CZ3 1 ATOM 8518 C CH2 . TRP F 2 47 ? 52.590 -32.078 -7.187 1.00 24.62 ? 47 TRP D CH2 1 ATOM 8519 N N . ILE F 2 48 ? 46.976 -31.564 -5.389 1.00 25.30 ? 48 ILE D N 1 ATOM 8520 C CA . ILE F 2 48 ? 46.601 -32.334 -6.573 1.00 23.62 ? 48 ILE D CA 1 ATOM 8521 C C . ILE F 2 48 ? 47.631 -32.183 -7.682 1.00 22.80 ? 48 ILE D C 1 ATOM 8522 O O . ILE F 2 48 ? 48.024 -33.159 -8.319 1.00 27.91 ? 48 ILE D O 1 ATOM 8523 C CB . ILE F 2 48 ? 45.218 -31.905 -7.087 1.00 22.04 ? 48 ILE D CB 1 ATOM 8524 C CG1 . ILE F 2 48 ? 44.142 -32.360 -6.103 1.00 21.65 ? 48 ILE D CG1 1 ATOM 8525 C CG2 . ILE F 2 48 ? 44.942 -32.468 -8.478 1.00 15.37 ? 48 ILE D CG2 1 ATOM 8526 C CD1 . ILE F 2 48 ? 42.817 -31.619 -6.264 1.00 24.37 ? 48 ILE D CD1 1 ATOM 8527 N N . GLY F 2 49 ? 48.084 -30.956 -7.897 1.00 26.38 ? 49 GLY D N 1 ATOM 8528 C CA . GLY F 2 49 ? 49.106 -30.697 -8.891 1.00 19.25 ? 49 GLY D CA 1 ATOM 8529 C C . GLY F 2 49 ? 49.276 -29.221 -9.176 1.00 24.32 ? 49 GLY D C 1 ATOM 8530 O O . GLY F 2 49 ? 48.551 -28.387 -8.635 1.00 25.29 ? 49 GLY D O 1 ATOM 8531 N N . GLU F 2 50 ? 50.241 -28.895 -10.027 1.00 24.05 ? 50 GLU D N 1 ATOM 8532 C CA . GLU F 2 50 ? 50.491 -27.506 -10.376 1.00 24.75 ? 50 GLU D CA 1 ATOM 8533 C C . GLU F 2 50 ? 51.131 -27.410 -11.754 1.00 28.40 ? 50 GLU D C 1 ATOM 8534 O O . GLU F 2 50 ? 51.640 -28.397 -12.282 1.00 29.51 ? 50 GLU D O 1 ATOM 8535 C CB . GLU F 2 50 ? 51.374 -26.832 -9.320 1.00 22.48 ? 50 GLU D CB 1 ATOM 8536 C CG . GLU F 2 50 ? 52.824 -27.279 -9.338 1.00 27.06 ? 50 GLU D CG 1 ATOM 8537 C CD . GLU F 2 50 ? 53.565 -26.921 -8.058 1.00 33.25 ? 50 GLU D CD 1 ATOM 8538 O OE1 . GLU F 2 50 ? 52.977 -27.052 -6.957 1.00 24.27 ? 50 GLU D OE1 1 ATOM 8539 O OE2 . GLU F 2 50 ? 54.742 -26.509 -8.158 1.00 27.88 ? 50 GLU D OE2 1 ATOM 8540 N N . ILE F 2 51 ? 51.101 -26.215 -12.329 1.00 25.20 ? 51 ILE D N 1 ATOM 8541 C CA . ILE F 2 51 ? 51.552 -26.014 -13.696 1.00 26.52 ? 51 ILE D CA 1 ATOM 8542 C C . ILE F 2 51 ? 51.907 -24.549 -13.937 1.00 23.22 ? 51 ILE D C 1 ATOM 8543 O O . ILE F 2 51 ? 51.389 -23.658 -13.257 1.00 23.62 ? 51 ILE D O 1 ATOM 8544 C CB . ILE F 2 51 ? 50.467 -26.457 -14.705 1.00 30.44 ? 51 ILE D CB 1 ATOM 8545 C CG1 . ILE F 2 51 ? 51.048 -26.648 -16.108 1.00 37.56 ? 51 ILE D CG1 1 ATOM 8546 C CG2 . ILE F 2 51 ? 49.318 -25.468 -14.723 1.00 31.31 ? 51 ILE D CG2 1 ATOM 8547 C CD1 . ILE F 2 51 ? 49.992 -26.876 -17.169 1.00 45.19 ? 51 ILE D CD1 1 ATOM 8548 N N . LYS F 2 52 ? 52.803 -24.308 -14.890 1.00 19.81 ? 52 LYS D N 1 ATOM 8549 C CA . LYS F 2 52 ? 53.139 -22.953 -15.322 1.00 28.66 ? 52 LYS D CA 1 ATOM 8550 C C . LYS F 2 52 ? 53.265 -22.941 -16.838 1.00 28.23 ? 52 LYS D C 1 ATOM 8551 O O . LYS F 2 52 ? 53.480 -23.982 -17.454 1.00 30.34 ? 52 LYS D O 1 ATOM 8552 C CB . LYS F 2 52 ? 54.437 -22.471 -14.683 1.00 26.62 ? 52 LYS D CB 1 ATOM 8553 C CG . LYS F 2 52 ? 55.664 -23.127 -15.280 1.00 34.39 ? 52 LYS D CG 1 ATOM 8554 C CD . LYS F 2 52 ? 56.869 -22.967 -14.380 1.00 39.73 ? 52 LYS D CD 1 ATOM 8555 C CE . LYS F 2 52 ? 57.531 -21.631 -14.556 1.00 34.39 ? 52 LYS D CE 1 ATOM 8556 N NZ . LYS F 2 52 ? 58.531 -21.674 -15.661 1.00 39.73 ? 52 LYS D NZ 1 ATOM 8557 N N . HIS F 2 53 ? 53.146 -21.760 -17.428 1.00 24.43 ? 53 HIS D N 1 ATOM 8558 C CA . HIS F 2 53 ? 53.086 -21.630 -18.879 1.00 31.15 ? 53 HIS D CA 1 ATOM 8559 C C . HIS F 2 53 ? 54.334 -22.174 -19.575 1.00 34.33 ? 53 HIS D C 1 ATOM 8560 O O . HIS F 2 53 ? 54.232 -22.981 -20.499 1.00 37.29 ? 53 HIS D O 1 ATOM 8561 C CB . HIS F 2 53 ? 52.862 -20.170 -19.260 1.00 24.42 ? 53 HIS D CB 1 ATOM 8562 C CG . HIS F 2 53 ? 52.837 -19.931 -20.736 1.00 31.88 ? 53 HIS D CG 1 ATOM 8563 N ND1 . HIS F 2 53 ? 52.068 -20.682 -21.597 1.00 32.01 ? 53 HIS D ND1 1 ATOM 8564 C CD2 . HIS F 2 53 ? 53.488 -19.025 -21.503 1.00 37.55 ? 53 HIS D CD2 1 ATOM 8565 C CE1 . HIS F 2 53 ? 52.248 -20.250 -22.833 1.00 37.85 ? 53 HIS D CE1 1 ATOM 8566 N NE2 . HIS F 2 53 ? 53.104 -19.245 -22.803 1.00 43.14 ? 53 HIS D NE2 1 ATOM 8567 N N . ASN F 2 54 ? 55.508 -21.733 -19.135 1.00 30.20 ? 54 ASN D N 1 ATOM 8568 C CA . ASN F 2 54 ? 56.761 -22.276 -19.660 1.00 35.53 ? 54 ASN D CA 1 ATOM 8569 C C . ASN F 2 54 ? 57.269 -23.418 -18.791 1.00 46.32 ? 54 ASN D C 1 ATOM 8570 O O . ASN F 2 54 ? 58.240 -23.262 -18.052 1.00 51.49 ? 54 ASN D O 1 ATOM 8571 C CB . ASN F 2 54 ? 57.831 -21.183 -19.769 1.00 32.06 ? 54 ASN D CB 1 ATOM 8572 C CG . ASN F 2 54 ? 57.641 -20.306 -20.988 1.00 30.61 ? 54 ASN D CG 1 ATOM 8573 O OD1 . ASN F 2 54 ? 57.864 -20.742 -22.116 1.00 40.54 ? 54 ASN D OD1 1 ATOM 8574 N ND2 . ASN F 2 54 ? 57.223 -19.064 -20.768 1.00 35.30 ? 54 ASN D ND2 1 ATOM 8575 N N . GLY F 2 55 ? 56.604 -24.565 -18.887 1.00 50.86 ? 55 GLY D N 1 ATOM 8576 C CA . GLY F 2 55 ? 56.931 -25.713 -18.064 1.00 42.74 ? 55 GLY D CA 1 ATOM 8577 C C . GLY F 2 55 ? 55.967 -26.861 -18.287 1.00 45.01 ? 55 GLY D C 1 ATOM 8578 O O . GLY F 2 55 ? 55.111 -26.803 -19.166 1.00 46.70 ? 55 GLY D O 1 ATOM 8579 N N . SER F 2 56 ? 56.109 -27.909 -17.482 1.00 49.27 ? 56 SER D N 1 ATOM 8580 C CA . SER F 2 56 ? 55.289 -29.108 -17.616 1.00 45.94 ? 56 SER D CA 1 ATOM 8581 C C . SER F 2 56 ? 54.390 -29.302 -16.403 1.00 41.02 ? 56 SER D C 1 ATOM 8582 O O . SER F 2 56 ? 54.729 -28.867 -15.305 1.00 45.53 ? 56 SER D O 1 ATOM 8583 C CB . SER F 2 56 ? 56.179 -30.340 -17.803 1.00 46.70 ? 56 SER D CB 1 ATOM 8584 O OG . SER F 2 56 ? 57.023 -30.192 -18.932 1.00 56.56 ? 56 SER D OG 1 ATOM 8585 N N . PRO F 2 57 ? 53.240 -29.963 -16.595 1.00 43.52 ? 57 PRO D N 1 ATOM 8586 C CA . PRO F 2 57 ? 52.365 -30.250 -15.455 1.00 39.92 ? 57 PRO D CA 1 ATOM 8587 C C . PRO F 2 57 ? 53.053 -31.149 -14.443 1.00 37.90 ? 57 PRO D C 1 ATOM 8588 O O . PRO F 2 57 ? 53.878 -31.985 -14.811 1.00 40.44 ? 57 PRO D O 1 ATOM 8589 C CB . PRO F 2 57 ? 51.168 -30.961 -16.094 1.00 43.11 ? 57 PRO D CB 1 ATOM 8590 C CG . PRO F 2 57 ? 51.197 -30.551 -17.528 1.00 47.36 ? 57 PRO D CG 1 ATOM 8591 C CD . PRO F 2 57 ? 52.652 -30.419 -17.866 1.00 46.63 ? 57 PRO D CD 1 ATOM 8592 N N . ASN F 2 58 ? 52.715 -30.968 -13.175 1.00 31.78 ? 58 ASN D N 1 ATOM 8593 C CA . ASN F 2 58 ? 53.321 -31.742 -12.105 1.00 33.05 ? 58 ASN D CA 1 ATOM 8594 C C . ASN F 2 58 ? 52.226 -32.222 -11.165 1.00 29.68 ? 58 ASN D C 1 ATOM 8595 O O . ASN F 2 58 ? 51.641 -31.421 -10.445 1.00 26.58 ? 58 ASN D O 1 ATOM 8596 C CB . ASN F 2 58 ? 54.364 -30.894 -11.368 1.00 27.57 ? 58 ASN D CB 1 ATOM 8597 C CG . ASN F 2 58 ? 55.046 -31.646 -10.246 1.00 30.75 ? 58 ASN D CG 1 ATOM 8598 O OD1 . ASN F 2 58 ? 54.988 -32.870 -10.176 1.00 34.04 ? 58 ASN D OD1 1 ATOM 8599 N ND2 . ASN F 2 58 ? 55.699 -30.909 -9.355 1.00 30.10 ? 58 ASN D ND2 1 ATOM 8600 N N . TYR F 2 59 ? 51.934 -33.522 -11.189 1.00 28.07 ? 59 TYR D N 1 ATOM 8601 C CA . TYR F 2 59 ? 50.782 -34.051 -10.461 1.00 27.91 ? 59 TYR D CA 1 ATOM 8602 C C . TYR F 2 59 ? 51.145 -34.939 -9.278 1.00 34.70 ? 59 TYR D C 1 ATOM 8603 O O . TYR F 2 59 ? 52.242 -35.493 -9.201 1.00 31.41 ? 59 TYR D O 1 ATOM 8604 C CB . TYR F 2 59 ? 49.873 -34.854 -11.394 1.00 22.75 ? 59 TYR D CB 1 ATOM 8605 C CG . TYR F 2 59 ? 49.433 -34.138 -12.648 1.00 28.22 ? 59 TYR D CG 1 ATOM 8606 C CD1 . TYR F 2 59 ? 48.785 -32.912 -12.584 1.00 33.29 ? 59 TYR D CD1 1 ATOM 8607 C CD2 . TYR F 2 59 ? 49.642 -34.704 -13.899 1.00 31.35 ? 59 TYR D CD2 1 ATOM 8608 C CE1 . TYR F 2 59 ? 48.375 -32.260 -13.733 1.00 31.66 ? 59 TYR D CE1 1 ATOM 8609 C CE2 . TYR F 2 59 ? 49.234 -34.060 -15.053 1.00 35.48 ? 59 TYR D CE2 1 ATOM 8610 C CZ . TYR F 2 59 ? 48.599 -32.840 -14.963 1.00 36.14 ? 59 TYR D CZ 1 ATOM 8611 O OH . TYR F 2 59 ? 48.194 -32.197 -16.110 1.00 39.35 ? 59 TYR D OH 1 ATOM 8612 N N . HIS F 2 60 ? 50.192 -35.073 -8.363 1.00 33.83 ? 60 HIS D N 1 ATOM 8613 C CA . HIS F 2 60 ? 50.275 -36.043 -7.286 1.00 27.94 ? 60 HIS D CA 1 ATOM 8614 C C . HIS F 2 60 ? 50.235 -37.430 -7.922 1.00 25.99 ? 60 HIS D C 1 ATOM 8615 O O . HIS F 2 60 ? 49.329 -37.718 -8.702 1.00 29.30 ? 60 HIS D O 1 ATOM 8616 C CB . HIS F 2 60 ? 49.115 -35.842 -6.305 1.00 29.45 ? 60 HIS D CB 1 ATOM 8617 C CG . HIS F 2 60 ? 49.358 -36.412 -4.943 1.00 35.39 ? 60 HIS D CG 1 ATOM 8618 N ND1 . HIS F 2 60 ? 49.301 -37.764 -4.679 1.00 41.05 ? 60 HIS D ND1 1 ATOM 8619 C CD2 . HIS F 2 60 ? 49.640 -35.810 -3.763 1.00 37.20 ? 60 HIS D CD2 1 ATOM 8620 C CE1 . HIS F 2 60 ? 49.551 -37.971 -3.398 1.00 39.78 ? 60 HIS D CE1 1 ATOM 8621 N NE2 . HIS F 2 60 ? 49.758 -36.802 -2.820 1.00 44.65 ? 60 HIS D NE2 1 ATOM 8622 N N . PRO F 2 61 ? 51.222 -38.287 -7.611 1.00 24.65 ? 61 PRO D N 1 ATOM 8623 C CA . PRO F 2 61 ? 51.341 -39.582 -8.301 1.00 29.52 ? 61 PRO D CA 1 ATOM 8624 C C . PRO F 2 61 ? 50.079 -40.444 -8.224 1.00 34.30 ? 61 PRO D C 1 ATOM 8625 O O . PRO F 2 61 ? 49.778 -41.147 -9.187 1.00 40.09 ? 61 PRO D O 1 ATOM 8626 C CB . PRO F 2 61 ? 52.507 -40.260 -7.572 1.00 29.05 ? 61 PRO D CB 1 ATOM 8627 C CG . PRO F 2 61 ? 53.326 -39.115 -7.029 1.00 25.55 ? 61 PRO D CG 1 ATOM 8628 C CD . PRO F 2 61 ? 52.315 -38.069 -6.644 1.00 24.51 ? 61 PRO D CD 1 ATOM 8629 N N . SER F 2 62 ? 49.358 -40.388 -7.107 1.00 37.48 ? 62 SER D N 1 ATOM 8630 C CA . SER F 2 62 ? 48.116 -41.149 -6.955 1.00 44.41 ? 62 SER D CA 1 ATOM 8631 C C . SER F 2 62 ? 47.098 -40.816 -8.043 1.00 39.75 ? 62 SER D C 1 ATOM 8632 O O . SER F 2 62 ? 46.330 -41.676 -8.471 1.00 30.85 ? 62 SER D O 1 ATOM 8633 C CB . SER F 2 62 ? 47.481 -40.888 -5.585 1.00 44.03 ? 62 SER D CB 1 ATOM 8634 O OG . SER F 2 62 ? 48.301 -41.354 -4.532 1.00 52.24 ? 62 SER D OG 1 ATOM 8635 N N . LEU F 2 63 ? 47.102 -39.564 -8.490 1.00 28.66 ? 63 LEU D N 1 ATOM 8636 C CA . LEU F 2 63 ? 46.042 -39.063 -9.359 1.00 36.93 ? 63 LEU D CA 1 ATOM 8637 C C . LEU F 2 63 ? 46.476 -38.817 -10.804 1.00 43.34 ? 63 LEU D C 1 ATOM 8638 O O . LEU F 2 63 ? 45.664 -38.394 -11.626 1.00 46.52 ? 63 LEU D O 1 ATOM 8639 C CB . LEU F 2 63 ? 45.484 -37.763 -8.778 1.00 31.85 ? 63 LEU D CB 1 ATOM 8640 C CG . LEU F 2 63 ? 45.082 -37.803 -7.305 1.00 39.73 ? 63 LEU D CG 1 ATOM 8641 C CD1 . LEU F 2 63 ? 44.966 -36.393 -6.747 1.00 42.62 ? 63 LEU D CD1 1 ATOM 8642 C CD2 . LEU F 2 63 ? 43.775 -38.564 -7.140 1.00 40.76 ? 63 LEU D CD2 1 ATOM 8643 N N . LYS F 2 64 ? 47.743 -39.085 -11.111 1.00 40.74 ? 64 LYS D N 1 ATOM 8644 C CA . LYS F 2 64 ? 48.330 -38.691 -12.394 1.00 42.70 ? 64 LYS D CA 1 ATOM 8645 C C . LYS F 2 64 ? 47.551 -39.202 -13.612 1.00 46.06 ? 64 LYS D C 1 ATOM 8646 O O . LYS F 2 64 ? 47.335 -38.461 -14.574 1.00 50.54 ? 64 LYS D O 1 ATOM 8647 C CB . LYS F 2 64 ? 49.782 -39.171 -12.480 1.00 43.75 ? 64 LYS D CB 1 ATOM 8648 C CG . LYS F 2 64 ? 50.551 -38.562 -13.638 1.00 52.78 ? 64 LYS D CG 1 ATOM 8649 C CD . LYS F 2 64 ? 51.932 -39.181 -13.779 1.00 68.85 ? 64 LYS D CD 1 ATOM 8650 C CE . LYS F 2 64 ? 52.708 -38.542 -14.925 1.00 74.59 ? 64 LYS D CE 1 ATOM 8651 N NZ . LYS F 2 64 ? 53.954 -39.294 -15.250 1.00 74.88 ? 64 LYS D NZ 1 ATOM 8652 N N . SER F 2 65 ? 47.121 -40.460 -13.556 1.00 41.35 ? 65 SER D N 1 ATOM 8653 C CA . SER F 2 65 ? 46.438 -41.095 -14.681 1.00 40.91 ? 65 SER D CA 1 ATOM 8654 C C . SER F 2 65 ? 45.045 -40.525 -14.945 1.00 39.75 ? 65 SER D C 1 ATOM 8655 O O . SER F 2 65 ? 44.485 -40.725 -16.021 1.00 44.36 ? 65 SER D O 1 ATOM 8656 C CB . SER F 2 65 ? 46.331 -42.601 -14.444 1.00 43.26 ? 65 SER D CB 1 ATOM 8657 O OG . SER F 2 65 ? 45.671 -42.872 -13.221 1.00 50.22 ? 65 SER D OG 1 ATOM 8658 N N . ARG F 2 66 ? 44.491 -39.818 -13.966 1.00 32.00 ? 66 ARG D N 1 ATOM 8659 C CA . ARG F 2 66 ? 43.130 -39.301 -14.071 1.00 31.97 ? 66 ARG D CA 1 ATOM 8660 C C . ARG F 2 66 ? 43.067 -37.772 -14.154 1.00 30.91 ? 66 ARG D C 1 ATOM 8661 O O . ARG F 2 66 ? 42.047 -37.212 -14.553 1.00 34.18 ? 66 ARG D O 1 ATOM 8662 C CB . ARG F 2 66 ? 42.301 -39.778 -12.876 1.00 34.59 ? 66 ARG D CB 1 ATOM 8663 C CG . ARG F 2 66 ? 42.178 -41.293 -12.749 1.00 32.26 ? 66 ARG D CG 1 ATOM 8664 C CD . ARG F 2 66 ? 41.643 -41.687 -11.373 1.00 28.25 ? 66 ARG D CD 1 ATOM 8665 N NE . ARG F 2 66 ? 40.427 -40.954 -11.039 1.00 39.98 ? 66 ARG D NE 1 ATOM 8666 C CZ . ARG F 2 66 ? 40.150 -40.469 -9.835 1.00 34.92 ? 66 ARG D CZ 1 ATOM 8667 N NH1 . ARG F 2 66 ? 40.999 -40.643 -8.834 1.00 19.90 ? 66 ARG D NH1 1 ATOM 8668 N NH2 . ARG F 2 66 ? 39.019 -39.809 -9.633 1.00 35.81 ? 66 ARG D NH2 1 ATOM 8669 N N . VAL F 2 67 ? 44.157 -37.107 -13.776 1.00 26.80 ? 67 VAL D N 1 ATOM 8670 C CA . VAL F 2 67 ? 44.179 -35.648 -13.656 1.00 27.83 ? 67 VAL D CA 1 ATOM 8671 C C . VAL F 2 67 ? 44.768 -34.938 -14.872 1.00 27.54 ? 67 VAL D C 1 ATOM 8672 O O . VAL F 2 67 ? 45.770 -35.375 -15.435 1.00 33.58 ? 67 VAL D O 1 ATOM 8673 C CB . VAL F 2 67 ? 44.978 -35.208 -12.405 1.00 29.93 ? 67 VAL D CB 1 ATOM 8674 C CG1 . VAL F 2 67 ? 45.248 -33.706 -12.419 1.00 39.78 ? 67 VAL D CG1 1 ATOM 8675 C CG2 . VAL F 2 67 ? 44.231 -35.577 -11.153 1.00 39.91 ? 67 VAL D CG2 1 ATOM 8676 N N . THR F 2 68 ? 44.127 -33.844 -15.274 1.00 25.04 ? 68 THR D N 1 ATOM 8677 C CA . THR F 2 68 ? 44.704 -32.919 -16.239 1.00 29.07 ? 68 THR D CA 1 ATOM 8678 C C . THR F 2 68 ? 44.541 -31.485 -15.744 1.00 32.26 ? 68 THR D C 1 ATOM 8679 O O . THR F 2 68 ? 43.438 -31.062 -15.407 1.00 31.79 ? 68 THR D O 1 ATOM 8680 C CB . THR F 2 68 ? 44.053 -33.053 -17.633 1.00 32.47 ? 68 THR D CB 1 ATOM 8681 O OG1 . THR F 2 68 ? 44.223 -34.390 -18.116 1.00 40.35 ? 68 THR D OG1 1 ATOM 8682 C CG2 . THR F 2 68 ? 44.700 -32.083 -18.616 1.00 29.23 ? 68 THR D CG2 1 ATOM 8683 N N . ILE F 2 69 ? 45.647 -30.750 -15.694 1.00 34.28 ? 69 ILE D N 1 ATOM 8684 C CA . ILE F 2 69 ? 45.631 -29.330 -15.354 1.00 27.51 ? 69 ILE D CA 1 ATOM 8685 C C . ILE F 2 69 ? 46.110 -28.527 -16.557 1.00 29.10 ? 69 ILE D C 1 ATOM 8686 O O . ILE F 2 69 ? 47.158 -28.828 -17.125 1.00 33.34 ? 69 ILE D O 1 ATOM 8687 C CB . ILE F 2 69 ? 46.517 -29.032 -14.124 1.00 21.48 ? 69 ILE D CB 1 ATOM 8688 C CG1 . ILE F 2 69 ? 45.973 -29.769 -12.894 1.00 22.97 ? 69 ILE D CG1 1 ATOM 8689 C CG2 . ILE F 2 69 ? 46.580 -27.550 -13.857 1.00 24.53 ? 69 ILE D CG2 1 ATOM 8690 C CD1 . ILE F 2 69 ? 46.731 -29.471 -11.607 1.00 26.66 ? 69 ILE D CD1 1 ATOM 8691 N N . SER F 2 70 ? 45.339 -27.519 -16.959 1.00 26.49 ? 70 SER D N 1 ATOM 8692 C CA . SER F 2 70 ? 45.674 -26.745 -18.152 1.00 31.20 ? 70 SER D CA 1 ATOM 8693 C C . SER F 2 70 ? 45.511 -25.234 -17.959 1.00 34.18 ? 70 SER D C 1 ATOM 8694 O O . SER F 2 70 ? 44.637 -24.778 -17.222 1.00 27.89 ? 70 SER D O 1 ATOM 8695 C CB . SER F 2 70 ? 44.816 -27.208 -19.333 1.00 31.36 ? 70 SER D CB 1 ATOM 8696 O OG . SER F 2 70 ? 43.440 -27.022 -19.060 1.00 40.98 ? 70 SER D OG 1 ATOM 8697 N N . LEU F 2 71 ? 46.364 -24.468 -18.634 1.00 30.63 ? 71 LEU D N 1 ATOM 8698 C CA . LEU F 2 71 ? 46.296 -23.012 -18.610 1.00 29.68 ? 71 LEU D CA 1 ATOM 8699 C C . LEU F 2 71 ? 45.700 -22.462 -19.894 1.00 33.54 ? 71 LEU D C 1 ATOM 8700 O O . LEU F 2 71 ? 45.951 -22.984 -20.981 1.00 32.96 ? 71 LEU D O 1 ATOM 8701 C CB . LEU F 2 71 ? 47.681 -22.402 -18.421 1.00 29.57 ? 71 LEU D CB 1 ATOM 8702 C CG . LEU F 2 71 ? 48.517 -22.787 -17.207 1.00 40.54 ? 71 LEU D CG 1 ATOM 8703 C CD1 . LEU F 2 71 ? 49.881 -22.149 -17.322 1.00 40.99 ? 71 LEU D CD1 1 ATOM 8704 C CD2 . LEU F 2 71 ? 47.844 -22.346 -15.930 1.00 45.87 ? 71 LEU D CD2 1 ATOM 8705 N N . ASP F 2 72 ? 44.918 -21.397 -19.763 1.00 31.81 ? 72 ASP D N 1 ATOM 8706 C CA . ASP F 2 72 ? 44.497 -20.619 -20.917 1.00 31.85 ? 72 ASP D CA 1 ATOM 8707 C C . ASP F 2 72 ? 44.984 -19.193 -20.710 1.00 29.65 ? 72 ASP D C 1 ATOM 8708 O O . ASP F 2 72 ? 44.347 -18.412 -20.000 1.00 25.64 ? 72 ASP D O 1 ATOM 8709 C CB . ASP F 2 72 ? 42.979 -20.664 -21.096 1.00 39.78 ? 72 ASP D CB 1 ATOM 8710 C CG . ASP F 2 72 ? 42.541 -20.193 -22.471 1.00 50.94 ? 72 ASP D CG 1 ATOM 8711 O OD1 . ASP F 2 72 ? 43.269 -19.385 -23.092 1.00 53.69 ? 72 ASP D OD1 1 ATOM 8712 O OD2 . ASP F 2 72 ? 41.469 -20.637 -22.932 1.00 53.84 ? 72 ASP D OD2 1 ATOM 8713 N N . MET F 2 73 ? 46.121 -18.867 -21.319 1.00 26.99 ? 73 MET D N 1 ATOM 8714 C CA . MET F 2 73 ? 46.783 -17.591 -21.078 1.00 28.34 ? 73 MET D CA 1 ATOM 8715 C C . MET F 2 73 ? 45.925 -16.403 -21.493 1.00 31.77 ? 73 MET D C 1 ATOM 8716 O O . MET F 2 73 ? 45.836 -15.419 -20.761 1.00 30.84 ? 73 MET D O 1 ATOM 8717 C CB . MET F 2 73 ? 48.127 -17.540 -21.806 1.00 25.85 ? 73 MET D CB 1 ATOM 8718 C CG . MET F 2 73 ? 49.094 -18.631 -21.386 1.00 32.14 ? 73 MET D CG 1 ATOM 8719 S SD . MET F 2 73 ? 49.497 -18.618 -19.626 1.00 43.68 ? 73 MET D SD 1 ATOM 8720 C CE . MET F 2 73 ? 50.577 -17.195 -19.529 1.00 26.13 ? 73 MET D CE 1 ATOM 8721 N N . SER F 2 74 ? 45.286 -16.494 -22.655 1.00 37.87 ? 74 SER D N 1 ATOM 8722 C CA . SER F 2 74 ? 44.499 -15.372 -23.162 1.00 38.78 ? 74 SER D CA 1 ATOM 8723 C C . SER F 2 74 ? 43.241 -15.142 -22.325 1.00 31.53 ? 74 SER D C 1 ATOM 8724 O O . SER F 2 74 ? 42.852 -14.005 -22.083 1.00 35.02 ? 74 SER D O 1 ATOM 8725 C CB . SER F 2 74 ? 44.129 -15.588 -24.632 1.00 41.99 ? 74 SER D CB 1 ATOM 8726 O OG . SER F 2 74 ? 43.417 -16.799 -24.814 1.00 50.32 ? 74 SER D OG 1 ATOM 8727 N N . LYS F 2 75 ? 42.614 -16.218 -21.865 1.00 31.73 ? 75 LYS D N 1 ATOM 8728 C CA . LYS F 2 75 ? 41.398 -16.086 -21.064 1.00 32.17 ? 75 LYS D CA 1 ATOM 8729 C C . LYS F 2 75 ? 41.697 -15.784 -19.597 1.00 27.87 ? 75 LYS D C 1 ATOM 8730 O O . LYS F 2 75 ? 40.791 -15.430 -18.843 1.00 32.36 ? 75 LYS D O 1 ATOM 8731 C CB . LYS F 2 75 ? 40.547 -17.355 -21.156 1.00 36.92 ? 75 LYS D CB 1 ATOM 8732 C CG . LYS F 2 75 ? 39.900 -17.596 -22.505 1.00 38.73 ? 75 LYS D CG 1 ATOM 8733 C CD . LYS F 2 75 ? 38.933 -18.767 -22.425 1.00 47.08 ? 75 LYS D CD 1 ATOM 8734 C CE . LYS F 2 75 ? 38.550 -19.273 -23.807 1.00 54.77 ? 75 LYS D CE 1 ATOM 8735 N NZ . LYS F 2 75 ? 37.759 -20.535 -23.728 1.00 61.39 ? 75 LYS D NZ 1 ATOM 8736 N N . ASN F 2 76 ? 42.962 -15.931 -19.201 1.00 22.71 ? 76 ASN D N 1 ATOM 8737 C CA . ASN F 2 76 ? 43.384 -15.736 -17.812 1.00 18.05 ? 76 ASN D CA 1 ATOM 8738 C C . ASN F 2 76 ? 42.675 -16.712 -16.864 1.00 23.40 ? 76 ASN D C 1 ATOM 8739 O O . ASN F 2 76 ? 42.266 -16.345 -15.761 1.00 27.77 ? 76 ASN D O 1 ATOM 8740 C CB . ASN F 2 76 ? 43.139 -14.285 -17.377 1.00 20.33 ? 76 ASN D CB 1 ATOM 8741 C CG . ASN F 2 76 ? 44.321 -13.688 -16.641 1.00 23.97 ? 76 ASN D CG 1 ATOM 8742 O OD1 . ASN F 2 76 ? 45.429 -13.637 -17.169 1.00 26.12 ? 76 ASN D OD1 1 ATOM 8743 N ND2 . ASN F 2 76 ? 44.085 -13.210 -15.426 1.00 18.01 ? 76 ASN D ND2 1 ATOM 8744 N N . GLN F 2 77 ? 42.533 -17.957 -17.317 1.00 24.96 ? 77 GLN D N 1 ATOM 8745 C CA . GLN F 2 77 ? 41.933 -19.033 -16.528 1.00 26.71 ? 77 GLN D CA 1 ATOM 8746 C C . GLN F 2 77 ? 42.809 -20.273 -16.526 1.00 26.52 ? 77 GLN D C 1 ATOM 8747 O O . GLN F 2 77 ? 43.624 -20.467 -17.428 1.00 31.29 ? 77 GLN D O 1 ATOM 8748 C CB . GLN F 2 77 ? 40.562 -19.433 -17.079 1.00 21.30 ? 77 GLN D CB 1 ATOM 8749 C CG . GLN F 2 77 ? 39.533 -18.349 -17.117 1.00 32.11 ? 77 GLN D CG 1 ATOM 8750 C CD . GLN F 2 77 ? 38.339 -18.742 -17.962 1.00 38.55 ? 77 GLN D CD 1 ATOM 8751 O OE1 . GLN F 2 77 ? 38.310 -19.828 -18.550 1.00 39.79 ? 77 GLN D OE1 1 ATOM 8752 N NE2 . GLN F 2 77 ? 37.348 -17.863 -18.032 1.00 34.35 ? 77 GLN D NE2 1 ATOM 8753 N N . PHE F 2 78 ? 42.622 -21.130 -15.529 1.00 23.79 ? 78 PHE D N 1 ATOM 8754 C CA . PHE F 2 78 ? 43.178 -22.472 -15.607 1.00 24.24 ? 78 PHE D CA 1 ATOM 8755 C C . PHE F 2 78 ? 42.196 -23.485 -15.042 1.00 27.38 ? 78 PHE D C 1 ATOM 8756 O O . PHE F 2 78 ? 41.312 -23.140 -14.257 1.00 27.13 ? 78 PHE D O 1 ATOM 8757 C CB . PHE F 2 78 ? 44.542 -22.564 -14.916 1.00 25.09 ? 78 PHE D CB 1 ATOM 8758 C CG . PHE F 2 78 ? 44.522 -22.313 -13.439 1.00 24.14 ? 78 PHE D CG 1 ATOM 8759 C CD1 . PHE F 2 78 ? 44.474 -21.021 -12.937 1.00 25.11 ? 78 PHE D CD1 1 ATOM 8760 C CD2 . PHE F 2 78 ? 44.616 -23.370 -12.549 1.00 25.49 ? 78 PHE D CD2 1 ATOM 8761 C CE1 . PHE F 2 78 ? 44.487 -20.792 -11.569 1.00 27.66 ? 78 PHE D CE1 1 ATOM 8762 C CE2 . PHE F 2 78 ? 44.634 -23.149 -11.180 1.00 26.24 ? 78 PHE D CE2 1 ATOM 8763 C CZ . PHE F 2 78 ? 44.568 -21.864 -10.689 1.00 26.59 ? 78 PHE D CZ 1 ATOM 8764 N N . SER F 2 79 ? 42.340 -24.731 -15.481 1.00 25.75 ? 79 SER D N 1 ATOM 8765 C CA . SER F 2 79 ? 41.314 -25.736 -15.251 1.00 31.89 ? 79 SER D CA 1 ATOM 8766 C C . SER F 2 79 ? 41.850 -26.999 -14.608 1.00 30.68 ? 79 SER D C 1 ATOM 8767 O O . SER F 2 79 ? 43.044 -27.295 -14.672 1.00 31.78 ? 79 SER D O 1 ATOM 8768 C CB . SER F 2 79 ? 40.622 -26.100 -16.568 1.00 31.52 ? 79 SER D CB 1 ATOM 8769 O OG . SER F 2 79 ? 39.952 -24.977 -17.112 1.00 52.54 ? 79 SER D OG 1 ATOM 8770 N N . LEU F 2 80 ? 40.939 -27.736 -13.986 1.00 28.79 ? 80 LEU D N 1 ATOM 8771 C CA . LEU F 2 80 ? 41.217 -29.065 -13.470 1.00 29.46 ? 80 LEU D CA 1 ATOM 8772 C C . LEU F 2 80 ? 40.196 -30.055 -14.023 1.00 28.96 ? 80 LEU D C 1 ATOM 8773 O O . LEU F 2 80 ? 38.996 -29.824 -13.920 1.00 23.68 ? 80 LEU D O 1 ATOM 8774 C CB . LEU F 2 80 ? 41.175 -29.065 -11.939 1.00 23.54 ? 80 LEU D CB 1 ATOM 8775 C CG . LEU F 2 80 ? 41.212 -30.444 -11.280 1.00 23.32 ? 80 LEU D CG 1 ATOM 8776 C CD1 . LEU F 2 80 ? 42.579 -31.082 -11.456 1.00 14.66 ? 80 LEU D CD1 1 ATOM 8777 C CD2 . LEU F 2 80 ? 40.834 -30.377 -9.805 1.00 20.00 ? 80 LEU D CD2 1 ATOM 8778 N N . ASN F 2 81 ? 40.678 -31.134 -14.631 1.00 25.84 ? 81 ASN D N 1 ATOM 8779 C CA . ASN F 2 81 ? 39.844 -32.279 -14.944 1.00 32.75 ? 81 ASN D CA 1 ATOM 8780 C C . ASN F 2 81 ? 40.280 -33.487 -14.140 1.00 33.08 ? 81 ASN D C 1 ATOM 8781 O O . ASN F 2 81 ? 41.473 -33.779 -14.035 1.00 23.86 ? 81 ASN D O 1 ATOM 8782 C CB . ASN F 2 81 ? 39.902 -32.621 -16.430 1.00 43.19 ? 81 ASN D CB 1 ATOM 8783 C CG . ASN F 2 81 ? 39.114 -31.658 -17.293 1.00 56.33 ? 81 ASN D CG 1 ATOM 8784 O OD1 . ASN F 2 81 ? 38.645 -30.612 -16.839 1.00 57.35 ? 81 ASN D OD1 1 ATOM 8785 N ND2 . ASN F 2 81 ? 38.971 -32.018 -18.557 1.00 74.08 ? 81 ASN D ND2 1 ATOM 8786 N N . LEU F 2 82 ? 39.304 -34.182 -13.571 1.00 32.73 ? 82 LEU D N 1 ATOM 8787 C CA . LEU F 2 82 ? 39.557 -35.425 -12.877 1.00 30.92 ? 82 LEU D CA 1 ATOM 8788 C C . LEU F 2 82 ? 38.563 -36.454 -13.388 1.00 33.82 ? 82 LEU D C 1 ATOM 8789 O O . LEU F 2 82 ? 37.369 -36.365 -13.116 1.00 37.51 ? 82 LEU D O 1 ATOM 8790 C CB . LEU F 2 82 ? 39.439 -35.234 -11.367 1.00 30.07 ? 82 LEU D CB 1 ATOM 8791 C CG . LEU F 2 82 ? 39.675 -36.471 -10.503 1.00 29.70 ? 82 LEU D CG 1 ATOM 8792 C CD1 . LEU F 2 82 ? 41.090 -36.986 -10.659 1.00 31.01 ? 82 LEU D CD1 1 ATOM 8793 C CD2 . LEU F 2 82 ? 39.372 -36.188 -9.040 1.00 31.41 ? 82 LEU D CD2 1 ATOM 8794 N N . THR F 2 83 A 39.058 -37.424 -14.146 1.00 38.41 ? 82 THR D N 1 ATOM 8795 C CA . THR F 2 83 A 38.181 -38.388 -14.801 1.00 36.63 ? 82 THR D CA 1 ATOM 8796 C C . THR F 2 83 A 37.811 -39.565 -13.893 1.00 34.92 ? 82 THR D C 1 ATOM 8797 O O . THR F 2 83 A 38.482 -39.817 -12.887 1.00 25.98 ? 82 THR D O 1 ATOM 8798 C CB . THR F 2 83 A 38.825 -38.945 -16.087 1.00 33.74 ? 82 THR D CB 1 ATOM 8799 O OG1 . THR F 2 83 A 39.968 -39.738 -15.751 1.00 27.44 ? 82 THR D OG1 1 ATOM 8800 C CG2 . THR F 2 83 A 39.253 -37.816 -17.007 1.00 28.77 ? 82 THR D CG2 1 ATOM 8801 N N . SER F 2 84 B 36.735 -40.268 -14.261 1.00 31.41 ? 82 SER D N 1 ATOM 8802 C CA . SER F 2 84 B 36.272 -41.475 -13.562 1.00 36.28 ? 82 SER D CA 1 ATOM 8803 C C . SER F 2 84 B 36.138 -41.292 -12.057 1.00 33.06 ? 82 SER D C 1 ATOM 8804 O O . SER F 2 84 B 36.696 -42.078 -11.296 1.00 26.68 ? 82 SER D O 1 ATOM 8805 C CB . SER F 2 84 B 37.222 -42.646 -13.830 1.00 33.77 ? 82 SER D CB 1 ATOM 8806 O OG . SER F 2 84 B 37.332 -42.904 -15.217 1.00 41.04 ? 82 SER D OG 1 ATOM 8807 N N . VAL F 2 85 C 35.417 -40.265 -11.621 1.00 29.77 ? 82 VAL D N 1 ATOM 8808 C CA . VAL F 2 85 C 35.357 -39.982 -10.191 1.00 27.05 ? 82 VAL D CA 1 ATOM 8809 C C . VAL F 2 85 C 34.590 -41.058 -9.421 1.00 33.31 ? 82 VAL D C 1 ATOM 8810 O O . VAL F 2 85 C 33.711 -41.734 -9.963 1.00 33.79 ? 82 VAL D O 1 ATOM 8811 C CB . VAL F 2 85 C 34.725 -38.605 -9.906 1.00 28.95 ? 82 VAL D CB 1 ATOM 8812 C CG1 . VAL F 2 85 C 35.592 -37.497 -10.500 1.00 29.05 ? 82 VAL D CG1 1 ATOM 8813 C CG2 . VAL F 2 85 C 33.307 -38.534 -10.448 1.00 26.62 ? 82 VAL D CG2 1 ATOM 8814 N N . THR F 2 86 ? 34.971 -41.229 -8.158 1.00 25.75 ? 83 THR D N 1 ATOM 8815 C CA . THR F 2 86 ? 34.251 -42.074 -7.217 1.00 28.88 ? 83 THR D CA 1 ATOM 8816 C C . THR F 2 86 ? 34.069 -41.304 -5.922 1.00 30.65 ? 83 THR D C 1 ATOM 8817 O O . THR F 2 86 ? 34.577 -40.193 -5.780 1.00 25.53 ? 83 THR D O 1 ATOM 8818 C CB . THR F 2 86 ? 34.992 -43.378 -6.907 1.00 25.69 ? 83 THR D CB 1 ATOM 8819 O OG1 . THR F 2 86 ? 36.206 -43.070 -6.212 1.00 31.85 ? 83 THR D OG1 1 ATOM 8820 C CG2 . THR F 2 86 ? 35.306 -44.147 -8.185 1.00 20.71 ? 83 THR D CG2 1 ATOM 8821 N N . ALA F 2 87 ? 33.370 -41.911 -4.969 1.00 35.33 ? 84 ALA D N 1 ATOM 8822 C CA . ALA F 2 87 ? 33.084 -41.267 -3.694 1.00 35.08 ? 84 ALA D CA 1 ATOM 8823 C C . ALA F 2 87 ? 34.359 -40.867 -2.952 1.00 34.52 ? 84 ALA D C 1 ATOM 8824 O O . ALA F 2 87 ? 34.318 -40.036 -2.048 1.00 40.97 ? 84 ALA D O 1 ATOM 8825 C CB . ALA F 2 87 ? 32.235 -42.179 -2.826 1.00 33.73 ? 84 ALA D CB 1 ATOM 8826 N N . ALA F 2 88 ? 35.491 -41.449 -3.340 1.00 32.52 ? 85 ALA D N 1 ATOM 8827 C CA . ALA F 2 88 ? 36.770 -41.079 -2.745 1.00 30.41 ? 85 ALA D CA 1 ATOM 8828 C C . ALA F 2 88 ? 37.211 -39.685 -3.193 1.00 31.09 ? 85 ALA D C 1 ATOM 8829 O O . ALA F 2 88 ? 38.119 -39.102 -2.605 1.00 30.57 ? 85 ALA D O 1 ATOM 8830 C CB . ALA F 2 88 ? 37.843 -42.106 -3.093 1.00 21.75 ? 85 ALA D CB 1 ATOM 8831 N N . ASP F 2 89 ? 36.573 -39.155 -4.233 1.00 29.16 ? 86 ASP D N 1 ATOM 8832 C CA . ASP F 2 89 ? 36.942 -37.839 -4.755 1.00 25.56 ? 86 ASP D CA 1 ATOM 8833 C C . ASP F 2 89 ? 36.023 -36.738 -4.239 1.00 25.33 ? 86 ASP D C 1 ATOM 8834 O O . ASP F 2 89 ? 36.112 -35.588 -4.673 1.00 29.25 ? 86 ASP D O 1 ATOM 8835 C CB . ASP F 2 89 ? 36.931 -37.843 -6.285 1.00 26.58 ? 86 ASP D CB 1 ATOM 8836 C CG . ASP F 2 89 ? 37.880 -38.874 -6.874 1.00 33.65 ? 86 ASP D CG 1 ATOM 8837 O OD1 . ASP F 2 89 ? 39.104 -38.759 -6.642 1.00 29.82 ? 86 ASP D OD1 1 ATOM 8838 O OD2 . ASP F 2 89 ? 37.405 -39.793 -7.580 1.00 25.51 ? 86 ASP D OD2 1 ATOM 8839 N N . THR F 2 90 ? 35.136 -37.091 -3.318 1.00 21.08 ? 87 THR D N 1 ATOM 8840 C CA . THR F 2 90 ? 34.265 -36.100 -2.701 1.00 22.95 ? 87 THR D CA 1 ATOM 8841 C C . THR F 2 90 ? 35.080 -35.249 -1.739 1.00 27.14 ? 87 THR D C 1 ATOM 8842 O O . THR F 2 90 ? 35.676 -35.768 -0.795 1.00 26.92 ? 87 THR D O 1 ATOM 8843 C CB . THR F 2 90 ? 33.082 -36.757 -1.963 1.00 25.37 ? 87 THR D CB 1 ATOM 8844 O OG1 . THR F 2 90 ? 32.139 -37.235 -2.929 1.00 29.73 ? 87 THR D OG1 1 ATOM 8845 C CG2 . THR F 2 90 ? 32.382 -35.751 -1.057 1.00 22.53 ? 87 THR D CG2 1 ATOM 8846 N N . ALA F 2 91 ? 35.104 -33.942 -1.993 1.00 21.96 ? 88 ALA D N 1 ATOM 8847 C CA . ALA F 2 91 ? 35.934 -33.009 -1.238 1.00 23.81 ? 88 ALA D CA 1 ATOM 8848 C C . ALA F 2 91 ? 35.629 -31.567 -1.623 1.00 25.87 ? 88 ALA D C 1 ATOM 8849 O O . ALA F 2 91 ? 34.904 -31.313 -2.585 1.00 28.15 ? 88 ALA D O 1 ATOM 8850 C CB . ALA F 2 91 ? 37.414 -33.305 -1.471 1.00 20.93 ? 88 ALA D CB 1 ATOM 8851 N N . VAL F 2 92 ? 36.184 -30.622 -0.870 1.00 21.38 ? 89 VAL D N 1 ATOM 8852 C CA . VAL F 2 92 ? 36.190 -29.235 -1.311 1.00 23.55 ? 89 VAL D CA 1 ATOM 8853 C C . VAL F 2 92 ? 37.455 -29.020 -2.124 1.00 24.82 ? 89 VAL D C 1 ATOM 8854 O O . VAL F 2 92 ? 38.551 -29.306 -1.651 1.00 25.69 ? 89 VAL D O 1 ATOM 8855 C CB . VAL F 2 92 ? 36.145 -28.241 -0.141 1.00 25.58 ? 89 VAL D CB 1 ATOM 8856 C CG1 . VAL F 2 92 ? 36.229 -26.813 -0.661 1.00 22.25 ? 89 VAL D CG1 1 ATOM 8857 C CG2 . VAL F 2 92 ? 34.878 -28.442 0.680 1.00 21.65 ? 89 VAL D CG2 1 ATOM 8858 N N . TYR F 2 93 ? 37.307 -28.542 -3.354 1.00 22.71 ? 90 TYR D N 1 ATOM 8859 C CA . TYR F 2 93 ? 38.461 -28.316 -4.218 1.00 18.59 ? 90 TYR D CA 1 ATOM 8860 C C . TYR F 2 93 ? 38.797 -26.825 -4.286 1.00 25.21 ? 90 TYR D C 1 ATOM 8861 O O . TYR F 2 93 ? 37.925 -26.002 -4.549 1.00 21.23 ? 90 TYR D O 1 ATOM 8862 C CB . TYR F 2 93 ? 38.195 -28.878 -5.623 1.00 18.33 ? 90 TYR D CB 1 ATOM 8863 C CG . TYR F 2 93 ? 38.172 -30.393 -5.689 1.00 20.44 ? 90 TYR D CG 1 ATOM 8864 C CD1 . TYR F 2 93 ? 37.127 -31.121 -5.133 1.00 27.38 ? 90 TYR D CD1 1 ATOM 8865 C CD2 . TYR F 2 93 ? 39.200 -31.095 -6.306 1.00 22.75 ? 90 TYR D CD2 1 ATOM 8866 C CE1 . TYR F 2 93 ? 37.114 -32.507 -5.185 1.00 32.56 ? 90 TYR D CE1 1 ATOM 8867 C CE2 . TYR F 2 93 ? 39.195 -32.471 -6.362 1.00 27.42 ? 90 TYR D CE2 1 ATOM 8868 C CZ . TYR F 2 93 ? 38.152 -33.174 -5.802 1.00 30.86 ? 90 TYR D CZ 1 ATOM 8869 O OH . TYR F 2 93 ? 38.152 -34.548 -5.861 1.00 30.55 ? 90 TYR D OH 1 ATOM 8870 N N . PHE F 2 94 ? 40.062 -26.493 -4.036 1.00 18.26 ? 91 PHE D N 1 ATOM 8871 C CA . PHE F 2 94 ? 40.549 -25.117 -4.082 1.00 24.22 ? 91 PHE D CA 1 ATOM 8872 C C . PHE F 2 94 ? 41.544 -24.929 -5.217 1.00 23.86 ? 91 PHE D C 1 ATOM 8873 O O . PHE F 2 94 ? 42.383 -25.795 -5.454 1.00 22.65 ? 91 PHE D O 1 ATOM 8874 C CB . PHE F 2 94 ? 41.252 -24.729 -2.777 1.00 24.53 ? 91 PHE D CB 1 ATOM 8875 C CG . PHE F 2 94 ? 40.379 -24.775 -1.556 1.00 23.84 ? 91 PHE D CG 1 ATOM 8876 C CD1 . PHE F 2 94 ? 39.560 -23.709 -1.234 1.00 20.81 ? 91 PHE D CD1 1 ATOM 8877 C CD2 . PHE F 2 94 ? 40.430 -25.858 -0.693 1.00 25.28 ? 91 PHE D CD2 1 ATOM 8878 C CE1 . PHE F 2 94 ? 38.774 -23.741 -0.100 1.00 21.16 ? 91 PHE D CE1 1 ATOM 8879 C CE2 . PHE F 2 94 ? 39.651 -25.895 0.450 1.00 24.40 ? 91 PHE D CE2 1 ATOM 8880 C CZ . PHE F 2 94 ? 38.824 -24.837 0.747 1.00 22.42 ? 91 PHE D CZ 1 ATOM 8881 N N . CYS F 2 95 ? 41.473 -23.799 -5.907 1.00 20.52 ? 92 CYS D N 1 ATOM 8882 C CA . CYS F 2 95 ? 42.589 -23.394 -6.749 1.00 21.87 ? 92 CYS D CA 1 ATOM 8883 C C . CYS F 2 95 ? 43.444 -22.419 -5.951 1.00 18.67 ? 92 CYS D C 1 ATOM 8884 O O . CYS F 2 95 ? 42.975 -21.807 -4.991 1.00 19.10 ? 92 CYS D O 1 ATOM 8885 C CB . CYS F 2 95 ? 42.123 -22.771 -8.073 1.00 18.89 ? 92 CYS D CB 1 ATOM 8886 S SG . CYS F 2 95 ? 41.069 -21.308 -7.977 1.00 25.92 ? 92 CYS D SG 1 ATOM 8887 N N . ALA F 2 96 ? 44.709 -22.296 -6.325 1.00 15.39 ? 93 ALA D N 1 ATOM 8888 C CA . ALA F 2 96 ? 45.612 -21.428 -5.595 1.00 15.84 ? 93 ALA D CA 1 ATOM 8889 C C . ALA F 2 96 ? 46.785 -21.010 -6.458 1.00 24.50 ? 93 ALA D C 1 ATOM 8890 O O . ALA F 2 96 ? 47.221 -21.745 -7.349 1.00 25.18 ? 93 ALA D O 1 ATOM 8891 C CB . ALA F 2 96 ? 46.106 -22.115 -4.336 1.00 17.54 ? 93 ALA D CB 1 ATOM 8892 N N . ARG F 2 97 ? 47.285 -19.812 -6.190 1.00 22.98 ? 94 ARG D N 1 ATOM 8893 C CA . ARG F 2 97 ? 48.514 -19.344 -6.798 1.00 13.17 ? 94 ARG D CA 1 ATOM 8894 C C . ARG F 2 97 ? 49.673 -19.703 -5.898 1.00 21.27 ? 94 ARG D C 1 ATOM 8895 O O . ARG F 2 97 ? 49.571 -19.596 -4.675 1.00 22.18 ? 94 ARG D O 1 ATOM 8896 C CB . ARG F 2 97 ? 48.479 -17.830 -7.018 1.00 19.31 ? 94 ARG D CB 1 ATOM 8897 C CG . ARG F 2 97 ? 49.688 -17.293 -7.779 1.00 15.89 ? 94 ARG D CG 1 ATOM 8898 C CD . ARG F 2 97 ? 49.732 -15.769 -7.780 1.00 21.22 ? 94 ARG D CD 1 ATOM 8899 N NE . ARG F 2 97 ? 49.975 -15.244 -6.439 1.00 16.39 ? 94 ARG D NE 1 ATOM 8900 C CZ . ARG F 2 97 ? 50.158 -13.957 -6.164 1.00 26.37 ? 94 ARG D CZ 1 ATOM 8901 N NH1 . ARG F 2 97 ? 50.132 -13.061 -7.144 1.00 20.83 ? 94 ARG D NH1 1 ATOM 8902 N NH2 . ARG F 2 97 ? 50.369 -13.569 -4.911 1.00 22.55 ? 94 ARG D NH2 1 ATOM 8903 N N . ARG F 2 98 ? 50.773 -20.142 -6.493 1.00 18.18 ? 95 ARG D N 1 ATOM 8904 C CA . ARG F 2 98 ? 52.031 -20.158 -5.770 1.00 18.97 ? 95 ARG D CA 1 ATOM 8905 C C . ARG F 2 98 ? 52.634 -18.774 -5.955 1.00 22.21 ? 95 ARG D C 1 ATOM 8906 O O . ARG F 2 98 ? 52.962 -18.374 -7.075 1.00 25.13 ? 95 ARG D O 1 ATOM 8907 C CB . ARG F 2 98 ? 52.963 -21.259 -6.279 1.00 19.23 ? 95 ARG D CB 1 ATOM 8908 C CG . ARG F 2 98 ? 52.338 -22.656 -6.241 1.00 17.01 ? 95 ARG D CG 1 ATOM 8909 C CD . ARG F 2 98 ? 53.396 -23.752 -6.192 1.00 18.91 ? 95 ARG D CD 1 ATOM 8910 N NE . ARG F 2 98 ? 54.297 -23.573 -5.057 1.00 21.35 ? 95 ARG D NE 1 ATOM 8911 C CZ . ARG F 2 98 ? 55.099 -24.517 -4.573 1.00 28.25 ? 95 ARG D CZ 1 ATOM 8912 N NH1 . ARG F 2 98 ? 55.115 -25.734 -5.113 1.00 24.14 ? 95 ARG D NH1 1 ATOM 8913 N NH2 . ARG F 2 98 ? 55.882 -24.245 -3.536 1.00 23.11 ? 95 ARG D NH2 1 ATOM 8914 N N . SER F 2 99 ? 52.734 -18.025 -4.862 1.00 21.66 ? 96 SER D N 1 ATOM 8915 C CA . SER F 2 99 ? 53.236 -16.659 -4.923 1.00 20.98 ? 96 SER D CA 1 ATOM 8916 C C . SER F 2 99 ? 54.721 -16.648 -5.259 1.00 25.61 ? 96 SER D C 1 ATOM 8917 O O . SER F 2 99 ? 55.381 -17.688 -5.216 1.00 21.53 ? 96 SER D O 1 ATOM 8918 C CB . SER F 2 99 ? 52.992 -15.935 -3.601 1.00 22.56 ? 96 SER D CB 1 ATOM 8919 O OG . SER F 2 99 ? 53.812 -16.468 -2.579 1.00 35.82 ? 96 SER D OG 1 ATOM 8920 N N . ASN F 2 100 ? 55.237 -15.468 -5.590 1.00 19.19 ? 97 ASN D N 1 ATOM 8921 C CA . ASN F 2 100 ? 56.628 -15.326 -5.993 1.00 23.26 ? 97 ASN D CA 1 ATOM 8922 C C . ASN F 2 100 ? 57.557 -15.012 -4.815 1.00 27.51 ? 97 ASN D C 1 ATOM 8923 O O . ASN F 2 100 ? 58.719 -14.659 -5.006 1.00 26.81 ? 97 ASN D O 1 ATOM 8924 C CB . ASN F 2 100 ? 56.762 -14.241 -7.062 1.00 21.74 ? 97 ASN D CB 1 ATOM 8925 C CG . ASN F 2 100 ? 58.085 -14.314 -7.803 1.00 30.50 ? 97 ASN D CG 1 ATOM 8926 O OD1 . ASN F 2 100 ? 58.577 -15.402 -8.120 1.00 21.95 ? 97 ASN D OD1 1 ATOM 8927 N ND2 . ASN F 2 100 ? 58.680 -13.156 -8.060 1.00 27.56 ? 97 ASN D ND2 1 ATOM 8928 N N . TRP F 2 101 ? 57.042 -15.148 -3.599 1.00 24.26 ? 98 TRP D N 1 ATOM 8929 C CA . TRP F 2 101 ? 57.871 -15.041 -2.401 1.00 26.11 ? 98 TRP D CA 1 ATOM 8930 C C . TRP F 2 101 ? 58.797 -16.258 -2.298 1.00 23.58 ? 98 TRP D C 1 ATOM 8931 O O . TRP F 2 101 ? 58.576 -17.250 -2.990 1.00 18.43 ? 98 TRP D O 1 ATOM 8932 C CB . TRP F 2 101 ? 56.983 -14.911 -1.163 1.00 25.22 ? 98 TRP D CB 1 ATOM 8933 C CG . TRP F 2 101 ? 56.416 -13.549 -1.028 1.00 32.66 ? 98 TRP D CG 1 ATOM 8934 C CD1 . TRP F 2 101 ? 56.984 -12.387 -1.459 1.00 33.65 ? 98 TRP D CD1 1 ATOM 8935 C CD2 . TRP F 2 101 ? 55.159 -13.192 -0.446 1.00 36.87 ? 98 TRP D CD2 1 ATOM 8936 N NE1 . TRP F 2 101 ? 56.162 -11.328 -1.173 1.00 47.35 ? 98 TRP D NE1 1 ATOM 8937 C CE2 . TRP F 2 101 ? 55.034 -11.794 -0.552 1.00 42.29 ? 98 TRP D CE2 1 ATOM 8938 C CE3 . TRP F 2 101 ? 54.130 -13.918 0.159 1.00 50.96 ? 98 TRP D CE3 1 ATOM 8939 C CZ2 . TRP F 2 101 ? 53.922 -11.105 -0.073 1.00 52.65 ? 98 TRP D CZ2 1 ATOM 8940 C CZ3 . TRP F 2 101 ? 53.020 -13.231 0.635 1.00 59.31 ? 98 TRP D CZ3 1 ATOM 8941 C CH2 . TRP F 2 101 ? 52.927 -11.839 0.515 1.00 60.37 ? 98 TRP D CH2 1 ATOM 8942 N N . PRO F 2 102 ? 59.849 -16.180 -1.457 1.00 24.69 ? 99 PRO D N 1 ATOM 8943 C CA . PRO F 2 102 ? 60.744 -17.337 -1.323 1.00 20.12 ? 99 PRO D CA 1 ATOM 8944 C C . PRO F 2 102 ? 60.010 -18.632 -0.984 1.00 25.00 ? 99 PRO D C 1 ATOM 8945 O O . PRO F 2 102 ? 59.113 -18.622 -0.139 1.00 27.44 ? 99 PRO D O 1 ATOM 8946 C CB . PRO F 2 102 ? 61.675 -16.933 -0.176 1.00 20.44 ? 99 PRO D CB 1 ATOM 8947 C CG . PRO F 2 102 ? 61.703 -15.458 -0.224 1.00 16.75 ? 99 PRO D CG 1 ATOM 8948 C CD . PRO F 2 102 ? 60.348 -15.011 -0.707 1.00 18.30 ? 99 PRO D CD 1 ATOM 8949 N N . TYR F 2 103 ? 60.395 -19.711 -1.668 1.00 21.60 ? 100 TYR D N 1 ATOM 8950 C CA . TYR F 2 103 ? 59.832 -21.054 -1.507 1.00 25.48 ? 100 TYR D CA 1 ATOM 8951 C C . TYR F 2 103 ? 58.442 -21.176 -2.129 1.00 27.44 ? 100 TYR D C 1 ATOM 8952 O O . TYR F 2 103 ? 57.832 -22.244 -2.081 1.00 25.22 ? 100 TYR D O 1 ATOM 8953 C CB . TYR F 2 103 ? 59.799 -21.463 -0.030 1.00 29.31 ? 100 TYR D CB 1 ATOM 8954 C CG . TYR F 2 103 ? 61.168 -21.503 0.611 1.00 27.27 ? 100 TYR D CG 1 ATOM 8955 C CD1 . TYR F 2 103 ? 62.024 -22.579 0.397 1.00 28.65 ? 100 TYR D CD1 1 ATOM 8956 C CD2 . TYR F 2 103 ? 61.609 -20.466 1.422 1.00 29.73 ? 100 TYR D CD2 1 ATOM 8957 C CE1 . TYR F 2 103 ? 63.281 -22.621 0.980 1.00 29.95 ? 100 TYR D CE1 1 ATOM 8958 C CE2 . TYR F 2 103 ? 62.865 -20.497 2.010 1.00 28.56 ? 100 TYR D CE2 1 ATOM 8959 C CZ . TYR F 2 103 ? 63.695 -21.577 1.782 1.00 34.91 ? 100 TYR D CZ 1 ATOM 8960 O OH . TYR F 2 103 ? 64.941 -21.614 2.359 1.00 39.35 ? 100 TYR D OH 1 ATOM 8961 N N . LEU F 2 104 A 57.967 -20.087 -2.732 1.00 27.62 ? 100 LEU D N 1 ATOM 8962 C CA . LEU F 2 104 A 56.684 -20.066 -3.446 1.00 26.88 ? 100 LEU D CA 1 ATOM 8963 C C . LEU F 2 104 A 55.510 -20.612 -2.621 1.00 25.70 ? 100 LEU D C 1 ATOM 8964 O O . LEU F 2 104 A 54.884 -21.601 -3.008 1.00 23.80 ? 100 LEU D O 1 ATOM 8965 C CB . LEU F 2 104 A 56.794 -20.859 -4.757 1.00 20.06 ? 100 LEU D CB 1 ATOM 8966 C CG . LEU F 2 104 A 58.040 -20.658 -5.629 1.00 24.58 ? 100 LEU D CG 1 ATOM 8967 C CD1 . LEU F 2 104 A 57.939 -21.501 -6.891 1.00 29.61 ? 100 LEU D CD1 1 ATOM 8968 C CD2 . LEU F 2 104 A 58.255 -19.195 -5.981 1.00 21.41 ? 100 LEU D CD2 1 ATOM 8969 N N . PRO F 2 105 B 55.205 -19.974 -1.482 1.00 24.32 ? 100 PRO D N 1 ATOM 8970 C CA . PRO F 2 105 B 54.074 -20.469 -0.697 1.00 19.28 ? 100 PRO D CA 1 ATOM 8971 C C . PRO F 2 105 B 52.748 -20.177 -1.399 1.00 23.52 ? 100 PRO D C 1 ATOM 8972 O O . PRO F 2 105 B 52.697 -19.347 -2.310 1.00 25.40 ? 100 PRO D O 1 ATOM 8973 C CB . PRO F 2 105 B 54.193 -19.693 0.610 1.00 23.20 ? 100 PRO D CB 1 ATOM 8974 C CG . PRO F 2 105 B 54.835 -18.398 0.199 1.00 23.29 ? 100 PRO D CG 1 ATOM 8975 C CD . PRO F 2 105 B 55.789 -18.748 -0.904 1.00 23.51 ? 100 PRO D CD 1 ATOM 8976 N N . PHE F 2 106 C 51.688 -20.845 -0.964 1.00 23.16 ? 100 PHE D N 1 ATOM 8977 C CA . PHE F 2 106 C 50.405 -20.800 -1.659 1.00 24.58 ? 100 PHE D CA 1 ATOM 8978 C C . PHE F 2 106 C 49.576 -19.584 -1.238 1.00 25.94 ? 100 PHE D C 1 ATOM 8979 O O . PHE F 2 106 C 49.090 -19.509 -0.107 1.00 20.42 ? 100 PHE D O 1 ATOM 8980 C CB . PHE F 2 106 C 49.630 -22.099 -1.406 1.00 19.67 ? 100 PHE D CB 1 ATOM 8981 C CG . PHE F 2 106 C 50.199 -23.299 -2.128 1.00 21.78 ? 100 PHE D CG 1 ATOM 8982 C CD1 . PHE F 2 106 C 51.502 -23.724 -1.893 1.00 17.80 ? 100 PHE D CD1 1 ATOM 8983 C CD2 . PHE F 2 106 C 49.434 -24.001 -3.036 1.00 23.56 ? 100 PHE D CD2 1 ATOM 8984 C CE1 . PHE F 2 106 C 52.025 -24.818 -2.554 1.00 25.12 ? 100 PHE D CE1 1 ATOM 8985 C CE2 . PHE F 2 106 C 49.954 -25.102 -3.700 1.00 27.41 ? 100 PHE D CE2 1 ATOM 8986 C CZ . PHE F 2 106 C 51.251 -25.508 -3.458 1.00 27.49 ? 100 PHE D CZ 1 ATOM 8987 N N . ASP F 2 107 ? 49.420 -18.640 -2.164 1.00 22.37 ? 101 ASP D N 1 ATOM 8988 C CA . ASP F 2 107 ? 48.746 -17.376 -1.890 1.00 20.65 ? 101 ASP D CA 1 ATOM 8989 C C . ASP F 2 107 ? 48.528 -16.570 -3.170 1.00 17.02 ? 101 ASP D C 1 ATOM 8990 O O . ASP F 2 107 ? 49.475 -16.349 -3.922 1.00 19.74 ? 101 ASP D O 1 ATOM 8991 C CB . ASP F 2 107 ? 49.558 -16.547 -0.889 1.00 25.07 ? 101 ASP D CB 1 ATOM 8992 C CG . ASP F 2 107 ? 48.914 -15.209 -0.589 1.00 38.88 ? 101 ASP D CG 1 ATOM 8993 O OD1 . ASP F 2 107 ? 47.781 -15.199 -0.060 1.00 42.35 ? 101 ASP D OD1 1 ATOM 8994 O OD2 . ASP F 2 107 ? 49.539 -14.169 -0.876 1.00 47.55 ? 101 ASP D OD2 1 ATOM 8995 N N . PRO F 2 108 ? 47.284 -16.121 -3.421 1.00 21.60 ? 102 PRO D N 1 ATOM 8996 C CA . PRO F 2 108 ? 46.082 -16.385 -2.623 1.00 20.71 ? 102 PRO D CA 1 ATOM 8997 C C . PRO F 2 108 ? 45.347 -17.640 -3.087 1.00 21.23 ? 102 PRO D C 1 ATOM 8998 O O . PRO F 2 108 ? 45.823 -18.343 -3.977 1.00 22.55 ? 102 PRO D O 1 ATOM 8999 C CB . PRO F 2 108 ? 45.225 -15.140 -2.872 1.00 16.49 ? 102 PRO D CB 1 ATOM 9000 C CG . PRO F 2 108 ? 45.535 -14.789 -4.302 1.00 16.80 ? 102 PRO D CG 1 ATOM 9001 C CD . PRO F 2 108 ? 47.014 -15.145 -4.499 1.00 17.52 ? 102 PRO D CD 1 ATOM 9002 N N . TRP F 2 109 ? 44.186 -17.896 -2.491 1.00 26.58 ? 103 TRP D N 1 ATOM 9003 C CA . TRP F 2 109 ? 43.377 -19.069 -2.807 1.00 22.54 ? 103 TRP D CA 1 ATOM 9004 C C . TRP F 2 109 ? 42.015 -18.686 -3.375 1.00 24.86 ? 103 TRP D C 1 ATOM 9005 O O . TRP F 2 109 ? 41.484 -17.619 -3.062 1.00 22.16 ? 103 TRP D O 1 ATOM 9006 C CB . TRP F 2 109 ? 43.166 -19.919 -1.559 1.00 18.60 ? 103 TRP D CB 1 ATOM 9007 C CG . TRP F 2 109 ? 44.406 -20.506 -0.963 1.00 27.20 ? 103 TRP D CG 1 ATOM 9008 C CD1 . TRP F 2 109 ? 45.479 -19.829 -0.458 1.00 26.82 ? 103 TRP D CD1 1 ATOM 9009 C CD2 . TRP F 2 109 ? 44.681 -21.900 -0.767 1.00 20.23 ? 103 TRP D CD2 1 ATOM 9010 N NE1 . TRP F 2 109 ? 46.412 -20.717 0.024 1.00 30.16 ? 103 TRP D NE1 1 ATOM 9011 C CE2 . TRP F 2 109 ? 45.943 -21.993 -0.151 1.00 22.80 ? 103 TRP D CE2 1 ATOM 9012 C CE3 . TRP F 2 109 ? 43.982 -23.075 -1.057 1.00 21.64 ? 103 TRP D CE3 1 ATOM 9013 C CZ2 . TRP F 2 109 ? 46.525 -23.220 0.176 1.00 27.91 ? 103 TRP D CZ2 1 ATOM 9014 C CZ3 . TRP F 2 109 ? 44.558 -24.293 -0.729 1.00 25.41 ? 103 TRP D CZ3 1 ATOM 9015 C CH2 . TRP F 2 109 ? 45.818 -24.356 -0.122 1.00 25.25 ? 103 TRP D CH2 1 ATOM 9016 N N . GLY F 2 110 ? 41.445 -19.567 -4.196 1.00 16.27 ? 104 GLY D N 1 ATOM 9017 C CA . GLY F 2 110 ? 40.065 -19.424 -4.627 1.00 18.37 ? 104 GLY D CA 1 ATOM 9018 C C . GLY F 2 110 ? 39.150 -19.719 -3.453 1.00 23.03 ? 104 GLY D C 1 ATOM 9019 O O . GLY F 2 110 ? 39.631 -20.106 -2.385 1.00 26.74 ? 104 GLY D O 1 ATOM 9020 N N . GLN F 2 111 ? 37.841 -19.552 -3.633 1.00 20.35 ? 105 GLN D N 1 ATOM 9021 C CA . GLN F 2 111 ? 36.913 -19.698 -2.509 1.00 19.10 ? 105 GLN D CA 1 ATOM 9022 C C . GLN F 2 111 ? 36.603 -21.163 -2.201 1.00 27.48 ? 105 GLN D C 1 ATOM 9023 O O . GLN F 2 111 ? 36.124 -21.486 -1.113 1.00 27.76 ? 105 GLN D O 1 ATOM 9024 C CB . GLN F 2 111 ? 35.609 -18.932 -2.773 1.00 22.33 ? 105 GLN D CB 1 ATOM 9025 C CG . GLN F 2 111 ? 34.581 -19.669 -3.630 1.00 21.17 ? 105 GLN D CG 1 ATOM 9026 C CD . GLN F 2 111 ? 34.869 -19.565 -5.119 1.00 28.52 ? 105 GLN D CD 1 ATOM 9027 O OE1 . GLN F 2 111 ? 35.981 -19.223 -5.532 1.00 25.29 ? 105 GLN D OE1 1 ATOM 9028 N NE2 . GLN F 2 111 ? 33.860 -19.849 -5.934 1.00 24.06 ? 105 GLN D NE2 1 ATOM 9029 N N . GLY F 2 112 ? 36.883 -22.047 -3.153 1.00 26.67 ? 106 GLY D N 1 ATOM 9030 C CA . GLY F 2 112 ? 36.624 -23.461 -2.960 1.00 27.30 ? 106 GLY D CA 1 ATOM 9031 C C . GLY F 2 112 ? 35.298 -23.899 -3.542 1.00 30.42 ? 106 GLY D C 1 ATOM 9032 O O . GLY F 2 112 ? 34.350 -23.118 -3.614 1.00 27.37 ? 106 GLY D O 1 ATOM 9033 N N . THR F 2 113 ? 35.242 -25.156 -3.966 1.00 25.64 ? 107 THR D N 1 ATOM 9034 C CA . THR F 2 113 ? 34.035 -25.734 -4.537 1.00 26.70 ? 107 THR D CA 1 ATOM 9035 C C . THR F 2 113 ? 33.798 -27.107 -3.942 1.00 26.02 ? 107 THR D C 1 ATOM 9036 O O . THR F 2 113 ? 34.639 -27.993 -4.079 1.00 24.48 ? 107 THR D O 1 ATOM 9037 C CB . THR F 2 113 ? 34.127 -25.879 -6.069 1.00 29.34 ? 107 THR D CB 1 ATOM 9038 O OG1 . THR F 2 113 ? 34.363 -24.600 -6.664 1.00 35.71 ? 107 THR D OG1 1 ATOM 9039 C CG2 . THR F 2 113 ? 32.836 -26.463 -6.628 1.00 28.00 ? 107 THR D CG2 1 ATOM 9040 N N . LEU F 2 114 ? 32.663 -27.292 -3.277 1.00 30.10 ? 108 LEU D N 1 ATOM 9041 C CA . LEU F 2 114 ? 32.329 -28.611 -2.764 1.00 29.17 ? 108 LEU D CA 1 ATOM 9042 C C . LEU F 2 114 ? 31.924 -29.496 -3.931 1.00 29.81 ? 108 LEU D C 1 ATOM 9043 O O . LEU F 2 114 ? 31.026 -29.153 -4.695 1.00 21.94 ? 108 LEU D O 1 ATOM 9044 C CB . LEU F 2 114 ? 31.212 -28.547 -1.720 1.00 36.54 ? 108 LEU D CB 1 ATOM 9045 C CG . LEU F 2 114 ? 30.805 -29.901 -1.126 1.00 38.81 ? 108 LEU D CG 1 ATOM 9046 C CD1 . LEU F 2 114 ? 32.003 -30.621 -0.514 1.00 39.55 ? 108 LEU D CD1 1 ATOM 9047 C CD2 . LEU F 2 114 ? 29.696 -29.734 -0.096 1.00 44.90 ? 108 LEU D CD2 1 ATOM 9048 N N . VAL F 2 115 ? 32.615 -30.620 -4.080 1.00 24.96 ? 109 VAL D N 1 ATOM 9049 C CA . VAL F 2 115 ? 32.271 -31.592 -5.104 1.00 27.87 ? 109 VAL D CA 1 ATOM 9050 C C . VAL F 2 115 ? 31.799 -32.876 -4.439 1.00 28.98 ? 109 VAL D C 1 ATOM 9051 O O . VAL F 2 115 ? 32.549 -33.515 -3.706 1.00 28.96 ? 109 VAL D O 1 ATOM 9052 C CB . VAL F 2 115 ? 33.459 -31.891 -6.033 1.00 33.70 ? 109 VAL D CB 1 ATOM 9053 C CG1 . VAL F 2 115 ? 33.134 -33.060 -6.949 1.00 31.49 ? 109 VAL D CG1 1 ATOM 9054 C CG2 . VAL F 2 115 ? 33.823 -30.648 -6.842 1.00 30.82 ? 109 VAL D CG2 1 ATOM 9055 N N . THR F 2 116 ? 30.541 -33.230 -4.676 1.00 24.59 ? 110 THR D N 1 ATOM 9056 C CA . THR F 2 116 ? 29.973 -34.447 -4.123 1.00 27.02 ? 110 THR D CA 1 ATOM 9057 C C . THR F 2 116 ? 29.769 -35.467 -5.233 1.00 30.90 ? 110 THR D C 1 ATOM 9058 O O . THR F 2 116 ? 29.083 -35.199 -6.217 1.00 29.52 ? 110 THR D O 1 ATOM 9059 C CB . THR F 2 116 ? 28.634 -34.180 -3.413 1.00 31.41 ? 110 THR D CB 1 ATOM 9060 O OG1 . THR F 2 116 ? 28.840 -33.272 -2.326 1.00 33.52 ? 110 THR D OG1 1 ATOM 9061 C CG2 . THR F 2 116 ? 28.047 -35.475 -2.869 1.00 30.79 ? 110 THR D CG2 1 ATOM 9062 N N . VAL F 2 117 ? 30.387 -36.630 -5.079 1.00 27.07 ? 111 VAL D N 1 ATOM 9063 C CA . VAL F 2 117 ? 30.221 -37.707 -6.038 1.00 26.72 ? 111 VAL D CA 1 ATOM 9064 C C . VAL F 2 117 ? 29.176 -38.667 -5.486 1.00 33.21 ? 111 VAL D C 1 ATOM 9065 O O . VAL F 2 117 ? 29.405 -39.330 -4.477 1.00 40.63 ? 111 VAL D O 1 ATOM 9066 C CB . VAL F 2 117 ? 31.549 -38.441 -6.309 1.00 28.34 ? 111 VAL D CB 1 ATOM 9067 C CG1 . VAL F 2 117 ? 31.364 -39.513 -7.368 1.00 30.57 ? 111 VAL D CG1 1 ATOM 9068 C CG2 . VAL F 2 117 ? 32.629 -37.447 -6.735 1.00 23.67 ? 111 VAL D CG2 1 ATOM 9069 N N . SER F 2 118 ? 28.023 -38.723 -6.143 1.00 29.36 ? 112 SER D N 1 ATOM 9070 C CA . SER F 2 118 ? 26.897 -39.495 -5.640 1.00 32.28 ? 112 SER D CA 1 ATOM 9071 C C . SER F 2 118 ? 25.940 -39.897 -6.754 1.00 36.98 ? 112 SER D C 1 ATOM 9072 O O . SER F 2 118 ? 25.879 -39.250 -7.800 1.00 34.65 ? 112 SER D O 1 ATOM 9073 C CB . SER F 2 118 ? 26.146 -38.692 -4.579 1.00 34.60 ? 112 SER D CB 1 ATOM 9074 O OG . SER F 2 118 ? 25.003 -39.392 -4.126 1.00 40.00 ? 112 SER D OG 1 ATOM 9075 N N . SER F 2 119 ? 25.189 -40.968 -6.518 1.00 35.87 ? 113 SER D N 1 ATOM 9076 C CA . SER F 2 119 ? 24.172 -41.419 -7.461 1.00 39.24 ? 113 SER D CA 1 ATOM 9077 C C . SER F 2 119 ? 22.826 -40.762 -7.171 1.00 39.54 ? 113 SER D C 1 ATOM 9078 O O . SER F 2 119 ? 21.904 -40.839 -7.982 1.00 42.46 ? 113 SER D O 1 ATOM 9079 C CB . SER F 2 119 ? 24.025 -42.942 -7.410 1.00 36.23 ? 113 SER D CB 1 ATOM 9080 O OG . SER F 2 119 ? 25.236 -43.583 -7.765 1.00 48.82 ? 113 SER D OG 1 ATOM 9081 N N . ALA F 2 120 ? 22.718 -40.123 -6.009 1.00 35.49 ? 114 ALA D N 1 ATOM 9082 C CA . ALA F 2 120 ? 21.471 -39.489 -5.593 1.00 35.91 ? 114 ALA D CA 1 ATOM 9083 C C . ALA F 2 120 ? 21.223 -38.199 -6.371 1.00 35.44 ? 114 ALA D C 1 ATOM 9084 O O . ALA F 2 120 ? 22.164 -37.508 -6.756 1.00 33.31 ? 114 ALA D O 1 ATOM 9085 C CB . ALA F 2 120 ? 21.493 -39.212 -4.097 1.00 33.69 ? 114 ALA D CB 1 ATOM 9086 N N . SER F 2 121 ? 19.955 -37.880 -6.604 1.00 37.11 ? 115 SER D N 1 ATOM 9087 C CA . SER F 2 121 ? 19.605 -36.668 -7.337 1.00 46.26 ? 115 SER D CA 1 ATOM 9088 C C . SER F 2 121 ? 19.516 -35.466 -6.407 1.00 44.34 ? 115 SER D C 1 ATOM 9089 O O . SER F 2 121 ? 19.425 -35.620 -5.188 1.00 41.30 ? 115 SER D O 1 ATOM 9090 C CB . SER F 2 121 ? 18.280 -36.850 -8.080 1.00 54.75 ? 115 SER D CB 1 ATOM 9091 O OG . SER F 2 121 ? 18.390 -37.846 -9.082 1.00 59.64 ? 115 SER D OG 1 ATOM 9092 N N . THR F 2 122 ? 19.550 -34.271 -6.988 1.00 43.15 ? 116 THR D N 1 ATOM 9093 C CA . THR F 2 122 ? 19.415 -33.043 -6.216 1.00 40.84 ? 116 THR D CA 1 ATOM 9094 C C . THR F 2 122 ? 18.010 -32.932 -5.632 1.00 36.72 ? 116 THR D C 1 ATOM 9095 O O . THR F 2 122 ? 17.031 -33.327 -6.266 1.00 37.00 ? 116 THR D O 1 ATOM 9096 C CB . THR F 2 122 ? 19.684 -31.782 -7.067 1.00 43.85 ? 116 THR D CB 1 ATOM 9097 O OG1 . THR F 2 122 ? 18.546 -31.510 -7.889 1.00 49.21 ? 116 THR D OG1 1 ATOM 9098 C CG2 . THR F 2 122 ? 20.879 -31.969 -7.957 1.00 43.88 ? 116 THR D CG2 1 ATOM 9099 N N . LYS F 2 123 ? 17.918 -32.391 -4.423 1.00 35.97 ? 117 LYS D N 1 ATOM 9100 C CA . LYS F 2 123 ? 16.632 -32.072 -3.824 1.00 36.47 ? 117 LYS D CA 1 ATOM 9101 C C . LYS F 2 123 ? 16.689 -30.678 -3.213 1.00 34.17 ? 117 LYS D C 1 ATOM 9102 O O . LYS F 2 123 ? 17.562 -30.388 -2.394 1.00 32.88 ? 117 LYS D O 1 ATOM 9103 C CB . LYS F 2 123 ? 16.247 -33.107 -2.768 1.00 42.96 ? 117 LYS D CB 1 ATOM 9104 C CG . LYS F 2 123 ? 14.824 -32.959 -2.257 1.00 59.62 ? 117 LYS D CG 1 ATOM 9105 C CD . LYS F 2 123 ? 14.375 -34.204 -1.507 1.00 74.06 ? 117 LYS D CD 1 ATOM 9106 C CE . LYS F 2 123 ? 12.914 -34.108 -1.088 1.00 81.77 ? 117 LYS D CE 1 ATOM 9107 N NZ . LYS F 2 123 ? 12.677 -32.955 -0.175 1.00 85.98 ? 117 LYS D NZ 1 ATOM 9108 N N . GLY F 2 124 ? 15.766 -29.814 -3.631 1.00 35.04 ? 118 GLY D N 1 ATOM 9109 C CA . GLY F 2 124 ? 15.694 -28.458 -3.120 1.00 32.88 ? 118 GLY D CA 1 ATOM 9110 C C . GLY F 2 124 ? 15.061 -28.413 -1.743 1.00 36.04 ? 118 GLY D C 1 ATOM 9111 O O . GLY F 2 124 ? 14.273 -29.285 -1.392 1.00 30.95 ? 118 GLY D O 1 ATOM 9112 N N . PRO F 2 125 ? 15.398 -27.388 -0.951 1.00 28.10 ? 119 PRO D N 1 ATOM 9113 C CA . PRO F 2 125 ? 14.915 -27.315 0.429 1.00 34.13 ? 119 PRO D CA 1 ATOM 9114 C C . PRO F 2 125 ? 13.479 -26.820 0.548 1.00 39.35 ? 119 PRO D C 1 ATOM 9115 O O . PRO F 2 125 ? 12.967 -26.149 -0.349 1.00 34.54 ? 119 PRO D O 1 ATOM 9116 C CB . PRO F 2 125 ? 15.872 -26.313 1.070 1.00 34.09 ? 119 PRO D CB 1 ATOM 9117 C CG . PRO F 2 125 ? 16.200 -25.385 -0.044 1.00 30.42 ? 119 PRO D CG 1 ATOM 9118 C CD . PRO F 2 125 ? 16.250 -26.236 -1.293 1.00 34.24 ? 119 PRO D CD 1 ATOM 9119 N N . SER F 2 126 ? 12.839 -27.176 1.656 1.00 43.16 ? 120 SER D N 1 ATOM 9120 C CA . SER F 2 126 ? 11.596 -26.546 2.068 1.00 39.85 ? 120 SER D CA 1 ATOM 9121 C C . SER F 2 126 ? 11.954 -25.492 3.105 1.00 34.36 ? 120 SER D C 1 ATOM 9122 O O . SER F 2 126 ? 12.800 -25.735 3.967 1.00 33.76 ? 120 SER D O 1 ATOM 9123 C CB . SER F 2 126 ? 10.614 -27.571 2.642 1.00 40.79 ? 120 SER D CB 1 ATOM 9124 O OG . SER F 2 126 ? 10.190 -28.488 1.648 1.00 38.94 ? 120 SER D OG 1 ATOM 9125 N N . VAL F 2 127 ? 11.331 -24.321 3.018 1.00 31.78 ? 121 VAL D N 1 ATOM 9126 C CA . VAL F 2 127 ? 11.680 -23.219 3.913 1.00 29.36 ? 121 VAL D CA 1 ATOM 9127 C C . VAL F 2 127 ? 10.487 -22.815 4.766 1.00 30.55 ? 121 VAL D C 1 ATOM 9128 O O . VAL F 2 127 ? 9.460 -22.383 4.247 1.00 34.55 ? 121 VAL D O 1 ATOM 9129 C CB . VAL F 2 127 ? 12.193 -21.993 3.132 1.00 31.02 ? 121 VAL D CB 1 ATOM 9130 C CG1 . VAL F 2 127 ? 12.646 -20.896 4.096 1.00 27.85 ? 121 VAL D CG1 1 ATOM 9131 C CG2 . VAL F 2 127 ? 13.338 -22.399 2.212 1.00 26.52 ? 121 VAL D CG2 1 ATOM 9132 N N . PHE F 2 128 ? 10.630 -22.971 6.077 1.00 27.65 ? 122 PHE D N 1 ATOM 9133 C CA . PHE F 2 128 ? 9.558 -22.660 7.016 1.00 33.28 ? 122 PHE D CA 1 ATOM 9134 C C . PHE F 2 128 ? 10.016 -21.575 7.984 1.00 30.52 ? 122 PHE D C 1 ATOM 9135 O O . PHE F 2 128 ? 11.202 -21.477 8.291 1.00 32.62 ? 122 PHE D O 1 ATOM 9136 C CB . PHE F 2 128 ? 9.129 -23.914 7.788 1.00 34.12 ? 122 PHE D CB 1 ATOM 9137 C CG . PHE F 2 128 ? 8.820 -25.093 6.908 1.00 38.02 ? 122 PHE D CG 1 ATOM 9138 C CD1 . PHE F 2 128 ? 7.708 -25.088 6.083 1.00 40.91 ? 122 PHE D CD1 1 ATOM 9139 C CD2 . PHE F 2 128 ? 9.634 -26.210 6.917 1.00 35.45 ? 122 PHE D CD2 1 ATOM 9140 C CE1 . PHE F 2 128 ? 7.422 -26.175 5.276 1.00 37.94 ? 122 PHE D CE1 1 ATOM 9141 C CE2 . PHE F 2 128 ? 9.353 -27.298 6.114 1.00 37.80 ? 122 PHE D CE2 1 ATOM 9142 C CZ . PHE F 2 128 ? 8.248 -27.281 5.293 1.00 39.51 ? 122 PHE D CZ 1 ATOM 9143 N N . PRO F 2 129 ? 9.077 -20.755 8.472 1.00 43.33 ? 123 PRO D N 1 ATOM 9144 C CA . PRO F 2 129 ? 9.455 -19.664 9.369 1.00 37.61 ? 123 PRO D CA 1 ATOM 9145 C C . PRO F 2 129 ? 9.555 -20.082 10.833 1.00 41.34 ? 123 PRO D C 1 ATOM 9146 O O . PRO F 2 129 ? 8.746 -20.875 11.310 1.00 46.82 ? 123 PRO D O 1 ATOM 9147 C CB . PRO F 2 129 ? 8.319 -18.648 9.188 1.00 35.18 ? 123 PRO D CB 1 ATOM 9148 C CG . PRO F 2 129 ? 7.263 -19.334 8.334 1.00 38.78 ? 123 PRO D CG 1 ATOM 9149 C CD . PRO F 2 129 ? 7.629 -20.772 8.218 1.00 41.45 ? 123 PRO D CD 1 ATOM 9150 N N . LEU F 2 130 ? 10.552 -19.543 11.528 1.00 42.04 ? 124 LEU D N 1 ATOM 9151 C CA . LEU F 2 130 ? 10.614 -19.619 12.982 1.00 40.04 ? 124 LEU D CA 1 ATOM 9152 C C . LEU F 2 130 ? 10.080 -18.307 13.547 1.00 44.12 ? 124 LEU D C 1 ATOM 9153 O O . LEU F 2 130 ? 10.838 -17.356 13.755 1.00 45.17 ? 124 LEU D O 1 ATOM 9154 C CB . LEU F 2 130 ? 12.043 -19.870 13.459 1.00 37.85 ? 124 LEU D CB 1 ATOM 9155 C CG . LEU F 2 130 ? 12.735 -21.120 12.914 1.00 33.38 ? 124 LEU D CG 1 ATOM 9156 C CD1 . LEU F 2 130 ? 14.228 -21.072 13.191 1.00 30.97 ? 124 LEU D CD1 1 ATOM 9157 C CD2 . LEU F 2 130 ? 12.123 -22.372 13.510 1.00 37.15 ? 124 LEU D CD2 1 ATOM 9158 N N . ALA F 2 131 ? 8.772 -18.262 13.780 1.00 41.15 ? 125 ALA D N 1 ATOM 9159 C CA . ALA F 2 131 ? 8.087 -17.028 14.165 1.00 43.85 ? 125 ALA D CA 1 ATOM 9160 C C . ALA F 2 131 ? 8.486 -16.521 15.548 1.00 46.57 ? 125 ALA D C 1 ATOM 9161 O O . ALA F 2 131 ? 8.581 -17.297 16.498 1.00 49.71 ? 125 ALA D O 1 ATOM 9162 C CB . ALA F 2 131 ? 6.577 -17.232 14.105 1.00 42.11 ? 125 ALA D CB 1 ATOM 9163 N N . PRO F 2 132 ? 8.707 -15.204 15.664 1.00 52.42 ? 126 PRO D N 1 ATOM 9164 C CA . PRO F 2 132 ? 9.008 -14.554 16.943 1.00 57.11 ? 126 PRO D CA 1 ATOM 9165 C C . PRO F 2 132 ? 7.779 -14.509 17.841 1.00 71.19 ? 126 PRO D C 1 ATOM 9166 O O . PRO F 2 132 ? 6.661 -14.394 17.339 1.00 67.67 ? 126 PRO D O 1 ATOM 9167 C CB . PRO F 2 132 ? 9.436 -13.147 16.527 1.00 50.18 ? 126 PRO D CB 1 ATOM 9168 C CG . PRO F 2 132 ? 8.696 -12.904 15.260 1.00 47.27 ? 126 PRO D CG 1 ATOM 9169 C CD . PRO F 2 132 ? 8.641 -14.233 14.557 1.00 52.48 ? 126 PRO D CD 1 ATOM 9170 N N . SER F 2 133 ? 7.982 -14.595 19.150 1.00 93.06 ? 127 SER D N 1 ATOM 9171 C CA . SER F 2 133 ? 6.863 -14.612 20.082 1.00 113.53 ? 127 SER D CA 1 ATOM 9172 C C . SER F 2 133 ? 7.243 -14.035 21.441 1.00 127.65 ? 127 SER D C 1 ATOM 9173 O O . SER F 2 133 ? 8.423 -13.849 21.739 1.00 128.75 ? 127 SER D O 1 ATOM 9174 C CB . SER F 2 133 ? 6.334 -16.038 20.243 1.00 119.37 ? 127 SER D CB 1 ATOM 9175 O OG . SER F 2 133 ? 7.380 -16.938 20.562 1.00 122.38 ? 127 SER D OG 1 ATOM 9176 N N . SER F 2 134 ? 6.233 -13.757 22.261 1.00 134.98 ? 128 SER D N 1 ATOM 9177 C CA . SER F 2 134 ? 6.447 -13.136 23.564 1.00 140.51 ? 128 SER D CA 1 ATOM 9178 C C . SER F 2 134 ? 7.131 -14.083 24.544 1.00 146.82 ? 128 SER D C 1 ATOM 9179 O O . SER F 2 134 ? 7.701 -13.642 25.541 1.00 146.75 ? 128 SER D O 1 ATOM 9180 C CB . SER F 2 134 ? 5.121 -12.645 24.147 1.00 138.02 ? 128 SER D CB 1 ATOM 9181 O OG . SER F 2 134 ? 4.586 -11.587 23.370 1.00 135.89 ? 128 SER D OG 1 ATOM 9182 N N . LYS F 2 135 ? 7.073 -15.382 24.264 1.00 153.81 ? 129 LYS D N 1 ATOM 9183 C CA . LYS F 2 135 ? 7.857 -16.351 25.024 1.00 161.69 ? 129 LYS D CA 1 ATOM 9184 C C . LYS F 2 135 ? 9.200 -16.553 24.320 1.00 160.04 ? 129 LYS D C 1 ATOM 9185 O O . LYS F 2 135 ? 9.744 -17.658 24.275 1.00 161.68 ? 129 LYS D O 1 ATOM 9186 C CB . LYS F 2 135 ? 7.104 -17.680 25.191 1.00 167.26 ? 129 LYS D CB 1 ATOM 9187 C CG . LYS F 2 135 ? 6.722 -18.390 23.896 1.00 168.96 ? 129 LYS D CG 1 ATOM 9188 C CD . LYS F 2 135 ? 5.340 -17.984 23.402 1.00 171.22 ? 129 LYS D CD 1 ATOM 9189 C CE . LYS F 2 135 ? 4.992 -18.685 22.099 1.00 169.69 ? 129 LYS D CE 1 ATOM 9190 N NZ . LYS F 2 135 ? 5.095 -20.160 22.210 1.00 170.18 ? 129 LYS D NZ 1 ATOM 9191 N N . SER F 2 136 ? 9.712 -15.456 23.767 1.00 159.86 ? 130 SER D N 1 ATOM 9192 C CA . SER F 2 136 ? 11.020 -15.406 23.123 1.00 155.17 ? 130 SER D CA 1 ATOM 9193 C C . SER F 2 136 ? 11.505 -13.960 23.074 1.00 149.43 ? 130 SER D C 1 ATOM 9194 O O . SER F 2 136 ? 12.369 -13.605 22.273 1.00 143.62 ? 130 SER D O 1 ATOM 9195 C CB . SER F 2 136 ? 10.969 -15.999 21.716 1.00 152.75 ? 130 SER D CB 1 ATOM 9196 O OG . SER F 2 136 ? 10.838 -17.409 21.765 1.00 151.56 ? 130 SER D OG 1 ATOM 9197 N N . THR F 2 137 ? 10.926 -13.125 23.931 1.00 149.60 ? 131 THR D N 1 ATOM 9198 C CA . THR F 2 137 ? 11.361 -11.744 24.072 1.00 147.19 ? 131 THR D CA 1 ATOM 9199 C C . THR F 2 137 ? 12.329 -11.663 25.244 1.00 142.02 ? 131 THR D C 1 ATOM 9200 O O . THR F 2 137 ? 11.924 -11.430 26.383 1.00 147.00 ? 131 THR D O 1 ATOM 9201 C CB . THR F 2 137 ? 10.170 -10.787 24.292 1.00 149.95 ? 131 THR D CB 1 ATOM 9202 O OG1 . THR F 2 137 ? 9.248 -10.909 23.201 1.00 149.92 ? 131 THR D OG1 1 ATOM 9203 C CG2 . THR F 2 137 ? 10.642 -9.342 24.391 1.00 151.97 ? 131 THR D CG2 1 ATOM 9204 N N . SER F 2 138 ? 13.609 -11.885 24.965 1.00 133.66 ? 132 SER D N 1 ATOM 9205 C CA . SER F 2 138 ? 14.627 -11.863 26.007 1.00 128.50 ? 132 SER D CA 1 ATOM 9206 C C . SER F 2 138 ? 15.125 -10.447 26.260 1.00 124.14 ? 132 SER D C 1 ATOM 9207 O O . SER F 2 138 ? 16.069 -9.986 25.617 1.00 124.58 ? 132 SER D O 1 ATOM 9208 C CB . SER F 2 138 ? 15.801 -12.771 25.637 1.00 126.02 ? 132 SER D CB 1 ATOM 9209 O OG . SER F 2 138 ? 16.791 -12.764 26.650 1.00 125.92 ? 132 SER D OG 1 ATOM 9210 N N . GLY F 2 139 ? 14.480 -9.766 27.202 1.00 120.10 ? 133 GLY D N 1 ATOM 9211 C CA . GLY F 2 139 ? 14.884 -8.432 27.606 1.00 116.25 ? 133 GLY D CA 1 ATOM 9212 C C . GLY F 2 139 ? 14.853 -7.402 26.493 1.00 112.26 ? 133 GLY D C 1 ATOM 9213 O O . GLY F 2 139 ? 15.843 -6.709 26.251 1.00 111.18 ? 133 GLY D O 1 ATOM 9214 N N . GLY F 2 140 ? 13.715 -7.298 25.813 1.00 107.12 ? 134 GLY D N 1 ATOM 9215 C CA . GLY F 2 140 ? 13.549 -6.317 24.755 1.00 99.75 ? 134 GLY D CA 1 ATOM 9216 C C . GLY F 2 140 ? 14.132 -6.749 23.422 1.00 90.07 ? 134 GLY D C 1 ATOM 9217 O O . GLY F 2 140 ? 14.149 -5.976 22.464 1.00 85.51 ? 134 GLY D O 1 ATOM 9218 N N . THR F 2 141 ? 14.611 -7.986 23.358 1.00 88.85 ? 135 THR D N 1 ATOM 9219 C CA . THR F 2 141 ? 15.167 -8.526 22.123 1.00 82.88 ? 135 THR D CA 1 ATOM 9220 C C . THR F 2 141 ? 14.389 -9.756 21.670 1.00 76.26 ? 135 THR D C 1 ATOM 9221 O O . THR F 2 141 ? 14.232 -10.717 22.424 1.00 82.42 ? 135 THR D O 1 ATOM 9222 C CB . THR F 2 141 ? 16.656 -8.890 22.287 1.00 86.23 ? 135 THR D CB 1 ATOM 9223 O OG1 . THR F 2 141 ? 17.442 -7.693 22.281 1.00 88.05 ? 135 THR D OG1 1 ATOM 9224 C CG2 . THR F 2 141 ? 17.119 -9.790 21.154 1.00 87.30 ? 135 THR D CG2 1 ATOM 9225 N N . ALA F 2 142 ? 13.895 -9.714 20.437 1.00 55.57 ? 136 ALA D N 1 ATOM 9226 C CA . ALA F 2 142 ? 13.156 -10.834 19.869 1.00 43.14 ? 136 ALA D CA 1 ATOM 9227 C C . ALA F 2 142 ? 14.035 -11.632 18.917 1.00 47.46 ? 136 ALA D C 1 ATOM 9228 O O . ALA F 2 142 ? 14.820 -11.065 18.155 1.00 53.73 ? 136 ALA D O 1 ATOM 9229 C CB . ALA F 2 142 ? 11.911 -10.344 19.150 1.00 33.61 ? 136 ALA D CB 1 ATOM 9230 N N . ALA F 2 143 ? 13.901 -12.951 18.966 1.00 39.28 ? 137 ALA D N 1 ATOM 9231 C CA . ALA F 2 143 ? 14.616 -13.821 18.047 1.00 38.84 ? 137 ALA D CA 1 ATOM 9232 C C . ALA F 2 143 ? 13.656 -14.405 17.023 1.00 36.54 ? 137 ALA D C 1 ATOM 9233 O O . ALA F 2 143 ? 12.571 -14.873 17.369 1.00 40.96 ? 137 ALA D O 1 ATOM 9234 C CB . ALA F 2 143 ? 15.330 -14.937 18.807 1.00 31.39 ? 137 ALA D CB 1 ATOM 9235 N N . LEU F 2 144 ? 14.054 -14.368 15.758 1.00 30.76 ? 138 LEU D N 1 ATOM 9236 C CA . LEU F 2 144 ? 13.269 -14.989 14.700 1.00 31.78 ? 138 LEU D CA 1 ATOM 9237 C C . LEU F 2 144 ? 14.205 -15.695 13.734 1.00 30.55 ? 138 LEU D C 1 ATOM 9238 O O . LEU F 2 144 ? 15.422 -15.516 13.804 1.00 30.88 ? 138 LEU D O 1 ATOM 9239 C CB . LEU F 2 144 ? 12.416 -13.950 13.971 1.00 28.12 ? 138 LEU D CB 1 ATOM 9240 C CG . LEU F 2 144 ? 13.155 -12.798 13.288 1.00 34.52 ? 138 LEU D CG 1 ATOM 9241 C CD1 . LEU F 2 144 ? 13.361 -13.080 11.807 1.00 37.19 ? 138 LEU D CD1 1 ATOM 9242 C CD2 . LEU F 2 144 ? 12.402 -11.499 13.483 1.00 42.52 ? 138 LEU D CD2 1 ATOM 9243 N N . GLY F 2 145 ? 13.645 -16.493 12.831 1.00 26.35 ? 139 GLY D N 1 ATOM 9244 C CA . GLY F 2 145 ? 14.478 -17.218 11.894 1.00 26.35 ? 139 GLY D CA 1 ATOM 9245 C C . GLY F 2 145 ? 13.763 -17.982 10.799 1.00 31.62 ? 139 GLY D C 1 ATOM 9246 O O . GLY F 2 145 ? 12.561 -17.825 10.578 1.00 28.46 ? 139 GLY D O 1 ATOM 9247 N N . CYS F 2 146 ? 14.536 -18.806 10.100 1.00 36.14 ? 140 CYS D N 1 ATOM 9248 C CA . CYS F 2 146 ? 14.024 -19.659 9.038 1.00 38.08 ? 140 CYS D CA 1 ATOM 9249 C C . CYS F 2 146 ? 14.545 -21.076 9.211 1.00 35.32 ? 140 CYS D C 1 ATOM 9250 O O . CYS F 2 146 ? 15.703 -21.273 9.576 1.00 32.40 ? 140 CYS D O 1 ATOM 9251 C CB . CYS F 2 146 ? 14.426 -19.125 7.661 1.00 33.96 ? 140 CYS D CB 1 ATOM 9252 S SG . CYS F 2 146 ? 13.382 -17.797 7.038 1.00 65.12 ? 140 CYS D SG 1 ATOM 9253 N N . LEU F 2 147 ? 13.685 -22.055 8.951 1.00 38.09 ? 141 LEU D N 1 ATOM 9254 C CA . LEU F 2 147 ? 14.093 -23.453 8.953 1.00 35.15 ? 141 LEU D CA 1 ATOM 9255 C C . LEU F 2 147 ? 14.240 -23.935 7.518 1.00 36.46 ? 141 LEU D C 1 ATOM 9256 O O . LEU F 2 147 ? 13.268 -23.964 6.761 1.00 37.92 ? 141 LEU D O 1 ATOM 9257 C CB . LEU F 2 147 ? 13.087 -24.317 9.715 1.00 28.21 ? 141 LEU D CB 1 ATOM 9258 C CG . LEU F 2 147 ? 13.269 -25.836 9.667 1.00 33.96 ? 141 LEU D CG 1 ATOM 9259 C CD1 . LEU F 2 147 ? 14.613 -26.267 10.241 1.00 33.45 ? 141 LEU D CD1 1 ATOM 9260 C CD2 . LEU F 2 147 ? 12.130 -26.513 10.411 1.00 39.88 ? 141 LEU D CD2 1 ATOM 9261 N N . VAL F 2 148 ? 15.465 -24.295 7.148 1.00 29.88 ? 142 VAL D N 1 ATOM 9262 C CA . VAL F 2 148 ? 15.762 -24.739 5.793 1.00 33.12 ? 142 VAL D CA 1 ATOM 9263 C C . VAL F 2 148 ? 15.971 -26.257 5.794 1.00 36.92 ? 142 VAL D C 1 ATOM 9264 O O . VAL F 2 148 ? 17.041 -26.746 6.162 1.00 34.60 ? 142 VAL D O 1 ATOM 9265 C CB . VAL F 2 148 ? 16.999 -24.009 5.233 1.00 26.59 ? 142 VAL D CB 1 ATOM 9266 C CG1 . VAL F 2 148 ? 17.214 -24.352 3.767 1.00 23.81 ? 142 VAL D CG1 1 ATOM 9267 C CG2 . VAL F 2 148 ? 16.839 -22.501 5.404 1.00 25.70 ? 142 VAL D CG2 1 ATOM 9268 N N . LYS F 2 149 ? 14.943 -26.997 5.385 1.00 33.55 ? 143 LYS D N 1 ATOM 9269 C CA . LYS F 2 149 ? 14.904 -28.440 5.625 1.00 34.81 ? 143 LYS D CA 1 ATOM 9270 C C . LYS F 2 149 ? 14.883 -29.311 4.364 1.00 33.37 ? 143 LYS D C 1 ATOM 9271 O O . LYS F 2 149 ? 14.316 -28.930 3.338 1.00 38.93 ? 143 LYS D O 1 ATOM 9272 C CB . LYS F 2 149 ? 13.682 -28.780 6.482 1.00 35.91 ? 143 LYS D CB 1 ATOM 9273 C CG . LYS F 2 149 ? 13.755 -30.149 7.125 1.00 41.67 ? 143 LYS D CG 1 ATOM 9274 C CD . LYS F 2 149 ? 12.427 -30.581 7.711 1.00 50.38 ? 143 LYS D CD 1 ATOM 9275 C CE . LYS F 2 149 ? 12.483 -32.050 8.103 1.00 57.90 ? 143 LYS D CE 1 ATOM 9276 N NZ . LYS F 2 149 ? 11.144 -32.588 8.449 1.00 70.45 ? 143 LYS D NZ 1 ATOM 9277 N N . ASP F 2 150 ? 15.514 -30.481 4.465 1.00 37.20 ? 144 ASP D N 1 ATOM 9278 C CA . ASP F 2 150 ? 15.445 -31.535 3.446 1.00 41.01 ? 144 ASP D CA 1 ATOM 9279 C C . ASP F 2 150 ? 16.012 -31.131 2.090 1.00 36.71 ? 144 ASP D C 1 ATOM 9280 O O . ASP F 2 150 ? 15.272 -30.998 1.113 1.00 38.75 ? 144 ASP D O 1 ATOM 9281 C CB . ASP F 2 150 ? 13.997 -32.002 3.264 1.00 47.01 ? 144 ASP D CB 1 ATOM 9282 C CG . ASP F 2 150 ? 13.395 -32.540 4.542 1.00 53.31 ? 144 ASP D CG 1 ATOM 9283 O OD1 . ASP F 2 150 ? 14.170 -32.987 5.414 1.00 48.59 ? 144 ASP D OD1 1 ATOM 9284 O OD2 . ASP F 2 150 ? 12.151 -32.518 4.670 1.00 61.22 ? 144 ASP D OD2 1 ATOM 9285 N N . TYR F 2 151 ? 17.325 -30.950 2.025 1.00 32.02 ? 145 TYR D N 1 ATOM 9286 C CA . TYR F 2 151 ? 17.966 -30.636 0.756 1.00 30.60 ? 145 TYR D CA 1 ATOM 9287 C C . TYR F 2 151 ? 19.239 -31.444 0.543 1.00 30.55 ? 145 TYR D C 1 ATOM 9288 O O . TYR F 2 151 ? 19.830 -31.965 1.492 1.00 30.30 ? 145 TYR D O 1 ATOM 9289 C CB . TYR F 2 151 ? 18.273 -29.140 0.660 1.00 19.36 ? 145 TYR D CB 1 ATOM 9290 C CG . TYR F 2 151 ? 19.288 -28.623 1.655 1.00 30.12 ? 145 TYR D CG 1 ATOM 9291 C CD1 . TYR F 2 151 ? 20.647 -28.639 1.366 1.00 29.47 ? 145 TYR D CD1 1 ATOM 9292 C CD2 . TYR F 2 151 ? 18.885 -28.091 2.873 1.00 31.36 ? 145 TYR D CD2 1 ATOM 9293 C CE1 . TYR F 2 151 ? 21.574 -28.157 2.267 1.00 25.13 ? 145 TYR D CE1 1 ATOM 9294 C CE2 . TYR F 2 151 ? 19.805 -27.602 3.781 1.00 22.92 ? 145 TYR D CE2 1 ATOM 9295 C CZ . TYR F 2 151 ? 21.149 -27.639 3.474 1.00 25.41 ? 145 TYR D CZ 1 ATOM 9296 O OH . TYR F 2 151 ? 22.070 -27.155 4.380 1.00 25.67 ? 145 TYR D OH 1 ATOM 9297 N N . PHE F 2 152 ? 19.644 -31.535 -0.718 1.00 28.33 ? 146 PHE D N 1 ATOM 9298 C CA . PHE F 2 152 ? 20.826 -32.281 -1.124 1.00 21.70 ? 146 PHE D CA 1 ATOM 9299 C C . PHE F 2 152 ? 21.239 -31.819 -2.519 1.00 31.29 ? 146 PHE D C 1 ATOM 9300 O O . PHE F 2 152 ? 20.389 -31.653 -3.396 1.00 37.97 ? 146 PHE D O 1 ATOM 9301 C CB . PHE F 2 152 ? 20.548 -33.793 -1.106 1.00 21.50 ? 146 PHE D CB 1 ATOM 9302 C CG . PHE F 2 152 ? 21.730 -34.636 -1.501 1.00 31.84 ? 146 PHE D CG 1 ATOM 9303 C CD1 . PHE F 2 152 ? 21.941 -34.986 -2.830 1.00 22.30 ? 146 PHE D CD1 1 ATOM 9304 C CD2 . PHE F 2 152 ? 22.626 -35.087 -0.540 1.00 25.86 ? 146 PHE D CD2 1 ATOM 9305 C CE1 . PHE F 2 152 ? 23.029 -35.754 -3.190 1.00 23.82 ? 146 PHE D CE1 1 ATOM 9306 C CE2 . PHE F 2 152 ? 23.713 -35.860 -0.894 1.00 27.69 ? 146 PHE D CE2 1 ATOM 9307 C CZ . PHE F 2 152 ? 23.916 -36.194 -2.218 1.00 29.89 ? 146 PHE D CZ 1 ATOM 9308 N N . PRO F 2 153 ? 22.542 -31.584 -2.727 1.00 32.17 ? 147 PRO D N 1 ATOM 9309 C CA . PRO F 2 153 ? 23.593 -31.647 -1.709 1.00 31.98 ? 147 PRO D CA 1 ATOM 9310 C C . PRO F 2 153 ? 23.829 -30.286 -1.063 1.00 32.89 ? 147 PRO D C 1 ATOM 9311 O O . PRO F 2 153 ? 23.108 -29.327 -1.357 1.00 33.40 ? 147 PRO D O 1 ATOM 9312 C CB . PRO F 2 153 ? 24.811 -32.071 -2.516 1.00 28.67 ? 147 PRO D CB 1 ATOM 9313 C CG . PRO F 2 153 ? 24.609 -31.331 -3.819 1.00 30.33 ? 147 PRO D CG 1 ATOM 9314 C CD . PRO F 2 153 ? 23.108 -31.341 -4.067 1.00 25.51 ? 147 PRO D CD 1 ATOM 9315 N N . GLU F 2 154 ? 24.834 -30.208 -0.196 1.00 30.73 ? 148 GLU D N 1 ATOM 9316 C CA . GLU F 2 154 ? 25.308 -28.929 0.322 1.00 33.85 ? 148 GLU D CA 1 ATOM 9317 C C . GLU F 2 154 ? 25.964 -28.132 -0.804 1.00 33.17 ? 148 GLU D C 1 ATOM 9318 O O . GLU F 2 154 ? 26.338 -28.707 -1.829 1.00 32.76 ? 148 GLU D O 1 ATOM 9319 C CB . GLU F 2 154 ? 26.299 -29.148 1.470 1.00 29.96 ? 148 GLU D CB 1 ATOM 9320 C CG . GLU F 2 154 ? 25.660 -29.539 2.786 1.00 39.72 ? 148 GLU D CG 1 ATOM 9321 C CD . GLU F 2 154 ? 26.677 -29.647 3.905 1.00 48.37 ? 148 GLU D CD 1 ATOM 9322 O OE1 . GLU F 2 154 ? 26.577 -28.870 4.878 1.00 56.77 ? 148 GLU D OE1 1 ATOM 9323 O OE2 . GLU F 2 154 ? 27.583 -30.501 3.810 1.00 46.45 ? 148 GLU D OE2 1 ATOM 9324 N N . PRO F 2 155 ? 26.094 -26.803 -0.635 1.00 32.79 ? 149 PRO D N 1 ATOM 9325 C CA . PRO F 2 155 ? 25.563 -25.966 0.444 1.00 31.41 ? 149 PRO D CA 1 ATOM 9326 C C . PRO F 2 155 ? 24.291 -25.227 0.048 1.00 30.87 ? 149 PRO D C 1 ATOM 9327 O O . PRO F 2 155 ? 23.845 -25.319 -1.095 1.00 31.44 ? 149 PRO D O 1 ATOM 9328 C CB . PRO F 2 155 ? 26.696 -24.966 0.678 1.00 29.30 ? 149 PRO D CB 1 ATOM 9329 C CG . PRO F 2 155 ? 27.224 -24.729 -0.712 1.00 25.34 ? 149 PRO D CG 1 ATOM 9330 C CD . PRO F 2 155 ? 27.081 -26.064 -1.446 1.00 21.95 ? 149 PRO D CD 1 ATOM 9331 N N . VAL F 2 156 ? 23.715 -24.507 1.005 1.00 29.42 ? 150 VAL D N 1 ATOM 9332 C CA . VAL F 2 156 ? 22.739 -23.471 0.709 1.00 30.60 ? 150 VAL D CA 1 ATOM 9333 C C . VAL F 2 156 ? 23.309 -22.160 1.208 1.00 32.19 ? 150 VAL D C 1 ATOM 9334 O O . VAL F 2 156 ? 24.220 -22.146 2.037 1.00 28.56 ? 150 VAL D O 1 ATOM 9335 C CB . VAL F 2 156 ? 21.369 -23.713 1.377 1.00 38.64 ? 150 VAL D CB 1 ATOM 9336 C CG1 . VAL F 2 156 ? 20.716 -24.970 0.833 1.00 44.96 ? 150 VAL D CG1 1 ATOM 9337 C CG2 . VAL F 2 156 ? 21.518 -23.781 2.888 1.00 43.20 ? 150 VAL D CG2 1 ATOM 9338 N N . THR F 2 157 ? 22.779 -21.058 0.697 1.00 29.38 ? 151 THR D N 1 ATOM 9339 C CA . THR F 2 157 ? 23.170 -19.746 1.180 1.00 30.79 ? 151 THR D CA 1 ATOM 9340 C C . THR F 2 157 ? 21.937 -19.030 1.701 1.00 29.92 ? 151 THR D C 1 ATOM 9341 O O . THR F 2 157 ? 20.923 -18.930 1.010 1.00 28.90 ? 151 THR D O 1 ATOM 9342 C CB . THR F 2 157 ? 23.843 -18.909 0.086 1.00 30.47 ? 151 THR D CB 1 ATOM 9343 O OG1 . THR F 2 157 ? 24.998 -19.605 -0.394 1.00 41.94 ? 151 THR D OG1 1 ATOM 9344 C CG2 . THR F 2 157 ? 24.273 -17.555 0.639 1.00 29.15 ? 151 THR D CG2 1 ATOM 9345 N N . VAL F 2 158 ? 22.014 -18.552 2.934 1.00 21.61 ? 152 VAL D N 1 ATOM 9346 C CA . VAL F 2 158 ? 20.884 -17.856 3.519 1.00 28.81 ? 152 VAL D CA 1 ATOM 9347 C C . VAL F 2 158 ? 21.236 -16.394 3.740 1.00 30.08 ? 152 VAL D C 1 ATOM 9348 O O . VAL F 2 158 ? 22.305 -16.075 4.261 1.00 31.42 ? 152 VAL D O 1 ATOM 9349 C CB . VAL F 2 158 ? 20.442 -18.505 4.847 1.00 29.83 ? 152 VAL D CB 1 ATOM 9350 C CG1 . VAL F 2 158 ? 19.210 -17.802 5.402 1.00 30.15 ? 152 VAL D CG1 1 ATOM 9351 C CG2 . VAL F 2 158 ? 20.158 -19.981 4.632 1.00 27.34 ? 152 VAL D CG2 1 ATOM 9352 N N . SER F 2 159 ? 20.343 -15.510 3.308 1.00 32.26 ? 153 SER D N 1 ATOM 9353 C CA . SER F 2 159 ? 20.491 -14.080 3.553 1.00 28.93 ? 153 SER D CA 1 ATOM 9354 C C . SER F 2 159 ? 19.216 -13.550 4.187 1.00 29.52 ? 153 SER D C 1 ATOM 9355 O O . SER F 2 159 ? 18.168 -14.190 4.110 1.00 25.04 ? 153 SER D O 1 ATOM 9356 C CB . SER F 2 159 ? 20.788 -13.326 2.255 1.00 28.17 ? 153 SER D CB 1 ATOM 9357 O OG . SER F 2 159 ? 21.793 -13.975 1.495 1.00 29.21 ? 153 SER D OG 1 ATOM 9358 N N . TRP F 2 160 ? 19.308 -12.382 4.815 1.00 32.26 ? 154 TRP D N 1 ATOM 9359 C CA . TRP F 2 160 ? 18.127 -11.718 5.355 1.00 30.99 ? 154 TRP D CA 1 ATOM 9360 C C . TRP F 2 160 ? 17.924 -10.363 4.698 1.00 31.92 ? 154 TRP D C 1 ATOM 9361 O O . TRP F 2 160 ? 18.875 -9.595 4.528 1.00 28.65 ? 154 TRP D O 1 ATOM 9362 C CB . TRP F 2 160 ? 18.232 -11.566 6.873 1.00 31.53 ? 154 TRP D CB 1 ATOM 9363 C CG . TRP F 2 160 ? 18.093 -12.874 7.579 1.00 28.24 ? 154 TRP D CG 1 ATOM 9364 C CD1 . TRP F 2 160 ? 19.096 -13.743 7.901 1.00 30.65 ? 154 TRP D CD1 1 ATOM 9365 C CD2 . TRP F 2 160 ? 16.875 -13.483 8.026 1.00 31.28 ? 154 TRP D CD2 1 ATOM 9366 N NE1 . TRP F 2 160 ? 18.578 -14.850 8.530 1.00 29.53 ? 154 TRP D NE1 1 ATOM 9367 C CE2 . TRP F 2 160 ? 17.217 -14.716 8.617 1.00 35.30 ? 154 TRP D CE2 1 ATOM 9368 C CE3 . TRP F 2 160 ? 15.529 -13.103 7.988 1.00 28.71 ? 154 TRP D CE3 1 ATOM 9369 C CZ2 . TRP F 2 160 ? 16.262 -15.570 9.165 1.00 34.10 ? 154 TRP D CZ2 1 ATOM 9370 C CZ3 . TRP F 2 160 ? 14.585 -13.951 8.533 1.00 26.54 ? 154 TRP D CZ3 1 ATOM 9371 C CH2 . TRP F 2 160 ? 14.955 -15.169 9.114 1.00 32.08 ? 154 TRP D CH2 1 ATOM 9372 N N . ASN F 2 161 ? 16.675 -10.090 4.328 1.00 23.31 ? 155 ASN D N 1 ATOM 9373 C CA . ASN F 2 161 ? 16.298 -8.855 3.652 1.00 30.79 ? 155 ASN D CA 1 ATOM 9374 C C . ASN F 2 161 ? 17.182 -8.558 2.457 1.00 28.37 ? 155 ASN D C 1 ATOM 9375 O O . ASN F 2 161 ? 17.639 -7.432 2.271 1.00 32.19 ? 155 ASN D O 1 ATOM 9376 C CB . ASN F 2 161 ? 16.323 -7.685 4.630 1.00 32.35 ? 155 ASN D CB 1 ATOM 9377 C CG . ASN F 2 161 ? 15.251 -7.803 5.687 1.00 36.66 ? 155 ASN D CG 1 ATOM 9378 O OD1 . ASN F 2 161 ? 14.387 -8.681 5.608 1.00 35.98 ? 155 ASN D OD1 1 ATOM 9379 N ND2 . ASN F 2 161 ? 15.288 -6.919 6.677 1.00 34.25 ? 155 ASN D ND2 1 ATOM 9380 N N . SER F 2 162 ? 17.410 -9.593 1.656 1.00 25.58 ? 156 SER D N 1 ATOM 9381 C CA . SER F 2 162 ? 18.212 -9.501 0.442 1.00 31.37 ? 156 SER D CA 1 ATOM 9382 C C . SER F 2 162 ? 19.622 -8.975 0.691 1.00 28.93 ? 156 SER D C 1 ATOM 9383 O O . SER F 2 162 ? 20.215 -8.346 -0.183 1.00 31.67 ? 156 SER D O 1 ATOM 9384 C CB . SER F 2 162 ? 17.498 -8.633 -0.595 1.00 24.85 ? 156 SER D CB 1 ATOM 9385 O OG . SER F 2 162 ? 16.468 -9.378 -1.224 1.00 26.61 ? 156 SER D OG 1 ATOM 9386 N N . GLY F 2 163 ? 20.156 -9.249 1.877 1.00 30.00 ? 157 GLY D N 1 ATOM 9387 C CA . GLY F 2 163 ? 21.522 -8.884 2.201 1.00 26.05 ? 157 GLY D CA 1 ATOM 9388 C C . GLY F 2 163 ? 21.633 -7.654 3.080 1.00 28.02 ? 157 GLY D C 1 ATOM 9389 O O . GLY F 2 163 ? 22.705 -7.363 3.606 1.00 28.94 ? 157 GLY D O 1 ATOM 9390 N N . ALA F 2 164 ? 20.526 -6.938 3.249 1.00 26.34 ? 158 ALA D N 1 ATOM 9391 C CA . ALA F 2 164 ? 20.538 -5.680 3.993 1.00 27.74 ? 158 ALA D CA 1 ATOM 9392 C C . ALA F 2 164 ? 20.677 -5.887 5.498 1.00 34.87 ? 158 ALA D C 1 ATOM 9393 O O . ALA F 2 164 ? 21.103 -4.982 6.215 1.00 35.21 ? 158 ALA D O 1 ATOM 9394 C CB . ALA F 2 164 ? 19.290 -4.891 3.699 1.00 17.72 ? 158 ALA D CB 1 ATOM 9395 N N . LEU F 2 165 ? 20.310 -7.073 5.974 1.00 30.25 ? 159 LEU D N 1 ATOM 9396 C CA . LEU F 2 165 ? 20.396 -7.385 7.398 1.00 25.87 ? 159 LEU D CA 1 ATOM 9397 C C . LEU F 2 165 ? 21.428 -8.481 7.639 1.00 30.87 ? 159 LEU D C 1 ATOM 9398 O O . LEU F 2 165 ? 21.264 -9.612 7.177 1.00 30.39 ? 159 LEU D O 1 ATOM 9399 C CB . LEU F 2 165 ? 19.028 -7.807 7.938 1.00 28.88 ? 159 LEU D CB 1 ATOM 9400 C CG . LEU F 2 165 ? 18.946 -8.299 9.385 1.00 34.62 ? 159 LEU D CG 1 ATOM 9401 C CD1 . LEU F 2 165 ? 19.296 -7.186 10.364 1.00 38.48 ? 159 LEU D CD1 1 ATOM 9402 C CD2 . LEU F 2 165 ? 17.562 -8.856 9.677 1.00 34.78 ? 159 LEU D CD2 1 ATOM 9403 N N . THR F 2 166 ? 22.497 -8.141 8.355 1.00 33.26 ? 160 THR D N 1 ATOM 9404 C CA . THR F 2 166 ? 23.594 -9.079 8.568 1.00 35.40 ? 160 THR D CA 1 ATOM 9405 C C . THR F 2 166 ? 24.027 -9.171 10.027 1.00 36.84 ? 160 THR D C 1 ATOM 9406 O O . THR F 2 166 ? 24.558 -10.193 10.456 1.00 41.27 ? 160 THR D O 1 ATOM 9407 C CB . THR F 2 166 ? 24.820 -8.702 7.730 1.00 35.01 ? 160 THR D CB 1 ATOM 9408 O OG1 . THR F 2 166 ? 25.191 -7.350 8.020 1.00 41.97 ? 160 THR D OG1 1 ATOM 9409 C CG2 . THR F 2 166 ? 24.513 -8.834 6.246 1.00 33.17 ? 160 THR D CG2 1 ATOM 9410 N N . SER F 2 167 ? 23.809 -8.107 10.791 1.00 36.21 ? 161 SER D N 1 ATOM 9411 C CA . SER F 2 167 ? 24.198 -8.118 12.196 1.00 38.84 ? 161 SER D CA 1 ATOM 9412 C C . SER F 2 167 ? 23.191 -8.917 13.013 1.00 37.68 ? 161 SER D C 1 ATOM 9413 O O . SER F 2 167 ? 21.983 -8.833 12.785 1.00 38.87 ? 161 SER D O 1 ATOM 9414 C CB . SER F 2 167 ? 24.323 -6.694 12.744 1.00 43.53 ? 161 SER D CB 1 ATOM 9415 O OG . SER F 2 167 ? 23.057 -6.070 12.837 1.00 59.45 ? 161 SER D OG 1 ATOM 9416 N N . GLY F 2 168 ? 23.699 -9.702 13.957 1.00 38.77 ? 162 GLY D N 1 ATOM 9417 C CA . GLY F 2 168 ? 22.851 -10.503 14.819 1.00 35.93 ? 162 GLY D CA 1 ATOM 9418 C C . GLY F 2 168 ? 22.382 -11.789 14.163 1.00 41.57 ? 162 GLY D C 1 ATOM 9419 O O . GLY F 2 168 ? 21.529 -12.492 14.705 1.00 42.95 ? 162 GLY D O 1 ATOM 9420 N N . VAL F 2 169 ? 22.942 -12.102 12.998 1.00 34.09 ? 163 VAL D N 1 ATOM 9421 C CA . VAL F 2 169 ? 22.538 -13.291 12.259 1.00 33.49 ? 163 VAL D CA 1 ATOM 9422 C C . VAL F 2 169 ? 23.429 -14.488 12.586 1.00 34.41 ? 163 VAL D C 1 ATOM 9423 O O . VAL F 2 169 ? 24.655 -14.396 12.529 1.00 35.46 ? 163 VAL D O 1 ATOM 9424 C CB . VAL F 2 169 ? 22.558 -13.041 10.737 1.00 30.54 ? 163 VAL D CB 1 ATOM 9425 C CG1 . VAL F 2 169 ? 22.208 -14.317 9.974 1.00 27.03 ? 163 VAL D CG1 1 ATOM 9426 C CG2 . VAL F 2 169 ? 21.593 -11.918 10.374 1.00 35.46 ? 163 VAL D CG2 1 ATOM 9427 N N . HIS F 2 170 ? 22.798 -15.603 12.943 1.00 33.87 ? 164 HIS D N 1 ATOM 9428 C CA . HIS F 2 170 ? 23.495 -16.874 13.129 1.00 34.57 ? 164 HIS D CA 1 ATOM 9429 C C . HIS F 2 170 ? 22.917 -17.932 12.204 1.00 32.95 ? 164 HIS D C 1 ATOM 9430 O O . HIS F 2 170 ? 21.806 -18.413 12.416 1.00 37.32 ? 164 HIS D O 1 ATOM 9431 C CB . HIS F 2 170 ? 23.402 -17.355 14.578 1.00 36.02 ? 164 HIS D CB 1 ATOM 9432 C CG . HIS F 2 170 ? 24.201 -16.536 15.542 1.00 52.84 ? 164 HIS D CG 1 ATOM 9433 N ND1 . HIS F 2 170 ? 23.622 -15.647 16.422 1.00 56.52 ? 164 HIS D ND1 1 ATOM 9434 C CD2 . HIS F 2 170 ? 25.535 -16.471 15.765 1.00 57.43 ? 164 HIS D CD2 1 ATOM 9435 C CE1 . HIS F 2 170 ? 24.563 -15.071 17.146 1.00 57.32 ? 164 HIS D CE1 1 ATOM 9436 N NE2 . HIS F 2 170 ? 25.734 -15.553 16.767 1.00 62.76 ? 164 HIS D NE2 1 ATOM 9437 N N . THR F 2 171 ? 23.665 -18.282 11.167 1.00 30.74 ? 165 THR D N 1 ATOM 9438 C CA . THR F 2 171 ? 23.274 -19.386 10.308 1.00 34.76 ? 165 THR D CA 1 ATOM 9439 C C . THR F 2 171 ? 24.052 -20.631 10.717 1.00 37.09 ? 165 THR D C 1 ATOM 9440 O O . THR F 2 171 ? 25.269 -20.706 10.541 1.00 40.97 ? 165 THR D O 1 ATOM 9441 C CB . THR F 2 171 ? 23.510 -19.070 8.826 1.00 31.66 ? 165 THR D CB 1 ATOM 9442 O OG1 . THR F 2 171 ? 22.798 -17.875 8.476 1.00 33.29 ? 165 THR D OG1 1 ATOM 9443 C CG2 . THR F 2 171 ? 23.019 -20.222 7.956 1.00 30.07 ? 165 THR D CG2 1 ATOM 9444 N N . PHE F 2 172 ? 23.338 -21.600 11.277 1.00 35.35 ? 166 PHE D N 1 ATOM 9445 C CA . PHE F 2 172 ? 23.960 -22.796 11.837 1.00 34.60 ? 166 PHE D CA 1 ATOM 9446 C C . PHE F 2 172 ? 24.480 -23.732 10.754 1.00 38.90 ? 166 PHE D C 1 ATOM 9447 O O . PHE F 2 172 ? 23.931 -23.778 9.656 1.00 38.40 ? 166 PHE D O 1 ATOM 9448 C CB . PHE F 2 172 ? 22.965 -23.528 12.743 1.00 32.22 ? 166 PHE D CB 1 ATOM 9449 C CG . PHE F 2 172 ? 22.644 -22.778 14.003 1.00 39.05 ? 166 PHE D CG 1 ATOM 9450 C CD1 . PHE F 2 172 ? 23.409 -22.964 15.148 1.00 39.94 ? 166 PHE D CD1 1 ATOM 9451 C CD2 . PHE F 2 172 ? 21.597 -21.866 14.038 1.00 37.04 ? 166 PHE D CD2 1 ATOM 9452 C CE1 . PHE F 2 172 ? 23.130 -22.267 16.309 1.00 41.22 ? 166 PHE D CE1 1 ATOM 9453 C CE2 . PHE F 2 172 ? 21.309 -21.161 15.197 1.00 39.48 ? 166 PHE D CE2 1 ATOM 9454 C CZ . PHE F 2 172 ? 22.077 -21.362 16.336 1.00 44.02 ? 166 PHE D CZ 1 ATOM 9455 N N . PRO F 2 173 ? 25.560 -24.471 11.058 1.00 38.24 ? 167 PRO D N 1 ATOM 9456 C CA . PRO F 2 173 ? 26.077 -25.478 10.126 1.00 39.98 ? 167 PRO D CA 1 ATOM 9457 C C . PRO F 2 173 ? 25.011 -26.521 9.813 1.00 37.31 ? 167 PRO D C 1 ATOM 9458 O O . PRO F 2 173 ? 24.207 -26.852 10.683 1.00 37.60 ? 167 PRO D O 1 ATOM 9459 C CB . PRO F 2 173 ? 27.249 -26.099 10.891 1.00 35.76 ? 167 PRO D CB 1 ATOM 9460 C CG . PRO F 2 173 ? 27.663 -25.046 11.861 1.00 38.58 ? 167 PRO D CG 1 ATOM 9461 C CD . PRO F 2 173 ? 26.396 -24.358 12.266 1.00 37.66 ? 167 PRO D CD 1 ATOM 9462 N N . ALA F 2 174 ? 24.996 -27.015 8.583 1.00 37.72 ? 168 ALA D N 1 ATOM 9463 C CA . ALA F 2 174 ? 24.011 -28.007 8.186 1.00 35.95 ? 168 ALA D CA 1 ATOM 9464 C C . ALA F 2 174 ? 24.197 -29.295 8.974 1.00 40.05 ? 168 ALA D C 1 ATOM 9465 O O . ALA F 2 174 ? 25.308 -29.638 9.380 1.00 40.11 ? 168 ALA D O 1 ATOM 9466 C CB . ALA F 2 174 ? 24.103 -28.280 6.701 1.00 30.88 ? 168 ALA D CB 1 ATOM 9467 N N . VAL F 2 175 ? 23.095 -29.999 9.193 1.00 38.54 ? 169 VAL D N 1 ATOM 9468 C CA . VAL F 2 175 ? 23.127 -31.284 9.869 1.00 36.46 ? 169 VAL D CA 1 ATOM 9469 C C . VAL F 2 175 ? 22.642 -32.368 8.919 1.00 39.12 ? 169 VAL D C 1 ATOM 9470 O O . VAL F 2 175 ? 21.602 -32.218 8.278 1.00 41.12 ? 169 VAL D O 1 ATOM 9471 C CB . VAL F 2 175 ? 22.253 -31.279 11.143 1.00 36.19 ? 169 VAL D CB 1 ATOM 9472 C CG1 . VAL F 2 175 ? 21.940 -32.693 11.589 1.00 40.28 ? 169 VAL D CG1 1 ATOM 9473 C CG2 . VAL F 2 175 ? 22.932 -30.492 12.259 1.00 34.26 ? 169 VAL D CG2 1 ATOM 9474 N N . LEU F 2 176 ? 23.406 -33.450 8.814 1.00 39.56 ? 170 LEU D N 1 ATOM 9475 C CA . LEU F 2 176 ? 22.964 -34.613 8.054 1.00 38.57 ? 170 LEU D CA 1 ATOM 9476 C C . LEU F 2 176 ? 21.878 -35.346 8.833 1.00 36.82 ? 170 LEU D C 1 ATOM 9477 O O . LEU F 2 176 ? 22.073 -35.704 9.993 1.00 40.53 ? 170 LEU D O 1 ATOM 9478 C CB . LEU F 2 176 ? 24.137 -35.553 7.757 1.00 38.01 ? 170 LEU D CB 1 ATOM 9479 C CG . LEU F 2 176 ? 23.815 -36.740 6.845 1.00 39.85 ? 170 LEU D CG 1 ATOM 9480 C CD1 . LEU F 2 176 ? 23.398 -36.249 5.463 1.00 42.43 ? 170 LEU D CD1 1 ATOM 9481 C CD2 . LEU F 2 176 ? 24.992 -37.704 6.746 1.00 35.48 ? 170 LEU D CD2 1 ATOM 9482 N N . GLN F 2 177 ? 20.730 -35.557 8.201 1.00 37.10 ? 171 GLN D N 1 ATOM 9483 C CA . GLN F 2 177 ? 19.626 -36.262 8.848 1.00 38.74 ? 171 GLN D CA 1 ATOM 9484 C C . GLN F 2 177 ? 19.687 -37.759 8.530 1.00 42.42 ? 171 GLN D C 1 ATOM 9485 O O . GLN F 2 177 ? 20.523 -38.191 7.735 1.00 32.46 ? 171 GLN D O 1 ATOM 9486 C CB . GLN F 2 177 ? 18.282 -35.665 8.411 1.00 38.41 ? 171 GLN D CB 1 ATOM 9487 C CG . GLN F 2 177 ? 18.078 -34.206 8.850 1.00 45.70 ? 171 GLN D CG 1 ATOM 9488 C CD . GLN F 2 177 ? 16.875 -33.547 8.190 1.00 60.14 ? 171 GLN D CD 1 ATOM 9489 O OE1 . GLN F 2 177 ? 15.992 -33.009 8.864 1.00 66.72 ? 171 GLN D OE1 1 ATOM 9490 N NE2 . GLN F 2 177 ? 16.843 -33.575 6.865 1.00 66.32 ? 171 GLN D NE2 1 ATOM 9491 N N . SER F 2 178 ? 18.807 -38.543 9.152 1.00 47.39 ? 172 SER D N 1 ATOM 9492 C CA . SER F 2 178 ? 18.750 -39.987 8.910 1.00 50.85 ? 172 SER D CA 1 ATOM 9493 C C . SER F 2 178 ? 18.427 -40.286 7.449 1.00 48.67 ? 172 SER D C 1 ATOM 9494 O O . SER F 2 178 ? 18.901 -41.271 6.883 1.00 47.30 ? 172 SER D O 1 ATOM 9495 C CB . SER F 2 178 ? 17.705 -40.649 9.811 1.00 54.90 ? 172 SER D CB 1 ATOM 9496 O OG . SER F 2 178 ? 17.801 -40.175 11.142 1.00 61.57 ? 172 SER D OG 1 ATOM 9497 N N . SER F 2 179 ? 17.621 -39.414 6.851 1.00 45.04 ? 173 SER D N 1 ATOM 9498 C CA . SER F 2 179 ? 17.182 -39.563 5.470 1.00 44.99 ? 173 SER D CA 1 ATOM 9499 C C . SER F 2 179 ? 18.314 -39.394 4.463 1.00 42.86 ? 173 SER D C 1 ATOM 9500 O O . SER F 2 179 ? 18.215 -39.855 3.328 1.00 48.52 ? 173 SER D O 1 ATOM 9501 C CB . SER F 2 179 ? 16.083 -38.547 5.167 1.00 46.37 ? 173 SER D CB 1 ATOM 9502 O OG . SER F 2 179 ? 16.559 -37.222 5.357 1.00 44.81 ? 173 SER D OG 1 ATOM 9503 N N . GLY F 2 180 ? 19.382 -38.721 4.875 1.00 37.77 ? 174 GLY D N 1 ATOM 9504 C CA . GLY F 2 180 ? 20.481 -38.428 3.974 1.00 38.33 ? 174 GLY D CA 1 ATOM 9505 C C . GLY F 2 180 ? 20.411 -37.016 3.430 1.00 35.77 ? 174 GLY D C 1 ATOM 9506 O O . GLY F 2 180 ? 21.325 -36.561 2.740 1.00 36.06 ? 174 GLY D O 1 ATOM 9507 N N . LEU F 2 181 ? 19.318 -36.327 3.737 1.00 29.97 ? 175 LEU D N 1 ATOM 9508 C CA . LEU F 2 181 ? 19.167 -34.926 3.352 1.00 31.91 ? 175 LEU D CA 1 ATOM 9509 C C . LEU F 2 181 ? 19.707 -34.021 4.448 1.00 34.58 ? 175 LEU D C 1 ATOM 9510 O O . LEU F 2 181 ? 19.810 -34.430 5.606 1.00 38.62 ? 175 LEU D O 1 ATOM 9511 C CB . LEU F 2 181 ? 17.700 -34.597 3.067 1.00 29.86 ? 175 LEU D CB 1 ATOM 9512 C CG . LEU F 2 181 ? 16.981 -35.552 2.112 1.00 31.40 ? 175 LEU D CG 1 ATOM 9513 C CD1 . LEU F 2 181 ? 15.523 -35.157 1.971 1.00 29.19 ? 175 LEU D CD1 1 ATOM 9514 C CD2 . LEU F 2 181 ? 17.673 -35.577 0.757 1.00 28.77 ? 175 LEU D CD2 1 ATOM 9515 N N . TYR F 2 182 ? 20.046 -32.789 4.086 1.00 31.53 ? 176 TYR D N 1 ATOM 9516 C CA . TYR F 2 182 ? 20.579 -31.848 5.057 1.00 27.79 ? 176 TYR D CA 1 ATOM 9517 C C . TYR F 2 182 ? 19.511 -30.891 5.563 1.00 32.97 ? 176 TYR D C 1 ATOM 9518 O O . TYR F 2 182 ? 18.478 -30.697 4.929 1.00 27.18 ? 176 TYR D O 1 ATOM 9519 C CB . TYR F 2 182 ? 21.745 -31.066 4.453 1.00 29.15 ? 176 TYR D CB 1 ATOM 9520 C CG . TYR F 2 182 ? 22.972 -31.919 4.228 1.00 29.81 ? 176 TYR D CG 1 ATOM 9521 C CD1 . TYR F 2 182 ? 23.161 -32.602 3.030 1.00 30.69 ? 176 TYR D CD1 1 ATOM 9522 C CD2 . TYR F 2 182 ? 23.928 -32.061 5.223 1.00 29.52 ? 176 TYR D CD2 1 ATOM 9523 C CE1 . TYR F 2 182 ? 24.279 -33.393 2.826 1.00 35.90 ? 176 TYR D CE1 1 ATOM 9524 C CE2 . TYR F 2 182 ? 25.050 -32.849 5.030 1.00 36.32 ? 176 TYR D CE2 1 ATOM 9525 C CZ . TYR F 2 182 ? 25.220 -33.511 3.830 1.00 34.35 ? 176 TYR D CZ 1 ATOM 9526 O OH . TYR F 2 182 ? 26.334 -34.290 3.638 1.00 38.77 ? 176 TYR D OH 1 ATOM 9527 N N . SER F 2 183 ? 19.773 -30.305 6.722 1.00 35.07 ? 177 SER D N 1 ATOM 9528 C CA . SER F 2 183 ? 18.863 -29.343 7.319 1.00 39.22 ? 177 SER D CA 1 ATOM 9529 C C . SER F 2 183 ? 19.653 -28.335 8.149 1.00 33.31 ? 177 SER D C 1 ATOM 9530 O O . SER F 2 183 ? 20.667 -28.684 8.749 1.00 29.52 ? 177 SER D O 1 ATOM 9531 C CB . SER F 2 183 ? 17.821 -30.056 8.183 1.00 44.30 ? 177 SER D CB 1 ATOM 9532 O OG . SER F 2 183 ? 17.012 -29.128 8.883 1.00 54.27 ? 177 SER D OG 1 ATOM 9533 N N . LEU F 2 184 ? 19.198 -27.086 8.164 1.00 31.43 ? 178 LEU D N 1 ATOM 9534 C CA . LEU F 2 184 ? 19.798 -26.070 9.022 1.00 32.82 ? 178 LEU D CA 1 ATOM 9535 C C . LEU F 2 184 ? 18.805 -24.954 9.320 1.00 35.97 ? 178 LEU D C 1 ATOM 9536 O O . LEU F 2 184 ? 17.728 -24.877 8.723 1.00 40.35 ? 178 LEU D O 1 ATOM 9537 C CB . LEU F 2 184 ? 21.076 -25.487 8.393 1.00 35.86 ? 178 LEU D CB 1 ATOM 9538 C CG . LEU F 2 184 ? 21.008 -24.438 7.277 1.00 42.75 ? 178 LEU D CG 1 ATOM 9539 C CD1 . LEU F 2 184 ? 22.405 -23.982 6.892 1.00 43.03 ? 178 LEU D CD1 1 ATOM 9540 C CD2 . LEU F 2 184 ? 20.298 -24.975 6.061 1.00 51.18 ? 178 LEU D CD2 1 ATOM 9541 N N . SER F 2 185 ? 19.172 -24.105 10.269 1.00 29.84 ? 179 SER D N 1 ATOM 9542 C CA . SER F 2 185 ? 18.376 -22.941 10.608 1.00 36.79 ? 179 SER D CA 1 ATOM 9543 C C . SER F 2 185 ? 19.243 -21.697 10.576 1.00 40.40 ? 179 SER D C 1 ATOM 9544 O O . SER F 2 185 ? 20.442 -21.747 10.865 1.00 39.14 ? 179 SER D O 1 ATOM 9545 C CB . SER F 2 185 ? 17.734 -23.093 11.988 1.00 44.48 ? 179 SER D CB 1 ATOM 9546 O OG . SER F 2 185 ? 16.589 -23.925 11.938 1.00 50.98 ? 179 SER D OG 1 ATOM 9547 N N . SER F 2 186 ? 18.627 -20.584 10.205 1.00 34.30 ? 180 SER D N 1 ATOM 9548 C CA . SER F 2 186 ? 19.270 -19.286 10.293 1.00 37.93 ? 180 SER D CA 1 ATOM 9549 C C . SER F 2 186 ? 18.422 -18.432 11.223 1.00 39.51 ? 180 SER D C 1 ATOM 9550 O O . SER F 2 186 ? 17.207 -18.375 11.070 1.00 39.27 ? 180 SER D O 1 ATOM 9551 C CB . SER F 2 186 ? 19.404 -18.640 8.910 1.00 32.83 ? 180 SER D CB 1 ATOM 9552 O OG . SER F 2 186 ? 20.097 -17.406 8.982 1.00 30.03 ? 180 SER D OG 1 ATOM 9553 N N . VAL F 2 187 ? 19.052 -17.797 12.203 1.00 37.66 ? 181 VAL D N 1 ATOM 9554 C CA . VAL F 2 187 ? 18.314 -17.002 13.174 1.00 31.52 ? 181 VAL D CA 1 ATOM 9555 C C . VAL F 2 187 ? 18.906 -15.609 13.304 1.00 34.90 ? 181 VAL D C 1 ATOM 9556 O O . VAL F 2 187 ? 20.102 -15.403 13.087 1.00 36.87 ? 181 VAL D O 1 ATOM 9557 C CB . VAL F 2 187 ? 18.299 -17.667 14.564 1.00 36.80 ? 181 VAL D CB 1 ATOM 9558 C CG1 . VAL F 2 187 ? 17.593 -19.022 14.505 1.00 31.40 ? 181 VAL D CG1 1 ATOM 9559 C CG2 . VAL F 2 187 ? 19.719 -17.812 15.104 1.00 39.76 ? 181 VAL D CG2 1 ATOM 9560 N N . VAL F 2 188 ? 18.059 -14.649 13.654 1.00 31.42 ? 182 VAL D N 1 ATOM 9561 C CA . VAL F 2 188 ? 18.519 -13.290 13.863 1.00 30.58 ? 182 VAL D CA 1 ATOM 9562 C C . VAL F 2 188 ? 17.768 -12.673 15.042 1.00 40.78 ? 182 VAL D C 1 ATOM 9563 O O . VAL F 2 188 ? 16.594 -12.966 15.270 1.00 42.82 ? 182 VAL D O 1 ATOM 9564 C CB . VAL F 2 188 ? 18.347 -12.437 12.576 1.00 34.95 ? 182 VAL D CB 1 ATOM 9565 C CG1 . VAL F 2 188 ? 16.930 -12.542 12.033 1.00 34.48 ? 182 VAL D CG1 1 ATOM 9566 C CG2 . VAL F 2 188 ? 18.748 -10.975 12.817 1.00 35.86 ? 182 VAL D CG2 1 ATOM 9567 N N . THR F 2 189 ? 18.469 -11.849 15.814 1.00 45.92 ? 183 THR D N 1 ATOM 9568 C CA . THR F 2 189 ? 17.858 -11.129 16.919 1.00 49.03 ? 183 THR D CA 1 ATOM 9569 C C . THR F 2 189 ? 17.593 -9.686 16.502 1.00 48.47 ? 183 THR D C 1 ATOM 9570 O O . THR F 2 189 ? 18.450 -9.038 15.900 1.00 49.71 ? 183 THR D O 1 ATOM 9571 C CB . THR F 2 189 ? 18.746 -11.158 18.178 1.00 55.29 ? 183 THR D CB 1 ATOM 9572 O OG1 . THR F 2 189 ? 20.071 -10.727 17.840 1.00 60.89 ? 183 THR D OG1 1 ATOM 9573 C CG2 . THR F 2 189 ? 18.807 -12.567 18.757 1.00 50.88 ? 183 THR D CG2 1 ATOM 9574 N N . VAL F 2 190 ? 16.397 -9.196 16.813 1.00 42.37 ? 184 VAL D N 1 ATOM 9575 C CA . VAL F 2 190 ? 15.974 -7.861 16.406 1.00 39.95 ? 184 VAL D CA 1 ATOM 9576 C C . VAL F 2 190 ? 15.278 -7.154 17.571 1.00 45.23 ? 184 VAL D C 1 ATOM 9577 O O . VAL F 2 190 ? 14.925 -7.796 18.561 1.00 48.37 ? 184 VAL D O 1 ATOM 9578 C CB . VAL F 2 190 ? 15.026 -7.930 15.186 1.00 33.13 ? 184 VAL D CB 1 ATOM 9579 C CG1 . VAL F 2 190 ? 15.770 -8.426 13.959 1.00 33.70 ? 184 VAL D CG1 1 ATOM 9580 C CG2 . VAL F 2 190 ? 13.838 -8.827 15.491 1.00 39.87 ? 184 VAL D CG2 1 ATOM 9581 N N . PRO F 2 191 ? 15.096 -5.825 17.474 1.00 47.20 ? 185 PRO D N 1 ATOM 9582 C CA . PRO F 2 191 ? 14.297 -5.146 18.501 1.00 48.45 ? 185 PRO D CA 1 ATOM 9583 C C . PRO F 2 191 ? 12.830 -5.569 18.464 1.00 51.59 ? 185 PRO D C 1 ATOM 9584 O O . PRO F 2 191 ? 12.235 -5.603 17.385 1.00 49.02 ? 185 PRO D O 1 ATOM 9585 C CB . PRO F 2 191 ? 14.443 -3.664 18.139 1.00 48.74 ? 185 PRO D CB 1 ATOM 9586 C CG . PRO F 2 191 ? 15.707 -3.584 17.359 1.00 44.60 ? 185 PRO D CG 1 ATOM 9587 C CD . PRO F 2 191 ? 15.782 -4.866 16.589 1.00 45.32 ? 185 PRO D CD 1 ATOM 9588 N N . SER F 2 192 ? 12.262 -5.881 19.627 1.00 54.79 ? 186 SER D N 1 ATOM 9589 C CA . SER F 2 192 ? 10.854 -6.265 19.729 1.00 56.24 ? 186 SER D CA 1 ATOM 9590 C C . SER F 2 192 ? 9.923 -5.209 19.139 1.00 56.90 ? 186 SER D C 1 ATOM 9591 O O . SER F 2 192 ? 8.867 -5.533 18.593 1.00 54.70 ? 186 SER D O 1 ATOM 9592 C CB . SER F 2 192 ? 10.475 -6.521 21.188 1.00 58.96 ? 186 SER D CB 1 ATOM 9593 O OG . SER F 2 192 ? 11.202 -7.611 21.720 1.00 62.16 ? 186 SER D OG 1 ATOM 9594 N N . SER F 2 193 ? 10.327 -3.947 19.250 1.00 55.47 ? 187 SER D N 1 ATOM 9595 C CA . SER F 2 193 ? 9.517 -2.822 18.799 1.00 54.25 ? 187 SER D CA 1 ATOM 9596 C C . SER F 2 193 ? 9.487 -2.696 17.276 1.00 55.40 ? 187 SER D C 1 ATOM 9597 O O . SER F 2 193 ? 8.693 -1.934 16.725 1.00 58.63 ? 187 SER D O 1 ATOM 9598 C CB . SER F 2 193 ? 10.038 -1.523 19.416 1.00 55.63 ? 187 SER D CB 1 ATOM 9599 O OG . SER F 2 193 ? 11.406 -1.325 19.097 1.00 55.51 ? 187 SER D OG 1 ATOM 9600 N N . SER F 2 194 ? 10.357 -3.441 16.601 1.00 54.38 ? 188 SER D N 1 ATOM 9601 C CA . SER F 2 194 ? 10.435 -3.387 15.145 1.00 51.64 ? 188 SER D CA 1 ATOM 9602 C C . SER F 2 194 ? 9.565 -4.463 14.496 1.00 48.02 ? 188 SER D C 1 ATOM 9603 O O . SER F 2 194 ? 9.353 -4.448 13.283 1.00 44.62 ? 188 SER D O 1 ATOM 9604 C CB . SER F 2 194 ? 11.883 -3.547 14.679 1.00 49.71 ? 188 SER D CB 1 ATOM 9605 O OG . SER F 2 194 ? 12.298 -4.899 14.797 1.00 48.51 ? 188 SER D OG 1 ATOM 9606 N N . LEU F 2 195 ? 9.064 -5.390 15.308 1.00 43.90 ? 189 LEU D N 1 ATOM 9607 C CA . LEU F 2 195 ? 8.297 -6.523 14.800 1.00 47.85 ? 189 LEU D CA 1 ATOM 9608 C C . LEU F 2 195 ? 6.990 -6.106 14.135 1.00 55.90 ? 189 LEU D C 1 ATOM 9609 O O . LEU F 2 195 ? 6.404 -6.876 13.376 1.00 60.13 ? 189 LEU D O 1 ATOM 9610 C CB . LEU F 2 195 ? 7.997 -7.514 15.926 1.00 47.15 ? 189 LEU D CB 1 ATOM 9611 C CG . LEU F 2 195 ? 9.183 -8.302 16.482 1.00 53.19 ? 189 LEU D CG 1 ATOM 9612 C CD1 . LEU F 2 195 ? 8.699 -9.386 17.436 1.00 52.88 ? 189 LEU D CD1 1 ATOM 9613 C CD2 . LEU F 2 195 ? 10.009 -8.899 15.352 1.00 52.84 ? 189 LEU D CD2 1 ATOM 9614 N N . GLY F 2 196 ? 6.532 -4.892 14.422 1.00 57.06 ? 190 GLY D N 1 ATOM 9615 C CA . GLY F 2 196 ? 5.283 -4.410 13.864 1.00 65.06 ? 190 GLY D CA 1 ATOM 9616 C C . GLY F 2 196 ? 5.484 -3.488 12.679 1.00 69.48 ? 190 GLY D C 1 ATOM 9617 O O . GLY F 2 196 ? 4.562 -3.249 11.898 1.00 71.19 ? 190 GLY D O 1 ATOM 9618 N N . THR F 2 197 ? 6.698 -2.971 12.539 1.00 68.74 ? 191 THR D N 1 ATOM 9619 C CA . THR F 2 197 ? 6.986 -2.000 11.495 1.00 69.40 ? 191 THR D CA 1 ATOM 9620 C C . THR F 2 197 ? 7.864 -2.597 10.394 1.00 63.26 ? 191 THR D C 1 ATOM 9621 O O . THR F 2 197 ? 7.597 -2.411 9.206 1.00 58.94 ? 191 THR D O 1 ATOM 9622 C CB . THR F 2 197 ? 7.672 -0.747 12.081 1.00 72.63 ? 191 THR D CB 1 ATOM 9623 O OG1 . THR F 2 197 ? 9.012 -1.066 12.475 1.00 74.77 ? 191 THR D OG1 1 ATOM 9624 C CG2 . THR F 2 197 ? 6.906 -0.245 13.295 1.00 77.69 ? 191 THR D CG2 1 ATOM 9625 N N . GLN F 2 198 ? 8.901 -3.324 10.798 1.00 56.62 ? 192 GLN D N 1 ATOM 9626 C CA . GLN F 2 198 ? 9.888 -3.857 9.863 1.00 50.83 ? 192 GLN D CA 1 ATOM 9627 C C . GLN F 2 198 ? 9.584 -5.295 9.457 1.00 50.61 ? 192 GLN D C 1 ATOM 9628 O O . GLN F 2 198 ? 9.375 -6.159 10.308 1.00 50.06 ? 192 GLN D O 1 ATOM 9629 C CB . GLN F 2 198 ? 11.287 -3.777 10.482 1.00 51.40 ? 192 GLN D CB 1 ATOM 9630 C CG . GLN F 2 198 ? 12.386 -4.383 9.627 1.00 52.64 ? 192 GLN D CG 1 ATOM 9631 C CD . GLN F 2 198 ? 12.715 -3.540 8.413 1.00 52.77 ? 192 GLN D CD 1 ATOM 9632 O OE1 . GLN F 2 198 ? 12.963 -2.339 8.523 1.00 56.47 ? 192 GLN D OE1 1 ATOM 9633 N NE2 . GLN F 2 198 ? 12.715 -4.167 7.243 1.00 48.06 ? 192 GLN D NE2 1 ATOM 9634 N N . THR F 2 199 ? 9.560 -5.555 8.154 1.00 48.45 ? 193 THR D N 1 ATOM 9635 C CA . THR F 2 199 ? 9.358 -6.918 7.681 1.00 47.64 ? 193 THR D CA 1 ATOM 9636 C C . THR F 2 199 ? 10.703 -7.630 7.566 1.00 40.68 ? 193 THR D C 1 ATOM 9637 O O . THR F 2 199 ? 11.721 -7.012 7.249 1.00 40.09 ? 193 THR D O 1 ATOM 9638 C CB . THR F 2 199 ? 8.625 -6.960 6.324 1.00 46.54 ? 193 THR D CB 1 ATOM 9639 O OG1 . THR F 2 199 ? 9.440 -6.355 5.313 1.00 55.81 ? 193 THR D OG1 1 ATOM 9640 C CG2 . THR F 2 199 ? 7.299 -6.224 6.411 1.00 39.95 ? 193 THR D CG2 1 ATOM 9641 N N . TYR F 2 200 ? 10.703 -8.928 7.850 1.00 33.57 ? 194 TYR D N 1 ATOM 9642 C CA . TYR F 2 200 ? 11.917 -9.726 7.763 1.00 30.75 ? 194 TYR D CA 1 ATOM 9643 C C . TYR F 2 200 ? 11.695 -10.894 6.820 1.00 33.04 ? 194 TYR D C 1 ATOM 9644 O O . TYR F 2 200 ? 10.725 -11.639 6.950 1.00 30.16 ? 194 TYR D O 1 ATOM 9645 C CB . TYR F 2 200 ? 12.346 -10.210 9.147 1.00 32.88 ? 194 TYR D CB 1 ATOM 9646 C CG . TYR F 2 200 ? 12.699 -9.074 10.076 1.00 37.98 ? 194 TYR D CG 1 ATOM 9647 C CD1 . TYR F 2 200 ? 13.934 -8.444 9.990 1.00 35.75 ? 194 TYR D CD1 1 ATOM 9648 C CD2 . TYR F 2 200 ? 11.791 -8.617 11.026 1.00 38.96 ? 194 TYR D CD2 1 ATOM 9649 C CE1 . TYR F 2 200 ? 14.262 -7.396 10.829 1.00 40.17 ? 194 TYR D CE1 1 ATOM 9650 C CE2 . TYR F 2 200 ? 12.109 -7.571 11.874 1.00 39.98 ? 194 TYR D CE2 1 ATOM 9651 C CZ . TYR F 2 200 ? 13.347 -6.963 11.771 1.00 44.13 ? 194 TYR D CZ 1 ATOM 9652 O OH . TYR F 2 200 ? 13.671 -5.917 12.608 1.00 43.98 ? 194 TYR D OH 1 ATOM 9653 N N . ILE F 2 201 ? 12.584 -11.026 5.846 1.00 31.37 ? 195 ILE D N 1 ATOM 9654 C CA . ILE F 2 201 ? 12.461 -12.058 4.831 1.00 30.13 ? 195 ILE D CA 1 ATOM 9655 C C . ILE F 2 201 ? 13.779 -12.805 4.729 1.00 30.59 ? 195 ILE D C 1 ATOM 9656 O O . ILE F 2 201 ? 14.824 -12.190 4.520 1.00 29.89 ? 195 ILE D O 1 ATOM 9657 C CB . ILE F 2 201 ? 12.088 -11.457 3.462 1.00 30.35 ? 195 ILE D CB 1 ATOM 9658 C CG1 . ILE F 2 201 ? 10.771 -10.679 3.558 1.00 35.34 ? 195 ILE D CG1 1 ATOM 9659 C CG2 . ILE F 2 201 ? 11.995 -12.543 2.405 1.00 32.30 ? 195 ILE D CG2 1 ATOM 9660 C CD1 . ILE F 2 201 ? 10.500 -9.770 2.364 1.00 30.19 ? 195 ILE D CD1 1 ATOM 9661 N N . CYS F 2 202 ? 13.756 -14.121 4.899 1.00 30.62 ? 196 CYS D N 1 ATOM 9662 C CA . CYS F 2 202 ? 14.988 -14.876 4.706 1.00 35.89 ? 196 CYS D CA 1 ATOM 9663 C C . CYS F 2 202 ? 15.086 -15.278 3.238 1.00 32.85 ? 196 CYS D C 1 ATOM 9664 O O . CYS F 2 202 ? 14.100 -15.693 2.624 1.00 29.96 ? 196 CYS D O 1 ATOM 9665 C CB . CYS F 2 202 ? 15.061 -16.098 5.630 1.00 37.11 ? 196 CYS D CB 1 ATOM 9666 S SG . CYS F 2 202 ? 14.069 -17.515 5.146 1.00 61.24 ? 196 CYS D SG 1 ATOM 9667 N N . ASN F 2 203 ? 16.276 -15.110 2.672 1.00 27.52 ? 197 ASN D N 1 ATOM 9668 C CA . ASN F 2 203 ? 16.515 -15.449 1.278 1.00 31.10 ? 197 ASN D CA 1 ATOM 9669 C C . ASN F 2 203 ? 17.377 -16.694 1.183 1.00 29.53 ? 197 ASN D C 1 ATOM 9670 O O . ASN F 2 203 ? 18.527 -16.700 1.637 1.00 33.83 ? 197 ASN D O 1 ATOM 9671 C CB . ASN F 2 203 ? 17.182 -14.288 0.547 1.00 32.71 ? 197 ASN D CB 1 ATOM 9672 C CG . ASN F 2 203 ? 16.646 -12.952 0.980 1.00 27.59 ? 197 ASN D CG 1 ATOM 9673 O OD1 . ASN F 2 203 ? 17.273 -12.249 1.767 1.00 32.35 ? 197 ASN D OD1 1 ATOM 9674 N ND2 . ASN F 2 203 ? 15.472 -12.594 0.478 1.00 28.39 ? 197 ASN D ND2 1 ATOM 9675 N N . VAL F 2 204 ? 16.817 -17.748 0.598 1.00 24.87 ? 198 VAL D N 1 ATOM 9676 C CA . VAL F 2 204 ? 17.489 -19.038 0.549 1.00 25.84 ? 198 VAL D CA 1 ATOM 9677 C C . VAL F 2 204 ? 17.824 -19.437 -0.881 1.00 27.31 ? 198 VAL D C 1 ATOM 9678 O O . VAL F 2 204 ? 16.949 -19.492 -1.746 1.00 22.23 ? 198 VAL D O 1 ATOM 9679 C CB . VAL F 2 204 ? 16.631 -20.133 1.195 1.00 30.26 ? 198 VAL D CB 1 ATOM 9680 C CG1 . VAL F 2 204 ? 17.350 -21.477 1.124 1.00 27.33 ? 198 VAL D CG1 1 ATOM 9681 C CG2 . VAL F 2 204 ? 16.313 -19.759 2.637 1.00 27.89 ? 198 VAL D CG2 1 ATOM 9682 N N . ASN F 2 205 ? 19.103 -19.699 -1.121 1.00 25.92 ? 199 ASN D N 1 ATOM 9683 C CA . ASN F 2 205 ? 19.573 -20.102 -2.437 1.00 22.56 ? 199 ASN D CA 1 ATOM 9684 C C . ASN F 2 205 ? 20.211 -21.477 -2.392 1.00 24.49 ? 199 ASN D C 1 ATOM 9685 O O . ASN F 2 205 ? 21.204 -21.686 -1.694 1.00 33.82 ? 199 ASN D O 1 ATOM 9686 C CB . ASN F 2 205 ? 20.579 -19.090 -2.984 1.00 20.77 ? 199 ASN D CB 1 ATOM 9687 C CG . ASN F 2 205 ? 20.909 -19.331 -4.449 1.00 30.99 ? 199 ASN D CG 1 ATOM 9688 O OD1 . ASN F 2 205 ? 20.326 -20.206 -5.093 1.00 33.95 ? 199 ASN D OD1 1 ATOM 9689 N ND2 . ASN F 2 205 ? 21.835 -18.542 -4.985 1.00 30.43 ? 199 ASN D ND2 1 ATOM 9690 N N . HIS F 2 206 ? 19.635 -22.418 -3.126 1.00 27.69 ? 200 HIS D N 1 ATOM 9691 C CA . HIS F 2 206 ? 20.239 -23.737 -3.260 1.00 28.21 ? 200 HIS D CA 1 ATOM 9692 C C . HIS F 2 206 ? 20.536 -23.956 -4.731 1.00 26.29 ? 200 HIS D C 1 ATOM 9693 O O . HIS F 2 206 ? 19.669 -24.387 -5.495 1.00 24.70 ? 200 HIS D O 1 ATOM 9694 C CB . HIS F 2 206 ? 19.321 -24.822 -2.705 1.00 22.68 ? 200 HIS D CB 1 ATOM 9695 C CG . HIS F 2 206 ? 19.903 -26.196 -2.772 1.00 25.20 ? 200 HIS D CG 1 ATOM 9696 N ND1 . HIS F 2 206 ? 19.388 -27.184 -3.588 1.00 21.73 ? 200 HIS D ND1 1 ATOM 9697 C CD2 . HIS F 2 206 ? 20.952 -26.759 -2.126 1.00 23.32 ? 200 HIS D CD2 1 ATOM 9698 C CE1 . HIS F 2 206 ? 20.092 -28.288 -3.440 1.00 19.15 ? 200 HIS D CE1 1 ATOM 9699 N NE2 . HIS F 2 206 ? 21.050 -28.058 -2.555 1.00 23.69 ? 200 HIS D NE2 1 ATOM 9700 N N . LYS F 2 207 ? 21.761 -23.623 -5.125 1.00 21.56 ? 201 LYS D N 1 ATOM 9701 C CA . LYS F 2 207 ? 22.154 -23.649 -6.532 1.00 28.73 ? 201 LYS D CA 1 ATOM 9702 C C . LYS F 2 207 ? 22.050 -25.022 -7.218 1.00 30.75 ? 201 LYS D C 1 ATOM 9703 O O . LYS F 2 207 ? 21.605 -25.081 -8.365 1.00 35.89 ? 201 LYS D O 1 ATOM 9704 C CB . LYS F 2 207 ? 23.574 -23.089 -6.680 1.00 30.02 ? 201 LYS D CB 1 ATOM 9705 C CG . LYS F 2 207 ? 23.669 -21.613 -6.304 1.00 37.34 ? 201 LYS D CG 1 ATOM 9706 C CD . LYS F 2 207 ? 25.111 -21.119 -6.224 1.00 55.12 ? 201 LYS D CD 1 ATOM 9707 C CE . LYS F 2 207 ? 25.688 -20.818 -7.602 1.00 69.10 ? 201 LYS D CE 1 ATOM 9708 N NZ . LYS F 2 207 ? 25.012 -19.661 -8.267 1.00 72.34 ? 201 LYS D NZ 1 ATOM 9709 N N . PRO F 2 208 ? 22.445 -26.125 -6.538 1.00 34.81 ? 202 PRO D N 1 ATOM 9710 C CA . PRO F 2 208 ? 22.319 -27.441 -7.189 1.00 30.55 ? 202 PRO D CA 1 ATOM 9711 C C . PRO F 2 208 ? 20.931 -27.751 -7.749 1.00 31.88 ? 202 PRO D C 1 ATOM 9712 O O . PRO F 2 208 ? 20.825 -28.374 -8.805 1.00 33.63 ? 202 PRO D O 1 ATOM 9713 C CB . PRO F 2 208 ? 22.656 -28.415 -6.061 1.00 27.62 ? 202 PRO D CB 1 ATOM 9714 C CG . PRO F 2 208 ? 23.611 -27.673 -5.219 1.00 29.75 ? 202 PRO D CG 1 ATOM 9715 C CD . PRO F 2 208 ? 23.148 -26.239 -5.244 1.00 29.20 ? 202 PRO D CD 1 ATOM 9716 N N . SER F 2 209 ? 19.888 -27.321 -7.051 1.00 27.16 ? 203 SER D N 1 ATOM 9717 C CA . SER F 2 209 ? 18.527 -27.581 -7.497 1.00 33.61 ? 203 SER D CA 1 ATOM 9718 C C . SER F 2 209 ? 17.886 -26.341 -8.120 1.00 39.18 ? 203 SER D C 1 ATOM 9719 O O . SER F 2 209 ? 16.713 -26.370 -8.488 1.00 42.00 ? 203 SER D O 1 ATOM 9720 C CB . SER F 2 209 ? 17.671 -28.079 -6.329 1.00 34.58 ? 203 SER D CB 1 ATOM 9721 O OG . SER F 2 209 ? 17.592 -27.101 -5.304 1.00 36.34 ? 203 SER D OG 1 ATOM 9722 N N . ASN F 2 210 ? 18.664 -25.265 -8.236 1.00 44.32 ? 204 ASN D N 1 ATOM 9723 C CA . ASN F 2 210 ? 18.165 -23.972 -8.715 1.00 40.43 ? 204 ASN D CA 1 ATOM 9724 C C . ASN F 2 210 ? 16.964 -23.482 -7.914 1.00 36.21 ? 204 ASN D C 1 ATOM 9725 O O . ASN F 2 210 ? 15.985 -23.000 -8.475 1.00 32.79 ? 204 ASN D O 1 ATOM 9726 C CB . ASN F 2 210 ? 17.801 -24.042 -10.199 1.00 38.15 ? 204 ASN D CB 1 ATOM 9727 C CG . ASN F 2 210 ? 18.953 -23.655 -11.098 1.00 51.68 ? 204 ASN D CG 1 ATOM 9728 O OD1 . ASN F 2 210 ? 19.684 -24.514 -11.595 1.00 53.34 ? 204 ASN D OD1 1 ATOM 9729 N ND2 . ASN F 2 210 ? 19.127 -22.352 -11.310 1.00 57.04 ? 204 ASN D ND2 1 ATOM 9730 N N . THR F 2 211 ? 17.047 -23.616 -6.597 1.00 36.52 ? 205 THR D N 1 ATOM 9731 C CA . THR F 2 211 ? 15.973 -23.192 -5.717 1.00 33.74 ? 205 THR D CA 1 ATOM 9732 C C . THR F 2 211 ? 16.263 -21.819 -5.128 1.00 42.09 ? 205 THR D C 1 ATOM 9733 O O . THR F 2 211 ? 17.242 -21.638 -4.403 1.00 46.73 ? 205 THR D O 1 ATOM 9734 C CB . THR F 2 211 ? 15.759 -24.200 -4.573 1.00 36.18 ? 205 THR D CB 1 ATOM 9735 O OG1 . THR F 2 211 ? 15.373 -25.467 -5.116 1.00 43.90 ? 205 THR D OG1 1 ATOM 9736 C CG2 . THR F 2 211 ? 14.677 -23.718 -3.628 1.00 37.21 ? 205 THR D CG2 1 ATOM 9737 N N . LYS F 2 212 ? 15.408 -20.854 -5.452 1.00 43.76 ? 206 LYS D N 1 ATOM 9738 C CA . LYS F 2 212 ? 15.497 -19.518 -4.876 1.00 41.79 ? 206 LYS D CA 1 ATOM 9739 C C . LYS F 2 212 ? 14.195 -19.163 -4.174 1.00 44.62 ? 206 LYS D C 1 ATOM 9740 O O . LYS F 2 212 ? 13.186 -18.881 -4.819 1.00 48.59 ? 206 LYS D O 1 ATOM 9741 C CB . LYS F 2 212 ? 15.823 -18.483 -5.950 1.00 38.11 ? 206 LYS D CB 1 ATOM 9742 C CG . LYS F 2 212 ? 17.271 -18.500 -6.379 1.00 34.45 ? 206 LYS D CG 1 ATOM 9743 C CD . LYS F 2 212 ? 17.515 -17.569 -7.548 1.00 31.90 ? 206 LYS D CD 1 ATOM 9744 C CE . LYS F 2 212 ? 18.980 -17.605 -7.944 1.00 30.79 ? 206 LYS D CE 1 ATOM 9745 N NZ . LYS F 2 212 ? 19.207 -16.986 -9.274 1.00 43.74 ? 206 LYS D NZ 1 ATOM 9746 N N . VAL F 2 213 ? 14.228 -19.183 -2.847 1.00 39.72 ? 207 VAL D N 1 ATOM 9747 C CA . VAL F 2 213 ? 13.030 -18.975 -2.048 1.00 39.83 ? 207 VAL D CA 1 ATOM 9748 C C . VAL F 2 213 ? 13.172 -17.780 -1.114 1.00 40.64 ? 207 VAL D C 1 ATOM 9749 O O . VAL F 2 213 ? 14.186 -17.629 -0.429 1.00 40.53 ? 207 VAL D O 1 ATOM 9750 C CB . VAL F 2 213 ? 12.697 -20.231 -1.213 1.00 39.28 ? 207 VAL D CB 1 ATOM 9751 C CG1 . VAL F 2 213 ? 11.554 -19.955 -0.247 1.00 42.52 ? 207 VAL D CG1 1 ATOM 9752 C CG2 . VAL F 2 213 ? 12.363 -21.395 -2.124 1.00 36.55 ? 207 VAL D CG2 1 ATOM 9753 N N . ASP F 2 214 ? 12.155 -16.924 -1.106 1.00 40.72 ? 208 ASP D N 1 ATOM 9754 C CA . ASP F 2 214 ? 12.067 -15.835 -0.138 1.00 39.54 ? 208 ASP D CA 1 ATOM 9755 C C . ASP F 2 214 ? 10.921 -16.128 0.822 1.00 41.30 ? 208 ASP D C 1 ATOM 9756 O O . ASP F 2 214 ? 9.810 -16.435 0.390 1.00 42.78 ? 208 ASP D O 1 ATOM 9757 C CB . ASP F 2 214 ? 11.858 -14.494 -0.841 1.00 38.01 ? 208 ASP D CB 1 ATOM 9758 C CG . ASP F 2 214 ? 12.980 -14.162 -1.805 1.00 40.22 ? 208 ASP D CG 1 ATOM 9759 O OD1 . ASP F 2 214 ? 14.153 -14.162 -1.378 1.00 35.31 ? 208 ASP D OD1 1 ATOM 9760 O OD2 . ASP F 2 214 ? 12.689 -13.912 -2.993 1.00 45.46 ? 208 ASP D OD2 1 ATOM 9761 N N . LYS F 2 215 ? 11.188 -16.048 2.122 1.00 32.51 ? 209 LYS D N 1 ATOM 9762 C CA . LYS F 2 215 ? 10.176 -16.398 3.111 1.00 29.70 ? 209 LYS D CA 1 ATOM 9763 C C . LYS F 2 215 ? 9.978 -15.292 4.134 1.00 30.81 ? 209 LYS D C 1 ATOM 9764 O O . LYS F 2 215 ? 10.890 -14.970 4.893 1.00 31.20 ? 209 LYS D O 1 ATOM 9765 C CB . LYS F 2 215 ? 10.549 -17.700 3.826 1.00 35.42 ? 209 LYS D CB 1 ATOM 9766 C CG . LYS F 2 215 ? 9.345 -18.522 4.241 1.00 49.94 ? 209 LYS D CG 1 ATOM 9767 C CD . LYS F 2 215 ? 8.611 -19.041 3.012 1.00 59.97 ? 209 LYS D CD 1 ATOM 9768 C CE . LYS F 2 215 ? 7.262 -19.632 3.367 1.00 66.45 ? 209 LYS D CE 1 ATOM 9769 N NZ . LYS F 2 215 ? 6.646 -20.318 2.197 1.00 71.24 ? 209 LYS D NZ 1 ATOM 9770 N N . LYS F 2 216 ? 8.778 -14.719 4.154 1.00 30.54 ? 210 LYS D N 1 ATOM 9771 C CA . LYS F 2 216 ? 8.442 -13.689 5.128 1.00 37.61 ? 210 LYS D CA 1 ATOM 9772 C C . LYS F 2 216 ? 8.237 -14.333 6.496 1.00 38.40 ? 210 LYS D C 1 ATOM 9773 O O . LYS F 2 216 ? 7.551 -15.348 6.619 1.00 38.09 ? 210 LYS D O 1 ATOM 9774 C CB . LYS F 2 216 ? 7.190 -12.919 4.693 1.00 40.76 ? 210 LYS D CB 1 ATOM 9775 C CG . LYS F 2 216 ? 6.914 -11.666 5.510 1.00 56.32 ? 210 LYS D CG 1 ATOM 9776 C CD . LYS F 2 216 ? 5.687 -10.916 4.998 1.00 66.89 ? 210 LYS D CD 1 ATOM 9777 C CE . LYS F 2 216 ? 5.388 -9.682 5.850 1.00 72.78 ? 210 LYS D CE 1 ATOM 9778 N NZ . LYS F 2 216 ? 4.098 -9.015 5.488 1.00 74.24 ? 210 LYS D NZ 1 ATOM 9779 N N . VAL F 2 217 ? 8.856 -13.759 7.521 1.00 33.84 ? 211 VAL D N 1 ATOM 9780 C CA . VAL F 2 217 ? 8.710 -14.280 8.873 1.00 34.04 ? 211 VAL D CA 1 ATOM 9781 C C . VAL F 2 217 ? 7.924 -13.295 9.738 1.00 41.02 ? 211 VAL D C 1 ATOM 9782 O O . VAL F 2 217 ? 8.446 -12.259 10.145 1.00 46.84 ? 211 VAL D O 1 ATOM 9783 C CB . VAL F 2 217 ? 10.079 -14.563 9.518 1.00 31.93 ? 211 VAL D CB 1 ATOM 9784 C CG1 . VAL F 2 217 ? 9.898 -15.274 10.849 1.00 27.93 ? 211 VAL D CG1 1 ATOM 9785 C CG2 . VAL F 2 217 ? 10.947 -15.390 8.578 1.00 29.47 ? 211 VAL D CG2 1 ATOM 9786 N N . GLU F 2 218 ? 6.665 -13.621 10.005 1.00 43.43 ? 212 GLU D N 1 ATOM 9787 C CA . GLU F 2 218 ? 5.784 -12.739 10.764 1.00 50.44 ? 212 GLU D CA 1 ATOM 9788 C C . GLU F 2 218 ? 5.526 -13.261 12.171 1.00 48.04 ? 212 GLU D C 1 ATOM 9789 O O . GLU F 2 218 ? 5.548 -14.468 12.399 1.00 50.06 ? 212 GLU D O 1 ATOM 9790 C CB . GLU F 2 218 ? 4.447 -12.573 10.044 1.00 58.44 ? 212 GLU D CB 1 ATOM 9791 C CG . GLU F 2 218 ? 4.534 -12.042 8.633 1.00 65.36 ? 212 GLU D CG 1 ATOM 9792 C CD . GLU F 2 218 ? 3.174 -12.021 7.968 1.00 77.95 ? 212 GLU D CD 1 ATOM 9793 O OE1 . GLU F 2 218 ? 2.178 -12.324 8.659 1.00 87.71 ? 212 GLU D OE1 1 ATOM 9794 O OE2 . GLU F 2 218 ? 3.094 -11.709 6.762 1.00 78.10 ? 212 GLU D OE2 1 ATOM 9795 N N . PRO F 2 219 ? 5.265 -12.350 13.120 1.00 54.61 ? 213 PRO D N 1 ATOM 9796 C CA . PRO F 2 219 ? 4.865 -12.779 14.463 1.00 62.74 ? 213 PRO D CA 1 ATOM 9797 C C . PRO F 2 219 ? 3.531 -13.518 14.422 1.00 74.48 ? 213 PRO D C 1 ATOM 9798 O O . PRO F 2 219 ? 2.554 -12.987 13.893 1.00 78.06 ? 213 PRO D O 1 ATOM 9799 C CB . PRO F 2 219 ? 4.745 -11.461 15.239 1.00 57.77 ? 213 PRO D CB 1 ATOM 9800 C CG . PRO F 2 219 ? 5.517 -10.457 14.429 1.00 51.21 ? 213 PRO D CG 1 ATOM 9801 C CD . PRO F 2 219 ? 5.351 -10.883 13.010 1.00 49.57 ? 213 PRO D CD 1 ATOM 9802 N N . LYS F 2 220 ? 3.501 -14.735 14.955 1.00 86.55 ? 214 LYS D N 1 ATOM 9803 C CA . LYS F 2 220 ? 2.289 -15.550 14.954 1.00 99.36 ? 214 LYS D CA 1 ATOM 9804 C C . LYS F 2 220 ? 2.208 -16.399 16.216 1.00 106.53 ? 214 LYS D C 1 ATOM 9805 O O . LYS F 2 220 ? 3.229 -16.712 16.829 1.00 109.49 ? 214 LYS D O 1 ATOM 9806 C CB . LYS F 2 220 ? 2.239 -16.446 13.711 1.00 105.75 ? 214 LYS D CB 1 ATOM 9807 C CG . LYS F 2 220 ? 1.942 -15.701 12.417 1.00 109.98 ? 214 LYS D CG 1 ATOM 9808 C CD . LYS F 2 220 ? 2.256 -16.543 11.192 1.00 109.41 ? 214 LYS D CD 1 ATOM 9809 C CE . LYS F 2 220 ? 2.096 -15.730 9.916 1.00 108.16 ? 214 LYS D CE 1 ATOM 9810 N NZ . LYS F 2 220 ? 2.509 -16.488 8.702 1.00 108.14 ? 214 LYS D NZ 1 ATOM 9811 N N . ASP G 1 1 ? 41.442 23.767 2.350 1.00 52.89 ? 1 ASP E N 1 ATOM 9812 C CA . ASP G 1 1 ? 41.992 22.427 2.189 1.00 42.86 ? 1 ASP E CA 1 ATOM 9813 C C . ASP G 1 1 ? 41.957 21.658 3.503 1.00 43.79 ? 1 ASP E C 1 ATOM 9814 O O . ASP G 1 1 ? 42.255 22.207 4.566 1.00 42.67 ? 1 ASP E O 1 ATOM 9815 C CB . ASP G 1 1 ? 43.423 22.491 1.654 1.00 42.50 ? 1 ASP E CB 1 ATOM 9816 C CG . ASP G 1 1 ? 43.490 22.993 0.220 1.00 51.08 ? 1 ASP E CG 1 ATOM 9817 O OD1 . ASP G 1 1 ? 42.447 22.985 -0.469 1.00 48.46 ? 1 ASP E OD1 1 ATOM 9818 O OD2 . ASP G 1 1 ? 44.592 23.389 -0.220 1.00 58.33 ? 1 ASP E OD2 1 ATOM 9819 N N . ILE G 1 2 ? 41.585 20.383 3.418 1.00 39.83 ? 2 ILE E N 1 ATOM 9820 C CA . ILE G 1 2 ? 41.470 19.524 4.589 1.00 36.87 ? 2 ILE E CA 1 ATOM 9821 C C . ILE G 1 2 ? 42.841 19.263 5.205 1.00 38.28 ? 2 ILE E C 1 ATOM 9822 O O . ILE G 1 2 ? 43.821 19.028 4.498 1.00 38.01 ? 2 ILE E O 1 ATOM 9823 C CB . ILE G 1 2 ? 40.779 18.192 4.227 1.00 44.14 ? 2 ILE E CB 1 ATOM 9824 C CG1 . ILE G 1 2 ? 39.293 18.443 3.950 1.00 45.50 ? 2 ILE E CG1 1 ATOM 9825 C CG2 . ILE G 1 2 ? 40.947 17.165 5.342 1.00 41.97 ? 2 ILE E CG2 1 ATOM 9826 C CD1 . ILE G 1 2 ? 38.619 17.365 3.146 1.00 48.61 ? 2 ILE E CD1 1 ATOM 9827 N N . GLN G 1 3 ? 42.901 19.324 6.530 1.00 43.72 ? 3 GLN E N 1 ATOM 9828 C CA . GLN G 1 3 ? 44.149 19.165 7.258 1.00 44.58 ? 3 GLN E CA 1 ATOM 9829 C C . GLN G 1 3 ? 44.019 18.034 8.265 1.00 39.00 ? 3 GLN E C 1 ATOM 9830 O O . GLN G 1 3 ? 43.022 17.958 8.982 1.00 38.66 ? 3 GLN E O 1 ATOM 9831 C CB . GLN G 1 3 ? 44.515 20.472 7.963 1.00 56.62 ? 3 GLN E CB 1 ATOM 9832 C CG . GLN G 1 3 ? 46.001 20.741 8.065 1.00 69.02 ? 3 GLN E CG 1 ATOM 9833 C CD . GLN G 1 3 ? 46.358 22.140 7.611 1.00 76.02 ? 3 GLN E CD 1 ATOM 9834 O OE1 . GLN G 1 3 ? 45.693 22.712 6.747 1.00 76.78 ? 3 GLN E OE1 1 ATOM 9835 N NE2 . GLN G 1 3 ? 47.409 22.702 8.196 1.00 83.20 ? 3 GLN E NE2 1 ATOM 9836 N N . MET G 1 4 ? 45.019 17.154 8.312 1.00 37.64 ? 4 MET E N 1 ATOM 9837 C CA . MET G 1 4 ? 45.019 16.040 9.260 1.00 34.75 ? 4 MET E CA 1 ATOM 9838 C C . MET G 1 4 ? 45.910 16.337 10.456 1.00 38.38 ? 4 MET E C 1 ATOM 9839 O O . MET G 1 4 ? 47.069 16.721 10.294 1.00 37.01 ? 4 MET E O 1 ATOM 9840 C CB . MET G 1 4 ? 45.496 14.739 8.600 1.00 39.77 ? 4 MET E CB 1 ATOM 9841 C CG . MET G 1 4 ? 44.857 14.406 7.272 1.00 40.47 ? 4 MET E CG 1 ATOM 9842 S SD . MET G 1 4 ? 43.067 14.505 7.317 1.00 70.82 ? 4 MET E SD 1 ATOM 9843 C CE . MET G 1 4 ? 42.662 13.168 8.429 1.00 138.07 ? 4 MET E CE 1 ATOM 9844 N N . THR G 1 5 ? 45.373 16.143 11.655 1.00 37.09 ? 5 THR E N 1 ATOM 9845 C CA . THR G 1 5 ? 46.159 16.303 12.874 1.00 34.39 ? 5 THR E CA 1 ATOM 9846 C C . THR G 1 5 ? 46.047 15.049 13.728 1.00 33.60 ? 5 THR E C 1 ATOM 9847 O O . THR G 1 5 ? 44.943 14.572 14.003 1.00 37.05 ? 5 THR E O 1 ATOM 9848 C CB . THR G 1 5 ? 45.702 17.526 13.694 1.00 39.87 ? 5 THR E CB 1 ATOM 9849 O OG1 . THR G 1 5 ? 45.617 18.673 12.840 1.00 47.75 ? 5 THR E OG1 1 ATOM 9850 C CG2 . THR G 1 5 ? 46.682 17.808 14.824 1.00 36.72 ? 5 THR E CG2 1 ATOM 9851 N N . GLN G 1 6 ? 47.188 14.510 14.141 1.00 23.69 ? 6 GLN E N 1 ATOM 9852 C CA . GLN G 1 6 ? 47.194 13.303 14.956 1.00 31.02 ? 6 GLN E CA 1 ATOM 9853 C C . GLN G 1 6 ? 47.453 13.627 16.424 1.00 33.93 ? 6 GLN E C 1 ATOM 9854 O O . GLN G 1 6 ? 48.085 14.634 16.736 1.00 29.10 ? 6 GLN E O 1 ATOM 9855 C CB . GLN G 1 6 ? 48.244 12.316 14.434 1.00 28.05 ? 6 GLN E CB 1 ATOM 9856 C CG . GLN G 1 6 ? 48.066 11.979 12.961 1.00 29.81 ? 6 GLN E CG 1 ATOM 9857 C CD . GLN G 1 6 ? 49.155 11.074 12.425 1.00 29.30 ? 6 GLN E CD 1 ATOM 9858 O OE1 . GLN G 1 6 ? 49.545 11.181 11.266 1.00 33.84 ? 6 GLN E OE1 1 ATOM 9859 N NE2 . GLN G 1 6 ? 49.643 10.170 13.265 1.00 33.54 ? 6 GLN E NE2 1 ATOM 9860 N N . SER G 1 7 ? 46.952 12.776 17.318 1.00 36.28 ? 7 SER E N 1 ATOM 9861 C CA . SER G 1 7 ? 47.263 12.887 18.741 1.00 35.81 ? 7 SER E CA 1 ATOM 9862 C C . SER G 1 7 ? 47.306 11.503 19.388 1.00 41.61 ? 7 SER E C 1 ATOM 9863 O O . SER G 1 7 ? 46.453 10.659 19.109 1.00 43.23 ? 7 SER E O 1 ATOM 9864 C CB . SER G 1 7 ? 46.249 13.783 19.460 1.00 35.57 ? 7 SER E CB 1 ATOM 9865 O OG . SER G 1 7 ? 44.985 13.154 19.572 1.00 45.56 ? 7 SER E OG 1 ATOM 9866 N N . PRO G 1 8 ? 48.309 11.261 20.251 1.00 39.52 ? 8 PRO E N 1 ATOM 9867 C CA . PRO G 1 8 ? 49.379 12.200 20.602 1.00 41.35 ? 8 PRO E CA 1 ATOM 9868 C C . PRO G 1 8 ? 50.411 12.305 19.491 1.00 44.85 ? 8 PRO E C 1 ATOM 9869 O O . PRO G 1 8 ? 50.287 11.609 18.488 1.00 42.66 ? 8 PRO E O 1 ATOM 9870 C CB . PRO G 1 8 ? 50.004 11.579 21.862 1.00 44.10 ? 8 PRO E CB 1 ATOM 9871 C CG . PRO G 1 8 ? 49.056 10.491 22.292 1.00 49.37 ? 8 PRO E CG 1 ATOM 9872 C CD . PRO G 1 8 ? 48.401 10.022 21.036 1.00 42.82 ? 8 PRO E CD 1 ATOM 9873 N N . SER G 1 9 ? 51.407 13.166 19.660 1.00 47.12 ? 9 SER E N 1 ATOM 9874 C CA . SER G 1 9 ? 52.496 13.229 18.701 1.00 43.84 ? 9 SER E CA 1 ATOM 9875 C C . SER G 1 9 ? 53.571 12.230 19.107 1.00 41.87 ? 9 SER E C 1 ATOM 9876 O O . SER G 1 9 ? 54.278 11.684 18.259 1.00 40.38 ? 9 SER E O 1 ATOM 9877 C CB . SER G 1 9 ? 53.065 14.644 18.611 1.00 43.90 ? 9 SER E CB 1 ATOM 9878 O OG . SER G 1 9 ? 52.076 15.554 18.158 1.00 41.17 ? 9 SER E OG 1 ATOM 9879 N N . PHE G 1 10 ? 53.677 11.986 20.410 1.00 45.37 ? 10 PHE E N 1 ATOM 9880 C CA . PHE G 1 10 ? 54.629 11.019 20.942 1.00 45.11 ? 10 PHE E CA 1 ATOM 9881 C C . PHE G 1 10 ? 53.946 10.067 21.915 1.00 47.89 ? 10 PHE E C 1 ATOM 9882 O O . PHE G 1 10 ? 53.137 10.483 22.745 1.00 46.29 ? 10 PHE E O 1 ATOM 9883 C CB . PHE G 1 10 ? 55.793 11.730 21.636 1.00 47.34 ? 10 PHE E CB 1 ATOM 9884 C CG . PHE G 1 10 ? 56.528 12.697 20.750 1.00 63.87 ? 10 PHE E CG 1 ATOM 9885 C CD1 . PHE G 1 10 ? 57.534 12.254 19.905 1.00 68.89 ? 10 PHE E CD1 1 ATOM 9886 C CD2 . PHE G 1 10 ? 56.215 14.049 20.763 1.00 67.93 ? 10 PHE E CD2 1 ATOM 9887 C CE1 . PHE G 1 10 ? 58.214 13.140 19.086 1.00 67.62 ? 10 PHE E CE1 1 ATOM 9888 C CE2 . PHE G 1 10 ? 56.892 14.940 19.946 1.00 66.86 ? 10 PHE E CE2 1 ATOM 9889 C CZ . PHE G 1 10 ? 57.893 14.484 19.106 1.00 66.48 ? 10 PHE E CZ 1 ATOM 9890 N N . VAL G 1 11 ? 54.259 8.782 21.794 1.00 48.53 ? 11 VAL E N 1 ATOM 9891 C CA . VAL G 1 11 ? 53.726 7.780 22.708 1.00 46.41 ? 11 VAL E CA 1 ATOM 9892 C C . VAL G 1 11 ? 54.828 6.839 23.178 1.00 49.40 ? 11 VAL E C 1 ATOM 9893 O O . VAL G 1 11 ? 55.613 6.329 22.375 1.00 47.29 ? 11 VAL E O 1 ATOM 9894 C CB . VAL G 1 11 ? 52.603 6.941 22.060 1.00 46.40 ? 11 VAL E CB 1 ATOM 9895 C CG1 . VAL G 1 11 ? 51.966 6.023 23.095 1.00 46.14 ? 11 VAL E CG1 1 ATOM 9896 C CG2 . VAL G 1 11 ? 51.554 7.837 21.434 1.00 45.67 ? 11 VAL E CG2 1 ATOM 9897 N N . SER G 1 12 ? 54.884 6.621 24.486 1.00 50.54 ? 12 SER E N 1 ATOM 9898 C CA . SER G 1 12 ? 55.793 5.647 25.070 1.00 44.35 ? 12 SER E CA 1 ATOM 9899 C C . SER G 1 12 ? 54.975 4.633 25.859 1.00 46.17 ? 12 SER E C 1 ATOM 9900 O O . SER G 1 12 ? 54.280 4.997 26.804 1.00 50.95 ? 12 SER E O 1 ATOM 9901 C CB . SER G 1 12 ? 56.824 6.336 25.965 1.00 44.25 ? 12 SER E CB 1 ATOM 9902 O OG . SER G 1 12 ? 57.714 5.399 26.543 1.00 52.54 ? 12 SER E OG 1 ATOM 9903 N N . ALA G 1 13 ? 55.043 3.366 25.461 1.00 51.70 ? 13 ALA E N 1 ATOM 9904 C CA . ALA G 1 13 ? 54.258 2.319 26.110 1.00 53.33 ? 13 ALA E CA 1 ATOM 9905 C C . ALA G 1 13 ? 55.026 1.003 26.182 1.00 51.53 ? 13 ALA E C 1 ATOM 9906 O O . ALA G 1 13 ? 55.983 0.793 25.440 1.00 51.46 ? 13 ALA E O 1 ATOM 9907 C CB . ALA G 1 13 ? 52.937 2.119 25.381 1.00 53.36 ? 13 ALA E CB 1 ATOM 9908 N N . SER G 1 14 ? 54.590 0.117 27.074 1.00 51.19 ? 14 SER E N 1 ATOM 9909 C CA . SER G 1 14 ? 55.274 -1.154 27.302 1.00 49.64 ? 14 SER E CA 1 ATOM 9910 C C . SER G 1 14 ? 54.686 -2.282 26.462 1.00 51.58 ? 14 SER E C 1 ATOM 9911 O O . SER G 1 14 ? 53.534 -2.213 26.030 1.00 50.79 ? 14 SER E O 1 ATOM 9912 C CB . SER G 1 14 ? 55.211 -1.534 28.783 1.00 48.83 ? 14 SER E CB 1 ATOM 9913 O OG . SER G 1 14 ? 55.718 -0.493 29.599 1.00 53.84 ? 14 SER E OG 1 ATOM 9914 N N . VAL G 1 15 ? 55.486 -3.321 26.237 1.00 50.93 ? 15 VAL E N 1 ATOM 9915 C CA . VAL G 1 15 ? 55.025 -4.505 25.523 1.00 50.60 ? 15 VAL E CA 1 ATOM 9916 C C . VAL G 1 15 ? 53.795 -5.093 26.210 1.00 52.48 ? 15 VAL E C 1 ATOM 9917 O O . VAL G 1 15 ? 53.828 -5.397 27.401 1.00 59.09 ? 15 VAL E O 1 ATOM 9918 C CB . VAL G 1 15 ? 56.132 -5.579 25.432 1.00 45.86 ? 15 VAL E CB 1 ATOM 9919 C CG1 . VAL G 1 15 ? 55.568 -6.886 24.884 1.00 47.47 ? 15 VAL E CG1 1 ATOM 9920 C CG2 . VAL G 1 15 ? 57.286 -5.084 24.572 1.00 36.01 ? 15 VAL E CG2 1 ATOM 9921 N N . GLY G 1 16 ? 52.706 -5.230 25.460 1.00 53.18 ? 16 GLY E N 1 ATOM 9922 C CA . GLY G 1 16 ? 51.475 -5.776 26.002 1.00 57.05 ? 16 GLY E CA 1 ATOM 9923 C C . GLY G 1 16 ? 50.422 -4.722 26.295 1.00 60.21 ? 16 GLY E C 1 ATOM 9924 O O . GLY G 1 16 ? 49.255 -5.047 26.516 1.00 63.23 ? 16 GLY E O 1 ATOM 9925 N N . ASP G 1 17 ? 50.834 -3.458 26.306 1.00 58.66 ? 17 ASP E N 1 ATOM 9926 C CA . ASP G 1 17 ? 49.904 -2.356 26.523 1.00 58.30 ? 17 ASP E CA 1 ATOM 9927 C C . ASP G 1 17 ? 48.989 -2.169 25.320 1.00 55.59 ? 17 ASP E C 1 ATOM 9928 O O . ASP G 1 17 ? 49.347 -2.513 24.193 1.00 48.28 ? 17 ASP E O 1 ATOM 9929 C CB . ASP G 1 17 ? 50.656 -1.053 26.805 1.00 59.32 ? 17 ASP E CB 1 ATOM 9930 C CG . ASP G 1 17 ? 51.227 -0.998 28.208 1.00 64.48 ? 17 ASP E CG 1 ATOM 9931 O OD1 . ASP G 1 17 ? 51.189 -2.031 28.909 1.00 66.79 ? 17 ASP E OD1 1 ATOM 9932 O OD2 . ASP G 1 17 ? 51.721 0.081 28.604 1.00 65.58 ? 17 ASP E OD2 1 ATOM 9933 N N . ARG G 1 18 ? 47.800 -1.633 25.570 1.00 62.84 ? 18 ARG E N 1 ATOM 9934 C CA . ARG G 1 18 ? 46.896 -1.258 24.493 1.00 62.46 ? 18 ARG E CA 1 ATOM 9935 C C . ARG G 1 18 ? 47.147 0.193 24.117 1.00 53.71 ? 18 ARG E C 1 ATOM 9936 O O . ARG G 1 18 ? 46.983 1.090 24.942 1.00 54.75 ? 18 ARG E O 1 ATOM 9937 C CB . ARG G 1 18 ? 45.435 -1.460 24.902 1.00 70.43 ? 18 ARG E CB 1 ATOM 9938 C CG . ARG G 1 18 ? 44.442 -1.102 23.811 1.00 74.56 ? 18 ARG E CG 1 ATOM 9939 C CD . ARG G 1 18 ? 43.023 -1.499 24.180 1.00 78.47 ? 18 ARG E CD 1 ATOM 9940 N NE . ARG G 1 18 ? 42.123 -1.342 23.042 1.00 85.84 ? 18 ARG E NE 1 ATOM 9941 C CZ . ARG G 1 18 ? 40.847 -1.712 23.038 1.00 95.60 ? 18 ARG E CZ 1 ATOM 9942 N NH1 . ARG G 1 18 ? 40.311 -2.264 24.119 1.00 100.56 ? 18 ARG E NH1 1 ATOM 9943 N NH2 . ARG G 1 18 ? 40.108 -1.529 21.952 1.00 95.96 ? 18 ARG E NH2 1 ATOM 9944 N N . VAL G 1 19 ? 47.553 0.417 22.874 1.00 50.02 ? 19 VAL E N 1 ATOM 9945 C CA . VAL G 1 19 ? 47.863 1.763 22.408 1.00 47.98 ? 19 VAL E CA 1 ATOM 9946 C C . VAL G 1 19 ? 46.855 2.230 21.369 1.00 45.03 ? 19 VAL E C 1 ATOM 9947 O O . VAL G 1 19 ? 46.508 1.486 20.454 1.00 50.93 ? 19 VAL E O 1 ATOM 9948 C CB . VAL G 1 19 ? 49.280 1.840 21.807 1.00 47.66 ? 19 VAL E CB 1 ATOM 9949 C CG1 . VAL G 1 19 ? 49.573 3.249 21.306 1.00 45.87 ? 19 VAL E CG1 1 ATOM 9950 C CG2 . VAL G 1 19 ? 50.311 1.414 22.836 1.00 51.39 ? 19 VAL E CG2 1 ATOM 9951 N N . THR G 1 20 ? 46.378 3.461 21.521 1.00 45.22 ? 20 THR E N 1 ATOM 9952 C CA . THR G 1 20 ? 45.484 4.054 20.538 1.00 44.63 ? 20 THR E CA 1 ATOM 9953 C C . THR G 1 20 ? 46.023 5.386 20.039 1.00 43.65 ? 20 THR E C 1 ATOM 9954 O O . THR G 1 20 ? 46.488 6.218 20.818 1.00 43.00 ? 20 THR E O 1 ATOM 9955 C CB . THR G 1 20 ? 44.075 4.273 21.101 1.00 50.00 ? 20 THR E CB 1 ATOM 9956 O OG1 . THR G 1 20 ? 44.128 5.244 22.153 1.00 52.73 ? 20 THR E OG1 1 ATOM 9957 C CG2 . THR G 1 20 ? 43.505 2.966 21.632 1.00 51.24 ? 20 THR E CG2 1 ATOM 9958 N N . ILE G 1 21 ? 45.959 5.566 18.727 1.00 44.53 ? 21 ILE E N 1 ATOM 9959 C CA . ILE G 1 21 ? 46.388 6.791 18.072 1.00 43.17 ? 21 ILE E CA 1 ATOM 9960 C C . ILE G 1 21 ? 45.199 7.381 17.327 1.00 41.38 ? 21 ILE E C 1 ATOM 9961 O O . ILE G 1 21 ? 44.482 6.659 16.634 1.00 41.34 ? 21 ILE E O 1 ATOM 9962 C CB . ILE G 1 21 ? 47.554 6.525 17.097 1.00 43.12 ? 21 ILE E CB 1 ATOM 9963 C CG1 . ILE G 1 21 ? 48.780 6.025 17.865 1.00 44.37 ? 21 ILE E CG1 1 ATOM 9964 C CG2 . ILE G 1 21 ? 47.890 7.774 16.294 1.00 42.21 ? 21 ILE E CG2 1 ATOM 9965 C CD1 . ILE G 1 21 ? 49.945 5.639 16.972 1.00 44.41 ? 21 ILE E CD1 1 ATOM 9966 N N . THR G 1 22 ? 44.970 8.682 17.475 1.00 39.27 ? 22 THR E N 1 ATOM 9967 C CA . THR G 1 22 ? 43.806 9.295 16.843 1.00 39.03 ? 22 THR E CA 1 ATOM 9968 C C . THR G 1 22 ? 44.187 10.287 15.751 1.00 38.28 ? 22 THR E C 1 ATOM 9969 O O . THR G 1 22 ? 45.222 10.951 15.817 1.00 33.84 ? 22 THR E O 1 ATOM 9970 C CB . THR G 1 22 ? 42.912 10.015 17.869 1.00 47.45 ? 22 THR E CB 1 ATOM 9971 O OG1 . THR G 1 22 ? 43.609 11.145 18.406 1.00 58.89 ? 22 THR E OG1 1 ATOM 9972 C CG2 . THR G 1 22 ? 42.528 9.074 18.996 1.00 46.07 ? 22 THR E CG2 1 ATOM 9973 N N . CYS G 1 23 ? 43.330 10.369 14.742 1.00 40.82 ? 23 CYS E N 1 ATOM 9974 C CA . CYS G 1 23 ? 43.513 11.290 13.634 1.00 42.88 ? 23 CYS E CA 1 ATOM 9975 C C . CYS G 1 23 ? 42.262 12.150 13.498 1.00 39.15 ? 23 CYS E C 1 ATOM 9976 O O . CYS G 1 23 ? 41.150 11.626 13.464 1.00 38.61 ? 23 CYS E O 1 ATOM 9977 C CB . CYS G 1 23 ? 43.782 10.519 12.340 1.00 39.62 ? 23 CYS E CB 1 ATOM 9978 S SG . CYS G 1 23 ? 44.321 11.512 10.929 1.00 55.95 ? 23 CYS E SG 1 ATOM 9979 N N . ARG G 1 24 ? 42.433 13.466 13.437 1.00 45.15 ? 24 ARG E N 1 ATOM 9980 C CA . ARG G 1 24 ? 41.286 14.346 13.234 1.00 48.42 ? 24 ARG E CA 1 ATOM 9981 C C . ARG G 1 24 ? 41.406 15.142 11.937 1.00 44.83 ? 24 ARG E C 1 ATOM 9982 O O . ARG G 1 24 ? 42.461 15.698 11.626 1.00 41.48 ? 24 ARG E O 1 ATOM 9983 C CB . ARG G 1 24 ? 41.103 15.305 14.414 1.00 51.08 ? 24 ARG E CB 1 ATOM 9984 C CG . ARG G 1 24 ? 39.640 15.665 14.657 1.00 67.77 ? 24 ARG E CG 1 ATOM 9985 C CD . ARG G 1 24 ? 39.456 17.073 15.208 1.00 83.87 ? 24 ARG E CD 1 ATOM 9986 N NE . ARG G 1 24 ? 40.013 17.227 16.548 1.00 99.31 ? 24 ARG E NE 1 ATOM 9987 C CZ . ARG G 1 24 ? 39.771 18.267 17.340 1.00 109.25 ? 24 ARG E CZ 1 ATOM 9988 N NH1 . ARG G 1 24 ? 38.971 19.242 16.928 1.00 112.77 ? 24 ARG E NH1 1 ATOM 9989 N NH2 . ARG G 1 24 ? 40.321 18.330 18.546 1.00 111.26 ? 24 ARG E NH2 1 ATOM 9990 N N . ALA G 1 25 ? 40.312 15.183 11.184 1.00 39.41 ? 25 ALA E N 1 ATOM 9991 C CA . ALA G 1 25 ? 40.265 15.921 9.930 1.00 37.21 ? 25 ALA E CA 1 ATOM 9992 C C . ALA G 1 25 ? 39.498 17.223 10.108 1.00 41.40 ? 25 ALA E C 1 ATOM 9993 O O . ALA G 1 25 ? 38.406 17.233 10.677 1.00 44.68 ? 25 ALA E O 1 ATOM 9994 C CB . ALA G 1 25 ? 39.628 15.076 8.842 1.00 31.55 ? 25 ALA E CB 1 ATOM 9995 N N . SER G 1 26 ? 40.067 18.316 9.610 1.00 40.05 ? 26 SER E N 1 ATOM 9996 C CA . SER G 1 26 ? 39.447 19.629 9.733 1.00 37.74 ? 26 SER E CA 1 ATOM 9997 C C . SER G 1 26 ? 38.036 19.663 9.130 1.00 40.64 ? 26 SER E C 1 ATOM 9998 O O . SER G 1 26 ? 37.205 20.472 9.536 1.00 46.84 ? 26 SER E O 1 ATOM 9999 C CB . SER G 1 26 ? 40.332 20.693 9.081 1.00 37.10 ? 26 SER E CB 1 ATOM 10000 O OG . SER G 1 26 ? 40.533 20.420 7.708 1.00 46.77 ? 26 SER E OG 1 ATOM 10001 N N . GLN G 1 27 ? 37.771 18.784 8.167 1.00 37.56 ? 27 GLN E N 1 ATOM 10002 C CA . GLN G 1 27 ? 36.422 18.604 7.622 1.00 47.01 ? 27 GLN E CA 1 ATOM 10003 C C . GLN G 1 27 ? 36.144 17.123 7.369 1.00 46.75 ? 27 GLN E C 1 ATOM 10004 O O . GLN G 1 27 ? 37.071 16.317 7.309 1.00 48.12 ? 27 GLN E O 1 ATOM 10005 C CB . GLN G 1 27 ? 36.239 19.391 6.321 1.00 50.20 ? 27 GLN E CB 1 ATOM 10006 C CG . GLN G 1 27 ? 36.331 20.898 6.454 1.00 61.36 ? 27 GLN E CG 1 ATOM 10007 C CD . GLN G 1 27 ? 36.185 21.602 5.117 1.00 72.64 ? 27 GLN E CD 1 ATOM 10008 O OE1 . GLN G 1 27 ? 36.207 20.965 4.059 1.00 69.69 ? 27 GLN E OE1 1 ATOM 10009 N NE2 . GLN G 1 27 ? 36.032 22.921 5.156 1.00 76.26 ? 27 GLN E NE2 1 ATOM 10010 N N . GLY G 1 28 ? 34.871 16.771 7.211 1.00 41.54 ? 28 GLY E N 1 ATOM 10011 C CA . GLY G 1 28 ? 34.484 15.390 6.974 1.00 34.84 ? 28 GLY E CA 1 ATOM 10012 C C . GLY G 1 28 ? 35.131 14.796 5.735 1.00 34.52 ? 28 GLY E C 1 ATOM 10013 O O . GLY G 1 28 ? 35.199 15.447 4.693 1.00 35.96 ? 28 GLY E O 1 ATOM 10014 N N . ILE G 1 29 ? 35.624 13.564 5.855 1.00 33.14 ? 29 ILE E N 1 ATOM 10015 C CA . ILE G 1 29 ? 36.234 12.865 4.725 1.00 31.74 ? 29 ILE E CA 1 ATOM 10016 C C . ILE G 1 29 ? 35.727 11.435 4.616 1.00 35.02 ? 29 ILE E C 1 ATOM 10017 O O . ILE G 1 29 ? 36.360 10.599 3.970 1.00 36.56 ? 29 ILE E O 1 ATOM 10018 C CB . ILE G 1 29 ? 37.774 12.830 4.824 1.00 28.88 ? 29 ILE E CB 1 ATOM 10019 C CG1 . ILE G 1 29 ? 38.217 12.125 6.108 1.00 26.39 ? 29 ILE E CG1 1 ATOM 10020 C CG2 . ILE G 1 29 ? 38.351 14.232 4.755 1.00 31.17 ? 29 ILE E CG2 1 ATOM 10021 C CD1 . ILE G 1 29 ? 39.712 11.966 6.217 1.00 29.12 ? 29 ILE E CD1 1 ATOM 10022 N N . SER G 1 30 ? 34.591 11.163 5.255 1.00 37.77 ? 30 SER E N 1 ATOM 10023 C CA . SER G 1 30 ? 33.948 9.852 5.203 1.00 37.41 ? 30 SER E CA 1 ATOM 10024 C C . SER G 1 30 ? 34.887 8.728 5.658 1.00 39.37 ? 30 SER E C 1 ATOM 10025 O O . SER G 1 30 ? 35.289 8.682 6.821 1.00 42.55 ? 30 SER E O 1 ATOM 10026 C CB . SER G 1 30 ? 33.428 9.577 3.789 1.00 45.38 ? 30 SER E CB 1 ATOM 10027 O OG . SER G 1 30 ? 32.828 8.297 3.706 1.00 59.91 ? 30 SER E OG 1 ATOM 10028 N N . SER G 1 31 ? 35.228 7.824 4.741 1.00 32.60 ? 31 SER E N 1 ATOM 10029 C CA . SER G 1 31 ? 36.115 6.708 5.052 1.00 33.27 ? 31 SER E CA 1 ATOM 10030 C C . SER G 1 31 ? 37.367 6.736 4.184 1.00 35.99 ? 31 SER E C 1 ATOM 10031 O O . SER G 1 31 ? 38.136 5.772 4.160 1.00 36.01 ? 31 SER E O 1 ATOM 10032 C CB . SER G 1 31 ? 35.393 5.370 4.870 1.00 36.53 ? 31 SER E CB 1 ATOM 10033 O OG . SER G 1 31 ? 34.297 5.257 5.757 1.00 48.49 ? 31 SER E OG 1 ATOM 10034 N N . TYR G 1 32 ? 37.562 7.839 3.470 1.00 29.26 ? 32 TYR E N 1 ATOM 10035 C CA . TYR G 1 32 ? 38.731 7.999 2.616 1.00 28.95 ? 32 TYR E CA 1 ATOM 10036 C C . TYR G 1 32 ? 39.979 8.241 3.452 1.00 28.75 ? 32 TYR E C 1 ATOM 10037 O O . TYR G 1 32 ? 40.535 9.339 3.450 1.00 30.57 ? 32 TYR E O 1 ATOM 10038 C CB . TYR G 1 32 ? 38.524 9.152 1.633 1.00 30.76 ? 32 TYR E CB 1 ATOM 10039 C CG . TYR G 1 32 ? 37.464 8.880 0.589 1.00 33.41 ? 32 TYR E CG 1 ATOM 10040 C CD1 . TYR G 1 32 ? 36.126 9.182 0.828 1.00 39.95 ? 32 TYR E CD1 1 ATOM 10041 C CD2 . TYR G 1 32 ? 37.800 8.319 -0.635 1.00 34.01 ? 32 TYR E CD2 1 ATOM 10042 C CE1 . TYR G 1 32 ? 35.155 8.933 -0.128 1.00 41.00 ? 32 TYR E CE1 1 ATOM 10043 C CE2 . TYR G 1 32 ? 36.840 8.068 -1.597 1.00 33.86 ? 32 TYR E CE2 1 ATOM 10044 C CZ . TYR G 1 32 ? 35.521 8.376 -1.337 1.00 40.10 ? 32 TYR E CZ 1 ATOM 10045 O OH . TYR G 1 32 ? 34.567 8.124 -2.291 1.00 45.74 ? 32 TYR E OH 1 ATOM 10046 N N . LEU G 1 33 ? 40.419 7.210 4.167 1.00 25.64 ? 33 LEU E N 1 ATOM 10047 C CA . LEU G 1 33 ? 41.566 7.349 5.051 1.00 28.11 ? 33 LEU E CA 1 ATOM 10048 C C . LEU G 1 33 ? 42.343 6.046 5.176 1.00 31.14 ? 33 LEU E C 1 ATOM 10049 O O . LEU G 1 33 ? 41.761 4.958 5.219 1.00 25.60 ? 33 LEU E O 1 ATOM 10050 C CB . LEU G 1 33 ? 41.122 7.822 6.437 1.00 26.46 ? 33 LEU E CB 1 ATOM 10051 C CG . LEU G 1 33 ? 42.266 8.171 7.393 1.00 33.15 ? 33 LEU E CG 1 ATOM 10052 C CD1 . LEU G 1 33 ? 42.541 9.668 7.411 1.00 29.84 ? 33 LEU E CD1 1 ATOM 10053 C CD2 . LEU G 1 33 ? 41.987 7.651 8.784 1.00 37.27 ? 33 LEU E CD2 1 ATOM 10054 N N . ALA G 1 34 ? 43.665 6.163 5.226 1.00 26.21 ? 34 ALA E N 1 ATOM 10055 C CA . ALA G 1 34 ? 44.512 5.010 5.489 1.00 23.16 ? 34 ALA E CA 1 ATOM 10056 C C . ALA G 1 34 ? 45.519 5.332 6.586 1.00 27.27 ? 34 ALA E C 1 ATOM 10057 O O . ALA G 1 34 ? 45.746 6.501 6.919 1.00 24.18 ? 34 ALA E O 1 ATOM 10058 C CB . ALA G 1 34 ? 45.226 4.566 4.227 1.00 19.50 ? 34 ALA E CB 1 ATOM 10059 N N . TRP G 1 35 ? 46.105 4.283 7.151 1.00 21.30 ? 35 TRP E N 1 ATOM 10060 C CA . TRP G 1 35 ? 47.165 4.416 8.140 1.00 22.38 ? 35 TRP E CA 1 ATOM 10061 C C . TRP G 1 35 ? 48.437 3.763 7.620 1.00 28.63 ? 35 TRP E C 1 ATOM 10062 O O . TRP G 1 35 ? 48.384 2.691 7.011 1.00 30.18 ? 35 TRP E O 1 ATOM 10063 C CB . TRP G 1 35 ? 46.757 3.777 9.462 1.00 25.35 ? 35 TRP E CB 1 ATOM 10064 C CG . TRP G 1 35 ? 45.707 4.522 10.231 1.00 28.36 ? 35 TRP E CG 1 ATOM 10065 C CD1 . TRP G 1 35 ? 44.359 4.311 10.198 1.00 25.06 ? 35 TRP E CD1 1 ATOM 10066 C CD2 . TRP G 1 35 ? 45.926 5.579 11.176 1.00 23.45 ? 35 TRP E CD2 1 ATOM 10067 N NE1 . TRP G 1 35 ? 43.725 5.176 11.060 1.00 26.51 ? 35 TRP E NE1 1 ATOM 10068 C CE2 . TRP G 1 35 ? 44.663 5.963 11.670 1.00 22.23 ? 35 TRP E CE2 1 ATOM 10069 C CE3 . TRP G 1 35 ? 47.066 6.233 11.651 1.00 25.06 ? 35 TRP E CE3 1 ATOM 10070 C CZ2 . TRP G 1 35 ? 44.511 6.975 12.615 1.00 25.54 ? 35 TRP E CZ2 1 ATOM 10071 C CZ3 . TRP G 1 35 ? 46.912 7.238 12.587 1.00 25.74 ? 35 TRP E CZ3 1 ATOM 10072 C CH2 . TRP G 1 35 ? 45.645 7.599 13.060 1.00 28.23 ? 35 TRP E CH2 1 ATOM 10073 N N . TYR G 1 36 ? 49.576 4.405 7.858 1.00 26.28 ? 36 TYR E N 1 ATOM 10074 C CA . TYR G 1 36 ? 50.856 3.850 7.441 1.00 24.85 ? 36 TYR E CA 1 ATOM 10075 C C . TYR G 1 36 ? 51.830 3.761 8.603 1.00 27.07 ? 36 TYR E C 1 ATOM 10076 O O . TYR G 1 36 ? 51.787 4.562 9.535 1.00 27.22 ? 36 TYR E O 1 ATOM 10077 C CB . TYR G 1 36 ? 51.473 4.684 6.317 1.00 18.10 ? 36 TYR E CB 1 ATOM 10078 C CG . TYR G 1 36 ? 50.591 4.793 5.104 1.00 23.53 ? 36 TYR E CG 1 ATOM 10079 C CD1 . TYR G 1 36 ? 49.650 5.811 4.994 1.00 21.45 ? 36 TYR E CD1 1 ATOM 10080 C CD2 . TYR G 1 36 ? 50.689 3.875 4.074 1.00 24.20 ? 36 TYR E CD2 1 ATOM 10081 C CE1 . TYR G 1 36 ? 48.833 5.911 3.885 1.00 22.91 ? 36 TYR E CE1 1 ATOM 10082 C CE2 . TYR G 1 36 ? 49.882 3.968 2.961 1.00 26.31 ? 36 TYR E CE2 1 ATOM 10083 C CZ . TYR G 1 36 ? 48.955 4.987 2.870 1.00 26.89 ? 36 TYR E CZ 1 ATOM 10084 O OH . TYR G 1 36 ? 48.148 5.077 1.758 1.00 27.37 ? 36 TYR E OH 1 ATOM 10085 N N . GLN G 1 37 ? 52.704 2.767 8.536 1.00 21.20 ? 37 GLN E N 1 ATOM 10086 C CA . GLN G 1 37 ? 53.768 2.607 9.512 1.00 27.13 ? 37 GLN E CA 1 ATOM 10087 C C . GLN G 1 37 ? 55.097 2.873 8.826 1.00 23.17 ? 37 GLN E C 1 ATOM 10088 O O . GLN G 1 37 ? 55.386 2.288 7.784 1.00 30.78 ? 37 GLN E O 1 ATOM 10089 C CB . GLN G 1 37 ? 53.743 1.202 10.118 1.00 27.06 ? 37 GLN E CB 1 ATOM 10090 C CG . GLN G 1 37 ? 54.911 0.896 11.037 1.00 32.04 ? 37 GLN E CG 1 ATOM 10091 C CD . GLN G 1 37 ? 55.010 -0.580 11.361 1.00 34.71 ? 37 GLN E CD 1 ATOM 10092 O OE1 . GLN G 1 37 ? 55.491 -1.369 10.553 1.00 30.66 ? 37 GLN E OE1 1 ATOM 10093 N NE2 . GLN G 1 37 ? 54.541 -0.963 12.544 1.00 34.84 ? 37 GLN E NE2 1 ATOM 10094 N N . GLN G 1 38 ? 55.903 3.764 9.390 1.00 21.96 ? 38 GLN E N 1 ATOM 10095 C CA . GLN G 1 38 ? 57.201 4.045 8.792 1.00 31.40 ? 38 GLN E CA 1 ATOM 10096 C C . GLN G 1 38 ? 58.351 3.873 9.781 1.00 28.00 ? 38 GLN E C 1 ATOM 10097 O O . GLN G 1 38 ? 58.439 4.580 10.787 1.00 28.45 ? 38 GLN E O 1 ATOM 10098 C CB . GLN G 1 38 ? 57.232 5.458 8.204 1.00 26.87 ? 38 GLN E CB 1 ATOM 10099 C CG . GLN G 1 38 ? 58.488 5.728 7.385 1.00 26.41 ? 38 GLN E CG 1 ATOM 10100 C CD . GLN G 1 38 ? 58.508 7.118 6.785 1.00 30.23 ? 38 GLN E CD 1 ATOM 10101 O OE1 . GLN G 1 38 ? 57.991 8.069 7.371 1.00 30.71 ? 38 GLN E OE1 1 ATOM 10102 N NE2 . GLN G 1 38 ? 59.104 7.242 5.607 1.00 30.52 ? 38 GLN E NE2 1 ATOM 10103 N N . LYS G 1 39 ? 59.223 2.917 9.483 1.00 29.29 ? 39 LYS E N 1 ATOM 10104 C CA . LYS G 1 39 ? 60.465 2.733 10.224 1.00 32.72 ? 39 LYS E CA 1 ATOM 10105 C C . LYS G 1 39 ? 61.486 3.768 9.759 1.00 41.11 ? 39 LYS E C 1 ATOM 10106 O O . LYS G 1 39 ? 61.463 4.177 8.594 1.00 37.10 ? 39 LYS E O 1 ATOM 10107 C CB . LYS G 1 39 ? 61.013 1.319 10.017 1.00 29.43 ? 39 LYS E CB 1 ATOM 10108 C CG . LYS G 1 39 ? 60.104 0.213 10.517 1.00 34.71 ? 39 LYS E CG 1 ATOM 10109 C CD . LYS G 1 39 ? 60.236 0.052 12.012 1.00 38.86 ? 39 LYS E CD 1 ATOM 10110 C CE . LYS G 1 39 ? 59.486 -1.164 12.508 1.00 38.87 ? 39 LYS E CE 1 ATOM 10111 N NZ . LYS G 1 39 ? 59.798 -1.406 13.942 1.00 36.45 ? 39 LYS E NZ 1 ATOM 10112 N N . PRO G 1 40 ? 62.380 4.200 10.666 1.00 42.21 ? 40 PRO E N 1 ATOM 10113 C CA . PRO G 1 40 ? 63.428 5.165 10.308 1.00 35.96 ? 40 PRO E CA 1 ATOM 10114 C C . PRO G 1 40 ? 64.224 4.734 9.078 1.00 32.67 ? 40 PRO E C 1 ATOM 10115 O O . PRO G 1 40 ? 64.664 3.587 9.003 1.00 34.05 ? 40 PRO E O 1 ATOM 10116 C CB . PRO G 1 40 ? 64.317 5.187 11.553 1.00 41.30 ? 40 PRO E CB 1 ATOM 10117 C CG . PRO G 1 40 ? 63.381 4.871 12.672 1.00 38.19 ? 40 PRO E CG 1 ATOM 10118 C CD . PRO G 1 40 ? 62.414 3.860 12.101 1.00 39.27 ? 40 PRO E CD 1 ATOM 10119 N N . GLY G 1 41 ? 64.378 5.643 8.120 1.00 34.07 ? 41 GLY E N 1 ATOM 10120 C CA . GLY G 1 41 ? 65.128 5.369 6.906 1.00 32.47 ? 41 GLY E CA 1 ATOM 10121 C C . GLY G 1 41 ? 64.433 4.438 5.926 1.00 37.96 ? 41 GLY E C 1 ATOM 10122 O O . GLY G 1 41 ? 65.037 4.003 4.946 1.00 46.37 ? 41 GLY E O 1 ATOM 10123 N N . LYS G 1 42 ? 63.164 4.131 6.178 1.00 28.87 ? 42 LYS E N 1 ATOM 10124 C CA . LYS G 1 42 ? 62.424 3.224 5.307 1.00 25.64 ? 42 LYS E CA 1 ATOM 10125 C C . LYS G 1 42 ? 61.184 3.885 4.713 1.00 28.39 ? 42 LYS E C 1 ATOM 10126 O O . LYS G 1 42 ? 60.757 4.947 5.161 1.00 24.15 ? 42 LYS E O 1 ATOM 10127 C CB . LYS G 1 42 ? 62.021 1.964 6.075 1.00 32.69 ? 42 LYS E CB 1 ATOM 10128 C CG . LYS G 1 42 ? 63.194 1.180 6.642 1.00 39.93 ? 42 LYS E CG 1 ATOM 10129 C CD . LYS G 1 42 ? 64.100 0.674 5.533 1.00 43.09 ? 42 LYS E CD 1 ATOM 10130 C CE . LYS G 1 42 ? 65.299 -0.080 6.085 1.00 48.58 ? 42 LYS E CE 1 ATOM 10131 N NZ . LYS G 1 42 ? 66.187 -0.546 4.982 1.00 52.02 ? 42 LYS E NZ 1 ATOM 10132 N N . ALA G 1 43 ? 60.610 3.244 3.701 1.00 29.27 ? 43 ALA E N 1 ATOM 10133 C CA . ALA G 1 43 ? 59.364 3.704 3.113 1.00 25.83 ? 43 ALA E CA 1 ATOM 10134 C C . ALA G 1 43 ? 58.199 3.363 4.031 1.00 27.24 ? 43 ALA E C 1 ATOM 10135 O O . ALA G 1 43 ? 58.262 2.383 4.776 1.00 28.51 ? 43 ALA E O 1 ATOM 10136 C CB . ALA G 1 43 ? 59.165 3.081 1.740 1.00 24.31 ? 43 ALA E CB 1 ATOM 10137 N N . PRO G 1 44 ? 57.134 4.175 3.990 1.00 26.87 ? 44 PRO E N 1 ATOM 10138 C CA . PRO G 1 44 ? 55.931 3.854 4.761 1.00 30.30 ? 44 PRO E CA 1 ATOM 10139 C C . PRO G 1 44 ? 55.369 2.509 4.329 1.00 27.86 ? 44 PRO E C 1 ATOM 10140 O O . PRO G 1 44 ? 55.547 2.117 3.178 1.00 28.24 ? 44 PRO E O 1 ATOM 10141 C CB . PRO G 1 44 ? 54.959 4.983 4.402 1.00 30.40 ? 44 PRO E CB 1 ATOM 10142 C CG . PRO G 1 44 ? 55.791 6.048 3.800 1.00 31.72 ? 44 PRO E CG 1 ATOM 10143 C CD . PRO G 1 44 ? 56.957 5.379 3.166 1.00 27.10 ? 44 PRO E CD 1 ATOM 10144 N N . LYS G 1 45 ? 54.714 1.802 5.237 1.00 24.39 ? 45 LYS E N 1 ATOM 10145 C CA . LYS G 1 45 ? 54.036 0.572 4.863 1.00 23.37 ? 45 LYS E CA 1 ATOM 10146 C C . LYS G 1 45 ? 52.580 0.663 5.280 1.00 24.38 ? 45 LYS E C 1 ATOM 10147 O O . LYS G 1 45 ? 52.273 1.040 6.413 1.00 24.77 ? 45 LYS E O 1 ATOM 10148 C CB . LYS G 1 45 ? 54.713 -0.647 5.495 1.00 26.72 ? 45 LYS E CB 1 ATOM 10149 C CG . LYS G 1 45 ? 56.199 -0.727 5.189 1.00 45.32 ? 45 LYS E CG 1 ATOM 10150 C CD . LYS G 1 45 ? 56.718 -2.158 5.165 1.00 54.19 ? 45 LYS E CD 1 ATOM 10151 C CE . LYS G 1 45 ? 58.240 -2.168 5.064 1.00 56.75 ? 45 LYS E CE 1 ATOM 10152 N NZ . LYS G 1 45 ? 58.765 -3.364 4.354 1.00 55.79 ? 45 LYS E NZ 1 ATOM 10153 N N . LEU G 1 46 ? 51.688 0.343 4.352 1.00 21.29 ? 46 LEU E N 1 ATOM 10154 C CA . LEU G 1 46 ? 50.262 0.360 4.628 1.00 19.31 ? 46 LEU E CA 1 ATOM 10155 C C . LEU G 1 46 ? 49.928 -0.558 5.792 1.00 26.45 ? 46 LEU E C 1 ATOM 10156 O O . LEU G 1 46 ? 50.339 -1.713 5.817 1.00 26.82 ? 46 LEU E O 1 ATOM 10157 C CB . LEU G 1 46 ? 49.468 -0.060 3.391 1.00 21.03 ? 46 LEU E CB 1 ATOM 10158 C CG . LEU G 1 46 ? 47.949 0.007 3.553 1.00 22.93 ? 46 LEU E CG 1 ATOM 10159 C CD1 . LEU G 1 46 ? 47.516 1.429 3.833 1.00 19.73 ? 46 LEU E CD1 1 ATOM 10160 C CD2 . LEU G 1 46 ? 47.246 -0.545 2.317 1.00 15.59 ? 46 LEU E CD2 1 ATOM 10161 N N . VAL G 1 47 ? 49.196 -0.031 6.763 1.00 31.18 ? 47 VAL E N 1 ATOM 10162 C CA . VAL G 1 47 ? 48.718 -0.834 7.878 1.00 38.54 ? 47 VAL E CA 1 ATOM 10163 C C . VAL G 1 47 ? 47.239 -1.115 7.705 1.00 42.22 ? 47 VAL E C 1 ATOM 10164 O O . VAL G 1 47 ? 46.804 -2.265 7.637 1.00 50.05 ? 47 VAL E O 1 ATOM 10165 C CB . VAL G 1 47 ? 48.931 -0.128 9.227 1.00 42.62 ? 47 VAL E CB 1 ATOM 10166 C CG1 . VAL G 1 47 ? 48.256 -0.910 10.343 1.00 42.44 ? 47 VAL E CG1 1 ATOM 10167 C CG2 . VAL G 1 47 ? 50.408 0.052 9.503 1.00 45.19 ? 47 VAL E CG2 1 ATOM 10168 N N . ILE G 1 48 ? 46.476 -0.034 7.621 1.00 50.97 ? 48 ILE E N 1 ATOM 10169 C CA . ILE G 1 48 ? 45.025 -0.092 7.568 1.00 55.64 ? 48 ILE E CA 1 ATOM 10170 C C . ILE G 1 48 ? 44.478 0.917 6.567 1.00 48.88 ? 48 ILE E C 1 ATOM 10171 O O . ILE G 1 48 ? 44.953 2.050 6.503 1.00 41.87 ? 48 ILE E O 1 ATOM 10172 C CB . ILE G 1 48 ? 44.417 0.181 8.960 1.00 61.39 ? 48 ILE E CB 1 ATOM 10173 C CG1 . ILE G 1 48 ? 44.579 -1.050 9.850 1.00 64.12 ? 48 ILE E CG1 1 ATOM 10174 C CG2 . ILE G 1 48 ? 42.950 0.574 8.855 1.00 61.39 ? 48 ILE E CG2 1 ATOM 10175 C CD1 . ILE G 1 48 ? 43.979 -0.891 11.204 1.00 64.89 ? 48 ILE E CD1 1 ATOM 10176 N N . TYR G 1 49 ? 43.492 0.493 5.781 1.00 50.12 ? 49 TYR E N 1 ATOM 10177 C CA . TYR G 1 49 ? 42.794 1.379 4.858 1.00 46.14 ? 49 TYR E CA 1 ATOM 10178 C C . TYR G 1 49 ? 41.293 1.304 5.108 1.00 49.55 ? 49 TYR E C 1 ATOM 10179 O O . TYR G 1 49 ? 40.844 0.510 5.931 1.00 44.18 ? 49 TYR E O 1 ATOM 10180 C CB . TYR G 1 49 ? 43.116 1.013 3.415 1.00 41.38 ? 49 TYR E CB 1 ATOM 10181 C CG . TYR G 1 49 ? 42.761 -0.406 3.058 1.00 36.56 ? 49 TYR E CG 1 ATOM 10182 C CD1 . TYR G 1 49 ? 43.641 -1.448 3.317 1.00 34.34 ? 49 TYR E CD1 1 ATOM 10183 C CD2 . TYR G 1 49 ? 41.544 -0.705 2.461 1.00 36.32 ? 49 TYR E CD2 1 ATOM 10184 C CE1 . TYR G 1 49 ? 43.319 -2.751 2.992 1.00 39.41 ? 49 TYR E CE1 1 ATOM 10185 C CE2 . TYR G 1 49 ? 41.210 -2.004 2.133 1.00 40.64 ? 49 TYR E CE2 1 ATOM 10186 C CZ . TYR G 1 49 ? 42.100 -3.025 2.399 1.00 48.87 ? 49 TYR E CZ 1 ATOM 10187 O OH . TYR G 1 49 ? 41.766 -4.321 2.072 1.00 56.74 ? 49 TYR E OH 1 ATOM 10188 N N . ALA G 1 50 ? 40.526 2.137 4.406 1.00 63.83 ? 50 ALA E N 1 ATOM 10189 C CA . ALA G 1 50 ? 39.085 2.250 4.632 1.00 67.12 ? 50 ALA E CA 1 ATOM 10190 C C . ALA G 1 50 ? 38.791 2.475 6.114 1.00 72.66 ? 50 ALA E C 1 ATOM 10191 O O . ALA G 1 50 ? 37.755 2.040 6.625 1.00 76.35 ? 50 ALA E O 1 ATOM 10192 C CB . ALA G 1 50 ? 38.357 1.010 4.121 1.00 65.37 ? 50 ALA E CB 1 ATOM 10193 N N . ALA G 1 51 ? 39.738 3.131 6.786 1.00 68.11 ? 51 ALA E N 1 ATOM 10194 C CA . ALA G 1 51 ? 39.670 3.480 8.204 1.00 63.36 ? 51 ALA E CA 1 ATOM 10195 C C . ALA G 1 51 ? 39.721 2.284 9.173 1.00 65.98 ? 51 ALA E C 1 ATOM 10196 O O . ALA G 1 51 ? 40.100 2.461 10.332 1.00 58.41 ? 51 ALA E O 1 ATOM 10197 C CB . ALA G 1 51 ? 38.419 4.316 8.476 1.00 53.40 ? 51 ALA E CB 1 ATOM 10198 N N . SER G 1 52 ? 39.367 1.080 8.718 1.00 70.86 ? 52 SER E N 1 ATOM 10199 C CA . SER G 1 52 ? 39.196 -0.051 9.643 1.00 69.04 ? 52 SER E CA 1 ATOM 10200 C C . SER G 1 52 ? 39.799 -1.402 9.222 1.00 66.86 ? 52 SER E C 1 ATOM 10201 O O . SER G 1 52 ? 40.138 -2.217 10.082 1.00 66.97 ? 52 SER E O 1 ATOM 10202 C CB . SER G 1 52 ? 37.704 -0.257 9.923 1.00 69.57 ? 52 SER E CB 1 ATOM 10203 O OG . SER G 1 52 ? 37.005 -0.624 8.747 1.00 72.46 ? 52 SER E OG 1 ATOM 10204 N N . THR G 1 53 ? 39.921 -1.654 7.921 1.00 67.87 ? 53 THR E N 1 ATOM 10205 C CA . THR G 1 53 ? 40.390 -2.964 7.451 1.00 72.32 ? 53 THR E CA 1 ATOM 10206 C C . THR G 1 53 ? 41.913 -3.021 7.271 1.00 67.46 ? 53 THR E C 1 ATOM 10207 O O . THR G 1 53 ? 42.530 -2.077 6.775 1.00 57.10 ? 53 THR E O 1 ATOM 10208 C CB . THR G 1 53 ? 39.691 -3.368 6.122 1.00 53.38 ? 53 THR E CB 1 ATOM 10209 O OG1 . THR G 1 53 ? 40.487 -4.332 5.418 1.00 51.39 ? 53 THR E OG1 1 ATOM 10210 C CG2 . THR G 1 53 ? 39.483 -2.164 5.242 1.00 47.70 ? 53 THR E CG2 1 ATOM 10211 N N . LEU G 1 54 ? 42.504 -4.142 7.684 1.00 69.18 ? 54 LEU E N 1 ATOM 10212 C CA . LEU G 1 54 ? 43.952 -4.344 7.628 1.00 63.54 ? 54 LEU E CA 1 ATOM 10213 C C . LEU G 1 54 ? 44.456 -4.514 6.197 1.00 57.77 ? 54 LEU E C 1 ATOM 10214 O O . LEU G 1 54 ? 45.651 -4.372 5.927 1.00 53.28 ? 54 LEU E O 1 ATOM 10215 C CB . LEU G 1 54 ? 44.349 -5.566 8.459 1.00 63.65 ? 54 LEU E CB 1 ATOM 10216 C CG . LEU G 1 54 ? 43.759 -5.657 9.867 1.00 61.94 ? 54 LEU E CG 1 ATOM 10217 C CD1 . LEU G 1 54 ? 44.198 -6.945 10.557 1.00 65.40 ? 54 LEU E CD1 1 ATOM 10218 C CD2 . LEU G 1 54 ? 44.134 -4.438 10.694 1.00 55.35 ? 54 LEU E CD2 1 ATOM 10219 N N . ARG G 1 61 ? 45.593 -7.726 15.778 1.00 56.84 ? 61 ARG E N 1 ATOM 10220 C CA . ARG G 1 61 ? 46.041 -6.848 16.855 1.00 63.32 ? 61 ARG E CA 1 ATOM 10221 C C . ARG G 1 61 ? 45.848 -5.380 16.513 1.00 71.15 ? 61 ARG E C 1 ATOM 10222 O O . ARG G 1 61 ? 45.255 -4.626 17.282 1.00 75.61 ? 61 ARG E O 1 ATOM 10223 C CB . ARG G 1 61 ? 47.506 -7.097 17.177 1.00 63.18 ? 61 ARG E CB 1 ATOM 10224 C CG . ARG G 1 61 ? 48.113 -6.026 18.047 1.00 69.71 ? 61 ARG E CG 1 ATOM 10225 C CD . ARG G 1 61 ? 49.210 -6.600 18.905 1.00 80.78 ? 61 ARG E CD 1 ATOM 10226 N NE . ARG G 1 61 ? 50.274 -7.212 18.114 1.00 85.81 ? 61 ARG E NE 1 ATOM 10227 C CZ . ARG G 1 61 ? 51.306 -6.543 17.608 1.00 82.06 ? 61 ARG E CZ 1 ATOM 10228 N NH1 . ARG G 1 61 ? 51.412 -5.238 17.811 1.00 79.68 ? 61 ARG E NH1 1 ATOM 10229 N NH2 . ARG G 1 61 ? 52.229 -7.177 16.897 1.00 80.24 ? 61 ARG E NH2 1 ATOM 10230 N N . PHE G 1 62 ? 46.382 -4.976 15.366 1.00 73.59 ? 62 PHE E N 1 ATOM 10231 C CA . PHE G 1 62 ? 46.123 -3.648 14.829 1.00 74.31 ? 62 PHE E CA 1 ATOM 10232 C C . PHE G 1 62 ? 44.650 -3.562 14.442 1.00 78.22 ? 62 PHE E C 1 ATOM 10233 O O . PHE G 1 62 ? 44.075 -4.539 13.962 1.00 79.63 ? 62 PHE E O 1 ATOM 10234 C CB . PHE G 1 62 ? 47.018 -3.361 13.618 1.00 71.70 ? 62 PHE E CB 1 ATOM 10235 C CG . PHE G 1 62 ? 48.460 -3.089 13.968 1.00 71.70 ? 62 PHE E CG 1 ATOM 10236 C CD1 . PHE G 1 62 ? 49.274 -4.093 14.473 1.00 70.07 ? 62 PHE E CD1 1 ATOM 10237 C CD2 . PHE G 1 62 ? 49.007 -1.831 13.768 1.00 68.96 ? 62 PHE E CD2 1 ATOM 10238 C CE1 . PHE G 1 62 ? 50.602 -3.841 14.787 1.00 67.64 ? 62 PHE E CE1 1 ATOM 10239 C CE2 . PHE G 1 62 ? 50.334 -1.573 14.078 1.00 65.27 ? 62 PHE E CE2 1 ATOM 10240 C CZ . PHE G 1 62 ? 51.131 -2.579 14.587 1.00 63.58 ? 62 PHE E CZ 1 ATOM 10241 N N . SER G 1 63 ? 44.035 -2.405 14.667 1.00 79.69 ? 63 SER E N 1 ATOM 10242 C CA . SER G 1 63 ? 42.638 -2.203 14.292 1.00 78.16 ? 63 SER E CA 1 ATOM 10243 C C . SER G 1 63 ? 42.344 -0.725 14.072 1.00 75.18 ? 63 SER E C 1 ATOM 10244 O O . SER G 1 63 ? 42.998 0.144 14.651 1.00 74.31 ? 63 SER E O 1 ATOM 10245 C CB . SER G 1 63 ? 41.694 -2.772 15.356 1.00 74.21 ? 63 SER E CB 1 ATOM 10246 O OG . SER G 1 63 ? 41.712 -1.983 16.532 1.00 72.31 ? 63 SER E OG 1 ATOM 10247 N N . GLY G 1 64 ? 41.366 -0.449 13.218 1.00 77.26 ? 64 GLY E N 1 ATOM 10248 C CA . GLY G 1 64 ? 40.983 0.917 12.919 1.00 76.92 ? 64 GLY E CA 1 ATOM 10249 C C . GLY G 1 64 ? 39.490 1.138 13.059 1.00 73.51 ? 64 GLY E C 1 ATOM 10250 O O . GLY G 1 64 ? 38.705 0.200 12.932 1.00 81.19 ? 64 GLY E O 1 ATOM 10251 N N . SER G 1 65 ? 39.096 2.381 13.320 1.00 58.63 ? 65 SER E N 1 ATOM 10252 C CA . SER G 1 65 ? 37.688 2.707 13.503 1.00 53.76 ? 65 SER E CA 1 ATOM 10253 C C . SER G 1 65 ? 37.423 4.203 13.390 1.00 50.50 ? 65 SER E C 1 ATOM 10254 O O . SER G 1 65 ? 38.341 5.023 13.463 1.00 45.82 ? 65 SER E O 1 ATOM 10255 C CB . SER G 1 65 ? 37.194 2.207 14.860 1.00 52.89 ? 65 SER E CB 1 ATOM 10256 O OG . SER G 1 65 ? 37.804 2.930 15.913 1.00 59.08 ? 65 SER E OG 1 ATOM 10257 N N . GLY G 1 66 ? 36.152 4.547 13.222 1.00 44.17 ? 66 GLY E N 1 ATOM 10258 C CA . GLY G 1 66 ? 35.746 5.933 13.139 1.00 47.96 ? 66 GLY E CA 1 ATOM 10259 C C . GLY G 1 66 ? 35.405 6.339 11.723 1.00 52.27 ? 66 GLY E C 1 ATOM 10260 O O . GLY G 1 66 ? 35.727 5.634 10.765 1.00 50.38 ? 66 GLY E O 1 ATOM 10261 N N . SER G 1 67 ? 34.752 7.487 11.595 1.00 52.81 ? 67 SER E N 1 ATOM 10262 C CA . SER G 1 67 ? 34.351 8.001 10.297 1.00 51.58 ? 67 SER E CA 1 ATOM 10263 C C . SER G 1 67 ? 34.214 9.518 10.359 1.00 51.11 ? 67 SER E C 1 ATOM 10264 O O . SER G 1 67 ? 34.232 10.108 11.440 1.00 54.06 ? 67 SER E O 1 ATOM 10265 C CB . SER G 1 67 ? 33.038 7.356 9.853 1.00 53.64 ? 67 SER E CB 1 ATOM 10266 O OG . SER G 1 67 ? 32.843 7.509 8.460 1.00 59.51 ? 67 SER E OG 1 ATOM 10267 N N . GLY G 1 68 ? 34.090 10.150 9.199 1.00 45.94 ? 68 GLY E N 1 ATOM 10268 C CA . GLY G 1 68 ? 33.906 11.587 9.146 1.00 47.62 ? 68 GLY E CA 1 ATOM 10269 C C . GLY G 1 68 ? 35.161 12.375 9.470 1.00 47.47 ? 68 GLY E C 1 ATOM 10270 O O . GLY G 1 68 ? 36.023 12.554 8.609 1.00 48.18 ? 68 GLY E O 1 ATOM 10271 N N . THR G 1 69 ? 35.268 12.851 10.709 1.00 42.21 ? 69 THR E N 1 ATOM 10272 C CA . THR G 1 69 ? 36.400 13.691 11.091 1.00 42.46 ? 69 THR E CA 1 ATOM 10273 C C . THR G 1 69 ? 37.278 13.086 12.181 1.00 40.23 ? 69 THR E C 1 ATOM 10274 O O . THR G 1 69 ? 38.315 13.650 12.516 1.00 45.83 ? 69 THR E O 1 ATOM 10275 C CB . THR G 1 69 ? 35.939 15.082 11.582 1.00 45.14 ? 69 THR E CB 1 ATOM 10276 O OG1 . THR G 1 69 ? 35.087 14.934 12.723 1.00 49.06 ? 69 THR E OG1 1 ATOM 10277 C CG2 . THR G 1 69 ? 35.188 15.818 10.491 1.00 45.38 ? 69 THR E CG2 1 ATOM 10278 N N . GLU G 1 70 ? 36.873 11.949 12.737 1.00 39.39 ? 70 GLU E N 1 ATOM 10279 C CA . GLU G 1 70 ? 37.640 11.326 13.816 1.00 38.16 ? 70 GLU E CA 1 ATOM 10280 C C . GLU G 1 70 ? 37.941 9.864 13.533 1.00 38.80 ? 70 GLU E C 1 ATOM 10281 O O . GLU G 1 70 ? 37.029 9.064 13.335 1.00 40.79 ? 70 GLU E O 1 ATOM 10282 C CB . GLU G 1 70 ? 36.892 11.440 15.140 1.00 50.94 ? 70 GLU E CB 1 ATOM 10283 C CG . GLU G 1 70 ? 37.670 10.914 16.330 1.00 66.73 ? 70 GLU E CG 1 ATOM 10284 C CD . GLU G 1 70 ? 38.913 11.733 16.609 1.00 84.63 ? 70 GLU E CD 1 ATOM 10285 O OE1 . GLU G 1 70 ? 38.787 12.964 16.789 1.00 91.76 ? 70 GLU E OE1 1 ATOM 10286 O OE2 . GLU G 1 70 ? 40.017 11.146 16.639 1.00 90.86 ? 70 GLU E OE2 1 ATOM 10287 N N . PHE G 1 71 ? 39.225 9.517 13.528 1.00 39.56 ? 71 PHE E N 1 ATOM 10288 C CA . PHE G 1 71 ? 39.643 8.152 13.234 1.00 34.04 ? 71 PHE E CA 1 ATOM 10289 C C . PHE G 1 71 ? 40.631 7.647 14.263 1.00 35.53 ? 71 PHE E C 1 ATOM 10290 O O . PHE G 1 71 ? 41.422 8.414 14.815 1.00 33.03 ? 71 PHE E O 1 ATOM 10291 C CB . PHE G 1 71 ? 40.259 8.067 11.842 1.00 34.45 ? 71 PHE E CB 1 ATOM 10292 C CG . PHE G 1 71 ? 39.361 8.568 10.760 1.00 35.50 ? 71 PHE E CG 1 ATOM 10293 C CD1 . PHE G 1 71 ? 39.306 9.921 10.460 1.00 33.78 ? 71 PHE E CD1 1 ATOM 10294 C CD2 . PHE G 1 71 ? 38.562 7.687 10.046 1.00 32.18 ? 71 PHE E CD2 1 ATOM 10295 C CE1 . PHE G 1 71 ? 38.466 10.389 9.466 1.00 38.11 ? 71 PHE E CE1 1 ATOM 10296 C CE2 . PHE G 1 71 ? 37.724 8.145 9.049 1.00 37.32 ? 71 PHE E CE2 1 ATOM 10297 C CZ . PHE G 1 71 ? 37.674 9.499 8.758 1.00 38.06 ? 71 PHE E CZ 1 ATOM 10298 N N . THR G 1 72 ? 40.598 6.344 14.503 1.00 41.18 ? 72 THR E N 1 ATOM 10299 C CA . THR G 1 72 ? 41.418 5.753 15.545 1.00 40.59 ? 72 THR E CA 1 ATOM 10300 C C . THR G 1 72 ? 42.189 4.539 15.047 1.00 35.57 ? 72 THR E C 1 ATOM 10301 O O . THR G 1 72 ? 41.620 3.636 14.441 1.00 36.73 ? 72 THR E O 1 ATOM 10302 C CB . THR G 1 72 ? 40.548 5.359 16.757 1.00 44.73 ? 72 THR E CB 1 ATOM 10303 O OG1 . THR G 1 72 ? 40.345 6.511 17.583 1.00 51.94 ? 72 THR E OG1 1 ATOM 10304 C CG2 . THR G 1 72 ? 41.215 4.278 17.583 1.00 49.87 ? 72 THR E CG2 1 ATOM 10305 N N . LEU G 1 73 ? 43.494 4.540 15.288 1.00 37.55 ? 73 LEU E N 1 ATOM 10306 C CA . LEU G 1 73 ? 44.317 3.359 15.073 1.00 34.74 ? 73 LEU E CA 1 ATOM 10307 C C . LEU G 1 73 ? 44.611 2.733 16.428 1.00 37.52 ? 73 LEU E C 1 ATOM 10308 O O . LEU G 1 73 ? 45.082 3.411 17.342 1.00 39.64 ? 73 LEU E O 1 ATOM 10309 C CB . LEU G 1 73 ? 45.618 3.709 14.348 1.00 36.74 ? 73 LEU E CB 1 ATOM 10310 C CG . LEU G 1 73 ? 46.542 2.522 14.057 1.00 40.11 ? 73 LEU E CG 1 ATOM 10311 C CD1 . LEU G 1 73 ? 45.868 1.550 13.102 1.00 41.09 ? 73 LEU E CD1 1 ATOM 10312 C CD2 . LEU G 1 73 ? 47.877 2.985 13.498 1.00 39.24 ? 73 LEU E CD2 1 ATOM 10313 N N . THR G 1 74 ? 44.326 1.444 16.565 1.00 38.05 ? 74 THR E N 1 ATOM 10314 C CA . THR G 1 74 ? 44.507 0.773 17.845 1.00 42.77 ? 74 THR E CA 1 ATOM 10315 C C . THR G 1 74 ? 45.425 -0.438 17.742 1.00 43.31 ? 74 THR E C 1 ATOM 10316 O O . THR G 1 74 ? 45.238 -1.295 16.882 1.00 47.18 ? 74 THR E O 1 ATOM 10317 C CB . THR G 1 74 ? 43.152 0.326 18.432 1.00 47.76 ? 74 THR E CB 1 ATOM 10318 O OG1 . THR G 1 74 ? 42.378 1.480 18.772 1.00 54.95 ? 74 THR E OG1 1 ATOM 10319 C CG2 . THR G 1 74 ? 43.353 -0.516 19.682 1.00 52.13 ? 74 THR E CG2 1 ATOM 10320 N N . ILE G 1 75 ? 46.426 -0.488 18.617 1.00 41.59 ? 75 ILE E N 1 ATOM 10321 C CA . ILE G 1 75 ? 47.252 -1.680 18.790 1.00 45.93 ? 75 ILE E CA 1 ATOM 10322 C C . ILE G 1 75 ? 46.861 -2.364 20.098 1.00 49.38 ? 75 ILE E C 1 ATOM 10323 O O . ILE G 1 75 ? 47.078 -1.813 21.178 1.00 48.30 ? 75 ILE E O 1 ATOM 10324 C CB . ILE G 1 75 ? 48.755 -1.348 18.816 1.00 45.77 ? 75 ILE E CB 1 ATOM 10325 C CG1 . ILE G 1 75 ? 49.154 -0.546 17.576 1.00 47.93 ? 75 ILE E CG1 1 ATOM 10326 C CG2 . ILE G 1 75 ? 49.578 -2.620 18.913 1.00 44.61 ? 75 ILE E CG2 1 ATOM 10327 C CD1 . ILE G 1 75 ? 50.641 -0.203 17.524 1.00 46.44 ? 75 ILE E CD1 1 ATOM 10328 N N . SER G 1 76 ? 46.281 -3.557 20.000 1.00 60.56 ? 76 SER E N 1 ATOM 10329 C CA . SER G 1 76 ? 45.711 -4.231 21.167 1.00 68.25 ? 76 SER E CA 1 ATOM 10330 C C . SER G 1 76 ? 46.765 -4.641 22.195 1.00 71.40 ? 76 SER E C 1 ATOM 10331 O O . SER G 1 76 ? 46.557 -4.484 23.399 1.00 75.72 ? 76 SER E O 1 ATOM 10332 C CB . SER G 1 76 ? 44.913 -5.462 20.730 1.00 77.58 ? 76 SER E CB 1 ATOM 10333 O OG . SER G 1 76 ? 45.753 -6.436 20.137 1.00 81.99 ? 76 SER E OG 1 ATOM 10334 N N . SER G 1 77 ? 47.891 -5.166 21.722 1.00 63.65 ? 77 SER E N 1 ATOM 10335 C CA . SER G 1 77 ? 48.952 -5.628 22.615 1.00 58.99 ? 77 SER E CA 1 ATOM 10336 C C . SER G 1 77 ? 50.331 -5.323 22.036 1.00 53.92 ? 77 SER E C 1 ATOM 10337 O O . SER G 1 77 ? 50.895 -6.131 21.304 1.00 60.86 ? 77 SER E O 1 ATOM 10338 C CB . SER G 1 77 ? 48.809 -7.131 22.883 1.00 55.32 ? 77 SER E CB 1 ATOM 10339 O OG . SER G 1 77 ? 49.693 -7.558 23.906 1.00 54.68 ? 77 SER E OG 1 ATOM 10340 N N . LEU G 1 78 ? 50.869 -4.158 22.386 1.00 42.16 ? 78 LEU E N 1 ATOM 10341 C CA . LEU G 1 78 ? 52.135 -3.670 21.838 1.00 38.40 ? 78 LEU E CA 1 ATOM 10342 C C . LEU G 1 78 ? 53.251 -4.723 21.819 1.00 44.77 ? 78 LEU E C 1 ATOM 10343 O O . LEU G 1 78 ? 53.406 -5.498 22.763 1.00 50.49 ? 78 LEU E O 1 ATOM 10344 C CB . LEU G 1 78 ? 52.598 -2.446 22.632 1.00 43.93 ? 78 LEU E CB 1 ATOM 10345 C CG . LEU G 1 78 ? 53.789 -1.669 22.071 1.00 47.93 ? 78 LEU E CG 1 ATOM 10346 C CD1 . LEU G 1 78 ? 53.507 -1.258 20.640 1.00 45.49 ? 78 LEU E CD1 1 ATOM 10347 C CD2 . LEU G 1 78 ? 54.086 -0.446 22.930 1.00 49.40 ? 78 LEU E CD2 1 ATOM 10348 N N . GLN G 1 79 ? 54.012 -4.750 20.729 1.00 40.98 ? 79 GLN E N 1 ATOM 10349 C CA . GLN G 1 79 ? 55.151 -5.656 20.587 1.00 42.84 ? 79 GLN E CA 1 ATOM 10350 C C . GLN G 1 79 ? 56.408 -4.844 20.273 1.00 44.17 ? 79 GLN E C 1 ATOM 10351 O O . GLN G 1 79 ? 56.303 -3.708 19.817 1.00 48.18 ? 79 GLN E O 1 ATOM 10352 C CB . GLN G 1 79 ? 54.882 -6.696 19.491 1.00 42.55 ? 79 GLN E CB 1 ATOM 10353 C CG . GLN G 1 79 ? 53.747 -7.669 19.810 1.00 53.11 ? 79 GLN E CG 1 ATOM 10354 C CD . GLN G 1 79 ? 54.048 -8.557 21.007 1.00 60.17 ? 79 GLN E CD 1 ATOM 10355 O OE1 . GLN G 1 79 ? 53.181 -8.802 21.850 1.00 62.11 ? 79 GLN E OE1 1 ATOM 10356 N NE2 . GLN G 1 79 ? 55.281 -9.048 21.083 1.00 56.35 ? 79 GLN E NE2 1 ATOM 10357 N N . PRO G 1 80 ? 57.599 -5.412 20.530 1.00 49.69 ? 80 PRO E N 1 ATOM 10358 C CA . PRO G 1 80 ? 58.850 -4.692 20.254 1.00 51.43 ? 80 PRO E CA 1 ATOM 10359 C C . PRO G 1 80 ? 58.969 -4.198 18.812 1.00 50.57 ? 80 PRO E C 1 ATOM 10360 O O . PRO G 1 80 ? 59.492 -3.111 18.573 1.00 49.46 ? 80 PRO E O 1 ATOM 10361 C CB . PRO G 1 80 ? 59.926 -5.743 20.547 1.00 53.04 ? 80 PRO E CB 1 ATOM 10362 C CG . PRO G 1 80 ? 59.305 -6.636 21.550 1.00 51.30 ? 80 PRO E CG 1 ATOM 10363 C CD . PRO G 1 80 ? 57.849 -6.706 21.191 1.00 50.97 ? 80 PRO E CD 1 ATOM 10364 N N . GLU G 1 81 ? 58.473 -4.990 17.870 1.00 50.13 ? 81 GLU E N 1 ATOM 10365 C CA . GLU G 1 81 ? 58.606 -4.684 16.452 1.00 51.52 ? 81 GLU E CA 1 ATOM 10366 C C . GLU G 1 81 ? 57.732 -3.508 16.009 1.00 51.88 ? 81 GLU E C 1 ATOM 10367 O O . GLU G 1 81 ? 57.824 -3.058 14.868 1.00 51.56 ? 81 GLU E O 1 ATOM 10368 C CB . GLU G 1 81 ? 58.256 -5.920 15.621 1.00 64.25 ? 81 GLU E CB 1 ATOM 10369 C CG . GLU G 1 81 ? 58.275 -7.216 16.416 1.00 82.50 ? 81 GLU E CG 1 ATOM 10370 C CD . GLU G 1 81 ? 57.682 -8.384 15.651 1.00 93.73 ? 81 GLU E CD 1 ATOM 10371 O OE1 . GLU G 1 81 ? 58.100 -8.621 14.497 1.00 95.19 ? 81 GLU E OE1 1 ATOM 10372 O OE2 . GLU G 1 81 ? 56.790 -9.061 16.206 1.00 98.83 ? 81 GLU E OE2 1 ATOM 10373 N N . ASP G 1 82 ? 56.891 -3.010 16.911 1.00 48.63 ? 82 ASP E N 1 ATOM 10374 C CA . ASP G 1 82 ? 55.871 -2.035 16.539 1.00 42.38 ? 82 ASP E CA 1 ATOM 10375 C C . ASP G 1 82 ? 56.337 -0.585 16.586 1.00 44.66 ? 82 ASP E C 1 ATOM 10376 O O . ASP G 1 82 ? 55.608 0.309 16.154 1.00 50.39 ? 82 ASP E O 1 ATOM 10377 C CB . ASP G 1 82 ? 54.648 -2.188 17.440 1.00 40.90 ? 82 ASP E CB 1 ATOM 10378 C CG . ASP G 1 82 ? 53.950 -3.514 17.252 1.00 49.01 ? 82 ASP E CG 1 ATOM 10379 O OD1 . ASP G 1 82 ? 54.010 -4.069 16.132 1.00 53.38 ? 82 ASP E OD1 1 ATOM 10380 O OD2 . ASP G 1 82 ? 53.336 -3.999 18.227 1.00 46.67 ? 82 ASP E OD2 1 ATOM 10381 N N . PHE G 1 83 ? 57.531 -0.343 17.116 1.00 37.87 ? 83 PHE E N 1 ATOM 10382 C CA . PHE G 1 83 ? 58.041 1.022 17.185 1.00 36.87 ? 83 PHE E CA 1 ATOM 10383 C C . PHE G 1 83 ? 58.201 1.579 15.777 1.00 31.21 ? 83 PHE E C 1 ATOM 10384 O O . PHE G 1 83 ? 58.722 0.901 14.885 1.00 32.68 ? 83 PHE E O 1 ATOM 10385 C CB . PHE G 1 83 ? 59.372 1.083 17.940 1.00 41.37 ? 83 PHE E CB 1 ATOM 10386 C CG . PHE G 1 83 ? 60.578 0.998 17.053 1.00 46.19 ? 83 PHE E CG 1 ATOM 10387 C CD1 . PHE G 1 83 ? 61.075 -0.231 16.656 1.00 54.50 ? 83 PHE E CD1 1 ATOM 10388 C CD2 . PHE G 1 83 ? 61.213 2.150 16.609 1.00 49.03 ? 83 PHE E CD2 1 ATOM 10389 C CE1 . PHE G 1 83 ? 62.183 -0.311 15.833 1.00 60.87 ? 83 PHE E CE1 1 ATOM 10390 C CE2 . PHE G 1 83 ? 62.316 2.078 15.785 1.00 51.62 ? 83 PHE E CE2 1 ATOM 10391 C CZ . PHE G 1 83 ? 62.804 0.847 15.398 1.00 57.21 ? 83 PHE E CZ 1 ATOM 10392 N N . ALA G 1 84 ? 57.732 2.808 15.590 1.00 31.64 ? 84 ALA E N 1 ATOM 10393 C CA . ALA G 1 84 ? 57.816 3.516 14.315 1.00 29.25 ? 84 ALA E CA 1 ATOM 10394 C C . ALA G 1 84 ? 57.164 4.879 14.441 1.00 33.38 ? 84 ALA E C 1 ATOM 10395 O O . ALA G 1 84 ? 56.791 5.304 15.536 1.00 30.69 ? 84 ALA E O 1 ATOM 10396 C CB . ALA G 1 84 ? 57.142 2.723 13.190 1.00 22.15 ? 84 ALA E CB 1 ATOM 10397 N N . THR G 1 85 ? 57.028 5.556 13.307 1.00 33.15 ? 85 THR E N 1 ATOM 10398 C CA . THR G 1 85 ? 56.186 6.736 13.219 1.00 32.79 ? 85 THR E CA 1 ATOM 10399 C C . THR G 1 85 ? 54.970 6.379 12.374 1.00 31.92 ? 85 THR E C 1 ATOM 10400 O O . THR G 1 85 ? 55.109 5.853 11.268 1.00 28.44 ? 85 THR E O 1 ATOM 10401 C CB . THR G 1 85 ? 56.930 7.936 12.608 1.00 29.70 ? 85 THR E CB 1 ATOM 10402 O OG1 . THR G 1 85 ? 58.037 8.290 13.449 1.00 32.15 ? 85 THR E OG1 1 ATOM 10403 C CG2 . THR G 1 85 ? 55.991 9.132 12.473 1.00 23.60 ? 85 THR E CG2 1 ATOM 10404 N N . TYR G 1 86 ? 53.781 6.634 12.908 1.00 27.23 ? 86 TYR E N 1 ATOM 10405 C CA . TYR G 1 86 ? 52.551 6.303 12.203 1.00 26.23 ? 86 TYR E CA 1 ATOM 10406 C C . TYR G 1 86 ? 51.912 7.551 11.601 1.00 31.41 ? 86 TYR E C 1 ATOM 10407 O O . TYR G 1 86 ? 51.799 8.586 12.259 1.00 33.35 ? 86 TYR E O 1 ATOM 10408 C CB . TYR G 1 86 ? 51.574 5.589 13.142 1.00 26.51 ? 86 TYR E CB 1 ATOM 10409 C CG . TYR G 1 86 ? 52.077 4.240 13.604 1.00 26.86 ? 86 TYR E CG 1 ATOM 10410 C CD1 . TYR G 1 86 ? 52.992 4.138 14.648 1.00 29.16 ? 86 TYR E CD1 1 ATOM 10411 C CD2 . TYR G 1 86 ? 51.653 3.068 12.986 1.00 26.08 ? 86 TYR E CD2 1 ATOM 10412 C CE1 . TYR G 1 86 ? 53.465 2.910 15.071 1.00 30.51 ? 86 TYR E CE1 1 ATOM 10413 C CE2 . TYR G 1 86 ? 52.117 1.827 13.405 1.00 28.95 ? 86 TYR E CE2 1 ATOM 10414 C CZ . TYR G 1 86 ? 53.025 1.756 14.448 1.00 36.44 ? 86 TYR E CZ 1 ATOM 10415 O OH . TYR G 1 86 ? 53.497 0.533 14.868 1.00 37.46 ? 86 TYR E OH 1 ATOM 10416 N N . TYR G 1 87 ? 51.520 7.443 10.335 1.00 28.73 ? 87 TYR E N 1 ATOM 10417 C CA . TYR G 1 87 ? 50.862 8.527 9.613 1.00 27.33 ? 87 TYR E CA 1 ATOM 10418 C C . TYR G 1 87 ? 49.467 8.122 9.178 1.00 27.32 ? 87 TYR E C 1 ATOM 10419 O O . TYR G 1 87 ? 49.275 7.019 8.665 1.00 28.78 ? 87 TYR E O 1 ATOM 10420 C CB . TYR G 1 87 ? 51.657 8.925 8.364 1.00 25.23 ? 87 TYR E CB 1 ATOM 10421 C CG . TYR G 1 87 ? 53.002 9.552 8.624 1.00 30.09 ? 87 TYR E CG 1 ATOM 10422 C CD1 . TYR G 1 87 ? 54.145 8.769 8.731 1.00 26.29 ? 87 TYR E CD1 1 ATOM 10423 C CD2 . TYR G 1 87 ? 53.133 10.933 8.742 1.00 32.24 ? 87 TYR E CD2 1 ATOM 10424 C CE1 . TYR G 1 87 ? 55.376 9.338 8.963 1.00 31.72 ? 87 TYR E CE1 1 ATOM 10425 C CE2 . TYR G 1 87 ? 54.361 11.513 8.974 1.00 31.18 ? 87 TYR E CE2 1 ATOM 10426 C CZ . TYR G 1 87 ? 55.479 10.711 9.085 1.00 35.73 ? 87 TYR E CZ 1 ATOM 10427 O OH . TYR G 1 87 ? 56.705 11.280 9.314 1.00 40.14 ? 87 TYR E OH 1 ATOM 10428 N N . CYS G 1 88 ? 48.495 9.010 9.357 1.00 23.80 ? 88 CYS E N 1 ATOM 10429 C CA . CYS G 1 88 ? 47.209 8.830 8.696 1.00 21.02 ? 88 CYS E CA 1 ATOM 10430 C C . CYS G 1 88 ? 47.241 9.621 7.393 1.00 27.54 ? 88 CYS E C 1 ATOM 10431 O O . CYS G 1 88 ? 48.035 10.560 7.251 1.00 24.82 ? 88 CYS E O 1 ATOM 10432 C CB . CYS G 1 88 ? 46.048 9.278 9.588 1.00 25.81 ? 88 CYS E CB 1 ATOM 10433 S SG . CYS G 1 88 ? 46.123 11.013 10.108 1.00 35.23 ? 88 CYS E SG 1 ATOM 10434 N N . GLN G 1 89 ? 46.401 9.234 6.436 1.00 27.84 ? 89 GLN E N 1 ATOM 10435 C CA . GLN G 1 89 ? 46.383 9.898 5.137 1.00 22.01 ? 89 GLN E CA 1 ATOM 10436 C C . GLN G 1 89 ? 44.981 10.011 4.548 1.00 26.43 ? 89 GLN E C 1 ATOM 10437 O O . GLN G 1 89 ? 44.210 9.050 4.553 1.00 28.42 ? 89 GLN E O 1 ATOM 10438 C CB . GLN G 1 89 ? 47.284 9.167 4.133 1.00 15.23 ? 89 GLN E CB 1 ATOM 10439 C CG . GLN G 1 89 ? 47.460 9.958 2.829 1.00 24.87 ? 89 GLN E CG 1 ATOM 10440 C CD . GLN G 1 89 ? 47.861 9.100 1.642 1.00 27.08 ? 89 GLN E CD 1 ATOM 10441 O OE1 . GLN G 1 89 ? 47.874 7.873 1.723 1.00 24.42 ? 89 GLN E OE1 1 ATOM 10442 N NE2 . GLN G 1 89 ? 48.189 9.748 0.528 1.00 23.00 ? 89 GLN E NE2 1 ATOM 10443 N N . HIS G 1 90 ? 44.668 11.195 4.033 1.00 19.96 ? 90 HIS E N 1 ATOM 10444 C CA . HIS G 1 90 ? 43.465 11.411 3.242 1.00 25.32 ? 90 HIS E CA 1 ATOM 10445 C C . HIS G 1 90 ? 43.661 10.727 1.896 1.00 26.38 ? 90 HIS E C 1 ATOM 10446 O O . HIS G 1 90 ? 44.711 10.868 1.276 1.00 32.22 ? 90 HIS E O 1 ATOM 10447 C CB . HIS G 1 90 ? 43.201 12.911 3.073 1.00 29.88 ? 90 HIS E CB 1 ATOM 10448 C CG . HIS G 1 90 ? 41.863 13.235 2.486 1.00 34.51 ? 90 HIS E CG 1 ATOM 10449 N ND1 . HIS G 1 90 ? 41.582 14.457 1.910 1.00 36.53 ? 90 HIS E ND1 1 ATOM 10450 C CD2 . HIS G 1 90 ? 40.726 12.507 2.393 1.00 34.91 ? 90 HIS E CD2 1 ATOM 10451 C CE1 . HIS G 1 90 ? 40.334 14.464 1.482 1.00 36.86 ? 90 HIS E CE1 1 ATOM 10452 N NE2 . HIS G 1 90 ? 39.790 13.293 1.764 1.00 38.60 ? 90 HIS E NE2 1 ATOM 10453 N N . LEU G 1 91 ? 42.670 9.972 1.441 1.00 27.87 ? 91 LEU E N 1 ATOM 10454 C CA . LEU G 1 91 ? 42.865 9.155 0.249 1.00 27.28 ? 91 LEU E CA 1 ATOM 10455 C C . LEU G 1 91 ? 42.343 9.824 -1.024 1.00 26.11 ? 91 LEU E C 1 ATOM 10456 O O . LEU G 1 91 ? 42.579 9.335 -2.127 1.00 22.55 ? 91 LEU E O 1 ATOM 10457 C CB . LEU G 1 91 ? 42.221 7.780 0.449 1.00 27.89 ? 91 LEU E CB 1 ATOM 10458 C CG . LEU G 1 91 ? 43.018 6.906 1.428 1.00 31.09 ? 91 LEU E CG 1 ATOM 10459 C CD1 . LEU G 1 91 ? 42.387 5.532 1.635 1.00 21.05 ? 91 LEU E CD1 1 ATOM 10460 C CD2 . LEU G 1 91 ? 44.464 6.769 0.953 1.00 29.69 ? 91 LEU E CD2 1 ATOM 10461 N N . ILE G 1 92 ? 41.644 10.945 -0.874 1.00 22.63 ? 92 ILE E N 1 ATOM 10462 C CA . ILE G 1 92 ? 41.329 11.797 -2.022 1.00 28.53 ? 92 ILE E CA 1 ATOM 10463 C C . ILE G 1 92 ? 41.697 13.246 -1.725 1.00 27.15 ? 92 ILE E C 1 ATOM 10464 O O . ILE G 1 92 ? 42.433 13.526 -0.780 1.00 25.84 ? 92 ILE E O 1 ATOM 10465 C CB . ILE G 1 92 ? 39.838 11.724 -2.425 1.00 29.76 ? 92 ILE E CB 1 ATOM 10466 C CG1 . ILE G 1 92 ? 38.937 12.054 -1.236 1.00 27.02 ? 92 ILE E CG1 1 ATOM 10467 C CG2 . ILE G 1 92 ? 39.506 10.359 -2.996 1.00 33.51 ? 92 ILE E CG2 1 ATOM 10468 C CD1 . ILE G 1 92 ? 37.464 11.941 -1.549 1.00 38.24 ? 92 ILE E CD1 1 ATOM 10469 N N . GLY G 1 93 ? 41.183 14.167 -2.533 1.00 31.50 ? 93 GLY E N 1 ATOM 10470 C CA . GLY G 1 93 ? 41.513 15.573 -2.380 1.00 27.06 ? 93 GLY E CA 1 ATOM 10471 C C . GLY G 1 93 ? 42.980 15.804 -2.685 1.00 27.57 ? 93 GLY E C 1 ATOM 10472 O O . GLY G 1 93 ? 43.473 15.402 -3.738 1.00 31.93 ? 93 GLY E O 1 ATOM 10473 N N . LEU G 1 94 ? 43.687 16.444 -1.762 1.00 25.39 ? 94 LEU E N 1 ATOM 10474 C CA . LEU G 1 94 ? 45.117 16.664 -1.942 1.00 29.12 ? 94 LEU E CA 1 ATOM 10475 C C . LEU G 1 94 ? 45.921 15.501 -1.372 1.00 31.00 ? 94 LEU E C 1 ATOM 10476 O O . LEU G 1 94 ? 47.154 15.528 -1.378 1.00 30.79 ? 94 LEU E O 1 ATOM 10477 C CB . LEU G 1 94 ? 45.553 17.978 -1.296 1.00 26.82 ? 94 LEU E CB 1 ATOM 10478 C CG . LEU G 1 94 ? 45.042 19.264 -1.950 1.00 36.04 ? 94 LEU E CG 1 ATOM 10479 C CD1 . LEU G 1 94 ? 45.921 20.441 -1.552 1.00 38.33 ? 94 LEU E CD1 1 ATOM 10480 C CD2 . LEU G 1 94 ? 44.962 19.127 -3.466 1.00 33.73 ? 94 LEU E CD2 1 ATOM 10481 N N . ARG G 1 95 ? 45.213 14.482 -0.890 1.00 28.96 ? 96 ARG E N 1 ATOM 10482 C CA . ARG G 1 95 ? 45.847 13.267 -0.393 1.00 27.53 ? 96 ARG E CA 1 ATOM 10483 C C . ARG G 1 95 ? 46.862 13.564 0.704 1.00 26.32 ? 96 ARG E C 1 ATOM 10484 O O . ARG G 1 95 ? 47.918 12.938 0.761 1.00 26.30 ? 96 ARG E O 1 ATOM 10485 C CB . ARG G 1 95 ? 46.531 12.513 -1.542 1.00 31.45 ? 96 ARG E CB 1 ATOM 10486 C CG . ARG G 1 95 ? 45.629 11.568 -2.313 1.00 35.02 ? 96 ARG E CG 1 ATOM 10487 C CD . ARG G 1 95 ? 45.653 11.856 -3.802 1.00 30.20 ? 96 ARG E CD 1 ATOM 10488 N NE . ARG G 1 95 ? 44.502 12.650 -4.203 1.00 43.77 ? 96 ARG E NE 1 ATOM 10489 C CZ . ARG G 1 95 ? 43.658 12.318 -5.175 1.00 42.03 ? 96 ARG E CZ 1 ATOM 10490 N NH1 . ARG G 1 95 ? 43.834 11.203 -5.871 1.00 38.52 ? 96 ARG E NH1 1 ATOM 10491 N NH2 . ARG G 1 95 ? 42.639 13.115 -5.454 1.00 37.52 ? 96 ARG E NH2 1 ATOM 10492 N N . SER G 1 96 ? 46.542 14.516 1.574 1.00 24.99 ? 97 SER E N 1 ATOM 10493 C CA . SER G 1 96 ? 47.509 14.988 2.559 1.00 32.34 ? 97 SER E CA 1 ATOM 10494 C C . SER G 1 96 ? 47.662 14.011 3.719 1.00 33.28 ? 97 SER E C 1 ATOM 10495 O O . SER G 1 96 ? 46.809 13.148 3.934 1.00 30.15 ? 97 SER E O 1 ATOM 10496 C CB . SER G 1 96 ? 47.109 16.371 3.083 1.00 33.89 ? 97 SER E CB 1 ATOM 10497 O OG . SER G 1 96 ? 45.883 16.316 3.788 1.00 36.66 ? 97 SER E OG 1 ATOM 10498 N N . PHE G 1 97 ? 48.763 14.154 4.453 1.00 28.53 ? 98 PHE E N 1 ATOM 10499 C CA . PHE G 1 97 ? 49.070 13.293 5.588 1.00 27.17 ? 98 PHE E CA 1 ATOM 10500 C C . PHE G 1 97 ? 48.963 14.048 6.912 1.00 30.02 ? 98 PHE E C 1 ATOM 10501 O O . PHE G 1 97 ? 49.062 15.273 6.944 1.00 34.27 ? 98 PHE E O 1 ATOM 10502 C CB . PHE G 1 97 ? 50.485 12.716 5.462 1.00 24.42 ? 98 PHE E CB 1 ATOM 10503 C CG . PHE G 1 97 ? 50.656 11.727 4.338 1.00 24.52 ? 98 PHE E CG 1 ATOM 10504 C CD1 . PHE G 1 97 ? 50.789 12.157 3.027 1.00 21.82 ? 98 PHE E CD1 1 ATOM 10505 C CD2 . PHE G 1 97 ? 50.720 10.368 4.601 1.00 21.99 ? 98 PHE E CD2 1 ATOM 10506 C CE1 . PHE G 1 97 ? 50.960 11.252 1.998 1.00 23.12 ? 98 PHE E CE1 1 ATOM 10507 C CE2 . PHE G 1 97 ? 50.893 9.451 3.573 1.00 25.88 ? 98 PHE E CE2 1 ATOM 10508 C CZ . PHE G 1 97 ? 51.017 9.895 2.270 1.00 23.20 ? 98 PHE E CZ 1 ATOM 10509 N N . GLY G 1 98 ? 48.781 13.312 8.004 1.00 27.18 ? 99 GLY E N 1 ATOM 10510 C CA . GLY G 1 98 ? 48.927 13.878 9.334 1.00 27.71 ? 99 GLY E CA 1 ATOM 10511 C C . GLY G 1 98 ? 50.394 14.145 9.624 1.00 27.72 ? 99 GLY E C 1 ATOM 10512 O O . GLY G 1 98 ? 51.253 13.790 8.819 1.00 31.52 ? 99 GLY E O 1 ATOM 10513 N N . GLN G 1 99 ? 50.694 14.760 10.766 1.00 33.07 ? 100 GLN E N 1 ATOM 10514 C CA . GLN G 1 99 ? 52.076 15.122 11.087 1.00 32.10 ? 100 GLN E CA 1 ATOM 10515 C C . GLN G 1 99 ? 52.874 13.922 11.589 1.00 37.66 ? 100 GLN E C 1 ATOM 10516 O O . GLN G 1 99 ? 54.100 13.979 11.691 1.00 38.06 ? 100 GLN E O 1 ATOM 10517 C CB . GLN G 1 99 ? 52.124 16.248 12.127 1.00 29.00 ? 100 GLN E CB 1 ATOM 10518 C CG . GLN G 1 99 ? 51.979 15.792 13.573 1.00 31.29 ? 100 GLN E CG 1 ATOM 10519 C CD . GLN G 1 99 ? 50.533 15.595 13.981 1.00 36.81 ? 100 GLN E CD 1 ATOM 10520 O OE1 . GLN G 1 99 ? 49.634 15.592 13.141 1.00 41.55 ? 100 GLN E OE1 1 ATOM 10521 N NE2 . GLN G 1 99 ? 50.300 15.434 15.279 1.00 38.54 ? 100 GLN E NE2 1 ATOM 10522 N N . GLY G 1 100 ? 52.179 12.835 11.903 1.00 34.70 ? 101 GLY E N 1 ATOM 10523 C CA . GLY G 1 100 ? 52.846 11.616 12.319 1.00 30.88 ? 101 GLY E CA 1 ATOM 10524 C C . GLY G 1 100 ? 52.884 11.438 13.823 1.00 37.99 ? 101 GLY E C 1 ATOM 10525 O O . GLY G 1 100 ? 52.984 12.407 14.577 1.00 44.08 ? 101 GLY E O 1 ATOM 10526 N N . THR G 1 101 ? 52.793 10.189 14.262 1.00 36.61 ? 102 THR E N 1 ATOM 10527 C CA . THR G 1 101 ? 52.866 9.871 15.678 1.00 33.64 ? 102 THR E CA 1 ATOM 10528 C C . THR G 1 101 ? 54.002 8.897 15.941 1.00 38.55 ? 102 THR E C 1 ATOM 10529 O O . THR G 1 101 ? 53.969 7.757 15.476 1.00 38.87 ? 102 THR E O 1 ATOM 10530 C CB . THR G 1 101 ? 51.557 9.264 16.191 1.00 31.13 ? 102 THR E CB 1 ATOM 10531 O OG1 . THR G 1 101 ? 50.515 10.238 16.104 1.00 32.11 ? 102 THR E OG1 1 ATOM 10532 C CG2 . THR G 1 101 ? 51.709 8.820 17.642 1.00 32.62 ? 102 THR E CG2 1 ATOM 10533 N N . LYS G 1 102 ? 55.011 9.347 16.680 1.00 39.48 ? 103 LYS E N 1 ATOM 10534 C CA . LYS G 1 102 ? 56.132 8.481 17.010 1.00 38.91 ? 103 LYS E CA 1 ATOM 10535 C C . LYS G 1 102 ? 55.786 7.590 18.198 1.00 35.66 ? 103 LYS E C 1 ATOM 10536 O O . LYS G 1 102 ? 55.435 8.073 19.275 1.00 35.12 ? 103 LYS E O 1 ATOM 10537 C CB . LYS G 1 102 ? 57.392 9.297 17.308 1.00 42.00 ? 103 LYS E CB 1 ATOM 10538 C CG . LYS G 1 102 ? 58.637 8.432 17.438 1.00 47.89 ? 103 LYS E CG 1 ATOM 10539 C CD . LYS G 1 102 ? 59.908 9.254 17.534 1.00 58.67 ? 103 LYS E CD 1 ATOM 10540 C CE . LYS G 1 102 ? 61.117 8.341 17.703 1.00 66.28 ? 103 LYS E CE 1 ATOM 10541 N NZ . LYS G 1 102 ? 62.402 9.086 17.814 1.00 73.83 ? 103 LYS E NZ 1 ATOM 10542 N N . LEU G 1 103 ? 55.875 6.283 17.992 1.00 31.97 ? 104 LEU E N 1 ATOM 10543 C CA . LEU G 1 103 ? 55.616 5.329 19.061 1.00 33.51 ? 104 LEU E CA 1 ATOM 10544 C C . LEU G 1 103 ? 56.928 4.736 19.552 1.00 37.77 ? 104 LEU E C 1 ATOM 10545 O O . LEU G 1 103 ? 57.738 4.260 18.754 1.00 45.32 ? 104 LEU E O 1 ATOM 10546 C CB . LEU G 1 103 ? 54.669 4.227 18.583 1.00 39.71 ? 104 LEU E CB 1 ATOM 10547 C CG . LEU G 1 103 ? 54.344 3.102 19.569 1.00 45.92 ? 104 LEU E CG 1 ATOM 10548 C CD1 . LEU G 1 103 ? 53.745 3.658 20.850 1.00 43.69 ? 104 LEU E CD1 1 ATOM 10549 C CD2 . LEU G 1 103 ? 53.399 2.098 18.928 1.00 47.62 ? 104 LEU E CD2 1 ATOM 10550 N N . GLU G 1 104 ? 57.141 4.782 20.863 1.00 42.44 ? 105 GLU E N 1 ATOM 10551 C CA . GLU G 1 104 ? 58.355 4.238 21.468 1.00 45.42 ? 105 GLU E CA 1 ATOM 10552 C C . GLU G 1 104 ? 58.012 3.115 22.439 1.00 44.97 ? 105 GLU E C 1 ATOM 10553 O O . GLU G 1 104 ? 57.009 3.184 23.145 1.00 46.19 ? 105 GLU E O 1 ATOM 10554 C CB . GLU G 1 104 ? 59.142 5.331 22.197 1.00 50.79 ? 105 GLU E CB 1 ATOM 10555 C CG . GLU G 1 104 ? 60.428 4.831 22.846 1.00 65.46 ? 105 GLU E CG 1 ATOM 10556 C CD . GLU G 1 104 ? 60.799 5.600 24.101 1.00 78.38 ? 105 GLU E CD 1 ATOM 10557 O OE1 . GLU G 1 104 ? 61.350 6.715 23.978 1.00 84.97 ? 105 GLU E OE1 1 ATOM 10558 O OE2 . GLU G 1 104 ? 60.538 5.086 25.211 1.00 78.05 ? 105 GLU E OE2 1 ATOM 10559 N N . ILE G 1 105 ? 58.847 2.082 22.476 1.00 44.08 ? 106 ILE E N 1 ATOM 10560 C CA . ILE G 1 105 ? 58.637 0.978 23.399 1.00 44.14 ? 106 ILE E CA 1 ATOM 10561 C C . ILE G 1 105 ? 59.270 1.273 24.757 1.00 52.24 ? 106 ILE E C 1 ATOM 10562 O O . ILE G 1 105 ? 60.431 1.676 24.836 1.00 58.03 ? 106 ILE E O 1 ATOM 10563 C CB . ILE G 1 105 ? 59.212 -0.331 22.843 1.00 43.06 ? 106 ILE E CB 1 ATOM 10564 C CG1 . ILE G 1 105 ? 58.791 -0.522 21.384 1.00 40.79 ? 106 ILE E CG1 1 ATOM 10565 C CG2 . ILE G 1 105 ? 58.775 -1.508 23.696 1.00 45.86 ? 106 ILE E CG2 1 ATOM 10566 C CD1 . ILE G 1 105 ? 57.296 -0.536 21.176 1.00 42.04 ? 106 ILE E CD1 1 ATOM 10567 N N . LYS G 1 106 ? 58.497 1.084 25.822 1.00 54.96 ? 107 LYS E N 1 ATOM 10568 C CA . LYS G 1 106 ? 59.010 1.245 27.178 1.00 61.79 ? 107 LYS E CA 1 ATOM 10569 C C . LYS G 1 106 ? 59.454 -0.108 27.731 1.00 66.87 ? 107 LYS E C 1 ATOM 10570 O O . LYS G 1 106 ? 58.771 -1.117 27.547 1.00 60.90 ? 107 LYS E O 1 ATOM 10571 C CB . LYS G 1 106 ? 57.950 1.872 28.090 1.00 64.67 ? 107 LYS E CB 1 ATOM 10572 C CG . LYS G 1 106 ? 58.514 2.527 29.343 1.00 70.47 ? 107 LYS E CG 1 ATOM 10573 C CD . LYS G 1 106 ? 57.447 2.700 30.419 1.00 75.15 ? 107 LYS E CD 1 ATOM 10574 C CE . LYS G 1 106 ? 56.244 3.468 29.899 1.00 77.05 ? 107 LYS E CE 1 ATOM 10575 N NZ . LYS G 1 106 ? 56.603 4.846 29.469 1.00 75.83 ? 107 LYS E NZ 1 ATOM 10576 N N . ARG G 1 107 ? 60.602 -0.129 28.400 1.00 50.43 ? 108 ARG E N 1 ATOM 10577 C CA . ARG G 1 107 ? 61.128 -1.362 28.976 1.00 52.44 ? 108 ARG E CA 1 ATOM 10578 C C . ARG G 1 107 ? 61.926 -1.091 30.250 1.00 52.20 ? 108 ARG E C 1 ATOM 10579 O O . ARG G 1 107 ? 62.097 0.061 30.658 1.00 56.75 ? 108 ARG E O 1 ATOM 10580 C CB . ARG G 1 107 ? 62.005 -2.099 27.962 1.00 52.39 ? 108 ARG E CB 1 ATOM 10581 C CG . ARG G 1 107 ? 63.222 -1.305 27.510 1.00 57.36 ? 108 ARG E CG 1 ATOM 10582 C CD . ARG G 1 107 ? 64.387 -2.224 27.178 1.00 58.28 ? 108 ARG E CD 1 ATOM 10583 N NE . ARG G 1 107 ? 64.904 -2.910 28.359 1.00 57.10 ? 108 ARG E NE 1 ATOM 10584 C CZ . ARG G 1 107 ? 65.722 -3.955 28.316 1.00 61.27 ? 108 ARG E CZ 1 ATOM 10585 N NH1 . ARG G 1 107 ? 66.111 -4.444 27.147 1.00 63.00 ? 108 ARG E NH1 1 ATOM 10586 N NH2 . ARG G 1 107 ? 66.145 -4.518 29.439 1.00 66.04 ? 108 ARG E NH2 1 ATOM 10587 N N . THR G 1 108 ? 62.417 -2.158 30.872 1.00 92.47 ? 109 THR E N 1 ATOM 10588 C CA . THR G 1 108 ? 63.203 -2.031 32.092 1.00 86.01 ? 109 THR E CA 1 ATOM 10589 C C . THR G 1 108 ? 64.553 -1.384 31.805 1.00 86.18 ? 109 THR E C 1 ATOM 10590 O O . THR G 1 108 ? 65.141 -1.597 30.744 1.00 87.93 ? 109 THR E O 1 ATOM 10591 C CB . THR G 1 108 ? 63.426 -3.395 32.770 1.00 78.11 ? 109 THR E CB 1 ATOM 10592 O OG1 . THR G 1 108 ? 64.101 -4.280 31.867 1.00 77.50 ? 109 THR E OG1 1 ATOM 10593 C CG2 . THR G 1 108 ? 62.096 -4.009 33.178 1.00 70.85 ? 109 THR E CG2 1 ATOM 10594 N N . VAL G 1 109 ? 65.031 -0.595 32.762 1.00 86.12 ? 110 VAL E N 1 ATOM 10595 C CA . VAL G 1 109 ? 66.294 0.123 32.632 1.00 79.62 ? 110 VAL E CA 1 ATOM 10596 C C . VAL G 1 109 ? 67.466 -0.813 32.350 1.00 76.12 ? 110 VAL E C 1 ATOM 10597 O O . VAL G 1 109 ? 67.712 -1.757 33.099 1.00 76.25 ? 110 VAL E O 1 ATOM 10598 C CB . VAL G 1 109 ? 66.603 0.934 33.903 1.00 78.64 ? 110 VAL E CB 1 ATOM 10599 C CG1 . VAL G 1 109 ? 67.878 1.732 33.720 1.00 79.01 ? 110 VAL E CG1 1 ATOM 10600 C CG2 . VAL G 1 109 ? 65.439 1.850 34.239 1.00 76.24 ? 110 VAL E CG2 1 ATOM 10601 N N . ALA G 1 110 ? 68.179 -0.546 31.260 1.00 75.39 ? 111 ALA E N 1 ATOM 10602 C CA . ALA G 1 110 ? 69.364 -1.316 30.901 1.00 74.58 ? 111 ALA E CA 1 ATOM 10603 C C . ALA G 1 110 ? 70.597 -0.416 30.870 1.00 71.73 ? 111 ALA E C 1 ATOM 10604 O O . ALA G 1 110 ? 70.559 0.687 30.322 1.00 66.19 ? 111 ALA E O 1 ATOM 10605 C CB . ALA G 1 110 ? 69.171 -2.005 29.558 1.00 71.31 ? 111 ALA E CB 1 ATOM 10606 N N . ALA G 1 111 ? 71.686 -0.896 31.465 1.00 71.48 ? 112 ALA E N 1 ATOM 10607 C CA . ALA G 1 111 ? 72.912 -0.115 31.603 1.00 76.49 ? 112 ALA E CA 1 ATOM 10608 C C . ALA G 1 111 ? 73.774 -0.170 30.341 1.00 78.23 ? 112 ALA E C 1 ATOM 10609 O O . ALA G 1 111 ? 73.804 -1.190 29.650 1.00 77.33 ? 112 ALA E O 1 ATOM 10610 C CB . ALA G 1 111 ? 73.709 -0.603 32.811 1.00 78.88 ? 112 ALA E CB 1 ATOM 10611 N N . PRO G 1 112 ? 74.484 0.932 30.043 1.00 78.57 ? 113 PRO E N 1 ATOM 10612 C CA . PRO G 1 112 ? 75.321 1.035 28.842 1.00 74.34 ? 113 PRO E CA 1 ATOM 10613 C C . PRO G 1 112 ? 76.664 0.324 28.972 1.00 70.25 ? 113 PRO E C 1 ATOM 10614 O O . PRO G 1 112 ? 77.330 0.464 29.993 1.00 67.82 ? 113 PRO E O 1 ATOM 10615 C CB . PRO G 1 112 ? 75.546 2.549 28.693 1.00 74.58 ? 113 PRO E CB 1 ATOM 10616 C CG . PRO G 1 112 ? 74.639 3.206 29.704 1.00 75.07 ? 113 PRO E CG 1 ATOM 10617 C CD . PRO G 1 112 ? 74.445 2.202 30.784 1.00 77.20 ? 113 PRO E CD 1 ATOM 10618 N N . SER G 1 113 ? 77.052 -0.425 27.944 1.00 75.77 ? 114 SER E N 1 ATOM 10619 C CA . SER G 1 113 ? 78.408 -0.954 27.857 1.00 75.86 ? 114 SER E CA 1 ATOM 10620 C C . SER G 1 113 ? 79.299 0.097 27.203 1.00 74.26 ? 114 SER E C 1 ATOM 10621 O O . SER G 1 113 ? 79.205 0.333 25.996 1.00 71.75 ? 114 SER E O 1 ATOM 10622 C CB . SER G 1 113 ? 78.442 -2.262 27.063 1.00 73.55 ? 114 SER E CB 1 ATOM 10623 O OG . SER G 1 113 ? 77.608 -3.243 27.653 1.00 75.43 ? 114 SER E OG 1 ATOM 10624 N N . VAL G 1 114 ? 80.156 0.729 28.003 1.00 69.87 ? 115 VAL E N 1 ATOM 10625 C CA . VAL G 1 114 ? 80.944 1.866 27.537 1.00 64.43 ? 115 VAL E CA 1 ATOM 10626 C C . VAL G 1 114 ? 82.300 1.471 26.958 1.00 66.25 ? 115 VAL E C 1 ATOM 10627 O O . VAL G 1 114 ? 83.122 0.857 27.637 1.00 70.22 ? 115 VAL E O 1 ATOM 10628 C CB . VAL G 1 114 ? 81.189 2.874 28.666 1.00 67.14 ? 115 VAL E CB 1 ATOM 10629 C CG1 . VAL G 1 114 ? 81.702 4.185 28.089 1.00 62.45 ? 115 VAL E CG1 1 ATOM 10630 C CG2 . VAL G 1 114 ? 79.915 3.098 29.461 1.00 70.70 ? 115 VAL E CG2 1 ATOM 10631 N N . PHE G 1 115 ? 82.524 1.842 25.701 1.00 65.48 ? 116 PHE E N 1 ATOM 10632 C CA . PHE G 1 115 ? 83.797 1.604 25.030 1.00 65.58 ? 116 PHE E CA 1 ATOM 10633 C C . PHE G 1 115 ? 84.451 2.921 24.634 1.00 65.79 ? 116 PHE E C 1 ATOM 10634 O O . PHE G 1 115 ? 83.798 3.961 24.607 1.00 67.69 ? 116 PHE E O 1 ATOM 10635 C CB . PHE G 1 115 ? 83.604 0.736 23.789 1.00 62.20 ? 116 PHE E CB 1 ATOM 10636 C CG . PHE G 1 115 ? 82.939 -0.579 24.061 1.00 67.33 ? 116 PHE E CG 1 ATOM 10637 C CD1 . PHE G 1 115 ? 81.559 -0.690 24.034 1.00 69.31 ? 116 PHE E CD1 1 ATOM 10638 C CD2 . PHE G 1 115 ? 83.690 -1.708 24.327 1.00 69.28 ? 116 PHE E CD2 1 ATOM 10639 C CE1 . PHE G 1 115 ? 80.939 -1.902 24.277 1.00 68.15 ? 116 PHE E CE1 1 ATOM 10640 C CE2 . PHE G 1 115 ? 83.073 -2.922 24.570 1.00 71.47 ? 116 PHE E CE2 1 ATOM 10641 C CZ . PHE G 1 115 ? 81.698 -3.018 24.544 1.00 68.77 ? 116 PHE E CZ 1 ATOM 10642 N N . ILE G 1 116 ? 85.741 2.871 24.324 1.00 64.96 ? 117 ILE E N 1 ATOM 10643 C CA . ILE G 1 116 ? 86.449 4.052 23.848 1.00 61.15 ? 117 ILE E CA 1 ATOM 10644 C C . ILE G 1 116 ? 87.456 3.664 22.765 1.00 59.85 ? 117 ILE E C 1 ATOM 10645 O O . ILE G 1 116 ? 88.086 2.607 22.833 1.00 61.25 ? 117 ILE E O 1 ATOM 10646 C CB . ILE G 1 116 ? 87.157 4.794 25.009 1.00 65.67 ? 117 ILE E CB 1 ATOM 10647 C CG1 . ILE G 1 116 ? 87.662 6.163 24.547 1.00 62.09 ? 117 ILE E CG1 1 ATOM 10648 C CG2 . ILE G 1 116 ? 88.284 3.950 25.599 1.00 68.26 ? 117 ILE E CG2 1 ATOM 10649 C CD1 . ILE G 1 116 ? 88.149 7.045 25.674 1.00 60.37 ? 117 ILE E CD1 1 ATOM 10650 N N . PHE G 1 117 ? 87.580 4.511 21.749 1.00 58.70 ? 118 PHE E N 1 ATOM 10651 C CA . PHE G 1 117 ? 88.494 4.245 20.645 1.00 56.51 ? 118 PHE E CA 1 ATOM 10652 C C . PHE G 1 117 ? 89.414 5.428 20.396 1.00 61.08 ? 118 PHE E C 1 ATOM 10653 O O . PHE G 1 117 ? 88.949 6.558 20.238 1.00 60.80 ? 118 PHE E O 1 ATOM 10654 C CB . PHE G 1 117 ? 87.728 3.928 19.359 1.00 49.26 ? 118 PHE E CB 1 ATOM 10655 C CG . PHE G 1 117 ? 86.762 2.788 19.484 1.00 55.96 ? 118 PHE E CG 1 ATOM 10656 C CD1 . PHE G 1 117 ? 87.172 1.486 19.247 1.00 54.36 ? 118 PHE E CD1 1 ATOM 10657 C CD2 . PHE G 1 117 ? 85.436 3.020 19.814 1.00 58.80 ? 118 PHE E CD2 1 ATOM 10658 C CE1 . PHE G 1 117 ? 86.281 0.433 19.353 1.00 57.62 ? 118 PHE E CE1 1 ATOM 10659 C CE2 . PHE G 1 117 ? 84.539 1.973 19.920 1.00 61.72 ? 118 PHE E CE2 1 ATOM 10660 C CZ . PHE G 1 117 ? 84.961 0.678 19.690 1.00 61.14 ? 118 PHE E CZ 1 ATOM 10661 N N . PRO G 1 118 ? 90.727 5.169 20.358 1.00 67.37 ? 119 PRO E N 1 ATOM 10662 C CA . PRO G 1 118 ? 91.715 6.188 19.994 1.00 63.05 ? 119 PRO E CA 1 ATOM 10663 C C . PRO G 1 118 ? 91.704 6.437 18.491 1.00 58.49 ? 119 PRO E C 1 ATOM 10664 O O . PRO G 1 118 ? 91.235 5.579 17.742 1.00 50.94 ? 119 PRO E O 1 ATOM 10665 C CB . PRO G 1 118 ? 93.050 5.568 20.437 1.00 61.82 ? 119 PRO E CB 1 ATOM 10666 C CG . PRO G 1 118 ? 92.685 4.381 21.290 1.00 66.51 ? 119 PRO E CG 1 ATOM 10667 C CD . PRO G 1 118 ? 91.369 3.910 20.768 1.00 67.92 ? 119 PRO E CD 1 ATOM 10668 N N . PRO G 1 119 ? 92.207 7.599 18.052 1.00 63.28 ? 120 PRO E N 1 ATOM 10669 C CA . PRO G 1 119 ? 92.339 7.855 16.614 1.00 59.77 ? 120 PRO E CA 1 ATOM 10670 C C . PRO G 1 119 ? 93.337 6.902 15.967 1.00 55.92 ? 120 PRO E C 1 ATOM 10671 O O . PRO G 1 119 ? 94.340 6.548 16.587 1.00 50.09 ? 120 PRO E O 1 ATOM 10672 C CB . PRO G 1 119 ? 92.843 9.303 16.555 1.00 63.60 ? 120 PRO E CB 1 ATOM 10673 C CG . PRO G 1 119 ? 93.460 9.549 17.890 1.00 63.34 ? 120 PRO E CG 1 ATOM 10674 C CD . PRO G 1 119 ? 92.650 8.747 18.862 1.00 64.39 ? 120 PRO E CD 1 ATOM 10675 N N . SER G 1 120 ? 93.049 6.484 14.739 1.00 54.27 ? 121 SER E N 1 ATOM 10676 C CA . SER G 1 120 ? 93.952 5.621 13.993 1.00 58.46 ? 121 SER E CA 1 ATOM 10677 C C . SER G 1 120 ? 95.208 6.385 13.607 1.00 63.23 ? 121 SER E C 1 ATOM 10678 O O . SER G 1 120 ? 95.174 7.603 13.442 1.00 61.78 ? 121 SER E O 1 ATOM 10679 C CB . SER G 1 120 ? 93.262 5.075 12.745 1.00 63.77 ? 121 SER E CB 1 ATOM 10680 O OG . SER G 1 120 ? 92.844 6.131 11.897 1.00 66.77 ? 121 SER E OG 1 ATOM 10681 N N . ASP G 1 121 ? 96.316 5.667 13.458 1.00 73.23 ? 122 ASP E N 1 ATOM 10682 C CA . ASP G 1 121 ? 97.573 6.299 13.080 1.00 80.56 ? 122 ASP E CA 1 ATOM 10683 C C . ASP G 1 121 ? 97.522 6.808 11.645 1.00 76.08 ? 122 ASP E C 1 ATOM 10684 O O . ASP G 1 121 ? 98.279 7.702 11.271 1.00 75.71 ? 122 ASP E O 1 ATOM 10685 C CB . ASP G 1 121 ? 98.742 5.327 13.256 1.00 87.13 ? 122 ASP E CB 1 ATOM 10686 C CG . ASP G 1 121 ? 99.043 5.037 14.715 1.00 92.45 ? 122 ASP E CG 1 ATOM 10687 O OD1 . ASP G 1 121 ? 98.640 5.848 15.576 1.00 96.38 ? 122 ASP E OD1 1 ATOM 10688 O OD2 . ASP G 1 121 ? 99.684 4.004 15.002 1.00 92.32 ? 122 ASP E OD2 1 ATOM 10689 N N . GLU G 1 122 ? 96.623 6.246 10.843 1.00 73.40 ? 123 GLU E N 1 ATOM 10690 C CA . GLU G 1 122 ? 96.504 6.670 9.456 1.00 69.54 ? 123 GLU E CA 1 ATOM 10691 C C . GLU G 1 122 ? 95.664 7.943 9.335 1.00 65.52 ? 123 GLU E C 1 ATOM 10692 O O . GLU G 1 122 ? 95.844 8.716 8.394 1.00 66.55 ? 123 GLU E O 1 ATOM 10693 C CB . GLU G 1 122 ? 95.917 5.547 8.594 1.00 70.48 ? 123 GLU E CB 1 ATOM 10694 C CG . GLU G 1 122 ? 94.450 5.695 8.259 1.00 76.72 ? 123 GLU E CG 1 ATOM 10695 C CD . GLU G 1 122 ? 93.987 4.685 7.225 1.00 83.45 ? 123 GLU E CD 1 ATOM 10696 O OE1 . GLU G 1 122 ? 94.491 3.542 7.242 1.00 84.52 ? 123 GLU E OE1 1 ATOM 10697 O OE2 . GLU G 1 122 ? 93.125 5.037 6.391 1.00 84.54 ? 123 GLU E OE2 1 ATOM 10698 N N . GLN G 1 123 ? 94.758 8.173 10.284 1.00 58.32 ? 124 GLN E N 1 ATOM 10699 C CA . GLN G 1 123 ? 94.016 9.430 10.299 1.00 60.31 ? 124 GLN E CA 1 ATOM 10700 C C . GLN G 1 123 ? 94.904 10.552 10.817 1.00 68.85 ? 124 GLN E C 1 ATOM 10701 O O . GLN G 1 123 ? 94.826 11.687 10.344 1.00 75.48 ? 124 GLN E O 1 ATOM 10702 C CB . GLN G 1 123 ? 92.752 9.345 11.161 1.00 51.06 ? 124 GLN E CB 1 ATOM 10703 C CG . GLN G 1 123 ? 91.976 10.668 11.185 1.00 49.42 ? 124 GLN E CG 1 ATOM 10704 C CD . GLN G 1 123 ? 91.035 10.812 12.370 1.00 49.28 ? 124 GLN E CD 1 ATOM 10705 O OE1 . GLN G 1 123 ? 91.125 10.073 13.349 1.00 56.92 ? 124 GLN E OE1 1 ATOM 10706 N NE2 . GLN G 1 123 ? 90.127 11.775 12.284 1.00 45.31 ? 124 GLN E NE2 1 ATOM 10707 N N . LEU G 1 124 ? 95.746 10.222 11.794 1.00 68.99 ? 125 LEU E N 1 ATOM 10708 C CA . LEU G 1 124 ? 96.599 11.207 12.450 1.00 70.59 ? 125 LEU E CA 1 ATOM 10709 C C . LEU G 1 124 ? 97.461 11.988 11.463 1.00 76.64 ? 125 LEU E C 1 ATOM 10710 O O . LEU G 1 124 ? 97.672 13.186 11.633 1.00 82.78 ? 125 LEU E O 1 ATOM 10711 C CB . LEU G 1 124 ? 97.489 10.528 13.493 1.00 68.39 ? 125 LEU E CB 1 ATOM 10712 C CG . LEU G 1 124 ? 96.813 10.218 14.830 1.00 65.22 ? 125 LEU E CG 1 ATOM 10713 C CD1 . LEU G 1 124 ? 97.784 9.568 15.801 1.00 62.22 ? 125 LEU E CD1 1 ATOM 10714 C CD2 . LEU G 1 124 ? 96.232 11.487 15.430 1.00 65.15 ? 125 LEU E CD2 1 ATOM 10715 N N . LYS G 1 125 ? 97.937 11.318 10.420 1.00 78.31 ? 126 LYS E N 1 ATOM 10716 C CA . LYS G 1 125 ? 98.805 11.964 9.443 1.00 81.75 ? 126 LYS E CA 1 ATOM 10717 C C . LYS G 1 125 ? 98.037 12.862 8.469 1.00 78.72 ? 126 LYS E C 1 ATOM 10718 O O . LYS G 1 125 ? 98.590 13.308 7.465 1.00 78.95 ? 126 LYS E O 1 ATOM 10719 C CB . LYS G 1 125 ? 99.600 10.914 8.662 1.00 84.60 ? 126 LYS E CB 1 ATOM 10720 C CG . LYS G 1 125 ? 98.753 10.016 7.780 1.00 87.79 ? 126 LYS E CG 1 ATOM 10721 C CD . LYS G 1 125 ? 99.619 9.216 6.819 1.00 94.53 ? 126 LYS E CD 1 ATOM 10722 C CE . LYS G 1 125 ? 98.775 8.533 5.753 1.00 97.64 ? 126 LYS E CE 1 ATOM 10723 N NZ . LYS G 1 125 ? 99.609 7.933 4.672 1.00 99.04 ? 126 LYS E NZ 1 ATOM 10724 N N . SER G 1 126 ? 96.768 13.129 8.763 1.00 80.24 ? 127 SER E N 1 ATOM 10725 C CA . SER G 1 126 ? 95.974 14.035 7.937 1.00 83.47 ? 127 SER E CA 1 ATOM 10726 C C . SER G 1 126 ? 95.742 15.368 8.650 1.00 85.29 ? 127 SER E C 1 ATOM 10727 O O . SER G 1 126 ? 95.147 16.288 8.088 1.00 86.82 ? 127 SER E O 1 ATOM 10728 C CB . SER G 1 126 ? 94.633 13.396 7.559 1.00 80.66 ? 127 SER E CB 1 ATOM 10729 O OG . SER G 1 126 ? 93.768 13.297 8.678 1.00 80.05 ? 127 SER E OG 1 ATOM 10730 N N . GLY G 1 127 ? 96.213 15.463 9.889 1.00 83.93 ? 128 GLY E N 1 ATOM 10731 C CA . GLY G 1 127 ? 96.115 16.695 10.651 1.00 84.53 ? 128 GLY E CA 1 ATOM 10732 C C . GLY G 1 127 ? 94.833 16.814 11.453 1.00 85.33 ? 128 GLY E C 1 ATOM 10733 O O . GLY G 1 127 ? 94.410 17.917 11.801 1.00 89.00 ? 128 GLY E O 1 ATOM 10734 N N . THR G 1 128 ? 94.212 15.676 11.745 1.00 82.99 ? 129 THR E N 1 ATOM 10735 C CA . THR G 1 128 ? 92.979 15.648 12.525 1.00 77.58 ? 129 THR E CA 1 ATOM 10736 C C . THR G 1 128 ? 92.890 14.355 13.330 1.00 73.45 ? 129 THR E C 1 ATOM 10737 O O . THR G 1 128 ? 93.277 13.290 12.849 1.00 75.77 ? 129 THR E O 1 ATOM 10738 C CB . THR G 1 128 ? 91.734 15.780 11.622 1.00 74.26 ? 129 THR E CB 1 ATOM 10739 O OG1 . THR G 1 128 ? 91.909 16.876 10.715 1.00 77.92 ? 129 THR E OG1 1 ATOM 10740 C CG2 . THR G 1 128 ? 90.484 16.015 12.458 1.00 66.94 ? 129 THR E CG2 1 ATOM 10741 N N . ALA G 1 129 ? 92.387 14.451 14.557 1.00 66.39 ? 130 ALA E N 1 ATOM 10742 C CA . ALA G 1 129 ? 92.275 13.287 15.431 1.00 61.72 ? 130 ALA E CA 1 ATOM 10743 C C . ALA G 1 129 ? 90.864 13.131 15.987 1.00 58.64 ? 130 ALA E C 1 ATOM 10744 O O . ALA G 1 129 ? 90.353 14.020 16.667 1.00 59.99 ? 130 ALA E O 1 ATOM 10745 C CB . ALA G 1 129 ? 93.281 13.385 16.569 1.00 61.11 ? 130 ALA E CB 1 ATOM 10746 N N . SER G 1 130 ? 90.238 11.994 15.700 1.00 54.64 ? 131 SER E N 1 ATOM 10747 C CA . SER G 1 130 ? 88.898 11.717 16.200 1.00 52.73 ? 131 SER E CA 1 ATOM 10748 C C . SER G 1 130 ? 88.925 10.654 17.297 1.00 52.19 ? 131 SER E C 1 ATOM 10749 O O . SER G 1 130 ? 89.496 9.578 17.122 1.00 54.14 ? 131 SER E O 1 ATOM 10750 C CB . SER G 1 130 ? 87.981 11.272 15.059 1.00 53.20 ? 131 SER E CB 1 ATOM 10751 O OG . SER G 1 130 ? 87.931 12.245 14.029 1.00 52.69 ? 131 SER E OG 1 ATOM 10752 N N . VAL G 1 131 ? 88.312 10.970 18.431 1.00 49.80 ? 132 VAL E N 1 ATOM 10753 C CA . VAL G 1 131 ? 88.200 10.030 19.537 1.00 49.01 ? 132 VAL E CA 1 ATOM 10754 C C . VAL G 1 131 ? 86.737 9.644 19.700 1.00 55.70 ? 132 VAL E C 1 ATOM 10755 O O . VAL G 1 131 ? 85.860 10.507 19.715 1.00 57.79 ? 132 VAL E O 1 ATOM 10756 C CB . VAL G 1 131 ? 88.736 10.627 20.852 1.00 55.80 ? 132 VAL E CB 1 ATOM 10757 C CG1 . VAL G 1 131 ? 88.895 9.540 21.907 1.00 60.96 ? 132 VAL E CG1 1 ATOM 10758 C CG2 . VAL G 1 131 ? 90.059 11.339 20.612 1.00 48.65 ? 132 VAL E CG2 1 ATOM 10759 N N . VAL G 1 132 ? 86.468 8.350 19.812 1.00 53.40 ? 133 VAL E N 1 ATOM 10760 C CA . VAL G 1 132 ? 85.091 7.880 19.838 1.00 54.73 ? 133 VAL E CA 1 ATOM 10761 C C . VAL G 1 132 ? 84.753 7.128 21.118 1.00 56.45 ? 133 VAL E C 1 ATOM 10762 O O . VAL G 1 132 ? 85.482 6.228 21.535 1.00 60.73 ? 133 VAL E O 1 ATOM 10763 C CB . VAL G 1 132 ? 84.794 6.966 18.632 1.00 49.74 ? 133 VAL E CB 1 ATOM 10764 C CG1 . VAL G 1 132 ? 83.385 6.401 18.725 1.00 44.12 ? 133 VAL E CG1 1 ATOM 10765 C CG2 . VAL G 1 132 ? 84.983 7.729 17.331 1.00 45.20 ? 133 VAL E CG2 1 ATOM 10766 N N . CYS G 1 133 ? 83.643 7.513 21.738 1.00 49.73 ? 134 CYS E N 1 ATOM 10767 C CA . CYS G 1 133 ? 83.096 6.778 22.869 1.00 52.98 ? 134 CYS E CA 1 ATOM 10768 C C . CYS G 1 133 ? 81.811 6.085 22.429 1.00 50.68 ? 134 CYS E C 1 ATOM 10769 O O . CYS G 1 133 ? 80.973 6.689 21.766 1.00 54.28 ? 134 CYS E O 1 ATOM 10770 C CB . CYS G 1 133 ? 82.835 7.714 24.052 1.00 48.61 ? 134 CYS E CB 1 ATOM 10771 S SG . CYS G 1 133 ? 82.313 6.883 25.566 1.00 89.80 ? 134 CYS E SG 1 ATOM 10772 N N . LEU G 1 134 ? 81.663 4.814 22.783 1.00 51.59 ? 135 LEU E N 1 ATOM 10773 C CA . LEU G 1 134 ? 80.491 4.047 22.379 1.00 51.22 ? 135 LEU E CA 1 ATOM 10774 C C . LEU G 1 134 ? 79.677 3.579 23.581 1.00 52.40 ? 135 LEU E C 1 ATOM 10775 O O . LEU G 1 134 ? 80.214 2.997 24.524 1.00 49.79 ? 135 LEU E O 1 ATOM 10776 C CB . LEU G 1 134 ? 80.909 2.845 21.527 1.00 51.43 ? 135 LEU E CB 1 ATOM 10777 C CG . LEU G 1 134 ? 79.834 1.810 21.178 1.00 58.30 ? 135 LEU E CG 1 ATOM 10778 C CD1 . LEU G 1 134 ? 78.676 2.437 20.413 1.00 43.04 ? 135 LEU E CD1 1 ATOM 10779 C CD2 . LEU G 1 134 ? 80.433 0.652 20.389 1.00 44.73 ? 135 LEU E CD2 1 ATOM 10780 N N . LEU G 1 135 ? 78.376 3.849 23.534 1.00 46.93 ? 136 LEU E N 1 ATOM 10781 C CA . LEU G 1 135 ? 77.441 3.371 24.543 1.00 51.45 ? 136 LEU E CA 1 ATOM 10782 C C . LEU G 1 135 ? 76.537 2.317 23.924 1.00 47.95 ? 136 LEU E C 1 ATOM 10783 O O . LEU G 1 135 ? 75.761 2.619 23.023 1.00 48.31 ? 136 LEU E O 1 ATOM 10784 C CB . LEU G 1 135 ? 76.614 4.527 25.099 1.00 59.16 ? 136 LEU E CB 1 ATOM 10785 C CG . LEU G 1 135 ? 77.440 5.615 25.778 1.00 57.54 ? 136 LEU E CG 1 ATOM 10786 C CD1 . LEU G 1 135 ? 76.553 6.728 26.297 1.00 55.78 ? 136 LEU E CD1 1 ATOM 10787 C CD2 . LEU G 1 135 ? 78.237 4.992 26.898 1.00 68.61 ? 136 LEU E CD2 1 ATOM 10788 N N . ASN G 1 136 ? 76.636 1.082 24.403 1.00 51.03 ? 137 ASN E N 1 ATOM 10789 C CA . ASN G 1 136 ? 75.979 -0.031 23.729 1.00 56.06 ? 137 ASN E CA 1 ATOM 10790 C C . ASN G 1 136 ? 74.815 -0.641 24.514 1.00 57.84 ? 137 ASN E C 1 ATOM 10791 O O . ASN G 1 136 ? 74.967 -1.021 25.677 1.00 63.75 ? 137 ASN E O 1 ATOM 10792 C CB . ASN G 1 136 ? 77.009 -1.117 23.407 1.00 56.74 ? 137 ASN E CB 1 ATOM 10793 C CG . ASN G 1 136 ? 76.781 -1.752 22.048 1.00 65.11 ? 137 ASN E CG 1 ATOM 10794 O OD1 . ASN G 1 136 ? 76.297 -1.103 21.120 1.00 64.63 ? 137 ASN E OD1 1 ATOM 10795 N ND2 . ASN G 1 136 ? 77.125 -3.029 21.926 1.00 71.00 ? 137 ASN E ND2 1 ATOM 10796 N N . ASN G 1 137 ? 73.659 -0.724 23.857 1.00 53.73 ? 138 ASN E N 1 ATOM 10797 C CA . ASN G 1 137 ? 72.464 -1.378 24.399 1.00 59.92 ? 138 ASN E CA 1 ATOM 10798 C C . ASN G 1 137 ? 72.023 -0.855 25.766 1.00 62.63 ? 138 ASN E C 1 ATOM 10799 O O . ASN G 1 137 ? 72.363 -1.434 26.799 1.00 62.86 ? 138 ASN E O 1 ATOM 10800 C CB . ASN G 1 137 ? 72.689 -2.889 24.487 1.00 58.30 ? 138 ASN E CB 1 ATOM 10801 C CG . ASN G 1 137 ? 73.198 -3.479 23.188 1.00 61.05 ? 138 ASN E CG 1 ATOM 10802 O OD1 . ASN G 1 137 ? 72.858 -3.008 22.101 1.00 54.72 ? 138 ASN E OD1 1 ATOM 10803 N ND2 . ASN G 1 137 ? 74.023 -4.515 23.293 1.00 67.66 ? 138 ASN E ND2 1 ATOM 10804 N N . PHE G 1 138 ? 71.254 0.229 25.772 1.00 64.38 ? 139 PHE E N 1 ATOM 10805 C CA . PHE G 1 138 ? 70.775 0.789 27.029 1.00 67.72 ? 139 PHE E CA 1 ATOM 10806 C C . PHE G 1 138 ? 69.381 1.404 26.911 1.00 68.00 ? 139 PHE E C 1 ATOM 10807 O O . PHE G 1 138 ? 68.957 1.816 25.831 1.00 68.58 ? 139 PHE E O 1 ATOM 10808 C CB . PHE G 1 138 ? 71.768 1.835 27.560 1.00 68.51 ? 139 PHE E CB 1 ATOM 10809 C CG . PHE G 1 138 ? 71.936 3.036 26.666 1.00 64.78 ? 139 PHE E CG 1 ATOM 10810 C CD1 . PHE G 1 138 ? 71.132 4.155 26.828 1.00 59.23 ? 139 PHE E CD1 1 ATOM 10811 C CD2 . PHE G 1 138 ? 72.907 3.054 25.678 1.00 63.07 ? 139 PHE E CD2 1 ATOM 10812 C CE1 . PHE G 1 138 ? 71.285 5.264 26.012 1.00 56.15 ? 139 PHE E CE1 1 ATOM 10813 C CE2 . PHE G 1 138 ? 73.066 4.162 24.858 1.00 59.93 ? 139 PHE E CE2 1 ATOM 10814 C CZ . PHE G 1 138 ? 72.255 5.267 25.027 1.00 55.64 ? 139 PHE E CZ 1 ATOM 10815 N N . TYR G 1 139 ? 68.675 1.445 28.038 1.00 67.16 ? 140 TYR E N 1 ATOM 10816 C CA . TYR G 1 139 ? 67.389 2.127 28.144 1.00 66.12 ? 140 TYR E CA 1 ATOM 10817 C C . TYR G 1 139 ? 67.322 2.835 29.495 1.00 67.58 ? 140 TYR E C 1 ATOM 10818 O O . TYR G 1 139 ? 67.731 2.270 30.508 1.00 73.41 ? 140 TYR E O 1 ATOM 10819 C CB . TYR G 1 139 ? 66.223 1.142 27.990 1.00 64.68 ? 140 TYR E CB 1 ATOM 10820 C CG . TYR G 1 139 ? 64.868 1.811 27.888 1.00 61.74 ? 140 TYR E CG 1 ATOM 10821 C CD1 . TYR G 1 139 ? 64.126 2.106 29.025 1.00 63.08 ? 140 TYR E CD1 1 ATOM 10822 C CD2 . TYR G 1 139 ? 64.337 2.158 26.653 1.00 58.33 ? 140 TYR E CD2 1 ATOM 10823 C CE1 . TYR G 1 139 ? 62.891 2.725 28.933 1.00 64.45 ? 140 TYR E CE1 1 ATOM 10824 C CE2 . TYR G 1 139 ? 63.105 2.776 26.553 1.00 57.35 ? 140 TYR E CE2 1 ATOM 10825 C CZ . TYR G 1 139 ? 62.386 3.057 27.694 1.00 60.02 ? 140 TYR E CZ 1 ATOM 10826 O OH . TYR G 1 139 ? 61.160 3.672 27.598 1.00 60.54 ? 140 TYR E OH 1 ATOM 10827 N N . PRO G 1 140 ? 66.808 4.074 29.522 1.00 63.24 ? 141 PRO E N 1 ATOM 10828 C CA . PRO G 1 140 ? 66.275 4.834 28.389 1.00 60.27 ? 141 PRO E CA 1 ATOM 10829 C C . PRO G 1 140 ? 67.341 5.583 27.595 1.00 59.65 ? 141 PRO E C 1 ATOM 10830 O O . PRO G 1 140 ? 68.527 5.516 27.915 1.00 53.40 ? 141 PRO E O 1 ATOM 10831 C CB . PRO G 1 140 ? 65.326 5.819 29.063 1.00 59.25 ? 141 PRO E CB 1 ATOM 10832 C CG . PRO G 1 140 ? 65.997 6.105 30.360 1.00 63.69 ? 141 PRO E CG 1 ATOM 10833 C CD . PRO G 1 140 ? 66.632 4.803 30.791 1.00 63.85 ? 141 PRO E CD 1 ATOM 10834 N N . ARG G 1 141 ? 66.890 6.311 26.577 1.00 63.01 ? 142 ARG E N 1 ATOM 10835 C CA . ARG G 1 141 ? 67.763 7.012 25.643 1.00 65.24 ? 142 ARG E CA 1 ATOM 10836 C C . ARG G 1 141 ? 68.579 8.125 26.297 1.00 67.01 ? 142 ARG E C 1 ATOM 10837 O O . ARG G 1 141 ? 69.717 8.380 25.901 1.00 67.00 ? 142 ARG E O 1 ATOM 10838 C CB . ARG G 1 141 ? 66.924 7.587 24.499 1.00 70.05 ? 142 ARG E CB 1 ATOM 10839 C CG . ARG G 1 141 ? 67.703 8.374 23.466 1.00 74.66 ? 142 ARG E CG 1 ATOM 10840 C CD . ARG G 1 141 ? 66.778 8.928 22.394 1.00 75.69 ? 142 ARG E CD 1 ATOM 10841 N NE . ARG G 1 141 ? 67.483 9.826 21.485 1.00 81.49 ? 142 ARG E NE 1 ATOM 10842 C CZ . ARG G 1 141 ? 66.904 10.496 20.495 1.00 86.27 ? 142 ARG E CZ 1 ATOM 10843 N NH1 . ARG G 1 141 ? 65.600 10.372 20.280 1.00 87.81 ? 142 ARG E NH1 1 ATOM 10844 N NH2 . ARG G 1 141 ? 67.629 11.293 19.720 1.00 85.92 ? 142 ARG E NH2 1 ATOM 10845 N N . GLU G 1 142 ? 67.996 8.779 27.296 1.00 73.87 ? 143 GLU E N 1 ATOM 10846 C CA . GLU G 1 142 ? 68.636 9.915 27.956 1.00 76.76 ? 143 GLU E CA 1 ATOM 10847 C C . GLU G 1 142 ? 69.968 9.524 28.594 1.00 76.56 ? 143 GLU E C 1 ATOM 10848 O O . GLU G 1 142 ? 70.024 8.637 29.444 1.00 80.33 ? 143 GLU E O 1 ATOM 10849 C CB . GLU G 1 142 ? 67.704 10.516 29.014 1.00 84.06 ? 143 GLU E CB 1 ATOM 10850 C CG . GLU G 1 142 ? 66.420 11.125 28.453 1.00 90.78 ? 143 GLU E CG 1 ATOM 10851 C CD . GLU G 1 142 ? 65.378 10.080 28.085 1.00 96.28 ? 143 GLU E CD 1 ATOM 10852 O OE1 . GLU G 1 142 ? 65.154 9.151 28.891 1.00 102.49 ? 143 GLU E OE1 1 ATOM 10853 O OE2 . GLU G 1 142 ? 64.787 10.183 26.989 1.00 94.10 ? 143 GLU E OE2 1 ATOM 10854 N N . ALA G 1 143 ? 71.037 10.192 28.170 1.00 68.60 ? 144 ALA E N 1 ATOM 10855 C CA . ALA G 1 143 ? 72.375 9.908 28.674 1.00 65.03 ? 144 ALA E CA 1 ATOM 10856 C C . ALA G 1 143 ? 73.279 11.132 28.553 1.00 69.05 ? 144 ALA E C 1 ATOM 10857 O O . ALA G 1 143 ? 73.071 11.992 27.697 1.00 70.49 ? 144 ALA E O 1 ATOM 10858 C CB . ALA G 1 143 ? 72.980 8.728 27.935 1.00 59.72 ? 144 ALA E CB 1 ATOM 10859 N N . LYS G 1 144 ? 74.286 11.199 29.417 1.00 70.86 ? 145 LYS E N 1 ATOM 10860 C CA . LYS G 1 144 ? 75.183 12.345 29.473 1.00 74.22 ? 145 LYS E CA 1 ATOM 10861 C C . LYS G 1 144 ? 76.632 11.917 29.273 1.00 73.79 ? 145 LYS E C 1 ATOM 10862 O O . LYS G 1 144 ? 77.152 11.091 30.022 1.00 73.31 ? 145 LYS E O 1 ATOM 10863 C CB . LYS G 1 144 ? 75.024 13.067 30.813 1.00 81.06 ? 145 LYS E CB 1 ATOM 10864 C CG . LYS G 1 144 ? 76.054 14.149 31.087 1.00 89.16 ? 145 LYS E CG 1 ATOM 10865 C CD . LYS G 1 144 ? 76.031 14.542 32.557 1.00 97.37 ? 145 LYS E CD 1 ATOM 10866 C CE . LYS G 1 144 ? 77.054 15.620 32.870 1.00 100.58 ? 145 LYS E CE 1 ATOM 10867 N NZ . LYS G 1 144 ? 77.158 15.875 34.336 1.00 105.07 ? 145 LYS E NZ 1 ATOM 10868 N N . VAL G 1 145 ? 77.283 12.476 28.258 1.00 75.44 ? 146 VAL E N 1 ATOM 10869 C CA . VAL G 1 145 ? 78.683 12.161 28.004 1.00 78.76 ? 146 VAL E CA 1 ATOM 10870 C C . VAL G 1 145 ? 79.572 13.384 28.205 1.00 81.94 ? 146 VAL E C 1 ATOM 10871 O O . VAL G 1 145 ? 79.299 14.465 27.683 1.00 78.53 ? 146 VAL E O 1 ATOM 10872 C CB . VAL G 1 145 ? 78.893 11.598 26.579 1.00 80.85 ? 146 VAL E CB 1 ATOM 10873 C CG1 . VAL G 1 145 ? 78.327 10.188 26.477 1.00 79.32 ? 146 VAL E CG1 1 ATOM 10874 C CG2 . VAL G 1 145 ? 78.267 12.510 25.531 1.00 81.29 ? 146 VAL E CG2 1 ATOM 10875 N N . GLN G 1 146 ? 80.632 13.204 28.984 1.00 88.77 ? 147 GLN E N 1 ATOM 10876 C CA . GLN G 1 146 ? 81.611 14.258 29.206 1.00 92.34 ? 147 GLN E CA 1 ATOM 10877 C C . GLN G 1 146 ? 82.969 13.811 28.684 1.00 87.81 ? 147 GLN E C 1 ATOM 10878 O O . GLN G 1 146 ? 83.372 12.667 28.894 1.00 89.04 ? 147 GLN E O 1 ATOM 10879 C CB . GLN G 1 146 ? 81.715 14.609 30.691 1.00 102.04 ? 147 GLN E CB 1 ATOM 10880 C CG . GLN G 1 146 ? 80.389 14.679 31.427 1.00 106.80 ? 147 GLN E CG 1 ATOM 10881 C CD . GLN G 1 146 ? 80.576 14.868 32.921 1.00 113.71 ? 147 GLN E CD 1 ATOM 10882 O OE1 . GLN G 1 146 ? 79.815 14.333 33.727 1.00 117.84 ? 147 GLN E OE1 1 ATOM 10883 N NE2 . GLN G 1 146 ? 81.597 15.629 33.296 1.00 117.09 ? 147 GLN E NE2 1 ATOM 10884 N N . TRP G 1 147 ? 83.673 14.709 28.006 1.00 82.25 ? 148 TRP E N 1 ATOM 10885 C CA . TRP G 1 147 ? 85.019 14.406 27.537 1.00 75.66 ? 148 TRP E CA 1 ATOM 10886 C C . TRP G 1 147 ? 86.066 15.096 28.399 1.00 80.49 ? 148 TRP E C 1 ATOM 10887 O O . TRP G 1 147 ? 86.050 16.316 28.552 1.00 84.70 ? 148 TRP E O 1 ATOM 10888 C CB . TRP G 1 147 ? 85.189 14.816 26.075 1.00 65.64 ? 148 TRP E CB 1 ATOM 10889 C CG . TRP G 1 147 ? 84.574 13.848 25.118 1.00 61.08 ? 148 TRP E CG 1 ATOM 10890 C CD1 . TRP G 1 147 ? 83.423 14.017 24.406 1.00 58.28 ? 148 TRP E CD1 1 ATOM 10891 C CD2 . TRP G 1 147 ? 85.071 12.548 24.776 1.00 62.20 ? 148 TRP E CD2 1 ATOM 10892 N NE1 . TRP G 1 147 ? 83.176 12.907 23.635 1.00 61.78 ? 148 TRP E NE1 1 ATOM 10893 C CE2 . TRP G 1 147 ? 84.172 11.991 23.844 1.00 61.00 ? 148 TRP E CE2 1 ATOM 10894 C CE3 . TRP G 1 147 ? 86.190 11.805 25.164 1.00 58.74 ? 148 TRP E CE3 1 ATOM 10895 C CZ2 . TRP G 1 147 ? 84.358 10.723 23.295 1.00 55.62 ? 148 TRP E CZ2 1 ATOM 10896 C CZ3 . TRP G 1 147 ? 86.372 10.546 24.618 1.00 60.09 ? 148 TRP E CZ3 1 ATOM 10897 C CH2 . TRP G 1 147 ? 85.461 10.018 23.693 1.00 57.13 ? 148 TRP E CH2 1 ATOM 10898 N N . LYS G 1 148 ? 86.974 14.305 28.961 1.00 83.50 ? 149 LYS E N 1 ATOM 10899 C CA . LYS G 1 148 ? 88.040 14.841 29.798 1.00 93.33 ? 149 LYS E CA 1 ATOM 10900 C C . LYS G 1 148 ? 89.417 14.515 29.230 1.00 96.76 ? 149 LYS E C 1 ATOM 10901 O O . LYS G 1 148 ? 89.743 13.354 28.986 1.00 97.70 ? 149 LYS E O 1 ATOM 10902 C CB . LYS G 1 148 ? 87.916 14.308 31.227 1.00 95.76 ? 149 LYS E CB 1 ATOM 10903 C CG . LYS G 1 148 ? 86.652 14.765 31.935 1.00 97.36 ? 149 LYS E CG 1 ATOM 10904 C CD . LYS G 1 148 ? 86.637 14.340 33.392 1.00 103.24 ? 149 LYS E CD 1 ATOM 10905 C CE . LYS G 1 148 ? 85.392 14.856 34.095 1.00 109.18 ? 149 LYS E CE 1 ATOM 10906 N NZ . LYS G 1 148 ? 85.397 14.532 35.547 1.00 117.64 ? 149 LYS E NZ 1 ATOM 10907 N N . VAL G 1 149 ? 90.216 15.556 29.021 1.00 98.44 ? 150 VAL E N 1 ATOM 10908 C CA . VAL G 1 149 ? 91.569 15.409 28.497 1.00 97.76 ? 150 VAL E CA 1 ATOM 10909 C C . VAL G 1 149 ? 92.585 15.974 29.488 1.00 102.93 ? 150 VAL E C 1 ATOM 10910 O O . VAL G 1 149 ? 92.579 17.173 29.775 1.00 101.87 ? 150 VAL E O 1 ATOM 10911 C CB . VAL G 1 149 ? 91.722 16.114 27.140 1.00 90.07 ? 150 VAL E CB 1 ATOM 10912 C CG1 . VAL G 1 149 ? 93.135 15.963 26.626 1.00 90.21 ? 150 VAL E CG1 1 ATOM 10913 C CG2 . VAL G 1 149 ? 90.723 15.557 26.138 1.00 86.50 ? 150 VAL E CG2 1 ATOM 10914 N N . ASP G 1 150 ? 93.458 15.103 29.994 1.00 107.61 ? 151 ASP E N 1 ATOM 10915 C CA . ASP G 1 150 ? 94.327 15.422 31.129 1.00 111.47 ? 151 ASP E CA 1 ATOM 10916 C C . ASP G 1 150 ? 93.481 15.944 32.287 1.00 117.55 ? 151 ASP E C 1 ATOM 10917 O O . ASP G 1 150 ? 93.855 16.902 32.965 1.00 120.64 ? 151 ASP E O 1 ATOM 10918 C CB . ASP G 1 150 ? 95.407 16.439 30.743 1.00 105.11 ? 151 ASP E CB 1 ATOM 10919 C CG . ASP G 1 150 ? 96.465 15.851 29.825 1.00 100.05 ? 151 ASP E CG 1 ATOM 10920 O OD1 . ASP G 1 150 ? 96.659 14.616 29.846 1.00 100.23 ? 151 ASP E OD1 1 ATOM 10921 O OD2 . ASP G 1 150 ? 97.108 16.626 29.085 1.00 93.79 ? 151 ASP E OD2 1 ATOM 10922 N N . ASN G 1 151 ? 92.336 15.294 32.489 1.00 120.71 ? 152 ASN E N 1 ATOM 10923 C CA . ASN G 1 151 ? 91.347 15.672 33.496 1.00 121.34 ? 152 ASN E CA 1 ATOM 10924 C C . ASN G 1 151 ? 90.848 17.104 33.314 1.00 114.34 ? 152 ASN E C 1 ATOM 10925 O O . ASN G 1 151 ? 90.779 17.872 34.272 1.00 116.72 ? 152 ASN E O 1 ATOM 10926 C CB . ASN G 1 151 ? 91.915 15.489 34.906 1.00 129.75 ? 152 ASN E CB 1 ATOM 10927 C CG . ASN G 1 151 ? 90.829 15.340 35.954 1.00 136.53 ? 152 ASN E CG 1 ATOM 10928 O OD1 . ASN G 1 151 ? 89.786 14.737 35.700 1.00 136.54 ? 152 ASN E OD1 1 ATOM 10929 N ND2 . ASN G 1 151 ? 91.066 15.895 37.137 1.00 143.46 ? 152 ASN E ND2 1 ATOM 10930 N N . ALA G 1 152 ? 90.500 17.453 32.079 1.00 106.15 ? 153 ALA E N 1 ATOM 10931 C CA . ALA G 1 152 ? 89.941 18.768 31.776 1.00 102.79 ? 153 ALA E CA 1 ATOM 10932 C C . ALA G 1 152 ? 88.691 18.638 30.908 1.00 100.18 ? 153 ALA E C 1 ATOM 10933 O O . ALA G 1 152 ? 88.717 17.999 29.856 1.00 96.54 ? 153 ALA E O 1 ATOM 10934 C CB . ALA G 1 152 ? 90.976 19.641 31.089 1.00 100.51 ? 153 ALA E CB 1 ATOM 10935 N N . LEU G 1 153 ? 87.599 19.252 31.355 1.00 98.78 ? 154 LEU E N 1 ATOM 10936 C CA . LEU G 1 153 ? 86.316 19.141 30.669 1.00 94.23 ? 154 LEU E CA 1 ATOM 10937 C C . LEU G 1 153 ? 86.322 19.842 29.310 1.00 92.53 ? 154 LEU E C 1 ATOM 10938 O O . LEU G 1 153 ? 86.577 21.043 29.221 1.00 94.56 ? 154 LEU E O 1 ATOM 10939 C CB . LEU G 1 153 ? 85.199 19.711 31.547 1.00 92.53 ? 154 LEU E CB 1 ATOM 10940 C CG . LEU G 1 153 ? 83.774 19.613 31.000 1.00 93.01 ? 154 LEU E CG 1 ATOM 10941 C CD1 . LEU G 1 153 ? 83.406 18.163 30.724 1.00 93.85 ? 154 LEU E CD1 1 ATOM 10942 C CD2 . LEU G 1 153 ? 82.785 20.247 31.967 1.00 93.60 ? 154 LEU E CD2 1 ATOM 10943 N N . GLN G 1 154 ? 86.039 19.080 28.257 1.00 87.96 ? 155 GLN E N 1 ATOM 10944 C CA . GLN G 1 154 ? 85.978 19.621 26.902 1.00 84.63 ? 155 GLN E CA 1 ATOM 10945 C C . GLN G 1 154 ? 84.626 20.275 26.642 1.00 86.73 ? 155 GLN E C 1 ATOM 10946 O O . GLN G 1 154 ? 83.665 20.031 27.371 1.00 87.64 ? 155 GLN E O 1 ATOM 10947 C CB . GLN G 1 154 ? 86.234 18.517 25.873 1.00 80.96 ? 155 GLN E CB 1 ATOM 10948 C CG . GLN G 1 154 ? 87.560 17.797 26.049 1.00 79.62 ? 155 GLN E CG 1 ATOM 10949 C CD . GLN G 1 154 ? 88.753 18.706 25.827 1.00 75.60 ? 155 GLN E CD 1 ATOM 10950 O OE1 . GLN G 1 154 ? 88.834 19.411 24.821 1.00 69.87 ? 155 GLN E OE1 1 ATOM 10951 N NE2 . GLN G 1 154 ? 89.685 18.697 26.772 1.00 78.25 ? 155 GLN E NE2 1 ATOM 10952 N N . SER G 1 155 ? 84.553 21.101 25.601 1.00 86.59 ? 156 SER E N 1 ATOM 10953 C CA . SER G 1 155 ? 83.298 21.757 25.242 1.00 87.05 ? 156 SER E CA 1 ATOM 10954 C C . SER G 1 155 ? 83.307 22.304 23.817 1.00 89.46 ? 156 SER E C 1 ATOM 10955 O O . SER G 1 155 ? 84.259 22.967 23.399 1.00 84.57 ? 156 SER E O 1 ATOM 10956 C CB . SER G 1 155 ? 82.989 22.890 26.221 1.00 85.89 ? 156 SER E CB 1 ATOM 10957 O OG . SER G 1 155 ? 81.710 23.439 25.966 1.00 83.81 ? 156 SER E OG 1 ATOM 10958 N N . GLY G 1 156 ? 82.235 22.023 23.081 1.00 97.80 ? 157 GLY E N 1 ATOM 10959 C CA . GLY G 1 156 ? 82.060 22.543 21.736 1.00 100.23 ? 157 GLY E CA 1 ATOM 10960 C C . GLY G 1 156 ? 82.951 21.891 20.697 1.00 92.36 ? 157 GLY E C 1 ATOM 10961 O O . GLY G 1 156 ? 83.246 22.487 19.661 1.00 97.31 ? 157 GLY E O 1 ATOM 10962 N N . ASN G 1 157 ? 83.380 20.663 20.966 1.00 77.05 ? 158 ASN E N 1 ATOM 10963 C CA . ASN G 1 157 ? 84.253 19.951 20.043 1.00 67.31 ? 158 ASN E CA 1 ATOM 10964 C C . ASN G 1 157 ? 83.886 18.472 19.917 1.00 64.48 ? 158 ASN E C 1 ATOM 10965 O O . ASN G 1 157 ? 84.684 17.660 19.446 1.00 64.82 ? 158 ASN E O 1 ATOM 10966 C CB . ASN G 1 157 ? 85.712 20.103 20.480 1.00 61.80 ? 158 ASN E CB 1 ATOM 10967 C CG . ASN G 1 157 ? 85.940 19.663 21.912 1.00 66.07 ? 158 ASN E CG 1 ATOM 10968 O OD1 . ASN G 1 157 ? 84.991 19.492 22.679 1.00 73.67 ? 158 ASN E OD1 1 ATOM 10969 N ND2 . ASN G 1 157 ? 87.202 19.482 22.283 1.00 63.10 ? 158 ASN E ND2 1 ATOM 10970 N N . SER G 1 158 ? 82.671 18.133 20.340 1.00 64.29 ? 159 SER E N 1 ATOM 10971 C CA . SER G 1 158 ? 82.165 16.769 20.223 1.00 61.76 ? 159 SER E CA 1 ATOM 10972 C C . SER G 1 158 ? 80.764 16.753 19.616 1.00 61.45 ? 159 SER E C 1 ATOM 10973 O O . SER G 1 158 ? 80.037 17.741 19.694 1.00 65.87 ? 159 SER E O 1 ATOM 10974 C CB . SER G 1 158 ? 82.150 16.078 21.588 1.00 64.10 ? 159 SER E CB 1 ATOM 10975 O OG . SER G 1 158 ? 81.147 16.628 22.424 1.00 67.83 ? 159 SER E OG 1 ATOM 10976 N N . GLN G 1 159 ? 80.397 15.629 19.005 1.00 60.25 ? 160 GLN E N 1 ATOM 10977 C CA . GLN G 1 159 ? 79.062 15.453 18.434 1.00 57.47 ? 160 GLN E CA 1 ATOM 10978 C C . GLN G 1 159 ? 78.503 14.072 18.768 1.00 59.69 ? 160 GLN E C 1 ATOM 10979 O O . GLN G 1 159 ? 79.246 13.091 18.844 1.00 54.15 ? 160 GLN E O 1 ATOM 10980 C CB . GLN G 1 159 ? 79.086 15.651 16.917 1.00 57.41 ? 160 GLN E CB 1 ATOM 10981 C CG . GLN G 1 159 ? 79.418 17.065 16.471 1.00 65.47 ? 160 GLN E CG 1 ATOM 10982 C CD . GLN G 1 159 ? 79.356 17.230 14.965 1.00 71.36 ? 160 GLN E CD 1 ATOM 10983 O OE1 . GLN G 1 159 ? 80.053 16.539 14.221 1.00 70.10 ? 160 GLN E OE1 1 ATOM 10984 N NE2 . GLN G 1 159 ? 78.510 18.145 14.507 1.00 75.42 ? 160 GLN E NE2 1 ATOM 10985 N N . GLU G 1 160 ? 77.189 13.999 18.961 1.00 58.75 ? 161 GLU E N 1 ATOM 10986 C CA . GLU G 1 160 ? 76.553 12.742 19.331 1.00 53.50 ? 161 GLU E CA 1 ATOM 10987 C C . GLU G 1 160 ? 75.608 12.237 18.249 1.00 57.54 ? 161 GLU E C 1 ATOM 10988 O O . GLU G 1 160 ? 75.002 13.017 17.516 1.00 58.97 ? 161 GLU E O 1 ATOM 10989 C CB . GLU G 1 160 ? 75.790 12.892 20.647 1.00 56.48 ? 161 GLU E CB 1 ATOM 10990 C CG . GLU G 1 160 ? 76.665 13.235 21.840 1.00 70.96 ? 161 GLU E CG 1 ATOM 10991 C CD . GLU G 1 160 ? 75.872 13.344 23.127 1.00 83.90 ? 161 GLU E CD 1 ATOM 10992 O OE1 . GLU G 1 160 ? 75.052 12.443 23.402 1.00 87.04 ? 161 GLU E OE1 1 ATOM 10993 O OE2 . GLU G 1 160 ? 76.063 14.335 23.861 1.00 90.51 ? 161 GLU E OE2 1 ATOM 10994 N N . SER G 1 161 ? 75.496 10.918 18.160 1.00 51.54 ? 162 SER E N 1 ATOM 10995 C CA . SER G 1 161 ? 74.565 10.281 17.249 1.00 49.50 ? 162 SER E CA 1 ATOM 10996 C C . SER G 1 161 ? 73.927 9.099 17.967 1.00 49.24 ? 162 SER E C 1 ATOM 10997 O O . SER G 1 161 ? 74.592 8.408 18.742 1.00 50.46 ? 162 SER E O 1 ATOM 10998 C CB . SER G 1 161 ? 75.279 9.840 15.971 1.00 51.60 ? 162 SER E CB 1 ATOM 10999 O OG . SER G 1 161 ? 74.383 9.229 15.063 1.00 48.39 ? 162 SER E OG 1 ATOM 11000 N N . VAL G 1 162 ? 72.638 8.880 17.726 1.00 40.55 ? 163 VAL E N 1 ATOM 11001 C CA . VAL G 1 162 ? 71.891 7.836 18.420 1.00 43.21 ? 163 VAL E CA 1 ATOM 11002 C C . VAL G 1 162 ? 71.170 6.927 17.434 1.00 44.54 ? 163 VAL E C 1 ATOM 11003 O O . VAL G 1 162 ? 70.513 7.405 16.509 1.00 50.10 ? 163 VAL E O 1 ATOM 11004 C CB . VAL G 1 162 ? 70.842 8.431 19.389 1.00 48.87 ? 163 VAL E CB 1 ATOM 11005 C CG1 . VAL G 1 162 ? 70.214 7.335 20.240 1.00 50.98 ? 163 VAL E CG1 1 ATOM 11006 C CG2 . VAL G 1 162 ? 71.463 9.503 20.268 1.00 51.32 ? 163 VAL E CG2 1 ATOM 11007 N N . THR G 1 163 ? 71.283 5.617 17.636 1.00 42.54 ? 164 THR E N 1 ATOM 11008 C CA . THR G 1 163 ? 70.557 4.667 16.802 1.00 45.85 ? 164 THR E CA 1 ATOM 11009 C C . THR G 1 163 ? 69.067 4.676 17.128 1.00 45.97 ? 164 THR E C 1 ATOM 11010 O O . THR G 1 163 ? 68.636 5.277 18.113 1.00 41.72 ? 164 THR E O 1 ATOM 11011 C CB . THR G 1 163 ? 71.077 3.226 16.975 1.00 51.93 ? 164 THR E CB 1 ATOM 11012 O OG1 . THR G 1 163 ? 70.707 2.732 18.270 1.00 48.36 ? 164 THR E OG1 1 ATOM 11013 C CG2 . THR G 1 163 ? 72.588 3.175 16.818 1.00 56.82 ? 164 THR E CG2 1 ATOM 11014 N N . GLU G 1 164 ? 68.290 4.001 16.290 1.00 49.80 ? 165 GLU E N 1 ATOM 11015 C CA . GLU G 1 164 ? 66.891 3.731 16.579 1.00 51.06 ? 165 GLU E CA 1 ATOM 11016 C C . GLU G 1 164 ? 66.801 2.660 17.656 1.00 52.29 ? 165 GLU E C 1 ATOM 11017 O O . GLU G 1 164 ? 67.798 2.012 17.978 1.00 57.43 ? 165 GLU E O 1 ATOM 11018 C CB . GLU G 1 164 ? 66.161 3.266 15.322 1.00 49.02 ? 165 GLU E CB 1 ATOM 11019 C CG . GLU G 1 164 ? 66.636 1.905 14.841 1.00 58.69 ? 165 GLU E CG 1 ATOM 11020 C CD . GLU G 1 164 ? 66.117 1.547 13.468 1.00 70.15 ? 165 GLU E CD 1 ATOM 11021 O OE1 . GLU G 1 164 ? 64.907 1.727 13.219 1.00 78.58 ? 165 GLU E OE1 1 ATOM 11022 O OE2 . GLU G 1 164 ? 66.924 1.088 12.632 1.00 74.05 ? 165 GLU E OE2 1 ATOM 11023 N N . GLN G 1 165 ? 65.610 2.473 18.210 1.00 49.46 ? 166 GLN E N 1 ATOM 11024 C CA . GLN G 1 165 ? 65.385 1.387 19.149 1.00 51.38 ? 166 GLN E CA 1 ATOM 11025 C C . GLN G 1 165 ? 65.617 0.048 18.466 1.00 57.23 ? 166 GLN E C 1 ATOM 11026 O O . GLN G 1 165 ? 65.265 -0.134 17.301 1.00 62.90 ? 166 GLN E O 1 ATOM 11027 C CB . GLN G 1 165 ? 63.967 1.450 19.724 1.00 49.20 ? 166 GLN E CB 1 ATOM 11028 C CG . GLN G 1 165 ? 63.926 1.883 21.173 1.00 48.75 ? 166 GLN E CG 1 ATOM 11029 C CD . GLN G 1 165 ? 62.526 1.915 21.747 1.00 49.31 ? 166 GLN E CD 1 ATOM 11030 O OE1 . GLN G 1 165 ? 61.553 2.168 21.039 1.00 48.14 ? 166 GLN E OE1 1 ATOM 11031 N NE2 . GLN G 1 165 ? 62.419 1.655 23.043 1.00 52.42 ? 166 GLN E NE2 1 ATOM 11032 N N . ASP G 1 166 ? 66.227 -0.885 19.187 1.00 60.16 ? 167 ASP E N 1 ATOM 11033 C CA . ASP G 1 166 ? 66.411 -2.226 18.659 1.00 62.05 ? 167 ASP E CA 1 ATOM 11034 C C . ASP G 1 166 ? 65.049 -2.896 18.546 1.00 64.02 ? 167 ASP E C 1 ATOM 11035 O O . ASP G 1 166 ? 64.220 -2.783 19.445 1.00 65.07 ? 167 ASP E O 1 ATOM 11036 C CB . ASP G 1 166 ? 67.344 -3.041 19.548 1.00 71.20 ? 167 ASP E CB 1 ATOM 11037 C CG . ASP G 1 166 ? 67.786 -4.329 18.892 1.00 80.94 ? 167 ASP E CG 1 ATOM 11038 O OD1 . ASP G 1 166 ? 68.314 -4.263 17.761 1.00 85.01 ? 167 ASP E OD1 1 ATOM 11039 O OD2 . ASP G 1 166 ? 67.593 -5.405 19.495 1.00 83.99 ? 167 ASP E OD2 1 ATOM 11040 N N . SER G 1 167 ? 64.815 -3.592 17.439 1.00 69.25 ? 168 SER E N 1 ATOM 11041 C CA . SER G 1 167 ? 63.492 -4.143 17.167 1.00 71.76 ? 168 SER E CA 1 ATOM 11042 C C . SER G 1 167 ? 63.208 -5.411 17.967 1.00 74.46 ? 168 SER E C 1 ATOM 11043 O O . SER G 1 167 ? 62.146 -6.018 17.820 1.00 76.64 ? 168 SER E O 1 ATOM 11044 C CB . SER G 1 167 ? 63.331 -4.424 15.671 1.00 72.65 ? 168 SER E CB 1 ATOM 11045 O OG . SER G 1 167 ? 64.244 -5.414 15.230 1.00 78.35 ? 168 SER E OG 1 ATOM 11046 N N . LYS G 1 168 ? 64.148 -5.807 18.819 1.00 70.62 ? 169 LYS E N 1 ATOM 11047 C CA . LYS G 1 168 ? 63.979 -7.029 19.595 1.00 73.68 ? 169 LYS E CA 1 ATOM 11048 C C . LYS G 1 168 ? 63.971 -6.778 21.104 1.00 70.87 ? 169 LYS E C 1 ATOM 11049 O O . LYS G 1 168 ? 63.137 -7.334 21.819 1.00 72.06 ? 169 LYS E O 1 ATOM 11050 C CB . LYS G 1 168 ? 65.068 -8.041 19.229 1.00 77.59 ? 169 LYS E CB 1 ATOM 11051 C CG . LYS G 1 168 ? 65.008 -8.489 17.774 1.00 81.29 ? 169 LYS E CG 1 ATOM 11052 C CD . LYS G 1 168 ? 65.637 -9.857 17.568 1.00 87.67 ? 169 LYS E CD 1 ATOM 11053 C CE . LYS G 1 168 ? 65.405 -10.356 16.147 1.00 88.05 ? 169 LYS E CE 1 ATOM 11054 N NZ . LYS G 1 168 ? 65.879 -11.757 15.953 1.00 89.03 ? 169 LYS E NZ 1 ATOM 11055 N N . ASP G 1 169 ? 64.882 -5.942 21.592 1.00 65.52 ? 170 ASP E N 1 ATOM 11056 C CA . ASP G 1 169 ? 64.955 -5.698 23.030 1.00 66.67 ? 170 ASP E CA 1 ATOM 11057 C C . ASP G 1 169 ? 64.788 -4.220 23.389 1.00 60.70 ? 170 ASP E C 1 ATOM 11058 O O . ASP G 1 169 ? 64.925 -3.842 24.553 1.00 59.52 ? 170 ASP E O 1 ATOM 11059 C CB . ASP G 1 169 ? 66.273 -6.237 23.598 1.00 72.20 ? 170 ASP E CB 1 ATOM 11060 C CG . ASP G 1 169 ? 67.475 -5.425 23.169 1.00 81.86 ? 170 ASP E CG 1 ATOM 11061 O OD1 . ASP G 1 169 ? 67.389 -4.710 22.151 1.00 84.02 ? 170 ASP E OD1 1 ATOM 11062 O OD2 . ASP G 1 169 ? 68.516 -5.507 23.853 1.00 89.26 ? 170 ASP E OD2 1 ATOM 11063 N N . SER G 1 170 ? 64.510 -3.398 22.379 1.00 49.42 ? 171 SER E N 1 ATOM 11064 C CA . SER G 1 170 ? 64.099 -2.007 22.573 1.00 46.76 ? 171 SER E CA 1 ATOM 11065 C C . SER G 1 170 ? 65.145 -1.120 23.252 1.00 49.41 ? 171 SER E C 1 ATOM 11066 O O . SER G 1 170 ? 64.799 -0.162 23.946 1.00 47.02 ? 171 SER E O 1 ATOM 11067 C CB . SER G 1 170 ? 62.795 -1.962 23.374 1.00 42.56 ? 171 SER E CB 1 ATOM 11068 O OG . SER G 1 170 ? 61.796 -2.761 22.759 1.00 50.59 ? 171 SER E OG 1 ATOM 11069 N N . THR G 1 171 ? 66.419 -1.428 23.045 1.00 46.82 ? 172 THR E N 1 ATOM 11070 C CA . THR G 1 171 ? 67.483 -0.608 23.608 1.00 51.93 ? 172 THR E CA 1 ATOM 11071 C C . THR G 1 171 ? 68.063 0.354 22.580 1.00 52.53 ? 172 THR E C 1 ATOM 11072 O O . THR G 1 171 ? 67.780 0.252 21.384 1.00 40.32 ? 172 THR E O 1 ATOM 11073 C CB . THR G 1 171 ? 68.629 -1.468 24.178 1.00 57.58 ? 172 THR E CB 1 ATOM 11074 O OG1 . THR G 1 171 ? 69.070 -2.403 23.186 1.00 54.82 ? 172 THR E OG1 1 ATOM 11075 C CG2 . THR G 1 171 ? 68.165 -2.217 25.419 1.00 58.69 ? 172 THR E CG2 1 ATOM 11076 N N . TYR G 1 172 ? 68.878 1.285 23.066 1.00 42.49 ? 173 TYR E N 1 ATOM 11077 C CA . TYR G 1 172 ? 69.539 2.263 22.215 1.00 47.26 ? 173 TYR E CA 1 ATOM 11078 C C . TYR G 1 172 ? 71.052 2.099 22.255 1.00 54.05 ? 173 TYR E C 1 ATOM 11079 O O . TYR G 1 172 ? 71.606 1.567 23.216 1.00 54.94 ? 173 TYR E O 1 ATOM 11080 C CB . TYR G 1 172 ? 69.190 3.691 22.645 1.00 45.82 ? 173 TYR E CB 1 ATOM 11081 C CG . TYR G 1 172 ? 67.722 4.053 22.588 1.00 49.88 ? 173 TYR E CG 1 ATOM 11082 C CD1 . TYR G 1 172 ? 67.133 4.465 21.399 1.00 45.59 ? 173 TYR E CD1 1 ATOM 11083 C CD2 . TYR G 1 172 ? 66.933 4.018 23.733 1.00 49.51 ? 173 TYR E CD2 1 ATOM 11084 C CE1 . TYR G 1 172 ? 65.795 4.812 21.348 1.00 46.88 ? 173 TYR E CE1 1 ATOM 11085 C CE2 . TYR G 1 172 ? 65.593 4.362 23.692 1.00 46.08 ? 173 TYR E CE2 1 ATOM 11086 C CZ . TYR G 1 172 ? 65.031 4.759 22.497 1.00 48.12 ? 173 TYR E CZ 1 ATOM 11087 O OH . TYR G 1 172 ? 63.698 5.101 22.451 1.00 51.79 ? 173 TYR E OH 1 ATOM 11088 N N . SER G 1 173 ? 71.713 2.568 21.203 1.00 55.93 ? 174 SER E N 1 ATOM 11089 C CA . SER G 1 173 ? 73.157 2.754 21.222 1.00 54.70 ? 174 SER E CA 1 ATOM 11090 C C . SER G 1 173 ? 73.465 4.194 20.840 1.00 47.22 ? 174 SER E C 1 ATOM 11091 O O . SER G 1 173 ? 72.722 4.814 20.078 1.00 47.20 ? 174 SER E O 1 ATOM 11092 C CB . SER G 1 173 ? 73.863 1.780 20.275 1.00 55.02 ? 174 SER E CB 1 ATOM 11093 O OG . SER G 1 173 ? 73.830 0.458 20.785 1.00 57.99 ? 174 SER E OG 1 ATOM 11094 N N . LEU G 1 174 ? 74.555 4.725 21.379 1.00 46.08 ? 175 LEU E N 1 ATOM 11095 C CA . LEU G 1 174 ? 74.949 6.107 21.127 1.00 47.92 ? 175 LEU E CA 1 ATOM 11096 C C . LEU G 1 174 ? 76.450 6.194 20.883 1.00 50.64 ? 175 LEU E C 1 ATOM 11097 O O . LEU G 1 174 ? 77.228 5.450 21.480 1.00 52.38 ? 175 LEU E O 1 ATOM 11098 C CB . LEU G 1 174 ? 74.543 7.002 22.307 1.00 45.32 ? 175 LEU E CB 1 ATOM 11099 C CG . LEU G 1 174 ? 74.892 8.496 22.303 1.00 48.92 ? 175 LEU E CG 1 ATOM 11100 C CD1 . LEU G 1 174 ? 73.831 9.271 23.065 1.00 52.23 ? 175 LEU E CD1 1 ATOM 11101 C CD2 . LEU G 1 174 ? 76.272 8.768 22.908 1.00 49.41 ? 175 LEU E CD2 1 ATOM 11102 N N . SER G 1 175 ? 76.851 7.105 20.003 1.00 51.78 ? 176 SER E N 1 ATOM 11103 C CA . SER G 1 175 ? 78.263 7.400 19.801 1.00 54.95 ? 176 SER E CA 1 ATOM 11104 C C . SER G 1 175 ? 78.545 8.858 20.127 1.00 57.43 ? 176 SER E C 1 ATOM 11105 O O . SER G 1 175 ? 77.696 9.725 19.926 1.00 61.67 ? 176 SER E O 1 ATOM 11106 C CB . SER G 1 175 ? 78.692 7.090 18.363 1.00 58.56 ? 176 SER E CB 1 ATOM 11107 O OG . SER G 1 175 ? 78.099 7.991 17.443 1.00 61.06 ? 176 SER E OG 1 ATOM 11108 N N . SER G 1 176 ? 79.736 9.121 20.646 1.00 59.44 ? 177 SER E N 1 ATOM 11109 C CA . SER G 1 176 ? 80.196 10.487 20.857 1.00 54.85 ? 177 SER E CA 1 ATOM 11110 C C . SER G 1 176 ? 81.577 10.635 20.244 1.00 56.03 ? 177 SER E C 1 ATOM 11111 O O . SER G 1 176 ? 82.505 9.904 20.599 1.00 55.38 ? 177 SER E O 1 ATOM 11112 C CB . SER G 1 176 ? 80.228 10.841 22.345 1.00 53.39 ? 177 SER E CB 1 ATOM 11113 O OG . SER G 1 176 ? 80.695 12.165 22.546 1.00 49.71 ? 177 SER E OG 1 ATOM 11114 N N . THR G 1 177 ? 81.709 11.571 19.313 1.00 53.79 ? 178 THR E N 1 ATOM 11115 C CA . THR G 1 177 ? 82.973 11.760 18.618 1.00 54.22 ? 178 THR E CA 1 ATOM 11116 C C . THR G 1 177 ? 83.623 13.078 19.002 1.00 58.76 ? 178 THR E C 1 ATOM 11117 O O . THR G 1 177 ? 83.111 14.149 18.676 1.00 59.40 ? 178 THR E O 1 ATOM 11118 C CB . THR G 1 177 ? 82.789 11.722 17.097 1.00 51.74 ? 178 THR E CB 1 ATOM 11119 O OG1 . THR G 1 177 ? 82.200 10.473 16.721 1.00 55.93 ? 178 THR E OG1 1 ATOM 11120 C CG2 . THR G 1 177 ? 84.130 11.875 16.400 1.00 53.41 ? 178 THR E CG2 1 ATOM 11121 N N . LEU G 1 178 ? 84.750 12.988 19.700 1.00 60.84 ? 179 LEU E N 1 ATOM 11122 C CA . LEU G 1 178 ? 85.534 14.161 20.057 1.00 56.06 ? 179 LEU E CA 1 ATOM 11123 C C . LEU G 1 178 ? 86.533 14.467 18.948 1.00 53.35 ? 179 LEU E C 1 ATOM 11124 O O . LEU G 1 178 ? 87.379 13.638 18.629 1.00 53.13 ? 179 LEU E O 1 ATOM 11125 C CB . LEU G 1 178 ? 86.263 13.939 21.385 1.00 57.24 ? 179 LEU E CB 1 ATOM 11126 C CG . LEU G 1 178 ? 87.135 15.092 21.889 1.00 57.65 ? 179 LEU E CG 1 ATOM 11127 C CD1 . LEU G 1 178 ? 86.283 16.183 22.529 1.00 61.70 ? 179 LEU E CD1 1 ATOM 11128 C CD2 . LEU G 1 178 ? 88.187 14.584 22.859 1.00 55.48 ? 179 LEU E CD2 1 ATOM 11129 N N . THR G 1 179 ? 86.433 15.653 18.357 1.00 56.10 ? 180 THR E N 1 ATOM 11130 C CA . THR G 1 179 ? 87.334 16.022 17.271 1.00 65.01 ? 180 THR E CA 1 ATOM 11131 C C . THR G 1 179 ? 88.346 17.085 17.690 1.00 74.22 ? 180 THR E C 1 ATOM 11132 O O . THR G 1 179 ? 87.976 18.157 18.167 1.00 77.45 ? 180 THR E O 1 ATOM 11133 C CB . THR G 1 179 ? 86.555 16.533 16.049 1.00 64.28 ? 180 THR E CB 1 ATOM 11134 O OG1 . THR G 1 179 ? 85.706 15.491 15.556 1.00 68.62 ? 180 THR E OG1 1 ATOM 11135 C CG2 . THR G 1 179 ? 87.514 16.955 14.947 1.00 62.95 ? 180 THR E CG2 1 ATOM 11136 N N . LEU G 1 180 ? 89.626 16.773 17.511 1.00 77.06 ? 181 LEU E N 1 ATOM 11137 C CA . LEU G 1 180 ? 90.702 17.720 17.779 1.00 80.31 ? 181 LEU E CA 1 ATOM 11138 C C . LEU G 1 180 ? 91.588 17.860 16.549 1.00 79.83 ? 181 LEU E C 1 ATOM 11139 O O . LEU G 1 180 ? 91.344 17.230 15.522 1.00 77.53 ? 181 LEU E O 1 ATOM 11140 C CB . LEU G 1 180 ? 91.547 17.269 18.971 1.00 79.73 ? 181 LEU E CB 1 ATOM 11141 C CG . LEU G 1 180 ? 90.841 16.604 20.153 1.00 79.42 ? 181 LEU E CG 1 ATOM 11142 C CD1 . LEU G 1 180 ? 91.870 16.067 21.136 1.00 79.18 ? 181 LEU E CD1 1 ATOM 11143 C CD2 . LEU G 1 180 ? 89.891 17.572 20.838 1.00 83.75 ? 181 LEU E CD2 1 ATOM 11144 N N . SER G 1 181 ? 92.617 18.692 16.654 1.00 83.44 ? 182 SER E N 1 ATOM 11145 C CA . SER G 1 181 ? 93.657 18.722 15.637 1.00 85.61 ? 182 SER E CA 1 ATOM 11146 C C . SER G 1 181 ? 94.743 17.748 16.079 1.00 79.44 ? 182 SER E C 1 ATOM 11147 O O . SER G 1 181 ? 94.777 17.352 17.244 1.00 80.13 ? 182 SER E O 1 ATOM 11148 C CB . SER G 1 181 ? 94.214 20.136 15.453 1.00 90.14 ? 182 SER E CB 1 ATOM 11149 O OG . SER G 1 181 ? 94.749 20.306 14.150 1.00 91.45 ? 182 SER E OG 1 ATOM 11150 N N . LYS G 1 182 ? 95.612 17.343 15.159 1.00 73.48 ? 183 LYS E N 1 ATOM 11151 C CA . LYS G 1 182 ? 96.690 16.428 15.516 1.00 74.69 ? 183 LYS E CA 1 ATOM 11152 C C . LYS G 1 182 ? 97.576 17.051 16.585 1.00 81.86 ? 183 LYS E C 1 ATOM 11153 O O . LYS G 1 182 ? 97.980 16.382 17.536 1.00 85.10 ? 183 LYS E O 1 ATOM 11154 C CB . LYS G 1 182 ? 97.531 16.053 14.296 1.00 74.51 ? 183 LYS E CB 1 ATOM 11155 C CG . LYS G 1 182 ? 98.684 15.118 14.629 1.00 76.43 ? 183 LYS E CG 1 ATOM 11156 C CD . LYS G 1 182 ? 99.600 14.901 13.442 1.00 79.22 ? 183 LYS E CD 1 ATOM 11157 C CE . LYS G 1 182 ? 100.643 13.838 13.747 1.00 82.25 ? 183 LYS E CE 1 ATOM 11158 N NZ . LYS G 1 182 ? 101.382 13.418 12.524 1.00 82.34 ? 183 LYS E NZ 1 ATOM 11159 N N . ALA G 1 183 ? 97.859 18.340 16.422 1.00 82.57 ? 184 ALA E N 1 ATOM 11160 C CA . ALA G 1 183 ? 98.692 19.084 17.359 1.00 86.21 ? 184 ALA E CA 1 ATOM 11161 C C . ALA G 1 183 ? 98.157 18.985 18.783 1.00 90.63 ? 184 ALA E C 1 ATOM 11162 O O . ALA G 1 183 ? 98.885 18.612 19.701 1.00 90.02 ? 184 ALA E O 1 ATOM 11163 C CB . ALA G 1 183 ? 98.787 20.538 16.933 1.00 82.36 ? 184 ALA E CB 1 ATOM 11164 N N . ASP G 1 184 ? 96.878 19.307 18.952 1.00 98.56 ? 185 ASP E N 1 ATOM 11165 C CA . ASP G 1 184 ? 96.232 19.256 20.260 1.00 104.78 ? 185 ASP E CA 1 ATOM 11166 C C . ASP G 1 184 ? 96.247 17.843 20.843 1.00 103.03 ? 185 ASP E C 1 ATOM 11167 O O . ASP G 1 184 ? 96.323 17.668 22.060 1.00 105.79 ? 185 ASP E O 1 ATOM 11168 C CB . ASP G 1 184 ? 94.792 19.766 20.161 1.00 109.83 ? 185 ASP E CB 1 ATOM 11169 C CG . ASP G 1 184 ? 94.707 21.177 19.605 1.00 115.84 ? 185 ASP E CG 1 ATOM 11170 O OD1 . ASP G 1 184 ? 95.684 21.632 18.973 1.00 118.95 ? 185 ASP E OD1 1 ATOM 11171 O OD2 . ASP G 1 184 ? 93.659 21.829 19.794 1.00 117.29 ? 185 ASP E OD2 1 ATOM 11172 N N . TYR G 1 185 ? 96.183 16.841 19.969 1.00 92.26 ? 186 TYR E N 1 ATOM 11173 C CA . TYR G 1 185 ? 96.136 15.447 20.402 1.00 81.86 ? 186 TYR E CA 1 ATOM 11174 C C . TYR G 1 185 ? 97.480 14.957 20.931 1.00 83.90 ? 186 TYR E C 1 ATOM 11175 O O . TYR G 1 185 ? 97.531 14.137 21.848 1.00 82.97 ? 186 TYR E O 1 ATOM 11176 C CB . TYR G 1 185 ? 95.677 14.539 19.257 1.00 69.59 ? 186 TYR E CB 1 ATOM 11177 C CG . TYR G 1 185 ? 95.706 13.072 19.618 1.00 63.07 ? 186 TYR E CG 1 ATOM 11178 C CD1 . TYR G 1 185 ? 94.816 12.550 20.548 1.00 61.57 ? 186 TYR E CD1 1 ATOM 11179 C CD2 . TYR G 1 185 ? 96.626 12.209 19.036 1.00 65.04 ? 186 TYR E CD2 1 ATOM 11180 C CE1 . TYR G 1 185 ? 94.839 11.209 20.887 1.00 62.88 ? 186 TYR E CE1 1 ATOM 11181 C CE2 . TYR G 1 185 ? 96.656 10.865 19.367 1.00 66.29 ? 186 TYR E CE2 1 ATOM 11182 C CZ . TYR G 1 185 ? 95.760 10.372 20.296 1.00 65.40 ? 186 TYR E CZ 1 ATOM 11183 O OH . TYR G 1 185 ? 95.781 9.040 20.634 1.00 66.97 ? 186 TYR E OH 1 ATOM 11184 N N . GLU G 1 186 ? 98.565 15.452 20.347 1.00 85.69 ? 187 GLU E N 1 ATOM 11185 C CA . GLU G 1 186 ? 99.898 15.040 20.769 1.00 89.64 ? 187 GLU E CA 1 ATOM 11186 C C . GLU G 1 186 ? 100.290 15.719 22.077 1.00 91.04 ? 187 GLU E C 1 ATOM 11187 O O . GLU G 1 186 ? 101.017 15.147 22.888 1.00 91.50 ? 187 GLU E O 1 ATOM 11188 C CB . GLU G 1 186 ? 100.933 15.357 19.685 1.00 92.50 ? 187 GLU E CB 1 ATOM 11189 C CG . GLU G 1 186 ? 100.595 14.823 18.298 1.00 92.56 ? 187 GLU E CG 1 ATOM 11190 C CD . GLU G 1 186 ? 100.762 13.319 18.173 1.00 96.28 ? 187 GLU E CD 1 ATOM 11191 O OE1 . GLU G 1 186 ? 100.436 12.778 17.095 1.00 95.39 ? 187 GLU E OE1 1 ATOM 11192 O OE2 . GLU G 1 186 ? 101.221 12.679 19.142 1.00 98.90 ? 187 GLU E OE2 1 ATOM 11193 N N . LYS G 1 187 ? 99.798 16.937 22.278 1.00 96.58 ? 188 LYS E N 1 ATOM 11194 C CA . LYS G 1 187 ? 100.177 17.740 23.437 1.00 107.60 ? 188 LYS E CA 1 ATOM 11195 C C . LYS G 1 187 ? 99.689 17.148 24.755 1.00 107.90 ? 188 LYS E C 1 ATOM 11196 O O . LYS G 1 187 ? 100.268 17.408 25.810 1.00 111.16 ? 188 LYS E O 1 ATOM 11197 C CB . LYS G 1 187 ? 99.646 19.168 23.290 1.00 115.13 ? 188 LYS E CB 1 ATOM 11198 C CG . LYS G 1 187 ? 100.312 19.971 22.185 1.00 120.66 ? 188 LYS E CG 1 ATOM 11199 C CD . LYS G 1 187 ? 99.705 21.361 22.062 1.00 125.76 ? 188 LYS E CD 1 ATOM 11200 C CE . LYS G 1 187 ? 100.347 22.142 20.927 1.00 128.76 ? 188 LYS E CE 1 ATOM 11201 N NZ . LYS G 1 187 ? 99.780 23.512 20.796 1.00 131.11 ? 188 LYS E NZ 1 ATOM 11202 N N . HIS G 1 188 ? 98.627 16.353 24.696 1.00 103.68 ? 189 HIS E N 1 ATOM 11203 C CA . HIS G 1 188 ? 98.033 15.802 25.909 1.00 99.18 ? 189 HIS E CA 1 ATOM 11204 C C . HIS G 1 188 ? 98.190 14.284 25.972 1.00 91.62 ? 189 HIS E C 1 ATOM 11205 O O . HIS G 1 188 ? 98.618 13.657 25.004 1.00 86.64 ? 189 HIS E O 1 ATOM 11206 C CB . HIS G 1 188 ? 96.561 16.195 25.995 1.00 103.17 ? 189 HIS E CB 1 ATOM 11207 C CG . HIS G 1 188 ? 96.330 17.674 25.994 1.00 105.08 ? 189 HIS E CG 1 ATOM 11208 N ND1 . HIS G 1 188 ? 96.470 18.450 24.860 1.00 104.65 ? 189 HIS E ND1 1 ATOM 11209 C CD2 . HIS G 1 188 ? 95.973 18.525 26.985 1.00 104.09 ? 189 HIS E CD2 1 ATOM 11210 C CE1 . HIS G 1 188 ? 96.208 19.709 25.155 1.00 103.89 ? 189 HIS E CE1 1 ATOM 11211 N NE2 . HIS G 1 188 ? 95.903 19.783 26.439 1.00 102.52 ? 189 HIS E NE2 1 ATOM 11212 N N . LYS G 1 189 ? 97.844 13.700 27.116 1.00 93.10 ? 190 LYS E N 1 ATOM 11213 C CA . LYS G 1 189 ? 98.099 12.281 27.354 1.00 98.04 ? 190 LYS E CA 1 ATOM 11214 C C . LYS G 1 189 ? 96.829 11.477 27.629 1.00 96.72 ? 190 LYS E C 1 ATOM 11215 O O . LYS G 1 189 ? 96.500 10.549 26.890 1.00 96.45 ? 190 LYS E O 1 ATOM 11216 C CB . LYS G 1 189 ? 99.069 12.112 28.527 1.00 103.26 ? 190 LYS E CB 1 ATOM 11217 C CG . LYS G 1 189 ? 100.405 12.823 28.356 1.00 109.29 ? 190 LYS E CG 1 ATOM 11218 C CD . LYS G 1 189 ? 101.309 12.103 27.365 1.00 110.32 ? 190 LYS E CD 1 ATOM 11219 C CE . LYS G 1 189 ? 102.694 12.735 27.325 1.00 108.63 ? 190 LYS E CE 1 ATOM 11220 N NZ . LYS G 1 189 ? 103.633 11.986 26.442 1.00 106.95 ? 190 LYS E NZ 1 ATOM 11221 N N . VAL G 1 190 ? 96.126 11.832 28.700 1.00 99.20 ? 191 VAL E N 1 ATOM 11222 C CA . VAL G 1 190 ? 94.971 11.062 29.153 1.00 98.90 ? 191 VAL E CA 1 ATOM 11223 C C . VAL G 1 190 ? 93.678 11.492 28.462 1.00 94.90 ? 191 VAL E C 1 ATOM 11224 O O . VAL G 1 190 ? 93.368 12.681 28.388 1.00 96.31 ? 191 VAL E O 1 ATOM 11225 C CB . VAL G 1 190 ? 94.790 11.184 30.680 1.00 103.64 ? 191 VAL E CB 1 ATOM 11226 C CG1 . VAL G 1 190 ? 93.572 10.398 31.142 1.00 103.28 ? 191 VAL E CG1 1 ATOM 11227 C CG2 . VAL G 1 190 ? 96.043 10.707 31.398 1.00 107.34 ? 191 VAL E CG2 1 ATOM 11228 N N . TYR G 1 191 ? 92.929 10.514 27.960 1.00 88.85 ? 192 TYR E N 1 ATOM 11229 C CA . TYR G 1 191 ? 91.657 10.774 27.291 1.00 78.46 ? 192 TYR E CA 1 ATOM 11230 C C . TYR G 1 191 ? 90.549 9.905 27.871 1.00 74.38 ? 192 TYR E C 1 ATOM 11231 O O . TYR G 1 191 ? 90.565 8.686 27.721 1.00 70.88 ? 192 TYR E O 1 ATOM 11232 C CB . TYR G 1 191 ? 91.786 10.531 25.789 1.00 71.52 ? 192 TYR E CB 1 ATOM 11233 C CG . TYR G 1 191 ? 92.685 11.528 25.108 1.00 69.90 ? 192 TYR E CG 1 ATOM 11234 C CD1 . TYR G 1 191 ? 94.059 11.334 25.063 1.00 75.08 ? 192 TYR E CD1 1 ATOM 11235 C CD2 . TYR G 1 191 ? 92.163 12.670 24.522 1.00 70.81 ? 192 TYR E CD2 1 ATOM 11236 C CE1 . TYR G 1 191 ? 94.887 12.248 24.448 1.00 78.23 ? 192 TYR E CE1 1 ATOM 11237 C CE2 . TYR G 1 191 ? 92.982 13.590 23.902 1.00 77.72 ? 192 TYR E CE2 1 ATOM 11238 C CZ . TYR G 1 191 ? 94.344 13.374 23.869 1.00 80.94 ? 192 TYR E CZ 1 ATOM 11239 O OH . TYR G 1 191 ? 95.164 14.289 23.253 1.00 84.42 ? 192 TYR E OH 1 ATOM 11240 N N . ALA G 1 192 ? 89.583 10.541 28.525 1.00 72.65 ? 193 ALA E N 1 ATOM 11241 C CA . ALA G 1 192 ? 88.551 9.813 29.250 1.00 73.90 ? 193 ALA E CA 1 ATOM 11242 C C . ALA G 1 192 ? 87.142 10.131 28.758 1.00 72.19 ? 193 ALA E C 1 ATOM 11243 O O . ALA G 1 192 ? 86.883 11.200 28.205 1.00 71.97 ? 193 ALA E O 1 ATOM 11244 C CB . ALA G 1 192 ? 88.661 10.105 30.735 1.00 76.51 ? 193 ALA E CB 1 ATOM 11245 N N . CYS G 1 193 ? 86.236 9.185 28.974 1.00 73.24 ? 194 CYS E N 1 ATOM 11246 C CA . CYS G 1 193 ? 84.842 9.330 28.581 1.00 73.94 ? 194 CYS E CA 1 ATOM 11247 C C . CYS G 1 193 ? 83.943 9.009 29.767 1.00 78.93 ? 194 CYS E C 1 ATOM 11248 O O . CYS G 1 193 ? 83.792 7.848 30.139 1.00 82.67 ? 194 CYS E O 1 ATOM 11249 C CB . CYS G 1 193 ? 84.524 8.413 27.395 1.00 75.05 ? 194 CYS E CB 1 ATOM 11250 S SG . CYS G 1 193 ? 82.773 8.273 26.976 1.00 120.91 ? 194 CYS E SG 1 ATOM 11251 N N . GLU G 1 194 ? 83.357 10.039 30.367 1.00 82.45 ? 195 GLU E N 1 ATOM 11252 C CA . GLU G 1 194 ? 82.505 9.849 31.535 1.00 87.27 ? 195 GLU E CA 1 ATOM 11253 C C . GLU G 1 194 ? 81.037 9.750 31.127 1.00 80.65 ? 195 GLU E C 1 ATOM 11254 O O . GLU G 1 194 ? 80.531 10.585 30.376 1.00 75.83 ? 195 GLU E O 1 ATOM 11255 C CB . GLU G 1 194 ? 82.711 10.987 32.535 1.00 96.57 ? 195 GLU E CB 1 ATOM 11256 C CG . GLU G 1 194 ? 82.068 10.755 33.892 1.00 105.70 ? 195 GLU E CG 1 ATOM 11257 C CD . GLU G 1 194 ? 82.546 11.747 34.935 1.00 111.52 ? 195 GLU E CD 1 ATOM 11258 O OE1 . GLU G 1 194 ? 83.736 12.127 34.892 1.00 114.17 ? 195 GLU E OE1 1 ATOM 11259 O OE2 . GLU G 1 194 ? 81.733 12.149 35.794 1.00 114.65 ? 195 GLU E OE2 1 ATOM 11260 N N . VAL G 1 195 ? 80.358 8.723 31.626 1.00 79.83 ? 196 VAL E N 1 ATOM 11261 C CA . VAL G 1 195 ? 78.991 8.438 31.209 1.00 81.95 ? 196 VAL E CA 1 ATOM 11262 C C . VAL G 1 195 ? 78.021 8.385 32.384 1.00 84.92 ? 196 VAL E C 1 ATOM 11263 O O . VAL G 1 195 ? 78.164 7.553 33.280 1.00 87.41 ? 196 VAL E O 1 ATOM 11264 C CB . VAL G 1 195 ? 78.915 7.101 30.445 1.00 79.68 ? 196 VAL E CB 1 ATOM 11265 C CG1 . VAL G 1 195 ? 77.481 6.808 30.023 1.00 78.40 ? 196 VAL E CG1 1 ATOM 11266 C CG2 . VAL G 1 195 ? 79.842 7.129 29.242 1.00 73.90 ? 196 VAL E CG2 1 ATOM 11267 N N . THR G 1 196 ? 77.032 9.275 32.373 1.00 81.15 ? 197 THR E N 1 ATOM 11268 C CA . THR G 1 196 ? 75.997 9.278 33.401 1.00 83.80 ? 197 THR E CA 1 ATOM 11269 C C . THR G 1 196 ? 74.663 8.824 32.815 1.00 81.54 ? 197 THR E C 1 ATOM 11270 O O . THR G 1 196 ? 74.230 9.317 31.773 1.00 77.86 ? 197 THR E O 1 ATOM 11271 C CB . THR G 1 196 ? 75.833 10.668 34.042 1.00 85.15 ? 197 THR E CB 1 ATOM 11272 O OG1 . THR G 1 196 ? 77.106 11.134 34.508 1.00 87.79 ? 197 THR E OG1 1 ATOM 11273 C CG2 . THR G 1 196 ? 74.864 10.602 35.215 1.00 83.58 ? 197 THR E CG2 1 ATOM 11274 N N . HIS G 1 197 ? 74.025 7.876 33.492 1.00 83.67 ? 198 HIS E N 1 ATOM 11275 C CA . HIS G 1 197 ? 72.787 7.273 33.014 1.00 81.66 ? 198 HIS E CA 1 ATOM 11276 C C . HIS G 1 197 ? 72.026 6.665 34.187 1.00 85.86 ? 198 HIS E C 1 ATOM 11277 O O . HIS G 1 197 ? 72.631 6.238 35.170 1.00 88.42 ? 198 HIS E O 1 ATOM 11278 C CB . HIS G 1 197 ? 73.090 6.215 31.946 1.00 78.93 ? 198 HIS E CB 1 ATOM 11279 C CG . HIS G 1 197 ? 71.877 5.517 31.413 1.00 78.83 ? 198 HIS E CG 1 ATOM 11280 N ND1 . HIS G 1 197 ? 71.714 4.149 31.487 1.00 79.18 ? 198 HIS E ND1 1 ATOM 11281 C CD2 . HIS G 1 197 ? 70.774 5.992 30.787 1.00 77.36 ? 198 HIS E CD2 1 ATOM 11282 C CE1 . HIS G 1 197 ? 70.562 3.814 30.935 1.00 78.26 ? 198 HIS E CE1 1 ATOM 11283 N NE2 . HIS G 1 197 ? 69.971 4.914 30.503 1.00 76.65 ? 198 HIS E NE2 1 ATOM 11284 N N . GLN G 1 198 ? 70.701 6.630 34.077 1.00 87.37 ? 199 GLN E N 1 ATOM 11285 C CA . GLN G 1 198 ? 69.832 6.165 35.156 1.00 94.54 ? 199 GLN E CA 1 ATOM 11286 C C . GLN G 1 198 ? 70.178 4.753 35.631 1.00 95.01 ? 199 GLN E C 1 ATOM 11287 O O . GLN G 1 198 ? 69.947 4.406 36.789 1.00 102.16 ? 199 GLN E O 1 ATOM 11288 C CB . GLN G 1 198 ? 68.368 6.215 34.708 1.00 98.91 ? 199 GLN E CB 1 ATOM 11289 C CG . GLN G 1 198 ? 67.361 6.062 35.837 1.00 106.39 ? 199 GLN E CG 1 ATOM 11290 C CD . GLN G 1 198 ? 65.949 5.842 35.331 1.00 110.79 ? 199 GLN E CD 1 ATOM 11291 O OE1 . GLN G 1 198 ? 65.738 5.168 34.324 1.00 110.11 ? 199 GLN E OE1 1 ATOM 11292 N NE2 . GLN G 1 198 ? 64.972 6.414 36.029 1.00 113.76 ? 199 GLN E NE2 1 ATOM 11293 N N . GLY G 1 199 ? 70.737 3.947 34.734 1.00 89.15 ? 200 GLY E N 1 ATOM 11294 C CA . GLY G 1 199 ? 71.058 2.566 35.044 1.00 88.90 ? 200 GLY E CA 1 ATOM 11295 C C . GLY G 1 199 ? 72.413 2.380 35.695 1.00 91.76 ? 200 GLY E C 1 ATOM 11296 O O . GLY G 1 199 ? 72.843 1.251 35.936 1.00 92.17 ? 200 GLY E O 1 ATOM 11297 N N . LEU G 1 200 ? 73.090 3.487 35.980 1.00 92.86 ? 201 LEU E N 1 ATOM 11298 C CA . LEU G 1 200 ? 74.404 3.432 36.610 1.00 95.27 ? 201 LEU E CA 1 ATOM 11299 C C . LEU G 1 200 ? 74.353 3.947 38.042 1.00 104.10 ? 201 LEU E C 1 ATOM 11300 O O . LEU G 1 200 ? 73.700 4.952 38.328 1.00 101.21 ? 201 LEU E O 1 ATOM 11301 C CB . LEU G 1 200 ? 75.421 4.238 35.801 1.00 89.21 ? 201 LEU E CB 1 ATOM 11302 C CG . LEU G 1 200 ? 75.711 3.733 34.388 1.00 85.52 ? 201 LEU E CG 1 ATOM 11303 C CD1 . LEU G 1 200 ? 76.628 4.700 33.660 1.00 86.47 ? 201 LEU E CD1 1 ATOM 11304 C CD2 . LEU G 1 200 ? 76.317 2.338 34.428 1.00 81.42 ? 201 LEU E CD2 1 ATOM 11305 N N . SER G 1 201 ? 75.044 3.247 38.937 1.00 113.08 ? 202 SER E N 1 ATOM 11306 C CA . SER G 1 201 ? 75.129 3.645 40.338 1.00 118.34 ? 202 SER E CA 1 ATOM 11307 C C . SER G 1 201 ? 75.766 5.028 40.477 1.00 116.78 ? 202 SER E C 1 ATOM 11308 O O . SER G 1 201 ? 75.336 5.847 41.291 1.00 116.35 ? 202 SER E O 1 ATOM 11309 C CB . SER G 1 201 ? 75.928 2.610 41.133 1.00 123.89 ? 202 SER E CB 1 ATOM 11310 O OG . SER G 1 201 ? 76.073 3.007 42.484 1.00 131.80 ? 202 SER E OG 1 ATOM 11311 N N . SER G 1 202 ? 76.788 5.272 39.664 1.00 115.88 ? 203 SER E N 1 ATOM 11312 C CA . SER G 1 202 ? 77.512 6.538 39.649 1.00 115.38 ? 203 SER E CA 1 ATOM 11313 C C . SER G 1 202 ? 78.342 6.604 38.365 1.00 112.10 ? 203 SER E C 1 ATOM 11314 O O . SER G 1 202 ? 78.729 5.559 37.839 1.00 108.70 ? 203 SER E O 1 ATOM 11315 C CB . SER G 1 202 ? 78.398 6.673 40.893 1.00 116.89 ? 203 SER E CB 1 ATOM 11316 O OG . SER G 1 202 ? 79.230 5.539 41.060 1.00 116.46 ? 203 SER E OG 1 ATOM 11317 N N . PRO G 1 203 ? 78.599 7.825 37.851 1.00 112.22 ? 204 PRO E N 1 ATOM 11318 C CA . PRO G 1 203 ? 79.308 8.073 36.587 1.00 107.95 ? 204 PRO E CA 1 ATOM 11319 C C . PRO G 1 203 ? 80.447 7.100 36.270 1.00 104.26 ? 204 PRO E C 1 ATOM 11320 O O . PRO G 1 203 ? 81.376 6.940 37.060 1.00 105.08 ? 204 PRO E O 1 ATOM 11321 C CB . PRO G 1 203 ? 79.853 9.486 36.785 1.00 109.96 ? 204 PRO E CB 1 ATOM 11322 C CG . PRO G 1 203 ? 78.783 10.157 37.577 1.00 111.39 ? 204 PRO E CG 1 ATOM 11323 C CD . PRO G 1 203 ? 78.172 9.094 38.474 1.00 113.16 ? 204 PRO E CD 1 ATOM 11324 N N . VAL G 1 204 ? 80.357 6.459 35.109 1.00 99.41 ? 205 VAL E N 1 ATOM 11325 C CA . VAL G 1 204 ? 81.334 5.460 34.690 1.00 96.25 ? 205 VAL E CA 1 ATOM 11326 C C . VAL G 1 204 ? 82.258 6.012 33.609 1.00 92.09 ? 205 VAL E C 1 ATOM 11327 O O . VAL G 1 204 ? 81.795 6.547 32.603 1.00 87.67 ? 205 VAL E O 1 ATOM 11328 C CB . VAL G 1 204 ? 80.638 4.185 34.170 1.00 91.08 ? 205 VAL E CB 1 ATOM 11329 C CG1 . VAL G 1 204 ? 81.636 3.260 33.489 1.00 84.57 ? 205 VAL E CG1 1 ATOM 11330 C CG2 . VAL G 1 204 ? 79.927 3.473 35.311 1.00 95.02 ? 205 VAL E CG2 1 ATOM 11331 N N . THR G 1 205 ? 83.564 5.877 33.820 1.00 92.72 ? 206 THR E N 1 ATOM 11332 C CA . THR G 1 205 ? 84.543 6.438 32.897 1.00 88.95 ? 206 THR E CA 1 ATOM 11333 C C . THR G 1 205 ? 85.440 5.375 32.272 1.00 85.63 ? 206 THR E C 1 ATOM 11334 O O . THR G 1 205 ? 85.905 4.461 32.949 1.00 88.10 ? 206 THR E O 1 ATOM 11335 C CB . THR G 1 205 ? 85.433 7.480 33.597 1.00 92.66 ? 206 THR E CB 1 ATOM 11336 O OG1 . THR G 1 205 ? 84.609 8.433 34.279 1.00 98.24 ? 206 THR E OG1 1 ATOM 11337 C CG2 . THR G 1 205 ? 86.299 8.207 32.586 1.00 90.23 ? 206 THR E CG2 1 ATOM 11338 N N . LYS G 1 206 ? 85.661 5.501 30.967 1.00 82.19 ? 207 LYS E N 1 ATOM 11339 C CA . LYS G 1 206 ? 86.641 4.690 30.255 1.00 82.31 ? 207 LYS E CA 1 ATOM 11340 C C . LYS G 1 206 ? 87.707 5.620 29.692 1.00 78.61 ? 207 LYS E C 1 ATOM 11341 O O . LYS G 1 206 ? 87.388 6.698 29.193 1.00 72.73 ? 207 LYS E O 1 ATOM 11342 C CB . LYS G 1 206 ? 85.981 3.884 29.134 1.00 82.85 ? 207 LYS E CB 1 ATOM 11343 C CG . LYS G 1 206 ? 84.898 2.922 29.600 1.00 85.30 ? 207 LYS E CG 1 ATOM 11344 C CD . LYS G 1 206 ? 85.483 1.676 30.250 1.00 89.81 ? 207 LYS E CD 1 ATOM 11345 C CE . LYS G 1 206 ? 84.384 0.698 30.646 1.00 90.37 ? 207 LYS E CE 1 ATOM 11346 N NZ . LYS G 1 206 ? 84.925 -0.587 31.167 1.00 91.00 ? 207 LYS E NZ 1 ATOM 11347 N N . SER G 1 207 ? 88.970 5.214 29.775 1.00 87.65 ? 208 SER E N 1 ATOM 11348 C CA . SER G 1 207 ? 90.060 6.102 29.380 1.00 89.76 ? 208 SER E CA 1 ATOM 11349 C C . SER G 1 207 ? 91.235 5.381 28.732 1.00 87.65 ? 208 SER E C 1 ATOM 11350 O O . SER G 1 207 ? 91.326 4.153 28.767 1.00 86.87 ? 208 SER E O 1 ATOM 11351 C CB . SER G 1 207 ? 90.563 6.892 30.591 1.00 92.91 ? 208 SER E CB 1 ATOM 11352 O OG . SER G 1 207 ? 91.170 6.037 31.544 1.00 93.86 ? 208 SER E OG 1 ATOM 11353 N N . PHE G 1 208 ? 92.132 6.162 28.137 1.00 87.69 ? 209 PHE E N 1 ATOM 11354 C CA . PHE G 1 208 ? 93.361 5.619 27.577 1.00 89.90 ? 209 PHE E CA 1 ATOM 11355 C C . PHE G 1 208 ? 94.476 6.651 27.560 1.00 94.97 ? 209 PHE E C 1 ATOM 11356 O O . PHE G 1 208 ? 94.226 7.852 27.470 1.00 100.03 ? 209 PHE E O 1 ATOM 11357 C CB . PHE G 1 208 ? 93.128 5.080 26.161 1.00 91.63 ? 209 PHE E CB 1 ATOM 11358 C CG . PHE G 1 208 ? 92.908 6.146 25.115 1.00 93.85 ? 209 PHE E CG 1 ATOM 11359 C CD1 . PHE G 1 208 ? 93.982 6.726 24.453 1.00 91.23 ? 209 PHE E CD1 1 ATOM 11360 C CD2 . PHE G 1 208 ? 91.625 6.535 24.763 1.00 94.48 ? 209 PHE E CD2 1 ATOM 11361 C CE1 . PHE G 1 208 ? 93.784 7.692 23.487 1.00 90.76 ? 209 PHE E CE1 1 ATOM 11362 C CE2 . PHE G 1 208 ? 91.420 7.499 23.793 1.00 92.81 ? 209 PHE E CE2 1 ATOM 11363 C CZ . PHE G 1 208 ? 92.503 8.079 23.155 1.00 92.53 ? 209 PHE E CZ 1 ATOM 11364 N N . ASN G 1 209 ? 95.709 6.165 27.639 1.00 91.95 ? 210 ASN E N 1 ATOM 11365 C CA . ASN G 1 209 ? 96.884 7.011 27.486 1.00 90.43 ? 210 ASN E CA 1 ATOM 11366 C C . ASN G 1 209 ? 97.411 6.912 26.061 1.00 84.29 ? 210 ASN E C 1 ATOM 11367 O O . ASN G 1 209 ? 97.517 5.817 25.509 1.00 85.64 ? 210 ASN E O 1 ATOM 11368 C CB . ASN G 1 209 ? 97.971 6.612 28.485 1.00 91.17 ? 210 ASN E CB 1 ATOM 11369 C CG . ASN G 1 209 ? 97.475 6.615 29.917 1.00 90.53 ? 210 ASN E CG 1 ATOM 11370 O OD1 . ASN G 1 209 ? 96.885 7.591 30.381 1.00 90.08 ? 210 ASN E OD1 1 ATOM 11371 N ND2 . ASN G 1 209 ? 97.700 5.512 30.621 1.00 92.99 ? 210 ASN E ND2 1 ATOM 11372 N N . ARG G 1 210 ? 97.735 8.056 25.467 1.00 79.37 ? 211 ARG E N 1 ATOM 11373 C CA . ARG G 1 210 ? 98.222 8.095 24.091 1.00 80.05 ? 211 ARG E CA 1 ATOM 11374 C C . ARG G 1 210 ? 99.525 7.313 23.918 1.00 87.52 ? 211 ARG E C 1 ATOM 11375 O O . ARG G 1 210 ? 100.398 7.326 24.786 1.00 88.21 ? 211 ARG E O 1 ATOM 11376 C CB . ARG G 1 210 ? 98.418 9.543 23.642 1.00 77.38 ? 211 ARG E CB 1 ATOM 11377 C CG . ARG G 1 210 ? 98.958 9.685 22.232 1.00 77.93 ? 211 ARG E CG 1 ATOM 11378 C CD . ARG G 1 210 ? 99.066 11.144 21.840 1.00 84.13 ? 211 ARG E CD 1 ATOM 11379 N NE . ARG G 1 210 ? 99.857 11.903 22.803 1.00 93.35 ? 211 ARG E NE 1 ATOM 11380 C CZ . ARG G 1 210 ? 101.180 12.024 22.755 1.00 96.59 ? 211 ARG E CZ 1 ATOM 11381 N NH1 . ARG G 1 210 ? 101.866 11.432 21.787 1.00 95.84 ? 211 ARG E NH1 1 ATOM 11382 N NH2 . ARG G 1 210 ? 101.817 12.735 23.675 1.00 99.39 ? 211 ARG E NH2 1 ATOM 11383 O OXT . ARG G 1 210 ? 99.735 6.645 22.904 1.00 91.79 ? 211 ARG E OXT 1 ATOM 11384 N N . GLN H 2 1 ? 54.059 -9.800 -4.109 1.00 55.30 ? 1 GLN F N 1 ATOM 11385 C CA . GLN H 2 1 ? 54.426 -10.002 -5.506 1.00 54.23 ? 1 GLN F CA 1 ATOM 11386 C C . GLN H 2 1 ? 55.039 -8.771 -6.119 1.00 45.50 ? 1 GLN F C 1 ATOM 11387 O O . GLN H 2 1 ? 56.252 -8.710 -6.329 1.00 54.46 ? 1 GLN F O 1 ATOM 11388 C CB . GLN H 2 1 ? 53.211 -10.411 -6.312 1.00 54.19 ? 1 GLN F CB 1 ATOM 11389 C CG . GLN H 2 1 ? 52.590 -11.623 -5.756 1.00 61.05 ? 1 GLN F CG 1 ATOM 11390 C CD . GLN H 2 1 ? 53.567 -12.763 -5.680 1.00 58.44 ? 1 GLN F CD 1 ATOM 11391 O OE1 . GLN H 2 1 ? 53.774 -13.471 -6.658 1.00 51.30 ? 1 GLN F OE1 1 ATOM 11392 N NE2 . GLN H 2 1 ? 54.176 -12.951 -4.513 1.00 70.22 ? 1 GLN F NE2 1 ATOM 11393 N N . VAL H 2 2 ? 54.186 -7.797 -6.411 1.00 36.04 ? 2 VAL F N 1 ATOM 11394 C CA . VAL H 2 2 ? 54.638 -6.545 -6.994 1.00 18.34 ? 2 VAL F CA 1 ATOM 11395 C C . VAL H 2 2 ? 55.658 -5.858 -6.102 1.00 19.08 ? 2 VAL F C 1 ATOM 11396 O O . VAL H 2 2 ? 55.459 -5.731 -4.893 1.00 26.37 ? 2 VAL F O 1 ATOM 11397 C CB . VAL H 2 2 ? 53.470 -5.598 -7.241 1.00 31.00 ? 2 VAL F CB 1 ATOM 11398 C CG1 . VAL H 2 2 ? 53.885 -4.504 -8.209 1.00 36.07 ? 2 VAL F CG1 1 ATOM 11399 C CG2 . VAL H 2 2 ? 52.305 -6.380 -7.788 1.00 42.71 ? 2 VAL F CG2 1 ATOM 11400 N N . GLN H 2 3 ? 56.767 -5.446 -6.708 1.00 21.22 ? 3 GLN F N 1 ATOM 11401 C CA . GLN H 2 3 ? 57.767 -4.630 -6.032 1.00 23.73 ? 3 GLN F CA 1 ATOM 11402 C C . GLN H 2 3 ? 58.058 -3.401 -6.865 1.00 22.44 ? 3 GLN F C 1 ATOM 11403 O O . GLN H 2 3 ? 58.000 -3.454 -8.093 1.00 22.97 ? 3 GLN F O 1 ATOM 11404 C CB . GLN H 2 3 ? 59.067 -5.401 -5.798 1.00 19.04 ? 3 GLN F CB 1 ATOM 11405 C CG . GLN H 2 3 ? 59.006 -6.440 -4.703 1.00 35.68 ? 3 GLN F CG 1 ATOM 11406 C CD . GLN H 2 3 ? 60.388 -6.811 -4.205 1.00 47.64 ? 3 GLN F CD 1 ATOM 11407 O OE1 . GLN H 2 3 ? 61.242 -5.945 -4.007 1.00 61.19 ? 3 GLN F OE1 1 ATOM 11408 N NE2 . GLN H 2 3 ? 60.622 -8.100 -4.015 1.00 48.77 ? 3 GLN F NE2 1 ATOM 11409 N N . LEU H 2 4 ? 58.361 -2.293 -6.195 1.00 16.23 ? 4 LEU F N 1 ATOM 11410 C CA . LEU H 2 4 ? 58.800 -1.089 -6.889 1.00 16.73 ? 4 LEU F CA 1 ATOM 11411 C C . LEU H 2 4 ? 60.241 -0.791 -6.510 1.00 23.71 ? 4 LEU F C 1 ATOM 11412 O O . LEU H 2 4 ? 60.674 -1.068 -5.389 1.00 28.90 ? 4 LEU F O 1 ATOM 11413 C CB . LEU H 2 4 ? 57.909 0.115 -6.556 1.00 21.18 ? 4 LEU F CB 1 ATOM 11414 C CG . LEU H 2 4 ? 56.380 0.008 -6.598 1.00 26.89 ? 4 LEU F CG 1 ATOM 11415 C CD1 . LEU H 2 4 ? 55.790 1.394 -6.754 1.00 22.91 ? 4 LEU F CD1 1 ATOM 11416 C CD2 . LEU H 2 4 ? 55.853 -0.924 -7.685 1.00 26.29 ? 4 LEU F CD2 1 ATOM 11417 N N . GLN H 2 5 ? 60.992 -0.240 -7.452 1.00 21.34 ? 5 GLN F N 1 ATOM 11418 C CA . GLN H 2 5 ? 62.362 0.161 -7.179 1.00 24.17 ? 5 GLN F CA 1 ATOM 11419 C C . GLN H 2 5 ? 62.668 1.382 -8.029 1.00 23.45 ? 5 GLN F C 1 ATOM 11420 O O . GLN H 2 5 ? 62.308 1.432 -9.207 1.00 25.68 ? 5 GLN F O 1 ATOM 11421 C CB . GLN H 2 5 ? 63.343 -0.980 -7.471 1.00 27.60 ? 5 GLN F CB 1 ATOM 11422 C CG . GLN H 2 5 ? 64.724 -0.826 -6.816 1.00 31.23 ? 5 GLN F CG 1 ATOM 11423 C CD . GLN H 2 5 ? 64.719 -1.161 -5.329 1.00 35.26 ? 5 GLN F CD 1 ATOM 11424 O OE1 . GLN H 2 5 ? 63.706 -1.595 -4.782 1.00 38.29 ? 5 GLN F OE1 1 ATOM 11425 N NE2 . GLN H 2 5 ? 65.857 -0.957 -4.671 1.00 33.64 ? 5 GLN F NE2 1 ATOM 11426 N N . GLN H 2 6 ? 63.314 2.375 -7.436 1.00 21.41 ? 6 GLN F N 1 ATOM 11427 C CA . GLN H 2 6 ? 63.518 3.638 -8.130 1.00 25.85 ? 6 GLN F CA 1 ATOM 11428 C C . GLN H 2 6 ? 64.989 4.020 -8.203 1.00 26.50 ? 6 GLN F C 1 ATOM 11429 O O . GLN H 2 6 ? 65.799 3.557 -7.405 1.00 31.96 ? 6 GLN F O 1 ATOM 11430 C CB . GLN H 2 6 ? 62.716 4.749 -7.450 1.00 28.15 ? 6 GLN F CB 1 ATOM 11431 C CG . GLN H 2 6 ? 62.967 4.858 -5.968 1.00 33.10 ? 6 GLN F CG 1 ATOM 11432 C CD . GLN H 2 6 ? 62.024 5.826 -5.295 1.00 32.61 ? 6 GLN F CD 1 ATOM 11433 O OE1 . GLN H 2 6 ? 61.142 5.420 -4.541 1.00 31.97 ? 6 GLN F OE1 1 ATOM 11434 N NE2 . GLN H 2 6 ? 62.207 7.117 -5.559 1.00 30.05 ? 6 GLN F NE2 1 ATOM 11435 N N . TRP H 2 7 ? 65.323 4.859 -9.178 1.00 23.11 ? 7 TRP F N 1 ATOM 11436 C CA . TRP H 2 7 ? 66.687 5.336 -9.354 1.00 21.35 ? 7 TRP F CA 1 ATOM 11437 C C . TRP H 2 7 ? 66.694 6.732 -9.978 1.00 22.83 ? 7 TRP F C 1 ATOM 11438 O O . TRP H 2 7 ? 65.674 7.194 -10.488 1.00 28.03 ? 7 TRP F O 1 ATOM 11439 C CB . TRP H 2 7 ? 67.493 4.357 -10.210 1.00 21.07 ? 7 TRP F CB 1 ATOM 11440 C CG . TRP H 2 7 ? 66.905 4.075 -11.565 1.00 30.63 ? 7 TRP F CG 1 ATOM 11441 C CD1 . TRP H 2 7 ? 67.192 4.719 -12.738 1.00 26.94 ? 7 TRP F CD1 1 ATOM 11442 C CD2 . TRP H 2 7 ? 65.946 3.059 -11.890 1.00 23.19 ? 7 TRP F CD2 1 ATOM 11443 N NE1 . TRP H 2 7 ? 66.464 4.172 -13.769 1.00 27.49 ? 7 TRP F NE1 1 ATOM 11444 C CE2 . TRP H 2 7 ? 65.692 3.151 -13.275 1.00 24.68 ? 7 TRP F CE2 1 ATOM 11445 C CE3 . TRP H 2 7 ? 65.272 2.088 -11.143 1.00 21.43 ? 7 TRP F CE3 1 ATOM 11446 C CZ2 . TRP H 2 7 ? 64.791 2.306 -13.930 1.00 26.46 ? 7 TRP F CZ2 1 ATOM 11447 C CZ3 . TRP H 2 7 ? 64.378 1.246 -11.796 1.00 29.75 ? 7 TRP F CZ3 1 ATOM 11448 C CH2 . TRP H 2 7 ? 64.146 1.362 -13.175 1.00 25.37 ? 7 TRP F CH2 1 ATOM 11449 N N . GLY H 2 8 ? 67.846 7.396 -9.927 1.00 25.61 ? 8 GLY F N 1 ATOM 11450 C CA . GLY H 2 8 ? 67.992 8.750 -10.442 1.00 18.32 ? 8 GLY F CA 1 ATOM 11451 C C . GLY H 2 8 ? 68.995 9.547 -9.627 1.00 29.27 ? 8 GLY F C 1 ATOM 11452 O O . GLY H 2 8 ? 69.365 9.141 -8.524 1.00 27.15 ? 8 GLY F O 1 ATOM 11453 N N . ALA H 2 9 ? 69.432 10.686 -10.163 1.00 30.58 ? 9 ALA F N 1 ATOM 11454 C CA . ALA H 2 9 ? 70.474 11.488 -9.523 1.00 29.69 ? 9 ALA F CA 1 ATOM 11455 C C . ALA H 2 9 ? 70.037 12.018 -8.161 1.00 37.18 ? 9 ALA F C 1 ATOM 11456 O O . ALA H 2 9 ? 68.963 12.604 -8.029 1.00 32.76 ? 9 ALA F O 1 ATOM 11457 C CB . ALA H 2 9 ? 70.882 12.642 -10.427 1.00 30.34 ? 9 ALA F CB 1 ATOM 11458 N N . GLY H 2 10 ? 70.887 11.821 -7.157 1.00 41.72 ? 10 GLY F N 1 ATOM 11459 C CA . GLY H 2 10 ? 70.588 12.248 -5.802 1.00 40.20 ? 10 GLY F CA 1 ATOM 11460 C C . GLY H 2 10 ? 71.103 13.631 -5.440 1.00 37.81 ? 10 GLY F C 1 ATOM 11461 O O . GLY H 2 10 ? 70.773 14.160 -4.377 1.00 44.56 ? 10 GLY F O 1 ATOM 11462 N N . LEU H 2 11 ? 71.910 14.223 -6.314 1.00 30.73 ? 11 LEU F N 1 ATOM 11463 C CA . LEU H 2 11 ? 72.464 15.550 -6.056 1.00 32.30 ? 11 LEU F CA 1 ATOM 11464 C C . LEU H 2 11 ? 72.186 16.519 -7.200 1.00 35.56 ? 11 LEU F C 1 ATOM 11465 O O . LEU H 2 11 ? 72.566 16.275 -8.346 1.00 40.27 ? 11 LEU F O 1 ATOM 11466 C CB . LEU H 2 11 ? 73.972 15.469 -5.808 1.00 27.57 ? 11 LEU F CB 1 ATOM 11467 C CG . LEU H 2 11 ? 74.662 16.799 -5.504 1.00 36.53 ? 11 LEU F CG 1 ATOM 11468 C CD1 . LEU H 2 11 ? 74.115 17.409 -4.223 1.00 39.15 ? 11 LEU F CD1 1 ATOM 11469 C CD2 . LEU H 2 11 ? 76.170 16.623 -5.413 1.00 36.88 ? 11 LEU F CD2 1 ATOM 11470 N N . LEU H 2 12 ? 71.522 17.622 -6.879 1.00 32.58 ? 12 LEU F N 1 ATOM 11471 C CA . LEU H 2 12 ? 71.201 18.639 -7.873 1.00 38.85 ? 12 LEU F CA 1 ATOM 11472 C C . LEU H 2 12 ? 71.622 20.015 -7.401 1.00 37.13 ? 12 LEU F C 1 ATOM 11473 O O . LEU H 2 12 ? 71.495 20.336 -6.221 1.00 43.38 ? 12 LEU F O 1 ATOM 11474 C CB . LEU H 2 12 ? 69.705 18.660 -8.168 1.00 38.71 ? 12 LEU F CB 1 ATOM 11475 C CG . LEU H 2 12 ? 69.022 17.337 -8.474 1.00 43.14 ? 12 LEU F CG 1 ATOM 11476 C CD1 . LEU H 2 12 ? 67.521 17.538 -8.449 1.00 42.53 ? 12 LEU F CD1 1 ATOM 11477 C CD2 . LEU H 2 12 ? 69.479 16.819 -9.824 1.00 49.82 ? 12 LEU F CD2 1 ATOM 11478 N N . LYS H 2 13 ? 72.110 20.834 -8.324 1.00 38.41 ? 13 LYS F N 1 ATOM 11479 C CA . LYS H 2 13 ? 72.339 22.243 -8.027 1.00 36.61 ? 13 LYS F CA 1 ATOM 11480 C C . LYS H 2 13 ? 71.039 23.011 -8.238 1.00 34.64 ? 13 LYS F C 1 ATOM 11481 O O . LYS H 2 13 ? 70.222 22.623 -9.068 1.00 37.15 ? 13 LYS F O 1 ATOM 11482 C CB . LYS H 2 13 ? 73.450 22.815 -8.906 1.00 39.44 ? 13 LYS F CB 1 ATOM 11483 C CG . LYS H 2 13 ? 74.839 22.314 -8.557 1.00 43.95 ? 13 LYS F CG 1 ATOM 11484 C CD . LYS H 2 13 ? 75.906 23.267 -9.085 1.00 48.72 ? 13 LYS F CD 1 ATOM 11485 C CE . LYS H 2 13 ? 77.261 22.993 -8.456 1.00 44.57 ? 13 LYS F CE 1 ATOM 11486 N NZ . LYS H 2 13 ? 77.706 21.603 -8.712 1.00 44.17 ? 13 LYS F NZ 1 ATOM 11487 N N . PRO H 2 14 ? 70.832 24.094 -7.473 1.00 39.02 ? 14 PRO F N 1 ATOM 11488 C CA . PRO H 2 14 ? 69.644 24.934 -7.668 1.00 35.06 ? 14 PRO F CA 1 ATOM 11489 C C . PRO H 2 14 ? 69.447 25.314 -9.137 1.00 40.95 ? 14 PRO F C 1 ATOM 11490 O O . PRO H 2 14 ? 70.441 25.564 -9.827 1.00 43.25 ? 14 PRO F O 1 ATOM 11491 C CB . PRO H 2 14 ? 69.943 26.168 -6.815 1.00 35.09 ? 14 PRO F CB 1 ATOM 11492 C CG . PRO H 2 14 ? 70.837 25.657 -5.731 1.00 36.81 ? 14 PRO F CG 1 ATOM 11493 C CD . PRO H 2 14 ? 71.679 24.577 -6.367 1.00 37.96 ? 14 PRO F CD 1 ATOM 11494 N N . SER H 2 15 ? 68.186 25.309 -9.578 1.00 33.57 ? 15 SER F N 1 ATOM 11495 C CA . SER H 2 15 ? 67.735 25.613 -10.949 1.00 39.74 ? 15 SER F CA 1 ATOM 11496 C C . SER H 2 15 ? 67.762 24.397 -11.883 1.00 36.52 ? 15 SER F C 1 ATOM 11497 O O . SER H 2 15 ? 67.188 24.444 -12.969 1.00 36.64 ? 15 SER F O 1 ATOM 11498 C CB . SER H 2 15 ? 68.546 26.754 -11.586 1.00 45.02 ? 15 SER F CB 1 ATOM 11499 O OG . SER H 2 15 ? 69.814 26.295 -12.031 1.00 53.07 ? 15 SER F OG 1 ATOM 11500 N N . GLU H 2 16 ? 68.404 23.308 -11.472 1.00 31.34 ? 16 GLU F N 1 ATOM 11501 C CA . GLU H 2 16 ? 68.436 22.117 -12.322 1.00 34.74 ? 16 GLU F CA 1 ATOM 11502 C C . GLU H 2 16 ? 67.134 21.322 -12.225 1.00 29.85 ? 16 GLU F C 1 ATOM 11503 O O . GLU H 2 16 ? 66.222 21.692 -11.486 1.00 33.51 ? 16 GLU F O 1 ATOM 11504 C CB . GLU H 2 16 ? 69.633 21.236 -11.969 1.00 36.91 ? 16 GLU F CB 1 ATOM 11505 C CG . GLU H 2 16 ? 70.958 21.828 -12.429 1.00 44.64 ? 16 GLU F CG 1 ATOM 11506 C CD . GLU H 2 16 ? 72.158 21.067 -11.908 1.00 51.57 ? 16 GLU F CD 1 ATOM 11507 O OE1 . GLU H 2 16 ? 71.964 20.039 -11.223 1.00 49.07 ? 16 GLU F OE1 1 ATOM 11508 O OE2 . GLU H 2 16 ? 73.298 21.502 -12.179 1.00 58.11 ? 16 GLU F OE2 1 ATOM 11509 N N . THR H 2 17 ? 67.049 20.235 -12.982 1.00 36.86 ? 17 THR F N 1 ATOM 11510 C CA . THR H 2 17 ? 65.816 19.458 -13.056 1.00 36.96 ? 17 THR F CA 1 ATOM 11511 C C . THR H 2 17 ? 65.941 18.102 -12.375 1.00 33.72 ? 17 THR F C 1 ATOM 11512 O O . THR H 2 17 ? 66.852 17.327 -12.662 1.00 28.87 ? 17 THR F O 1 ATOM 11513 C CB . THR H 2 17 ? 65.377 19.238 -14.516 1.00 37.27 ? 17 THR F CB 1 ATOM 11514 O OG1 . THR H 2 17 ? 65.206 20.508 -15.155 1.00 39.51 ? 17 THR F OG1 1 ATOM 11515 C CG2 . THR H 2 17 ? 64.062 18.473 -14.578 1.00 33.29 ? 17 THR F CG2 1 ATOM 11516 N N . LEU H 2 18 ? 65.013 17.831 -11.466 1.00 33.38 ? 18 LEU F N 1 ATOM 11517 C CA . LEU H 2 18 ? 64.924 16.536 -10.813 1.00 30.63 ? 18 LEU F CA 1 ATOM 11518 C C . LEU H 2 18 ? 64.301 15.515 -11.756 1.00 32.88 ? 18 LEU F C 1 ATOM 11519 O O . LEU H 2 18 ? 63.277 15.792 -12.377 1.00 30.98 ? 18 LEU F O 1 ATOM 11520 C CB . LEU H 2 18 ? 64.104 16.641 -9.526 1.00 33.72 ? 18 LEU F CB 1 ATOM 11521 C CG . LEU H 2 18 ? 63.828 15.322 -8.805 1.00 35.76 ? 18 LEU F CG 1 ATOM 11522 C CD1 . LEU H 2 18 ? 65.125 14.561 -8.577 1.00 47.42 ? 18 LEU F CD1 1 ATOM 11523 C CD2 . LEU H 2 18 ? 63.119 15.571 -7.488 1.00 32.26 ? 18 LEU F CD2 1 ATOM 11524 N N . SER H 2 19 ? 64.929 14.344 -11.862 1.00 25.16 ? 19 SER F N 1 ATOM 11525 C CA . SER H 2 19 ? 64.427 13.250 -12.691 1.00 32.48 ? 19 SER F CA 1 ATOM 11526 C C . SER H 2 19 ? 64.581 11.914 -11.985 1.00 37.98 ? 19 SER F C 1 ATOM 11527 O O . SER H 2 19 ? 65.697 11.450 -11.754 1.00 42.30 ? 19 SER F O 1 ATOM 11528 C CB . SER H 2 19 ? 65.152 13.198 -14.035 1.00 32.84 ? 19 SER F CB 1 ATOM 11529 O OG . SER H 2 19 ? 64.568 14.095 -14.958 1.00 54.15 ? 19 SER F OG 1 ATOM 11530 N N . LEU H 2 20 ? 63.457 11.297 -11.644 1.00 32.73 ? 20 LEU F N 1 ATOM 11531 C CA . LEU H 2 20 ? 63.478 9.976 -11.039 1.00 26.64 ? 20 LEU F CA 1 ATOM 11532 C C . LEU H 2 20 ? 62.665 8.999 -11.876 1.00 29.53 ? 20 LEU F C 1 ATOM 11533 O O . LEU H 2 20 ? 61.696 9.388 -12.528 1.00 24.68 ? 20 LEU F O 1 ATOM 11534 C CB . LEU H 2 20 ? 62.940 10.030 -9.610 1.00 18.91 ? 20 LEU F CB 1 ATOM 11535 C CG . LEU H 2 20 ? 63.664 10.996 -8.672 1.00 26.89 ? 20 LEU F CG 1 ATOM 11536 C CD1 . LEU H 2 20 ? 62.929 11.077 -7.354 1.00 24.02 ? 20 LEU F CD1 1 ATOM 11537 C CD2 . LEU H 2 20 ? 65.109 10.571 -8.457 1.00 28.68 ? 20 LEU F CD2 1 ATOM 11538 N N . THR H 2 21 ? 63.077 7.735 -11.856 1.00 25.92 ? 21 THR F N 1 ATOM 11539 C CA . THR H 2 21 ? 62.358 6.668 -12.536 1.00 26.44 ? 21 THR F CA 1 ATOM 11540 C C . THR H 2 21 ? 61.983 5.574 -11.543 1.00 27.54 ? 21 THR F C 1 ATOM 11541 O O . THR H 2 21 ? 62.802 5.174 -10.714 1.00 20.42 ? 21 THR F O 1 ATOM 11542 C CB . THR H 2 21 ? 63.193 6.044 -13.672 1.00 30.36 ? 21 THR F CB 1 ATOM 11543 O OG1 . THR H 2 21 ? 63.577 7.058 -14.606 1.00 35.71 ? 21 THR F OG1 1 ATOM 11544 C CG2 . THR H 2 21 ? 62.391 4.960 -14.400 1.00 27.60 ? 21 THR F CG2 1 ATOM 11545 N N . CYS H 2 22 ? 60.746 5.097 -11.624 1.00 21.21 ? 22 CYS F N 1 ATOM 11546 C CA . CYS H 2 22 ? 60.310 3.997 -10.782 1.00 21.17 ? 22 CYS F CA 1 ATOM 11547 C C . CYS H 2 22 ? 60.107 2.754 -11.630 1.00 26.84 ? 22 CYS F C 1 ATOM 11548 O O . CYS H 2 22 ? 59.344 2.776 -12.599 1.00 25.98 ? 22 CYS F O 1 ATOM 11549 C CB . CYS H 2 22 ? 59.016 4.353 -10.044 1.00 23.75 ? 22 CYS F CB 1 ATOM 11550 S SG . CYS H 2 22 ? 58.472 3.128 -8.809 1.00 29.98 ? 22 CYS F SG 1 ATOM 11551 N N . GLY H 2 23 ? 60.794 1.676 -11.267 1.00 20.96 ? 23 GLY F N 1 ATOM 11552 C CA . GLY H 2 23 ? 60.613 0.402 -11.938 1.00 16.03 ? 23 GLY F CA 1 ATOM 11553 C C . GLY H 2 23 ? 59.551 -0.421 -11.234 1.00 19.82 ? 23 GLY F C 1 ATOM 11554 O O . GLY H 2 23 ? 59.505 -0.455 -10.006 1.00 21.01 ? 23 GLY F O 1 ATOM 11555 N N . VAL H 2 24 ? 58.694 -1.083 -12.005 1.00 20.84 ? 24 VAL F N 1 ATOM 11556 C CA . VAL H 2 24 ? 57.659 -1.932 -11.431 1.00 20.42 ? 24 VAL F CA 1 ATOM 11557 C C . VAL H 2 24 ? 57.884 -3.383 -11.850 1.00 24.62 ? 24 VAL F C 1 ATOM 11558 O O . VAL H 2 24 ? 58.014 -3.685 -13.036 1.00 31.77 ? 24 VAL F O 1 ATOM 11559 C CB . VAL H 2 24 ? 56.252 -1.460 -11.850 1.00 19.36 ? 24 VAL F CB 1 ATOM 11560 C CG1 . VAL H 2 24 ? 55.188 -2.370 -11.279 1.00 16.60 ? 24 VAL F CG1 1 ATOM 11561 C CG2 . VAL H 2 24 ? 56.020 -0.015 -11.392 1.00 16.69 ? 24 VAL F CG2 1 ATOM 11562 N N . TYR H 2 25 ? 57.934 -4.276 -10.865 1.00 20.82 ? 25 TYR F N 1 ATOM 11563 C CA . TYR H 2 25 ? 58.291 -5.674 -11.095 1.00 19.59 ? 25 TYR F CA 1 ATOM 11564 C C . TYR H 2 25 ? 57.203 -6.620 -10.618 1.00 22.59 ? 25 TYR F C 1 ATOM 11565 O O . TYR H 2 25 ? 56.703 -6.484 -9.500 1.00 22.98 ? 25 TYR F O 1 ATOM 11566 C CB . TYR H 2 25 ? 59.600 -6.011 -10.379 1.00 19.81 ? 25 TYR F CB 1 ATOM 11567 C CG . TYR H 2 25 ? 60.714 -5.029 -10.654 1.00 20.78 ? 25 TYR F CG 1 ATOM 11568 C CD1 . TYR H 2 25 ? 60.845 -3.868 -9.896 1.00 17.85 ? 25 TYR F CD1 1 ATOM 11569 C CD2 . TYR H 2 25 ? 61.637 -5.260 -11.669 1.00 19.11 ? 25 TYR F CD2 1 ATOM 11570 C CE1 . TYR H 2 25 ? 61.868 -2.961 -10.143 1.00 17.31 ? 25 TYR F CE1 1 ATOM 11571 C CE2 . TYR H 2 25 ? 62.665 -4.358 -11.921 1.00 23.67 ? 25 TYR F CE2 1 ATOM 11572 C CZ . TYR H 2 25 ? 62.771 -3.210 -11.155 1.00 23.56 ? 25 TYR F CZ 1 ATOM 11573 O OH . TYR H 2 25 ? 63.782 -2.308 -11.399 1.00 27.76 ? 25 TYR F OH 1 ATOM 11574 N N . GLY H 2 26 ? 56.841 -7.582 -11.461 1.00 25.97 ? 26 GLY F N 1 ATOM 11575 C CA . GLY H 2 26 ? 55.895 -8.609 -11.063 1.00 32.54 ? 26 GLY F CA 1 ATOM 11576 C C . GLY H 2 26 ? 54.520 -8.451 -11.678 1.00 39.70 ? 26 GLY F C 1 ATOM 11577 O O . GLY H 2 26 ? 53.758 -9.417 -11.766 1.00 40.94 ? 26 GLY F O 1 ATOM 11578 N N . GLU H 2 27 ? 54.199 -7.231 -12.099 1.00 32.18 ? 27 GLU F N 1 ATOM 11579 C CA . GLU H 2 27 ? 52.975 -6.987 -12.850 1.00 27.57 ? 27 GLU F CA 1 ATOM 11580 C C . GLU H 2 27 ? 53.167 -5.815 -13.811 1.00 29.01 ? 27 GLU F C 1 ATOM 11581 O O . GLU H 2 27 ? 54.154 -5.076 -13.717 1.00 23.33 ? 27 GLU F O 1 ATOM 11582 C CB . GLU H 2 27 ? 51.798 -6.724 -11.904 1.00 31.11 ? 27 GLU F CB 1 ATOM 11583 C CG . GLU H 2 27 ? 51.824 -5.361 -11.211 1.00 47.96 ? 27 GLU F CG 1 ATOM 11584 C CD . GLU H 2 27 ? 50.605 -5.128 -10.319 1.00 56.90 ? 27 GLU F CD 1 ATOM 11585 O OE1 . GLU H 2 27 ? 49.853 -6.098 -10.068 1.00 63.45 ? 27 GLU F OE1 1 ATOM 11586 O OE2 . GLU H 2 27 ? 50.401 -3.980 -9.862 1.00 40.24 ? 27 GLU F OE2 1 ATOM 11587 N N . SER H 2 28 ? 52.229 -5.655 -14.742 1.00 21.99 ? 28 SER F N 1 ATOM 11588 C CA . SER H 2 28 ? 52.251 -4.516 -15.651 1.00 29.08 ? 28 SER F CA 1 ATOM 11589 C C . SER H 2 28 ? 51.634 -3.295 -14.971 1.00 26.65 ? 28 SER F C 1 ATOM 11590 O O . SER H 2 28 ? 51.131 -3.391 -13.851 1.00 26.03 ? 28 SER F O 1 ATOM 11591 C CB . SER H 2 28 ? 51.506 -4.833 -16.947 1.00 31.54 ? 28 SER F CB 1 ATOM 11592 O OG . SER H 2 28 ? 50.118 -4.613 -16.789 1.00 31.21 ? 28 SER F OG 1 ATOM 11593 N N . LEU H 2 29 ? 51.670 -2.154 -15.652 1.00 23.57 ? 29 LEU F N 1 ATOM 11594 C CA . LEU H 2 29 ? 51.136 -0.910 -15.093 1.00 24.28 ? 29 LEU F CA 1 ATOM 11595 C C . LEU H 2 29 ? 49.610 -0.813 -15.189 1.00 30.68 ? 29 LEU F C 1 ATOM 11596 O O . LEU H 2 29 ? 48.993 -0.001 -14.497 1.00 33.62 ? 29 LEU F O 1 ATOM 11597 C CB . LEU H 2 29 ? 51.763 0.302 -15.791 1.00 17.14 ? 29 LEU F CB 1 ATOM 11598 C CG . LEU H 2 29 ? 53.279 0.470 -15.681 1.00 27.52 ? 29 LEU F CG 1 ATOM 11599 C CD1 . LEU H 2 29 ? 53.720 1.775 -16.326 1.00 30.41 ? 29 LEU F CD1 1 ATOM 11600 C CD2 . LEU H 2 29 ? 53.729 0.404 -14.230 1.00 28.70 ? 29 LEU F CD2 1 ATOM 11601 N N . SER H 2 30 ? 49.006 -1.634 -16.043 1.00 25.70 ? 30 SER F N 1 ATOM 11602 C CA . SER H 2 30 ? 47.571 -1.543 -16.316 1.00 24.22 ? 30 SER F CA 1 ATOM 11603 C C . SER H 2 30 ? 46.712 -1.749 -15.076 1.00 22.83 ? 30 SER F C 1 ATOM 11604 O O . SER H 2 30 ? 47.032 -2.575 -14.225 1.00 30.91 ? 30 SER F O 1 ATOM 11605 C CB . SER H 2 30 ? 47.174 -2.558 -17.389 1.00 26.53 ? 30 SER F CB 1 ATOM 11606 O OG . SER H 2 30 ? 47.685 -2.186 -18.659 1.00 32.86 ? 30 SER F OG 1 ATOM 11607 N N . GLY H 2 31 ? 45.629 -0.982 -14.975 1.00 22.92 ? 31 GLY F N 1 ATOM 11608 C CA . GLY H 2 31 ? 44.663 -1.148 -13.902 1.00 24.12 ? 31 GLY F CA 1 ATOM 11609 C C . GLY H 2 31 ? 44.972 -0.451 -12.587 1.00 24.96 ? 31 GLY F C 1 ATOM 11610 O O . GLY H 2 31 ? 44.242 -0.617 -11.610 1.00 25.39 ? 31 GLY F O 1 ATOM 11611 N N . HIS H 2 32 ? 46.047 0.329 -12.543 1.00 24.66 ? 32 HIS F N 1 ATOM 11612 C CA . HIS H 2 32 ? 46.398 1.043 -11.318 1.00 27.04 ? 32 HIS F CA 1 ATOM 11613 C C . HIS H 2 32 ? 46.787 2.494 -11.559 1.00 28.23 ? 32 HIS F C 1 ATOM 11614 O O . HIS H 2 32 ? 47.313 2.840 -12.617 1.00 25.50 ? 32 HIS F O 1 ATOM 11615 C CB . HIS H 2 32 ? 47.560 0.357 -10.597 1.00 28.94 ? 32 HIS F CB 1 ATOM 11616 C CG . HIS H 2 32 ? 47.226 -0.989 -10.040 1.00 31.59 ? 32 HIS F CG 1 ATOM 11617 N ND1 . HIS H 2 32 ? 47.386 -2.152 -10.763 1.00 26.13 ? 32 HIS F ND1 1 ATOM 11618 C CD2 . HIS H 2 32 ? 46.755 -1.361 -8.827 1.00 14.76 ? 32 HIS F CD2 1 ATOM 11619 C CE1 . HIS H 2 32 ? 47.021 -3.182 -10.022 1.00 28.57 ? 32 HIS F CE1 1 ATOM 11620 N NE2 . HIS H 2 32 ? 46.635 -2.730 -8.843 1.00 26.04 ? 32 HIS F NE2 1 ATOM 11621 N N . TYR H 2 33 ? 46.529 3.330 -10.560 1.00 19.90 ? 33 TYR F N 1 ATOM 11622 C CA . TYR H 2 33 ? 47.162 4.637 -10.469 1.00 23.59 ? 33 TYR F CA 1 ATOM 11623 C C . TYR H 2 33 ? 48.576 4.483 -9.927 1.00 23.29 ? 33 TYR F C 1 ATOM 11624 O O . TYR H 2 33 ? 48.843 3.608 -9.097 1.00 24.48 ? 33 TYR F O 1 ATOM 11625 C CB . TYR H 2 33 ? 46.380 5.576 -9.556 1.00 28.16 ? 33 TYR F CB 1 ATOM 11626 C CG . TYR H 2 33 ? 45.052 6.036 -10.092 1.00 30.73 ? 33 TYR F CG 1 ATOM 11627 C CD1 . TYR H 2 33 ? 44.944 7.228 -10.797 1.00 31.84 ? 33 TYR F CD1 1 ATOM 11628 C CD2 . TYR H 2 33 ? 43.901 5.294 -9.871 1.00 32.63 ? 33 TYR F CD2 1 ATOM 11629 C CE1 . TYR H 2 33 ? 43.726 7.666 -11.272 1.00 27.75 ? 33 TYR F CE1 1 ATOM 11630 C CE2 . TYR H 2 33 ? 42.680 5.720 -10.347 1.00 34.61 ? 33 TYR F CE2 1 ATOM 11631 C CZ . TYR H 2 33 ? 42.597 6.906 -11.046 1.00 34.13 ? 33 TYR F CZ 1 ATOM 11632 O OH . TYR H 2 33 ? 41.379 7.332 -11.521 1.00 42.35 ? 33 TYR F OH 1 ATOM 11633 N N . TRP H 2 34 ? 49.470 5.349 -10.384 1.00 23.17 ? 34 TRP F N 1 ATOM 11634 C CA . TRP H 2 34 ? 50.857 5.333 -9.946 1.00 22.59 ? 34 TRP F CA 1 ATOM 11635 C C . TRP H 2 34 ? 51.263 6.712 -9.465 1.00 23.67 ? 34 TRP F C 1 ATOM 11636 O O . TRP H 2 34 ? 50.981 7.710 -10.121 1.00 28.81 ? 34 TRP F O 1 ATOM 11637 C CB . TRP H 2 34 ? 51.753 4.856 -11.081 1.00 23.95 ? 34 TRP F CB 1 ATOM 11638 C CG . TRP H 2 34 ? 51.323 3.512 -11.542 1.00 23.35 ? 34 TRP F CG 1 ATOM 11639 C CD1 . TRP H 2 34 ? 50.420 3.230 -12.525 1.00 28.63 ? 34 TRP F CD1 1 ATOM 11640 C CD2 . TRP H 2 34 ? 51.736 2.256 -11.000 1.00 23.13 ? 34 TRP F CD2 1 ATOM 11641 N NE1 . TRP H 2 34 ? 50.263 1.868 -12.646 1.00 27.38 ? 34 TRP F NE1 1 ATOM 11642 C CE2 . TRP H 2 34 ? 51.064 1.248 -11.721 1.00 21.70 ? 34 TRP F CE2 1 ATOM 11643 C CE3 . TRP H 2 34 ? 52.626 1.883 -9.986 1.00 21.22 ? 34 TRP F CE3 1 ATOM 11644 C CZ2 . TRP H 2 34 ? 51.248 -0.106 -11.456 1.00 18.22 ? 34 TRP F CZ2 1 ATOM 11645 C CZ3 . TRP H 2 34 ? 52.811 0.539 -9.729 1.00 15.38 ? 34 TRP F CZ3 1 ATOM 11646 C CH2 . TRP H 2 34 ? 52.122 -0.440 -10.459 1.00 21.57 ? 34 TRP F CH2 1 ATOM 11647 N N . SER H 2 35 ? 51.934 6.762 -8.321 1.00 19.69 ? 35 SER F N 1 ATOM 11648 C CA . SER H 2 35 ? 52.069 8.013 -7.594 1.00 17.68 ? 35 SER F CA 1 ATOM 11649 C C . SER H 2 35 ? 53.488 8.321 -7.139 1.00 23.50 ? 35 SER F C 1 ATOM 11650 O O . SER H 2 35 ? 54.322 7.428 -6.996 1.00 21.84 ? 35 SER F O 1 ATOM 11651 C CB . SER H 2 35 ? 51.143 7.991 -6.381 1.00 21.96 ? 35 SER F CB 1 ATOM 11652 O OG . SER H 2 35 ? 51.235 9.204 -5.659 1.00 38.82 ? 35 SER F OG 1 ATOM 11653 N N . TRP H 2 36 ? 53.748 9.606 -6.919 1.00 19.60 ? 36 TRP F N 1 ATOM 11654 C CA . TRP H 2 36 ? 54.982 10.058 -6.292 1.00 18.81 ? 36 TRP F CA 1 ATOM 11655 C C . TRP H 2 36 ? 54.654 10.835 -5.023 1.00 21.42 ? 36 TRP F C 1 ATOM 11656 O O . TRP H 2 36 ? 53.666 11.566 -4.964 1.00 22.18 ? 36 TRP F O 1 ATOM 11657 C CB . TRP H 2 36 ? 55.810 10.928 -7.246 1.00 22.27 ? 36 TRP F CB 1 ATOM 11658 C CG . TRP H 2 36 ? 56.465 10.168 -8.365 1.00 24.96 ? 36 TRP F CG 1 ATOM 11659 C CD1 . TRP H 2 36 ? 55.977 9.981 -9.626 1.00 18.01 ? 36 TRP F CD1 1 ATOM 11660 C CD2 . TRP H 2 36 ? 57.736 9.499 -8.321 1.00 23.10 ? 36 TRP F CD2 1 ATOM 11661 N NE1 . TRP H 2 36 ? 56.864 9.239 -10.371 1.00 23.18 ? 36 TRP F NE1 1 ATOM 11662 C CE2 . TRP H 2 36 ? 57.947 8.930 -9.595 1.00 25.53 ? 36 TRP F CE2 1 ATOM 11663 C CE3 . TRP H 2 36 ? 58.709 9.329 -7.333 1.00 20.22 ? 36 TRP F CE3 1 ATOM 11664 C CZ2 . TRP H 2 36 ? 59.098 8.200 -9.902 1.00 22.62 ? 36 TRP F CZ2 1 ATOM 11665 C CZ3 . TRP H 2 36 ? 59.850 8.605 -7.641 1.00 23.62 ? 36 TRP F CZ3 1 ATOM 11666 C CH2 . TRP H 2 36 ? 60.033 8.046 -8.914 1.00 25.24 ? 36 TRP F CH2 1 ATOM 11667 N N . VAL H 2 37 ? 55.496 10.668 -4.013 1.00 24.90 ? 37 VAL F N 1 ATOM 11668 C CA . VAL H 2 37 ? 55.314 11.283 -2.705 1.00 25.34 ? 37 VAL F CA 1 ATOM 11669 C C . VAL H 2 37 ? 56.687 11.723 -2.208 1.00 27.53 ? 37 VAL F C 1 ATOM 11670 O O . VAL H 2 37 ? 57.675 11.048 -2.468 1.00 29.31 ? 37 VAL F O 1 ATOM 11671 C CB . VAL H 2 37 ? 54.670 10.291 -1.704 1.00 20.90 ? 37 VAL F CB 1 ATOM 11672 C CG1 . VAL H 2 37 ? 54.723 10.821 -0.283 1.00 18.12 ? 37 VAL F CG1 1 ATOM 11673 C CG2 . VAL H 2 37 ? 53.240 9.966 -2.116 1.00 20.87 ? 37 VAL F CG2 1 ATOM 11674 N N . ARG H 2 38 ? 56.778 12.851 -1.517 1.00 24.48 ? 38 ARG F N 1 ATOM 11675 C CA . ARG H 2 38 ? 58.074 13.214 -0.964 1.00 22.65 ? 38 ARG F CA 1 ATOM 11676 C C . ARG H 2 38 ? 58.002 13.492 0.529 1.00 26.57 ? 38 ARG F C 1 ATOM 11677 O O . ARG H 2 38 ? 56.929 13.725 1.089 1.00 25.25 ? 38 ARG F O 1 ATOM 11678 C CB . ARG H 2 38 ? 58.665 14.415 -1.705 1.00 19.23 ? 38 ARG F CB 1 ATOM 11679 C CG . ARG H 2 38 ? 57.892 15.714 -1.573 1.00 16.93 ? 38 ARG F CG 1 ATOM 11680 C CD . ARG H 2 38 ? 58.645 16.828 -2.283 1.00 23.33 ? 38 ARG F CD 1 ATOM 11681 N NE . ARG H 2 38 ? 58.004 18.129 -2.102 1.00 31.19 ? 38 ARG F NE 1 ATOM 11682 C CZ . ARG H 2 38 ? 58.450 19.262 -2.635 1.00 30.22 ? 38 ARG F CZ 1 ATOM 11683 N NH1 . ARG H 2 38 ? 59.542 19.256 -3.388 1.00 23.46 ? 38 ARG F NH1 1 ATOM 11684 N NH2 . ARG H 2 38 ? 57.801 20.400 -2.420 1.00 26.51 ? 38 ARG F NH2 1 ATOM 11685 N N . GLN H 2 39 ? 59.163 13.449 1.168 1.00 22.78 ? 39 GLN F N 1 ATOM 11686 C CA . GLN H 2 39 ? 59.259 13.647 2.603 1.00 24.87 ? 39 GLN F CA 1 ATOM 11687 C C . GLN H 2 39 ? 60.503 14.470 2.907 1.00 26.93 ? 39 GLN F C 1 ATOM 11688 O O . GLN H 2 39 ? 61.613 13.939 2.920 1.00 29.24 ? 39 GLN F O 1 ATOM 11689 C CB . GLN H 2 39 ? 59.300 12.295 3.325 1.00 25.55 ? 39 GLN F CB 1 ATOM 11690 C CG . GLN H 2 39 ? 59.202 12.376 4.833 1.00 27.56 ? 39 GLN F CG 1 ATOM 11691 C CD . GLN H 2 39 ? 59.100 11.005 5.483 1.00 27.86 ? 39 GLN F CD 1 ATOM 11692 O OE1 . GLN H 2 39 ? 59.687 10.034 5.006 1.00 31.44 ? 39 GLN F OE1 1 ATOM 11693 N NE2 . GLN H 2 39 ? 58.348 10.921 6.576 1.00 25.39 ? 39 GLN F NE2 1 ATOM 11694 N N . PRO H 2 40 ? 60.327 15.784 3.110 1.00 30.75 ? 40 PRO F N 1 ATOM 11695 C CA . PRO H 2 40 ? 61.440 16.637 3.537 1.00 33.31 ? 40 PRO F CA 1 ATOM 11696 C C . PRO H 2 40 ? 61.982 16.157 4.874 1.00 38.11 ? 40 PRO F C 1 ATOM 11697 O O . PRO H 2 40 ? 61.231 15.546 5.634 1.00 37.03 ? 40 PRO F O 1 ATOM 11698 C CB . PRO H 2 40 ? 60.802 18.022 3.660 1.00 32.54 ? 40 PRO F CB 1 ATOM 11699 C CG . PRO H 2 40 ? 59.590 17.961 2.785 1.00 32.99 ? 40 PRO F CG 1 ATOM 11700 C CD . PRO H 2 40 ? 59.090 16.554 2.896 1.00 25.80 ? 40 PRO F CD 1 ATOM 11701 N N . PRO H 2 41 ? 63.267 16.419 5.155 1.00 46.45 ? 41 PRO F N 1 ATOM 11702 C CA . PRO H 2 41 ? 63.889 15.920 6.388 1.00 42.73 ? 41 PRO F CA 1 ATOM 11703 C C . PRO H 2 41 ? 63.122 16.322 7.648 1.00 37.23 ? 41 PRO F C 1 ATOM 11704 O O . PRO H 2 41 ? 62.880 17.509 7.884 1.00 34.45 ? 41 PRO F O 1 ATOM 11705 C CB . PRO H 2 41 ? 65.276 16.565 6.364 1.00 44.83 ? 41 PRO F CB 1 ATOM 11706 C CG . PRO H 2 41 ? 65.550 16.798 4.914 1.00 50.28 ? 41 PRO F CG 1 ATOM 11707 C CD . PRO H 2 41 ? 64.223 17.155 4.310 1.00 46.65 ? 41 PRO F CD 1 ATOM 11708 N N . GLY H 2 42 ? 62.721 15.320 8.427 1.00 38.57 ? 42 GLY F N 1 ATOM 11709 C CA . GLY H 2 42 ? 62.060 15.536 9.703 1.00 46.04 ? 42 GLY F CA 1 ATOM 11710 C C . GLY H 2 42 ? 60.628 16.030 9.620 1.00 44.13 ? 42 GLY F C 1 ATOM 11711 O O . GLY H 2 42 ? 60.048 16.433 10.626 1.00 43.27 ? 42 GLY F O 1 ATOM 11712 N N . LYS H 2 43 ? 60.053 16.003 8.423 1.00 43.39 ? 43 LYS F N 1 ATOM 11713 C CA . LYS H 2 43 ? 58.687 16.478 8.238 1.00 38.87 ? 43 LYS F CA 1 ATOM 11714 C C . LYS H 2 43 ? 57.792 15.376 7.686 1.00 43.63 ? 43 LYS F C 1 ATOM 11715 O O . LYS H 2 43 ? 58.243 14.257 7.440 1.00 41.73 ? 43 LYS F O 1 ATOM 11716 C CB . LYS H 2 43 ? 58.662 17.699 7.314 1.00 37.06 ? 43 LYS F CB 1 ATOM 11717 C CG . LYS H 2 43 ? 59.649 18.788 7.710 1.00 42.76 ? 43 LYS F CG 1 ATOM 11718 C CD . LYS H 2 43 ? 59.107 20.173 7.397 1.00 55.55 ? 43 LYS F CD 1 ATOM 11719 C CE . LYS H 2 43 ? 58.035 20.584 8.398 1.00 62.93 ? 43 LYS F CE 1 ATOM 11720 N NZ . LYS H 2 43 ? 57.328 21.835 7.996 1.00 66.36 ? 43 LYS F NZ 1 ATOM 11721 N N . ARG H 2 44 ? 56.517 15.699 7.497 1.00 41.90 ? 44 ARG F N 1 ATOM 11722 C CA . ARG H 2 44 ? 55.538 14.709 7.078 1.00 39.55 ? 44 ARG F CA 1 ATOM 11723 C C . ARG H 2 44 ? 55.623 14.418 5.586 1.00 34.42 ? 44 ARG F C 1 ATOM 11724 O O . ARG H 2 44 ? 56.308 15.113 4.838 1.00 32.24 ? 44 ARG F O 1 ATOM 11725 C CB . ARG H 2 44 ? 54.128 15.180 7.424 1.00 39.95 ? 44 ARG F CB 1 ATOM 11726 C CG . ARG H 2 44 ? 53.574 16.206 6.452 1.00 31.83 ? 44 ARG F CG 1 ATOM 11727 C CD . ARG H 2 44 ? 52.200 16.667 6.891 1.00 36.67 ? 44 ARG F CD 1 ATOM 11728 N NE . ARG H 2 44 ? 52.274 17.476 8.103 1.00 34.73 ? 44 ARG F NE 1 ATOM 11729 C CZ . ARG H 2 44 ? 51.221 17.838 8.826 1.00 33.80 ? 44 ARG F CZ 1 ATOM 11730 N NH1 . ARG H 2 44 ? 50.003 17.453 8.469 1.00 26.91 ? 44 ARG F NH1 1 ATOM 11731 N NH2 . ARG H 2 44 ? 51.388 18.581 9.912 1.00 34.94 ? 44 ARG F NH2 1 ATOM 11732 N N . LEU H 2 45 ? 54.900 13.390 5.165 1.00 33.03 ? 45 LEU F N 1 ATOM 11733 C CA . LEU H 2 45 ? 54.826 13.018 3.765 1.00 28.35 ? 45 LEU F CA 1 ATOM 11734 C C . LEU H 2 45 ? 53.938 13.984 2.994 1.00 32.27 ? 45 LEU F C 1 ATOM 11735 O O . LEU H 2 45 ? 53.000 14.560 3.547 1.00 33.61 ? 45 LEU F O 1 ATOM 11736 C CB . LEU H 2 45 ? 54.303 11.592 3.635 1.00 31.18 ? 45 LEU F CB 1 ATOM 11737 C CG . LEU H 2 45 ? 55.182 10.521 4.286 1.00 35.40 ? 45 LEU F CG 1 ATOM 11738 C CD1 . LEU H 2 45 ? 54.322 9.399 4.852 1.00 37.35 ? 45 LEU F CD1 1 ATOM 11739 C CD2 . LEU H 2 45 ? 56.191 9.970 3.283 1.00 29.06 ? 45 LEU F CD2 1 ATOM 11740 N N . GLU H 2 46 ? 54.244 14.158 1.714 1.00 26.71 ? 46 GLU F N 1 ATOM 11741 C CA . GLU H 2 46 ? 53.458 15.025 0.849 1.00 27.67 ? 46 GLU F CA 1 ATOM 11742 C C . GLU H 2 46 ? 53.258 14.387 -0.520 1.00 24.21 ? 46 GLU F C 1 ATOM 11743 O O . GLU H 2 46 ? 54.223 14.042 -1.203 1.00 24.77 ? 46 GLU F O 1 ATOM 11744 C CB . GLU H 2 46 ? 54.133 16.391 0.691 1.00 29.94 ? 46 GLU F CB 1 ATOM 11745 C CG . GLU H 2 46 ? 53.487 17.270 -0.377 1.00 46.53 ? 46 GLU F CG 1 ATOM 11746 C CD . GLU H 2 46 ? 54.386 18.413 -0.830 1.00 63.59 ? 46 GLU F CD 1 ATOM 11747 O OE1 . GLU H 2 46 ? 55.488 18.575 -0.259 1.00 61.76 ? 46 GLU F OE1 1 ATOM 11748 O OE2 . GLU H 2 46 ? 53.990 19.146 -1.764 1.00 71.86 ? 46 GLU F OE2 1 ATOM 11749 N N . TRP H 2 47 ? 51.996 14.241 -0.908 1.00 22.57 ? 47 TRP F N 1 ATOM 11750 C CA . TRP H 2 47 ? 51.614 13.721 -2.216 1.00 16.64 ? 47 TRP F CA 1 ATOM 11751 C C . TRP H 2 47 ? 52.009 14.702 -3.313 1.00 22.81 ? 47 TRP F C 1 ATOM 11752 O O . TRP H 2 47 ? 51.711 15.886 -3.221 1.00 28.10 ? 47 TRP F O 1 ATOM 11753 C CB . TRP H 2 47 ? 50.105 13.455 -2.237 1.00 16.41 ? 47 TRP F CB 1 ATOM 11754 C CG . TRP H 2 47 ? 49.510 13.019 -3.551 1.00 25.25 ? 47 TRP F CG 1 ATOM 11755 C CD1 . TRP H 2 47 ? 49.576 11.776 -4.110 1.00 25.25 ? 47 TRP F CD1 1 ATOM 11756 C CD2 . TRP H 2 47 ? 48.700 13.811 -4.434 1.00 30.14 ? 47 TRP F CD2 1 ATOM 11757 N NE1 . TRP H 2 47 ? 48.882 11.751 -5.298 1.00 24.86 ? 47 TRP F NE1 1 ATOM 11758 C CE2 . TRP H 2 47 ? 48.335 12.988 -5.520 1.00 26.81 ? 47 TRP F CE2 1 ATOM 11759 C CE3 . TRP H 2 47 ? 48.259 15.140 -4.418 1.00 28.52 ? 47 TRP F CE3 1 ATOM 11760 C CZ2 . TRP H 2 47 ? 47.550 13.448 -6.578 1.00 27.21 ? 47 TRP F CZ2 1 ATOM 11761 C CZ3 . TRP H 2 47 ? 47.479 15.596 -5.473 1.00 25.50 ? 47 TRP F CZ3 1 ATOM 11762 C CH2 . TRP H 2 47 ? 47.133 14.754 -6.535 1.00 24.95 ? 47 TRP F CH2 1 ATOM 11763 N N . ILE H 2 48 ? 52.688 14.212 -4.345 1.00 24.45 ? 48 ILE F N 1 ATOM 11764 C CA . ILE H 2 48 ? 53.096 15.064 -5.458 1.00 22.90 ? 48 ILE F CA 1 ATOM 11765 C C . ILE H 2 48 ? 52.093 14.984 -6.598 1.00 22.55 ? 48 ILE F C 1 ATOM 11766 O O . ILE H 2 48 ? 51.712 15.990 -7.189 1.00 26.49 ? 48 ILE F O 1 ATOM 11767 C CB . ILE H 2 48 ? 54.490 14.677 -5.991 1.00 24.81 ? 48 ILE F CB 1 ATOM 11768 C CG1 . ILE H 2 48 ? 55.570 15.031 -4.970 1.00 22.15 ? 48 ILE F CG1 1 ATOM 11769 C CG2 . ILE H 2 48 ? 54.779 15.373 -7.313 1.00 18.35 ? 48 ILE F CG2 1 ATOM 11770 C CD1 . ILE H 2 48 ? 56.925 14.408 -5.285 1.00 23.23 ? 48 ILE F CD1 1 ATOM 11771 N N . GLY H 2 49 ? 51.663 13.771 -6.903 1.00 25.31 ? 49 GLY F N 1 ATOM 11772 C CA . GLY H 2 49 ? 50.771 13.562 -8.020 1.00 26.15 ? 49 GLY F CA 1 ATOM 11773 C C . GLY H 2 49 ? 50.609 12.095 -8.333 1.00 26.73 ? 49 GLY F C 1 ATOM 11774 O O . GLY H 2 49 ? 51.266 11.246 -7.735 1.00 30.72 ? 49 GLY F O 1 ATOM 11775 N N . GLU H 2 50 ? 49.725 11.797 -9.273 1.00 26.05 ? 50 GLU F N 1 ATOM 11776 C CA . GLU H 2 50 ? 49.486 10.423 -9.683 1.00 23.68 ? 50 GLU F CA 1 ATOM 11777 C C . GLU H 2 50 ? 48.976 10.405 -11.113 1.00 31.41 ? 50 GLU F C 1 ATOM 11778 O O . GLU H 2 50 ? 48.586 11.442 -11.660 1.00 26.14 ? 50 GLU F O 1 ATOM 11779 C CB . GLU H 2 50 ? 48.492 9.735 -8.743 1.00 24.67 ? 50 GLU F CB 1 ATOM 11780 C CG . GLU H 2 50 ? 47.117 10.366 -8.721 1.00 30.35 ? 50 GLU F CG 1 ATOM 11781 C CD . GLU H 2 50 ? 46.255 9.857 -7.577 1.00 36.56 ? 50 GLU F CD 1 ATOM 11782 O OE1 . GLU H 2 50 ? 46.719 9.884 -6.417 1.00 32.43 ? 50 GLU F OE1 1 ATOM 11783 O OE2 . GLU H 2 50 ? 45.110 9.430 -7.839 1.00 34.32 ? 50 GLU F OE2 1 ATOM 11784 N N . ILE H 2 51 ? 48.982 9.224 -11.715 1.00 25.09 ? 51 ILE F N 1 ATOM 11785 C CA . ILE H 2 51 ? 48.638 9.078 -13.117 1.00 22.85 ? 51 ILE F CA 1 ATOM 11786 C C . ILE H 2 51 ? 48.234 7.636 -13.376 1.00 23.11 ? 51 ILE F C 1 ATOM 11787 O O . ILE H 2 51 ? 48.641 6.738 -12.636 1.00 22.38 ? 51 ILE F O 1 ATOM 11788 C CB . ILE H 2 51 ? 49.833 9.463 -14.028 1.00 32.59 ? 51 ILE F CB 1 ATOM 11789 C CG1 . ILE H 2 51 ? 49.396 9.661 -15.481 1.00 31.63 ? 51 ILE F CG1 1 ATOM 11790 C CG2 . ILE H 2 51 ? 50.948 8.415 -13.934 1.00 27.32 ? 51 ILE F CG2 1 ATOM 11791 C CD1 . ILE H 2 51 ? 50.559 9.921 -16.423 1.00 32.73 ? 51 ILE F CD1 1 ATOM 11792 N N . LYS H 2 52 ? 47.423 7.416 -14.406 1.00 22.89 ? 52 LYS F N 1 ATOM 11793 C CA . LYS H 2 52 ? 47.199 6.070 -14.924 1.00 28.69 ? 52 LYS F CA 1 ATOM 11794 C C . LYS H 2 52 ? 47.080 6.137 -16.442 1.00 28.99 ? 52 LYS F C 1 ATOM 11795 O O . LYS H 2 52 ? 46.856 7.211 -16.999 1.00 29.25 ? 52 LYS F O 1 ATOM 11796 C CB . LYS H 2 52 ? 45.954 5.435 -14.306 1.00 34.54 ? 52 LYS F CB 1 ATOM 11797 C CG . LYS H 2 52 ? 44.679 5.732 -15.055 1.00 42.01 ? 52 LYS F CG 1 ATOM 11798 C CD . LYS H 2 52 ? 43.528 5.919 -14.095 1.00 47.00 ? 52 LYS F CD 1 ATOM 11799 C CE . LYS H 2 52 ? 42.444 4.896 -14.307 1.00 40.23 ? 52 LYS F CE 1 ATOM 11800 N NZ . LYS H 2 52 ? 41.884 4.958 -15.683 1.00 40.70 ? 52 LYS F NZ 1 ATOM 11801 N N . HIS H 2 53 ? 47.231 4.987 -17.096 1.00 26.67 ? 53 HIS F N 1 ATOM 11802 C CA . HIS H 2 53 ? 47.330 4.907 -18.553 1.00 30.85 ? 53 HIS F CA 1 ATOM 11803 C C . HIS H 2 53 ? 46.127 5.517 -19.270 1.00 29.46 ? 53 HIS F C 1 ATOM 11804 O O . HIS H 2 53 ? 46.290 6.391 -20.124 1.00 35.18 ? 53 HIS F O 1 ATOM 11805 C CB . HIS H 2 53 ? 47.513 3.450 -18.981 1.00 22.68 ? 53 HIS F CB 1 ATOM 11806 C CG . HIS H 2 53 ? 47.575 3.257 -20.461 1.00 33.44 ? 53 HIS F CG 1 ATOM 11807 N ND1 . HIS H 2 53 ? 48.358 4.040 -21.283 1.00 37.23 ? 53 HIS F ND1 1 ATOM 11808 C CD2 . HIS H 2 53 ? 46.955 2.366 -21.272 1.00 39.52 ? 53 HIS F CD2 1 ATOM 11809 C CE1 . HIS H 2 53 ? 48.215 3.642 -22.534 1.00 40.26 ? 53 HIS F CE1 1 ATOM 11810 N NE2 . HIS H 2 53 ? 47.370 2.626 -22.555 1.00 39.93 ? 53 HIS F NE2 1 ATOM 11811 N N . ASN H 2 54 ? 44.926 5.055 -18.935 1.00 30.89 ? 54 ASN F N 1 ATOM 11812 C CA . ASN H 2 54 ? 43.710 5.672 -19.463 1.00 35.30 ? 54 ASN F CA 1 ATOM 11813 C C . ASN H 2 54 ? 43.241 6.764 -18.518 1.00 40.58 ? 54 ASN F C 1 ATOM 11814 O O . ASN H 2 54 ? 42.333 6.566 -17.713 1.00 39.34 ? 54 ASN F O 1 ATOM 11815 C CB . ASN H 2 54 ? 42.598 4.639 -19.683 1.00 32.95 ? 54 ASN F CB 1 ATOM 11816 C CG . ASN H 2 54 ? 42.858 3.750 -20.886 1.00 36.50 ? 54 ASN F CG 1 ATOM 11817 O OD1 . ASN H 2 54 ? 42.760 4.193 -22.032 1.00 37.91 ? 54 ASN F OD1 1 ATOM 11818 N ND2 . ASN H 2 54 ? 43.193 2.486 -20.631 1.00 34.10 ? 54 ASN F ND2 1 ATOM 11819 N N . GLY H 2 55 ? 43.882 7.921 -18.617 1.00 43.73 ? 55 GLY F N 1 ATOM 11820 C CA . GLY H 2 55 ? 43.593 9.018 -17.721 1.00 38.11 ? 55 GLY F CA 1 ATOM 11821 C C . GLY H 2 55 ? 44.574 10.149 -17.916 1.00 39.39 ? 55 GLY F C 1 ATOM 11822 O O . GLY H 2 55 ? 45.358 10.156 -18.865 1.00 43.21 ? 55 GLY F O 1 ATOM 11823 N N . SER H 2 56 ? 44.524 11.109 -17.003 1.00 36.09 ? 56 SER F N 1 ATOM 11824 C CA . SER H 2 56 ? 45.343 12.303 -17.096 1.00 43.59 ? 56 SER F CA 1 ATOM 11825 C C . SER H 2 56 ? 46.143 12.480 -15.822 1.00 43.00 ? 56 SER F C 1 ATOM 11826 O O . SER H 2 56 ? 45.721 12.031 -14.757 1.00 43.53 ? 56 SER F O 1 ATOM 11827 C CB . SER H 2 56 ? 44.469 13.536 -17.349 1.00 46.16 ? 56 SER F CB 1 ATOM 11828 O OG . SER H 2 56 ? 43.727 13.394 -18.547 1.00 55.26 ? 56 SER F OG 1 ATOM 11829 N N . PRO H 2 57 ? 47.308 13.129 -15.928 1.00 45.47 ? 57 PRO F N 1 ATOM 11830 C CA . PRO H 2 57 ? 48.108 13.450 -14.747 1.00 35.54 ? 57 PRO F CA 1 ATOM 11831 C C . PRO H 2 57 ? 47.330 14.315 -13.760 1.00 32.99 ? 57 PRO F C 1 ATOM 11832 O O . PRO H 2 57 ? 46.630 15.247 -14.157 1.00 34.03 ? 57 PRO F O 1 ATOM 11833 C CB . PRO H 2 57 ? 49.298 14.212 -15.329 1.00 41.44 ? 57 PRO F CB 1 ATOM 11834 C CG . PRO H 2 57 ? 49.401 13.738 -16.726 1.00 47.17 ? 57 PRO F CG 1 ATOM 11835 C CD . PRO H 2 57 ? 47.988 13.521 -17.173 1.00 48.60 ? 57 PRO F CD 1 ATOM 11836 N N . ASN H 2 58 ? 47.447 13.986 -12.482 1.00 33.89 ? 58 ASN F N 1 ATOM 11837 C CA . ASN H 2 58 ? 46.776 14.724 -11.426 1.00 30.98 ? 58 ASN F CA 1 ATOM 11838 C C . ASN H 2 58 ? 47.810 15.168 -10.405 1.00 31.24 ? 58 ASN F C 1 ATOM 11839 O O . ASN H 2 58 ? 48.420 14.332 -9.749 1.00 29.85 ? 58 ASN F O 1 ATOM 11840 C CB . ASN H 2 58 ? 45.697 13.859 -10.771 1.00 25.51 ? 58 ASN F CB 1 ATOM 11841 C CG . ASN H 2 58 ? 44.902 14.613 -9.729 1.00 36.81 ? 58 ASN F CG 1 ATOM 11842 O OD1 . ASN H 2 58 ? 44.927 15.842 -9.688 1.00 47.14 ? 58 ASN F OD1 1 ATOM 11843 N ND2 . ASN H 2 58 ? 44.188 13.881 -8.879 1.00 29.78 ? 58 ASN F ND2 1 ATOM 11844 N N . TYR H 2 59 ? 48.012 16.476 -10.275 1.00 28.48 ? 59 TYR F N 1 ATOM 11845 C CA . TYR H 2 59 ? 49.109 16.989 -9.461 1.00 24.33 ? 59 TYR F CA 1 ATOM 11846 C C . TYR H 2 59 ? 48.678 17.786 -8.231 1.00 31.63 ? 59 TYR F C 1 ATOM 11847 O O . TYR H 2 59 ? 47.545 18.260 -8.127 1.00 30.55 ? 59 TYR F O 1 ATOM 11848 C CB . TYR H 2 59 ? 50.023 17.881 -10.305 1.00 25.17 ? 59 TYR F CB 1 ATOM 11849 C CG . TYR H 2 59 ? 50.576 17.249 -11.562 1.00 29.50 ? 59 TYR F CG 1 ATOM 11850 C CD1 . TYR H 2 59 ? 51.345 16.094 -11.504 1.00 27.04 ? 59 TYR F CD1 1 ATOM 11851 C CD2 . TYR H 2 59 ? 50.359 17.831 -12.804 1.00 28.30 ? 59 TYR F CD2 1 ATOM 11852 C CE1 . TYR H 2 59 ? 51.863 15.527 -12.654 1.00 34.16 ? 59 TYR F CE1 1 ATOM 11853 C CE2 . TYR H 2 59 ? 50.871 17.272 -13.956 1.00 31.31 ? 59 TYR F CE2 1 ATOM 11854 C CZ . TYR H 2 59 ? 51.625 16.123 -13.875 1.00 35.04 ? 59 TYR F CZ 1 ATOM 11855 O OH . TYR H 2 59 ? 52.136 15.565 -15.022 1.00 37.36 ? 59 TYR F OH 1 ATOM 11856 N N . HIS H 2 60 ? 49.619 17.928 -7.305 1.00 30.48 ? 60 HIS F N 1 ATOM 11857 C CA . HIS H 2 60 ? 49.492 18.843 -6.188 1.00 27.97 ? 60 HIS F CA 1 ATOM 11858 C C . HIS H 2 60 ? 49.609 20.269 -6.729 1.00 29.25 ? 60 HIS F C 1 ATOM 11859 O O . HIS H 2 60 ? 50.581 20.591 -7.408 1.00 29.29 ? 60 HIS F O 1 ATOM 11860 C CB . HIS H 2 60 ? 50.573 18.558 -5.144 1.00 29.45 ? 60 HIS F CB 1 ATOM 11861 C CG . HIS H 2 60 ? 50.289 19.141 -3.797 1.00 35.84 ? 60 HIS F CG 1 ATOM 11862 N ND1 . HIS H 2 60 ? 50.416 20.487 -3.524 1.00 40.47 ? 60 HIS F ND1 1 ATOM 11863 C CD2 . HIS H 2 60 ? 49.894 18.560 -2.640 1.00 31.85 ? 60 HIS F CD2 1 ATOM 11864 C CE1 . HIS H 2 60 ? 50.104 20.710 -2.261 1.00 37.57 ? 60 HIS F CE1 1 ATOM 11865 N NE2 . HIS H 2 60 ? 49.783 19.556 -1.701 1.00 36.64 ? 60 HIS F NE2 1 ATOM 11866 N N . PRO H 2 61 ? 48.612 21.121 -6.443 1.00 32.03 ? 61 PRO F N 1 ATOM 11867 C CA . PRO H 2 61 ? 48.530 22.482 -6.996 1.00 34.70 ? 61 PRO F CA 1 ATOM 11868 C C . PRO H 2 61 ? 49.796 23.319 -6.783 1.00 37.06 ? 61 PRO F C 1 ATOM 11869 O O . PRO H 2 61 ? 50.200 24.047 -7.690 1.00 43.20 ? 61 PRO F O 1 ATOM 11870 C CB . PRO H 2 61 ? 47.345 23.091 -6.240 1.00 34.60 ? 61 PRO F CB 1 ATOM 11871 C CG . PRO H 2 61 ? 46.493 21.925 -5.887 1.00 36.24 ? 61 PRO F CG 1 ATOM 11872 C CD . PRO H 2 61 ? 47.452 20.802 -5.592 1.00 36.83 ? 61 PRO F CD 1 ATOM 11873 N N . SER H 2 62 ? 50.414 23.204 -5.609 1.00 34.60 ? 62 SER F N 1 ATOM 11874 C CA . SER H 2 62 ? 51.655 23.917 -5.302 1.00 37.22 ? 62 SER F CA 1 ATOM 11875 C C . SER H 2 62 ? 52.798 23.538 -6.239 1.00 40.68 ? 62 SER F C 1 ATOM 11876 O O . SER H 2 62 ? 53.765 24.285 -6.380 1.00 41.39 ? 62 SER F O 1 ATOM 11877 C CB . SER H 2 62 ? 52.089 23.638 -3.859 1.00 49.37 ? 62 SER F CB 1 ATOM 11878 O OG . SER H 2 62 ? 51.020 23.819 -2.948 1.00 63.09 ? 62 SER F OG 1 ATOM 11879 N N . LEU H 2 63 ? 52.686 22.370 -6.866 1.00 35.33 ? 63 LEU F N 1 ATOM 11880 C CA . LEU H 2 63 ? 53.767 21.821 -7.677 1.00 34.60 ? 63 LEU F CA 1 ATOM 11881 C C . LEU H 2 63 ? 53.433 21.765 -9.166 1.00 37.01 ? 63 LEU F C 1 ATOM 11882 O O . LEU H 2 63 ? 54.298 21.466 -9.985 1.00 39.90 ? 63 LEU F O 1 ATOM 11883 C CB . LEU H 2 63 ? 54.124 20.416 -7.178 1.00 32.07 ? 63 LEU F CB 1 ATOM 11884 C CG . LEU H 2 63 ? 54.767 20.349 -5.793 1.00 32.77 ? 63 LEU F CG 1 ATOM 11885 C CD1 . LEU H 2 63 ? 54.804 18.922 -5.280 1.00 27.28 ? 63 LEU F CD1 1 ATOM 11886 C CD2 . LEU H 2 63 ? 56.165 20.945 -5.844 1.00 35.10 ? 63 LEU F CD2 1 ATOM 11887 N N . LYS H 2 64 ? 52.185 22.068 -9.508 1.00 34.04 ? 64 LYS F N 1 ATOM 11888 C CA . LYS H 2 64 ? 51.667 21.839 -10.855 1.00 40.01 ? 64 LYS F CA 1 ATOM 11889 C C . LYS H 2 64 ? 52.529 22.430 -11.975 1.00 39.13 ? 64 LYS F C 1 ATOM 11890 O O . LYS H 2 64 ? 52.697 21.809 -13.023 1.00 42.89 ? 64 LYS F O 1 ATOM 11891 C CB . LYS H 2 64 ? 50.246 22.391 -10.963 1.00 38.61 ? 64 LYS F CB 1 ATOM 11892 C CG . LYS H 2 64 ? 49.558 22.068 -12.279 1.00 46.90 ? 64 LYS F CG 1 ATOM 11893 C CD . LYS H 2 64 ? 48.195 22.738 -12.377 1.00 54.66 ? 64 LYS F CD 1 ATOM 11894 C CE . LYS H 2 64 ? 47.595 22.575 -13.766 1.00 61.27 ? 64 LYS F CE 1 ATOM 11895 N NZ . LYS H 2 64 ? 46.384 23.426 -13.949 1.00 67.26 ? 64 LYS F NZ 1 ATOM 11896 N N . SER H 2 65 ? 53.091 23.612 -11.745 1.00 35.66 ? 65 SER F N 1 ATOM 11897 C CA . SER H 2 65 ? 53.828 24.326 -12.788 1.00 33.59 ? 65 SER F CA 1 ATOM 11898 C C . SER H 2 65 ? 55.260 23.823 -12.999 1.00 38.59 ? 65 SER F C 1 ATOM 11899 O O . SER H 2 65 ? 55.924 24.223 -13.957 1.00 45.55 ? 65 SER F O 1 ATOM 11900 C CB . SER H 2 65 ? 53.865 25.823 -12.469 1.00 42.15 ? 65 SER F CB 1 ATOM 11901 O OG . SER H 2 65 ? 54.567 26.070 -11.261 1.00 46.94 ? 65 SER F OG 1 ATOM 11902 N N . ARG H 2 66 ? 55.737 22.957 -12.109 1.00 28.29 ? 66 ARG F N 1 ATOM 11903 C CA . ARG H 2 66 ? 57.114 22.477 -12.186 1.00 28.22 ? 66 ARG F CA 1 ATOM 11904 C C . ARG H 2 66 ? 57.191 20.960 -12.372 1.00 34.04 ? 66 ARG F C 1 ATOM 11905 O O . ARG H 2 66 ? 58.265 20.419 -12.645 1.00 35.21 ? 66 ARG F O 1 ATOM 11906 C CB . ARG H 2 66 ? 57.890 22.875 -10.924 1.00 28.55 ? 66 ARG F CB 1 ATOM 11907 C CG . ARG H 2 66 ? 57.895 24.365 -10.599 1.00 35.38 ? 66 ARG F CG 1 ATOM 11908 C CD . ARG H 2 66 ? 58.282 24.595 -9.137 1.00 34.45 ? 66 ARG F CD 1 ATOM 11909 N NE . ARG H 2 66 ? 59.563 23.974 -8.830 1.00 38.58 ? 66 ARG F NE 1 ATOM 11910 C CZ . ARG H 2 66 ? 59.871 23.389 -7.675 1.00 37.56 ? 66 ARG F CZ 1 ATOM 11911 N NH1 . ARG H 2 66 ? 58.992 23.334 -6.679 1.00 23.96 ? 66 ARG F NH1 1 ATOM 11912 N NH2 . ARG H 2 66 ? 61.071 22.853 -7.521 1.00 39.96 ? 66 ARG F NH2 1 ATOM 11913 N N . VAL H 2 67 ? 56.058 20.275 -12.226 1.00 32.87 ? 67 VAL F N 1 ATOM 11914 C CA . VAL H 2 67 ? 56.055 18.811 -12.220 1.00 33.41 ? 67 VAL F CA 1 ATOM 11915 C C . VAL H 2 67 ? 55.504 18.180 -13.495 1.00 31.91 ? 67 VAL F C 1 ATOM 11916 O O . VAL H 2 67 ? 54.513 18.646 -14.062 1.00 34.10 ? 67 VAL F O 1 ATOM 11917 C CB . VAL H 2 67 ? 55.242 18.254 -11.026 1.00 33.26 ? 67 VAL F CB 1 ATOM 11918 C CG1 . VAL H 2 67 ? 55.250 16.728 -11.025 1.00 37.36 ? 67 VAL F CG1 1 ATOM 11919 C CG2 . VAL H 2 67 ? 55.810 18.755 -9.732 1.00 46.80 ? 67 VAL F CG2 1 ATOM 11920 N N . THR H 2 68 ? 56.168 17.115 -13.936 1.00 28.06 ? 68 THR F N 1 ATOM 11921 C CA . THR H 2 68 ? 55.616 16.215 -14.938 1.00 27.35 ? 68 THR F CA 1 ATOM 11922 C C . THR H 2 68 ? 55.744 14.767 -14.458 1.00 27.57 ? 68 THR F C 1 ATOM 11923 O O . THR H 2 68 ? 56.824 14.333 -14.066 1.00 32.48 ? 68 THR F O 1 ATOM 11924 C CB . THR H 2 68 ? 56.322 16.358 -16.292 1.00 35.70 ? 68 THR F CB 1 ATOM 11925 O OG1 . THR H 2 68 ? 56.504 17.745 -16.597 1.00 52.36 ? 68 THR F OG1 1 ATOM 11926 C CG2 . THR H 2 68 ? 55.500 15.696 -17.388 1.00 32.60 ? 68 THR F CG2 1 ATOM 11927 N N . ILE H 2 69 ? 54.636 14.034 -14.478 1.00 24.98 ? 69 ILE F N 1 ATOM 11928 C CA . ILE H 2 69 ? 54.649 12.602 -14.203 1.00 31.89 ? 69 ILE F CA 1 ATOM 11929 C C . ILE H 2 69 ? 54.238 11.861 -15.471 1.00 34.26 ? 69 ILE F C 1 ATOM 11930 O O . ILE H 2 69 ? 53.228 12.198 -16.090 1.00 34.75 ? 69 ILE F O 1 ATOM 11931 C CB . ILE H 2 69 ? 53.702 12.233 -13.047 1.00 27.11 ? 69 ILE F CB 1 ATOM 11932 C CG1 . ILE H 2 69 ? 54.163 12.891 -11.748 1.00 29.92 ? 69 ILE F CG1 1 ATOM 11933 C CG2 . ILE H 2 69 ? 53.633 10.739 -12.864 1.00 18.32 ? 69 ILE F CG2 1 ATOM 11934 C CD1 . ILE H 2 69 ? 53.175 12.740 -10.615 1.00 25.71 ? 69 ILE F CD1 1 ATOM 11935 N N . SER H 2 70 ? 55.023 10.868 -15.871 1.00 26.86 ? 70 SER F N 1 ATOM 11936 C CA . SER H 2 70 ? 54.731 10.147 -17.106 1.00 32.92 ? 70 SER F CA 1 ATOM 11937 C C . SER H 2 70 ? 54.803 8.629 -16.942 1.00 30.56 ? 70 SER F C 1 ATOM 11938 O O . SER H 2 70 ? 55.443 8.122 -16.022 1.00 30.20 ? 70 SER F O 1 ATOM 11939 C CB . SER H 2 70 ? 55.688 10.595 -18.211 1.00 35.75 ? 70 SER F CB 1 ATOM 11940 O OG . SER H 2 70 ? 57.033 10.469 -17.791 1.00 40.34 ? 70 SER F OG 1 ATOM 11941 N N . LEU H 2 71 ? 54.131 7.918 -17.842 1.00 27.12 ? 71 LEU F N 1 ATOM 11942 C CA . LEU H 2 71 ? 54.148 6.460 -17.870 1.00 31.77 ? 71 LEU F CA 1 ATOM 11943 C C . LEU H 2 71 ? 54.861 5.951 -19.110 1.00 33.52 ? 71 LEU F C 1 ATOM 11944 O O . LEU H 2 71 ? 54.812 6.583 -20.162 1.00 29.22 ? 71 LEU F O 1 ATOM 11945 C CB . LEU H 2 71 ? 52.729 5.887 -17.856 1.00 36.74 ? 71 LEU F CB 1 ATOM 11946 C CG . LEU H 2 71 ? 51.849 5.993 -16.615 1.00 44.19 ? 71 LEU F CG 1 ATOM 11947 C CD1 . LEU H 2 71 ? 50.506 5.360 -16.901 1.00 49.60 ? 71 LEU F CD1 1 ATOM 11948 C CD2 . LEU H 2 71 ? 52.503 5.312 -15.441 1.00 48.96 ? 71 LEU F CD2 1 ATOM 11949 N N . ASP H 2 72 ? 55.513 4.800 -18.986 1.00 33.12 ? 72 ASP F N 1 ATOM 11950 C CA . ASP H 2 72 ? 56.013 4.082 -20.149 1.00 30.96 ? 72 ASP F CA 1 ATOM 11951 C C . ASP H 2 72 ? 55.550 2.636 -20.040 1.00 26.15 ? 72 ASP F C 1 ATOM 11952 O O . ASP H 2 72 ? 56.209 1.813 -19.408 1.00 25.56 ? 72 ASP F O 1 ATOM 11953 C CB . ASP H 2 72 ? 57.538 4.172 -20.247 1.00 34.61 ? 72 ASP F CB 1 ATOM 11954 C CG . ASP H 2 72 ? 58.063 3.754 -21.614 1.00 48.46 ? 72 ASP F CG 1 ATOM 11955 O OD1 . ASP H 2 72 ? 57.571 2.745 -22.167 1.00 50.03 ? 72 ASP F OD1 1 ATOM 11956 O OD2 . ASP H 2 72 ? 58.966 4.441 -22.140 1.00 56.29 ? 72 ASP F OD2 1 ATOM 11957 N N . MET H 2 73 ? 54.409 2.340 -20.658 1.00 30.18 ? 73 MET F N 1 ATOM 11958 C CA . MET H 2 73 ? 53.750 1.045 -20.512 1.00 33.24 ? 73 MET F CA 1 ATOM 11959 C C . MET H 2 73 ? 54.630 -0.124 -20.930 1.00 34.29 ? 73 MET F C 1 ATOM 11960 O O . MET H 2 73 ? 54.647 -1.158 -20.264 1.00 44.53 ? 73 MET F O 1 ATOM 11961 C CB . MET H 2 73 ? 52.449 1.016 -21.320 1.00 36.86 ? 73 MET F CB 1 ATOM 11962 C CG . MET H 2 73 ? 51.470 2.130 -20.974 1.00 37.23 ? 73 MET F CG 1 ATOM 11963 S SD . MET H 2 73 ? 50.904 2.079 -19.262 1.00 42.47 ? 73 MET F SD 1 ATOM 11964 C CE . MET H 2 73 ? 50.008 0.528 -19.254 1.00 33.16 ? 73 MET F CE 1 ATOM 11965 N N . SER H 2 74 ? 55.359 0.030 -22.030 1.00 31.27 ? 74 SER F N 1 ATOM 11966 C CA . SER H 2 74 ? 56.172 -1.076 -22.530 1.00 34.73 ? 74 SER F CA 1 ATOM 11967 C C . SER H 2 74 ? 57.420 -1.290 -21.673 1.00 35.33 ? 74 SER F C 1 ATOM 11968 O O . SER H 2 74 ? 57.865 -2.419 -21.499 1.00 40.46 ? 74 SER F O 1 ATOM 11969 C CB . SER H 2 74 ? 56.564 -0.847 -23.992 1.00 33.62 ? 74 SER F CB 1 ATOM 11970 O OG . SER H 2 74 ? 57.311 0.345 -24.145 1.00 45.34 ? 74 SER F OG 1 ATOM 11971 N N . LYS H 2 75 ? 57.984 -0.212 -21.134 1.00 32.15 ? 75 LYS F N 1 ATOM 11972 C CA . LYS H 2 75 ? 59.140 -0.346 -20.255 1.00 30.16 ? 75 LYS F CA 1 ATOM 11973 C C . LYS H 2 75 ? 58.728 -0.775 -18.846 1.00 29.35 ? 75 LYS F C 1 ATOM 11974 O O . LYS H 2 75 ? 59.562 -1.228 -18.060 1.00 29.31 ? 75 LYS F O 1 ATOM 11975 C CB . LYS H 2 75 ? 59.927 0.965 -20.196 1.00 31.45 ? 75 LYS F CB 1 ATOM 11976 C CG . LYS H 2 75 ? 60.619 1.326 -21.502 1.00 45.21 ? 75 LYS F CG 1 ATOM 11977 C CD . LYS H 2 75 ? 61.491 2.563 -21.345 1.00 53.17 ? 75 LYS F CD 1 ATOM 11978 C CE . LYS H 2 75 ? 62.244 2.883 -22.628 1.00 61.06 ? 75 LYS F CE 1 ATOM 11979 N NZ . LYS H 2 75 ? 63.163 4.046 -22.452 1.00 64.91 ? 75 LYS F NZ 1 ATOM 11980 N N . ASN H 2 76 ? 57.438 -0.638 -18.540 1.00 30.43 ? 76 ASN F N 1 ATOM 11981 C CA . ASN H 2 76 ? 56.906 -0.920 -17.207 1.00 20.88 ? 76 ASN F CA 1 ATOM 11982 C C . ASN H 2 76 ? 57.529 0.002 -16.162 1.00 25.51 ? 76 ASN F C 1 ATOM 11983 O O . ASN H 2 76 ? 57.805 -0.411 -15.031 1.00 26.87 ? 76 ASN F O 1 ATOM 11984 C CB . ASN H 2 76 ? 57.128 -2.392 -16.832 1.00 28.93 ? 76 ASN F CB 1 ATOM 11985 C CG . ASN H 2 76 ? 55.922 -3.007 -16.163 1.00 27.58 ? 76 ASN F CG 1 ATOM 11986 O OD1 . ASN H 2 76 ? 54.832 -3.008 -16.725 1.00 31.92 ? 76 ASN F OD1 1 ATOM 11987 N ND2 . ASN H 2 76 ? 56.114 -3.553 -14.963 1.00 24.00 ? 76 ASN F ND2 1 ATOM 11988 N N . GLN H 2 77 ? 57.744 1.255 -16.562 1.00 26.92 ? 77 GLN F N 1 ATOM 11989 C CA . GLN H 2 77 ? 58.326 2.285 -15.708 1.00 25.90 ? 77 GLN F CA 1 ATOM 11990 C C . GLN H 2 77 ? 57.436 3.520 -15.667 1.00 27.12 ? 77 GLN F C 1 ATOM 11991 O O . GLN H 2 77 ? 56.649 3.755 -16.584 1.00 24.44 ? 77 GLN F O 1 ATOM 11992 C CB . GLN H 2 77 ? 59.711 2.705 -16.210 1.00 22.92 ? 77 GLN F CB 1 ATOM 11993 C CG . GLN H 2 77 ? 60.738 1.598 -16.324 1.00 32.07 ? 77 GLN F CG 1 ATOM 11994 C CD . GLN H 2 77 ? 62.010 2.077 -17.007 1.00 30.13 ? 77 GLN F CD 1 ATOM 11995 O OE1 . GLN H 2 77 ? 62.140 3.253 -17.344 1.00 38.36 ? 77 GLN F OE1 1 ATOM 11996 N NE2 . GLN H 2 77 ? 62.949 1.168 -17.218 1.00 34.95 ? 77 GLN F NE2 1 ATOM 11997 N N . PHE H 2 78 ? 57.565 4.314 -14.610 1.00 25.16 ? 78 PHE F N 1 ATOM 11998 C CA . PHE H 2 78 ? 57.022 5.667 -14.639 1.00 24.74 ? 78 PHE F CA 1 ATOM 11999 C C . PHE H 2 78 ? 57.985 6.645 -13.973 1.00 29.08 ? 78 PHE F C 1 ATOM 12000 O O . PHE H 2 78 ? 58.840 6.255 -13.175 1.00 28.99 ? 78 PHE F O 1 ATOM 12001 C CB . PHE H 2 78 ? 55.623 5.729 -14.008 1.00 28.94 ? 78 PHE F CB 1 ATOM 12002 C CG . PHE H 2 78 ? 55.557 5.309 -12.568 1.00 32.47 ? 78 PHE F CG 1 ATOM 12003 C CD1 . PHE H 2 78 ? 55.558 3.969 -12.216 1.00 23.73 ? 78 PHE F CD1 1 ATOM 12004 C CD2 . PHE H 2 78 ? 55.424 6.262 -11.567 1.00 28.80 ? 78 PHE F CD2 1 ATOM 12005 C CE1 . PHE H 2 78 ? 55.470 3.590 -10.886 1.00 21.05 ? 78 PHE F CE1 1 ATOM 12006 C CE2 . PHE H 2 78 ? 55.339 5.889 -10.236 1.00 20.56 ? 78 PHE F CE2 1 ATOM 12007 C CZ . PHE H 2 78 ? 55.363 4.555 -9.894 1.00 21.80 ? 78 PHE F CZ 1 ATOM 12008 N N . SER H 2 79 ? 57.858 7.916 -14.336 1.00 30.70 ? 79 SER F N 1 ATOM 12009 C CA . SER H 2 79 ? 58.878 8.904 -14.014 1.00 30.44 ? 79 SER F CA 1 ATOM 12010 C C . SER H 2 79 ? 58.330 10.162 -13.359 1.00 30.79 ? 79 SER F C 1 ATOM 12011 O O . SER H 2 79 ? 57.146 10.477 -13.467 1.00 27.85 ? 79 SER F O 1 ATOM 12012 C CB . SER H 2 79 ? 59.638 9.299 -15.280 1.00 33.06 ? 79 SER F CB 1 ATOM 12013 O OG . SER H 2 79 ? 60.155 8.157 -15.933 1.00 45.59 ? 79 SER F OG 1 ATOM 12014 N N . LEU H 2 80 ? 59.229 10.874 -12.691 1.00 28.92 ? 80 LEU F N 1 ATOM 12015 C CA . LEU H 2 80 ? 58.936 12.158 -12.082 1.00 24.49 ? 80 LEU F CA 1 ATOM 12016 C C . LEU H 2 80 ? 59.926 13.210 -12.554 1.00 28.42 ? 80 LEU F C 1 ATOM 12017 O O . LEU H 2 80 ? 61.139 12.977 -12.563 1.00 30.21 ? 80 LEU F O 1 ATOM 12018 C CB . LEU H 2 80 ? 58.978 12.055 -10.562 1.00 23.57 ? 80 LEU F CB 1 ATOM 12019 C CG . LEU H 2 80 ? 59.028 13.391 -9.825 1.00 25.23 ? 80 LEU F CG 1 ATOM 12020 C CD1 . LEU H 2 80 ? 57.701 14.130 -9.956 1.00 19.45 ? 80 LEU F CD1 1 ATOM 12021 C CD2 . LEU H 2 80 ? 59.406 13.189 -8.368 1.00 26.83 ? 80 LEU F CD2 1 ATOM 12022 N N . ASN H 2 81 ? 59.390 14.362 -12.949 1.00 28.09 ? 81 ASN F N 1 ATOM 12023 C CA . ASN H 2 81 ? 60.183 15.534 -13.310 1.00 33.36 ? 81 ASN F CA 1 ATOM 12024 C C . ASN H 2 81 ? 59.843 16.731 -12.439 1.00 33.80 ? 81 ASN F C 1 ATOM 12025 O O . ASN H 2 81 ? 58.679 17.093 -12.291 1.00 34.35 ? 81 ASN F O 1 ATOM 12026 C CB . ASN H 2 81 ? 59.968 15.898 -14.767 1.00 50.14 ? 81 ASN F CB 1 ATOM 12027 C CG . ASN H 2 81 ? 60.982 15.277 -15.662 1.00 65.79 ? 81 ASN F CG 1 ATOM 12028 O OD1 . ASN H 2 81 ? 61.761 14.415 -15.252 1.00 60.61 ? 81 ASN F OD1 1 ATOM 12029 N ND2 . ASN H 2 81 ? 60.989 15.709 -16.904 1.00 90.93 ? 81 ASN F ND2 1 ATOM 12030 N N . LEU H 2 82 ? 60.866 17.342 -11.862 1.00 29.18 ? 82 LEU F N 1 ATOM 12031 C CA . LEU H 2 82 ? 60.675 18.575 -11.125 1.00 29.85 ? 82 LEU F CA 1 ATOM 12032 C C . LEU H 2 82 ? 61.707 19.593 -11.604 1.00 32.50 ? 82 LEU F C 1 ATOM 12033 O O . LEU H 2 82 ? 62.909 19.406 -11.418 1.00 32.22 ? 82 LEU F O 1 ATOM 12034 C CB . LEU H 2 82 ? 60.787 18.325 -9.621 1.00 35.14 ? 82 LEU F CB 1 ATOM 12035 C CG . LEU H 2 82 ? 60.435 19.469 -8.673 1.00 37.54 ? 82 LEU F CG 1 ATOM 12036 C CD1 . LEU H 2 82 ? 58.979 19.856 -8.813 1.00 33.52 ? 82 LEU F CD1 1 ATOM 12037 C CD2 . LEU H 2 82 ? 60.750 19.067 -7.242 1.00 44.01 ? 82 LEU F CD2 1 ATOM 12038 N N . THR H 2 83 A 61.234 20.650 -12.257 1.00 32.70 ? 82 THR F N 1 ATOM 12039 C CA . THR H 2 83 A 62.122 21.674 -12.803 1.00 30.57 ? 82 THR F CA 1 ATOM 12040 C C . THR H 2 83 A 62.406 22.789 -11.801 1.00 35.82 ? 82 THR F C 1 ATOM 12041 O O . THR H 2 83 A 61.675 22.953 -10.820 1.00 31.08 ? 82 THR F O 1 ATOM 12042 C CB . THR H 2 83 A 61.531 22.305 -14.074 1.00 34.32 ? 82 THR F CB 1 ATOM 12043 O OG1 . THR H 2 83 A 60.280 22.923 -13.759 1.00 35.77 ? 82 THR F OG1 1 ATOM 12044 C CG2 . THR H 2 83 A 61.306 21.249 -15.147 1.00 32.70 ? 82 THR F CG2 1 ATOM 12045 N N . SER H 2 84 B 63.469 23.546 -12.065 1.00 34.49 ? 82 SER F N 1 ATOM 12046 C CA . SER H 2 84 B 63.847 24.711 -11.265 1.00 33.81 ? 82 SER F CA 1 ATOM 12047 C C . SER H 2 84 B 63.897 24.419 -9.771 1.00 35.55 ? 82 SER F C 1 ATOM 12048 O O . SER H 2 84 B 63.228 25.089 -8.986 1.00 36.99 ? 82 SER F O 1 ATOM 12049 C CB . SER H 2 84 B 62.874 25.863 -11.521 1.00 35.80 ? 82 SER F CB 1 ATOM 12050 O OG . SER H 2 84 B 62.787 26.145 -12.905 1.00 40.46 ? 82 SER F OG 1 ATOM 12051 N N . VAL H 2 85 C 64.681 23.422 -9.376 1.00 29.35 ? 82 VAL F N 1 ATOM 12052 C CA . VAL H 2 85 C 64.708 23.018 -7.976 1.00 31.97 ? 82 VAL F CA 1 ATOM 12053 C C . VAL H 2 85 C 65.427 24.043 -7.106 1.00 34.70 ? 82 VAL F C 1 ATOM 12054 O O . VAL H 2 85 C 66.305 24.775 -7.575 1.00 27.01 ? 82 VAL F O 1 ATOM 12055 C CB . VAL H 2 85 C 65.380 21.636 -7.784 1.00 29.10 ? 82 VAL F CB 1 ATOM 12056 C CG1 . VAL H 2 85 C 64.579 20.550 -8.496 1.00 21.14 ? 82 VAL F CG1 1 ATOM 12057 C CG2 . VAL H 2 85 C 66.829 21.662 -8.274 1.00 24.36 ? 82 VAL F CG2 1 ATOM 12058 N N . THR H 2 86 ? 65.018 24.102 -5.842 1.00 25.07 ? 83 THR F N 1 ATOM 12059 C CA . THR H 2 86 ? 65.729 24.861 -4.825 1.00 32.62 ? 83 THR F CA 1 ATOM 12060 C C . THR H 2 86 ? 65.930 23.967 -3.615 1.00 30.61 ? 83 THR F C 1 ATOM 12061 O O . THR H 2 86 ? 65.484 22.818 -3.607 1.00 30.62 ? 83 THR F O 1 ATOM 12062 C CB . THR H 2 86 ? 64.974 26.139 -4.397 1.00 37.09 ? 83 THR F CB 1 ATOM 12063 O OG1 . THR H 2 86 ? 63.769 25.781 -3.706 1.00 38.48 ? 83 THR F OG1 1 ATOM 12064 C CG2 . THR H 2 86 ? 64.641 27.003 -5.603 1.00 35.89 ? 83 THR F CG2 1 ATOM 12065 N N . ALA H 2 87 ? 66.589 24.502 -2.592 1.00 30.69 ? 84 ALA F N 1 ATOM 12066 C CA . ALA H 2 87 ? 66.830 23.769 -1.354 1.00 36.48 ? 84 ALA F CA 1 ATOM 12067 C C . ALA H 2 87 ? 65.527 23.302 -0.703 1.00 36.16 ? 84 ALA F C 1 ATOM 12068 O O . ALA H 2 87 ? 65.528 22.395 0.131 1.00 35.40 ? 84 ALA F O 1 ATOM 12069 C CB . ALA H 2 87 ? 67.624 24.629 -0.382 1.00 37.13 ? 84 ALA F CB 1 ATOM 12070 N N . ALA H 2 88 ? 64.416 23.921 -1.089 1.00 29.45 ? 85 ALA F N 1 ATOM 12071 C CA . ALA H 2 88 ? 63.113 23.530 -0.569 1.00 32.87 ? 85 ALA F CA 1 ATOM 12072 C C . ALA H 2 88 ? 62.643 22.183 -1.138 1.00 33.33 ? 85 ALA F C 1 ATOM 12073 O O . ALA H 2 88 ? 61.683 21.598 -0.638 1.00 27.84 ? 85 ALA F O 1 ATOM 12074 C CB . ALA H 2 88 ? 62.085 24.618 -0.862 1.00 31.39 ? 85 ALA F CB 1 ATOM 12075 N N . ASP H 2 89 ? 63.316 21.689 -2.175 1.00 34.27 ? 86 ASP F N 1 ATOM 12076 C CA . ASP H 2 89 ? 62.916 20.423 -2.797 1.00 34.83 ? 86 ASP F CA 1 ATOM 12077 C C . ASP H 2 89 ? 63.745 19.253 -2.283 1.00 29.71 ? 86 ASP F C 1 ATOM 12078 O O . ASP H 2 89 ? 63.529 18.109 -2.674 1.00 34.55 ? 86 ASP F O 1 ATOM 12079 C CB . ASP H 2 89 ? 63.019 20.513 -4.321 1.00 29.72 ? 86 ASP F CB 1 ATOM 12080 C CG . ASP H 2 89 ? 62.086 21.564 -4.902 1.00 38.68 ? 86 ASP F CG 1 ATOM 12081 O OD1 . ASP H 2 89 ? 60.899 21.597 -4.510 1.00 32.01 ? 86 ASP F OD1 1 ATOM 12082 O OD2 . ASP H 2 89 ? 62.542 22.374 -5.736 1.00 39.05 ? 86 ASP F OD2 1 ATOM 12083 N N . THR H 2 90 ? 64.692 19.552 -1.404 1.00 31.92 ? 87 THR F N 1 ATOM 12084 C CA . THR H 2 90 ? 65.467 18.524 -0.725 1.00 32.35 ? 87 THR F CA 1 ATOM 12085 C C . THR H 2 90 ? 64.548 17.626 0.093 1.00 30.54 ? 87 THR F C 1 ATOM 12086 O O . THR H 2 90 ? 63.862 18.089 1.004 1.00 30.58 ? 87 THR F O 1 ATOM 12087 C CB . THR H 2 90 ? 66.539 19.149 0.193 1.00 30.96 ? 87 THR F CB 1 ATOM 12088 O OG1 . THR H 2 90 ? 67.581 19.716 -0.611 1.00 33.49 ? 87 THR F OG1 1 ATOM 12089 C CG2 . THR H 2 90 ? 67.135 18.102 1.123 1.00 30.21 ? 87 THR F CG2 1 ATOM 12090 N N . ALA H 2 91 ? 64.535 16.341 -0.245 1.00 25.53 ? 88 ALA F N 1 ATOM 12091 C CA . ALA H 2 91 ? 63.667 15.376 0.414 1.00 29.23 ? 88 ALA F CA 1 ATOM 12092 C C . ALA H 2 91 ? 63.986 13.967 -0.050 1.00 27.76 ? 88 ALA F C 1 ATOM 12093 O O . ALA H 2 91 ? 64.703 13.769 -1.034 1.00 30.57 ? 88 ALA F O 1 ATOM 12094 C CB . ALA H 2 91 ? 62.192 15.695 0.134 1.00 18.15 ? 88 ALA F CB 1 ATOM 12095 N N . VAL H 2 92 ? 63.454 12.989 0.668 1.00 24.69 ? 89 VAL F N 1 ATOM 12096 C CA . VAL H 2 92 ? 63.382 11.636 0.143 1.00 21.27 ? 89 VAL F CA 1 ATOM 12097 C C . VAL H 2 92 ? 62.135 11.550 -0.726 1.00 18.95 ? 89 VAL F C 1 ATOM 12098 O O . VAL H 2 92 ? 61.037 11.875 -0.278 1.00 21.37 ? 89 VAL F O 1 ATOM 12099 C CB . VAL H 2 92 ? 63.323 10.577 1.254 1.00 22.54 ? 89 VAL F CB 1 ATOM 12100 C CG1 . VAL H 2 92 ? 63.173 9.182 0.646 1.00 17.35 ? 89 VAL F CG1 1 ATOM 12101 C CG2 . VAL H 2 92 ? 64.571 10.650 2.125 1.00 23.67 ? 89 VAL F CG2 1 ATOM 12102 N N . TYR H 2 93 ? 62.295 11.141 -1.977 1.00 21.51 ? 90 TYR F N 1 ATOM 12103 C CA . TYR H 2 93 ? 61.140 10.986 -2.851 1.00 20.67 ? 90 TYR F CA 1 ATOM 12104 C C . TYR H 2 93 ? 60.785 9.511 -2.963 1.00 27.56 ? 90 TYR F C 1 ATOM 12105 O O . TYR H 2 93 ? 61.668 8.676 -3.159 1.00 23.95 ? 90 TYR F O 1 ATOM 12106 C CB . TYR H 2 93 ? 61.418 11.580 -4.235 1.00 20.59 ? 90 TYR F CB 1 ATOM 12107 C CG . TYR H 2 93 ? 61.499 13.092 -4.252 1.00 20.81 ? 90 TYR F CG 1 ATOM 12108 C CD1 . TYR H 2 93 ? 62.526 13.762 -3.586 1.00 23.93 ? 90 TYR F CD1 1 ATOM 12109 C CD2 . TYR H 2 93 ? 60.555 13.851 -4.934 1.00 17.45 ? 90 TYR F CD2 1 ATOM 12110 C CE1 . TYR H 2 93 ? 62.602 15.143 -3.591 1.00 24.72 ? 90 TYR F CE1 1 ATOM 12111 C CE2 . TYR H 2 93 ? 60.625 15.233 -4.946 1.00 25.54 ? 90 TYR F CE2 1 ATOM 12112 C CZ . TYR H 2 93 ? 61.653 15.875 -4.273 1.00 22.66 ? 90 TYR F CZ 1 ATOM 12113 O OH . TYR H 2 93 ? 61.734 17.247 -4.274 1.00 22.75 ? 90 TYR F OH 1 ATOM 12114 N N . PHE H 2 94 ? 59.497 9.195 -2.824 1.00 20.05 ? 91 PHE F N 1 ATOM 12115 C CA . PHE H 2 94 ? 59.014 7.822 -2.957 1.00 22.89 ? 91 PHE F CA 1 ATOM 12116 C C . PHE H 2 94 ? 58.082 7.685 -4.151 1.00 25.01 ? 91 PHE F C 1 ATOM 12117 O O . PHE H 2 94 ? 57.246 8.558 -4.388 1.00 22.82 ? 91 PHE F O 1 ATOM 12118 C CB . PHE H 2 94 ? 58.250 7.373 -1.708 1.00 25.01 ? 91 PHE F CB 1 ATOM 12119 C CG . PHE H 2 94 ? 59.054 7.395 -0.443 1.00 23.42 ? 91 PHE F CG 1 ATOM 12120 C CD1 . PHE H 2 94 ? 59.851 6.318 -0.096 1.00 21.61 ? 91 PHE F CD1 1 ATOM 12121 C CD2 . PHE H 2 94 ? 58.970 8.472 0.428 1.00 26.29 ? 91 PHE F CD2 1 ATOM 12122 C CE1 . PHE H 2 94 ? 60.582 6.323 1.087 1.00 19.74 ? 91 PHE F CE1 1 ATOM 12123 C CE2 . PHE H 2 94 ? 59.690 8.485 1.611 1.00 20.88 ? 91 PHE F CE2 1 ATOM 12124 C CZ . PHE H 2 94 ? 60.498 7.403 1.942 1.00 23.07 ? 91 PHE F CZ 1 ATOM 12125 N N . CYS H 2 95 ? 58.213 6.593 -4.895 1.00 19.76 ? 92 CYS F N 1 ATOM 12126 C CA . CYS H 2 95 ? 57.153 6.207 -5.820 1.00 20.92 ? 92 CYS F CA 1 ATOM 12127 C C . CYS H 2 95 ? 56.256 5.198 -5.097 1.00 20.72 ? 92 CYS F C 1 ATOM 12128 O O . CYS H 2 95 ? 56.677 4.571 -4.117 1.00 19.98 ? 92 CYS F O 1 ATOM 12129 C CB . CYS H 2 95 ? 57.715 5.632 -7.130 1.00 19.23 ? 92 CYS F CB 1 ATOM 12130 S SG . CYS H 2 95 ? 58.723 4.118 -7.024 1.00 31.11 ? 92 CYS F SG 1 ATOM 12131 N N . ALA H 2 96 ? 55.015 5.072 -5.548 1.00 13.97 ? 93 ALA F N 1 ATOM 12132 C CA . ALA H 2 96 ? 54.082 4.149 -4.921 1.00 18.49 ? 93 ALA F CA 1 ATOM 12133 C C . ALA H 2 96 ? 52.955 3.759 -5.868 1.00 19.77 ? 93 ALA F C 1 ATOM 12134 O O . ALA H 2 96 ? 52.583 4.520 -6.762 1.00 22.87 ? 93 ALA F O 1 ATOM 12135 C CB . ALA H 2 96 ? 53.515 4.758 -3.651 1.00 21.07 ? 93 ALA F CB 1 ATOM 12136 N N . ARG H 2 97 ? 52.432 2.555 -5.673 1.00 18.68 ? 94 ARG F N 1 ATOM 12137 C CA . ARG H 2 97 ? 51.238 2.109 -6.371 1.00 13.93 ? 94 ARG F CA 1 ATOM 12138 C C . ARG H 2 97 ? 50.015 2.396 -5.522 1.00 22.51 ? 94 ARG F C 1 ATOM 12139 O O . ARG H 2 97 ? 50.034 2.181 -4.310 1.00 22.99 ? 94 ARG F O 1 ATOM 12140 C CB . ARG H 2 97 ? 51.300 0.607 -6.678 1.00 14.72 ? 94 ARG F CB 1 ATOM 12141 C CG . ARG H 2 97 ? 50.031 0.064 -7.350 1.00 14.11 ? 94 ARG F CG 1 ATOM 12142 C CD . ARG H 2 97 ? 50.038 -1.464 -7.480 1.00 17.68 ? 94 ARG F CD 1 ATOM 12143 N NE . ARG H 2 97 ? 49.732 -2.125 -6.214 1.00 18.57 ? 94 ARG F NE 1 ATOM 12144 C CZ . ARG H 2 97 ? 49.504 -3.428 -6.083 1.00 24.69 ? 94 ARG F CZ 1 ATOM 12145 N NH1 . ARG H 2 97 ? 49.547 -4.224 -7.145 1.00 19.44 ? 94 ARG F NH1 1 ATOM 12146 N NH2 . ARG H 2 97 ? 49.232 -3.937 -4.890 1.00 29.19 ? 94 ARG F NH2 1 ATOM 12147 N N . ARG H 2 98 ? 48.951 2.886 -6.145 1.00 20.14 ? 95 ARG F N 1 ATOM 12148 C CA . ARG H 2 98 ? 47.662 2.845 -5.480 1.00 20.03 ? 95 ARG F CA 1 ATOM 12149 C C . ARG H 2 98 ? 47.070 1.479 -5.783 1.00 23.71 ? 95 ARG F C 1 ATOM 12150 O O . ARG H 2 98 ? 46.783 1.159 -6.939 1.00 22.69 ? 95 ARG F O 1 ATOM 12151 C CB . ARG H 2 98 ? 46.743 3.979 -5.941 1.00 16.91 ? 95 ARG F CB 1 ATOM 12152 C CG . ARG H 2 98 ? 47.348 5.358 -5.723 1.00 20.47 ? 95 ARG F CG 1 ATOM 12153 C CD . ARG H 2 98 ? 46.293 6.454 -5.738 1.00 18.62 ? 95 ARG F CD 1 ATOM 12154 N NE . ARG H 2 98 ? 45.314 6.266 -4.670 1.00 22.58 ? 95 ARG F NE 1 ATOM 12155 C CZ . ARG H 2 98 ? 44.544 7.235 -4.183 1.00 26.58 ? 95 ARG F CZ 1 ATOM 12156 N NH1 . ARG H 2 98 ? 44.645 8.468 -4.664 1.00 26.16 ? 95 ARG F NH1 1 ATOM 12157 N NH2 . ARG H 2 98 ? 43.678 6.976 -3.212 1.00 23.59 ? 95 ARG F NH2 1 ATOM 12158 N N . SER H 2 99 ? 46.926 0.659 -4.747 1.00 26.51 ? 96 SER F N 1 ATOM 12159 C CA . SER H 2 99 ? 46.397 -0.683 -4.925 1.00 29.06 ? 96 SER F CA 1 ATOM 12160 C C . SER H 2 99 ? 44.922 -0.632 -5.294 1.00 32.50 ? 96 SER F C 1 ATOM 12161 O O . SER H 2 99 ? 44.279 0.413 -5.177 1.00 21.49 ? 96 SER F O 1 ATOM 12162 C CB . SER H 2 99 ? 46.593 -1.520 -3.662 1.00 27.51 ? 96 SER F CB 1 ATOM 12163 O OG . SER H 2 99 ? 45.709 -1.109 -2.643 1.00 31.88 ? 96 SER F OG 1 ATOM 12164 N N . ASN H 2 100 ? 44.398 -1.774 -5.728 1.00 14.88 ? 97 ASN F N 1 ATOM 12165 C CA . ASN H 2 100 ? 43.021 -1.883 -6.176 1.00 24.50 ? 97 ASN F CA 1 ATOM 12166 C C . ASN H 2 100 ? 42.071 -2.247 -5.038 1.00 28.80 ? 97 ASN F C 1 ATOM 12167 O O . ASN H 2 100 ? 40.915 -2.591 -5.269 1.00 36.00 ? 97 ASN F O 1 ATOM 12168 C CB . ASN H 2 100 ? 42.913 -2.921 -7.293 1.00 23.30 ? 97 ASN F CB 1 ATOM 12169 C CG . ASN H 2 100 ? 41.620 -2.799 -8.082 1.00 22.51 ? 97 ASN F CG 1 ATOM 12170 O OD1 . ASN H 2 100 ? 41.162 -1.697 -8.383 1.00 22.32 ? 97 ASN F OD1 1 ATOM 12171 N ND2 . ASN H 2 100 ? 41.022 -3.935 -8.408 1.00 21.09 ? 97 ASN F ND2 1 ATOM 12172 N N . TRP H 2 101 ? 42.567 -2.180 -3.809 1.00 26.58 ? 98 TRP F N 1 ATOM 12173 C CA . TRP H 2 101 ? 41.724 -2.357 -2.634 1.00 25.07 ? 98 TRP F CA 1 ATOM 12174 C C . TRP H 2 101 ? 40.798 -1.152 -2.510 1.00 20.95 ? 98 TRP F C 1 ATOM 12175 O O . TRP H 2 101 ? 41.097 -0.098 -3.061 1.00 22.04 ? 98 TRP F O 1 ATOM 12176 C CB . TRP H 2 101 ? 42.582 -2.530 -1.375 1.00 24.91 ? 98 TRP F CB 1 ATOM 12177 C CG . TRP H 2 101 ? 43.125 -3.914 -1.215 1.00 32.78 ? 98 TRP F CG 1 ATOM 12178 C CD1 . TRP H 2 101 ? 42.584 -5.071 -1.702 1.00 35.77 ? 98 TRP F CD1 1 ATOM 12179 C CD2 . TRP H 2 101 ? 44.326 -4.291 -0.529 1.00 35.17 ? 98 TRP F CD2 1 ATOM 12180 N NE1 . TRP H 2 101 ? 43.370 -6.144 -1.354 1.00 41.65 ? 98 TRP F NE1 1 ATOM 12181 C CE2 . TRP H 2 101 ? 44.443 -5.694 -0.636 1.00 39.86 ? 98 TRP F CE2 1 ATOM 12182 C CE3 . TRP H 2 101 ? 45.307 -3.580 0.168 1.00 41.59 ? 98 TRP F CE3 1 ATOM 12183 C CZ2 . TRP H 2 101 ? 45.509 -6.399 -0.069 1.00 49.58 ? 98 TRP F CZ2 1 ATOM 12184 C CZ3 . TRP H 2 101 ? 46.364 -4.281 0.730 1.00 49.02 ? 98 TRP F CZ3 1 ATOM 12185 C CH2 . TRP H 2 101 ? 46.456 -5.676 0.606 1.00 55.82 ? 98 TRP F CH2 1 ATOM 12186 N N . PRO H 2 102 ? 39.663 -1.308 -1.805 1.00 25.29 ? 99 PRO F N 1 ATOM 12187 C CA . PRO H 2 102 ? 38.721 -0.199 -1.598 1.00 24.08 ? 99 PRO F CA 1 ATOM 12188 C C . PRO H 2 102 ? 39.410 1.100 -1.174 1.00 27.90 ? 99 PRO F C 1 ATOM 12189 O O . PRO H 2 102 ? 40.296 1.057 -0.321 1.00 30.79 ? 99 PRO F O 1 ATOM 12190 C CB . PRO H 2 102 ? 37.812 -0.720 -0.483 1.00 27.73 ? 99 PRO F CB 1 ATOM 12191 C CG . PRO H 2 102 ? 37.822 -2.203 -0.661 1.00 27.92 ? 99 PRO F CG 1 ATOM 12192 C CD . PRO H 2 102 ? 39.181 -2.567 -1.199 1.00 24.75 ? 99 PRO F CD 1 ATOM 12193 N N . TYR H 2 103 ? 39.012 2.213 -1.795 1.00 20.60 ? 100 TYR F N 1 ATOM 12194 C CA . TYR H 2 103 ? 39.565 3.553 -1.563 1.00 26.60 ? 100 TYR F CA 1 ATOM 12195 C C . TYR H 2 103 ? 40.989 3.710 -2.096 1.00 25.71 ? 100 TYR F C 1 ATOM 12196 O O . TYR H 2 103 ? 41.566 4.790 -2.002 1.00 21.17 ? 100 TYR F O 1 ATOM 12197 C CB . TYR H 2 103 ? 39.508 3.918 -0.074 1.00 27.79 ? 100 TYR F CB 1 ATOM 12198 C CG . TYR H 2 103 ? 38.102 3.910 0.490 1.00 31.24 ? 100 TYR F CG 1 ATOM 12199 C CD1 . TYR H 2 103 ? 37.235 4.971 0.261 1.00 33.47 ? 100 TYR F CD1 1 ATOM 12200 C CD2 . TYR H 2 103 ? 37.638 2.837 1.243 1.00 33.39 ? 100 TYR F CD2 1 ATOM 12201 C CE1 . TYR H 2 103 ? 35.948 4.971 0.775 1.00 36.50 ? 100 TYR F CE1 1 ATOM 12202 C CE2 . TYR H 2 103 ? 36.347 2.822 1.753 1.00 31.02 ? 100 TYR F CE2 1 ATOM 12203 C CZ . TYR H 2 103 ? 35.507 3.891 1.513 1.00 35.20 ? 100 TYR F CZ 1 ATOM 12204 O OH . TYR H 2 103 ? 34.230 3.881 2.023 1.00 38.55 ? 100 TYR F OH 1 ATOM 12205 N N . LEU H 2 104 A 41.537 2.642 -2.674 1.00 25.46 ? 100 LEU F N 1 ATOM 12206 C CA . LEU H 2 104 A 42.861 2.665 -3.314 1.00 21.74 ? 100 LEU F CA 1 ATOM 12207 C C . LEU H 2 104 A 43.993 3.194 -2.424 1.00 25.66 ? 100 LEU F C 1 ATOM 12208 O O . LEU H 2 104 A 44.639 4.193 -2.761 1.00 22.40 ? 100 LEU F O 1 ATOM 12209 C CB . LEU H 2 104 A 42.815 3.502 -4.602 1.00 15.83 ? 100 LEU F CB 1 ATOM 12210 C CG . LEU H 2 104 A 41.594 3.404 -5.525 1.00 20.30 ? 100 LEU F CG 1 ATOM 12211 C CD1 . LEU H 2 104 A 41.766 4.318 -6.736 1.00 20.48 ? 100 LEU F CD1 1 ATOM 12212 C CD2 . LEU H 2 104 A 41.340 1.974 -5.966 1.00 21.34 ? 100 LEU F CD2 1 ATOM 12213 N N . PRO H 2 105 B 44.255 2.520 -1.294 1.00 27.92 ? 100 PRO F N 1 ATOM 12214 C CA . PRO H 2 105 B 45.361 2.967 -0.441 1.00 18.38 ? 100 PRO F CA 1 ATOM 12215 C C . PRO H 2 105 B 46.713 2.753 -1.129 1.00 24.60 ? 100 PRO F C 1 ATOM 12216 O O . PRO H 2 105 B 46.802 1.956 -2.064 1.00 29.73 ? 100 PRO F O 1 ATOM 12217 C CB . PRO H 2 105 B 45.226 2.079 0.793 1.00 25.73 ? 100 PRO F CB 1 ATOM 12218 C CG . PRO H 2 105 B 44.629 0.801 0.253 1.00 23.57 ? 100 PRO F CG 1 ATOM 12219 C CD . PRO H 2 105 B 43.664 1.253 -0.818 1.00 28.17 ? 100 PRO F CD 1 ATOM 12220 N N . PHE H 2 106 C 47.747 3.442 -0.660 1.00 26.01 ? 100 PHE F N 1 ATOM 12221 C CA . PHE H 2 106 C 49.061 3.385 -1.298 1.00 23.57 ? 100 PHE F CA 1 ATOM 12222 C C . PHE H 2 106 C 49.837 2.141 -0.854 1.00 23.91 ? 100 PHE F C 1 ATOM 12223 O O . PHE H 2 106 C 50.293 2.056 0.285 1.00 24.67 ? 100 PHE F O 1 ATOM 12224 C CB . PHE H 2 106 C 49.874 4.651 -0.989 1.00 14.23 ? 100 PHE F CB 1 ATOM 12225 C CG . PHE H 2 106 C 49.342 5.909 -1.640 1.00 26.17 ? 100 PHE F CG 1 ATOM 12226 C CD1 . PHE H 2 106 C 48.012 6.289 -1.498 1.00 25.97 ? 100 PHE F CD1 1 ATOM 12227 C CD2 . PHE H 2 106 C 50.186 6.733 -2.367 1.00 25.08 ? 100 PHE F CD2 1 ATOM 12228 C CE1 . PHE H 2 106 C 47.528 7.457 -2.090 1.00 25.43 ? 100 PHE F CE1 1 ATOM 12229 C CE2 . PHE H 2 106 C 49.710 7.903 -2.956 1.00 31.24 ? 100 PHE F CE2 1 ATOM 12230 C CZ . PHE H 2 106 C 48.379 8.263 -2.816 1.00 22.81 ? 100 PHE F CZ 1 ATOM 12231 N N . ASP H 2 107 ? 49.986 1.185 -1.765 1.00 24.25 ? 101 ASP F N 1 ATOM 12232 C CA . ASP H 2 107 ? 50.701 -0.059 -1.478 1.00 20.97 ? 101 ASP F CA 1 ATOM 12233 C C . ASP H 2 107 ? 51.004 -0.806 -2.769 1.00 20.48 ? 101 ASP F C 1 ATOM 12234 O O . ASP H 2 107 ? 50.102 -1.011 -3.582 1.00 17.35 ? 101 ASP F O 1 ATOM 12235 C CB . ASP H 2 107 ? 49.882 -0.953 -0.541 1.00 27.59 ? 101 ASP F CB 1 ATOM 12236 C CG . ASP H 2 107 ? 50.510 -2.326 -0.345 1.00 34.40 ? 101 ASP F CG 1 ATOM 12237 O OD1 . ASP H 2 107 ? 51.648 -2.402 0.159 1.00 37.28 ? 101 ASP F OD1 1 ATOM 12238 O OD2 . ASP H 2 107 ? 49.870 -3.337 -0.694 1.00 44.97 ? 101 ASP F OD2 1 ATOM 12239 N N . PRO H 2 108 ? 52.272 -1.217 -2.967 1.00 19.64 ? 102 PRO F N 1 ATOM 12240 C CA . PRO H 2 108 ? 53.433 -0.938 -2.117 1.00 21.89 ? 102 PRO F CA 1 ATOM 12241 C C . PRO H 2 108 ? 54.199 0.321 -2.527 1.00 24.33 ? 102 PRO F C 1 ATOM 12242 O O . PRO H 2 108 ? 53.821 1.008 -3.479 1.00 25.98 ? 102 PRO F O 1 ATOM 12243 C CB . PRO H 2 108 ? 54.302 -2.174 -2.324 1.00 19.88 ? 102 PRO F CB 1 ATOM 12244 C CG . PRO H 2 108 ? 54.047 -2.522 -3.754 1.00 20.50 ? 102 PRO F CG 1 ATOM 12245 C CD . PRO H 2 108 ? 52.593 -2.226 -3.995 1.00 14.08 ? 102 PRO F CD 1 ATOM 12246 N N . TRP H 2 109 ? 55.279 0.600 -1.803 1.00 25.79 ? 103 TRP F N 1 ATOM 12247 C CA . TRP H 2 109 ? 56.107 1.778 -2.035 1.00 20.55 ? 103 TRP F CA 1 ATOM 12248 C C . TRP H 2 109 ? 57.495 1.404 -2.553 1.00 24.63 ? 103 TRP F C 1 ATOM 12249 O O . TRP H 2 109 ? 58.002 0.318 -2.268 1.00 24.43 ? 103 TRP F O 1 ATOM 12250 C CB . TRP H 2 109 ? 56.257 2.582 -0.746 1.00 23.67 ? 103 TRP F CB 1 ATOM 12251 C CG . TRP H 2 109 ? 54.984 3.141 -0.181 1.00 25.83 ? 103 TRP F CG 1 ATOM 12252 C CD1 . TRP H 2 109 ? 53.888 2.440 0.240 1.00 17.47 ? 103 TRP F CD1 1 ATOM 12253 C CD2 . TRP H 2 109 ? 54.695 4.521 0.063 1.00 24.57 ? 103 TRP F CD2 1 ATOM 12254 N NE1 . TRP H 2 109 ? 52.930 3.302 0.712 1.00 19.72 ? 103 TRP F NE1 1 ATOM 12255 C CE2 . TRP H 2 109 ? 53.401 4.583 0.619 1.00 24.51 ? 103 TRP F CE2 1 ATOM 12256 C CE3 . TRP H 2 109 ? 55.399 5.709 -0.144 1.00 24.25 ? 103 TRP F CE3 1 ATOM 12257 C CZ2 . TRP H 2 109 ? 52.800 5.788 0.967 1.00 31.67 ? 103 TRP F CZ2 1 ATOM 12258 C CZ3 . TRP H 2 109 ? 54.805 6.898 0.205 1.00 27.48 ? 103 TRP F CZ3 1 ATOM 12259 C CH2 . TRP H 2 109 ? 53.515 6.931 0.756 1.00 28.81 ? 103 TRP F CH2 1 ATOM 12260 N N . GLY H 2 110 ? 58.118 2.309 -3.302 1.00 18.94 ? 104 GLY F N 1 ATOM 12261 C CA . GLY H 2 110 ? 59.515 2.150 -3.672 1.00 17.28 ? 104 GLY F CA 1 ATOM 12262 C C . GLY H 2 110 ? 60.396 2.346 -2.446 1.00 25.33 ? 104 GLY F C 1 ATOM 12263 O O . GLY H 2 110 ? 59.885 2.657 -1.369 1.00 24.56 ? 104 GLY F O 1 ATOM 12264 N N . GLN H 2 111 ? 61.711 2.177 -2.590 1.00 20.79 ? 105 GLN F N 1 ATOM 12265 C CA . GLN H 2 111 ? 62.600 2.267 -1.430 1.00 22.83 ? 105 GLN F CA 1 ATOM 12266 C C . GLN H 2 111 ? 62.909 3.716 -1.069 1.00 24.90 ? 105 GLN F C 1 ATOM 12267 O O . GLN H 2 111 ? 63.441 3.989 0.008 1.00 25.82 ? 105 GLN F O 1 ATOM 12268 C CB . GLN H 2 111 ? 63.908 1.501 -1.670 1.00 22.30 ? 105 GLN F CB 1 ATOM 12269 C CG . GLN H 2 111 ? 64.976 2.265 -2.454 1.00 22.50 ? 105 GLN F CG 1 ATOM 12270 C CD . GLN H 2 111 ? 64.721 2.271 -3.951 1.00 25.36 ? 105 GLN F CD 1 ATOM 12271 O OE1 . GLN H 2 111 ? 63.650 1.885 -4.415 1.00 24.60 ? 105 GLN F OE1 1 ATOM 12272 N NE2 . GLN H 2 111 ? 65.714 2.706 -4.715 1.00 27.90 ? 105 GLN F NE2 1 ATOM 12273 N N . GLY H 2 112 ? 62.568 4.640 -1.964 1.00 21.48 ? 106 GLY F N 1 ATOM 12274 C CA . GLY H 2 112 ? 62.831 6.051 -1.735 1.00 17.26 ? 106 GLY F CA 1 ATOM 12275 C C . GLY H 2 112 ? 64.212 6.465 -2.211 1.00 29.51 ? 106 GLY F C 1 ATOM 12276 O O . GLY H 2 112 ? 65.176 5.716 -2.066 1.00 31.96 ? 106 GLY F O 1 ATOM 12277 N N . THR H 2 113 ? 64.301 7.660 -2.789 1.00 28.40 ? 107 THR F N 1 ATOM 12278 C CA . THR H 2 113 ? 65.574 8.222 -3.228 1.00 29.70 ? 107 THR F CA 1 ATOM 12279 C C . THR H 2 113 ? 65.798 9.567 -2.552 1.00 30.94 ? 107 THR F C 1 ATOM 12280 O O . THR H 2 113 ? 64.985 10.476 -2.696 1.00 25.21 ? 107 THR F O 1 ATOM 12281 C CB . THR H 2 113 ? 65.624 8.414 -4.763 1.00 35.70 ? 107 THR F CB 1 ATOM 12282 O OG1 . THR H 2 113 ? 65.702 7.139 -5.410 1.00 44.18 ? 107 THR F OG1 1 ATOM 12283 C CG2 . THR H 2 113 ? 66.842 9.246 -5.162 1.00 33.00 ? 107 THR F CG2 1 ATOM 12284 N N . LEU H 2 114 ? 66.890 9.698 -1.807 1.00 32.77 ? 108 LEU F N 1 ATOM 12285 C CA . LEU H 2 114 ? 67.224 10.987 -1.220 1.00 32.39 ? 108 LEU F CA 1 ATOM 12286 C C . LEU H 2 114 ? 67.729 11.923 -2.309 1.00 32.06 ? 108 LEU F C 1 ATOM 12287 O O . LEU H 2 114 ? 68.716 11.628 -2.984 1.00 32.88 ? 108 LEU F O 1 ATOM 12288 C CB . LEU H 2 114 ? 68.274 10.846 -0.115 1.00 25.12 ? 108 LEU F CB 1 ATOM 12289 C CG . LEU H 2 114 ? 68.691 12.177 0.518 1.00 38.91 ? 108 LEU F CG 1 ATOM 12290 C CD1 . LEU H 2 114 ? 67.548 12.769 1.332 1.00 36.34 ? 108 LEU F CD1 1 ATOM 12291 C CD2 . LEU H 2 114 ? 69.936 12.009 1.373 1.00 44.29 ? 108 LEU F CD2 1 ATOM 12292 N N . VAL H 2 115 ? 67.035 13.039 -2.496 1.00 26.50 ? 109 VAL F N 1 ATOM 12293 C CA . VAL H 2 115 ? 67.482 14.057 -3.437 1.00 22.94 ? 109 VAL F CA 1 ATOM 12294 C C . VAL H 2 115 ? 67.956 15.282 -2.668 1.00 28.19 ? 109 VAL F C 1 ATOM 12295 O O . VAL H 2 115 ? 67.176 15.933 -1.976 1.00 28.32 ? 109 VAL F O 1 ATOM 12296 C CB . VAL H 2 115 ? 66.373 14.463 -4.423 1.00 27.40 ? 109 VAL F CB 1 ATOM 12297 C CG1 . VAL H 2 115 ? 66.789 15.704 -5.203 1.00 29.09 ? 109 VAL F CG1 1 ATOM 12298 C CG2 . VAL H 2 115 ? 66.049 13.308 -5.372 1.00 19.30 ? 109 VAL F CG2 1 ATOM 12299 N N . THR H 2 116 ? 69.246 15.578 -2.772 1.00 26.26 ? 110 THR F N 1 ATOM 12300 C CA . THR H 2 116 ? 69.801 16.747 -2.108 1.00 27.45 ? 110 THR F CA 1 ATOM 12301 C C . THR H 2 116 ? 69.992 17.873 -3.110 1.00 29.06 ? 110 THR F C 1 ATOM 12302 O O . THR H 2 116 ? 70.632 17.690 -4.149 1.00 28.85 ? 110 THR F O 1 ATOM 12303 C CB . THR H 2 116 ? 71.142 16.433 -1.425 1.00 31.28 ? 110 THR F CB 1 ATOM 12304 O OG1 . THR H 2 116 ? 70.932 15.469 -0.383 1.00 30.03 ? 110 THR F OG1 1 ATOM 12305 C CG2 . THR H 2 116 ? 71.738 17.696 -0.824 1.00 31.88 ? 110 THR F CG2 1 ATOM 12306 N N . VAL H 2 117 ? 69.408 19.030 -2.811 1.00 26.39 ? 111 VAL F N 1 ATOM 12307 C CA . VAL H 2 117 ? 69.607 20.206 -3.641 1.00 26.90 ? 111 VAL F CA 1 ATOM 12308 C C . VAL H 2 117 ? 70.608 21.131 -2.961 1.00 31.12 ? 111 VAL F C 1 ATOM 12309 O O . VAL H 2 117 ? 70.306 21.760 -1.950 1.00 34.90 ? 111 VAL F O 1 ATOM 12310 C CB . VAL H 2 117 ? 68.295 20.961 -3.909 1.00 29.99 ? 111 VAL F CB 1 ATOM 12311 C CG1 . VAL H 2 117 ? 68.540 22.110 -4.888 1.00 28.43 ? 111 VAL F CG1 1 ATOM 12312 C CG2 . VAL H 2 117 ? 67.243 20.010 -4.457 1.00 27.59 ? 111 VAL F CG2 1 ATOM 12313 N N . SER H 2 118 ? 71.807 21.195 -3.523 1.00 30.57 ? 112 SER F N 1 ATOM 12314 C CA . SER H 2 118 ? 72.901 21.941 -2.925 1.00 37.33 ? 112 SER F CA 1 ATOM 12315 C C . SER H 2 118 ? 73.946 22.250 -3.978 1.00 37.58 ? 112 SER F C 1 ATOM 12316 O O . SER H 2 118 ? 74.075 21.532 -4.970 1.00 32.84 ? 112 SER F O 1 ATOM 12317 C CB . SER H 2 118 ? 73.528 21.158 -1.769 1.00 41.44 ? 112 SER F CB 1 ATOM 12318 O OG . SER H 2 118 ? 74.734 21.763 -1.329 1.00 45.27 ? 112 SER F OG 1 ATOM 12319 N N . SER H 2 119 ? 74.686 23.328 -3.765 1.00 31.06 ? 113 SER F N 1 ATOM 12320 C CA . SER H 2 119 ? 75.756 23.701 -4.677 1.00 36.65 ? 113 SER F CA 1 ATOM 12321 C C . SER H 2 119 ? 77.053 23.000 -4.320 1.00 35.53 ? 113 SER F C 1 ATOM 12322 O O . SER H 2 119 ? 77.986 22.968 -5.123 1.00 39.03 ? 113 SER F O 1 ATOM 12323 C CB . SER H 2 119 ? 75.975 25.212 -4.664 1.00 31.60 ? 113 SER F CB 1 ATOM 12324 O OG . SER H 2 119 ? 74.921 25.892 -5.321 1.00 34.61 ? 113 SER F OG 1 ATOM 12325 N N . ALA H 2 120 ? 77.110 22.448 -3.112 1.00 34.05 ? 114 ALA F N 1 ATOM 12326 C CA . ALA H 2 120 ? 78.331 21.818 -2.621 1.00 36.05 ? 114 ALA F CA 1 ATOM 12327 C C . ALA H 2 120 ? 78.754 20.676 -3.535 1.00 40.01 ? 114 ALA F C 1 ATOM 12328 O O . ALA H 2 120 ? 77.917 20.029 -4.172 1.00 38.21 ? 114 ALA F O 1 ATOM 12329 C CB . ALA H 2 120 ? 78.140 21.322 -1.199 1.00 38.07 ? 114 ALA F CB 1 ATOM 12330 N N . SER H 2 121 ? 80.059 20.444 -3.604 1.00 37.11 ? 115 SER F N 1 ATOM 12331 C CA . SER H 2 121 ? 80.616 19.465 -4.525 1.00 39.19 ? 115 SER F CA 1 ATOM 12332 C C . SER H 2 121 ? 80.592 18.063 -3.937 1.00 40.07 ? 115 SER F C 1 ATOM 12333 O O . SER H 2 121 ? 80.632 17.890 -2.719 1.00 44.70 ? 115 SER F O 1 ATOM 12334 C CB . SER H 2 121 ? 82.049 19.844 -4.905 1.00 42.31 ? 115 SER F CB 1 ATOM 12335 O OG . SER H 2 121 ? 82.084 21.092 -5.573 1.00 48.78 ? 115 SER F OG 1 ATOM 12336 N N . THR H 2 122 ? 80.517 17.065 -4.810 1.00 37.96 ? 116 THR F N 1 ATOM 12337 C CA . THR H 2 122 ? 80.594 15.673 -4.387 1.00 35.06 ? 116 THR F CA 1 ATOM 12338 C C . THR H 2 122 ? 81.966 15.380 -3.786 1.00 37.31 ? 116 THR F C 1 ATOM 12339 O O . THR H 2 122 ? 82.988 15.730 -4.374 1.00 37.08 ? 116 THR F O 1 ATOM 12340 C CB . THR H 2 122 ? 80.339 14.712 -5.564 1.00 36.22 ? 116 THR F CB 1 ATOM 12341 O OG1 . THR H 2 122 ? 78.987 14.854 -6.015 1.00 45.32 ? 116 THR F OG1 1 ATOM 12342 C CG2 . THR H 2 122 ? 80.572 13.274 -5.142 1.00 31.66 ? 116 THR F CG2 1 ATOM 12343 N N . LYS H 2 123 ? 81.992 14.756 -2.611 1.00 40.81 ? 117 LYS F N 1 ATOM 12344 C CA . LYS H 2 123 ? 83.260 14.350 -2.012 1.00 45.24 ? 117 LYS F CA 1 ATOM 12345 C C . LYS H 2 123 ? 83.184 12.953 -1.397 1.00 39.83 ? 117 LYS F C 1 ATOM 12346 O O . LYS H 2 123 ? 82.282 12.648 -0.615 1.00 39.37 ? 117 LYS F O 1 ATOM 12347 C CB . LYS H 2 123 ? 83.714 15.356 -0.949 1.00 53.33 ? 117 LYS F CB 1 ATOM 12348 C CG . LYS H 2 123 ? 85.072 14.998 -0.350 1.00 65.45 ? 117 LYS F CG 1 ATOM 12349 C CD . LYS H 2 123 ? 85.553 16.014 0.671 1.00 74.87 ? 117 LYS F CD 1 ATOM 12350 C CE . LYS H 2 123 ? 86.931 15.634 1.201 1.00 79.14 ? 117 LYS F CE 1 ATOM 12351 N NZ . LYS H 2 123 ? 86.959 14.239 1.733 1.00 77.73 ? 117 LYS F NZ 1 ATOM 12352 N N . GLY H 2 124 ? 84.144 12.109 -1.757 1.00 35.90 ? 118 GLY F N 1 ATOM 12353 C CA . GLY H 2 124 ? 84.220 10.766 -1.217 1.00 34.62 ? 118 GLY F CA 1 ATOM 12354 C C . GLY H 2 124 ? 84.781 10.770 0.191 1.00 41.01 ? 118 GLY F C 1 ATOM 12355 O O . GLY H 2 124 ? 85.555 11.652 0.551 1.00 39.45 ? 118 GLY F O 1 ATOM 12356 N N . PRO H 2 125 ? 84.393 9.777 1.000 1.00 28.19 ? 119 PRO F N 1 ATOM 12357 C CA . PRO H 2 125 ? 84.823 9.711 2.400 1.00 34.69 ? 119 PRO F CA 1 ATOM 12358 C C . PRO H 2 125 ? 86.214 9.121 2.598 1.00 37.93 ? 119 PRO F C 1 ATOM 12359 O O . PRO H 2 125 ? 86.767 8.487 1.700 1.00 39.09 ? 119 PRO F O 1 ATOM 12360 C CB . PRO H 2 125 ? 83.777 8.795 3.031 1.00 30.02 ? 119 PRO F CB 1 ATOM 12361 C CG . PRO H 2 125 ? 83.407 7.867 1.923 1.00 24.49 ? 119 PRO F CG 1 ATOM 12362 C CD . PRO H 2 125 ? 83.457 8.689 0.659 1.00 25.86 ? 119 PRO F CD 1 ATOM 12363 N N . SER H 2 126 ? 86.766 9.344 3.785 1.00 39.62 ? 120 SER F N 1 ATOM 12364 C CA . SER H 2 126 ? 87.941 8.621 4.243 1.00 37.89 ? 120 SER F CA 1 ATOM 12365 C C . SER H 2 126 ? 87.460 7.597 5.258 1.00 38.25 ? 120 SER F C 1 ATOM 12366 O O . SER H 2 126 ? 86.547 7.879 6.036 1.00 40.18 ? 120 SER F O 1 ATOM 12367 C CB . SER H 2 126 ? 88.968 9.567 4.866 1.00 44.83 ? 120 SER F CB 1 ATOM 12368 O OG . SER H 2 126 ? 89.193 10.698 4.042 1.00 48.59 ? 120 SER F OG 1 ATOM 12369 N N . VAL H 2 127 ? 88.052 6.409 5.253 1.00 29.58 ? 121 VAL F N 1 ATOM 12370 C CA . VAL H 2 127 ? 87.607 5.365 6.166 1.00 30.86 ? 121 VAL F CA 1 ATOM 12371 C C . VAL H 2 127 ? 88.710 4.959 7.131 1.00 34.80 ? 121 VAL F C 1 ATOM 12372 O O . VAL H 2 127 ? 89.754 4.454 6.720 1.00 42.95 ? 121 VAL F O 1 ATOM 12373 C CB . VAL H 2 127 ? 87.122 4.120 5.403 1.00 27.47 ? 121 VAL F CB 1 ATOM 12374 C CG1 . VAL H 2 127 ? 86.519 3.117 6.367 1.00 23.05 ? 121 VAL F CG1 1 ATOM 12375 C CG2 . VAL H 2 127 ? 86.111 4.519 4.341 1.00 30.50 ? 121 VAL F CG2 1 ATOM 12376 N N . PHE H 2 128 ? 88.470 5.173 8.419 1.00 28.25 ? 122 PHE F N 1 ATOM 12377 C CA . PHE H 2 128 ? 89.463 4.852 9.432 1.00 34.86 ? 122 PHE F CA 1 ATOM 12378 C C . PHE H 2 128 ? 88.939 3.776 10.371 1.00 39.15 ? 122 PHE F C 1 ATOM 12379 O O . PHE H 2 128 ? 87.752 3.752 10.702 1.00 41.69 ? 122 PHE F O 1 ATOM 12380 C CB . PHE H 2 128 ? 89.858 6.101 10.229 1.00 36.80 ? 122 PHE F CB 1 ATOM 12381 C CG . PHE H 2 128 ? 90.242 7.276 9.372 1.00 38.74 ? 122 PHE F CG 1 ATOM 12382 C CD1 . PHE H 2 128 ? 91.338 7.210 8.530 1.00 39.69 ? 122 PHE F CD1 1 ATOM 12383 C CD2 . PHE H 2 128 ? 89.509 8.454 9.419 1.00 38.31 ? 122 PHE F CD2 1 ATOM 12384 C CE1 . PHE H 2 128 ? 91.692 8.292 7.743 1.00 37.35 ? 122 PHE F CE1 1 ATOM 12385 C CE2 . PHE H 2 128 ? 89.858 9.536 8.634 1.00 32.99 ? 122 PHE F CE2 1 ATOM 12386 C CZ . PHE H 2 128 ? 90.949 9.456 7.799 1.00 30.38 ? 122 PHE F CZ 1 ATOM 12387 N N . PRO H 2 129 ? 89.826 2.874 10.806 1.00 49.20 ? 123 PRO F N 1 ATOM 12388 C CA . PRO H 2 129 ? 89.404 1.818 11.726 1.00 42.27 ? 123 PRO F CA 1 ATOM 12389 C C . PRO H 2 129 ? 89.147 2.338 13.133 1.00 45.26 ? 123 PRO F C 1 ATOM 12390 O O . PRO H 2 129 ? 89.805 3.276 13.581 1.00 44.88 ? 123 PRO F O 1 ATOM 12391 C CB . PRO H 2 129 ? 90.589 0.850 11.711 1.00 46.06 ? 123 PRO F CB 1 ATOM 12392 C CG . PRO H 2 129 ? 91.765 1.709 11.373 1.00 47.40 ? 123 PRO F CG 1 ATOM 12393 C CD . PRO H 2 129 ? 91.242 2.749 10.421 1.00 45.94 ? 123 PRO F CD 1 ATOM 12394 N N . LEU H 2 130 ? 88.167 1.742 13.802 1.00 44.69 ? 124 LEU F N 1 ATOM 12395 C CA . LEU H 2 130 ? 87.976 1.917 15.232 1.00 41.13 ? 124 LEU F CA 1 ATOM 12396 C C . LEU H 2 130 ? 88.463 0.638 15.899 1.00 49.60 ? 124 LEU F C 1 ATOM 12397 O O . LEU H 2 130 ? 87.686 -0.292 16.126 1.00 52.75 ? 124 LEU F O 1 ATOM 12398 C CB . LEU H 2 130 ? 86.510 2.196 15.572 1.00 41.52 ? 124 LEU F CB 1 ATOM 12399 C CG . LEU H 2 130 ? 85.904 3.501 15.048 1.00 40.83 ? 124 LEU F CG 1 ATOM 12400 C CD1 . LEU H 2 130 ? 84.412 3.586 15.372 1.00 32.46 ? 124 LEU F CD1 1 ATOM 12401 C CD2 . LEU H 2 130 ? 86.643 4.701 15.618 1.00 39.84 ? 124 LEU F CD2 1 ATOM 12402 N N . ALA H 2 131 ? 89.761 0.597 16.189 1.00 54.97 ? 125 ALA F N 1 ATOM 12403 C CA . ALA H 2 131 ? 90.440 -0.626 16.608 1.00 51.15 ? 125 ALA F CA 1 ATOM 12404 C C . ALA H 2 131 ? 89.975 -1.149 17.961 1.00 54.28 ? 125 ALA F C 1 ATOM 12405 O O . ALA H 2 131 ? 89.820 -0.381 18.910 1.00 53.79 ? 125 ALA F O 1 ATOM 12406 C CB . ALA H 2 131 ? 91.943 -0.397 16.634 1.00 57.02 ? 125 ALA F CB 1 ATOM 12407 N N . PRO H 2 132 ? 89.765 -2.471 18.052 1.00 61.23 ? 126 PRO F N 1 ATOM 12408 C CA . PRO H 2 132 ? 89.417 -3.130 19.312 1.00 73.30 ? 126 PRO F CA 1 ATOM 12409 C C . PRO H 2 132 ? 90.629 -3.189 20.231 1.00 90.64 ? 126 PRO F C 1 ATOM 12410 O O . PRO H 2 132 ? 91.759 -3.200 19.744 1.00 92.34 ? 126 PRO F O 1 ATOM 12411 C CB . PRO H 2 132 ? 88.989 -4.529 18.869 1.00 65.73 ? 126 PRO F CB 1 ATOM 12412 C CG . PRO H 2 132 ? 89.791 -4.776 17.644 1.00 60.35 ? 126 PRO F CG 1 ATOM 12413 C CD . PRO H 2 132 ? 89.912 -3.439 16.951 1.00 60.13 ? 126 PRO F CD 1 ATOM 12414 N N . SER H 2 133 ? 90.399 -3.226 21.537 1.00 105.47 ? 127 SER F N 1 ATOM 12415 C CA . SER H 2 133 ? 91.499 -3.220 22.490 1.00 122.26 ? 127 SER F CA 1 ATOM 12416 C C . SER H 2 133 ? 91.064 -3.755 23.847 1.00 136.89 ? 127 SER F C 1 ATOM 12417 O O . SER H 2 133 ? 89.871 -3.859 24.130 1.00 137.50 ? 127 SER F O 1 ATOM 12418 C CB . SER H 2 133 ? 92.068 -1.808 22.629 1.00 123.20 ? 127 SER F CB 1 ATOM 12419 O OG . SER H 2 133 ? 91.033 -0.849 22.766 1.00 121.81 ? 127 SER F OG 1 ATOM 12420 N N . SER H 2 134 ? 92.043 -4.090 24.683 1.00 149.72 ? 128 SER F N 1 ATOM 12421 C CA . SER H 2 134 ? 91.775 -4.711 25.976 1.00 160.13 ? 128 SER F CA 1 ATOM 12422 C C . SER H 2 134 ? 90.988 -3.790 26.905 1.00 169.69 ? 128 SER F C 1 ATOM 12423 O O . SER H 2 134 ? 90.298 -4.260 27.810 1.00 172.30 ? 128 SER F O 1 ATOM 12424 C CB . SER H 2 134 ? 93.083 -5.140 26.639 1.00 159.89 ? 128 SER F CB 1 ATOM 12425 O OG . SER H 2 134 ? 93.705 -6.179 25.901 1.00 158.65 ? 128 SER F OG 1 ATOM 12426 N N . LYS H 2 135 ? 91.090 -2.482 26.683 1.00 178.35 ? 129 LYS F N 1 ATOM 12427 C CA . LYS H 2 135 ? 90.238 -1.530 27.389 1.00 183.53 ? 129 LYS F CA 1 ATOM 12428 C C . LYS H 2 135 ? 88.982 -1.278 26.546 1.00 174.13 ? 129 LYS F C 1 ATOM 12429 O O . LYS H 2 135 ? 88.551 -0.141 26.341 1.00 178.35 ? 129 LYS F O 1 ATOM 12430 C CB . LYS H 2 135 ? 90.991 -0.226 27.710 1.00 190.32 ? 129 LYS F CB 1 ATOM 12431 C CG . LYS H 2 135 ? 91.461 0.610 26.517 1.00 191.89 ? 129 LYS F CG 1 ATOM 12432 C CD . LYS H 2 135 ? 92.746 0.088 25.894 1.00 194.82 ? 129 LYS F CD 1 ATOM 12433 C CE . LYS H 2 135 ? 93.077 0.838 24.614 1.00 194.46 ? 129 LYS F CE 1 ATOM 12434 N NZ . LYS H 2 135 ? 93.373 2.269 24.844 1.00 195.45 ? 129 LYS F NZ 1 ATOM 12435 N N . SER H 2 136 ? 88.412 -2.379 26.061 1.00 165.80 ? 130 SER F N 1 ATOM 12436 C CA . SER H 2 136 ? 87.154 -2.392 25.320 1.00 155.06 ? 130 SER F CA 1 ATOM 12437 C C . SER H 2 136 ? 86.632 -3.824 25.256 1.00 150.72 ? 130 SER F C 1 ATOM 12438 O O . SER H 2 136 ? 85.853 -4.176 24.371 1.00 146.08 ? 130 SER F O 1 ATOM 12439 C CB . SER H 2 136 ? 87.328 -1.821 23.912 1.00 145.93 ? 130 SER F CB 1 ATOM 12440 O OG . SER H 2 136 ? 87.455 -0.411 23.948 1.00 141.89 ? 130 SER F OG 1 ATOM 12441 N N . THR H 2 137 ? 87.083 -4.651 26.194 1.00 153.52 ? 131 THR F N 1 ATOM 12442 C CA . THR H 2 137 ? 86.603 -6.022 26.310 1.00 155.82 ? 131 THR F CA 1 ATOM 12443 C C . THR H 2 137 ? 85.566 -6.080 27.423 1.00 157.48 ? 131 THR F C 1 ATOM 12444 O O . THR H 2 137 ? 85.895 -6.337 28.582 1.00 159.49 ? 131 THR F O 1 ATOM 12445 C CB . THR H 2 137 ? 87.753 -7.011 26.597 1.00 158.64 ? 131 THR F CB 1 ATOM 12446 O OG1 . THR H 2 137 ? 88.760 -6.883 25.585 1.00 158.88 ? 131 THR F OG1 1 ATOM 12447 C CG2 . THR H 2 137 ? 87.241 -8.446 26.618 1.00 158.94 ? 131 THR F CG2 1 ATOM 12448 N N . SER H 2 138 ? 84.314 -5.813 27.066 1.00 158.87 ? 132 SER F N 1 ATOM 12449 C CA . SER H 2 138 ? 83.227 -5.770 28.038 1.00 160.47 ? 132 SER F CA 1 ATOM 12450 C C . SER H 2 138 ? 82.672 -7.162 28.315 1.00 159.57 ? 132 SER F C 1 ATOM 12451 O O . SER H 2 138 ? 81.708 -7.595 27.682 1.00 159.55 ? 132 SER F O 1 ATOM 12452 C CB . SER H 2 138 ? 82.108 -4.845 27.551 1.00 160.28 ? 132 SER F CB 1 ATOM 12453 O OG . SER H 2 138 ? 81.049 -4.783 28.490 1.00 160.47 ? 132 SER F OG 1 ATOM 12454 N N . GLY H 2 139 ? 83.290 -7.856 29.265 1.00 157.23 ? 133 GLY F N 1 ATOM 12455 C CA . GLY H 2 139 ? 82.850 -9.182 29.658 1.00 151.59 ? 133 GLY F CA 1 ATOM 12456 C C . GLY H 2 139 ? 83.007 -10.218 28.562 1.00 143.41 ? 133 GLY F C 1 ATOM 12457 O O . GLY H 2 139 ? 82.100 -11.014 28.318 1.00 146.02 ? 133 GLY F O 1 ATOM 12458 N N . GLY H 2 140 ? 84.159 -10.208 27.898 1.00 132.92 ? 134 GLY F N 1 ATOM 12459 C CA . GLY H 2 140 ? 84.436 -11.160 26.838 1.00 123.18 ? 134 GLY F CA 1 ATOM 12460 C C . GLY H 2 140 ? 83.888 -10.738 25.486 1.00 112.71 ? 134 GLY F C 1 ATOM 12461 O O . GLY H 2 140 ? 83.955 -11.494 24.517 1.00 108.70 ? 134 GLY F O 1 ATOM 12462 N N . THR H 2 141 ? 83.340 -9.528 25.421 1.00 106.02 ? 135 THR F N 1 ATOM 12463 C CA . THR H 2 141 ? 82.804 -8.991 24.174 1.00 91.59 ? 135 THR F CA 1 ATOM 12464 C C . THR H 2 141 ? 83.607 -7.781 23.715 1.00 81.46 ? 135 THR F C 1 ATOM 12465 O O . THR H 2 141 ? 83.740 -6.798 24.443 1.00 81.70 ? 135 THR F O 1 ATOM 12466 C CB . THR H 2 141 ? 81.323 -8.588 24.315 1.00 85.38 ? 135 THR F CB 1 ATOM 12467 O OG1 . THR H 2 141 ? 80.513 -9.765 24.419 1.00 81.18 ? 135 THR F OG1 1 ATOM 12468 C CG2 . THR H 2 141 ? 80.873 -7.780 23.108 1.00 82.00 ? 135 THR F CG2 1 ATOM 12469 N N . ALA H 2 142 ? 84.144 -7.859 22.503 1.00 72.26 ? 136 ALA F N 1 ATOM 12470 C CA . ALA H 2 142 ? 84.953 -6.777 21.963 1.00 66.60 ? 136 ALA F CA 1 ATOM 12471 C C . ALA H 2 142 ? 84.157 -5.945 20.969 1.00 63.56 ? 136 ALA F C 1 ATOM 12472 O O . ALA H 2 142 ? 83.443 -6.488 20.126 1.00 64.65 ? 136 ALA F O 1 ATOM 12473 C CB . ALA H 2 142 ? 86.207 -7.331 21.304 1.00 63.78 ? 136 ALA F CB 1 ATOM 12474 N N . ALA H 2 143 ? 84.280 -4.627 21.072 1.00 55.87 ? 137 ALA F N 1 ATOM 12475 C CA . ALA H 2 143 ? 83.655 -3.738 20.105 1.00 50.75 ? 137 ALA F CA 1 ATOM 12476 C C . ALA H 2 143 ? 84.704 -3.194 19.148 1.00 52.39 ? 137 ALA F C 1 ATOM 12477 O O . ALA H 2 143 ? 85.795 -2.801 19.562 1.00 51.35 ? 137 ALA F O 1 ATOM 12478 C CB . ALA H 2 143 ? 82.929 -2.597 20.805 1.00 41.77 ? 137 ALA F CB 1 ATOM 12479 N N . LEU H 2 144 ? 84.371 -3.190 17.862 1.00 47.95 ? 138 LEU F N 1 ATOM 12480 C CA . LEU H 2 144 ? 85.226 -2.583 16.854 1.00 49.03 ? 138 LEU F CA 1 ATOM 12481 C C . LEU H 2 144 ? 84.360 -1.914 15.794 1.00 51.09 ? 138 LEU F C 1 ATOM 12482 O O . LEU H 2 144 ? 83.151 -2.153 15.726 1.00 48.03 ? 138 LEU F O 1 ATOM 12483 C CB . LEU H 2 144 ? 86.149 -3.625 16.225 1.00 49.91 ? 138 LEU F CB 1 ATOM 12484 C CG . LEU H 2 144 ? 85.468 -4.793 15.513 1.00 57.37 ? 138 LEU F CG 1 ATOM 12485 C CD1 . LEU H 2 144 ? 85.437 -4.572 14.006 1.00 61.35 ? 138 LEU F CD1 1 ATOM 12486 C CD2 . LEU H 2 144 ? 86.159 -6.099 15.854 1.00 58.11 ? 138 LEU F CD2 1 ATOM 12487 N N . GLY H 2 145 ? 84.973 -1.074 14.969 1.00 47.96 ? 139 GLY F N 1 ATOM 12488 C CA . GLY H 2 145 ? 84.213 -0.375 13.957 1.00 42.96 ? 139 GLY F CA 1 ATOM 12489 C C . GLY H 2 145 ? 84.991 0.411 12.924 1.00 36.96 ? 139 GLY F C 1 ATOM 12490 O O . GLY H 2 145 ? 86.213 0.306 12.818 1.00 37.80 ? 139 GLY F O 1 ATOM 12491 N N . CYS H 2 146 ? 84.249 1.200 12.156 1.00 37.79 ? 140 CYS F N 1 ATOM 12492 C CA . CYS H 2 146 ? 84.797 2.030 11.094 1.00 39.65 ? 140 CYS F CA 1 ATOM 12493 C C . CYS H 2 146 ? 84.267 3.450 11.202 1.00 40.47 ? 140 CYS F C 1 ATOM 12494 O O . CYS H 2 146 ? 83.072 3.665 11.422 1.00 38.01 ? 140 CYS F O 1 ATOM 12495 C CB . CYS H 2 146 ? 84.448 1.460 9.717 1.00 39.56 ? 140 CYS F CB 1 ATOM 12496 S SG . CYS H 2 146 ? 85.424 0.024 9.223 1.00 99.08 ? 140 CYS F SG 1 ATOM 12497 N N . LEU H 2 147 ? 85.165 4.415 11.044 1.00 39.13 ? 141 LEU F N 1 ATOM 12498 C CA . LEU H 2 147 ? 84.787 5.818 11.013 1.00 30.62 ? 141 LEU F CA 1 ATOM 12499 C C . LEU H 2 147 ? 84.805 6.303 9.570 1.00 37.56 ? 141 LEU F C 1 ATOM 12500 O O . LEU H 2 147 ? 85.854 6.318 8.924 1.00 38.29 ? 141 LEU F O 1 ATOM 12501 C CB . LEU H 2 147 ? 85.730 6.652 11.888 1.00 26.30 ? 141 LEU F CB 1 ATOM 12502 C CG . LEU H 2 147 ? 85.540 8.172 11.919 1.00 31.79 ? 141 LEU F CG 1 ATOM 12503 C CD1 . LEU H 2 147 ? 84.175 8.548 12.477 1.00 27.62 ? 141 LEU F CD1 1 ATOM 12504 C CD2 . LEU H 2 147 ? 86.650 8.831 12.730 1.00 36.73 ? 141 LEU F CD2 1 ATOM 12505 N N . VAL H 2 148 ? 83.632 6.678 9.067 1.00 35.49 ? 142 VAL F N 1 ATOM 12506 C CA . VAL H 2 148 ? 83.489 7.178 7.705 1.00 33.60 ? 142 VAL F CA 1 ATOM 12507 C C . VAL H 2 148 ? 83.332 8.691 7.741 1.00 33.89 ? 142 VAL F C 1 ATOM 12508 O O . VAL H 2 148 ? 82.257 9.198 8.053 1.00 30.44 ? 142 VAL F O 1 ATOM 12509 C CB . VAL H 2 148 ? 82.277 6.538 6.998 1.00 34.32 ? 142 VAL F CB 1 ATOM 12510 C CG1 . VAL H 2 148 ? 82.136 7.050 5.576 1.00 30.26 ? 142 VAL F CG1 1 ATOM 12511 C CG2 . VAL H 2 148 ? 82.384 5.022 7.021 1.00 35.82 ? 142 VAL F CG2 1 ATOM 12512 N N . LYS H 2 149 ? 84.408 9.408 7.428 1.00 39.16 ? 143 LYS F N 1 ATOM 12513 C CA . LYS H 2 149 ? 84.453 10.855 7.629 1.00 44.97 ? 143 LYS F CA 1 ATOM 12514 C C . LYS H 2 149 ? 84.534 11.680 6.349 1.00 45.78 ? 143 LYS F C 1 ATOM 12515 O O . LYS H 2 149 ? 85.145 11.265 5.359 1.00 44.82 ? 143 LYS F O 1 ATOM 12516 C CB . LYS H 2 149 ? 85.646 11.223 8.514 1.00 54.32 ? 143 LYS F CB 1 ATOM 12517 C CG . LYS H 2 149 ? 85.305 11.436 9.974 1.00 63.87 ? 143 LYS F CG 1 ATOM 12518 C CD . LYS H 2 149 ? 86.391 12.241 10.676 1.00 65.53 ? 143 LYS F CD 1 ATOM 12519 C CE . LYS H 2 149 ? 86.612 13.579 9.987 1.00 66.55 ? 143 LYS F CE 1 ATOM 12520 N NZ . LYS H 2 149 ? 87.389 14.529 10.826 1.00 67.15 ? 143 LYS F NZ 1 ATOM 12521 N N . ASP H 2 150 ? 83.910 12.856 6.397 1.00 41.34 ? 144 ASP F N 1 ATOM 12522 C CA . ASP H 2 150 ? 84.065 13.891 5.376 1.00 39.91 ? 144 ASP F CA 1 ATOM 12523 C C . ASP H 2 150 ? 83.586 13.462 3.995 1.00 38.77 ? 144 ASP F C 1 ATOM 12524 O O . ASP H 2 150 ? 84.386 13.326 3.072 1.00 43.95 ? 144 ASP F O 1 ATOM 12525 C CB . ASP H 2 150 ? 85.530 14.334 5.298 1.00 43.95 ? 144 ASP F CB 1 ATOM 12526 C CG . ASP H 2 150 ? 86.009 15.002 6.579 1.00 55.49 ? 144 ASP F CG 1 ATOM 12527 O OD1 . ASP H 2 150 ? 85.220 15.082 7.545 1.00 54.29 ? 144 ASP F OD1 1 ATOM 12528 O OD2 . ASP H 2 150 ? 87.179 15.443 6.621 1.00 64.08 ? 144 ASP F OD2 1 ATOM 12529 N N . TYR H 2 151 ? 82.280 13.258 3.853 1.00 28.56 ? 145 TYR F N 1 ATOM 12530 C CA . TYR H 2 151 ? 81.709 12.969 2.547 1.00 32.98 ? 145 TYR F CA 1 ATOM 12531 C C . TYR H 2 151 ? 80.483 13.828 2.284 1.00 35.67 ? 145 TYR F C 1 ATOM 12532 O O . TYR H 2 151 ? 79.871 14.367 3.210 1.00 33.73 ? 145 TYR F O 1 ATOM 12533 C CB . TYR H 2 151 ? 81.346 11.486 2.419 1.00 34.71 ? 145 TYR F CB 1 ATOM 12534 C CG . TYR H 2 151 ? 80.289 11.010 3.394 1.00 30.99 ? 145 TYR F CG 1 ATOM 12535 C CD1 . TYR H 2 151 ? 80.646 10.496 4.634 1.00 28.89 ? 145 TYR F CD1 1 ATOM 12536 C CD2 . TYR H 2 151 ? 78.937 11.071 3.074 1.00 30.41 ? 145 TYR F CD2 1 ATOM 12537 C CE1 . TYR H 2 151 ? 79.688 10.057 5.529 1.00 31.72 ? 145 TYR F CE1 1 ATOM 12538 C CE2 . TYR H 2 151 ? 77.969 10.635 3.964 1.00 30.50 ? 145 TYR F CE2 1 ATOM 12539 C CZ . TYR H 2 151 ? 78.353 10.127 5.189 1.00 33.48 ? 145 TYR F CZ 1 ATOM 12540 O OH . TYR H 2 151 ? 77.403 9.693 6.081 1.00 31.96 ? 145 TYR F OH 1 ATOM 12541 N N . PHE H 2 152 ? 80.134 13.941 1.008 1.00 31.87 ? 146 PHE F N 1 ATOM 12542 C CA . PHE H 2 152 ? 78.962 14.680 0.581 1.00 27.15 ? 146 PHE F CA 1 ATOM 12543 C C . PHE H 2 152 ? 78.588 14.239 -0.827 1.00 35.48 ? 146 PHE F C 1 ATOM 12544 O O . PHE H 2 152 ? 79.461 14.117 -1.684 1.00 40.92 ? 146 PHE F O 1 ATOM 12545 C CB . PHE H 2 152 ? 79.226 16.188 0.623 1.00 29.06 ? 146 PHE F CB 1 ATOM 12546 C CG . PHE H 2 152 ? 77.998 17.018 0.417 1.00 33.01 ? 146 PHE F CG 1 ATOM 12547 C CD1 . PHE H 2 152 ? 77.234 17.422 1.501 1.00 36.04 ? 146 PHE F CD1 1 ATOM 12548 C CD2 . PHE H 2 152 ? 77.596 17.379 -0.860 1.00 31.20 ? 146 PHE F CD2 1 ATOM 12549 C CE1 . PHE H 2 152 ? 76.094 18.180 1.319 1.00 33.71 ? 146 PHE F CE1 1 ATOM 12550 C CE2 . PHE H 2 152 ? 76.455 18.139 -1.051 1.00 28.03 ? 146 PHE F CE2 1 ATOM 12551 C CZ . PHE H 2 152 ? 75.704 18.541 0.041 1.00 35.03 ? 146 PHE F CZ 1 ATOM 12552 N N . PRO H 2 153 ? 77.290 13.995 -1.075 1.00 36.89 ? 147 PRO F N 1 ATOM 12553 C CA . PRO H 2 153 ? 76.188 14.084 -0.114 1.00 33.17 ? 147 PRO F CA 1 ATOM 12554 C C . PRO H 2 153 ? 75.890 12.752 0.560 1.00 36.25 ? 147 PRO F C 1 ATOM 12555 O O . PRO H 2 153 ? 76.639 11.787 0.396 1.00 32.27 ? 147 PRO F O 1 ATOM 12556 C CB . PRO H 2 153 ? 75.015 14.488 -0.992 1.00 30.03 ? 147 PRO F CB 1 ATOM 12557 C CG . PRO H 2 153 ? 75.274 13.707 -2.254 1.00 35.61 ? 147 PRO F CG 1 ATOM 12558 C CD . PRO H 2 153 ? 76.787 13.708 -2.432 1.00 33.63 ? 147 PRO F CD 1 ATOM 12559 N N . GLU H 2 154 ? 74.794 12.708 1.309 1.00 33.77 ? 148 GLU F N 1 ATOM 12560 C CA . GLU H 2 154 ? 74.260 11.449 1.805 1.00 33.15 ? 148 GLU F CA 1 ATOM 12561 C C . GLU H 2 154 ? 73.632 10.687 0.636 1.00 34.15 ? 148 GLU F C 1 ATOM 12562 O O . GLU H 2 154 ? 73.299 11.292 -0.381 1.00 27.43 ? 148 GLU F O 1 ATOM 12563 C CB . GLU H 2 154 ? 73.235 11.701 2.913 1.00 36.77 ? 148 GLU F CB 1 ATOM 12564 C CG . GLU H 2 154 ? 73.813 12.375 4.149 1.00 49.10 ? 148 GLU F CG 1 ATOM 12565 C CD . GLU H 2 154 ? 72.918 12.222 5.366 1.00 53.78 ? 148 GLU F CD 1 ATOM 12566 O OE1 . GLU H 2 154 ? 72.929 11.131 5.979 1.00 50.91 ? 148 GLU F OE1 1 ATOM 12567 O OE2 . GLU H 2 154 ? 72.200 13.189 5.704 1.00 53.32 ? 148 GLU F OE2 1 ATOM 12568 N N . PRO H 2 155 ? 73.486 9.354 0.760 1.00 31.30 ? 149 PRO F N 1 ATOM 12569 C CA . PRO H 2 155 ? 73.927 8.494 1.860 1.00 31.13 ? 149 PRO F CA 1 ATOM 12570 C C . PRO H 2 155 ? 75.221 7.748 1.555 1.00 32.99 ? 149 PRO F C 1 ATOM 12571 O O . PRO H 2 155 ? 75.738 7.824 0.441 1.00 30.11 ? 149 PRO F O 1 ATOM 12572 C CB . PRO H 2 155 ? 72.778 7.503 1.980 1.00 27.46 ? 149 PRO F CB 1 ATOM 12573 C CG . PRO H 2 155 ? 72.405 7.271 0.535 1.00 28.19 ? 149 PRO F CG 1 ATOM 12574 C CD . PRO H 2 155 ? 72.620 8.611 -0.173 1.00 30.74 ? 149 PRO F CD 1 ATOM 12575 N N . VAL H 2 156 ? 75.730 7.034 2.553 1.00 30.94 ? 150 VAL F N 1 ATOM 12576 C CA . VAL H 2 156 ? 76.731 6.002 2.333 1.00 33.64 ? 150 VAL F CA 1 ATOM 12577 C C . VAL H 2 156 ? 76.148 4.666 2.764 1.00 29.58 ? 150 VAL F C 1 ATOM 12578 O O . VAL H 2 156 ? 75.198 4.621 3.546 1.00 29.19 ? 150 VAL F O 1 ATOM 12579 C CB . VAL H 2 156 ? 78.033 6.250 3.119 1.00 34.09 ? 150 VAL F CB 1 ATOM 12580 C CG1 . VAL H 2 156 ? 78.720 7.510 2.634 1.00 40.67 ? 150 VAL F CG1 1 ATOM 12581 C CG2 . VAL H 2 156 ? 77.751 6.321 4.610 1.00 33.19 ? 150 VAL F CG2 1 ATOM 12582 N N . THR H 2 157 ? 76.725 3.581 2.265 1.00 23.43 ? 151 THR F N 1 ATOM 12583 C CA . THR H 2 157 ? 76.311 2.249 2.684 1.00 26.86 ? 151 THR F CA 1 ATOM 12584 C C . THR H 2 157 ? 77.475 1.511 3.333 1.00 29.55 ? 151 THR F C 1 ATOM 12585 O O . THR H 2 157 ? 78.551 1.393 2.750 1.00 32.56 ? 151 THR F O 1 ATOM 12586 C CB . THR H 2 157 ? 75.777 1.425 1.505 1.00 33.25 ? 151 THR F CB 1 ATOM 12587 O OG1 . THR H 2 157 ? 74.601 2.051 0.980 1.00 40.51 ? 151 THR F OG1 1 ATOM 12588 C CG2 . THR H 2 157 ? 75.425 0.017 1.957 1.00 39.73 ? 151 THR F CG2 1 ATOM 12589 N N . VAL H 2 158 ? 77.257 1.018 4.546 1.00 30.87 ? 152 VAL F N 1 ATOM 12590 C CA . VAL H 2 158 ? 78.295 0.299 5.266 1.00 28.16 ? 152 VAL F CA 1 ATOM 12591 C C . VAL H 2 158 ? 77.942 -1.174 5.426 1.00 31.26 ? 152 VAL F C 1 ATOM 12592 O O . VAL H 2 158 ? 76.883 -1.516 5.947 1.00 33.91 ? 152 VAL F O 1 ATOM 12593 C CB . VAL H 2 158 ? 78.546 0.910 6.656 1.00 33.21 ? 152 VAL F CB 1 ATOM 12594 C CG1 . VAL H 2 158 ? 79.611 0.116 7.396 1.00 32.12 ? 152 VAL F CG1 1 ATOM 12595 C CG2 . VAL H 2 158 ? 78.960 2.367 6.523 1.00 35.25 ? 152 VAL F CG2 1 ATOM 12596 N N . SER H 2 159 ? 78.839 -2.038 4.959 1.00 32.80 ? 153 SER F N 1 ATOM 12597 C CA . SER H 2 159 ? 78.701 -3.476 5.143 1.00 30.06 ? 153 SER F CA 1 ATOM 12598 C C . SER H 2 159 ? 79.879 -3.998 5.949 1.00 26.69 ? 153 SER F C 1 ATOM 12599 O O . SER H 2 159 ? 80.900 -3.331 6.068 1.00 28.91 ? 153 SER F O 1 ATOM 12600 C CB . SER H 2 159 ? 78.629 -4.203 3.796 1.00 31.33 ? 153 SER F CB 1 ATOM 12601 O OG . SER H 2 159 ? 77.572 -3.710 2.993 1.00 36.41 ? 153 SER F OG 1 ATOM 12602 N N . TRP H 2 160 ? 79.734 -5.195 6.500 1.00 28.96 ? 154 TRP F N 1 ATOM 12603 C CA . TRP H 2 160 ? 80.837 -5.855 7.182 1.00 31.63 ? 154 TRP F CA 1 ATOM 12604 C C . TRP H 2 160 ? 81.084 -7.231 6.584 1.00 30.15 ? 154 TRP F C 1 ATOM 12605 O O . TRP H 2 160 ? 80.141 -7.993 6.351 1.00 26.12 ? 154 TRP F O 1 ATOM 12606 C CB . TRP H 2 160 ? 80.561 -5.961 8.679 1.00 31.06 ? 154 TRP F CB 1 ATOM 12607 C CG . TRP H 2 160 ? 80.720 -4.658 9.381 1.00 33.09 ? 154 TRP F CG 1 ATOM 12608 C CD1 . TRP H 2 160 ? 79.759 -3.716 9.587 1.00 35.70 ? 154 TRP F CD1 1 ATOM 12609 C CD2 . TRP H 2 160 ? 81.921 -4.140 9.960 1.00 34.91 ? 154 TRP F CD2 1 ATOM 12610 N NE1 . TRP H 2 160 ? 80.284 -2.644 10.268 1.00 34.00 ? 154 TRP F NE1 1 ATOM 12611 C CE2 . TRP H 2 160 ? 81.614 -2.881 10.509 1.00 33.04 ? 154 TRP F CE2 1 ATOM 12612 C CE3 . TRP H 2 160 ? 83.230 -4.622 10.074 1.00 37.53 ? 154 TRP F CE3 1 ATOM 12613 C CZ2 . TRP H 2 160 ? 82.561 -2.095 11.159 1.00 35.36 ? 154 TRP F CZ2 1 ATOM 12614 C CZ3 . TRP H 2 160 ? 84.169 -3.844 10.720 1.00 37.63 ? 154 TRP F CZ3 1 ATOM 12615 C CH2 . TRP H 2 160 ? 83.830 -2.593 11.255 1.00 41.74 ? 154 TRP F CH2 1 ATOM 12616 N N . ASN H 2 161 ? 82.356 -7.532 6.333 1.00 27.38 ? 155 ASN F N 1 ATOM 12617 C CA . ASN H 2 161 ? 82.756 -8.787 5.709 1.00 33.00 ? 155 ASN F CA 1 ATOM 12618 C C . ASN H 2 161 ? 81.942 -9.094 4.451 1.00 30.81 ? 155 ASN F C 1 ATOM 12619 O O . ASN H 2 161 ? 81.485 -10.220 4.251 1.00 30.83 ? 155 ASN F O 1 ATOM 12620 C CB . ASN H 2 161 ? 82.642 -9.935 6.713 1.00 37.73 ? 155 ASN F CB 1 ATOM 12621 C CG . ASN H 2 161 ? 83.648 -9.818 7.842 1.00 43.13 ? 155 ASN F CG 1 ATOM 12622 O OD1 . ASN H 2 161 ? 84.576 -9.018 7.773 1.00 46.97 ? 155 ASN F OD1 1 ATOM 12623 N ND2 . ASN H 2 161 ? 83.473 -10.624 8.884 1.00 42.69 ? 155 ASN F ND2 1 ATOM 12624 N N . SER H 2 162 ? 81.768 -8.071 3.621 1.00 23.48 ? 156 SER F N 1 ATOM 12625 C CA . SER H 2 162 ? 81.045 -8.171 2.356 1.00 29.62 ? 156 SER F CA 1 ATOM 12626 C C . SER H 2 162 ? 79.618 -8.671 2.538 1.00 34.85 ? 156 SER F C 1 ATOM 12627 O O . SER H 2 162 ? 79.087 -9.384 1.682 1.00 39.94 ? 156 SER F O 1 ATOM 12628 C CB . SER H 2 162 ? 81.799 -9.076 1.380 1.00 36.42 ? 156 SER F CB 1 ATOM 12629 O OG . SER H 2 162 ? 83.041 -8.501 1.013 1.00 40.81 ? 156 SER F OG 1 ATOM 12630 N N . GLY H 2 163 ? 79.002 -8.296 3.656 1.00 27.86 ? 157 GLY F N 1 ATOM 12631 C CA . GLY H 2 163 ? 77.621 -8.658 3.916 1.00 27.08 ? 157 GLY F CA 1 ATOM 12632 C C . GLY H 2 163 ? 77.438 -9.888 4.789 1.00 34.22 ? 157 GLY F C 1 ATOM 12633 O O . GLY H 2 163 ? 76.336 -10.151 5.264 1.00 40.39 ? 157 GLY F O 1 ATOM 12634 N N . ALA H 2 164 ? 78.510 -10.641 5.011 1.00 32.79 ? 158 ALA F N 1 ATOM 12635 C CA . ALA H 2 164 ? 78.411 -11.883 5.776 1.00 37.74 ? 158 ALA F CA 1 ATOM 12636 C C . ALA H 2 164 ? 78.198 -11.637 7.271 1.00 42.19 ? 158 ALA F C 1 ATOM 12637 O O . ALA H 2 164 ? 77.708 -12.514 7.981 1.00 40.73 ? 158 ALA F O 1 ATOM 12638 C CB . ALA H 2 164 ? 79.646 -12.734 5.562 1.00 28.35 ? 158 ALA F CB 1 ATOM 12639 N N . LEU H 2 165 ? 78.569 -10.451 7.746 1.00 37.61 ? 159 LEU F N 1 ATOM 12640 C CA . LEU H 2 165 ? 78.384 -10.106 9.155 1.00 35.74 ? 159 LEU F CA 1 ATOM 12641 C C . LEU H 2 165 ? 77.331 -9.003 9.326 1.00 39.59 ? 159 LEU F C 1 ATOM 12642 O O . LEU H 2 165 ? 77.542 -7.857 8.914 1.00 33.79 ? 159 LEU F O 1 ATOM 12643 C CB . LEU H 2 165 ? 79.712 -9.675 9.778 1.00 35.35 ? 159 LEU F CB 1 ATOM 12644 C CG . LEU H 2 165 ? 79.668 -9.162 11.218 1.00 39.24 ? 159 LEU F CG 1 ATOM 12645 C CD1 . LEU H 2 165 ? 79.065 -10.202 12.149 1.00 43.04 ? 159 LEU F CD1 1 ATOM 12646 C CD2 . LEU H 2 165 ? 81.064 -8.776 11.682 1.00 38.07 ? 159 LEU F CD2 1 ATOM 12647 N N . THR H 2 166 ? 76.205 -9.359 9.941 1.00 37.01 ? 160 THR F N 1 ATOM 12648 C CA . THR H 2 166 ? 75.084 -8.437 10.100 1.00 39.56 ? 160 THR F CA 1 ATOM 12649 C C . THR H 2 166 ? 74.661 -8.225 11.555 1.00 45.52 ? 160 THR F C 1 ATOM 12650 O O . THR H 2 166 ? 74.290 -7.114 11.941 1.00 49.32 ? 160 THR F O 1 ATOM 12651 C CB . THR H 2 166 ? 73.854 -8.923 9.310 1.00 43.07 ? 160 THR F CB 1 ATOM 12652 O OG1 . THR H 2 166 ? 73.560 -10.280 9.670 1.00 44.04 ? 160 THR F OG1 1 ATOM 12653 C CG2 . THR H 2 166 ? 74.115 -8.848 7.812 1.00 37.75 ? 160 THR F CG2 1 ATOM 12654 N N . SER H 2 167 ? 74.700 -9.286 12.356 1.00 43.10 ? 161 SER F N 1 ATOM 12655 C CA . SER H 2 167 ? 74.240 -9.204 13.742 1.00 41.54 ? 161 SER F CA 1 ATOM 12656 C C . SER H 2 167 ? 75.256 -8.492 14.627 1.00 45.02 ? 161 SER F C 1 ATOM 12657 O O . SER H 2 167 ? 76.460 -8.722 14.519 1.00 51.20 ? 161 SER F O 1 ATOM 12658 C CB . SER H 2 167 ? 73.949 -10.600 14.302 1.00 44.55 ? 161 SER F CB 1 ATOM 12659 O OG . SER H 2 167 ? 75.148 -11.283 14.623 1.00 51.86 ? 161 SER F OG 1 ATOM 12660 N N . GLY H 2 168 ? 74.761 -7.628 15.507 1.00 49.55 ? 162 GLY F N 1 ATOM 12661 C CA . GLY H 2 168 ? 75.621 -6.868 16.395 1.00 50.89 ? 162 GLY F CA 1 ATOM 12662 C C . GLY H 2 168 ? 76.075 -5.562 15.775 1.00 47.08 ? 162 GLY F C 1 ATOM 12663 O O . GLY H 2 168 ? 76.739 -4.755 16.425 1.00 51.76 ? 162 GLY F O 1 ATOM 12664 N N . VAL H 2 169 ? 75.707 -5.355 14.514 1.00 38.95 ? 163 VAL F N 1 ATOM 12665 C CA . VAL H 2 169 ? 76.112 -4.167 13.768 1.00 39.44 ? 163 VAL F CA 1 ATOM 12666 C C . VAL H 2 169 ? 75.226 -2.956 14.059 1.00 44.51 ? 163 VAL F C 1 ATOM 12667 O O . VAL H 2 169 ? 73.999 -3.016 13.932 1.00 41.80 ? 163 VAL F O 1 ATOM 12668 C CB . VAL H 2 169 ? 76.097 -4.434 12.249 1.00 36.45 ? 163 VAL F CB 1 ATOM 12669 C CG1 . VAL H 2 169 ? 76.316 -3.142 11.474 1.00 36.38 ? 163 VAL F CG1 1 ATOM 12670 C CG2 . VAL H 2 169 ? 77.147 -5.470 11.884 1.00 36.28 ? 163 VAL F CG2 1 ATOM 12671 N N . HIS H 2 170 ? 75.864 -1.859 14.452 1.00 39.69 ? 164 HIS F N 1 ATOM 12672 C CA . HIS H 2 170 ? 75.176 -0.591 14.648 1.00 40.29 ? 164 HIS F CA 1 ATOM 12673 C C . HIS H 2 170 ? 75.809 0.483 13.774 1.00 37.01 ? 164 HIS F C 1 ATOM 12674 O O . HIS H 2 170 ? 76.918 0.944 14.045 1.00 38.71 ? 164 HIS F O 1 ATOM 12675 C CB . HIS H 2 170 ? 75.218 -0.155 16.116 1.00 52.71 ? 164 HIS F CB 1 ATOM 12676 C CG . HIS H 2 170 ? 74.459 -1.054 17.041 1.00 62.68 ? 164 HIS F CG 1 ATOM 12677 N ND1 . HIS H 2 170 ? 75.033 -1.629 18.154 1.00 63.10 ? 164 HIS F ND1 1 ATOM 12678 C CD2 . HIS H 2 170 ? 73.170 -1.468 17.026 1.00 67.57 ? 164 HIS F CD2 1 ATOM 12679 C CE1 . HIS H 2 170 ? 74.134 -2.366 18.780 1.00 65.83 ? 164 HIS F CE1 1 ATOM 12680 N NE2 . HIS H 2 170 ? 72.994 -2.285 18.116 1.00 68.03 ? 164 HIS F NE2 1 ATOM 12681 N N . THR H 2 171 ? 75.105 0.876 12.723 1.00 35.85 ? 165 THR F N 1 ATOM 12682 C CA . THR H 2 171 ? 75.561 1.974 11.888 1.00 36.60 ? 165 THR F CA 1 ATOM 12683 C C . THR H 2 171 ? 74.782 3.226 12.273 1.00 40.10 ? 165 THR F C 1 ATOM 12684 O O . THR H 2 171 ? 73.581 3.332 12.024 1.00 39.86 ? 165 THR F O 1 ATOM 12685 C CB . THR H 2 171 ? 75.392 1.657 10.393 1.00 36.85 ? 165 THR F CB 1 ATOM 12686 O OG1 . THR H 2 171 ? 76.157 0.488 10.070 1.00 38.63 ? 165 THR F OG1 1 ATOM 12687 C CG2 . THR H 2 171 ? 75.872 2.819 9.536 1.00 32.82 ? 165 THR F CG2 1 ATOM 12688 N N . PHE H 2 172 ? 75.479 4.163 12.905 1.00 36.66 ? 166 PHE F N 1 ATOM 12689 C CA . PHE H 2 172 ? 74.853 5.361 13.445 1.00 38.67 ? 166 PHE F CA 1 ATOM 12690 C C . PHE H 2 172 ? 74.414 6.317 12.346 1.00 34.71 ? 166 PHE F C 1 ATOM 12691 O O . PHE H 2 172 ? 75.001 6.331 11.267 1.00 33.72 ? 166 PHE F O 1 ATOM 12692 C CB . PHE H 2 172 ? 75.816 6.065 14.410 1.00 43.17 ? 166 PHE F CB 1 ATOM 12693 C CG . PHE H 2 172 ? 76.136 5.256 15.633 1.00 45.31 ? 166 PHE F CG 1 ATOM 12694 C CD1 . PHE H 2 172 ? 77.160 4.326 15.620 1.00 47.37 ? 166 PHE F CD1 1 ATOM 12695 C CD2 . PHE H 2 172 ? 75.395 5.411 16.793 1.00 50.26 ? 166 PHE F CD2 1 ATOM 12696 C CE1 . PHE H 2 172 ? 77.444 3.573 16.744 1.00 46.50 ? 166 PHE F CE1 1 ATOM 12697 C CE2 . PHE H 2 172 ? 75.677 4.661 17.920 1.00 46.16 ? 166 PHE F CE2 1 ATOM 12698 C CZ . PHE H 2 172 ? 76.698 3.741 17.894 1.00 44.48 ? 166 PHE F CZ 1 ATOM 12699 N N . PRO H 2 173 ? 73.364 7.107 12.614 1.00 43.01 ? 167 PRO F N 1 ATOM 12700 C CA . PRO H 2 173 ? 72.944 8.187 11.715 1.00 42.47 ? 167 PRO F CA 1 ATOM 12701 C C . PRO H 2 173 ? 74.068 9.185 11.503 1.00 40.10 ? 167 PRO F C 1 ATOM 12702 O O . PRO H 2 173 ? 74.740 9.540 12.472 1.00 42.24 ? 167 PRO F O 1 ATOM 12703 C CB . PRO H 2 173 ? 71.776 8.836 12.464 1.00 38.12 ? 167 PRO F CB 1 ATOM 12704 C CG . PRO H 2 173 ? 71.252 7.758 13.347 1.00 41.15 ? 167 PRO F CG 1 ATOM 12705 C CD . PRO H 2 173 ? 72.443 6.947 13.755 1.00 40.93 ? 167 PRO F CD 1 ATOM 12706 N N . ALA H 2 174 ? 74.275 9.625 10.266 1.00 40.09 ? 168 ALA F N 1 ATOM 12707 C CA . ALA H 2 174 ? 75.348 10.568 9.971 1.00 40.72 ? 168 ALA F CA 1 ATOM 12708 C C . ALA H 2 174 ? 75.130 11.885 10.705 1.00 40.47 ? 168 ALA F C 1 ATOM 12709 O O . ALA H 2 174 ? 74.001 12.256 11.015 1.00 37.04 ? 168 ALA F O 1 ATOM 12710 C CB . ALA H 2 174 ? 75.454 10.811 8.476 1.00 34.91 ? 168 ALA F CB 1 ATOM 12711 N N . VAL H 2 175 ? 76.220 12.581 10.991 1.00 40.15 ? 169 VAL F N 1 ATOM 12712 C CA . VAL H 2 175 ? 76.135 13.907 11.572 1.00 43.59 ? 169 VAL F CA 1 ATOM 12713 C C . VAL H 2 175 ? 76.725 14.908 10.592 1.00 44.51 ? 169 VAL F C 1 ATOM 12714 O O . VAL H 2 175 ? 77.778 14.658 10.005 1.00 45.01 ? 169 VAL F O 1 ATOM 12715 C CB . VAL H 2 175 ? 76.875 13.987 12.924 1.00 50.15 ? 169 VAL F CB 1 ATOM 12716 C CG1 . VAL H 2 175 ? 76.838 15.402 13.471 1.00 58.89 ? 169 VAL F CG1 1 ATOM 12717 C CG2 . VAL H 2 175 ? 76.268 13.010 13.919 1.00 50.44 ? 169 VAL F CG2 1 ATOM 12718 N N . LEU H 2 176 ? 76.030 16.025 10.394 1.00 40.76 ? 170 LEU F N 1 ATOM 12719 C CA . LEU H 2 176 ? 76.564 17.113 9.586 1.00 43.15 ? 170 LEU F CA 1 ATOM 12720 C C . LEU H 2 176 ? 77.590 17.898 10.400 1.00 43.12 ? 170 LEU F C 1 ATOM 12721 O O . LEU H 2 176 ? 77.300 18.354 11.508 1.00 41.39 ? 170 LEU F O 1 ATOM 12722 C CB . LEU H 2 176 ? 75.448 18.037 9.097 1.00 46.23 ? 170 LEU F CB 1 ATOM 12723 C CG . LEU H 2 176 ? 75.913 19.150 8.154 1.00 47.91 ? 170 LEU F CG 1 ATOM 12724 C CD1 . LEU H 2 176 ? 76.629 18.562 6.949 1.00 39.02 ? 170 LEU F CD1 1 ATOM 12725 C CD2 . LEU H 2 176 ? 74.742 20.020 7.715 1.00 53.28 ? 170 LEU F CD2 1 ATOM 12726 N N . GLN H 2 177 ? 78.793 18.040 9.855 1.00 40.29 ? 171 GLN F N 1 ATOM 12727 C CA . GLN H 2 177 ? 79.867 18.737 10.557 1.00 47.38 ? 171 GLN F CA 1 ATOM 12728 C C . GLN H 2 177 ? 79.911 20.209 10.157 1.00 48.49 ? 171 GLN F C 1 ATOM 12729 O O . GLN H 2 177 ? 79.272 20.609 9.185 1.00 43.62 ? 171 GLN F O 1 ATOM 12730 C CB . GLN H 2 177 ? 81.216 18.064 10.277 1.00 46.74 ? 171 GLN F CB 1 ATOM 12731 C CG . GLN H 2 177 ? 81.308 16.620 10.773 1.00 51.46 ? 171 GLN F CG 1 ATOM 12732 C CD . GLN H 2 177 ? 82.546 15.895 10.257 1.00 58.11 ? 171 GLN F CD 1 ATOM 12733 O OE1 . GLN H 2 177 ? 83.344 15.373 11.038 1.00 60.54 ? 171 GLN F OE1 1 ATOM 12734 N NE2 . GLN H 2 177 ? 82.703 15.853 8.937 1.00 54.29 ? 171 GLN F NE2 1 ATOM 12735 N N . SER H 2 178 ? 80.670 21.006 10.906 1.00 56.68 ? 172 SER F N 1 ATOM 12736 C CA . SER H 2 178 ? 80.786 22.444 10.653 1.00 65.55 ? 172 SER F CA 1 ATOM 12737 C C . SER H 2 178 ? 81.297 22.734 9.244 1.00 65.16 ? 172 SER F C 1 ATOM 12738 O O . SER H 2 178 ? 81.030 23.798 8.680 1.00 61.13 ? 172 SER F O 1 ATOM 12739 C CB . SER H 2 178 ? 81.717 23.094 11.681 1.00 73.65 ? 172 SER F CB 1 ATOM 12740 O OG . SER H 2 178 ? 81.324 22.778 13.005 1.00 77.29 ? 172 SER F OG 1 ATOM 12741 N N . SER H 2 179 ? 82.030 21.774 8.688 1.00 58.14 ? 173 SER F N 1 ATOM 12742 C CA . SER H 2 179 ? 82.628 21.905 7.365 1.00 53.23 ? 173 SER F CA 1 ATOM 12743 C C . SER H 2 179 ? 81.597 21.797 6.247 1.00 50.15 ? 173 SER F C 1 ATOM 12744 O O . SER H 2 179 ? 81.894 22.094 5.090 1.00 49.13 ? 173 SER F O 1 ATOM 12745 C CB . SER H 2 179 ? 83.704 20.837 7.171 1.00 48.31 ? 173 SER F CB 1 ATOM 12746 O OG . SER H 2 179 ? 83.157 19.541 7.353 1.00 52.47 ? 173 SER F OG 1 ATOM 12747 N N . GLY H 2 180 ? 80.390 21.366 6.596 1.00 47.73 ? 174 GLY F N 1 ATOM 12748 C CA . GLY H 2 180 ? 79.363 21.105 5.605 1.00 46.15 ? 174 GLY F CA 1 ATOM 12749 C C . GLY H 2 180 ? 79.409 19.671 5.105 1.00 48.84 ? 174 GLY F C 1 ATOM 12750 O O . GLY H 2 180 ? 78.586 19.267 4.281 1.00 49.13 ? 174 GLY F O 1 ATOM 12751 N N . LEU H 2 181 ? 80.376 18.902 5.603 1.00 47.27 ? 175 LEU F N 1 ATOM 12752 C CA . LEU H 2 181 ? 80.524 17.496 5.228 1.00 44.55 ? 175 LEU F CA 1 ATOM 12753 C C . LEU H 2 181 ? 79.907 16.581 6.275 1.00 42.55 ? 175 LEU F C 1 ATOM 12754 O O . LEU H 2 181 ? 79.821 16.942 7.451 1.00 42.99 ? 175 LEU F O 1 ATOM 12755 C CB . LEU H 2 181 ? 81.999 17.135 5.045 1.00 43.68 ? 175 LEU F CB 1 ATOM 12756 C CG . LEU H 2 181 ? 82.807 17.974 4.057 1.00 40.17 ? 175 LEU F CG 1 ATOM 12757 C CD1 . LEU H 2 181 ? 84.270 17.577 4.113 1.00 39.16 ? 175 LEU F CD1 1 ATOM 12758 C CD2 . LEU H 2 181 ? 82.256 17.814 2.653 1.00 40.25 ? 175 LEU F CD2 1 ATOM 12759 N N . TYR H 2 182 ? 79.489 15.392 5.851 1.00 37.91 ? 176 TYR F N 1 ATOM 12760 C CA . TYR H 2 182 ? 78.915 14.421 6.773 1.00 35.45 ? 176 TYR F CA 1 ATOM 12761 C C . TYR H 2 182 ? 79.967 13.446 7.287 1.00 37.88 ? 176 TYR F C 1 ATOM 12762 O O . TYR H 2 182 ? 80.999 13.243 6.652 1.00 40.23 ? 176 TYR F O 1 ATOM 12763 C CB . TYR H 2 182 ? 77.781 13.643 6.101 1.00 33.90 ? 176 TYR F CB 1 ATOM 12764 C CG . TYR H 2 182 ? 76.578 14.482 5.742 1.00 37.22 ? 176 TYR F CG 1 ATOM 12765 C CD1 . TYR H 2 182 ? 75.635 14.828 6.703 1.00 38.99 ? 176 TYR F CD1 1 ATOM 12766 C CD2 . TYR H 2 182 ? 76.379 14.921 4.442 1.00 41.30 ? 176 TYR F CD2 1 ATOM 12767 C CE1 . TYR H 2 182 ? 74.531 15.595 6.380 1.00 39.55 ? 176 TYR F CE1 1 ATOM 12768 C CE2 . TYR H 2 182 ? 75.277 15.687 4.108 1.00 43.24 ? 176 TYR F CE2 1 ATOM 12769 C CZ . TYR H 2 182 ? 74.357 16.022 5.081 1.00 42.52 ? 176 TYR F CZ 1 ATOM 12770 O OH . TYR H 2 182 ? 73.259 16.783 4.753 1.00 46.12 ? 176 TYR F OH 1 ATOM 12771 N N . SER H 2 183 ? 79.699 12.848 8.443 1.00 37.44 ? 177 SER F N 1 ATOM 12772 C CA . SER H 2 183 ? 80.496 11.724 8.917 1.00 41.17 ? 177 SER F CA 1 ATOM 12773 C C . SER H 2 183 ? 79.645 10.809 9.797 1.00 42.28 ? 177 SER F C 1 ATOM 12774 O O . SER H 2 183 ? 78.685 11.254 10.428 1.00 50.74 ? 177 SER F O 1 ATOM 12775 C CB . SER H 2 183 ? 81.731 12.211 9.682 1.00 39.98 ? 177 SER F CB 1 ATOM 12776 O OG . SER H 2 183 ? 81.571 12.027 11.076 1.00 40.23 ? 177 SER F OG 1 ATOM 12777 N N . LEU H 2 184 ? 79.991 9.527 9.826 1.00 40.27 ? 178 LEU F N 1 ATOM 12778 C CA . LEU H 2 184 ? 79.263 8.566 10.644 1.00 43.04 ? 178 LEU F CA 1 ATOM 12779 C C . LEU H 2 184 ? 80.191 7.456 11.129 1.00 40.14 ? 178 LEU F C 1 ATOM 12780 O O . LEU H 2 184 ? 81.339 7.365 10.697 1.00 37.69 ? 178 LEU F O 1 ATOM 12781 C CB . LEU H 2 184 ? 78.071 7.991 9.858 1.00 44.36 ? 178 LEU F CB 1 ATOM 12782 C CG . LEU H 2 184 ? 78.003 6.591 9.231 1.00 46.17 ? 178 LEU F CG 1 ATOM 12783 C CD1 . LEU H 2 184 ? 76.657 6.400 8.542 1.00 50.35 ? 178 LEU F CD1 1 ATOM 12784 C CD2 . LEU H 2 184 ? 79.100 6.335 8.239 1.00 53.09 ? 178 LEU F CD2 1 ATOM 12785 N N . SER H 2 185 ? 79.693 6.625 12.037 1.00 43.28 ? 179 SER F N 1 ATOM 12786 C CA . SER H 2 185 ? 80.442 5.466 12.502 1.00 46.01 ? 179 SER F CA 1 ATOM 12787 C C . SER H 2 185 ? 79.593 4.211 12.375 1.00 44.44 ? 179 SER F C 1 ATOM 12788 O O . SER H 2 185 ? 78.361 4.270 12.385 1.00 47.47 ? 179 SER F O 1 ATOM 12789 C CB . SER H 2 185 ? 80.895 5.651 13.953 1.00 49.02 ? 179 SER F CB 1 ATOM 12790 O OG . SER H 2 185 ? 81.785 6.747 14.073 1.00 58.75 ? 179 SER F OG 1 ATOM 12791 N N . SER H 2 186 ? 80.260 3.075 12.246 1.00 32.27 ? 180 SER F N 1 ATOM 12792 C CA . SER H 2 186 ? 79.576 1.798 12.222 1.00 33.37 ? 180 SER F CA 1 ATOM 12793 C C . SER H 2 186 ? 80.315 0.836 13.137 1.00 37.25 ? 180 SER F C 1 ATOM 12794 O O . SER H 2 186 ? 81.501 0.586 12.947 1.00 40.20 ? 180 SER F O 1 ATOM 12795 C CB . SER H 2 186 ? 79.499 1.252 10.796 1.00 28.15 ? 180 SER F CB 1 ATOM 12796 O OG . SER H 2 186 ? 78.954 -0.054 10.784 1.00 29.99 ? 180 SER F OG 1 ATOM 12797 N N . VAL H 2 187 ? 79.624 0.310 14.141 1.00 32.94 ? 181 VAL F N 1 ATOM 12798 C CA . VAL H 2 187 ? 80.283 -0.548 15.117 1.00 36.56 ? 181 VAL F CA 1 ATOM 12799 C C . VAL H 2 187 ? 79.668 -1.931 15.156 1.00 44.20 ? 181 VAL F C 1 ATOM 12800 O O . VAL H 2 187 ? 78.492 -2.115 14.836 1.00 44.30 ? 181 VAL F O 1 ATOM 12801 C CB . VAL H 2 187 ? 80.230 0.053 16.534 1.00 43.43 ? 181 VAL F CB 1 ATOM 12802 C CG1 . VAL H 2 187 ? 81.002 1.364 16.585 1.00 35.87 ? 181 VAL F CG1 1 ATOM 12803 C CG2 . VAL H 2 187 ? 78.784 0.248 16.976 1.00 45.31 ? 181 VAL F CG2 1 ATOM 12804 N N . VAL H 2 188 ? 80.473 -2.905 15.556 1.00 43.64 ? 182 VAL F N 1 ATOM 12805 C CA . VAL H 2 188 ? 79.992 -4.269 15.682 1.00 43.88 ? 182 VAL F CA 1 ATOM 12806 C C . VAL H 2 188 ? 80.635 -4.921 16.909 1.00 43.87 ? 182 VAL F C 1 ATOM 12807 O O . VAL H 2 188 ? 81.811 -4.707 17.200 1.00 43.36 ? 182 VAL F O 1 ATOM 12808 C CB . VAL H 2 188 ? 80.271 -5.087 14.386 1.00 37.99 ? 182 VAL F CB 1 ATOM 12809 C CG1 . VAL H 2 188 ? 81.748 -5.051 14.019 1.00 43.05 ? 182 VAL F CG1 1 ATOM 12810 C CG2 . VAL H 2 188 ? 79.761 -6.519 14.520 1.00 38.99 ? 182 VAL F CG2 1 ATOM 12811 N N . THR H 2 189 ? 79.835 -5.675 17.655 1.00 43.02 ? 183 THR F N 1 ATOM 12812 C CA . THR H 2 189 ? 80.336 -6.425 18.795 1.00 41.03 ? 183 THR F CA 1 ATOM 12813 C C . THR H 2 189 ? 80.560 -7.868 18.375 1.00 44.69 ? 183 THR F C 1 ATOM 12814 O O . THR H 2 189 ? 79.690 -8.494 17.768 1.00 52.30 ? 183 THR F O 1 ATOM 12815 C CB . THR H 2 189 ? 79.369 -6.366 19.991 1.00 49.08 ? 183 THR F CB 1 ATOM 12816 O OG1 . THR H 2 189 ? 78.024 -6.542 19.530 1.00 54.46 ? 183 THR F OG1 1 ATOM 12817 C CG2 . THR H 2 189 ? 79.484 -5.023 20.701 1.00 50.83 ? 183 THR F CG2 1 ATOM 12818 N N . VAL H 2 190 ? 81.744 -8.383 18.683 1.00 43.58 ? 184 VAL F N 1 ATOM 12819 C CA . VAL H 2 190 ? 82.148 -9.717 18.263 1.00 41.53 ? 184 VAL F CA 1 ATOM 12820 C C . VAL H 2 190 ? 82.754 -10.476 19.445 1.00 45.12 ? 184 VAL F C 1 ATOM 12821 O O . VAL H 2 190 ? 83.127 -9.860 20.443 1.00 45.14 ? 184 VAL F O 1 ATOM 12822 C CB . VAL H 2 190 ? 83.174 -9.651 17.107 1.00 42.02 ? 184 VAL F CB 1 ATOM 12823 C CG1 . VAL H 2 190 ? 82.617 -8.843 15.944 1.00 44.67 ? 184 VAL F CG1 1 ATOM 12824 C CG2 . VAL H 2 190 ? 84.490 -9.054 17.593 1.00 37.98 ? 184 VAL F CG2 1 ATOM 12825 N N . PRO H 2 191 ? 82.837 -11.816 19.348 1.00 48.42 ? 185 PRO F N 1 ATOM 12826 C CA . PRO H 2 191 ? 83.566 -12.564 20.381 1.00 53.26 ? 185 PRO F CA 1 ATOM 12827 C C . PRO H 2 191 ? 85.012 -12.097 20.489 1.00 58.48 ? 185 PRO F C 1 ATOM 12828 O O . PRO H 2 191 ? 85.713 -12.043 19.479 1.00 53.47 ? 185 PRO F O 1 ATOM 12829 C CB . PRO H 2 191 ? 83.497 -14.010 19.886 1.00 54.14 ? 185 PRO F CB 1 ATOM 12830 C CG . PRO H 2 191 ? 82.267 -14.061 19.047 1.00 56.11 ? 185 PRO F CG 1 ATOM 12831 C CD . PRO H 2 191 ? 82.159 -12.712 18.393 1.00 52.43 ? 185 PRO F CD 1 ATOM 12832 N N . SER H 2 192 ? 85.445 -11.763 21.700 1.00 70.32 ? 186 SER F N 1 ATOM 12833 C CA . SER H 2 192 ? 86.793 -11.252 21.921 1.00 69.89 ? 186 SER F CA 1 ATOM 12834 C C . SER H 2 192 ? 87.854 -12.287 21.551 1.00 68.22 ? 186 SER F C 1 ATOM 12835 O O . SER H 2 192 ? 88.983 -11.936 21.212 1.00 68.90 ? 186 SER F O 1 ATOM 12836 C CB . SER H 2 192 ? 86.963 -10.820 23.379 1.00 73.00 ? 186 SER F CB 1 ATOM 12837 O OG . SER H 2 192 ? 88.161 -10.085 23.561 1.00 75.50 ? 186 SER F OG 1 ATOM 12838 N N . SER H 2 193 ? 87.478 -13.561 21.609 1.00 68.37 ? 187 SER F N 1 ATOM 12839 C CA . SER H 2 193 ? 88.401 -14.653 21.314 1.00 73.57 ? 187 SER F CA 1 ATOM 12840 C C . SER H 2 193 ? 88.452 -14.981 19.827 1.00 72.18 ? 187 SER F C 1 ATOM 12841 O O . SER H 2 193 ? 89.167 -15.892 19.409 1.00 76.58 ? 187 SER F O 1 ATOM 12842 C CB . SER H 2 193 ? 88.006 -15.905 22.089 1.00 76.88 ? 187 SER F CB 1 ATOM 12843 O OG . SER H 2 193 ? 86.809 -16.441 21.560 1.00 77.58 ? 187 SER F OG 1 ATOM 12844 N N . SER H 2 194 ? 87.682 -14.252 19.031 1.00 66.53 ? 188 SER F N 1 ATOM 12845 C CA . SER H 2 194 ? 87.686 -14.460 17.590 1.00 64.63 ? 188 SER F CA 1 ATOM 12846 C C . SER H 2 194 ? 88.597 -13.443 16.910 1.00 55.28 ? 188 SER F C 1 ATOM 12847 O O . SER H 2 194 ? 88.845 -13.525 15.705 1.00 44.14 ? 188 SER F O 1 ATOM 12848 C CB . SER H 2 194 ? 86.264 -14.372 17.025 1.00 62.71 ? 188 SER F CB 1 ATOM 12849 O OG . SER H 2 194 ? 85.709 -13.085 17.231 1.00 61.59 ? 188 SER F OG 1 ATOM 12850 N N . LEU H 2 195 ? 89.099 -12.493 17.697 1.00 53.42 ? 189 LEU F N 1 ATOM 12851 C CA . LEU H 2 195 ? 89.935 -11.414 17.178 1.00 54.26 ? 189 LEU F CA 1 ATOM 12852 C C . LEU H 2 195 ? 91.241 -11.920 16.579 1.00 62.19 ? 189 LEU F C 1 ATOM 12853 O O . LEU H 2 195 ? 91.778 -11.317 15.651 1.00 67.30 ? 189 LEU F O 1 ATOM 12854 C CB . LEU H 2 195 ? 90.240 -10.397 18.280 1.00 49.98 ? 189 LEU F CB 1 ATOM 12855 C CG . LEU H 2 195 ? 89.078 -9.507 18.719 1.00 50.59 ? 189 LEU F CG 1 ATOM 12856 C CD1 . LEU H 2 195 ? 89.543 -8.477 19.734 1.00 49.41 ? 189 LEU F CD1 1 ATOM 12857 C CD2 . LEU H 2 195 ? 88.449 -8.831 17.511 1.00 43.85 ? 189 LEU F CD2 1 ATOM 12858 N N . GLY H 2 196 ? 91.753 -13.022 17.113 1.00 62.03 ? 190 GLY F N 1 ATOM 12859 C CA . GLY H 2 196 ? 92.984 -13.594 16.606 1.00 69.62 ? 190 GLY F CA 1 ATOM 12860 C C . GLY H 2 196 ? 92.722 -14.558 15.469 1.00 75.61 ? 190 GLY F C 1 ATOM 12861 O O . GLY H 2 196 ? 93.644 -14.964 14.762 1.00 80.50 ? 190 GLY F O 1 ATOM 12862 N N . THR H 2 197 ? 91.455 -14.913 15.285 1.00 75.69 ? 191 THR F N 1 ATOM 12863 C CA . THR H 2 197 ? 91.078 -15.937 14.318 1.00 74.16 ? 191 THR F CA 1 ATOM 12864 C C . THR H 2 197 ? 90.382 -15.356 13.088 1.00 67.11 ? 191 THR F C 1 ATOM 12865 O O . THR H 2 197 ? 90.589 -15.823 11.969 1.00 67.93 ? 191 THR F O 1 ATOM 12866 C CB . THR H 2 197 ? 90.145 -16.986 14.962 1.00 83.48 ? 191 THR F CB 1 ATOM 12867 O OG1 . THR H 2 197 ? 90.722 -17.457 16.186 1.00 90.69 ? 191 THR F OG1 1 ATOM 12868 C CG2 . THR H 2 197 ? 89.922 -18.161 14.022 1.00 83.08 ? 191 THR F CG2 1 ATOM 12869 N N . GLN H 2 198 ? 89.562 -14.335 13.303 1.00 61.89 ? 192 GLN F N 1 ATOM 12870 C CA . GLN H 2 198 ? 88.704 -13.803 12.247 1.00 62.57 ? 192 GLN F CA 1 ATOM 12871 C C . GLN H 2 198 ? 89.059 -12.360 11.893 1.00 58.33 ? 192 GLN F C 1 ATOM 12872 O O . GLN H 2 198 ? 89.208 -11.515 12.775 1.00 58.99 ? 192 GLN F O 1 ATOM 12873 C CB . GLN H 2 198 ? 87.236 -13.893 12.678 1.00 66.48 ? 192 GLN F CB 1 ATOM 12874 C CG . GLN H 2 198 ? 86.243 -13.296 11.696 1.00 69.56 ? 192 GLN F CG 1 ATOM 12875 C CD . GLN H 2 198 ? 85.899 -14.238 10.560 1.00 74.72 ? 192 GLN F CD 1 ATOM 12876 O OE1 . GLN H 2 198 ? 85.922 -15.458 10.721 1.00 78.37 ? 192 GLN F OE1 1 ATOM 12877 N NE2 . GLN H 2 198 ? 85.578 -13.675 9.401 1.00 76.60 ? 192 GLN F NE2 1 ATOM 12878 N N . THR H 2 199 ? 89.199 -12.084 10.600 1.00 58.02 ? 193 THR F N 1 ATOM 12879 C CA . THR H 2 199 ? 89.468 -10.726 10.135 1.00 60.89 ? 193 THR F CA 1 ATOM 12880 C C . THR H 2 199 ? 88.164 -9.971 9.896 1.00 56.64 ? 193 THR F C 1 ATOM 12881 O O . THR H 2 199 ? 87.203 -10.523 9.356 1.00 59.65 ? 193 THR F O 1 ATOM 12882 C CB . THR H 2 199 ? 90.312 -10.715 8.842 1.00 69.37 ? 193 THR F CB 1 ATOM 12883 O OG1 . THR H 2 199 ? 89.992 -11.863 8.047 1.00 72.91 ? 193 THR F OG1 1 ATOM 12884 C CG2 . THR H 2 199 ? 91.798 -10.737 9.172 1.00 76.03 ? 193 THR F CG2 1 ATOM 12885 N N . TYR H 2 200 ? 88.133 -8.708 10.308 1.00 46.78 ? 194 TYR F N 1 ATOM 12886 C CA . TYR H 2 200 ? 86.928 -7.900 10.187 1.00 42.27 ? 194 TYR F CA 1 ATOM 12887 C C . TYR H 2 200 ? 87.153 -6.728 9.237 1.00 39.79 ? 194 TYR F C 1 ATOM 12888 O O . TYR H 2 200 ? 88.076 -5.935 9.417 1.00 43.68 ? 194 TYR F O 1 ATOM 12889 C CB . TYR H 2 200 ? 86.471 -7.416 11.570 1.00 42.84 ? 194 TYR F CB 1 ATOM 12890 C CG . TYR H 2 200 ? 85.954 -8.548 12.432 1.00 41.77 ? 194 TYR F CG 1 ATOM 12891 C CD1 . TYR H 2 200 ? 84.752 -9.174 12.130 1.00 45.59 ? 194 TYR F CD1 1 ATOM 12892 C CD2 . TYR H 2 200 ? 86.675 -9.009 13.529 1.00 40.39 ? 194 TYR F CD2 1 ATOM 12893 C CE1 . TYR H 2 200 ? 84.273 -10.219 12.895 1.00 46.53 ? 194 TYR F CE1 1 ATOM 12894 C CE2 . TYR H 2 200 ? 86.202 -10.056 14.306 1.00 43.63 ? 194 TYR F CE2 1 ATOM 12895 C CZ . TYR H 2 200 ? 84.998 -10.657 13.982 1.00 50.97 ? 194 TYR F CZ 1 ATOM 12896 O OH . TYR H 2 200 ? 84.508 -11.700 14.738 1.00 52.92 ? 194 TYR F OH 1 ATOM 12897 N N . ILE H 2 201 ? 86.305 -6.638 8.217 1.00 34.35 ? 195 ILE F N 1 ATOM 12898 C CA . ILE H 2 201 ? 86.444 -5.633 7.169 1.00 31.38 ? 195 ILE F CA 1 ATOM 12899 C C . ILE H 2 201 ? 85.152 -4.854 6.989 1.00 32.92 ? 195 ILE F C 1 ATOM 12900 O O . ILE H 2 201 ? 84.095 -5.446 6.763 1.00 37.12 ? 195 ILE F O 1 ATOM 12901 C CB . ILE H 2 201 ? 86.827 -6.279 5.814 1.00 31.89 ? 195 ILE F CB 1 ATOM 12902 C CG1 . ILE H 2 201 ? 88.155 -7.032 5.935 1.00 41.83 ? 195 ILE F CG1 1 ATOM 12903 C CG2 . ILE H 2 201 ? 86.905 -5.229 4.715 1.00 26.15 ? 195 ILE F CG2 1 ATOM 12904 C CD1 . ILE H 2 201 ? 88.597 -7.710 4.648 1.00 44.99 ? 195 ILE F CD1 1 ATOM 12905 N N . CYS H 2 202 ? 85.221 -3.531 7.095 1.00 27.19 ? 196 CYS F N 1 ATOM 12906 C CA . CYS H 2 202 ? 84.051 -2.726 6.782 1.00 33.06 ? 196 CYS F CA 1 ATOM 12907 C C . CYS H 2 202 ? 84.082 -2.379 5.300 1.00 33.93 ? 196 CYS F C 1 ATOM 12908 O O . CYS H 2 202 ? 85.121 -2.001 4.755 1.00 32.72 ? 196 CYS F O 1 ATOM 12909 C CB . CYS H 2 202 ? 83.980 -1.460 7.645 1.00 45.03 ? 196 CYS F CB 1 ATOM 12910 S SG . CYS H 2 202 ? 85.141 -0.144 7.218 1.00 66.74 ? 196 CYS F SG 1 ATOM 12911 N N . ASN H 2 203 ? 82.941 -2.546 4.646 1.00 28.67 ? 197 ASN F N 1 ATOM 12912 C CA . ASN H 2 203 ? 82.817 -2.219 3.237 1.00 31.44 ? 197 ASN F CA 1 ATOM 12913 C C . ASN H 2 203 ? 82.001 -0.945 3.102 1.00 26.57 ? 197 ASN F C 1 ATOM 12914 O O . ASN H 2 203 ? 80.850 -0.888 3.536 1.00 27.19 ? 197 ASN F O 1 ATOM 12915 C CB . ASN H 2 203 ? 82.174 -3.376 2.466 1.00 28.12 ? 197 ASN F CB 1 ATOM 12916 C CG . ASN H 2 203 ? 82.602 -4.735 2.993 1.00 30.20 ? 197 ASN F CG 1 ATOM 12917 O OD1 . ASN H 2 203 ? 81.901 -5.352 3.794 1.00 32.12 ? 197 ASN F OD1 1 ATOM 12918 N ND2 . ASN H 2 203 ? 83.762 -5.201 2.553 1.00 27.68 ? 197 ASN F ND2 1 ATOM 12919 N N . VAL H 2 204 ? 82.611 0.084 2.524 1.00 26.61 ? 198 VAL F N 1 ATOM 12920 C CA . VAL H 2 204 ? 81.980 1.392 2.434 1.00 24.68 ? 198 VAL F CA 1 ATOM 12921 C C . VAL H 2 204 ? 81.736 1.798 0.989 1.00 22.32 ? 198 VAL F C 1 ATOM 12922 O O . VAL H 2 204 ? 82.663 1.877 0.185 1.00 25.02 ? 198 VAL F O 1 ATOM 12923 C CB . VAL H 2 204 ? 82.834 2.474 3.121 1.00 26.24 ? 198 VAL F CB 1 ATOM 12924 C CG1 . VAL H 2 204 ? 82.182 3.843 2.957 1.00 31.65 ? 198 VAL F CG1 1 ATOM 12925 C CG2 . VAL H 2 204 ? 83.022 2.138 4.588 1.00 28.65 ? 198 VAL F CG2 1 ATOM 12926 N N . ASN H 2 205 ? 80.478 2.048 0.664 1.00 19.87 ? 199 ASN F N 1 ATOM 12927 C CA . ASN H 2 205 ? 80.112 2.458 -0.679 1.00 22.06 ? 199 ASN F CA 1 ATOM 12928 C C . ASN H 2 205 ? 79.461 3.829 -0.656 1.00 26.60 ? 199 ASN F C 1 ATOM 12929 O O . ASN H 2 205 ? 78.408 4.020 -0.050 1.00 26.43 ? 199 ASN F O 1 ATOM 12930 C CB . ASN H 2 205 ? 79.174 1.433 -1.316 1.00 30.05 ? 199 ASN F CB 1 ATOM 12931 C CG . ASN H 2 205 ? 78.911 1.712 -2.782 1.00 31.82 ? 199 ASN F CG 1 ATOM 12932 O OD1 . ASN H 2 205 ? 79.520 2.600 -3.379 1.00 38.35 ? 199 ASN F OD1 1 ATOM 12933 N ND2 . ASN H 2 205 ? 78.006 0.944 -3.373 1.00 28.18 ? 199 ASN F ND2 1 ATOM 12934 N N . HIS H 2 206 ? 80.115 4.790 -1.294 1.00 27.09 ? 200 HIS F N 1 ATOM 12935 C CA . HIS H 2 206 ? 79.547 6.119 -1.458 1.00 28.11 ? 200 HIS F CA 1 ATOM 12936 C C . HIS H 2 206 ? 79.329 6.353 -2.944 1.00 27.96 ? 200 HIS F C 1 ATOM 12937 O O . HIS H 2 206 ? 80.221 6.814 -3.654 1.00 31.17 ? 200 HIS F O 1 ATOM 12938 C CB . HIS H 2 206 ? 80.461 7.187 -0.852 1.00 28.35 ? 200 HIS F CB 1 ATOM 12939 C CG . HIS H 2 206 ? 79.911 8.576 -0.945 1.00 34.69 ? 200 HIS F CG 1 ATOM 12940 N ND1 . HIS H 2 206 ? 80.482 9.551 -1.733 1.00 31.55 ? 200 HIS F ND1 1 ATOM 12941 C CD2 . HIS H 2 206 ? 78.839 9.153 -0.350 1.00 33.72 ? 200 HIS F CD2 1 ATOM 12942 C CE1 . HIS H 2 206 ? 79.788 10.670 -1.618 1.00 39.89 ? 200 HIS F CE1 1 ATOM 12943 N NE2 . HIS H 2 206 ? 78.786 10.455 -0.785 1.00 37.74 ? 200 HIS F NE2 1 ATOM 12944 N N . LYS H 2 207 ? 78.135 6.007 -3.409 1.00 32.99 ? 201 LYS F N 1 ATOM 12945 C CA . LYS H 2 207 ? 77.814 6.028 -4.831 1.00 32.23 ? 201 LYS F CA 1 ATOM 12946 C C . LYS H 2 207 ? 78.004 7.382 -5.547 1.00 34.30 ? 201 LYS F C 1 ATOM 12947 O O . LYS H 2 207 ? 78.458 7.396 -6.691 1.00 35.04 ? 201 LYS F O 1 ATOM 12948 C CB . LYS H 2 207 ? 76.379 5.525 -5.027 1.00 36.99 ? 201 LYS F CB 1 ATOM 12949 C CG . LYS H 2 207 ? 76.178 4.085 -4.536 1.00 44.79 ? 201 LYS F CG 1 ATOM 12950 C CD . LYS H 2 207 ? 74.738 3.594 -4.689 1.00 50.44 ? 201 LYS F CD 1 ATOM 12951 C CE . LYS H 2 207 ? 74.392 3.285 -6.143 1.00 64.75 ? 201 LYS F CE 1 ATOM 12952 N NZ . LYS H 2 207 ? 75.207 2.175 -6.717 1.00 68.07 ? 201 LYS F NZ 1 ATOM 12953 N N . PRO H 2 208 ? 77.669 8.518 -4.895 1.00 34.32 ? 202 PRO F N 1 ATOM 12954 C CA . PRO H 2 208 ? 77.829 9.776 -5.640 1.00 30.69 ? 202 PRO F CA 1 ATOM 12955 C C . PRO H 2 208 ? 79.259 10.063 -6.095 1.00 35.81 ? 202 PRO F C 1 ATOM 12956 O O . PRO H 2 208 ? 79.451 10.704 -7.128 1.00 39.51 ? 202 PRO F O 1 ATOM 12957 C CB . PRO H 2 208 ? 77.373 10.835 -4.632 1.00 33.62 ? 202 PRO F CB 1 ATOM 12958 C CG . PRO H 2 208 ? 76.424 10.132 -3.764 1.00 38.86 ? 202 PRO F CG 1 ATOM 12959 C CD . PRO H 2 208 ? 76.989 8.747 -3.607 1.00 40.26 ? 202 PRO F CD 1 ATOM 12960 N N . SER H 2 209 ? 80.243 9.590 -5.337 1.00 39.04 ? 203 SER F N 1 ATOM 12961 C CA . SER H 2 209 ? 81.645 9.807 -5.671 1.00 31.08 ? 203 SER F CA 1 ATOM 12962 C C . SER H 2 209 ? 82.287 8.552 -6.252 1.00 35.47 ? 203 SER F C 1 ATOM 12963 O O . SER H 2 209 ? 83.498 8.519 -6.478 1.00 36.93 ? 203 SER F O 1 ATOM 12964 C CB . SER H 2 209 ? 82.420 10.252 -4.433 1.00 33.23 ? 203 SER F CB 1 ATOM 12965 O OG . SER H 2 209 ? 82.484 9.203 -3.483 1.00 35.66 ? 203 SER F OG 1 ATOM 12966 N N . ASN H 2 210 ? 81.472 7.525 -6.489 1.00 35.56 ? 204 ASN F N 1 ATOM 12967 C CA . ASN H 2 210 ? 81.968 6.217 -6.915 1.00 38.32 ? 204 ASN F CA 1 ATOM 12968 C C . ASN H 2 210 ? 83.104 5.730 -6.038 1.00 36.49 ? 204 ASN F C 1 ATOM 12969 O O . ASN H 2 210 ? 84.128 5.277 -6.536 1.00 39.79 ? 204 ASN F O 1 ATOM 12970 C CB . ASN H 2 210 ? 82.428 6.256 -8.370 1.00 49.18 ? 204 ASN F CB 1 ATOM 12971 C CG . ASN H 2 210 ? 81.275 6.370 -9.337 1.00 65.79 ? 204 ASN F CG 1 ATOM 12972 O OD1 . ASN H 2 210 ? 81.067 7.415 -9.958 1.00 67.21 ? 204 ASN F OD1 1 ATOM 12973 N ND2 . ASN H 2 210 ? 80.509 5.293 -9.468 1.00 70.58 ? 204 ASN F ND2 1 ATOM 12974 N N . THR H 2 211 ? 82.924 5.848 -4.730 1.00 35.17 ? 205 THR F N 1 ATOM 12975 C CA . THR H 2 211 ? 83.934 5.406 -3.786 1.00 33.09 ? 205 THR F CA 1 ATOM 12976 C C . THR H 2 211 ? 83.550 4.049 -3.200 1.00 36.83 ? 205 THR F C 1 ATOM 12977 O O . THR H 2 211 ? 82.472 3.892 -2.628 1.00 33.54 ? 205 THR F O 1 ATOM 12978 C CB . THR H 2 211 ? 84.130 6.433 -2.653 1.00 34.96 ? 205 THR F CB 1 ATOM 12979 O OG1 . THR H 2 211 ? 84.581 7.676 -3.205 1.00 38.36 ? 205 THR F OG1 1 ATOM 12980 C CG2 . THR H 2 211 ? 85.155 5.941 -1.651 1.00 32.82 ? 205 THR F CG2 1 ATOM 12981 N N . LYS H 2 212 ? 84.432 3.069 -3.370 1.00 39.07 ? 206 LYS F N 1 ATOM 12982 C CA . LYS H 2 212 ? 84.271 1.765 -2.739 1.00 32.58 ? 206 LYS F CA 1 ATOM 12983 C C . LYS H 2 212 ? 85.517 1.438 -1.931 1.00 36.34 ? 206 LYS F C 1 ATOM 12984 O O . LYS H 2 212 ? 86.584 1.202 -2.493 1.00 36.55 ? 206 LYS F O 1 ATOM 12985 C CB . LYS H 2 212 ? 84.015 0.681 -3.781 1.00 25.38 ? 206 LYS F CB 1 ATOM 12986 C CG . LYS H 2 212 ? 82.627 0.723 -4.367 1.00 27.49 ? 206 LYS F CG 1 ATOM 12987 C CD . LYS H 2 212 ? 82.542 -0.072 -5.654 1.00 30.79 ? 206 LYS F CD 1 ATOM 12988 C CE . LYS H 2 212 ? 81.166 0.075 -6.278 1.00 35.42 ? 206 LYS F CE 1 ATOM 12989 N NZ . LYS H 2 212 ? 81.129 -0.464 -7.660 1.00 46.18 ? 206 LYS F NZ 1 ATOM 12990 N N . VAL H 2 213 ? 85.381 1.434 -0.610 1.00 31.80 ? 207 VAL F N 1 ATOM 12991 C CA . VAL H 2 213 ? 86.521 1.201 0.259 1.00 33.73 ? 207 VAL F CA 1 ATOM 12992 C C . VAL H 2 213 ? 86.329 -0.031 1.134 1.00 37.35 ? 207 VAL F C 1 ATOM 12993 O O . VAL H 2 213 ? 85.299 -0.196 1.792 1.00 39.47 ? 207 VAL F O 1 ATOM 12994 C CB . VAL H 2 213 ? 86.794 2.416 1.165 1.00 34.50 ? 207 VAL F CB 1 ATOM 12995 C CG1 . VAL H 2 213 ? 87.963 2.133 2.097 1.00 38.26 ? 207 VAL F CG1 1 ATOM 12996 C CG2 . VAL H 2 213 ? 87.075 3.650 0.326 1.00 31.27 ? 207 VAL F CG2 1 ATOM 12997 N N . ASP H 2 214 ? 87.335 -0.896 1.121 1.00 31.79 ? 208 ASP F N 1 ATOM 12998 C CA . ASP H 2 214 ? 87.396 -2.039 2.015 1.00 35.16 ? 208 ASP F CA 1 ATOM 12999 C C . ASP H 2 214 ? 88.460 -1.787 3.071 1.00 37.76 ? 208 ASP F C 1 ATOM 13000 O O . ASP H 2 214 ? 89.647 -1.796 2.762 1.00 51.15 ? 208 ASP F O 1 ATOM 13001 C CB . ASP H 2 214 ? 87.714 -3.313 1.236 1.00 34.92 ? 208 ASP F CB 1 ATOM 13002 C CG . ASP H 2 214 ? 86.578 -3.740 0.329 1.00 42.10 ? 208 ASP F CG 1 ATOM 13003 O OD1 . ASP H 2 214 ? 85.438 -3.864 0.819 1.00 36.61 ? 208 ASP F OD1 1 ATOM 13004 O OD2 . ASP H 2 214 ? 86.821 -3.953 -0.877 1.00 53.67 ? 208 ASP F OD2 1 ATOM 13005 N N . LYS H 2 215 ? 88.046 -1.546 4.309 1.00 29.21 ? 209 LYS F N 1 ATOM 13006 C CA . LYS H 2 215 ? 89.015 -1.267 5.362 1.00 35.77 ? 209 LYS F CA 1 ATOM 13007 C C . LYS H 2 215 ? 89.088 -2.382 6.395 1.00 37.94 ? 209 LYS F C 1 ATOM 13008 O O . LYS H 2 215 ? 88.104 -2.682 7.071 1.00 40.53 ? 209 LYS F O 1 ATOM 13009 C CB . LYS H 2 215 ? 88.692 0.052 6.063 1.00 39.16 ? 209 LYS F CB 1 ATOM 13010 C CG . LYS H 2 215 ? 89.931 0.820 6.494 1.00 46.15 ? 209 LYS F CG 1 ATOM 13011 C CD . LYS H 2 215 ? 90.716 1.264 5.271 1.00 53.81 ? 209 LYS F CD 1 ATOM 13012 C CE . LYS H 2 215 ? 91.923 2.100 5.644 1.00 61.56 ? 209 LYS F CE 1 ATOM 13013 N NZ . LYS H 2 215 ? 92.662 2.541 4.429 1.00 69.19 ? 209 LYS F NZ 1 ATOM 13014 N N . LYS H 2 216 ? 90.262 -2.990 6.518 1.00 33.46 ? 210 LYS F N 1 ATOM 13015 C CA . LYS H 2 216 ? 90.495 -3.983 7.561 1.00 40.30 ? 210 LYS F CA 1 ATOM 13016 C C . LYS H 2 216 ? 90.536 -3.309 8.930 1.00 41.59 ? 210 LYS F C 1 ATOM 13017 O O . LYS H 2 216 ? 91.091 -2.222 9.077 1.00 41.98 ? 210 LYS F O 1 ATOM 13018 C CB . LYS H 2 216 ? 91.799 -4.744 7.306 1.00 38.68 ? 210 LYS F CB 1 ATOM 13019 C CG . LYS H 2 216 ? 91.819 -5.507 5.998 1.00 38.27 ? 210 LYS F CG 1 ATOM 13020 C CD . LYS H 2 216 ? 93.112 -6.284 5.828 1.00 50.18 ? 210 LYS F CD 1 ATOM 13021 C CE . LYS H 2 216 ? 93.039 -7.209 4.623 1.00 66.06 ? 210 LYS F CE 1 ATOM 13022 N NZ . LYS H 2 216 ? 94.169 -8.189 4.594 1.00 79.57 ? 210 LYS F NZ 1 ATOM 13023 N N . VAL H 2 217 ? 89.933 -3.950 9.925 1.00 41.71 ? 211 VAL F N 1 ATOM 13024 C CA . VAL H 2 217 ? 89.943 -3.430 11.288 1.00 42.52 ? 211 VAL F CA 1 ATOM 13025 C C . VAL H 2 217 ? 90.607 -4.434 12.228 1.00 45.16 ? 211 VAL F C 1 ATOM 13026 O O . VAL H 2 217 ? 90.005 -5.432 12.617 1.00 51.14 ? 211 VAL F O 1 ATOM 13027 C CB . VAL H 2 217 ? 88.522 -3.107 11.782 1.00 40.80 ? 211 VAL F CB 1 ATOM 13028 C CG1 . VAL H 2 217 ? 88.560 -2.587 13.210 1.00 36.64 ? 211 VAL F CG1 1 ATOM 13029 C CG2 . VAL H 2 217 ? 87.866 -2.090 10.862 1.00 43.74 ? 211 VAL F CG2 1 ATOM 13030 N N . GLU H 2 218 ? 91.859 -4.161 12.576 1.00 49.59 ? 212 GLU F N 1 ATOM 13031 C CA . GLU H 2 218 ? 92.673 -5.090 13.353 1.00 56.44 ? 212 GLU F CA 1 ATOM 13032 C C . GLU H 2 218 ? 93.078 -4.490 14.696 1.00 62.86 ? 212 GLU F C 1 ATOM 13033 O O . GLU H 2 218 ? 93.177 -3.271 14.820 1.00 60.98 ? 212 GLU F O 1 ATOM 13034 C CB . GLU H 2 218 ? 93.926 -5.481 12.562 1.00 55.55 ? 212 GLU F CB 1 ATOM 13035 C CG . GLU H 2 218 ? 93.647 -6.185 11.245 1.00 58.33 ? 212 GLU F CG 1 ATOM 13036 C CD . GLU H 2 218 ? 94.867 -6.236 10.343 1.00 57.20 ? 212 GLU F CD 1 ATOM 13037 O OE1 . GLU H 2 218 ? 95.814 -5.456 10.583 1.00 51.69 ? 212 GLU F OE1 1 ATOM 13038 O OE2 . GLU H 2 218 ? 94.876 -7.050 9.393 1.00 58.52 ? 212 GLU F OE2 1 ATOM 13039 N N . PRO H 2 219 ? 93.314 -5.347 15.705 1.00 72.34 ? 213 PRO F N 1 ATOM 13040 C CA . PRO H 2 219 ? 93.824 -4.879 16.999 1.00 80.25 ? 213 PRO F CA 1 ATOM 13041 C C . PRO H 2 219 ? 95.122 -4.094 16.838 1.00 92.91 ? 213 PRO F C 1 ATOM 13042 O O . PRO H 2 219 ? 96.098 -4.641 16.338 1.00 95.40 ? 213 PRO F O 1 ATOM 13043 C CB . PRO H 2 219 ? 94.063 -6.178 17.774 1.00 76.92 ? 213 PRO F CB 1 ATOM 13044 C CG . PRO H 2 219 ? 93.127 -7.158 17.161 1.00 73.39 ? 213 PRO F CG 1 ATOM 13045 C CD . PRO H 2 219 ? 93.061 -6.799 15.706 1.00 73.15 ? 213 PRO F CD 1 ATOM 13046 N N . LYS H 2 220 ? 95.125 -2.826 17.237 1.00 107.79 ? 214 LYS F N 1 ATOM 13047 C CA . LYS H 2 220 ? 96.311 -1.987 17.091 1.00 123.72 ? 214 LYS F CA 1 ATOM 13048 C C . LYS H 2 220 ? 96.623 -1.234 18.379 1.00 134.38 ? 214 LYS F C 1 ATOM 13049 O O . LYS H 2 220 ? 95.720 -0.751 19.060 1.00 137.88 ? 214 LYS F O 1 ATOM 13050 C CB . LYS H 2 220 ? 96.131 -0.997 15.938 1.00 127.74 ? 214 LYS F CB 1 ATOM 13051 C CG . LYS H 2 220 ? 95.968 -1.648 14.574 1.00 131.61 ? 214 LYS F CG 1 ATOM 13052 C CD . LYS H 2 220 ? 95.682 -0.610 13.503 1.00 134.33 ? 214 LYS F CD 1 ATOM 13053 C CE . LYS H 2 220 ? 95.522 -1.253 12.136 1.00 135.60 ? 214 LYS F CE 1 ATOM 13054 N NZ . LYS H 2 220 ? 95.257 -0.240 11.078 1.00 135.56 ? 214 LYS F NZ 1 HETATM 13055 S S . SO4 I 3 . ? 10.420 -10.692 -19.148 1.00 52.35 ? 301 SO4 L S 1 HETATM 13056 O O1 . SO4 I 3 . ? 9.312 -10.258 -19.993 1.00 58.48 ? 301 SO4 L O1 1 HETATM 13057 O O2 . SO4 I 3 . ? 11.369 -11.456 -19.953 1.00 58.32 ? 301 SO4 L O2 1 HETATM 13058 O O3 . SO4 I 3 . ? 9.916 -11.525 -18.061 1.00 50.69 ? 301 SO4 L O3 1 HETATM 13059 O O4 . SO4 I 3 . ? 11.092 -9.523 -18.588 1.00 51.81 ? 301 SO4 L O4 1 HETATM 13060 S S . SO4 J 3 . ? 24.237 42.754 -37.965 1.00 57.48 ? 302 SO4 L S 1 HETATM 13061 O O1 . SO4 J 3 . ? 24.812 43.803 -38.804 1.00 63.22 ? 302 SO4 L O1 1 HETATM 13062 O O2 . SO4 J 3 . ? 24.769 41.460 -38.384 1.00 57.38 ? 302 SO4 L O2 1 HETATM 13063 O O3 . SO4 J 3 . ? 22.782 42.771 -38.094 1.00 50.53 ? 302 SO4 L O3 1 HETATM 13064 O O4 . SO4 J 3 . ? 24.594 42.985 -36.569 1.00 69.02 ? 302 SO4 L O4 1 HETATM 13065 S S . SO4 K 3 . ? 9.686 35.563 -9.353 1.00 76.36 ? 303 SO4 L S 1 HETATM 13066 O O1 . SO4 K 3 . ? 9.765 34.903 -10.653 1.00 77.50 ? 303 SO4 L O1 1 HETATM 13067 O O2 . SO4 K 3 . ? 9.863 37.002 -9.524 1.00 86.25 ? 303 SO4 L O2 1 HETATM 13068 O O3 . SO4 K 3 . ? 10.742 35.045 -8.486 1.00 80.86 ? 303 SO4 L O3 1 HETATM 13069 O O4 . SO4 K 3 . ? 8.380 35.304 -8.752 1.00 72.51 ? 303 SO4 L O4 1 HETATM 13070 S S . SO4 L 3 . ? 0.055 8.394 0.073 0.50 66.99 ? 304 SO4 L S 1 HETATM 13071 O O1 . SO4 L 3 . ? 1.440 8.556 -0.370 0.50 68.72 ? 304 SO4 L O1 1 HETATM 13072 O O2 . SO4 L 3 . ? -0.775 8.078 -1.094 0.50 66.57 ? 304 SO4 L O2 1 HETATM 13073 O O3 . SO4 L 3 . ? -0.021 7.300 1.033 0.50 64.31 ? 304 SO4 L O3 1 HETATM 13074 O O4 . SO4 L 3 . ? -0.403 9.639 0.676 0.50 67.89 ? 304 SO4 L O4 1 HETATM 13075 S S . SO4 M 3 . ? 18.158 10.312 8.051 1.00 102.87 ? 305 SO4 L S 1 HETATM 13076 O O1 . SO4 M 3 . ? 18.406 9.104 7.268 1.00 102.31 ? 305 SO4 L O1 1 HETATM 13077 O O2 . SO4 M 3 . ? 17.599 11.354 7.191 1.00 97.48 ? 305 SO4 L O2 1 HETATM 13078 O O3 . SO4 M 3 . ? 19.417 10.776 8.630 1.00 104.82 ? 305 SO4 L O3 1 HETATM 13079 O O4 . SO4 M 3 . ? 17.214 10.009 9.124 1.00 103.89 ? 305 SO4 L O4 1 HETATM 13080 S S . SO4 N 3 . ? 3.539 -12.606 -7.976 1.00 104.84 ? 306 SO4 L S 1 HETATM 13081 O O1 . SO4 N 3 . ? 4.412 -12.385 -9.126 1.00 96.19 ? 306 SO4 L O1 1 HETATM 13082 O O2 . SO4 N 3 . ? 2.156 -12.331 -8.355 1.00 110.12 ? 306 SO4 L O2 1 HETATM 13083 O O3 . SO4 N 3 . ? 3.657 -13.994 -7.535 1.00 109.65 ? 306 SO4 L O3 1 HETATM 13084 O O4 . SO4 N 3 . ? 3.923 -11.716 -6.884 1.00 104.14 ? 306 SO4 L O4 1 HETATM 13085 C C1 . NAG O 4 . ? 35.581 -4.740 -30.763 1.00 95.39 ? 301 NAG H C1 1 HETATM 13086 C C2 . NAG O 4 . ? 36.689 -5.795 -30.589 1.00 117.47 ? 301 NAG H C2 1 HETATM 13087 C C3 . NAG O 4 . ? 37.969 -5.398 -31.343 1.00 120.03 ? 301 NAG H C3 1 HETATM 13088 C C4 . NAG O 4 . ? 37.677 -4.955 -32.770 1.00 118.75 ? 301 NAG H C4 1 HETATM 13089 C C5 . NAG O 4 . ? 36.607 -3.880 -32.751 1.00 112.70 ? 301 NAG H C5 1 HETATM 13090 C C6 . NAG O 4 . ? 36.230 -3.398 -34.135 1.00 114.15 ? 301 NAG H C6 1 HETATM 13091 C C7 . NAG O 4 . ? 37.529 -5.127 -28.353 1.00 126.14 ? 301 NAG H C7 1 HETATM 13092 C C8 . NAG O 4 . ? 37.808 -5.606 -26.964 1.00 124.19 ? 301 NAG H C8 1 HETATM 13093 N N2 . NAG O 4 . ? 36.991 -6.036 -29.185 1.00 120.80 ? 301 NAG H N2 1 HETATM 13094 O O3 . NAG O 4 . ? 38.843 -6.521 -31.354 1.00 122.11 ? 301 NAG H O3 1 HETATM 13095 O O4 . NAG O 4 . ? 38.854 -4.408 -33.353 1.00 120.91 ? 301 NAG H O4 1 HETATM 13096 O O5 . NAG O 4 . ? 35.428 -4.418 -32.144 1.00 103.63 ? 301 NAG H O5 1 HETATM 13097 O O6 . NAG O 4 . ? 35.167 -4.144 -34.713 1.00 114.85 ? 301 NAG H O6 1 HETATM 13098 O O7 . NAG O 4 . ? 37.762 -3.962 -28.698 1.00 131.18 ? 301 NAG H O7 1 HETATM 13099 S S . SO4 P 3 . ? 22.534 -15.058 -9.917 1.00 49.29 ? 302 SO4 H S 1 HETATM 13100 O O1 . SO4 P 3 . ? 22.067 -14.607 -11.225 1.00 39.45 ? 302 SO4 H O1 1 HETATM 13101 O O2 . SO4 P 3 . ? 23.695 -15.927 -10.073 1.00 50.82 ? 302 SO4 H O2 1 HETATM 13102 O O3 . SO4 P 3 . ? 21.468 -15.788 -9.240 1.00 55.07 ? 302 SO4 H O3 1 HETATM 13103 O O4 . SO4 P 3 . ? 22.910 -13.903 -9.111 1.00 47.97 ? 302 SO4 H O4 1 HETATM 13104 S S . SO4 Q 3 . ? 10.581 6.017 -23.778 1.00 50.01 ? 303 SO4 H S 1 HETATM 13105 O O1 . SO4 Q 3 . ? 10.887 6.131 -25.202 1.00 55.09 ? 303 SO4 H O1 1 HETATM 13106 O O2 . SO4 Q 3 . ? 9.406 5.169 -23.596 1.00 47.28 ? 303 SO4 H O2 1 HETATM 13107 O O3 . SO4 Q 3 . ? 11.722 5.426 -23.085 1.00 55.63 ? 303 SO4 H O3 1 HETATM 13108 O O4 . SO4 Q 3 . ? 10.315 7.344 -23.229 1.00 58.50 ? 303 SO4 H O4 1 HETATM 13109 S S . SO4 R 3 . ? 30.407 -16.679 -7.416 1.00 54.02 ? 304 SO4 H S 1 HETATM 13110 O O1 . SO4 R 3 . ? 31.773 -17.010 -7.817 1.00 50.69 ? 304 SO4 H O1 1 HETATM 13111 O O2 . SO4 R 3 . ? 29.973 -15.482 -8.129 1.00 51.00 ? 304 SO4 H O2 1 HETATM 13112 O O3 . SO4 R 3 . ? 30.363 -16.422 -5.978 1.00 56.53 ? 304 SO4 H O3 1 HETATM 13113 O O4 . SO4 R 3 . ? 29.511 -17.786 -7.743 1.00 59.62 ? 304 SO4 H O4 1 HETATM 13114 S S . SO4 S 3 . ? 29.528 -4.419 -1.484 1.00 92.42 ? 305 SO4 H S 1 HETATM 13115 O O1 . SO4 S 3 . ? 30.319 -3.282 -1.952 1.00 91.48 ? 305 SO4 H O1 1 HETATM 13116 O O2 . SO4 S 3 . ? 30.012 -5.645 -2.116 1.00 84.01 ? 305 SO4 H O2 1 HETATM 13117 O O3 . SO4 S 3 . ? 28.122 -4.218 -1.825 1.00 89.34 ? 305 SO4 H O3 1 HETATM 13118 O O4 . SO4 S 3 . ? 29.662 -4.532 -0.034 1.00 97.82 ? 305 SO4 H O4 1 HETATM 13119 S S . SO4 T 3 . ? 48.216 -7.364 -18.440 1.00 83.44 ? 306 SO4 H S 1 HETATM 13120 O O1 . SO4 T 3 . ? 49.154 -6.683 -19.329 1.00 83.27 ? 306 SO4 H O1 1 HETATM 13121 O O2 . SO4 T 3 . ? 47.003 -7.700 -19.181 1.00 83.42 ? 306 SO4 H O2 1 HETATM 13122 O O3 . SO4 T 3 . ? 48.830 -8.585 -17.926 1.00 89.80 ? 306 SO4 H O3 1 HETATM 13123 O O4 . SO4 T 3 . ? 47.874 -6.491 -17.319 1.00 83.25 ? 306 SO4 H O4 1 HETATM 13124 S S . SO4 U 3 . ? 90.148 -7.098 -16.951 1.00 62.61 ? 301 SO4 A S 1 HETATM 13125 O O1 . SO4 U 3 . ? 89.311 -6.040 -17.509 1.00 68.72 ? 301 SO4 A O1 1 HETATM 13126 O O2 . SO4 U 3 . ? 90.307 -8.168 -17.930 1.00 67.69 ? 301 SO4 A O2 1 HETATM 13127 O O3 . SO4 U 3 . ? 89.515 -7.634 -15.750 1.00 59.88 ? 301 SO4 A O3 1 HETATM 13128 O O4 . SO4 U 3 . ? 91.458 -6.548 -16.617 1.00 65.18 ? 301 SO4 A O4 1 HETATM 13129 S S . SO4 V 3 . ? 71.404 -57.721 -37.592 1.00 57.38 ? 302 SO4 A S 1 HETATM 13130 O O1 . SO4 V 3 . ? 71.184 -56.375 -38.118 1.00 50.99 ? 302 SO4 A O1 1 HETATM 13131 O O2 . SO4 V 3 . ? 70.624 -58.677 -38.374 1.00 68.17 ? 302 SO4 A O2 1 HETATM 13132 O O3 . SO4 V 3 . ? 72.823 -58.067 -37.681 1.00 44.38 ? 302 SO4 A O3 1 HETATM 13133 O O4 . SO4 V 3 . ? 70.968 -57.771 -36.199 1.00 59.22 ? 302 SO4 A O4 1 HETATM 13134 S S . SO4 W 3 . ? 87.307 -46.191 -47.931 1.00 57.16 ? 303 SO4 A S 1 HETATM 13135 O O1 . SO4 W 3 . ? 86.213 -45.311 -48.339 1.00 48.15 ? 303 SO4 A O1 1 HETATM 13136 O O2 . SO4 W 3 . ? 88.546 -45.733 -48.556 1.00 67.28 ? 303 SO4 A O2 1 HETATM 13137 O O3 . SO4 W 3 . ? 87.040 -47.563 -48.351 1.00 43.41 ? 303 SO4 A O3 1 HETATM 13138 O O4 . SO4 W 3 . ? 87.445 -46.150 -46.477 1.00 62.15 ? 303 SO4 A O4 1 HETATM 13139 S S . SO4 X 3 . ? 97.043 -49.919 -6.429 1.00 69.35 ? 304 SO4 A S 1 HETATM 13140 O O1 . SO4 X 3 . ? 98.119 -50.427 -7.276 1.00 75.05 ? 304 SO4 A O1 1 HETATM 13141 O O2 . SO4 X 3 . ? 96.659 -48.584 -6.878 1.00 71.65 ? 304 SO4 A O2 1 HETATM 13142 O O3 . SO4 X 3 . ? 97.498 -49.840 -5.043 1.00 71.78 ? 304 SO4 A O3 1 HETATM 13143 O O4 . SO4 X 3 . ? 95.898 -50.823 -6.517 1.00 62.67 ? 304 SO4 A O4 1 HETATM 13144 S S . SO4 Y 3 . ? 97.436 -36.300 -7.685 1.00 102.49 ? 305 SO4 A S 1 HETATM 13145 O O1 . SO4 Y 3 . ? 98.348 -35.229 -8.077 1.00 105.51 ? 305 SO4 A O1 1 HETATM 13146 O O2 . SO4 Y 3 . ? 96.702 -36.767 -8.857 1.00 100.97 ? 305 SO4 A O2 1 HETATM 13147 O O3 . SO4 Y 3 . ? 98.189 -37.408 -7.108 1.00 103.15 ? 305 SO4 A O3 1 HETATM 13148 O O4 . SO4 Y 3 . ? 96.504 -35.791 -6.686 1.00 105.83 ? 305 SO4 A O4 1 HETATM 13149 C C1 . NAG Z 4 . ? 65.875 -10.884 -30.255 1.00 102.75 ? 301 NAG B C1 1 HETATM 13150 C C2 . NAG Z 4 . ? 64.789 -9.822 -30.000 1.00 119.75 ? 301 NAG B C2 1 HETATM 13151 C C3 . NAG Z 4 . ? 63.472 -10.216 -30.680 1.00 126.67 ? 301 NAG B C3 1 HETATM 13152 C C4 . NAG Z 4 . ? 63.688 -10.570 -32.144 1.00 130.09 ? 301 NAG B C4 1 HETATM 13153 C C5 . NAG Z 4 . ? 64.759 -11.643 -32.257 1.00 127.01 ? 301 NAG B C5 1 HETATM 13154 C C6 . NAG Z 4 . ? 65.071 -12.014 -33.689 1.00 132.48 ? 301 NAG B C6 1 HETATM 13155 C C7 . NAG Z 4 . ? 64.144 -10.543 -27.722 1.00 137.16 ? 301 NAG B C7 1 HETATM 13156 C C8 . NAG Z 4 . ? 63.962 -10.107 -26.301 1.00 138.88 ? 301 NAG B C8 1 HETATM 13157 N N2 . NAG Z 4 . ? 64.578 -9.599 -28.577 1.00 130.24 ? 301 NAG B N2 1 HETATM 13158 O O3 . NAG Z 4 . ? 62.565 -9.124 -30.572 1.00 128.35 ? 301 NAG B O3 1 HETATM 13159 O O4 . NAG Z 4 . ? 62.483 -11.096 -32.686 1.00 132.64 ? 301 NAG B O4 1 HETATM 13160 O O5 . NAG Z 4 . ? 65.974 -11.157 -31.672 1.00 116.36 ? 301 NAG B O5 1 HETATM 13161 O O6 . NAG Z 4 . ? 64.809 -10.940 -34.582 1.00 135.52 ? 301 NAG B O6 1 HETATM 13162 O O7 . NAG Z 4 . ? 63.926 -11.703 -28.075 1.00 139.51 ? 301 NAG B O7 1 HETATM 13163 S S . SO4 AA 3 . ? 77.462 -2.360 -8.255 1.00 47.87 ? 302 SO4 B S 1 HETATM 13164 O O1 . SO4 AA 3 . ? 78.096 -2.992 -9.413 1.00 46.87 ? 302 SO4 B O1 1 HETATM 13165 O O2 . SO4 AA 3 . ? 76.291 -1.595 -8.683 1.00 48.68 ? 302 SO4 B O2 1 HETATM 13166 O O3 . SO4 AA 3 . ? 78.416 -1.466 -7.606 1.00 45.30 ? 302 SO4 B O3 1 HETATM 13167 O O4 . SO4 AA 3 . ? 77.043 -3.394 -7.313 1.00 42.70 ? 302 SO4 B O4 1 HETATM 13168 S S . SO4 BA 3 . ? 89.924 -23.423 -22.164 1.00 80.57 ? 303 SO4 B S 1 HETATM 13169 O O1 . SO4 BA 3 . ? 89.484 -22.411 -23.121 1.00 81.75 ? 303 SO4 B O1 1 HETATM 13170 O O2 . SO4 BA 3 . ? 89.849 -24.745 -22.780 1.00 88.04 ? 303 SO4 B O2 1 HETATM 13171 O O3 . SO4 BA 3 . ? 89.055 -23.394 -20.990 1.00 74.37 ? 303 SO4 B O3 1 HETATM 13172 O O4 . SO4 BA 3 . ? 91.303 -23.146 -21.769 1.00 80.04 ? 303 SO4 B O4 1 HETATM 13173 S S . SO4 CA 3 . ? 87.621 -38.656 -41.447 1.00 62.53 ? 304 SO4 B S 1 HETATM 13174 O O1 . SO4 CA 3 . ? 88.987 -39.171 -41.401 1.00 74.10 ? 304 SO4 B O1 1 HETATM 13175 O O2 . SO4 CA 3 . ? 87.136 -38.695 -42.823 1.00 68.68 ? 304 SO4 B O2 1 HETATM 13176 O O3 . SO4 CA 3 . ? 87.611 -37.280 -40.962 1.00 59.45 ? 304 SO4 B O3 1 HETATM 13177 O O4 . SO4 CA 3 . ? 86.757 -39.480 -40.604 1.00 60.26 ? 304 SO4 B O4 1 HETATM 13178 S S . SO4 DA 3 . ? 66.163 -28.101 -39.602 1.00 88.03 ? 305 SO4 B S 1 HETATM 13179 O O1 . SO4 DA 3 . ? 66.464 -27.948 -41.024 1.00 78.88 ? 305 SO4 B O1 1 HETATM 13180 O O2 . SO4 DA 3 . ? 65.240 -29.218 -39.413 1.00 89.09 ? 305 SO4 B O2 1 HETATM 13181 O O3 . SO4 DA 3 . ? 67.396 -28.358 -38.862 1.00 84.65 ? 305 SO4 B O3 1 HETATM 13182 O O4 . SO4 DA 3 . ? 65.545 -26.877 -39.097 1.00 93.17 ? 305 SO4 B O4 1 HETATM 13183 S S . SO4 EA 3 . ? 79.272 -25.229 -39.838 1.00 91.08 ? 306 SO4 B S 1 HETATM 13184 O O1 . SO4 EA 3 . ? 80.398 -25.367 -40.758 1.00 93.06 ? 306 SO4 B O1 1 HETATM 13185 O O2 . SO4 EA 3 . ? 78.177 -26.090 -40.269 1.00 86.15 ? 306 SO4 B O2 1 HETATM 13186 O O3 . SO4 EA 3 . ? 79.682 -25.628 -38.492 1.00 94.81 ? 306 SO4 B O3 1 HETATM 13187 O O4 . SO4 EA 3 . ? 78.831 -23.837 -39.832 1.00 91.38 ? 306 SO4 B O4 1 HETATM 13188 S S . SO4 FA 3 . ? 69.902 -12.930 -0.658 1.00 89.28 ? 307 SO4 B S 1 HETATM 13189 O O1 . SO4 FA 3 . ? 71.258 -12.851 -1.194 1.00 88.62 ? 307 SO4 B O1 1 HETATM 13190 O O2 . SO4 FA 3 . ? 69.113 -11.808 -1.161 1.00 87.10 ? 307 SO4 B O2 1 HETATM 13191 O O3 . SO4 FA 3 . ? 69.280 -14.186 -1.072 1.00 85.69 ? 307 SO4 B O3 1 HETATM 13192 O O4 . SO4 FA 3 . ? 69.958 -12.872 0.800 1.00 94.24 ? 307 SO4 B O4 1 HETATM 13193 S S . SO4 GA 3 . ? 52.338 -9.234 -18.339 1.00 91.20 ? 308 SO4 B S 1 HETATM 13194 O O1 . SO4 GA 3 . ? 53.598 -8.943 -19.019 1.00 89.05 ? 308 SO4 B O1 1 HETATM 13195 O O2 . SO4 GA 3 . ? 51.575 -10.207 -19.118 1.00 94.71 ? 308 SO4 B O2 1 HETATM 13196 O O3 . SO4 GA 3 . ? 52.616 -9.780 -17.013 1.00 92.66 ? 308 SO4 B O3 1 HETATM 13197 O O4 . SO4 GA 3 . ? 51.565 -8.003 -18.204 1.00 91.59 ? 308 SO4 B O4 1 HETATM 13198 S S . SO4 HA 3 . ? 69.533 -0.570 -6.040 1.00 86.20 ? 309 SO4 B S 1 HETATM 13199 O O1 . SO4 HA 3 . ? 70.545 0.306 -6.629 1.00 89.20 ? 309 SO4 B O1 1 HETATM 13200 O O2 . SO4 HA 3 . ? 68.238 -0.309 -6.662 1.00 83.82 ? 309 SO4 B O2 1 HETATM 13201 O O3 . SO4 HA 3 . ? 69.911 -1.964 -6.265 1.00 87.14 ? 309 SO4 B O3 1 HETATM 13202 O O4 . SO4 HA 3 . ? 69.439 -0.317 -4.604 1.00 86.26 ? 309 SO4 B O4 1 HETATM 13203 S S . SO4 IA 3 . ? 57.825 -36.266 -0.551 1.00 39.34 ? 301 SO4 C S 1 HETATM 13204 O O1 . SO4 IA 3 . ? 57.518 -36.600 -1.941 1.00 38.63 ? 301 SO4 C O1 1 HETATM 13205 O O2 . SO4 IA 3 . ? 59.199 -35.771 -0.486 1.00 43.19 ? 301 SO4 C O2 1 HETATM 13206 O O3 . SO4 IA 3 . ? 57.676 -37.445 0.295 1.00 41.16 ? 301 SO4 C O3 1 HETATM 13207 O O4 . SO4 IA 3 . ? 56.906 -35.236 -0.068 1.00 42.35 ? 301 SO4 C O4 1 HETATM 13208 S S . SO4 JA 3 . ? 67.663 -30.721 6.649 1.00 90.06 ? 302 SO4 C S 1 HETATM 13209 O O1 . SO4 JA 3 . ? 68.226 -31.365 5.466 1.00 93.41 ? 302 SO4 C O1 1 HETATM 13210 O O2 . SO4 JA 3 . ? 68.019 -29.303 6.657 1.00 88.32 ? 302 SO4 C O2 1 HETATM 13211 O O3 . SO4 JA 3 . ? 68.196 -31.359 7.849 1.00 92.73 ? 302 SO4 C O3 1 HETATM 13212 O O4 . SO4 JA 3 . ? 66.210 -30.864 6.626 1.00 86.40 ? 302 SO4 C O4 1 HETATM 13213 S S . SO4 KA 3 . ? 2.296 -20.258 9.269 1.00 112.85 ? 303 SO4 C S 1 HETATM 13214 O O1 . SO4 KA 3 . ? 2.717 -21.440 8.522 1.00 111.04 ? 303 SO4 C O1 1 HETATM 13215 O O2 . SO4 KA 3 . ? 0.916 -19.928 8.922 1.00 115.52 ? 303 SO4 C O2 1 HETATM 13216 O O3 . SO4 KA 3 . ? 2.384 -20.531 10.701 1.00 111.35 ? 303 SO4 C O3 1 HETATM 13217 O O4 . SO4 KA 3 . ? 3.165 -19.134 8.931 1.00 113.35 ? 303 SO4 C O4 1 HETATM 13218 C C1 . NAG LA 4 . ? 38.251 -31.281 -19.557 1.00 77.74 ? 301 NAG D C1 1 HETATM 13219 C C2 . NAG LA 4 . ? 38.746 -31.781 -20.905 1.00 86.88 ? 301 NAG D C2 1 HETATM 13220 C C3 . NAG LA 4 . ? 38.032 -31.045 -22.045 1.00 97.42 ? 301 NAG D C3 1 HETATM 13221 C C4 . NAG LA 4 . ? 36.520 -31.080 -21.865 1.00 102.12 ? 301 NAG D C4 1 HETATM 13222 C C5 . NAG LA 4 . ? 36.149 -30.586 -20.470 1.00 100.57 ? 301 NAG D C5 1 HETATM 13223 C C6 . NAG LA 4 . ? 34.667 -30.657 -20.182 1.00 100.68 ? 301 NAG D C6 1 HETATM 13224 C C7 . NAG LA 4 . ? 40.872 -30.496 -20.973 1.00 95.22 ? 301 NAG D C7 1 HETATM 13225 C C8 . NAG LA 4 . ? 42.355 -30.611 -21.138 1.00 93.44 ? 301 NAG D C8 1 HETATM 13226 N N2 . NAG LA 4 . ? 40.186 -31.653 -21.024 1.00 88.57 ? 301 NAG D N2 1 HETATM 13227 O O3 . NAG LA 4 . ? 38.383 -31.641 -23.290 1.00 102.48 ? 301 NAG D O3 1 HETATM 13228 O O4 . NAG LA 4 . ? 35.894 -30.256 -22.844 1.00 105.23 ? 301 NAG D O4 1 HETATM 13229 O O5 . NAG LA 4 . ? 36.814 -31.391 -19.481 1.00 91.97 ? 301 NAG D O5 1 HETATM 13230 O O6 . NAG LA 4 . ? 34.277 -31.968 -19.798 1.00 97.82 ? 301 NAG D O6 1 HETATM 13231 O O7 . NAG LA 4 . ? 40.322 -29.412 -20.806 1.00 101.89 ? 301 NAG D O7 1 HETATM 13232 S S . SO4 MA 3 . ? 56.081 -18.391 -17.078 1.00 37.37 ? 302 SO4 D S 1 HETATM 13233 O O1 . SO4 MA 3 . ? 56.739 -17.737 -18.207 1.00 45.21 ? 302 SO4 D O1 1 HETATM 13234 O O2 . SO4 MA 3 . ? 54.688 -17.956 -17.024 1.00 35.91 ? 302 SO4 D O2 1 HETATM 13235 O O3 . SO4 MA 3 . ? 56.759 -18.022 -15.835 1.00 42.85 ? 302 SO4 D O3 1 HETATM 13236 O O4 . SO4 MA 3 . ? 56.150 -19.841 -17.256 1.00 38.45 ? 302 SO4 D O4 1 HETATM 13237 S S . SO4 NA 3 . ? 41.077 18.512 -0.086 1.00 46.52 ? 301 SO4 E S 1 HETATM 13238 O O1 . SO4 NA 3 . ? 41.123 18.998 -1.461 1.00 49.19 ? 301 SO4 E O1 1 HETATM 13239 O O2 . SO4 NA 3 . ? 39.829 17.782 0.126 1.00 48.49 ? 301 SO4 E O2 1 HETATM 13240 O O3 . SO4 NA 3 . ? 41.148 19.638 0.839 1.00 42.36 ? 301 SO4 E O3 1 HETATM 13241 O O4 . SO4 NA 3 . ? 42.214 17.625 0.150 1.00 51.94 ? 301 SO4 E O4 1 HETATM 13242 S S . SO4 OA 3 . ? 39.449 14.055 -6.190 1.00 85.11 ? 302 SO4 E S 1 HETATM 13243 O O1 . SO4 OA 3 . ? 40.271 13.383 -7.194 1.00 76.46 ? 302 SO4 E O1 1 HETATM 13244 O O2 . SO4 OA 3 . ? 38.354 14.758 -6.852 1.00 94.15 ? 302 SO4 E O2 1 HETATM 13245 O O3 . SO4 OA 3 . ? 38.897 13.073 -5.262 1.00 83.08 ? 302 SO4 E O3 1 HETATM 13246 O O4 . SO4 OA 3 . ? 40.262 15.019 -5.453 1.00 85.64 ? 302 SO4 E O4 1 HETATM 13247 C C1 . NAG PA 4 . ? 61.902 15.133 -17.851 1.00 94.74 ? 301 NAG F C1 1 HETATM 13248 C C2 . NAG PA 4 . ? 61.543 15.496 -19.280 1.00 109.81 ? 301 NAG F C2 1 HETATM 13249 C C3 . NAG PA 4 . ? 62.418 14.714 -20.253 1.00 114.62 ? 301 NAG F C3 1 HETATM 13250 C C4 . NAG PA 4 . ? 63.890 14.918 -19.923 1.00 116.15 ? 301 NAG F C4 1 HETATM 13251 C C5 . NAG PA 4 . ? 64.154 14.627 -18.447 1.00 112.58 ? 301 NAG F C5 1 HETATM 13252 C C6 . NAG PA 4 . ? 65.561 14.979 -18.022 1.00 118.06 ? 301 NAG F C6 1 HETATM 13253 C C7 . NAG PA 4 . ? 59.503 14.092 -19.438 1.00 124.22 ? 301 NAG F C7 1 HETATM 13254 C C8 . NAG PA 4 . ? 58.040 14.103 -19.782 1.00 126.23 ? 301 NAG F C8 1 HETATM 13255 N N2 . NAG PA 4 . ? 60.133 15.269 -19.553 1.00 117.90 ? 301 NAG F N2 1 HETATM 13256 O O3 . NAG PA 4 . ? 62.166 15.127 -21.590 1.00 117.69 ? 301 NAG F O3 1 HETATM 13257 O O4 . NAG PA 4 . ? 64.684 14.051 -20.725 1.00 118.52 ? 301 NAG F O4 1 HETATM 13258 O O5 . NAG PA 4 . ? 63.270 15.401 -17.621 1.00 102.57 ? 301 NAG F O5 1 HETATM 13259 O O6 . NAG PA 4 . ? 65.770 16.384 -17.984 1.00 120.28 ? 301 NAG F O6 1 HETATM 13260 O O7 . NAG PA 4 . ? 60.077 13.070 -19.069 1.00 128.73 ? 301 NAG F O7 1 HETATM 13261 S S . SO4 QA 3 . ? 44.348 1.723 -16.963 1.00 33.95 ? 302 SO4 F S 1 HETATM 13262 O O1 . SO4 QA 3 . ? 43.719 1.127 -18.141 1.00 32.73 ? 302 SO4 F O1 1 HETATM 13263 O O2 . SO4 QA 3 . ? 45.758 1.344 -16.926 1.00 36.03 ? 302 SO4 F O2 1 HETATM 13264 O O3 . SO4 QA 3 . ? 43.684 1.250 -15.750 1.00 33.00 ? 302 SO4 F O3 1 HETATM 13265 O O4 . SO4 QA 3 . ? 44.229 3.179 -17.024 1.00 36.03 ? 302 SO4 F O4 1 HETATM 13266 S S . SO4 RA 3 . ? 49.968 -8.282 -5.018 1.00 84.26 ? 303 SO4 F S 1 HETATM 13267 O O1 . SO4 RA 3 . ? 50.013 -9.187 -6.165 1.00 81.20 ? 303 SO4 F O1 1 HETATM 13268 O O2 . SO4 RA 3 . ? 49.664 -6.925 -5.461 1.00 71.73 ? 303 SO4 F O2 1 HETATM 13269 O O3 . SO4 RA 3 . ? 48.931 -8.738 -4.099 1.00 87.09 ? 303 SO4 F O3 1 HETATM 13270 O O4 . SO4 RA 3 . ? 51.261 -8.290 -4.338 1.00 90.21 ? 303 SO4 F O4 1 HETATM 13271 S S . SO4 SA 3 . ? 55.281 18.537 9.959 1.00 75.82 ? 304 SO4 F S 1 HETATM 13272 O O1 . SO4 SA 3 . ? 54.450 19.683 10.322 1.00 78.21 ? 304 SO4 F O1 1 HETATM 13273 O O2 . SO4 SA 3 . ? 55.484 18.523 8.513 1.00 74.06 ? 304 SO4 F O2 1 HETATM 13274 O O3 . SO4 SA 3 . ? 54.623 17.299 10.363 1.00 82.74 ? 304 SO4 F O3 1 HETATM 13275 O O4 . SO4 SA 3 . ? 56.568 18.630 10.642 1.00 76.22 ? 304 SO4 F O4 1 HETATM 13276 S S . SO4 TA 3 . ? 80.125 17.516 -8.554 1.00 74.40 ? 305 SO4 F S 1 HETATM 13277 O O1 . SO4 TA 3 . ? 81.125 16.762 -9.304 1.00 81.75 ? 305 SO4 F O1 1 HETATM 13278 O O2 . SO4 TA 3 . ? 79.573 18.563 -9.409 1.00 75.11 ? 305 SO4 F O2 1 HETATM 13279 O O3 . SO4 TA 3 . ? 79.059 16.616 -8.126 1.00 72.16 ? 305 SO4 F O3 1 HETATM 13280 O O4 . SO4 TA 3 . ? 80.749 18.116 -7.381 1.00 73.44 ? 305 SO4 F O4 1 HETATM 13281 S S . SO4 UA 3 . ? 93.786 -1.385 4.795 1.00 99.11 ? 306 SO4 F S 1 HETATM 13282 O O1 . SO4 UA 3 . ? 94.904 -2.288 4.532 1.00 104.46 ? 306 SO4 F O1 1 HETATM 13283 O O2 . SO4 UA 3 . ? 93.855 -0.249 3.879 1.00 99.96 ? 306 SO4 F O2 1 HETATM 13284 O O3 . SO4 UA 3 . ? 93.858 -0.909 6.175 1.00 96.21 ? 306 SO4 F O3 1 HETATM 13285 O O4 . SO4 UA 3 . ? 92.527 -2.100 4.594 1.00 94.11 ? 306 SO4 F O4 1 HETATM 13286 S S . SO4 VA 3 . ? 90.074 -3.583 -2.051 1.00 83.46 ? 307 SO4 F S 1 HETATM 13287 O O1 . SO4 VA 3 . ? 90.759 -3.546 -3.340 1.00 80.29 ? 307 SO4 F O1 1 HETATM 13288 O O2 . SO4 VA 3 . ? 88.896 -2.723 -2.122 1.00 84.51 ? 307 SO4 F O2 1 HETATM 13289 O O3 . SO4 VA 3 . ? 89.669 -4.952 -1.742 1.00 81.63 ? 307 SO4 F O3 1 HETATM 13290 O O4 . SO4 VA 3 . ? 90.972 -3.106 -1.001 1.00 85.12 ? 307 SO4 F O4 1 HETATM 13291 O O . HOH WA 5 . ? 20.445 -8.251 -14.355 1.00 27.29 ? 401 HOH L O 1 HETATM 13292 O O . HOH WA 5 . ? 14.471 30.364 -15.989 1.00 26.20 ? 402 HOH L O 1 HETATM 13293 O O . HOH WA 5 . ? 8.466 -0.241 -4.591 1.00 22.67 ? 403 HOH L O 1 HETATM 13294 O O . HOH WA 5 . ? 8.785 7.369 2.973 1.00 27.64 ? 404 HOH L O 1 HETATM 13295 O O . HOH WA 5 . ? 15.296 22.254 -38.148 1.00 38.84 ? 405 HOH L O 1 HETATM 13296 O O . HOH WA 5 . ? -0.172 31.353 -28.266 1.00 25.40 ? 406 HOH L O 1 HETATM 13297 O O . HOH WA 5 . ? 18.189 12.588 -2.717 1.00 25.26 ? 407 HOH L O 1 HETATM 13298 O O . HOH WA 5 . ? 12.921 21.537 -18.636 1.00 31.40 ? 408 HOH L O 1 HETATM 13299 O O . HOH WA 5 . ? 12.627 4.277 5.316 1.00 36.88 ? 409 HOH L O 1 HETATM 13300 O O . HOH WA 5 . ? 0.681 27.645 -18.653 1.00 27.12 ? 410 HOH L O 1 HETATM 13301 O O . HOH WA 5 . ? 15.827 -14.104 -15.714 1.00 37.22 ? 411 HOH L O 1 HETATM 13302 O O . HOH WA 5 . ? 17.647 18.381 -7.064 1.00 34.27 ? 412 HOH L O 1 HETATM 13303 O O . HOH WA 5 . ? 6.649 24.160 -23.015 1.00 31.41 ? 413 HOH L O 1 HETATM 13304 O O . HOH WA 5 . ? 17.521 28.610 -37.172 1.00 35.69 ? 414 HOH L O 1 HETATM 13305 O O . HOH WA 5 . ? 15.960 32.563 -13.257 1.00 31.68 ? 415 HOH L O 1 HETATM 13306 O O . HOH WA 5 . ? 4.574 12.523 4.857 1.00 30.19 ? 416 HOH L O 1 HETATM 13307 O O . HOH WA 5 . ? 10.064 13.023 7.567 1.00 29.77 ? 417 HOH L O 1 HETATM 13308 O O . HOH WA 5 . ? 2.280 22.868 -11.408 1.00 44.29 ? 418 HOH L O 1 HETATM 13309 O O . HOH WA 5 . ? 2.321 34.838 -44.792 1.00 30.40 ? 419 HOH L O 1 HETATM 13310 O O . HOH WA 5 . ? 1.605 3.330 -13.040 1.00 32.31 ? 420 HOH L O 1 HETATM 13311 O O . HOH WA 5 . ? 10.808 0.876 2.526 1.00 26.28 ? 421 HOH L O 1 HETATM 13312 O O . HOH WA 5 . ? 17.509 13.236 -15.505 1.00 51.34 ? 422 HOH L O 1 HETATM 13313 O O . HOH WA 5 . ? 6.059 45.455 -28.069 1.00 48.94 ? 423 HOH L O 1 HETATM 13314 O O . HOH WA 5 . ? 14.897 21.462 -24.845 1.00 33.32 ? 424 HOH L O 1 HETATM 13315 O O . HOH WA 5 . ? 1.440 -4.402 -4.408 1.00 38.87 ? 425 HOH L O 1 HETATM 13316 O O . HOH WA 5 . ? 19.599 11.286 -0.788 1.00 32.38 ? 426 HOH L O 1 HETATM 13317 O O . HOH WA 5 . ? 2.592 17.234 1.002 1.00 29.76 ? 427 HOH L O 1 HETATM 13318 O O . HOH WA 5 . ? 19.620 8.979 -2.625 1.00 31.90 ? 428 HOH L O 1 HETATM 13319 O O . HOH WA 5 . ? 20.880 36.044 -37.201 1.00 27.43 ? 429 HOH L O 1 HETATM 13320 O O . HOH WA 5 . ? 14.079 20.738 -14.406 1.00 38.40 ? 430 HOH L O 1 HETATM 13321 O O . HOH WA 5 . ? 17.429 16.975 -10.685 1.00 36.60 ? 431 HOH L O 1 HETATM 13322 O O . HOH WA 5 . ? 2.394 38.549 -38.723 1.00 25.50 ? 432 HOH L O 1 HETATM 13323 O O . HOH WA 5 . ? 13.721 26.587 -36.524 1.00 23.92 ? 433 HOH L O 1 HETATM 13324 O O . HOH WA 5 . ? 17.618 36.181 -34.887 1.00 31.85 ? 434 HOH L O 1 HETATM 13325 O O . HOH WA 5 . ? 15.605 42.593 -41.100 1.00 36.21 ? 435 HOH L O 1 HETATM 13326 O O . HOH WA 5 . ? 8.494 24.239 2.170 1.00 26.32 ? 436 HOH L O 1 HETATM 13327 O O . HOH WA 5 . ? 1.648 27.124 -8.792 1.00 44.33 ? 437 HOH L O 1 HETATM 13328 O O . HOH WA 5 . ? 22.197 11.006 -10.808 1.00 24.54 ? 438 HOH L O 1 HETATM 13329 O O . HOH WA 5 . ? -3.285 31.352 -40.376 1.00 35.37 ? 439 HOH L O 1 HETATM 13330 O O . HOH WA 5 . ? 15.600 14.684 -14.299 1.00 33.01 ? 440 HOH L O 1 HETATM 13331 O O . HOH WA 5 . ? 9.994 7.076 5.706 1.00 40.15 ? 441 HOH L O 1 HETATM 13332 O O . HOH WA 5 . ? 12.941 15.851 4.918 1.00 37.80 ? 442 HOH L O 1 HETATM 13333 O O . HOH WA 5 . ? 14.797 27.445 -30.221 1.00 31.29 ? 443 HOH L O 1 HETATM 13334 O O . HOH WA 5 . ? 10.686 21.782 -31.092 1.00 35.09 ? 444 HOH L O 1 HETATM 13335 O O . HOH WA 5 . ? 5.961 44.211 -30.216 1.00 30.56 ? 445 HOH L O 1 HETATM 13336 O O . HOH WA 5 . ? 7.490 27.067 -31.292 1.00 49.15 ? 446 HOH L O 1 HETATM 13337 O O . HOH WA 5 . ? 14.897 -8.433 -5.564 1.00 38.04 ? 447 HOH L O 1 HETATM 13338 O O . HOH WA 5 . ? 9.606 47.082 -36.528 1.00 42.64 ? 448 HOH L O 1 HETATM 13339 O O . HOH WA 5 . ? 13.107 12.680 -17.035 1.00 41.51 ? 449 HOH L O 1 HETATM 13340 O O . HOH WA 5 . ? 23.310 5.577 -0.904 1.00 28.67 ? 450 HOH L O 1 HETATM 13341 O O . HOH WA 5 . ? -3.643 36.882 -36.392 1.00 50.60 ? 451 HOH L O 1 HETATM 13342 O O . HOH WA 5 . ? 17.217 35.588 -14.552 1.00 42.87 ? 452 HOH L O 1 HETATM 13343 O O . HOH WA 5 . ? 25.322 5.698 -8.908 1.00 36.02 ? 453 HOH L O 1 HETATM 13344 O O . HOH WA 5 . ? 5.543 22.217 1.806 1.00 38.74 ? 454 HOH L O 1 HETATM 13345 O O . HOH WA 5 . ? 26.796 40.510 -36.909 1.00 48.69 ? 455 HOH L O 1 HETATM 13346 O O . HOH WA 5 . ? 1.379 14.911 -11.444 1.00 28.83 ? 456 HOH L O 1 HETATM 13347 O O . HOH WA 5 . ? 6.421 3.066 1.953 1.00 42.84 ? 457 HOH L O 1 HETATM 13348 O O . HOH WA 5 . ? 6.252 27.192 -36.840 1.00 27.71 ? 458 HOH L O 1 HETATM 13349 O O . HOH WA 5 . ? 3.296 20.488 3.127 1.00 46.08 ? 459 HOH L O 1 HETATM 13350 O O . HOH WA 5 . ? 17.876 27.992 -28.304 1.00 31.18 ? 460 HOH L O 1 HETATM 13351 O O . HOH WA 5 . ? 9.146 -1.629 -19.037 1.00 29.84 ? 461 HOH L O 1 HETATM 13352 O O . HOH WA 5 . ? 20.912 18.343 -6.743 1.00 48.90 ? 462 HOH L O 1 HETATM 13353 O O . HOH WA 5 . ? -0.535 -3.271 -18.498 1.00 45.85 ? 463 HOH L O 1 HETATM 13354 O O . HOH WA 5 . ? 0.975 38.991 -15.974 1.00 56.05 ? 464 HOH L O 1 HETATM 13355 O O . HOH WA 5 . ? 5.956 1.257 -20.628 1.00 51.99 ? 465 HOH L O 1 HETATM 13356 O O . HOH WA 5 . ? 20.216 37.035 -52.909 1.00 42.35 ? 466 HOH L O 1 HETATM 13357 O O . HOH WA 5 . ? 6.911 6.454 -10.886 1.00 36.67 ? 467 HOH L O 1 HETATM 13358 O O . HOH WA 5 . ? 19.605 -9.896 -12.436 1.00 30.55 ? 468 HOH L O 1 HETATM 13359 O O . HOH WA 5 . ? 22.719 4.745 -3.817 1.00 36.52 ? 469 HOH L O 1 HETATM 13360 O O . HOH WA 5 . ? 15.759 20.719 -20.703 1.00 42.45 ? 470 HOH L O 1 HETATM 13361 O O . HOH WA 5 . ? 8.811 -13.529 -9.933 1.00 40.79 ? 471 HOH L O 1 HETATM 13362 O O . HOH WA 5 . ? -1.023 37.840 -32.667 1.00 40.25 ? 472 HOH L O 1 HETATM 13363 O O . HOH WA 5 . ? 20.626 13.445 -4.175 1.00 45.63 ? 473 HOH L O 1 HETATM 13364 O O . HOH WA 5 . ? 8.527 11.363 -17.467 1.00 48.69 ? 474 HOH L O 1 HETATM 13365 O O . HOH WA 5 . ? 1.823 17.489 -9.639 1.00 47.21 ? 475 HOH L O 1 HETATM 13366 O O . HOH WA 5 . ? 5.023 23.781 -36.055 1.00 44.32 ? 476 HOH L O 1 HETATM 13367 O O . HOH WA 5 . ? 14.901 44.631 -45.592 1.00 55.54 ? 477 HOH L O 1 HETATM 13368 O O . HOH WA 5 . ? 1.217 -2.062 -20.219 1.00 44.56 ? 478 HOH L O 1 HETATM 13369 O O . HOH WA 5 . ? -3.941 32.649 -42.412 1.00 36.26 ? 479 HOH L O 1 HETATM 13370 O O . HOH WA 5 . ? 17.776 -14.204 -14.335 1.00 47.77 ? 480 HOH L O 1 HETATM 13371 O O . HOH WA 5 . ? 9.513 36.759 -15.974 1.00 45.39 ? 481 HOH L O 1 HETATM 13372 O O . HOH WA 5 . ? 1.073 30.666 -45.374 0.50 27.29 ? 482 HOH L O 1 HETATM 13373 O O . HOH WA 5 . ? 27.743 9.930 -12.578 1.00 35.29 ? 483 HOH L O 1 HETATM 13374 O O . HOH WA 5 . ? 7.811 23.319 -36.363 1.00 37.95 ? 484 HOH L O 1 HETATM 13375 O O . HOH WA 5 . ? 15.929 17.052 -12.632 1.00 33.30 ? 485 HOH L O 1 HETATM 13376 O O . HOH WA 5 . ? 16.323 42.771 -44.224 1.00 38.88 ? 486 HOH L O 1 HETATM 13377 O O . HOH WA 5 . ? 12.902 38.584 -17.516 1.00 51.60 ? 487 HOH L O 1 HETATM 13378 O O . HOH WA 5 . ? 16.022 25.420 -35.087 1.00 32.80 ? 488 HOH L O 1 HETATM 13379 O O . HOH WA 5 . ? 4.235 28.628 -35.166 1.00 34.96 ? 489 HOH L O 1 HETATM 13380 O O . HOH WA 5 . ? 15.904 28.026 -16.180 1.00 42.27 ? 490 HOH L O 1 HETATM 13381 O O . HOH WA 5 . ? 0.689 39.479 -36.648 1.00 51.15 ? 491 HOH L O 1 HETATM 13382 O O . HOH WA 5 . ? 22.394 17.479 -12.752 1.00 36.01 ? 492 HOH L O 1 HETATM 13383 O O . HOH WA 5 . ? 12.332 14.121 7.420 1.00 52.11 ? 493 HOH L O 1 HETATM 13384 O O . HOH WA 5 . ? 3.228 32.251 -44.647 1.00 34.44 ? 494 HOH L O 1 HETATM 13385 O O . HOH WA 5 . ? 22.863 35.769 -49.115 1.00 65.64 ? 495 HOH L O 1 HETATM 13386 O O . HOH WA 5 . ? 11.408 -7.412 -0.093 1.00 35.68 ? 496 HOH L O 1 HETATM 13387 O O . HOH WA 5 . ? 11.736 1.895 5.033 1.00 45.48 ? 497 HOH L O 1 HETATM 13388 O O . HOH WA 5 . ? 21.252 -1.988 1.644 1.00 42.01 ? 498 HOH L O 1 HETATM 13389 O O . HOH WA 5 . ? 19.745 3.230 4.176 1.00 37.45 ? 499 HOH L O 1 HETATM 13390 O O . HOH WA 5 . ? 9.776 9.215 7.275 1.00 44.42 ? 500 HOH L O 1 HETATM 13391 O O . HOH WA 5 . ? 0.066 41.677 -26.754 1.00 34.78 ? 501 HOH L O 1 HETATM 13392 O O . HOH WA 5 . ? 20.740 13.225 2.519 1.00 28.13 ? 502 HOH L O 1 HETATM 13393 O O . HOH WA 5 . ? 11.492 -6.999 -17.565 1.00 35.86 ? 503 HOH L O 1 HETATM 13394 O O . HOH WA 5 . ? 23.267 11.285 -18.152 1.00 36.39 ? 504 HOH L O 1 HETATM 13395 O O . HOH WA 5 . ? 6.809 40.921 -21.958 1.00 44.06 ? 505 HOH L O 1 HETATM 13396 O O . HOH WA 5 . ? 5.517 22.988 -14.587 1.00 33.28 ? 506 HOH L O 1 HETATM 13397 O O . HOH WA 5 . ? 2.191 12.042 -4.529 1.00 45.33 ? 507 HOH L O 1 HETATM 13398 O O . HOH WA 5 . ? 1.458 7.897 -7.488 1.00 54.11 ? 508 HOH L O 1 HETATM 13399 O O . HOH WA 5 . ? 7.894 24.768 -32.440 1.00 44.14 ? 509 HOH L O 1 HETATM 13400 O O . HOH WA 5 . ? 22.265 42.891 -35.039 1.00 41.60 ? 510 HOH L O 1 HETATM 13401 O O . HOH WA 5 . ? 16.002 19.127 -14.144 1.00 46.46 ? 511 HOH L O 1 HETATM 13402 O O . HOH WA 5 . ? 25.311 9.335 -10.322 1.00 35.35 ? 512 HOH L O 1 HETATM 13403 O O . HOH WA 5 . ? 12.862 37.257 -51.891 1.00 39.42 ? 513 HOH L O 1 HETATM 13404 O O . HOH WA 5 . ? 13.282 17.839 -11.357 1.00 32.87 ? 514 HOH L O 1 HETATM 13405 O O . HOH WA 5 . ? 21.142 11.340 -8.291 1.00 36.17 ? 515 HOH L O 1 HETATM 13406 O O . HOH WA 5 . ? 22.183 -6.172 0.399 1.00 42.34 ? 516 HOH L O 1 HETATM 13407 O O . HOH WA 5 . ? 9.682 -11.685 -12.393 1.00 34.55 ? 517 HOH L O 1 HETATM 13408 O O . HOH WA 5 . ? 13.773 -7.301 1.712 1.00 38.34 ? 518 HOH L O 1 HETATM 13409 O O . HOH WA 5 . ? 12.718 24.528 -38.083 1.00 39.28 ? 519 HOH L O 1 HETATM 13410 O O . HOH WA 5 . ? 17.637 5.058 6.085 1.00 47.25 ? 520 HOH L O 1 HETATM 13411 O O . HOH WA 5 . ? -0.749 -5.112 -14.195 1.00 44.69 ? 521 HOH L O 1 HETATM 13412 O O . HOH WA 5 . ? 13.648 20.427 -11.401 1.00 44.84 ? 522 HOH L O 1 HETATM 13413 O O . HOH WA 5 . ? 8.673 -7.094 -0.059 1.00 48.72 ? 523 HOH L O 1 HETATM 13414 O O . HOH WA 5 . ? 18.324 -1.157 4.430 1.00 47.74 ? 524 HOH L O 1 HETATM 13415 O O . HOH WA 5 . ? 22.501 -2.316 4.281 1.00 44.11 ? 525 HOH L O 1 HETATM 13416 O O . HOH WA 5 . ? 11.159 22.406 -37.719 1.00 44.48 ? 526 HOH L O 1 HETATM 13417 O O . HOH WA 5 . ? 0.256 13.837 -9.365 1.00 46.95 ? 527 HOH L O 1 HETATM 13418 O O . HOH WA 5 . ? 17.000 22.225 -11.667 1.00 61.80 ? 528 HOH L O 1 HETATM 13419 O O . HOH WA 5 . ? 5.036 -3.893 1.771 1.00 42.06 ? 529 HOH L O 1 HETATM 13420 O O . HOH WA 5 . ? 0.950 -14.481 -14.675 1.00 47.84 ? 530 HOH L O 1 HETATM 13421 O O . HOH WA 5 . ? 25.911 29.844 -47.407 1.00 47.01 ? 531 HOH L O 1 HETATM 13422 O O . HOH WA 5 . ? 1.964 12.393 -6.947 1.00 54.85 ? 532 HOH L O 1 HETATM 13423 O O . HOH WA 5 . ? -0.650 39.959 -18.231 1.00 57.68 ? 533 HOH L O 1 HETATM 13424 O O . HOH WA 5 . ? 15.735 38.032 -51.682 1.00 49.23 ? 534 HOH L O 1 HETATM 13425 O O . HOH WA 5 . ? 22.767 41.045 -45.137 1.00 42.22 ? 535 HOH L O 1 HETATM 13426 O O . HOH WA 5 . ? 3.681 -5.546 0.139 1.00 62.91 ? 536 HOH L O 1 HETATM 13427 O O . HOH WA 5 . ? -0.345 7.877 -5.704 1.00 53.45 ? 537 HOH L O 1 HETATM 13428 O O . HOH WA 5 . ? 18.728 20.192 -13.712 1.00 47.80 ? 538 HOH L O 1 HETATM 13429 O O . HOH WA 5 . ? 0.446 -11.972 -13.710 1.00 53.33 ? 539 HOH L O 1 HETATM 13430 O O . HOH WA 5 . ? -0.695 -0.072 -16.875 1.00 52.24 ? 540 HOH L O 1 HETATM 13431 O O . HOH WA 5 . ? 12.527 25.825 -41.170 1.00 45.48 ? 541 HOH L O 1 HETATM 13432 O O . HOH WA 5 . ? 22.680 2.638 6.233 1.00 58.85 ? 542 HOH L O 1 HETATM 13433 O O . HOH WA 5 . ? 23.623 0.164 5.929 1.00 52.10 ? 543 HOH L O 1 HETATM 13434 O O . HOH WA 5 . ? 26.748 34.925 -42.937 1.00 44.60 ? 544 HOH L O 1 HETATM 13435 O O . HOH WA 5 . ? 9.544 35.516 -13.103 1.00 43.87 ? 545 HOH L O 1 HETATM 13436 O O . HOH WA 5 . ? 27.682 15.413 -16.745 1.00 49.12 ? 546 HOH L O 1 HETATM 13437 O O . HOH WA 5 . ? 18.122 28.664 -47.151 1.00 35.57 ? 547 HOH L O 1 HETATM 13438 O O . HOH WA 5 . ? 11.302 10.470 -17.938 1.00 50.19 ? 548 HOH L O 1 HETATM 13439 O O . HOH WA 5 . ? 4.646 39.507 -20.876 1.00 51.04 ? 549 HOH L O 1 HETATM 13440 O O . HOH WA 5 . ? 10.463 19.706 -15.108 1.00 50.53 ? 550 HOH L O 1 HETATM 13441 O O . HOH WA 5 . ? 19.161 24.090 -18.745 1.00 33.75 ? 551 HOH L O 1 HETATM 13442 O O . HOH WA 5 . ? -1.235 -11.009 -11.472 1.00 43.19 ? 552 HOH L O 1 HETATM 13443 O O . HOH WA 5 . ? 4.029 -6.057 3.275 1.00 57.84 ? 553 HOH L O 1 HETATM 13444 O O . HOH WA 5 . ? 3.575 -13.448 -13.691 1.00 43.45 ? 554 HOH L O 1 HETATM 13445 O O . HOH WA 5 . ? 2.791 15.554 -3.814 1.00 48.77 ? 555 HOH L O 1 HETATM 13446 O O . HOH WA 5 . ? -0.080 10.729 -4.910 1.00 52.22 ? 556 HOH L O 1 HETATM 13447 O O . HOH WA 5 . ? 7.003 24.631 -42.948 1.00 52.33 ? 557 HOH L O 1 HETATM 13448 O O . HOH WA 5 . ? 2.027 13.712 4.864 1.00 28.26 ? 558 HOH L O 1 HETATM 13449 O O . HOH WA 5 . ? 19.642 -14.143 -15.778 1.00 45.94 ? 559 HOH L O 1 HETATM 13450 O O . HOH WA 5 . ? 1.081 11.815 -1.936 1.00 48.52 ? 560 HOH L O 1 HETATM 13451 O O . HOH WA 5 . ? 11.055 -15.681 -5.921 1.00 54.12 ? 561 HOH L O 1 HETATM 13452 O O . HOH WA 5 . ? 16.638 11.342 -16.764 1.00 52.35 ? 562 HOH L O 1 HETATM 13453 O O . HOH WA 5 . ? 6.672 -2.417 2.866 1.00 58.97 ? 563 HOH L O 1 HETATM 13454 O O . HOH WA 5 . ? 7.205 -4.757 -0.108 1.00 56.70 ? 564 HOH L O 1 HETATM 13455 O O . HOH WA 5 . ? 23.401 13.987 -6.429 1.00 47.69 ? 565 HOH L O 1 HETATM 13456 O O . HOH WA 5 . ? 14.713 44.210 -39.318 1.00 45.41 ? 566 HOH L O 1 HETATM 13457 O O . HOH WA 5 . ? 18.452 40.801 -33.775 1.00 44.28 ? 567 HOH L O 1 HETATM 13458 O O . HOH WA 5 . ? -1.770 38.983 -28.154 1.00 42.13 ? 568 HOH L O 1 HETATM 13459 O O . HOH WA 5 . ? 13.574 45.166 -37.340 1.00 52.44 ? 569 HOH L O 1 HETATM 13460 O O . HOH WA 5 . ? 3.954 41.187 -47.033 1.00 47.20 ? 570 HOH L O 1 HETATM 13461 O O . HOH WA 5 . ? 12.652 42.660 -50.025 1.00 41.83 ? 571 HOH L O 1 HETATM 13462 O O . HOH WA 5 . ? 9.656 -2.319 -21.673 1.00 52.54 ? 572 HOH L O 1 HETATM 13463 O O . HOH WA 5 . ? 13.084 -14.543 -16.170 1.00 52.89 ? 573 HOH L O 1 HETATM 13464 O O . HOH WA 5 . ? 2.364 -1.842 -17.253 1.00 49.06 ? 574 HOH L O 1 HETATM 13465 O O . HOH WA 5 . ? 19.770 12.947 5.759 1.00 57.67 ? 575 HOH L O 1 HETATM 13466 O O . HOH WA 5 . ? 15.466 11.893 5.857 1.00 28.74 ? 576 HOH L O 1 HETATM 13467 O O . HOH WA 5 . ? 11.862 18.393 5.077 1.00 32.54 ? 577 HOH L O 1 HETATM 13468 O O . HOH WA 5 . ? 18.837 19.387 -0.486 1.00 41.18 ? 578 HOH L O 1 HETATM 13469 O O . HOH WA 5 . ? 22.731 12.289 -4.665 1.00 61.73 ? 579 HOH L O 1 HETATM 13470 O O . HOH WA 5 . ? 4.959 6.114 4.501 1.00 46.79 ? 580 HOH L O 1 HETATM 13471 O O . HOH WA 5 . ? 4.493 -12.170 -4.325 1.00 49.71 ? 581 HOH L O 1 HETATM 13472 O O . HOH WA 5 . ? 11.819 38.398 -9.527 1.00 53.79 ? 582 HOH L O 1 HETATM 13473 O O . HOH WA 5 . ? 19.182 19.005 -10.538 1.00 46.27 ? 583 HOH L O 1 HETATM 13474 O O . HOH WA 5 . ? 3.768 4.848 2.822 1.00 53.81 ? 584 HOH L O 1 HETATM 13475 O O . HOH WA 5 . ? 24.763 4.251 6.007 1.00 49.43 ? 585 HOH L O 1 HETATM 13476 O O . HOH WA 5 . ? 2.297 -10.766 -4.810 1.00 45.56 ? 586 HOH L O 1 HETATM 13477 O O . HOH WA 5 . ? 22.778 30.663 -42.644 1.00 34.14 ? 587 HOH L O 1 HETATM 13478 O O . HOH WA 5 . ? 17.778 15.163 6.729 1.00 38.14 ? 588 HOH L O 1 HETATM 13479 O O . HOH WA 5 . ? -2.584 33.466 -21.920 1.00 40.71 ? 589 HOH L O 1 HETATM 13480 O O . HOH WA 5 . ? 5.428 21.244 -20.807 1.00 54.69 ? 590 HOH L O 1 HETATM 13481 O O . HOH WA 5 . ? 23.315 26.378 -7.847 1.00 50.41 ? 591 HOH L O 1 HETATM 13482 O O . HOH WA 5 . ? 5.163 26.905 -33.036 1.00 57.30 ? 592 HOH L O 1 HETATM 13483 O O . HOH WA 5 . ? 24.793 8.546 3.420 1.00 43.56 ? 593 HOH L O 1 HETATM 13484 O O . HOH WA 5 . ? -0.638 -8.598 -6.530 1.00 49.88 ? 594 HOH L O 1 HETATM 13485 O O . HOH WA 5 . ? 0.230 -10.578 -7.628 1.00 52.89 ? 595 HOH L O 1 HETATM 13486 O O . HOH WA 5 . ? -0.746 7.705 -10.125 1.00 53.93 ? 596 HOH L O 1 HETATM 13487 O O . HOH WA 5 . ? 3.481 27.227 -42.683 1.00 40.90 ? 597 HOH L O 1 HETATM 13488 O O . HOH WA 5 . ? 22.220 30.599 -40.553 1.00 51.59 ? 598 HOH L O 1 HETATM 13489 O O . HOH WA 5 . ? 12.583 48.780 -38.778 1.00 45.40 ? 599 HOH L O 1 HETATM 13490 O O . HOH WA 5 . ? 16.032 15.786 -17.871 1.00 46.53 ? 600 HOH L O 1 HETATM 13491 O O . HOH WA 5 . ? 12.862 47.797 -40.864 1.00 46.11 ? 601 HOH L O 1 HETATM 13492 O O . HOH WA 5 . ? 18.640 1.516 5.695 1.00 47.85 ? 602 HOH L O 1 HETATM 13493 O O . HOH WA 5 . ? -3.149 31.369 -44.060 1.00 53.87 ? 603 HOH L O 1 HETATM 13494 O O . HOH WA 5 . ? 27.138 43.813 -34.921 1.00 55.48 ? 604 HOH L O 1 HETATM 13495 O O . HOH WA 5 . ? 6.454 31.797 -44.621 1.00 52.16 ? 605 HOH L O 1 HETATM 13496 O O . HOH WA 5 . ? 10.307 -12.438 -15.597 1.00 52.28 ? 606 HOH L O 1 HETATM 13497 O O . HOH WA 5 . ? 4.363 25.882 -28.207 1.00 29.29 ? 607 HOH L O 1 HETATM 13498 O O . HOH WA 5 . ? 15.068 -0.649 4.497 1.00 38.85 ? 608 HOH L O 1 HETATM 13499 O O . HOH WA 5 . ? 7.342 0.389 2.793 1.00 58.91 ? 609 HOH L O 1 HETATM 13500 O O . HOH WA 5 . ? 17.853 6.627 10.559 1.00 54.15 ? 610 HOH L O 1 HETATM 13501 O O . HOH WA 5 . ? 27.556 17.292 -9.165 1.00 66.85 ? 611 HOH L O 1 HETATM 13502 O O . HOH WA 5 . ? 17.441 36.073 -52.168 1.00 52.56 ? 612 HOH L O 1 HETATM 13503 O O . HOH WA 5 . ? 18.570 6.723 8.255 1.00 68.85 ? 613 HOH L O 1 HETATM 13504 O O . HOH WA 5 . ? 21.106 8.517 6.353 1.00 53.66 ? 614 HOH L O 1 HETATM 13505 O O . HOH XA 5 . ? 16.026 -2.715 -20.111 1.00 27.51 ? 401 HOH H O 1 HETATM 13506 O O . HOH XA 5 . ? 16.926 26.245 -31.061 1.00 47.26 ? 402 HOH H O 1 HETATM 13507 O O . HOH XA 5 . ? 18.551 28.630 -15.709 1.00 37.74 ? 403 HOH H O 1 HETATM 13508 O O . HOH XA 5 . ? 12.107 -1.263 -22.409 1.00 40.89 ? 404 HOH H O 1 HETATM 13509 O O . HOH XA 5 . ? 23.544 13.638 -34.366 1.00 27.34 ? 405 HOH H O 1 HETATM 13510 O O . HOH XA 5 . ? 28.063 -10.996 -6.031 1.00 24.20 ? 406 HOH H O 1 HETATM 13511 O O . HOH XA 5 . ? 19.235 -6.398 -12.601 1.00 28.89 ? 407 HOH H O 1 HETATM 13512 O O . HOH XA 5 . ? 29.296 33.964 -18.649 1.00 32.17 ? 408 HOH H O 1 HETATM 13513 O O . HOH XA 5 . ? 28.521 -15.072 -16.995 1.00 30.71 ? 409 HOH H O 1 HETATM 13514 O O . HOH XA 5 . ? 31.363 34.977 -12.220 1.00 32.20 ? 410 HOH H O 1 HETATM 13515 O O . HOH XA 5 . ? 23.488 -16.090 -5.670 1.00 33.53 ? 411 HOH H O 1 HETATM 13516 O O . HOH XA 5 . ? 17.347 -7.481 -4.992 1.00 24.34 ? 412 HOH H O 1 HETATM 13517 O O . HOH XA 5 . ? 41.027 -1.505 -14.292 1.00 33.88 ? 413 HOH H O 1 HETATM 13518 O O . HOH XA 5 . ? 17.852 29.216 -30.634 1.00 28.63 ? 414 HOH H O 1 HETATM 13519 O O . HOH XA 5 . ? 23.030 -12.575 -16.444 1.00 28.90 ? 415 HOH H O 1 HETATM 13520 O O . HOH XA 5 . ? 43.586 -4.474 -10.980 1.00 29.89 ? 416 HOH H O 1 HETATM 13521 O O . HOH XA 5 . ? 26.176 21.710 -27.368 1.00 40.26 ? 417 HOH H O 1 HETATM 13522 O O . HOH XA 5 . ? 30.194 29.154 -19.707 1.00 43.53 ? 418 HOH H O 1 HETATM 13523 O O . HOH XA 5 . ? 23.731 14.534 -37.026 1.00 27.60 ? 419 HOH H O 1 HETATM 13524 O O . HOH XA 5 . ? 31.541 4.751 -10.402 1.00 25.30 ? 420 HOH H O 1 HETATM 13525 O O . HOH XA 5 . ? 37.867 -5.008 -21.369 1.00 25.08 ? 421 HOH H O 1 HETATM 13526 O O . HOH XA 5 . ? 40.508 -3.860 -21.402 1.00 26.94 ? 422 HOH H O 1 HETATM 13527 O O . HOH XA 5 . ? 30.639 -2.590 -37.423 1.00 39.57 ? 423 HOH H O 1 HETATM 13528 O O . HOH XA 5 . ? 16.661 1.960 -25.726 1.00 45.78 ? 424 HOH H O 1 HETATM 13529 O O . HOH XA 5 . ? 20.582 10.217 -22.685 1.00 36.36 ? 425 HOH H O 1 HETATM 13530 O O . HOH XA 5 . ? 25.969 -1.831 -3.837 1.00 31.17 ? 426 HOH H O 1 HETATM 13531 O O . HOH XA 5 . ? 33.515 22.193 -27.599 1.00 44.90 ? 427 HOH H O 1 HETATM 13532 O O . HOH XA 5 . ? 21.114 0.563 -34.812 1.00 36.35 ? 428 HOH H O 1 HETATM 13533 O O . HOH XA 5 . ? 44.562 0.627 -23.567 1.00 40.79 ? 429 HOH H O 1 HETATM 13534 O O . HOH XA 5 . ? 30.200 42.182 -17.135 1.00 45.06 ? 430 HOH H O 1 HETATM 13535 O O . HOH XA 5 . ? 13.992 -0.643 -20.415 1.00 20.87 ? 431 HOH H O 1 HETATM 13536 O O . HOH XA 5 . ? 37.613 -7.076 -22.688 1.00 31.55 ? 432 HOH H O 1 HETATM 13537 O O . HOH XA 5 . ? 43.378 -1.144 -20.980 1.00 31.79 ? 433 HOH H O 1 HETATM 13538 O O . HOH XA 5 . ? 24.001 3.949 -6.912 1.00 26.76 ? 434 HOH H O 1 HETATM 13539 O O . HOH XA 5 . ? 21.697 9.914 -20.113 1.00 26.23 ? 435 HOH H O 1 HETATM 13540 O O . HOH XA 5 . ? 27.774 -7.131 -3.575 1.00 36.15 ? 436 HOH H O 1 HETATM 13541 O O . HOH XA 5 . ? 21.345 23.747 -40.553 1.00 38.80 ? 437 HOH H O 1 HETATM 13542 O O . HOH XA 5 . ? 31.946 -12.710 -24.613 1.00 42.41 ? 438 HOH H O 1 HETATM 13543 O O . HOH XA 5 . ? 41.949 0.541 -23.193 1.00 40.91 ? 439 HOH H O 1 HETATM 13544 O O . HOH XA 5 . ? 18.963 6.946 -30.373 1.00 30.09 ? 440 HOH H O 1 HETATM 13545 O O . HOH XA 5 . ? 28.951 7.584 -11.635 1.00 50.89 ? 441 HOH H O 1 HETATM 13546 O O . HOH XA 5 . ? 17.193 50.263 -16.824 1.00 49.41 ? 442 HOH H O 1 HETATM 13547 O O . HOH XA 5 . ? 16.180 9.638 -28.633 1.00 44.11 ? 443 HOH H O 1 HETATM 13548 O O . HOH XA 5 . ? 26.767 38.723 -13.254 1.00 43.01 ? 444 HOH H O 1 HETATM 13549 O O . HOH XA 5 . ? 23.478 -5.772 -7.302 1.00 36.44 ? 445 HOH H O 1 HETATM 13550 O O . HOH XA 5 . ? 22.905 28.664 -18.477 1.00 36.66 ? 446 HOH H O 1 HETATM 13551 O O . HOH XA 5 . ? 22.535 11.038 -34.958 1.00 37.61 ? 447 HOH H O 1 HETATM 13552 O O . HOH XA 5 . ? 27.887 45.420 -26.451 1.00 43.29 ? 448 HOH H O 1 HETATM 13553 O O . HOH XA 5 . ? 33.692 8.409 -21.688 1.00 46.89 ? 449 HOH H O 1 HETATM 13554 O O . HOH XA 5 . ? 26.043 29.287 -19.878 1.00 49.99 ? 450 HOH H O 1 HETATM 13555 O O . HOH XA 5 . ? 33.139 29.627 -24.038 1.00 42.36 ? 451 HOH H O 1 HETATM 13556 O O . HOH XA 5 . ? 31.815 10.799 -25.749 1.00 48.61 ? 452 HOH H O 1 HETATM 13557 O O . HOH XA 5 . ? 31.643 -19.742 -19.370 1.00 46.39 ? 453 HOH H O 1 HETATM 13558 O O . HOH XA 5 . ? 17.319 36.168 -17.118 1.00 31.95 ? 454 HOH H O 1 HETATM 13559 O O . HOH XA 5 . ? 30.561 -13.680 -5.168 1.00 50.44 ? 455 HOH H O 1 HETATM 13560 O O . HOH XA 5 . ? 22.193 40.241 -15.723 1.00 34.42 ? 456 HOH H O 1 HETATM 13561 O O . HOH XA 5 . ? 20.415 36.062 -34.743 1.00 37.14 ? 457 HOH H O 1 HETATM 13562 O O . HOH XA 5 . ? 40.447 -12.154 -19.517 1.00 35.24 ? 458 HOH H O 1 HETATM 13563 O O . HOH XA 5 . ? 27.602 3.682 -5.728 1.00 34.27 ? 459 HOH H O 1 HETATM 13564 O O . HOH XA 5 . ? 18.693 25.498 -28.496 1.00 35.79 ? 460 HOH H O 1 HETATM 13565 O O . HOH XA 5 . ? 37.660 0.934 -25.900 1.00 34.47 ? 461 HOH H O 1 HETATM 13566 O O . HOH XA 5 . ? 22.750 -16.206 -2.311 1.00 38.56 ? 462 HOH H O 1 HETATM 13567 O O . HOH XA 5 . ? 25.479 -4.394 -6.872 1.00 34.03 ? 463 HOH H O 1 HETATM 13568 O O . HOH XA 5 . ? 19.413 -12.870 -12.045 1.00 37.59 ? 464 HOH H O 1 HETATM 13569 O O . HOH XA 5 . ? 24.618 -11.010 -3.199 1.00 35.91 ? 465 HOH H O 1 HETATM 13570 O O . HOH XA 5 . ? 33.879 3.418 -30.030 1.00 33.86 ? 466 HOH H O 1 HETATM 13571 O O . HOH XA 5 . ? 30.473 34.072 -9.772 1.00 45.58 ? 467 HOH H O 1 HETATM 13572 O O . HOH XA 5 . ? 27.653 4.456 -8.502 1.00 33.99 ? 468 HOH H O 1 HETATM 13573 O O . HOH XA 5 . ? 43.186 -10.922 -19.633 1.00 30.34 ? 469 HOH H O 1 HETATM 13574 O O . HOH XA 5 . ? 31.172 4.884 -7.614 1.00 46.53 ? 470 HOH H O 1 HETATM 13575 O O . HOH XA 5 . ? 18.224 26.881 -35.295 1.00 31.23 ? 471 HOH H O 1 HETATM 13576 O O . HOH XA 5 . ? 27.384 31.792 -18.349 1.00 40.90 ? 472 HOH H O 1 HETATM 13577 O O . HOH XA 5 . ? 33.613 -12.207 -12.485 1.00 34.30 ? 473 HOH H O 1 HETATM 13578 O O . HOH XA 5 . ? 29.455 -13.158 -27.259 1.00 45.07 ? 474 HOH H O 1 HETATM 13579 O O . HOH XA 5 . ? 37.673 7.998 -18.700 1.00 43.58 ? 475 HOH H O 1 HETATM 13580 O O . HOH XA 5 . ? 39.560 2.148 -25.733 1.00 51.94 ? 476 HOH H O 1 HETATM 13581 O O . HOH XA 5 . ? 22.332 -14.042 -24.630 1.00 38.18 ? 477 HOH H O 1 HETATM 13582 O O . HOH XA 5 . ? 34.938 -8.747 -6.024 1.00 43.94 ? 478 HOH H O 1 HETATM 13583 O O . HOH XA 5 . ? 18.572 27.569 -32.107 1.00 38.21 ? 479 HOH H O 1 HETATM 13584 O O . HOH XA 5 . ? 32.461 -16.886 -10.586 1.00 42.26 ? 480 HOH H O 1 HETATM 13585 O O . HOH XA 5 . ? 29.990 -7.303 -31.357 1.00 34.16 ? 481 HOH H O 1 HETATM 13586 O O . HOH XA 5 . ? 49.495 -7.178 -14.820 1.00 47.09 ? 482 HOH H O 1 HETATM 13587 O O . HOH XA 5 . ? 18.629 42.897 -15.302 1.00 42.46 ? 483 HOH H O 1 HETATM 13588 O O . HOH XA 5 . ? 34.843 38.871 -23.321 1.00 40.40 ? 484 HOH H O 1 HETATM 13589 O O . HOH XA 5 . ? 30.026 11.803 -37.877 1.00 36.74 ? 485 HOH H O 1 HETATM 13590 O O . HOH XA 5 . ? 32.713 -7.392 -32.122 1.00 33.84 ? 486 HOH H O 1 HETATM 13591 O O . HOH XA 5 . ? 15.202 3.131 -24.368 1.00 45.47 ? 487 HOH H O 1 HETATM 13592 O O . HOH XA 5 . ? 34.710 0.510 -36.885 1.00 44.63 ? 488 HOH H O 1 HETATM 13593 O O . HOH XA 5 . ? 23.505 24.003 -23.623 1.00 33.96 ? 489 HOH H O 1 HETATM 13594 O O . HOH XA 5 . ? 31.284 11.213 -22.856 1.00 38.88 ? 490 HOH H O 1 HETATM 13595 O O . HOH XA 5 . ? 27.985 11.257 -15.217 1.00 52.22 ? 491 HOH H O 1 HETATM 13596 O O . HOH XA 5 . ? 16.272 10.446 -20.611 1.00 40.47 ? 492 HOH H O 1 HETATM 13597 O O . HOH XA 5 . ? 18.321 11.574 -21.812 1.00 43.80 ? 493 HOH H O 1 HETATM 13598 O O . HOH XA 5 . ? 25.413 -13.210 -17.691 1.00 40.55 ? 494 HOH H O 1 HETATM 13599 O O . HOH XA 5 . ? 34.588 -18.373 -18.460 1.00 45.35 ? 495 HOH H O 1 HETATM 13600 O O . HOH XA 5 . ? 24.773 43.497 -32.758 1.00 53.12 ? 496 HOH H O 1 HETATM 13601 O O . HOH XA 5 . ? 28.116 26.671 -21.949 1.00 43.16 ? 497 HOH H O 1 HETATM 13602 O O . HOH XA 5 . ? 16.853 17.890 -30.543 1.00 39.52 ? 498 HOH H O 1 HETATM 13603 O O . HOH XA 5 . ? 18.619 -12.463 -21.939 1.00 35.49 ? 499 HOH H O 1 HETATM 13604 O O . HOH XA 5 . ? 33.232 -5.193 -3.321 1.00 44.48 ? 500 HOH H O 1 HETATM 13605 O O . HOH XA 5 . ? 36.692 3.226 -29.009 1.00 51.90 ? 501 HOH H O 1 HETATM 13606 O O . HOH XA 5 . ? 21.905 5.760 -39.545 1.00 42.19 ? 502 HOH H O 1 HETATM 13607 O O . HOH XA 5 . ? 17.729 40.387 -15.098 1.00 45.53 ? 503 HOH H O 1 HETATM 13608 O O . HOH XA 5 . ? 35.490 -3.524 -2.648 1.00 48.26 ? 504 HOH H O 1 HETATM 13609 O O . HOH XA 5 . ? 21.942 -14.905 -13.818 1.00 41.64 ? 505 HOH H O 1 HETATM 13610 O O . HOH XA 5 . ? 25.822 47.559 -25.112 1.00 45.42 ? 506 HOH H O 1 HETATM 13611 O O . HOH XA 5 . ? 19.870 12.413 -31.475 1.00 47.86 ? 507 HOH H O 1 HETATM 13612 O O . HOH XA 5 . ? 20.278 28.382 -17.616 1.00 45.91 ? 508 HOH H O 1 HETATM 13613 O O . HOH XA 5 . ? 44.923 -9.129 -21.081 1.00 37.69 ? 509 HOH H O 1 HETATM 13614 O O . HOH XA 5 . ? 29.664 7.090 -9.131 1.00 61.95 ? 510 HOH H O 1 HETATM 13615 O O . HOH XA 5 . ? 27.648 48.166 -26.917 1.00 51.50 ? 511 HOH H O 1 HETATM 13616 O O . HOH XA 5 . ? 19.683 50.212 -13.761 1.00 61.71 ? 512 HOH H O 1 HETATM 13617 O O . HOH XA 5 . ? 16.982 2.759 -28.687 1.00 52.04 ? 513 HOH H O 1 HETATM 13618 O O . HOH XA 5 . ? 29.485 11.935 -28.936 1.00 43.14 ? 514 HOH H O 1 HETATM 13619 O O . HOH XA 5 . ? 37.093 -6.247 -2.968 1.00 34.69 ? 515 HOH H O 1 HETATM 13620 O O . HOH XA 5 . ? 31.307 2.762 -4.468 1.00 51.07 ? 516 HOH H O 1 HETATM 13621 O O . HOH XA 5 . ? 35.336 7.698 -38.791 1.00 44.99 ? 517 HOH H O 1 HETATM 13622 O O . HOH XA 5 . ? 30.885 10.333 -43.243 1.00 57.84 ? 518 HOH H O 1 HETATM 13623 O O . HOH XA 5 . ? 28.512 -20.961 -12.388 1.00 41.42 ? 519 HOH H O 1 HETATM 13624 O O . HOH XA 5 . ? 30.361 33.567 -36.949 1.00 52.31 ? 520 HOH H O 1 HETATM 13625 O O . HOH XA 5 . ? 34.257 9.851 -25.734 1.00 62.59 ? 521 HOH H O 1 HETATM 13626 O O . HOH XA 5 . ? 25.351 3.014 -3.401 1.00 44.09 ? 522 HOH H O 1 HETATM 13627 O O . HOH XA 5 . ? 33.016 43.509 -17.068 1.00 58.59 ? 523 HOH H O 1 HETATM 13628 O O . HOH XA 5 . ? 26.081 41.289 -13.455 1.00 48.50 ? 524 HOH H O 1 HETATM 13629 O O . HOH XA 5 . ? 29.296 -19.151 -10.429 1.00 44.07 ? 525 HOH H O 1 HETATM 13630 O O . HOH XA 5 . ? 36.457 38.920 -25.590 1.00 56.60 ? 526 HOH H O 1 HETATM 13631 O O . HOH XA 5 . ? 18.138 -14.811 -17.924 1.00 52.92 ? 527 HOH H O 1 HETATM 13632 O O . HOH XA 5 . ? 20.735 40.739 -34.006 1.00 48.21 ? 528 HOH H O 1 HETATM 13633 O O . HOH XA 5 . ? 18.952 25.745 -41.107 1.00 52.33 ? 529 HOH H O 1 HETATM 13634 O O . HOH XA 5 . ? 37.917 7.887 -24.201 1.00 45.95 ? 530 HOH H O 1 HETATM 13635 O O . HOH XA 5 . ? 29.098 8.273 -43.069 1.00 46.36 ? 531 HOH H O 1 HETATM 13636 O O . HOH XA 5 . ? 30.553 17.532 -45.678 1.00 48.53 ? 532 HOH H O 1 HETATM 13637 O O . HOH XA 5 . ? 17.546 13.878 -30.535 1.00 47.65 ? 533 HOH H O 1 HETATM 13638 O O . HOH XA 5 . ? 39.939 7.397 -25.057 1.00 57.93 ? 534 HOH H O 1 HETATM 13639 O O . HOH XA 5 . ? 40.658 4.971 -25.693 1.00 58.12 ? 535 HOH H O 1 HETATM 13640 O O . HOH XA 5 . ? 39.158 2.754 -28.091 1.00 54.47 ? 536 HOH H O 1 HETATM 13641 O O . HOH XA 5 . ? 34.402 47.524 -26.155 1.00 54.95 ? 537 HOH H O 1 HETATM 13642 O O . HOH XA 5 . ? 20.094 -9.815 -32.309 1.00 49.97 ? 538 HOH H O 1 HETATM 13643 O O . HOH XA 5 . ? 22.199 3.933 -41.322 1.00 43.03 ? 539 HOH H O 1 HETATM 13644 O O . HOH XA 5 . ? 33.733 -6.581 -26.224 1.00 35.06 ? 540 HOH H O 1 HETATM 13645 O O . HOH XA 5 . ? 18.237 15.716 -37.978 1.00 33.60 ? 541 HOH H O 1 HETATM 13646 O O . HOH XA 5 . ? 18.880 -3.341 -32.730 1.00 50.34 ? 542 HOH H O 1 HETATM 13647 O O . HOH XA 5 . ? 16.616 49.112 -14.516 1.00 55.05 ? 543 HOH H O 1 HETATM 13648 O O . HOH XA 5 . ? 15.272 13.829 -29.166 1.00 58.22 ? 544 HOH H O 1 HETATM 13649 O O . HOH XA 5 . ? 40.044 -2.041 -23.712 1.00 40.93 ? 545 HOH H O 1 HETATM 13650 O O . HOH XA 5 . ? 21.338 -15.966 -22.711 1.00 51.69 ? 546 HOH H O 1 HETATM 13651 O O . HOH XA 5 . ? 17.517 22.350 -41.137 1.00 48.93 ? 547 HOH H O 1 HETATM 13652 O O . HOH XA 5 . ? 34.575 14.374 -40.526 1.00 43.37 ? 548 HOH H O 1 HETATM 13653 O O . HOH XA 5 . ? 18.210 21.579 -44.080 1.00 44.32 ? 549 HOH H O 1 HETATM 13654 O O . HOH XA 5 . ? 33.698 13.733 -43.128 1.00 50.32 ? 550 HOH H O 1 HETATM 13655 O O . HOH XA 5 . ? 12.703 3.979 -25.903 1.00 56.83 ? 551 HOH H O 1 HETATM 13656 O O . HOH XA 5 . ? 11.070 2.537 -24.699 1.00 55.89 ? 552 HOH H O 1 HETATM 13657 O O . HOH XA 5 . ? 15.171 14.743 -26.710 1.00 59.96 ? 553 HOH H O 1 HETATM 13658 O O . HOH XA 5 . ? 22.413 23.765 -21.170 1.00 48.30 ? 554 HOH H O 1 HETATM 13659 O O . HOH XA 5 . ? 32.430 1.427 -41.746 1.00 61.45 ? 555 HOH H O 1 HETATM 13660 O O . HOH XA 5 . ? 28.572 41.700 -14.490 1.00 51.80 ? 556 HOH H O 1 HETATM 13661 O O . HOH XA 5 . ? 10.601 42.273 -28.021 1.00 38.13 ? 557 HOH H O 1 HETATM 13662 O O . HOH XA 5 . ? 35.370 10.144 -30.326 1.00 40.97 ? 558 HOH H O 1 HETATM 13663 O O . HOH XA 5 . ? 34.230 11.398 -28.536 1.00 55.37 ? 559 HOH H O 1 HETATM 13664 O O . HOH XA 5 . ? 18.125 4.219 -37.658 1.00 52.06 ? 560 HOH H O 1 HETATM 13665 O O . HOH XA 5 . ? 7.420 7.117 -22.228 1.00 46.30 ? 561 HOH H O 1 HETATM 13666 O O . HOH XA 5 . ? 17.101 52.188 -33.428 1.00 62.26 ? 562 HOH H O 1 HETATM 13667 O O . HOH XA 5 . ? 26.418 11.080 -18.702 1.00 40.42 ? 563 HOH H O 1 HETATM 13668 O O . HOH XA 5 . ? 24.043 13.057 -28.822 1.00 56.23 ? 564 HOH H O 1 HETATM 13669 O O . HOH XA 5 . ? 19.300 5.384 -39.424 1.00 56.25 ? 565 HOH H O 1 HETATM 13670 O O . HOH XA 5 . ? 35.463 4.662 -35.230 1.00 56.93 ? 566 HOH H O 1 HETATM 13671 O O . HOH XA 5 . ? 25.350 12.869 -19.969 1.00 54.80 ? 567 HOH H O 1 HETATM 13672 O O . HOH XA 5 . ? 22.848 -2.326 -37.825 1.00 38.41 ? 568 HOH H O 1 HETATM 13673 O O . HOH XA 5 . ? 26.261 -6.745 -37.420 1.00 51.54 ? 569 HOH H O 1 HETATM 13674 O O . HOH XA 5 . ? 37.433 47.819 -25.883 1.00 56.90 ? 570 HOH H O 1 HETATM 13675 O O . HOH XA 5 . ? 21.869 12.651 -24.141 1.00 52.85 ? 571 HOH H O 1 HETATM 13676 O O . HOH XA 5 . ? 25.091 -13.995 -2.105 1.00 49.20 ? 572 HOH H O 1 HETATM 13677 O O . HOH XA 5 . ? 33.326 -13.986 -23.241 1.00 59.65 ? 573 HOH H O 1 HETATM 13678 O O . HOH XA 5 . ? 32.243 41.354 -32.913 1.00 42.84 ? 574 HOH H O 1 HETATM 13679 O O . HOH XA 5 . ? 21.019 -1.921 -36.315 1.00 41.41 ? 575 HOH H O 1 HETATM 13680 O O . HOH XA 5 . ? 23.649 26.221 -18.665 1.00 54.19 ? 576 HOH H O 1 HETATM 13681 O O . HOH XA 5 . ? 30.535 0.056 -3.808 1.00 47.18 ? 577 HOH H O 1 HETATM 13682 O O . HOH XA 5 . ? 35.859 32.454 -26.891 1.00 47.68 ? 578 HOH H O 1 HETATM 13683 O O . HOH XA 5 . ? 21.597 14.006 -30.596 1.00 59.06 ? 579 HOH H O 1 HETATM 13684 O O . HOH XA 5 . ? 20.099 32.526 -14.488 1.00 51.65 ? 580 HOH H O 1 HETATM 13685 O O . HOH XA 5 . ? 32.783 40.719 -35.144 1.00 52.72 ? 581 HOH H O 1 HETATM 13686 O O . HOH XA 5 . ? 22.942 13.427 -21.715 1.00 43.65 ? 582 HOH H O 1 HETATM 13687 O O . HOH XA 5 . ? 39.217 46.336 -24.007 1.00 53.39 ? 583 HOH H O 1 HETATM 13688 O O . HOH XA 5 . ? 18.212 1.950 -37.358 1.00 49.88 ? 584 HOH H O 1 HETATM 13689 O O . HOH XA 5 . ? 36.038 -15.359 -17.336 1.00 38.25 ? 585 HOH H O 1 HETATM 13690 O O . HOH XA 5 . ? 33.990 -14.400 -10.840 1.00 33.59 ? 586 HOH H O 1 HETATM 13691 O O . HOH XA 5 . ? 41.661 -8.335 -8.663 1.00 39.29 ? 587 HOH H O 1 HETATM 13692 O O . HOH XA 5 . ? 37.412 -7.611 -4.828 1.00 44.71 ? 588 HOH H O 1 HETATM 13693 O O . HOH XA 5 . ? 47.217 -10.922 -20.097 1.00 47.97 ? 589 HOH H O 1 HETATM 13694 O O . HOH YA 5 . ? 75.955 -51.787 -36.596 1.00 26.77 ? 401 HOH A O 1 HETATM 13695 O O . HOH YA 5 . ? 80.916 -45.466 -36.464 1.00 25.23 ? 402 HOH A O 1 HETATM 13696 O O . HOH YA 5 . ? 77.293 -28.305 -9.820 1.00 20.63 ? 403 HOH A O 1 HETATM 13697 O O . HOH YA 5 . ? 89.798 -25.608 4.752 1.00 28.96 ? 404 HOH A O 1 HETATM 13698 O O . HOH YA 5 . ? 97.509 -30.622 -13.234 1.00 26.85 ? 405 HOH A O 1 HETATM 13699 O O . HOH YA 5 . ? 90.722 -17.420 -2.324 1.00 30.96 ? 406 HOH A O 1 HETATM 13700 O O . HOH YA 5 . ? 75.306 -30.906 -5.766 1.00 40.56 ? 407 HOH A O 1 HETATM 13701 O O . HOH YA 5 . ? 87.769 -19.036 4.335 1.00 26.86 ? 408 HOH A O 1 HETATM 13702 O O . HOH YA 5 . ? 88.701 -42.276 3.298 1.00 24.45 ? 409 HOH A O 1 HETATM 13703 O O . HOH YA 5 . ? 83.182 -28.453 -15.799 1.00 31.06 ? 410 HOH A O 1 HETATM 13704 O O . HOH YA 5 . ? 87.153 -47.806 -44.676 1.00 32.25 ? 411 HOH A O 1 HETATM 13705 O O . HOH YA 5 . ? 78.454 -28.856 -16.836 1.00 39.09 ? 412 HOH A O 1 HETATM 13706 O O . HOH YA 5 . ? 98.550 -21.114 -10.713 1.00 35.31 ? 413 HOH A O 1 HETATM 13707 O O . HOH YA 5 . ? 80.522 -30.434 -1.543 1.00 28.06 ? 414 HOH A O 1 HETATM 13708 O O . HOH YA 5 . ? 80.615 -7.269 -10.782 1.00 35.24 ? 415 HOH A O 1 HETATM 13709 O O . HOH YA 5 . ? 82.534 -47.871 -14.835 1.00 36.54 ? 416 HOH A O 1 HETATM 13710 O O . HOH YA 5 . ? 79.015 -52.510 -34.055 1.00 29.30 ? 417 HOH A O 1 HETATM 13711 O O . HOH YA 5 . ? 81.496 -45.077 -15.021 1.00 39.43 ? 418 HOH A O 1 HETATM 13712 O O . HOH YA 5 . ? 85.448 -35.625 -10.285 1.00 31.28 ? 419 HOH A O 1 HETATM 13713 O O . HOH YA 5 . ? 91.828 -43.274 -21.360 1.00 40.70 ? 420 HOH A O 1 HETATM 13714 O O . HOH YA 5 . ? 80.219 -44.568 -27.507 1.00 33.67 ? 421 HOH A O 1 HETATM 13715 O O . HOH YA 5 . ? 92.860 -41.795 -13.391 1.00 33.44 ? 422 HOH A O 1 HETATM 13716 O O . HOH YA 5 . ? 92.219 -46.219 -35.493 1.00 36.37 ? 423 HOH A O 1 HETATM 13717 O O . HOH YA 5 . ? 83.005 -37.088 -12.596 1.00 38.85 ? 424 HOH A O 1 HETATM 13718 O O . HOH YA 5 . ? 74.238 -56.831 -44.807 1.00 41.71 ? 425 HOH A O 1 HETATM 13719 O O . HOH YA 5 . ? 92.277 -40.663 3.266 1.00 37.26 ? 426 HOH A O 1 HETATM 13720 O O . HOH YA 5 . ? 81.786 -2.956 -13.880 1.00 45.87 ? 427 HOH A O 1 HETATM 13721 O O . HOH YA 5 . ? 87.979 -37.916 -13.796 1.00 40.63 ? 428 HOH A O 1 HETATM 13722 O O . HOH YA 5 . ? 74.853 -51.913 -48.615 1.00 39.99 ? 429 HOH A O 1 HETATM 13723 O O . HOH YA 5 . ? 85.674 -39.197 -17.365 1.00 27.29 ? 430 HOH A O 1 HETATM 13724 O O . HOH YA 5 . ? 94.076 -19.602 -18.139 1.00 55.98 ? 431 HOH A O 1 HETATM 13725 O O . HOH YA 5 . ? 75.550 -47.373 -42.731 1.00 40.18 ? 432 HOH A O 1 HETATM 13726 O O . HOH YA 5 . ? 76.370 -22.226 -2.640 1.00 31.96 ? 433 HOH A O 1 HETATM 13727 O O . HOH YA 5 . ? 85.990 -22.616 6.995 1.00 33.56 ? 434 HOH A O 1 HETATM 13728 O O . HOH YA 5 . ? 85.120 -33.776 6.115 1.00 33.07 ? 435 HOH A O 1 HETATM 13729 O O . HOH YA 5 . ? 97.180 -51.436 -26.942 1.00 53.53 ? 436 HOH A O 1 HETATM 13730 O O . HOH YA 5 . ? 86.884 -30.333 -15.884 1.00 50.23 ? 437 HOH A O 1 HETATM 13731 O O . HOH YA 5 . ? 81.446 -34.583 -9.890 1.00 34.94 ? 438 HOH A O 1 HETATM 13732 O O . HOH YA 5 . ? 69.282 -55.107 -36.795 1.00 49.27 ? 439 HOH A O 1 HETATM 13733 O O . HOH YA 5 . ? 95.588 -46.411 -7.895 1.00 37.91 ? 440 HOH A O 1 HETATM 13734 O O . HOH YA 5 . ? 83.874 -32.321 -13.140 1.00 33.44 ? 441 HOH A O 1 HETATM 13735 O O . HOH YA 5 . ? 82.832 -42.483 -7.325 1.00 43.73 ? 442 HOH A O 1 HETATM 13736 O O . HOH YA 5 . ? 82.939 -42.354 -34.290 1.00 27.85 ? 443 HOH A O 1 HETATM 13737 O O . HOH YA 5 . ? 79.616 -26.417 8.807 1.00 51.84 ? 444 HOH A O 1 HETATM 13738 O O . HOH YA 5 . ? 91.331 -41.996 -34.912 1.00 42.88 ? 445 HOH A O 1 HETATM 13739 O O . HOH YA 5 . ? 77.932 -53.418 -52.179 1.00 38.06 ? 446 HOH A O 1 HETATM 13740 O O . HOH YA 5 . ? 88.943 -64.256 -26.298 1.00 53.26 ? 447 HOH A O 1 HETATM 13741 O O . HOH YA 5 . ? 97.002 -47.766 -17.357 1.00 43.23 ? 448 HOH A O 1 HETATM 13742 O O . HOH YA 5 . ? 83.353 -44.639 -29.172 1.00 27.36 ? 449 HOH A O 1 HETATM 13743 O O . HOH YA 5 . ? 91.669 -55.848 -11.696 1.00 37.31 ? 450 HOH A O 1 HETATM 13744 O O . HOH YA 5 . ? 74.200 -26.524 -9.532 1.00 42.03 ? 451 HOH A O 1 HETATM 13745 O O . HOH YA 5 . ? 79.384 -30.847 -18.288 1.00 52.59 ? 452 HOH A O 1 HETATM 13746 O O . HOH YA 5 . ? 91.367 -4.845 -7.667 1.00 42.40 ? 453 HOH A O 1 HETATM 13747 O O . HOH YA 5 . ? 84.734 -9.456 -3.687 1.00 34.96 ? 454 HOH A O 1 HETATM 13748 O O . HOH YA 5 . ? 84.974 -43.603 -35.531 1.00 38.39 ? 455 HOH A O 1 HETATM 13749 O O . HOH YA 5 . ? 79.771 -28.559 8.724 1.00 52.45 ? 456 HOH A O 1 HETATM 13750 O O . HOH YA 5 . ? 88.225 -46.146 -42.365 1.00 41.88 ? 457 HOH A O 1 HETATM 13751 O O . HOH YA 5 . ? 93.637 -31.400 7.091 1.00 41.64 ? 458 HOH A O 1 HETATM 13752 O O . HOH YA 5 . ? 88.207 -62.999 -28.623 1.00 55.36 ? 459 HOH A O 1 HETATM 13753 O O . HOH YA 5 . ? 87.277 -7.750 1.306 1.00 39.03 ? 460 HOH A O 1 HETATM 13754 O O . HOH YA 5 . ? 88.337 -25.378 7.179 1.00 45.52 ? 461 HOH A O 1 HETATM 13755 O O . HOH YA 5 . ? 75.231 -23.231 0.311 1.00 38.16 ? 462 HOH A O 1 HETATM 13756 O O . HOH YA 5 . ? 83.594 -34.285 -11.567 1.00 37.94 ? 463 HOH A O 1 HETATM 13757 O O . HOH YA 5 . ? 102.690 -13.955 -5.590 1.00 45.98 ? 464 HOH A O 1 HETATM 13758 O O . HOH YA 5 . ? 79.299 -26.744 -1.601 1.00 37.34 ? 465 HOH A O 1 HETATM 13759 O O . HOH YA 5 . ? 101.666 -14.162 -3.257 1.00 49.46 ? 466 HOH A O 1 HETATM 13760 O O . HOH YA 5 . ? 96.535 -45.622 -10.137 1.00 47.00 ? 467 HOH A O 1 HETATM 13761 O O . HOH YA 5 . ? 87.848 -10.464 1.968 1.00 51.53 ? 468 HOH A O 1 HETATM 13762 O O . HOH YA 5 . ? 95.829 -35.486 2.850 1.00 35.17 ? 469 HOH A O 1 HETATM 13763 O O . HOH YA 5 . ? 99.507 -12.235 -4.120 1.00 44.81 ? 470 HOH A O 1 HETATM 13764 O O . HOH YA 5 . ? 85.072 -38.448 -13.725 1.00 43.95 ? 471 HOH A O 1 HETATM 13765 O O . HOH YA 5 . ? 81.840 -30.717 -14.430 1.00 48.61 ? 472 HOH A O 1 HETATM 13766 O O . HOH YA 5 . ? 79.585 -59.288 -40.370 1.00 35.16 ? 473 HOH A O 1 HETATM 13767 O O . HOH YA 5 . ? 84.335 -55.165 -50.735 1.00 28.86 ? 474 HOH A O 1 HETATM 13768 O O . HOH YA 5 . ? 73.249 -20.109 0.200 1.00 41.19 ? 475 HOH A O 1 HETATM 13769 O O . HOH YA 5 . ? 78.398 -35.649 -6.363 1.00 47.80 ? 476 HOH A O 1 HETATM 13770 O O . HOH YA 5 . ? 78.855 -29.132 0.172 1.00 43.92 ? 477 HOH A O 1 HETATM 13771 O O . HOH YA 5 . ? 78.828 -21.188 5.636 1.00 45.57 ? 478 HOH A O 1 HETATM 13772 O O . HOH YA 5 . ? 77.449 -15.671 2.739 1.00 54.15 ? 479 HOH A O 1 HETATM 13773 O O . HOH YA 5 . ? 88.697 -40.437 -36.208 1.00 40.51 ? 480 HOH A O 1 HETATM 13774 O O . HOH YA 5 . ? 97.815 -13.788 -1.577 1.00 63.77 ? 481 HOH A O 1 HETATM 13775 O O . HOH YA 5 . ? 90.720 -45.718 -30.151 1.00 43.06 ? 482 HOH A O 1 HETATM 13776 O O . HOH YA 5 . ? 78.013 -28.518 -7.265 1.00 40.47 ? 483 HOH A O 1 HETATM 13777 O O . HOH YA 5 . ? 94.059 -47.870 -33.812 1.00 44.46 ? 484 HOH A O 1 HETATM 13778 O O . HOH YA 5 . ? 91.004 -16.052 -17.099 1.00 34.41 ? 485 HOH A O 1 HETATM 13779 O O . HOH YA 5 . ? 81.617 -55.091 -50.721 1.00 38.97 ? 486 HOH A O 1 HETATM 13780 O O . HOH YA 5 . ? 98.509 -54.201 -20.594 1.00 41.35 ? 487 HOH A O 1 HETATM 13781 O O . HOH YA 5 . ? 89.004 -10.387 -15.617 1.00 35.55 ? 488 HOH A O 1 HETATM 13782 O O . HOH YA 5 . ? 82.668 -29.787 7.184 1.00 36.75 ? 489 HOH A O 1 HETATM 13783 O O . HOH YA 5 . ? 88.810 -39.787 -30.008 1.00 35.53 ? 490 HOH A O 1 HETATM 13784 O O . HOH YA 5 . ? 86.313 -42.117 -37.233 1.00 31.77 ? 491 HOH A O 1 HETATM 13785 O O . HOH YA 5 . ? 93.598 -57.908 -37.095 1.00 55.39 ? 492 HOH A O 1 HETATM 13786 O O . HOH YA 5 . ? 97.420 -16.378 -14.952 1.00 41.01 ? 493 HOH A O 1 HETATM 13787 O O . HOH YA 5 . ? 84.394 -3.115 -13.431 1.00 43.58 ? 494 HOH A O 1 HETATM 13788 O O . HOH YA 5 . ? 78.230 -30.679 -3.091 1.00 46.24 ? 495 HOH A O 1 HETATM 13789 O O . HOH YA 5 . ? 70.868 -49.470 -42.708 1.00 44.18 ? 496 HOH A O 1 HETATM 13790 O O . HOH YA 5 . ? 98.533 -44.172 -14.964 1.00 54.32 ? 497 HOH A O 1 HETATM 13791 O O . HOH YA 5 . ? 85.045 -60.666 -24.273 1.00 40.29 ? 498 HOH A O 1 HETATM 13792 O O . HOH YA 5 . ? 79.004 -52.162 -13.953 1.00 40.39 ? 499 HOH A O 1 HETATM 13793 O O . HOH YA 5 . ? 74.748 -49.364 -48.886 1.00 37.63 ? 500 HOH A O 1 HETATM 13794 O O . HOH YA 5 . ? 81.034 -35.949 -6.612 1.00 45.68 ? 501 HOH A O 1 HETATM 13795 O O . HOH YA 5 . ? 88.493 -25.509 -18.749 1.00 43.19 ? 502 HOH A O 1 HETATM 13796 O O . HOH YA 5 . ? 90.279 -6.123 -10.210 1.00 32.08 ? 503 HOH A O 1 HETATM 13797 O O . HOH YA 5 . ? 93.944 -51.554 -43.262 1.00 46.34 ? 504 HOH A O 1 HETATM 13798 O O . HOH YA 5 . ? 95.187 -55.888 -11.484 1.00 38.13 ? 505 HOH A O 1 HETATM 13799 O O . HOH YA 5 . ? 83.996 -31.636 8.387 1.00 41.58 ? 506 HOH A O 1 HETATM 13800 O O . HOH YA 5 . ? 79.974 -16.813 5.720 1.00 50.03 ? 507 HOH A O 1 HETATM 13801 O O . HOH YA 5 . ? 83.556 -17.425 6.094 1.00 47.86 ? 508 HOH A O 1 HETATM 13802 O O . HOH YA 5 . ? 91.367 -60.882 -45.862 1.00 43.07 ? 509 HOH A O 1 HETATM 13803 O O . HOH YA 5 . ? 97.852 -32.909 -9.154 1.00 35.27 ? 510 HOH A O 1 HETATM 13804 O O . HOH YA 5 . ? 96.336 -32.368 6.829 1.00 59.61 ? 511 HOH A O 1 HETATM 13805 O O . HOH YA 5 . ? 94.859 -61.551 -25.652 1.00 50.23 ? 512 HOH A O 1 HETATM 13806 O O . HOH YA 5 . ? 78.138 -55.859 -52.941 1.00 46.57 ? 513 HOH A O 1 HETATM 13807 O O . HOH YA 5 . ? 80.474 -37.504 -12.146 1.00 51.35 ? 514 HOH A O 1 HETATM 13808 O O . HOH YA 5 . ? 85.940 -1.584 -7.522 1.00 37.49 ? 515 HOH A O 1 HETATM 13809 O O . HOH YA 5 . ? 94.034 -58.484 -14.536 1.00 42.42 ? 516 HOH A O 1 HETATM 13810 O O . HOH YA 5 . ? 80.207 -23.183 7.570 1.00 43.22 ? 517 HOH A O 1 HETATM 13811 O O . HOH YA 5 . ? 89.274 -64.029 -34.345 1.00 53.23 ? 518 HOH A O 1 HETATM 13812 O O . HOH YA 5 . ? 80.896 -56.179 -53.318 1.00 56.74 ? 519 HOH A O 1 HETATM 13813 O O . HOH YA 5 . ? 77.811 -43.369 -11.557 1.00 39.36 ? 520 HOH A O 1 HETATM 13814 O O . HOH YA 5 . ? 77.204 -44.710 -45.972 1.00 52.91 ? 521 HOH A O 1 HETATM 13815 O O . HOH YA 5 . ? 89.929 -5.088 -13.619 1.00 46.22 ? 522 HOH A O 1 HETATM 13816 O O . HOH YA 5 . ? 79.174 -36.003 -9.627 1.00 43.83 ? 523 HOH A O 1 HETATM 13817 O O . HOH YA 5 . ? 94.401 -57.988 -46.041 1.00 43.58 ? 524 HOH A O 1 HETATM 13818 O O . HOH YA 5 . ? 77.034 -15.929 5.650 1.00 53.18 ? 525 HOH A O 1 HETATM 13819 O O . HOH YA 5 . ? 91.257 -29.583 -15.561 1.00 44.78 ? 526 HOH A O 1 HETATM 13820 O O . HOH YA 5 . ? 85.198 -10.342 3.600 1.00 56.69 ? 527 HOH A O 1 HETATM 13821 O O . HOH YA 5 . ? 88.306 -2.990 -13.547 1.00 62.63 ? 528 HOH A O 1 HETATM 13822 O O . HOH YA 5 . ? 98.341 -24.690 -14.157 1.00 55.42 ? 529 HOH A O 1 HETATM 13823 O O . HOH YA 5 . ? 93.049 -21.916 1.243 1.00 39.78 ? 530 HOH A O 1 HETATM 13824 O O . HOH YA 5 . ? 92.422 -21.192 3.729 1.00 50.20 ? 531 HOH A O 1 HETATM 13825 O O . HOH YA 5 . ? 96.793 -51.848 -3.185 1.00 36.65 ? 532 HOH A O 1 HETATM 13826 O O . HOH YA 5 . ? 98.851 -15.404 -17.380 1.00 47.16 ? 533 HOH A O 1 HETATM 13827 O O . HOH YA 5 . ? 86.722 -20.065 6.604 1.00 44.76 ? 534 HOH A O 1 HETATM 13828 O O . HOH YA 5 . ? 88.636 -28.363 -16.296 1.00 55.64 ? 535 HOH A O 1 HETATM 13829 O O . HOH YA 5 . ? 69.662 -47.780 -41.124 1.00 57.48 ? 536 HOH A O 1 HETATM 13830 O O . HOH YA 5 . ? 72.739 -29.120 -9.134 1.00 66.52 ? 537 HOH A O 1 HETATM 13831 O O . HOH YA 5 . ? 93.895 -4.305 -7.968 1.00 60.15 ? 538 HOH A O 1 HETATM 13832 O O . HOH YA 5 . ? 92.361 -43.178 -24.112 1.00 46.02 ? 539 HOH A O 1 HETATM 13833 O O . HOH YA 5 . ? 96.999 -59.617 -26.891 1.00 39.91 ? 540 HOH A O 1 HETATM 13834 O O . HOH YA 5 . ? 99.169 -40.579 -5.116 1.00 53.31 ? 541 HOH A O 1 HETATM 13835 O O . HOH YA 5 . ? 94.800 -42.559 -25.942 1.00 55.71 ? 542 HOH A O 1 HETATM 13836 O O . HOH YA 5 . ? 77.376 -30.724 3.321 1.00 36.96 ? 543 HOH A O 1 HETATM 13837 O O . HOH YA 5 . ? 78.007 -31.171 5.388 1.00 39.51 ? 544 HOH A O 1 HETATM 13838 O O . HOH YA 5 . ? 95.392 -59.930 -17.457 1.00 41.25 ? 545 HOH A O 1 HETATM 13839 O O . HOH YA 5 . ? 100.661 -38.836 -4.421 1.00 63.75 ? 546 HOH A O 1 HETATM 13840 O O . HOH YA 5 . ? 94.819 -60.647 -19.507 1.00 49.79 ? 547 HOH A O 1 HETATM 13841 O O . HOH YA 5 . ? 90.438 -43.087 -30.825 1.00 58.17 ? 548 HOH A O 1 HETATM 13842 O O . HOH YA 5 . ? 92.483 -2.890 -22.878 1.00 65.96 ? 549 HOH A O 1 HETATM 13843 O O . HOH YA 5 . ? 79.479 -37.312 3.480 1.00 54.39 ? 550 HOH A O 1 HETATM 13844 O O . HOH YA 5 . ? 80.245 -52.272 -51.204 1.00 42.98 ? 551 HOH A O 1 HETATM 13845 O O . HOH YA 5 . ? 93.394 -3.174 -20.460 1.00 61.12 ? 552 HOH A O 1 HETATM 13846 O O . HOH YA 5 . ? 96.069 -5.957 -5.631 1.00 43.74 ? 553 HOH A O 1 HETATM 13847 O O . HOH YA 5 . ? 81.342 -43.118 -30.453 1.00 46.22 ? 554 HOH A O 1 HETATM 13848 O O . HOH YA 5 . ? 100.875 -52.866 -27.962 1.00 56.28 ? 555 HOH A O 1 HETATM 13849 O O . HOH YA 5 . ? 96.190 -6.339 -3.259 1.00 49.91 ? 556 HOH A O 1 HETATM 13850 O O . HOH YA 5 . ? 99.142 -48.032 -19.390 1.00 45.75 ? 557 HOH A O 1 HETATM 13851 O O . HOH YA 5 . ? 76.692 -34.789 -11.776 1.00 35.13 ? 558 HOH A O 1 HETATM 13852 O O . HOH YA 5 . ? 95.215 -42.018 -33.967 1.00 49.83 ? 559 HOH A O 1 HETATM 13853 O O . HOH YA 5 . ? 93.582 -43.606 -34.129 1.00 55.37 ? 560 HOH A O 1 HETATM 13854 O O . HOH YA 5 . ? 89.118 -37.748 -23.070 1.00 60.24 ? 561 HOH A O 1 HETATM 13855 O O . HOH YA 5 . ? 78.476 -33.162 4.486 1.00 52.36 ? 562 HOH A O 1 HETATM 13856 O O . HOH YA 5 . ? 91.328 -37.149 -22.875 1.00 51.58 ? 563 HOH A O 1 HETATM 13857 O O . HOH YA 5 . ? 94.768 -2.561 -18.220 1.00 68.19 ? 564 HOH A O 1 HETATM 13858 O O . HOH YA 5 . ? 93.819 -1.443 -15.926 1.00 68.51 ? 565 HOH A O 1 HETATM 13859 O O . HOH YA 5 . ? 94.058 -44.937 -26.977 1.00 44.34 ? 566 HOH A O 1 HETATM 13860 O O . HOH YA 5 . ? 96.920 -3.830 -19.268 1.00 59.11 ? 567 HOH A O 1 HETATM 13861 O O . HOH YA 5 . ? 70.330 -29.321 -9.020 1.00 59.56 ? 568 HOH A O 1 HETATM 13862 O O . HOH YA 5 . ? 91.353 -63.104 -25.619 1.00 56.36 ? 569 HOH A O 1 HETATM 13863 O O . HOH YA 5 . ? 79.432 -36.987 0.395 1.00 52.29 ? 570 HOH A O 1 HETATM 13864 O O . HOH YA 5 . ? 97.931 -9.316 -17.573 1.00 55.71 ? 571 HOH A O 1 HETATM 13865 O O . HOH YA 5 . ? 76.121 -20.920 7.184 1.00 52.32 ? 572 HOH A O 1 HETATM 13866 O O . HOH YA 5 . ? 87.605 -37.564 -31.854 1.00 47.51 ? 573 HOH A O 1 HETATM 13867 O O . HOH YA 5 . ? 91.867 -38.054 -35.377 1.00 45.12 ? 574 HOH A O 1 HETATM 13868 O O . HOH YA 5 . ? 93.428 -39.799 -34.792 1.00 49.98 ? 575 HOH A O 1 HETATM 13869 O O . HOH YA 5 . ? 85.048 -64.974 -34.603 1.00 42.66 ? 576 HOH A O 1 HETATM 13870 O O . HOH YA 5 . ? 93.623 -39.274 -18.659 1.00 54.08 ? 577 HOH A O 1 HETATM 13871 O O . HOH YA 5 . ? 79.999 -45.381 -30.332 1.00 44.77 ? 578 HOH A O 1 HETATM 13872 O O . HOH YA 5 . ? 85.971 -54.920 -14.803 1.00 44.79 ? 579 HOH A O 1 HETATM 13873 O O . HOH YA 5 . ? 86.191 -36.686 5.761 1.00 51.50 ? 580 HOH A O 1 HETATM 13874 O O . HOH YA 5 . ? 93.433 -45.645 -32.097 1.00 54.91 ? 581 HOH A O 1 HETATM 13875 O O . HOH YA 5 . ? 79.671 -9.173 -12.785 1.00 23.59 ? 582 HOH A O 1 HETATM 13876 O O . HOH YA 5 . ? 76.028 -46.195 -40.531 1.00 33.11 ? 583 HOH A O 1 HETATM 13877 O O . HOH YA 5 . ? 78.644 -52.717 -16.465 1.00 47.67 ? 584 HOH A O 1 HETATM 13878 O O . HOH YA 5 . ? 76.356 -28.140 -18.159 1.00 37.48 ? 585 HOH A O 1 HETATM 13879 O O . HOH YA 5 . ? 73.808 -27.814 -17.308 1.00 39.57 ? 586 HOH A O 1 HETATM 13880 O O . HOH ZA 5 . ? 84.141 -39.556 -37.398 1.00 34.16 ? 401 HOH B O 1 HETATM 13881 O O . HOH ZA 5 . ? 76.478 -56.467 -33.344 1.00 52.09 ? 402 HOH B O 1 HETATM 13882 O O . HOH ZA 5 . ? 73.409 -36.825 -26.278 1.00 35.34 ? 403 HOH B O 1 HETATM 13883 O O . HOH ZA 5 . ? 78.444 -39.987 -39.918 1.00 31.57 ? 404 HOH B O 1 HETATM 13884 O O . HOH ZA 5 . ? 78.189 -26.824 -19.427 1.00 20.82 ? 405 HOH B O 1 HETATM 13885 O O . HOH ZA 5 . ? 88.084 -37.437 -44.828 1.00 30.59 ? 406 HOH B O 1 HETATM 13886 O O . HOH ZA 5 . ? 71.891 -6.664 -4.618 1.00 27.69 ? 407 HOH B O 1 HETATM 13887 O O . HOH ZA 5 . ? 62.760 -11.279 -20.983 1.00 42.69 ? 408 HOH B O 1 HETATM 13888 O O . HOH ZA 5 . ? 68.257 -21.882 -10.107 1.00 26.43 ? 409 HOH B O 1 HETATM 13889 O O . HOH ZA 5 . ? 61.924 -23.592 -25.038 1.00 46.45 ? 410 HOH B O 1 HETATM 13890 O O . HOH ZA 5 . ? 63.805 -59.413 -19.776 1.00 50.91 ? 411 HOH B O 1 HETATM 13891 O O . HOH ZA 5 . ? 80.665 -11.076 -10.643 1.00 35.71 ? 412 HOH B O 1 HETATM 13892 O O . HOH ZA 5 . ? 81.462 -6.612 -30.132 1.00 60.79 ? 413 HOH B O 1 HETATM 13893 O O . HOH ZA 5 . ? 81.685 -28.379 -21.080 1.00 41.91 ? 414 HOH B O 1 HETATM 13894 O O . HOH ZA 5 . ? 71.745 -10.501 -2.444 1.00 31.41 ? 415 HOH B O 1 HETATM 13895 O O . HOH ZA 5 . ? 74.261 -30.674 -30.306 1.00 32.63 ? 416 HOH B O 1 HETATM 13896 O O . HOH ZA 5 . ? 80.430 -43.617 -34.523 1.00 29.80 ? 417 HOH B O 1 HETATM 13897 O O . HOH ZA 5 . ? 71.514 -26.499 -37.174 1.00 40.50 ? 418 HOH B O 1 HETATM 13898 O O . HOH ZA 5 . ? 59.264 -16.270 -23.297 1.00 34.61 ? 419 HOH B O 1 HETATM 13899 O O . HOH ZA 5 . ? 82.033 -10.200 -3.495 1.00 23.40 ? 420 HOH B O 1 HETATM 13900 O O . HOH ZA 5 . ? 71.090 -27.479 -29.234 1.00 36.89 ? 421 HOH B O 1 HETATM 13901 O O . HOH ZA 5 . ? 76.491 -52.011 -34.173 1.00 31.67 ? 422 HOH B O 1 HETATM 13902 O O . HOH ZA 5 . ? 66.929 -18.985 -29.730 1.00 34.33 ? 423 HOH B O 1 HETATM 13903 O O . HOH ZA 5 . ? 71.592 -12.867 -36.744 1.00 32.53 ? 424 HOH B O 1 HETATM 13904 O O . HOH ZA 5 . ? 75.236 -21.412 -6.244 1.00 30.77 ? 425 HOH B O 1 HETATM 13905 O O . HOH ZA 5 . ? 70.463 -41.684 -38.912 1.00 51.30 ? 426 HOH B O 1 HETATM 13906 O O . HOH ZA 5 . ? 58.209 -14.806 -11.404 1.00 25.52 ? 427 HOH B O 1 HETATM 13907 O O . HOH ZA 5 . ? 90.133 -20.016 -23.350 1.00 43.12 ? 428 HOH B O 1 HETATM 13908 O O . HOH ZA 5 . ? 72.145 -1.898 -15.193 1.00 33.25 ? 429 HOH B O 1 HETATM 13909 O O . HOH ZA 5 . ? 67.568 -0.859 -9.337 1.00 38.52 ? 430 HOH B O 1 HETATM 13910 O O . HOH ZA 5 . ? 75.242 -39.968 -23.268 1.00 31.67 ? 431 HOH B O 1 HETATM 13911 O O . HOH ZA 5 . ? 80.735 -4.418 -10.407 1.00 36.12 ? 432 HOH B O 1 HETATM 13912 O O . HOH ZA 5 . ? 84.534 -14.510 -18.447 1.00 44.56 ? 433 HOH B O 1 HETATM 13913 O O . HOH ZA 5 . ? 68.392 -22.313 -7.252 1.00 32.92 ? 434 HOH B O 1 HETATM 13914 O O . HOH ZA 5 . ? 86.250 -16.610 -18.697 1.00 28.29 ? 435 HOH B O 1 HETATM 13915 O O . HOH ZA 5 . ? 63.150 -8.868 -22.422 1.00 38.54 ? 436 HOH B O 1 HETATM 13916 O O . HOH ZA 5 . ? 66.505 -24.348 -13.335 1.00 53.11 ? 437 HOH B O 1 HETATM 13917 O O . HOH ZA 5 . ? 79.974 -42.061 -27.863 1.00 26.80 ? 438 HOH B O 1 HETATM 13918 O O . HOH ZA 5 . ? 64.765 -24.678 -23.993 1.00 54.55 ? 439 HOH B O 1 HETATM 13919 O O . HOH ZA 5 . ? 57.416 -5.665 -18.826 1.00 35.51 ? 440 HOH B O 1 HETATM 13920 O O . HOH ZA 5 . ? 81.930 -23.110 -29.253 1.00 41.08 ? 441 HOH B O 1 HETATM 13921 O O . HOH ZA 5 . ? 80.591 -16.430 -33.500 1.00 37.39 ? 442 HOH B O 1 HETATM 13922 O O . HOH ZA 5 . ? 74.113 -13.030 -5.881 1.00 38.25 ? 443 HOH B O 1 HETATM 13923 O O . HOH ZA 5 . ? 56.778 -12.600 -10.868 1.00 39.34 ? 444 HOH B O 1 HETATM 13924 O O . HOH ZA 5 . ? 62.307 -25.320 -23.195 1.00 50.15 ? 445 HOH B O 1 HETATM 13925 O O . HOH ZA 5 . ? 77.371 -30.322 -36.764 1.00 34.73 ? 446 HOH B O 1 HETATM 13926 O O . HOH ZA 5 . ? 79.383 -26.936 -21.977 1.00 29.10 ? 447 HOH B O 1 HETATM 13927 O O . HOH ZA 5 . ? 84.362 -59.792 -27.076 1.00 32.42 ? 448 HOH B O 1 HETATM 13928 O O . HOH ZA 5 . ? 66.698 -4.654 -11.323 1.00 48.04 ? 449 HOH B O 1 HETATM 13929 O O . HOH ZA 5 . ? 76.206 -1.590 -4.336 1.00 42.14 ? 450 HOH B O 1 HETATM 13930 O O . HOH ZA 5 . ? 77.652 -44.734 -16.733 1.00 34.23 ? 451 HOH B O 1 HETATM 13931 O O . HOH ZA 5 . ? 78.934 -2.727 -22.301 1.00 31.19 ? 452 HOH B O 1 HETATM 13932 O O . HOH ZA 5 . ? 71.341 -8.451 -30.147 1.00 39.47 ? 453 HOH B O 1 HETATM 13933 O O . HOH ZA 5 . ? 71.763 -2.935 -25.447 1.00 41.91 ? 454 HOH B O 1 HETATM 13934 O O . HOH ZA 5 . ? 65.896 -36.155 -26.580 1.00 41.85 ? 455 HOH B O 1 HETATM 13935 O O . HOH ZA 5 . ? 74.600 -0.983 -6.701 1.00 54.06 ? 456 HOH B O 1 HETATM 13936 O O . HOH ZA 5 . ? 75.575 -44.247 -17.936 1.00 43.00 ? 457 HOH B O 1 HETATM 13937 O O . HOH ZA 5 . ? 77.330 -4.114 -14.722 1.00 40.97 ? 458 HOH B O 1 HETATM 13938 O O . HOH ZA 5 . ? 60.292 -4.267 -18.817 1.00 39.06 ? 459 HOH B O 1 HETATM 13939 O O . HOH ZA 5 . ? 71.585 -5.469 -1.960 1.00 44.44 ? 460 HOH B O 1 HETATM 13940 O O . HOH ZA 5 . ? 70.788 -24.402 -10.875 1.00 53.29 ? 461 HOH B O 1 HETATM 13941 O O . HOH ZA 5 . ? 58.998 -15.322 -14.216 1.00 29.11 ? 462 HOH B O 1 HETATM 13942 O O . HOH ZA 5 . ? 59.963 -12.693 -20.794 1.00 25.32 ? 463 HOH B O 1 HETATM 13943 O O . HOH ZA 5 . ? 77.506 -29.565 -33.728 1.00 34.95 ? 464 HOH B O 1 HETATM 13944 O O . HOH ZA 5 . ? 67.249 -48.254 -18.207 1.00 34.80 ? 465 HOH B O 1 HETATM 13945 O O . HOH ZA 5 . ? 77.120 -1.372 -0.704 1.00 35.14 ? 466 HOH B O 1 HETATM 13946 O O . HOH ZA 5 . ? 66.592 -24.936 -22.028 1.00 50.84 ? 467 HOH B O 1 HETATM 13947 O O . HOH ZA 5 . ? 67.180 -9.513 -25.029 1.00 42.40 ? 468 HOH B O 1 HETATM 13948 O O . HOH ZA 5 . ? 71.002 -44.383 -20.013 1.00 36.67 ? 469 HOH B O 1 HETATM 13949 O O . HOH ZA 5 . ? 74.540 -6.772 -1.998 1.00 35.66 ? 470 HOH B O 1 HETATM 13950 O O . HOH ZA 5 . ? 83.531 -18.591 -24.298 1.00 52.60 ? 471 HOH B O 1 HETATM 13951 O O . HOH ZA 5 . ? 82.264 -39.219 -40.940 1.00 34.42 ? 472 HOH B O 1 HETATM 13952 O O . HOH ZA 5 . ? 82.083 -12.719 -31.002 1.00 45.47 ? 473 HOH B O 1 HETATM 13953 O O . HOH ZA 5 . ? 63.335 -17.025 -25.260 1.00 40.36 ? 474 HOH B O 1 HETATM 13954 O O . HOH ZA 5 . ? 68.513 -53.171 -12.910 1.00 57.44 ? 475 HOH B O 1 HETATM 13955 O O . HOH ZA 5 . ? 69.703 -58.054 -32.388 1.00 42.57 ? 476 HOH B O 1 HETATM 13956 O O . HOH ZA 5 . ? 63.672 -54.936 -33.251 1.00 50.57 ? 477 HOH B O 1 HETATM 13957 O O . HOH ZA 5 . ? 71.923 -21.886 -7.817 1.00 43.33 ? 478 HOH B O 1 HETATM 13958 O O . HOH ZA 5 . ? 63.993 -18.854 -28.801 1.00 39.35 ? 479 HOH B O 1 HETATM 13959 O O . HOH ZA 5 . ? 82.142 -41.768 -38.001 1.00 42.09 ? 480 HOH B O 1 HETATM 13960 O O . HOH ZA 5 . ? 68.811 -26.106 -37.980 1.00 43.90 ? 481 HOH B O 1 HETATM 13961 O O . HOH ZA 5 . ? 67.922 -28.900 -28.892 1.00 52.08 ? 482 HOH B O 1 HETATM 13962 O O . HOH ZA 5 . ? 72.913 -55.901 -15.722 1.00 47.58 ? 483 HOH B O 1 HETATM 13963 O O . HOH ZA 5 . ? 78.925 -26.322 -43.566 1.00 49.60 ? 484 HOH B O 1 HETATM 13964 O O . HOH ZA 5 . ? 73.559 -15.550 -2.849 1.00 43.93 ? 485 HOH B O 1 HETATM 13965 O O . HOH ZA 5 . ? 65.037 -4.699 -3.989 1.00 47.82 ? 486 HOH B O 1 HETATM 13966 O O . HOH ZA 5 . ? 83.339 -19.747 -36.153 1.00 57.02 ? 487 HOH B O 1 HETATM 13967 O O . HOH ZA 5 . ? 59.170 -42.189 -33.711 1.00 54.04 ? 488 HOH B O 1 HETATM 13968 O O . HOH ZA 5 . ? 65.794 -31.624 -41.110 1.00 50.08 ? 489 HOH B O 1 HETATM 13969 O O . HOH ZA 5 . ? 56.828 -15.260 -20.943 1.00 45.19 ? 490 HOH B O 1 HETATM 13970 O O . HOH ZA 5 . ? 66.324 -28.461 -31.198 1.00 43.71 ? 491 HOH B O 1 HETATM 13971 O O . HOH ZA 5 . ? 63.494 -54.153 -35.400 1.00 56.05 ? 492 HOH B O 1 HETATM 13972 O O . HOH ZA 5 . ? 85.737 -17.187 -24.142 1.00 65.06 ? 493 HOH B O 1 HETATM 13973 O O . HOH ZA 5 . ? 64.831 -8.902 -5.309 1.00 54.52 ? 494 HOH B O 1 HETATM 13974 O O . HOH ZA 5 . ? 78.552 -27.181 -34.737 1.00 50.30 ? 495 HOH B O 1 HETATM 13975 O O . HOH ZA 5 . ? 78.765 -0.942 -19.135 1.00 57.24 ? 496 HOH B O 1 HETATM 13976 O O . HOH ZA 5 . ? 65.882 -18.954 -32.535 1.00 46.18 ? 497 HOH B O 1 HETATM 13977 O O . HOH ZA 5 . ? 72.608 -2.818 -2.066 1.00 47.26 ? 498 HOH B O 1 HETATM 13978 O O . HOH ZA 5 . ? 65.554 -25.629 -30.899 1.00 45.08 ? 499 HOH B O 1 HETATM 13979 O O . HOH ZA 5 . ? 69.010 2.796 -18.291 1.00 44.43 ? 500 HOH B O 1 HETATM 13980 O O . HOH ZA 5 . ? 72.723 -0.324 -12.622 1.00 51.69 ? 501 HOH B O 1 HETATM 13981 O O . HOH ZA 5 . ? 80.035 -21.545 -38.548 1.00 51.54 ? 502 HOH B O 1 HETATM 13982 O O . HOH ZA 5 . ? 89.310 -38.975 -46.909 1.00 60.32 ? 503 HOH B O 1 HETATM 13983 O O . HOH ZA 5 . ? 67.009 -59.920 -26.227 1.00 55.62 ? 504 HOH B O 1 HETATM 13984 O O . HOH ZA 5 . ? 83.551 -27.856 -18.997 1.00 39.68 ? 505 HOH B O 1 HETATM 13985 O O . HOH ZA 5 . ? 80.473 -28.889 -30.614 1.00 48.66 ? 506 HOH B O 1 HETATM 13986 O O . HOH ZA 5 . ? 73.215 -65.721 -36.873 1.00 50.52 ? 507 HOH B O 1 HETATM 13987 O O . HOH ZA 5 . ? 78.939 -30.593 -29.271 1.00 64.12 ? 508 HOH B O 1 HETATM 13988 O O . HOH ZA 5 . ? 88.301 -41.393 -46.760 1.00 55.10 ? 509 HOH B O 1 HETATM 13989 O O . HOH ZA 5 . ? 70.739 -65.612 -36.078 1.00 65.51 ? 510 HOH B O 1 HETATM 13990 O O . HOH ZA 5 . ? 77.363 -39.555 -42.728 1.00 46.58 ? 511 HOH B O 1 HETATM 13991 O O . HOH ZA 5 . ? 95.562 -22.945 -18.368 1.00 72.44 ? 512 HOH B O 1 HETATM 13992 O O . HOH ZA 5 . ? 66.307 -23.875 -41.756 1.00 50.01 ? 513 HOH B O 1 HETATM 13993 O O . HOH ZA 5 . ? 94.174 -24.131 -20.147 1.00 62.11 ? 514 HOH B O 1 HETATM 13994 O O . HOH ZA 5 . ? 63.790 -63.905 -25.424 1.00 50.68 ? 515 HOH B O 1 HETATM 13995 O O . HOH ZA 5 . ? 73.728 -67.962 -35.810 1.00 53.79 ? 516 HOH B O 1 HETATM 13996 O O . HOH ZA 5 . ? 67.483 -43.443 -19.218 1.00 53.96 ? 517 HOH B O 1 HETATM 13997 O O . HOH ZA 5 . ? 67.125 -15.719 -36.579 1.00 49.71 ? 518 HOH B O 1 HETATM 13998 O O . HOH ZA 5 . ? 72.570 -20.265 -42.455 1.00 57.73 ? 519 HOH B O 1 HETATM 13999 O O . HOH ZA 5 . ? 82.230 -15.300 -30.214 1.00 66.26 ? 520 HOH B O 1 HETATM 14000 O O . HOH ZA 5 . ? 84.245 -26.838 -26.955 1.00 48.63 ? 521 HOH B O 1 HETATM 14001 O O . HOH ZA 5 . ? 69.006 2.071 -3.412 1.00 46.97 ? 522 HOH B O 1 HETATM 14002 O O . HOH ZA 5 . ? 70.537 2.108 -8.637 1.00 61.32 ? 523 HOH B O 1 HETATM 14003 O O . HOH ZA 5 . ? 88.240 -22.165 -29.604 1.00 57.83 ? 524 HOH B O 1 HETATM 14004 O O . HOH ZA 5 . ? 79.875 -19.624 -40.048 1.00 50.52 ? 525 HOH B O 1 HETATM 14005 O O . HOH ZA 5 . ? 61.393 -9.509 -34.785 1.00 62.40 ? 526 HOH B O 1 HETATM 14006 O O . HOH ZA 5 . ? 71.500 -21.051 -4.420 1.00 50.48 ? 527 HOH B O 1 HETATM 14007 O O . HOH ZA 5 . ? 78.092 -29.255 -23.483 1.00 49.06 ? 528 HOH B O 1 HETATM 14008 O O . HOH ZA 5 . ? 60.622 -13.314 -33.760 1.00 57.34 ? 529 HOH B O 1 HETATM 14009 O O . HOH ZA 5 . ? 82.177 -3.085 -16.481 1.00 59.25 ? 530 HOH B O 1 HETATM 14010 O O . HOH ZA 5 . ? 78.698 -64.065 -24.166 1.00 54.14 ? 531 HOH B O 1 HETATM 14011 O O . HOH ZA 5 . ? 66.313 -7.080 -28.951 1.00 47.90 ? 532 HOH B O 1 HETATM 14012 O O . HOH ZA 5 . ? 92.243 -25.636 -20.984 1.00 41.38 ? 533 HOH B O 1 HETATM 14013 O O . HOH ZA 5 . ? 82.990 -34.685 -29.787 1.00 45.64 ? 534 HOH B O 1 HETATM 14014 O O . HOH ZA 5 . ? 68.581 -8.280 -31.110 1.00 59.12 ? 535 HOH B O 1 HETATM 14015 O O . HOH ZA 5 . ? 67.930 -8.665 -33.934 1.00 50.10 ? 536 HOH B O 1 HETATM 14016 O O . HOH ZA 5 . ? 87.786 -24.665 -30.844 1.00 59.62 ? 537 HOH B O 1 HETATM 14017 O O . HOH ZA 5 . ? 84.483 -22.572 -28.644 1.00 63.26 ? 538 HOH B O 1 HETATM 14018 O O . HOH ZA 5 . ? 75.697 -8.196 -36.180 1.00 55.18 ? 539 HOH B O 1 HETATM 14019 O O . HOH ZA 5 . ? 65.433 -7.326 -33.440 1.00 60.51 ? 540 HOH B O 1 HETATM 14020 O O . HOH ZA 5 . ? 68.257 -27.095 -25.713 1.00 48.05 ? 541 HOH B O 1 HETATM 14021 O O . HOH ZA 5 . ? 57.313 -44.148 -24.605 1.00 62.64 ? 542 HOH B O 1 HETATM 14022 O O . HOH ZA 5 . ? 80.938 -31.361 -21.093 1.00 52.27 ? 543 HOH B O 1 HETATM 14023 O O . HOH ZA 5 . ? 61.964 -53.822 -31.384 1.00 58.25 ? 544 HOH B O 1 HETATM 14024 O O . HOH ZA 5 . ? 62.134 -24.816 -18.848 1.00 64.82 ? 545 HOH B O 1 HETATM 14025 O O . HOH ZA 5 . ? 82.579 -32.737 -37.113 1.00 41.04 ? 546 HOH B O 1 HETATM 14026 O O . HOH ZA 5 . ? 84.805 -2.618 -16.208 1.00 54.32 ? 547 HOH B O 1 HETATM 14027 O O . HOH ZA 5 . ? 74.882 -55.973 -13.402 1.00 51.12 ? 548 HOH B O 1 HETATM 14028 O O . HOH ZA 5 . ? 68.548 -62.487 -24.614 1.00 58.02 ? 549 HOH B O 1 HETATM 14029 O O . HOH ZA 5 . ? 65.315 -2.739 -13.513 1.00 33.80 ? 550 HOH B O 1 HETATM 14030 O O . HOH ZA 5 . ? 56.372 -16.934 -23.809 1.00 48.65 ? 551 HOH B O 1 HETATM 14031 O O . HOH ZA 5 . ? 54.766 -17.859 -25.557 1.00 53.71 ? 552 HOH B O 1 HETATM 14032 O O . HOH AB 5 . ? 40.309 -19.081 6.511 1.00 23.35 ? 401 HOH C O 1 HETATM 14033 O O . HOH AB 5 . ? 57.819 -22.618 10.977 1.00 33.95 ? 402 HOH C O 1 HETATM 14034 O O . HOH AB 5 . ? 39.691 -27.231 8.698 1.00 45.08 ? 403 HOH C O 1 HETATM 14035 O O . HOH AB 5 . ? 9.729 -24.589 14.265 1.00 40.66 ? 404 HOH C O 1 HETATM 14036 O O . HOH AB 5 . ? 19.965 -25.552 13.063 1.00 47.72 ? 405 HOH C O 1 HETATM 14037 O O . HOH AB 5 . ? 51.803 -34.713 5.425 1.00 26.19 ? 406 HOH C O 1 HETATM 14038 O O . HOH AB 5 . ? 54.594 -36.608 1.292 1.00 29.44 ? 407 HOH C O 1 HETATM 14039 O O . HOH AB 5 . ? 36.926 -15.710 19.265 1.00 43.99 ? 408 HOH C O 1 HETATM 14040 O O . HOH AB 5 . ? 42.004 -16.933 7.769 1.00 38.33 ? 409 HOH C O 1 HETATM 14041 O O . HOH AB 5 . ? 19.107 -28.930 12.576 1.00 51.18 ? 410 HOH C O 1 HETATM 14042 O O . HOH AB 5 . ? 23.117 -34.060 17.503 1.00 37.35 ? 411 HOH C O 1 HETATM 14043 O O . HOH AB 5 . ? 53.977 -32.865 16.552 1.00 37.13 ? 412 HOH C O 1 HETATM 14044 O O . HOH AB 5 . ? 55.472 -36.729 11.251 1.00 36.82 ? 413 HOH C O 1 HETATM 14045 O O . HOH AB 5 . ? 17.695 -27.205 12.285 1.00 49.92 ? 414 HOH C O 1 HETATM 14046 O O . HOH AB 5 . ? 44.059 -13.872 13.270 1.00 41.84 ? 415 HOH C O 1 HETATM 14047 O O . HOH AB 5 . ? 57.700 -19.852 16.624 1.00 52.08 ? 416 HOH C O 1 HETATM 14048 O O . HOH AB 5 . ? 51.488 -10.792 13.463 1.00 61.42 ? 417 HOH C O 1 HETATM 14049 O O . HOH AB 5 . ? 38.421 -24.525 10.339 1.00 42.16 ? 418 HOH C O 1 HETATM 14050 O O . HOH AB 5 . ? 41.949 -7.693 19.327 1.00 48.07 ? 419 HOH C O 1 HETATM 14051 O O . HOH AB 5 . ? 17.340 -37.091 11.545 1.00 41.84 ? 420 HOH C O 1 HETATM 14052 O O . HOH AB 5 . ? 59.231 -41.027 3.253 1.00 51.32 ? 421 HOH C O 1 HETATM 14053 O O . HOH AB 5 . ? 6.554 -31.116 28.669 1.00 50.18 ? 422 HOH C O 1 HETATM 14054 O O . HOH AB 5 . ? 47.378 -14.116 4.024 1.00 35.53 ? 423 HOH C O 1 HETATM 14055 O O . HOH AB 5 . ? 61.178 -13.668 3.481 1.00 51.42 ? 424 HOH C O 1 HETATM 14056 O O . HOH AB 5 . ? 67.107 -25.765 7.296 1.00 62.22 ? 425 HOH C O 1 HETATM 14057 O O . HOH AB 5 . ? 38.049 -17.934 1.869 1.00 45.57 ? 426 HOH C O 1 HETATM 14058 O O . HOH AB 5 . ? 30.664 -25.594 14.521 1.00 39.27 ? 427 HOH C O 1 HETATM 14059 O O . HOH AB 5 . ? 55.146 -33.626 1.398 1.00 21.33 ? 428 HOH C O 1 HETATM 14060 O O . HOH AB 5 . ? 29.138 -17.522 17.114 1.00 45.04 ? 429 HOH C O 1 HETATM 14061 O O . HOH AB 5 . ? 62.100 -30.670 1.515 1.00 38.55 ? 430 HOH C O 1 HETATM 14062 O O . HOH AB 5 . ? 60.361 -31.574 -6.440 1.00 32.70 ? 431 HOH C O 1 HETATM 14063 O O . HOH AB 5 . ? 59.392 -30.299 -8.136 1.00 43.35 ? 432 HOH C O 1 HETATM 14064 O O . HOH AB 5 . ? 27.738 -16.533 19.227 1.00 51.14 ? 433 HOH C O 1 HETATM 14065 O O . HOH AB 5 . ? 41.757 -13.295 11.682 1.00 49.11 ? 434 HOH C O 1 HETATM 14066 O O . HOH AB 5 . ? 60.789 -36.685 12.785 1.00 48.14 ? 435 HOH C O 1 HETATM 14067 O O . HOH AB 5 . ? 49.694 -8.682 13.006 1.00 46.83 ? 436 HOH C O 1 HETATM 14068 O O . HOH AB 5 . ? 48.887 -7.652 10.147 1.00 55.36 ? 437 HOH C O 1 HETATM 14069 O O . HOH AB 5 . ? 22.806 -31.466 24.894 1.00 52.58 ? 438 HOH C O 1 HETATM 14070 O O . HOH AB 5 . ? 50.817 -36.898 4.353 1.00 42.55 ? 439 HOH C O 1 HETATM 14071 O O . HOH AB 5 . ? 54.879 -40.135 10.824 1.00 59.80 ? 440 HOH C O 1 HETATM 14072 O O . HOH AB 5 . ? 34.325 -19.242 8.951 1.00 46.62 ? 441 HOH C O 1 HETATM 14073 O O . HOH AB 5 . ? 51.922 -37.421 1.653 1.00 44.67 ? 442 HOH C O 1 HETATM 14074 O O . HOH AB 5 . ? 10.079 -33.446 34.431 1.00 60.70 ? 443 HOH C O 1 HETATM 14075 O O . HOH AB 5 . ? 3.426 -41.324 14.142 1.00 60.29 ? 444 HOH C O 1 HETATM 14076 O O . HOH AB 5 . ? 61.477 -33.592 15.912 1.00 46.46 ? 445 HOH C O 1 HETATM 14077 O O . HOH AB 5 . ? 35.836 -24.307 19.422 1.00 50.71 ? 446 HOH C O 1 HETATM 14078 O O . HOH AB 5 . ? 0.987 -25.175 16.838 1.00 55.01 ? 447 HOH C O 1 HETATM 14079 O O . HOH AB 5 . ? 7.290 -39.156 15.873 1.00 52.68 ? 448 HOH C O 1 HETATM 14080 O O . HOH AB 5 . ? 15.307 -37.073 9.656 1.00 48.09 ? 449 HOH C O 1 HETATM 14081 O O . HOH AB 5 . ? 33.933 -24.904 25.251 1.00 67.03 ? 450 HOH C O 1 HETATM 14082 O O . HOH AB 5 . ? 43.873 -17.137 0.603 1.00 48.70 ? 451 HOH C O 1 HETATM 14083 O O . HOH AB 5 . ? 59.537 -41.015 6.368 1.00 60.83 ? 452 HOH C O 1 HETATM 14084 O O . HOH AB 5 . ? 56.573 -33.459 -6.838 1.00 46.38 ? 453 HOH C O 1 HETATM 14085 O O . HOH AB 5 . ? 19.331 -28.139 15.107 1.00 50.04 ? 454 HOH C O 1 HETATM 14086 O O . HOH AB 5 . ? 48.700 -39.663 6.234 1.00 51.34 ? 455 HOH C O 1 HETATM 14087 O O . HOH AB 5 . ? -5.995 -27.818 21.403 1.00 68.02 ? 456 HOH C O 1 HETATM 14088 O O . HOH AB 5 . ? 60.851 -33.814 -1.047 1.00 49.10 ? 457 HOH C O 1 HETATM 14089 O O . HOH AB 5 . ? -6.053 -25.104 19.962 1.00 70.72 ? 458 HOH C O 1 HETATM 14090 O O . HOH AB 5 . ? 61.377 -33.646 -3.689 1.00 52.64 ? 459 HOH C O 1 HETATM 14091 O O . HOH AB 5 . ? 57.485 -40.550 12.363 1.00 49.90 ? 460 HOH C O 1 HETATM 14092 O O . HOH AB 5 . ? 13.302 -31.637 11.588 1.00 53.75 ? 461 HOH C O 1 HETATM 14093 O O . HOH AB 5 . ? 38.372 -24.256 13.276 1.00 51.02 ? 462 HOH C O 1 HETATM 14094 O O . HOH AB 5 . ? 29.250 -31.030 17.820 1.00 53.28 ? 463 HOH C O 1 HETATM 14095 O O . HOH AB 5 . ? 34.672 -22.283 16.564 1.00 48.74 ? 464 HOH C O 1 HETATM 14096 O O . HOH AB 5 . ? 50.956 -12.577 10.205 1.00 40.96 ? 465 HOH C O 1 HETATM 14097 O O . HOH AB 5 . ? 36.955 -22.091 18.233 1.00 61.88 ? 466 HOH C O 1 HETATM 14098 O O . HOH AB 5 . ? 50.437 -9.918 10.635 1.00 49.65 ? 467 HOH C O 1 HETATM 14099 O O . HOH AB 5 . ? 60.286 -40.529 11.435 1.00 48.72 ? 468 HOH C O 1 HETATM 14100 O O . HOH AB 5 . ? 47.633 -9.819 13.464 1.00 61.91 ? 469 HOH C O 1 HETATM 14101 O O . HOH AB 5 . ? 57.165 -39.011 -2.584 1.00 43.65 ? 470 HOH C O 1 HETATM 14102 O O . HOH AB 5 . ? 23.279 -35.798 15.095 1.00 49.29 ? 471 HOH C O 1 HETATM 14103 O O . HOH AB 5 . ? 4.534 -18.956 11.564 1.00 46.69 ? 472 HOH C O 1 HETATM 14104 O O . HOH AB 5 . ? 0.185 -21.535 6.622 1.00 42.88 ? 473 HOH C O 1 HETATM 14105 O O . HOH AB 5 . ? -2.752 -22.460 21.886 1.00 60.22 ? 474 HOH C O 1 HETATM 14106 O O . HOH AB 5 . ? 15.268 -35.713 21.905 1.00 55.26 ? 475 HOH C O 1 HETATM 14107 O O . HOH AB 5 . ? 44.763 -20.103 29.245 1.00 49.27 ? 476 HOH C O 1 HETATM 14108 O O . HOH AB 5 . ? 52.000 -13.208 4.102 1.00 47.80 ? 477 HOH C O 1 HETATM 14109 O O . HOH AB 5 . ? 27.428 -28.509 14.918 1.00 43.89 ? 478 HOH C O 1 HETATM 14110 O O . HOH AB 5 . ? 39.755 -28.979 11.925 1.00 51.54 ? 479 HOH C O 1 HETATM 14111 O O . HOH AB 5 . ? 52.637 -8.891 14.104 1.00 66.22 ? 480 HOH C O 1 HETATM 14112 O O . HOH AB 5 . ? 8.340 -25.196 10.946 1.00 58.30 ? 481 HOH C O 1 HETATM 14113 O O . HOH AB 5 . ? 49.670 -9.034 7.860 1.00 38.16 ? 482 HOH C O 1 HETATM 14114 O O . HOH AB 5 . ? 66.443 -36.316 8.763 1.00 43.92 ? 483 HOH C O 1 HETATM 14115 O O . HOH AB 5 . ? 18.367 -38.414 22.801 1.00 57.58 ? 484 HOH C O 1 HETATM 14116 O O . HOH AB 5 . ? 64.850 -37.389 10.551 1.00 51.59 ? 485 HOH C O 1 HETATM 14117 O O . HOH AB 5 . ? 1.414 -22.986 18.679 1.00 59.75 ? 486 HOH C O 1 HETATM 14118 O O . HOH AB 5 . ? 44.414 -26.728 25.749 1.00 52.05 ? 487 HOH C O 1 HETATM 14119 O O . HOH AB 5 . ? 50.229 -8.228 5.848 1.00 43.61 ? 488 HOH C O 1 HETATM 14120 O O . HOH AB 5 . ? 48.355 -5.053 9.398 1.00 43.40 ? 489 HOH C O 1 HETATM 14121 O O . HOH AB 5 . ? 56.698 -41.782 7.044 1.00 57.77 ? 490 HOH C O 1 HETATM 14122 O O . HOH AB 5 . ? 62.363 -16.193 3.863 1.00 48.94 ? 491 HOH C O 1 HETATM 14123 O O . HOH AB 5 . ? 63.929 -17.046 2.535 1.00 41.83 ? 492 HOH C O 1 HETATM 14124 O O . HOH AB 5 . ? 36.156 -30.116 17.100 1.00 60.75 ? 493 HOH C O 1 HETATM 14125 O O . HOH AB 5 . ? 38.046 -14.761 2.776 1.00 52.96 ? 494 HOH C O 1 HETATM 14126 O O . HOH AB 5 . ? 59.336 -33.055 17.965 1.00 54.38 ? 495 HOH C O 1 HETATM 14127 O O . HOH AB 5 . ? -6.709 -30.180 21.005 1.00 58.14 ? 496 HOH C O 1 HETATM 14128 O O . HOH AB 5 . ? 57.312 -37.911 13.156 1.00 53.46 ? 497 HOH C O 1 HETATM 14129 O O . HOH AB 5 . ? 37.195 -23.659 28.222 1.00 77.51 ? 498 HOH C O 1 HETATM 14130 O O . HOH AB 5 . ? 36.105 -24.492 30.146 1.00 56.12 ? 499 HOH C O 1 HETATM 14131 O O . HOH AB 5 . ? 62.474 -35.137 18.936 1.00 55.80 ? 500 HOH C O 1 HETATM 14132 O O . HOH AB 5 . ? 50.995 -17.233 28.194 1.00 56.48 ? 501 HOH C O 1 HETATM 14133 O O . HOH BB 5 . ? 49.614 -33.251 -0.754 1.00 32.32 ? 401 HOH D O 1 HETATM 14134 O O . HOH BB 5 . ? 22.352 -18.402 -8.020 1.00 40.73 ? 402 HOH D O 1 HETATM 14135 O O . HOH BB 5 . ? 35.187 -14.444 -14.789 1.00 28.79 ? 403 HOH D O 1 HETATM 14136 O O . HOH BB 5 . ? 54.828 -19.402 -8.604 1.00 19.70 ? 404 HOH D O 1 HETATM 14137 O O . HOH BB 5 . ? 52.484 -19.489 -15.793 1.00 18.21 ? 405 HOH D O 1 HETATM 14138 O O . HOH BB 5 . ? 55.982 -27.913 -10.379 1.00 23.12 ? 406 HOH D O 1 HETATM 14139 O O . HOH BB 5 . ? 14.334 -9.776 0.445 1.00 25.13 ? 407 HOH D O 1 HETATM 14140 O O . HOH BB 5 . ? 21.861 -11.164 5.159 1.00 32.22 ? 408 HOH D O 1 HETATM 14141 O O . HOH BB 5 . ? 39.569 -17.496 -0.935 1.00 38.48 ? 409 HOH D O 1 HETATM 14142 O O . HOH BB 5 . ? 24.984 -26.429 4.023 1.00 37.77 ? 410 HOH D O 1 HETATM 14143 O O . HOH BB 5 . ? 24.006 -23.601 -3.115 1.00 32.45 ? 411 HOH D O 1 HETATM 14144 O O . HOH BB 5 . ? 12.378 -30.372 1.013 1.00 46.63 ? 412 HOH D O 1 HETATM 14145 O O . HOH BB 5 . ? 41.626 -14.987 -4.069 1.00 23.46 ? 413 HOH D O 1 HETATM 14146 O O . HOH BB 5 . ? 59.345 -24.391 -3.122 1.00 31.12 ? 414 HOH D O 1 HETATM 14147 O O . HOH BB 5 . ? 43.171 -42.242 -8.495 1.00 42.91 ? 415 HOH D O 1 HETATM 14148 O O . HOH BB 5 . ? 42.124 -35.774 -16.825 1.00 33.53 ? 416 HOH D O 1 HETATM 14149 O O . HOH BB 5 . ? 23.943 -37.563 -8.664 1.00 43.07 ? 417 HOH D O 1 HETATM 14150 O O . HOH BB 5 . ? 28.391 -30.757 -4.174 1.00 38.85 ? 418 HOH D O 1 HETATM 14151 O O . HOH BB 5 . ? 56.428 -17.231 -9.056 1.00 27.29 ? 419 HOH D O 1 HETATM 14152 O O . HOH BB 5 . ? 54.854 -22.943 -23.133 1.00 56.55 ? 420 HOH D O 1 HETATM 14153 O O . HOH BB 5 . ? 16.950 -4.847 7.284 1.00 39.07 ? 421 HOH D O 1 HETATM 14154 O O . HOH BB 5 . ? 24.821 -8.523 2.709 1.00 41.09 ? 422 HOH D O 1 HETATM 14155 O O . HOH BB 5 . ? 53.677 -35.348 -12.904 1.00 27.94 ? 423 HOH D O 1 HETATM 14156 O O . HOH BB 5 . ? 29.255 -27.002 -4.977 1.00 35.67 ? 424 HOH D O 1 HETATM 14157 O O . HOH BB 5 . ? 48.609 -33.483 -18.594 1.00 43.02 ? 425 HOH D O 1 HETATM 14158 O O . HOH BB 5 . ? 48.629 -33.704 2.323 1.00 33.38 ? 426 HOH D O 1 HETATM 14159 O O . HOH BB 5 . ? 8.200 -9.888 9.018 1.00 35.09 ? 427 HOH D O 1 HETATM 14160 O O . HOH BB 5 . ? 34.422 -25.234 -15.229 1.00 45.22 ? 428 HOH D O 1 HETATM 14161 O O . HOH BB 5 . ? 51.795 -13.313 -2.266 1.00 46.68 ? 429 HOH D O 1 HETATM 14162 O O . HOH BB 5 . ? 26.627 -28.510 -4.801 1.00 40.37 ? 430 HOH D O 1 HETATM 14163 O O . HOH BB 5 . ? 46.692 -16.934 1.262 1.00 44.97 ? 431 HOH D O 1 HETATM 14164 O O . HOH BB 5 . ? 26.007 -20.779 -10.793 1.00 50.94 ? 432 HOH D O 1 HETATM 14165 O O . HOH BB 5 . ? 54.962 -27.336 -12.627 1.00 36.76 ? 433 HOH D O 1 HETATM 14166 O O . HOH BB 5 . ? 55.925 -11.471 -8.687 1.00 33.72 ? 434 HOH D O 1 HETATM 14167 O O . HOH BB 5 . ? 38.361 -42.300 -7.384 1.00 34.09 ? 435 HOH D O 1 HETATM 14168 O O . HOH BB 5 . ? 18.141 -37.240 -3.281 1.00 60.76 ? 436 HOH D O 1 HETATM 14169 O O . HOH BB 5 . ? 26.818 -43.431 -12.385 1.00 52.10 ? 437 HOH D O 1 HETATM 14170 O O . HOH BB 5 . ? 61.669 -23.092 -3.947 1.00 46.78 ? 438 HOH D O 1 HETATM 14171 O O . HOH BB 5 . ? 25.694 -24.321 4.065 1.00 48.15 ? 439 HOH D O 1 HETATM 14172 O O . HOH BB 5 . ? 37.283 -27.506 3.203 1.00 27.77 ? 440 HOH D O 1 HETATM 14173 O O . HOH BB 5 . ? 26.462 -36.380 2.321 1.00 40.60 ? 441 HOH D O 1 HETATM 14174 O O . HOH BB 5 . ? 35.909 -38.263 0.082 1.00 32.72 ? 442 HOH D O 1 HETATM 14175 O O . HOH BB 5 . ? 31.603 -44.157 -5.682 1.00 37.35 ? 443 HOH D O 1 HETATM 14176 O O . HOH BB 5 . ? 47.845 -14.821 -18.908 1.00 32.50 ? 444 HOH D O 1 HETATM 14177 O O . HOH BB 5 . ? 36.412 -29.985 3.189 1.00 34.66 ? 445 HOH D O 1 HETATM 14178 O O . HOH BB 5 . ? 20.978 -16.067 -0.180 1.00 33.88 ? 446 HOH D O 1 HETATM 14179 O O . HOH BB 5 . ? 26.080 -42.780 -4.166 1.00 36.83 ? 447 HOH D O 1 HETATM 14180 O O . HOH BB 5 . ? 14.589 -35.781 5.680 1.00 35.38 ? 448 HOH D O 1 HETATM 14181 O O . HOH BB 5 . ? 35.180 -39.720 -16.476 1.00 35.42 ? 449 HOH D O 1 HETATM 14182 O O . HOH BB 5 . ? 23.426 -13.227 6.721 1.00 43.36 ? 450 HOH D O 1 HETATM 14183 O O . HOH BB 5 . ? 36.576 -30.453 5.937 1.00 50.94 ? 451 HOH D O 1 HETATM 14184 O O . HOH BB 5 . ? 30.773 -45.951 -3.573 1.00 51.48 ? 452 HOH D O 1 HETATM 14185 O O . HOH BB 5 . ? 35.503 -19.699 0.914 1.00 42.89 ? 453 HOH D O 1 HETATM 14186 O O . HOH BB 5 . ? 24.410 -19.003 4.416 1.00 31.53 ? 454 HOH D O 1 HETATM 14187 O O . HOH BB 5 . ? 59.175 -27.420 -11.512 1.00 52.74 ? 455 HOH D O 1 HETATM 14188 O O . HOH BB 5 . ? 38.177 -39.378 1.271 1.00 46.53 ? 456 HOH D O 1 HETATM 14189 O O . HOH BB 5 . ? 24.789 -21.805 4.838 1.00 45.87 ? 457 HOH D O 1 HETATM 14190 O O . HOH BB 5 . ? 42.277 -29.471 -17.691 1.00 51.49 ? 458 HOH D O 1 HETATM 14191 O O . HOH BB 5 . ? 54.722 -16.339 -19.917 1.00 32.99 ? 459 HOH D O 1 HETATM 14192 O O . HOH BB 5 . ? 18.082 -14.317 -10.096 1.00 42.50 ? 460 HOH D O 1 HETATM 14193 O O . HOH BB 5 . ? 39.730 -22.596 -19.156 1.00 43.56 ? 461 HOH D O 1 HETATM 14194 O O . HOH BB 5 . ? 8.017 -8.187 11.375 1.00 41.01 ? 462 HOH D O 1 HETATM 14195 O O . HOH BB 5 . ? 32.457 -30.687 -12.642 1.00 48.71 ? 463 HOH D O 1 HETATM 14196 O O . HOH BB 5 . ? 25.513 -23.020 7.403 1.00 44.77 ? 464 HOH D O 1 HETATM 14197 O O . HOH BB 5 . ? 12.396 -3.110 21.253 1.00 60.49 ? 465 HOH D O 1 HETATM 14198 O O . HOH BB 5 . ? 29.096 -42.419 -5.226 1.00 42.42 ? 466 HOH D O 1 HETATM 14199 O O . HOH BB 5 . ? 59.432 -12.250 -4.284 1.00 35.88 ? 467 HOH D O 1 HETATM 14200 O O . HOH BB 5 . ? 27.007 -26.093 6.691 1.00 52.58 ? 468 HOH D O 1 HETATM 14201 O O . HOH BB 5 . ? 57.309 -25.157 -7.736 1.00 48.31 ? 469 HOH D O 1 HETATM 14202 O O . HOH BB 5 . ? 25.534 -35.707 -12.834 1.00 46.53 ? 470 HOH D O 1 HETATM 14203 O O . HOH BB 5 . ? 54.895 -35.021 -8.255 1.00 34.32 ? 471 HOH D O 1 HETATM 14204 O O . HOH BB 5 . ? 58.554 -25.291 -5.593 1.00 42.42 ? 472 HOH D O 1 HETATM 14205 O O . HOH BB 5 . ? 23.758 -35.692 -10.845 1.00 44.37 ? 473 HOH D O 1 HETATM 14206 O O . HOH BB 5 . ? 23.437 -10.444 -0.555 1.00 30.51 ? 474 HOH D O 1 HETATM 14207 O O . HOH BB 5 . ? 41.959 -23.550 -18.581 1.00 44.35 ? 475 HOH D O 1 HETATM 14208 O O . HOH BB 5 . ? 30.640 -25.105 -3.367 1.00 30.41 ? 476 HOH D O 1 HETATM 14209 O O . HOH BB 5 . ? 12.398 -6.551 4.266 1.00 50.61 ? 477 HOH D O 1 HETATM 14210 O O . HOH BB 5 . ? 44.308 -5.758 -8.795 1.00 30.35 ? 478 HOH D O 1 HETATM 14211 O O . HOH BB 5 . ? 16.138 -15.300 -10.666 1.00 37.66 ? 479 HOH D O 1 HETATM 14212 O O . HOH BB 5 . ? 46.997 -44.662 -9.738 1.00 42.91 ? 480 HOH D O 1 HETATM 14213 O O . HOH BB 5 . ? 33.948 -38.641 1.975 1.00 42.67 ? 481 HOH D O 1 HETATM 14214 O O . HOH BB 5 . ? 8.667 -18.564 19.136 1.00 63.30 ? 482 HOH D O 1 HETATM 14215 O O . HOH BB 5 . ? 30.585 -38.918 -1.099 1.00 42.87 ? 483 HOH D O 1 HETATM 14216 O O . HOH BB 5 . ? 36.312 -45.304 -4.078 1.00 36.66 ? 484 HOH D O 1 HETATM 14217 O O . HOH BB 5 . ? 56.617 -31.924 -13.950 1.00 46.05 ? 485 HOH D O 1 HETATM 14218 O O . HOH BB 5 . ? 50.536 -9.589 -14.418 1.00 46.62 ? 486 HOH D O 1 HETATM 14219 O O . HOH BB 5 . ? 31.566 -28.076 -14.535 1.00 50.48 ? 487 HOH D O 1 HETATM 14220 O O . HOH BB 5 . ? 47.975 -42.273 -11.332 1.00 50.95 ? 488 HOH D O 1 HETATM 14221 O O . HOH BB 5 . ? 39.771 -42.369 -15.893 1.00 49.82 ? 489 HOH D O 1 HETATM 14222 O O . HOH BB 5 . ? 19.418 -37.010 -11.738 1.00 54.88 ? 490 HOH D O 1 HETATM 14223 O O . HOH BB 5 . ? 25.074 -21.196 -2.345 1.00 55.52 ? 491 HOH D O 1 HETATM 14224 O O . HOH BB 5 . ? 45.120 -12.965 -19.757 1.00 42.32 ? 492 HOH D O 1 HETATM 14225 O O . HOH BB 5 . ? 24.853 -7.995 -0.297 1.00 43.79 ? 493 HOH D O 1 HETATM 14226 O O . HOH BB 5 . ? 13.604 -16.262 -9.838 1.00 49.08 ? 494 HOH D O 1 HETATM 14227 O O . HOH BB 5 . ? 29.096 -25.970 -7.509 1.00 42.62 ? 495 HOH D O 1 HETATM 14228 O O . HOH BB 5 . ? 24.267 -11.332 3.803 1.00 47.28 ? 496 HOH D O 1 HETATM 14229 O O . HOH BB 5 . ? 24.963 -43.552 -10.517 1.00 46.71 ? 497 HOH D O 1 HETATM 14230 O O . HOH BB 5 . ? 20.286 -4.041 11.335 1.00 47.17 ? 498 HOH D O 1 HETATM 14231 O O . HOH BB 5 . ? 17.903 -39.632 -5.215 1.00 57.60 ? 499 HOH D O 1 HETATM 14232 O O . HOH BB 5 . ? 27.082 -21.528 2.066 1.00 45.40 ? 500 HOH D O 1 HETATM 14233 O O . HOH BB 5 . ? 40.122 -12.842 -22.047 1.00 51.90 ? 501 HOH D O 1 HETATM 14234 O O . HOH BB 5 . ? 43.869 -37.154 8.221 1.00 29.77 ? 502 HOH D O 1 HETATM 14235 O O . HOH BB 5 . ? 58.674 -26.351 -14.444 1.00 49.65 ? 503 HOH D O 1 HETATM 14236 O O . HOH BB 5 . ? 26.748 -32.595 0.478 1.00 35.16 ? 504 HOH D O 1 HETATM 14237 O O . HOH BB 5 . ? 26.207 -44.808 -5.678 1.00 56.57 ? 505 HOH D O 1 HETATM 14238 O O . HOH BB 5 . ? 41.011 -40.487 -4.765 1.00 44.13 ? 506 HOH D O 1 HETATM 14239 O O . HOH BB 5 . ? 47.861 -25.861 -20.527 1.00 49.17 ? 507 HOH D O 1 HETATM 14240 O O . HOH BB 5 . ? 44.601 -37.665 10.464 1.00 54.26 ? 508 HOH D O 1 HETATM 14241 O O . HOH BB 5 . ? 8.089 -14.699 -2.563 1.00 50.30 ? 509 HOH D O 1 HETATM 14242 O O . HOH BB 5 . ? 28.524 -32.742 2.414 1.00 49.77 ? 510 HOH D O 1 HETATM 14243 O O . HOH BB 5 . ? 18.773 -5.209 13.296 1.00 42.43 ? 511 HOH D O 1 HETATM 14244 O O . HOH BB 5 . ? 42.219 -12.766 -2.167 1.00 40.55 ? 512 HOH D O 1 HETATM 14245 O O . HOH BB 5 . ? 31.903 -22.592 -5.133 1.00 42.87 ? 513 HOH D O 1 HETATM 14246 O O . HOH BB 5 . ? 58.956 -27.819 -19.694 1.00 53.72 ? 514 HOH D O 1 HETATM 14247 O O . HOH BB 5 . ? 28.199 -34.537 5.704 1.00 47.80 ? 515 HOH D O 1 HETATM 14248 O O . HOH BB 5 . ? 24.929 -39.547 -1.085 1.00 45.86 ? 516 HOH D O 1 HETATM 14249 O O . HOH BB 5 . ? 29.344 -44.864 -1.608 1.00 47.23 ? 517 HOH D O 1 HETATM 14250 O O . HOH BB 5 . ? 34.359 -43.629 -16.381 1.00 46.40 ? 518 HOH D O 1 HETATM 14251 O O . HOH BB 5 . ? 66.027 -19.680 4.186 1.00 53.81 ? 519 HOH D O 1 HETATM 14252 O O . HOH BB 5 . ? 47.109 -20.669 -23.817 1.00 44.14 ? 520 HOH D O 1 HETATM 14253 O O . HOH BB 5 . ? 24.621 -42.270 -2.062 1.00 50.30 ? 521 HOH D O 1 HETATM 14254 O O . HOH BB 5 . ? 23.970 -16.266 6.529 1.00 49.61 ? 522 HOH D O 1 HETATM 14255 O O . HOH BB 5 . ? 32.094 -45.693 -7.873 1.00 47.29 ? 523 HOH D O 1 HETATM 14256 O O . HOH BB 5 . ? 40.150 -34.611 -19.205 1.00 43.54 ? 524 HOH D O 1 HETATM 14257 O O . HOH BB 5 . ? 16.365 -4.692 12.408 1.00 48.60 ? 525 HOH D O 1 HETATM 14258 O O . HOH BB 5 . ? 49.166 -19.803 -25.368 1.00 49.06 ? 526 HOH D O 1 HETATM 14259 O O . HOH BB 5 . ? 38.521 -43.689 -10.390 1.00 48.03 ? 527 HOH D O 1 HETATM 14260 O O . HOH BB 5 . ? 27.945 -21.182 -2.995 1.00 43.79 ? 528 HOH D O 1 HETATM 14261 O O . HOH BB 5 . ? 51.306 -12.615 -13.086 1.00 49.59 ? 529 HOH D O 1 HETATM 14262 O O . HOH BB 5 . ? 35.206 -45.704 -14.878 1.00 47.35 ? 530 HOH D O 1 HETATM 14263 O O . HOH BB 5 . ? 28.295 -23.079 -4.532 1.00 53.92 ? 531 HOH D O 1 HETATM 14264 O O . HOH BB 5 . ? 9.691 -14.395 -4.623 1.00 31.15 ? 532 HOH D O 1 HETATM 14265 O O . HOH BB 5 . ? 46.992 -6.206 -9.353 1.00 37.89 ? 533 HOH D O 1 HETATM 14266 O O . HOH BB 5 . ? 27.362 -42.627 -2.307 1.00 39.64 ? 534 HOH D O 1 HETATM 14267 O O . HOH BB 5 . ? 9.883 -17.648 -2.791 1.00 41.44 ? 535 HOH D O 1 HETATM 14268 O O . HOH BB 5 . ? 58.857 -22.889 -22.945 1.00 43.93 ? 536 HOH D O 1 HETATM 14269 O O . HOH BB 5 . ? 26.419 -24.979 -5.244 1.00 45.06 ? 537 HOH D O 1 HETATM 14270 O O . HOH BB 5 . ? 50.494 -13.163 -20.128 1.00 63.11 ? 538 HOH D O 1 HETATM 14271 O O . HOH BB 5 . ? 23.738 -12.125 1.212 1.00 52.18 ? 539 HOH D O 1 HETATM 14272 O O . HOH BB 5 . ? 46.254 -18.976 -24.863 1.00 47.53 ? 540 HOH D O 1 HETATM 14273 O O . HOH BB 5 . ? 9.561 -23.849 0.936 1.00 46.54 ? 541 HOH D O 1 HETATM 14274 O O . HOH BB 5 . ? 10.657 -24.399 -1.371 1.00 42.28 ? 542 HOH D O 1 HETATM 14275 O O . HOH BB 5 . ? 21.523 -26.802 11.610 1.00 49.18 ? 543 HOH D O 1 HETATM 14276 O O . HOH BB 5 . ? 45.061 -23.224 -23.886 1.00 46.10 ? 544 HOH D O 1 HETATM 14277 O O . HOH BB 5 . ? 31.920 -23.378 -7.619 1.00 53.58 ? 545 HOH D O 1 HETATM 14278 O O . HOH BB 5 . ? 41.262 -7.132 -4.770 1.00 47.63 ? 546 HOH D O 1 HETATM 14279 O O . HOH BB 5 . ? 19.739 -21.278 -7.679 1.00 40.50 ? 547 HOH D O 1 HETATM 14280 O O . HOH BB 5 . ? 22.546 -5.460 9.749 1.00 36.70 ? 548 HOH D O 1 HETATM 14281 O O . HOH BB 5 . ? 60.051 -24.455 -20.737 1.00 59.80 ? 549 HOH D O 1 HETATM 14282 O O . HOH BB 5 . ? 3.654 -13.170 21.361 1.00 53.58 ? 550 HOH D O 1 HETATM 14283 O O . HOH BB 5 . ? 39.840 -16.706 -25.916 1.00 50.19 ? 551 HOH D O 1 HETATM 14284 O O . HOH BB 5 . ? 40.316 -14.366 -24.939 1.00 62.78 ? 552 HOH D O 1 HETATM 14285 O O . HOH BB 5 . ? 9.236 -30.951 6.715 1.00 54.98 ? 553 HOH D O 1 HETATM 14286 O O . HOH BB 5 . ? 39.367 -45.280 -4.248 1.00 37.95 ? 554 HOH D O 1 HETATM 14287 O O . HOH BB 5 . ? 37.129 -20.826 -26.615 1.00 56.23 ? 555 HOH D O 1 HETATM 14288 O O . HOH BB 5 . ? 31.431 -36.588 -17.524 1.00 40.93 ? 556 HOH D O 1 HETATM 14289 O O . HOH BB 5 . ? 57.287 -29.558 -13.795 1.00 65.99 ? 557 HOH D O 1 HETATM 14290 O O . HOH BB 5 . ? 24.596 -14.490 3.301 1.00 58.67 ? 558 HOH D O 1 HETATM 14291 O O . HOH BB 5 . ? 13.111 -21.066 -7.607 1.00 50.28 ? 559 HOH D O 1 HETATM 14292 O O . HOH BB 5 . ? 26.158 -28.148 -9.479 1.00 43.42 ? 560 HOH D O 1 HETATM 14293 O O . HOH BB 5 . ? 20.292 -34.467 -10.085 1.00 41.13 ? 561 HOH D O 1 HETATM 14294 O O . HOH BB 5 . ? 33.299 -15.976 -2.502 1.00 42.51 ? 562 HOH D O 1 HETATM 14295 O O . HOH BB 5 . ? 18.055 -18.580 -11.878 1.00 55.76 ? 563 HOH D O 1 HETATM 14296 O O . HOH BB 5 . ? 39.819 -40.121 -0.703 1.00 55.60 ? 564 HOH D O 1 HETATM 14297 O O . HOH CB 5 . ? 58.706 1.242 7.231 1.00 33.93 ? 401 HOH E O 1 HETATM 14298 O O . HOH CB 5 . ? 43.043 18.642 11.527 1.00 32.09 ? 402 HOH E O 1 HETATM 14299 O O . HOH CB 5 . ? 90.862 7.586 13.213 1.00 38.79 ? 403 HOH E O 1 HETATM 14300 O O . HOH CB 5 . ? 38.501 22.794 11.229 1.00 46.58 ? 404 HOH E O 1 HETATM 14301 O O . HOH CB 5 . ? 34.841 6.420 -3.930 1.00 42.78 ? 405 HOH E O 1 HETATM 14302 O O . HOH CB 5 . ? 47.096 17.036 6.282 1.00 46.83 ? 406 HOH E O 1 HETATM 14303 O O . HOH CB 5 . ? 79.235 10.590 17.043 1.00 45.89 ? 407 HOH E O 1 HETATM 14304 O O . HOH CB 5 . ? 36.905 -2.286 3.435 1.00 49.67 ? 408 HOH E O 1 HETATM 14305 O O . HOH CB 5 . ? 61.483 -2.268 20.333 1.00 46.57 ? 409 HOH E O 1 HETATM 14306 O O . HOH CB 5 . ? 38.355 24.301 9.170 1.00 52.05 ? 410 HOH E O 1 HETATM 14307 O O . HOH CB 5 . ? 70.856 10.551 24.692 1.00 44.12 ? 411 HOH E O 1 HETATM 14308 O O . HOH CB 5 . ? 37.044 13.261 1.455 1.00 34.51 ? 412 HOH E O 1 HETATM 14309 O O . HOH CB 5 . ? 57.222 -0.507 8.571 1.00 41.43 ? 413 HOH E O 1 HETATM 14310 O O . HOH CB 5 . ? 59.089 10.715 13.315 1.00 41.30 ? 414 HOH E O 1 HETATM 14311 O O . HOH CB 5 . ? 43.864 15.875 1.661 1.00 29.56 ? 415 HOH E O 1 HETATM 14312 O O . HOH CB 5 . ? 55.228 13.504 15.895 1.00 51.40 ? 416 HOH E O 1 HETATM 14313 O O . HOH CB 5 . ? 65.836 -1.646 15.142 1.00 50.22 ? 417 HOH E O 1 HETATM 14314 O O . HOH CB 5 . ? 42.780 -4.105 18.159 1.00 66.59 ? 418 HOH E O 1 HETATM 14315 O O . HOH CB 5 . ? 38.290 -4.512 3.346 1.00 56.03 ? 419 HOH E O 1 HETATM 14316 O O . HOH CB 5 . ? 43.222 16.453 -6.204 1.00 42.18 ? 420 HOH E O 1 HETATM 14317 O O . HOH CB 5 . ? 35.348 -0.515 2.490 1.00 52.27 ? 421 HOH E O 1 HETATM 14318 O O . HOH CB 5 . ? 61.588 0.263 2.432 1.00 34.85 ? 422 HOH E O 1 HETATM 14319 O O . HOH CB 5 . ? 46.866 -7.237 13.531 1.00 54.21 ? 423 HOH E O 1 HETATM 14320 O O . HOH CB 5 . ? 48.854 -8.909 26.203 1.00 50.31 ? 424 HOH E O 1 HETATM 14321 O O . HOH CB 5 . ? 54.966 -4.048 13.500 1.00 43.57 ? 425 HOH E O 1 HETATM 14322 O O . HOH CB 5 . ? 47.881 -4.275 4.455 1.00 48.02 ? 426 HOH E O 1 HETATM 14323 O O . HOH CB 5 . ? 39.925 21.053 12.906 1.00 57.96 ? 427 HOH E O 1 HETATM 14324 O O . HOH CB 5 . ? 31.738 6.677 5.401 1.00 52.91 ? 428 HOH E O 1 HETATM 14325 O O . HOH CB 5 . ? 96.727 19.367 13.433 1.00 65.06 ? 429 HOH E O 1 HETATM 14326 O O . HOH CB 5 . ? 93.518 24.325 18.503 1.00 51.92 ? 430 HOH E O 1 HETATM 14327 O O . HOH CB 5 . ? 40.756 4.679 10.990 1.00 42.47 ? 431 HOH E O 1 HETATM 14328 O O . HOH CB 5 . ? 46.853 -6.578 5.362 1.00 49.18 ? 432 HOH E O 1 HETATM 14329 O O . HOH CB 5 . ? 38.118 25.641 7.021 1.00 53.51 ? 433 HOH E O 1 HETATM 14330 O O . HOH CB 5 . ? 48.144 19.428 5.141 1.00 40.47 ? 434 HOH E O 1 HETATM 14331 O O . HOH CB 5 . ? 48.244 18.793 11.034 1.00 46.33 ? 435 HOH E O 1 HETATM 14332 O O . HOH CB 5 . ? 83.303 15.346 16.746 1.00 57.03 ? 436 HOH E O 1 HETATM 14333 O O . HOH CB 5 . ? 68.216 4.897 39.165 1.00 52.07 ? 437 HOH E O 1 HETATM 14334 O O . HOH CB 5 . ? 54.349 -7.279 14.968 1.00 58.86 ? 438 HOH E O 1 HETATM 14335 O O . HOH CB 5 . ? 47.789 7.266 23.661 1.00 56.25 ? 439 HOH E O 1 HETATM 14336 O O . HOH CB 5 . ? 61.253 -4.857 24.871 1.00 57.87 ? 440 HOH E O 1 HETATM 14337 O O . HOH CB 5 . ? 39.913 10.693 -7.179 1.00 57.12 ? 441 HOH E O 1 HETATM 14338 O O . HOH CB 5 . ? 38.966 24.598 0.719 1.00 53.04 ? 442 HOH E O 1 HETATM 14339 O O . HOH CB 5 . ? 78.432 22.129 23.999 1.00 47.37 ? 443 HOH E O 1 HETATM 14340 O O . HOH CB 5 . ? 34.491 -2.316 4.931 1.00 51.56 ? 444 HOH E O 1 HETATM 14341 O O . HOH CB 5 . ? 79.572 20.463 24.804 1.00 56.71 ? 445 HOH E O 1 HETATM 14342 O O . HOH CB 5 . ? 35.692 15.982 2.072 1.00 59.76 ? 446 HOH E O 1 HETATM 14343 O O . HOH CB 5 . ? 47.374 4.832 23.912 1.00 60.82 ? 447 HOH E O 1 HETATM 14344 O O . HOH CB 5 . ? 38.569 22.860 3.451 1.00 58.46 ? 448 HOH E O 1 HETATM 14345 O O . HOH CB 5 . ? 51.649 14.671 22.919 1.00 52.34 ? 449 HOH E O 1 HETATM 14346 O O . HOH CB 5 . ? 50.212 16.054 21.448 1.00 50.48 ? 450 HOH E O 1 HETATM 14347 O O . HOH CB 5 . ? 104.966 11.712 24.248 1.00 60.98 ? 451 HOH E O 1 HETATM 14348 O O . HOH CB 5 . ? 40.922 -4.086 20.767 1.00 61.81 ? 452 HOH E O 1 HETATM 14349 O O . HOH CB 5 . ? 99.759 6.757 1.838 1.00 54.68 ? 453 HOH E O 1 HETATM 14350 O O . HOH CB 5 . ? 38.543 -4.196 21.480 1.00 64.07 ? 454 HOH E O 1 HETATM 14351 O O . HOH CB 5 . ? 99.540 25.640 22.831 1.00 63.94 ? 455 HOH E O 1 HETATM 14352 O O . HOH CB 5 . ? 65.948 12.090 25.085 1.00 54.57 ? 456 HOH E O 1 HETATM 14353 O O . HOH CB 5 . ? 63.726 6.304 26.322 1.00 49.38 ? 457 HOH E O 1 HETATM 14354 O O . HOH CB 5 . ? 61.976 11.417 19.709 1.00 50.44 ? 458 HOH E O 1 HETATM 14355 O O . HOH CB 5 . ? 38.613 -4.526 24.177 1.00 57.43 ? 459 HOH E O 1 HETATM 14356 O O . HOH CB 5 . ? 31.793 9.073 -1.929 1.00 57.97 ? 460 HOH E O 1 HETATM 14357 O O . HOH CB 5 . ? 73.836 -6.210 20.570 1.00 54.04 ? 461 HOH E O 1 HETATM 14358 O O . HOH CB 5 . ? 63.461 12.819 17.948 1.00 62.68 ? 462 HOH E O 1 HETATM 14359 O O . HOH CB 5 . ? 71.111 10.900 16.072 1.00 51.76 ? 463 HOH E O 1 HETATM 14360 O O . HOH CB 5 . ? 65.898 8.910 37.518 1.00 64.31 ? 464 HOH E O 1 HETATM 14361 O O . HOH CB 5 . ? 49.693 15.854 0.156 1.00 41.07 ? 465 HOH E O 1 HETATM 14362 O O . HOH CB 5 . ? 63.534 7.220 4.598 1.00 41.24 ? 466 HOH E O 1 HETATM 14363 O O . HOH DB 5 . ? 50.822 19.019 4.273 1.00 49.31 ? 401 HOH F O 1 HETATM 14364 O O . HOH DB 5 . ? 77.404 0.778 -6.178 1.00 35.08 ? 402 HOH F O 1 HETATM 14365 O O . HOH DB 5 . ? 48.299 -6.651 -2.499 1.00 42.10 ? 403 HOH F O 1 HETATM 14366 O O . HOH DB 5 . ? 51.339 -10.446 -1.881 1.00 46.67 ? 404 HOH F O 1 HETATM 14367 O O . HOH DB 5 . ? 49.926 -10.633 -4.210 1.00 44.06 ? 405 HOH F O 1 HETATM 14368 O O . HOH DB 5 . ? 48.596 -5.812 -12.760 1.00 54.71 ? 406 HOH F O 1 HETATM 14369 O O . HOH DB 5 . ? 42.006 -6.304 -6.899 1.00 47.50 ? 407 HOH F O 1 HETATM 14370 O O . HOH DB 5 . ? 52.676 -6.437 -3.515 1.00 64.77 ? 408 HOH F O 1 HETATM 14371 O O . HOH DB 5 . ? 45.477 -0.112 -19.632 1.00 29.58 ? 409 HOH F O 1 HETATM 14372 O O . HOH DB 5 . ? 78.329 -1.501 1.706 1.00 35.52 ? 410 HOH F O 1 HETATM 14373 O O . HOH DB 5 . ? 65.167 23.096 -14.330 1.00 39.48 ? 411 HOH F O 1 HETATM 14374 O O . HOH DB 5 . ? 58.030 -2.315 -3.383 1.00 21.29 ? 412 HOH F O 1 HETATM 14375 O O . HOH DB 5 . ? 43.908 10.732 -9.825 1.00 37.13 ? 413 HOH F O 1 HETATM 14376 O O . HOH DB 5 . ? 58.312 19.162 -15.254 1.00 32.77 ? 414 HOH F O 1 HETATM 14377 O O . HOH DB 5 . ? 76.184 20.569 -6.109 1.00 27.05 ? 415 HOH F O 1 HETATM 14378 O O . HOH DB 5 . ? 50.730 16.020 3.487 1.00 25.19 ? 416 HOH F O 1 HETATM 14379 O O . HOH DB 5 . ? 52.411 -0.578 1.859 1.00 31.81 ? 417 HOH F O 1 HETATM 14380 O O . HOH DB 5 . ? 72.916 14.883 1.617 1.00 34.64 ? 418 HOH F O 1 HETATM 14381 O O . HOH DB 5 . ? 52.429 12.864 -18.791 1.00 52.38 ? 419 HOH F O 1 HETATM 14382 O O . HOH DB 5 . ? 45.645 -4.796 -12.810 1.00 25.77 ? 420 HOH F O 1 HETATM 14383 O O . HOH DB 5 . ? 46.389 18.365 -11.795 1.00 29.19 ? 421 HOH F O 1 HETATM 14384 O O . HOH DB 5 . ? 63.046 19.555 6.322 1.00 33.56 ? 422 HOH F O 1 HETATM 14385 O O . HOH DB 5 . ? 60.292 12.791 8.638 1.00 35.40 ? 423 HOH F O 1 HETATM 14386 O O . HOH DB 5 . ? 71.529 13.201 -1.951 1.00 36.18 ? 424 HOH F O 1 HETATM 14387 O O . HOH DB 5 . ? 63.719 20.846 2.311 1.00 45.35 ? 425 HOH F O 1 HETATM 14388 O O . HOH DB 5 . ? 52.447 9.182 -19.724 1.00 35.05 ? 426 HOH F O 1 HETATM 14389 O O . HOH DB 5 . ? 84.840 -7.895 3.159 1.00 37.09 ? 427 HOH F O 1 HETATM 14390 O O . HOH DB 5 . ? 73.145 26.728 -9.487 1.00 38.85 ? 428 HOH F O 1 HETATM 14391 O O . HOH DB 5 . ? 65.897 -2.523 -9.544 1.00 38.46 ? 429 HOH F O 1 HETATM 14392 O O . HOH DB 5 . ? 55.459 23.571 -2.794 1.00 43.30 ? 430 HOH F O 1 HETATM 14393 O O . HOH DB 5 . ? 75.861 6.061 -1.663 1.00 34.49 ? 431 HOH F O 1 HETATM 14394 O O . HOH DB 5 . ? 45.427 10.274 -12.406 1.00 33.36 ? 432 HOH F O 1 HETATM 14395 O O . HOH DB 5 . ? 45.094 2.303 -8.533 1.00 27.42 ? 433 HOH F O 1 HETATM 14396 O O . HOH DB 5 . ? 73.325 26.520 -2.988 1.00 33.07 ? 434 HOH F O 1 HETATM 14397 O O . HOH DB 5 . ? 67.681 13.600 -10.658 1.00 43.84 ? 435 HOH F O 1 HETATM 14398 O O . HOH DB 5 . ? 43.496 0.016 -9.134 1.00 26.07 ? 436 HOH F O 1 HETATM 14399 O O . HOH DB 5 . ? 47.769 2.672 -15.540 1.00 23.91 ? 437 HOH F O 1 HETATM 14400 O O . HOH DB 5 . ? 74.759 9.312 5.187 1.00 40.72 ? 438 HOH F O 1 HETATM 14401 O O . HOH DB 5 . ? 52.439 -1.787 -18.449 1.00 35.32 ? 439 HOH F O 1 HETATM 14402 O O . HOH DB 5 . ? 81.739 -3.246 -8.250 1.00 39.48 ? 440 HOH F O 1 HETATM 14403 O O . HOH DB 5 . ? 60.448 18.230 -17.709 1.00 48.33 ? 441 HOH F O 1 HETATM 14404 O O . HOH DB 5 . ? 87.837 -1.842 -4.127 1.00 47.35 ? 442 HOH F O 1 HETATM 14405 O O . HOH DB 5 . ? 54.304 20.745 7.958 1.00 44.82 ? 443 HOH F O 1 HETATM 14406 O O . HOH DB 5 . ? 58.133 -8.569 -8.313 1.00 33.66 ? 444 HOH F O 1 HETATM 14407 O O . HOH DB 5 . ? 57.189 24.265 -4.702 1.00 48.49 ? 445 HOH F O 1 HETATM 14408 O O . HOH DB 5 . ? 70.308 9.489 -3.259 1.00 38.33 ? 446 HOH F O 1 HETATM 14409 O O . HOH DB 5 . ? 41.933 -2.094 -11.506 1.00 25.95 ? 447 HOH F O 1 HETATM 14410 O O . HOH DB 5 . ? 73.699 6.995 5.235 1.00 45.17 ? 448 HOH F O 1 HETATM 14411 O O . HOH DB 5 . ? 80.054 3.461 -6.161 1.00 37.61 ? 449 HOH F O 1 HETATM 14412 O O . HOH DB 5 . ? 76.907 -6.343 6.868 1.00 28.58 ? 450 HOH F O 1 HETATM 14413 O O . HOH DB 5 . ? 68.534 11.255 -13.027 1.00 42.49 ? 451 HOH F O 1 HETATM 14414 O O . HOH DB 5 . ? 83.944 -2.150 -8.659 1.00 42.33 ? 452 HOH F O 1 HETATM 14415 O O . HOH DB 5 . ? 47.095 20.604 -10.054 1.00 46.61 ? 453 HOH F O 1 HETATM 14416 O O . HOH DB 5 . ? 68.320 26.944 -2.919 1.00 35.10 ? 454 HOH F O 1 HETATM 14417 O O . HOH DB 5 . ? 58.964 22.955 -2.584 1.00 42.55 ? 455 HOH F O 1 HETATM 14418 O O . HOH DB 5 . ? 80.445 21.167 -7.745 1.00 46.83 ? 456 HOH F O 1 HETATM 14419 O O . HOH DB 5 . ? 74.147 24.757 -0.877 1.00 33.37 ? 457 HOH F O 1 HETATM 14420 O O . HOH DB 5 . ? 74.970 26.460 -7.700 1.00 38.68 ? 458 HOH F O 1 HETATM 14421 O O . HOH DB 5 . ? 62.671 12.514 7.812 1.00 39.99 ? 459 HOH F O 1 HETATM 14422 O O . HOH DB 5 . ? 47.901 -4.153 -1.992 1.00 40.68 ? 460 HOH F O 1 HETATM 14423 O O . HOH DB 5 . ? 54.668 -11.967 -12.567 1.00 26.15 ? 461 HOH F O 1 HETATM 14424 O O . HOH DB 5 . ? 69.080 7.410 -1.717 1.00 32.31 ? 462 HOH F O 1 HETATM 14425 O O . HOH DB 5 . ? 39.963 6.630 -3.387 1.00 37.25 ? 463 HOH F O 1 HETATM 14426 O O . HOH DB 5 . ? 59.234 6.284 -17.579 1.00 40.12 ? 464 HOH F O 1 HETATM 14427 O O . HOH DB 5 . ? 40.022 -5.130 -4.591 1.00 40.86 ? 465 HOH F O 1 HETATM 14428 O O . HOH DB 5 . ? 44.871 17.948 -7.524 1.00 31.91 ? 466 HOH F O 1 HETATM 14429 O O . HOH DB 5 . ? 55.047 21.696 -1.433 1.00 46.22 ? 467 HOH F O 1 HETATM 14430 O O . HOH DB 5 . ? 73.561 5.772 8.738 1.00 40.63 ? 468 HOH F O 1 HETATM 14431 O O . HOH DB 5 . ? 79.481 20.138 2.100 1.00 47.70 ? 469 HOH F O 1 HETATM 14432 O O . HOH DB 5 . ? 63.023 12.563 4.877 1.00 34.85 ? 470 HOH F O 1 HETATM 14433 O O . HOH DB 5 . ? 84.949 -15.283 23.623 1.00 54.15 ? 471 HOH F O 1 HETATM 14434 O O . HOH DB 5 . ? 72.958 10.527 -3.299 1.00 41.82 ? 472 HOH F O 1 HETATM 14435 O O . HOH DB 5 . ? 50.231 6.368 -21.065 1.00 51.86 ? 473 HOH F O 1 HETATM 14436 O O . HOH DB 5 . ? 61.676 25.037 -5.014 1.00 44.84 ? 474 HOH F O 1 HETATM 14437 O O . HOH DB 5 . ? 40.881 8.095 -5.500 1.00 42.68 ? 475 HOH F O 1 HETATM 14438 O O . HOH DB 5 . ? 74.863 1.465 5.989 1.00 38.80 ? 476 HOH F O 1 HETATM 14439 O O . HOH DB 5 . ? 70.813 8.460 -5.963 1.00 33.15 ? 477 HOH F O 1 HETATM 14440 O O . HOH DB 5 . ? 67.870 5.682 -5.586 1.00 45.60 ? 478 HOH F O 1 HETATM 14441 O O . HOH DB 5 . ? 80.844 23.542 -4.999 1.00 48.38 ? 479 HOH F O 1 HETATM 14442 O O . HOH DB 5 . ? 65.610 8.987 -13.823 1.00 49.29 ? 480 HOH F O 1 HETATM 14443 O O . HOH DB 5 . ? 62.273 -10.066 -3.984 1.00 38.15 ? 481 HOH F O 1 HETATM 14444 O O . HOH DB 5 . ? 47.227 19.066 -14.315 1.00 45.88 ? 482 HOH F O 1 HETATM 14445 O O . HOH DB 5 . ? 63.860 1.937 2.244 1.00 47.36 ? 483 HOH F O 1 HETATM 14446 O O . HOH DB 5 . ? 49.425 20.214 -15.673 1.00 38.78 ? 484 HOH F O 1 HETATM 14447 O O . HOH DB 5 . ? 55.809 23.355 6.499 1.00 46.06 ? 485 HOH F O 1 HETATM 14448 O O . HOH DB 5 . ? 89.868 5.865 3.113 1.00 48.20 ? 486 HOH F O 1 HETATM 14449 O O . HOH DB 5 . ? 52.424 20.149 -15.346 1.00 51.86 ? 487 HOH F O 1 HETATM 14450 O O . HOH DB 5 . ? 78.277 4.533 -8.248 1.00 50.74 ? 488 HOH F O 1 HETATM 14451 O O . HOH DB 5 . ? 71.461 3.987 -11.305 1.00 49.26 ? 489 HOH F O 1 HETATM 14452 O O . HOH DB 5 . ? 73.879 -0.348 -1.201 1.00 67.53 ? 490 HOH F O 1 HETATM 14453 O O . HOH DB 5 . ? 49.585 -3.274 -19.769 1.00 46.00 ? 491 HOH F O 1 HETATM 14454 O O . HOH DB 5 . ? 62.161 9.950 4.521 1.00 28.65 ? 492 HOH F O 1 HETATM 14455 O O . HOH DB 5 . ? 54.494 13.254 -20.330 1.00 49.60 ? 493 HOH F O 1 HETATM 14456 O O . HOH DB 5 . ? 51.261 -5.223 -1.868 1.00 42.17 ? 494 HOH F O 1 HETATM 14457 O O . HOH DB 5 . ? 74.952 -1.093 8.223 1.00 44.00 ? 495 HOH F O 1 HETATM 14458 O O . HOH DB 5 . ? 59.697 -0.228 0.048 1.00 47.64 ? 496 HOH F O 1 HETATM 14459 O O . HOH DB 5 . ? 69.640 29.058 -4.181 1.00 59.48 ? 497 HOH F O 1 HETATM 14460 O O . HOH DB 5 . ? 70.676 6.798 -11.253 1.00 56.18 ? 498 HOH F O 1 HETATM 14461 O O . HOH DB 5 . ? 72.897 -0.379 -3.629 1.00 57.36 ? 499 HOH F O 1 HETATM 14462 O O . HOH DB 5 . ? 73.626 16.403 12.073 1.00 40.44 ? 500 HOH F O 1 HETATM 14463 O O . HOH DB 5 . ? 59.204 21.925 0.993 1.00 42.33 ? 501 HOH F O 1 HETATM 14464 O O . HOH DB 5 . ? 68.895 16.141 6.662 1.00 51.47 ? 502 HOH F O 1 HETATM 14465 O O . HOH DB 5 . ? 68.674 29.402 -8.343 1.00 50.52 ? 503 HOH F O 1 HETATM 14466 O O . HOH DB 5 . ? 65.909 12.917 5.007 1.00 47.89 ? 504 HOH F O 1 HETATM 14467 O O . HOH DB 5 . ? 68.171 29.459 -5.968 1.00 63.61 ? 505 HOH F O 1 HETATM 14468 O O . HOH DB 5 . ? 70.114 15.108 4.190 1.00 61.47 ? 506 HOH F O 1 HETATM 14469 O O . HOH DB 5 . ? 66.246 -1.429 -1.389 1.00 47.10 ? 507 HOH F O 1 HETATM 14470 O O . HOH DB 5 . ? 63.735 -2.097 -0.749 1.00 55.91 ? 508 HOH F O 1 HETATM 14471 O O . HOH DB 5 . ? 71.588 17.173 7.281 1.00 45.71 ? 509 HOH F O 1 HETATM 14472 O O . HOH DB 5 . ? 49.102 -6.996 -7.804 1.00 38.89 ? 510 HOH F O 1 HETATM 14473 O O . HOH DB 5 . ? 75.369 -4.227 8.223 1.00 49.57 ? 511 HOH F O 1 HETATM 14474 O O . HOH DB 5 . ? 68.184 7.948 -14.519 1.00 53.53 ? 512 HOH F O 1 HETATM 14475 O O . HOH DB 5 . ? 73.859 28.928 -1.871 1.00 66.24 ? 513 HOH F O 1 HETATM 14476 O O . HOH DB 5 . ? 72.361 -0.576 12.377 1.00 53.71 ? 514 HOH F O 1 HETATM 14477 O O . HOH DB 5 . ? 74.189 -8.991 3.965 1.00 44.39 ? 515 HOH F O 1 HETATM 14478 O O . HOH DB 5 . ? 71.004 -0.239 14.618 1.00 49.90 ? 516 HOH F O 1 HETATM 14479 O O . HOH DB 5 . ? 81.127 23.957 -7.514 1.00 57.37 ? 517 HOH F O 1 HETATM 14480 O O . HOH DB 5 . ? 74.106 -2.526 5.112 1.00 58.50 ? 518 HOH F O 1 HETATM 14481 O O . HOH DB 5 . ? 72.093 -2.956 11.324 1.00 54.55 ? 519 HOH F O 1 HETATM 14482 O O . HOH DB 5 . ? 90.007 -6.222 1.296 1.00 48.80 ? 520 HOH F O 1 HETATM 14483 O O . HOH DB 5 . ? 67.242 15.487 -21.454 1.00 51.78 ? 521 HOH F O 1 HETATM 14484 O O . HOH DB 5 . ? 48.039 8.921 -19.274 1.00 49.67 ? 522 HOH F O 1 HETATM 14485 O O . HOH DB 5 . ? 62.389 -11.362 -1.979 1.00 53.99 ? 523 HOH F O 1 HETATM 14486 O O . HOH DB 5 . ? 73.582 7.683 -4.170 1.00 48.41 ? 524 HOH F O 1 HETATM 14487 O O . HOH DB 5 . ? 55.387 -0.593 1.081 1.00 37.84 ? 525 HOH F O 1 HETATM 14488 O O . HOH DB 5 . ? 96.028 -7.535 6.526 1.00 48.57 ? 526 HOH F O 1 HETATM 14489 O O . HOH DB 5 . ? 71.382 5.250 -3.206 1.00 54.84 ? 527 HOH F O 1 HETATM 14490 O O . HOH DB 5 . ? 89.677 -0.345 -0.463 1.00 44.26 ? 528 HOH F O 1 HETATM 14491 O O . HOH DB 5 . ? 58.195 12.767 -16.381 1.00 43.47 ? 529 HOH F O 1 HETATM 14492 O O . HOH DB 5 . ? 73.641 -5.125 10.060 1.00 44.61 ? 530 HOH F O 1 HETATM 14493 O O . HOH DB 5 . ? 95.398 1.129 2.001 1.00 62.68 ? 531 HOH F O 1 HETATM 14494 O O . HOH DB 5 . ? 71.506 3.497 -1.075 1.00 52.98 ? 532 HOH F O 1 HETATM 14495 O O . HOH DB 5 . ? 61.297 -1.409 -2.357 1.00 49.69 ? 533 HOH F O 1 HETATM 14496 O O . HOH DB 5 . ? 81.556 -13.078 9.254 1.00 51.65 ? 534 HOH F O 1 HETATM 14497 O O . HOH DB 5 . ? 37.866 5.501 -4.655 1.00 48.03 ? 535 HOH F O 1 HETATM 14498 O O . HOH DB 5 . ? 86.654 -10.612 5.904 1.00 44.24 ? 536 HOH F O 1 HETATM 14499 O O . HOH DB 5 . ? 40.849 10.392 -11.207 1.00 60.43 ? 537 HOH F O 1 HETATM 14500 O O . HOH DB 5 . ? 70.255 29.974 -10.166 1.00 55.00 ? 538 HOH F O 1 HETATM 14501 O O . HOH DB 5 . ? 88.192 -6.808 -3.028 1.00 41.31 ? 539 HOH F O 1 HETATM 14502 O O . HOH DB 5 . ? 94.588 -4.730 23.680 1.00 61.50 ? 540 HOH F O 1 HETATM 14503 O O . HOH DB 5 . ? 90.367 -7.865 11.598 1.00 45.24 ? 541 HOH F O 1 HETATM 14504 O O . HOH DB 5 . ? 85.260 17.914 8.048 1.00 42.74 ? 542 HOH F O 1 HETATM 14505 O O . HOH DB 5 . ? 55.261 21.556 -15.940 1.00 42.89 ? 543 HOH F O 1 HETATM 14506 O O . HOH DB 5 . ? 88.914 6.653 0.743 1.00 52.59 ? 544 HOH F O 1 HETATM 14507 O O . HOH DB 5 . ? 40.818 8.961 -8.664 1.00 67.21 ? 545 HOH F O 1 HETATM 14508 O O . HOH DB 5 . ? 58.085 22.910 -15.624 1.00 61.85 ? 546 HOH F O 1 HETATM 14509 O O . HOH DB 5 . ? 86.928 3.443 -5.125 1.00 51.23 ? 547 HOH F O 1 HETATM 14510 O O . HOH DB 5 . ? 76.241 18.868 -8.628 1.00 43.75 ? 548 HOH F O 1 HETATM 14511 O O . HOH DB 5 . ? 46.458 1.418 -25.645 1.00 60.60 ? 549 HOH F O 1 HETATM 14512 O O . HOH DB 5 . ? 96.225 2.459 12.552 1.00 45.87 ? 550 HOH F O 1 HETATM 14513 O O . HOH DB 5 . ? 44.234 8.724 -21.506 1.00 50.06 ? 551 HOH F O 1 HETATM 14514 O O . HOH DB 5 . ? 71.089 23.761 -0.233 1.00 58.91 ? 552 HOH F O 1 HETATM 14515 O O . HOH DB 5 . ? 88.977 14.857 4.408 1.00 62.29 ? 553 HOH F O 1 HETATM 14516 O O . HOH DB 5 . ? 59.937 -3.888 -0.760 1.00 56.23 ? 554 HOH F O 1 HETATM 14517 O O . HOH DB 5 . ? 56.003 18.028 3.942 1.00 47.03 ? 555 HOH F O 1 HETATM 14518 O O . HOH DB 5 . ? 74.114 3.431 -9.423 1.00 70.08 ? 556 HOH F O 1 HETATM 14519 O O . HOH DB 5 . ? 72.242 0.123 5.328 1.00 61.51 ? 557 HOH F O 1 HETATM 14520 O O . HOH DB 5 . ? 51.598 16.611 -17.549 1.00 43.94 ? 558 HOH F O 1 HETATM 14521 O O . HOH DB 5 . ? 75.073 3.582 -1.155 1.00 55.02 ? 559 HOH F O 1 HETATM 14522 O O . HOH DB 5 . ? 95.077 -17.455 13.801 1.00 60.19 ? 560 HOH F O 1 HETATM 14523 O O . HOH DB 5 . ? 83.356 -13.585 6.881 1.00 55.27 ? 561 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 ? 0.7929 0.8011 0.9876 0.0085 -0.0665 -0.1258 1 ASP L N 2 C CA . ASP A 1 ? 0.7775 0.7801 0.9529 0.0101 -0.0603 -0.1122 1 ASP L CA 3 C C . ASP A 1 ? 0.6558 0.6609 0.8345 0.0085 -0.0572 -0.1020 1 ASP L C 4 O O . ASP A 1 ? 0.6772 0.6900 0.8591 0.0098 -0.0621 -0.1050 1 ASP L O 5 C CB . ASP A 1 ? 0.8579 0.8613 1.0057 0.0165 -0.0640 -0.1134 1 ASP L CB 6 C CG . ASP A 1 ? 0.9483 0.9474 1.0882 0.0185 -0.0642 -0.1195 1 ASP L CG 7 O OD1 . ASP A 1 ? 0.9261 0.9224 1.0831 0.0153 -0.0633 -0.1258 1 ASP L OD1 8 O OD2 . ASP A 1 ? 1.0136 1.0117 1.1306 0.0234 -0.0647 -0.1179 1 ASP L OD2 9 N N . ILE A 2 ? 0.5271 0.5261 0.7045 0.0062 -0.0492 -0.0901 2 ILE L N 10 C CA . ILE A 2 ? 0.5310 0.5320 0.7104 0.0050 -0.0455 -0.0801 2 ILE L CA 11 C C . ILE A 2 ? 0.4857 0.4867 0.6403 0.0094 -0.0464 -0.0745 2 ILE L C 12 O O . ILE A 2 ? 0.4673 0.4632 0.6036 0.0114 -0.0447 -0.0716 2 ILE L O 13 C CB . ILE A 2 ? 0.5186 0.5142 0.7075 0.0012 -0.0366 -0.0699 2 ILE L CB 14 C CG1 . ILE A 2 ? 0.5240 0.5200 0.7410 -0.0032 -0.0350 -0.0740 2 ILE L CG1 15 C CG2 . ILE A 2 ? 0.4499 0.4471 0.6340 0.0013 -0.0326 -0.0590 2 ILE L CG2 16 C CD1 . ILE A 2 ? 0.5224 0.5142 0.7512 -0.0064 -0.0259 -0.0632 2 ILE L CD1 17 N N . GLN A 3 ? 0.4864 0.4930 0.6415 0.0108 -0.0487 -0.0732 3 GLN L N 18 C CA . GLN A 3 ? 0.4427 0.4491 0.5761 0.0153 -0.0500 -0.0688 3 GLN L CA 19 C C . GLN A 3 ? 0.4207 0.4257 0.5531 0.0140 -0.0442 -0.0579 3 GLN L C 20 O O . GLN A 3 ? 0.3642 0.3734 0.5139 0.0116 -0.0425 -0.0562 3 GLN L O 21 C CB . GLN A 3 ? 0.6076 0.6222 0.7398 0.0196 -0.0581 -0.0767 3 GLN L CB 22 C CG . GLN A 3 ? 0.8308 0.8440 0.9378 0.0257 -0.0606 -0.0748 3 GLN L CG 23 C CD . GLN A 3 ? 0.9600 0.9719 1.0542 0.0290 -0.0643 -0.0816 3 GLN L CD 24 O OE1 . GLN A 3 ? 0.9387 0.9509 1.0431 0.0268 -0.0656 -0.0887 3 GLN L OE1 25 N NE2 . GLN A 3 ? 0.9923 1.0025 1.0642 0.0346 -0.0657 -0.0793 3 GLN L NE2 26 N N . MET A 4 ? 0.3725 0.3720 0.4851 0.0157 -0.0411 -0.0510 4 MET L N 27 C CA . MET A 4 ? 0.3288 0.3268 0.4375 0.0152 -0.0361 -0.0418 4 MET L CA 28 C C . MET A 4 ? 0.3342 0.3331 0.4290 0.0199 -0.0392 -0.0412 4 MET L C 29 O O . MET A 4 ? 0.3228 0.3183 0.3997 0.0233 -0.0412 -0.0421 4 MET L O 30 C CB . MET A 4 ? 0.3802 0.3713 0.4779 0.0134 -0.0301 -0.0345 4 MET L CB 31 C CG . MET A 4 ? 0.5169 0.5065 0.6258 0.0098 -0.0267 -0.0342 4 MET L CG 32 S SD . MET A 4 ? 0.8636 0.8583 1.0007 0.0065 -0.0251 -0.0346 4 MET L SD 33 C CE . MET A 4 ? 2.6085 2.6037 2.7443 0.0058 -0.0186 -0.0235 4 MET L CE 34 N N . THR A 5 ? 0.2753 0.2789 0.3785 0.0205 -0.0389 -0.0390 5 THR L N 35 C CA . THR A 5 ? 0.3372 0.3416 0.4282 0.0255 -0.0413 -0.0379 5 THR L CA 36 C C . THR A 5 ? 0.3209 0.3221 0.4074 0.0250 -0.0355 -0.0294 5 THR L C 37 O O . THR A 5 ? 0.3636 0.3685 0.4645 0.0225 -0.0322 -0.0264 5 THR L O 38 C CB . THR A 5 ? 0.3845 0.3988 0.4879 0.0282 -0.0474 -0.0443 5 THR L CB 39 O OG1 . THR A 5 ? 0.4627 0.4803 0.5681 0.0292 -0.0536 -0.0533 5 THR L OG1 40 C CG2 . THR A 5 ? 0.3835 0.3984 0.4740 0.0342 -0.0495 -0.0422 5 THR L CG2 41 N N . GLN A 6 ? 0.2207 0.2149 0.2874 0.0275 -0.0340 -0.0257 6 GLN L N 42 C CA . GLN A 6 ? 0.2128 0.2031 0.2734 0.0272 -0.0288 -0.0188 6 GLN L CA 43 C C . GLN A 6 ? 0.3411 0.3326 0.3966 0.0325 -0.0306 -0.0183 6 GLN L C 44 O O . GLN A 6 ? 0.3264 0.3172 0.3725 0.0371 -0.0349 -0.0212 6 GLN L O 45 C CB . GLN A 6 ? 0.2431 0.2242 0.2866 0.0258 -0.0251 -0.0150 6 GLN L CB 46 C CG . GLN A 6 ? 0.3060 0.2862 0.3540 0.0210 -0.0224 -0.0143 6 GLN L CG 47 C CD . GLN A 6 ? 0.3393 0.3121 0.3717 0.0193 -0.0187 -0.0106 6 GLN L CD 48 O OE1 . GLN A 6 ? 0.3279 0.2984 0.3555 0.0182 -0.0191 -0.0121 6 GLN L OE1 49 N NE2 . GLN A 6 ? 0.2584 0.2278 0.2834 0.0192 -0.0152 -0.0062 6 GLN L NE2 50 N N . SER A 7 ? 0.3031 0.2966 0.3644 0.0324 -0.0271 -0.0143 7 SER L N 51 C CA . SER A 7 ? 0.3650 0.3584 0.4202 0.0376 -0.0277 -0.0130 7 SER L CA 52 C C . SER A 7 ? 0.3778 0.3657 0.4260 0.0369 -0.0215 -0.0071 7 SER L C 53 O O . SER A 7 ? 0.3317 0.3206 0.3863 0.0326 -0.0172 -0.0042 7 SER L O 54 C CB . SER A 7 ? 0.4366 0.4413 0.5093 0.0398 -0.0310 -0.0159 7 SER L CB 55 O OG . SER A 7 ? 0.5164 0.5266 0.6060 0.0358 -0.0270 -0.0136 7 SER L OG 56 N N . PRO A 8 ? 0.3273 0.3090 0.3616 0.0412 -0.0209 -0.0054 8 PRO L N 57 C CA . PRO A 8 ? 0.3656 0.3445 0.3893 0.0468 -0.0253 -0.0076 8 PRO L CA 58 C C . PRO A 8 ? 0.4037 0.3742 0.4132 0.0454 -0.0254 -0.0079 8 PRO L C 59 O O . PRO A 8 ? 0.3505 0.3175 0.3586 0.0400 -0.0221 -0.0065 8 PRO L O 60 C CB . PRO A 8 ? 0.3423 0.3157 0.3567 0.0515 -0.0225 -0.0043 8 PRO L CB 61 C CG . PRO A 8 ? 0.4548 0.4311 0.4779 0.0487 -0.0177 -0.0015 8 PRO L CG 62 C CD . PRO A 8 ? 0.3563 0.3340 0.3856 0.0419 -0.0157 -0.0012 8 PRO L CD 63 N N . SER A 9 ? 0.3668 0.3349 0.3660 0.0505 -0.0291 -0.0095 9 SER L N 64 C CA . SER A 9 ? 0.4510 0.4112 0.4360 0.0497 -0.0285 -0.0090 9 SER L CA 65 C C . SER A 9 ? 0.4183 0.3662 0.3894 0.0485 -0.0226 -0.0041 9 SER L C 66 O O . SER A 9 ? 0.4002 0.3415 0.3630 0.0449 -0.0199 -0.0029 9 SER L O 67 C CB . SER A 9 ? 0.4836 0.4452 0.4605 0.0565 -0.0337 -0.0115 9 SER L CB 68 O OG . SER A 9 ? 0.5583 0.5181 0.5292 0.0632 -0.0341 -0.0093 9 SER L OG 69 N N . PHE A 10 ? 0.3052 0.2504 0.2750 0.0513 -0.0205 -0.0018 10 PHE L N 70 C CA . PHE A 10 ? 0.4852 0.4180 0.4417 0.0515 -0.0155 0.0019 10 PHE L CA 71 C C . PHE A 10 ? 0.4710 0.4043 0.4326 0.0517 -0.0125 0.0032 10 PHE L C 72 O O . PHE A 10 ? 0.5371 0.4762 0.5050 0.0566 -0.0145 0.0027 10 PHE L O 73 C CB . PHE A 10 ? 0.6335 0.5595 0.5767 0.0586 -0.0167 0.0034 10 PHE L CB 74 C CG . PHE A 10 ? 0.7959 0.7079 0.7263 0.0596 -0.0113 0.0072 10 PHE L CG 75 C CD1 . PHE A 10 ? 0.8008 0.7097 0.7302 0.0645 -0.0100 0.0086 10 PHE L CD1 76 C CD2 . PHE A 10 ? 0.9759 0.8775 0.8956 0.0559 -0.0075 0.0091 10 PHE L CD2 77 C CE1 . PHE A 10 ? 0.8083 0.7032 0.7265 0.0656 -0.0048 0.0116 10 PHE L CE1 78 C CE2 . PHE A 10 ? 0.9876 0.8755 0.8967 0.0563 -0.0023 0.0121 10 PHE L CE2 79 C CZ . PHE A 10 ? 0.9087 0.7927 0.8170 0.0612 -0.0010 0.0132 10 PHE L CZ 80 N N . VAL A 11 ? 0.4045 0.3328 0.3636 0.0465 -0.0077 0.0045 11 VAL L N 81 C CA . VAL A 11 ? 0.3945 0.3231 0.3569 0.0469 -0.0045 0.0055 11 VAL L CA 82 C C . VAL A 11 ? 0.3415 0.2567 0.2905 0.0466 0.0001 0.0068 11 VAL L C 83 O O . VAL A 11 ? 0.3847 0.2932 0.3267 0.0418 0.0023 0.0069 11 VAL L O 84 C CB . VAL A 11 ? 0.4955 0.4324 0.4688 0.0413 -0.0028 0.0054 11 VAL L CB 85 C CG1 . VAL A 11 ? 0.4914 0.4294 0.4667 0.0425 0.0008 0.0064 11 VAL L CG1 86 C CG2 . VAL A 11 ? 0.4194 0.3684 0.4077 0.0408 -0.0066 0.0040 11 VAL L CG2 87 N N . SER A 12 ? 0.3567 0.2681 0.3030 0.0518 0.0017 0.0074 12 SER L N 88 C CA . SER A 12 ? 0.4008 0.2990 0.3360 0.0514 0.0064 0.0079 12 SER L CA 89 C C . SER A 12 ? 0.4275 0.3292 0.3672 0.0503 0.0093 0.0068 12 SER L C 90 O O . SER A 12 ? 0.4075 0.3161 0.3541 0.0549 0.0088 0.0071 12 SER L O 91 C CB . SER A 12 ? 0.4974 0.3858 0.4237 0.0588 0.0067 0.0095 12 SER L CB 92 O OG . SER A 12 ? 0.7636 0.6581 0.6960 0.0654 0.0056 0.0097 12 SER L OG 93 N N . ALA A 13 ? 0.3997 0.2978 0.3356 0.0443 0.0124 0.0055 13 ALA L N 94 C CA . ALA A 13 ? 0.3735 0.2762 0.3126 0.0435 0.0151 0.0043 13 ALA L CA 95 C C . ALA A 13 ? 0.3955 0.2876 0.3246 0.0401 0.0189 0.0018 13 ALA L C 96 O O . ALA A 13 ? 0.3818 0.2663 0.3048 0.0354 0.0194 0.0011 13 ALA L O 97 C CB . ALA A 13 ? 0.2132 0.1296 0.1628 0.0394 0.0140 0.0049 13 ALA L CB 98 N N . SER A 14 ? 0.4464 0.3380 0.3742 0.0424 0.0216 0.0001 14 SER L N 99 C CA . SER A 14 ? 0.5045 0.3865 0.4235 0.0393 0.0250 -0.0037 14 SER L CA 100 C C . SER A 14 ? 0.4431 0.3335 0.3641 0.0327 0.0251 -0.0056 14 SER L C 101 O O . SER A 14 ? 0.4218 0.3257 0.3510 0.0323 0.0238 -0.0035 14 SER L O 102 C CB . SER A 14 ? 0.4692 0.3477 0.3855 0.0449 0.0279 -0.0057 14 SER L CB 103 O OG . SER A 14 ? 0.5859 0.4590 0.5017 0.0521 0.0276 -0.0033 14 SER L OG 104 N N . VAL A 15 ? 0.3614 0.2438 0.2753 0.0277 0.0269 -0.0094 15 VAL L N 105 C CA . VAL A 15 ? 0.3170 0.2076 0.2315 0.0224 0.0271 -0.0121 15 VAL L CA 106 C C . VAL A 15 ? 0.3604 0.2607 0.2770 0.0265 0.0283 -0.0129 15 VAL L C 107 O O . VAL A 15 ? 0.3592 0.2539 0.2725 0.0315 0.0303 -0.0145 15 VAL L O 108 C CB . VAL A 15 ? 0.3935 0.2734 0.3002 0.0169 0.0290 -0.0175 15 VAL L CB 109 C CG1 . VAL A 15 ? 0.3251 0.2157 0.2326 0.0119 0.0285 -0.0210 15 VAL L CG1 110 C CG2 . VAL A 15 ? 0.3971 0.2673 0.3020 0.0133 0.0288 -0.0158 15 VAL L CG2 111 N N . GLY A 16 ? 0.3427 0.2575 0.2649 0.0249 0.0275 -0.0112 16 GLY L N 112 C CA . GLY A 16 ? 0.3470 0.2723 0.2715 0.0292 0.0292 -0.0107 16 GLY L CA 113 C C . GLY A 16 ? 0.3496 0.2833 0.2842 0.0342 0.0289 -0.0050 16 GLY L C 114 O O . GLY A 16 ? 0.3831 0.3283 0.3225 0.0371 0.0305 -0.0026 16 GLY L O 115 N N . ASP A 17 ? 0.2977 0.2261 0.2359 0.0354 0.0269 -0.0027 17 ASP L N 116 C CA . ASP A 17 ? 0.3197 0.2565 0.2690 0.0395 0.0260 0.0018 17 ASP L CA 117 C C . ASP A 17 ? 0.3317 0.2805 0.2915 0.0364 0.0247 0.0055 17 ASP L C 118 O O . ASP A 17 ? 0.3827 0.3318 0.3409 0.0312 0.0235 0.0052 17 ASP L O 119 C CB . ASP A 17 ? 0.4102 0.3389 0.3598 0.0421 0.0237 0.0024 17 ASP L CB 120 C CG . ASP A 17 ? 0.6905 0.6116 0.6351 0.0484 0.0255 0.0009 17 ASP L CG 121 O OD1 . ASP A 17 ? 0.8009 0.7206 0.7402 0.0499 0.0287 -0.0015 17 ASP L OD1 122 O OD2 . ASP A 17 ? 0.7686 0.6854 0.7142 0.0522 0.0237 0.0022 17 ASP L OD2 123 N N . ARG A 18 ? 0.3533 0.3118 0.3245 0.0398 0.0251 0.0092 18 ARG L N 124 C CA . ARG A 18 ? 0.3460 0.3147 0.3298 0.0375 0.0241 0.0130 18 ARG L CA 125 C C . ARG A 18 ? 0.3125 0.2783 0.3020 0.0371 0.0200 0.0129 18 ARG L C 126 O O . ARG A 18 ? 0.3489 0.3099 0.3371 0.0409 0.0187 0.0117 18 ARG L O 127 C CB . ARG A 18 ? 0.3625 0.3429 0.3569 0.0412 0.0272 0.0170 18 ARG L CB 128 C CG . ARG A 18 ? 0.4009 0.3909 0.4112 0.0395 0.0268 0.0212 18 ARG L CG 129 C CD . ARG A 18 ? 0.4686 0.4693 0.4904 0.0435 0.0306 0.0254 18 ARG L CD 130 N NE . ARG A 18 ? 0.5509 0.5604 0.5887 0.0413 0.0313 0.0298 18 ARG L NE 131 C CZ . ARG A 18 ? 0.5378 0.5538 0.5786 0.0399 0.0347 0.0341 18 ARG L CZ 132 N NH1 . ARG A 18 ? 0.5398 0.5561 0.5681 0.0406 0.0370 0.0342 18 ARG L NH1 133 N NH2 . ARG A 18 ? 0.4879 0.5105 0.5444 0.0380 0.0357 0.0383 18 ARG L NH2 134 N N . VAL A 19 ? 0.2500 0.2191 0.2456 0.0331 0.0180 0.0141 19 VAL L N 135 C CA . VAL A 19 ? 0.3225 0.2905 0.3240 0.0330 0.0140 0.0134 19 VAL L CA 136 C C . VAL A 19 ? 0.3393 0.3165 0.3549 0.0304 0.0133 0.0157 19 VAL L C 137 O O . VAL A 19 ? 0.3064 0.2871 0.3231 0.0271 0.0152 0.0176 19 VAL L O 138 C CB . VAL A 19 ? 0.3648 0.3219 0.3545 0.0307 0.0116 0.0106 19 VAL L CB 139 C CG1 . VAL A 19 ? 0.3499 0.3067 0.3355 0.0253 0.0126 0.0107 19 VAL L CG1 140 C CG2 . VAL A 19 ? 0.3898 0.3466 0.3842 0.0317 0.0073 0.0097 19 VAL L CG2 141 N N . THR A 20 ? 0.2986 0.2801 0.3258 0.0320 0.0107 0.0153 20 THR L N 142 C CA . THR A 20 ? 0.3401 0.3288 0.3821 0.0293 0.0098 0.0165 20 THR L CA 143 C C . THR A 20 ? 0.3439 0.3304 0.3882 0.0291 0.0044 0.0127 20 THR L C 144 O O . THR A 20 ? 0.3154 0.3016 0.3601 0.0328 0.0016 0.0106 20 THR L O 145 C CB . THR A 20 ? 0.3271 0.3261 0.3856 0.0311 0.0124 0.0196 20 THR L CB 146 O OG1 . THR A 20 ? 0.3616 0.3635 0.4168 0.0320 0.0178 0.0235 20 THR L OG1 147 C CG2 . THR A 20 ? 0.3202 0.3252 0.3952 0.0278 0.0119 0.0206 20 THR L CG2 148 N N . ILE A 21 ? 0.2289 0.2143 0.2742 0.0254 0.0029 0.0119 21 ILE L N 149 C CA . ILE A 21 ? 0.2647 0.2489 0.3119 0.0254 -0.0022 0.0078 21 ILE L CA 150 C C . ILE A 21 ? 0.2511 0.2423 0.3156 0.0228 -0.0029 0.0074 21 ILE L C 151 O O . ILE A 21 ? 0.2435 0.2374 0.3140 0.0199 0.0007 0.0107 21 ILE L O 152 C CB . ILE A 21 ? 0.3616 0.3370 0.3935 0.0238 -0.0035 0.0062 21 ILE L CB 153 C CG1 . ILE A 21 ? 0.3229 0.2984 0.3544 0.0193 -0.0007 0.0083 21 ILE L CG1 154 C CG2 . ILE A 21 ? 0.4559 0.4230 0.4719 0.0262 -0.0023 0.0065 21 ILE L CG2 155 C CD1 . ILE A 21 ? 0.4243 0.3924 0.4423 0.0174 -0.0015 0.0069 21 ILE L CD1 156 N N . THR A 22 ? 0.2555 0.2498 0.3283 0.0240 -0.0076 0.0031 22 THR L N 157 C CA . THR A 22 ? 0.3580 0.3591 0.4499 0.0215 -0.0084 0.0017 22 THR L CA 158 C C . THR A 22 ? 0.3180 0.3169 0.4094 0.0200 -0.0128 -0.0034 22 THR L C 159 O O . THR A 22 ? 0.2642 0.2589 0.3430 0.0222 -0.0167 -0.0068 22 THR L O 160 C CB . THR A 22 ? 0.3571 0.3665 0.4644 0.0236 -0.0101 0.0000 22 THR L CB 161 O OG1 . THR A 22 ? 0.5590 0.5680 0.6595 0.0276 -0.0159 -0.0048 22 THR L OG1 162 C CG2 . THR A 22 ? 0.3205 0.3331 0.4297 0.0254 -0.0050 0.0054 22 THR L CG2 163 N N . CYS A 23 ? 0.2940 0.2958 0.3995 0.0165 -0.0116 -0.0036 23 CYS L N 164 C CA . CYS A 23 ? 0.3403 0.3408 0.4484 0.0149 -0.0153 -0.0090 23 CYS L CA 165 C C . CYS A 23 ? 0.3204 0.3279 0.4517 0.0131 -0.0166 -0.0123 23 CYS L C 166 O O . CYS A 23 ? 0.3065 0.3170 0.4518 0.0108 -0.0118 -0.0079 23 CYS L O 167 C CB . CYS A 23 ? 0.3640 0.3596 0.4659 0.0121 -0.0120 -0.0061 23 CYS L CB 168 S SG . CYS A 23 ? 0.5129 0.5056 0.6140 0.0109 -0.0160 -0.0126 23 CYS L SG 169 N N . ARG A 24 ? 0.2688 0.2791 0.4043 0.0143 -0.0230 -0.0201 24 ARG L N 170 C CA . ARG A 24 ? 0.2691 0.2862 0.4276 0.0121 -0.0249 -0.0250 24 ARG L CA 171 C C . ARG A 24 ? 0.2783 0.2931 0.4395 0.0103 -0.0284 -0.0319 24 ARG L C 172 O O . ARG A 24 ? 0.3982 0.4109 0.5455 0.0129 -0.0334 -0.0370 24 ARG L O 173 C CB . ARG A 24 ? 0.3695 0.3946 0.5343 0.0151 -0.0301 -0.0296 24 ARG L CB 174 C CG . ARG A 24 ? 0.5005 0.5339 0.6908 0.0124 -0.0327 -0.0359 24 ARG L CG 175 C CD . ARG A 24 ? 0.7415 0.7843 0.9369 0.0159 -0.0390 -0.0416 24 ARG L CD 176 N NE . ARG A 24 ? 1.0440 1.0934 1.2561 0.0141 -0.0452 -0.0520 24 ARG L NE 177 C CZ . ARG A 24 ? 1.2405 1.3006 1.4620 0.0164 -0.0517 -0.0589 24 ARG L CZ 178 N NH1 . ARG A 24 ? 1.3090 1.3739 1.5247 0.0211 -0.0525 -0.0559 24 ARG L NH1 179 N NH2 . ARG A 24 ? 1.2550 1.3211 1.4920 0.0142 -0.0575 -0.0694 24 ARG L NH2 180 N N . ALA A 25 ? 0.2978 0.3127 0.4767 0.0061 -0.0252 -0.0318 25 ALA L N 181 C CA . ALA A 25 ? 0.2683 0.2810 0.4527 0.0043 -0.0281 -0.0391 25 ALA L CA 182 C C . ALA A 25 ? 0.2675 0.2876 0.4714 0.0033 -0.0336 -0.0487 25 ALA L C 183 O O . ALA A 25 ? 0.3137 0.3399 0.5351 0.0017 -0.0322 -0.0474 25 ALA L O 184 C CB . ALA A 25 ? 0.2147 0.2224 0.4073 0.0008 -0.0215 -0.0339 25 ALA L CB 185 N N . SER A 26 ? 0.2574 0.2775 0.4586 0.0042 -0.0399 -0.0585 26 SER L N 186 C CA . SER A 26 ? 0.3736 0.4016 0.5918 0.0035 -0.0466 -0.0695 26 SER L CA 187 C C . SER A 26 ? 0.3842 0.4127 0.6304 -0.0023 -0.0432 -0.0716 26 SER L C 188 O O . SER A 26 ? 0.4212 0.4575 0.6878 -0.0044 -0.0465 -0.0782 26 SER L O 189 C CB . SER A 26 ? 0.3187 0.3469 0.5243 0.0069 -0.0542 -0.0798 26 SER L CB 190 O OG . SER A 26 ? 0.3826 0.4025 0.5828 0.0055 -0.0516 -0.0802 26 SER L OG 191 N N . GLN A 27 ? 0.4078 0.4279 0.6554 -0.0049 -0.0365 -0.0660 27 GLN L N 192 C CA . GLN A 27 ? 0.4049 0.4234 0.6782 -0.0102 -0.0310 -0.0647 27 GLN L CA 193 C C . GLN A 27 ? 0.3666 0.3796 0.6365 -0.0108 -0.0213 -0.0506 27 GLN L C 194 O O . GLN A 27 ? 0.4371 0.4466 0.6847 -0.0078 -0.0199 -0.0444 27 GLN L O 195 C CB . GLN A 27 ? 0.4263 0.4398 0.7075 -0.0122 -0.0330 -0.0739 27 GLN L CB 196 C CG . GLN A 27 ? 0.5267 0.5455 0.8070 -0.0107 -0.0432 -0.0888 27 GLN L CG 197 C CD . GLN A 27 ? 0.6974 0.7100 0.9814 -0.0119 -0.0447 -0.0976 27 GLN L CD 198 O OE1 . GLN A 27 ? 0.6987 0.7051 0.9992 -0.0158 -0.0387 -0.0956 27 GLN L OE1 199 N NE2 . GLN A 27 ? 0.7340 0.7482 1.0021 -0.0080 -0.0522 -0.1072 27 GLN L NE2 200 N N . GLY A 28 ? 0.3479 0.3605 0.6400 -0.0146 -0.0146 -0.0457 28 GLY L N 201 C CA . GLY A 28 ? 0.3527 0.3610 0.6423 -0.0145 -0.0053 -0.0322 28 GLY L CA 202 C C . GLY A 28 ? 0.3270 0.3269 0.6020 -0.0132 -0.0030 -0.0293 28 GLY L C 203 O O . GLY A 28 ? 0.3961 0.3915 0.6751 -0.0143 -0.0053 -0.0366 28 GLY L O 204 N N . ILE A 29 ? 0.2453 0.2437 0.5034 -0.0108 0.0014 -0.0191 29 ILE L N 205 C CA . ILE A 29 ? 0.2854 0.2775 0.5300 -0.0094 0.0040 -0.0153 29 ILE L CA 206 C C . ILE A 29 ? 0.2787 0.2704 0.5235 -0.0087 0.0127 -0.0020 29 ILE L C 207 O O . ILE A 29 ? 0.2408 0.2301 0.4697 -0.0066 0.0146 0.0031 29 ILE L O 208 C CB . ILE A 29 ? 0.3163 0.3077 0.5342 -0.0064 -0.0011 -0.0179 29 ILE L CB 209 C CG1 . ILE A 29 ? 0.2910 0.2867 0.4964 -0.0044 -0.0011 -0.0127 29 ILE L CG1 210 C CG2 . ILE A 29 ? 0.3149 0.3064 0.5304 -0.0060 -0.0093 -0.0305 29 ILE L CG2 211 C CD1 . ILE A 29 ? 0.3085 0.3022 0.4884 -0.0018 -0.0043 -0.0132 29 ILE L CD1 212 N N . SER A 30 ? 0.2585 0.2532 0.5216 -0.0102 0.0179 0.0035 30 SER L N 213 C CA . SER A 30 ? 0.2063 0.2024 0.4699 -0.0087 0.0264 0.0167 30 SER L CA 214 C C . SER A 30 ? 0.1665 0.1647 0.4047 -0.0053 0.0259 0.0217 30 SER L C 215 O O . SER A 30 ? 0.2490 0.2509 0.4775 -0.0043 0.0222 0.0194 30 SER L O 216 C CB . SER A 30 ? 0.3577 0.3483 0.6314 -0.0089 0.0328 0.0223 30 SER L CB 217 O OG . SER A 30 ? 0.5411 0.5264 0.8043 -0.0082 0.0295 0.0172 30 SER L OG 218 N N . SER A 31 ? 0.1560 0.1520 0.3841 -0.0034 0.0295 0.0281 31 SER L N 219 C CA . SER A 31 ? 0.2857 0.2840 0.4912 -0.0007 0.0293 0.0325 31 SER L CA 220 C C . SER A 31 ? 0.2867 0.2813 0.4756 -0.0003 0.0252 0.0280 31 SER L C 221 O O . SER A 31 ? 0.2518 0.2479 0.4252 0.0015 0.0264 0.0325 31 SER L O 222 C CB . SER A 31 ? 0.2905 0.2923 0.4964 0.0017 0.0371 0.0447 31 SER L CB 223 O OG . SER A 31 ? 0.4052 0.4117 0.6213 0.0021 0.0410 0.0496 31 SER L OG 224 N N . TYR A 32 ? 0.2526 0.2431 0.4451 -0.0018 0.0205 0.0189 32 TYR L N 225 C CA . TYR A 32 ? 0.1774 0.1645 0.3551 -0.0011 0.0171 0.0146 32 TYR L CA 226 C C . TYR A 32 ? 0.2394 0.2272 0.3988 -0.0005 0.0114 0.0096 32 TYR L C 227 O O . TYR A 32 ? 0.2498 0.2353 0.4053 -0.0007 0.0060 0.0011 32 TYR L O 228 C CB . TYR A 32 ? 0.2220 0.2044 0.4109 -0.0023 0.0152 0.0071 32 TYR L CB 229 C CG . TYR A 32 ? 0.2133 0.1932 0.4171 -0.0023 0.0215 0.0129 32 TYR L CG 230 C CD1 . TYR A 32 ? 0.3012 0.2803 0.4967 -0.0003 0.0249 0.0186 32 TYR L CD1 231 C CD2 . TYR A 32 ? 0.2334 0.2118 0.4600 -0.0042 0.0245 0.0129 32 TYR L CD2 232 C CE1 . TYR A 32 ? 0.3937 0.3705 0.6023 0.0007 0.0311 0.0247 32 TYR L CE1 233 C CE2 . TYR A 32 ? 0.2533 0.2283 0.4939 -0.0039 0.0312 0.0190 32 TYR L CE2 234 C CZ . TYR A 32 ? 0.2958 0.2699 0.5267 -0.0010 0.0344 0.0252 32 TYR L CZ 235 O OH . TYR A 32 ? 0.3305 0.3010 0.5744 0.0003 0.0412 0.0320 32 TYR L OH 236 N N . LEU A 33 ? 0.2340 0.2248 0.3820 0.0005 0.0129 0.0150 33 LEU L N 237 C CA . LEU A 33 ? 0.2444 0.2348 0.3756 0.0013 0.0085 0.0114 33 LEU L CA 238 C C . LEU A 33 ? 0.2376 0.2290 0.3525 0.0020 0.0108 0.0168 33 LEU L C 239 O O . LEU A 33 ? 0.2659 0.2609 0.3830 0.0026 0.0154 0.0240 33 LEU L O 240 C CB . LEU A 33 ? 0.2101 0.2033 0.3468 0.0016 0.0069 0.0100 33 LEU L CB 241 C CG . LEU A 33 ? 0.3021 0.2941 0.4219 0.0031 0.0026 0.0065 33 LEU L CG 242 C CD1 . LEU A 33 ? 0.2621 0.2530 0.3837 0.0036 -0.0035 -0.0022 33 LEU L CD1 243 C CD2 . LEU A 33 ? 0.3166 0.3118 0.4343 0.0044 0.0048 0.0110 33 LEU L CD2 244 N N . ALA A 34 ? 0.2593 0.2478 0.3581 0.0021 0.0075 0.0131 34 ALA L N 245 C CA . ALA A 34 ? 0.2569 0.2460 0.3402 0.0021 0.0089 0.0165 34 ALA L CA 246 C C . ALA A 34 ? 0.2519 0.2380 0.3220 0.0026 0.0056 0.0130 34 ALA L C 247 O O . ALA A 34 ? 0.2885 0.2719 0.3585 0.0033 0.0017 0.0076 34 ALA L O 248 C CB . ALA A 34 ? 0.2408 0.2292 0.3179 0.0014 0.0095 0.0167 34 ALA L CB 249 N N . TRP A 35 ? 0.2023 0.1889 0.2613 0.0025 0.0072 0.0159 35 TRP L N 250 C CA . TRP A 35 ? 0.2210 0.2033 0.2665 0.0030 0.0050 0.0132 35 TRP L CA 251 C C . TRP A 35 ? 0.2790 0.2587 0.3106 0.0013 0.0056 0.0132 35 TRP L C 252 O O . TRP A 35 ? 0.3115 0.2950 0.3418 0.0000 0.0083 0.0166 35 TRP L O 253 C CB . TRP A 35 ? 0.2155 0.1995 0.2602 0.0043 0.0065 0.0156 35 TRP L CB 254 C CG . TRP A 35 ? 0.2566 0.2432 0.3141 0.0061 0.0059 0.0154 35 TRP L CG 255 C CD1 . TRP A 35 ? 0.2260 0.2181 0.2983 0.0062 0.0088 0.0191 35 TRP L CD1 256 C CD2 . TRP A 35 ? 0.2484 0.2330 0.3058 0.0080 0.0025 0.0114 35 TRP L CD2 257 N NE1 . TRP A 35 ? 0.2249 0.2187 0.3073 0.0075 0.0074 0.0173 35 TRP L NE1 258 C CE2 . TRP A 35 ? 0.2424 0.2322 0.3158 0.0088 0.0032 0.0124 35 TRP L CE2 259 C CE3 . TRP A 35 ? 0.3025 0.2818 0.3482 0.0095 -0.0009 0.0076 35 TRP L CE3 260 C CZ2 . TRP A 35 ? 0.2153 0.2062 0.2937 0.0109 0.0001 0.0091 35 TRP L CZ2 261 C CZ3 . TRP A 35 ? 0.3002 0.2802 0.3498 0.0123 -0.0040 0.0048 35 TRP L CZ3 262 C CH2 . TRP A 35 ? 0.2695 0.2558 0.3355 0.0129 -0.0038 0.0052 35 TRP L CH2 263 N N . TYR A 36 ? 0.2802 0.2541 0.3019 0.0014 0.0032 0.0096 36 TYR L N 264 C CA . TYR A 36 ? 0.2407 0.2116 0.2499 -0.0007 0.0042 0.0095 36 TYR L CA 265 C C . TYR A 36 ? 0.2452 0.2098 0.2429 -0.0002 0.0039 0.0084 36 TYR L C 266 O O . TYR A 36 ? 0.2176 0.1790 0.2146 0.0025 0.0018 0.0067 36 TYR L O 267 C CB . TYR A 36 ? 0.2177 0.1865 0.2244 -0.0010 0.0030 0.0071 36 TYR L CB 268 C CG . TYR A 36 ? 0.2198 0.1933 0.2374 -0.0011 0.0035 0.0075 36 TYR L CG 269 C CD1 . TYR A 36 ? 0.2129 0.1869 0.2411 0.0007 0.0014 0.0051 36 TYR L CD1 270 C CD2 . TYR A 36 ? 0.2702 0.2477 0.2883 -0.0029 0.0060 0.0101 36 TYR L CD2 271 C CE1 . TYR A 36 ? 0.2277 0.2047 0.2666 0.0006 0.0023 0.0052 36 TYR L CE1 272 C CE2 . TYR A 36 ? 0.2528 0.2339 0.2810 -0.0024 0.0068 0.0108 36 TYR L CE2 273 C CZ . TYR A 36 ? 0.2830 0.2630 0.3215 -0.0007 0.0052 0.0084 36 TYR L CZ 274 O OH . TYR A 36 ? 0.3397 0.3219 0.3889 -0.0001 0.0064 0.0089 36 TYR L OH 275 N N . GLN A 37 ? 0.2951 0.2582 0.2843 -0.0028 0.0060 0.0092 37 GLN L N 276 C CA . GLN A 37 ? 0.3030 0.2588 0.2811 -0.0031 0.0065 0.0081 37 GLN L CA 277 C C . GLN A 37 ? 0.3267 0.2770 0.2963 -0.0048 0.0070 0.0070 37 GLN L C 278 O O . GLN A 37 ? 0.3249 0.2788 0.2952 -0.0077 0.0083 0.0076 37 GLN L O 279 C CB . GLN A 37 ? 0.2276 0.1853 0.2030 -0.0052 0.0088 0.0090 37 GLN L CB 280 C CG . GLN A 37 ? 0.2209 0.1699 0.1855 -0.0060 0.0099 0.0073 37 GLN L CG 281 C CD . GLN A 37 ? 0.2916 0.2434 0.2534 -0.0091 0.0120 0.0068 37 GLN L CD 282 O OE1 . GLN A 37 ? 0.2953 0.2487 0.2549 -0.0131 0.0130 0.0061 37 GLN L OE1 283 N NE2 . GLN A 37 ? 0.2287 0.1821 0.1909 -0.0072 0.0125 0.0067 37 GLN L NE2 284 N N . GLN A 38 ? 0.2809 0.2232 0.2427 -0.0027 0.0063 0.0060 38 GLN L N 285 C CA . GLN A 38 ? 0.2527 0.1895 0.2060 -0.0041 0.0077 0.0059 38 GLN L CA 286 C C . GLN A 38 ? 0.2364 0.1629 0.1792 -0.0036 0.0094 0.0062 38 GLN L C 287 O O . GLN A 38 ? 0.2758 0.1979 0.2160 0.0006 0.0080 0.0060 38 GLN L O 288 C CB . GLN A 38 ? 0.3042 0.2416 0.2579 -0.0009 0.0054 0.0048 38 GLN L CB 289 C CG . GLN A 38 ? 0.3066 0.2400 0.2520 -0.0021 0.0075 0.0053 38 GLN L CG 290 C CD . GLN A 38 ? 0.3238 0.2577 0.2676 0.0020 0.0052 0.0038 38 GLN L CD 291 O OE1 . GLN A 38 ? 0.2929 0.2270 0.2381 0.0064 0.0016 0.0020 38 GLN L OE1 292 N NE2 . GLN A 38 ? 0.2881 0.2230 0.2290 0.0008 0.0070 0.0040 38 GLN L NE2 293 N N . LYS A 39 ? 0.2619 0.1849 0.1996 -0.0079 0.0127 0.0066 39 LYS L N 294 C CA . LYS A 39 ? 0.3487 0.2605 0.2771 -0.0084 0.0155 0.0072 39 LYS L CA 295 C C . LYS A 39 ? 0.4237 0.3306 0.3454 -0.0076 0.0172 0.0088 39 LYS L C 296 O O . LYS A 39 ? 0.3619 0.2749 0.2864 -0.0085 0.0168 0.0089 39 LYS L O 297 C CB . LYS A 39 ? 0.2792 0.1903 0.2076 -0.0141 0.0183 0.0060 39 LYS L CB 298 C CG . LYS A 39 ? 0.3856 0.3029 0.3195 -0.0140 0.0168 0.0046 39 LYS L CG 299 C CD . LYS A 39 ? 0.4144 0.3313 0.3472 -0.0189 0.0190 0.0023 39 LYS L CD 300 C CE . LYS A 39 ? 0.3906 0.3156 0.3283 -0.0178 0.0174 0.0013 39 LYS L CE 301 N NZ . LYS A 39 ? 0.4566 0.3822 0.3926 -0.0220 0.0190 -0.0020 39 LYS L NZ 302 N N . PRO A 40 ? 0.4004 0.2961 0.3131 -0.0054 0.0193 0.0105 40 PRO L N 303 C CA . PRO A 40 ? 0.3853 0.2765 0.2906 -0.0033 0.0213 0.0129 40 PRO L CA 304 C C . PRO A 40 ? 0.3961 0.2894 0.3023 -0.0091 0.0250 0.0136 40 PRO L C 305 O O . PRO A 40 ? 0.4723 0.3649 0.3812 -0.0152 0.0276 0.0128 40 PRO L O 306 C CB . PRO A 40 ? 0.4698 0.3477 0.3659 -0.0006 0.0241 0.0153 40 PRO L CB 307 C CG . PRO A 40 ? 0.4693 0.3468 0.3684 0.0017 0.0215 0.0135 40 PRO L CG 308 C CD . PRO A 40 ? 0.4699 0.3568 0.3786 -0.0037 0.0203 0.0106 40 PRO L CD 309 N N . GLY A 41 ? 0.3857 0.2823 0.2898 -0.0069 0.0249 0.0147 41 GLY L N 310 C CA . GLY A 41 ? 0.4349 0.3346 0.3401 -0.0116 0.0287 0.0157 41 GLY L CA 311 C C . GLY A 41 ? 0.4803 0.3916 0.3959 -0.0162 0.0272 0.0133 41 GLY L C 312 O O . GLY A 41 ? 0.5900 0.5055 0.5081 -0.0205 0.0302 0.0138 41 GLY L O 313 N N . LYS A 42 ? 0.3764 0.2936 0.2987 -0.0149 0.0230 0.0111 42 LYS L N 314 C CA . LYS A 42 ? 0.3663 0.2943 0.2981 -0.0185 0.0219 0.0096 42 LYS L CA 315 C C . LYS A 42 ? 0.2661 0.2018 0.2046 -0.0147 0.0179 0.0085 42 LYS L C 316 O O . LYS A 42 ? 0.2613 0.1944 0.1982 -0.0097 0.0152 0.0078 42 LYS L O 317 C CB . LYS A 42 ? 0.4535 0.3820 0.3883 -0.0219 0.0218 0.0084 42 LYS L CB 318 C CG . LYS A 42 ? 0.6267 0.5483 0.5573 -0.0270 0.0258 0.0082 42 LYS L CG 319 C CD . LYS A 42 ? 0.8824 0.8050 0.8155 -0.0297 0.0251 0.0058 42 LYS L CD 320 C CE . LYS A 42 ? 1.0042 0.9184 0.9336 -0.0347 0.0289 0.0045 42 LYS L CE 321 N NZ . LYS A 42 ? 1.0079 0.9227 0.9388 -0.0368 0.0280 0.0011 42 LYS L NZ 322 N N . ALA A 43 ? 0.3460 0.2912 0.2927 -0.0171 0.0177 0.0083 43 ALA L N 323 C CA . ALA A 43 ? 0.3186 0.2706 0.2733 -0.0141 0.0149 0.0075 43 ALA L CA 324 C C . ALA A 43 ? 0.3061 0.2597 0.2663 -0.0129 0.0125 0.0072 43 ALA L C 325 O O . ALA A 43 ? 0.2503 0.2032 0.2094 -0.0152 0.0134 0.0076 43 ALA L O 326 C CB . ALA A 43 ? 0.3273 0.2885 0.2886 -0.0163 0.0162 0.0081 43 ALA L CB 327 N N . PRO A 44 ? 0.2557 0.2117 0.2223 -0.0093 0.0097 0.0063 44 PRO L N 328 C CA . PRO A 44 ? 0.3240 0.2827 0.2975 -0.0083 0.0082 0.0067 44 PRO L CA 329 C C . PRO A 44 ? 0.3395 0.3060 0.3190 -0.0110 0.0099 0.0088 44 PRO L C 330 O O . PRO A 44 ? 0.3362 0.3078 0.3177 -0.0128 0.0112 0.0096 44 PRO L O 331 C CB . PRO A 44 ? 0.2727 0.2334 0.2541 -0.0048 0.0055 0.0051 44 PRO L CB 332 C CG . PRO A 44 ? 0.2429 0.1997 0.2179 -0.0029 0.0047 0.0029 44 PRO L CG 333 C CD . PRO A 44 ? 0.2256 0.1818 0.1936 -0.0059 0.0080 0.0044 44 PRO L CD 334 N N . LYS A 45 ? 0.2615 0.2295 0.2431 -0.0108 0.0098 0.0097 45 LYS L N 335 C CA . LYS A 45 ? 0.2310 0.2076 0.2180 -0.0120 0.0111 0.0120 45 LYS L CA 336 C C . LYS A 45 ? 0.2848 0.2650 0.2812 -0.0090 0.0105 0.0139 45 LYS L C 337 O O . LYS A 45 ? 0.2786 0.2549 0.2753 -0.0070 0.0093 0.0131 45 LYS L O 338 C CB . LYS A 45 ? 0.2371 0.2136 0.2176 -0.0146 0.0122 0.0114 45 LYS L CB 339 C CG . LYS A 45 ? 0.4310 0.4055 0.4048 -0.0188 0.0135 0.0098 45 LYS L CG 340 C CD . LYS A 45 ? 0.5476 0.5222 0.5165 -0.0216 0.0144 0.0081 45 LYS L CD 341 C CE . LYS A 45 ? 0.7022 0.6743 0.6661 -0.0265 0.0161 0.0060 45 LYS L CE 342 N NZ . LYS A 45 ? 0.8175 0.7884 0.7772 -0.0297 0.0167 0.0031 45 LYS L NZ 343 N N . LEU A 46 ? 0.1740 0.1619 0.1786 -0.0085 0.0116 0.0167 46 LEU L N 344 C CA . LEU A 46 ? 0.2088 0.2004 0.2240 -0.0058 0.0121 0.0195 46 LEU L CA 345 C C . LEU A 46 ? 0.2768 0.2714 0.2909 -0.0050 0.0132 0.0215 46 LEU L C 346 O O . LEU A 46 ? 0.1894 0.1887 0.1983 -0.0061 0.0143 0.0225 46 LEU L O 347 C CB . LEU A 46 ? 0.2277 0.2262 0.2513 -0.0050 0.0138 0.0229 46 LEU L CB 348 C CG . LEU A 46 ? 0.2540 0.2564 0.2895 -0.0023 0.0155 0.0271 46 LEU L CG 349 C CD1 . LEU A 46 ? 0.2298 0.2265 0.2728 -0.0012 0.0140 0.0246 46 LEU L CD1 350 C CD2 . LEU A 46 ? 0.2197 0.2284 0.2625 -0.0011 0.0178 0.0311 46 LEU L CD2 351 N N . VAL A 47 ? 0.2335 0.2261 0.2528 -0.0028 0.0129 0.0219 47 VAL L N 352 C CA . VAL A 47 ? 0.2546 0.2501 0.2730 -0.0013 0.0143 0.0239 47 VAL L CA 353 C C . VAL A 47 ? 0.1976 0.1995 0.2282 0.0012 0.0167 0.0290 47 VAL L C 354 O O . VAL A 47 ? 0.2376 0.2466 0.2681 0.0025 0.0192 0.0329 47 VAL L O 355 C CB . VAL A 47 ? 0.2956 0.2842 0.3101 -0.0003 0.0127 0.0209 47 VAL L CB 356 C CG1 . VAL A 47 ? 0.3360 0.3278 0.3494 0.0016 0.0146 0.0227 47 VAL L CG1 357 C CG2 . VAL A 47 ? 0.3495 0.3305 0.3521 -0.0023 0.0110 0.0168 47 VAL L CG2 358 N N . ILE A 48 ? 0.2464 0.2460 0.2877 0.0021 0.0161 0.0287 48 ILE L N 359 C CA . ILE A 48 ? 0.1451 0.1493 0.2002 0.0041 0.0190 0.0335 48 ILE L CA 360 C C . ILE A 48 ? 0.2189 0.2212 0.2855 0.0036 0.0185 0.0327 48 ILE L C 361 O O . ILE A 48 ? 0.2233 0.2202 0.2886 0.0025 0.0151 0.0273 48 ILE L O 362 C CB . ILE A 48 ? 0.2586 0.2624 0.3181 0.0057 0.0192 0.0335 48 ILE L CB 363 C CG1 . ILE A 48 ? 0.3206 0.3287 0.3722 0.0073 0.0216 0.0363 48 ILE L CG1 364 C CG2 . ILE A 48 ? 0.2916 0.2977 0.3688 0.0067 0.0214 0.0366 48 ILE L CG2 365 C CD1 . ILE A 48 ? 0.3951 0.4022 0.4477 0.0091 0.0216 0.0355 48 ILE L CD1 366 N N . TYR A 49 ? 0.2387 0.2454 0.3160 0.0048 0.0220 0.0381 49 TYR L N 367 C CA . TYR A 49 ? 0.2103 0.2145 0.3009 0.0045 0.0223 0.0375 49 TYR L CA 368 C C . TYR A 49 ? 0.2663 0.2731 0.3730 0.0060 0.0265 0.0429 49 TYR L C 369 O O . TYR A 49 ? 0.3115 0.3231 0.4177 0.0078 0.0296 0.0482 49 TYR L O 370 C CB . TYR A 49 ? 0.2005 0.2058 0.2893 0.0045 0.0232 0.0388 49 TYR L CB 371 C CG . TYR A 49 ? 0.1986 0.2115 0.2856 0.0066 0.0271 0.0462 49 TYR L CG 372 C CD1 . TYR A 49 ? 0.2421 0.2595 0.3153 0.0064 0.0263 0.0465 49 TYR L CD1 373 C CD2 . TYR A 49 ? 0.2837 0.2995 0.3831 0.0090 0.0316 0.0529 49 TYR L CD2 374 C CE1 . TYR A 49 ? 0.3296 0.3555 0.4005 0.0087 0.0293 0.0526 49 TYR L CE1 375 C CE2 . TYR A 49 ? 0.2825 0.3063 0.3793 0.0119 0.0351 0.0603 49 TYR L CE2 376 C CZ . TYR A 49 ? 0.3548 0.3844 0.4370 0.0119 0.0335 0.0598 49 TYR L CZ 377 O OH . TYR A 49 ? 0.3160 0.3551 0.3949 0.0152 0.0363 0.0663 49 TYR L OH 378 N N . ALA A 50 ? 0.2661 0.2696 0.3873 0.0054 0.0268 0.0414 50 ALA L N 379 C CA . ALA A 50 ? 0.2416 0.2461 0.3810 0.0059 0.0309 0.0457 50 ALA L CA 380 C C . ALA A 50 ? 0.2770 0.2840 0.4181 0.0062 0.0309 0.0460 50 ALA L C 381 O O . ALA A 50 ? 0.2163 0.2276 0.3653 0.0078 0.0360 0.0530 50 ALA L O 382 C CB . ALA A 50 ? 0.2402 0.2490 0.3844 0.0085 0.0372 0.0554 50 ALA L CB 383 N N . ALA A 51 ? 0.2637 0.2683 0.3966 0.0051 0.0256 0.0388 51 ALA L N 384 C CA . ALA A 51 ? 0.2728 0.2792 0.4062 0.0056 0.0246 0.0376 51 ALA L CA 385 C C . ALA A 51 ? 0.3104 0.3212 0.4328 0.0079 0.0274 0.0427 51 ALA L C 386 O O . ALA A 51 ? 0.3260 0.3363 0.4396 0.0085 0.0249 0.0395 51 ALA L O 387 C CB . ALA A 51 ? 0.2753 0.2835 0.4302 0.0050 0.0270 0.0387 51 ALA L CB 388 N N . SER A 52 ? 0.3246 0.3400 0.4470 0.0096 0.0325 0.0504 52 SER L N 389 C CA . SER A 52 ? 0.2942 0.3150 0.4078 0.0123 0.0354 0.0550 52 SER L CA 390 C C . SER A 52 ? 0.2364 0.2612 0.3374 0.0139 0.0370 0.0589 52 SER L C 391 O O . SER A 52 ? 0.3552 0.3853 0.4481 0.0164 0.0393 0.0622 52 SER L O 392 C CB . SER A 52 ? 0.2849 0.3107 0.4135 0.0143 0.0412 0.0618 52 SER L CB 393 O OG . SER A 52 ? 0.4886 0.5151 0.6302 0.0145 0.0455 0.0676 52 SER L OG 394 N N . THR A 53 ? 0.2365 0.2595 0.3360 0.0126 0.0358 0.0580 53 THR L N 395 C CA . THR A 53 ? 0.2348 0.2633 0.3246 0.0142 0.0371 0.0618 53 THR L CA 396 C C . THR A 53 ? 0.2443 0.2707 0.3175 0.0119 0.0324 0.0553 53 THR L C 397 O O . THR A 53 ? 0.3146 0.3349 0.3862 0.0091 0.0288 0.0496 53 THR L O 398 C CB . THR A 53 ? 0.2660 0.2952 0.3652 0.0148 0.0396 0.0661 53 THR L CB 399 O OG1 . THR A 53 ? 0.3038 0.3344 0.4188 0.0169 0.0450 0.0730 53 THR L OG1 400 C CG2 . THR A 53 ? 0.2672 0.3036 0.3565 0.0169 0.0406 0.0699 53 THR L CG2 401 N N . LEU A 54 ? 0.2724 0.3041 0.3336 0.0132 0.0328 0.0561 54 LEU L N 402 C CA . LEU A 54 ? 0.2879 0.3180 0.3345 0.0107 0.0290 0.0501 54 LEU L CA 403 C C . LEU A 54 ? 0.2573 0.2902 0.3015 0.0095 0.0282 0.0503 54 LEU L C 404 O O . LEU A 54 ? 0.3090 0.3495 0.3572 0.0122 0.0309 0.0562 54 LEU L O 405 C CB . LEU A 54 ? 0.3450 0.3803 0.3805 0.0124 0.0297 0.0501 54 LEU L CB 406 C CG . LEU A 54 ? 0.3529 0.3834 0.3840 0.0125 0.0289 0.0464 54 LEU L CG 407 C CD1 . LEU A 54 ? 0.2864 0.3180 0.3293 0.0154 0.0321 0.0509 54 LEU L CD1 408 C CD2 . LEU A 54 ? 0.2593 0.2942 0.2774 0.0135 0.0289 0.0444 54 LEU L CD2 409 N N . GLN A 55 ? 0.2881 0.3155 0.3257 0.0060 0.0247 0.0442 55 GLN L N 410 C CA . GLN A 55 ? 0.2065 0.2376 0.2406 0.0045 0.0238 0.0436 55 GLN L CA 411 C C . GLN A 55 ? 0.3021 0.3419 0.3265 0.0048 0.0238 0.0438 55 GLN L C 412 O O . GLN A 55 ? 0.3116 0.3504 0.3285 0.0045 0.0231 0.0411 55 GLN L O 413 C CB . GLN A 55 ? 0.1946 0.2175 0.2242 0.0007 0.0206 0.0373 55 GLN L CB 414 C CG . GLN A 55 ? 0.2438 0.2707 0.2688 -0.0014 0.0198 0.0360 55 GLN L CG 415 C CD . GLN A 55 ? 0.3622 0.3946 0.3960 0.0009 0.0217 0.0406 55 GLN L CD 416 O OE1 . GLN A 55 ? 0.4436 0.4743 0.4878 0.0034 0.0235 0.0441 55 GLN L OE1 417 N NE2 . GLN A 55 ? 0.2573 0.2965 0.2881 0.0001 0.0214 0.0407 55 GLN L NE2 418 N N . SER A 56 ? 0.3793 0.4281 0.4040 0.0059 0.0244 0.0467 56 SER L N 419 C CA . SER A 56 ? 0.3919 0.4510 0.4079 0.0064 0.0238 0.0463 56 SER L CA 420 C C . SER A 56 ? 0.2688 0.3237 0.2746 0.0015 0.0207 0.0382 56 SER L C 421 O O . SER A 56 ? 0.2900 0.3375 0.2950 -0.0024 0.0191 0.0342 56 SER L O 422 C CB . SER A 56 ? 0.4618 0.5318 0.4805 0.0083 0.0243 0.0502 56 SER L CB 423 O OG . SER A 56 ? 0.6045 0.6702 0.6257 0.0052 0.0230 0.0475 56 SER L OG 424 N N . GLY A 57 ? 0.2927 0.3519 0.2906 0.0019 0.0202 0.0359 57 GLY L N 425 C CA . GLY A 57 ? 0.2811 0.3355 0.2700 -0.0028 0.0178 0.0281 57 GLY L CA 426 C C . GLY A 57 ? 0.3086 0.3506 0.2943 -0.0035 0.0179 0.0251 57 GLY L C 427 O O . GLY A 57 ? 0.3862 0.4240 0.3640 -0.0061 0.0167 0.0193 57 GLY L O 428 N N . VAL A 58 ? 0.3051 0.3413 0.2977 -0.0012 0.0192 0.0286 58 VAL L N 429 C CA . VAL A 58 ? 0.3139 0.3397 0.3046 -0.0010 0.0191 0.0261 58 VAL L CA 430 C C . VAL A 58 ? 0.3307 0.3606 0.3174 0.0023 0.0206 0.0267 58 VAL L C 431 O O . VAL A 58 ? 0.3149 0.3541 0.3055 0.0063 0.0228 0.0321 58 VAL L O 432 C CB . VAL A 58 ? 0.3064 0.3267 0.3070 0.0005 0.0196 0.0291 58 VAL L CB 433 C CG1 . VAL A 58 ? 0.2123 0.2245 0.2118 0.0015 0.0194 0.0270 58 VAL L CG1 434 C CG2 . VAL A 58 ? 0.2224 0.2380 0.2253 -0.0024 0.0180 0.0275 58 VAL L CG2 435 N N . PRO A 59 ? 0.3036 0.3264 0.2823 0.0010 0.0198 0.0213 59 PRO L N 436 C CA . PRO A 59 ? 0.3198 0.3458 0.2933 0.0043 0.0212 0.0205 59 PRO L CA 437 C C . PRO A 59 ? 0.3078 0.3349 0.2883 0.0092 0.0238 0.0259 59 PRO L C 438 O O . PRO A 59 ? 0.3574 0.3784 0.3456 0.0091 0.0238 0.0276 59 PRO L O 439 C CB . PRO A 59 ? 0.2726 0.2871 0.2375 0.0014 0.0198 0.0133 59 PRO L CB 440 C CG . PRO A 59 ? 0.3368 0.3456 0.3010 -0.0038 0.0179 0.0104 59 PRO L CG 441 C CD . PRO A 59 ? 0.3074 0.3187 0.2810 -0.0033 0.0179 0.0156 59 PRO L CD 442 N N . SER A 60 ? 0.3164 0.3518 0.2944 0.0134 0.0261 0.0281 60 SER L N 443 C CA . SER A 60 ? 0.3753 0.4142 0.3609 0.0183 0.0297 0.0343 60 SER L CA 444 C C . SER A 60 ? 0.3252 0.3549 0.3127 0.0191 0.0299 0.0324 60 SER L C 445 O O . SER A 60 ? 0.3039 0.3356 0.3009 0.0222 0.0325 0.0373 60 SER L O 446 C CB . SER A 60 ? 0.3942 0.4448 0.3745 0.0232 0.0324 0.0370 60 SER L CB 447 O OG . SER A 60 ? 0.4762 0.5246 0.4443 0.0230 0.0311 0.0298 60 SER L OG 448 N N . ARG A 61 ? 0.2424 0.2625 0.2218 0.0166 0.0274 0.0254 61 ARG L N 449 C CA . ARG A 61 ? 0.3007 0.3123 0.2812 0.0180 0.0274 0.0236 61 ARG L CA 450 C C . ARG A 61 ? 0.3488 0.3557 0.3401 0.0168 0.0260 0.0256 61 ARG L C 451 O O . ARG A 61 ? 0.3698 0.3729 0.3656 0.0189 0.0261 0.0257 61 ARG L O 452 C CB . ARG A 61 ? 0.3077 0.3090 0.2765 0.0160 0.0256 0.0162 61 ARG L CB 453 C CG . ARG A 61 ? 0.2353 0.2285 0.2008 0.0106 0.0226 0.0125 61 ARG L CG 454 C CD . ARG A 61 ? 0.2772 0.2605 0.2315 0.0087 0.0220 0.0057 61 ARG L CD 455 N NE . ARG A 61 ? 0.2524 0.2278 0.2036 0.0035 0.0201 0.0027 61 ARG L NE 456 C CZ . ARG A 61 ? 0.2853 0.2644 0.2337 -0.0008 0.0193 0.0004 61 ARG L CZ 457 N NH1 . ARG A 61 ? 0.3344 0.3252 0.2820 -0.0002 0.0197 0.0006 61 ARG L NH1 458 N NH2 . ARG A 61 ? 0.2986 0.2704 0.2451 -0.0054 0.0182 -0.0018 61 ARG L NH2 459 N N . PHE A 62 ? 0.3250 0.3329 0.3203 0.0137 0.0247 0.0269 62 PHE L N 460 C CA . PHE A 62 ? 0.3279 0.3331 0.3342 0.0128 0.0234 0.0285 62 PHE L CA 461 C C . PHE A 62 ? 0.3505 0.3639 0.3703 0.0152 0.0264 0.0351 62 PHE L C 462 O O . PHE A 62 ? 0.3779 0.3995 0.3985 0.0165 0.0290 0.0394 62 PHE L O 463 C CB . PHE A 62 ? 0.3009 0.3032 0.3056 0.0088 0.0210 0.0267 62 PHE L CB 464 C CG . PHE A 62 ? 0.2809 0.2735 0.2753 0.0061 0.0184 0.0210 62 PHE L CG 465 C CD1 . PHE A 62 ? 0.3027 0.2942 0.2861 0.0041 0.0184 0.0177 62 PHE L CD1 466 C CD2 . PHE A 62 ? 0.2788 0.2636 0.2748 0.0056 0.0160 0.0189 62 PHE L CD2 467 C CE1 . PHE A 62 ? 0.2978 0.2795 0.2729 0.0013 0.0169 0.0130 62 PHE L CE1 468 C CE2 . PHE A 62 ? 0.2821 0.2577 0.2683 0.0037 0.0144 0.0148 62 PHE L CE2 469 C CZ . PHE A 62 ? 0.3025 0.2759 0.2787 0.0013 0.0152 0.0122 62 PHE L CZ 470 N N . SER A 63 ? 0.2422 0.2538 0.2732 0.0160 0.0262 0.0359 63 SER L N 471 C CA . SER A 63 ? 0.3308 0.3485 0.3772 0.0173 0.0291 0.0417 63 SER L CA 472 C C . SER A 63 ? 0.3124 0.3258 0.3703 0.0158 0.0266 0.0394 63 SER L C 473 O O . SER A 63 ? 0.3085 0.3156 0.3619 0.0153 0.0229 0.0341 63 SER L O 474 C CB . SER A 63 ? 0.4022 0.4268 0.4524 0.0213 0.0337 0.0465 63 SER L CB 475 O OG . SER A 63 ? 0.4707 0.4923 0.5220 0.0229 0.0328 0.0436 63 SER L OG 476 N N . GLY A 64 ? 0.3059 0.3226 0.3787 0.0154 0.0285 0.0432 64 GLY L N 477 C CA . GLY A 64 ? 0.2882 0.3021 0.3739 0.0139 0.0260 0.0402 64 GLY L CA 478 C C . GLY A 64 ? 0.3448 0.3642 0.4495 0.0147 0.0302 0.0455 64 GLY L C 479 O O . GLY A 64 ? 0.4100 0.4345 0.5178 0.0161 0.0353 0.0524 64 GLY L O 480 N N . SER A 65 ? 0.3405 0.3593 0.4582 0.0139 0.0283 0.0424 65 SER L N 481 C CA . SER A 65 ? 0.4189 0.4422 0.5576 0.0135 0.0323 0.0467 65 SER L CA 482 C C . SER A 65 ? 0.3193 0.3405 0.4719 0.0110 0.0280 0.0403 65 SER L C 483 O O . SER A 65 ? 0.2659 0.2831 0.4107 0.0105 0.0219 0.0331 65 SER L O 484 C CB . SER A 65 ? 0.4770 0.5069 0.6207 0.0165 0.0373 0.0521 65 SER L CB 485 O OG . SER A 65 ? 0.4617 0.4915 0.6022 0.0177 0.0339 0.0472 65 SER L OG 486 N N . GLY A 66 ? 0.3326 0.3568 0.5061 0.0096 0.0314 0.0431 66 GLY L N 487 C CA . GLY A 66 ? 0.2685 0.2919 0.4578 0.0069 0.0274 0.0364 66 GLY L CA 488 C C . GLY A 66 ? 0.3652 0.3853 0.5672 0.0041 0.0290 0.0367 66 GLY L C 489 O O . GLY A 66 ? 0.4270 0.4445 0.6217 0.0045 0.0316 0.0409 66 GLY L O 490 N N . SER A 67 ? 0.3507 0.3716 0.5726 0.0014 0.0274 0.0320 67 SER L N 491 C CA . SER A 67 ? 0.4104 0.4271 0.6458 -0.0015 0.0281 0.0302 67 SER L CA 492 C C . SER A 67 ? 0.4451 0.4630 0.6978 -0.0044 0.0231 0.0206 67 SER L C 493 O O . SER A 67 ? 0.5064 0.5303 0.7681 -0.0045 0.0221 0.0190 67 SER L O 494 C CB . SER A 67 ? 0.4156 0.4332 0.6649 -0.0016 0.0374 0.0406 67 SER L CB 495 O OG . SER A 67 ? 0.5312 0.5550 0.7965 -0.0017 0.0418 0.0448 67 SER L OG 496 N N . GLY A 68 ? 0.3912 0.4041 0.6483 -0.0066 0.0196 0.0137 68 GLY L N 497 C CA . GLY A 68 ? 0.3250 0.3394 0.5975 -0.0093 0.0139 0.0030 68 GLY L CA 498 C C . GLY A 68 ? 0.3238 0.3389 0.5799 -0.0074 0.0047 -0.0064 68 GLY L C 499 O O . GLY A 68 ? 0.3408 0.3508 0.5856 -0.0071 0.0007 -0.0116 68 GLY L O 500 N N . THR A 69 ? 0.2315 0.2529 0.4859 -0.0058 0.0016 -0.0081 69 THR L N 501 C CA . THR A 69 ? 0.3181 0.3408 0.5590 -0.0034 -0.0071 -0.0168 69 THR L CA 502 C C . THR A 69 ? 0.3589 0.3824 0.5791 0.0008 -0.0076 -0.0127 69 THR L C 503 O O . THR A 69 ? 0.4006 0.4227 0.6044 0.0035 -0.0134 -0.0176 69 THR L O 504 C CB . THR A 69 ? 0.2873 0.3176 0.5468 -0.0046 -0.0127 -0.0259 69 THR L CB 505 O OG1 . THR A 69 ? 0.2973 0.3349 0.5699 -0.0047 -0.0090 -0.0210 69 THR L OG1 506 C CG2 . THR A 69 ? 0.2763 0.3049 0.5566 -0.0091 -0.0129 -0.0321 69 THR L CG2 507 N N . GLU A 70 ? 0.3084 0.3340 0.5294 0.0016 -0.0011 -0.0036 70 GLU L N 508 C CA . GLU A 70 ? 0.3221 0.3483 0.5251 0.0055 -0.0011 -0.0002 70 GLU L CA 509 C C . GLU A 70 ? 0.3125 0.3341 0.5005 0.0063 0.0046 0.0081 70 GLU L C 510 O O . GLU A 70 ? 0.3014 0.3244 0.4980 0.0053 0.0113 0.0154 70 GLU L O 511 C CB . GLU A 70 ? 0.3380 0.3726 0.5535 0.0068 0.0006 0.0019 70 GLU L CB 512 C CG . GLU A 70 ? 0.5788 0.6202 0.8092 0.0065 -0.0057 -0.0068 70 GLU L CG 513 C CD . GLU A 70 ? 0.7927 0.8334 1.0059 0.0104 -0.0136 -0.0133 70 GLU L CD 514 O OE1 . GLU A 70 ? 0.8858 0.9205 1.0765 0.0134 -0.0132 -0.0103 70 GLU L OE1 515 O OE2 . GLU A 70 ? 0.7770 0.8235 0.9995 0.0107 -0.0201 -0.0216 70 GLU L OE2 516 N N . PHE A 71 ? 0.2503 0.2666 0.4159 0.0083 0.0020 0.0070 71 PHE L N 517 C CA . PHE A 71 ? 0.2649 0.2773 0.4156 0.0087 0.0063 0.0133 71 PHE L CA 518 C C . PHE A 71 ? 0.2618 0.2724 0.3938 0.0118 0.0055 0.0141 71 PHE L C 519 O O . PHE A 71 ? 0.2655 0.2751 0.3913 0.0138 0.0007 0.0092 71 PHE L O 520 C CB . PHE A 71 ? 0.2349 0.2415 0.3776 0.0070 0.0048 0.0113 71 PHE L CB 521 C CG . PHE A 71 ? 0.2324 0.2393 0.3925 0.0042 0.0060 0.0105 71 PHE L CG 522 C CD1 . PHE A 71 ? 0.1983 0.2057 0.3698 0.0030 0.0011 0.0025 71 PHE L CD1 523 C CD2 . PHE A 71 ? 0.2261 0.2329 0.3914 0.0032 0.0121 0.0175 71 PHE L CD2 524 C CE1 . PHE A 71 ? 0.1858 0.1925 0.3742 0.0002 0.0025 0.0010 71 PHE L CE1 525 C CE2 . PHE A 71 ? 0.2581 0.2639 0.4400 0.0009 0.0139 0.0170 71 PHE L CE2 526 C CZ . PHE A 71 ? 0.2240 0.2292 0.4178 -0.0008 0.0092 0.0085 71 PHE L CZ 527 N N . THR A 72 ? 0.2854 0.2957 0.4084 0.0125 0.0104 0.0202 72 THR L N 528 C CA . THR A 72 ? 0.2676 0.2761 0.3748 0.0153 0.0107 0.0211 72 THR L CA 529 C C . THR A 72 ? 0.3119 0.3159 0.4025 0.0145 0.0124 0.0232 72 THR L C 530 O O . THR A 72 ? 0.2395 0.2457 0.3332 0.0131 0.0159 0.0275 72 THR L O 531 C CB . THR A 72 ? 0.3198 0.3347 0.4344 0.0176 0.0154 0.0259 72 THR L CB 532 O OG1 . THR A 72 ? 0.4748 0.4924 0.5954 0.0198 0.0124 0.0224 72 THR L OG1 533 C CG2 . THR A 72 ? 0.5438 0.5575 0.6426 0.0197 0.0187 0.0293 72 THR L CG2 534 N N . LEU A 73 ? 0.2248 0.2230 0.2988 0.0154 0.0098 0.0201 73 LEU L N 535 C CA . LEU A 73 ? 0.2312 0.2259 0.2899 0.0146 0.0117 0.0216 73 LEU L CA 536 C C . LEU A 73 ? 0.2574 0.2509 0.3066 0.0175 0.0130 0.0218 73 LEU L C 537 O O . LEU A 73 ? 0.2568 0.2469 0.3030 0.0197 0.0105 0.0188 73 LEU L O 538 C CB . LEU A 73 ? 0.2718 0.2596 0.3195 0.0127 0.0083 0.0178 73 LEU L CB 539 C CG . LEU A 73 ? 0.3805 0.3650 0.4133 0.0112 0.0100 0.0185 73 LEU L CG 540 C CD1 . LEU A 73 ? 0.4204 0.4107 0.4572 0.0095 0.0132 0.0226 73 LEU L CD1 541 C CD2 . LEU A 73 ? 0.4864 0.4633 0.5081 0.0097 0.0071 0.0147 73 LEU L CD2 542 N N . THR A 74 ? 0.2705 0.2670 0.3150 0.0179 0.0170 0.0253 74 THR L N 543 C CA . THR A 74 ? 0.2588 0.2544 0.2946 0.0208 0.0188 0.0251 74 THR L CA 544 C C . THR A 74 ? 0.2561 0.2485 0.2769 0.0195 0.0198 0.0241 74 THR L C 545 O O . THR A 74 ? 0.3265 0.3228 0.3467 0.0175 0.0212 0.0263 74 THR L O 546 C CB . THR A 74 ? 0.2974 0.3017 0.3431 0.0237 0.0232 0.0299 74 THR L CB 547 O OG1 . THR A 74 ? 0.3344 0.3421 0.3955 0.0247 0.0223 0.0302 74 THR L OG1 548 C CG2 . THR A 74 ? 0.2435 0.2472 0.2791 0.0272 0.0254 0.0293 74 THR L CG2 549 N N . ILE A 75 ? 0.2350 0.2203 0.2440 0.0206 0.0190 0.0206 75 ILE L N 550 C CA . ILE A 75 ? 0.2200 0.2027 0.2159 0.0195 0.0204 0.0187 75 ILE L CA 551 C C . ILE A 75 ? 0.3119 0.2957 0.3040 0.0237 0.0230 0.0185 75 ILE L C 552 O O . ILE A 75 ? 0.2934 0.2716 0.2834 0.0264 0.0224 0.0165 75 ILE L O 553 C CB . ILE A 75 ? 0.2505 0.2223 0.2354 0.0168 0.0179 0.0142 75 ILE L CB 554 C CG1 . ILE A 75 ? 0.2183 0.1896 0.2069 0.0133 0.0155 0.0145 75 ILE L CG1 555 C CG2 . ILE A 75 ? 0.2576 0.2272 0.2310 0.0148 0.0193 0.0115 75 ILE L CG2 556 C CD1 . ILE A 75 ? 0.2408 0.2017 0.2199 0.0112 0.0135 0.0110 75 ILE L CD1 557 N N . SER A 76 ? 0.2885 0.2801 0.2792 0.0247 0.0261 0.0207 76 SER L N 558 C CA . SER A 76 ? 0.2738 0.2689 0.2626 0.0295 0.0293 0.0212 76 SER L CA 559 C C . SER A 76 ? 0.3434 0.3293 0.3186 0.0304 0.0291 0.0154 76 SER L C 560 O O . SER A 76 ? 0.2970 0.2823 0.2709 0.0349 0.0310 0.0148 76 SER L O 561 C CB . SER A 76 ? 0.2591 0.2655 0.2486 0.0310 0.0328 0.0252 76 SER L CB 562 O OG . SER A 76 ? 0.3098 0.3162 0.2888 0.0281 0.0319 0.0222 76 SER L OG 563 N N . SER A 77 ? 0.3632 0.3419 0.3291 0.0262 0.0271 0.0111 77 SER L N 564 C CA . SER A 77 ? 0.3164 0.2847 0.2703 0.0261 0.0271 0.0052 77 SER L CA 565 C C . SER A 77 ? 0.3609 0.3204 0.3094 0.0204 0.0246 0.0019 77 SER L C 566 O O . SER A 77 ? 0.3977 0.3610 0.3437 0.0163 0.0241 0.0007 77 SER L O 567 C CB . SER A 77 ? 0.2809 0.2543 0.2274 0.0277 0.0295 0.0026 77 SER L CB 568 O OG . SER A 77 ? 0.3295 0.2919 0.2656 0.0278 0.0298 -0.0038 77 SER L OG 569 N N . LEU A 78 ? 0.2798 0.2282 0.2266 0.0205 0.0233 0.0008 78 LEU L N 570 C CA . LEU A 78 ? 0.3666 0.3067 0.3094 0.0156 0.0215 -0.0010 78 LEU L CA 571 C C . LEU A 78 ? 0.3709 0.3042 0.3041 0.0115 0.0225 -0.0063 78 LEU L C 572 O O . LEU A 78 ? 0.3838 0.3110 0.3107 0.0134 0.0243 -0.0099 78 LEU L O 573 C CB . LEU A 78 ? 0.3188 0.2488 0.2610 0.0179 0.0203 -0.0004 78 LEU L CB 574 C CG . LEU A 78 ? 0.3835 0.3193 0.3358 0.0208 0.0182 0.0035 78 LEU L CG 575 C CD1 . LEU A 78 ? 0.3855 0.3122 0.3351 0.0249 0.0171 0.0033 78 LEU L CD1 576 C CD2 . LEU A 78 ? 0.2899 0.2297 0.2468 0.0167 0.0162 0.0050 78 LEU L CD2 577 N N . GLN A 79 ? 0.3078 0.2423 0.2405 0.0059 0.0215 -0.0071 79 GLN L N 578 C CA . GLN A 79 ? 0.3053 0.2323 0.2307 0.0009 0.0222 -0.0123 79 GLN L CA 579 C C . GLN A 79 ? 0.3390 0.2553 0.2630 -0.0019 0.0218 -0.0115 79 GLN L C 580 O O . GLN A 79 ? 0.3674 0.2859 0.2962 -0.0007 0.0203 -0.0073 79 GLN L O 581 C CB . GLN A 79 ? 0.2383 0.1768 0.1646 -0.0032 0.0215 -0.0141 79 GLN L CB 582 C CG . GLN A 79 ? 0.2771 0.2267 0.2032 0.0005 0.0222 -0.0146 79 GLN L CG 583 C CD . GLN A 79 ? 0.3714 0.3342 0.2980 -0.0024 0.0212 -0.0157 79 GLN L CD 584 O OE1 . GLN A 79 ? 0.4267 0.3888 0.3523 -0.0081 0.0201 -0.0187 79 GLN L OE1 585 N NE2 . GLN A 79 ? 0.3076 0.2831 0.2361 0.0018 0.0217 -0.0130 79 GLN L NE2 586 N N . PRO A 80 ? 0.3645 0.2689 0.2821 -0.0054 0.0235 -0.0155 80 PRO L N 587 C CA . PRO A 80 ? 0.3360 0.2290 0.2513 -0.0072 0.0242 -0.0139 80 PRO L CA 588 C C . PRO A 80 ? 0.3543 0.2540 0.2742 -0.0101 0.0226 -0.0106 80 PRO L C 589 O O . PRO A 80 ? 0.4258 0.3201 0.3451 -0.0085 0.0223 -0.0074 80 PRO L O 590 C CB . PRO A 80 ? 0.3861 0.2691 0.2962 -0.0125 0.0268 -0.0192 80 PRO L CB 591 C CG . PRO A 80 ? 0.3674 0.2510 0.2749 -0.0104 0.0275 -0.0238 80 PRO L CG 592 C CD . PRO A 80 ? 0.3379 0.2383 0.2502 -0.0075 0.0252 -0.0218 80 PRO L CD 593 N N . GLU A 81 ? 0.3327 0.2447 0.2568 -0.0137 0.0215 -0.0114 81 GLU L N 594 C CA . GLU A 81 ? 0.3604 0.2790 0.2890 -0.0163 0.0202 -0.0086 81 GLU L CA 595 C C . GLU A 81 ? 0.3550 0.2793 0.2893 -0.0116 0.0182 -0.0040 81 GLU L C 596 O O . GLU A 81 ? 0.3473 0.2742 0.2847 -0.0127 0.0172 -0.0017 81 GLU L O 597 C CB . GLU A 81 ? 0.4491 0.3799 0.3808 -0.0206 0.0196 -0.0106 81 GLU L CB 598 C CG . GLU A 81 ? 0.5645 0.5076 0.4995 -0.0173 0.0185 -0.0099 81 GLU L CG 599 C CD . GLU A 81 ? 0.8014 0.7576 0.7387 -0.0207 0.0177 -0.0114 81 GLU L CD 600 O OE1 . GLU A 81 ? 0.9021 0.8570 0.8375 -0.0262 0.0180 -0.0153 81 GLU L OE1 601 O OE2 . GLU A 81 ? 0.8634 0.8317 0.8049 -0.0176 0.0169 -0.0086 81 GLU L OE2 602 N N . ASP A 82 ? 0.3345 0.2610 0.2709 -0.0066 0.0177 -0.0029 82 ASP L N 603 C CA . ASP A 82 ? 0.2728 0.2056 0.2167 -0.0026 0.0158 0.0008 82 ASP L CA 604 C C . ASP A 82 ? 0.3162 0.2411 0.2589 0.0005 0.0146 0.0021 82 ASP L C 605 O O . ASP A 82 ? 0.3178 0.2475 0.2670 0.0028 0.0125 0.0042 82 ASP L O 606 C CB . ASP A 82 ? 0.2595 0.1989 0.2075 0.0015 0.0162 0.0018 82 ASP L CB 607 C CG . ASP A 82 ? 0.3938 0.3434 0.3431 -0.0002 0.0171 0.0014 82 ASP L CG 608 O OD1 . ASP A 82 ? 0.3582 0.3135 0.3091 -0.0039 0.0167 0.0017 82 ASP L OD1 609 O OD2 . ASP A 82 ? 0.3769 0.3296 0.3253 0.0027 0.0184 0.0009 82 ASP L OD2 610 N N . PHE A 83 ? 0.2495 0.1623 0.1840 0.0008 0.0160 0.0008 83 PHE L N 611 C CA . PHE A 83 ? 0.3001 0.2058 0.2319 0.0048 0.0149 0.0024 83 PHE L CA 612 C C . PHE A 83 ? 0.3202 0.2261 0.2518 0.0027 0.0139 0.0036 83 PHE L C 613 O O . PHE A 83 ? 0.3745 0.2774 0.3025 -0.0021 0.0159 0.0030 83 PHE L O 614 C CB . PHE A 83 ? 0.3746 0.2667 0.2974 0.0067 0.0173 0.0015 83 PHE L CB 615 C CG . PHE A 83 ? 0.4073 0.2993 0.3306 0.0106 0.0179 0.0004 83 PHE L CG 616 C CD1 . PHE A 83 ? 0.3169 0.2099 0.2427 0.0171 0.0162 0.0021 83 PHE L CD1 617 C CD2 . PHE A 83 ? 0.4560 0.3485 0.3779 0.0079 0.0199 -0.0026 83 PHE L CD2 618 C CE1 . PHE A 83 ? 0.4278 0.3217 0.3547 0.0210 0.0171 0.0013 83 PHE L CE1 619 C CE2 . PHE A 83 ? 0.4486 0.3415 0.3705 0.0121 0.0208 -0.0038 83 PHE L CE2 620 C CZ . PHE A 83 ? 0.3658 0.2594 0.2904 0.0186 0.0196 -0.0015 83 PHE L CZ 621 N N . ALA A 84 ? 0.2942 0.2046 0.2303 0.0062 0.0110 0.0049 84 ALA L N 622 C CA . ALA A 84 ? 0.3214 0.2349 0.2590 0.0048 0.0097 0.0055 84 ALA L CA 623 C C . ALA A 84 ? 0.2938 0.2121 0.2369 0.0096 0.0059 0.0056 84 ALA L C 624 O O . ALA A 84 ? 0.3408 0.2606 0.2873 0.0136 0.0044 0.0055 84 ALA L O 625 C CB . ALA A 84 ? 0.2866 0.2089 0.2303 -0.0002 0.0102 0.0053 84 ALA L CB 626 N N . THR A 85 ? 0.2944 0.2157 0.2390 0.0091 0.0042 0.0054 85 THR L N 627 C CA . THR A 85 ? 0.3347 0.2622 0.2866 0.0128 0.0002 0.0041 85 THR L CA 628 C C . THR A 85 ? 0.2809 0.2182 0.2452 0.0100 -0.0004 0.0038 85 THR L C 629 O O . THR A 85 ? 0.3090 0.2484 0.2739 0.0061 0.0013 0.0043 85 THR L O 630 C CB . THR A 85 ? 0.3228 0.2479 0.2687 0.0151 -0.0015 0.0034 85 THR L CB 631 O OG1 . THR A 85 ? 0.3220 0.2379 0.2563 0.0187 -0.0006 0.0048 85 THR L OG1 632 C CG2 . THR A 85 ? 0.2400 0.1724 0.1943 0.0186 -0.0063 0.0007 85 THR L CG2 633 N N . TYR A 86 ? 0.3441 0.2874 0.3188 0.0122 -0.0024 0.0032 86 TYR L N 634 C CA . TYR A 86 ? 0.2528 0.2046 0.2404 0.0101 -0.0023 0.0036 86 TYR L CA 635 C C . TYR A 86 ? 0.2618 0.2178 0.2582 0.0117 -0.0059 0.0009 86 TYR L C 636 O O . TYR A 86 ? 0.3307 0.2871 0.3287 0.0154 -0.0092 -0.0014 86 TYR L O 637 C CB . TYR A 86 ? 0.1804 0.1366 0.1752 0.0107 -0.0008 0.0055 86 TYR L CB 638 C CG . TYR A 86 ? 0.2888 0.2426 0.2762 0.0086 0.0027 0.0073 86 TYR L CG 639 C CD1 . TYR A 86 ? 0.2601 0.2064 0.2370 0.0099 0.0036 0.0068 86 TYR L CD1 640 C CD2 . TYR A 86 ? 0.2446 0.2038 0.2354 0.0054 0.0051 0.0093 86 TYR L CD2 641 C CE1 . TYR A 86 ? 0.3227 0.2666 0.2932 0.0077 0.0066 0.0072 86 TYR L CE1 642 C CE2 . TYR A 86 ? 0.2540 0.2124 0.2380 0.0036 0.0077 0.0100 86 TYR L CE2 643 C CZ . TYR A 86 ? 0.3930 0.3435 0.3670 0.0044 0.0084 0.0084 86 TYR L CZ 644 O OH . TYR A 86 ? 0.3329 0.2824 0.3006 0.0023 0.0107 0.0078 86 TYR L OH 645 N N . TYR A 87 ? 0.2698 0.2291 0.2718 0.0092 -0.0055 0.0006 87 TYR L N 646 C CA . TYR A 87 ? 0.2648 0.2279 0.2765 0.0102 -0.0086 -0.0028 87 TYR L CA 647 C C . TYR A 87 ? 0.2620 0.2313 0.2896 0.0084 -0.0071 -0.0014 87 TYR L C 648 O O . TYR A 87 ? 0.2764 0.2474 0.3054 0.0059 -0.0036 0.0023 87 TYR L O 649 C CB . TYR A 87 ? 0.2366 0.1975 0.2421 0.0096 -0.0090 -0.0046 87 TYR L CB 650 C CG . TYR A 87 ? 0.2866 0.2417 0.2774 0.0121 -0.0103 -0.0059 87 TYR L CG 651 C CD1 . TYR A 87 ? 0.2915 0.2470 0.2810 0.0163 -0.0146 -0.0100 87 TYR L CD1 652 C CD2 . TYR A 87 ? 0.2526 0.2022 0.2312 0.0104 -0.0070 -0.0030 87 TYR L CD2 653 C CE1 . TYR A 87 ? 0.3454 0.2958 0.3206 0.0195 -0.0154 -0.0102 87 TYR L CE1 654 C CE2 . TYR A 87 ? 0.2512 0.1947 0.2167 0.0129 -0.0072 -0.0032 87 TYR L CE2 655 C CZ . TYR A 87 ? 0.3584 0.3023 0.3217 0.0179 -0.0113 -0.0063 87 TYR L CZ 656 O OH . TYR A 87 ? 0.4408 0.3788 0.3902 0.0212 -0.0111 -0.0056 87 TYR L OH 657 N N . CYS A 88 ? 0.2667 0.2397 0.3068 0.0097 -0.0098 -0.0044 88 CYS L N 658 C CA . CYS A 88 ? 0.2328 0.2106 0.2894 0.0078 -0.0081 -0.0034 88 CYS L CA 659 C C . CYS A 88 ? 0.2336 0.2108 0.2937 0.0072 -0.0100 -0.0076 88 CYS L C 660 O O . CYS A 88 ? 0.2316 0.2064 0.2835 0.0091 -0.0136 -0.0122 88 CYS L O 661 C CB . CYS A 88 ? 0.2425 0.2250 0.3136 0.0087 -0.0092 -0.0041 88 CYS L CB 662 S SG . CYS A 88 ? 0.3633 0.3474 0.4379 0.0116 -0.0159 -0.0120 88 CYS L SG 663 N N . GLN A 89 ? 0.2101 0.1894 0.2818 0.0053 -0.0072 -0.0057 89 GLN L N 664 C CA . GLN A 89 ? 0.2240 0.2023 0.2998 0.0049 -0.0083 -0.0096 89 GLN L CA 665 C C . GLN A 89 ? 0.2687 0.2494 0.3643 0.0035 -0.0064 -0.0093 89 GLN L C 666 O O . GLN A 89 ? 0.2915 0.2742 0.3939 0.0024 -0.0018 -0.0028 89 GLN L O 667 C CB . GLN A 89 ? 0.1708 0.1471 0.2356 0.0041 -0.0056 -0.0068 89 GLN L CB 668 C CG . GLN A 89 ? 0.2406 0.2156 0.3079 0.0044 -0.0065 -0.0112 89 GLN L CG 669 C CD . GLN A 89 ? 0.3427 0.3187 0.4117 0.0032 -0.0021 -0.0066 89 GLN L CD 670 O OE1 . GLN A 89 ? 0.3535 0.3306 0.4143 0.0022 0.0006 -0.0014 89 GLN L OE1 671 N NE2 . GLN A 89 ? 0.2730 0.2487 0.3530 0.0034 -0.0016 -0.0090 89 GLN L NE2 672 N N . HIS A 90 ? 0.2394 0.2197 0.3440 0.0038 -0.0098 -0.0163 90 HIS L N 673 C CA . HIS A 90 ? 0.1811 0.1619 0.3050 0.0022 -0.0078 -0.0172 90 HIS L CA 674 C C . HIS A 90 ? 0.2703 0.2485 0.3919 0.0019 -0.0042 -0.0144 90 HIS L C 675 O O . HIS A 90 ? 0.2391 0.2153 0.3496 0.0031 -0.0061 -0.0180 90 HIS L O 676 C CB . HIS A 90 ? 0.1920 0.1733 0.3254 0.0025 -0.0132 -0.0272 90 HIS L CB 677 C CG . HIS A 90 ? 0.2036 0.1845 0.3590 0.0003 -0.0113 -0.0292 90 HIS L CG 678 N ND1 . HIS A 90 ? 0.2590 0.2391 0.4234 0.0001 -0.0154 -0.0392 90 HIS L ND1 679 C CD2 . HIS A 90 ? 0.2224 0.2033 0.3929 -0.0017 -0.0054 -0.0225 90 HIS L CD2 680 C CE1 . HIS A 90 ? 0.2415 0.2203 0.4267 -0.0024 -0.0120 -0.0388 90 HIS L CE1 681 N NE2 . HIS A 90 ? 0.2483 0.2275 0.4374 -0.0033 -0.0057 -0.0282 90 HIS L NE2 682 N N . LEU A 91 ? 0.2611 0.2402 0.3933 0.0009 0.0013 -0.0075 91 LEU L N 683 C CA . LEU A 91 ? 0.2537 0.2318 0.3822 0.0013 0.0052 -0.0030 91 LEU L CA 684 C C . LEU A 91 ? 0.3448 0.3195 0.4832 0.0016 0.0055 -0.0075 91 LEU L C 685 O O . LEU A 91 ? 0.2978 0.2717 0.4317 0.0026 0.0079 -0.0052 91 LEU L O 686 C CB . LEU A 91 ? 0.2631 0.2444 0.3969 0.0012 0.0110 0.0071 91 LEU L CB 687 C CG . LEU A 91 ? 0.2507 0.2354 0.3712 0.0014 0.0111 0.0114 91 LEU L CG 688 C CD1 . LEU A 91 ? 0.2385 0.2274 0.3629 0.0020 0.0167 0.0210 91 LEU L CD1 689 C CD2 . LEU A 91 ? 0.1420 0.1258 0.2439 0.0016 0.0090 0.0096 91 LEU L CD2 690 N N . ILE A 92 ? 0.2961 0.2691 0.4485 0.0008 0.0030 -0.0144 92 ILE L N 691 C CA . ILE A 92 ? 0.3125 0.2814 0.4744 0.0010 0.0027 -0.0206 92 ILE L CA 692 C C . ILE A 92 ? 0.3555 0.3240 0.5172 0.0012 -0.0042 -0.0327 92 ILE L C 693 O O . ILE A 92 ? 0.3755 0.3468 0.5271 0.0018 -0.0086 -0.0352 92 ILE L O 694 C CB . ILE A 92 ? 0.2985 0.2652 0.4829 -0.0004 0.0077 -0.0172 92 ILE L CB 695 C CG1 . ILE A 92 ? 0.2668 0.2357 0.4655 -0.0028 0.0067 -0.0184 92 ILE L CG1 696 C CG2 . ILE A 92 ? 0.2755 0.2434 0.4590 0.0007 0.0146 -0.0050 92 ILE L CG2 697 C CD1 . ILE A 92 ? 0.3327 0.2988 0.5554 -0.0046 0.0120 -0.0155 92 ILE L CD1 698 N N . GLY A 93 ? 0.3594 0.3244 0.5317 0.0012 -0.0053 -0.0404 93 GLY L N 699 C CA . GLY A 93 ? 0.3160 0.2816 0.4883 0.0019 -0.0123 -0.0529 93 GLY L CA 700 C C . GLY A 93 ? 0.2879 0.2544 0.4373 0.0052 -0.0162 -0.0564 93 GLY L C 701 O O . GLY A 93 ? 0.2932 0.2575 0.4331 0.0069 -0.0136 -0.0543 93 GLY L O 702 N N . LEU A 94 ? 0.3466 0.3168 0.4875 0.0064 -0.0220 -0.0613 94 LEU L N 703 C CA . LEU A 94 ? 0.3800 0.3512 0.4985 0.0100 -0.0251 -0.0635 94 LEU L CA 704 C C . LEU A 94 ? 0.3258 0.2971 0.4286 0.0101 -0.0218 -0.0532 94 LEU L C 705 O O . LEU A 94 ? 0.3572 0.3286 0.4418 0.0127 -0.0233 -0.0533 94 LEU L O 706 C CB . LEU A 94 ? 0.3951 0.3703 0.5100 0.0123 -0.0327 -0.0726 94 LEU L CB 707 C CG . LEU A 94 ? 0.6097 0.5857 0.7344 0.0132 -0.0376 -0.0856 94 LEU L CG 708 C CD1 . LEU A 94 ? 0.6891 0.6708 0.8053 0.0168 -0.0456 -0.0939 94 LEU L CD1 709 C CD2 . LEU A 94 ? 0.6617 0.6337 0.7802 0.0152 -0.0355 -0.0883 94 LEU L CD2 710 N N . ARG A 95 ? 0.3156 0.2871 0.4259 0.0074 -0.0173 -0.0445 96 ARG L N 711 C CA . ARG A 95 ? 0.2798 0.2519 0.3771 0.0071 -0.0142 -0.0355 96 ARG L CA 712 C C . ARG A 95 ? 0.2505 0.2237 0.3332 0.0089 -0.0181 -0.0367 96 ARG L C 713 O O . ARG A 95 ? 0.3046 0.2765 0.3708 0.0098 -0.0169 -0.0331 96 ARG L O 714 C CB . ARG A 95 ? 0.2901 0.2606 0.3769 0.0076 -0.0104 -0.0316 96 ARG L CB 715 C CG . ARG A 95 ? 0.3258 0.2960 0.4241 0.0063 -0.0050 -0.0260 96 ARG L CG 716 C CD . ARG A 95 ? 0.3383 0.3060 0.4498 0.0069 -0.0051 -0.0321 96 ARG L CD 717 N NE . ARG A 95 ? 0.3839 0.3506 0.5004 0.0071 0.0004 -0.0266 96 ARG L NE 718 C CZ . ARG A 95 ? 0.4662 0.4298 0.5961 0.0077 0.0021 -0.0297 96 ARG L CZ 719 N NH1 . ARG A 95 ? 0.4051 0.3661 0.5453 0.0075 -0.0015 -0.0390 96 ARG L NH1 720 N NH2 . ARG A 95 ? 0.4494 0.4126 0.5827 0.0086 0.0073 -0.0237 96 ARG L NH2 721 N N . SER A 96 ? 0.2645 0.2401 0.3535 0.0096 -0.0225 -0.0417 97 SER L N 722 C CA . SER A 96 ? 0.2658 0.2426 0.3411 0.0124 -0.0265 -0.0431 97 SER L CA 723 C C . SER A 96 ? 0.2678 0.2444 0.3380 0.0114 -0.0237 -0.0350 97 SER L C 724 O O . SER A 96 ? 0.2073 0.1851 0.2888 0.0088 -0.0203 -0.0301 97 SER L O 725 C CB . SER A 96 ? 0.3076 0.2885 0.3916 0.0141 -0.0329 -0.0519 97 SER L CB 726 O OG . SER A 96 ? 0.3676 0.3516 0.4686 0.0116 -0.0324 -0.0504 97 SER L OG 727 N N . PHE A 97 ? 0.2296 0.2043 0.2823 0.0138 -0.0246 -0.0334 98 PHE L N 728 C CA . PHE A 97 ? 0.2595 0.2332 0.3060 0.0134 -0.0224 -0.0270 98 PHE L CA 729 C C . PHE A 97 ? 0.3181 0.2942 0.3649 0.0163 -0.0267 -0.0297 98 PHE L C 730 O O . PHE A 97 ? 0.2689 0.2473 0.3151 0.0194 -0.0319 -0.0364 98 PHE L O 731 C CB . PHE A 97 ? 0.2567 0.2257 0.2846 0.0138 -0.0197 -0.0228 98 PHE L CB 732 C CG . PHE A 97 ? 0.3255 0.2933 0.3523 0.0110 -0.0153 -0.0195 98 PHE L CG 733 C CD1 . PHE A 97 ? 0.3182 0.2861 0.3454 0.0116 -0.0158 -0.0232 98 PHE L CD1 734 C CD2 . PHE A 97 ? 0.2829 0.2502 0.3077 0.0082 -0.0109 -0.0130 98 PHE L CD2 735 C CE1 . PHE A 97 ? 0.3255 0.2931 0.3519 0.0095 -0.0117 -0.0199 98 PHE L CE1 736 C CE2 . PHE A 97 ? 0.2725 0.2404 0.2965 0.0060 -0.0073 -0.0101 98 PHE L CE2 737 C CZ . PHE A 97 ? 0.2747 0.2428 0.2998 0.0067 -0.0076 -0.0133 98 PHE L CZ 738 N N . GLY A 98 ? 0.2954 0.2717 0.3425 0.0159 -0.0247 -0.0248 99 GLY L N 739 C CA . GLY A 98 ? 0.2627 0.2407 0.3069 0.0194 -0.0281 -0.0262 99 GLY L CA 740 C C . GLY A 98 ? 0.3504 0.3233 0.3743 0.0230 -0.0290 -0.0255 99 GLY L C 741 O O . GLY A 98 ? 0.3288 0.2971 0.3422 0.0219 -0.0264 -0.0236 99 GLY L O 742 N N . GLN A 99 ? 0.2202 0.1941 0.2389 0.0274 -0.0323 -0.0266 100 GLN L N 743 C CA . GLN A 99 ? 0.3693 0.3379 0.3689 0.0317 -0.0328 -0.0254 100 GLN L CA 744 C C . GLN A 99 ? 0.3472 0.3083 0.3362 0.0305 -0.0275 -0.0185 100 GLN L C 745 O O . GLN A 99 ? 0.3705 0.3254 0.3440 0.0331 -0.0264 -0.0162 100 GLN L O 746 C CB . GLN A 99 ? 0.3038 0.2767 0.3014 0.0380 -0.0386 -0.0292 100 GLN L CB 747 C CG . GLN A 99 ? 0.4163 0.3892 0.4147 0.0401 -0.0381 -0.0258 100 GLN L CG 748 C CD . GLN A 99 ? 0.6333 0.6127 0.6511 0.0368 -0.0378 -0.0263 100 GLN L CD 749 O OE1 . GLN A 99 ? 0.6407 0.6247 0.6727 0.0331 -0.0385 -0.0296 100 GLN L OE1 750 N NE2 . GLN A 99 ? 0.6450 0.6244 0.6637 0.0384 -0.0363 -0.0228 100 GLN L NE2 751 N N . GLY A 100 ? 0.3369 0.2986 0.3343 0.0266 -0.0241 -0.0152 101 GLY L N 752 C CA . GLY A 100 ? 0.2122 0.1674 0.2006 0.0249 -0.0192 -0.0098 101 GLY L CA 753 C C . GLY A 100 ? 0.3499 0.3038 0.3365 0.0281 -0.0192 -0.0080 101 GLY L C 754 O O . GLY A 100 ? 0.3280 0.2838 0.3136 0.0332 -0.0230 -0.0101 101 GLY L O 755 N N . THR A 101 ? 0.3200 0.2715 0.3064 0.0254 -0.0149 -0.0043 102 THR L N 756 C CA . THR A 101 ? 0.3540 0.3027 0.3369 0.0284 -0.0139 -0.0024 102 THR L CA 757 C C . THR A 101 ? 0.3327 0.2717 0.3021 0.0268 -0.0095 0.0006 102 THR L C 758 O O . THR A 101 ? 0.3038 0.2423 0.2738 0.0221 -0.0061 0.0021 102 THR L O 759 C CB . THR A 101 ? 0.3047 0.2602 0.3010 0.0273 -0.0127 -0.0015 102 THR L CB 760 O OG1 . THR A 101 ? 0.3756 0.3400 0.3862 0.0287 -0.0166 -0.0045 102 THR L OG1 761 C CG2 . THR A 101 ? 0.2281 0.1802 0.2195 0.0306 -0.0108 0.0005 102 THR L CG2 762 N N . LYS A 102 ? 0.3023 0.2337 0.2600 0.0310 -0.0095 0.0014 103 LYS L N 763 C CA . LYS A 102 ? 0.3714 0.2923 0.3173 0.0293 -0.0050 0.0039 103 LYS L CA 764 C C . LYS A 102 ? 0.3983 0.3168 0.3448 0.0303 -0.0027 0.0050 103 LYS L C 765 O O . LYS A 102 ? 0.4560 0.3753 0.4037 0.0357 -0.0043 0.0049 103 LYS L O 766 C CB . LYS A 102 ? 0.4656 0.3778 0.3983 0.0334 -0.0050 0.0052 103 LYS L CB 767 C CG . LYS A 102 ? 0.5549 0.4558 0.4767 0.0301 0.0002 0.0076 103 LYS L CG 768 C CD . LYS A 102 ? 0.6720 0.5654 0.5818 0.0340 0.0008 0.0097 103 LYS L CD 769 C CE . LYS A 102 ? 0.7465 0.6292 0.6478 0.0295 0.0065 0.0121 103 LYS L CE 770 N NZ . LYS A 102 ? 0.8363 0.7109 0.7358 0.0279 0.0101 0.0127 103 LYS L NZ 771 N N . LEU A 103 ? 0.3566 0.2732 0.3024 0.0254 0.0010 0.0055 104 LEU L N 772 C CA . LEU A 103 ? 0.3197 0.2343 0.2652 0.0260 0.0036 0.0058 104 LEU L CA 773 C C . LEU A 103 ? 0.4076 0.3090 0.3406 0.0255 0.0072 0.0063 104 LEU L C 774 O O . LEU A 103 ? 0.4625 0.3601 0.3914 0.0202 0.0096 0.0060 104 LEU L O 775 C CB . LEU A 103 ? 0.3317 0.2543 0.2851 0.0214 0.0051 0.0057 104 LEU L CB 776 C CG . LEU A 103 ? 0.4863 0.4085 0.4387 0.0211 0.0082 0.0055 104 LEU L CG 777 C CD1 . LEU A 103 ? 0.5672 0.4900 0.5222 0.0272 0.0077 0.0058 104 LEU L CD1 778 C CD2 . LEU A 103 ? 0.4208 0.3533 0.3814 0.0176 0.0090 0.0062 104 LEU L CD2 779 N N . GLU A 104 ? 0.4173 0.3118 0.3451 0.0311 0.0076 0.0070 105 GLU L N 780 C CA . GLU A 104 ? 0.3634 0.2435 0.2798 0.0313 0.0114 0.0077 105 GLU L CA 781 C C . GLU A 104 ? 0.3981 0.2738 0.3133 0.0323 0.0143 0.0064 105 GLU L C 782 O O . GLU A 104 ? 0.3997 0.2831 0.3217 0.0353 0.0131 0.0059 105 GLU L O 783 C CB . GLU A 104 ? 0.4796 0.3527 0.3886 0.0379 0.0105 0.0101 105 GLU L CB 784 C CG . GLU A 104 ? 0.6860 0.5607 0.5969 0.0458 0.0087 0.0107 105 GLU L CG 785 C CD . GLU A 104 ? 0.7055 0.5657 0.6057 0.0511 0.0120 0.0130 105 GLU L CD 786 O OE1 . GLU A 104 ? 0.6515 0.5028 0.5427 0.0523 0.0134 0.0156 105 GLU L OE1 787 O OE2 . GLU A 104 ? 0.6836 0.5412 0.5844 0.0544 0.0135 0.0125 105 GLU L OE2 788 N N . ILE A 105 ? 0.4254 0.2887 0.3325 0.0298 0.0185 0.0057 106 ILE L N 789 C CA . ILE A 105 ? 0.3614 0.2194 0.2666 0.0303 0.0215 0.0033 106 ILE L CA 790 C C . ILE A 105 ? 0.4137 0.2637 0.3148 0.0384 0.0223 0.0048 106 ILE L C 791 O O . ILE A 105 ? 0.3964 0.2354 0.2903 0.0415 0.0236 0.0073 106 ILE L O 792 C CB . ILE A 105 ? 0.4784 0.3259 0.3776 0.0238 0.0255 0.0008 106 ILE L CB 793 C CG1 . ILE A 105 ? 0.4744 0.3307 0.3777 0.0161 0.0246 -0.0006 106 ILE L CG1 794 C CG2 . ILE A 105 ? 0.3934 0.2360 0.2907 0.0244 0.0283 -0.0029 106 ILE L CG2 795 C CD1 . ILE A 105 ? 0.5786 0.4265 0.4777 0.0092 0.0281 -0.0035 106 ILE L CD1 796 N N . LYS A 106 ? 0.3568 0.2127 0.2624 0.0423 0.0220 0.0036 107 LYS L N 797 C CA . LYS A 106 ? 0.4222 0.2718 0.3249 0.0504 0.0230 0.0048 107 LYS L CA 798 C C . LYS A 106 ? 0.5147 0.3488 0.4092 0.0500 0.0281 0.0025 107 LYS L C 799 O O . LYS A 106 ? 0.5079 0.3413 0.4021 0.0443 0.0302 -0.0015 107 LYS L O 800 C CB . LYS A 106 ? 0.4636 0.3266 0.3755 0.0548 0.0211 0.0045 107 LYS L CB 801 C CG . LYS A 106 ? 0.5759 0.4356 0.4866 0.0642 0.0214 0.0061 107 LYS L CG 802 C CD . LYS A 106 ? 0.7038 0.5766 0.6241 0.0677 0.0207 0.0054 107 LYS L CD 803 C CE . LYS A 106 ? 0.7823 0.6702 0.7138 0.0700 0.0158 0.0074 107 LYS L CE 804 N NZ . LYS A 106 ? 0.8221 0.7075 0.7515 0.0779 0.0134 0.0096 107 LYS L NZ 816 N N . THR A 108 ? 0.4278 0.3126 0.1871 0.0778 0.0146 0.0057 109 THR L N 817 C CA . THR A 108 ? 0.3805 0.2663 0.1374 0.0840 0.0174 0.0040 109 THR L CA 818 C C . THR A 108 ? 0.3448 0.2386 0.1140 0.0802 0.0156 0.0033 109 THR L C 819 O O . THR A 108 ? 0.3294 0.2219 0.1030 0.0735 0.0104 0.0035 109 THR L O 820 C CB . THR A 108 ? 0.5278 0.3951 0.2639 0.0896 0.0141 0.0020 109 THR L CB 821 O OG1 . THR A 108 ? 0.5807 0.4356 0.3100 0.0835 0.0056 0.0014 109 THR L OG1 822 C CG2 . THR A 108 ? 0.5930 0.4554 0.3218 0.0940 0.0171 0.0025 109 THR L CG2 823 N N . VAL A 109 ? 0.3314 0.2341 0.1058 0.0847 0.0200 0.0028 110 VAL L N 824 C CA . VAL A 109 ? 0.3629 0.2729 0.1475 0.0819 0.0184 0.0021 110 VAL L CA 825 C C . VAL A 109 ? 0.5018 0.3960 0.2743 0.0813 0.0112 0.0007 110 VAL L C 826 O O . VAL A 109 ? 0.5324 0.4115 0.2874 0.0870 0.0096 -0.0004 110 VAL L O 827 C CB . VAL A 109 ? 0.4284 0.3509 0.2189 0.0878 0.0242 0.0023 110 VAL L CB 828 C CG1 . VAL A 109 ? 0.3491 0.2754 0.1455 0.0865 0.0215 0.0014 110 VAL L CG1 829 C CG2 . VAL A 109 ? 0.5314 0.4715 0.3365 0.0853 0.0306 0.0040 110 VAL L CG2 830 N N . ALA A 110 ? 0.4933 0.3903 0.2742 0.0742 0.0069 0.0007 111 ALA L N 831 C CA . ALA A 110 ? 0.4510 0.3343 0.2219 0.0719 -0.0002 -0.0002 111 ALA L CA 832 C C . ALA A 110 ? 0.4025 0.2947 0.1846 0.0688 -0.0011 -0.0004 111 ALA L C 833 O O . ALA A 110 ? 0.3647 0.2698 0.1622 0.0629 -0.0003 0.0005 111 ALA L O 834 C CB . ALA A 110 ? 0.3881 0.2638 0.1553 0.0646 -0.0061 0.0006 111 ALA L CB 835 N N . ALA A 111 ? 0.4301 0.3143 0.2034 0.0733 -0.0027 -0.0013 112 ALA L N 836 C CA . ALA A 111 ? 0.4441 0.3358 0.2262 0.0711 -0.0037 -0.0013 112 ALA L CA 837 C C . ALA A 111 ? 0.4377 0.3259 0.2222 0.0617 -0.0101 -0.0008 112 ALA L C 838 O O . ALA A 111 ? 0.4790 0.3532 0.2520 0.0585 -0.0154 -0.0007 112 ALA L O 839 C CB . ALA A 111 ? 0.3857 0.2681 0.1558 0.0793 -0.0038 -0.0021 112 ALA L CB 840 N N . PRO A 112 ? 0.4427 0.3443 0.2419 0.0570 -0.0098 -0.0003 113 PRO L N 841 C CA . PRO A 112 ? 0.3870 0.2870 0.1890 0.0485 -0.0154 0.0005 113 PRO L CA 842 C C . PRO A 112 ? 0.4689 0.3548 0.2583 0.0485 -0.0207 0.0003 113 PRO L C 843 O O . PRO A 112 ? 0.3836 0.2668 0.1682 0.0550 -0.0191 -0.0004 113 PRO L O 844 C CB . PRO A 112 ? 0.3663 0.2848 0.1869 0.0449 -0.0122 0.0008 113 PRO L CB 845 C CG . PRO A 112 ? 0.4218 0.3481 0.2455 0.0518 -0.0069 0.0000 113 PRO L CG 846 C CD . PRO A 112 ? 0.3631 0.2826 0.1770 0.0587 -0.0041 -0.0003 113 PRO L CD 847 N N . SER A 113 ? 0.4526 0.3299 0.2365 0.0413 -0.0270 0.0012 114 SER L N 848 C CA . SER A 113 ? 0.5040 0.3704 0.2792 0.0385 -0.0324 0.0016 114 SER L CA 849 C C . SER A 113 ? 0.4444 0.3263 0.2357 0.0328 -0.0321 0.0027 114 SER L C 850 O O . SER A 113 ? 0.4840 0.3779 0.2876 0.0269 -0.0318 0.0037 114 SER L O 851 C CB . SER A 113 ? 0.5692 0.4195 0.3304 0.0321 -0.0396 0.0024 114 SER L CB 852 O OG . SER A 113 ? 0.7109 0.5481 0.4579 0.0366 -0.0396 0.0013 114 SER L OG 853 N N . VAL A 114 ? 0.4322 0.3139 0.2228 0.0351 -0.0320 0.0025 115 VAL L N 854 C CA . VAL A 114 ? 0.3506 0.2478 0.1562 0.0307 -0.0310 0.0032 115 VAL L CA 855 C C . VAL A 114 ? 0.4494 0.3388 0.2493 0.0243 -0.0370 0.0047 115 VAL L C 856 O O . VAL A 114 ? 0.5024 0.3759 0.2875 0.0268 -0.0402 0.0048 115 VAL L O 857 C CB . VAL A 114 ? 0.3886 0.2961 0.2010 0.0374 -0.0259 0.0023 115 VAL L CB 858 C CG1 . VAL A 114 ? 0.2885 0.2118 0.1158 0.0322 -0.0249 0.0028 115 VAL L CG1 859 C CG2 . VAL A 114 ? 0.3407 0.2561 0.1581 0.0431 -0.0200 0.0012 115 VAL L CG2 860 N N . PHE A 115 ? 0.4560 0.3565 0.2672 0.0162 -0.0383 0.0062 116 PHE L N 861 C CA . PHE A 115 ? 0.4251 0.3212 0.2329 0.0091 -0.0436 0.0082 116 PHE L CA 862 C C . PHE A 115 ? 0.4408 0.3546 0.2643 0.0057 -0.0412 0.0088 116 PHE L C 863 O O . PHE A 115 ? 0.3674 0.2964 0.2049 0.0050 -0.0370 0.0083 116 PHE L O 864 C CB . PHE A 115 ? 0.4086 0.2993 0.2119 0.0011 -0.0490 0.0102 116 PHE L CB 865 C CG . PHE A 115 ? 0.4545 0.3284 0.2423 0.0035 -0.0515 0.0094 116 PHE L CG 866 C CD1 . PHE A 115 ? 0.4382 0.3166 0.2297 0.0068 -0.0483 0.0085 116 PHE L CD1 867 C CD2 . PHE A 115 ? 0.4685 0.3209 0.2368 0.0023 -0.0570 0.0096 116 PHE L CD2 868 C CE1 . PHE A 115 ? 0.4973 0.3601 0.2737 0.0091 -0.0505 0.0077 116 PHE L CE1 869 C CE2 . PHE A 115 ? 0.5064 0.3420 0.2588 0.0045 -0.0593 0.0086 116 PHE L CE2 870 C CZ . PHE A 115 ? 0.4870 0.3284 0.2437 0.0079 -0.0561 0.0076 116 PHE L CZ 871 N N . ILE A 116 ? 0.4322 0.3427 0.2522 0.0036 -0.0438 0.0098 117 ILE L N 872 C CA . ILE A 116 ? 0.3702 0.2963 0.2033 -0.0004 -0.0421 0.0106 117 ILE L CA 873 C C . ILE A 116 ? 0.4194 0.3431 0.2501 -0.0095 -0.0474 0.0135 117 ILE L C 874 O O . ILE A 116 ? 0.4633 0.3708 0.2797 -0.0120 -0.0528 0.0149 117 ILE L O 875 C CB . ILE A 116 ? 0.3697 0.2987 0.2036 0.0051 -0.0397 0.0096 117 ILE L CB 876 C CG1 . ILE A 116 ? 0.3876 0.3347 0.2363 0.0016 -0.0367 0.0096 117 ILE L CG1 877 C CG2 . ILE A 116 ? 0.3454 0.2573 0.1636 0.0062 -0.0444 0.0109 117 ILE L CG2 878 C CD1 . ILE A 116 ? 0.3961 0.3498 0.2477 0.0068 -0.0339 0.0086 117 ILE L CD1 879 N N . PHE A 117 ? 0.3975 0.3371 0.2416 -0.0147 -0.0457 0.0146 118 PHE L N 880 C CA . PHE A 117 ? 0.3381 0.2796 0.1824 -0.0236 -0.0500 0.0179 118 PHE L CA 881 C C . PHE A 117 ? 0.3670 0.3209 0.2204 -0.0258 -0.0478 0.0184 118 PHE L C 882 O O . PHE A 117 ? 0.3379 0.3067 0.2042 -0.0244 -0.0427 0.0171 118 PHE L O 883 C CB . PHE A 117 ? 0.2588 0.2088 0.1102 -0.0284 -0.0504 0.0197 118 PHE L CB 884 C CG . PHE A 117 ? 0.4031 0.3417 0.2453 -0.0276 -0.0533 0.0197 118 PHE L CG 885 C CD1 . PHE A 117 ? 0.3479 0.2725 0.1766 -0.0335 -0.0602 0.0219 118 PHE L CD1 886 C CD2 . PHE A 117 ? 0.3237 0.2649 0.1698 -0.0216 -0.0492 0.0174 118 PHE L CD2 887 C CE1 . PHE A 117 ? 0.4290 0.3425 0.2480 -0.0332 -0.0631 0.0217 118 PHE L CE1 888 C CE2 . PHE A 117 ? 0.4163 0.3471 0.2534 -0.0209 -0.0518 0.0174 118 PHE L CE2 889 C CZ . PHE A 117 ? 0.4236 0.3405 0.2470 -0.0266 -0.0588 0.0194 118 PHE L CZ 890 N N . PRO A 118 ? 0.3763 0.3232 0.2220 -0.0294 -0.0516 0.0204 119 PRO L N 891 C CA . PRO A 118 ? 0.3780 0.3371 0.2318 -0.0322 -0.0499 0.0213 119 PRO L CA 892 C C . PRO A 118 ? 0.3810 0.3540 0.2449 -0.0393 -0.0496 0.0238 119 PRO L C 893 O O . PRO A 118 ? 0.4545 0.4254 0.3165 -0.0435 -0.0526 0.0259 119 PRO L O 894 C CB . PRO A 118 ? 0.3518 0.2971 0.1924 -0.0344 -0.0548 0.0234 119 PRO L CB 895 C CG . PRO A 118 ? 0.3935 0.3188 0.2191 -0.0298 -0.0577 0.0224 119 PRO L CG 896 C CD . PRO A 118 ? 0.3724 0.2988 0.2005 -0.0305 -0.0574 0.0218 119 PRO L CD 897 N N . PRO A 119 ? 0.3112 0.2989 0.1856 -0.0405 -0.0459 0.0237 120 PRO L N 898 C CA . PRO A 119 ? 0.3531 0.3543 0.2364 -0.0465 -0.0452 0.0265 120 PRO L CA 899 C C . PRO A 119 ? 0.4422 0.4387 0.3184 -0.0550 -0.0513 0.0312 120 PRO L C 900 O O . PRO A 119 ? 0.4944 0.4790 0.3599 -0.0566 -0.0550 0.0321 120 PRO L O 901 C CB . PRO A 119 ? 0.3214 0.3356 0.2136 -0.0454 -0.0402 0.0251 120 PRO L CB 902 C CG . PRO A 119 ? 0.4015 0.4068 0.2862 -0.0422 -0.0412 0.0235 120 PRO L CG 903 C CD . PRO A 119 ? 0.3785 0.3708 0.2557 -0.0367 -0.0425 0.0215 120 PRO L CD 904 N N . SER A 120 ? 0.4438 0.4496 0.3255 -0.0604 -0.0524 0.0345 121 SER L N 905 C CA . SER A 120 ? 0.3998 0.4046 0.2766 -0.0699 -0.0581 0.0396 121 SER L CA 906 C C . SER A 120 ? 0.4163 0.4308 0.2971 -0.0736 -0.0566 0.0416 121 SER L C 907 O O . SER A 120 ? 0.4324 0.4589 0.3227 -0.0694 -0.0507 0.0394 121 SER L O 908 C CB . SER A 120 ? 0.3877 0.4034 0.2710 -0.0744 -0.0594 0.0430 121 SER L CB 909 O OG . SER A 120 ? 0.4217 0.4572 0.3200 -0.0716 -0.0532 0.0430 121 SER L OG 910 N N . ASP A 121 ? 0.4301 0.4389 0.3027 -0.0818 -0.0620 0.0458 122 ASP L N 911 C CA . ASP A 121 ? 0.4304 0.4490 0.3064 -0.0863 -0.0609 0.0484 122 ASP L CA 912 C C . ASP A 121 ? 0.4252 0.4670 0.3160 -0.0885 -0.0568 0.0509 122 ASP L C 913 O O . ASP A 121 ? 0.3510 0.4051 0.2488 -0.0877 -0.0524 0.0509 122 ASP L O 914 C CB . ASP A 121 ? 0.5080 0.5146 0.3712 -0.0956 -0.0678 0.0530 122 ASP L CB 915 C CG . ASP A 121 ? 0.6878 0.6718 0.5358 -0.0921 -0.0706 0.0508 122 ASP L CG 916 O OD1 . ASP A 121 ? 0.7230 0.7066 0.5729 -0.0838 -0.0666 0.0468 122 ASP L OD1 917 O OD2 . ASP A 121 ? 0.7737 0.7401 0.6073 -0.0977 -0.0770 0.0531 122 ASP L OD2 918 N N . GLU A 122 ? 0.3690 0.4168 0.2641 -0.0905 -0.0583 0.0530 123 GLU L N 919 C CA . GLU A 122 ? 0.4358 0.5060 0.3449 -0.0913 -0.0543 0.0558 123 GLU L CA 920 C C . GLU A 122 ? 0.4333 0.5127 0.3524 -0.0818 -0.0460 0.0512 123 GLU L C 921 O O . GLU A 122 ? 0.4151 0.5105 0.3430 -0.0814 -0.0413 0.0525 123 GLU L O 922 C CB . GLU A 122 ? 0.4559 0.5301 0.3674 -0.0939 -0.0575 0.0587 123 GLU L CB 923 C CG . GLU A 122 ? 0.5685 0.6674 0.4940 -0.0954 -0.0544 0.0633 123 GLU L CG 924 C CD . GLU A 122 ? 0.7133 0.8178 0.6425 -0.0960 -0.0568 0.0658 123 GLU L CD 925 O OE1 . GLU A 122 ? 0.6791 0.7678 0.5984 -0.0978 -0.0623 0.0648 123 GLU L OE1 926 O OE2 . GLU A 122 ? 0.7044 0.8293 0.6460 -0.0941 -0.0531 0.0688 123 GLU L OE2 927 N N . GLN A 123 ? 0.3726 0.4414 0.2894 -0.0743 -0.0442 0.0459 124 GLN L N 928 C CA . GLN A 123 ? 0.3606 0.4362 0.2854 -0.0663 -0.0367 0.0414 124 GLN L CA 929 C C . GLN A 123 ? 0.3004 0.3768 0.2243 -0.0653 -0.0337 0.0391 124 GLN L C 930 O O . GLN A 123 ? 0.3190 0.4054 0.2500 -0.0617 -0.0276 0.0371 124 GLN L O 931 C CB . GLN A 123 ? 0.3969 0.4617 0.3194 -0.0594 -0.0355 0.0367 124 GLN L CB 932 C CG . GLN A 123 ? 0.4161 0.4882 0.3471 -0.0521 -0.0279 0.0327 124 GLN L CG 933 C CD . GLN A 123 ? 0.3714 0.4326 0.2994 -0.0459 -0.0265 0.0280 124 GLN L CD 934 O OE1 . GLN A 123 ? 0.3713 0.4195 0.2907 -0.0459 -0.0307 0.0271 124 GLN L OE1 935 N NE2 . GLN A 123 ? 0.3093 0.3756 0.2438 -0.0406 -0.0205 0.0250 124 GLN L NE2 936 N N . LEU A 124 ? 0.3736 0.4385 0.2878 -0.0684 -0.0381 0.0395 125 LEU L N 937 C CA . LEU A 124 ? 0.4451 0.5106 0.3576 -0.0677 -0.0360 0.0378 125 LEU L CA 938 C C . LEU A 124 ? 0.4987 0.5795 0.4169 -0.0722 -0.0336 0.0412 125 LEU L C 939 O O . LEU A 124 ? 0.5459 0.6322 0.4662 -0.0702 -0.0295 0.0391 125 LEU L O 940 C CB . LEU A 124 ? 0.4662 0.5156 0.3663 -0.0696 -0.0416 0.0383 125 LEU L CB 941 C CG . LEU A 124 ? 0.4982 0.5336 0.3927 -0.0632 -0.0426 0.0344 125 LEU L CG 942 C CD1 . LEU A 124 ? 0.4862 0.5046 0.3672 -0.0639 -0.0479 0.0353 125 LEU L CD1 943 C CD2 . LEU A 124 ? 0.4205 0.4615 0.3214 -0.0561 -0.0366 0.0293 125 LEU L CD2 944 N N . LYS A 125 ? 0.4935 0.5816 0.4139 -0.0784 -0.0362 0.0466 126 LYS L N 945 C CA . LYS A 125 ? 0.5595 0.6647 0.4865 -0.0822 -0.0334 0.0504 126 LYS L CA 946 C C . LYS A 125 ? 0.6949 0.8135 0.6321 -0.0756 -0.0253 0.0476 126 LYS L C 947 O O . LYS A 125 ? 0.7126 0.8420 0.6531 -0.0757 -0.0210 0.0482 126 LYS L O 948 C CB . LYS A 125 ? 0.5636 0.6765 0.4925 -0.0899 -0.0376 0.0571 126 LYS L CB 949 C CG . LYS A 125 ? 0.6147 0.7146 0.5323 -0.0984 -0.0457 0.0608 126 LYS L CG 950 C CD . LYS A 125 ? 0.6789 0.7876 0.5991 -0.1066 -0.0499 0.0672 126 LYS L CD 951 C CE . LYS A 125 ? 0.8007 0.9344 0.7332 -0.1080 -0.0451 0.0715 126 LYS L CE 952 N NZ . LYS A 125 ? 0.9140 1.0598 0.8510 -0.1155 -0.0491 0.0782 126 LYS L NZ 953 N N . SER A 126 ? 0.7254 0.8422 0.6664 -0.0697 -0.0232 0.0447 127 SER L N 954 C CA . SER A 126 ? 0.7046 0.8322 0.6543 -0.0632 -0.0157 0.0425 127 SER L CA 955 C C . SER A 126 ? 0.6474 0.7704 0.5956 -0.0579 -0.0105 0.0363 127 SER L C 956 O O . SER A 126 ? 0.6967 0.8280 0.6496 -0.0538 -0.0040 0.0345 127 SER L O 957 C CB . SER A 126 ? 0.8028 0.9293 0.7562 -0.0593 -0.0156 0.0423 127 SER L CB 958 O OG . SER A 126 ? 0.8476 0.9584 0.7954 -0.0562 -0.0175 0.0378 127 SER L OG 959 N N . GLY A 127 ? 0.3899 0.4999 0.3310 -0.0578 -0.0134 0.0330 128 GLY L N 960 C CA . GLY A 127 ? 0.4207 0.5276 0.3602 -0.0540 -0.0094 0.0276 128 GLY L CA 961 C C . GLY A 127 ? 0.4339 0.5312 0.3724 -0.0488 -0.0084 0.0226 128 GLY L C 962 O O . GLY A 127 ? 0.4544 0.5500 0.3921 -0.0461 -0.0050 0.0181 128 GLY L O 963 N N . THR A 128 ? 0.5062 0.5975 0.4443 -0.0479 -0.0116 0.0237 129 THR L N 964 C CA . THR A 128 ? 0.4473 0.5300 0.3844 -0.0431 -0.0107 0.0196 129 THR L CA 965 C C . THR A 128 ? 0.3541 0.4256 0.2850 -0.0442 -0.0170 0.0210 129 THR L C 966 O O . THR A 128 ? 0.3455 0.4163 0.2743 -0.0483 -0.0215 0.0253 129 THR L O 967 C CB . THR A 128 ? 0.5449 0.6316 0.4883 -0.0390 -0.0061 0.0188 129 THR L CB 968 O OG1 . THR A 128 ? 0.7350 0.8306 0.6827 -0.0376 -0.0001 0.0176 129 THR L OG1 969 C CG2 . THR A 128 ? 0.4549 0.5331 0.3972 -0.0344 -0.0046 0.0146 129 THR L CG2 970 N N . ALA A 129 ? 0.3029 0.3656 0.2299 -0.0406 -0.0173 0.0176 130 ALA L N 971 C CA . ALA A 129 ? 0.3279 0.3786 0.2477 -0.0400 -0.0225 0.0184 130 ALA L CA 972 C C . ALA A 129 ? 0.3791 0.4252 0.3000 -0.0349 -0.0205 0.0156 130 ALA L C 973 O O . ALA A 129 ? 0.3537 0.4009 0.2769 -0.0312 -0.0166 0.0119 130 ALA L O 974 C CB . ALA A 129 ? 0.2720 0.3159 0.1845 -0.0399 -0.0253 0.0178 130 ALA L CB 975 N N . SER A 130 ? 0.3231 0.3643 0.2420 -0.0351 -0.0233 0.0176 131 SER L N 976 C CA . SER A 130 ? 0.2621 0.2978 0.1806 -0.0303 -0.0220 0.0154 131 SER L CA 977 C C . SER A 130 ? 0.3261 0.3481 0.2344 -0.0289 -0.0267 0.0154 131 SER L C 978 O O . SER A 130 ? 0.3360 0.3513 0.2376 -0.0325 -0.0320 0.0184 131 SER L O 979 C CB . SER A 130 ? 0.2960 0.3359 0.2191 -0.0305 -0.0212 0.0174 131 SER L CB 980 O OG . SER A 130 ? 0.2816 0.3333 0.2132 -0.0305 -0.0164 0.0175 131 SER L OG 981 N N . VAL A 131 ? 0.3412 0.3590 0.2478 -0.0238 -0.0247 0.0123 132 VAL L N 982 C CA . VAL A 131 ? 0.3144 0.3193 0.2111 -0.0206 -0.0280 0.0121 132 VAL L CA 983 C C . VAL A 131 ? 0.3197 0.3219 0.2172 -0.0167 -0.0261 0.0107 132 VAL L C 984 O O . VAL A 131 ? 0.2969 0.3056 0.2013 -0.0140 -0.0210 0.0084 132 VAL L O 985 C CB . VAL A 131 ? 0.2743 0.2775 0.1681 -0.0167 -0.0272 0.0101 132 VAL L CB 986 C CG1 . VAL A 131 ? 0.2920 0.2806 0.1737 -0.0132 -0.0312 0.0107 132 VAL L CG1 987 C CG2 . VAL A 131 ? 0.2964 0.3057 0.1919 -0.0203 -0.0277 0.0110 132 VAL L CG2 988 N N . VAL A 132 ? 0.3287 0.3206 0.2183 -0.0171 -0.0301 0.0123 133 VAL L N 989 C CA . VAL A 132 ? 0.2737 0.2630 0.1633 -0.0139 -0.0286 0.0115 133 VAL L CA 990 C C . VAL A 132 ? 0.3227 0.2991 0.2017 -0.0087 -0.0300 0.0101 133 VAL L C 991 O O . VAL A 132 ? 0.3358 0.3004 0.2037 -0.0092 -0.0347 0.0112 133 VAL L O 992 C CB . VAL A 132 ? 0.3190 0.3086 0.2086 -0.0183 -0.0318 0.0146 133 VAL L CB 993 C CG1 . VAL A 132 ? 0.2851 0.2713 0.1736 -0.0147 -0.0307 0.0140 133 VAL L CG1 994 C CG2 . VAL A 132 ? 0.2223 0.2263 0.1230 -0.0220 -0.0295 0.0162 133 VAL L CG2 995 N N . CYS A 133 ? 0.2814 0.2599 0.1635 -0.0035 -0.0255 0.0079 134 CYS L N 996 C CA . CYS A 133 ? 0.3144 0.2827 0.1875 0.0024 -0.0256 0.0067 134 CYS L CA 997 C C . CYS A 133 ? 0.3901 0.3552 0.2620 0.0036 -0.0250 0.0068 134 CYS L C 998 O O . CYS A 133 ? 0.4543 0.4283 0.3353 0.0037 -0.0209 0.0063 134 CYS L O 999 C CB . CYS A 133 ? 0.3047 0.2795 0.1822 0.0075 -0.0208 0.0044 134 CYS L CB 1000 S SG . CYS A 133 ? 0.5647 0.5296 0.4318 0.0161 -0.0200 0.0033 134 CYS L SG 1001 N N . LEU A 134 ? 0.3312 0.2826 0.1907 0.0044 -0.0292 0.0076 135 LEU L N 1002 C CA . LEU A 134 ? 0.3251 0.2725 0.1816 0.0053 -0.0294 0.0080 135 LEU L CA 1003 C C . LEU A 134 ? 0.3828 0.3213 0.2307 0.0125 -0.0275 0.0061 135 LEU L C 1004 O O . LEU A 134 ? 0.3739 0.3013 0.2106 0.0158 -0.0295 0.0055 135 LEU L O 1005 C CB . LEU A 134 ? 0.2722 0.2114 0.1206 -0.0005 -0.0361 0.0105 135 LEU L CB 1006 C CG . LEU A 134 ? 0.3520 0.2840 0.1935 0.0001 -0.0380 0.0112 135 LEU L CG 1007 C CD1 . LEU A 134 ? 0.3403 0.2849 0.1939 0.0000 -0.0343 0.0121 135 LEU L CD1 1008 C CD2 . LEU A 134 ? 0.3462 0.2682 0.1770 -0.0064 -0.0457 0.0136 135 LEU L CD2 1009 N N . LEU A 135 ? 0.3252 0.2685 0.1780 0.0153 -0.0232 0.0055 136 LEU L N 1010 C CA . LEU A 135 ? 0.3030 0.2387 0.1476 0.0218 -0.0212 0.0043 136 LEU L CA 1011 C C . LEU A 135 ? 0.3364 0.2657 0.1754 0.0203 -0.0237 0.0055 136 LEU L C 1012 O O . LEU A 135 ? 0.3466 0.2844 0.1945 0.0181 -0.0218 0.0066 136 LEU L O 1013 C CB . LEU A 135 ? 0.3299 0.2765 0.1839 0.0259 -0.0142 0.0029 136 LEU L CB 1014 C CG . LEU A 135 ? 0.3257 0.2799 0.1846 0.0286 -0.0112 0.0016 136 LEU L CG 1015 C CD1 . LEU A 135 ? 0.2721 0.2333 0.1384 0.0233 -0.0127 0.0019 136 LEU L CD1 1016 C CD2 . LEU A 135 ? 0.3252 0.2900 0.1929 0.0309 -0.0047 0.0007 136 LEU L CD2 1017 N N . ASN A 136 ? 0.3595 0.2735 0.1831 0.0215 -0.0279 0.0055 137 ASN L N 1018 C CA . ASN A 136 ? 0.4102 0.3177 0.2272 0.0187 -0.0317 0.0070 137 ASN L CA 1019 C C . ASN A 136 ? 0.4203 0.3197 0.2280 0.0249 -0.0294 0.0059 137 ASN L C 1020 O O . ASN A 136 ? 0.4549 0.3445 0.2520 0.0308 -0.0283 0.0041 137 ASN L O 1021 C CB . ASN A 136 ? 0.4013 0.2962 0.2060 0.0132 -0.0395 0.0082 137 ASN L CB 1022 C CG . ASN A 136 ? 0.5556 0.4506 0.3590 0.0070 -0.0442 0.0108 137 ASN L CG 1023 O OD1 . ASN A 136 ? 0.6068 0.5162 0.4236 0.0032 -0.0434 0.0129 137 ASN L OD1 1024 N ND2 . ASN A 136 ? 0.5399 0.4188 0.3264 0.0060 -0.0492 0.0108 137 ASN L ND2 1025 N N . ASN A 137 ? 0.4214 0.3256 0.2333 0.0239 -0.0283 0.0072 138 ASN L N 1026 C CA . ASN A 137 ? 0.3795 0.2757 0.1816 0.0284 -0.0271 0.0068 138 ASN L CA 1027 C C . ASN A 137 ? 0.4183 0.3141 0.2186 0.0366 -0.0207 0.0046 138 ASN L C 1028 O O . ASN A 137 ? 0.4810 0.3638 0.2667 0.0415 -0.0214 0.0033 138 ASN L O 1029 C CB . ASN A 137 ? 0.3872 0.2657 0.1707 0.0265 -0.0340 0.0069 138 ASN L CB 1030 C CG . ASN A 137 ? 0.5145 0.3949 0.2994 0.0178 -0.0406 0.0097 138 ASN L CG 1031 O OD1 . ASN A 137 ? 0.4558 0.3509 0.2552 0.0147 -0.0393 0.0119 138 ASN L OD1 1032 N ND2 . ASN A 137 ? 0.5642 0.4298 0.3334 0.0138 -0.0476 0.0100 138 ASN L ND2 1033 N N . PHE A 138 ? 0.3738 0.2837 0.1883 0.0381 -0.0145 0.0045 139 PHE L N 1034 C CA . PHE A 138 ? 0.3356 0.2484 0.1504 0.0449 -0.0082 0.0031 139 PHE L CA 1035 C C . PHE A 138 ? 0.3762 0.2967 0.1978 0.0463 -0.0027 0.0039 139 PHE L C 1036 O O . PHE A 138 ? 0.3469 0.2725 0.1758 0.0421 -0.0029 0.0055 139 PHE L O 1037 C CB . PHE A 138 ? 0.3450 0.2676 0.1693 0.0453 -0.0057 0.0022 139 PHE L CB 1038 C CG . PHE A 138 ? 0.3910 0.3271 0.2313 0.0396 -0.0042 0.0028 139 PHE L CG 1039 C CD1 . PHE A 138 ? 0.3661 0.3029 0.2097 0.0337 -0.0087 0.0036 139 PHE L CD1 1040 C CD2 . PHE A 138 ? 0.3509 0.2985 0.2020 0.0400 0.0020 0.0027 139 PHE L CD2 1041 C CE1 . PHE A 138 ? 0.3752 0.3239 0.2324 0.0293 -0.0068 0.0040 139 PHE L CE1 1042 C CE2 . PHE A 138 ? 0.3667 0.3245 0.2305 0.0351 0.0036 0.0029 139 PHE L CE2 1043 C CZ . PHE A 138 ? 0.3529 0.3112 0.2196 0.0302 -0.0006 0.0035 139 PHE L CZ 1044 N N . TYR A 139 ? 0.4117 0.3331 0.2303 0.0524 0.0023 0.0032 140 TYR L N 1045 C CA . TYR A 139 ? 0.3823 0.3112 0.2070 0.0536 0.0082 0.0041 140 TYR L CA 1046 C C . TYR A 139 ? 0.3885 0.3241 0.2147 0.0591 0.0140 0.0033 140 TYR L C 1047 O O . TYR A 139 ? 0.4214 0.3508 0.2377 0.0647 0.0134 0.0024 140 TYR L O 1048 C CB . TYR A 139 ? 0.3588 0.2782 0.1730 0.0551 0.0070 0.0052 140 TYR L CB 1049 C CG . TYR A 139 ? 0.4208 0.3472 0.2412 0.0555 0.0128 0.0066 140 TYR L CG 1050 C CD1 . TYR A 139 ? 0.3794 0.3084 0.1973 0.0608 0.0186 0.0066 140 TYR L CD1 1051 C CD2 . TYR A 139 ? 0.3426 0.2732 0.1713 0.0509 0.0128 0.0084 140 TYR L CD2 1052 C CE1 . TYR A 139 ? 0.3745 0.3096 0.1978 0.0603 0.0240 0.0082 140 TYR L CE1 1053 C CE2 . TYR A 139 ? 0.3511 0.2864 0.1844 0.0512 0.0182 0.0098 140 TYR L CE2 1054 C CZ . TYR A 139 ? 0.3834 0.3206 0.2138 0.0554 0.0236 0.0097 140 TYR L CZ 1055 O OH . TYR A 139 ? 0.4835 0.4246 0.3178 0.0549 0.0289 0.0114 140 TYR L OH 1056 N N . PRO A 140 ? 0.3751 0.3237 0.2133 0.0575 0.0196 0.0039 141 PRO L N 1057 C CA . PRO A 140 ? 0.3912 0.3461 0.2402 0.0516 0.0212 0.0049 141 PRO L CA 1058 C C . PRO A 140 ? 0.3743 0.3342 0.2328 0.0460 0.0187 0.0042 141 PRO L C 1059 O O . PRO A 140 ? 0.3994 0.3583 0.2565 0.0460 0.0153 0.0032 141 PRO L O 1060 C CB . PRO A 140 ? 0.3473 0.3128 0.2031 0.0523 0.0283 0.0054 141 PRO L CB 1061 C CG . PRO A 140 ? 0.3653 0.3361 0.2201 0.0567 0.0296 0.0046 141 PRO L CG 1062 C CD . PRO A 140 ? 0.3925 0.3502 0.2332 0.0621 0.0252 0.0039 141 PRO L CD 1063 N N . ARG A 141 ? 0.3040 0.2687 0.1712 0.0415 0.0207 0.0050 142 ARG L N 1064 C CA . ARG A 141 ? 0.3346 0.3032 0.2099 0.0365 0.0188 0.0046 142 ARG L CA 1065 C C . ARG A 141 ? 0.3280 0.3056 0.2106 0.0347 0.0203 0.0030 142 ARG L C 1066 O O . ARG A 141 ? 0.3829 0.3620 0.2686 0.0319 0.0171 0.0023 142 ARG L O 1067 C CB . ARG A 141 ? 0.3314 0.3016 0.2126 0.0336 0.0217 0.0059 142 ARG L CB 1068 C CG . ARG A 141 ? 0.4096 0.3825 0.2976 0.0295 0.0197 0.0060 142 ARG L CG 1069 C CD . ARG A 141 ? 0.4788 0.4518 0.3710 0.0283 0.0232 0.0074 142 ARG L CD 1070 N NE . ARG A 141 ? 0.5860 0.5623 0.4848 0.0253 0.0226 0.0075 142 ARG L NE 1071 C CZ . ARG A 141 ? 0.6800 0.6615 0.5852 0.0223 0.0252 0.0056 142 ARG L CZ 1072 N NH1 . ARG A 141 ? 0.7254 0.7106 0.6321 0.0213 0.0281 0.0037 142 ARG L NH1 1073 N NH2 . ARG A 141 ? 0.7548 0.7387 0.6649 0.0203 0.0247 0.0058 142 ARG L NH2 1074 N N . GLU A 142 ? 0.2950 0.2793 0.1801 0.0362 0.0249 0.0026 143 GLU L N 1075 C CA . GLU A 142 ? 0.4008 0.3956 0.2935 0.0340 0.0265 0.0013 143 GLU L CA 1076 C C . GLU A 142 ? 0.4311 0.4256 0.3202 0.0369 0.0227 0.0006 143 GLU L C 1077 O O . GLU A 142 ? 0.4932 0.4832 0.3741 0.0427 0.0219 0.0010 143 GLU L O 1078 C CB . GLU A 142 ? 0.4715 0.4751 0.3676 0.0343 0.0322 0.0018 143 GLU L CB 1079 C CG . GLU A 142 ? 0.6501 0.6535 0.5496 0.0305 0.0364 0.0025 143 GLU L CG 1080 C CD . GLU A 142 ? 0.7487 0.7435 0.6406 0.0342 0.0372 0.0042 143 GLU L CD 1081 O OE1 . GLU A 142 ? 0.7215 0.7114 0.6053 0.0397 0.0351 0.0045 143 GLU L OE1 1082 O OE2 . GLU A 142 ? 0.8135 0.8055 0.7065 0.0317 0.0400 0.0052 143 GLU L OE2 1083 N N . ALA A 143 ? 0.3355 0.3341 0.2299 0.0332 0.0206 -0.0003 144 ALA L N 1084 C CA . ALA A 143 ? 0.3996 0.3981 0.2910 0.0354 0.0171 -0.0007 144 ALA L CA 1085 C C . ALA A 143 ? 0.3350 0.3437 0.2354 0.0308 0.0175 -0.0016 144 ALA L C 1086 O O . ALA A 143 ? 0.3719 0.3831 0.2785 0.0254 0.0185 -0.0022 144 ALA L O 1087 C CB . ALA A 143 ? 0.4109 0.3972 0.2941 0.0358 0.0113 -0.0003 144 ALA L CB 1088 N N . LYS A 144 ? 0.3881 0.4026 0.2886 0.0333 0.0169 -0.0017 145 LYS L N 1089 C CA . LYS A 144 ? 0.3123 0.3363 0.2203 0.0289 0.0166 -0.0025 145 LYS L CA 1090 C C . LYS A 144 ? 0.3598 0.3780 0.2634 0.0292 0.0113 -0.0024 145 LYS L C 1091 O O . LYS A 144 ? 0.3536 0.3655 0.2492 0.0347 0.0088 -0.0016 145 LYS L O 1092 C CB . LYS A 144 ? 0.3736 0.4111 0.2863 0.0305 0.0195 -0.0021 145 LYS L CB 1093 C CG . LYS A 144 ? 0.4383 0.4859 0.3579 0.0256 0.0188 -0.0029 145 LYS L CG 1094 C CD . LYS A 144 ? 0.5993 0.6629 0.5255 0.0250 0.0221 -0.0023 145 LYS L CD 1095 C CE . LYS A 144 ? 0.7307 0.7990 0.6535 0.0333 0.0215 -0.0005 145 LYS L CE 1096 N NZ . LYS A 144 ? 0.8226 0.9096 0.7530 0.0324 0.0244 0.0007 145 LYS L NZ 1097 N N . VAL A 145 ? 0.3205 0.3399 0.2286 0.0234 0.0098 -0.0030 146 VAL L N 1098 C CA . VAL A 145 ? 0.3440 0.3591 0.2487 0.0225 0.0051 -0.0026 146 VAL L CA 1099 C C . VAL A 145 ? 0.3433 0.3690 0.2546 0.0189 0.0054 -0.0033 146 VAL L C 1100 O O . VAL A 145 ? 0.4539 0.4858 0.3722 0.0136 0.0078 -0.0045 146 VAL L O 1101 C CB . VAL A 145 ? 0.4309 0.4381 0.3339 0.0189 0.0023 -0.0021 146 VAL L CB 1102 C CG1 . VAL A 145 ? 0.4430 0.4455 0.3417 0.0174 -0.0028 -0.0012 146 VAL L CG1 1103 C CG2 . VAL A 145 ? 0.3609 0.3584 0.2573 0.0219 0.0018 -0.0013 146 VAL L CG2 1104 N N . GLN A 146 ? 0.3256 0.3526 0.2338 0.0220 0.0030 -0.0026 147 GLN L N 1105 C CA . GLN A 146 ? 0.3551 0.3922 0.2685 0.0189 0.0026 -0.0029 147 GLN L CA 1106 C C . GLN A 146 ? 0.3295 0.3603 0.2380 0.0180 -0.0022 -0.0019 147 GLN L C 1107 O O . GLN A 146 ? 0.2975 0.3180 0.1970 0.0225 -0.0054 -0.0006 147 GLN L O 1108 C CB . GLN A 146 ? 0.3588 0.4062 0.2739 0.0233 0.0042 -0.0022 147 GLN L CB 1109 C CG . GLN A 146 ? 0.4784 0.5349 0.3994 0.0229 0.0091 -0.0028 147 GLN L CG 1110 C CD . GLN A 146 ? 0.5775 0.6453 0.4999 0.0281 0.0104 -0.0013 147 GLN L CD 1111 O OE1 . GLN A 146 ? 0.6492 0.7122 0.5650 0.0361 0.0098 0.0002 147 GLN L OE1 1112 N NE2 . GLN A 146 ? 0.5446 0.6276 0.4751 0.0238 0.0122 -0.0015 147 GLN L NE2 1113 N N . TRP A 147 ? 0.2215 0.2576 0.1349 0.0121 -0.0025 -0.0026 148 TRP L N 1114 C CA . TRP A 147 ? 0.2800 0.3123 0.1896 0.0104 -0.0067 -0.0014 148 TRP L CA 1115 C C . TRP A 147 ? 0.3148 0.3553 0.2253 0.0118 -0.0076 -0.0009 148 TRP L C 1116 O O . TRP A 147 ? 0.3599 0.4127 0.2773 0.0099 -0.0048 -0.0020 148 TRP L O 1117 C CB . TRP A 147 ? 0.2503 0.2839 0.1642 0.0036 -0.0066 -0.0020 148 TRP L CB 1118 C CG . TRP A 147 ? 0.2614 0.2864 0.1730 0.0027 -0.0075 -0.0013 148 TRP L CG 1119 C CD1 . TRP A 147 ? 0.2135 0.2391 0.1292 0.0014 -0.0043 -0.0022 148 TRP L CD1 1120 C CD2 . TRP A 147 ? 0.2679 0.2823 0.1718 0.0026 -0.0122 0.0008 148 TRP L CD2 1121 N NE1 . TRP A 147 ? 0.3314 0.3490 0.2433 0.0009 -0.0069 -0.0006 148 TRP L NE1 1122 C CE2 . TRP A 147 ? 0.2906 0.3014 0.1954 0.0010 -0.0118 0.0012 148 TRP L CE2 1123 C CE3 . TRP A 147 ? 0.2802 0.2873 0.1761 0.0033 -0.0168 0.0026 148 TRP L CE3 1124 C CZ2 . TRP A 147 ? 0.3360 0.3376 0.2343 -0.0005 -0.0162 0.0033 148 TRP L CZ2 1125 C CZ3 . TRP A 147 ? 0.3122 0.3083 0.2007 0.0016 -0.0210 0.0045 148 TRP L CZ3 1126 C CH2 . TRP A 147 ? 0.3594 0.3536 0.2495 -0.0007 -0.0208 0.0048 148 TRP L CH2 1127 N N . LYS A 148 ? 0.3069 0.3404 0.2097 0.0147 -0.0116 0.0010 149 LYS L N 1128 C CA . LYS A 148 ? 0.3136 0.3542 0.2164 0.0165 -0.0130 0.0021 149 LYS L CA 1129 C C . LYS A 148 ? 0.3945 0.4288 0.2923 0.0132 -0.0171 0.0036 149 LYS L C 1130 O O . LYS A 148 ? 0.4035 0.4239 0.2926 0.0141 -0.0204 0.0050 149 LYS L O 1131 C CB . LYS A 148 ? 0.3101 0.3487 0.2071 0.0256 -0.0133 0.0037 149 LYS L CB 1132 C CG . LYS A 148 ? 0.3415 0.3916 0.2449 0.0287 -0.0089 0.0029 149 LYS L CG 1133 C CD . LYS A 148 ? 0.4526 0.4993 0.3492 0.0389 -0.0089 0.0047 149 LYS L CD 1134 C CE . LYS A 148 ? 0.5164 0.5761 0.4198 0.0418 -0.0043 0.0045 149 LYS L CE 1135 N NZ . LYS A 148 ? 0.6004 0.6569 0.4967 0.0529 -0.0037 0.0064 149 LYS L NZ 1136 N N . VAL A 149 ? 0.3091 0.3537 0.2120 0.0088 -0.0170 0.0033 150 VAL L N 1137 C CA . VAL A 149 ? 0.3515 0.3921 0.2500 0.0057 -0.0206 0.0050 150 VAL L CA 1138 C C . VAL A 149 ? 0.3325 0.3797 0.2296 0.0090 -0.0221 0.0066 150 VAL L C 1139 O O . VAL A 149 ? 0.3497 0.4112 0.2539 0.0075 -0.0201 0.0056 150 VAL L O 1140 C CB . VAL A 149 ? 0.3363 0.3826 0.2409 -0.0024 -0.0192 0.0037 150 VAL L CB 1141 C CG1 . VAL A 149 ? 0.3002 0.3434 0.2002 -0.0058 -0.0227 0.0059 150 VAL L CG1 1142 C CG2 . VAL A 149 ? 0.2863 0.3271 0.1927 -0.0048 -0.0176 0.0027 150 VAL L CG2 1143 N N . ASP A 150 ? 0.3077 0.3438 0.1946 0.0134 -0.0259 0.0093 151 ASP L N 1144 C CA . ASP A 150 ? 0.3076 0.3479 0.1913 0.0191 -0.0275 0.0116 151 ASP L CA 1145 C C . ASP A 150 ? 0.3352 0.3890 0.2256 0.0245 -0.0243 0.0108 151 ASP L C 1146 O O . ASP A 150 ? 0.3630 0.4315 0.2586 0.0247 -0.0239 0.0115 151 ASP L O 1147 C CB . ASP A 150 ? 0.3099 0.3586 0.1960 0.0138 -0.0291 0.0124 151 ASP L CB 1148 C CG . ASP A 150 ? 0.4152 0.4507 0.2929 0.0100 -0.0328 0.0144 151 ASP L CG 1149 O OD1 . ASP A 150 ? 0.4036 0.4228 0.2708 0.0137 -0.0355 0.0162 151 ASP L OD1 1150 O OD2 . ASP A 150 ? 0.4303 0.4715 0.3113 0.0030 -0.0330 0.0142 151 ASP L OD2 1151 N N . ASN A 151 ? 0.2434 0.2929 0.1336 0.0280 -0.0220 0.0097 152 ASN L N 1152 C CA . ASN A 151 ? 0.3475 0.4086 0.2432 0.0334 -0.0186 0.0094 152 ASN L CA 1153 C C . ASN A 151 ? 0.3085 0.3876 0.2167 0.0268 -0.0152 0.0073 152 ASN L C 1154 O O . ASN A 151 ? 0.3772 0.4695 0.2911 0.0297 -0.0127 0.0076 152 ASN L O 1155 C CB . ASN A 151 ? 0.3896 0.4552 0.2813 0.0424 -0.0199 0.0126 152 ASN L CB 1156 C CG . ASN A 151 ? 0.4992 0.5628 0.3875 0.0524 -0.0177 0.0135 152 ASN L CG 1157 O OD1 . ASN A 151 ? 0.5444 0.5954 0.4278 0.0537 -0.0168 0.0122 152 ASN L OD1 1158 N ND2 . ASN A 151 ? 0.5615 0.6385 0.4522 0.0597 -0.0168 0.0159 152 ASN L ND2 1159 N N . ALA A 152 ? 0.2455 0.3249 0.1574 0.0179 -0.0150 0.0052 153 ALA L N 1160 C CA . ALA A 152 ? 0.3087 0.4009 0.2302 0.0112 -0.0116 0.0026 153 ALA L CA 1161 C C . ALA A 152 ? 0.3804 0.4659 0.3039 0.0084 -0.0086 0.0003 153 ALA L C 1162 O O . ALA A 152 ? 0.2948 0.3687 0.2148 0.0063 -0.0095 -0.0002 153 ALA L O 1163 C CB . ALA A 152 ? 0.2330 0.3305 0.1567 0.0037 -0.0127 0.0017 153 ALA L CB 1164 N N . LEU A 153 ? 0.3066 0.4004 0.2357 0.0083 -0.0050 -0.0008 154 LEU L N 1165 C CA . LEU A 153 ? 0.4086 0.4966 0.3395 0.0061 -0.0018 -0.0027 154 LEU L CA 1166 C C . LEU A 153 ? 0.3231 0.4095 0.2566 -0.0019 -0.0007 -0.0052 154 LEU L C 1167 O O . LEU A 153 ? 0.3847 0.4800 0.3218 -0.0073 0.0000 -0.0065 154 LEU L O 1168 C CB . LEU A 153 ? 0.4938 0.5919 0.4300 0.0068 0.0019 -0.0031 154 LEU L CB 1169 C CG . LEU A 153 ? 0.6448 0.7370 0.5824 0.0045 0.0055 -0.0048 154 LEU L CG 1170 C CD1 . LEU A 153 ? 0.6226 0.7021 0.5541 0.0110 0.0049 -0.0037 154 LEU L CD1 1171 C CD2 . LEU A 153 ? 0.6475 0.7517 0.5912 0.0019 0.0093 -0.0053 154 LEU L CD2 1172 N N . GLN A 154 ? 0.3018 0.3769 0.2329 -0.0025 -0.0004 -0.0057 155 GLN L N 1173 C CA . GLN A 154 ? 0.3297 0.4028 0.2629 -0.0086 0.0011 -0.0075 155 GLN L CA 1174 C C . GLN A 154 ? 0.3762 0.4501 0.3132 -0.0112 0.0057 -0.0097 155 GLN L C 1175 O O . GLN A 154 ? 0.3673 0.4391 0.3044 -0.0080 0.0073 -0.0093 155 GLN L O 1176 C CB . GLN A 154 ? 0.2406 0.3029 0.1697 -0.0080 -0.0012 -0.0062 155 GLN L CB 1177 C CG . GLN A 154 ? 0.2660 0.3251 0.1898 -0.0063 -0.0059 -0.0039 155 GLN L CG 1178 C CD . GLN A 154 ? 0.3201 0.3869 0.2453 -0.0103 -0.0067 -0.0042 155 GLN L CD 1179 O OE1 . GLN A 154 ? 0.3362 0.4039 0.2632 -0.0151 -0.0057 -0.0051 155 GLN L OE1 1180 N NE2 . GLN A 154 ? 0.2768 0.3496 0.2010 -0.0079 -0.0085 -0.0031 155 GLN L NE2 1181 N N . SER A 155 ? 0.3711 0.4468 0.3103 -0.0169 0.0080 -0.0119 156 SER L N 1182 C CA . SER A 155 ? 0.3977 0.4717 0.3389 -0.0197 0.0125 -0.0141 156 SER L CA 1183 C C . SER A 155 ? 0.3765 0.4453 0.3171 -0.0230 0.0145 -0.0157 156 SER L C 1184 O O . SER A 155 ? 0.4561 0.5277 0.3961 -0.0261 0.0137 -0.0165 156 SER L O 1185 C CB . SER A 155 ? 0.4763 0.5598 0.4201 -0.0237 0.0144 -0.0156 156 SER L CB 1186 O OG . SER A 155 ? 0.5964 0.6764 0.5408 -0.0268 0.0187 -0.0174 156 SER L OG 1187 N N . GLY A 156 ? 0.3478 0.4093 0.2883 -0.0218 0.0172 -0.0159 157 GLY L N 1188 C CA . GLY A 156 ? 0.2980 0.3550 0.2380 -0.0239 0.0201 -0.0172 157 GLY L CA 1189 C C . GLY A 156 ? 0.3602 0.4152 0.2997 -0.0223 0.0181 -0.0153 157 GLY L C 1190 O O . GLY A 156 ? 0.4405 0.4935 0.3798 -0.0233 0.0206 -0.0161 157 GLY L O 1191 N N . ASN A 157 ? 0.2695 0.3248 0.2082 -0.0198 0.0135 -0.0127 158 ASN L N 1192 C CA . ASN A 157 ? 0.2668 0.3207 0.2049 -0.0194 0.0111 -0.0103 158 ASN L CA 1193 C C . ASN A 157 ? 0.3345 0.3829 0.2712 -0.0160 0.0083 -0.0075 158 ASN L C 1194 O O . ASN A 157 ? 0.3640 0.4113 0.2989 -0.0162 0.0044 -0.0050 158 ASN L O 1195 C CB . ASN A 157 ? 0.3059 0.3642 0.2425 -0.0214 0.0076 -0.0095 158 ASN L CB 1196 C CG . ASN A 157 ? 0.3391 0.3985 0.2736 -0.0195 0.0043 -0.0089 158 ASN L CG 1197 O OD1 . ASN A 157 ? 0.3214 0.3788 0.2558 -0.0165 0.0047 -0.0089 158 ASN L OD1 1198 N ND2 . ASN A 157 ? 0.3145 0.3775 0.2472 -0.0208 0.0014 -0.0080 158 ASN L ND2 1199 N N . SER A 158 ? 0.2792 0.3238 0.2160 -0.0134 0.0101 -0.0079 159 SER L N 1200 C CA . SER A 158 ? 0.2587 0.2974 0.1933 -0.0104 0.0075 -0.0054 159 SER L CA 1201 C C . SER A 158 ? 0.3215 0.3570 0.2576 -0.0087 0.0111 -0.0056 159 SER L C 1202 O O . SER A 158 ? 0.3373 0.3732 0.2750 -0.0092 0.0155 -0.0078 159 SER L O 1203 C CB . SER A 158 ? 0.2443 0.2802 0.1750 -0.0075 0.0048 -0.0050 159 SER L CB 1204 O OG . SER A 158 ? 0.3423 0.3796 0.2743 -0.0060 0.0082 -0.0067 159 SER L OG 1205 N N . GLN A 159 ? 0.3416 0.3735 0.2767 -0.0071 0.0091 -0.0030 160 GLN L N 1206 C CA . GLN A 159 ? 0.2733 0.3018 0.2092 -0.0047 0.0118 -0.0025 160 GLN L CA 1207 C C . GLN A 159 ? 0.3287 0.3516 0.2604 -0.0021 0.0083 -0.0004 160 GLN L C 1208 O O . GLN A 159 ? 0.3210 0.3421 0.2493 -0.0027 0.0033 0.0014 160 GLN L O 1209 C CB . GLN A 159 ? 0.2713 0.3025 0.2105 -0.0050 0.0135 -0.0010 160 GLN L CB 1210 C CG . GLN A 159 ? 0.2776 0.3117 0.2193 -0.0064 0.0185 -0.0035 160 GLN L CG 1211 C CD . GLN A 159 ? 0.3978 0.4341 0.3422 -0.0050 0.0211 -0.0018 160 GLN L CD 1212 O OE1 . GLN A 159 ? 0.3792 0.4210 0.3254 -0.0058 0.0188 0.0006 160 GLN L OE1 1213 N NE2 . GLN A 159 ? 0.3311 0.3633 0.2754 -0.0025 0.0261 -0.0028 160 GLN L NE2 1214 N N . GLU A 160 ? 0.3167 0.3358 0.2475 0.0005 0.0110 -0.0008 161 GLU L N 1215 C CA . GLU A 160 ? 0.3686 0.3816 0.2945 0.0033 0.0082 0.0010 161 GLU L CA 1216 C C . GLU A 160 ? 0.3712 0.3827 0.2980 0.0046 0.0088 0.0033 161 GLU L C 1217 O O . GLU A 160 ? 0.2744 0.2880 0.2053 0.0049 0.0130 0.0031 161 GLU L O 1218 C CB . GLU A 160 ? 0.3492 0.3596 0.2727 0.0058 0.0106 -0.0006 161 GLU L CB 1219 C CG . GLU A 160 ? 0.4831 0.4963 0.4057 0.0056 0.0100 -0.0022 161 GLU L CG 1220 C CD . GLU A 160 ? 0.5988 0.6110 0.5192 0.0086 0.0122 -0.0030 161 GLU L CD 1221 O OE1 . GLU A 160 ? 0.6362 0.6458 0.5564 0.0099 0.0152 -0.0027 161 GLU L OE1 1222 O OE2 . GLU A 160 ? 0.6708 0.6852 0.5893 0.0101 0.0112 -0.0035 161 GLU L OE2 1223 N N . SER A 161 ? 0.3249 0.3320 0.2470 0.0057 0.0045 0.0056 162 SER L N 1224 C CA . SER A 161 ? 0.2794 0.2854 0.2016 0.0073 0.0043 0.0082 162 SER L CA 1225 C C . SER A 161 ? 0.3069 0.3050 0.2214 0.0095 0.0016 0.0088 162 SER L C 1226 O O . SER A 161 ? 0.4054 0.3991 0.3138 0.0089 -0.0027 0.0087 162 SER L O 1227 C CB . SER A 161 ? 0.3741 0.3856 0.2990 0.0049 0.0007 0.0114 162 SER L CB 1228 O OG . SER A 161 ? 0.4609 0.4729 0.3863 0.0067 0.0002 0.0145 162 SER L OG 1229 N N . VAL A 162 ? 0.3172 0.3125 0.2309 0.0124 0.0044 0.0095 163 VAL L N 1230 C CA . VAL A 162 ? 0.3376 0.3254 0.2433 0.0149 0.0025 0.0100 163 VAL L CA 1231 C C . VAL A 162 ? 0.3477 0.3344 0.2519 0.0158 0.0004 0.0134 163 VAL L C 1232 O O . VAL A 162 ? 0.3351 0.3261 0.2450 0.0167 0.0034 0.0149 163 VAL L O 1233 C CB . VAL A 162 ? 0.3758 0.3611 0.2807 0.0178 0.0079 0.0079 163 VAL L CB 1234 C CG1 . VAL A 162 ? 0.3528 0.3305 0.2484 0.0207 0.0061 0.0082 163 VAL L CG1 1235 C CG2 . VAL A 162 ? 0.3604 0.3498 0.2688 0.0164 0.0106 0.0050 163 VAL L CG2 1236 N N . THR A 163 ? 0.2716 0.2524 0.1676 0.0156 -0.0050 0.0148 164 THR L N 1237 C CA . THR A 163 ? 0.3377 0.3181 0.2316 0.0161 -0.0077 0.0183 164 THR L CA 1238 C C . THR A 163 ? 0.3493 0.3252 0.2404 0.0204 -0.0037 0.0183 164 THR L C 1239 O O . THR A 163 ? 0.3224 0.2940 0.2108 0.0225 0.0000 0.0157 164 THR L O 1240 C CB . THR A 163 ? 0.3650 0.3392 0.2491 0.0135 -0.0153 0.0196 164 THR L CB 1241 O OG1 . THR A 163 ? 0.4017 0.3653 0.2758 0.0159 -0.0153 0.0170 164 THR L OG1 1242 C CG2 . THR A 163 ? 0.3631 0.3410 0.2489 0.0083 -0.0198 0.0202 164 THR L CG2 1243 N N . GLU A 164 ? 0.3493 0.3269 0.2410 0.0216 -0.0043 0.0217 165 GLU L N 1244 C CA . GLU A 164 ? 0.3860 0.3580 0.2730 0.0254 -0.0016 0.0223 165 GLU L CA 1245 C C . GLU A 164 ? 0.4083 0.3712 0.2834 0.0257 -0.0057 0.0216 165 GLU L C 1246 O O . GLU A 164 ? 0.3957 0.3562 0.2658 0.0226 -0.0115 0.0213 165 GLU L O 1247 C CB . GLU A 164 ? 0.3600 0.3361 0.2498 0.0272 -0.0018 0.0267 165 GLU L CB 1248 C CG . GLU A 164 ? 0.4948 0.4783 0.3949 0.0284 0.0029 0.0277 165 GLU L CG 1249 C CD . GLU A 164 ? 0.7434 0.7227 0.6451 0.0311 0.0107 0.0254 165 GLU L CD 1250 O OE1 . GLU A 164 ? 0.8378 0.8104 0.7339 0.0317 0.0126 0.0233 165 GLU L OE1 1251 O OE2 . GLU A 164 ? 0.8539 0.8364 0.7617 0.0325 0.0150 0.0259 165 GLU L OE2 1252 N N . GLN A 165 ? 0.3855 0.3423 0.2548 0.0292 -0.0026 0.0211 166 GLN L N 1253 C CA . GLN A 165 ? 0.3591 0.3063 0.2156 0.0304 -0.0059 0.0204 166 GLN L CA 1254 C C . GLN A 165 ? 0.3673 0.3124 0.2176 0.0277 -0.0135 0.0232 166 GLN L C 1255 O O . GLN A 165 ? 0.5498 0.5000 0.4037 0.0275 -0.0146 0.0267 166 GLN L O 1256 C CB . GLN A 165 ? 0.4380 0.3806 0.2898 0.0347 -0.0010 0.0204 166 GLN L CB 1257 C CG . GLN A 165 ? 0.4369 0.3759 0.2849 0.0372 0.0029 0.0171 166 GLN L CG 1258 C CD . GLN A 165 ? 0.4338 0.3688 0.2764 0.0411 0.0074 0.0176 166 GLN L CD 1259 O OE1 . GLN A 165 ? 0.4228 0.3595 0.2687 0.0418 0.0103 0.0199 166 GLN L OE1 1260 N NE2 . GLN A 165 ? 0.3644 0.2939 0.1982 0.0442 0.0083 0.0156 166 GLN L NE2 1261 N N . ASP A 166 ? 0.3948 0.3324 0.2353 0.0256 -0.0188 0.0218 167 ASP L N 1262 C CA . ASP A 166 ? 0.4099 0.3436 0.2420 0.0218 -0.0268 0.0242 167 ASP L CA 1263 C C . ASP A 166 ? 0.5046 0.4338 0.3290 0.0245 -0.0271 0.0261 167 ASP L C 1264 O O . ASP A 166 ? 0.5386 0.4606 0.3563 0.0291 -0.0231 0.0242 167 ASP L O 1265 C CB . ASP A 166 ? 0.5121 0.4344 0.3318 0.0195 -0.0317 0.0217 167 ASP L CB 1266 C CG . ASP A 166 ? 0.6695 0.5860 0.4786 0.0142 -0.0404 0.0239 167 ASP L CG 1267 O OD1 . ASP A 166 ? 0.8051 0.7279 0.6189 0.0081 -0.0453 0.0261 167 ASP L OD1 1268 O OD2 . ASP A 166 ? 0.6267 0.5325 0.4223 0.0157 -0.0425 0.0237 167 ASP L OD2 1269 N N . SER A 167 ? 0.5642 0.4987 0.3899 0.0218 -0.0317 0.0303 168 SER L N 1270 C CA . SER A 167 ? 0.6281 0.5604 0.4480 0.0243 -0.0321 0.0329 168 SER L CA 1271 C C . SER A 167 ? 0.6268 0.5443 0.4281 0.0244 -0.0361 0.0313 168 SER L C 1272 O O . SER A 167 ? 0.6771 0.5906 0.4715 0.0273 -0.0354 0.0327 168 SER L O 1273 C CB . SER A 167 ? 0.5945 0.5380 0.4208 0.0214 -0.0367 0.0383 168 SER L CB 1274 O OG . SER A 167 ? 0.5278 0.4716 0.3496 0.0145 -0.0451 0.0395 168 SER L OG 1275 N N . LYS A 168 ? 0.6228 0.5310 0.4149 0.0214 -0.0401 0.0284 169 LYS L N 1276 C CA . LYS A 168 ? 0.6612 0.5530 0.4335 0.0219 -0.0437 0.0264 169 LYS L CA 1277 C C . LYS A 168 ? 0.6781 0.5599 0.4435 0.0277 -0.0381 0.0218 169 LYS L C 1278 O O . LYS A 168 ? 0.6307 0.5051 0.3869 0.0328 -0.0349 0.0208 169 LYS L O 1279 C CB . LYS A 168 ? 0.7248 0.6101 0.4874 0.0142 -0.0531 0.0269 169 LYS L CB 1280 C CG . LYS A 168 ? 0.7841 0.6754 0.5458 0.0085 -0.0604 0.0317 169 LYS L CG 1281 C CD . LYS A 168 ? 0.8870 0.7748 0.6425 -0.0007 -0.0693 0.0323 169 LYS L CD 1282 C CE . LYS A 168 ? 1.0255 0.9206 0.7816 -0.0070 -0.0760 0.0366 169 LYS L CE 1283 N NZ . LYS A 168 ? 1.0762 0.9587 0.8191 -0.0066 -0.0775 0.0344 169 LYS L NZ 1284 N N . ASP A 169 ? 0.5634 0.4454 0.3330 0.0273 -0.0369 0.0193 170 ASP L N 1285 C CA . ASP A 169 ? 0.5159 0.3894 0.2787 0.0331 -0.0321 0.0153 170 ASP L CA 1286 C C . ASP A 169 ? 0.4701 0.3548 0.2473 0.0377 -0.0232 0.0145 170 ASP L C 1287 O O . ASP A 169 ? 0.4560 0.3372 0.2298 0.0429 -0.0186 0.0119 170 ASP L O 1288 C CB . ASP A 169 ? 0.4962 0.3608 0.2517 0.0307 -0.0363 0.0130 170 ASP L CB 1289 C CG . ASP A 169 ? 0.6486 0.5251 0.4193 0.0259 -0.0371 0.0139 170 ASP L CG 1290 O OD1 . ASP A 169 ? 0.6223 0.5126 0.4093 0.0273 -0.0315 0.0144 170 ASP L OD1 1291 O OD2 . ASP A 169 ? 0.7655 0.6366 0.5309 0.0203 -0.0435 0.0141 170 ASP L OD2 1292 N N . SER A 170 ? 0.3844 0.2826 0.1771 0.0357 -0.0210 0.0169 171 SER L N 1293 C CA . SER A 170 ? 0.3572 0.2651 0.1628 0.0388 -0.0129 0.0164 171 SER L CA 1294 C C . SER A 170 ? 0.4017 0.3131 0.2133 0.0393 -0.0101 0.0136 171 SER L C 1295 O O . SER A 170 ? 0.4090 0.3254 0.2264 0.0425 -0.0035 0.0124 171 SER L O 1296 C CB . SER A 170 ? 0.3070 0.2111 0.1065 0.0443 -0.0076 0.0162 171 SER L CB 1297 O OG . SER A 170 ? 0.5060 0.4072 0.2999 0.0440 -0.0100 0.0191 171 SER L OG 1298 N N . THR A 171 ? 0.2946 0.2037 0.1046 0.0358 -0.0151 0.0128 172 THR L N 1299 C CA . THR A 171 ? 0.3680 0.2809 0.1838 0.0362 -0.0130 0.0105 172 THR L CA 1300 C C . THR A 171 ? 0.3730 0.2985 0.2045 0.0318 -0.0123 0.0116 172 THR L C 1301 O O . THR A 171 ? 0.3097 0.2404 0.1467 0.0287 -0.0140 0.0141 172 THR L O 1302 C CB . THR A 171 ? 0.4442 0.3460 0.2481 0.0355 -0.0184 0.0090 172 THR L CB 1303 O OG1 . THR A 171 ? 0.5392 0.4395 0.3419 0.0288 -0.0255 0.0109 172 THR L OG1 1304 C CG2 . THR A 171 ? 0.3288 0.2161 0.1152 0.0406 -0.0188 0.0076 172 THR L CG2 1305 N N . TYR A 172 ? 0.3540 0.2846 0.1919 0.0320 -0.0096 0.0096 173 TYR L N 1306 C CA . TYR A 172 ? 0.3810 0.3223 0.2321 0.0280 -0.0089 0.0101 173 TYR L CA 1307 C C . TYR A 172 ? 0.3642 0.3035 0.2132 0.0249 -0.0136 0.0094 173 TYR L C 1308 O O . TYR A 172 ? 0.3631 0.2933 0.2018 0.0271 -0.0156 0.0079 173 TYR L O 1309 C CB . TYR A 172 ? 0.3231 0.2730 0.1841 0.0298 -0.0017 0.0086 173 TYR L CB 1310 C CG . TYR A 172 ? 0.3460 0.2978 0.2095 0.0320 0.0033 0.0095 173 TYR L CG 1311 C CD1 . TYR A 172 ? 0.2935 0.2406 0.1500 0.0363 0.0062 0.0090 173 TYR L CD1 1312 C CD2 . TYR A 172 ? 0.3937 0.3513 0.2659 0.0300 0.0055 0.0111 173 TYR L CD2 1313 C CE1 . TYR A 172 ? 0.3996 0.3480 0.2578 0.0379 0.0108 0.0101 173 TYR L CE1 1314 C CE2 . TYR A 172 ? 0.3596 0.3172 0.2329 0.0320 0.0101 0.0122 173 TYR L CE2 1315 C CZ . TYR A 172 ? 0.4093 0.3623 0.2757 0.0355 0.0127 0.0117 173 TYR L CZ 1316 O OH . TYR A 172 ? 0.4126 0.3652 0.2796 0.0370 0.0173 0.0131 173 TYR L OH 1317 N N . SER A 173 ? 0.3514 0.2988 0.2095 0.0203 -0.0150 0.0106 174 SER L N 1318 C CA . SER A 173 ? 0.3191 0.2671 0.1778 0.0171 -0.0180 0.0100 174 SER L CA 1319 C C . SER A 173 ? 0.3489 0.3092 0.2212 0.0157 -0.0138 0.0094 174 SER L C 1320 O O . SER A 173 ? 0.3475 0.3151 0.2282 0.0156 -0.0103 0.0103 174 SER L O 1321 C CB . SER A 173 ? 0.2520 0.1965 0.1057 0.0117 -0.0253 0.0124 174 SER L CB 1322 O OG . SER A 173 ? 0.3815 0.3118 0.2199 0.0125 -0.0297 0.0122 174 SER L OG 1323 N N . LEU A 174 ? 0.3715 0.3332 0.2449 0.0148 -0.0141 0.0080 175 LEU L N 1324 C CA . LEU A 174 ? 0.3304 0.3028 0.2151 0.0136 -0.0099 0.0069 175 LEU L CA 1325 C C . LEU A 174 ? 0.3747 0.3490 0.2602 0.0097 -0.0134 0.0071 175 LEU L C 1326 O O . LEU A 174 ? 0.3588 0.3253 0.2357 0.0101 -0.0172 0.0068 175 LEU L O 1327 C CB . LEU A 174 ? 0.3071 0.2817 0.1935 0.0175 -0.0046 0.0045 175 LEU L CB 1328 C CG . LEU A 174 ? 0.4063 0.3913 0.3032 0.0158 0.0001 0.0030 175 LEU L CG 1329 C CD1 . LEU A 174 ? 0.3386 0.3262 0.2376 0.0187 0.0057 0.0016 175 LEU L CD1 1330 C CD2 . LEU A 174 ? 0.3570 0.3450 0.2549 0.0142 -0.0017 0.0020 175 LEU L CD2 1331 N N . SER A 175 ? 0.3134 0.2972 0.2083 0.0064 -0.0121 0.0078 176 SER L N 1332 C CA . SER A 175 ? 0.3579 0.3450 0.2546 0.0027 -0.0144 0.0080 176 SER L CA 1333 C C . SER A 175 ? 0.3160 0.3115 0.2208 0.0030 -0.0093 0.0058 176 SER L C 1334 O O . SER A 175 ? 0.3203 0.3211 0.2316 0.0037 -0.0045 0.0050 176 SER L O 1335 C CB . SER A 175 ? 0.2932 0.2853 0.1934 -0.0021 -0.0175 0.0111 176 SER L CB 1336 O OG . SER A 175 ? 0.3686 0.3705 0.2788 -0.0018 -0.0128 0.0113 176 SER L OG 1337 N N . SER A 176 ? 0.2184 0.2141 0.1215 0.0023 -0.0107 0.0048 177 SER L N 1338 C CA . SER A 176 ? 0.2452 0.2493 0.1552 0.0013 -0.0071 0.0030 177 SER L CA 1339 C C . SER A 176 ? 0.3534 0.3605 0.2642 -0.0030 -0.0102 0.0042 177 SER L C 1340 O O . SER A 176 ? 0.3433 0.3442 0.2471 -0.0037 -0.0150 0.0054 177 SER L O 1341 C CB . SER A 176 ? 0.1940 0.1982 0.1022 0.0047 -0.0052 0.0009 177 SER L CB 1342 O OG . SER A 176 ? 0.3097 0.3227 0.2242 0.0027 -0.0025 -0.0006 177 SER L OG 1343 N N . THR A 177 ? 0.2962 0.3118 0.2146 -0.0057 -0.0075 0.0040 178 THR L N 1344 C CA . THR A 177 ? 0.2833 0.3032 0.2030 -0.0098 -0.0098 0.0055 178 THR L CA 1345 C C . THR A 177 ? 0.2699 0.2962 0.1934 -0.0108 -0.0069 0.0032 178 THR L C 1346 O O . THR A 177 ? 0.2530 0.2842 0.1818 -0.0104 -0.0020 0.0012 178 THR L O 1347 C CB . THR A 177 ? 0.2691 0.2947 0.1939 -0.0122 -0.0093 0.0079 178 THR L CB 1348 O OG1 . THR A 177 ? 0.3180 0.3387 0.2396 -0.0114 -0.0121 0.0101 178 THR L OG1 1349 C CG2 . THR A 177 ? 0.2913 0.3215 0.2167 -0.0168 -0.0123 0.0101 178 THR L CG2 1350 N N . LEU A 178 ? 0.3322 0.3575 0.2520 -0.0120 -0.0100 0.0036 179 LEU L N 1351 C CA . LEU A 178 ? 0.3183 0.3502 0.2409 -0.0135 -0.0081 0.0019 179 LEU L CA 1352 C C . LEU A 178 ? 0.2906 0.3279 0.2157 -0.0179 -0.0088 0.0036 179 LEU L C 1353 O O . LEU A 178 ? 0.3159 0.3505 0.2374 -0.0203 -0.0132 0.0065 179 LEU L O 1354 C CB . LEU A 178 ? 0.3503 0.3789 0.2674 -0.0116 -0.0110 0.0018 179 LEU L CB 1355 C CG . LEU A 178 ? 0.3773 0.4128 0.2961 -0.0131 -0.0103 0.0007 179 LEU L CG 1356 C CD1 . LEU A 178 ? 0.3259 0.3683 0.2499 -0.0123 -0.0055 -0.0023 179 LEU L CD1 1357 C CD2 . LEU A 178 ? 0.2757 0.3063 0.1874 -0.0108 -0.0145 0.0021 179 LEU L CD2 1358 N N . THR A 179 ? 0.2455 0.2902 0.1760 -0.0192 -0.0044 0.0018 180 THR L N 1359 C CA . THR A 179 ? 0.2999 0.3507 0.2329 -0.0227 -0.0041 0.0033 180 THR L CA 1360 C C . THR A 179 ? 0.2958 0.3511 0.2283 -0.0249 -0.0036 0.0018 180 THR L C 1361 O O . THR A 179 ? 0.3471 0.4049 0.2811 -0.0244 -0.0001 -0.0015 180 THR L O 1362 C CB . THR A 179 ? 0.4127 0.4679 0.3510 -0.0220 0.0008 0.0028 180 THR L CB 1363 O OG1 . THR A 179 ? 0.4160 0.4677 0.3548 -0.0198 0.0001 0.0045 180 THR L OG1 1364 C CG2 . THR A 179 ? 0.3785 0.4411 0.3192 -0.0249 0.0013 0.0050 180 THR L CG2 1365 N N . LEU A 180 ? 0.3203 0.3765 0.2500 -0.0278 -0.0073 0.0043 181 LEU L N 1366 C CA . LEU A 180 ? 0.2254 0.2860 0.1540 -0.0300 -0.0072 0.0035 181 LEU L CA 1367 C C . LEU A 180 ? 0.1978 0.2641 0.1275 -0.0339 -0.0073 0.0060 181 LEU L C 1368 O O . LEU A 180 ? 0.3068 0.3731 0.2371 -0.0353 -0.0091 0.0093 181 LEU L O 1369 C CB . LEU A 180 ? 0.3209 0.3766 0.2435 -0.0293 -0.0119 0.0045 181 LEU L CB 1370 C CG . LEU A 180 ? 0.4468 0.4968 0.3672 -0.0247 -0.0126 0.0032 181 LEU L CG 1371 C CD1 . LEU A 180 ? 0.4963 0.5407 0.4096 -0.0232 -0.0173 0.0050 181 LEU L CD1 1372 C CD2 . LEU A 180 ? 0.4194 0.4751 0.3441 -0.0234 -0.0082 -0.0005 181 LEU L CD2 1373 N N . SER A 181 ? 0.2423 0.3143 0.1721 -0.0359 -0.0053 0.0046 182 SER L N 1374 C CA . SER A 181 ? 0.2919 0.3697 0.2217 -0.0396 -0.0056 0.0074 182 SER L CA 1375 C C . SER A 181 ? 0.3315 0.4050 0.2558 -0.0421 -0.0118 0.0112 182 SER L C 1376 O O . SER A 181 ? 0.2492 0.3157 0.1690 -0.0403 -0.0151 0.0108 182 SER L O 1377 C CB . SER A 181 ? 0.2943 0.3780 0.2241 -0.0409 -0.0020 0.0046 182 SER L CB 1378 O OG . SER A 181 ? 0.3073 0.3895 0.2330 -0.0414 -0.0046 0.0036 182 SER L OG 1379 N N . LYS A 182 ? 0.2524 0.3299 0.1765 -0.0462 -0.0132 0.0150 183 LYS L N 1380 C CA . LYS A 182 ? 0.3051 0.3774 0.2228 -0.0497 -0.0191 0.0190 183 LYS L CA 1381 C C . LYS A 182 ? 0.3078 0.3774 0.2201 -0.0493 -0.0207 0.0179 183 LYS L C 1382 O O . LYS A 182 ? 0.3459 0.4062 0.2515 -0.0485 -0.0253 0.0192 183 LYS L O 1383 C CB . LYS A 182 ? 0.3718 0.4515 0.2910 -0.0550 -0.0195 0.0234 183 LYS L CB 1384 C CG . LYS A 182 ? 0.3270 0.4012 0.2386 -0.0600 -0.0253 0.0278 183 LYS L CG 1385 C CD . LYS A 182 ? 0.4243 0.5084 0.3385 -0.0659 -0.0250 0.0324 183 LYS L CD 1386 C CE . LYS A 182 ? 0.4650 0.5434 0.3709 -0.0718 -0.0306 0.0370 183 LYS L CE 1387 N NZ . LYS A 182 ? 0.4372 0.5278 0.3462 -0.0778 -0.0295 0.0416 183 LYS L NZ 1388 N N . ALA A 183 ? 0.2498 0.3274 0.1643 -0.0497 -0.0170 0.0156 184 ALA L N 1389 C CA . ALA A 183 ? 0.3113 0.3885 0.2212 -0.0496 -0.0185 0.0148 184 ALA L CA 1390 C C . ALA A 183 ? 0.3137 0.3853 0.2220 -0.0448 -0.0199 0.0124 184 ALA L C 1391 O O . ALA A 183 ? 0.3604 0.4267 0.2627 -0.0435 -0.0239 0.0140 184 ALA L O 1392 C CB . ALA A 183 ? 0.2197 0.3064 0.1319 -0.0510 -0.0140 0.0121 184 ALA L CB 1393 N N . ASP A 184 ? 0.2689 0.3417 0.1821 -0.0420 -0.0164 0.0089 185 ASP L N 1394 C CA . ASP A 184 ? 0.2591 0.3287 0.1720 -0.0375 -0.0169 0.0068 185 ASP L CA 1395 C C . ASP A 184 ? 0.3804 0.4393 0.2881 -0.0347 -0.0214 0.0094 185 ASP L C 1396 O O . ASP A 184 ? 0.3762 0.4314 0.2796 -0.0311 -0.0239 0.0097 185 ASP L O 1397 C CB . ASP A 184 ? 0.2598 0.3318 0.1786 -0.0359 -0.0121 0.0030 185 ASP L CB 1398 C CG . ASP A 184 ? 0.5349 0.6078 0.4544 -0.0326 -0.0116 0.0005 185 ASP L CG 1399 O OD1 . ASP A 184 ? 0.6298 0.7015 0.5456 -0.0304 -0.0150 0.0018 185 ASP L OD1 1400 O OD2 . ASP A 184 ? 0.6782 0.7533 0.6019 -0.0321 -0.0076 -0.0026 185 ASP L OD2 1401 N N . TYR A 185 ? 0.3503 0.4042 0.2577 -0.0360 -0.0225 0.0113 186 TYR L N 1402 C CA . TYR A 185 ? 0.3282 0.3701 0.2289 -0.0340 -0.0269 0.0135 186 TYR L CA 1403 C C . TYR A 185 ? 0.3439 0.3791 0.2357 -0.0348 -0.0316 0.0166 186 TYR L C 1404 O O . TYR A 185 ? 0.3464 0.3725 0.2314 -0.0304 -0.0343 0.0171 186 TYR L O 1405 C CB . TYR A 185 ? 0.2526 0.2916 0.1542 -0.0369 -0.0278 0.0156 186 TYR L CB 1406 C CG . TYR A 185 ? 0.3341 0.3590 0.2266 -0.0362 -0.0330 0.0180 186 TYR L CG 1407 C CD1 . TYR A 185 ? 0.3156 0.3329 0.2055 -0.0308 -0.0331 0.0162 186 TYR L CD1 1408 C CD2 . TYR A 185 ? 0.3005 0.3189 0.1860 -0.0413 -0.0377 0.0220 186 TYR L CD2 1409 C CE1 . TYR A 185 ? 0.2918 0.2945 0.1716 -0.0299 -0.0377 0.0180 186 TYR L CE1 1410 C CE2 . TYR A 185 ? 0.3306 0.3338 0.2058 -0.0413 -0.0426 0.0239 186 TYR L CE2 1411 C CZ . TYR A 185 ? 0.3436 0.3385 0.2156 -0.0353 -0.0426 0.0217 186 TYR L CZ 1412 O OH . TYR A 185 ? 0.3853 0.3636 0.2453 -0.0350 -0.0473 0.0233 186 TYR L OH 1413 N N . GLU A 186 ? 0.3101 0.3498 0.2014 -0.0399 -0.0323 0.0188 187 GLU L N 1414 C CA . GLU A 186 ? 0.3582 0.3904 0.2402 -0.0415 -0.0369 0.0224 187 GLU L CA 1415 C C . GLU A 186 ? 0.3880 0.4225 0.2674 -0.0379 -0.0372 0.0216 187 GLU L C 1416 O O . GLU A 186 ? 0.4443 0.4719 0.3153 -0.0382 -0.0409 0.0247 187 GLU L O 1417 C CB . GLU A 186 ? 0.3963 0.4329 0.2785 -0.0489 -0.0376 0.0257 187 GLU L CB 1418 C CG . GLU A 186 ? 0.5613 0.5911 0.4409 -0.0531 -0.0405 0.0288 187 GLU L CG 1419 C CD . GLU A 186 ? 0.8714 0.9099 0.7541 -0.0606 -0.0401 0.0322 187 GLU L CD 1420 O OE1 . GLU A 186 ? 0.9096 0.9579 0.7953 -0.0621 -0.0376 0.0321 187 GLU L OE1 1421 O OE2 . GLU A 186 ? 1.0327 1.0688 0.9147 -0.0649 -0.0425 0.0351 187 GLU L OE2 1422 N N . LYS A 187 ? 0.3569 0.4009 0.2430 -0.0347 -0.0335 0.0179 188 LYS L N 1423 C CA . LYS A 187 ? 0.4074 0.4550 0.2914 -0.0313 -0.0343 0.0177 188 LYS L CA 1424 C C . LYS A 187 ? 0.3340 0.3765 0.2158 -0.0237 -0.0351 0.0169 188 LYS L C 1425 O O . LYS A 187 ? 0.3800 0.4270 0.2609 -0.0197 -0.0357 0.0170 188 LYS L O 1426 C CB . LYS A 187 ? 0.4198 0.4820 0.3111 -0.0335 -0.0303 0.0146 188 LYS L CB 1427 C CG . LYS A 187 ? 0.5675 0.6356 0.4670 -0.0329 -0.0257 0.0104 188 LYS L CG 1428 C CD . LYS A 187 ? 0.6589 0.7389 0.5628 -0.0356 -0.0224 0.0073 188 LYS L CD 1429 C CE . LYS A 187 ? 0.7065 0.7903 0.6089 -0.0409 -0.0220 0.0083 188 LYS L CE 1430 N NZ . LYS A 187 ? 0.7528 0.8465 0.6578 -0.0437 -0.0186 0.0049 188 LYS L NZ 1431 N N . HIS A 188 ? 0.2785 0.3122 0.1590 -0.0216 -0.0353 0.0165 189 HIS L N 1432 C CA . HIS A 188 ? 0.3111 0.3395 0.1887 -0.0139 -0.0357 0.0160 189 HIS L CA 1433 C C . HIS A 188 ? 0.3697 0.3798 0.2360 -0.0116 -0.0396 0.0185 189 HIS L C 1434 O O . HIS A 188 ? 0.3749 0.3775 0.2376 -0.0170 -0.0417 0.0202 189 HIS L O 1435 C CB . HIS A 188 ? 0.2853 0.3207 0.1717 -0.0124 -0.0313 0.0124 189 HIS L CB 1436 C CG . HIS A 188 ? 0.3696 0.4206 0.2649 -0.0144 -0.0277 0.0097 189 HIS L CG 1437 N ND1 . HIS A 188 ? 0.3645 0.4239 0.2608 -0.0112 -0.0277 0.0096 189 HIS L ND1 1438 C CD2 . HIS A 188 ? 0.3927 0.4519 0.2954 -0.0196 -0.0241 0.0072 189 HIS L CD2 1439 C CE1 . HIS A 188 ? 0.3811 0.4530 0.2848 -0.0152 -0.0246 0.0070 189 HIS L CE1 1440 N NE2 . HIS A 188 ? 0.4116 0.4824 0.3185 -0.0200 -0.0222 0.0052 189 HIS L NE2 1441 N N . LYS A 189 ? 0.3980 0.4011 0.2583 -0.0035 -0.0405 0.0188 190 LYS L N 1442 C CA . LYS A 189 ? 0.3817 0.3649 0.2283 -0.0005 -0.0443 0.0210 190 LYS L CA 1443 C C . LYS A 189 ? 0.4096 0.3854 0.2546 0.0038 -0.0431 0.0191 190 LYS L C 1444 O O . LYS A 189 ? 0.5163 0.4795 0.3550 0.0007 -0.0454 0.0197 190 LYS L O 1445 C CB . LYS A 189 ? 0.3970 0.3739 0.2341 0.0067 -0.0467 0.0234 190 LYS L CB 1446 C CG . LYS A 189 ? 0.6354 0.5887 0.4557 0.0107 -0.0505 0.0255 190 LYS L CG 1447 C CD . LYS A 189 ? 0.8240 0.7719 0.6355 0.0209 -0.0515 0.0276 190 LYS L CD 1448 C CE . LYS A 189 ? 0.9060 0.8284 0.6994 0.0267 -0.0544 0.0289 190 LYS L CE 1449 N NZ . LYS A 189 ? 1.0562 0.9605 0.8377 0.0186 -0.0592 0.0313 190 LYS L NZ 1450 N N . VAL A 190 ? 0.3432 0.3273 0.1935 0.0106 -0.0398 0.0171 191 VAL L N 1451 C CA . VAL A 190 ? 0.3398 0.3166 0.1872 0.0159 -0.0384 0.0156 191 VAL L CA 1452 C C . VAL A 190 ? 0.3236 0.3106 0.1826 0.0123 -0.0346 0.0127 191 VAL L C 1453 O O . VAL A 190 ? 0.3289 0.3321 0.1993 0.0113 -0.0310 0.0110 191 VAL L O 1454 C CB . VAL A 190 ? 0.3582 0.3372 0.2034 0.0267 -0.0368 0.0157 191 VAL L CB 1455 C CG1 . VAL A 190 ? 0.3139 0.2844 0.1548 0.0324 -0.0352 0.0143 191 VAL L CG1 1456 C CG2 . VAL A 190 ? 0.3664 0.3346 0.1993 0.0318 -0.0403 0.0188 191 VAL L CG2 1457 N N . TYR A 191 ? 0.2872 0.2639 0.1424 0.0104 -0.0355 0.0124 192 TYR L N 1458 C CA . TYR A 191 ? 0.3147 0.2988 0.1792 0.0079 -0.0321 0.0101 192 TYR L CA 1459 C C . TYR A 191 ? 0.3923 0.3676 0.2512 0.0142 -0.0312 0.0092 192 TYR L C 1460 O O . TYR A 191 ? 0.4139 0.3726 0.2605 0.0158 -0.0346 0.0103 192 TYR L O 1461 C CB . TYR A 191 ? 0.2587 0.2416 0.1253 -0.0006 -0.0337 0.0109 192 TYR L CB 1462 C CG . TYR A 191 ? 0.3578 0.3520 0.2314 -0.0063 -0.0331 0.0114 192 TYR L CG 1463 C CD1 . TYR A 191 ? 0.3373 0.3268 0.2043 -0.0087 -0.0368 0.0140 192 TYR L CD1 1464 C CD2 . TYR A 191 ? 0.2818 0.2906 0.1674 -0.0089 -0.0287 0.0093 192 TYR L CD2 1465 C CE1 . TYR A 191 ? 0.3227 0.3229 0.1957 -0.0137 -0.0361 0.0145 192 TYR L CE1 1466 C CE2 . TYR A 191 ? 0.3093 0.3277 0.2000 -0.0137 -0.0279 0.0095 192 TYR L CE2 1467 C CZ . TYR A 191 ? 0.3093 0.3240 0.1939 -0.0160 -0.0315 0.0121 192 TYR L CZ 1468 O OH . TYR A 191 ? 0.3816 0.4059 0.2707 -0.0207 -0.0306 0.0124 192 TYR L OH 1469 N N . ALA A 192 ? 0.3170 0.3029 0.1841 0.0174 -0.0267 0.0072 193 ALA L N 1470 C CA . ALA A 192 ? 0.2927 0.2721 0.1551 0.0240 -0.0251 0.0064 193 ALA L CA 1471 C C . ALA A 192 ? 0.3278 0.3162 0.1999 0.0222 -0.0209 0.0044 193 ALA L C 1472 O O . ALA A 192 ? 0.3283 0.3309 0.2117 0.0186 -0.0178 0.0033 193 ALA L O 1473 C CB . ALA A 192 ? 0.3171 0.2995 0.1768 0.0329 -0.0237 0.0069 193 ALA L CB 1474 N N . CYS A 193 ? 0.2907 0.2697 0.1575 0.0243 -0.0208 0.0040 194 CYS L N 1475 C CA . CYS A 193 ? 0.3179 0.3046 0.1925 0.0246 -0.0163 0.0024 194 CYS L CA 1476 C C . CYS A 193 ? 0.3434 0.3259 0.2120 0.0331 -0.0144 0.0022 194 CYS L C 1477 O O . CYS A 193 ? 0.3408 0.3085 0.1965 0.0375 -0.0171 0.0029 194 CYS L O 1478 C CB . CYS A 193 ? 0.3716 0.3542 0.2475 0.0192 -0.0171 0.0024 194 CYS L CB 1479 S SG . CYS A 193 ? 0.6711 0.6350 0.5331 0.0210 -0.0210 0.0032 194 CYS L SG 1480 N N . GLU A 194 ? 0.3077 0.3032 0.1848 0.0351 -0.0095 0.0013 195 GLU L N 1481 C CA . GLU A 194 ? 0.3751 0.3706 0.2484 0.0433 -0.0068 0.0014 195 GLU L CA 1482 C C . GLU A 194 ? 0.4128 0.4097 0.2896 0.0424 -0.0033 0.0005 195 GLU L C 1483 O O . GLU A 194 ? 0.3838 0.3913 0.2711 0.0371 -0.0004 -0.0004 195 GLU L O 1484 C CB . GLU A 194 ? 0.4534 0.4646 0.3336 0.0466 -0.0040 0.0020 195 GLU L CB 1485 C CG . GLU A 194 ? 0.5527 0.5670 0.4302 0.0556 -0.0006 0.0027 195 GLU L CG 1486 C CD . GLU A 194 ? 0.6459 0.6785 0.5311 0.0586 0.0018 0.0040 195 GLU L CD 1487 O OE1 . GLU A 194 ? 0.5819 0.6245 0.4747 0.0531 0.0007 0.0040 195 GLU L OE1 1488 O OE2 . GLU A 194 ? 0.7403 0.7780 0.6240 0.0666 0.0047 0.0052 195 GLU L OE2 1489 N N . VAL A 195 ? 0.3572 0.3423 0.2239 0.0477 -0.0035 0.0006 196 VAL L N 1490 C CA . VAL A 195 ? 0.3871 0.3714 0.2551 0.0470 -0.0007 0.0000 196 VAL L CA 1491 C C . VAL A 195 ? 0.4098 0.3986 0.2764 0.0545 0.0038 0.0003 196 VAL L C 1492 O O . VAL A 195 ? 0.3697 0.3510 0.2261 0.0624 0.0033 0.0008 196 VAL L O 1493 C CB . VAL A 195 ? 0.3492 0.3165 0.2066 0.0457 -0.0047 0.0001 196 VAL L CB 1494 C CG1 . VAL A 195 ? 0.2904 0.2570 0.1485 0.0458 -0.0018 -0.0002 196 VAL L CG1 1495 C CG2 . VAL A 195 ? 0.3246 0.2902 0.1849 0.0377 -0.0087 0.0004 196 VAL L CG2 1496 N N . THR A 196 ? 0.3449 0.3456 0.2214 0.0520 0.0084 0.0000 197 THR L N 1497 C CA . THR A 196 ? 0.3736 0.3802 0.2499 0.0578 0.0131 0.0007 197 THR L CA 1498 C C . THR A 196 ? 0.3610 0.3609 0.2349 0.0564 0.0148 0.0003 197 THR L C 1499 O O . THR A 196 ? 0.3646 0.3660 0.2449 0.0495 0.0151 -0.0002 197 THR L O 1500 C CB . THR A 196 ? 0.3782 0.4050 0.2673 0.0556 0.0172 0.0012 197 THR L CB 1501 O OG1 . THR A 196 ? 0.4259 0.4593 0.3167 0.0573 0.0153 0.0018 197 THR L OG1 1502 C CG2 . THR A 196 ? 0.3874 0.4222 0.2770 0.0611 0.0223 0.0024 197 THR L CG2 1503 N N . HIS A 197 ? 0.3507 0.3427 0.2146 0.0635 0.0159 0.0008 198 HIS L N 1504 C CA . HIS A 197 ? 0.3597 0.3443 0.2195 0.0629 0.0171 0.0007 198 HIS L CA 1505 C C . HIS A 197 ? 0.3620 0.3447 0.2135 0.0717 0.0206 0.0014 198 HIS L C 1506 O O . HIS A 197 ? 0.3420 0.3202 0.1849 0.0793 0.0200 0.0016 198 HIS L O 1507 C CB . HIS A 197 ? 0.2930 0.2610 0.1439 0.0600 0.0115 0.0002 198 HIS L CB 1508 C CG . HIS A 197 ? 0.3001 0.2612 0.1470 0.0591 0.0122 0.0004 198 HIS L CG 1509 N ND1 . HIS A 197 ? 0.3545 0.3041 0.1880 0.0651 0.0121 0.0005 198 HIS L ND1 1510 C CD2 . HIS A 197 ? 0.2552 0.2191 0.1089 0.0532 0.0130 0.0008 198 HIS L CD2 1511 C CE1 . HIS A 197 ? 0.3746 0.3210 0.2075 0.0626 0.0126 0.0010 198 HIS L CE1 1512 N NE2 . HIS A 197 ? 0.2947 0.2497 0.1399 0.0556 0.0132 0.0013 198 HIS L NE2 1513 N N . GLN A 198 ? 0.3529 0.3384 0.2063 0.0711 0.0245 0.0020 199 GLN L N 1514 C CA . GLN A 198 ? 0.3365 0.3224 0.1831 0.0790 0.0288 0.0030 199 GLN L CA 1515 C C . GLN A 198 ? 0.4037 0.3712 0.2323 0.0868 0.0260 0.0023 199 GLN L C 1516 O O . GLN A 198 ? 0.4376 0.4049 0.2588 0.0956 0.0293 0.0029 199 GLN L O 1517 C CB . GLN A 198 ? 0.3840 0.3723 0.2338 0.0757 0.0325 0.0037 199 GLN L CB 1518 C CG . GLN A 198 ? 0.6168 0.6106 0.4629 0.0827 0.0382 0.0052 199 GLN L CG 1519 C CD . GLN A 198 ? 0.7518 0.7487 0.6016 0.0787 0.0421 0.0064 199 GLN L CD 1520 O OE1 . GLN A 198 ? 0.8752 0.8866 0.7326 0.0782 0.0476 0.0081 199 GLN L OE1 1521 N NE2 . GLN A 198 ? 0.6567 0.6403 0.5008 0.0756 0.0392 0.0058 199 GLN L NE2 1522 N N . GLY A 199 ? 0.4428 0.3948 0.2637 0.0834 0.0200 0.0011 200 GLY L N 1523 C CA . GLY A 199 ? 0.4292 0.3611 0.2312 0.0891 0.0165 0.0002 200 GLY L CA 1524 C C . GLY A 199 ? 0.4515 0.3772 0.2458 0.0948 0.0142 -0.0002 200 GLY L C 1525 O O . GLY A 199 ? 0.4419 0.3496 0.2187 0.1007 0.0119 -0.0010 200 GLY L O 1526 N N . LEU A 200 ? 0.4690 0.4086 0.2754 0.0931 0.0148 0.0005 201 LEU L N 1527 C CA . LEU A 200 ? 0.4742 0.4092 0.2744 0.0985 0.0126 0.0005 201 LEU L CA 1528 C C . LEU A 200 ? 0.5302 0.4787 0.3333 0.1083 0.0183 0.0020 201 LEU L C 1529 O O . LEU A 200 ? 0.5173 0.4860 0.3346 0.1068 0.0231 0.0032 201 LEU L O 1530 C CB . LEU A 200 ? 0.4470 0.3882 0.2577 0.0904 0.0089 0.0006 201 LEU L CB 1531 C CG . LEU A 200 ? 0.4275 0.3575 0.2362 0.0809 0.0032 -0.0003 201 LEU L CG 1532 C CD1 . LEU A 200 ? 0.3010 0.2417 0.1229 0.0728 0.0012 0.0000 201 LEU L CD1 1533 C CD2 . LEU A 200 ? 0.4019 0.3080 0.1909 0.0833 -0.0022 -0.0009 201 LEU L CD2 1534 N N . SER A 201 ? 0.5048 0.4425 0.2942 0.1183 0.0177 0.0022 202 SER L N 1535 C CA . SER A 201 ? 0.5161 0.4675 0.3078 0.1291 0.0231 0.0042 202 SER L CA 1536 C C . SER A 201 ? 0.5176 0.4901 0.3260 0.1259 0.0233 0.0058 202 SER L C 1537 O O . SER A 201 ? 0.6092 0.6030 0.4283 0.1297 0.0283 0.0079 202 SER L O 1538 C CB . SER A 201 ? 0.5071 0.4394 0.2782 0.1416 0.0224 0.0040 202 SER L CB 1539 O OG . SER A 201 ? 0.6251 0.5420 0.3883 0.1394 0.0162 0.0033 202 SER L OG 1540 N N . SER A 202 ? 0.4255 0.3927 0.2361 0.1183 0.0179 0.0049 203 SER L N 1541 C CA . SER A 202 ? 0.4257 0.4113 0.2513 0.1137 0.0174 0.0061 203 SER L CA 1542 C C . SER A 202 ? 0.4570 0.4362 0.2864 0.1019 0.0121 0.0046 203 SER L C 1543 O O . SER A 202 ? 0.4943 0.4541 0.3130 0.0989 0.0082 0.0031 203 SER L O 1544 C CB . SER A 202 ? 0.4423 0.4288 0.2623 0.1239 0.0171 0.0080 203 SER L CB 1545 O OG . SER A 202 ? 0.5596 0.5214 0.3630 0.1261 0.0119 0.0070 203 SER L OG 1546 N N . PRO A 203 ? 0.5353 0.5315 0.3797 0.0949 0.0119 0.0051 204 PRO L N 1547 C CA . PRO A 203 ? 0.5292 0.5207 0.3774 0.0841 0.0074 0.0038 204 PRO L CA 1548 C C . PRO A 203 ? 0.5025 0.4739 0.3370 0.0851 0.0017 0.0036 204 PRO L C 1549 O O . PRO A 203 ? 0.5853 0.5526 0.4123 0.0926 0.0007 0.0048 204 PRO L O 1550 C CB . PRO A 203 ? 0.4893 0.5018 0.3527 0.0795 0.0085 0.0046 204 PRO L CB 1551 C CG . PRO A 203 ? 0.4994 0.5298 0.3708 0.0834 0.0143 0.0058 204 PRO L CG 1552 C CD . PRO A 203 ? 0.4762 0.4974 0.3349 0.0954 0.0160 0.0068 204 PRO L CD 1553 N N . VAL A 204 ? 0.5353 0.4945 0.3664 0.0774 -0.0021 0.0024 205 VAL L N 1554 C CA . VAL A 204 ? 0.4809 0.4208 0.2990 0.0761 -0.0080 0.0024 205 VAL L CA 1555 C C . VAL A 204 ? 0.4636 0.4098 0.2905 0.0670 -0.0112 0.0027 205 VAL L C 1556 O O . VAL A 204 ? 0.4511 0.4081 0.2904 0.0591 -0.0101 0.0021 205 VAL L O 1557 C CB . VAL A 204 ? 0.5295 0.4510 0.3360 0.0735 -0.0108 0.0014 205 VAL L CB 1558 C CG1 . VAL A 204 ? 0.5143 0.4174 0.3087 0.0691 -0.0175 0.0017 205 VAL L CG1 1559 C CG2 . VAL A 204 ? 0.5309 0.4431 0.3253 0.0832 -0.0081 0.0010 205 VAL L CG2 1560 N N . THR A 205 ? 0.4845 0.4231 0.3043 0.0684 -0.0147 0.0038 206 THR L N 1561 C CA . THR A 205 ? 0.4650 0.4093 0.2921 0.0602 -0.0176 0.0044 206 THR L CA 1562 C C . THR A 205 ? 0.4708 0.3953 0.2849 0.0560 -0.0237 0.0050 206 THR L C 1563 O O . THR A 205 ? 0.4559 0.3629 0.2540 0.0617 -0.0261 0.0055 206 THR L O 1564 C CB . THR A 205 ? 0.4871 0.4438 0.3196 0.0641 -0.0166 0.0057 206 THR L CB 1565 O OG1 . THR A 205 ? 0.5476 0.5236 0.3918 0.0673 -0.0112 0.0055 206 THR L OG1 1566 C CG2 . THR A 205 ? 0.4682 0.4317 0.3084 0.0553 -0.0192 0.0061 206 THR L CG2 1567 N N . LYS A 206 ? 0.4903 0.4174 0.3108 0.0458 -0.0260 0.0049 207 LYS L N 1568 C CA . LYS A 206 ? 0.4303 0.3424 0.2409 0.0398 -0.0319 0.0061 207 LYS L CA 1569 C C . LYS A 206 ? 0.5107 0.4334 0.3301 0.0338 -0.0331 0.0073 207 LYS L C 1570 O O . LYS A 206 ? 0.4918 0.4322 0.3264 0.0299 -0.0301 0.0067 207 LYS L O 1571 C CB . LYS A 206 ? 0.4212 0.3282 0.2312 0.0328 -0.0339 0.0058 207 LYS L CB 1572 C CG . LYS A 206 ? 0.4918 0.3864 0.2909 0.0380 -0.0335 0.0047 207 LYS L CG 1573 C CD . LYS A 206 ? 0.5394 0.4107 0.3175 0.0427 -0.0373 0.0051 207 LYS L CD 1574 C CE . LYS A 206 ? 0.6749 0.5327 0.4406 0.0477 -0.0368 0.0037 207 LYS L CE 1575 N NZ . LYS A 206 ? 0.7402 0.5729 0.4833 0.0529 -0.0402 0.0037 207 LYS L NZ 1576 N N . SER A 207 ? 0.4549 0.3657 0.2638 0.0331 -0.0374 0.0090 208 SER L N 1577 C CA . SER A 207 ? 0.5021 0.4227 0.3184 0.0280 -0.0384 0.0104 208 SER L CA 1578 C C . SER A 207 ? 0.4313 0.3370 0.2363 0.0221 -0.0442 0.0126 208 SER L C 1579 O O . SER A 207 ? 0.4936 0.3790 0.2827 0.0229 -0.0479 0.0132 208 SER L O 1580 C CB . SER A 207 ? 0.4425 0.3726 0.2620 0.0355 -0.0358 0.0107 208 SER L CB 1581 O OG . SER A 207 ? 0.5260 0.4403 0.3302 0.0444 -0.0373 0.0116 208 SER L OG 1582 N N . PHE A 208 ? 0.3791 0.2949 0.1919 0.0157 -0.0451 0.0139 209 PHE L N 1583 C CA . PHE A 208 ? 0.4209 0.3247 0.2238 0.0099 -0.0503 0.0166 209 PHE L CA 1584 C C . PHE A 208 ? 0.4507 0.3661 0.2602 0.0087 -0.0497 0.0179 209 PHE L C 1585 O O . PHE A 208 ? 0.3601 0.2945 0.1836 0.0099 -0.0455 0.0165 209 PHE L O 1586 C CB . PHE A 208 ? 0.3235 0.2260 0.1278 -0.0007 -0.0532 0.0177 209 PHE L CB 1587 C CG . PHE A 208 ? 0.3426 0.2667 0.1651 -0.0066 -0.0501 0.0173 209 PHE L CG 1588 C CD1 . PHE A 208 ? 0.3727 0.3061 0.2009 -0.0122 -0.0506 0.0190 209 PHE L CD1 1589 C CD2 . PHE A 208 ? 0.3156 0.2497 0.1483 -0.0062 -0.0465 0.0153 209 PHE L CD2 1590 C CE1 . PHE A 208 ? 0.3352 0.2870 0.1785 -0.0168 -0.0473 0.0185 209 PHE L CE1 1591 C CE2 . PHE A 208 ? 0.2943 0.2461 0.1418 -0.0108 -0.0434 0.0149 209 PHE L CE2 1592 C CZ . PHE A 208 ? 0.3511 0.3117 0.2039 -0.0159 -0.0436 0.0163 209 PHE L CZ 1593 N N . ASN A 209 ? 0.4253 0.3286 0.2238 0.0060 -0.0540 0.0207 210 ASN L N 1594 C CA . ASN A 209 ? 0.4440 0.3570 0.2475 0.0031 -0.0543 0.0225 210 ASN L CA 1595 C C . ASN A 209 ? 0.4682 0.3842 0.2750 -0.0087 -0.0567 0.0244 210 ASN L C 1596 O O . ASN A 209 ? 0.5253 0.4267 0.3220 -0.0141 -0.0608 0.0260 210 ASN L O 1597 C CB . ASN A 209 ? 0.5533 0.4513 0.3419 0.0089 -0.0571 0.0248 210 ASN L CB 1598 C CG . ASN A 209 ? 0.5945 0.4900 0.3792 0.0217 -0.0546 0.0236 210 ASN L CG 1599 O OD1 . ASN A 209 ? 0.6575 0.5713 0.4551 0.0261 -0.0502 0.0218 210 ASN L OD1 1600 N ND2 . ASN A 209 ? 0.6294 0.5020 0.3957 0.0276 -0.0573 0.0246 210 ASN L ND2 1601 N N . ARG A 210 ? 0.4625 0.3976 0.2831 -0.0128 -0.0540 0.0242 211 ARG L N 1602 C CA . ARG A 210 ? 0.5158 0.4568 0.3408 -0.0232 -0.0555 0.0263 211 ARG L CA 1603 C C . ARG A 210 ? 0.6290 0.5551 0.4402 -0.0278 -0.0608 0.0303 211 ARG L C 1604 O O . ARG A 210 ? 0.5963 0.5156 0.4028 -0.0360 -0.0644 0.0327 211 ARG L O 1605 C CB . ARG A 210 ? 0.4582 0.4207 0.2980 -0.0252 -0.0513 0.0252 211 ARG L CB 1606 C CG . ARG A 210 ? 0.4694 0.4394 0.3137 -0.0348 -0.0521 0.0276 211 ARG L CG 1607 C CD . ARG A 210 ? 0.4403 0.4293 0.2967 -0.0357 -0.0477 0.0262 211 ARG L CD 1608 N NE . ARG A 210 ? 0.4661 0.4566 0.3202 -0.0306 -0.0473 0.0257 211 ARG L NE 1609 C CZ . ARG A 210 ? 0.4929 0.4780 0.3390 -0.0319 -0.0504 0.0288 211 ARG L CZ 1610 N NH1 . ARG A 210 ? 0.5204 0.4976 0.3596 -0.0389 -0.0541 0.0325 211 ARG L NH1 1611 N NH2 . ARG A 210 ? 0.3671 0.3553 0.2120 -0.0266 -0.0500 0.0285 211 ARG L NH2 1612 O OXT . ARG A 210 ? 0.6308 0.5514 0.4350 -0.0236 -0.0619 0.0314 211 ARG L OXT 1613 N N . GLN B 1 ? 0.8346 0.8488 0.7748 -0.0084 -0.0173 0.0220 1 GLN H N 1614 C CA . GLN B 1 ? 0.7186 0.7250 0.6612 -0.0047 -0.0120 0.0183 1 GLN H CA 1615 C C . GLN B 1 ? 0.5778 0.5902 0.5336 -0.0018 -0.0122 0.0191 1 GLN H C 1616 O O . GLN B 1 ? 0.4571 0.4783 0.4189 -0.0034 -0.0158 0.0217 1 GLN H O 1617 C CB . GLN B 1 ? 0.8178 0.8135 0.7490 -0.0086 -0.0098 0.0132 1 GLN H CB 1618 C CG . GLN B 1 ? 0.8952 0.8806 0.8238 -0.0048 -0.0035 0.0104 1 GLN H CG 1619 C CD . GLN B 1 ? 0.9877 0.9689 0.9099 -0.0028 -0.0011 0.0118 1 GLN H CD 1620 O OE1 . GLN B 1 ? 0.9349 0.9209 0.8543 -0.0040 -0.0042 0.0148 1 GLN H OE1 1621 N NE2 . GLN B 1 ? 1.1054 1.0780 1.0259 0.0006 0.0047 0.0102 1 GLN H NE2 1622 N N . VAL B 2 ? 0.4878 0.4953 0.4478 0.0026 -0.0081 0.0170 2 VAL H N 1623 C CA . VAL B 2 ? 0.3614 0.3734 0.3327 0.0065 -0.0077 0.0177 2 VAL H CA 1624 C C . VAL B 2 ? 0.4236 0.4299 0.3943 0.0066 -0.0052 0.0140 2 VAL H C 1625 O O . VAL B 2 ? 0.4814 0.4793 0.4466 0.0069 -0.0020 0.0112 2 VAL H O 1626 C CB . VAL B 2 ? 0.3266 0.3390 0.3048 0.0121 -0.0059 0.0194 2 VAL H CB 1627 C CG1 . VAL B 2 ? 0.3991 0.4149 0.3873 0.0158 -0.0056 0.0197 2 VAL H CG1 1628 C CG2 . VAL B 2 ? 0.2865 0.3043 0.2654 0.0122 -0.0079 0.0237 2 VAL H CG2 1629 N N . GLN B 3 ? 0.3497 0.3608 0.3263 0.0066 -0.0062 0.0143 3 GLN H N 1630 C CA . GLN B 3 ? 0.3577 0.3643 0.3344 0.0073 -0.0038 0.0115 3 GLN H CA 1631 C C . GLN B 3 ? 0.3322 0.3420 0.3176 0.0123 -0.0030 0.0122 3 GLN H C 1632 O O . GLN B 3 ? 0.3886 0.4055 0.3803 0.0137 -0.0046 0.0150 3 GLN H O 1633 C CB . GLN B 3 ? 0.3894 0.3971 0.3634 0.0022 -0.0052 0.0109 3 GLN H CB 1634 C CG . GLN B 3 ? 0.6577 0.6591 0.6298 0.0022 -0.0021 0.0079 3 GLN H CG 1635 C CD . GLN B 3 ? 0.8956 0.8969 0.8646 -0.0034 -0.0033 0.0073 3 GLN H CD 1636 O OE1 . GLN B 3 ? 0.9570 0.9654 0.9282 -0.0069 -0.0070 0.0097 3 GLN H OE1 1637 N NE2 . GLN B 3 ? 0.9170 0.9105 0.8817 -0.0045 -0.0003 0.0044 3 GLN H NE2 1638 N N . LEU B 4 ? 0.2887 0.2928 0.2741 0.0151 -0.0004 0.0099 4 LEU H N 1639 C CA . LEU B 4 ? 0.2985 0.3041 0.2897 0.0191 0.0002 0.0097 4 LEU H CA 1640 C C . LEU B 4 ? 0.3545 0.3585 0.3441 0.0181 0.0015 0.0083 4 LEU H C 1641 O O . LEU B 4 ? 0.3808 0.3789 0.3660 0.0170 0.0034 0.0063 4 LEU H O 1642 C CB . LEU B 4 ? 0.2542 0.2553 0.2470 0.0228 0.0014 0.0086 4 LEU H CB 1643 C CG . LEU B 4 ? 0.2932 0.2944 0.2882 0.0242 0.0009 0.0100 4 LEU H CG 1644 C CD1 . LEU B 4 ? 0.1935 0.1923 0.1930 0.0281 0.0012 0.0092 4 LEU H CD1 1645 C CD2 . LEU B 4 ? 0.2569 0.2647 0.2548 0.0239 -0.0010 0.0130 4 LEU H CD2 1646 N N . GLN B 5 ? 0.3737 0.3829 0.3672 0.0187 0.0011 0.0098 5 GLN H N 1647 C CA . GLN B 5 ? 0.3590 0.3672 0.3517 0.0181 0.0027 0.0090 5 GLN H CA 1648 C C . GLN B 5 ? 0.3189 0.3271 0.3144 0.0231 0.0041 0.0088 5 GLN H C 1649 O O . GLN B 5 ? 0.3455 0.3574 0.3452 0.0259 0.0036 0.0102 5 GLN H O 1650 C CB . GLN B 5 ? 0.4666 0.4806 0.4612 0.0143 0.0015 0.0112 5 GLN H CB 1651 C CG . GLN B 5 ? 0.6054 0.6188 0.5956 0.0086 -0.0006 0.0111 5 GLN H CG 1652 C CD . GLN B 5 ? 0.7161 0.7364 0.7094 0.0043 -0.0029 0.0139 5 GLN H CD 1653 O OE1 . GLN B 5 ? 0.7437 0.7682 0.7424 0.0054 -0.0019 0.0157 5 GLN H OE1 1654 N NE2 . GLN B 5 ? 0.7138 0.7357 0.7039 -0.0007 -0.0060 0.0145 5 GLN H NE2 1655 N N . GLN B 6 ? 0.2504 0.2541 0.2433 0.0241 0.0059 0.0071 6 GLN H N 1656 C CA . GLN B 6 ? 0.3393 0.3421 0.3328 0.0285 0.0069 0.0065 6 GLN H CA 1657 C C . GLN B 6 ? 0.3256 0.3298 0.3189 0.0288 0.0090 0.0075 6 GLN H C 1658 O O . GLN B 6 ? 0.3622 0.3657 0.3542 0.0255 0.0099 0.0077 6 GLN H O 1659 C CB . GLN B 6 ? 0.3963 0.3933 0.3872 0.0303 0.0070 0.0044 6 GLN H CB 1660 C CG . GLN B 6 ? 0.4482 0.4429 0.4391 0.0291 0.0059 0.0039 6 GLN H CG 1661 C CD . GLN B 6 ? 0.4061 0.3962 0.3962 0.0309 0.0060 0.0028 6 GLN H CD 1662 O OE1 . GLN B 6 ? 0.3532 0.3409 0.3437 0.0302 0.0060 0.0028 6 GLN H OE1 1663 N NE2 . GLN B 6 ? 0.3626 0.3518 0.3519 0.0334 0.0060 0.0022 6 GLN H NE2 1664 N N . TRP B 7 ? 0.2852 0.2906 0.2794 0.0327 0.0100 0.0080 7 TRP H N 1665 C CA . TRP B 7 ? 0.3027 0.3089 0.2962 0.0341 0.0125 0.0091 7 TRP H CA 1666 C C . TRP B 7 ? 0.3325 0.3359 0.3229 0.0392 0.0134 0.0079 7 TRP H C 1667 O O . TRP B 7 ? 0.3088 0.3100 0.2985 0.0411 0.0118 0.0063 7 TRP H O 1668 C CB . TRP B 7 ? 0.2662 0.2791 0.2649 0.0326 0.0134 0.0125 7 TRP H CB 1669 C CG . TRP B 7 ? 0.3374 0.3548 0.3405 0.0348 0.0130 0.0143 7 TRP H CG 1670 C CD1 . TRP B 7 ? 0.3329 0.3511 0.3370 0.0397 0.0153 0.0153 7 TRP H CD1 1671 C CD2 . TRP B 7 ? 0.3580 0.3796 0.3652 0.0325 0.0105 0.0157 7 TRP H CD2 1672 N NE1 . TRP B 7 ? 0.3798 0.4022 0.3890 0.0407 0.0148 0.0174 7 TRP H NE1 1673 C CE2 . TRP B 7 ? 0.3319 0.3569 0.3433 0.0363 0.0115 0.0179 7 TRP H CE2 1674 C CE3 . TRP B 7 ? 0.3307 0.3528 0.3375 0.0277 0.0077 0.0154 7 TRP H CE3 1675 C CZ2 . TRP B 7 ? 0.2911 0.3211 0.3077 0.0356 0.0097 0.0203 7 TRP H CZ2 1676 C CZ3 . TRP B 7 ? 0.3894 0.4164 0.4002 0.0268 0.0055 0.0176 7 TRP H CZ3 1677 C CH2 . TRP B 7 ? 0.2565 0.2878 0.2726 0.0307 0.0065 0.0202 7 TRP H CH2 1678 N N . GLY B 8 ? 0.3519 0.3550 0.3401 0.0412 0.0160 0.0088 8 GLY H N 1679 C CA . GLY B 8 ? 0.2913 0.2906 0.2742 0.0458 0.0169 0.0074 8 GLY H CA 1680 C C . GLY B 8 ? 0.3419 0.3384 0.3202 0.0464 0.0181 0.0074 8 GLY H C 1681 O O . GLY B 8 ? 0.3844 0.3802 0.3636 0.0433 0.0177 0.0076 8 GLY H O 1682 N N . ALA B 9 ? 0.3999 0.3942 0.3728 0.0504 0.0197 0.0072 9 ALA H N 1683 C CA . ALA B 9 ? 0.3921 0.3842 0.3603 0.0514 0.0210 0.0080 9 ALA H CA 1684 C C . ALA B 9 ? 0.3842 0.3726 0.3494 0.0508 0.0176 0.0060 9 ALA H C 1685 O O . ALA B 9 ? 0.3970 0.3827 0.3594 0.0519 0.0145 0.0036 9 ALA H O 1686 C CB . ALA B 9 ? 0.3455 0.3360 0.3074 0.0562 0.0238 0.0084 9 ALA H CB 1687 N N . GLY B 10 ? 0.4514 0.4396 0.4176 0.0489 0.0184 0.0075 10 GLY H N 1688 C CA . GLY B 10 ? 0.4766 0.4622 0.4419 0.0484 0.0157 0.0068 10 GLY H CA 1689 C C . GLY B 10 ? 0.5247 0.5087 0.4848 0.0509 0.0160 0.0082 10 GLY H C 1690 O O . GLY B 10 ? 0.5953 0.5779 0.5548 0.0509 0.0132 0.0082 10 GLY H O 1691 N N . LEU B 11 ? 0.4678 0.4525 0.4246 0.0531 0.0192 0.0100 11 LEU H N 1692 C CA . LEU B 11 ? 0.3927 0.3761 0.3435 0.0559 0.0195 0.0117 11 LEU H CA 1693 C C . LEU B 11 ? 0.3802 0.3616 0.3222 0.0595 0.0182 0.0099 11 LEU H C 1694 O O . LEU B 11 ? 0.3613 0.3429 0.3011 0.0614 0.0214 0.0100 11 LEU H O 1695 C CB . LEU B 11 ? 0.3773 0.3620 0.3294 0.0563 0.0246 0.0154 11 LEU H CB 1696 C CG . LEU B 11 ? 0.5258 0.5096 0.4717 0.0595 0.0254 0.0180 11 LEU H CG 1697 C CD1 . LEU B 11 ? 0.5479 0.5307 0.4936 0.0592 0.0215 0.0184 11 LEU H CD1 1698 C CD2 . LEU B 11 ? 0.4131 0.3981 0.3619 0.0596 0.0309 0.0220 11 LEU H CD2 1699 N N . LEU B 12 ? 0.3633 0.3423 0.3003 0.0602 0.0136 0.0084 12 LEU H N 1700 C CA . LEU B 12 ? 0.3583 0.3337 0.2856 0.0628 0.0115 0.0056 12 LEU H CA 1701 C C . LEU B 12 ? 0.3339 0.3075 0.2521 0.0648 0.0090 0.0066 12 LEU H C 1702 O O . LEU B 12 ? 0.3902 0.3658 0.3112 0.0637 0.0069 0.0091 12 LEU H O 1703 C CB . LEU B 12 ? 0.3448 0.3181 0.2738 0.0610 0.0070 0.0018 12 LEU H CB 1704 C CG . LEU B 12 ? 0.4749 0.4500 0.4121 0.0591 0.0086 0.0008 12 LEU H CG 1705 C CD1 . LEU B 12 ? 0.4481 0.4205 0.3861 0.0578 0.0041 -0.0027 12 LEU H CD1 1706 C CD2 . LEU B 12 ? 0.5171 0.4926 0.4528 0.0616 0.0137 0.0012 12 LEU H CD2 1707 N N . LYS B 13 ? 0.3965 0.3661 0.3033 0.0678 0.0093 0.0047 13 LYS H N 1708 C CA . LYS B 13 ? 0.4175 0.3844 0.3131 0.0695 0.0057 0.0048 13 LYS H CA 1709 C C . LYS B 13 ? 0.4705 0.4329 0.3607 0.0680 -0.0009 0.0001 13 LYS H C 1710 O O . LYS B 13 ? 0.5146 0.4744 0.4067 0.0672 -0.0008 -0.0034 13 LYS H O 1711 C CB . LYS B 13 ? 0.4827 0.4470 0.3671 0.0739 0.0106 0.0058 13 LYS H CB 1712 C CG . LYS B 13 ? 0.5844 0.5532 0.4748 0.0752 0.0172 0.0109 13 LYS H CG 1713 C CD . LYS B 13 ? 0.6561 0.6227 0.5357 0.0799 0.0222 0.0128 13 LYS H CD 1714 C CE . LYS B 13 ? 0.6882 0.6595 0.5760 0.0807 0.0290 0.0180 13 LYS H CE 1715 N NZ . LYS B 13 ? 0.7042 0.6796 0.6011 0.0778 0.0275 0.0213 13 LYS H NZ 1716 N N . PRO B 14 ? 0.4278 0.3896 0.3120 0.0673 -0.0069 0.0004 14 PRO H N 1717 C CA . PRO B 14 ? 0.4414 0.3985 0.3201 0.0652 -0.0140 -0.0041 14 PRO H CA 1718 C C . PRO B 14 ? 0.4958 0.4446 0.3627 0.0672 -0.0123 -0.0093 14 PRO H C 1719 O O . PRO B 14 ? 0.5974 0.5435 0.4547 0.0711 -0.0072 -0.0088 14 PRO H O 1720 C CB . PRO B 14 ? 0.4884 0.4465 0.3599 0.0649 -0.0198 -0.0018 14 PRO H CB 1721 C CG . PRO B 14 ? 0.4773 0.4426 0.3576 0.0657 -0.0165 0.0046 14 PRO H CG 1722 C CD . PRO B 14 ? 0.3989 0.3646 0.2821 0.0681 -0.0077 0.0054 14 PRO H CD 1723 N N . SER B 15 ? 0.4879 0.4326 0.3562 0.0649 -0.0159 -0.0137 15 SER H N 1724 C CA . SER B 15 ? 0.4670 0.4025 0.3251 0.0664 -0.0145 -0.0191 15 SER H CA 1725 C C . SER B 15 ? 0.4489 0.3847 0.3129 0.0690 -0.0064 -0.0190 15 SER H C 1726 O O . SER B 15 ? 0.4879 0.4165 0.3458 0.0707 -0.0042 -0.0228 15 SER H O 1727 C CB . SER B 15 ? 0.4886 0.4169 0.3272 0.0693 -0.0146 -0.0211 15 SER H CB 1728 O OG . SER B 15 ? 0.5764 0.5056 0.4111 0.0741 -0.0064 -0.0182 15 SER H OG 1729 N N . GLU B 16 ? 0.4025 0.3463 0.2784 0.0692 -0.0022 -0.0144 16 GLU H N 1730 C CA . GLU B 16 ? 0.4257 0.3713 0.3091 0.0707 0.0042 -0.0137 16 GLU H CA 1731 C C . GLU B 16 ? 0.4402 0.3870 0.3346 0.0675 0.0017 -0.0153 16 GLU H C 1732 O O . GLU B 16 ? 0.4868 0.4328 0.3832 0.0643 -0.0045 -0.0170 16 GLU H O 1733 C CB . GLU B 16 ? 0.3766 0.3299 0.2681 0.0714 0.0093 -0.0084 16 GLU H CB 1734 C CG . GLU B 16 ? 0.4820 0.4342 0.3638 0.0754 0.0138 -0.0061 16 GLU H CG 1735 C CD . GLU B 16 ? 0.6009 0.5604 0.4917 0.0756 0.0189 -0.0008 16 GLU H CD 1736 O OE1 . GLU B 16 ? 0.5750 0.5400 0.4782 0.0722 0.0179 0.0009 16 GLU H OE1 1737 O OE2 . GLU B 16 ? 0.7119 0.6713 0.5972 0.0792 0.0240 0.0018 16 GLU H OE2 1738 N N . THR B 17 ? 0.3809 0.3301 0.2829 0.0685 0.0066 -0.0143 17 THR H N 1739 C CA . THR B 17 ? 0.3407 0.2911 0.2527 0.0660 0.0050 -0.0153 17 THR H CA 1740 C C . THR B 17 ? 0.3189 0.2779 0.2441 0.0637 0.0063 -0.0115 17 THR H C 1741 O O . THR B 17 ? 0.3920 0.3552 0.3209 0.0650 0.0112 -0.0085 17 THR H O 1742 C CB . THR B 17 ? 0.3985 0.3444 0.3089 0.0689 0.0091 -0.0172 17 THR H CB 1743 O OG1 . THR B 17 ? 0.4690 0.4047 0.3660 0.0707 0.0077 -0.0217 17 THR H OG1 1744 C CG2 . THR B 17 ? 0.4159 0.3640 0.3375 0.0665 0.0077 -0.0173 17 THR H CG2 1745 N N . LEU B 18 ? 0.3146 0.2759 0.2470 0.0600 0.0019 -0.0115 18 LEU H N 1746 C CA . LEU B 18 ? 0.2685 0.2362 0.2120 0.0576 0.0030 -0.0087 18 LEU H CA 1747 C C . LEU B 18 ? 0.3672 0.3360 0.3165 0.0578 0.0052 -0.0088 18 LEU H C 1748 O O . LEU B 18 ? 0.3532 0.3179 0.3021 0.0579 0.0032 -0.0114 18 LEU H O 1749 C CB . LEU B 18 ? 0.3265 0.2957 0.2754 0.0542 -0.0015 -0.0084 18 LEU H CB 1750 C CG . LEU B 18 ? 0.3746 0.3486 0.3335 0.0516 -0.0005 -0.0063 18 LEU H CG 1751 C CD1 . LEU B 18 ? 0.3207 0.2987 0.2813 0.0513 0.0035 -0.0033 18 LEU H CD1 1752 C CD2 . LEU B 18 ? 0.4017 0.3760 0.3653 0.0490 -0.0043 -0.0059 18 LEU H CD2 1753 N N . SER B 19 ? 0.3392 0.3134 0.2940 0.0577 0.0090 -0.0058 19 SER H N 1754 C CA . SER B 19 ? 0.3581 0.3347 0.3192 0.0580 0.0110 -0.0049 19 SER H CA 1755 C C . SER B 19 ? 0.3892 0.3727 0.3591 0.0547 0.0114 -0.0018 19 SER H C 1756 O O . SER B 19 ? 0.3741 0.3618 0.3460 0.0543 0.0142 0.0009 19 SER H O 1757 C CB . SER B 19 ? 0.4017 0.3777 0.3598 0.0621 0.0160 -0.0038 19 SER H CB 1758 O OG . SER B 19 ? 0.5423 0.5219 0.5078 0.0625 0.0180 -0.0018 19 SER H OG 1759 N N . LEU B 20 ? 0.3477 0.3318 0.3223 0.0520 0.0084 -0.0023 20 LEU H N 1760 C CA . LEU B 20 ? 0.3139 0.3031 0.2949 0.0485 0.0084 -0.0001 20 LEU H CA 1761 C C . LEU B 20 ? 0.3182 0.3106 0.3051 0.0481 0.0084 0.0012 20 LEU H C 1762 O O . LEU B 20 ? 0.2723 0.2619 0.2594 0.0500 0.0077 -0.0001 20 LEU H O 1763 C CB . LEU B 20 ? 0.2896 0.2772 0.2711 0.0459 0.0056 -0.0009 20 LEU H CB 1764 C CG . LEU B 20 ? 0.2437 0.2291 0.2207 0.0462 0.0054 -0.0013 20 LEU H CG 1765 C CD1 . LEU B 20 ? 0.1753 0.1594 0.1544 0.0441 0.0031 -0.0014 20 LEU H CD1 1766 C CD2 . LEU B 20 ? 0.1675 0.1556 0.1440 0.0457 0.0087 0.0009 20 LEU H CD2 1767 N N . THR B 21 ? 0.2861 0.2840 0.2775 0.0455 0.0091 0.0039 21 THR H N 1768 C CA . THR B 21 ? 0.2740 0.2762 0.2713 0.0448 0.0089 0.0060 21 THR H CA 1769 C C . THR B 21 ? 0.2925 0.2973 0.2920 0.0404 0.0070 0.0069 21 THR H C 1770 O O . THR B 21 ? 0.3154 0.3206 0.3132 0.0376 0.0072 0.0070 21 THR H O 1771 C CB . THR B 21 ? 0.2990 0.3066 0.2999 0.0463 0.0116 0.0094 21 THR H CB 1772 O OG1 . THR B 21 ? 0.3120 0.3161 0.3099 0.0511 0.0142 0.0084 21 THR H OG1 1773 C CG2 . THR B 21 ? 0.2798 0.2933 0.2876 0.0453 0.0109 0.0125 21 THR H CG2 1774 N N . CYS B 22 ? 0.2770 0.2827 0.2796 0.0399 0.0054 0.0075 22 CYS H N 1775 C CA . CYS B 22 ? 0.2595 0.2670 0.2630 0.0360 0.0039 0.0084 22 CYS H CA 1776 C C . CYS B 22 ? 0.3369 0.3510 0.3451 0.0351 0.0033 0.0119 22 CYS H C 1777 O O . CYS B 22 ? 0.3090 0.3243 0.3210 0.0378 0.0035 0.0132 22 CYS H O 1778 C CB . CYS B 22 ? 0.2616 0.2644 0.2644 0.0362 0.0025 0.0066 22 CYS H CB 1779 S SG . CYS B 22 ? 0.4534 0.4563 0.4553 0.0322 0.0016 0.0074 22 CYS H SG 1780 N N . GLY B 23 ? 0.2924 0.3106 0.3006 0.0312 0.0026 0.0136 23 GLY H N 1781 C CA . GLY B 23 ? 0.2548 0.2803 0.2675 0.0295 0.0012 0.0175 23 GLY H CA 1782 C C . GLY B 23 ? 0.2730 0.2980 0.2833 0.0262 -0.0010 0.0176 23 GLY H C 1783 O O . GLY B 23 ? 0.3314 0.3518 0.3361 0.0233 -0.0012 0.0152 23 GLY H O 1784 N N . VAL B 24 ? 0.3046 0.3339 0.3188 0.0269 -0.0022 0.0206 24 VAL H N 1785 C CA . VAL B 24 ? 0.3154 0.3443 0.3267 0.0243 -0.0041 0.0212 24 VAL H CA 1786 C C . VAL B 24 ? 0.3249 0.3616 0.3372 0.0203 -0.0069 0.0250 24 VAL H C 1787 O O . VAL B 24 ? 0.3225 0.3667 0.3417 0.0217 -0.0075 0.0293 24 VAL H O 1788 C CB . VAL B 24 ? 0.2958 0.3234 0.3105 0.0279 -0.0037 0.0221 24 VAL H CB 1789 C CG1 . VAL B 24 ? 0.2699 0.2974 0.2814 0.0255 -0.0051 0.0233 24 VAL H CG1 1790 C CG2 . VAL B 24 ? 0.3699 0.3900 0.3838 0.0311 -0.0018 0.0183 24 VAL H CG2 1791 N N . TYR B 25 ? 0.2553 0.2900 0.2606 0.0153 -0.0085 0.0236 25 TYR H N 1792 C CA . TYR B 25 ? 0.2853 0.3268 0.2900 0.0104 -0.0121 0.0268 25 TYR H CA 1793 C C . TYR B 25 ? 0.2496 0.2888 0.2469 0.0075 -0.0139 0.0267 25 TYR H C 1794 O O . TYR B 25 ? 0.3058 0.3367 0.2946 0.0057 -0.0127 0.0229 25 TYR H O 1795 C CB . TYR B 25 ? 0.2943 0.3354 0.2964 0.0058 -0.0127 0.0253 25 TYR H CB 1796 C CG . TYR B 25 ? 0.2605 0.3034 0.2691 0.0090 -0.0102 0.0256 25 TYR H CG 1797 C CD1 . TYR B 25 ? 0.2595 0.2949 0.2656 0.0119 -0.0068 0.0216 25 TYR H CD1 1798 C CD2 . TYR B 25 ? 0.3200 0.3725 0.3374 0.0095 -0.0111 0.0304 25 TYR H CD2 1799 C CE1 . TYR B 25 ? 0.2748 0.3113 0.2854 0.0151 -0.0045 0.0220 25 TYR H CE1 1800 C CE2 . TYR B 25 ? 0.3200 0.3736 0.3427 0.0129 -0.0081 0.0309 25 TYR H CE2 1801 C CZ . TYR B 25 ? 0.2750 0.3202 0.2934 0.0157 -0.0048 0.0264 25 TYR H CZ 1802 O OH . TYR B 25 ? 0.3376 0.3834 0.3597 0.0192 -0.0017 0.0269 25 TYR H OH 1803 N N . GLY B 26 ? 0.2315 0.2782 0.2323 0.0074 -0.0165 0.0315 26 GLY H N 1804 C CA . GLY B 26 ? 0.2781 0.3233 0.2715 0.0051 -0.0183 0.0322 26 GLY H CA 1805 C C . GLY B 26 ? 0.3265 0.3719 0.3242 0.0102 -0.0166 0.0345 26 GLY H C 1806 O O . GLY B 26 ? 0.3714 0.4167 0.3645 0.0095 -0.0176 0.0363 26 GLY H O 1807 N N . GLU B 27 ? 0.3381 0.3833 0.3442 0.0155 -0.0139 0.0345 27 GLU H N 1808 C CA . GLU B 27 ? 0.2947 0.3391 0.3060 0.0205 -0.0119 0.0362 27 GLU H CA 1809 C C . GLU B 27 ? 0.2825 0.3294 0.3037 0.0252 -0.0100 0.0375 27 GLU H C 1810 O O . GLU B 27 ? 0.2062 0.2525 0.2286 0.0254 -0.0091 0.0354 27 GLU H O 1811 C CB . GLU B 27 ? 0.3900 0.4244 0.3963 0.0218 -0.0092 0.0320 27 GLU H CB 1812 C CG . GLU B 27 ? 0.4795 0.5122 0.4910 0.0261 -0.0073 0.0338 27 GLU H CG 1813 C CD . GLU B 27 ? 0.5427 0.5664 0.5513 0.0272 -0.0048 0.0301 27 GLU H CD 1814 O OE1 . GLU B 27 ? 0.5812 0.6001 0.5839 0.0251 -0.0041 0.0263 27 GLU H OE1 1815 O OE2 . GLU B 27 ? 0.5646 0.5864 0.5777 0.0303 -0.0033 0.0315 27 GLU H OE2 1816 N N . SER B 28 ? 0.2103 0.2595 0.2381 0.0291 -0.0091 0.0410 28 SER H N 1817 C CA . SER B 28 ? 0.2592 0.3085 0.2953 0.0342 -0.0064 0.0419 28 SER H CA 1818 C C . SER B 28 ? 0.2894 0.3288 0.3246 0.0370 -0.0038 0.0371 28 SER H C 1819 O O . SER B 28 ? 0.2279 0.2621 0.2588 0.0360 -0.0039 0.0350 28 SER H O 1820 C CB . SER B 28 ? 0.2875 0.3434 0.3315 0.0369 -0.0064 0.0485 28 SER H CB 1821 O OG . SER B 28 ? 0.3203 0.3734 0.3713 0.0423 -0.0029 0.0486 28 SER H OG 1822 N N . LEU B 29 ? 0.2951 0.3317 0.3341 0.0406 -0.0016 0.0355 29 LEU H N 1823 C CA . LEU B 29 ? 0.2779 0.3055 0.3165 0.0431 0.0002 0.0312 29 LEU H CA 1824 C C . LEU B 29 ? 0.3106 0.3359 0.3537 0.0454 0.0010 0.0332 29 LEU H C 1825 O O . LEU B 29 ? 0.2388 0.2570 0.2815 0.0461 0.0015 0.0301 29 LEU H O 1826 C CB . LEU B 29 ? 0.2275 0.2521 0.2676 0.0463 0.0024 0.0291 29 LEU H CB 1827 C CG . LEU B 29 ? 0.3049 0.3298 0.3405 0.0448 0.0023 0.0265 29 LEU H CG 1828 C CD1 . LEU B 29 ? 0.3637 0.3861 0.4008 0.0488 0.0051 0.0255 29 LEU H CD1 1829 C CD2 . LEU B 29 ? 0.2991 0.3179 0.3281 0.0423 0.0011 0.0217 29 LEU H CD2 1830 N N . SER B 30 ? 0.2116 0.2435 0.2598 0.0464 0.0010 0.0389 30 SER H N 1831 C CA . SER B 30 ? 0.2360 0.2663 0.2898 0.0492 0.0024 0.0418 30 SER H CA 1832 C C . SER B 30 ? 0.3036 0.3295 0.3547 0.0476 0.0018 0.0406 30 SER H C 1833 O O . SER B 30 ? 0.3303 0.3577 0.3753 0.0442 0.0001 0.0401 30 SER H O 1834 C CB . SER B 30 ? 0.2835 0.3232 0.3429 0.0502 0.0022 0.0491 30 SER H CB 1835 O OG . SER B 30 ? 0.4376 0.4827 0.4921 0.0463 -0.0008 0.0514 30 SER H OG 1836 N N . GLY B 31 ? 0.2783 0.2984 0.3342 0.0500 0.0035 0.0401 31 GLY H N 1837 C CA . GLY B 31 ? 0.2550 0.2718 0.3110 0.0492 0.0035 0.0406 31 GLY H CA 1838 C C . GLY B 31 ? 0.2930 0.3044 0.3438 0.0468 0.0028 0.0357 31 GLY H C 1839 O O . GLY B 31 ? 0.3913 0.4009 0.4417 0.0459 0.0032 0.0367 31 GLY H O 1840 N N . HIS B 32 ? 0.2760 0.2851 0.3232 0.0460 0.0020 0.0312 32 HIS H N 1841 C CA . HIS B 32 ? 0.2571 0.2617 0.2998 0.0439 0.0013 0.0271 32 HIS H CA 1842 C C . HIS B 32 ? 0.2636 0.2628 0.3063 0.0447 0.0008 0.0224 32 HIS H C 1843 O O . HIS B 32 ? 0.2537 0.2526 0.2973 0.0466 0.0012 0.0216 32 HIS H O 1844 C CB . HIS B 32 ? 0.1889 0.1966 0.2238 0.0409 0.0005 0.0265 32 HIS H CB 1845 C CG . HIS B 32 ? 0.3204 0.3315 0.3523 0.0393 0.0007 0.0301 32 HIS H CG 1846 N ND1 . HIS B 32 ? 0.3531 0.3707 0.3854 0.0392 -0.0001 0.0343 32 HIS H ND1 1847 C CD2 . HIS B 32 ? 0.3490 0.3576 0.3768 0.0378 0.0016 0.0302 32 HIS H CD2 1848 C CE1 . HIS B 32 ? 0.3145 0.3333 0.3420 0.0374 0.0000 0.0365 32 HIS H CE1 1849 N NE2 . HIS B 32 ? 0.3056 0.3184 0.3300 0.0367 0.0014 0.0340 32 HIS H NE2 1850 N N . TYR B 33 ? 0.1757 0.1705 0.2170 0.0433 0.0000 0.0197 33 TYR H N 1851 C CA . TYR B 33 ? 0.2346 0.2249 0.2741 0.0434 -0.0012 0.0153 33 TYR H CA 1852 C C . TYR B 33 ? 0.2967 0.2888 0.3295 0.0418 -0.0015 0.0134 33 TYR H C 1853 O O . TYR B 33 ? 0.2624 0.2569 0.2922 0.0400 -0.0010 0.0147 33 TYR H O 1854 C CB . TYR B 33 ? 0.2534 0.2389 0.2965 0.0427 -0.0025 0.0140 33 TYR H CB 1855 C CG . TYR B 33 ? 0.2995 0.2818 0.3500 0.0438 -0.0024 0.0153 33 TYR H CG 1856 C CD1 . TYR B 33 ? 0.2596 0.2439 0.3152 0.0441 -0.0010 0.0195 33 TYR H CD1 1857 C CD2 . TYR B 33 ? 0.2679 0.2446 0.3196 0.0447 -0.0037 0.0121 33 TYR H CD2 1858 C CE1 . TYR B 33 ? 0.2671 0.2482 0.3302 0.0451 -0.0007 0.0210 33 TYR H CE1 1859 C CE2 . TYR B 33 ? 0.2424 0.2151 0.3008 0.0454 -0.0036 0.0130 33 TYR H CE2 1860 C CZ . TYR B 33 ? 0.2722 0.2474 0.3370 0.0456 -0.0020 0.0176 33 TYR H CZ 1861 O OH . TYR B 33 ? 0.3085 0.2795 0.3806 0.0462 -0.0016 0.0188 33 TYR H OH 1862 N N . TRP B 34 ? 0.3389 0.3291 0.3687 0.0426 -0.0020 0.0104 34 TRP H N 1863 C CA . TRP B 34 ? 0.3077 0.2994 0.3317 0.0414 -0.0020 0.0089 34 TRP H CA 1864 C C . TRP B 34 ? 0.3080 0.2949 0.3295 0.0415 -0.0033 0.0054 34 TRP H C 1865 O O . TRP B 34 ? 0.2973 0.2804 0.3190 0.0431 -0.0041 0.0033 34 TRP H O 1866 C CB . TRP B 34 ? 0.2793 0.2751 0.3019 0.0423 -0.0009 0.0099 34 TRP H CB 1867 C CG . TRP B 34 ? 0.2747 0.2760 0.3002 0.0419 -0.0003 0.0140 34 TRP H CG 1868 C CD1 . TRP B 34 ? 0.2055 0.2083 0.2363 0.0439 0.0004 0.0167 34 TRP H CD1 1869 C CD2 . TRP B 34 ? 0.1969 0.2026 0.2197 0.0390 -0.0006 0.0160 34 TRP H CD2 1870 N NE1 . TRP B 34 ? 0.2168 0.2257 0.2486 0.0426 0.0002 0.0207 34 TRP H NE1 1871 C CE2 . TRP B 34 ? 0.1714 0.1819 0.1978 0.0393 -0.0006 0.0201 34 TRP H CE2 1872 C CE3 . TRP B 34 ? 0.1525 0.1579 0.1697 0.0361 -0.0008 0.0147 34 TRP H CE3 1873 C CZ2 . TRP B 34 ? 0.2224 0.2375 0.2459 0.0365 -0.0014 0.0227 34 TRP H CZ2 1874 C CZ3 . TRP B 34 ? 0.2207 0.2296 0.2350 0.0332 -0.0012 0.0168 34 TRP H CZ3 1875 C CH2 . TRP B 34 ? 0.2755 0.2894 0.2925 0.0333 -0.0018 0.0207 34 TRP H CH2 1876 N N . SER B 35 ? 0.2691 0.2560 0.2880 0.0398 -0.0035 0.0050 35 SER H N 1877 C CA . SER B 35 ? 0.2517 0.2348 0.2702 0.0395 -0.0053 0.0030 35 SER H CA 1878 C C . SER B 35 ? 0.2417 0.2251 0.2548 0.0390 -0.0050 0.0017 35 SER H C 1879 O O . SER B 35 ? 0.2662 0.2522 0.2762 0.0382 -0.0032 0.0025 35 SER H O 1880 C CB . SER B 35 ? 0.2919 0.2745 0.3153 0.0384 -0.0055 0.0049 35 SER H CB 1881 O OG . SER B 35 ? 0.4763 0.4568 0.5005 0.0379 -0.0074 0.0041 35 SER H OG 1882 N N . TRP B 36 ? 0.2648 0.2454 0.2768 0.0393 -0.0071 0.0000 36 TRP H N 1883 C CA . TRP B 36 ? 0.2813 0.2619 0.2887 0.0391 -0.0068 -0.0006 36 TRP H CA 1884 C C . TRP B 36 ? 0.2762 0.2557 0.2866 0.0383 -0.0085 0.0003 36 TRP H C 1885 O O . TRP B 36 ? 0.2823 0.2601 0.2965 0.0381 -0.0114 0.0000 36 TRP H O 1886 C CB . TRP B 36 ? 0.2652 0.2440 0.2671 0.0408 -0.0076 -0.0031 36 TRP H CB 1887 C CG . TRP B 36 ? 0.2508 0.2316 0.2504 0.0419 -0.0050 -0.0030 36 TRP H CG 1888 C CD1 . TRP B 36 ? 0.2600 0.2401 0.2606 0.0435 -0.0045 -0.0035 36 TRP H CD1 1889 C CD2 . TRP B 36 ? 0.2708 0.2548 0.2677 0.0416 -0.0025 -0.0020 36 TRP H CD2 1890 N NE1 . TRP B 36 ? 0.3179 0.3014 0.3172 0.0444 -0.0018 -0.0023 36 TRP H NE1 1891 C CE2 . TRP B 36 ? 0.2458 0.2318 0.2429 0.0430 -0.0009 -0.0015 36 TRP H CE2 1892 C CE3 . TRP B 36 ? 0.3107 0.2958 0.3056 0.0402 -0.0013 -0.0012 36 TRP H CE3 1893 C CZ2 . TRP B 36 ? 0.3031 0.2931 0.2992 0.0427 0.0014 0.0001 36 TRP H CZ2 1894 C CZ3 . TRP B 36 ? 0.3415 0.3295 0.3345 0.0397 0.0010 -0.0002 36 TRP H CZ3 1895 C CH2 . TRP B 36 ? 0.3223 0.3131 0.3163 0.0408 0.0021 0.0005 36 TRP H CH2 1896 N N . VAL B 37 ? 0.2698 0.2503 0.2789 0.0377 -0.0066 0.0017 37 VAL H N 1897 C CA . VAL B 37 ? 0.2699 0.2502 0.2828 0.0374 -0.0072 0.0037 37 VAL H CA 1898 C C . VAL B 37 ? 0.2174 0.1979 0.2260 0.0378 -0.0062 0.0039 37 VAL H C 1899 O O . VAL B 37 ? 0.3545 0.3352 0.3585 0.0377 -0.0033 0.0035 37 VAL H O 1900 C CB . VAL B 37 ? 0.3374 0.3181 0.3544 0.0367 -0.0042 0.0064 37 VAL H CB 1901 C CG1 . VAL B 37 ? 0.2827 0.2634 0.3041 0.0368 -0.0037 0.0093 37 VAL H CG1 1902 C CG2 . VAL B 37 ? 0.3079 0.2887 0.3297 0.0365 -0.0050 0.0069 37 VAL H CG2 1903 N N . ARG B 38 ? 0.2248 0.2054 0.2349 0.0382 -0.0088 0.0049 38 ARG H N 1904 C CA . ARG B 38 ? 0.2365 0.2174 0.2426 0.0389 -0.0077 0.0056 38 ARG H CA 1905 C C . ARG B 38 ? 0.2644 0.2463 0.2758 0.0391 -0.0068 0.0094 38 ARG H C 1906 O O . ARG B 38 ? 0.3133 0.2961 0.3318 0.0387 -0.0083 0.0115 38 ARG H O 1907 C CB . ARG B 38 ? 0.2411 0.2214 0.2419 0.0398 -0.0113 0.0035 38 ARG H CB 1908 C CG . ARG B 38 ? 0.3057 0.2862 0.3093 0.0394 -0.0166 0.0041 38 ARG H CG 1909 C CD . ARG B 38 ? 0.3755 0.3545 0.3709 0.0403 -0.0197 0.0017 38 ARG H CD 1910 N NE . ARG B 38 ? 0.3903 0.3690 0.3872 0.0392 -0.0259 0.0019 38 ARG H NE 1911 C CZ . ARG B 38 ? 0.4101 0.3864 0.3990 0.0394 -0.0298 -0.0005 38 ARG H CZ 1912 N NH1 . ARG B 38 ? 0.3569 0.3309 0.3362 0.0413 -0.0274 -0.0030 38 ARG H NH1 1913 N NH2 . ARG B 38 ? 0.4635 0.4396 0.4538 0.0376 -0.0361 -0.0004 38 ARG H NH2 1914 N N . GLN B 39 ? 0.2514 0.2331 0.2598 0.0398 -0.0040 0.0108 39 GLN H N 1915 C CA . GLN B 39 ? 0.2740 0.2563 0.2874 0.0405 -0.0018 0.0150 39 GLN H CA 1916 C C . GLN B 39 ? 0.2777 0.2609 0.2881 0.0419 -0.0019 0.0165 39 GLN H C 1917 O O . GLN B 39 ? 0.2970 0.2785 0.3027 0.0422 0.0020 0.0161 39 GLN H O 1918 C CB . GLN B 39 ? 0.3059 0.2855 0.3194 0.0402 0.0045 0.0158 39 GLN H CB 1919 C CG . GLN B 39 ? 0.2779 0.2571 0.2979 0.0413 0.0078 0.0204 39 GLN H CG 1920 C CD . GLN B 39 ? 0.3551 0.3298 0.3734 0.0408 0.0141 0.0205 39 GLN H CD 1921 O OE1 . GLN B 39 ? 0.3054 0.2773 0.3166 0.0394 0.0162 0.0174 39 GLN H OE1 1922 N NE2 . GLN B 39 ? 0.2385 0.2124 0.2631 0.0419 0.0171 0.0242 39 GLN H NE2 1923 N N . PRO B 40 ? 0.3150 0.3009 0.3283 0.0424 -0.0067 0.0185 40 PRO H N 1924 C CA . PRO B 40 ? 0.3379 0.3254 0.3490 0.0438 -0.0071 0.0211 40 PRO H CA 1925 C C . PRO B 40 ? 0.3659 0.3529 0.3810 0.0451 -0.0010 0.0253 40 PRO H C 1926 O O . PRO B 40 ? 0.3259 0.3120 0.3472 0.0450 0.0021 0.0272 40 PRO H O 1927 C CB . PRO B 40 ? 0.2617 0.2528 0.2772 0.0434 -0.0140 0.0232 40 PRO H CB 1928 C CG . PRO B 40 ? 0.2445 0.2346 0.2612 0.0415 -0.0178 0.0197 40 PRO H CG 1929 C CD . PRO B 40 ? 0.2481 0.2360 0.2670 0.0412 -0.0123 0.0187 40 PRO H CD 1930 N N . PRO B 41 ? 0.4375 0.4241 0.4486 0.0466 0.0014 0.0269 41 PRO H N 1931 C CA . PRO B 41 ? 0.4589 0.4438 0.4731 0.0480 0.0078 0.0309 41 PRO H CA 1932 C C . PRO B 41 ? 0.4360 0.4235 0.4607 0.0491 0.0082 0.0365 41 PRO H C 1933 O O . PRO B 41 ? 0.4745 0.4670 0.5035 0.0499 0.0032 0.0400 41 PRO H O 1934 C CB . PRO B 41 ? 0.4233 0.4092 0.4327 0.0496 0.0079 0.0324 41 PRO H CB 1935 C CG . PRO B 41 ? 0.4248 0.4107 0.4259 0.0487 0.0042 0.0275 41 PRO H CG 1936 C CD . PRO B 41 ? 0.4440 0.4313 0.4471 0.0472 -0.0014 0.0250 41 PRO H CD 1937 N N . GLY B 42 ? 0.3608 0.3447 0.3892 0.0493 0.0140 0.0376 42 GLY H N 1938 C CA . GLY B 42 ? 0.3093 0.2951 0.3482 0.0509 0.0160 0.0435 42 GLY H CA 1939 C C . GLY B 42 ? 0.4413 0.4316 0.4877 0.0498 0.0104 0.0444 42 GLY H C 1940 O O . GLY B 42 ? 0.4173 0.4113 0.4742 0.0511 0.0105 0.0504 42 GLY H O 1941 N N . LYS B 43 ? 0.4447 0.4348 0.4866 0.0475 0.0058 0.0391 43 LYS H N 1942 C CA . LYS B 43 ? 0.3760 0.3696 0.4250 0.0461 0.0005 0.0396 43 LYS H CA 1943 C C . LYS B 43 ? 0.3749 0.3649 0.4222 0.0447 0.0025 0.0357 43 LYS H C 1944 O O . LYS B 43 ? 0.3873 0.3725 0.4277 0.0446 0.0075 0.0327 43 LYS H O 1945 C CB . LYS B 43 ? 0.4199 0.4169 0.4661 0.0446 -0.0084 0.0374 43 LYS H CB 1946 C CG . LYS B 43 ? 0.5390 0.5405 0.5872 0.0457 -0.0115 0.0420 43 LYS H CG 1947 C CD . LYS B 43 ? 0.6960 0.7001 0.7406 0.0438 -0.0208 0.0397 43 LYS H CD 1948 C CE . LYS B 43 ? 0.8472 0.8568 0.8944 0.0447 -0.0247 0.0451 43 LYS H CE 1949 N NZ . LYS B 43 ? 0.9320 0.9433 0.9736 0.0424 -0.0342 0.0426 43 LYS H NZ 1950 N N . ARG B 44 ? 0.3414 0.3340 0.3953 0.0434 -0.0018 0.0362 44 ARG H N 1951 C CA . ARG B 44 ? 0.3569 0.3468 0.4112 0.0426 0.0004 0.0341 44 ARG H CA 1952 C C . ARG B 44 ? 0.4077 0.3955 0.4532 0.0409 -0.0025 0.0277 44 ARG H C 1953 O O . ARG B 44 ? 0.3899 0.3784 0.4301 0.0403 -0.0070 0.0249 44 ARG H O 1954 C CB . ARG B 44 ? 0.3998 0.3934 0.4663 0.0420 -0.0025 0.0379 44 ARG H CB 1955 C CG . ARG B 44 ? 0.4186 0.4146 0.4863 0.0396 -0.0112 0.0354 44 ARG H CG 1956 C CD . ARG B 44 ? 0.3907 0.3905 0.4717 0.0385 -0.0141 0.0397 44 ARG H CD 1957 N NE . ARG B 44 ? 0.3267 0.3320 0.4173 0.0390 -0.0164 0.0460 44 ARG H NE 1958 C CZ . ARG B 44 ? 0.3292 0.3391 0.4340 0.0385 -0.0179 0.0518 44 ARG H CZ 1959 N NH1 . ARG B 44 ? 0.2978 0.3068 0.4084 0.0376 -0.0170 0.0520 44 ARG H NH1 1960 N NH2 . ARG B 44 ? 0.3070 0.3229 0.4210 0.0389 -0.0203 0.0582 44 ARG H NH2 1961 N N . LEU B 45 ? 0.3325 0.3177 0.3765 0.0403 0.0003 0.0258 45 LEU H N 1962 C CA . LEU B 45 ? 0.3199 0.3038 0.3576 0.0390 -0.0021 0.0207 45 LEU H CA 1963 C C . LEU B 45 ? 0.3508 0.3367 0.3928 0.0379 -0.0087 0.0198 45 LEU H C 1964 O O . LEU B 45 ? 0.2822 0.2702 0.3337 0.0375 -0.0106 0.0231 45 LEU H O 1965 C CB . LEU B 45 ? 0.2850 0.2664 0.3209 0.0387 0.0023 0.0200 45 LEU H CB 1966 C CG . LEU B 45 ? 0.3429 0.3209 0.3726 0.0391 0.0086 0.0200 45 LEU H CG 1967 C CD1 . LEU B 45 ? 0.3730 0.3483 0.4029 0.0391 0.0132 0.0212 45 LEU H CD1 1968 C CD2 . LEU B 45 ? 0.3481 0.3249 0.3684 0.0381 0.0082 0.0158 45 LEU H CD2 1969 N N . GLU B 46 ? 0.3005 0.2852 0.3356 0.0373 -0.0120 0.0154 46 GLU H N 1970 C CA . GLU B 46 ? 0.2804 0.2648 0.3171 0.0360 -0.0179 0.0133 46 GLU H CA 1971 C C . GLU B 46 ? 0.3125 0.2943 0.3439 0.0359 -0.0176 0.0091 46 GLU H C 1972 O O . GLU B 46 ? 0.3191 0.2997 0.3423 0.0367 -0.0161 0.0064 46 GLU H O 1973 C CB . GLU B 46 ? 0.3097 0.2946 0.3424 0.0358 -0.0229 0.0122 46 GLU H CB 1974 C CG . GLU B 46 ? 0.5214 0.5045 0.5542 0.0340 -0.0293 0.0094 46 GLU H CG 1975 C CD . GLU B 46 ? 0.6312 0.6126 0.6546 0.0340 -0.0335 0.0064 46 GLU H CD 1976 O OE1 . GLU B 46 ? 0.6087 0.5909 0.6260 0.0356 -0.0313 0.0067 46 GLU H OE1 1977 O OE2 . GLU B 46 ? 0.6567 0.6353 0.6784 0.0323 -0.0389 0.0036 46 GLU H OE2 1978 N N . TRP B 47 ? 0.3047 0.2858 0.3418 0.0351 -0.0188 0.0092 47 TRP H N 1979 C CA . TRP B 47 ? 0.3517 0.3304 0.3855 0.0352 -0.0186 0.0060 47 TRP H CA 1980 C C . TRP B 47 ? 0.3214 0.2971 0.3488 0.0351 -0.0225 0.0019 47 TRP H C 1981 O O . TRP B 47 ? 0.2928 0.2674 0.3217 0.0338 -0.0274 0.0014 47 TRP H O 1982 C CB . TRP B 47 ? 0.3396 0.3181 0.3820 0.0345 -0.0189 0.0078 47 TRP H CB 1983 C CG . TRP B 47 ? 0.3460 0.3222 0.3868 0.0348 -0.0184 0.0055 47 TRP H CG 1984 C CD1 . TRP B 47 ? 0.3204 0.2973 0.3577 0.0360 -0.0145 0.0053 47 TRP H CD1 1985 C CD2 . TRP B 47 ? 0.4215 0.3943 0.4648 0.0341 -0.0218 0.0035 47 TRP H CD2 1986 N NE1 . TRP B 47 ? 0.2967 0.2715 0.3348 0.0364 -0.0150 0.0039 47 TRP H NE1 1987 C CE2 . TRP B 47 ? 0.3384 0.3100 0.3799 0.0353 -0.0192 0.0025 47 TRP H CE2 1988 C CE3 . TRP B 47 ? 0.3338 0.3041 0.3805 0.0321 -0.0271 0.0024 47 TRP H CE3 1989 C CZ2 . TRP B 47 ? 0.3493 0.3166 0.3924 0.0353 -0.0208 0.0005 47 TRP H CZ2 1990 C CZ3 . TRP B 47 ? 0.3390 0.3045 0.3866 0.0315 -0.0291 -0.0001 47 TRP H CZ3 1991 C CH2 . TRP B 47 ? 0.3986 0.3623 0.4443 0.0333 -0.0255 -0.0010 47 TRP H CH2 1992 N N . ILE B 48 ? 0.2808 0.2549 0.3009 0.0364 -0.0204 -0.0008 48 ILE H N 1993 C CA . ILE B 48 ? 0.2522 0.2226 0.2649 0.0371 -0.0227 -0.0047 48 ILE H CA 1994 C C . ILE B 48 ? 0.3053 0.2719 0.3191 0.0373 -0.0230 -0.0068 48 ILE H C 1995 O O . ILE B 48 ? 0.3058 0.2674 0.3171 0.0367 -0.0265 -0.0097 48 ILE H O 1996 C CB . ILE B 48 ? 0.2384 0.2094 0.2428 0.0389 -0.0194 -0.0058 48 ILE H CB 1997 C CG1 . ILE B 48 ? 0.2082 0.1820 0.2111 0.0389 -0.0190 -0.0038 48 ILE H CG1 1998 C CG2 . ILE B 48 ? 0.2884 0.2547 0.2845 0.0403 -0.0207 -0.0097 48 ILE H CG2 1999 C CD1 . ILE B 48 ? 0.2492 0.2241 0.2457 0.0403 -0.0152 -0.0041 48 ILE H CD1 2000 N N . GLY B 49 ? 0.2663 0.2348 0.2834 0.0381 -0.0193 -0.0053 49 GLY H N 2001 C CA . GLY B 49 ? 0.2978 0.2634 0.3169 0.0388 -0.0187 -0.0063 49 GLY H CA 2002 C C . GLY B 49 ? 0.3095 0.2788 0.3303 0.0400 -0.0144 -0.0040 49 GLY H C 2003 O O . GLY B 49 ? 0.3348 0.3083 0.3542 0.0399 -0.0122 -0.0022 49 GLY H O 2004 N N . GLU B 50 ? 0.2897 0.2572 0.3134 0.0410 -0.0134 -0.0039 50 GLU H N 2005 C CA . GLU B 50 ? 0.3458 0.3173 0.3718 0.0420 -0.0099 -0.0011 50 GLU H CA 2006 C C . GLU B 50 ? 0.3646 0.3331 0.3918 0.0441 -0.0087 -0.0017 50 GLU H C 2007 O O . GLU B 50 ? 0.3610 0.3231 0.3880 0.0442 -0.0104 -0.0044 50 GLU H O 2008 C CB . GLU B 50 ? 0.3408 0.3154 0.3734 0.0407 -0.0094 0.0025 50 GLU H CB 2009 C CG . GLU B 50 ? 0.2967 0.2680 0.3366 0.0402 -0.0110 0.0031 50 GLU H CG 2010 C CD . GLU B 50 ? 0.3665 0.3406 0.4128 0.0390 -0.0103 0.0069 50 GLU H CD 2011 O OE1 . GLU B 50 ? 0.4049 0.3818 0.4491 0.0383 -0.0093 0.0080 50 GLU H OE1 2012 O OE2 . GLU B 50 ? 0.4506 0.4234 0.5040 0.0389 -0.0103 0.0088 50 GLU H OE2 2013 N N . ILE B 51 ? 0.2927 0.2653 0.3211 0.0456 -0.0057 0.0009 51 ILE H N 2014 C CA . ILE B 51 ? 0.2898 0.2600 0.3203 0.0481 -0.0037 0.0014 51 ILE H CA 2015 C C . ILE B 51 ? 0.3216 0.2984 0.3572 0.0488 -0.0014 0.0062 51 ILE H C 2016 O O . ILE B 51 ? 0.2594 0.2424 0.2936 0.0476 -0.0010 0.0084 51 ILE H O 2017 C CB . ILE B 51 ? 0.3754 0.3431 0.3996 0.0505 -0.0020 -0.0011 51 ILE H CB 2018 C CG1 . ILE B 51 ? 0.3230 0.2858 0.3492 0.0535 0.0006 -0.0012 51 ILE H CG1 2019 C CG2 . ILE B 51 ? 0.2681 0.2431 0.2901 0.0509 -0.0001 0.0012 51 ILE H CG2 2020 C CD1 . ILE B 51 ? 0.3566 0.3158 0.3762 0.0565 0.0032 -0.0034 51 ILE H CD1 2021 N N . LYS B 52 ? 0.2586 0.2335 0.2996 0.0506 0.0001 0.0081 52 LYS H N 2022 C CA . LYS B 52 ? 0.2849 0.2664 0.3304 0.0518 0.0022 0.0133 52 LYS H CA 2023 C C . LYS B 52 ? 0.3381 0.3189 0.3850 0.0554 0.0052 0.0144 52 LYS H C 2024 O O . LYS B 52 ? 0.3916 0.3795 0.4396 0.0565 0.0068 0.0181 52 LYS H O 2025 C CB . LYS B 52 ? 0.3686 0.3502 0.4210 0.0512 0.0021 0.0164 52 LYS H CB 2026 C CG . LYS B 52 ? 0.4225 0.4110 0.4789 0.0526 0.0041 0.0222 52 LYS H CG 2027 C CD . LYS B 52 ? 0.4941 0.4817 0.5576 0.0531 0.0048 0.0257 52 LYS H CD 2028 C CE . LYS B 52 ? 0.4692 0.4588 0.5324 0.0504 0.0035 0.0268 52 LYS H CE 2029 N NZ . LYS B 52 ? 0.4939 0.4819 0.5645 0.0511 0.0046 0.0303 52 LYS H NZ 2030 N N . HIS B 53 ? 0.2920 0.2640 0.3391 0.0571 0.0061 0.0114 53 HIS H N 2031 C CA . HIS B 53 ? 0.3336 0.3028 0.3811 0.0611 0.0099 0.0119 53 HIS H CA 2032 C C . HIS B 53 ? 0.3347 0.2960 0.3738 0.0620 0.0102 0.0062 53 HIS H C 2033 O O . HIS B 53 ? 0.3627 0.3164 0.3979 0.0600 0.0074 0.0015 53 HIS H O 2034 C CB . HIS B 53 ? 0.4321 0.3957 0.4862 0.0631 0.0119 0.0134 53 HIS H CB 2035 C CG . HIS B 53 ? 0.4529 0.4232 0.5149 0.0623 0.0117 0.0191 53 HIS H CG 2036 N ND1 . HIS B 53 ? 0.4016 0.3672 0.4688 0.0613 0.0109 0.0193 53 HIS H ND1 2037 C CD2 . HIS B 53 ? 0.4649 0.4458 0.5300 0.0623 0.0120 0.0248 53 HIS H CD2 2038 C CE1 . HIS B 53 ? 0.4588 0.4320 0.5318 0.0612 0.0112 0.0252 53 HIS H CE1 2039 N NE2 . HIS B 53 ? 0.4560 0.4384 0.5272 0.0617 0.0116 0.0284 53 HIS H NE2 2040 N N . ASN B 54 ? 0.4171 0.3805 0.4534 0.0649 0.0134 0.0071 54 ASN H N 2041 C CA . ASN B 54 ? 0.5365 0.4915 0.5641 0.0667 0.0149 0.0022 54 ASN H CA 2042 C C . ASN B 54 ? 0.5213 0.4634 0.5470 0.0678 0.0157 -0.0019 54 ASN H C 2043 O O . ASN B 54 ? 0.5004 0.4404 0.5325 0.0699 0.0184 0.0007 54 ASN H O 2044 C CB . ASN B 54 ? 0.5368 0.4958 0.5641 0.0708 0.0199 0.0052 54 ASN H CB 2045 C CG . ASN B 54 ? 0.5618 0.5305 0.5875 0.0691 0.0187 0.0071 54 ASN H CG 2046 O OD1 . ASN B 54 ? 0.5350 0.5032 0.5552 0.0660 0.0152 0.0038 54 ASN H OD1 2047 N ND2 . ASN B 54 ? 0.5375 0.5153 0.5689 0.0710 0.0215 0.0127 54 ASN H ND2 2048 N N . GLY B 55 ? 0.4913 0.4246 0.5080 0.0661 0.0130 -0.0080 55 GLY H N 2049 C CA . GLY B 55 ? 0.4880 0.4081 0.5018 0.0660 0.0126 -0.0126 55 GLY H CA 2050 C C . GLY B 55 ? 0.4891 0.4078 0.5070 0.0612 0.0069 -0.0141 55 GLY H C 2051 O O . GLY B 55 ? 0.4859 0.3937 0.5001 0.0595 0.0046 -0.0188 55 GLY H O 2052 N N . SER B 56 ? 0.4707 0.4000 0.4960 0.0589 0.0046 -0.0098 56 SER H N 2053 C CA . SER B 56 ? 0.3804 0.3097 0.4105 0.0547 -0.0003 -0.0102 56 SER H CA 2054 C C . SER B 56 ? 0.3613 0.2981 0.3897 0.0517 -0.0039 -0.0098 56 SER H C 2055 O O . SER B 56 ? 0.3458 0.2902 0.3810 0.0503 -0.0047 -0.0058 56 SER H O 2056 C CB . SER B 56 ? 0.3940 0.3272 0.4355 0.0549 0.0012 -0.0050 56 SER H CB 2057 O OG . SER B 56 ? 0.5276 0.4538 0.5716 0.0578 0.0050 -0.0048 56 SER H OG 2058 N N . PRO B 57 ? 0.3494 0.2838 0.3687 0.0511 -0.0059 -0.0137 57 PRO H N 2059 C CA . PRO B 57 ? 0.3549 0.2957 0.3735 0.0484 -0.0091 -0.0129 57 PRO H CA 2060 C C . PRO B 57 ? 0.3738 0.3124 0.3965 0.0446 -0.0141 -0.0139 57 PRO H C 2061 O O . PRO B 57 ? 0.3967 0.3272 0.4201 0.0435 -0.0160 -0.0165 57 PRO H O 2062 C CB . PRO B 57 ? 0.3522 0.2907 0.3598 0.0495 -0.0092 -0.0163 57 PRO H CB 2063 C CG . PRO B 57 ? 0.3738 0.3010 0.3751 0.0509 -0.0085 -0.0208 57 PRO H CG 2064 C CD . PRO B 57 ? 0.4142 0.3397 0.4227 0.0530 -0.0048 -0.0185 57 PRO H CD 2065 N N . ASN B 58 ? 0.4015 0.3468 0.4274 0.0425 -0.0161 -0.0115 58 ASN H N 2066 C CA . ASN B 58 ? 0.3780 0.3225 0.4083 0.0391 -0.0209 -0.0116 58 ASN H CA 2067 C C . ASN B 58 ? 0.4049 0.3528 0.4302 0.0379 -0.0233 -0.0121 58 ASN H C 2068 O O . ASN B 58 ? 0.3771 0.3318 0.4030 0.0385 -0.0212 -0.0093 58 ASN H O 2069 C CB . ASN B 58 ? 0.4262 0.3757 0.4678 0.0381 -0.0199 -0.0067 58 ASN H CB 2070 C CG . ASN B 58 ? 0.4832 0.4319 0.5318 0.0347 -0.0244 -0.0060 58 ASN H CG 2071 O OD1 . ASN B 58 ? 0.5169 0.4606 0.5625 0.0326 -0.0289 -0.0094 58 ASN H OD1 2072 N ND2 . ASN B 58 ? 0.4996 0.4533 0.5576 0.0342 -0.0232 -0.0012 58 ASN H ND2 2073 N N . TYR B 59 ? 0.3707 0.3136 0.3908 0.0361 -0.0278 -0.0157 59 TYR H N 2074 C CA . TYR B 59 ? 0.3593 0.3052 0.3741 0.0354 -0.0302 -0.0159 59 TYR H CA 2075 C C . TYR B 59 ? 0.4714 0.4195 0.4925 0.0319 -0.0355 -0.0142 59 TYR H C 2076 O O . TYR B 59 ? 0.4743 0.4193 0.5016 0.0294 -0.0389 -0.0144 59 TYR H O 2077 C CB . TYR B 59 ? 0.3119 0.2514 0.3139 0.0364 -0.0313 -0.0207 59 TYR H CB 2078 C CG . TYR B 59 ? 0.3766 0.3142 0.3724 0.0402 -0.0257 -0.0220 59 TYR H CG 2079 C CD1 . TYR B 59 ? 0.3475 0.2922 0.3448 0.0423 -0.0212 -0.0188 59 TYR H CD1 2080 C CD2 . TYR B 59 ? 0.4325 0.3608 0.4211 0.0416 -0.0249 -0.0262 59 TYR H CD2 2081 C CE1 . TYR B 59 ? 0.3846 0.3286 0.3778 0.0456 -0.0163 -0.0190 59 TYR H CE1 2082 C CE2 . TYR B 59 ? 0.4085 0.3355 0.3926 0.0456 -0.0192 -0.0264 59 TYR H CE2 2083 C CZ . TYR B 59 ? 0.3615 0.2971 0.3487 0.0475 -0.0151 -0.0226 59 TYR H CZ 2084 O OH . TYR B 59 ? 0.4136 0.3491 0.3980 0.0513 -0.0097 -0.0220 59 TYR H OH 2085 N N . HIS B 60 ? 0.5171 0.4707 0.5372 0.0319 -0.0359 -0.0120 60 HIS H N 2086 C CA . HIS B 60 ? 0.4304 0.3865 0.4549 0.0291 -0.0411 -0.0102 60 HIS H CA 2087 C C . HIS B 60 ? 0.4839 0.4335 0.5000 0.0272 -0.0470 -0.0147 60 HIS H C 2088 O O . HIS B 60 ? 0.5713 0.5179 0.5754 0.0290 -0.0463 -0.0179 60 HIS H O 2089 C CB . HIS B 60 ? 0.4142 0.3769 0.4382 0.0302 -0.0392 -0.0069 60 HIS H CB 2090 C CG . HIS B 60 ? 0.5575 0.5245 0.5889 0.0280 -0.0434 -0.0032 60 HIS H CG 2091 N ND1 . HIS B 60 ? 0.6550 0.6211 0.6825 0.0261 -0.0496 -0.0043 60 HIS H ND1 2092 C CD2 . HIS B 60 ? 0.6257 0.5982 0.6684 0.0276 -0.0420 0.0022 60 HIS H CD2 2093 C CE1 . HIS B 60 ? 0.6954 0.6672 0.7328 0.0245 -0.0522 0.0006 60 HIS H CE1 2094 N NE2 . HIS B 60 ? 0.7068 0.6823 0.7537 0.0256 -0.0473 0.0046 60 HIS H NE2 2095 N N . PRO B 61 ? 0.4730 0.4201 0.4949 0.0236 -0.0527 -0.0151 61 PRO H N 2096 C CA . PRO B 61 ? 0.4268 0.3657 0.4402 0.0209 -0.0588 -0.0202 61 PRO H CA 2097 C C . PRO B 61 ? 0.4698 0.4084 0.4709 0.0211 -0.0619 -0.0220 61 PRO H C 2098 O O . PRO B 61 ? 0.5564 0.4866 0.5442 0.0213 -0.0633 -0.0275 61 PRO H O 2099 C CB . PRO B 61 ? 0.4824 0.4228 0.5080 0.0162 -0.0650 -0.0178 61 PRO H CB 2100 C CG . PRO B 61 ? 0.5131 0.4584 0.5523 0.0173 -0.0601 -0.0131 61 PRO H CG 2101 C CD . PRO B 61 ? 0.4079 0.3596 0.4452 0.0215 -0.0536 -0.0103 61 PRO H CD 2102 N N . SER B 62 ? 0.4570 0.4041 0.4619 0.0215 -0.0624 -0.0174 62 SER H N 2103 C CA . SER B 62 ? 0.5340 0.4818 0.5284 0.0216 -0.0656 -0.0182 62 SER H CA 2104 C C . SER B 62 ? 0.5935 0.5387 0.5750 0.0260 -0.0597 -0.0208 62 SER H C 2105 O O . SER B 62 ? 0.6725 0.6169 0.6433 0.0268 -0.0614 -0.0219 62 SER H O 2106 C CB . SER B 62 ? 0.5417 0.4995 0.5454 0.0211 -0.0671 -0.0116 62 SER H CB 2107 O OG . SER B 62 ? 0.6008 0.5640 0.6086 0.0246 -0.0596 -0.0082 62 SER H OG 2108 N N . LEU B 63 ? 0.5231 0.4673 0.5059 0.0288 -0.0528 -0.0213 63 LEU H N 2109 C CA . LEU B 63 ? 0.5458 0.4891 0.5192 0.0329 -0.0468 -0.0227 63 LEU H CA 2110 C C . LEU B 63 ? 0.5933 0.5284 0.5601 0.0348 -0.0435 -0.0272 63 LEU H C 2111 O O . LEU B 63 ? 0.5849 0.5187 0.5443 0.0383 -0.0383 -0.0282 63 LEU H O 2112 C CB . LEU B 63 ? 0.4638 0.4150 0.4450 0.0349 -0.0409 -0.0182 63 LEU H CB 2113 C CG . LEU B 63 ? 0.4594 0.4179 0.4445 0.0345 -0.0417 -0.0137 63 LEU H CG 2114 C CD1 . LEU B 63 ? 0.5257 0.4898 0.5189 0.0357 -0.0360 -0.0099 63 LEU H CD1 2115 C CD2 . LEU B 63 ? 0.4491 0.4069 0.4227 0.0363 -0.0416 -0.0146 63 LEU H CD2 2116 N N . LYS B 64 ? 0.5809 0.5103 0.5511 0.0325 -0.0462 -0.0295 64 LYS H N 2117 C CA . LYS B 64 ? 0.6219 0.5433 0.5886 0.0344 -0.0424 -0.0330 64 LYS H CA 2118 C C . LYS B 64 ? 0.5823 0.4957 0.5328 0.0373 -0.0400 -0.0375 64 LYS H C 2119 O O . LYS B 64 ? 0.6029 0.5147 0.5509 0.0412 -0.0334 -0.0378 64 LYS H O 2120 C CB . LYS B 64 ? 0.7599 0.6750 0.7316 0.0308 -0.0468 -0.0351 64 LYS H CB 2121 C CG . LYS B 64 ? 0.9056 0.8120 0.8754 0.0328 -0.0424 -0.0381 64 LYS H CG 2122 C CD . LYS B 64 ? 0.9949 0.8927 0.9670 0.0287 -0.0475 -0.0413 64 LYS H CD 2123 C CE . LYS B 64 ? 1.0600 0.9468 1.0277 0.0311 -0.0427 -0.0450 64 LYS H CE 2124 N NZ . LYS B 64 ? 1.1042 0.9802 1.0717 0.0268 -0.0477 -0.0491 64 LYS H NZ 2125 N N . SER B 65 ? 0.5686 0.4774 0.5082 0.0356 -0.0452 -0.0405 65 SER H N 2126 C CA . SER B 65 ? 0.5733 0.4729 0.4958 0.0383 -0.0431 -0.0451 65 SER H CA 2127 C C . SER B 65 ? 0.5568 0.4616 0.4743 0.0428 -0.0372 -0.0427 65 SER H C 2128 O O . SER B 65 ? 0.5872 0.4853 0.4921 0.0463 -0.0331 -0.0456 65 SER H O 2129 C CB . SER B 65 ? 0.6526 0.5459 0.5638 0.0347 -0.0511 -0.0489 65 SER H CB 2130 O OG . SER B 65 ? 0.7364 0.6388 0.6492 0.0334 -0.0551 -0.0450 65 SER H OG 2131 N N . ARG B 66 ? 0.4664 0.3828 0.3938 0.0428 -0.0362 -0.0374 66 ARG H N 2132 C CA . ARG B 66 ? 0.4835 0.4051 0.4074 0.0465 -0.0310 -0.0348 66 ARG H CA 2133 C C . ARG B 66 ? 0.4547 0.3828 0.3888 0.0486 -0.0245 -0.0313 66 ARG H C 2134 O O . ARG B 66 ? 0.4613 0.3921 0.3925 0.0518 -0.0192 -0.0297 66 ARG H O 2135 C CB . ARG B 66 ? 0.5216 0.4505 0.4466 0.0449 -0.0346 -0.0315 66 ARG H CB 2136 C CG . ARG B 66 ? 0.5436 0.4676 0.4567 0.0433 -0.0408 -0.0340 66 ARG H CG 2137 C CD . ARG B 66 ? 0.4866 0.4182 0.3991 0.0437 -0.0419 -0.0299 66 ARG H CD 2138 N NE . ARG B 66 ? 0.4688 0.4094 0.3961 0.0411 -0.0442 -0.0250 66 ARG H NE 2139 C CZ . ARG B 66 ? 0.4508 0.3993 0.3841 0.0424 -0.0409 -0.0203 66 ARG H CZ 2140 N NH1 . ARG B 66 ? 0.4575 0.4067 0.3842 0.0458 -0.0356 -0.0195 66 ARG H NH1 2141 N NH2 . ARG B 66 ? 0.3576 0.3129 0.3036 0.0403 -0.0426 -0.0161 66 ARG H NH2 2142 N N . VAL B 67 ? 0.3836 0.3142 0.3295 0.0467 -0.0252 -0.0298 67 VAL H N 2143 C CA . VAL B 67 ? 0.4366 0.3745 0.3925 0.0479 -0.0204 -0.0259 67 VAL H CA 2144 C C . VAL B 67 ? 0.4553 0.3899 0.4132 0.0502 -0.0160 -0.0267 67 VAL H C 2145 O O . VAL B 67 ? 0.4287 0.3568 0.3875 0.0493 -0.0175 -0.0291 67 VAL H O 2146 C CB . VAL B 67 ? 0.4804 0.4245 0.4486 0.0446 -0.0232 -0.0227 67 VAL H CB 2147 C CG1 . VAL B 67 ? 0.5314 0.4811 0.5084 0.0455 -0.0187 -0.0194 67 VAL H CG1 2148 C CG2 . VAL B 67 ? 0.5946 0.5441 0.5632 0.0432 -0.0256 -0.0204 67 VAL H CG2 2149 N N . THR B 68 ? 0.3390 0.2783 0.2984 0.0530 -0.0104 -0.0241 68 THR H N 2150 C CA . THR B 68 ? 0.3328 0.2721 0.2975 0.0551 -0.0061 -0.0228 68 THR H CA 2151 C C . THR B 68 ? 0.4306 0.3802 0.4054 0.0543 -0.0042 -0.0179 68 THR H C 2152 O O . THR B 68 ? 0.4212 0.3765 0.3953 0.0544 -0.0028 -0.0158 68 THR H O 2153 C CB . THR B 68 ? 0.4302 0.3651 0.3872 0.0595 -0.0007 -0.0239 68 THR H CB 2154 O OG1 . THR B 68 ? 0.5141 0.4380 0.4597 0.0601 -0.0023 -0.0290 68 THR H OG1 2155 C CG2 . THR B 68 ? 0.5092 0.4450 0.4733 0.0620 0.0039 -0.0216 68 THR H CG2 2156 N N . ILE B 69 ? 0.3872 0.3385 0.3706 0.0535 -0.0042 -0.0161 69 ILE H N 2157 C CA . ILE B 69 ? 0.3390 0.2992 0.3304 0.0529 -0.0023 -0.0117 69 ILE H CA 2158 C C . ILE B 69 ? 0.3632 0.3239 0.3588 0.0556 0.0015 -0.0097 69 ILE H C 2159 O O . ILE B 69 ? 0.3918 0.3468 0.3890 0.0564 0.0016 -0.0110 69 ILE H O 2160 C CB . ILE B 69 ? 0.2874 0.2506 0.2858 0.0496 -0.0054 -0.0101 69 ILE H CB 2161 C CG1 . ILE B 69 ? 0.2898 0.2537 0.2854 0.0473 -0.0084 -0.0109 69 ILE H CG1 2162 C CG2 . ILE B 69 ? 0.3084 0.2792 0.3132 0.0490 -0.0033 -0.0059 69 ILE H CG2 2163 C CD1 . ILE B 69 ? 0.2790 0.2449 0.2815 0.0446 -0.0110 -0.0092 69 ILE H CD1 2164 N N . SER B 70 ? 0.3825 0.3502 0.3806 0.0568 0.0047 -0.0061 70 SER H N 2165 C CA . SER B 70 ? 0.3472 0.3166 0.3499 0.0598 0.0086 -0.0032 70 SER H CA 2166 C C . SER B 70 ? 0.4065 0.3865 0.4165 0.0586 0.0093 0.0020 70 SER H C 2167 O O . SER B 70 ? 0.4037 0.3889 0.4130 0.0560 0.0080 0.0029 70 SER H O 2168 C CB . SER B 70 ? 0.3552 0.3208 0.3521 0.0638 0.0127 -0.0043 70 SER H CB 2169 O OG . SER B 70 ? 0.4500 0.4203 0.4437 0.0634 0.0135 -0.0033 70 SER H OG 2170 N N . LEU B 71 ? 0.4035 0.3863 0.4201 0.0604 0.0114 0.0056 71 LEU H N 2171 C CA . LEU B 71 ? 0.3930 0.3861 0.4162 0.0591 0.0116 0.0110 71 LEU H CA 2172 C C . LEU B 71 ? 0.4023 0.4004 0.4284 0.0623 0.0156 0.0148 71 LEU H C 2173 O O . LEU B 71 ? 0.3352 0.3287 0.3615 0.0665 0.0194 0.0148 71 LEU H O 2174 C CB . LEU B 71 ? 0.3740 0.3688 0.4040 0.0588 0.0108 0.0138 71 LEU H CB 2175 C CG . LEU B 71 ? 0.4160 0.4076 0.4458 0.0559 0.0074 0.0117 71 LEU H CG 2176 C CD1 . LEU B 71 ? 0.4501 0.4430 0.4869 0.0566 0.0078 0.0151 71 LEU H CD1 2177 C CD2 . LEU B 71 ? 0.3407 0.3371 0.3683 0.0518 0.0049 0.0119 71 LEU H CD2 2178 N N . ASP B 72 ? 0.3522 0.3592 0.3805 0.0601 0.0150 0.0181 72 ASP H N 2179 C CA . ASP B 72 ? 0.3276 0.3421 0.3617 0.0622 0.0182 0.0234 72 ASP H CA 2180 C C . ASP B 72 ? 0.3208 0.3446 0.3630 0.0601 0.0161 0.0290 72 ASP H C 2181 O O . ASP B 72 ? 0.3152 0.3461 0.3582 0.0558 0.0132 0.0308 72 ASP H O 2182 C CB . ASP B 72 ? 0.3301 0.3485 0.3618 0.0609 0.0187 0.0238 72 ASP H CB 2183 C CG . ASP B 72 ? 0.4786 0.5045 0.5173 0.0637 0.0225 0.0297 72 ASP H CG 2184 O OD1 . ASP B 72 ? 0.4353 0.4653 0.4817 0.0661 0.0241 0.0343 72 ASP H OD1 2185 O OD2 . ASP B 72 ? 0.5332 0.5614 0.5705 0.0636 0.0241 0.0302 72 ASP H OD2 2186 N N . MET B 73 ? 0.2912 0.3146 0.3389 0.0631 0.0178 0.0316 73 MET H N 2187 C CA . MET B 73 ? 0.3106 0.3414 0.3647 0.0613 0.0154 0.0365 73 MET H CA 2188 C C . MET B 73 ? 0.3276 0.3711 0.3889 0.0602 0.0150 0.0435 73 MET H C 2189 O O . MET B 73 ? 0.4008 0.4515 0.4644 0.0565 0.0112 0.0468 73 MET H O 2190 C CB . MET B 73 ? 0.2549 0.2810 0.3132 0.0652 0.0178 0.0376 73 MET H CB 2191 C CG . MET B 73 ? 0.4015 0.4170 0.4542 0.0643 0.0163 0.0315 73 MET H CG 2192 S SD . MET B 73 ? 0.4532 0.4582 0.5081 0.0694 0.0203 0.0302 73 MET H SD 2193 C CE . MET B 73 ? 0.1877 0.2009 0.2532 0.0701 0.0204 0.0380 73 MET H CE 2194 N N . SER B 74 ? 0.2723 0.3188 0.3371 0.0632 0.0186 0.0462 74 SER H N 2195 C CA . SER B 74 ? 0.3022 0.3618 0.3756 0.0621 0.0180 0.0537 74 SER H CA 2196 C C . SER B 74 ? 0.3094 0.3741 0.3794 0.0556 0.0134 0.0528 74 SER H C 2197 O O . SER B 74 ? 0.3020 0.3776 0.3777 0.0522 0.0104 0.0583 74 SER H O 2198 C CB . SER B 74 ? 0.2783 0.3397 0.3575 0.0675 0.0240 0.0575 74 SER H CB 2199 O OG . SER B 74 ? 0.3542 0.4065 0.4252 0.0694 0.0270 0.0517 74 SER H OG 2200 N N . LYS B 75 ? 0.3213 0.3780 0.3819 0.0537 0.0128 0.0460 75 LYS H N 2201 C CA . LYS B 75 ? 0.3488 0.4083 0.4054 0.0479 0.0092 0.0445 75 LYS H CA 2202 C C . LYS B 75 ? 0.3577 0.4126 0.4069 0.0434 0.0052 0.0401 75 LYS H C 2203 O O . LYS B 75 ? 0.3300 0.3858 0.3750 0.0385 0.0025 0.0385 75 LYS H O 2204 C CB . LYS B 75 ? 0.3236 0.3785 0.3757 0.0490 0.0120 0.0410 75 LYS H CB 2205 C CG . LYS B 75 ? 0.3149 0.3739 0.3736 0.0535 0.0168 0.0455 75 LYS H CG 2206 C CD . LYS B 75 ? 0.3153 0.3697 0.3686 0.0545 0.0196 0.0423 75 LYS H CD 2207 C CE . LYS B 75 ? 0.4602 0.5150 0.5176 0.0608 0.0259 0.0456 75 LYS H CE 2208 N NZ . LYS B 75 ? 0.6368 0.6870 0.6883 0.0622 0.0290 0.0430 75 LYS H NZ 2209 N N . ASN B 76 ? 0.2740 0.3234 0.3219 0.0454 0.0053 0.0383 76 ASN H N 2210 C CA . ASN B 76 ? 0.2159 0.2597 0.2571 0.0423 0.0026 0.0342 76 ASN H CA 2211 C C . ASN B 76 ? 0.2732 0.3100 0.3069 0.0409 0.0028 0.0285 76 ASN H C 2212 O O . ASN B 76 ? 0.2221 0.2580 0.2508 0.0366 0.0007 0.0266 76 ASN H O 2213 C CB . ASN B 76 ? 0.2387 0.2890 0.2795 0.0372 -0.0012 0.0372 76 ASN H CB 2214 C CG . ASN B 76 ? 0.3780 0.4324 0.4237 0.0386 -0.0021 0.0416 76 ASN H CG 2215 O OD1 . ASN B 76 ? 0.4017 0.4503 0.4471 0.0412 -0.0009 0.0401 76 ASN H OD1 2216 N ND2 . ASN B 76 ? 0.3208 0.3853 0.3713 0.0367 -0.0042 0.0476 76 ASN H ND2 2217 N N . GLN B 77 ? 0.2164 0.2477 0.2488 0.0447 0.0057 0.0258 77 GLN H N 2218 C CA . GLN B 77 ? 0.2837 0.3085 0.3091 0.0441 0.0059 0.0209 77 GLN H CA 2219 C C . GLN B 77 ? 0.2942 0.3103 0.3169 0.0474 0.0069 0.0170 77 GLN H C 2220 O O . GLN B 77 ? 0.3332 0.3477 0.3591 0.0509 0.0086 0.0180 77 GLN H O 2221 C CB . GLN B 77 ? 0.2826 0.3100 0.3079 0.0447 0.0081 0.0218 77 GLN H CB 2222 C CG . GLN B 77 ? 0.2328 0.2691 0.2618 0.0407 0.0066 0.0259 77 GLN H CG 2223 C CD . GLN B 77 ? 0.3141 0.3535 0.3447 0.0414 0.0091 0.0275 77 GLN H CD 2224 O OE1 . GLN B 77 ? 0.3181 0.3534 0.3469 0.0457 0.0125 0.0262 77 GLN H OE1 2225 N NE2 . GLN B 77 ? 0.2588 0.3054 0.2926 0.0370 0.0073 0.0306 77 GLN H NE2 2226 N N . PHE B 78 ? 0.2362 0.2464 0.2531 0.0462 0.0058 0.0129 78 PHE H N 2227 C CA . PHE B 78 ? 0.2569 0.2590 0.2706 0.0488 0.0060 0.0091 78 PHE H CA 2228 C C . PHE B 78 ? 0.3081 0.3064 0.3153 0.0485 0.0060 0.0059 78 PHE H C 2229 O O . PHE B 78 ? 0.3074 0.3084 0.3130 0.0459 0.0056 0.0064 78 PHE H O 2230 C CB . PHE B 78 ? 0.2384 0.2370 0.2535 0.0477 0.0038 0.0080 78 PHE H CB 2231 C CG . PHE B 78 ? 0.1895 0.1885 0.2030 0.0441 0.0018 0.0075 78 PHE H CG 2232 C CD1 . PHE B 78 ? 0.1844 0.1889 0.1992 0.0413 0.0014 0.0102 78 PHE H CD1 2233 C CD2 . PHE B 78 ? 0.1859 0.1796 0.1964 0.0435 0.0004 0.0044 78 PHE H CD2 2234 C CE1 . PHE B 78 ? 0.2335 0.2368 0.2456 0.0383 0.0004 0.0095 78 PHE H CE1 2235 C CE2 . PHE B 78 ? 0.2505 0.2442 0.2601 0.0408 -0.0005 0.0045 78 PHE H CE2 2236 C CZ . PHE B 78 ? 0.3042 0.3020 0.3142 0.0383 -0.0001 0.0068 78 PHE H CZ 2237 N N . SER B 79 ? 0.2821 0.2738 0.2852 0.0512 0.0064 0.0028 79 SER H N 2238 C CA . SER B 79 ? 0.2852 0.2736 0.2815 0.0518 0.0067 0.0005 79 SER H CA 2239 C C . SER B 79 ? 0.3306 0.3117 0.3223 0.0518 0.0041 -0.0034 79 SER H C 2240 O O . SER B 79 ? 0.3062 0.2834 0.2995 0.0522 0.0027 -0.0048 79 SER H O 2241 C CB . SER B 79 ? 0.3892 0.3772 0.3832 0.0555 0.0106 0.0011 79 SER H CB 2242 O OG . SER B 79 ? 0.4263 0.4221 0.4248 0.0549 0.0126 0.0052 79 SER H OG 2243 N N . LEU B 80 ? 0.2811 0.2609 0.2677 0.0511 0.0032 -0.0048 80 LEU H N 2244 C CA . LEU B 80 ? 0.3172 0.2911 0.2991 0.0509 0.0001 -0.0079 80 LEU H CA 2245 C C . LEU B 80 ? 0.3825 0.3526 0.3556 0.0534 0.0012 -0.0098 80 LEU H C 2246 O O . LEU B 80 ? 0.3018 0.2750 0.2729 0.0540 0.0036 -0.0081 80 LEU H O 2247 C CB . LEU B 80 ? 0.3029 0.2787 0.2868 0.0479 -0.0024 -0.0072 80 LEU H CB 2248 C CG . LEU B 80 ? 0.3280 0.2998 0.3073 0.0476 -0.0057 -0.0092 80 LEU H CG 2249 C CD1 . LEU B 80 ? 0.2965 0.2635 0.2768 0.0471 -0.0093 -0.0115 80 LEU H CD1 2250 C CD2 . LEU B 80 ? 0.3324 0.3072 0.3141 0.0455 -0.0065 -0.0073 80 LEU H CD2 2251 N N . ASN B 81 ? 0.3658 0.3287 0.3332 0.0547 -0.0005 -0.0131 81 ASN H N 2252 C CA . ASN B 81 ? 0.3056 0.2637 0.2626 0.0569 0.0001 -0.0153 81 ASN H CA 2253 C C . ASN B 81 ? 0.3915 0.3450 0.3438 0.0550 -0.0054 -0.0181 81 ASN H C 2254 O O . ASN B 81 ? 0.4227 0.3727 0.3773 0.0533 -0.0089 -0.0199 81 ASN H O 2255 C CB . ASN B 81 ? 0.4743 0.4267 0.4264 0.0607 0.0037 -0.0170 81 ASN H CB 2256 C CG . ASN B 81 ? 0.7383 0.6944 0.6897 0.0638 0.0095 -0.0142 81 ASN H CG 2257 O OD1 . ASN B 81 ? 0.7494 0.7133 0.7064 0.0625 0.0107 -0.0106 81 ASN H OD1 2258 N ND2 . ASN B 81 ? 1.0346 0.9847 0.9789 0.0678 0.0134 -0.0156 81 ASN H ND2 2259 N N . LEU B 82 ? 0.3564 0.3105 0.3027 0.0552 -0.0063 -0.0178 82 LEU H N 2260 C CA . LEU B 82 ? 0.4552 0.4063 0.3969 0.0533 -0.0118 -0.0195 82 LEU H CA 2261 C C . LEU B 82 ? 0.4977 0.4446 0.4264 0.0557 -0.0113 -0.0210 82 LEU H C 2262 O O . LEU B 82 ? 0.4598 0.4106 0.3868 0.0571 -0.0085 -0.0184 82 LEU H O 2263 C CB . LEU B 82 ? 0.3957 0.3532 0.3450 0.0506 -0.0141 -0.0162 82 LEU H CB 2264 C CG . LEU B 82 ? 0.4266 0.3834 0.3742 0.0486 -0.0200 -0.0163 82 LEU H CG 2265 C CD1 . LEU B 82 ? 0.4512 0.4038 0.4009 0.0462 -0.0251 -0.0189 82 LEU H CD1 2266 C CD2 . LEU B 82 ? 0.4094 0.3729 0.3650 0.0470 -0.0201 -0.0121 82 LEU H CD2 2267 N N . THR B 83 A 0.4451 0.3835 0.3643 0.0562 -0.0139 -0.0252 82 THR H N 2268 C CA . THR B 83 A 0.3998 0.3325 0.3043 0.0588 -0.0130 -0.0273 82 THR H CA 2269 C C . THR B 83 A 0.4388 0.3718 0.3375 0.0568 -0.0191 -0.0272 82 THR H C 2270 O O . THR B 83 A 0.3867 0.3225 0.2923 0.0531 -0.0249 -0.0264 82 THR H O 2271 C CB . THR B 83 A 0.4195 0.3409 0.3140 0.0605 -0.0124 -0.0324 82 THR H CB 2272 O OG1 . THR B 83 A 0.4510 0.3682 0.3476 0.0566 -0.0188 -0.0354 82 THR H OG1 2273 C CG2 . THR B 83 A 0.3620 0.2833 0.2613 0.0637 -0.0052 -0.0316 82 THR H CG2 2274 N N . SER B 84 B 0.4904 0.4207 0.3766 0.0595 -0.0176 -0.0274 82 SER H N 2275 C CA . SER B 84 B 0.4327 0.3632 0.3113 0.0582 -0.0231 -0.0268 82 SER H CA 2276 C C . SER B 84 B 0.4230 0.3630 0.3139 0.0554 -0.0263 -0.0221 82 SER H C 2277 O O . SER B 84 B 0.3681 0.3090 0.2612 0.0520 -0.0334 -0.0220 82 SER H O 2278 C CB . SER B 84 B 0.4630 0.3847 0.3317 0.0557 -0.0301 -0.0319 82 SER H CB 2279 O OG . SER B 84 B 0.5255 0.4366 0.3815 0.0585 -0.0264 -0.0367 82 SER H OG 2280 N N . VAL B 85 C 0.3509 0.2979 0.2502 0.0567 -0.0210 -0.0179 82 VAL H N 2281 C CA . VAL B 85 C 0.3701 0.3248 0.2809 0.0545 -0.0227 -0.0135 82 VAL H CA 2282 C C . VAL B 85 C 0.4484 0.4052 0.3538 0.0547 -0.0260 -0.0107 82 VAL H C 2283 O O . VAL B 85 C 0.4996 0.4537 0.3932 0.0573 -0.0245 -0.0110 82 VAL H O 2284 C CB . VAL B 85 C 0.3324 0.2926 0.2525 0.0554 -0.0161 -0.0102 82 VAL H CB 2285 C CG1 . VAL B 85 C 0.3455 0.3049 0.2720 0.0549 -0.0137 -0.0122 82 VAL H CG1 2286 C CG2 . VAL B 85 C 0.3177 0.2781 0.2308 0.0589 -0.0105 -0.0086 82 VAL H CG2 2287 N N . THR B 86 ? 0.4256 0.3874 0.3400 0.0520 -0.0303 -0.0077 83 THR H N 2288 C CA . THR B 86 ? 0.4682 0.4340 0.3809 0.0522 -0.0331 -0.0034 83 THR H CA 2289 C C . THR B 86 ? 0.4380 0.4107 0.3641 0.0520 -0.0296 0.0018 83 THR H C 2290 O O . THR B 86 ? 0.3851 0.3587 0.3198 0.0513 -0.0258 0.0015 83 THR H O 2291 C CB . THR B 86 ? 0.4429 0.4084 0.3539 0.0492 -0.0423 -0.0038 83 THR H CB 2292 O OG1 . THR B 86 ? 0.4556 0.4257 0.3816 0.0462 -0.0448 -0.0016 83 THR H OG1 2293 C CG2 . THR B 86 ? 0.4698 0.4267 0.3689 0.0483 -0.0460 -0.0103 83 THR H CG2 2294 N N . ALA B 87 ? 0.4019 0.3790 0.3292 0.0526 -0.0309 0.0067 84 ALA H N 2295 C CA . ALA B 87 ? 0.3996 0.3819 0.3386 0.0527 -0.0270 0.0119 84 ALA H CA 2296 C C . ALA B 87 ? 0.3922 0.3765 0.3439 0.0499 -0.0286 0.0124 84 ALA H C 2297 O O . ALA B 87 ? 0.4282 0.4142 0.3885 0.0499 -0.0236 0.0145 84 ALA H O 2298 C CB . ALA B 87 ? 0.3951 0.3816 0.3336 0.0539 -0.0288 0.0176 84 ALA H CB 2299 N N . ALA B 88 ? 0.4227 0.4060 0.3748 0.0475 -0.0354 0.0103 85 ALA H N 2300 C CA . ALA B 88 ? 0.4274 0.4126 0.3917 0.0450 -0.0372 0.0110 85 ALA H CA 2301 C C . ALA B 88 ? 0.4079 0.3904 0.3756 0.0447 -0.0324 0.0077 85 ALA H C 2302 O O . ALA B 88 ? 0.4518 0.4359 0.4297 0.0431 -0.0322 0.0088 85 ALA H O 2303 C CB . ALA B 88 ? 0.3986 0.3830 0.3622 0.0421 -0.0459 0.0094 85 ALA H CB 2304 N N . ASP B 89 ? 0.3198 0.2987 0.2794 0.0463 -0.0285 0.0042 86 ASP H N 2305 C CA . ASP B 89 ? 0.3234 0.3006 0.2862 0.0461 -0.0243 0.0017 86 ASP H CA 2306 C C . ASP B 89 ? 0.4006 0.3801 0.3674 0.0470 -0.0176 0.0044 86 ASP H C 2307 O O . ASP B 89 ? 0.3969 0.3758 0.3659 0.0466 -0.0139 0.0030 86 ASP H O 2308 C CB . ASP B 89 ? 0.3486 0.3209 0.3019 0.0473 -0.0236 -0.0030 86 ASP H CB 2309 C CG . ASP B 89 ? 0.4507 0.4186 0.3997 0.0459 -0.0297 -0.0066 86 ASP H CG 2310 O OD1 . ASP B 89 ? 0.4425 0.4111 0.3995 0.0434 -0.0331 -0.0065 86 ASP H OD1 2311 O OD2 . ASP B 89 ? 0.4602 0.4236 0.3975 0.0472 -0.0310 -0.0095 86 ASP H OD2 2312 N N . THR B 90 ? 0.3589 0.3410 0.3265 0.0479 -0.0163 0.0084 87 THR H N 2313 C CA . THR B 90 ? 0.3063 0.2895 0.2777 0.0484 -0.0101 0.0110 87 THR H CA 2314 C C . THR B 90 ? 0.2713 0.2552 0.2521 0.0466 -0.0087 0.0120 87 THR H C 2315 O O . THR B 90 ? 0.2857 0.2714 0.2728 0.0459 -0.0116 0.0144 87 THR H O 2316 C CB . THR B 90 ? 0.3720 0.3572 0.3428 0.0501 -0.0089 0.0155 87 THR H CB 2317 O OG1 . THR B 90 ? 0.3497 0.3340 0.3106 0.0521 -0.0092 0.0146 87 THR H OG1 2318 C CG2 . THR B 90 ? 0.3799 0.3650 0.3552 0.0502 -0.0022 0.0180 87 THR H CG2 2319 N N . ALA B 91 ? 0.3047 0.2873 0.2866 0.0458 -0.0043 0.0106 88 ALA H N 2320 C CA . ALA B 91 ? 0.2041 0.1865 0.1929 0.0441 -0.0027 0.0110 88 ALA H CA 2321 C C . ALA B 91 ? 0.2817 0.2626 0.2691 0.0430 0.0017 0.0093 88 ALA H C 2322 O O . ALA B 91 ? 0.2662 0.2470 0.2487 0.0434 0.0030 0.0077 88 ALA H O 2323 C CB . ALA B 91 ? 0.2543 0.2369 0.2464 0.0431 -0.0074 0.0093 88 ALA H CB 2324 N N . VAL B 92 ? 0.2484 0.2282 0.2402 0.0415 0.0041 0.0099 89 VAL H N 2325 C CA . VAL B 92 ? 0.2508 0.2297 0.2412 0.0398 0.0066 0.0079 89 VAL H CA 2326 C C . VAL B 92 ? 0.2762 0.2561 0.2683 0.0393 0.0033 0.0059 89 VAL H C 2327 O O . VAL B 92 ? 0.2341 0.2141 0.2308 0.0393 0.0013 0.0067 89 VAL H O 2328 C CB . VAL B 92 ? 0.3105 0.2867 0.3026 0.0383 0.0109 0.0091 89 VAL H CB 2329 C CG1 . VAL B 92 ? 0.2787 0.2543 0.2685 0.0358 0.0122 0.0070 89 VAL H CG1 2330 C CG2 . VAL B 92 ? 0.3002 0.2743 0.2909 0.0388 0.0148 0.0112 89 VAL H CG2 2331 N N . TYR B 93 ? 0.2690 0.2497 0.2581 0.0391 0.0031 0.0038 90 TYR H N 2332 C CA . TYR B 93 ? 0.2875 0.2688 0.2782 0.0389 0.0008 0.0022 90 TYR H CA 2333 C C . TYR B 93 ? 0.3259 0.3080 0.3180 0.0370 0.0028 0.0022 90 TYR H C 2334 O O . TYR B 93 ? 0.2903 0.2733 0.2800 0.0359 0.0050 0.0022 90 TYR H O 2335 C CB . TYR B 93 ? 0.2751 0.2567 0.2618 0.0406 -0.0006 0.0003 90 TYR H CB 2336 C CG . TYR B 93 ? 0.3169 0.2971 0.3011 0.0422 -0.0038 -0.0004 90 TYR H CG 2337 C CD1 . TYR B 93 ? 0.2789 0.2591 0.2604 0.0431 -0.0035 0.0010 90 TYR H CD1 2338 C CD2 . TYR B 93 ? 0.2339 0.2123 0.2180 0.0427 -0.0073 -0.0024 90 TYR H CD2 2339 C CE1 . TYR B 93 ? 0.3192 0.2983 0.2975 0.0443 -0.0071 0.0006 90 TYR H CE1 2340 C CE2 . TYR B 93 ? 0.3058 0.2822 0.2864 0.0435 -0.0109 -0.0034 90 TYR H CE2 2341 C CZ . TYR B 93 ? 0.3596 0.3367 0.3371 0.0442 -0.0111 -0.0018 90 TYR H CZ 2342 O OH . TYR B 93 ? 0.3593 0.3348 0.3324 0.0448 -0.0153 -0.0025 90 TYR H OH 2343 N N . PHE B 94 ? 0.2338 0.2156 0.2297 0.0365 0.0018 0.0025 91 PHE H N 2344 C CA . PHE B 94 ? 0.2603 0.2428 0.2567 0.0347 0.0032 0.0028 91 PHE H CA 2345 C C . PHE B 94 ? 0.2927 0.2771 0.2913 0.0354 0.0012 0.0022 91 PHE H C 2346 O O . PHE B 94 ? 0.2614 0.2449 0.2625 0.0367 -0.0012 0.0016 91 PHE H O 2347 C CB . PHE B 94 ? 0.2916 0.2720 0.2903 0.0339 0.0048 0.0044 91 PHE H CB 2348 C CG . PHE B 94 ? 0.2456 0.2234 0.2427 0.0336 0.0078 0.0054 91 PHE H CG 2349 C CD1 . PHE B 94 ? 0.1955 0.1713 0.1880 0.0316 0.0110 0.0050 91 PHE H CD1 2350 C CD2 . PHE B 94 ? 0.2838 0.2608 0.2845 0.0351 0.0076 0.0071 91 PHE H CD2 2351 C CE1 . PHE B 94 ? 0.2101 0.1821 0.2009 0.0314 0.0145 0.0059 91 PHE H CE1 2352 C CE2 . PHE B 94 ? 0.3081 0.2825 0.3081 0.0353 0.0111 0.0087 91 PHE H CE2 2353 C CZ . PHE B 94 ? 0.2540 0.2254 0.2488 0.0336 0.0149 0.0080 91 PHE H CZ 2354 N N . CYS B 95 ? 0.2556 0.2423 0.2534 0.0342 0.0020 0.0026 92 CYS H N 2355 C CA . CYS B 95 ? 0.3036 0.2922 0.3046 0.0348 0.0008 0.0030 92 CYS H CA 2356 C C . CYS B 95 ? 0.3115 0.3000 0.3137 0.0331 0.0016 0.0046 92 CYS H C 2357 O O . CYS B 95 ? 0.2828 0.2699 0.2817 0.0312 0.0034 0.0049 92 CYS H O 2358 C CB . CYS B 95 ? 0.3270 0.3192 0.3274 0.0351 0.0010 0.0033 92 CYS H CB 2359 S SG . CYS B 95 ? 0.3988 0.3946 0.3966 0.0317 0.0024 0.0047 92 CYS H SG 2360 N N . ALA B 96 ? 0.2117 0.2010 0.2179 0.0340 0.0006 0.0056 93 ALA H N 2361 C CA . ALA B 96 ? 0.2180 0.2071 0.2250 0.0329 0.0016 0.0075 93 ALA H CA 2362 C C . ALA B 96 ? 0.2858 0.2771 0.2971 0.0340 0.0006 0.0091 93 ALA H C 2363 O O . ALA B 96 ? 0.3302 0.3215 0.3449 0.0359 -0.0007 0.0085 93 ALA H O 2364 C CB . ALA B 96 ? 0.1529 0.1385 0.1620 0.0333 0.0025 0.0080 93 ALA H CB 2365 N N . ARG B 97 ? 0.1871 0.1797 0.1975 0.0329 0.0015 0.0113 94 ARG H N 2366 C CA . ARG B 97 ? 0.2158 0.2105 0.2308 0.0341 0.0010 0.0136 94 ARG H CA 2367 C C . ARG B 97 ? 0.2694 0.2611 0.2890 0.0352 0.0018 0.0148 94 ARG H C 2368 O O . ARG B 97 ? 0.2956 0.2846 0.3137 0.0345 0.0034 0.0150 94 ARG H O 2369 C CB . ARG B 97 ? 0.2248 0.2232 0.2362 0.0324 0.0013 0.0160 94 ARG H CB 2370 C CG . ARG B 97 ? 0.2469 0.2482 0.2631 0.0339 0.0009 0.0194 94 ARG H CG 2371 C CD . ARG B 97 ? 0.2232 0.2282 0.2349 0.0318 0.0008 0.0221 94 ARG H CD 2372 N NE . ARG B 97 ? 0.2861 0.2871 0.2925 0.0306 0.0027 0.0224 94 ARG H NE 2373 C CZ . ARG B 97 ? 0.3506 0.3530 0.3524 0.0293 0.0030 0.0250 94 ARG H CZ 2374 N NH1 . ARG B 97 ? 0.3675 0.3760 0.3701 0.0289 0.0010 0.0279 94 ARG H NH1 2375 N NH2 . ARG B 97 ? 0.3322 0.3297 0.3283 0.0287 0.0057 0.0250 94 ARG H NH2 2376 N N . ARG B 98 ? 0.2405 0.2324 0.2665 0.0369 0.0009 0.0160 95 ARG H N 2377 C CA . ARG B 98 ? 0.2210 0.2107 0.2531 0.0377 0.0015 0.0177 95 ARG H CA 2378 C C . ARG B 98 ? 0.2503 0.2419 0.2865 0.0389 0.0019 0.0209 95 ARG H C 2379 O O . ARG B 98 ? 0.3313 0.3239 0.3703 0.0401 0.0009 0.0207 95 ARG H O 2380 C CB . ARG B 98 ? 0.2696 0.2561 0.3065 0.0383 -0.0006 0.0156 95 ARG H CB 2381 C CG . ARG B 98 ? 0.3038 0.2883 0.3472 0.0383 -0.0003 0.0174 95 ARG H CG 2382 C CD . ARG B 98 ? 0.4262 0.4087 0.4773 0.0389 -0.0025 0.0172 95 ARG H CD 2383 N NE . ARG B 98 ? 0.3190 0.3024 0.3746 0.0399 -0.0010 0.0205 95 ARG H NE 2384 C CZ . ARG B 98 ? 0.3704 0.3518 0.4321 0.0406 -0.0021 0.0206 95 ARG H CZ 2385 N NH1 . ARG B 98 ? 0.3749 0.3525 0.4380 0.0402 -0.0050 0.0172 95 ARG H NH1 2386 N NH2 . ARG B 98 ? 0.2966 0.2792 0.3624 0.0417 -0.0001 0.0243 95 ARG H NH2 2387 N N . SER B 99 ? 0.3479 0.3399 0.3841 0.0387 0.0040 0.0241 96 SER H N 2388 C CA . SER B 99 ? 0.3674 0.3621 0.4064 0.0399 0.0047 0.0279 96 SER H CA 2389 C C . SER B 99 ? 0.3266 0.3192 0.3755 0.0415 0.0051 0.0299 96 SER H C 2390 O O . SER B 99 ? 0.3265 0.3158 0.3798 0.0413 0.0046 0.0287 96 SER H O 2391 C CB . SER B 99 ? 0.3766 0.3727 0.4091 0.0389 0.0068 0.0306 96 SER H CB 2392 O OG . SER B 99 ? 0.4094 0.4079 0.4334 0.0369 0.0057 0.0292 96 SER H OG 2393 N N . ASN B 100 ? 0.2898 0.2845 0.3424 0.0430 0.0057 0.0334 97 ASN H N 2394 C CA . ASN B 100 ? 0.2779 0.2703 0.3404 0.0445 0.0062 0.0355 97 ASN H CA 2395 C C . ASN B 100 ? 0.3350 0.3259 0.4009 0.0444 0.0085 0.0384 97 ASN H C 2396 O O . ASN B 100 ? 0.2410 0.2332 0.3009 0.0441 0.0107 0.0404 97 ASN H O 2397 C CB . ASN B 100 ? 0.2914 0.2865 0.3574 0.0465 0.0071 0.0392 97 ASN H CB 2398 C CG . ASN B 100 ? 0.3378 0.3339 0.4031 0.0473 0.0056 0.0370 97 ASN H CG 2399 O OD1 . ASN B 100 ? 0.3921 0.3853 0.4558 0.0467 0.0040 0.0324 97 ASN H OD1 2400 N ND2 . ASN B 100 ? 0.3479 0.3484 0.4146 0.0490 0.0065 0.0409 97 ASN H ND2 2401 N N . TRP B 101 ? 0.3008 0.2886 0.3763 0.0446 0.0080 0.0387 98 TRP H N 2402 C CA . TRP B 101 ? 0.3492 0.3360 0.4314 0.0450 0.0104 0.0428 98 TRP H CA 2403 C C . TRP B 101 ? 0.3392 0.3288 0.4191 0.0466 0.0139 0.0480 98 TRP H C 2404 O O . TRP B 101 ? 0.3226 0.3143 0.4024 0.0477 0.0138 0.0496 98 TRP H O 2405 C CB . TRP B 101 ? 0.3056 0.2892 0.3998 0.0448 0.0089 0.0431 98 TRP H CB 2406 C CG . TRP B 101 ? 0.2633 0.2463 0.3667 0.0446 0.0107 0.0471 98 TRP H CG 2407 C CD1 . TRP B 101 ? 0.2927 0.2744 0.4014 0.0430 0.0091 0.0463 98 TRP H CD1 2408 C CD2 . TRP B 101 ? 0.1989 0.1829 0.3082 0.0463 0.0146 0.0533 98 TRP H CD2 2409 N NE1 . TRP B 101 ? 0.2934 0.2756 0.4118 0.0436 0.0119 0.0517 98 TRP H NE1 2410 C CE2 . TRP B 101 ? 0.2497 0.2330 0.3683 0.0457 0.0156 0.0560 98 TRP H CE2 2411 C CE3 . TRP B 101 ? 0.2487 0.2347 0.3566 0.0485 0.0174 0.0573 98 TRP H CE3 2412 C CZ2 . TRP B 101 ? 0.2306 0.2147 0.3572 0.0472 0.0197 0.0625 98 TRP H CZ2 2413 C CZ3 . TRP B 101 ? 0.3380 0.3245 0.4529 0.0500 0.0213 0.0636 98 TRP H CZ3 2414 C CH2 . TRP B 101 ? 0.2717 0.2570 0.3958 0.0495 0.0227 0.0661 98 TRP H CH2 2415 N N . PRO B 102 ? 0.2784 0.2679 0.3562 0.0469 0.0174 0.0510 99 PRO H N 2416 C CA . PRO B 102 ? 0.1838 0.1710 0.2640 0.0463 0.0187 0.0507 99 PRO H CA 2417 C C . PRO B 102 ? 0.2720 0.2586 0.3409 0.0451 0.0191 0.0474 99 PRO H C 2418 O O . PRO B 102 ? 0.2819 0.2667 0.3513 0.0452 0.0216 0.0483 99 PRO H O 2419 C CB . PRO B 102 ? 0.2025 0.1897 0.2862 0.0481 0.0236 0.0569 99 PRO H CB 2420 C CG . PRO B 102 ? 0.2708 0.2601 0.3443 0.0491 0.0251 0.0587 99 PRO H CG 2421 C CD . PRO B 102 ? 0.2305 0.2220 0.3034 0.0484 0.0208 0.0558 99 PRO H CD 2422 N N . TYR B 103 ? 0.3546 0.3425 0.4142 0.0441 0.0169 0.0440 100 TYR H N 2423 C CA . TYR B 103 ? 0.2717 0.2586 0.3204 0.0427 0.0174 0.0409 100 TYR H CA 2424 C C . TYR B 103 ? 0.2652 0.2518 0.3147 0.0414 0.0136 0.0360 100 TYR H C 2425 O O . TYR B 103 ? 0.2812 0.2695 0.3257 0.0405 0.0112 0.0332 100 TYR H O 2426 C CB . TYR B 103 ? 0.2601 0.2490 0.2975 0.0419 0.0176 0.0409 100 TYR H CB 2427 C CG . TYR B 103 ? 0.3173 0.3041 0.3429 0.0399 0.0181 0.0376 100 TYR H CG 2428 C CD1 . TYR B 103 ? 0.3132 0.2955 0.3354 0.0401 0.0220 0.0377 100 TYR H CD1 2429 C CD2 . TYR B 103 ? 0.3176 0.3069 0.3361 0.0379 0.0152 0.0349 100 TYR H CD2 2430 C CE1 . TYR B 103 ? 0.3136 0.2929 0.3249 0.0382 0.0229 0.0345 100 TYR H CE1 2431 C CE2 . TYR B 103 ? 0.2683 0.2553 0.2765 0.0357 0.0156 0.0318 100 TYR H CE2 2432 C CZ . TYR B 103 ? 0.3509 0.3324 0.3551 0.0358 0.0196 0.0314 100 TYR H CZ 2433 O OH . TYR B 103 ? 0.4121 0.3901 0.4059 0.0335 0.0205 0.0283 100 TYR H OH 2434 N N . LEU B 104 A 0.2348 0.2195 0.2908 0.0413 0.0133 0.0355 100 LEU H N 2435 C CA . LEU B 104 A 0.2166 0.2009 0.2744 0.0403 0.0093 0.0314 100 LEU H CA 2436 C C . LEU B 104 A 0.2216 0.2048 0.2724 0.0392 0.0093 0.0284 100 LEU H C 2437 O O . LEU B 104 A 0.2811 0.2641 0.3329 0.0386 0.0061 0.0254 100 LEU H O 2438 C CB . LEU B 104 A 0.2901 0.2734 0.3599 0.0403 0.0075 0.0327 100 LEU H CB 2439 C CG . LEU B 104 A 0.2420 0.2253 0.3205 0.0410 0.0072 0.0354 100 LEU H CG 2440 C CD1 . LEU B 104 A 0.2465 0.2289 0.3375 0.0404 0.0060 0.0376 100 LEU H CD1 2441 C CD2 . LEU B 104 A 0.2629 0.2459 0.3400 0.0409 0.0042 0.0322 100 LEU H CD2 2442 N N . PRO B 105 B 0.2185 0.2004 0.2617 0.0391 0.0131 0.0292 100 PRO H N 2443 C CA . PRO B 105 B 0.2770 0.2574 0.3156 0.0383 0.0130 0.0264 100 PRO H CA 2444 C C . PRO B 105 B 0.3158 0.2974 0.3470 0.0369 0.0104 0.0224 100 PRO H C 2445 O O . PRO B 105 B 0.2942 0.2781 0.3233 0.0367 0.0090 0.0221 100 PRO H O 2446 C CB . PRO B 105 B 0.2481 0.2254 0.2802 0.0385 0.0183 0.0281 100 PRO H CB 2447 C CG . PRO B 105 B 0.2896 0.2674 0.3167 0.0385 0.0197 0.0296 100 PRO H CG 2448 C CD . PRO B 105 B 0.2595 0.2403 0.2968 0.0396 0.0174 0.0319 100 PRO H CD 2449 N N . PHE B 106 C 0.2993 0.2798 0.3276 0.0363 0.0099 0.0200 100 PHE H N 2450 C CA . PHE B 106 C 0.2980 0.2795 0.3195 0.0351 0.0082 0.0168 100 PHE H CA 2451 C C . PHE B 106 C 0.3257 0.3057 0.3375 0.0335 0.0109 0.0164 100 PHE H C 2452 O O . PHE B 106 C 0.2571 0.2334 0.2654 0.0332 0.0143 0.0168 100 PHE H O 2453 C CB . PHE B 106 C 0.2752 0.2559 0.2973 0.0351 0.0068 0.0148 100 PHE H CB 2454 C CG . PHE B 106 C 0.3060 0.2876 0.3349 0.0359 0.0029 0.0141 100 PHE H CG 2455 C CD1 . PHE B 106 C 0.3335 0.3164 0.3636 0.0363 0.0004 0.0129 100 PHE H CD1 2456 C CD2 . PHE B 106 C 0.3191 0.3000 0.3532 0.0363 0.0018 0.0149 100 PHE H CD2 2457 C CE1 . PHE B 106 C 0.3565 0.3386 0.3915 0.0367 -0.0030 0.0117 100 PHE H CE1 2458 C CE2 . PHE B 106 C 0.3665 0.3476 0.4058 0.0364 -0.0024 0.0139 100 PHE H CE2 2459 C CZ . PHE B 106 C 0.3204 0.3014 0.3594 0.0365 -0.0047 0.0119 100 PHE H CZ 2460 N N . ASP B 107 ? 0.2462 0.2291 0.2540 0.0323 0.0095 0.0159 101 ASP H N 2461 C CA . ASP B 107 ? 0.2757 0.2576 0.2739 0.0299 0.0109 0.0154 101 ASP H CA 2462 C C . ASP B 107 ? 0.2831 0.2701 0.2797 0.0286 0.0079 0.0157 101 ASP H C 2463 O O . ASP B 107 ? 0.2988 0.2890 0.3000 0.0299 0.0068 0.0180 101 ASP H O 2464 C CB . ASP B 107 ? 0.3276 0.3059 0.3222 0.0300 0.0145 0.0176 101 ASP H CB 2465 C CG . ASP B 107 ? 0.5004 0.4752 0.4829 0.0272 0.0163 0.0163 101 ASP H CG 2466 O OD1 . ASP B 107 ? 0.5495 0.5216 0.5275 0.0255 0.0168 0.0137 101 ASP H OD1 2467 O OD2 . ASP B 107 ? 0.6305 0.6048 0.6074 0.0264 0.0172 0.0179 101 ASP H OD2 2468 N N . PRO B 108 ? 0.2992 0.2874 0.2902 0.0260 0.0068 0.0139 102 PRO H N 2469 C CA . PRO B 108 ? 0.2505 0.2349 0.2361 0.0242 0.0082 0.0113 102 PRO H CA 2470 C C . PRO B 108 ? 0.2759 0.2607 0.2664 0.0259 0.0074 0.0097 102 PRO H C 2471 O O . PRO B 108 ? 0.3009 0.2882 0.2981 0.0282 0.0057 0.0101 102 PRO H O 2472 C CB . PRO B 108 ? 0.1604 0.1476 0.1401 0.0205 0.0063 0.0108 102 PRO H CB 2473 C CG . PRO B 108 ? 0.2518 0.2448 0.2338 0.0207 0.0039 0.0136 102 PRO H CG 2474 C CD . PRO B 108 ? 0.2213 0.2154 0.2119 0.0247 0.0040 0.0151 102 PRO H CD 2475 N N . TRP B 109 ? 0.2709 0.2526 0.2572 0.0245 0.0088 0.0078 103 TRP H N 2476 C CA . TRP B 109 ? 0.2900 0.2717 0.2793 0.0259 0.0084 0.0066 103 TRP H CA 2477 C C . TRP B 109 ? 0.2840 0.2675 0.2699 0.0238 0.0078 0.0053 103 TRP H C 2478 O O . TRP B 109 ? 0.2662 0.2484 0.2463 0.0205 0.0085 0.0049 103 TRP H O 2479 C CB . TRP B 109 ? 0.2984 0.2749 0.2874 0.0269 0.0114 0.0065 103 TRP H CB 2480 C CG . TRP B 109 ? 0.2391 0.2144 0.2337 0.0293 0.0122 0.0084 103 TRP H CG 2481 C CD1 . TRP B 109 ? 0.2858 0.2595 0.2804 0.0295 0.0141 0.0102 103 TRP H CD1 2482 C CD2 . TRP B 109 ? 0.2243 0.1999 0.2254 0.0316 0.0112 0.0091 103 TRP H CD2 2483 N NE1 . TRP B 109 ? 0.2850 0.2584 0.2869 0.0318 0.0145 0.0122 103 TRP H NE1 2484 C CE2 . TRP B 109 ? 0.2607 0.2355 0.2669 0.0329 0.0124 0.0116 103 TRP H CE2 2485 C CE3 . TRP B 109 ? 0.2852 0.2620 0.2881 0.0325 0.0093 0.0082 103 TRP H CE3 2486 C CZ2 . TRP B 109 ? 0.2416 0.2171 0.2556 0.0346 0.0111 0.0132 103 TRP H CZ2 2487 C CZ3 . TRP B 109 ? 0.2736 0.2508 0.2829 0.0343 0.0078 0.0095 103 TRP H CZ3 2488 C CH2 . TRP B 109 ? 0.2674 0.2442 0.2826 0.0351 0.0084 0.0120 103 TRP H CH2 2489 N N . GLY B 110 ? 0.2874 0.2734 0.2764 0.0255 0.0065 0.0048 104 GLY H N 2490 C CA . GLY B 110 ? 0.2159 0.2030 0.2026 0.0240 0.0067 0.0041 104 GLY H CA 2491 C C . GLY B 110 ? 0.2692 0.2510 0.2525 0.0233 0.0095 0.0031 104 GLY H C 2492 O O . GLY B 110 ? 0.3378 0.3157 0.3215 0.0246 0.0112 0.0034 104 GLY H O 2493 N N . GLN B 111 ? 0.3197 0.3015 0.3006 0.0214 0.0104 0.0026 105 GLN H N 2494 C CA . GLN B 111 ? 0.3784 0.3545 0.3560 0.0206 0.0136 0.0020 105 GLN H CA 2495 C C . GLN B 111 ? 0.3716 0.3472 0.3521 0.0241 0.0142 0.0025 105 GLN H C 2496 O O . GLN B 111 ? 0.4704 0.4417 0.4496 0.0245 0.0171 0.0028 105 GLN H O 2497 C CB . GLN B 111 ? 0.4353 0.4112 0.4097 0.0168 0.0142 0.0015 105 GLN H CB 2498 C CG . GLN B 111 ? 0.5209 0.5014 0.4985 0.0181 0.0135 0.0022 105 GLN H CG 2499 C CD . GLN B 111 ? 0.5646 0.5524 0.5460 0.0186 0.0105 0.0033 105 GLN H CD 2500 O OE1 . GLN B 111 ? 0.5775 0.5676 0.5597 0.0182 0.0086 0.0036 105 GLN H OE1 2501 N NE2 . GLN B 111 ? 0.5254 0.5170 0.5093 0.0198 0.0107 0.0043 105 GLN H NE2 2502 N N . GLY B 112 ? 0.3569 0.3368 0.3410 0.0268 0.0116 0.0028 106 GLY H N 2503 C CA . GLY B 112 ? 0.2662 0.2458 0.2518 0.0299 0.0113 0.0031 106 GLY H CA 2504 C C . GLY B 112 ? 0.3217 0.3028 0.3058 0.0305 0.0120 0.0032 106 GLY H C 2505 O O . GLY B 112 ? 0.3134 0.2944 0.2957 0.0281 0.0138 0.0034 106 GLY H O 2506 N N . THR B 113 ? 0.3553 0.3378 0.3399 0.0335 0.0104 0.0033 107 THR H N 2507 C CA . THR B 113 ? 0.3556 0.3390 0.3381 0.0348 0.0115 0.0038 107 THR H CA 2508 C C . THR B 113 ? 0.4533 0.4348 0.4348 0.0371 0.0115 0.0047 107 THR H C 2509 O O . THR B 113 ? 0.3880 0.3694 0.3704 0.0388 0.0086 0.0043 107 THR H O 2510 C CB . THR B 113 ? 0.3332 0.3197 0.3153 0.0368 0.0101 0.0032 107 THR H CB 2511 O OG1 . THR B 113 ? 0.4131 0.4026 0.3971 0.0347 0.0104 0.0034 107 THR H OG1 2512 C CG2 . THR B 113 ? 0.3526 0.3395 0.3318 0.0389 0.0117 0.0040 107 THR H CG2 2513 N N . LEU B 114 ? 0.4024 0.3825 0.3826 0.0370 0.0144 0.0062 108 LEU H N 2514 C CA . LEU B 114 ? 0.3883 0.3675 0.3677 0.0395 0.0143 0.0079 108 LEU H CA 2515 C C . LEU B 114 ? 0.3883 0.3695 0.3642 0.0422 0.0125 0.0075 108 LEU H C 2516 O O . LEU B 114 ? 0.4123 0.3947 0.3862 0.0426 0.0143 0.0076 108 LEU H O 2517 C CB . LEU B 114 ? 0.4985 0.4753 0.4777 0.0389 0.0186 0.0100 108 LEU H CB 2518 C CG . LEU B 114 ? 0.6126 0.5892 0.5913 0.0417 0.0189 0.0127 108 LEU H CG 2519 C CD1 . LEU B 114 ? 0.5480 0.5252 0.5296 0.0430 0.0157 0.0136 108 LEU H CD1 2520 C CD2 . LEU B 114 ? 0.7316 0.7051 0.7110 0.0411 0.0239 0.0150 108 LEU H CD2 2521 N N . VAL B 115 ? 0.2928 0.2740 0.2678 0.0440 0.0089 0.0073 109 VAL H N 2522 C CA . VAL B 115 ? 0.3271 0.3087 0.2967 0.0466 0.0070 0.0065 109 VAL H CA 2523 C C . VAL B 115 ? 0.3141 0.2954 0.2814 0.0484 0.0056 0.0087 109 VAL H C 2524 O O . VAL B 115 ? 0.3715 0.3531 0.3419 0.0481 0.0027 0.0097 109 VAL H O 2525 C CB . VAL B 115 ? 0.3542 0.3352 0.3230 0.0469 0.0031 0.0036 109 VAL H CB 2526 C CG1 . VAL B 115 ? 0.2953 0.2747 0.2566 0.0495 0.0010 0.0024 109 VAL H CG1 2527 C CG2 . VAL B 115 ? 0.2930 0.2749 0.2636 0.0459 0.0048 0.0021 109 VAL H CG2 2528 N N . THR B 116 ? 0.3272 0.3087 0.2896 0.0504 0.0077 0.0101 110 THR H N 2529 C CA . THR B 116 ? 0.3247 0.3066 0.2841 0.0524 0.0066 0.0128 110 THR H CA 2530 C C . THR B 116 ? 0.3237 0.3047 0.2740 0.0549 0.0043 0.0113 110 THR H C 2531 O O . THR B 116 ? 0.3198 0.3002 0.2658 0.0563 0.0073 0.0106 110 THR H O 2532 C CB . THR B 116 ? 0.4089 0.3911 0.3695 0.0529 0.0117 0.0165 110 THR H CB 2533 O OG1 . THR B 116 ? 0.4426 0.4239 0.4102 0.0505 0.0144 0.0172 110 THR H OG1 2534 C CG2 . THR B 116 ? 0.3893 0.3725 0.3477 0.0552 0.0103 0.0202 110 THR H CG2 2535 N N . VAL B 117 ? 0.3793 0.3600 0.3265 0.0553 -0.0011 0.0111 111 VAL H N 2536 C CA . VAL B 117 ? 0.3098 0.2885 0.2463 0.0575 -0.0037 0.0094 111 VAL H CA 2537 C C . VAL B 117 ? 0.3709 0.3511 0.3032 0.0592 -0.0047 0.0133 111 VAL H C 2538 O O . VAL B 117 ? 0.3180 0.3004 0.2542 0.0582 -0.0088 0.0157 111 VAL H O 2539 C CB . VAL B 117 ? 0.3487 0.3248 0.2827 0.0561 -0.0098 0.0055 111 VAL H CB 2540 C CG1 . VAL B 117 ? 0.3447 0.3169 0.2653 0.0582 -0.0122 0.0032 111 VAL H CG1 2541 C CG2 . VAL B 117 ? 0.2525 0.2273 0.1911 0.0547 -0.0085 0.0023 111 VAL H CG2 2542 N N . SER B 118 ? 0.3134 0.2930 0.2386 0.0620 -0.0010 0.0147 112 SER H N 2543 C CA . SER B 118 ? 0.3420 0.3230 0.2621 0.0641 -0.0018 0.0188 112 SER H CA 2544 C C . SER B 118 ? 0.4020 0.3806 0.3104 0.0676 0.0012 0.0186 112 SER H C 2545 O O . SER B 118 ? 0.4374 0.4143 0.3447 0.0685 0.0059 0.0167 112 SER H O 2546 C CB . SER B 118 ? 0.3664 0.3507 0.2956 0.0641 0.0023 0.0241 112 SER H CB 2547 O OG . SER B 118 ? 0.4196 0.4055 0.3441 0.0667 0.0023 0.0288 112 SER H OG 2548 N N . SER B 119 ? 0.3499 0.3288 0.2496 0.0696 -0.0014 0.0210 113 SER H N 2549 C CA . SER B 119 ? 0.4210 0.3975 0.3085 0.0734 0.0019 0.0216 113 SER H CA 2550 C C . SER B 119 ? 0.4287 0.4083 0.3208 0.0754 0.0087 0.0275 113 SER H C 2551 O O . SER B 119 ? 0.4174 0.3958 0.3018 0.0788 0.0132 0.0291 113 SER H O 2552 C CB . SER B 119 ? 0.4032 0.3778 0.2773 0.0745 -0.0044 0.0214 113 SER H CB 2553 O OG . SER B 119 ? 0.4739 0.4536 0.3526 0.0739 -0.0078 0.0268 113 SER H OG 2554 N N . ALA B 120 ? 0.3450 0.3281 0.2497 0.0734 0.0098 0.0307 114 ALA H N 2555 C CA . ALA B 120 ? 0.4319 0.4170 0.3416 0.0749 0.0161 0.0363 114 ALA H CA 2556 C C . ALA B 120 ? 0.5030 0.4867 0.4133 0.0758 0.0232 0.0357 114 ALA H C 2557 O O . ALA B 120 ? 0.5245 0.5071 0.4379 0.0739 0.0240 0.0316 114 ALA H O 2558 C CB . ALA B 120 ? 0.4200 0.4072 0.3429 0.0724 0.0167 0.0387 114 ALA H CB 2559 N N . SER B 121 ? 0.5509 0.5352 0.4587 0.0788 0.0284 0.0404 115 SER H N 2560 C CA . SER B 121 ? 0.6091 0.5931 0.5192 0.0796 0.0355 0.0412 115 SER H CA 2561 C C . SER B 121 ? 0.6033 0.5884 0.5267 0.0764 0.0396 0.0432 115 SER H C 2562 O O . SER B 121 ? 0.5044 0.4900 0.4331 0.0754 0.0390 0.0459 115 SER H O 2563 C CB . SER B 121 ? 0.7268 0.7108 0.6282 0.0842 0.0396 0.0457 115 SER H CB 2564 O OG . SER B 121 ? 0.8037 0.7856 0.6906 0.0871 0.0355 0.0438 115 SER H OG 2565 N N . THR B 122 ? 0.5967 0.5818 0.5253 0.0747 0.0437 0.0421 116 THR H N 2566 C CA . THR B 122 ? 0.6217 0.6069 0.5616 0.0711 0.0475 0.0435 116 THR H CA 2567 C C . THR B 122 ? 0.6028 0.5879 0.5447 0.0728 0.0525 0.0496 116 THR H C 2568 O O . THR B 122 ? 0.7327 0.7185 0.6699 0.0764 0.0561 0.0530 116 THR H O 2569 C CB . THR B 122 ? 0.5687 0.5548 0.5136 0.0689 0.0506 0.0419 116 THR H CB 2570 O OG1 . THR B 122 ? 0.6173 0.6035 0.5617 0.0672 0.0462 0.0367 116 THR H OG1 2571 C CG2 . THR B 122 ? 0.5035 0.4890 0.4587 0.0646 0.0541 0.0434 116 THR H CG2 2572 N N . LYS B 123 ? 0.5567 0.5403 0.5054 0.0707 0.0531 0.0511 117 LYS H N 2573 C CA . LYS B 123 ? 0.4978 0.4806 0.4495 0.0722 0.0582 0.0571 117 LYS H CA 2574 C C . LYS B 123 ? 0.4956 0.4748 0.4571 0.0679 0.0615 0.0571 117 LYS H C 2575 O O . LYS B 123 ? 0.5102 0.4877 0.4748 0.0649 0.0587 0.0537 117 LYS H O 2576 C CB . LYS B 123 ? 0.4375 0.4215 0.3845 0.0758 0.0553 0.0607 117 LYS H CB 2577 C CG . LYS B 123 ? 0.4253 0.4088 0.3753 0.0783 0.0607 0.0678 117 LYS H CG 2578 C CD . LYS B 123 ? 0.5600 0.5461 0.5055 0.0820 0.0572 0.0720 117 LYS H CD 2579 C CE . LYS B 123 ? 0.7146 0.7006 0.6636 0.0849 0.0629 0.0799 117 LYS H CE 2580 N NZ . LYS B 123 ? 0.8252 0.8069 0.7855 0.0819 0.0681 0.0809 117 LYS H NZ 2581 N N . GLY B 124 ? 0.4736 0.4512 0.4396 0.0675 0.0678 0.0609 118 GLY H N 2582 C CA . GLY B 124 ? 0.4287 0.4013 0.4027 0.0634 0.0717 0.0610 118 GLY H CA 2583 C C . GLY B 124 ? 0.5163 0.4862 0.4923 0.0653 0.0734 0.0649 118 GLY H C 2584 O O . GLY B 124 ? 0.5083 0.4809 0.4807 0.0701 0.0731 0.0696 118 GLY H O 2616 N N . PRO B 129 ? 0.3916 0.4751 0.4073 -0.0536 -0.0503 -0.0094 123 PRO H N 2617 C CA . PRO B 129 ? 0.3533 0.4208 0.3619 -0.0544 -0.0537 -0.0112 123 PRO H CA 2618 C C . PRO B 129 ? 0.3159 0.3685 0.3160 -0.0513 -0.0497 -0.0108 123 PRO H C 2619 O O . PRO B 129 ? 0.3624 0.4168 0.3647 -0.0526 -0.0453 -0.0076 123 PRO H O 2620 C CB . PRO B 129 ? 0.3980 0.4675 0.4129 -0.0631 -0.0572 -0.0088 123 PRO H CB 2621 C CG . PRO B 129 ? 0.3872 0.4689 0.4107 -0.0667 -0.0533 -0.0048 123 PRO H CG 2622 C CD . PRO B 129 ? 0.3451 0.4391 0.3706 -0.0610 -0.0500 -0.0055 123 PRO H CD 2623 N N . LEU B 130 ? 0.2909 0.3299 0.2816 -0.0472 -0.0512 -0.0136 124 LEU H N 2624 C CA . LEU B 130 ? 0.3362 0.3610 0.3190 -0.0446 -0.0480 -0.0124 124 LEU H CA 2625 C C . LEU B 130 ? 0.3614 0.3740 0.3407 -0.0478 -0.0511 -0.0129 124 LEU H C 2626 O O . LEU B 130 ? 0.3820 0.3846 0.3536 -0.0454 -0.0544 -0.0163 124 LEU H O 2627 C CB . LEU B 130 ? 0.2744 0.2923 0.2480 -0.0371 -0.0469 -0.0147 124 LEU H CB 2628 C CG . LEU B 130 ? 0.3476 0.3740 0.3218 -0.0339 -0.0439 -0.0141 124 LEU H CG 2629 C CD1 . LEU B 130 ? 0.2508 0.2708 0.2157 -0.0271 -0.0445 -0.0168 124 LEU H CD1 2630 C CD2 . LEU B 130 ? 0.3038 0.3311 0.2795 -0.0357 -0.0389 -0.0092 124 LEU H CD2 2631 N N . ALA B 131 ? 0.3480 0.3607 0.3322 -0.0534 -0.0502 -0.0095 125 ALA H N 2632 C CA . ALA B 131 ? 0.3938 0.3955 0.3750 -0.0577 -0.0540 -0.0098 125 ALA H CA 2633 C C . ALA B 131 ? 0.4133 0.3955 0.3827 -0.0528 -0.0522 -0.0103 125 ALA H C 2634 O O . ALA B 131 ? 0.4593 0.4390 0.4270 -0.0488 -0.0467 -0.0076 125 ALA H O 2635 C CB . ALA B 131 ? 0.3746 0.3826 0.3647 -0.0653 -0.0538 -0.0056 125 ALA H CB 2636 N N . PRO B 132 ? 0.4592 0.4277 0.4197 -0.0532 -0.0568 -0.0136 126 PRO H N 2637 C CA . PRO B 132 ? 0.5459 0.4944 0.4937 -0.0480 -0.0549 -0.0142 126 PRO H CA 2638 C C . PRO B 132 ? 0.6255 0.5668 0.5741 -0.0510 -0.0527 -0.0102 126 PRO H C 2639 O O . PRO B 132 ? 0.6244 0.5718 0.5806 -0.0588 -0.0555 -0.0084 126 PRO H O 2640 C CB . PRO B 132 ? 0.4962 0.4328 0.4343 -0.0492 -0.0614 -0.0190 126 PRO H CB 2641 C CG . PRO B 132 ? 0.4283 0.3768 0.3759 -0.0584 -0.0673 -0.0187 126 PRO H CG 2642 C CD . PRO B 132 ? 0.4401 0.4108 0.4016 -0.0589 -0.0641 -0.0162 126 PRO H CD 2643 N N . SER B 133 ? 0.7345 0.6639 0.6757 -0.0447 -0.0478 -0.0083 127 SER H N 2644 C CA . SER B 133 ? 0.9190 0.8402 0.8600 -0.0462 -0.0454 -0.0042 127 SER H CA 2645 C C . SER B 133 ? 1.1292 1.0304 1.0561 -0.0380 -0.0423 -0.0043 127 SER H C 2646 O O . SER B 133 ? 1.1859 1.0824 1.1048 -0.0309 -0.0408 -0.0067 127 SER H O 2647 C CB . SER B 133 ? 0.9193 0.8556 0.8722 -0.0476 -0.0402 0.0017 127 SER H CB 2648 O OG . SER B 133 ? 0.9734 0.9168 0.9265 -0.0414 -0.0357 0.0028 127 SER H OG 2649 N N . SER B 134 ? 1.2907 1.1799 1.2142 -0.0387 -0.0411 -0.0015 128 SER H N 2650 C CA . SER B 134 ? 1.3919 1.2606 1.3009 -0.0302 -0.0378 -0.0014 128 SER H CA 2651 C C . SER B 134 ? 1.4657 1.3402 1.3759 -0.0213 -0.0298 0.0033 128 SER H C 2652 O O . SER B 134 ? 1.4253 1.2863 1.3237 -0.0123 -0.0261 0.0035 128 SER H O 2653 C CB . SER B 134 ? 1.3533 1.2075 1.2583 -0.0331 -0.0385 0.0009 128 SER H CB 2654 O OG . SER B 134 ? 1.3034 1.1487 1.2039 -0.0412 -0.0466 -0.0033 128 SER H OG 2655 N N . LYS B 135 ? 1.5929 1.4876 1.5167 -0.0239 -0.0272 0.0074 129 LYS H N 2656 C CA . LYS B 135 ? 1.7007 1.6036 1.6261 -0.0171 -0.0210 0.0119 129 LYS H CA 2657 C C . LYS B 135 ? 1.6869 1.5983 1.6119 -0.0160 -0.0229 0.0080 129 LYS H C 2658 O O . LYS B 135 ? 1.7070 1.6331 1.6392 -0.0164 -0.0207 0.0109 129 LYS H O 2659 C CB . LYS B 135 ? 1.7789 1.6966 1.7172 -0.0208 -0.0171 0.0195 129 LYS H CB 2660 C CG . LYS B 135 ? 1.8184 1.7538 1.7693 -0.0296 -0.0198 0.0192 129 LYS H CG 2661 C CD . LYS B 135 ? 1.8268 1.7620 1.7830 -0.0383 -0.0243 0.0176 129 LYS H CD 2662 C CE . LYS B 135 ? 1.7773 1.7314 1.7459 -0.0458 -0.0259 0.0180 129 LYS H CE 2663 N NZ . LYS B 135 ? 1.7395 1.7056 1.7153 -0.0461 -0.0208 0.0246 129 LYS H NZ 2664 N N . SER B 136 ? 1.6829 1.5838 1.5985 -0.0147 -0.0273 0.0013 130 SER H N 2665 C CA . SER B 136 ? 1.6179 1.5234 1.5308 -0.0126 -0.0296 -0.0031 130 SER H CA 2666 C C . SER B 136 ? 1.5412 1.4290 1.4397 -0.0091 -0.0330 -0.0090 130 SER H C 2667 O O . SER B 136 ? 1.5280 1.4170 1.4234 -0.0092 -0.0369 -0.0139 130 SER H O 2668 C CB . SER B 136 ? 1.6064 1.5273 1.5301 -0.0202 -0.0339 -0.0053 130 SER H CB 2669 O OG . SER B 136 ? 1.5806 1.5172 1.5152 -0.0224 -0.0305 -0.0003 130 SER H OG 2670 N N . THR B 137 ? 1.4676 1.3379 1.3564 -0.0060 -0.0315 -0.0085 131 THR H N 2671 C CA . THR B 137 ? 1.4449 1.2949 1.3172 -0.0025 -0.0344 -0.0139 131 THR H CA 2672 C C . THR B 137 ? 1.3532 1.1960 1.2150 0.0089 -0.0285 -0.0124 131 THR H C 2673 O O . THR B 137 ? 1.3555 1.1863 1.2097 0.0152 -0.0237 -0.0094 131 THR H O 2674 C CB . THR B 137 ? 1.5215 1.3536 1.3866 -0.0056 -0.0369 -0.0146 131 THR H CB 2675 O OG1 . THR B 137 ? 1.5323 1.3739 1.4088 -0.0167 -0.0422 -0.0147 131 THR H OG1 2676 C CG2 . THR B 137 ? 1.5667 1.3760 1.4127 -0.0032 -0.0409 -0.0208 131 THR H CG2 2677 N N . SER B 138 ? 1.3138 1.1648 1.1754 0.0117 -0.0286 -0.0141 132 SER H N 2678 C CA . SER B 138 ? 1.2400 1.0870 1.0924 0.0219 -0.0234 -0.0123 132 SER H CA 2679 C C . SER B 138 ? 1.1903 1.0147 1.0237 0.0273 -0.0249 -0.0177 132 SER H C 2680 O O . SER B 138 ? 1.1867 1.0081 1.0135 0.0273 -0.0289 -0.0230 132 SER H O 2681 C CB . SER B 138 ? 1.2175 1.0804 1.0757 0.0223 -0.0238 -0.0122 132 SER H CB 2682 O OG . SER B 138 ? 1.2066 1.0673 1.0566 0.0315 -0.0189 -0.0097 132 SER H OG 2683 N N . GLY B 139 ? 1.1051 0.9128 0.9289 0.0318 -0.0216 -0.0162 133 GLY H N 2684 C CA . GLY B 139 ? 1.1305 0.9137 0.9336 0.0379 -0.0221 -0.0209 133 GLY H CA 2685 C C . GLY B 139 ? 1.1309 0.9022 0.9258 0.0305 -0.0313 -0.0289 133 GLY H C 2686 O O . GLY B 139 ? 1.1409 0.9029 0.9232 0.0337 -0.0335 -0.0336 133 GLY H O 2687 N N . GLY B 140 ? 1.1110 0.8831 0.9129 0.0204 -0.0368 -0.0298 134 GLY H N 2688 C CA . GLY B 140 ? 1.0500 0.8129 0.8455 0.0120 -0.0461 -0.0360 134 GLY H CA 2689 C C . GLY B 140 ? 0.9259 0.7097 0.7350 0.0050 -0.0512 -0.0378 134 GLY H C 2690 O O . GLY B 140 ? 0.8989 0.6791 0.7050 -0.0023 -0.0592 -0.0421 134 GLY H O 2691 N N . THR B 141 ? 0.7430 0.5483 0.5664 0.0072 -0.0468 -0.0340 135 THR H N 2692 C CA . THR B 141 ? 0.6798 0.5050 0.5160 0.0018 -0.0508 -0.0352 135 THR H CA 2693 C C . THR B 141 ? 0.6185 0.4641 0.4739 -0.0035 -0.0492 -0.0306 135 THR H C 2694 O O . THR B 141 ? 0.5499 0.4031 0.4113 0.0005 -0.0427 -0.0254 135 THR H O 2695 C CB . THR B 141 ? 0.7189 0.5508 0.5530 0.0088 -0.0482 -0.0358 135 THR H CB 2696 O OG1 . THR B 141 ? 0.8008 0.6154 0.6177 0.0125 -0.0509 -0.0408 135 THR H OG1 2697 C CG2 . THR B 141 ? 0.5986 0.4512 0.4464 0.0040 -0.0515 -0.0363 135 THR H CG2 2698 N N . ALA B 142 ? 0.5485 0.4033 0.4130 -0.0127 -0.0552 -0.0320 136 ALA H N 2699 C CA . ALA B 142 ? 0.4972 0.3721 0.3794 -0.0179 -0.0540 -0.0281 136 ALA H CA 2700 C C . ALA B 142 ? 0.4847 0.3778 0.3757 -0.0180 -0.0550 -0.0290 136 ALA H C 2701 O O . ALA B 142 ? 0.5838 0.4749 0.4694 -0.0171 -0.0591 -0.0332 136 ALA H O 2702 C CB . ALA B 142 ? 0.4189 0.2941 0.3064 -0.0277 -0.0593 -0.0281 136 ALA H CB 2703 N N . ALA B 143 ? 0.4113 0.3210 0.3150 -0.0190 -0.0515 -0.0251 137 ALA H N 2704 C CA . ALA B 143 ? 0.3654 0.2914 0.2770 -0.0195 -0.0526 -0.0259 137 ALA H CA 2705 C C . ALA B 143 ? 0.3637 0.3052 0.2893 -0.0269 -0.0543 -0.0241 137 ALA H C 2706 O O . ALA B 143 ? 0.4063 0.3497 0.3376 -0.0304 -0.0520 -0.0205 137 ALA H O 2707 C CB . ALA B 143 ? 0.4057 0.3369 0.3173 -0.0134 -0.0470 -0.0229 137 ALA H CB 2708 N N . LEU B 144 ? 0.3712 0.3241 0.3021 -0.0289 -0.0581 -0.0265 138 LEU H N 2709 C CA . LEU B 144 ? 0.3912 0.3608 0.3353 -0.0348 -0.0593 -0.0247 138 LEU H CA 2710 C C . LEU B 144 ? 0.4049 0.3875 0.3531 -0.0322 -0.0601 -0.0263 138 LEU H C 2711 O O . LEU B 144 ? 0.4109 0.3887 0.3518 -0.0270 -0.0611 -0.0291 138 LEU H O 2712 C CB . LEU B 144 ? 0.4236 0.3922 0.3702 -0.0424 -0.0652 -0.0254 138 LEU H CB 2713 C CG . LEU B 144 ? 0.5084 0.4719 0.4489 -0.0438 -0.0721 -0.0294 138 LEU H CG 2714 C CD1 . LEU B 144 ? 0.5001 0.4826 0.4512 -0.0468 -0.0758 -0.0294 138 LEU H CD1 2715 C CD2 . LEU B 144 ? 0.5527 0.5014 0.4863 -0.0495 -0.0767 -0.0299 138 LEU H CD2 2716 N N . GLY B 145 ? 0.3260 0.3247 0.2854 -0.0353 -0.0596 -0.0244 139 GLY H N 2717 C CA . GLY B 145 ? 0.3093 0.3197 0.2719 -0.0320 -0.0600 -0.0257 139 GLY H CA 2718 C C . GLY B 145 ? 0.2970 0.3252 0.2714 -0.0352 -0.0592 -0.0235 139 GLY H C 2719 O O . GLY B 145 ? 0.3055 0.3391 0.2872 -0.0414 -0.0596 -0.0211 139 GLY H O 2720 N N . CYS B 146 ? 0.2831 0.3198 0.2585 -0.0305 -0.0580 -0.0244 140 CYS H N 2721 C CA . CYS B 146 ? 0.3286 0.3817 0.3133 -0.0315 -0.0564 -0.0226 140 CYS H CA 2722 C C . CYS B 146 ? 0.3163 0.3695 0.2968 -0.0260 -0.0517 -0.0222 140 CYS H C 2723 O O . CYS B 146 ? 0.3180 0.3642 0.2903 -0.0205 -0.0520 -0.0244 140 CYS H O 2724 C CB . CYS B 146 ? 0.3905 0.4558 0.3808 -0.0311 -0.0608 -0.0239 140 CYS H CB 2725 S SG . CYS B 146 ? 0.9849 1.0560 0.9831 -0.0401 -0.0669 -0.0224 140 CYS H SG 2726 N N . LEU B 147 ? 0.3337 0.3942 0.3190 -0.0281 -0.0478 -0.0193 141 LEU H N 2727 C CA . LEU B 147 ? 0.3066 0.3672 0.2872 -0.0239 -0.0438 -0.0187 141 LEU H CA 2728 C C . LEU B 147 ? 0.3043 0.3784 0.2893 -0.0208 -0.0436 -0.0195 141 LEU H C 2729 O O . LEU B 147 ? 0.3594 0.4463 0.3538 -0.0243 -0.0430 -0.0176 141 LEU H O 2730 C CB . LEU B 147 ? 0.2143 0.2734 0.1956 -0.0280 -0.0395 -0.0147 141 LEU H CB 2731 C CG . LEU B 147 ? 0.3106 0.3689 0.2860 -0.0255 -0.0356 -0.0132 141 LEU H CG 2732 C CD1 . LEU B 147 ? 0.2666 0.3133 0.2302 -0.0201 -0.0360 -0.0147 141 LEU H CD1 2733 C CD2 . LEU B 147 ? 0.2585 0.3161 0.2359 -0.0310 -0.0321 -0.0086 141 LEU H CD2 2734 N N . VAL B 148 ? 0.2987 0.3701 0.2767 -0.0140 -0.0441 -0.0221 142 VAL H N 2735 C CA . VAL B 148 ? 0.3289 0.4120 0.3097 -0.0091 -0.0436 -0.0229 142 VAL H CA 2736 C C . VAL B 148 ? 0.3326 0.4114 0.3049 -0.0052 -0.0392 -0.0225 142 VAL H C 2737 O O . VAL B 148 ? 0.3812 0.4484 0.3424 -0.0009 -0.0393 -0.0240 142 VAL H O 2738 C CB . VAL B 148 ? 0.3302 0.4133 0.3088 -0.0038 -0.0478 -0.0261 142 VAL H CB 2739 C CG1 . VAL B 148 ? 0.2920 0.3885 0.2744 0.0020 -0.0470 -0.0263 142 VAL H CG1 2740 C CG2 . VAL B 148 ? 0.3087 0.3930 0.2931 -0.0086 -0.0527 -0.0265 142 VAL H CG2 2741 N N . LYS B 149 ? 0.4184 0.5060 0.3952 -0.0072 -0.0356 -0.0201 143 LYS H N 2742 C CA . LYS B 149 ? 0.4244 0.5050 0.3919 -0.0060 -0.0314 -0.0190 143 LYS H CA 2743 C C . LYS B 149 ? 0.3812 0.4698 0.3471 -0.0005 -0.0283 -0.0194 143 LYS H C 2744 O O . LYS B 149 ? 0.3535 0.4579 0.3298 0.0002 -0.0279 -0.0188 143 LYS H O 2745 C CB . LYS B 149 ? 0.3879 0.4676 0.3590 -0.0141 -0.0291 -0.0152 143 LYS H CB 2746 C CG . LYS B 149 ? 0.4402 0.5095 0.4003 -0.0150 -0.0259 -0.0132 143 LYS H CG 2747 C CD . LYS B 149 ? 0.4480 0.5161 0.4126 -0.0232 -0.0245 -0.0090 143 LYS H CD 2748 C CE . LYS B 149 ? 0.4508 0.5098 0.4050 -0.0253 -0.0217 -0.0059 143 LYS H CE 2749 N NZ . LYS B 149 ? 0.5444 0.6079 0.4950 -0.0237 -0.0186 -0.0060 143 LYS H NZ 2750 N N . ASP B 150 ? 0.3673 0.4442 0.3192 0.0035 -0.0261 -0.0200 144 ASP H N 2751 C CA . ASP B 150 ? 0.3350 0.4148 0.2811 0.0090 -0.0224 -0.0204 144 ASP H CA 2752 C C . ASP B 150 ? 0.3673 0.4580 0.3171 0.0176 -0.0227 -0.0226 144 ASP H C 2753 O O . ASP B 150 ? 0.4306 0.5366 0.3886 0.0193 -0.0201 -0.0213 144 ASP H O 2754 C CB . ASP B 150 ? 0.3791 0.4685 0.3318 0.0037 -0.0184 -0.0172 144 ASP H CB 2755 C CG . ASP B 150 ? 0.4515 0.5305 0.3996 -0.0043 -0.0175 -0.0143 144 ASP H CG 2756 O OD1 . ASP B 150 ? 0.4851 0.5487 0.4220 -0.0046 -0.0190 -0.0145 144 ASP H OD1 2757 O OD2 . ASP B 150 ? 0.4737 0.5607 0.4294 -0.0105 -0.0153 -0.0113 144 ASP H OD2 2758 N N . TYR B 151 ? 0.3119 0.3957 0.2561 0.0232 -0.0260 -0.0253 145 TYR H N 2759 C CA . TYR B 151 ? 0.3822 0.4756 0.3290 0.0321 -0.0264 -0.0269 145 TYR H CA 2760 C C . TYR B 151 ? 0.3791 0.4575 0.3088 0.0409 -0.0262 -0.0296 145 TYR H C 2761 O O . TYR B 151 ? 0.3176 0.3779 0.2344 0.0391 -0.0276 -0.0305 145 TYR H O 2762 C CB . TYR B 151 ? 0.3497 0.4523 0.3082 0.0308 -0.0314 -0.0273 145 TYR H CB 2763 C CG . TYR B 151 ? 0.3449 0.4324 0.2960 0.0297 -0.0357 -0.0295 145 TYR H CG 2764 C CD1 . TYR B 151 ? 0.3412 0.4209 0.2930 0.0214 -0.0372 -0.0287 145 TYR H CD1 2765 C CD2 . TYR B 151 ? 0.2921 0.3734 0.2357 0.0372 -0.0382 -0.0321 145 TYR H CD2 2766 C CE1 . TYR B 151 ? 0.2720 0.3388 0.2170 0.0210 -0.0407 -0.0303 145 TYR H CE1 2767 C CE2 . TYR B 151 ? 0.3440 0.4123 0.2809 0.0361 -0.0421 -0.0339 145 TYR H CE2 2768 C CZ . TYR B 151 ? 0.3510 0.4123 0.2885 0.0281 -0.0432 -0.0329 145 TYR H CZ 2769 O OH . TYR B 151 ? 0.3767 0.4260 0.3074 0.0276 -0.0466 -0.0343 145 TYR H OH 2770 N N . PHE B 152 ? 0.4216 0.5079 0.3511 0.0504 -0.0246 -0.0305 146 PHE H N 2771 C CA . PHE B 152 ? 0.3897 0.4620 0.3028 0.0600 -0.0244 -0.0331 146 PHE H CA 2772 C C . PHE B 152 ? 0.4045 0.4909 0.3235 0.0704 -0.0239 -0.0335 146 PHE H C 2773 O O . PHE B 152 ? 0.4634 0.5684 0.3934 0.0725 -0.0205 -0.0312 146 PHE H O 2774 C CB . PHE B 152 ? 0.4162 0.4746 0.3128 0.0616 -0.0200 -0.0332 146 PHE H CB 2775 C CG . PHE B 152 ? 0.4340 0.4742 0.3107 0.0708 -0.0203 -0.0359 146 PHE H CG 2776 C CD1 . PHE B 152 ? 0.4153 0.4599 0.2880 0.0828 -0.0172 -0.0370 146 PHE H CD1 2777 C CD2 . PHE B 152 ? 0.3944 0.4133 0.2562 0.0676 -0.0238 -0.0369 146 PHE H CD2 2778 C CE1 . PHE B 152 ? 0.4903 0.5162 0.3434 0.0916 -0.0178 -0.0395 146 PHE H CE1 2779 C CE2 . PHE B 152 ? 0.4221 0.4230 0.2647 0.0753 -0.0249 -0.0391 146 PHE H CE2 2780 C CZ . PHE B 152 ? 0.4754 0.4788 0.3130 0.0874 -0.0219 -0.0407 146 PHE H CZ 2781 N N . PRO B 153 ? 0.4091 0.4876 0.3212 0.0771 -0.0272 -0.0358 147 PRO H N 2782 C CA . PRO B 153 ? 0.3684 0.4267 0.2684 0.0742 -0.0315 -0.0379 147 PRO H CA 2783 C C . PRO B 153 ? 0.3481 0.4120 0.2597 0.0679 -0.0369 -0.0379 147 PRO H C 2784 O O . PRO B 153 ? 0.3938 0.4751 0.3220 0.0634 -0.0374 -0.0360 147 PRO H O 2785 C CB . PRO B 153 ? 0.4441 0.4922 0.3305 0.0857 -0.0320 -0.0402 147 PRO H CB 2786 C CG . PRO B 153 ? 0.4304 0.5002 0.3305 0.0933 -0.0308 -0.0390 147 PRO H CG 2787 C CD . PRO B 153 ? 0.3968 0.4848 0.3104 0.0889 -0.0265 -0.0360 147 PRO H CD 2788 N N . GLU B 154 ? 0.3634 0.4120 0.2653 0.0674 -0.0409 -0.0397 148 GLU H N 2789 C CA . GLU B 154 ? 0.4441 0.4959 0.3539 0.0635 -0.0461 -0.0402 148 GLU H CA 2790 C C . GLU B 154 ? 0.4901 0.5558 0.4085 0.0703 -0.0482 -0.0406 148 GLU H C 2791 O O . GLU B 154 ? 0.5134 0.5818 0.4279 0.0797 -0.0460 -0.0407 148 GLU H O 2792 C CB . GLU B 154 ? 0.4740 0.5062 0.3701 0.0622 -0.0494 -0.0418 148 GLU H CB 2793 C CG . GLU B 154 ? 0.5913 0.6106 0.4787 0.0554 -0.0477 -0.0404 148 GLU H CG 2794 C CD . GLU B 154 ? 0.7525 0.7574 0.6308 0.0523 -0.0515 -0.0407 148 GLU H CD 2795 O OE1 . GLU B 154 ? 0.7983 0.8071 0.6847 0.0476 -0.0539 -0.0406 148 GLU H OE1 2796 O OE2 . GLU B 154 ? 0.8067 0.7962 0.6691 0.0546 -0.0521 -0.0408 148 GLU H OE2 2797 N N . PRO B 155 ? 0.5166 0.5910 0.4461 0.0659 -0.0526 -0.0403 149 PRO H N 2798 C CA . PRO B 155 ? 0.5333 0.6052 0.4676 0.0556 -0.0550 -0.0400 149 PRO H CA 2799 C C . PRO B 155 ? 0.4518 0.5413 0.4025 0.0493 -0.0547 -0.0375 149 PRO H C 2800 O O . PRO B 155 ? 0.3879 0.4938 0.3475 0.0527 -0.0528 -0.0355 149 PRO H O 2801 C CB . PRO B 155 ? 0.5082 0.5751 0.4404 0.0563 -0.0607 -0.0419 149 PRO H CB 2802 C CG . PRO B 155 ? 0.4613 0.5413 0.3992 0.0641 -0.0620 -0.0414 149 PRO H CG 2803 C CD . PRO B 155 ? 0.5111 0.5936 0.4450 0.0717 -0.0565 -0.0407 149 PRO H CD 2804 N N . VAL B 156 ? 0.4554 0.5412 0.4092 0.0405 -0.0564 -0.0372 150 VAL H N 2805 C CA . VAL B 156 ? 0.4386 0.5384 0.4066 0.0335 -0.0583 -0.0351 150 VAL H CA 2806 C C . VAL B 156 ? 0.5006 0.5952 0.4686 0.0298 -0.0642 -0.0365 150 VAL H C 2807 O O . VAL B 156 ? 0.4900 0.5689 0.4473 0.0306 -0.0655 -0.0389 150 VAL H O 2808 C CB . VAL B 156 ? 0.4086 0.5079 0.3801 0.0258 -0.0552 -0.0332 150 VAL H CB 2809 C CG1 . VAL B 156 ? 0.4068 0.5144 0.3801 0.0287 -0.0496 -0.0313 150 VAL H CG1 2810 C CG2 . VAL B 156 ? 0.4427 0.5230 0.4034 0.0228 -0.0546 -0.0345 150 VAL H CG2 2811 N N . THR B 157 ? 0.5187 0.6264 0.4979 0.0255 -0.0680 -0.0349 151 THR H N 2812 C CA . THR B 157 ? 0.4842 0.5856 0.4624 0.0203 -0.0738 -0.0361 151 THR H CA 2813 C C . THR B 157 ? 0.4512 0.5524 0.4347 0.0106 -0.0744 -0.0346 151 THR H C 2814 O O . THR B 157 ? 0.4566 0.5707 0.4498 0.0073 -0.0725 -0.0316 151 THR H O 2815 C CB . THR B 157 ? 0.5058 0.6196 0.4905 0.0218 -0.0791 -0.0352 151 THR H CB 2816 O OG1 . THR B 157 ? 0.6069 0.7421 0.6048 0.0217 -0.0781 -0.0311 151 THR H OG1 2817 C CG2 . THR B 157 ? 0.4790 0.5881 0.4560 0.0311 -0.0797 -0.0373 151 THR H CG2 2818 N N . VAL B 158 ? 0.3974 0.4836 0.3739 0.0065 -0.0769 -0.0366 152 VAL H N 2819 C CA . VAL B 158 ? 0.3718 0.4548 0.3512 -0.0022 -0.0780 -0.0355 152 VAL H CA 2820 C C . VAL B 158 ? 0.4090 0.4843 0.3847 -0.0066 -0.0844 -0.0370 152 VAL H C 2821 O O . VAL B 158 ? 0.4163 0.4785 0.3817 -0.0035 -0.0858 -0.0400 152 VAL H O 2822 C CB . VAL B 158 ? 0.3865 0.4558 0.3591 -0.0033 -0.0732 -0.0359 152 VAL H CB 2823 C CG1 . VAL B 158 ? 0.4196 0.4839 0.3941 -0.0116 -0.0746 -0.0348 152 VAL H CG1 2824 C CG2 . VAL B 158 ? 0.2779 0.3535 0.2530 -0.0005 -0.0673 -0.0341 152 VAL H CG2 2825 N N . SER B 159 ? 0.3318 0.4149 0.3150 -0.0141 -0.0885 -0.0348 153 SER H N 2826 C CA . SER B 159 ? 0.3304 0.4033 0.3082 -0.0198 -0.0948 -0.0361 153 SER H CA 2827 C C . SER B 159 ? 0.3975 0.4643 0.3760 -0.0283 -0.0952 -0.0347 153 SER H C 2828 O O . SER B 159 ? 0.4077 0.4816 0.3931 -0.0301 -0.0911 -0.0322 153 SER H O 2829 C CB . SER B 159 ? 0.4387 0.5249 0.4227 -0.0219 -0.1014 -0.0343 153 SER H CB 2830 O OG . SER B 159 ? 0.5171 0.6244 0.5152 -0.0250 -0.1015 -0.0296 153 SER H OG 2831 N N . TRP B 160 ? 0.4384 0.4910 0.4086 -0.0332 -0.1001 -0.0363 154 TRP H N 2832 C CA . TRP B 160 ? 0.3842 0.4282 0.3530 -0.0412 -0.1013 -0.0352 154 TRP H CA 2833 C C . TRP B 160 ? 0.3573 0.4012 0.3256 -0.0498 -0.1100 -0.0340 154 TRP H C 2834 O O . TRP B 160 ? 0.4146 0.4499 0.3745 -0.0496 -0.1149 -0.0364 154 TRP H O 2835 C CB . TRP B 160 ? 0.3914 0.4128 0.3468 -0.0387 -0.0979 -0.0383 154 TRP H CB 2836 C CG . TRP B 160 ? 0.3800 0.4019 0.3371 -0.0335 -0.0899 -0.0376 154 TRP H CG 2837 C CD1 . TRP B 160 ? 0.4050 0.4256 0.3584 -0.0255 -0.0856 -0.0391 154 TRP H CD1 2838 C CD2 . TRP B 160 ? 0.2820 0.3060 0.2445 -0.0368 -0.0858 -0.0348 154 TRP H CD2 2839 N NE1 . TRP B 160 ? 0.4002 0.4217 0.3559 -0.0239 -0.0792 -0.0372 154 TRP H NE1 2840 C CE2 . TRP B 160 ? 0.4348 0.4587 0.3965 -0.0306 -0.0790 -0.0347 154 TRP H CE2 2841 C CE3 . TRP B 160 ? 0.3259 0.3514 0.2935 -0.0449 -0.0875 -0.0322 154 TRP H CE3 2842 C CZ2 . TRP B 160 ? 0.4072 0.4330 0.3732 -0.0322 -0.0739 -0.0319 154 TRP H CZ2 2843 C CZ3 . TRP B 160 ? 0.3586 0.3861 0.3309 -0.0460 -0.0822 -0.0297 154 TRP H CZ3 2844 C CH2 . TRP B 160 ? 0.4139 0.4417 0.3855 -0.0397 -0.0754 -0.0295 154 TRP H CH2 2845 N N . ASN B 161 ? 0.3782 0.4314 0.3552 -0.0580 -0.1122 -0.0300 155 ASN H N 2846 C CA . ASN B 161 ? 0.4257 0.4824 0.4040 -0.0678 -0.1212 -0.0274 155 ASN H CA 2847 C C . ASN B 161 ? 0.4276 0.4977 0.4100 -0.0662 -0.1261 -0.0264 155 ASN H C 2848 O O . ASN B 161 ? 0.3409 0.4020 0.3151 -0.0704 -0.1332 -0.0274 155 ASN H O 2849 C CB . ASN B 161 ? 0.4647 0.4951 0.4269 -0.0732 -0.1256 -0.0302 155 ASN H CB 2850 C CG . ASN B 161 ? 0.5169 0.5353 0.4762 -0.0759 -0.1218 -0.0300 155 ASN H CG 2851 O OD1 . ASN B 161 ? 0.4887 0.5206 0.4595 -0.0762 -0.1173 -0.0269 155 ASN H OD1 2852 N ND2 . ASN B 161 ? 0.4652 0.4581 0.4085 -0.0775 -0.1235 -0.0330 155 ASN H ND2 2853 N N . SER B 162 ? 0.4469 0.5378 0.4412 -0.0596 -0.1219 -0.0245 156 SER H N 2854 C CA . SER B 162 ? 0.4334 0.5411 0.4343 -0.0569 -0.1256 -0.0225 156 SER H CA 2855 C C . SER B 162 ? 0.4303 0.5238 0.4190 -0.0525 -0.1284 -0.0269 156 SER H C 2856 O O . SER B 162 ? 0.4359 0.5388 0.4273 -0.0534 -0.1341 -0.0250 156 SER H O 2857 C CB . SER B 162 ? 0.4344 0.5579 0.4443 -0.0674 -0.1336 -0.0164 156 SER H CB 2858 O OG . SER B 162 ? 0.4882 0.6274 0.5104 -0.0714 -0.1310 -0.0117 156 SER H OG 2859 N N . GLY B 163 ? 0.3854 0.4573 0.3611 -0.0478 -0.1244 -0.0322 157 GLY H N 2860 C CA . GLY B 163 ? 0.3908 0.4491 0.3545 -0.0429 -0.1262 -0.0364 157 GLY H CA 2861 C C . GLY B 163 ? 0.4494 0.4853 0.3982 -0.0491 -0.1316 -0.0391 157 GLY H C 2862 O O . GLY B 163 ? 0.4349 0.4578 0.3722 -0.0458 -0.1334 -0.0427 157 GLY H O 2863 N N . ALA B 164 ? 0.4087 0.4389 0.3565 -0.0581 -0.1343 -0.0374 158 ALA H N 2864 C CA . ALA B 164 ? 0.5620 0.5678 0.4933 -0.0638 -0.1392 -0.0402 158 ALA H CA 2865 C C . ALA B 164 ? 0.5358 0.5198 0.4545 -0.0575 -0.1324 -0.0447 158 ALA H C 2866 O O . ALA B 164 ? 0.4998 0.4628 0.4023 -0.0566 -0.1342 -0.0485 158 ALA H O 2867 C CB . ALA B 164 ? 0.5373 0.5434 0.4708 -0.0758 -0.1450 -0.0365 158 ALA H CB 2868 N N . LEU B 165 ? 0.4812 0.4708 0.4070 -0.0531 -0.1245 -0.0439 159 LEU H N 2869 C CA . LEU B 165 ? 0.5185 0.4907 0.4343 -0.0472 -0.1177 -0.0468 159 LEU H CA 2870 C C . LEU B 165 ? 0.5155 0.4908 0.4308 -0.0370 -0.1124 -0.0487 159 LEU H C 2871 O O . LEU B 165 ? 0.4686 0.4602 0.3952 -0.0332 -0.1083 -0.0468 159 LEU H O 2872 C CB . LEU B 165 ? 0.4839 0.4587 0.4066 -0.0493 -0.1126 -0.0442 159 LEU H CB 2873 C CG . LEU B 165 ? 0.4765 0.4363 0.3911 -0.0434 -0.1051 -0.0457 159 LEU H CG 2874 C CD1 . LEU B 165 ? 0.4496 0.3840 0.3459 -0.0430 -0.1069 -0.0491 159 LEU H CD1 2875 C CD2 . LEU B 165 ? 0.4038 0.3685 0.3268 -0.0468 -0.1012 -0.0424 159 LEU H CD2 2876 N N . THR B 166 ? 0.5095 0.4683 0.4106 -0.0327 -0.1125 -0.0523 160 THR H N 2877 C CA . THR B 166 ? 0.4928 0.4541 0.3923 -0.0240 -0.1091 -0.0539 160 THR H CA 2878 C C . THR B 166 ? 0.4492 0.3929 0.3359 -0.0181 -0.1037 -0.0560 160 THR H C 2879 O O . THR B 166 ? 0.5178 0.4645 0.4051 -0.0114 -0.0986 -0.0558 160 THR H O 2880 C CB . THR B 166 ? 0.4819 0.4459 0.3786 -0.0242 -0.1159 -0.0554 160 THR H CB 2881 O OG1 . THR B 166 ? 0.5783 0.5542 0.4806 -0.0172 -0.1135 -0.0552 160 THR H OG1 2882 C CG2 . THR B 166 ? 0.4028 0.3455 0.2818 -0.0239 -0.1187 -0.0591 160 THR H CG2 2883 N N . SER B 167 ? 0.5230 0.4483 0.3977 -0.0206 -0.1047 -0.0576 161 SER H N 2884 C CA . SER B 167 ? 0.5166 0.4251 0.3784 -0.0146 -0.0995 -0.0591 161 SER H CA 2885 C C . SER B 167 ? 0.5154 0.4257 0.3824 -0.0124 -0.0920 -0.0561 161 SER H C 2886 O O . SER B 167 ? 0.5270 0.4405 0.4009 -0.0176 -0.0919 -0.0540 161 SER H O 2887 C CB . SER B 167 ? 0.6425 0.5294 0.4881 -0.0173 -0.1032 -0.0618 161 SER H CB 2888 O OG . SER B 167 ? 0.7762 0.6471 0.6094 -0.0108 -0.0974 -0.0627 161 SER H OG 2889 N N . GLY B 168 ? 0.5700 0.4786 0.4337 -0.0051 -0.0860 -0.0554 162 GLY H N 2890 C CA . GLY B 168 ? 0.5502 0.4605 0.4181 -0.0029 -0.0789 -0.0519 162 GLY H CA 2891 C C . GLY B 168 ? 0.5620 0.4909 0.4451 -0.0046 -0.0769 -0.0489 162 GLY H C 2892 O O . GLY B 168 ? 0.5745 0.5062 0.4625 -0.0045 -0.0718 -0.0456 162 GLY H O 2893 N N . VAL B 169 ? 0.4222 0.3636 0.3123 -0.0057 -0.0808 -0.0499 163 VAL H N 2894 C CA . VAL B 169 ? 0.4049 0.3634 0.3080 -0.0064 -0.0790 -0.0474 163 VAL H CA 2895 C C . VAL B 169 ? 0.4457 0.4077 0.3475 -0.0001 -0.0751 -0.0465 163 VAL H C 2896 O O . VAL B 169 ? 0.4778 0.4366 0.3730 0.0039 -0.0770 -0.0485 163 VAL H O 2897 C CB . VAL B 169 ? 0.4347 0.4062 0.3462 -0.0098 -0.0846 -0.0482 163 VAL H CB 2898 C CG1 . VAL B 169 ? 0.4468 0.4351 0.3696 -0.0083 -0.0819 -0.0459 163 VAL H CG1 2899 C CG2 . VAL B 169 ? 0.3345 0.3051 0.2490 -0.0177 -0.0889 -0.0477 163 VAL H CG2 2900 N N . HIS B 170 ? 0.3821 0.3501 0.2895 0.0001 -0.0701 -0.0432 164 HIS H N 2901 C CA . HIS B 170 ? 0.3739 0.3457 0.2801 0.0046 -0.0671 -0.0418 164 HIS H CA 2902 C C . HIS B 170 ? 0.4729 0.4581 0.3891 0.0031 -0.0656 -0.0400 164 HIS H C 2903 O O . HIS B 170 ? 0.4274 0.4163 0.3496 -0.0003 -0.0625 -0.0372 164 HIS H O 2904 C CB . HIS B 170 ? 0.3779 0.3418 0.2779 0.0068 -0.0620 -0.0386 164 HIS H CB 2905 C CG . HIS B 170 ? 0.4287 0.3799 0.3176 0.0100 -0.0624 -0.0399 164 HIS H CG 2906 N ND1 . HIS B 170 ? 0.5265 0.4739 0.4078 0.0137 -0.0654 -0.0426 164 HIS H ND1 2907 C CD2 . HIS B 170 ? 0.4151 0.3561 0.2984 0.0104 -0.0599 -0.0388 164 HIS H CD2 2908 C CE1 . HIS B 170 ? 0.5718 0.5077 0.4434 0.0162 -0.0647 -0.0431 164 HIS H CE1 2909 N NE2 . HIS B 170 ? 0.5359 0.4674 0.4082 0.0146 -0.0612 -0.0409 164 HIS H NE2 2910 N N . THR B 171 ? 0.4555 0.4477 0.3730 0.0061 -0.0678 -0.0414 165 THR H N 2911 C CA . THR B 171 ? 0.3257 0.3294 0.2504 0.0064 -0.0658 -0.0399 165 THR H CA 2912 C C . THR B 171 ? 0.3529 0.3528 0.2704 0.0108 -0.0632 -0.0388 165 THR H C 2913 O O . THR B 171 ? 0.4167 0.4137 0.3280 0.0153 -0.0654 -0.0406 165 THR H O 2914 C CB . THR B 171 ? 0.3538 0.3688 0.2851 0.0073 -0.0697 -0.0417 165 THR H CB 2915 O OG1 . THR B 171 ? 0.3809 0.4004 0.3192 0.0017 -0.0726 -0.0417 165 THR H OG1 2916 C CG2 . THR B 171 ? 0.2606 0.2866 0.1974 0.0093 -0.0669 -0.0402 165 THR H CG2 2917 N N . PHE B 172 ? 0.2950 0.2945 0.2128 0.0090 -0.0588 -0.0355 166 PHE H N 2918 C CA . PHE B 172 ? 0.2604 0.2548 0.1701 0.0116 -0.0566 -0.0334 166 PHE H CA 2919 C C . PHE B 172 ? 0.3175 0.3160 0.2256 0.0153 -0.0573 -0.0346 166 PHE H C 2920 O O . PHE B 172 ? 0.3822 0.3904 0.2979 0.0155 -0.0575 -0.0357 166 PHE H O 2921 C CB . PHE B 172 ? 0.2560 0.2498 0.1671 0.0077 -0.0521 -0.0288 166 PHE H CB 2922 C CG . PHE B 172 ? 0.4094 0.3970 0.3193 0.0058 -0.0507 -0.0268 166 PHE H CG 2923 C CD1 . PHE B 172 ? 0.4581 0.4379 0.3591 0.0079 -0.0498 -0.0244 166 PHE H CD1 2924 C CD2 . PHE B 172 ? 0.3524 0.3417 0.2692 0.0023 -0.0505 -0.0271 166 PHE H CD2 2925 C CE1 . PHE B 172 ? 0.4304 0.4048 0.3298 0.0074 -0.0480 -0.0222 166 PHE H CE1 2926 C CE2 . PHE B 172 ? 0.3554 0.3373 0.2695 0.0017 -0.0490 -0.0254 166 PHE H CE2 2927 C CZ . PHE B 172 ? 0.3558 0.3306 0.2614 0.0048 -0.0474 -0.0230 166 PHE H CZ 2928 N N . PRO B 173 ? 0.3842 0.3751 0.2817 0.0186 -0.0577 -0.0341 167 PRO H N 2929 C CA . PRO B 173 ? 0.4389 0.4299 0.3315 0.0224 -0.0578 -0.0347 167 PRO H CA 2930 C C . PRO B 173 ? 0.4057 0.4015 0.3017 0.0200 -0.0539 -0.0324 167 PRO H C 2931 O O . PRO B 173 ? 0.4027 0.3972 0.2998 0.0152 -0.0511 -0.0289 167 PRO H O 2932 C CB . PRO B 173 ? 0.4167 0.3962 0.2961 0.0239 -0.0587 -0.0330 167 PRO H CB 2933 C CG . PRO B 173 ? 0.5325 0.5082 0.4110 0.0232 -0.0604 -0.0332 167 PRO H CG 2934 C CD . PRO B 173 ? 0.4099 0.3910 0.2985 0.0192 -0.0584 -0.0328 167 PRO H CD 2935 N N . ALA B 174 ? 0.3440 0.3454 0.2415 0.0235 -0.0535 -0.0340 168 ALA H N 2936 C CA . ALA B 174 ? 0.3531 0.3582 0.2519 0.0220 -0.0497 -0.0321 168 ALA H CA 2937 C C . ALA B 174 ? 0.3569 0.3502 0.2429 0.0204 -0.0483 -0.0291 168 ALA H C 2938 O O . ALA B 174 ? 0.3770 0.3602 0.2518 0.0229 -0.0506 -0.0293 168 ALA H O 2939 C CB . ALA B 174 ? 0.3133 0.3257 0.2138 0.0279 -0.0494 -0.0344 168 ALA H CB 2940 N N . VAL B 175 ? 0.3314 0.3263 0.2191 0.0156 -0.0448 -0.0259 169 VAL H N 2941 C CA . VAL B 175 ? 0.3487 0.3332 0.2240 0.0134 -0.0437 -0.0225 169 VAL H CA 2942 C C . VAL B 175 ? 0.3860 0.3721 0.2585 0.0146 -0.0410 -0.0229 169 VAL H C 2943 O O . VAL B 175 ? 0.3361 0.3338 0.2196 0.0143 -0.0386 -0.0237 169 VAL H O 2944 C CB . VAL B 175 ? 0.4821 0.4653 0.3594 0.0060 -0.0421 -0.0172 169 VAL H CB 2945 C CG1 . VAL B 175 ? 0.4252 0.4072 0.3050 0.0058 -0.0441 -0.0168 169 VAL H CG1 2946 C CG2 . VAL B 175 ? 0.5077 0.5011 0.3970 0.0014 -0.0387 -0.0157 169 VAL H CG2 2947 N N . LEU B 176 ? 0.4053 0.3790 0.2620 0.0161 -0.0415 -0.0222 170 LEU H N 2948 C CA . LEU B 176 ? 0.3711 0.3429 0.2214 0.0177 -0.0386 -0.0225 170 LEU H CA 2949 C C . LEU B 176 ? 0.4223 0.3926 0.2715 0.0094 -0.0361 -0.0176 170 LEU H C 2950 O O . LEU B 176 ? 0.4727 0.4329 0.3122 0.0044 -0.0376 -0.0136 170 LEU H O 2951 C CB . LEU B 176 ? 0.4216 0.3781 0.2529 0.0232 -0.0407 -0.0242 170 LEU H CB 2952 C CG . LEU B 176 ? 0.5382 0.4891 0.3588 0.0261 -0.0377 -0.0250 170 LEU H CG 2953 C CD1 . LEU B 176 ? 0.4246 0.3915 0.2583 0.0315 -0.0341 -0.0278 170 LEU H CD1 2954 C CD2 . LEU B 176 ? 0.5711 0.5043 0.3714 0.0320 -0.0404 -0.0268 170 LEU H CD2 2955 N N . GLN B 177 ? 0.3781 0.3596 0.2376 0.0076 -0.0324 -0.0173 171 GLN H N 2956 C CA . GLN B 177 ? 0.3192 0.3009 0.1791 -0.0004 -0.0299 -0.0126 171 GLN H CA 2957 C C . GLN B 177 ? 0.3308 0.3002 0.1732 -0.0005 -0.0288 -0.0117 171 GLN H C 2958 O O . GLN B 177 ? 0.3770 0.3397 0.2088 0.0067 -0.0291 -0.0154 171 GLN H O 2959 C CB . GLN B 177 ? 0.2971 0.2952 0.1743 -0.0027 -0.0267 -0.0126 171 GLN H CB 2960 C CG . GLN B 177 ? 0.3379 0.3466 0.2310 -0.0034 -0.0281 -0.0135 171 GLN H CG 2961 C CD . GLN B 177 ? 0.4462 0.4708 0.3551 -0.0052 -0.0257 -0.0137 171 GLN H CD 2962 O OE1 . GLN B 177 ? 0.4875 0.5171 0.4055 -0.0118 -0.0247 -0.0106 171 GLN H OE1 2963 N NE2 . GLN B 177 ? 0.4700 0.5029 0.3824 0.0007 -0.0249 -0.0170 171 GLN H NE2 2964 N N . SER B 178 ? 0.3197 0.2856 0.1584 -0.0086 -0.0276 -0.0066 172 SER H N 2965 C CA . SER B 178 ? 0.4040 0.3562 0.2241 -0.0102 -0.0271 -0.0053 172 SER H CA 2966 C C . SER B 178 ? 0.4453 0.4020 0.2649 -0.0049 -0.0230 -0.0089 172 SER H C 2967 O O . SER B 178 ? 0.4851 0.4291 0.2873 -0.0040 -0.0221 -0.0091 172 SER H O 2968 C CB . SER B 178 ? 0.4586 0.4080 0.2766 -0.0210 -0.0270 0.0018 172 SER H CB 2969 O OG . SER B 178 ? 0.5102 0.4754 0.3466 -0.0254 -0.0239 0.0038 172 SER H OG 2970 N N . SER B 179 ? 0.3276 0.3019 0.1654 -0.0016 -0.0206 -0.0114 173 SER H N 2971 C CA . SER B 179 ? 0.3386 0.3206 0.1783 0.0044 -0.0166 -0.0144 173 SER H CA 2972 C C . SER B 179 ? 0.4416 0.4205 0.2747 0.0160 -0.0171 -0.0195 173 SER H C 2973 O O . SER B 179 ? 0.5103 0.4928 0.3408 0.0229 -0.0136 -0.0218 173 SER H O 2974 C CB . SER B 179 ? 0.3313 0.3351 0.1938 0.0022 -0.0142 -0.0139 173 SER H CB 2975 O OG . SER B 179 ? 0.3592 0.3716 0.2345 0.0048 -0.0169 -0.0158 173 SER H OG 2976 N N . GLY B 180 ? 0.3819 0.3546 0.2124 0.0186 -0.0214 -0.0209 174 GLY H N 2977 C CA . GLY B 180 ? 0.3127 0.2829 0.1380 0.0295 -0.0224 -0.0254 174 GLY H CA 2978 C C . GLY B 180 ? 0.3564 0.3467 0.2022 0.0336 -0.0223 -0.0274 174 GLY H C 2979 O O . GLY B 180 ? 0.3139 0.3067 0.1593 0.0428 -0.0228 -0.0306 174 GLY H O 2980 N N . LEU B 181 ? 0.3515 0.3556 0.2147 0.0264 -0.0219 -0.0251 175 LEU H N 2981 C CA . LEU B 181 ? 0.3809 0.4030 0.2631 0.0281 -0.0228 -0.0263 175 LEU H CA 2982 C C . LEU B 181 ? 0.3566 0.3763 0.2439 0.0238 -0.0272 -0.0260 175 LEU H C 2983 O O . LEU B 181 ? 0.3296 0.3395 0.2115 0.0174 -0.0283 -0.0235 175 LEU H O 2984 C CB . LEU B 181 ? 0.3184 0.3576 0.2160 0.0233 -0.0195 -0.0241 175 LEU H CB 2985 C CG . LEU B 181 ? 0.3607 0.4043 0.2542 0.0275 -0.0145 -0.0241 175 LEU H CG 2986 C CD1 . LEU B 181 ? 0.4436 0.5016 0.3504 0.0203 -0.0115 -0.0209 175 LEU H CD1 2987 C CD2 . LEU B 181 ? 0.2774 0.3303 0.1733 0.0385 -0.0136 -0.0267 175 LEU H CD2 2988 N N . TYR B 182 ? 0.3179 0.3465 0.2149 0.0275 -0.0297 -0.0282 176 TYR H N 2989 C CA . TYR B 182 ? 0.2721 0.2980 0.1729 0.0242 -0.0338 -0.0284 176 TYR H CA 2990 C C . TYR B 182 ? 0.3622 0.3987 0.2781 0.0167 -0.0335 -0.0263 176 TYR H C 2991 O O . TYR B 182 ? 0.3055 0.3550 0.2319 0.0149 -0.0312 -0.0253 176 TYR H O 2992 C CB . TYR B 182 ? 0.2944 0.3228 0.1966 0.0312 -0.0372 -0.0317 176 TYR H CB 2993 C CG . TYR B 182 ? 0.4045 0.4198 0.2904 0.0385 -0.0381 -0.0336 176 TYR H CG 2994 C CD1 . TYR B 182 ? 0.3443 0.3438 0.2178 0.0375 -0.0412 -0.0335 176 TYR H CD1 2995 C CD2 . TYR B 182 ? 0.4336 0.4517 0.3156 0.0466 -0.0358 -0.0351 176 TYR H CD2 2996 C CE1 . TYR B 182 ? 0.4137 0.3997 0.2710 0.0436 -0.0426 -0.0351 176 TYR H CE1 2997 C CE2 . TYR B 182 ? 0.4867 0.4906 0.3521 0.0537 -0.0368 -0.0370 176 TYR H CE2 2998 C CZ . TYR B 182 ? 0.4952 0.4826 0.3481 0.0518 -0.0404 -0.0370 176 TYR H CZ 2999 O OH . TYR B 182 ? 0.5979 0.5700 0.4333 0.0583 -0.0419 -0.0386 176 TYR H OH 3000 N N . SER B 183 ? 0.3343 0.3647 0.2505 0.0126 -0.0359 -0.0254 177 SER H N 3001 C CA . SER B 183 ? 0.3656 0.4030 0.2940 0.0061 -0.0362 -0.0238 177 SER H CA 3002 C C . SER B 183 ? 0.3919 0.4232 0.3195 0.0061 -0.0398 -0.0250 177 SER H C 3003 O O . SER B 183 ? 0.3263 0.3468 0.2432 0.0090 -0.0415 -0.0256 177 SER H O 3004 C CB . SER B 183 ? 0.3318 0.3665 0.2599 -0.0007 -0.0332 -0.0195 177 SER H CB 3005 O OG . SER B 183 ? 0.4186 0.4582 0.3574 -0.0063 -0.0336 -0.0179 177 SER H OG 3006 N N . LEU B 184 ? 0.3095 0.3473 0.2477 0.0026 -0.0412 -0.0251 178 LEU H N 3007 C CA . LEU B 184 ? 0.2803 0.3134 0.2180 0.0032 -0.0449 -0.0270 178 LEU H CA 3008 C C . LEU B 184 ? 0.3092 0.3454 0.2559 -0.0027 -0.0454 -0.0258 178 LEU H C 3009 O O . LEU B 184 ? 0.3651 0.4112 0.3213 -0.0065 -0.0444 -0.0245 178 LEU H O 3010 C CB . LEU B 184 ? 0.3963 0.4343 0.3349 0.0088 -0.0482 -0.0305 178 LEU H CB 3011 C CG . LEU B 184 ? 0.4066 0.4437 0.3467 0.0097 -0.0529 -0.0331 178 LEU H CG 3012 C CD1 . LEU B 184 ? 0.4034 0.4424 0.3400 0.0166 -0.0552 -0.0357 178 LEU H CD1 3013 C CD2 . LEU B 184 ? 0.3880 0.4349 0.3399 0.0047 -0.0547 -0.0328 178 LEU H CD2 3014 N N . SER B 185 ? 0.3069 0.3340 0.2498 -0.0034 -0.0470 -0.0261 179 SER H N 3015 C CA . SER B 185 ? 0.3387 0.3660 0.2878 -0.0079 -0.0484 -0.0259 179 SER H CA 3016 C C . SER B 185 ? 0.3582 0.3806 0.3042 -0.0058 -0.0529 -0.0293 179 SER H C 3017 O O . SER B 185 ? 0.3347 0.3502 0.2722 -0.0012 -0.0540 -0.0310 179 SER H O 3018 C CB . SER B 185 ? 0.3753 0.3949 0.3221 -0.0111 -0.0454 -0.0223 179 SER H CB 3019 O OG . SER B 185 ? 0.5446 0.5699 0.4963 -0.0148 -0.0418 -0.0188 179 SER H OG 3020 N N . SER B 186 ? 0.3294 0.3552 0.2817 -0.0097 -0.0558 -0.0302 180 SER H N 3021 C CA . SER B 186 ? 0.3256 0.3445 0.2737 -0.0093 -0.0603 -0.0331 180 SER H CA 3022 C C . SER B 186 ? 0.3430 0.3537 0.2906 -0.0139 -0.0604 -0.0321 180 SER H C 3023 O O . SER B 186 ? 0.3303 0.3465 0.2855 -0.0193 -0.0602 -0.0302 180 SER H O 3024 C CB . SER B 186 ? 0.3339 0.3634 0.2883 -0.0098 -0.0649 -0.0349 180 SER H CB 3025 O OG . SER B 186 ? 0.3290 0.3508 0.2784 -0.0103 -0.0698 -0.0374 180 SER H OG 3026 N N . VAL B 187 ? 0.2961 0.2931 0.2340 -0.0116 -0.0608 -0.0334 181 VAL H N 3027 C CA . VAL B 187 ? 0.3540 0.3404 0.2888 -0.0145 -0.0603 -0.0326 181 VAL H CA 3028 C C . VAL B 187 ? 0.3946 0.3701 0.3212 -0.0140 -0.0650 -0.0362 181 VAL H C 3029 O O . VAL B 187 ? 0.3773 0.3524 0.2996 -0.0106 -0.0678 -0.0390 181 VAL H O 3030 C CB . VAL B 187 ? 0.3392 0.3179 0.2686 -0.0116 -0.0549 -0.0295 181 VAL H CB 3031 C CG1 . VAL B 187 ? 0.4007 0.3890 0.3372 -0.0133 -0.0507 -0.0255 181 VAL H CG1 3032 C CG2 . VAL B 187 ? 0.3422 0.3144 0.2618 -0.0054 -0.0547 -0.0308 181 VAL H CG2 3033 N N . VAL B 188 ? 0.3416 0.3072 0.2651 -0.0174 -0.0659 -0.0361 182 VAL H N 3034 C CA . VAL B 188 ? 0.4091 0.3611 0.3223 -0.0173 -0.0702 -0.0395 182 VAL H CA 3035 C C . VAL B 188 ? 0.4771 0.4134 0.3826 -0.0175 -0.0677 -0.0385 182 VAL H C 3036 O O . VAL B 188 ? 0.4059 0.3442 0.3172 -0.0209 -0.0652 -0.0354 182 VAL H O 3037 C CB . VAL B 188 ? 0.4191 0.3766 0.3367 -0.0236 -0.0773 -0.0412 182 VAL H CB 3038 C CG1 . VAL B 188 ? 0.4246 0.3888 0.3517 -0.0309 -0.0778 -0.0383 182 VAL H CG1 3039 C CG2 . VAL B 188 ? 0.3907 0.3323 0.2957 -0.0243 -0.0824 -0.0447 182 VAL H CG2 3040 N N . THR B 189 ? 0.4542 0.3750 0.3463 -0.0131 -0.0678 -0.0408 183 THR H N 3041 C CA . THR B 189 ? 0.5065 0.4105 0.3893 -0.0121 -0.0655 -0.0402 183 THR H CA 3042 C C . THR B 189 ? 0.5697 0.4602 0.4436 -0.0166 -0.0720 -0.0437 183 THR H C 3043 O O . THR B 189 ? 0.6067 0.4929 0.4736 -0.0161 -0.0766 -0.0474 183 THR H O 3044 C CB . THR B 189 ? 0.5381 0.4325 0.4103 -0.0035 -0.0603 -0.0395 183 THR H CB 3045 O OG1 . THR B 189 ? 0.5493 0.4414 0.4142 0.0000 -0.0631 -0.0431 183 THR H OG1 3046 C CG2 . THR B 189 ? 0.5556 0.4616 0.4357 -0.0005 -0.0539 -0.0345 183 THR H CG2 3047 N N . VAL B 190 ? 0.5891 0.4725 0.4629 -0.0216 -0.0728 -0.0424 184 VAL H N 3048 C CA . VAL B 190 ? 0.5709 0.4402 0.4355 -0.0275 -0.0798 -0.0452 184 VAL H CA 3049 C C . VAL B 190 ? 0.6196 0.4667 0.4709 -0.0254 -0.0772 -0.0450 184 VAL H C 3050 O O . VAL B 190 ? 0.6925 0.5396 0.5462 -0.0208 -0.0703 -0.0417 184 VAL H O 3051 C CB . VAL B 190 ? 0.5271 0.4096 0.4042 -0.0377 -0.0854 -0.0436 184 VAL H CB 3052 C CG1 . VAL B 190 ? 0.5165 0.4211 0.4063 -0.0385 -0.0873 -0.0435 184 VAL H CG1 3053 C CG2 . VAL B 190 ? 0.4686 0.3563 0.3550 -0.0405 -0.0814 -0.0393 184 VAL H CG2 3054 N N . PRO B 191 ? 0.6376 0.4649 0.4739 -0.0284 -0.0829 -0.0484 185 PRO H N 3055 C CA . PRO B 191 ? 0.6391 0.4439 0.4620 -0.0266 -0.0808 -0.0481 185 PRO H CA 3056 C C . PRO B 191 ? 0.6581 0.4685 0.4917 -0.0328 -0.0803 -0.0440 185 PRO H C 3057 O O . PRO B 191 ? 0.7401 0.5636 0.5851 -0.0421 -0.0858 -0.0429 185 PRO H O 3058 C CB . PRO B 191 ? 0.5861 0.3697 0.3912 -0.0311 -0.0888 -0.0526 185 PRO H CB 3059 C CG . PRO B 191 ? 0.6339 0.4268 0.4400 -0.0308 -0.0925 -0.0554 185 PRO H CG 3060 C CD . PRO B 191 ? 0.6076 0.4301 0.4362 -0.0325 -0.0910 -0.0523 185 PRO H CD 3061 N N . SER B 192 ? 0.7386 0.5402 0.5690 -0.0275 -0.0737 -0.0413 186 SER H N 3062 C CA . SER B 192 ? 0.7985 0.6037 0.6380 -0.0328 -0.0728 -0.0371 186 SER H CA 3063 C C . SER B 192 ? 0.7579 0.5496 0.5905 -0.0429 -0.0812 -0.0384 186 SER H C 3064 O O . SER B 192 ? 0.7263 0.5297 0.5713 -0.0518 -0.0844 -0.0355 186 SER H O 3065 C CB . SER B 192 ? 0.7675 0.5623 0.6019 -0.0243 -0.0644 -0.0340 186 SER H CB 3066 O OG . SER B 192 ? 0.8745 0.6756 0.7090 -0.0143 -0.0577 -0.0332 186 SER H OG 3067 N N . SER B 193 ? 0.8930 0.6596 0.7048 -0.0419 -0.0852 -0.0426 187 SER H N 3068 C CA . SER B 193 ? 0.9555 0.7047 0.7566 -0.0517 -0.0939 -0.0437 187 SER H CA 3069 C C . SER B 193 ? 0.9622 0.7300 0.7762 -0.0640 -0.1026 -0.0431 187 SER H C 3070 O O . SER B 193 ? 0.9948 0.7577 0.8078 -0.0746 -0.1097 -0.0416 187 SER H O 3071 C CB . SER B 193 ? 0.9980 0.7165 0.7726 -0.0480 -0.0967 -0.0488 187 SER H CB 3072 O OG . SER B 193 ? 1.0142 0.7383 0.7865 -0.0452 -0.0983 -0.0523 187 SER H OG 3073 N N . SER B 194 ? 0.8901 0.6796 0.7160 -0.0624 -0.1021 -0.0436 188 SER H N 3074 C CA . SER B 194 ? 0.8094 0.6186 0.6478 -0.0723 -0.1097 -0.0426 188 SER H CA 3075 C C . SER B 194 ? 0.7394 0.5741 0.6001 -0.0776 -0.1082 -0.0375 188 SER H C 3076 O O . SER B 194 ? 0.7347 0.5856 0.6061 -0.0868 -0.1145 -0.0355 188 SER H O 3077 C CB . SER B 194 ? 0.8248 0.6462 0.6662 -0.0676 -0.1097 -0.0452 188 SER H CB 3078 O OG . SER B 194 ? 0.7422 0.5799 0.5953 -0.0588 -0.1009 -0.0440 188 SER H OG 3079 N N . LEU B 195 ? 0.6839 0.5226 0.5512 -0.0719 -0.0998 -0.0351 189 LEU H N 3080 C CA . LEU B 195 ? 0.7029 0.5657 0.5906 -0.0758 -0.0971 -0.0304 189 LEU H CA 3081 C C . LEU B 195 ? 0.7914 0.6574 0.6845 -0.0883 -0.1040 -0.0272 189 LEU H C 3082 O O . LEU B 195 ? 0.7631 0.6533 0.6732 -0.0941 -0.1055 -0.0240 189 LEU H O 3083 C CB . LEU B 195 ? 0.6016 0.4635 0.4923 -0.0683 -0.0876 -0.0279 189 LEU H CB 3084 C CG . LEU B 195 ? 0.5832 0.4517 0.4752 -0.0574 -0.0802 -0.0289 189 LEU H CG 3085 C CD1 . LEU B 195 ? 0.4909 0.3629 0.3888 -0.0524 -0.0717 -0.0248 189 LEU H CD1 3086 C CD2 . LEU B 195 ? 0.5413 0.4331 0.4460 -0.0584 -0.0816 -0.0294 189 LEU H CD2 3087 N N . GLY B 196 ? 0.8868 0.7284 0.7649 -0.0923 -0.1081 -0.0277 190 GLY H N 3088 C CA . GLY B 196 ? 0.9628 0.8049 0.8442 -0.1047 -0.1151 -0.0242 190 GLY H CA 3089 C C . GLY B 196 ? 1.0450 0.8884 0.9232 -0.1151 -0.1261 -0.0246 190 GLY H C 3090 O O . GLY B 196 ? 1.1243 0.9722 1.0070 -0.1268 -0.1330 -0.0209 190 GLY H O 3091 N N . THR B 197 ? 1.0269 0.8673 0.8978 -0.1113 -0.1282 -0.0286 191 THR H N 3092 C CA . THR B 197 ? 1.0453 0.8844 0.9109 -0.1211 -0.1391 -0.0288 191 THR H CA 3093 C C . THR B 197 ? 1.0516 0.9142 0.9285 -0.1194 -0.1402 -0.0292 191 THR H C 3094 O O . THR B 197 ? 1.1375 1.0016 1.0112 -0.1270 -0.1491 -0.0289 191 THR H O 3095 C CB . THR B 197 ? 1.0909 0.8946 0.9292 -0.1207 -0.1438 -0.0334 191 THR H CB 3096 O OG1 . THR B 197 ? 1.0822 0.8773 0.9118 -0.1077 -0.1370 -0.0383 191 THR H OG1 3097 C CG2 . THR B 197 ? 1.1341 0.9117 0.9587 -0.1229 -0.1440 -0.0328 191 THR H CG2 3098 N N . GLN B 198 ? 0.9098 0.7901 0.7992 -0.1096 -0.1314 -0.0297 192 GLN H N 3099 C CA . GLN B 198 ? 0.7370 0.6377 0.6359 -0.1064 -0.1316 -0.0304 192 GLN H CA 3100 C C . GLN B 198 ? 0.6859 0.6170 0.6070 -0.1039 -0.1258 -0.0269 192 GLN H C 3101 O O . GLN B 198 ? 0.7327 0.6656 0.6586 -0.0984 -0.1178 -0.0263 192 GLN H O 3102 C CB . GLN B 198 ? 0.7466 0.6337 0.6332 -0.0951 -0.1273 -0.0358 192 GLN H CB 3103 C CG . GLN B 198 ? 0.7515 0.6584 0.6474 -0.0901 -0.1263 -0.0367 192 GLN H CG 3104 C CD . GLN B 198 ? 0.7868 0.6976 0.6806 -0.0974 -0.1362 -0.0365 192 GLN H CD 3105 O OE1 . GLN B 198 ? 0.8350 0.7239 0.7114 -0.1009 -0.1423 -0.0390 192 GLN H OE1 3106 N NE2 . GLN B 198 ? 0.7286 0.6672 0.6397 -0.0994 -0.1378 -0.0332 192 GLN H NE2 3107 N N . THR B 199 ? 0.6135 0.5681 0.5474 -0.1078 -0.1299 -0.0244 193 THR H N 3108 C CA . THR B 199 ? 0.5906 0.5737 0.5442 -0.1051 -0.1246 -0.0211 193 THR H CA 3109 C C . THR B 199 ? 0.5394 0.5298 0.4951 -0.0935 -0.1184 -0.0242 193 THR H C 3110 O O . THR B 199 ? 0.6013 0.5879 0.5504 -0.0908 -0.1217 -0.0270 193 THR H O 3111 C CB . THR B 199 ? 0.6214 0.6285 0.5887 -0.1144 -0.1313 -0.0159 193 THR H CB 3112 O OG1 . THR B 199 ? 0.7285 0.7306 0.6951 -0.1259 -0.1369 -0.0121 193 THR H OG1 3113 C CG2 . THR B 199 ? 0.6242 0.6600 0.6103 -0.1100 -0.1251 -0.0129 193 THR H CG2 3114 N N . TYR B 200 ? 0.4976 0.4975 0.4615 -0.0871 -0.1100 -0.0236 194 TYR H N 3115 C CA . TYR B 200 ? 0.5217 0.5289 0.4876 -0.0767 -0.1044 -0.0259 194 TYR H CA 3116 C C . TYR B 200 ? 0.5076 0.5413 0.4901 -0.0753 -0.1009 -0.0227 194 TYR H C 3117 O O . TYR B 200 ? 0.5048 0.5456 0.4948 -0.0762 -0.0962 -0.0200 194 TYR H O 3118 C CB . TYR B 200 ? 0.4423 0.4333 0.3991 -0.0689 -0.0971 -0.0284 194 TYR H CB 3119 C CG . TYR B 200 ? 0.3737 0.3387 0.3130 -0.0679 -0.0994 -0.0319 194 TYR H CG 3120 C CD1 . TYR B 200 ? 0.3928 0.3499 0.3224 -0.0634 -0.1017 -0.0357 194 TYR H CD1 3121 C CD2 . TYR B 200 ? 0.4012 0.3488 0.3327 -0.0712 -0.0993 -0.0313 194 TYR H CD2 3122 C CE1 . TYR B 200 ? 0.4674 0.4001 0.3795 -0.0621 -0.1036 -0.0390 194 TYR H CE1 3123 C CE2 . TYR B 200 ? 0.4643 0.3868 0.3780 -0.0694 -0.1010 -0.0346 194 TYR H CE2 3124 C CZ . TYR B 200 ? 0.4955 0.4106 0.3993 -0.0648 -0.1030 -0.0385 194 TYR H CZ 3125 O OH . TYR B 200 ? 0.5908 0.4803 0.4757 -0.0625 -0.1044 -0.0419 194 TYR H OH 3126 N N . ILE B 201 ? 0.4185 0.4666 0.4062 -0.0729 -0.1032 -0.0228 195 ILE H N 3127 C CA . ILE B 201 ? 0.3862 0.4587 0.3880 -0.0699 -0.0998 -0.0200 195 ILE H CA 3128 C C . ILE B 201 ? 0.4241 0.4985 0.4233 -0.0592 -0.0959 -0.0231 195 ILE H C 3129 O O . ILE B 201 ? 0.4651 0.5338 0.4578 -0.0568 -0.0998 -0.0256 195 ILE H O 3130 C CB . ILE B 201 ? 0.4185 0.5112 0.4313 -0.0767 -0.1063 -0.0156 195 ILE H CB 3131 C CG1 . ILE B 201 ? 0.4234 0.5140 0.4380 -0.0885 -0.1112 -0.0120 195 ILE H CG1 3132 C CG2 . ILE B 201 ? 0.3974 0.5157 0.4241 -0.0721 -0.1018 -0.0125 195 ILE H CG2 3133 C CD1 . ILE B 201 ? 0.4128 0.5224 0.4371 -0.0968 -0.1189 -0.0068 195 ILE H CD1 3134 N N . CYS B 202 ? 0.3921 0.4733 0.3954 -0.0533 -0.0887 -0.0227 196 CYS H N 3135 C CA . CYS B 202 ? 0.3944 0.4784 0.3953 -0.0437 -0.0855 -0.0251 196 CYS H CA 3136 C C . CYS B 202 ? 0.3416 0.4491 0.3543 -0.0419 -0.0859 -0.0223 196 CYS H C 3137 O O . CYS B 202 ? 0.2989 0.4214 0.3220 -0.0452 -0.0842 -0.0185 196 CYS H O 3138 C CB . CYS B 202 ? 0.4421 0.5186 0.4385 -0.0380 -0.0780 -0.0261 196 CYS H CB 3139 S SG . CYS B 202 ? 0.7390 0.8312 0.7460 -0.0384 -0.0717 -0.0223 196 CYS H SG 3140 N N . ASN B 203 ? 0.3435 0.4545 0.3544 -0.0364 -0.0882 -0.0239 197 ASN H N 3141 C CA . ASN B 203 ? 0.3288 0.4619 0.3502 -0.0328 -0.0882 -0.0211 197 ASN H CA 3142 C C . ASN B 203 ? 0.3234 0.4564 0.3411 -0.0220 -0.0821 -0.0232 197 ASN H C 3143 O O . ASN B 203 ? 0.3817 0.5017 0.3894 -0.0166 -0.0823 -0.0269 197 ASN H O 3144 C CB . ASN B 203 ? 0.2760 0.4151 0.2990 -0.0347 -0.0957 -0.0203 197 ASN H CB 3145 C CG . ASN B 203 ? 0.4065 0.5347 0.4254 -0.0450 -0.1027 -0.0201 197 ASN H CG 3146 O OD1 . ASN B 203 ? 0.4633 0.5730 0.4703 -0.0448 -0.1056 -0.0240 197 ASN H OD1 3147 N ND2 . ASN B 203 ? 0.3504 0.4891 0.3780 -0.0540 -0.1055 -0.0156 197 ASN H ND2 3148 N N . VAL B 204 ? 0.3356 0.4823 0.3604 -0.0190 -0.0769 -0.0207 198 VAL H N 3149 C CA . VAL B 204 ? 0.3410 0.4853 0.3603 -0.0094 -0.0709 -0.0226 198 VAL H CA 3150 C C . VAL B 204 ? 0.3633 0.5273 0.3901 -0.0026 -0.0693 -0.0203 198 VAL H C 3151 O O . VAL B 204 ? 0.4306 0.6129 0.4687 -0.0051 -0.0682 -0.0161 198 VAL H O 3152 C CB . VAL B 204 ? 0.3447 0.4831 0.3617 -0.0105 -0.0647 -0.0223 198 VAL H CB 3153 C CG1 . VAL B 204 ? 0.3260 0.4597 0.3351 -0.0013 -0.0594 -0.0242 198 VAL H CG1 3154 C CG2 . VAL B 204 ? 0.3508 0.4707 0.3608 -0.0163 -0.0656 -0.0239 198 VAL H CG2 3155 N N . ASN B 205 ? 0.3451 0.5052 0.3653 0.0064 -0.0689 -0.0228 199 ASN H N 3156 C CA . ASN B 205 ? 0.4703 0.6473 0.4960 0.0147 -0.0669 -0.0207 199 ASN H CA 3157 C C . ASN B 205 ? 0.4478 0.6151 0.4625 0.0250 -0.0612 -0.0235 199 ASN H C 3158 O O . ASN B 205 ? 0.3897 0.5390 0.3924 0.0280 -0.0619 -0.0273 199 ASN H O 3159 C CB . ASN B 205 ? 0.5971 0.7818 0.6265 0.0163 -0.0731 -0.0199 199 ASN H CB 3160 C CG . ASN B 205 ? 0.8137 1.0184 0.8503 0.0253 -0.0711 -0.0166 199 ASN H CG 3161 O OD1 . ASN B 205 ? 0.8866 1.1053 0.9298 0.0277 -0.0662 -0.0136 199 ASN H OD1 3162 N ND2 . ASN B 205 ? 0.8703 1.0764 0.9054 0.0307 -0.0748 -0.0171 199 ASN H ND2 3163 N N . HIS B 206 ? 0.4478 0.6269 0.4661 0.0301 -0.0558 -0.0213 200 HIS H N 3164 C CA . HIS B 206 ? 0.4037 0.5737 0.4104 0.0402 -0.0506 -0.0236 200 HIS H CA 3165 C C . HIS B 206 ? 0.4614 0.6491 0.4735 0.0501 -0.0485 -0.0212 200 HIS H C 3166 O O . HIS B 206 ? 0.4946 0.6971 0.5132 0.0521 -0.0439 -0.0180 200 HIS H O 3167 C CB . HIS B 206 ? 0.3094 0.4725 0.3112 0.0379 -0.0448 -0.0237 200 HIS H CB 3168 C CG . HIS B 206 ? 0.3761 0.5264 0.3634 0.0468 -0.0401 -0.0261 200 HIS H CG 3169 N ND1 . HIS B 206 ? 0.4041 0.5601 0.3897 0.0515 -0.0340 -0.0247 200 HIS H ND1 3170 C CD2 . HIS B 206 ? 0.4178 0.5487 0.3901 0.0516 -0.0409 -0.0297 200 HIS H CD2 3171 C CE1 . HIS B 206 ? 0.4165 0.5559 0.3859 0.0586 -0.0314 -0.0276 200 HIS H CE1 3172 N NE2 . HIS B 206 ? 0.4293 0.5536 0.3907 0.0586 -0.0357 -0.0304 200 HIS H NE2 3173 N N . LYS B 207 ? 0.5132 0.6999 0.5226 0.0566 -0.0518 -0.0223 201 LYS H N 3174 C CA . LYS B 207 ? 0.6302 0.8348 0.6456 0.0666 -0.0504 -0.0193 201 LYS H CA 3175 C C . LYS B 207 ? 0.6944 0.8992 0.7028 0.0775 -0.0426 -0.0194 201 LYS H C 3176 O O . LYS B 207 ? 0.7151 0.9413 0.7333 0.0828 -0.0394 -0.0151 201 LYS H O 3177 C CB . LYS B 207 ? 0.7304 0.9299 0.7417 0.0719 -0.0553 -0.0210 201 LYS H CB 3178 C CG . LYS B 207 ? 0.8800 1.0848 0.9000 0.0626 -0.0632 -0.0197 201 LYS H CG 3179 C CD . LYS B 207 ? 0.9967 1.2081 1.0184 0.0689 -0.0676 -0.0187 201 LYS H CD 3180 C CE . LYS B 207 ? 1.0598 1.2972 1.0933 0.0772 -0.0649 -0.0130 201 LYS H CE 3181 N NZ . LYS B 207 ? 1.1103 1.3563 1.1471 0.0831 -0.0694 -0.0110 201 LYS H NZ 3182 N N . PRO B 208 ? 0.6131 0.7944 0.6040 0.0808 -0.0397 -0.0239 202 PRO H N 3183 C CA . PRO B 208 ? 0.5738 0.7529 0.5556 0.0909 -0.0325 -0.0241 202 PRO H CA 3184 C C . PRO B 208 ? 0.6269 0.8234 0.6182 0.0892 -0.0271 -0.0203 202 PRO H C 3185 O O . PRO B 208 ? 0.6496 0.8513 0.6369 0.0993 -0.0212 -0.0193 202 PRO H O 3186 C CB . PRO B 208 ? 0.5151 0.6654 0.4777 0.0894 -0.0317 -0.0288 202 PRO H CB 3187 C CG . PRO B 208 ? 0.5132 0.6518 0.4728 0.0856 -0.0383 -0.0312 202 PRO H CG 3188 C CD . PRO B 208 ? 0.5439 0.7001 0.5214 0.0770 -0.0429 -0.0284 202 PRO H CD 3189 N N . SER B 209 ? 0.6146 0.8194 0.6175 0.0769 -0.0291 -0.0181 203 SER H N 3190 C CA . SER B 209 ? 0.5180 0.7411 0.5313 0.0741 -0.0247 -0.0139 203 SER H CA 3191 C C . SER B 209 ? 0.5936 0.8424 0.6276 0.0669 -0.0289 -0.0085 203 SER H C 3192 O O . SER B 209 ? 0.6070 0.8715 0.6515 0.0614 -0.0268 -0.0045 203 SER H O 3193 C CB . SER B 209 ? 0.5149 0.7242 0.5223 0.0651 -0.0226 -0.0155 203 SER H CB 3194 O OG . SER B 209 ? 0.5435 0.7468 0.5556 0.0531 -0.0283 -0.0161 203 SER H OG 3195 N N . ASN B 210 ? 0.6676 0.9201 0.7066 0.0665 -0.0352 -0.0081 204 ASN H N 3196 C CA . ASN B 210 ? 0.7331 1.0067 0.7896 0.0581 -0.0409 -0.0030 204 ASN H CA 3197 C C . ASN B 210 ? 0.7236 0.9972 0.7864 0.0437 -0.0429 -0.0017 204 ASN H C 3198 O O . ASN B 210 ? 0.6769 0.9719 0.7533 0.0386 -0.0427 0.0039 204 ASN H O 3199 C CB . ASN B 210 ? 0.8155 1.1191 0.8854 0.0650 -0.0382 0.0037 204 ASN H CB 3200 C CG . ASN B 210 ? 0.9290 1.2384 0.9986 0.0760 -0.0398 0.0045 204 ASN H CG 3201 O OD1 . ASN B 210 ? 0.9824 1.2998 1.0498 0.0892 -0.0340 0.0058 204 ASN H OD1 3202 N ND2 . ASN B 210 ? 0.9504 1.2552 1.0214 0.0710 -0.0475 0.0036 204 ASN H ND2 3203 N N . THR B 211 ? 0.7457 0.9955 0.7983 0.0375 -0.0449 -0.0066 205 THR H N 3204 C CA . THR B 211 ? 0.7138 0.9598 0.7702 0.0248 -0.0465 -0.0059 205 THR H CA 3205 C C . THR B 211 ? 0.6658 0.9049 0.7240 0.0157 -0.0547 -0.0066 205 THR H C 3206 O O . THR B 211 ? 0.6439 0.8655 0.6921 0.0178 -0.0573 -0.0110 205 THR H O 3207 C CB . THR B 211 ? 0.7782 1.0029 0.8217 0.0242 -0.0419 -0.0099 205 THR H CB 3208 O OG1 . THR B 211 ? 0.8680 1.0989 0.9093 0.0312 -0.0346 -0.0088 205 THR H OG1 3209 C CG2 . THR B 211 ? 0.7350 0.9546 0.7822 0.0115 -0.0439 -0.0090 205 THR H CG2 3210 N N . LYS B 212 ? 0.6642 0.9168 0.7344 0.0056 -0.0587 -0.0022 206 LYS H N 3211 C CA . LYS B 212 ? 0.6800 0.9243 0.7505 -0.0042 -0.0666 -0.0028 206 LYS H CA 3212 C C . LYS B 212 ? 0.6697 0.9088 0.7423 -0.0157 -0.0673 -0.0017 206 LYS H C 3213 O O . LYS B 212 ? 0.7367 0.9933 0.8203 -0.0209 -0.0668 0.0034 206 LYS H O 3214 C CB . LYS B 212 ? 0.7042 0.9684 0.7859 -0.0067 -0.0730 0.0021 206 LYS H CB 3215 C CG . LYS B 212 ? 0.8164 1.0769 0.8932 0.0007 -0.0760 -0.0001 206 LYS H CG 3216 C CD . LYS B 212 ? 0.9492 1.2281 1.0370 -0.0047 -0.0837 0.0055 206 LYS H CD 3217 C CE . LYS B 212 ? 1.0108 1.2814 1.0922 -0.0004 -0.0884 0.0028 206 LYS H CE 3218 N NZ . LYS B 212 ? 1.0454 1.3316 1.1363 -0.0077 -0.0970 0.0083 206 LYS H NZ 3219 N N . VAL B 213 ? 0.5951 0.8106 0.6572 -0.0194 -0.0685 -0.0062 207 VAL H N 3220 C CA . VAL B 213 ? 0.5176 0.7255 0.5802 -0.0293 -0.0689 -0.0054 207 VAL H CA 3221 C C . VAL B 213 ? 0.5224 0.7147 0.5798 -0.0370 -0.0758 -0.0072 207 VAL H C 3222 O O . VAL B 213 ? 0.5868 0.7622 0.6336 -0.0334 -0.0772 -0.0116 207 VAL H O 3223 C CB . VAL B 213 ? 0.4455 0.6388 0.4996 -0.0264 -0.0621 -0.0082 207 VAL H CB 3224 C CG1 . VAL B 213 ? 0.4033 0.5872 0.4574 -0.0362 -0.0629 -0.0073 207 VAL H CG1 3225 C CG2 . VAL B 213 ? 0.3958 0.6028 0.4534 -0.0200 -0.0554 -0.0063 207 VAL H CG2 3226 N N . ASP B 214 ? 0.4389 0.6363 0.5029 -0.0476 -0.0802 -0.0036 208 ASP H N 3227 C CA . ASP B 214 ? 0.4776 0.6569 0.5346 -0.0555 -0.0861 -0.0053 208 ASP H CA 3228 C C . ASP B 214 ? 0.5144 0.6844 0.5702 -0.0616 -0.0835 -0.0047 208 ASP H C 3229 O O . ASP B 214 ? 0.6359 0.8200 0.7015 -0.0676 -0.0832 -0.0001 208 ASP H O 3230 C CB . ASP B 214 ? 0.5147 0.7046 0.5779 -0.0638 -0.0948 -0.0014 208 ASP H CB 3231 C CG . ASP B 214 ? 0.6001 0.8003 0.6652 -0.0580 -0.0976 -0.0012 208 ASP H CG 3232 O OD1 . ASP B 214 ? 0.5986 0.7848 0.6536 -0.0508 -0.0967 -0.0063 208 ASP H OD1 3233 O OD2 . ASP B 214 ? 0.6441 0.8674 0.7210 -0.0606 -0.1008 0.0044 208 ASP H OD2 3234 N N . LYS B 215 ? 0.3884 0.5358 0.4326 -0.0599 -0.0814 -0.0089 209 LYS H N 3235 C CA . LYS B 215 ? 0.3619 0.4996 0.4046 -0.0649 -0.0787 -0.0081 209 LYS H CA 3236 C C . LYS B 215 ? 0.4619 0.5775 0.4944 -0.0697 -0.0831 -0.0103 209 LYS H C 3237 O O . LYS B 215 ? 0.5222 0.6210 0.5436 -0.0645 -0.0825 -0.0145 209 LYS H O 3238 C CB . LYS B 215 ? 0.4792 0.6112 0.5177 -0.0579 -0.0707 -0.0098 209 LYS H CB 3239 C CG . LYS B 215 ? 0.6609 0.7870 0.7001 -0.0630 -0.0674 -0.0078 209 LYS H CG 3240 C CD . LYS B 215 ? 0.7315 0.8733 0.7787 -0.0622 -0.0618 -0.0048 209 LYS H CD 3241 C CE . LYS B 215 ? 0.8019 0.9522 0.8581 -0.0719 -0.0630 -0.0002 209 LYS H CE 3242 N NZ . LYS B 215 ? 0.8135 0.9454 0.8641 -0.0775 -0.0645 -0.0003 209 LYS H NZ 3243 N N . LYS B 216 ? 0.5033 0.6188 0.5390 -0.0796 -0.0876 -0.0073 210 LYS H N 3244 C CA . LYS B 216 ? 0.4732 0.5662 0.4981 -0.0844 -0.0916 -0.0091 210 LYS H CA 3245 C C . LYS B 216 ? 0.4759 0.5536 0.4946 -0.0813 -0.0853 -0.0104 210 LYS H C 3246 O O . LYS B 216 ? 0.5502 0.6364 0.5758 -0.0817 -0.0802 -0.0078 210 LYS H O 3247 C CB . LYS B 216 ? 0.4587 0.5555 0.4881 -0.0963 -0.0986 -0.0050 210 LYS H CB 3248 C CG . LYS B 216 ? 0.6191 0.6906 0.6352 -0.1015 -0.1036 -0.0069 210 LYS H CG 3249 C CD . LYS B 216 ? 0.7283 0.8031 0.7480 -0.1142 -0.1112 -0.0023 210 LYS H CD 3250 C CE . LYS B 216 ? 0.8712 0.9174 0.8752 -0.1190 -0.1157 -0.0045 210 LYS H CE 3251 N NZ . LYS B 216 ? 0.9404 0.9872 0.9456 -0.1323 -0.1245 0.0000 210 LYS H NZ 3252 N N . VAL B 217 ? 0.4551 0.5106 0.4605 -0.0780 -0.0854 -0.0141 211 VAL H N 3253 C CA . VAL B 217 ? 0.3998 0.4414 0.3991 -0.0743 -0.0793 -0.0147 211 VAL H CA 3254 C C . VAL B 217 ? 0.4183 0.4412 0.4097 -0.0797 -0.0822 -0.0144 211 VAL H C 3255 O O . VAL B 217 ? 0.4914 0.4976 0.4712 -0.0793 -0.0861 -0.0173 211 VAL H O 3256 C CB . VAL B 217 ? 0.3809 0.4123 0.3707 -0.0645 -0.0757 -0.0185 211 VAL H CB 3257 C CG1 . VAL B 217 ? 0.3158 0.3356 0.3005 -0.0611 -0.0694 -0.0177 211 VAL H CG1 3258 C CG2 . VAL B 217 ? 0.3694 0.4170 0.3650 -0.0590 -0.0735 -0.0191 211 VAL H CG2 3259 N N . GLU B 218 ? 0.4889 0.5136 0.4858 -0.0846 -0.0801 -0.0107 212 GLU H N 3260 C CA . GLU B 218 ? 0.5201 0.5273 0.5099 -0.0901 -0.0830 -0.0098 212 GLU H CA 3261 C C . GLU B 218 ? 0.5816 0.5754 0.5659 -0.0853 -0.0764 -0.0092 212 GLU H C 3262 O O . GLU B 218 ? 0.5769 0.5802 0.5674 -0.0814 -0.0700 -0.0075 212 GLU H O 3263 C CB . GLU B 218 ? 0.6454 0.6644 0.6453 -0.1008 -0.0871 -0.0054 212 GLU H CB 3264 C CG . GLU B 218 ? 0.7939 0.8257 0.7987 -0.1069 -0.0947 -0.0047 212 GLU H CG 3265 C CD . GLU B 218 ? 0.9236 0.9714 0.9403 -0.1173 -0.0982 0.0008 212 GLU H CD 3266 O OE1 . GLU B 218 ? 0.9388 0.9815 0.9566 -0.1214 -0.0965 0.0035 212 GLU H OE1 3267 O OE2 . GLU B 218 ? 0.9734 1.0398 0.9987 -0.1214 -0.1025 0.0030 212 GLU H OE2 3268 N N . PRO B 219 ? 0.6438 0.6150 0.6157 -0.0854 -0.0779 -0.0104 213 PRO H N 3269 C CA . PRO B 219 ? 0.6720 0.6301 0.6383 -0.0801 -0.0717 -0.0091 213 PRO H CA 3270 C C . PRO B 219 ? 0.8294 0.7961 0.8060 -0.0845 -0.0683 -0.0039 213 PRO H C 3271 O O . PRO B 219 ? 0.7823 0.7640 0.7697 -0.0923 -0.0711 -0.0014 213 PRO H O 3272 C CB . PRO B 219 ? 0.5879 0.5202 0.5384 -0.0804 -0.0755 -0.0113 213 PRO H CB 3273 C CG . PRO B 219 ? 0.6496 0.5801 0.5947 -0.0827 -0.0826 -0.0151 213 PRO H CG 3274 C CD . PRO B 219 ? 0.6449 0.6005 0.6056 -0.0893 -0.0856 -0.0130 213 PRO H CD 3275 N N . LYS B 220 ? 0.9911 0.9493 0.9644 -0.0794 -0.0622 -0.0018 214 LYS H N 3276 C CA . LYS B 220 ? 1.0388 1.0031 1.0206 -0.0831 -0.0587 0.0035 214 LYS H CA 3277 C C . LYS B 220 ? 1.0580 1.0048 1.0315 -0.0779 -0.0542 0.0056 214 LYS H C 3278 O O . LYS B 220 ? 1.1083 1.0352 1.0703 -0.0775 -0.0569 0.0041 214 LYS H O 3279 C CB . LYS B 220 ? 1.0150 1.0004 1.0086 -0.0821 -0.0539 0.0058 214 LYS H CB 3280 C CG . LYS B 220 ? 1.0399 1.0437 1.0466 -0.0909 -0.0560 0.0085 214 LYS H CG 3281 C CD . LYS B 220 ? 1.0550 1.0764 1.0707 -0.0893 -0.0505 0.0109 214 LYS H CD 3282 C CE . LYS B 220 ? 1.0852 1.1242 1.1133 -0.0976 -0.0518 0.0141 214 LYS H CE 3283 N NZ . LYS B 220 ? 1.0954 1.1500 1.1302 -0.0959 -0.0465 0.0161 214 LYS H NZ 3284 N N . ASP C 1 ? 0.9171 0.9613 1.0348 0.0165 0.0766 0.1293 1 ASP A N 3285 C CA . ASP C 1 ? 0.9115 0.9484 1.0159 0.0159 0.0692 0.1116 1 ASP A CA 3286 C C . ASP C 1 ? 0.8105 0.8561 0.9211 0.0092 0.0648 0.1065 1 ASP A C 3287 O O . ASP C 1 ? 0.8501 0.9091 0.9663 0.0112 0.0690 0.1143 1 ASP A O 3288 C CB . ASP C 1 ? 1.0224 1.0570 1.1051 0.0298 0.0723 0.1057 1 ASP A CB 3289 C CG . ASP C 1 ? 1.1582 1.1826 1.2321 0.0380 0.0757 0.1087 1 ASP A CG 3290 O OD1 . ASP C 1 ? 1.2074 1.2223 1.2886 0.0315 0.0732 0.1104 1 ASP A OD1 3291 O OD2 . ASP C 1 ? 1.1981 1.2227 1.2569 0.0515 0.0800 0.1090 1 ASP A OD2 3292 N N . ILE C 2 ? 0.5789 0.6167 0.6872 0.0022 0.0565 0.0935 2 ILE A N 3293 C CA . ILE C 2 ? 0.4629 0.5064 0.5748 -0.0038 0.0517 0.0877 2 ILE A CA 3294 C C . ILE C 2 ? 0.4122 0.4608 0.5086 0.0039 0.0539 0.0824 2 ILE A C 3295 O O . ILE C 2 ? 0.3812 0.4234 0.4624 0.0097 0.0537 0.0740 2 ILE A O 3296 C CB . ILE C 2 ? 0.4538 0.4867 0.5659 -0.0122 0.0424 0.0757 2 ILE A CB 3297 C CG1 . ILE C 2 ? 0.5138 0.5425 0.6444 -0.0212 0.0377 0.0812 2 ILE A CG1 3298 C CG2 . ILE C 2 ? 0.4318 0.4686 0.5406 -0.0153 0.0383 0.0677 2 ILE A CG2 3299 C CD1 . ILE C 2 ? 0.5595 0.5764 0.6890 -0.0275 0.0276 0.0693 2 ILE A CD1 3300 N N . GLN C 3 ? 0.4404 0.5005 0.5416 0.0041 0.0553 0.0872 3 GLN A N 3301 C CA . GLN C 3 ? 0.4750 0.5395 0.5621 0.0114 0.0565 0.0830 3 GLN A CA 3302 C C . GLN C 3 ? 0.3712 0.4341 0.4561 0.0046 0.0500 0.0734 3 GLN A C 3303 O O . GLN C 3 ? 0.3117 0.3777 0.4094 -0.0033 0.0464 0.0748 3 GLN A O 3304 C CB . GLN C 3 ? 0.6159 0.6943 0.7067 0.0187 0.0628 0.0951 3 GLN A CB 3305 C CG . GLN C 3 ? 0.8544 0.9361 0.9289 0.0285 0.0634 0.0917 3 GLN A CG 3306 C CD . GLN C 3 ? 1.0300 1.1101 1.0912 0.0422 0.0684 0.0946 3 GLN A CD 3307 O OE1 . GLN C 3 ? 1.1220 1.1949 1.1818 0.0439 0.0703 0.0951 3 GLN A OE1 3308 N NE2 . GLN C 3 ? 1.0192 1.1051 1.0692 0.0531 0.0699 0.0961 3 GLN A NE2 3309 N N . MET C 4 ? 0.2756 0.3332 0.3444 0.0080 0.0482 0.0638 4 MET A N 3310 C CA . MET C 4 ? 0.2134 0.2696 0.2772 0.0033 0.0434 0.0559 4 MET A CA 3311 C C . MET C 4 ? 0.3234 0.3859 0.3786 0.0103 0.0449 0.0581 4 MET A C 3312 O O . MET C 4 ? 0.2928 0.3544 0.3368 0.0192 0.0473 0.0580 4 MET A O 3313 C CB . MET C 4 ? 0.3031 0.3489 0.3558 0.0011 0.0403 0.0440 4 MET A CB 3314 C CG . MET C 4 ? 0.4581 0.4969 0.5154 -0.0032 0.0385 0.0403 4 MET A CG 3315 S SD . MET C 4 ? 0.9807 1.0195 1.0552 -0.0124 0.0340 0.0436 4 MET A SD 3316 C CE . MET C 4 ? 1.8675 1.9049 1.9367 -0.0175 0.0286 0.0354 4 MET A CE 3317 N N . THR C 5 ? 0.2547 0.3228 0.3144 0.0070 0.0425 0.0595 5 THR A N 3318 C CA . THR C 5 ? 0.2586 0.3318 0.3089 0.0138 0.0427 0.0607 5 THR A CA 3319 C C . THR C 5 ? 0.3046 0.3727 0.3477 0.0087 0.0372 0.0527 5 THR A C 3320 O O . THR C 5 ? 0.3028 0.3714 0.3548 0.0014 0.0337 0.0513 5 THR A O 3321 C CB . THR C 5 ? 0.3175 0.4053 0.3791 0.0178 0.0462 0.0721 5 THR A CB 3322 O OG1 . THR C 5 ? 0.3961 0.4882 0.4621 0.0238 0.0525 0.0806 5 THR A OG1 3323 C CG2 . THR C 5 ? 0.2946 0.3874 0.3446 0.0261 0.0456 0.0725 5 THR A CG2 3324 N N . GLN C 6 ? 0.3019 0.3639 0.3285 0.0130 0.0359 0.0473 6 GLN A N 3325 C CA . GLN C 6 ? 0.2857 0.3411 0.3028 0.0089 0.0313 0.0403 6 GLN A CA 3326 C C . GLN C 6 ? 0.2879 0.3485 0.2993 0.0143 0.0296 0.0432 6 GLN A C 3327 O O . GLN C 6 ? 0.2598 0.3273 0.2694 0.0234 0.0320 0.0490 6 GLN A O 3328 C CB . GLN C 6 ? 0.2854 0.3299 0.2890 0.0088 0.0305 0.0327 6 GLN A CB 3329 C CG . GLN C 6 ? 0.3169 0.3572 0.3254 0.0043 0.0319 0.0289 6 GLN A CG 3330 C CD . GLN C 6 ? 0.3690 0.4011 0.3670 0.0041 0.0314 0.0218 6 GLN A CD 3331 O OE1 . GLN C 6 ? 0.3898 0.4205 0.3894 0.0058 0.0331 0.0200 6 GLN A OE1 3332 N NE2 . GLN C 6 ? 0.3340 0.3606 0.3219 0.0019 0.0290 0.0179 6 GLN A NE2 3333 N N . SER C 7 ? 0.2841 0.3414 0.2920 0.0099 0.0254 0.0391 7 SER A N 3334 C CA . SER C 7 ? 0.3863 0.4461 0.3856 0.0154 0.0227 0.0401 7 SER A CA 3335 C C . SER C 7 ? 0.3765 0.4247 0.3628 0.0109 0.0180 0.0326 7 SER A C 3336 O O . SER C 7 ? 0.3165 0.3599 0.3063 0.0034 0.0166 0.0284 7 SER A O 3337 C CB . SER C 7 ? 0.5029 0.5771 0.5170 0.0167 0.0229 0.0469 7 SER A CB 3338 O OG . SER C 7 ? 0.6137 0.6878 0.6402 0.0079 0.0202 0.0448 7 SER A OG 3339 N N . PRO C 8 ? 0.3579 0.4005 0.3279 0.0164 0.0154 0.0309 8 PRO A N 3340 C CA . PRO C 8 ? 0.3636 0.4094 0.3264 0.0268 0.0160 0.0346 8 PRO A CA 3341 C C . PRO C 8 ? 0.3364 0.3770 0.2962 0.0284 0.0184 0.0335 8 PRO A C 3342 O O . PRO C 8 ? 0.3573 0.3925 0.3209 0.0210 0.0198 0.0298 8 PRO A O 3343 C CB . PRO C 8 ? 0.3269 0.3635 0.2713 0.0302 0.0105 0.0310 8 PRO A CB 3344 C CG . PRO C 8 ? 0.3926 0.4246 0.3368 0.0224 0.0080 0.0270 8 PRO A CG 3345 C CD . PRO C 8 ? 0.3431 0.3744 0.2991 0.0134 0.0111 0.0252 8 PRO A CD 3346 N N . SER C 9 ? 0.3072 0.3496 0.2603 0.0390 0.0183 0.0363 9 SER A N 3347 C CA . SER C 9 ? 0.3405 0.3763 0.2892 0.0418 0.0189 0.0340 9 SER A CA 3348 C C . SER C 9 ? 0.3607 0.3819 0.2940 0.0412 0.0133 0.0277 9 SER A C 3349 O O . SER C 9 ? 0.2858 0.2994 0.2166 0.0404 0.0125 0.0239 9 SER A O 3350 C CB . SER C 9 ? 0.3112 0.3549 0.2593 0.0549 0.0208 0.0397 9 SER A CB 3351 O OG . SER C 9 ? 0.3650 0.4214 0.3286 0.0545 0.0270 0.0466 9 SER A OG 3352 N N . PHE C 10 ? 0.2851 0.3022 0.2086 0.0415 0.0092 0.0268 10 PHE A N 3353 C CA . PHE C 10 ? 0.3160 0.3182 0.2237 0.0415 0.0033 0.0221 10 PHE A CA 3354 C C . PHE C 10 ? 0.4004 0.3973 0.3006 0.0365 0.0007 0.0205 10 PHE A C 3355 O O . PHE C 10 ? 0.4270 0.4316 0.3276 0.0405 0.0000 0.0232 10 PHE A O 3356 C CB . PHE C 10 ? 0.3007 0.3006 0.1968 0.0552 -0.0015 0.0232 10 PHE A CB 3357 C CG . PHE C 10 ? 0.3361 0.3190 0.2163 0.0557 -0.0091 0.0186 10 PHE A CG 3358 C CD1 . PHE C 10 ? 0.3817 0.3572 0.2487 0.0565 -0.0141 0.0178 10 PHE A CD1 3359 C CD2 . PHE C 10 ? 0.4019 0.3754 0.2805 0.0556 -0.0120 0.0151 10 PHE A CD2 3360 C CE1 . PHE C 10 ? 0.4384 0.3966 0.2907 0.0565 -0.0215 0.0142 10 PHE A CE1 3361 C CE2 . PHE C 10 ? 0.4892 0.4462 0.3551 0.0552 -0.0197 0.0114 10 PHE A CE2 3362 C CZ . PHE C 10 ? 0.4450 0.3939 0.2975 0.0555 -0.0244 0.0113 10 PHE A CZ 3363 N N . VAL C 11 ? 0.3998 0.3838 0.2935 0.0282 -0.0006 0.0163 11 VAL A N 3364 C CA . VAL C 11 ? 0.3734 0.3497 0.2571 0.0239 -0.0031 0.0146 11 VAL A CA 3365 C C . VAL C 11 ? 0.4120 0.3709 0.2804 0.0222 -0.0077 0.0119 11 VAL A C 3366 O O . VAL C 11 ? 0.4256 0.3787 0.2967 0.0166 -0.0064 0.0101 11 VAL A O 3367 C CB . VAL C 11 ? 0.4803 0.4586 0.3724 0.0138 0.0013 0.0130 11 VAL A CB 3368 C CG1 . VAL C 11 ? 0.3992 0.3677 0.2783 0.0110 -0.0015 0.0110 11 VAL A CG1 3369 C CG2 . VAL C 11 ? 0.4342 0.4281 0.3429 0.0145 0.0046 0.0158 11 VAL A CG2 3370 N N . SER C 12 ? 0.4445 0.3953 0.2975 0.0271 -0.0135 0.0118 12 SER A N 3371 C CA . SER C 12 ? 0.4964 0.4286 0.3340 0.0247 -0.0185 0.0099 12 SER A CA 3372 C C . SER C 12 ? 0.4842 0.4080 0.3129 0.0179 -0.0177 0.0089 12 SER A C 3373 O O . SER C 12 ? 0.5387 0.4645 0.3609 0.0223 -0.0199 0.0090 12 SER A O 3374 C CB . SER C 12 ? 0.4437 0.3692 0.2669 0.0364 -0.0270 0.0100 12 SER A CB 3375 O OG . SER C 12 ? 0.5405 0.4462 0.3496 0.0336 -0.0330 0.0083 12 SER A OG 3376 N N . ALA C 13 ? 0.4333 0.3484 0.2617 0.0079 -0.0144 0.0082 13 ALA A N 3377 C CA . ALA C 13 ? 0.3969 0.3046 0.2168 0.0020 -0.0121 0.0077 13 ALA A CA 3378 C C . ALA C 13 ? 0.4799 0.3704 0.2891 -0.0051 -0.0122 0.0084 13 ALA A C 3379 O O . ALA C 13 ? 0.4881 0.3764 0.3042 -0.0095 -0.0113 0.0089 13 ALA A O 3380 C CB . ALA C 13 ? 0.2803 0.1998 0.1141 -0.0035 -0.0048 0.0070 13 ALA A CB 3381 N N . SER C 14 ? 0.4884 0.3667 0.2811 -0.0060 -0.0134 0.0087 14 SER A N 3382 C CA . SER C 14 ? 0.4984 0.3602 0.2807 -0.0134 -0.0122 0.0108 14 SER A CA 3383 C C . SER C 14 ? 0.4755 0.3433 0.2682 -0.0226 -0.0025 0.0116 14 SER A C 3384 O O . SER C 14 ? 0.4038 0.2841 0.2051 -0.0222 0.0019 0.0098 14 SER A O 3385 C CB . SER C 14 ? 0.4378 0.2840 0.1973 -0.0105 -0.0160 0.0112 14 SER A CB 3386 O OG . SER C 14 ? 0.5501 0.3961 0.3065 -0.0006 -0.0245 0.0094 14 SER A OG 3387 N N . VAL C 15 ? 0.4818 0.3410 0.2745 -0.0307 0.0004 0.0144 15 VAL A N 3388 C CA . VAL C 15 ? 0.4233 0.2861 0.2211 -0.0387 0.0100 0.0160 15 VAL A CA 3389 C C . VAL C 15 ? 0.4725 0.3306 0.2550 -0.0361 0.0124 0.0158 15 VAL A C 3390 O O . VAL C 15 ? 0.4112 0.2554 0.1750 -0.0321 0.0073 0.0165 15 VAL A O 3391 C CB . VAL C 15 ? 0.4481 0.3003 0.2457 -0.0477 0.0125 0.0204 15 VAL A CB 3392 C CG1 . VAL C 15 ? 0.4057 0.2622 0.2058 -0.0547 0.0234 0.0231 15 VAL A CG1 3393 C CG2 . VAL C 15 ? 0.4318 0.2893 0.2466 -0.0499 0.0093 0.0195 15 VAL A CG2 3394 N N . GLY C 16 ? 0.4513 0.3204 0.2407 -0.0372 0.0190 0.0142 16 GLY A N 3395 C CA . GLY C 16 ? 0.4771 0.3416 0.2522 -0.0337 0.0205 0.0132 16 GLY A CA 3396 C C . GLY C 16 ? 0.4936 0.3663 0.2711 -0.0258 0.0152 0.0084 16 GLY A C 3397 O O . GLY C 16 ? 0.5336 0.4058 0.3041 -0.0224 0.0158 0.0060 16 GLY A O 3398 N N . ASP C 17 ? 0.4251 0.3053 0.2128 -0.0224 0.0097 0.0071 17 ASP A N 3399 C CA . ASP C 17 ? 0.4202 0.3105 0.2139 -0.0158 0.0052 0.0037 17 ASP A CA 3400 C C . ASP C 17 ? 0.3957 0.3006 0.2068 -0.0176 0.0093 0.0015 17 ASP A C 3401 O O . ASP C 17 ? 0.3796 0.2900 0.2014 -0.0229 0.0149 0.0022 17 ASP A O 3402 C CB . ASP C 17 ? 0.5083 0.4038 0.3080 -0.0109 -0.0006 0.0042 17 ASP A CB 3403 C CG . ASP C 17 ? 0.7309 0.6124 0.5115 -0.0059 -0.0074 0.0049 17 ASP A CG 3404 O OD1 . ASP C 17 ? 0.7850 0.6513 0.5477 -0.0071 -0.0073 0.0055 17 ASP A OD1 3405 O OD2 . ASP C 17 ? 0.7340 0.6192 0.5165 0.0001 -0.0127 0.0050 17 ASP A OD2 3406 N N . ARG C 18 ? 0.4536 0.3642 0.2676 -0.0130 0.0057 -0.0015 18 ARG A N 3407 C CA . ARG C 18 ? 0.4989 0.4228 0.3307 -0.0138 0.0072 -0.0038 18 ARG A CA 3408 C C . ARG C 18 ? 0.5308 0.4677 0.3798 -0.0119 0.0048 -0.0025 18 ARG A C 3409 O O . ARG C 18 ? 0.4968 0.4344 0.3430 -0.0069 0.0000 -0.0015 18 ARG A O 3410 C CB . ARG C 18 ? 0.5281 0.4506 0.3555 -0.0100 0.0035 -0.0078 18 ARG A CB 3411 C CG . ARG C 18 ? 0.5371 0.4727 0.3842 -0.0097 0.0015 -0.0102 18 ARG A CG 3412 C CD . ARG C 18 ? 0.6496 0.5823 0.4925 -0.0051 -0.0048 -0.0147 18 ARG A CD 3413 N NE . ARG C 18 ? 0.7202 0.6496 0.5603 -0.0056 -0.0030 -0.0183 18 ARG A NE 3414 C CZ . ARG C 18 ? 0.7663 0.7026 0.6207 -0.0054 -0.0061 -0.0215 18 ARG A CZ 3415 N NH1 . ARG C 18 ? 0.7562 0.7037 0.6303 -0.0058 -0.0105 -0.0208 18 ARG A NH1 3416 N NH2 . ARG C 18 ? 0.8169 0.7489 0.6657 -0.0044 -0.0051 -0.0252 18 ARG A NH2 3417 N N . VAL C 19 ? 0.4788 0.4260 0.3446 -0.0150 0.0085 -0.0023 19 VAL A N 3418 C CA . VAL C 19 ? 0.4072 0.3667 0.2889 -0.0127 0.0072 -0.0003 19 VAL A CA 3419 C C . VAL C 19 ? 0.3981 0.3680 0.2973 -0.0148 0.0087 -0.0014 19 VAL A C 3420 O O . VAL C 19 ? 0.3620 0.3307 0.2628 -0.0188 0.0123 -0.0036 19 VAL A O 3421 C CB . VAL C 19 ? 0.5644 0.5239 0.4474 -0.0129 0.0091 0.0024 19 VAL A CB 3422 C CG1 . VAL C 19 ? 0.5209 0.4806 0.4093 -0.0188 0.0147 0.0014 19 VAL A CG1 3423 C CG2 . VAL C 19 ? 0.5637 0.5348 0.4591 -0.0080 0.0076 0.0051 19 VAL A CG2 3424 N N . THR C 20 ? 0.3609 0.3409 0.2731 -0.0120 0.0059 0.0003 20 THR A N 3425 C CA . THR C 20 ? 0.3672 0.3565 0.2975 -0.0140 0.0064 0.0003 20 THR A CA 3426 C C . THR C 20 ? 0.4290 0.4292 0.3727 -0.0118 0.0080 0.0053 20 THR A C 3427 O O . THR C 20 ? 0.5243 0.5299 0.4693 -0.0072 0.0058 0.0085 20 THR A O 3428 C CB . THR C 20 ? 0.3769 0.3683 0.3132 -0.0133 0.0009 -0.0019 20 THR A CB 3429 O OG1 . THR C 20 ? 0.5772 0.5575 0.4988 -0.0136 -0.0008 -0.0068 20 THR A OG1 3430 C CG2 . THR C 20 ? 0.4073 0.4066 0.3630 -0.0161 0.0006 -0.0015 20 THR A CG2 3431 N N . ILE C 21 ? 0.3398 0.3435 0.2924 -0.0140 0.0119 0.0059 21 ILE A N 3432 C CA . ILE C 21 ? 0.3278 0.3413 0.2924 -0.0110 0.0138 0.0109 21 ILE A CA 3433 C C . ILE C 21 ? 0.3346 0.3548 0.3165 -0.0138 0.0139 0.0119 21 ILE A C 3434 O O . ILE C 21 ? 0.3445 0.3604 0.3276 -0.0180 0.0131 0.0076 21 ILE A O 3435 C CB . ILE C 21 ? 0.4222 0.4335 0.3829 -0.0098 0.0174 0.0111 21 ILE A CB 3436 C CG1 . ILE C 21 ? 0.4364 0.4434 0.3977 -0.0151 0.0201 0.0066 21 ILE A CG1 3437 C CG2 . ILE C 21 ? 0.4737 0.4776 0.4187 -0.0067 0.0158 0.0108 21 ILE A CG2 3438 C CD1 . ILE C 21 ? 0.4938 0.4973 0.4500 -0.0147 0.0225 0.0055 21 ILE A CD1 3439 N N . THR C 22 ? 0.2606 0.2911 0.2555 -0.0111 0.0147 0.0179 22 THR A N 3440 C CA . THR C 22 ? 0.3149 0.3508 0.3273 -0.0145 0.0142 0.0199 22 THR A CA 3441 C C . THR C 22 ? 0.3199 0.3610 0.3407 -0.0126 0.0189 0.0247 22 THR A C 3442 O O . THR C 22 ? 0.2255 0.2691 0.2410 -0.0071 0.0222 0.0278 22 THR A O 3443 C CB . THR C 22 ? 0.3297 0.3741 0.3549 -0.0144 0.0104 0.0237 22 THR A CB 3444 O OG1 . THR C 22 ? 0.4526 0.5074 0.4814 -0.0086 0.0134 0.0310 22 THR A OG1 3445 C CG2 . THR C 22 ? 0.2976 0.3361 0.3131 -0.0147 0.0049 0.0184 22 THR A CG2 3446 N N . CYS C 23 ? 0.2614 0.3027 0.2943 -0.0167 0.0186 0.0247 23 CYS A N 3447 C CA . CYS C 23 ? 0.2981 0.3430 0.3396 -0.0152 0.0226 0.0294 23 CYS A CA 3448 C C . CYS C 23 ? 0.2254 0.2766 0.2864 -0.0184 0.0209 0.0353 23 CYS A C 3449 O O . CYS C 23 ? 0.2540 0.3013 0.3214 -0.0237 0.0156 0.0317 23 CYS A O 3450 C CB . CYS C 23 ? 0.4057 0.4426 0.4418 -0.0172 0.0235 0.0231 23 CYS A CB 3451 S SG . CYS C 23 ? 0.6406 0.6793 0.6817 -0.0134 0.0284 0.0271 23 CYS A SG 3452 N N . ARG C 24 ? 0.2724 0.3330 0.3428 -0.0148 0.0252 0.0446 24 ARG A N 3453 C CA . ARG C 24 ? 0.3057 0.3727 0.3969 -0.0187 0.0245 0.0518 24 ARG A CA 3454 C C . ARG C 24 ? 0.2725 0.3388 0.3694 -0.0177 0.0291 0.0569 24 ARG A C 3455 O O . ARG C 24 ? 0.3084 0.3772 0.3979 -0.0106 0.0350 0.0606 24 ARG A O 3456 C CB . ARG C 24 ? 0.3275 0.4086 0.4293 -0.0161 0.0259 0.0604 24 ARG A CB 3457 C CG . ARG C 24 ? 0.4076 0.4958 0.5341 -0.0221 0.0241 0.0678 24 ARG A CG 3458 C CD . ARG C 24 ? 0.5177 0.6219 0.6570 -0.0202 0.0252 0.0758 24 ARG A CD 3459 N NE . ARG C 24 ? 0.6585 0.7679 0.8231 -0.0282 0.0204 0.0800 24 ARG A NE 3460 C CZ . ARG C 24 ? 0.8414 0.9550 1.0248 -0.0320 0.0232 0.0895 24 ARG A CZ 3461 N NH1 . ARG C 24 ? 0.8735 0.9868 1.0519 -0.0276 0.0314 0.0957 24 ARG A NH1 3462 N NH2 . ARG C 24 ? 0.9068 1.0242 1.1145 -0.0401 0.0174 0.0928 24 ARG A NH2 3463 N N . ALA C 25 ? 0.2764 0.3378 0.3853 -0.0239 0.0255 0.0568 25 ALA A N 3464 C CA . ALA C 25 ? 0.3247 0.3842 0.4399 -0.0234 0.0291 0.0623 25 ALA A CA 3465 C C . ALA C 25 ? 0.2928 0.3626 0.4292 -0.0256 0.0314 0.0753 25 ALA A C 3466 O O . ALA C 25 ? 0.2927 0.3673 0.4437 -0.0312 0.0265 0.0771 25 ALA A O 3467 C CB . ALA C 25 ? 0.2420 0.2887 0.3566 -0.0284 0.0235 0.0545 25 ALA A CB 3468 N N . SER C 26 ? 0.2635 0.3369 0.4019 -0.0208 0.0388 0.0845 26 SER A N 3469 C CA . SER C 26 ? 0.3235 0.4085 0.4822 -0.0222 0.0430 0.0988 26 SER A CA 3470 C C . SER C 26 ? 0.3937 0.4730 0.5722 -0.0326 0.0370 0.1012 26 SER A C 3471 O O . SER C 26 ? 0.3879 0.4769 0.5882 -0.0372 0.0377 0.1119 26 SER A O 3472 C CB . SER C 26 ? 0.2865 0.3755 0.4393 -0.0130 0.0529 0.1083 26 SER A CB 3473 O OG . SER C 26 ? 0.3121 0.3874 0.4549 -0.0116 0.0528 0.1037 26 SER A OG 3474 N N . GLN C 27 ? 0.3907 0.4543 0.5619 -0.0358 0.0308 0.0914 27 GLN A N 3475 C CA . GLN C 27 ? 0.4374 0.4924 0.6244 -0.0451 0.0221 0.0905 27 GLN A CA 3476 C C . GLN C 27 ? 0.3866 0.4292 0.5617 -0.0472 0.0125 0.0749 27 GLN A C 3477 O O . GLN C 27 ? 0.3444 0.3844 0.4994 -0.0419 0.0144 0.0661 27 GLN A O 3478 C CB . GLN C 27 ? 0.5286 0.5751 0.7192 -0.0456 0.0244 0.0966 27 GLN A CB 3479 C CG . GLN C 27 ? 0.6981 0.7540 0.8908 -0.0396 0.0363 0.1107 27 GLN A CG 3480 C CD . GLN C 27 ? 0.7645 0.8088 0.9563 -0.0390 0.0380 0.1151 27 GLN A CD 3481 O OE1 . GLN C 27 ? 0.7788 0.8093 0.9745 -0.0452 0.0295 0.1098 27 GLN A OE1 3482 N NE2 . GLN C 27 ? 0.7660 0.8146 0.9511 -0.0306 0.0486 0.1243 27 GLN A NE2 3483 N N . GLY C 28 ? 0.3349 0.3698 0.5225 -0.0545 0.0021 0.0716 28 GLY A N 3484 C CA . GLY C 28 ? 0.3679 0.3907 0.5437 -0.0552 -0.0072 0.0572 28 GLY A CA 3485 C C . GLY C 28 ? 0.3237 0.3353 0.4808 -0.0508 -0.0059 0.0494 28 GLY A C 3486 O O . GLY C 28 ? 0.3018 0.3078 0.4615 -0.0506 -0.0041 0.0538 28 GLY A O 3487 N N . ILE C 29 ? 0.2935 0.3021 0.4317 -0.0470 -0.0065 0.0382 29 ILE A N 3488 C CA . ILE C 29 ? 0.2686 0.2685 0.3900 -0.0428 -0.0056 0.0297 29 ILE A CA 3489 C C . ILE C 29 ? 0.2326 0.2237 0.3445 -0.0430 -0.0142 0.0171 29 ILE A C 3490 O O . ILE C 29 ? 0.3265 0.3142 0.4223 -0.0388 -0.0125 0.0086 29 ILE A O 3491 C CB . ILE C 29 ? 0.2385 0.2448 0.3448 -0.0365 0.0042 0.0289 29 ILE A CB 3492 C CG1 . ILE C 29 ? 0.2618 0.2749 0.3614 -0.0359 0.0054 0.0262 29 ILE A CG1 3493 C CG2 . ILE C 29 ? 0.2619 0.2747 0.3738 -0.0336 0.0124 0.0403 29 ILE A CG2 3494 C CD1 . ILE C 29 ? 0.1526 0.1698 0.2371 -0.0303 0.0129 0.0241 29 ILE A CD1 3495 N N . SER C 30 ? 0.2869 0.2749 0.4094 -0.0472 -0.0236 0.0160 30 SER A N 3496 C CA . SER C 30 ? 0.3289 0.3086 0.4424 -0.0461 -0.0328 0.0045 30 SER A CA 3497 C C . SER C 30 ? 0.2540 0.2367 0.3470 -0.0412 -0.0272 -0.0027 30 SER A C 3498 O O . SER C 30 ? 0.3144 0.3054 0.4051 -0.0410 -0.0221 0.0001 30 SER A O 3499 C CB . SER C 30 ? 0.4178 0.3839 0.5294 -0.0454 -0.0412 -0.0016 30 SER A CB 3500 O OG . SER C 30 ? 0.6067 0.5715 0.7102 -0.0421 -0.0346 -0.0015 30 SER A OG 3501 N N . SER C 31 ? 0.2954 0.2717 0.3738 -0.0372 -0.0280 -0.0117 31 SER A N 3502 C CA . SER C 31 ? 0.4325 0.4120 0.4931 -0.0334 -0.0224 -0.0177 31 SER A CA 3503 C C . SER C 31 ? 0.3938 0.3770 0.4460 -0.0304 -0.0134 -0.0184 31 SER A C 3504 O O . SER C 31 ? 0.4329 0.4176 0.4715 -0.0275 -0.0096 -0.0244 31 SER A O 3505 C CB . SER C 31 ? 0.5230 0.4944 0.5722 -0.0301 -0.0299 -0.0280 31 SER A CB 3506 O OG . SER C 31 ? 0.5905 0.5605 0.6420 -0.0311 -0.0361 -0.0287 31 SER A OG 3507 N N . TYR C 32 ? 0.2581 0.2429 0.3188 -0.0310 -0.0101 -0.0120 32 TYR A N 3508 C CA . TYR C 32 ? 0.2750 0.2626 0.3285 -0.0274 -0.0028 -0.0130 32 TYR A CA 3509 C C . TYR C 32 ? 0.2919 0.2886 0.3420 -0.0264 0.0057 -0.0086 32 TYR A C 3510 O O . TYR C 32 ? 0.2608 0.2611 0.3152 -0.0249 0.0106 -0.0019 32 TYR A O 3511 C CB . TYR C 32 ? 0.2734 0.2567 0.3347 -0.0269 -0.0034 -0.0086 32 TYR A CB 3512 C CG . TYR C 32 ? 0.2355 0.2081 0.2964 -0.0264 -0.0122 -0.0149 32 TYR A CG 3513 C CD1 . TYR C 32 ? 0.2917 0.2615 0.3408 -0.0216 -0.0123 -0.0241 32 TYR A CD1 3514 C CD2 . TYR C 32 ? 0.3660 0.3313 0.4385 -0.0304 -0.0210 -0.0119 32 TYR A CD2 3515 C CE1 . TYR C 32 ? 0.3416 0.3011 0.3883 -0.0197 -0.0210 -0.0304 32 TYR A CE1 3516 C CE2 . TYR C 32 ? 0.4545 0.4080 0.5255 -0.0292 -0.0306 -0.0183 32 TYR A CE2 3517 C CZ . TYR C 32 ? 0.4462 0.3966 0.5030 -0.0233 -0.0305 -0.0277 32 TYR A CZ 3518 O OH . TYR C 32 ? 0.4289 0.3675 0.4823 -0.0207 -0.0406 -0.0347 32 TYR A OH 3519 N N . LEU C 33 ? 0.2422 0.2415 0.2835 -0.0265 0.0071 -0.0124 33 LEU A N 3520 C CA . LEU C 33 ? 0.2176 0.2235 0.2547 -0.0257 0.0135 -0.0088 33 LEU A CA 3521 C C . LEU C 33 ? 0.2520 0.2586 0.2763 -0.0248 0.0165 -0.0154 33 LEU A C 3522 O O . LEU C 33 ? 0.3012 0.3047 0.3193 -0.0254 0.0137 -0.0209 33 LEU A O 3523 C CB . LEU C 33 ? 0.2662 0.2750 0.3087 -0.0280 0.0119 -0.0030 33 LEU A CB 3524 C CG . LEU C 33 ? 0.2882 0.3028 0.3253 -0.0261 0.0173 0.0009 33 LEU A CG 3525 C CD1 . LEU C 33 ? 0.2433 0.2640 0.2904 -0.0247 0.0195 0.0105 33 LEU A CD1 3526 C CD2 . LEU C 33 ? 0.3125 0.3263 0.3416 -0.0274 0.0156 -0.0017 33 LEU A CD2 3527 N N . ALA C 34 ? 0.1879 0.1986 0.2083 -0.0229 0.0221 -0.0144 34 ALA A N 3528 C CA . ALA C 34 ? 0.2462 0.2583 0.2569 -0.0231 0.0256 -0.0190 34 ALA A CA 3529 C C . ALA C 34 ? 0.3270 0.3416 0.3345 -0.0229 0.0285 -0.0146 34 ALA A C 3530 O O . ALA C 34 ? 0.2936 0.3101 0.3055 -0.0208 0.0289 -0.0088 34 ALA A O 3531 C CB . ALA C 34 ? 0.2799 0.2938 0.2897 -0.0209 0.0281 -0.0243 34 ALA A CB 3532 N N . TRP C 35 ? 0.2868 0.3009 0.2857 -0.0245 0.0306 -0.0172 35 TRP A N 3533 C CA . TRP C 35 ? 0.2977 0.3121 0.2918 -0.0243 0.0325 -0.0141 35 TRP A CA 3534 C C . TRP C 35 ? 0.3443 0.3600 0.3357 -0.0247 0.0358 -0.0175 35 TRP A C 3535 O O . TRP C 35 ? 0.3614 0.3782 0.3509 -0.0268 0.0378 -0.0221 35 TRP A O 3536 C CB . TRP C 35 ? 0.1876 0.1987 0.1739 -0.0265 0.0312 -0.0130 35 TRP A CB 3537 C CG . TRP C 35 ? 0.2084 0.2193 0.1988 -0.0259 0.0273 -0.0093 35 TRP A CG 3538 C CD1 . TRP C 35 ? 0.2419 0.2512 0.2359 -0.0270 0.0234 -0.0109 35 TRP A CD1 3539 C CD2 . TRP C 35 ? 0.2309 0.2440 0.2232 -0.0237 0.0263 -0.0034 35 TRP A CD2 3540 N NE1 . TRP C 35 ? 0.2610 0.2718 0.2610 -0.0267 0.0200 -0.0063 35 TRP A NE1 3541 C CE2 . TRP C 35 ? 0.2054 0.2194 0.2044 -0.0245 0.0223 -0.0014 35 TRP A CE2 3542 C CE3 . TRP C 35 ? 0.2966 0.3111 0.2857 -0.0206 0.0278 0.0001 35 TRP A CE3 3543 C CZ2 . TRP C 35 ? 0.2421 0.2605 0.2459 -0.0226 0.0209 0.0045 35 TRP A CZ2 3544 C CZ3 . TRP C 35 ? 0.2493 0.2671 0.2407 -0.0175 0.0262 0.0057 35 TRP A CZ3 3545 C CH2 . TRP C 35 ? 0.2758 0.2965 0.2751 -0.0187 0.0234 0.0081 35 TRP A CH2 3546 N N . TYR C 36 ? 0.2667 0.2828 0.2583 -0.0222 0.0361 -0.0152 36 TYR A N 3547 C CA . TYR C 36 ? 0.2393 0.2561 0.2303 -0.0228 0.0378 -0.0182 36 TYR A CA 3548 C C . TYR C 36 ? 0.3026 0.3153 0.2871 -0.0234 0.0368 -0.0154 36 TYR A C 3549 O O . TYR C 36 ? 0.2584 0.2688 0.2395 -0.0204 0.0346 -0.0111 36 TYR A O 3550 C CB . TYR C 36 ? 0.1848 0.2040 0.1821 -0.0179 0.0374 -0.0200 36 TYR A CB 3551 C CG . TYR C 36 ? 0.1524 0.1742 0.1552 -0.0168 0.0378 -0.0231 36 TYR A CG 3552 C CD1 . TYR C 36 ? 0.2221 0.2474 0.2274 -0.0182 0.0394 -0.0293 36 TYR A CD1 3553 C CD2 . TYR C 36 ? 0.2253 0.2461 0.2309 -0.0142 0.0363 -0.0196 36 TYR A CD2 3554 C CE1 . TYR C 36 ? 0.2063 0.2329 0.2150 -0.0162 0.0389 -0.0328 36 TYR A CE1 3555 C CE2 . TYR C 36 ? 0.2713 0.2923 0.2811 -0.0132 0.0357 -0.0224 36 TYR A CE2 3556 C CZ . TYR C 36 ? 0.2743 0.2976 0.2847 -0.0138 0.0366 -0.0293 36 TYR A CZ 3557 O OH . TYR C 36 ? 0.2683 0.2908 0.2813 -0.0118 0.0351 -0.0326 36 TYR A OH 3558 N N . GLN C 37 ? 0.2697 0.2816 0.2530 -0.0271 0.0383 -0.0178 37 GLN A N 3559 C CA . GLN C 37 ? 0.2561 0.2625 0.2338 -0.0280 0.0364 -0.0157 37 GLN A CA 3560 C C . GLN C 37 ? 0.2711 0.2780 0.2547 -0.0255 0.0343 -0.0182 37 GLN A C 3561 O O . GLN C 37 ? 0.3367 0.3485 0.3281 -0.0275 0.0363 -0.0224 37 GLN A O 3562 C CB . GLN C 37 ? 0.2070 0.2106 0.1791 -0.0348 0.0393 -0.0154 37 GLN A CB 3563 C CG . GLN C 37 ? 0.1767 0.1729 0.1433 -0.0370 0.0372 -0.0132 37 GLN A CG 3564 C CD . GLN C 37 ? 0.2703 0.2650 0.2340 -0.0444 0.0416 -0.0126 37 GLN A CD 3565 O OE1 . GLN C 37 ? 0.3201 0.3199 0.2922 -0.0483 0.0446 -0.0146 37 GLN A OE1 3566 N NE2 . GLN C 37 ? 0.3167 0.3050 0.2685 -0.0459 0.0423 -0.0095 37 GLN A NE2 3567 N N . GLN C 38 ? 0.2218 0.2236 0.2015 -0.0203 0.0297 -0.0162 38 GLN A N 3568 C CA . GLN C 38 ? 0.2139 0.2144 0.1982 -0.0166 0.0260 -0.0193 38 GLN A CA 3569 C C . GLN C 38 ? 0.2917 0.2832 0.2695 -0.0162 0.0206 -0.0179 38 GLN A C 3570 O O . GLN C 38 ? 0.2813 0.2677 0.2496 -0.0120 0.0178 -0.0141 38 GLN A O 3571 C CB . GLN C 38 ? 0.1797 0.1824 0.1658 -0.0068 0.0241 -0.0195 38 GLN A CB 3572 C CG . GLN C 38 ? 0.3317 0.3337 0.3234 -0.0021 0.0201 -0.0246 38 GLN A CG 3573 C CD . GLN C 38 ? 0.3848 0.3871 0.3751 0.0095 0.0182 -0.0243 38 GLN A CD 3574 O OE1 . GLN C 38 ? 0.3398 0.3414 0.3235 0.0152 0.0184 -0.0189 38 GLN A OE1 3575 N NE2 . GLN C 38 ? 0.2720 0.2761 0.2686 0.0134 0.0166 -0.0298 38 GLN A NE2 3576 N N . LYS C 39 ? 0.3062 0.2959 0.2902 -0.0204 0.0187 -0.0210 39 LYS A N 3577 C CA . LYS C 39 ? 0.2869 0.2665 0.2667 -0.0204 0.0120 -0.0205 39 LYS A CA 3578 C C . LYS C 39 ? 0.3491 0.3265 0.3332 -0.0118 0.0048 -0.0248 39 LYS A C 3579 O O . LYS C 39 ? 0.3121 0.2967 0.3050 -0.0089 0.0062 -0.0288 39 LYS A O 3580 C CB . LYS C 39 ? 0.3027 0.2808 0.2874 -0.0319 0.0144 -0.0201 39 LYS A CB 3581 C CG . LYS C 39 ? 0.3160 0.2938 0.2927 -0.0382 0.0207 -0.0157 39 LYS A CG 3582 C CD . LYS C 39 ? 0.3483 0.3263 0.3296 -0.0491 0.0252 -0.0143 39 LYS A CD 3583 C CE . LYS C 39 ? 0.3586 0.3338 0.3279 -0.0530 0.0306 -0.0098 39 LYS A CE 3584 N NZ . LYS C 39 ? 0.4233 0.4018 0.3970 -0.0625 0.0377 -0.0078 39 LYS A NZ 3585 N N . PRO C 40 ? 0.3654 0.3320 0.3419 -0.0065 -0.0037 -0.0244 40 PRO A N 3586 C CA . PRO C 40 ? 0.3536 0.3163 0.3312 0.0043 -0.0121 -0.0287 40 PRO A CA 3587 C C . PRO C 40 ? 0.4085 0.3749 0.4020 0.0008 -0.0140 -0.0351 40 PRO A C 3588 O O . PRO C 40 ? 0.4411 0.4071 0.4436 -0.0102 -0.0136 -0.0357 40 PRO A O 3589 C CB . PRO C 40 ? 0.3670 0.3157 0.3338 0.0075 -0.0214 -0.0274 40 PRO A CB 3590 C CG . PRO C 40 ? 0.4111 0.3583 0.3671 0.0034 -0.0169 -0.0214 40 PRO A CG 3591 C CD . PRO C 40 ? 0.4286 0.3849 0.3932 -0.0088 -0.0068 -0.0202 40 PRO A CD 3592 N N . GLY C 41 ? 0.4415 0.4119 0.4385 0.0104 -0.0156 -0.0395 41 GLY A N 3593 C CA . GLY C 41 ? 0.3464 0.3210 0.3583 0.0092 -0.0184 -0.0467 41 GLY A CA 3594 C C . GLY C 41 ? 0.3700 0.3576 0.3941 -0.0003 -0.0090 -0.0480 41 GLY A C 3595 O O . GLY C 41 ? 0.4009 0.3944 0.4387 -0.0017 -0.0103 -0.0540 41 GLY A O 3596 N N . LYS C 42 ? 0.3642 0.3566 0.3834 -0.0059 -0.0001 -0.0428 42 LYS A N 3597 C CA . LYS C 42 ? 0.2858 0.2899 0.3143 -0.0140 0.0085 -0.0439 42 LYS A CA 3598 C C . LYS C 42 ? 0.2592 0.2686 0.2830 -0.0087 0.0137 -0.0432 42 LYS A C 3599 O O . LYS C 42 ? 0.2969 0.3018 0.3107 -0.0006 0.0123 -0.0400 42 LYS A O 3600 C CB . LYS C 42 ? 0.4166 0.4211 0.4437 -0.0259 0.0142 -0.0388 42 LYS A CB 3601 C CG . LYS C 42 ? 0.4605 0.4568 0.4897 -0.0319 0.0091 -0.0373 42 LYS A CG 3602 C CD . LYS C 42 ? 0.5515 0.5556 0.5987 -0.0405 0.0105 -0.0405 42 LYS A CD 3603 C CE . LYS C 42 ? 0.6882 0.6835 0.7381 -0.0488 0.0064 -0.0371 42 LYS A CE 3604 N NZ . LYS C 42 ? 0.7737 0.7787 0.8428 -0.0595 0.0101 -0.0380 42 LYS A NZ 3605 N N . ALA C 43 ? 0.2106 0.2298 0.2422 -0.0130 0.0195 -0.0460 43 ALA A N 3606 C CA . ALA C 43 ? 0.2444 0.2676 0.2724 -0.0093 0.0239 -0.0455 43 ALA A CA 3607 C C . ALA C 43 ? 0.2181 0.2406 0.2383 -0.0148 0.0289 -0.0395 43 ALA A C 3608 O O . ALA C 43 ? 0.2413 0.2630 0.2604 -0.0225 0.0308 -0.0371 43 ALA A O 3609 C CB . ALA C 43 ? 0.2301 0.2630 0.2681 -0.0105 0.0267 -0.0518 43 ALA A CB 3610 N N . PRO C 44 ? 0.2140 0.2363 0.2290 -0.0107 0.0305 -0.0369 44 PRO A N 3611 C CA . PRO C 44 ? 0.2842 0.3058 0.2930 -0.0155 0.0340 -0.0322 44 PRO A CA 3612 C C . PRO C 44 ? 0.3298 0.3573 0.3418 -0.0229 0.0388 -0.0346 44 PRO A C 3613 O O . PRO C 44 ? 0.3653 0.3993 0.3850 -0.0232 0.0402 -0.0398 44 PRO A O 3614 C CB . PRO C 44 ? 0.3269 0.3485 0.3339 -0.0098 0.0342 -0.0299 44 PRO A CB 3615 C CG . PRO C 44 ? 0.3200 0.3398 0.3280 -0.0008 0.0308 -0.0311 44 PRO A CG 3616 C CD . PRO C 44 ? 0.2611 0.2830 0.2756 -0.0016 0.0290 -0.0377 44 PRO A CD 3617 N N . LYS C 45 ? 0.2781 0.3036 0.2835 -0.0277 0.0413 -0.0310 45 LYS A N 3618 C CA . LYS C 45 ? 0.2640 0.2945 0.2695 -0.0328 0.0461 -0.0326 45 LYS A CA 3619 C C . LYS C 45 ? 0.2576 0.2860 0.2564 -0.0320 0.0465 -0.0309 45 LYS A C 3620 O O . LYS C 45 ? 0.3033 0.3257 0.2953 -0.0319 0.0447 -0.0265 45 LYS A O 3621 C CB . LYS C 45 ? 0.3012 0.3305 0.3046 -0.0396 0.0488 -0.0302 45 LYS A CB 3622 C CG . LYS C 45 ? 0.5227 0.5562 0.5364 -0.0424 0.0488 -0.0327 45 LYS A CG 3623 C CD . LYS C 45 ? 0.7382 0.7701 0.7504 -0.0502 0.0522 -0.0289 45 LYS A CD 3624 C CE . LYS C 45 ? 0.8862 0.9222 0.9117 -0.0542 0.0513 -0.0307 45 LYS A CE 3625 N NZ . LYS C 45 ? 0.9480 0.9810 0.9727 -0.0626 0.0545 -0.0255 45 LYS A NZ 3626 N N . LEU C 46 ? 0.2203 0.2535 0.2213 -0.0309 0.0481 -0.0348 46 LEU A N 3627 C CA . LEU C 46 ? 0.2310 0.2614 0.2269 -0.0298 0.0469 -0.0343 46 LEU A CA 3628 C C . LEU C 46 ? 0.2312 0.2581 0.2178 -0.0332 0.0486 -0.0316 46 LEU A C 3629 O O . LEU C 46 ? 0.2004 0.2304 0.1845 -0.0362 0.0529 -0.0323 46 LEU A O 3630 C CB . LEU C 46 ? 0.2081 0.2433 0.2067 -0.0273 0.0474 -0.0399 46 LEU A CB 3631 C CG . LEU C 46 ? 0.2824 0.3135 0.2756 -0.0259 0.0447 -0.0404 46 LEU A CG 3632 C CD1 . LEU C 46 ? 0.2454 0.2705 0.2407 -0.0244 0.0399 -0.0364 46 LEU A CD1 3633 C CD2 . LEU C 46 ? 0.2558 0.2909 0.2503 -0.0225 0.0444 -0.0467 46 LEU A CD2 3634 N N . VAL C 47 ? 0.2257 0.2466 0.2074 -0.0324 0.0452 -0.0282 47 VAL A N 3635 C CA . VAL C 47 ? 0.2749 0.2911 0.2464 -0.0342 0.0458 -0.0264 47 VAL A CA 3636 C C . VAL C 47 ? 0.2693 0.2837 0.2377 -0.0318 0.0430 -0.0290 47 VAL A C 3637 O O . VAL C 47 ? 0.3188 0.3328 0.2795 -0.0315 0.0450 -0.0311 47 VAL A O 3638 C CB . VAL C 47 ? 0.3594 0.3696 0.3265 -0.0346 0.0431 -0.0214 47 VAL A CB 3639 C CG1 . VAL C 47 ? 0.3595 0.3639 0.3151 -0.0354 0.0426 -0.0202 47 VAL A CG1 3640 C CG2 . VAL C 47 ? 0.3076 0.3173 0.2755 -0.0364 0.0445 -0.0193 47 VAL A CG2 3641 N N . ILE C 48 ? 0.2306 0.2435 0.2049 -0.0297 0.0381 -0.0285 48 ILE A N 3642 C CA . ILE C 48 ? 0.2079 0.2173 0.1812 -0.0278 0.0332 -0.0307 48 ILE A CA 3643 C C . ILE C 48 ? 0.2365 0.2469 0.2198 -0.0258 0.0298 -0.0321 48 ILE A C 3644 O O . ILE C 48 ? 0.2362 0.2487 0.2269 -0.0257 0.0303 -0.0291 48 ILE A O 3645 C CB . ILE C 48 ? 0.3838 0.3880 0.3542 -0.0282 0.0291 -0.0270 48 ILE A CB 3646 C CG1 . ILE C 48 ? 0.3990 0.3995 0.3560 -0.0288 0.0313 -0.0272 48 ILE A CG1 3647 C CG2 . ILE C 48 ? 0.2622 0.2631 0.2376 -0.0267 0.0220 -0.0284 48 ILE A CG2 3648 C CD1 . ILE C 48 ? 0.3969 0.3919 0.3494 -0.0283 0.0269 -0.0248 48 ILE A CD1 3649 N N . TYR C 49 ? 0.3015 0.3095 0.2838 -0.0236 0.0260 -0.0367 49 TYR A N 3650 C CA . TYR C 49 ? 0.2508 0.2574 0.2419 -0.0220 0.0216 -0.0377 49 TYR A CA 3651 C C . TYR C 49 ? 0.2506 0.2502 0.2423 -0.0210 0.0134 -0.0393 49 TYR A C 3652 O O . TYR C 49 ? 0.3207 0.3170 0.3042 -0.0201 0.0112 -0.0415 49 TYR A O 3653 C CB . TYR C 49 ? 0.2786 0.2890 0.2695 -0.0192 0.0239 -0.0432 49 TYR A CB 3654 C CG . TYR C 49 ? 0.3841 0.3951 0.3658 -0.0163 0.0240 -0.0496 49 TYR A CG 3655 C CD1 . TYR C 49 ? 0.4280 0.4444 0.4024 -0.0169 0.0306 -0.0502 49 TYR A CD1 3656 C CD2 . TYR C 49 ? 0.4129 0.4189 0.3929 -0.0122 0.0174 -0.0547 49 TYR A CD2 3657 C CE1 . TYR C 49 ? 0.4681 0.4864 0.4335 -0.0131 0.0318 -0.0552 49 TYR A CE1 3658 C CE2 . TYR C 49 ? 0.4490 0.4560 0.4189 -0.0076 0.0174 -0.0607 49 TYR A CE2 3659 C CZ . TYR C 49 ? 0.5288 0.5427 0.4913 -0.0077 0.0252 -0.0607 49 TYR A CZ 3660 O OH . TYR C 49 ? 0.5787 0.5948 0.5304 -0.0021 0.0263 -0.0658 49 TYR A OH 3661 N N . ALA C 50 ? 0.2344 0.2309 0.2358 -0.0210 0.0086 -0.0380 50 ALA A N 3662 C CA . ALA C 50 ? 0.3437 0.3328 0.3494 -0.0210 -0.0007 -0.0387 50 ALA A CA 3663 C C . ALA C 50 ? 0.3836 0.3716 0.3893 -0.0231 -0.0031 -0.0356 50 ALA A C 3664 O O . ALA C 50 ? 0.4142 0.3962 0.4165 -0.0216 -0.0102 -0.0394 50 ALA A O 3665 C CB . ALA C 50 ? 0.3002 0.2842 0.2976 -0.0164 -0.0057 -0.0472 50 ALA A CB 3666 N N . ALA C 51 ? 0.3962 0.3896 0.4044 -0.0255 0.0023 -0.0294 51 ALA A N 3667 C CA . ALA C 51 ? 0.4052 0.3990 0.4148 -0.0273 0.0005 -0.0253 51 ALA A CA 3668 C C . ALA C 51 ? 0.3823 0.3737 0.3772 -0.0258 0.0013 -0.0289 51 ALA A C 3669 O O . ALA C 51 ? 0.3750 0.3681 0.3665 -0.0267 0.0037 -0.0254 51 ALA A O 3670 C CB . ALA C 51 ? 0.3861 0.3763 0.4083 -0.0288 -0.0085 -0.0238 51 ALA A CB 3671 N N . SER C 52 ? 0.3825 0.3693 0.3672 -0.0226 -0.0006 -0.0357 52 SER A N 3672 C CA . SER C 52 ? 0.4019 0.3850 0.3719 -0.0202 -0.0005 -0.0385 52 SER A CA 3673 C C . SER C 52 ? 0.4171 0.4009 0.3732 -0.0172 0.0055 -0.0428 52 SER A C 3674 O O . SER C 52 ? 0.5375 0.5185 0.4799 -0.0149 0.0076 -0.0440 52 SER A O 3675 C CB . SER C 52 ? 0.4521 0.4275 0.4222 -0.0175 -0.0112 -0.0423 52 SER A CB 3676 O OG . SER C 52 ? 0.5168 0.4877 0.4866 -0.0140 -0.0168 -0.0483 52 SER A OG 3677 N N . THR C 53 ? 0.3543 0.3423 0.3140 -0.0167 0.0085 -0.0448 53 THR A N 3678 C CA . THR C 53 ? 0.3842 0.3755 0.3334 -0.0135 0.0143 -0.0488 53 THR A CA 3679 C C . THR C 53 ? 0.4194 0.4182 0.3683 -0.0173 0.0245 -0.0451 53 THR A C 3680 O O . THR C 53 ? 0.4173 0.4208 0.3766 -0.0202 0.0267 -0.0426 53 THR A O 3681 C CB . THR C 53 ? 0.4725 0.4649 0.4253 -0.0100 0.0115 -0.0542 53 THR A CB 3682 O OG1 . THR C 53 ? 0.5800 0.5636 0.5344 -0.0070 0.0005 -0.0576 53 THR A OG1 3683 C CG2 . THR C 53 ? 0.5406 0.5379 0.4822 -0.0054 0.0173 -0.0586 53 THR A CG2 3684 N N . LEU C 54 ? 0.4059 0.4053 0.3429 -0.0168 0.0302 -0.0445 54 LEU A N 3685 C CA . LEU C 54 ? 0.4254 0.4312 0.3629 -0.0209 0.0391 -0.0409 54 LEU A CA 3686 C C . LEU C 54 ? 0.4371 0.4521 0.3797 -0.0201 0.0439 -0.0441 54 LEU A C 3687 O O . LEU C 54 ? 0.4278 0.4448 0.3652 -0.0151 0.0439 -0.0489 54 LEU A O 3688 C CB . LEU C 54 ? 0.4519 0.4548 0.3752 -0.0210 0.0441 -0.0385 54 LEU A CB 3689 C CG . LEU C 54 ? 0.5372 0.5307 0.4516 -0.0209 0.0404 -0.0358 54 LEU A CG 3690 C CD1 . LEU C 54 ? 0.6037 0.5947 0.5036 -0.0211 0.0472 -0.0328 54 LEU A CD1 3691 C CD2 . LEU C 54 ? 0.5610 0.5535 0.4846 -0.0251 0.0377 -0.0317 54 LEU A CD2 3692 N N . GLN C 55 ? 0.3779 0.3986 0.3304 -0.0242 0.0475 -0.0419 55 GLN A N 3693 C CA . GLN C 55 ? 0.3510 0.3819 0.3091 -0.0241 0.0530 -0.0447 55 GLN A CA 3694 C C . GLN C 55 ? 0.4441 0.4795 0.3938 -0.0247 0.0607 -0.0434 55 GLN A C 3695 O O . GLN C 55 ? 0.4593 0.4899 0.4018 -0.0276 0.0630 -0.0386 55 GLN A O 3696 C CB . GLN C 55 ? 0.2469 0.2816 0.2167 -0.0279 0.0543 -0.0427 55 GLN A CB 3697 C CG . GLN C 55 ? 0.2907 0.3365 0.2680 -0.0287 0.0598 -0.0454 55 GLN A CG 3698 C CD . GLN C 55 ? 0.4297 0.4805 0.4112 -0.0234 0.0575 -0.0519 55 GLN A CD 3699 O OE1 . GLN C 55 ? 0.4433 0.4879 0.4219 -0.0195 0.0515 -0.0542 55 GLN A OE1 3700 N NE2 . GLN C 55 ? 0.4794 0.5412 0.4683 -0.0233 0.0618 -0.0550 55 GLN A NE2 3701 N N . SER C 56 ? 0.4345 0.4793 0.3845 -0.0214 0.0649 -0.0472 56 SER A N 3702 C CA . SER C 56 ? 0.4660 0.5174 0.4093 -0.0216 0.0737 -0.0450 56 SER A CA 3703 C C . SER C 56 ? 0.4648 0.5199 0.4158 -0.0299 0.0798 -0.0390 56 SER A C 3704 O O . SER C 56 ? 0.4273 0.4866 0.3919 -0.0335 0.0788 -0.0396 56 SER A O 3705 C CB . SER C 56 ? 0.5566 0.6201 0.5012 -0.0160 0.0773 -0.0502 56 SER A CB 3706 O OG . SER C 56 ? 0.6326 0.7029 0.5915 -0.0167 0.0753 -0.0541 56 SER A OG 3707 N N . GLY C 57 ? 0.5057 0.5578 0.4472 -0.0325 0.0853 -0.0334 57 GLY A N 3708 C CA . GLY C 57 ? 0.4906 0.5435 0.4382 -0.0408 0.0901 -0.0273 57 GLY A CA 3709 C C . GLY C 57 ? 0.4854 0.5241 0.4268 -0.0439 0.0851 -0.0232 57 GLY A C 3710 O O . GLY C 57 ? 0.5997 0.6343 0.5385 -0.0494 0.0885 -0.0173 57 GLY A O 3711 N N . VAL C 58 ? 0.3564 0.3877 0.2960 -0.0404 0.0767 -0.0261 58 VAL A N 3712 C CA . VAL C 58 ? 0.3506 0.3699 0.2844 -0.0419 0.0715 -0.0227 58 VAL A CA 3713 C C . VAL C 58 ? 0.3544 0.3649 0.2703 -0.0400 0.0730 -0.0199 58 VAL A C 3714 O O . VAL C 58 ? 0.4275 0.4377 0.3345 -0.0342 0.0729 -0.0229 58 VAL A O 3715 C CB . VAL C 58 ? 0.4069 0.4229 0.3452 -0.0384 0.0629 -0.0260 58 VAL A CB 3716 C CG1 . VAL C 58 ? 0.4458 0.4513 0.3776 -0.0387 0.0578 -0.0226 58 VAL A CG1 3717 C CG2 . VAL C 58 ? 0.3603 0.3829 0.3140 -0.0395 0.0615 -0.0279 58 VAL A CG2 3718 N N . PRO C 59 ? 0.4356 0.4379 0.3452 -0.0441 0.0737 -0.0145 59 PRO A N 3719 C CA . PRO C 59 ? 0.4399 0.4324 0.3310 -0.0421 0.0754 -0.0114 59 PRO A CA 3720 C C . PRO C 59 ? 0.4205 0.4045 0.3024 -0.0359 0.0672 -0.0148 59 PRO A C 3721 O O . PRO C 59 ? 0.3644 0.3485 0.2552 -0.0354 0.0602 -0.0171 59 PRO A O 3722 C CB . PRO C 59 ? 0.4754 0.4602 0.3645 -0.0483 0.0760 -0.0054 59 PRO A CB 3723 C CG . PRO C 59 ? 0.4785 0.4712 0.3858 -0.0537 0.0764 -0.0053 59 PRO A CG 3724 C CD . PRO C 59 ? 0.4256 0.4266 0.3443 -0.0499 0.0724 -0.0114 59 PRO A CD 3725 N N . SER C 60 ? 0.4713 0.4483 0.3360 -0.0310 0.0682 -0.0147 60 SER A N 3726 C CA . SER C 60 ? 0.4589 0.4283 0.3153 -0.0242 0.0597 -0.0190 60 SER A CA 3727 C C . SER C 60 ? 0.4839 0.4449 0.3394 -0.0254 0.0525 -0.0176 60 SER A C 3728 O O . SER C 60 ? 0.4192 0.3762 0.2735 -0.0209 0.0444 -0.0212 60 SER A O 3729 C CB . SER C 60 ? 0.4819 0.4448 0.3179 -0.0174 0.0624 -0.0195 60 SER A CB 3730 O OG . SER C 60 ? 0.5643 0.5212 0.3882 -0.0203 0.0693 -0.0129 60 SER A OG 3731 N N . ARG C 61 ? 0.4804 0.4389 0.3370 -0.0310 0.0547 -0.0125 61 ARG A N 3732 C CA . ARG C 61 ? 0.3786 0.3301 0.2336 -0.0310 0.0479 -0.0112 61 ARG A CA 3733 C C . ARG C 61 ? 0.3816 0.3403 0.2538 -0.0309 0.0419 -0.0135 61 ARG A C 3734 O O . ARG C 61 ? 0.4227 0.3783 0.2955 -0.0291 0.0356 -0.0133 61 ARG A O 3735 C CB . ARG C 61 ? 0.3881 0.3340 0.2390 -0.0361 0.0509 -0.0056 61 ARG A CB 3736 C CG . ARG C 61 ? 0.3037 0.2576 0.1700 -0.0421 0.0543 -0.0037 61 ARG A CG 3737 C CD . ARG C 61 ? 0.3933 0.3386 0.2537 -0.0469 0.0557 0.0017 61 ARG A CD 3738 N NE . ARG C 61 ? 0.4163 0.3679 0.2920 -0.0522 0.0570 0.0028 61 ARG A NE 3739 C CZ . ARG C 61 ? 0.4276 0.3853 0.3106 -0.0574 0.0640 0.0046 61 ARG A CZ 3740 N NH1 . ARG C 61 ? 0.3945 0.3536 0.2701 -0.0577 0.0714 0.0061 61 ARG A NH1 3741 N NH2 . ARG C 61 ? 0.3936 0.3564 0.2913 -0.0615 0.0634 0.0047 61 ARG A NH2 3742 N N . PHE C 62 ? 0.3452 0.3136 0.2311 -0.0325 0.0442 -0.0154 62 PHE A N 3743 C CA . PHE C 62 ? 0.3044 0.2793 0.2059 -0.0319 0.0393 -0.0172 62 PHE A CA 3744 C C . PHE C 62 ? 0.3094 0.2846 0.2126 -0.0276 0.0341 -0.0218 62 PHE A C 3745 O O . PHE C 62 ? 0.3737 0.3493 0.2719 -0.0252 0.0360 -0.0251 62 PHE A O 3746 C CB . PHE C 62 ? 0.2420 0.2258 0.1567 -0.0349 0.0433 -0.0175 62 PHE A CB 3747 C CG . PHE C 62 ? 0.3303 0.3139 0.2475 -0.0387 0.0456 -0.0137 62 PHE A CG 3748 C CD1 . PHE C 62 ? 0.3303 0.3122 0.2421 -0.0425 0.0514 -0.0115 62 PHE A CD1 3749 C CD2 . PHE C 62 ? 0.3307 0.3157 0.2561 -0.0380 0.0417 -0.0122 62 PHE A CD2 3750 C CE1 . PHE C 62 ? 0.3839 0.3643 0.2992 -0.0462 0.0519 -0.0085 62 PHE A CE1 3751 C CE2 . PHE C 62 ? 0.3528 0.3362 0.2795 -0.0402 0.0423 -0.0096 62 PHE A CE2 3752 C CZ . PHE C 62 ? 0.3721 0.3526 0.2942 -0.0446 0.0467 -0.0081 62 PHE A CZ 3753 N N . SER C 63 ? 0.3330 0.3083 0.2439 -0.0262 0.0272 -0.0218 63 SER A N 3754 C CA . SER C 63 ? 0.3210 0.2967 0.2381 -0.0233 0.0209 -0.0259 63 SER A CA 3755 C C . SER C 63 ? 0.3493 0.3304 0.2836 -0.0247 0.0167 -0.0238 63 SER A C 3756 O O . SER C 63 ? 0.3751 0.3588 0.3133 -0.0261 0.0177 -0.0194 63 SER A O 3757 C CB . SER C 63 ? 0.3666 0.3339 0.2720 -0.0190 0.0152 -0.0286 63 SER A CB 3758 O OG . SER C 63 ? 0.4366 0.4017 0.3415 -0.0191 0.0117 -0.0257 63 SER A OG 3759 N N . GLY C 64 ? 0.3863 0.3690 0.3305 -0.0237 0.0121 -0.0266 64 GLY A N 3760 C CA . GLY C 64 ? 0.3747 0.3625 0.3360 -0.0253 0.0086 -0.0236 64 GLY A CA 3761 C C . GLY C 64 ? 0.4299 0.4149 0.3989 -0.0240 -0.0002 -0.0265 64 GLY A C 3762 O O . GLY C 64 ? 0.4597 0.4390 0.4215 -0.0212 -0.0038 -0.0322 64 GLY A O 3763 N N . SER C 65 ? 0.3621 0.3512 0.3461 -0.0257 -0.0041 -0.0223 65 SER A N 3764 C CA . SER C 65 ? 0.4407 0.4275 0.4364 -0.0258 -0.0133 -0.0242 65 SER A CA 3765 C C . SER C 65 ? 0.3778 0.3721 0.3938 -0.0291 -0.0141 -0.0173 65 SER A C 3766 O O . SER C 65 ? 0.3844 0.3857 0.4033 -0.0298 -0.0078 -0.0113 65 SER A O 3767 C CB . SER C 65 ? 0.5660 0.5474 0.5553 -0.0232 -0.0204 -0.0276 65 SER A CB 3768 O OG . SER C 65 ? 0.7057 0.6918 0.6969 -0.0237 -0.0193 -0.0228 65 SER A OG 3769 N N . GLY C 66 ? 0.3489 0.3414 0.3789 -0.0306 -0.0224 -0.0180 66 GLY A N 3770 C CA . GLY C 66 ? 0.3850 0.3847 0.4361 -0.0341 -0.0233 -0.0104 66 GLY A CA 3771 C C . GLY C 66 ? 0.4546 0.4509 0.5162 -0.0362 -0.0261 -0.0106 66 GLY A C 3772 O O . GLY C 66 ? 0.5232 0.5143 0.5749 -0.0344 -0.0245 -0.0155 66 GLY A O 3773 N N . SER C 67 ? 0.4426 0.4423 0.5250 -0.0400 -0.0306 -0.0048 67 SER A N 3774 C CA . SER C 67 ? 0.5292 0.5251 0.6229 -0.0425 -0.0331 -0.0030 67 SER A CA 3775 C C . SER C 67 ? 0.4634 0.4682 0.5793 -0.0469 -0.0313 0.0083 67 SER A C 3776 O O . SER C 67 ? 0.5514 0.5640 0.6780 -0.0485 -0.0325 0.0129 67 SER A O 3777 C CB . SER C 67 ? 0.5307 0.5146 0.6259 -0.0425 -0.0457 -0.0110 67 SER A CB 3778 O OG . SER C 67 ? 0.6263 0.6104 0.7329 -0.0443 -0.0548 -0.0113 67 SER A OG 3779 N N . GLY C 68 ? 0.3347 0.3387 0.4569 -0.0482 -0.0278 0.0131 68 GLY A N 3780 C CA . GLY C 68 ? 0.3402 0.3520 0.4834 -0.0521 -0.0253 0.0251 68 GLY A CA 3781 C C . GLY C 68 ? 0.3042 0.3281 0.4446 -0.0490 -0.0132 0.0334 68 GLY A C 3782 O O . GLY C 68 ? 0.3529 0.3760 0.4851 -0.0458 -0.0062 0.0350 68 GLY A O 3783 N N . THR C 69 ? 0.2915 0.3263 0.4379 -0.0488 -0.0116 0.0380 69 THR A N 3784 C CA . THR C 69 ? 0.3475 0.3944 0.4922 -0.0447 -0.0012 0.0466 69 THR A CA 3785 C C . THR C 69 ? 0.2949 0.3450 0.4223 -0.0398 0.0016 0.0422 69 THR A C 3786 O O . THR C 69 ? 0.3895 0.4467 0.5103 -0.0347 0.0094 0.0470 69 THR A O 3787 C CB . THR C 69 ? 0.3644 0.4246 0.5327 -0.0475 0.0002 0.0588 69 THR A CB 3788 O OG1 . THR C 69 ? 0.4217 0.4847 0.6005 -0.0510 -0.0082 0.0561 69 THR A OG1 3789 C CG2 . THR C 69 ? 0.2967 0.3544 0.4823 -0.0522 -0.0001 0.0663 69 THR A CG2 3790 N N . GLU C 70 ? 0.2652 0.3093 0.3844 -0.0405 -0.0051 0.0332 70 GLU A N 3791 C CA . GLU C 70 ? 0.3291 0.3749 0.4318 -0.0361 -0.0029 0.0297 70 GLU A CA 3792 C C . GLU C 70 ? 0.2967 0.3305 0.3794 -0.0351 -0.0051 0.0189 70 GLU A C 3793 O O . GLU C 70 ? 0.3392 0.3649 0.4217 -0.0371 -0.0125 0.0123 70 GLU A O 3794 C CB . GLU C 70 ? 0.3624 0.4154 0.4744 -0.0367 -0.0079 0.0313 70 GLU A CB 3795 C CG . GLU C 70 ? 0.5484 0.6052 0.6452 -0.0312 -0.0046 0.0307 70 GLU A CG 3796 C CD . GLU C 70 ? 0.7607 0.8307 0.8622 -0.0270 0.0030 0.0406 70 GLU A CD 3797 O OE1 . GLU C 70 ? 0.8245 0.8941 0.9090 -0.0215 0.0073 0.0398 70 GLU A OE1 3798 O OE2 . GLU C 70 ? 0.8086 0.8891 0.9306 -0.0289 0.0045 0.0493 70 GLU A OE2 3799 N N . PHE C 71 ? 0.2831 0.3157 0.3491 -0.0315 0.0013 0.0174 71 PHE A N 3800 C CA . PHE C 71 ? 0.2964 0.3195 0.3445 -0.0307 0.0013 0.0087 71 PHE A CA 3801 C C . PHE C 71 ? 0.3352 0.3580 0.3675 -0.0277 0.0042 0.0076 71 PHE A C 3802 O O . PHE C 71 ? 0.3743 0.4034 0.4063 -0.0249 0.0081 0.0131 71 PHE A O 3803 C CB . PHE C 71 ? 0.2501 0.2704 0.2946 -0.0303 0.0059 0.0072 71 PHE A CB 3804 C CG . PHE C 71 ? 0.2380 0.2564 0.2956 -0.0328 0.0029 0.0080 71 PHE A CG 3805 C CD1 . PHE C 71 ? 0.2773 0.3019 0.3497 -0.0333 0.0050 0.0166 71 PHE A CD1 3806 C CD2 . PHE C 71 ? 0.1933 0.2033 0.2474 -0.0338 -0.0023 0.0005 71 PHE A CD2 3807 C CE1 . PHE C 71 ? 0.2091 0.2302 0.2932 -0.0360 0.0018 0.0179 71 PHE A CE1 3808 C CE2 . PHE C 71 ? 0.2635 0.2699 0.3287 -0.0357 -0.0064 0.0009 71 PHE A CE2 3809 C CZ . PHE C 71 ? 0.2568 0.2681 0.3372 -0.0373 -0.0044 0.0097 71 PHE A CZ 3810 N N . THR C 72 ? 0.2886 0.3033 0.3065 -0.0275 0.0022 0.0007 72 THR A N 3811 C CA . THR C 72 ? 0.3388 0.3507 0.3404 -0.0252 0.0046 -0.0002 72 THR A CA 3812 C C . THR C 72 ? 0.3586 0.3636 0.3456 -0.0257 0.0085 -0.0051 72 THR A C 3813 O O . THR C 72 ? 0.4562 0.4573 0.4421 -0.0268 0.0077 -0.0097 72 THR A O 3814 C CB . THR C 72 ? 0.2947 0.3035 0.2911 -0.0240 -0.0012 -0.0026 72 THR A CB 3815 O OG1 . THR C 72 ? 0.3719 0.3726 0.3632 -0.0246 -0.0057 -0.0093 72 THR A OG1 3816 C CG2 . THR C 72 ? 0.3235 0.3412 0.3368 -0.0239 -0.0053 0.0021 72 THR A CG2 3817 N N . LEU C 73 ? 0.3631 0.3668 0.3392 -0.0244 0.0125 -0.0037 73 LEU A N 3818 C CA . LEU C 73 ? 0.3548 0.3525 0.3176 -0.0255 0.0163 -0.0072 73 LEU A CA 3819 C C . LEU C 73 ? 0.3461 0.3375 0.2939 -0.0243 0.0156 -0.0070 73 LEU A C 3820 O O . LEU C 73 ? 0.3091 0.3020 0.2555 -0.0221 0.0147 -0.0034 73 LEU A O 3821 C CB . LEU C 73 ? 0.3376 0.3384 0.3030 -0.0258 0.0213 -0.0057 73 LEU A CB 3822 C CG . LEU C 73 ? 0.3808 0.3769 0.3351 -0.0277 0.0255 -0.0080 73 LEU A CG 3823 C CD1 . LEU C 73 ? 0.3923 0.3867 0.3438 -0.0295 0.0271 -0.0128 73 LEU A CD1 3824 C CD2 . LEU C 73 ? 0.3766 0.3759 0.3351 -0.0273 0.0285 -0.0067 73 LEU A CD2 3825 N N . THR C 74 ? 0.2331 0.2171 0.1685 -0.0249 0.0160 -0.0108 74 THR A N 3826 C CA . THR C 74 ? 0.2755 0.2515 0.1949 -0.0235 0.0150 -0.0106 74 THR A CA 3827 C C . THR C 74 ? 0.3875 0.3573 0.2940 -0.0258 0.0207 -0.0111 74 THR A C 3828 O O . THR C 74 ? 0.4070 0.3771 0.3129 -0.0271 0.0241 -0.0137 74 THR A O 3829 C CB . THR C 74 ? 0.3417 0.3132 0.2560 -0.0208 0.0092 -0.0140 74 THR A CB 3830 O OG1 . THR C 74 ? 0.4257 0.4041 0.3546 -0.0195 0.0036 -0.0128 74 THR A OG1 3831 C CG2 . THR C 74 ? 0.3317 0.2934 0.2271 -0.0184 0.0082 -0.0140 74 THR A CG2 3832 N N . ILE C 75 ? 0.3991 0.3635 0.2960 -0.0260 0.0217 -0.0082 75 ILE A N 3833 C CA . ILE C 75 ? 0.3813 0.3381 0.2653 -0.0287 0.0264 -0.0074 75 ILE A CA 3834 C C . ILE C 75 ? 0.3318 0.2776 0.1980 -0.0260 0.0237 -0.0074 75 ILE A C 3835 O O . ILE C 75 ? 0.3775 0.3198 0.2389 -0.0233 0.0192 -0.0060 75 ILE A O 3836 C CB . ILE C 75 ? 0.3700 0.3264 0.2561 -0.0314 0.0284 -0.0042 75 ILE A CB 3837 C CG1 . ILE C 75 ? 0.3323 0.2992 0.2356 -0.0322 0.0297 -0.0048 75 ILE A CG1 3838 C CG2 . ILE C 75 ? 0.3280 0.2774 0.2044 -0.0358 0.0337 -0.0027 75 ILE A CG2 3839 C CD1 . ILE C 75 ? 0.3363 0.3026 0.2425 -0.0337 0.0305 -0.0028 75 ILE A CD1 3840 N N . SER C 76 ? 0.3327 0.2732 0.1879 -0.0255 0.0263 -0.0092 76 SER A N 3841 C CA . SER C 76 ? 0.4111 0.3405 0.2483 -0.0213 0.0231 -0.0102 76 SER A CA 3842 C C . SER C 76 ? 0.4735 0.3920 0.2959 -0.0225 0.0243 -0.0061 76 SER A C 3843 O O . SER C 76 ? 0.4977 0.4070 0.3064 -0.0183 0.0195 -0.0064 76 SER A O 3844 C CB . SER C 76 ? 0.4080 0.3338 0.2352 -0.0189 0.0259 -0.0130 76 SER A CB 3845 O OG . SER C 76 ? 0.4666 0.3921 0.2898 -0.0229 0.0349 -0.0100 76 SER A OG 3846 N N . SER C 77 ? 0.4688 0.3877 0.2941 -0.0281 0.0298 -0.0024 77 SER A N 3847 C CA . SER C 77 ? 0.3854 0.2926 0.1983 -0.0304 0.0303 0.0018 77 SER A CA 3848 C C . SER C 77 ? 0.3681 0.2799 0.1932 -0.0367 0.0339 0.0047 77 SER A C 3849 O O . SER C 77 ? 0.3592 0.2750 0.1892 -0.0414 0.0409 0.0059 77 SER A O 3850 C CB . SER C 77 ? 0.4236 0.3187 0.2166 -0.0302 0.0347 0.0038 77 SER A CB 3851 O OG . SER C 77 ? 0.4785 0.3598 0.2578 -0.0320 0.0337 0.0081 77 SER A OG 3852 N N . LEU C 78 ? 0.3806 0.2924 0.2108 -0.0359 0.0287 0.0054 78 LEU A N 3853 C CA . LEU C 78 ? 0.3663 0.2825 0.2094 -0.0402 0.0299 0.0068 78 LEU A CA 3854 C C . LEU C 78 ? 0.4106 0.3180 0.2486 -0.0470 0.0340 0.0108 78 LEU A C 3855 O O . LEU C 78 ? 0.4377 0.3310 0.2598 -0.0473 0.0323 0.0137 78 LEU A O 3856 C CB . LEU C 78 ? 0.3282 0.2436 0.1734 -0.0357 0.0224 0.0068 78 LEU A CB 3857 C CG . LEU C 78 ? 0.3851 0.3131 0.2423 -0.0302 0.0197 0.0044 78 LEU A CG 3858 C CD1 . LEU C 78 ? 0.3989 0.3240 0.2508 -0.0236 0.0125 0.0052 78 LEU A CD1 3859 C CD2 . LEU C 78 ? 0.3564 0.2955 0.2314 -0.0325 0.0227 0.0034 78 LEU A CD2 3860 N N . GLN C 79 ? 0.3678 0.2838 0.2202 -0.0524 0.0393 0.0110 79 GLN A N 3861 C CA . GLN C 79 ? 0.4122 0.3227 0.2661 -0.0599 0.0426 0.0152 79 GLN A CA 3862 C C . GLN C 79 ? 0.3771 0.2896 0.2443 -0.0607 0.0369 0.0140 79 GLN A C 3863 O O . GLN C 79 ? 0.4360 0.3572 0.3122 -0.0558 0.0336 0.0103 79 GLN A O 3864 C CB . GLN C 79 ? 0.3950 0.3147 0.2559 -0.0651 0.0527 0.0164 79 GLN A CB 3865 C CG . GLN C 79 ? 0.4554 0.3713 0.3002 -0.0626 0.0578 0.0176 79 GLN A CG 3866 C CD . GLN C 79 ? 0.5218 0.4471 0.3715 -0.0661 0.0683 0.0193 79 GLN A CD 3867 O OE1 . GLN C 79 ? 0.5786 0.5108 0.4422 -0.0728 0.0727 0.0216 79 GLN A OE1 3868 N NE2 . GLN C 79 ? 0.4222 0.3484 0.2607 -0.0609 0.0718 0.0179 79 GLN A NE2 3869 N N . PRO C 80 ? 0.4703 0.3735 0.3380 -0.0664 0.0352 0.0174 80 PRO A N 3870 C CA . PRO C 80 ? 0.4431 0.3451 0.3208 -0.0655 0.0275 0.0156 80 PRO A CA 3871 C C . PRO C 80 ? 0.4207 0.3388 0.3183 -0.0647 0.0290 0.0113 80 PRO A C 3872 O O . PRO C 80 ? 0.3789 0.2985 0.2811 -0.0587 0.0223 0.0082 80 PRO A O 3873 C CB . PRO C 80 ? 0.4491 0.3399 0.3274 -0.0742 0.0272 0.0203 80 PRO A CB 3874 C CG . PRO C 80 ? 0.4757 0.3549 0.3349 -0.0760 0.0310 0.0251 80 PRO A CG 3875 C CD . PRO C 80 ? 0.4231 0.3140 0.2801 -0.0730 0.0389 0.0234 80 PRO A CD 3876 N N . GLU C 81 ? 0.4337 0.3635 0.3416 -0.0695 0.0377 0.0110 81 GLU A N 3877 C CA . GLU C 81 ? 0.4463 0.3908 0.3722 -0.0684 0.0391 0.0065 81 GLU A CA 3878 C C . GLU C 81 ? 0.4970 0.4493 0.4226 -0.0603 0.0380 0.0027 81 GLU A C 3879 O O . GLU C 81 ? 0.4937 0.4565 0.4320 -0.0581 0.0383 -0.0011 81 GLU A O 3880 C CB . GLU C 81 ? 0.4232 0.3786 0.3596 -0.0753 0.0486 0.0072 81 GLU A CB 3881 C CG . GLU C 81 ? 0.5765 0.5352 0.5028 -0.0745 0.0563 0.0085 81 GLU A CG 3882 C CD . GLU C 81 ? 0.8208 0.7915 0.7566 -0.0797 0.0660 0.0094 81 GLU A CD 3883 O OE1 . GLU C 81 ? 0.9498 0.9245 0.8995 -0.0861 0.0675 0.0108 81 GLU A OE1 3884 O OE2 . GLU C 81 ? 0.8608 0.8372 0.7907 -0.0769 0.0717 0.0086 81 GLU A OE2 3885 N N . ASP C 82 ? 0.3922 0.3393 0.3040 -0.0560 0.0366 0.0037 82 ASP A N 3886 C CA . ASP C 82 ? 0.3247 0.2793 0.2381 -0.0495 0.0356 0.0010 82 ASP A CA 3887 C C . ASP C 82 ? 0.3561 0.3100 0.2708 -0.0425 0.0284 0.0003 82 ASP A C 3888 O O . ASP C 82 ? 0.3349 0.2966 0.2550 -0.0375 0.0278 -0.0012 82 ASP A O 3889 C CB . ASP C 82 ? 0.3308 0.2817 0.2311 -0.0477 0.0367 0.0020 82 ASP A CB 3890 C CG . ASP C 82 ? 0.4335 0.3859 0.3307 -0.0522 0.0441 0.0024 82 ASP A CG 3891 O OD1 . ASP C 82 ? 0.4514 0.4129 0.3600 -0.0554 0.0491 0.0010 82 ASP A OD1 3892 O OD2 . ASP C 82 ? 0.3897 0.3344 0.2724 -0.0514 0.0449 0.0041 82 ASP A OD2 3893 N N . PHE C 83 ? 0.3383 0.2824 0.2477 -0.0417 0.0228 0.0017 83 PHE A N 3894 C CA . PHE C 83 ? 0.3532 0.2960 0.2611 -0.0331 0.0157 0.0012 83 PHE A CA 3895 C C . PHE C 83 ? 0.4074 0.3583 0.3295 -0.0305 0.0150 -0.0017 83 PHE A C 3896 O O . PHE C 83 ? 0.4680 0.4170 0.3972 -0.0343 0.0140 -0.0033 83 PHE A O 3897 C CB . PHE C 83 ? 0.3777 0.3058 0.2732 -0.0317 0.0085 0.0030 83 PHE A CB 3898 C CG . PHE C 83 ? 0.3837 0.3032 0.2629 -0.0313 0.0078 0.0054 83 PHE A CG 3899 C CD1 . PHE C 83 ? 0.3452 0.2577 0.2176 -0.0390 0.0120 0.0075 83 PHE A CD1 3900 C CD2 . PHE C 83 ? 0.2927 0.2120 0.1632 -0.0226 0.0032 0.0058 83 PHE A CD2 3901 C CE1 . PHE C 83 ? 0.4277 0.3311 0.2835 -0.0375 0.0110 0.0093 83 PHE A CE1 3902 C CE2 . PHE C 83 ? 0.3725 0.2842 0.2281 -0.0215 0.0018 0.0072 83 PHE A CE2 3903 C CZ . PHE C 83 ? 0.3846 0.2875 0.2320 -0.0288 0.0054 0.0087 83 PHE A CZ 3904 N N . ALA C 84 ? 0.3701 0.3298 0.2965 -0.0240 0.0155 -0.0023 84 ALA A N 3905 C CA . ALA C 84 ? 0.3044 0.2716 0.2424 -0.0200 0.0154 -0.0050 84 ALA A CA 3906 C C . ALA C 84 ? 0.3041 0.2781 0.2426 -0.0116 0.0152 -0.0033 84 ALA A C 3907 O O . ALA C 84 ? 0.2895 0.2625 0.2203 -0.0086 0.0141 -0.0003 84 ALA A O 3908 C CB . ALA C 84 ? 0.3153 0.2903 0.2648 -0.0266 0.0216 -0.0077 84 ALA A CB 3909 N N . THR C 85 ? 0.2326 0.2136 0.1805 -0.0076 0.0164 -0.0050 85 THR A N 3910 C CA . THR C 85 ? 0.2888 0.2774 0.2396 -0.0013 0.0181 -0.0023 85 THR A CA 3911 C C . THR C 85 ? 0.3031 0.2988 0.2627 -0.0070 0.0235 -0.0033 85 THR A C 3912 O O . THR C 85 ? 0.3166 0.3140 0.2826 -0.0114 0.0258 -0.0072 85 THR A O 3913 C CB . THR C 85 ? 0.3347 0.3252 0.2880 0.0085 0.0157 -0.0027 85 THR A CB 3914 O OG1 . THR C 85 ? 0.3741 0.3573 0.3175 0.0155 0.0094 -0.0020 85 THR A OG1 3915 C CG2 . THR C 85 ? 0.2287 0.2276 0.1861 0.0142 0.0189 0.0016 85 THR A CG2 3916 N N . TYR C 86 ? 0.3131 0.3128 0.2733 -0.0067 0.0249 -0.0001 86 TYR A N 3917 C CA . TYR C 86 ? 0.2396 0.2443 0.2073 -0.0112 0.0283 -0.0012 86 TYR A CA 3918 C C . TYR C 86 ? 0.2932 0.3044 0.2693 -0.0063 0.0293 0.0018 86 TYR A C 3919 O O . TYR C 86 ? 0.2567 0.2705 0.2321 -0.0008 0.0283 0.0068 86 TYR A O 3920 C CB . TYR C 86 ? 0.2769 0.2796 0.2398 -0.0157 0.0282 -0.0004 86 TYR A CB 3921 C CG . TYR C 86 ? 0.3126 0.3086 0.2673 -0.0212 0.0289 -0.0029 86 TYR A CG 3922 C CD1 . TYR C 86 ? 0.2495 0.2382 0.1938 -0.0205 0.0262 -0.0015 86 TYR A CD1 3923 C CD2 . TYR C 86 ? 0.2574 0.2544 0.2142 -0.0266 0.0323 -0.0064 86 TYR A CD2 3924 C CE1 . TYR C 86 ? 0.2178 0.1996 0.1548 -0.0261 0.0273 -0.0026 86 TYR A CE1 3925 C CE2 . TYR C 86 ? 0.2951 0.2870 0.2448 -0.0315 0.0342 -0.0074 86 TYR A CE2 3926 C CZ . TYR C 86 ? 0.3056 0.2897 0.2459 -0.0317 0.0319 -0.0051 86 TYR A CZ 3927 O OH . TYR C 86 ? 0.2931 0.2715 0.2266 -0.0371 0.0343 -0.0050 86 TYR A OH 3928 N N . TYR C 87 ? 0.2697 0.2836 0.2534 -0.0080 0.0314 -0.0009 87 TYR A N 3929 C CA . TYR C 87 ? 0.2254 0.2439 0.2172 -0.0042 0.0325 0.0021 87 TYR A CA 3930 C C . TYR C 87 ? 0.3021 0.3219 0.3003 -0.0095 0.0330 0.0013 87 TYR A C 3931 O O . TYR C 87 ? 0.2879 0.3059 0.2852 -0.0143 0.0333 -0.0041 87 TYR A O 3932 C CB . TYR C 87 ? 0.2037 0.2222 0.1979 0.0003 0.0332 -0.0007 87 TYR A CB 3933 C CG . TYR C 87 ? 0.2592 0.2758 0.2478 0.0079 0.0314 0.0000 87 TYR A CG 3934 C CD1 . TYR C 87 ? 0.2095 0.2284 0.1971 0.0168 0.0316 0.0059 87 TYR A CD1 3935 C CD2 . TYR C 87 ? 0.2517 0.2640 0.2363 0.0069 0.0291 -0.0049 87 TYR A CD2 3936 C CE1 . TYR C 87 ? 0.2620 0.2783 0.2426 0.0257 0.0290 0.0061 87 TYR A CE1 3937 C CE2 . TYR C 87 ? 0.3520 0.3608 0.3313 0.0147 0.0256 -0.0050 87 TYR A CE2 3938 C CZ . TYR C 87 ? 0.3586 0.3690 0.3348 0.0248 0.0253 0.0001 87 TYR A CZ 3939 O OH . TYR C 87 ? 0.4549 0.4611 0.4239 0.0344 0.0209 -0.0005 87 TYR A OH 3940 N N . CYS C 88 ? 0.2499 0.2731 0.2551 -0.0083 0.0328 0.0066 88 CYS A N 3941 C CA . CYS C 88 ? 0.2105 0.2337 0.2236 -0.0124 0.0317 0.0058 88 CYS A CA 3942 C C . CYS C 88 ? 0.2140 0.2377 0.2331 -0.0093 0.0332 0.0066 88 CYS A C 3943 O O . CYS C 88 ? 0.2426 0.2682 0.2612 -0.0031 0.0352 0.0103 88 CYS A O 3944 C CB . CYS C 88 ? 0.2022 0.2283 0.2216 -0.0142 0.0296 0.0111 88 CYS A CB 3945 S SG . CYS C 88 ? 0.3717 0.4053 0.3976 -0.0080 0.0320 0.0214 88 CYS A SG 3946 N N . GLN C 89 ? 0.2508 0.2720 0.2743 -0.0124 0.0317 0.0030 89 GLN A N 3947 C CA . GLN C 89 ? 0.1843 0.2043 0.2121 -0.0093 0.0325 0.0032 89 GLN A CA 3948 C C . GLN C 89 ? 0.2621 0.2789 0.2977 -0.0129 0.0292 0.0034 89 GLN A C 3949 O O . GLN C 89 ? 0.2600 0.2739 0.2943 -0.0169 0.0259 -0.0021 89 GLN A O 3950 C CB . GLN C 89 ? 0.1839 0.2024 0.2061 -0.0072 0.0335 -0.0047 89 GLN A CB 3951 C CG . GLN C 89 ? 0.2723 0.2886 0.2968 -0.0026 0.0339 -0.0055 89 GLN A CG 3952 C CD . GLN C 89 ? 0.3292 0.3439 0.3519 -0.0033 0.0326 -0.0148 89 GLN A CD 3953 O OE1 . GLN C 89 ? 0.3540 0.3708 0.3730 -0.0057 0.0331 -0.0206 89 GLN A OE1 3954 N NE2 . GLN C 89 ? 0.3940 0.4048 0.4192 -0.0011 0.0311 -0.0159 89 GLN A NE2 3955 N N . HIS C 90 ? 0.2348 0.2514 0.2779 -0.0108 0.0299 0.0101 90 HIS A N 3956 C CA . HIS C 90 ? 0.2484 0.2599 0.2992 -0.0138 0.0262 0.0106 90 HIS A CA 3957 C C . HIS C 90 ? 0.2378 0.2439 0.2828 -0.0118 0.0249 0.0019 90 HIS A C 3958 O O . HIS C 90 ? 0.2618 0.2680 0.3021 -0.0064 0.0279 0.0006 90 HIS A O 3959 C CB . HIS C 90 ? 0.2103 0.2230 0.2704 -0.0119 0.0285 0.0214 90 HIS A CB 3960 C CG . HIS C 90 ? 0.2856 0.2923 0.3560 -0.0163 0.0239 0.0237 90 HIS A CG 3961 N ND1 . HIS C 90 ? 0.2578 0.2623 0.3353 -0.0146 0.0259 0.0322 90 HIS A ND1 3962 C CD2 . HIS C 90 ? 0.2647 0.2658 0.3391 -0.0218 0.0167 0.0188 90 HIS A CD2 3963 C CE1 . HIS C 90 ? 0.2401 0.2376 0.3265 -0.0199 0.0199 0.0325 90 HIS A CE1 3964 N NE2 . HIS C 90 ? 0.3185 0.3136 0.4031 -0.0239 0.0136 0.0240 90 HIS A NE2 3965 N N . LEU C 91 ? 0.2438 0.2453 0.2883 -0.0152 0.0197 -0.0045 91 LEU A N 3966 C CA . LEU C 91 ? 0.2663 0.2646 0.3039 -0.0126 0.0186 -0.0139 91 LEU A CA 3967 C C . LEU C 91 ? 0.3458 0.3373 0.3858 -0.0096 0.0163 -0.0138 91 LEU A C 3968 O O . LEU C 91 ? 0.4214 0.4111 0.4555 -0.0058 0.0158 -0.0213 91 LEU A O 3969 C CB . LEU C 91 ? 0.2342 0.2306 0.2678 -0.0154 0.0142 -0.0213 91 LEU A CB 3970 C CG . LEU C 91 ? 0.2431 0.2454 0.2706 -0.0170 0.0174 -0.0232 91 LEU A CG 3971 C CD1 . LEU C 91 ? 0.2197 0.2195 0.2417 -0.0185 0.0135 -0.0296 91 LEU A CD1 3972 C CD2 . LEU C 91 ? 0.1981 0.2057 0.2204 -0.0141 0.0230 -0.0264 91 LEU A CD2 3973 N N . ILE C 92 ? 0.2850 0.2728 0.3339 -0.0114 0.0148 -0.0051 92 ILE A N 3974 C CA . ILE C 92 ? 0.2531 0.2330 0.3037 -0.0085 0.0132 -0.0033 92 ILE A CA 3975 C C . ILE C 92 ? 0.2412 0.2228 0.2976 -0.0066 0.0185 0.0088 92 ILE A C 3976 O O . ILE C 92 ? 0.2485 0.2384 0.3059 -0.0058 0.0236 0.0143 92 ILE A O 3977 C CB . ILE C 92 ? 0.3466 0.3168 0.4029 -0.0128 0.0046 -0.0044 92 ILE A CB 3978 C CG1 . ILE C 92 ? 0.3269 0.2986 0.3962 -0.0196 0.0023 0.0042 92 ILE A CG1 3979 C CG2 . ILE C 92 ? 0.3006 0.2684 0.3486 -0.0122 -0.0007 -0.0168 92 ILE A CG2 3980 C CD1 . ILE C 92 ? 0.2913 0.2519 0.3693 -0.0239 -0.0072 0.0048 92 ILE A CD1 3981 N N . GLY C 93 ? 0.3110 0.2844 0.3702 -0.0050 0.0172 0.0132 93 GLY A N 3982 C CA . GLY C 93 ? 0.2681 0.2429 0.3324 -0.0023 0.0230 0.0258 93 GLY A CA 3983 C C . GLY C 93 ? 0.3160 0.2952 0.3696 0.0070 0.0296 0.0249 93 GLY A C 3984 O O . GLY C 93 ? 0.3195 0.2943 0.3634 0.0126 0.0286 0.0163 93 GLY A O 3985 N N . LEU C 94 ? 0.3226 0.3104 0.3780 0.0093 0.0355 0.0333 94 LEU A N 3986 C CA . LEU C 94 ? 0.3989 0.3903 0.4437 0.0192 0.0405 0.0323 94 LEU A CA 3987 C C . LEU C 94 ? 0.3625 0.3599 0.4013 0.0190 0.0395 0.0230 94 LEU A C 3988 O O . LEU C 94 ? 0.3997 0.3999 0.4306 0.0266 0.0421 0.0214 94 LEU A O 3989 C CB . LEU C 94 ? 0.4320 0.4295 0.4797 0.0240 0.0471 0.0460 94 LEU A CB 3990 C CG . LEU C 94 ? 0.4666 0.4585 0.5183 0.0267 0.0503 0.0569 94 LEU A CG 3991 C CD1 . LEU C 94 ? 0.4786 0.4782 0.5298 0.0346 0.0583 0.0697 94 LEU A CD1 3992 C CD2 . LEU C 94 ? 0.4902 0.4705 0.5314 0.0330 0.0482 0.0498 94 LEU A CD2 3993 N N . ARG C 95 ? 0.3356 0.3340 0.3777 0.0108 0.0354 0.0172 96 ARG A N 3994 C CA . ARG C 95 ? 0.3392 0.3422 0.3757 0.0094 0.0347 0.0088 96 ARG A CA 3995 C C . ARG C 95 ? 0.3417 0.3515 0.3753 0.0128 0.0383 0.0132 96 ARG A C 3996 O O . ARG C 95 ? 0.3311 0.3426 0.3578 0.0160 0.0386 0.0072 96 ARG A O 3997 C CB . ARG C 95 ? 0.3629 0.3633 0.3918 0.0137 0.0335 -0.0021 96 ARG A CB 3998 C CG . ARG C 95 ? 0.3729 0.3689 0.4021 0.0099 0.0290 -0.0104 96 ARG A CG 3999 C CD . ARG C 95 ? 0.3667 0.3540 0.3976 0.0121 0.0267 -0.0080 96 ARG A CD 4000 N NE . ARG C 95 ? 0.3923 0.3750 0.4193 0.0128 0.0223 -0.0184 96 ARG A NE 4001 C CZ . ARG C 95 ? 0.4552 0.4284 0.4818 0.0145 0.0185 -0.0187 96 ARG A CZ 4002 N NH1 . ARG C 95 ? 0.4041 0.3712 0.4353 0.0145 0.0192 -0.0084 96 ARG A NH1 4003 N NH2 . ARG C 95 ? 0.4053 0.3751 0.4270 0.0163 0.0141 -0.0290 96 ARG A NH2 4004 N N . SER C 96 ? 0.2956 0.3094 0.3351 0.0123 0.0407 0.0238 97 SER A N 4005 C CA . SER C 96 ? 0.3363 0.3565 0.3720 0.0173 0.0437 0.0285 97 SER A CA 4006 C C . SER C 96 ? 0.3369 0.3603 0.3700 0.0123 0.0416 0.0238 97 SER A C 4007 O O . SER C 96 ? 0.3192 0.3416 0.3561 0.0043 0.0385 0.0202 97 SER A O 4008 C CB . SER C 96 ? 0.3364 0.3620 0.3799 0.0189 0.0475 0.0417 97 SER A CB 4009 O OG . SER C 96 ? 0.4679 0.4947 0.5236 0.0095 0.0452 0.0450 97 SER A OG 4010 N N . PHE C 97 ? 0.2673 0.2931 0.2927 0.0179 0.0426 0.0235 98 PHE A N 4011 C CA . PHE C 97 ? 0.2600 0.2874 0.2810 0.0143 0.0407 0.0199 98 PHE A CA 4012 C C . PHE C 97 ? 0.2967 0.3301 0.3185 0.0167 0.0419 0.0282 98 PHE A C 4013 O O . PHE C 97 ? 0.2333 0.2706 0.2564 0.0238 0.0451 0.0362 98 PHE A O 4014 C CB . PHE C 97 ? 0.2543 0.2788 0.2661 0.0184 0.0394 0.0127 98 PHE A CB 4015 C CG . PHE C 97 ? 0.3440 0.3649 0.3560 0.0153 0.0380 0.0035 98 PHE A CG 4016 C CD1 . PHE C 97 ? 0.2729 0.2914 0.2859 0.0200 0.0385 0.0015 98 PHE A CD1 4017 C CD2 . PHE C 97 ? 0.3047 0.3252 0.3153 0.0084 0.0366 -0.0031 98 PHE A CD2 4018 C CE1 . PHE C 97 ? 0.3010 0.3176 0.3143 0.0180 0.0370 -0.0074 98 PHE A CE1 4019 C CE2 . PHE C 97 ? 0.2935 0.3131 0.3050 0.0062 0.0360 -0.0111 98 PHE A CE2 4020 C CZ . PHE C 97 ? 0.2299 0.2480 0.2431 0.0110 0.0360 -0.0137 98 PHE A CZ 4021 N N . GLY C 98 ? 0.2081 0.2425 0.2281 0.0117 0.0397 0.0265 99 GLY A N 4022 C CA . GLY C 98 ? 0.1917 0.2316 0.2098 0.0151 0.0401 0.0324 99 GLY A CA 4023 C C . GLY C 98 ? 0.2914 0.3294 0.2975 0.0242 0.0397 0.0311 99 GLY A C 4024 O O . GLY C 98 ? 0.2988 0.3313 0.2998 0.0265 0.0387 0.0251 99 GLY A O 4025 N N . GLN C 99 ? 0.2908 0.3333 0.2925 0.0299 0.0396 0.0361 100 GLN A N 4026 C CA . GLN C 99 ? 0.3019 0.3417 0.2914 0.0404 0.0379 0.0351 100 GLN A CA 4027 C C . GLN C 99 ? 0.3362 0.3681 0.3164 0.0368 0.0329 0.0272 100 GLN A C 4028 O O . GLN C 99 ? 0.3200 0.3468 0.2904 0.0441 0.0297 0.0244 100 GLN A O 4029 C CB . GLN C 99 ? 0.3176 0.3656 0.3047 0.0497 0.0395 0.0436 100 GLN A CB 4030 C CG . GLN C 99 ? 0.2808 0.3304 0.2639 0.0473 0.0363 0.0435 100 GLN A CG 4031 C CD . GLN C 99 ? 0.3558 0.4119 0.3517 0.0376 0.0376 0.0466 100 GLN A CD 4032 O OE1 . GLN C 99 ? 0.2702 0.3276 0.2778 0.0310 0.0398 0.0476 100 GLN A OE1 4033 N NE2 . GLN C 99 ? 0.2525 0.3118 0.2457 0.0374 0.0352 0.0477 100 GLN A NE2 4034 N N . GLY C 100 ? 0.2381 0.2679 0.2209 0.0261 0.0319 0.0237 101 GLY A N 4035 C CA . GLY C 100 ? 0.2291 0.2512 0.2035 0.0218 0.0282 0.0176 101 GLY A CA 4036 C C . GLY C 100 ? 0.3039 0.3253 0.2708 0.0223 0.0255 0.0197 101 GLY A C 4037 O O . GLY C 100 ? 0.2942 0.3209 0.2591 0.0301 0.0254 0.0251 101 GLY A O 4038 N N . THR C 101 ? 0.2260 0.2413 0.1884 0.0146 0.0237 0.0155 102 THR A N 4039 C CA . THR C 101 ? 0.2439 0.2559 0.1968 0.0149 0.0204 0.0163 102 THR A CA 4040 C C . THR C 101 ? 0.2956 0.2963 0.2379 0.0125 0.0171 0.0117 102 THR A C 4041 O O . THR C 101 ? 0.2982 0.2950 0.2424 0.0045 0.0185 0.0077 102 THR A O 4042 C CB . THR C 101 ? 0.3097 0.3238 0.2664 0.0077 0.0211 0.0165 102 THR A CB 4043 O OG1 . THR C 101 ? 0.3306 0.3550 0.2993 0.0093 0.0233 0.0214 102 THR A OG1 4044 C CG2 . THR C 101 ? 0.3016 0.3107 0.2466 0.0086 0.0173 0.0164 102 THR A CG2 4045 N N . LYS C 102 ? 0.3136 0.3093 0.2452 0.0197 0.0124 0.0124 103 LYS A N 4046 C CA . LYS C 102 ? 0.3440 0.3276 0.2664 0.0174 0.0081 0.0086 103 LYS A CA 4047 C C . LYS C 102 ? 0.3916 0.3676 0.3032 0.0133 0.0056 0.0086 103 LYS A C 4048 O O . LYS C 102 ? 0.3513 0.3291 0.2566 0.0188 0.0035 0.0113 103 LYS A O 4049 C CB . LYS C 102 ? 0.4483 0.4275 0.3638 0.0283 0.0026 0.0084 103 LYS A CB 4050 C CG . LYS C 102 ? 0.5324 0.4993 0.4436 0.0251 -0.0025 0.0038 103 LYS A CG 4051 C CD . LYS C 102 ? 0.7065 0.6666 0.6083 0.0373 -0.0105 0.0031 103 LYS A CD 4052 C CE . LYS C 102 ? 0.8034 0.7526 0.7061 0.0342 -0.0161 -0.0019 103 LYS A CE 4053 N NZ . LYS C 102 ? 0.8716 0.8125 0.7735 0.0212 -0.0160 -0.0029 103 LYS A NZ 4054 N N . LEU C 103 ? 0.3909 0.3588 0.3004 0.0042 0.0063 0.0059 104 LEU A N 4055 C CA . LEU C 103 ? 0.4216 0.3793 0.3185 0.0005 0.0039 0.0060 104 LEU A CA 4056 C C . LEU C 103 ? 0.4537 0.3981 0.3409 0.0014 -0.0021 0.0049 104 LEU A C 4057 O O . LEU C 103 ? 0.5117 0.4526 0.4044 -0.0037 -0.0017 0.0029 104 LEU A O 4058 C CB . LEU C 103 ? 0.4097 0.3666 0.3088 -0.0097 0.0092 0.0047 104 LEU A CB 4059 C CG . LEU C 103 ? 0.4586 0.4261 0.3674 -0.0119 0.0140 0.0046 104 LEU A CG 4060 C CD1 . LEU C 103 ? 0.3825 0.3459 0.2875 -0.0196 0.0175 0.0031 104 LEU A CD1 4061 C CD2 . LEU C 103 ? 0.4721 0.4456 0.3805 -0.0056 0.0119 0.0071 104 LEU A CD2 4062 N N . GLU C 104 ? 0.4199 0.3569 0.2934 0.0080 -0.0083 0.0061 105 GLU A N 4063 C CA . GLU C 104 ? 0.3634 0.2850 0.2259 0.0092 -0.0158 0.0051 105 GLU A CA 4064 C C . GLU C 104 ? 0.4346 0.3435 0.2851 0.0019 -0.0163 0.0059 105 GLU A C 4065 O O . GLU C 104 ? 0.4297 0.3410 0.2749 0.0015 -0.0138 0.0070 105 GLU A O 4066 C CB . GLU C 104 ? 0.4678 0.3876 0.3202 0.0230 -0.0235 0.0055 105 GLU A CB 4067 C CG . GLU C 104 ? 0.5400 0.4415 0.3783 0.0260 -0.0336 0.0041 105 GLU A CG 4068 C CD . GLU C 104 ? 0.6636 0.5624 0.4865 0.0399 -0.0410 0.0047 105 GLU A CD 4069 O OE1 . GLU C 104 ? 0.6654 0.5669 0.4811 0.0412 -0.0397 0.0064 105 GLU A OE1 4070 O OE2 . GLU C 104 ? 0.6233 0.5175 0.4412 0.0504 -0.0487 0.0032 105 GLU A OE2 4071 N N . ILE C 105 ? 0.4357 0.3308 0.2823 -0.0037 -0.0198 0.0056 106 ILE A N 4072 C CA . ILE C 105 ? 0.4527 0.3335 0.2858 -0.0098 -0.0206 0.0074 106 ILE A CA 4073 C C . ILE C 105 ? 0.5002 0.3690 0.3144 -0.0006 -0.0300 0.0076 106 ILE A C 4074 O O . ILE C 105 ? 0.4993 0.3614 0.3094 0.0064 -0.0386 0.0063 106 ILE A O 4075 C CB . ILE C 105 ? 0.5261 0.3962 0.3630 -0.0201 -0.0207 0.0082 106 ILE A CB 4076 C CG1 . ILE C 105 ? 0.6584 0.5413 0.5138 -0.0287 -0.0112 0.0078 106 ILE A CG1 4077 C CG2 . ILE C 105 ? 0.3905 0.2446 0.2119 -0.0258 -0.0210 0.0113 106 ILE A CG2 4078 C CD1 . ILE C 105 ? 0.7323 0.6083 0.5952 -0.0392 -0.0104 0.0091 106 ILE A CD1 4079 N N . LYS C 106 ? 0.4253 0.2909 0.2270 0.0002 -0.0291 0.0086 107 LYS A N 4080 C CA . LYS C 106 ? 0.5045 0.3590 0.2871 0.0094 -0.0380 0.0083 107 LYS A CA 4081 C C . LYS C 106 ? 0.4910 0.3224 0.2589 0.0045 -0.0438 0.0095 107 LYS A C 4082 O O . LYS C 106 ? 0.4697 0.2947 0.2389 -0.0067 -0.0383 0.0117 107 LYS A O 4083 C CB . LYS C 106 ? 0.5616 0.4226 0.3375 0.0131 -0.0355 0.0083 107 LYS A CB 4084 C CG . LYS C 106 ? 0.6992 0.5629 0.4763 0.0233 -0.0411 0.0065 107 LYS A CG 4085 C CD . LYS C 106 ? 0.7600 0.6303 0.5376 0.0244 -0.0385 0.0058 107 LYS A CD 4086 C CE . LYS C 106 ? 0.7955 0.6856 0.5845 0.0263 -0.0337 0.0060 107 LYS A CE 4087 N NZ . LYS C 106 ? 0.7959 0.6912 0.5849 0.0280 -0.0332 0.0046 107 LYS A NZ 4099 N N . THR C 108 ? 0.2887 0.3498 0.1857 -0.0289 -0.0095 -0.0056 109 THR A N 4100 C CA . THR C 108 ? 0.3141 0.3847 0.2178 -0.0276 -0.0087 -0.0016 109 THR A CA 4101 C C . THR C 108 ? 0.3805 0.4390 0.2829 -0.0243 -0.0090 -0.0024 109 THR A C 4102 O O . THR C 108 ? 0.3034 0.3478 0.2029 -0.0228 -0.0098 -0.0051 109 THR A O 4103 C CB . THR C 108 ? 0.3243 0.4066 0.2389 -0.0227 -0.0089 0.0034 109 THR A CB 4104 O OG1 . THR C 108 ? 0.2904 0.3636 0.2080 -0.0182 -0.0111 0.0040 109 THR A OG1 4105 C CG2 . THR C 108 ? 0.2982 0.3975 0.2156 -0.0258 -0.0080 0.0050 109 THR A CG2 4106 N N . VAL C 109 ? 0.3579 0.4233 0.2622 -0.0225 -0.0081 0.0004 110 VAL A N 4107 C CA . VAL C 109 ? 0.3346 0.3901 0.2374 -0.0179 -0.0085 -0.0003 110 VAL A CA 4108 C C . VAL C 109 ? 0.3591 0.4039 0.2657 -0.0118 -0.0105 0.0002 110 VAL A C 4109 O O . VAL C 109 ? 0.3512 0.4013 0.2638 -0.0093 -0.0114 0.0035 110 VAL A O 4110 C CB . VAL C 109 ? 0.3459 0.4133 0.2487 -0.0151 -0.0071 0.0037 110 VAL A CB 4111 C CG1 . VAL C 109 ? 0.3288 0.3863 0.2295 -0.0080 -0.0077 0.0029 110 VAL A CG1 4112 C CG2 . VAL C 109 ? 0.3891 0.4674 0.2874 -0.0228 -0.0063 0.0048 110 VAL A CG2 4113 N N . ALA C 110 ? 0.3434 0.3736 0.2467 -0.0102 -0.0115 -0.0026 111 ALA A N 4114 C CA . ALA C 110 ? 0.3481 0.3667 0.2534 -0.0056 -0.0143 -0.0016 111 ALA A CA 4115 C C . ALA C 110 ? 0.3532 0.3619 0.2541 -0.0016 -0.0148 -0.0035 111 ALA A C 4116 O O . ALA C 110 ? 0.3471 0.3519 0.2445 -0.0038 -0.0135 -0.0066 111 ALA A O 4117 C CB . ALA C 110 ? 0.2868 0.2982 0.1920 -0.0081 -0.0155 -0.0020 111 ALA A CB 4118 N N . ALA C 111 ? 0.3653 0.3698 0.2659 0.0048 -0.0168 -0.0017 112 ALA A N 4119 C CA . ALA C 111 ? 0.4157 0.4104 0.3107 0.0103 -0.0176 -0.0038 112 ALA A CA 4120 C C . ALA C 111 ? 0.3964 0.3750 0.2894 0.0089 -0.0204 -0.0059 112 ALA A C 4121 O O . ALA C 111 ? 0.4882 0.4613 0.3839 0.0063 -0.0232 -0.0037 112 ALA A O 4122 C CB . ALA C 111 ? 0.3930 0.3852 0.2855 0.0187 -0.0193 -0.0015 112 ALA A CB 4123 N N . PRO C 112 ? 0.3549 0.3280 0.2437 0.0106 -0.0196 -0.0092 113 PRO A N 4124 C CA . PRO C 112 ? 0.3315 0.2906 0.2183 0.0091 -0.0219 -0.0106 113 PRO A CA 4125 C C . PRO C 112 ? 0.4350 0.3790 0.3175 0.0137 -0.0273 -0.0096 113 PRO A C 4126 O O . PRO C 112 ? 0.4375 0.3792 0.3157 0.0209 -0.0285 -0.0100 113 PRO A O 4127 C CB . PRO C 112 ? 0.3023 0.2631 0.1869 0.0100 -0.0191 -0.0140 113 PRO A CB 4128 C CG . PRO C 112 ? 0.2564 0.2280 0.1394 0.0156 -0.0176 -0.0137 113 PRO A CG 4129 C CD . PRO C 112 ? 0.3041 0.2863 0.1906 0.0134 -0.0167 -0.0106 113 PRO A CD 4130 N N . SER C 113 ? 0.3984 0.3321 0.2809 0.0096 -0.0309 -0.0077 114 SER A N 4131 C CA . SER C 113 ? 0.4412 0.3570 0.3173 0.0120 -0.0370 -0.0074 114 SER A CA 4132 C C . SER C 113 ? 0.4431 0.3529 0.3145 0.0131 -0.0358 -0.0116 114 SER A C 4133 O O . SER C 113 ? 0.4316 0.3469 0.3064 0.0081 -0.0322 -0.0119 114 SER A O 4134 C CB . SER C 113 ? 0.4906 0.4004 0.3691 0.0058 -0.0424 -0.0015 114 SER A CB 4135 O OG . SER C 113 ? 0.6327 0.5512 0.5174 0.0049 -0.0434 0.0029 114 SER A OG 4136 N N . VAL C 114 ? 0.3538 0.2526 0.2168 0.0203 -0.0385 -0.0148 115 VAL A N 4137 C CA . VAL C 114 ? 0.4144 0.3102 0.2734 0.0226 -0.0370 -0.0190 115 VAL A CA 4138 C C . VAL C 114 ? 0.4945 0.3702 0.3454 0.0216 -0.0436 -0.0193 115 VAL A C 4139 O O . VAL C 114 ? 0.4103 0.2699 0.2533 0.0245 -0.0502 -0.0185 115 VAL A O 4140 C CB . VAL C 114 ? 0.4369 0.3387 0.2914 0.0331 -0.0346 -0.0225 115 VAL A CB 4141 C CG1 . VAL C 114 ? 0.4917 0.3960 0.3449 0.0352 -0.0324 -0.0261 115 VAL A CG1 4142 C CG2 . VAL C 114 ? 0.4029 0.3246 0.2642 0.0331 -0.0294 -0.0206 115 VAL A CG2 4143 N N . PHE C 115 ? 0.4665 0.3428 0.3188 0.0170 -0.0419 -0.0200 116 PHE A N 4144 C CA . PHE C 115 ? 0.4500 0.3092 0.2946 0.0144 -0.0478 -0.0198 116 PHE A CA 4145 C C . PHE C 115 ? 0.5089 0.3713 0.3519 0.0174 -0.0444 -0.0245 116 PHE A C 4146 O O . PHE C 115 ? 0.4216 0.3010 0.2730 0.0167 -0.0373 -0.0254 116 PHE A O 4147 C CB . PHE C 115 ? 0.4138 0.2728 0.2628 0.0033 -0.0499 -0.0128 116 PHE A CB 4148 C CG . PHE C 115 ? 0.5053 0.3656 0.3580 0.0002 -0.0531 -0.0071 116 PHE A CG 4149 C CD1 . PHE C 115 ? 0.4829 0.3608 0.3452 -0.0009 -0.0472 -0.0054 116 PHE A CD1 4150 C CD2 . PHE C 115 ? 0.5588 0.4025 0.4051 -0.0017 -0.0625 -0.0032 116 PHE A CD2 4151 C CE1 . PHE C 115 ? 0.5066 0.3879 0.3730 -0.0032 -0.0500 0.0001 116 PHE A CE1 4152 C CE2 . PHE C 115 ? 0.5609 0.4084 0.4124 -0.0045 -0.0656 0.0030 116 PHE A CE2 4153 C CZ . PHE C 115 ? 0.4841 0.3516 0.3462 -0.0049 -0.0590 0.0046 116 PHE A CZ 4154 N N . ILE C 116 ? 0.5140 0.3597 0.3460 0.0207 -0.0500 -0.0274 117 ILE A N 4155 C CA . ILE C 116 ? 0.4667 0.3161 0.2976 0.0235 -0.0473 -0.0314 117 ILE A CA 4156 C C . ILE C 116 ? 0.5007 0.3369 0.3263 0.0154 -0.0523 -0.0293 117 ILE A C 4157 O O . ILE C 116 ? 0.5570 0.3741 0.3738 0.0116 -0.0606 -0.0267 117 ILE A O 4158 C CB . ILE C 116 ? 0.4163 0.2615 0.2373 0.0375 -0.0484 -0.0377 117 ILE A CB 4159 C CG1 . ILE C 116 ? 0.4474 0.3046 0.2713 0.0412 -0.0440 -0.0411 117 ILE A CG1 4160 C CG2 . ILE C 116 ? 0.3850 0.2018 0.1885 0.0420 -0.0582 -0.0398 117 ILE A CG2 4161 C CD1 . ILE C 116 ? 0.4558 0.3154 0.2715 0.0566 -0.0441 -0.0460 117 ILE A CD1 4162 N N . PHE C 117 ? 0.4916 0.3389 0.3231 0.0120 -0.0473 -0.0294 118 PHE A N 4163 C CA . PHE C 117 ? 0.5035 0.3426 0.3312 0.0034 -0.0507 -0.0262 118 PHE A CA 4164 C C . PHE C 117 ? 0.5044 0.3451 0.3290 0.0080 -0.0492 -0.0315 118 PHE A C 4165 O O . PHE C 117 ? 0.5295 0.3894 0.3638 0.0118 -0.0414 -0.0338 118 PHE A O 4166 C CB . PHE C 117 ? 0.4977 0.3514 0.3367 -0.0071 -0.0454 -0.0186 118 PHE A CB 4167 C CG . PHE C 117 ? 0.5400 0.3945 0.3823 -0.0116 -0.0469 -0.0125 118 PHE A CG 4168 C CD1 . PHE C 117 ? 0.5239 0.3654 0.3602 -0.0188 -0.0554 -0.0057 118 PHE A CD1 4169 C CD2 . PHE C 117 ? 0.5414 0.4106 0.3929 -0.0090 -0.0403 -0.0129 118 PHE A CD2 4170 C CE1 . PHE C 117 ? 0.5322 0.3776 0.3729 -0.0223 -0.0569 0.0007 118 PHE A CE1 4171 C CE2 . PHE C 117 ? 0.5248 0.3961 0.3794 -0.0125 -0.0416 -0.0075 118 PHE A CE2 4172 C CZ . PHE C 117 ? 0.5147 0.3753 0.3646 -0.0186 -0.0496 -0.0006 118 PHE A CZ 4173 N N . PRO C 118 ? 0.4898 0.3105 0.3006 0.0073 -0.0574 -0.0332 119 PRO A N 4174 C CA . PRO C 118 ? 0.4493 0.2716 0.2565 0.0108 -0.0565 -0.0379 119 PRO A CA 4175 C C . PRO C 118 ? 0.4727 0.3126 0.2918 0.0008 -0.0500 -0.0326 119 PRO A C 4176 O O . PRO C 118 ? 0.5251 0.3694 0.3501 -0.0096 -0.0487 -0.0246 119 PRO A O 4177 C CB . PRO C 118 ? 0.5315 0.3237 0.3187 0.0098 -0.0685 -0.0398 119 PRO A CB 4178 C CG . PRO C 118 ? 0.5591 0.3343 0.3392 0.0108 -0.0752 -0.0382 119 PRO A CG 4179 C CD . PRO C 118 ? 0.4839 0.2782 0.2806 0.0041 -0.0687 -0.0313 119 PRO A CD 4180 N N . PRO C 119 ? 0.4823 0.3334 0.3045 0.0046 -0.0457 -0.0363 120 PRO A N 4181 C CA . PRO C 119 ? 0.4940 0.3592 0.3253 -0.0053 -0.0403 -0.0307 120 PRO A CA 4182 C C . PRO C 119 ? 0.5106 0.3580 0.3299 -0.0157 -0.0487 -0.0260 120 PRO A C 4183 O O . PRO C 119 ? 0.5230 0.3472 0.3259 -0.0127 -0.0585 -0.0305 120 PRO A O 4184 C CB . PRO C 119 ? 0.3839 0.2645 0.2207 0.0028 -0.0349 -0.0364 120 PRO A CB 4185 C CG . PRO C 119 ? 0.4370 0.3020 0.2594 0.0154 -0.0420 -0.0448 120 PRO A CG 4186 C CD . PRO C 119 ? 0.4048 0.2578 0.2224 0.0184 -0.0457 -0.0448 120 PRO A CD 4187 N N . SER C 120 ? 0.4922 0.3497 0.3181 -0.0277 -0.0454 -0.0165 121 SER A N 4188 C CA . SER C 120 ? 0.5048 0.3494 0.3202 -0.0395 -0.0534 -0.0097 121 SER A CA 4189 C C . SER C 120 ? 0.4897 0.3330 0.2993 -0.0394 -0.0546 -0.0138 121 SER A C 4190 O O . SER C 120 ? 0.4965 0.3580 0.3160 -0.0326 -0.0461 -0.0185 121 SER A O 4191 C CB . SER C 120 ? 0.5137 0.3740 0.3381 -0.0512 -0.0485 0.0035 121 SER A CB 4192 O OG . SER C 120 ? 0.4389 0.3232 0.2760 -0.0514 -0.0369 0.0052 121 SER A OG 4193 N N . ASP C 121 ? 0.5155 0.3380 0.3092 -0.0474 -0.0657 -0.0114 122 ASP A N 4194 C CA . ASP C 121 ? 0.4959 0.3164 0.2826 -0.0492 -0.0677 -0.0143 122 ASP A CA 4195 C C . ASP C 121 ? 0.4725 0.3225 0.2748 -0.0567 -0.0566 -0.0064 122 ASP A C 4196 O O . ASP C 121 ? 0.5140 0.3758 0.3200 -0.0532 -0.0519 -0.0108 122 ASP A O 4197 C CB . ASP C 121 ? 0.5903 0.3814 0.3557 -0.0594 -0.0829 -0.0113 122 ASP A CB 4198 C CG . ASP C 121 ? 0.8075 0.5659 0.5540 -0.0497 -0.0942 -0.0215 122 ASP A CG 4199 O OD1 . ASP C 121 ? 0.8283 0.5873 0.5742 -0.0335 -0.0907 -0.0330 122 ASP A OD1 4200 O OD2 . ASP C 121 ? 0.9209 0.6535 0.6526 -0.0579 -0.1069 -0.0171 122 ASP A OD2 4201 N N . GLU C 122 ? 0.4454 0.3082 0.2566 -0.0660 -0.0523 0.0056 123 GLU A N 4202 C CA . GLU C 122 ? 0.5463 0.4365 0.3708 -0.0726 -0.0413 0.0148 123 GLU A CA 4203 C C . GLU C 122 ? 0.5895 0.5029 0.4312 -0.0620 -0.0278 0.0086 123 GLU A C 4204 O O . GLU C 122 ? 0.5775 0.5102 0.4279 -0.0637 -0.0199 0.0108 123 GLU A O 4205 C CB . GLU C 122 ? 0.5625 0.4612 0.3911 -0.0820 -0.0395 0.0292 123 GLU A CB 4206 C CG . GLU C 122 ? 0.6603 0.5866 0.5002 -0.0883 -0.0280 0.0404 123 GLU A CG 4207 C CD . GLU C 122 ? 0.9076 0.8452 0.7520 -0.0928 -0.0242 0.0537 123 GLU A CD 4208 O OE1 . GLU C 122 ? 0.9422 0.8663 0.7812 -0.0927 -0.0315 0.0548 123 GLU A OE1 4209 O OE2 . GLU C 122 ? 1.0069 0.9696 0.8677 -0.0916 -0.0136 0.0593 123 GLU A OE2 4210 N N . GLN C 123 ? 0.5213 0.4339 0.3681 -0.0518 -0.0254 0.0019 124 GLN A N 4211 C CA . GLN C 123 ? 0.4349 0.3689 0.2976 -0.0429 -0.0141 -0.0028 124 GLN A CA 4212 C C . GLN C 123 ? 0.3778 0.3156 0.2407 -0.0346 -0.0143 -0.0122 124 GLN A C 4213 O O . GLN C 123 ? 0.3907 0.3509 0.2671 -0.0324 -0.0053 -0.0122 124 GLN A O 4214 C CB . GLN C 123 ? 0.4141 0.3461 0.2809 -0.0351 -0.0127 -0.0069 124 GLN A CB 4215 C CG . GLN C 123 ? 0.2890 0.2430 0.1720 -0.0285 -0.0018 -0.0096 124 GLN A CG 4216 C CD . GLN C 123 ? 0.3888 0.3401 0.2740 -0.0209 -0.0020 -0.0145 124 GLN A CD 4217 O OE1 . GLN C 123 ? 0.4524 0.3862 0.3274 -0.0183 -0.0098 -0.0175 124 GLN A OE1 4218 N NE2 . GLN C 123 ? 0.3132 0.2818 0.2115 -0.0178 0.0065 -0.0147 124 GLN A NE2 4219 N N . LEU C 124 ? 0.3934 0.3093 0.2408 -0.0293 -0.0248 -0.0199 125 LEU A N 4220 C CA . LEU C 124 ? 0.5359 0.4536 0.3802 -0.0193 -0.0263 -0.0292 125 LEU A CA 4221 C C . LEU C 124 ? 0.5531 0.4848 0.4013 -0.0256 -0.0228 -0.0261 125 LEU A C 4222 O O . LEU C 124 ? 0.5530 0.5001 0.4078 -0.0174 -0.0188 -0.0315 125 LEU A O 4223 C CB . LEU C 124 ? 0.4816 0.3684 0.3038 -0.0133 -0.0392 -0.0369 125 LEU A CB 4224 C CG . LEU C 124 ? 0.5108 0.3866 0.3294 -0.0038 -0.0419 -0.0413 125 LEU A CG 4225 C CD1 . LEU C 124 ? 0.5496 0.3923 0.3444 0.0017 -0.0549 -0.0478 125 LEU A CD1 4226 C CD2 . LEU C 124 ? 0.4688 0.3672 0.3007 0.0095 -0.0340 -0.0463 125 LEU A CD2 4227 N N . LYS C 125 ? 0.4862 0.4149 0.3309 -0.0401 -0.0241 -0.0164 126 LYS A N 4228 C CA . LYS C 125 ? 0.5465 0.4894 0.3944 -0.0479 -0.0207 -0.0116 126 LYS A CA 4229 C C . LYS C 125 ? 0.5675 0.5449 0.4384 -0.0460 -0.0058 -0.0081 126 LYS A C 4230 O O . LYS C 125 ? 0.5868 0.5808 0.4637 -0.0484 -0.0014 -0.0066 126 LYS A O 4231 C CB . LYS C 125 ? 0.5132 0.4476 0.3523 -0.0647 -0.0255 0.0007 126 LYS A CB 4232 C CG . LYS C 125 ? 0.6321 0.5320 0.4473 -0.0691 -0.0417 -0.0018 126 LYS A CG 4233 C CD . LYS C 125 ? 0.8226 0.7145 0.6312 -0.0847 -0.0473 0.0121 126 LYS A CD 4234 C CE . LYS C 125 ? 0.9239 0.8377 0.7388 -0.0981 -0.0413 0.0254 126 LYS A CE 4235 N NZ . LYS C 125 ? 1.0217 0.9287 0.8283 -0.1133 -0.0485 0.0406 126 LYS A NZ 4236 N N . SER C 126 ? 0.4672 0.4548 0.3506 -0.0419 0.0015 -0.0067 127 SER A N 4237 C CA . SER C 126 ? 0.4586 0.4758 0.3628 -0.0398 0.0148 -0.0036 127 SER A CA 4238 C C . SER C 126 ? 0.4772 0.5048 0.3914 -0.0261 0.0172 -0.0127 127 SER A C 4239 O O . SER C 126 ? 0.5440 0.5952 0.4756 -0.0238 0.0269 -0.0106 127 SER A O 4240 C CB . SER C 126 ? 0.4545 0.4778 0.3653 -0.0458 0.0220 0.0062 127 SER A CB 4241 O OG . SER C 126 ? 0.5213 0.5276 0.4257 -0.0428 0.0171 0.0037 127 SER A OG 4242 N N . GLY C 127 ? 0.4232 0.4336 0.3259 -0.0171 0.0083 -0.0217 128 GLY A N 4243 C CA . GLY C 127 ? 0.3909 0.4135 0.3007 -0.0035 0.0092 -0.0294 128 GLY A CA 4244 C C . GLY C 127 ? 0.4499 0.4719 0.3632 0.0043 0.0092 -0.0321 128 GLY A C 4245 O O . GLY C 127 ? 0.4100 0.4452 0.3295 0.0154 0.0098 -0.0366 128 GLY A O 4246 N N . THR C 128 ? 0.4240 0.4325 0.3333 -0.0015 0.0085 -0.0286 129 THR A N 4247 C CA . THR C 128 ? 0.3662 0.3739 0.2783 0.0045 0.0084 -0.0307 129 THR A CA 4248 C C . THR C 128 ? 0.4029 0.3834 0.2983 0.0042 -0.0002 -0.0326 129 THR A C 4249 O O . THR C 128 ? 0.4089 0.3742 0.2952 -0.0047 -0.0037 -0.0287 129 THR A O 4250 C CB . THR C 128 ? 0.4627 0.4843 0.3892 -0.0013 0.0174 -0.0243 129 THR A CB 4251 O OG1 . THR C 128 ? 0.6074 0.6543 0.5501 0.0001 0.0250 -0.0227 129 THR A OG1 4252 C CG2 . THR C 128 ? 0.4310 0.4495 0.3583 0.0029 0.0164 -0.0261 129 THR A CG2 4253 N N . ALA C 129 ? 0.3533 0.3293 0.2448 0.0139 -0.0038 -0.0377 130 ALA A N 4254 C CA . ALA C 129 ? 0.3299 0.2818 0.2070 0.0145 -0.0114 -0.0393 130 ALA A CA 4255 C C . ALA C 129 ? 0.4023 0.3586 0.2860 0.0145 -0.0084 -0.0373 130 ALA A C 4256 O O . ALA C 129 ? 0.4283 0.3990 0.3194 0.0220 -0.0056 -0.0392 130 ALA A O 4257 C CB . ALA C 129 ? 0.3309 0.2698 0.1934 0.0267 -0.0192 -0.0469 130 ALA A CB 4258 N N . SER C 130 ? 0.3043 0.2496 0.1853 0.0059 -0.0091 -0.0326 131 SER A N 4259 C CA . SER C 130 ? 0.3206 0.2677 0.2058 0.0056 -0.0071 -0.0310 131 SER A CA 4260 C C . SER C 130 ? 0.4059 0.3334 0.2785 0.0088 -0.0150 -0.0332 131 SER A C 4261 O O . SER C 130 ? 0.4614 0.3716 0.3244 0.0034 -0.0208 -0.0311 131 SER A O 4262 C CB . SER C 130 ? 0.3127 0.2641 0.2043 -0.0045 -0.0016 -0.0239 131 SER A CB 4263 O OG . SER C 130 ? 0.3067 0.2763 0.2101 -0.0065 0.0066 -0.0216 131 SER A OG 4264 N N . VAL C 131 ? 0.2666 0.1979 0.1397 0.0171 -0.0154 -0.0366 132 VAL A N 4265 C CA . VAL C 131 ? 0.3735 0.2887 0.2361 0.0207 -0.0216 -0.0380 132 VAL A CA 4266 C C . VAL C 131 ? 0.4073 0.3289 0.2770 0.0168 -0.0182 -0.0347 132 VAL A C 4267 O O . VAL C 131 ? 0.4772 0.4157 0.3565 0.0182 -0.0128 -0.0344 132 VAL A O 4268 C CB . VAL C 131 ? 0.3936 0.3080 0.2487 0.0346 -0.0249 -0.0436 132 VAL A CB 4269 C CG1 . VAL C 131 ? 0.3785 0.2717 0.2199 0.0385 -0.0321 -0.0451 132 VAL A CG1 4270 C CG2 . VAL C 131 ? 0.4157 0.3298 0.2659 0.0400 -0.0266 -0.0475 132 VAL A CG2 4271 N N . VAL C 132 ? 0.3860 0.2945 0.2508 0.0115 -0.0218 -0.0316 133 VAL A N 4272 C CA . VAL C 132 ? 0.3901 0.3047 0.2611 0.0074 -0.0186 -0.0283 133 VAL A CA 4273 C C . VAL C 132 ? 0.4274 0.3341 0.2928 0.0118 -0.0231 -0.0293 133 VAL A C 4274 O O . VAL C 132 ? 0.3992 0.2893 0.2548 0.0133 -0.0300 -0.0297 133 VAL A O 4275 C CB . VAL C 132 ? 0.3556 0.2677 0.2283 -0.0027 -0.0176 -0.0219 133 VAL A CB 4276 C CG1 . VAL C 132 ? 0.4199 0.3378 0.2972 -0.0053 -0.0145 -0.0191 133 VAL A CG1 4277 C CG2 . VAL C 132 ? 0.3055 0.2272 0.1839 -0.0067 -0.0119 -0.0199 133 VAL A CG2 4278 N N . CYS C 133 ? 0.4242 0.3428 0.2954 0.0135 -0.0194 -0.0294 134 CYS A N 4279 C CA . CYS C 133 ? 0.3994 0.3148 0.2674 0.0167 -0.0221 -0.0292 134 CYS A CA 4280 C C . CYS C 133 ? 0.4236 0.3434 0.2972 0.0093 -0.0196 -0.0253 134 CYS A C 4281 O O . CYS C 133 ? 0.4540 0.3849 0.3343 0.0056 -0.0143 -0.0246 134 CYS A O 4282 C CB . CYS C 133 ? 0.4382 0.3659 0.3072 0.0253 -0.0204 -0.0316 134 CYS A CB 4283 S SG . CYS C 133 ? 0.6321 0.5572 0.4955 0.0316 -0.0234 -0.0311 134 CYS A SG 4284 N N . LEU C 134 ? 0.4036 0.3142 0.2739 0.0074 -0.0239 -0.0227 135 LEU A N 4285 C CA . LEU C 134 ? 0.3657 0.2813 0.2406 0.0016 -0.0220 -0.0187 135 LEU A CA 4286 C C . LEU C 134 ? 0.3802 0.2996 0.2556 0.0045 -0.0229 -0.0187 135 LEU A C 4287 O O . LEU C 134 ? 0.4266 0.3381 0.2973 0.0089 -0.0276 -0.0189 135 LEU A O 4288 C CB . LEU C 134 ? 0.3047 0.2116 0.1776 -0.0042 -0.0259 -0.0131 135 LEU A CB 4289 C CG . LEU C 134 ? 0.3805 0.2923 0.2567 -0.0080 -0.0258 -0.0080 135 LEU A CG 4290 C CD1 . LEU C 134 ? 0.3207 0.2441 0.2014 -0.0101 -0.0186 -0.0079 135 LEU A CD1 4291 C CD2 . LEU C 134 ? 0.3262 0.2313 0.2002 -0.0131 -0.0313 -0.0006 135 LEU A CD2 4292 N N . LEU C 135 ? 0.3371 0.2680 0.2175 0.0020 -0.0185 -0.0184 136 LEU A N 4293 C CA . LEU C 135 ? 0.3413 0.2782 0.2229 0.0031 -0.0188 -0.0176 136 LEU A CA 4294 C C . LEU C 135 ? 0.3291 0.2678 0.2133 -0.0023 -0.0184 -0.0139 136 LEU A C 4295 O O . LEU C 135 ? 0.3926 0.3364 0.2785 -0.0059 -0.0143 -0.0140 136 LEU A O 4296 C CB . LEU C 135 ? 0.3424 0.2923 0.2264 0.0042 -0.0149 -0.0197 136 LEU A CB 4297 C CG . LEU C 135 ? 0.4198 0.3747 0.3018 0.0114 -0.0153 -0.0216 136 LEU A CG 4298 C CD1 . LEU C 135 ? 0.3747 0.3244 0.2549 0.0141 -0.0156 -0.0238 136 LEU A CD1 4299 C CD2 . LEU C 135 ? 0.3862 0.3569 0.2714 0.0097 -0.0121 -0.0209 136 LEU A CD2 4300 N N . ASN C 136 ? 0.3930 0.3275 0.2770 -0.0022 -0.0228 -0.0104 137 ASN A N 4301 C CA . ASN C 136 ? 0.3987 0.3363 0.2853 -0.0063 -0.0232 -0.0055 137 ASN A CA 4302 C C . ASN C 136 ? 0.3976 0.3450 0.2876 -0.0061 -0.0225 -0.0045 137 ASN A C 4303 O O . ASN C 136 ? 0.4136 0.3620 0.3045 -0.0032 -0.0249 -0.0043 137 ASN A O 4304 C CB . ASN C 136 ? 0.4531 0.3817 0.3383 -0.0079 -0.0295 0.0001 137 ASN A CB 4305 C CG . ASN C 136 ? 0.5129 0.4456 0.3995 -0.0123 -0.0291 0.0064 137 ASN A CG 4306 O OD1 . ASN C 136 ? 0.5485 0.4845 0.4342 -0.0135 -0.0239 0.0056 137 ASN A OD1 4307 N ND2 . ASN C 136 ? 0.5281 0.4617 0.4165 -0.0142 -0.0345 0.0138 137 ASN A ND2 4308 N N . ASN C 137 ? 0.3722 0.3267 0.2631 -0.0087 -0.0191 -0.0037 138 ASN A N 4309 C CA . ASN C 137 ? 0.3395 0.3038 0.2330 -0.0091 -0.0187 -0.0023 138 ASN A CA 4310 C C . ASN C 137 ? 0.3537 0.3246 0.2483 -0.0079 -0.0175 -0.0055 138 ASN A C 4311 O O . ASN C 137 ? 0.3729 0.3482 0.2708 -0.0061 -0.0198 -0.0033 138 ASN A O 4312 C CB . ASN C 137 ? 0.3648 0.3310 0.2622 -0.0089 -0.0236 0.0044 138 ASN A CB 4313 C CG . ASN C 137 ? 0.4673 0.4301 0.3636 -0.0106 -0.0255 0.0100 138 ASN A CG 4314 O OD1 . ASN C 137 ? 0.3503 0.3133 0.2432 -0.0114 -0.0215 0.0095 138 ASN A OD1 4315 N ND2 . ASN C 137 ? 0.5726 0.5324 0.4712 -0.0115 -0.0318 0.0163 138 ASN A ND2 4316 N N . PHE C 138 ? 0.3318 0.3048 0.2239 -0.0092 -0.0140 -0.0098 139 PHE A N 4317 C CA . PHE C 138 ? 0.3634 0.3455 0.2561 -0.0088 -0.0131 -0.0110 139 PHE A CA 4318 C C . PHE C 138 ? 0.4124 0.4009 0.3029 -0.0137 -0.0106 -0.0127 139 PHE A C 4319 O O . PHE C 138 ? 0.3807 0.3638 0.2676 -0.0163 -0.0091 -0.0143 139 PHE A O 4320 C CB . PHE C 138 ? 0.3061 0.2871 0.1973 -0.0057 -0.0128 -0.0129 139 PHE A CB 4321 C CG . PHE C 138 ? 0.3519 0.3293 0.2411 -0.0081 -0.0107 -0.0156 139 PHE A CG 4322 C CD1 . PHE C 138 ? 0.3546 0.3222 0.2431 -0.0071 -0.0110 -0.0163 139 PHE A CD1 4323 C CD2 . PHE C 138 ? 0.4014 0.3860 0.2896 -0.0119 -0.0088 -0.0168 139 PHE A CD2 4324 C CE1 . PHE C 138 ? 0.3760 0.3419 0.2637 -0.0090 -0.0085 -0.0183 139 PHE A CE1 4325 C CE2 . PHE C 138 ? 0.4409 0.4224 0.3279 -0.0142 -0.0072 -0.0187 139 PHE A CE2 4326 C CZ . PHE C 138 ? 0.3799 0.3526 0.2673 -0.0123 -0.0066 -0.0196 139 PHE A CZ 4327 N N . TYR C 139 ? 0.4165 0.4160 0.3080 -0.0149 -0.0104 -0.0119 140 TYR A N 4328 C CA . TYR C 139 ? 0.3499 0.3550 0.2378 -0.0207 -0.0091 -0.0133 140 TYR A CA 4329 C C . TYR C 139 ? 0.3167 0.3356 0.2060 -0.0215 -0.0091 -0.0109 140 TYR A C 4330 O O . TYR C 139 ? 0.3603 0.3862 0.2536 -0.0171 -0.0094 -0.0079 140 TYR A O 4331 C CB . TYR C 139 ? 0.2717 0.2783 0.1586 -0.0225 -0.0092 -0.0133 140 TYR A CB 4332 C CG . TYR C 139 ? 0.3123 0.3208 0.1925 -0.0289 -0.0088 -0.0156 140 TYR A CG 4333 C CD1 . TYR C 139 ? 0.2887 0.3102 0.1696 -0.0327 -0.0093 -0.0138 140 TYR A CD1 4334 C CD2 . TYR C 139 ? 0.3019 0.2984 0.1739 -0.0313 -0.0083 -0.0191 140 TYR A CD2 4335 C CE1 . TYR C 139 ? 0.2873 0.3091 0.1607 -0.0399 -0.0101 -0.0156 140 TYR A CE1 4336 C CE2 . TYR C 139 ? 0.3523 0.3467 0.2157 -0.0376 -0.0091 -0.0216 140 TYR A CE2 4337 C CZ . TYR C 139 ? 0.3801 0.3868 0.2441 -0.0424 -0.0104 -0.0199 140 TYR A CZ 4338 O OH . TYR C 139 ? 0.4618 0.4654 0.3160 -0.0500 -0.0123 -0.0220 140 TYR A OH 4339 N N . PRO C 140 ? 0.3515 0.3748 0.2370 -0.0272 -0.0090 -0.0112 141 PRO A N 4340 C CA . PRO C 140 ? 0.3577 0.3716 0.2375 -0.0328 -0.0092 -0.0144 141 PRO A CA 4341 C C . PRO C 140 ? 0.4610 0.4669 0.3417 -0.0299 -0.0086 -0.0159 141 PRO A C 4342 O O . PRO C 140 ? 0.4692 0.4754 0.3539 -0.0234 -0.0084 -0.0150 141 PRO A O 4343 C CB . PRO C 140 ? 0.3771 0.4018 0.2538 -0.0402 -0.0106 -0.0120 141 PRO A CB 4344 C CG . PRO C 140 ? 0.3631 0.4042 0.2448 -0.0360 -0.0102 -0.0067 141 PRO A CG 4345 C CD . PRO C 140 ? 0.3294 0.3694 0.2157 -0.0289 -0.0091 -0.0068 141 PRO A CD 4346 N N . ARG C 141 ? 0.5242 0.5223 0.4005 -0.0348 -0.0085 -0.0181 142 ARG A N 4347 C CA . ARG C 141 ? 0.5056 0.4962 0.3831 -0.0327 -0.0073 -0.0196 142 ARG A CA 4348 C C . ARG C 141 ? 0.4785 0.4798 0.3608 -0.0302 -0.0080 -0.0170 142 ARG A C 4349 O O . ARG C 141 ? 0.5424 0.5405 0.4277 -0.0254 -0.0070 -0.0178 142 ARG A O 4350 C CB . ARG C 141 ? 0.6367 0.6168 0.5077 -0.0387 -0.0071 -0.0220 142 ARG A CB 4351 C CG . ARG C 141 ? 0.7091 0.6802 0.5811 -0.0364 -0.0048 -0.0236 142 ARG A CG 4352 C CD . ARG C 141 ? 0.8007 0.7583 0.6639 -0.0408 -0.0040 -0.0261 142 ARG A CD 4353 N NE . ARG C 141 ? 0.8099 0.7600 0.6738 -0.0391 -0.0012 -0.0269 142 ARG A NE 4354 C CZ . ARG C 141 ? 0.8627 0.8148 0.7293 -0.0425 -0.0016 -0.0261 142 ARG A CZ 4355 N NH1 . ARG C 141 ? 0.9102 0.8723 0.7788 -0.0477 -0.0054 -0.0238 142 ARG A NH1 4356 N NH2 . ARG C 141 ? 0.8524 0.7987 0.7204 -0.0407 0.0016 -0.0264 142 ARG A NH2 4357 N N . GLU C 142 ? 0.4151 0.4304 0.2975 -0.0333 -0.0098 -0.0132 143 GLU A N 4358 C CA . GLU C 142 ? 0.3924 0.4218 0.2784 -0.0300 -0.0105 -0.0091 143 GLU A CA 4359 C C . GLU C 142 ? 0.4514 0.4821 0.3402 -0.0190 -0.0095 -0.0090 143 GLU A C 4360 O O . GLU C 142 ? 0.4893 0.5215 0.3777 -0.0150 -0.0093 -0.0082 143 GLU A O 4361 C CB . GLU C 142 ? 0.4287 0.4757 0.3137 -0.0348 -0.0126 -0.0030 143 GLU A CB 4362 C CG . GLU C 142 ? 0.6280 0.6759 0.5097 -0.0463 -0.0156 -0.0012 143 GLU A CG 4363 C CD . GLU C 142 ? 0.8182 0.8556 0.6929 -0.0543 -0.0166 -0.0042 143 GLU A CD 4364 O OE1 . GLU C 142 ? 0.7938 0.8291 0.6681 -0.0510 -0.0149 -0.0062 143 GLU A OE1 4365 O OE2 . GLU C 142 ? 0.9256 0.9567 0.7949 -0.0637 -0.0196 -0.0044 143 GLU A OE2 4366 N N . ALA C 143 ? 0.3748 0.4044 0.2659 -0.0141 -0.0091 -0.0099 144 ALA A N 4367 C CA . ALA C 143 ? 0.3408 0.3694 0.2320 -0.0034 -0.0090 -0.0103 144 ALA A CA 4368 C C . ALA C 143 ? 0.3876 0.4239 0.2811 0.0010 -0.0091 -0.0093 144 ALA A C 4369 O O . ALA C 143 ? 0.5098 0.5468 0.4063 -0.0047 -0.0088 -0.0096 144 ALA A O 4370 C CB . ALA C 143 ? 0.3753 0.3858 0.2655 -0.0014 -0.0086 -0.0147 144 ALA A CB 4371 N N . LYS C 144 ? 0.3875 0.4299 0.2792 0.0117 -0.0096 -0.0079 145 LYS A N 4372 C CA . LYS C 144 ? 0.4162 0.4672 0.3097 0.0179 -0.0098 -0.0069 145 LYS A CA 4373 C C . LYS C 144 ? 0.4815 0.5184 0.3711 0.0274 -0.0102 -0.0117 145 LYS A C 4374 O O . LYS C 144 ? 0.5770 0.6060 0.4605 0.0343 -0.0111 -0.0126 145 LYS A O 4375 C CB . LYS C 144 ? 0.4623 0.5372 0.3553 0.0234 -0.0107 0.0005 145 LYS A CB 4376 C CG . LYS C 144 ? 0.5745 0.6623 0.4697 0.0314 -0.0112 0.0026 145 LYS A CG 4377 C CD . LYS C 144 ? 0.6643 0.7811 0.5613 0.0331 -0.0124 0.0126 145 LYS A CD 4378 C CE . LYS C 144 ? 0.7785 0.9045 0.6680 0.0441 -0.0120 0.0171 145 LYS A CE 4379 N NZ . LYS C 144 ? 0.8436 1.0012 0.7346 0.0453 -0.0131 0.0290 145 LYS A NZ 4380 N N . VAL C 145 ? 0.4350 0.4679 0.3276 0.0272 -0.0096 -0.0145 146 VAL A N 4381 C CA . VAL C 145 ? 0.3543 0.3738 0.2424 0.0351 -0.0106 -0.0189 146 VAL A CA 4382 C C . VAL C 145 ? 0.4436 0.4763 0.3328 0.0437 -0.0108 -0.0180 146 VAL A C 4383 O O . VAL C 145 ? 0.4329 0.4782 0.3301 0.0394 -0.0095 -0.0161 146 VAL A O 4384 C CB . VAL C 145 ? 0.4392 0.4420 0.3293 0.0275 -0.0097 -0.0227 146 VAL A CB 4385 C CG1 . VAL C 145 ? 0.4831 0.4719 0.3674 0.0341 -0.0117 -0.0265 146 VAL A CG1 4386 C CG2 . VAL C 145 ? 0.4198 0.4122 0.3089 0.0201 -0.0097 -0.0227 146 VAL A CG2 4387 N N . GLN C 146 ? 0.4677 0.4976 0.3483 0.0567 -0.0127 -0.0191 147 GLN A N 4388 C CA . GLN C 146 ? 0.4959 0.5380 0.3756 0.0675 -0.0131 -0.0187 147 GLN A CA 4389 C C . GLN C 146 ? 0.4441 0.4659 0.3154 0.0743 -0.0152 -0.0252 147 GLN A C 4390 O O . GLN C 146 ? 0.4769 0.4783 0.3380 0.0777 -0.0177 -0.0284 147 GLN A O 4391 C CB . GLN C 146 ? 0.5380 0.5983 0.4123 0.0797 -0.0137 -0.0131 147 GLN A CB 4392 C CG . GLN C 146 ? 0.6367 0.7228 0.5195 0.0732 -0.0126 -0.0046 147 GLN A CG 4393 C CD . GLN C 146 ? 0.7682 0.8742 0.6448 0.0855 -0.0130 0.0027 147 GLN A CD 4394 O OE1 . GLN C 146 ? 0.8445 0.9403 0.7105 0.0941 -0.0131 0.0016 147 GLN A OE1 4395 N NE2 . GLN C 146 ? 0.7985 0.9341 0.6815 0.0866 -0.0132 0.0112 147 GLN A NE2 4396 N N . TRP C 147 ? 0.4221 0.4497 0.2979 0.0756 -0.0145 -0.0269 148 TRP A N 4397 C CA . TRP C 147 ? 0.3741 0.3841 0.2413 0.0817 -0.0169 -0.0329 148 TRP A CA 4398 C C . TRP C 147 ? 0.4213 0.4403 0.2796 0.0993 -0.0187 -0.0332 148 TRP A C 4399 O O . TRP C 147 ? 0.4704 0.5164 0.3353 0.1048 -0.0171 -0.0281 148 TRP A O 4400 C CB . TRP C 147 ? 0.3543 0.3644 0.2309 0.0726 -0.0148 -0.0346 148 TRP A CB 4401 C CG . TRP C 147 ? 0.3621 0.3571 0.2422 0.0582 -0.0136 -0.0352 148 TRP A CG 4402 C CD1 . TRP C 147 ? 0.3313 0.3341 0.2221 0.0468 -0.0101 -0.0321 148 TRP A CD1 4403 C CD2 . TRP C 147 ? 0.3688 0.3387 0.2407 0.0544 -0.0165 -0.0384 148 TRP A CD2 4404 N NE1 . TRP C 147 ? 0.3690 0.3546 0.2585 0.0376 -0.0098 -0.0331 148 TRP A NE1 4405 C CE2 . TRP C 147 ? 0.3895 0.3563 0.2684 0.0414 -0.0139 -0.0362 148 TRP A CE2 4406 C CE3 . TRP C 147 ? 0.3720 0.3214 0.2301 0.0605 -0.0217 -0.0423 148 TRP A CE3 4407 C CZ2 . TRP C 147 ? 0.3911 0.3387 0.2654 0.0345 -0.0161 -0.0365 148 TRP A CZ2 4408 C CZ3 . TRP C 147 ? 0.4124 0.3407 0.2659 0.0521 -0.0247 -0.0428 148 TRP A CZ3 4409 C CH2 . TRP C 147 ? 0.4092 0.3386 0.2715 0.0393 -0.0217 -0.0393 148 TRP A CH2 4410 N N . LYS C 148 ? 0.4169 0.4131 0.2594 0.1084 -0.0227 -0.0387 149 LYS A N 4411 C CA . LYS C 148 ? 0.5373 0.5374 0.3678 0.1270 -0.0248 -0.0404 149 LYS A CA 4412 C C . LYS C 148 ? 0.5710 0.5483 0.3913 0.1295 -0.0285 -0.0479 149 LYS A C 4413 O O . LYS C 148 ? 0.6251 0.5739 0.4377 0.1222 -0.0320 -0.0520 149 LYS A O 4414 C CB . LYS C 148 ? 0.5739 0.5677 0.3894 0.1402 -0.0267 -0.0390 149 LYS A CB 4415 C CG . LYS C 148 ? 0.6580 0.6800 0.4817 0.1411 -0.0231 -0.0301 149 LYS A CG 4416 C CD . LYS C 148 ? 0.7725 0.7864 0.5815 0.1526 -0.0242 -0.0284 149 LYS A CD 4417 C CE . LYS C 148 ? 0.8009 0.8457 0.6172 0.1535 -0.0207 -0.0183 149 LYS A CE 4418 N NZ . LYS C 148 ? 0.8968 0.9351 0.6991 0.1649 -0.0209 -0.0158 149 LYS A NZ 4419 N N . VAL C 149 ? 0.4854 0.4766 0.3057 0.1392 -0.0283 -0.0491 150 VAL A N 4420 C CA . VAL C 149 ? 0.5042 0.4755 0.3128 0.1433 -0.0322 -0.0564 150 VAL A CA 4421 C C . VAL C 149 ? 0.6144 0.5871 0.4056 0.1662 -0.0351 -0.0588 150 VAL A C 4422 O O . VAL C 149 ? 0.6431 0.6467 0.4439 0.1755 -0.0324 -0.0538 150 VAL A O 4423 C CB . VAL C 149 ? 0.4591 0.4453 0.2837 0.1336 -0.0291 -0.0563 150 VAL A CB 4424 C CG1 . VAL C 149 ? 0.5369 0.5042 0.3486 0.1380 -0.0334 -0.0635 150 VAL A CG1 4425 C CG2 . VAL C 149 ? 0.3744 0.3579 0.2137 0.1128 -0.0259 -0.0536 150 VAL A CG2 4426 N N . ASP C 150 ? 0.6947 0.6352 0.4674 0.1725 -0.0410 -0.0630 151 ASP A N 4427 C CA . ASP C 150 ? 0.7512 0.6899 0.5113 0.1926 -0.0441 -0.0619 151 ASP A CA 4428 C C . ASP C 150 ? 0.7675 0.7361 0.5333 0.2031 -0.0396 -0.0539 151 ASP A C 4429 O O . ASP C 150 ? 0.8124 0.8048 0.5815 0.2180 -0.0387 -0.0492 151 ASP A O 4430 C CB . ASP C 150 ? 0.7498 0.6964 0.5108 0.2008 -0.0461 -0.0633 151 ASP A CB 4431 C CG . ASP C 150 ? 0.7395 0.6521 0.4888 0.1941 -0.0521 -0.0704 151 ASP A CG 4432 O OD1 . ASP C 150 ? 0.6827 0.5639 0.4213 0.1851 -0.0560 -0.0734 151 ASP A OD1 4433 O OD2 . ASP C 150 ? 0.8051 0.7234 0.5561 0.1974 -0.0534 -0.0722 151 ASP A OD2 4434 N N . ASN C 151 ? 0.7030 0.6723 0.4710 0.1945 -0.0369 -0.0515 152 ASN A N 4435 C CA . ASN C 151 ? 0.7037 0.6996 0.4769 0.2010 -0.0328 -0.0428 152 ASN A CA 4436 C C . ASN C 151 ? 0.6792 0.7182 0.4743 0.1985 -0.0280 -0.0347 152 ASN A C 4437 O O . ASN C 151 ? 0.7349 0.8006 0.5386 0.2039 -0.0244 -0.0260 152 ASN A O 4438 C CB . ASN C 151 ? 0.7620 0.7520 0.5204 0.2224 -0.0348 -0.0408 152 ASN A CB 4439 C CG . ASN C 151 ? 0.9013 0.9084 0.6623 0.2264 -0.0304 -0.0328 152 ASN A CG 4440 O OD1 . ASN C 151 ? 0.9165 0.9312 0.6860 0.2117 -0.0279 -0.0295 152 ASN A OD1 4441 N ND2 . ASN C 151 ? 0.9845 0.9980 0.7386 0.2462 -0.0289 -0.0295 152 ASN A ND2 4442 N N . ALA C 152 ? 0.5732 0.6191 0.3791 0.1890 -0.0275 -0.0372 153 ALA A N 4443 C CA . ALA C 152 ? 0.5449 0.6296 0.3725 0.1840 -0.0236 -0.0294 153 ALA A CA 4444 C C . ALA C 152 ? 0.5830 0.6713 0.4245 0.1624 -0.0213 -0.0267 153 ALA A C 4445 O O . ALA C 152 ? 0.6325 0.6992 0.4777 0.1483 -0.0213 -0.0324 153 ALA A O 4446 C CB . ALA C 152 ? 0.5214 0.6153 0.3563 0.1871 -0.0239 -0.0322 153 ALA A CB 4447 N N . LEU C 153 ? 0.5073 0.6223 0.3593 0.1589 -0.0192 -0.0170 154 LEU A N 4448 C CA . LEU C 153 ? 0.5033 0.6210 0.3709 0.1381 -0.0170 -0.0138 154 LEU A CA 4449 C C . LEU C 153 ? 0.5215 0.6477 0.4056 0.1264 -0.0154 -0.0145 154 LEU A C 4450 O O . LEU C 153 ? 0.4675 0.6200 0.3599 0.1323 -0.0152 -0.0102 154 LEU A O 4451 C CB . LEU C 153 ? 0.5293 0.6750 0.4028 0.1371 -0.0162 -0.0025 154 LEU A CB 4452 C CG . LEU C 153 ? 0.5584 0.7062 0.4452 0.1164 -0.0148 0.0010 154 LEU A CG 4453 C CD1 . LEU C 153 ? 0.5115 0.6282 0.3913 0.1080 -0.0145 -0.0052 154 LEU A CD1 4454 C CD2 . LEU C 153 ? 0.5565 0.7362 0.4493 0.1153 -0.0151 0.0134 154 LEU A CD2 4455 N N . GLN C 154 ? 0.4926 0.5980 0.3815 0.1104 -0.0141 -0.0191 155 GLN A N 4456 C CA . GLN C 154 ? 0.3944 0.5046 0.2978 0.0991 -0.0117 -0.0199 155 GLN A CA 4457 C C . GLN C 154 ? 0.4387 0.5653 0.3569 0.0852 -0.0098 -0.0129 155 GLN A C 4458 O O . GLN C 154 ? 0.5144 0.6362 0.4306 0.0787 -0.0101 -0.0105 155 GLN A O 4459 C CB . GLN C 154 ? 0.3303 0.4097 0.2292 0.0903 -0.0112 -0.0277 155 GLN A CB 4460 C CG . GLN C 154 ? 0.3819 0.4404 0.2644 0.1013 -0.0146 -0.0347 155 GLN A CG 4461 C CD . GLN C 154 ? 0.4065 0.4780 0.2901 0.1114 -0.0148 -0.0363 155 GLN A CD 4462 O OE1 . GLN C 154 ? 0.4179 0.4947 0.3124 0.1038 -0.0124 -0.0370 155 GLN A OE1 4463 N NE2 . GLN C 154 ? 0.4583 0.5365 0.3306 0.1294 -0.0175 -0.0366 155 GLN A NE2 4464 N N . SER C 155 ? 0.4148 0.5597 0.3474 0.0806 -0.0082 -0.0098 156 SER A N 4465 C CA . SER C 155 ? 0.4099 0.5687 0.3556 0.0674 -0.0073 -0.0031 156 SER A CA 4466 C C . SER C 155 ? 0.4057 0.5644 0.3639 0.0577 -0.0041 -0.0044 156 SER A C 4467 O O . SER C 155 ? 0.5488 0.7180 0.5125 0.0638 -0.0031 -0.0054 156 SER A O 4468 C CB . SER C 155 ? 0.4961 0.6891 0.4481 0.0733 -0.0100 0.0074 156 SER A CB 4469 O OG . SER C 155 ? 0.6250 0.8296 0.5884 0.0592 -0.0107 0.0144 156 SER A OG 4470 N N . GLY C 156 ? 0.3373 0.4843 0.2993 0.0433 -0.0023 -0.0043 157 GLY A N 4471 C CA . GLY C 156 ? 0.3173 0.4652 0.2907 0.0342 0.0012 -0.0041 157 GLY A CA 4472 C C . GLY C 156 ? 0.4065 0.5331 0.3764 0.0321 0.0051 -0.0111 157 GLY A C 4473 O O . GLY C 156 ? 0.4521 0.5774 0.4301 0.0241 0.0090 -0.0106 157 GLY A O 4474 N N . ASN C 157 ? 0.3269 0.4372 0.2845 0.0389 0.0039 -0.0167 158 ASN A N 4475 C CA . ASN C 157 ? 0.3570 0.4486 0.3106 0.0363 0.0065 -0.0219 158 ASN A CA 4476 C C . ASN C 157 ? 0.3626 0.4275 0.3048 0.0308 0.0060 -0.0251 158 ASN A C 4477 O O . ASN C 157 ? 0.3702 0.4188 0.3046 0.0314 0.0055 -0.0288 158 ASN A O 4478 C CB . ASN C 157 ? 0.3037 0.3971 0.2520 0.0477 0.0046 -0.0257 158 ASN A CB 4479 C CG . ASN C 157 ? 0.3358 0.4252 0.2711 0.0597 -0.0005 -0.0276 158 ASN A CG 4480 O OD1 . ASN C 157 ? 0.3422 0.4296 0.2735 0.0590 -0.0021 -0.0255 158 ASN A OD1 4481 N ND2 . ASN C 157 ? 0.3523 0.4399 0.2796 0.0710 -0.0029 -0.0315 158 ASN A ND2 4482 N N . SER C 158 ? 0.4051 0.4663 0.3463 0.0249 0.0056 -0.0230 159 SER A N 4483 C CA . SER C 158 ? 0.3551 0.3942 0.2874 0.0194 0.0055 -0.0250 159 SER A CA 4484 C C . SER C 158 ? 0.3217 0.3584 0.2575 0.0093 0.0081 -0.0225 159 SER A C 4485 O O . SER C 158 ? 0.3120 0.3619 0.2543 0.0066 0.0081 -0.0192 159 SER A O 4486 C CB . SER C 158 ? 0.4328 0.4647 0.3548 0.0256 0.0010 -0.0264 159 SER A CB 4487 O OG . SER C 158 ? 0.5150 0.5614 0.4396 0.0267 -0.0004 -0.0228 159 SER A OG 4488 N N . GLN C 159 ? 0.2979 0.3174 0.2283 0.0039 0.0098 -0.0236 160 GLN A N 4489 C CA . GLN C 159 ? 0.3149 0.3287 0.2451 -0.0039 0.0122 -0.0220 160 GLN A CA 4490 C C . GLN C 159 ? 0.3037 0.3024 0.2245 -0.0054 0.0103 -0.0231 160 GLN A C 4491 O O . GLN C 159 ? 0.3721 0.3612 0.2877 -0.0031 0.0089 -0.0242 160 GLN A O 4492 C CB . GLN C 159 ? 0.3558 0.3673 0.2898 -0.0085 0.0177 -0.0206 160 GLN A CB 4493 C CG . GLN C 159 ? 0.3673 0.3951 0.3126 -0.0086 0.0202 -0.0186 160 GLN A CG 4494 C CD . GLN C 159 ? 0.4390 0.4641 0.3875 -0.0129 0.0265 -0.0166 160 GLN A CD 4495 O OE1 . GLN C 159 ? 0.4203 0.4439 0.3689 -0.0118 0.0293 -0.0164 160 GLN A OE1 4496 N NE2 . GLN C 159 ? 0.3623 0.3863 0.3124 -0.0178 0.0286 -0.0147 160 GLN A NE2 4497 N N . GLU C 160 ? 0.3264 0.3230 0.2450 -0.0097 0.0099 -0.0223 161 GLU A N 4498 C CA . GLU C 160 ? 0.3558 0.3408 0.2667 -0.0110 0.0083 -0.0230 161 GLU A CA 4499 C C . GLU C 160 ? 0.3968 0.3720 0.3040 -0.0161 0.0117 -0.0222 161 GLU A C 4500 O O . GLU C 160 ? 0.2981 0.2743 0.2072 -0.0195 0.0147 -0.0215 161 GLU A O 4501 C CB . GLU C 160 ? 0.3094 0.3001 0.2186 -0.0110 0.0048 -0.0226 161 GLU A CB 4502 C CG . GLU C 160 ? 0.5392 0.5384 0.4488 -0.0036 0.0015 -0.0227 161 GLU A CG 4503 C CD . GLU C 160 ? 0.6464 0.6534 0.5540 -0.0035 -0.0013 -0.0208 161 GLU A CD 4504 O OE1 . GLU C 160 ? 0.6773 0.6838 0.5839 -0.0104 -0.0012 -0.0197 161 GLU A OE1 4505 O OE2 . GLU C 160 ? 0.6924 0.7057 0.5984 0.0039 -0.0035 -0.0202 161 GLU A OE2 4506 N N . SER C 161 ? 0.3405 0.3062 0.2418 -0.0159 0.0111 -0.0219 162 SER A N 4507 C CA . SER C 161 ? 0.3228 0.2803 0.2186 -0.0187 0.0138 -0.0206 162 SER A CA 4508 C C . SER C 161 ? 0.3418 0.2951 0.2325 -0.0183 0.0105 -0.0207 162 SER A C 4509 O O . SER C 161 ? 0.4000 0.3537 0.2913 -0.0158 0.0071 -0.0205 162 SER A O 4510 C CB . SER C 161 ? 0.4192 0.3732 0.3142 -0.0182 0.0176 -0.0175 162 SER A CB 4511 O OG . SER C 161 ? 0.4454 0.3929 0.3336 -0.0190 0.0205 -0.0154 162 SER A OG 4512 N N . VAL C 162 ? 0.3651 0.3140 0.2502 -0.0206 0.0114 -0.0211 163 VAL A N 4513 C CA . VAL C 162 ? 0.4174 0.3646 0.2985 -0.0203 0.0086 -0.0210 163 VAL A CA 4514 C C . VAL C 162 ? 0.4152 0.3555 0.2889 -0.0198 0.0111 -0.0193 163 VAL A C 4515 O O . VAL C 162 ? 0.3896 0.3246 0.2586 -0.0204 0.0147 -0.0197 163 VAL A O 4516 C CB . VAL C 162 ? 0.3789 0.3303 0.2595 -0.0231 0.0059 -0.0232 163 VAL A CB 4517 C CG1 . VAL C 162 ? 0.4899 0.4375 0.3667 -0.0274 0.0074 -0.0246 163 VAL A CG1 4518 C CG2 . VAL C 162 ? 0.2957 0.2470 0.1727 -0.0229 0.0035 -0.0230 163 VAL A CG2 4519 N N . THR C 163 ? 0.3605 0.3013 0.2327 -0.0177 0.0092 -0.0167 164 THR A N 4520 C CA . THR C 163 ? 0.3612 0.2986 0.2261 -0.0156 0.0113 -0.0139 164 THR A CA 4521 C C . THR C 163 ? 0.4283 0.3621 0.2860 -0.0165 0.0108 -0.0175 164 THR A C 4522 O O . THR C 163 ? 0.4793 0.4151 0.3388 -0.0198 0.0081 -0.0209 164 THR A O 4523 C CB . THR C 163 ? 0.3140 0.2559 0.1806 -0.0133 0.0086 -0.0084 164 THR A CB 4524 O OG1 . THR C 163 ? 0.4079 0.3538 0.2781 -0.0140 0.0041 -0.0099 164 THR A OG1 4525 C CG2 . THR C 163 ? 0.2858 0.2290 0.1573 -0.0136 0.0078 -0.0044 164 THR A CG2 4526 N N . GLU C 164 ? 0.4136 0.3427 0.2619 -0.0132 0.0132 -0.0161 165 GLU A N 4527 C CA . GLU C 164 ? 0.3677 0.2925 0.2071 -0.0130 0.0120 -0.0193 165 GLU A CA 4528 C C . GLU C 164 ? 0.4332 0.3676 0.2774 -0.0123 0.0082 -0.0175 165 GLU A C 4529 O O . GLU C 164 ? 0.4036 0.3457 0.2559 -0.0110 0.0067 -0.0129 165 GLU A O 4530 C CB . GLU C 164 ? 0.4190 0.3355 0.2452 -0.0074 0.0158 -0.0181 165 GLU A CB 4531 C CG . GLU C 164 ? 0.4878 0.3940 0.3086 -0.0073 0.0203 -0.0192 165 GLU A CG 4532 C CD . GLU C 164 ? 0.6570 0.5520 0.4722 -0.0129 0.0186 -0.0257 165 GLU A CD 4533 O OE1 . GLU C 164 ? 0.6116 0.5035 0.4212 -0.0154 0.0147 -0.0293 165 GLU A OE1 4534 O OE2 . GLU C 164 ? 0.7502 0.6404 0.5669 -0.0154 0.0206 -0.0264 165 GLU A OE2 4535 N N . GLN C 165 ? 0.4764 0.4103 0.3154 -0.0137 0.0062 -0.0208 166 GLN A N 4536 C CA . GLN C 165 ? 0.4780 0.4227 0.3220 -0.0128 0.0031 -0.0187 166 GLN A CA 4537 C C . GLN C 165 ? 0.4324 0.3832 0.2764 -0.0064 0.0035 -0.0123 166 GLN A C 4538 O O . GLN C 165 ? 0.4970 0.4436 0.3308 -0.0014 0.0060 -0.0112 166 GLN A O 4539 C CB . GLN C 165 ? 0.4343 0.3777 0.2710 -0.0153 0.0013 -0.0231 166 GLN A CB 4540 C CG . GLN C 165 ? 0.4148 0.3631 0.2570 -0.0222 -0.0013 -0.0255 166 GLN A CG 4541 C CD . GLN C 165 ? 0.4659 0.4163 0.3020 -0.0253 -0.0035 -0.0281 166 GLN A CD 4542 O OE1 . GLN C 165 ? 0.4562 0.3953 0.2790 -0.0265 -0.0037 -0.0319 166 GLN A OE1 4543 N NE2 . GLN C 165 ? 0.2891 0.2536 0.1340 -0.0266 -0.0054 -0.0260 166 GLN A NE2 4544 N N . ASP C 166 ? 0.4247 0.3855 0.2795 -0.0063 0.0007 -0.0073 167 ASP A N 4545 C CA . ASP C 166 ? 0.4700 0.4399 0.3271 -0.0017 -0.0006 0.0007 167 ASP A CA 4546 C C . ASP C 166 ? 0.4882 0.4634 0.3385 0.0028 -0.0005 0.0009 167 ASP A C 4547 O O . ASP C 166 ? 0.5088 0.4856 0.3588 0.0006 -0.0018 -0.0039 167 ASP A O 4548 C CB . ASP C 166 ? 0.4373 0.4153 0.3066 -0.0038 -0.0053 0.0052 167 ASP A CB 4549 C CG . ASP C 166 ? 0.6277 0.6155 0.5005 -0.0007 -0.0079 0.0154 167 ASP A CG 4550 O OD1 . ASP C 166 ? 0.5794 0.5786 0.4547 0.0019 -0.0101 0.0191 167 ASP A OD1 4551 O OD2 . ASP C 166 ? 0.7840 0.7696 0.6575 -0.0013 -0.0082 0.0206 167 ASP A OD2 4552 N N . SER C 167 ? 0.5495 0.5289 0.3940 0.0095 0.0010 0.0071 168 SER A N 4553 C CA . SER C 167 ? 0.5350 0.5179 0.3697 0.0160 0.0018 0.0066 168 SER A CA 4554 C C . SER C 167 ? 0.5236 0.5239 0.3674 0.0171 -0.0024 0.0109 168 SER A C 4555 O O . SER C 167 ? 0.5669 0.5714 0.4042 0.0214 -0.0024 0.0089 168 SER A O 4556 C CB . SER C 167 ? 0.4900 0.4735 0.3140 0.0249 0.0053 0.0130 168 SER A CB 4557 O OG . SER C 167 ? 0.5545 0.5526 0.3878 0.0263 0.0033 0.0248 168 SER A OG 4558 N N . LYS C 168 ? 0.5211 0.5308 0.3795 0.0133 -0.0061 0.0166 169 LYS A N 4559 C CA . LYS C 168 ? 0.5287 0.5556 0.3977 0.0139 -0.0104 0.0217 169 LYS A CA 4560 C C . LYS C 168 ? 0.4103 0.4373 0.2876 0.0075 -0.0122 0.0159 169 LYS A C 4561 O O . LYS C 168 ? 0.4134 0.4507 0.2934 0.0081 -0.0131 0.0148 169 LYS A O 4562 C CB . LYS C 168 ? 0.5623 0.6008 0.4413 0.0145 -0.0145 0.0340 169 LYS A CB 4563 C CG . LYS C 168 ? 0.7324 0.7818 0.6055 0.0224 -0.0138 0.0437 169 LYS A CG 4564 C CD . LYS C 168 ? 0.8455 0.9055 0.7278 0.0206 -0.0187 0.0573 169 LYS A CD 4565 C CE . LYS C 168 ? 0.8980 0.9718 0.7738 0.0288 -0.0177 0.0689 169 LYS A CE 4566 N NZ . LYS C 168 ? 0.8689 0.9455 0.7581 0.0236 -0.0218 0.0782 169 LYS A NZ 4567 N N . ASP C 169 ? 0.3524 0.3696 0.2336 0.0021 -0.0124 0.0128 170 ASP A N 4568 C CA . ASP C 169 ? 0.3151 0.3347 0.2039 -0.0023 -0.0140 0.0094 170 ASP A CA 4569 C C . ASP C 169 ? 0.3145 0.3231 0.1970 -0.0066 -0.0112 0.0005 170 ASP A C 4570 O O . ASP C 169 ? 0.3923 0.4041 0.2797 -0.0099 -0.0118 -0.0017 170 ASP A O 4571 C CB . ASP C 169 ? 0.3638 0.3840 0.2629 -0.0039 -0.0179 0.0146 170 ASP A CB 4572 C CG . ASP C 169 ? 0.3817 0.3876 0.2774 -0.0056 -0.0174 0.0133 170 ASP A CG 4573 O OD1 . ASP C 169 ? 0.5071 0.5037 0.3950 -0.0063 -0.0135 0.0077 170 ASP A OD1 4574 O OD2 . ASP C 169 ? 0.5217 0.5254 0.4227 -0.0065 -0.0213 0.0182 170 ASP A OD2 4575 N N . SER C 170 ? 0.3223 0.3191 0.1941 -0.0063 -0.0082 -0.0034 171 SER A N 4576 C CA . SER C 170 ? 0.3023 0.2892 0.1669 -0.0109 -0.0063 -0.0109 171 SER A CA 4577 C C . SER C 170 ? 0.3807 0.3648 0.2512 -0.0148 -0.0067 -0.0124 171 SER A C 4578 O O . SER C 170 ? 0.3539 0.3365 0.2222 -0.0192 -0.0065 -0.0164 171 SER A O 4579 C CB . SER C 170 ? 0.2577 0.2500 0.1188 -0.0135 -0.0070 -0.0144 171 SER A CB 4580 O OG . SER C 170 ? 0.3808 0.3739 0.2336 -0.0089 -0.0066 -0.0143 171 SER A OG 4581 N N . THR C 171 ? 0.3747 0.3585 0.2519 -0.0130 -0.0079 -0.0085 172 THR A N 4582 C CA . THR C 171 ? 0.3358 0.3165 0.2170 -0.0147 -0.0084 -0.0100 172 THR A CA 4583 C C . THR C 171 ? 0.3625 0.3329 0.2397 -0.0153 -0.0061 -0.0120 172 THR A C 4584 O O . THR C 171 ? 0.3726 0.3381 0.2445 -0.0138 -0.0041 -0.0111 172 THR A O 4585 C CB . THR C 171 ? 0.4012 0.3849 0.2905 -0.0125 -0.0118 -0.0054 172 THR A CB 4586 O OG1 . THR C 171 ? 0.3813 0.3623 0.2708 -0.0108 -0.0131 -0.0003 172 THR A OG1 4587 C CG2 . THR C 171 ? 0.3287 0.3238 0.2235 -0.0120 -0.0138 -0.0030 172 THR A CG2 4588 N N . TYR C 172 ? 0.3275 0.2961 0.2071 -0.0165 -0.0062 -0.0142 173 TYR A N 4589 C CA . TYR C 172 ? 0.3114 0.2728 0.1893 -0.0169 -0.0041 -0.0157 173 TYR A CA 4590 C C . TYR C 172 ? 0.3619 0.3210 0.2442 -0.0145 -0.0060 -0.0135 173 TYR A C 4591 O O . TYR C 172 ? 0.3533 0.3150 0.2392 -0.0127 -0.0091 -0.0121 173 TYR A O 4592 C CB . TYR C 172 ? 0.3604 0.3228 0.2374 -0.0200 -0.0033 -0.0194 173 TYR A CB 4593 C CG . TYR C 172 ? 0.3689 0.3302 0.2395 -0.0241 -0.0026 -0.0219 173 TYR A CG 4594 C CD1 . TYR C 172 ? 0.3112 0.2629 0.1748 -0.0255 -0.0002 -0.0238 173 TYR A CD1 4595 C CD2 . TYR C 172 ? 0.2668 0.2355 0.1369 -0.0267 -0.0044 -0.0221 173 TYR A CD2 4596 C CE1 . TYR C 172 ? 0.3225 0.2694 0.1776 -0.0294 -0.0006 -0.0265 173 TYR A CE1 4597 C CE2 . TYR C 172 ? 0.2742 0.2401 0.1367 -0.0315 -0.0048 -0.0244 173 TYR A CE2 4598 C CZ . TYR C 172 ? 0.3757 0.3291 0.2298 -0.0329 -0.0033 -0.0270 173 TYR A CZ 4599 O OH . TYR C 172 ? 0.4436 0.3904 0.2875 -0.0378 -0.0047 -0.0298 173 TYR A OH 4600 N N . SER C 173 ? 0.3006 0.2542 0.1818 -0.0145 -0.0041 -0.0130 174 SER A N 4601 C CA . SER C 173 ? 0.3217 0.2719 0.2056 -0.0131 -0.0060 -0.0121 174 SER A CA 4602 C C . SER C 173 ? 0.3880 0.3371 0.2722 -0.0136 -0.0031 -0.0153 174 SER A C 4603 O O . SER C 173 ? 0.4371 0.3855 0.3191 -0.0155 0.0007 -0.0163 174 SER A O 4604 C CB . SER C 173 ? 0.3609 0.3078 0.2443 -0.0131 -0.0076 -0.0064 174 SER A CB 4605 O OG . SER C 173 ? 0.3917 0.3408 0.2769 -0.0125 -0.0120 -0.0025 174 SER A OG 4606 N N . LEU C 174 ? 0.3767 0.3257 0.2630 -0.0113 -0.0050 -0.0169 175 LEU A N 4607 C CA . LEU C 174 ? 0.3002 0.2516 0.1882 -0.0110 -0.0027 -0.0194 175 LEU A CA 4608 C C . LEU C 174 ? 0.3963 0.3434 0.2847 -0.0083 -0.0044 -0.0193 175 LEU A C 4609 O O . LEU C 174 ? 0.3579 0.2997 0.2442 -0.0057 -0.0087 -0.0186 175 LEU A O 4610 C CB . LEU C 174 ? 0.2518 0.2118 0.1414 -0.0099 -0.0033 -0.0215 175 LEU A CB 4611 C CG . LEU C 174 ? 0.3162 0.2832 0.2089 -0.0096 -0.0016 -0.0228 175 LEU A CG 4612 C CD1 . LEU C 174 ? 0.3172 0.2939 0.2106 -0.0122 -0.0020 -0.0225 175 LEU A CD1 4613 C CD2 . LEU C 174 ? 0.2928 0.2616 0.1865 -0.0033 -0.0036 -0.0236 175 LEU A CD2 4614 N N . SER C 175 ? 0.3868 0.3355 0.2773 -0.0091 -0.0013 -0.0199 176 SER A N 4615 C CA . SER C 175 ? 0.4097 0.3559 0.3003 -0.0066 -0.0027 -0.0206 176 SER A CA 4616 C C . SER C 175 ? 0.4258 0.3813 0.3207 -0.0040 -0.0007 -0.0233 176 SER A C 4617 O O . SER C 175 ? 0.3622 0.3247 0.2608 -0.0067 0.0028 -0.0233 176 SER A O 4618 C CB . SER C 175 ? 0.4292 0.3711 0.3192 -0.0101 -0.0009 -0.0171 176 SER A CB 4619 O OG . SER C 175 ? 0.5175 0.4655 0.4111 -0.0122 0.0051 -0.0169 176 SER A OG 4620 N N . SER C 176 ? 0.2297 0.1852 0.1233 0.0016 -0.0036 -0.0253 177 SER A N 4621 C CA . SER C 176 ? 0.2695 0.2362 0.1675 0.0053 -0.0021 -0.0269 177 SER A CA 4622 C C . SER C 176 ? 0.3398 0.3023 0.2366 0.0075 -0.0028 -0.0280 177 SER A C 4623 O O . SER C 176 ? 0.3531 0.3036 0.2426 0.0101 -0.0072 -0.0290 177 SER A O 4624 C CB . SER C 176 ? 0.2714 0.2460 0.1680 0.0122 -0.0047 -0.0278 177 SER A CB 4625 O OG . SER C 176 ? 0.3601 0.3487 0.2614 0.0166 -0.0037 -0.0280 177 SER A OG 4626 N N . THR C 177 ? 0.3469 0.3186 0.2503 0.0059 0.0013 -0.0276 178 THR A N 4627 C CA . THR C 177 ? 0.3646 0.3341 0.2676 0.0069 0.0013 -0.0282 178 THR A CA 4628 C C . THR C 177 ? 0.3549 0.3380 0.2624 0.0137 0.0016 -0.0303 178 THR A C 4629 O O . THR C 177 ? 0.3335 0.3319 0.2503 0.0126 0.0053 -0.0288 178 THR A O 4630 C CB . THR C 177 ? 0.4256 0.3959 0.3328 -0.0006 0.0065 -0.0247 178 THR A CB 4631 O OG1 . THR C 177 ? 0.4494 0.4092 0.3517 -0.0055 0.0060 -0.0217 178 THR A OG1 4632 C CG2 . THR C 177 ? 0.3487 0.3182 0.2553 -0.0005 0.0064 -0.0246 178 THR A CG2 4633 N N . LEU C 178 ? 0.3481 0.3255 0.2483 0.0210 -0.0029 -0.0334 179 LEU A N 4634 C CA . LEU C 178 ? 0.2971 0.2877 0.2000 0.0294 -0.0030 -0.0354 179 LEU A CA 4635 C C . LEU C 178 ? 0.3807 0.3725 0.2864 0.0269 -0.0010 -0.0357 179 LEU A C 4636 O O . LEU C 178 ? 0.3537 0.3293 0.2508 0.0245 -0.0040 -0.0368 179 LEU A O 4637 C CB . LEU C 178 ? 0.3169 0.2999 0.2079 0.0408 -0.0089 -0.0389 179 LEU A CB 4638 C CG . LEU C 178 ? 0.4226 0.4184 0.3129 0.0526 -0.0099 -0.0411 179 LEU A CG 4639 C CD1 . LEU C 178 ? 0.2507 0.2732 0.1521 0.0563 -0.0071 -0.0372 179 LEU A CD1 4640 C CD2 . LEU C 178 ? 0.3116 0.2913 0.1848 0.0643 -0.0162 -0.0453 179 LEU A CD2 4641 N N . THR C 179 ? 0.3346 0.3462 0.2525 0.0266 0.0037 -0.0340 180 THR A N 4642 C CA . THR C 179 ? 0.2877 0.3040 0.2102 0.0241 0.0066 -0.0337 180 THR A CA 4643 C C . THR C 179 ? 0.3402 0.3688 0.2633 0.0345 0.0047 -0.0367 180 THR A C 4644 O O . THR C 179 ? 0.2671 0.3164 0.1992 0.0403 0.0059 -0.0354 180 THR A O 4645 C CB . THR C 179 ? 0.3865 0.4165 0.3228 0.0162 0.0140 -0.0291 180 THR A CB 4646 O OG1 . THR C 179 ? 0.4637 0.4809 0.3968 0.0078 0.0158 -0.0265 180 THR A OG1 4647 C CG2 . THR C 179 ? 0.3727 0.4112 0.3150 0.0143 0.0177 -0.0281 180 THR A CG2 4648 N N . LEU C 180 ? 0.3181 0.3341 0.2309 0.0370 0.0010 -0.0402 181 LEU A N 4649 C CA . LEU C 180 ? 0.3078 0.3328 0.2183 0.0480 -0.0013 -0.0438 181 LEU A CA 4650 C C . LEU C 180 ? 0.3147 0.3434 0.2287 0.0432 0.0012 -0.0437 181 LEU A C 4651 O O . LEU C 180 ? 0.3312 0.3492 0.2442 0.0320 0.0028 -0.0411 181 LEU A O 4652 C CB . LEU C 180 ? 0.3404 0.3444 0.2310 0.0579 -0.0093 -0.0493 181 LEU A CB 4653 C CG . LEU C 180 ? 0.4512 0.4513 0.3363 0.0641 -0.0118 -0.0492 181 LEU A CG 4654 C CD1 . LEU C 180 ? 0.4586 0.4336 0.3224 0.0731 -0.0196 -0.0545 181 LEU A CD1 4655 C CD2 . LEU C 180 ? 0.3378 0.3666 0.2336 0.0730 -0.0092 -0.0466 181 LEU A CD2 4656 N N . SER C 181 ? 0.2301 0.2763 0.1486 0.0519 0.0016 -0.0456 182 SER A N 4657 C CA . SER C 181 ? 0.2046 0.2526 0.1233 0.0490 0.0026 -0.0466 182 SER A CA 4658 C C . SER C 181 ? 0.3762 0.3949 0.2721 0.0514 -0.0059 -0.0522 182 SER A C 4659 O O . SER C 181 ? 0.3854 0.3874 0.2669 0.0597 -0.0121 -0.0562 182 SER A O 4660 C CB . SER C 181 ? 0.3202 0.3975 0.2509 0.0585 0.0052 -0.0469 182 SER A CB 4661 O OG . SER C 181 ? 0.2834 0.3588 0.2018 0.0744 -0.0010 -0.0522 182 SER A OG 4662 N N . LYS C 182 ? 0.3692 0.3812 0.2614 0.0438 -0.0063 -0.0520 183 LYS A N 4663 C CA . LYS C 182 ? 0.3636 0.3461 0.2332 0.0440 -0.0155 -0.0568 183 LYS A CA 4664 C C . LYS C 182 ? 0.3658 0.3442 0.2220 0.0615 -0.0215 -0.0648 183 LYS A C 4665 O O . LYS C 182 ? 0.4347 0.3861 0.2705 0.0676 -0.0298 -0.0697 183 LYS A O 4666 C CB . LYS C 182 ? 0.3660 0.3475 0.2354 0.0321 -0.0146 -0.0539 183 LYS A CB 4667 C CG . LYS C 182 ? 0.3057 0.2582 0.1509 0.0325 -0.0254 -0.0593 183 LYS A CG 4668 C CD . LYS C 182 ? 0.3630 0.3183 0.2092 0.0193 -0.0242 -0.0549 183 LYS A CD 4669 C CE . LYS C 182 ? 0.4445 0.3702 0.2653 0.0185 -0.0360 -0.0601 183 LYS A CE 4670 N NZ . LYS C 182 ? 0.4807 0.4168 0.3044 0.0079 -0.0340 -0.0564 183 LYS A NZ 4671 N N . ALA C 183 ? 0.3465 0.3525 0.2140 0.0703 -0.0174 -0.0658 184 ALA A N 4672 C CA . ALA C 183 ? 0.4244 0.4311 0.2795 0.0890 -0.0224 -0.0727 184 ALA A CA 4673 C C . ALA C 183 ? 0.4465 0.4494 0.2948 0.1018 -0.0250 -0.0739 184 ALA A C 4674 O O . ALA C 183 ? 0.4557 0.4380 0.2831 0.1141 -0.0323 -0.0796 184 ALA A O 4675 C CB . ALA C 183 ? 0.3832 0.4267 0.2559 0.0959 -0.0167 -0.0714 184 ALA A CB 4676 N N . ASP C 184 ? 0.3819 0.4042 0.2480 0.0981 -0.0191 -0.0677 185 ASP A N 4677 C CA . ASP C 184 ? 0.3755 0.3975 0.2368 0.1082 -0.0209 -0.0672 185 ASP A CA 4678 C C . ASP C 184 ? 0.5165 0.5006 0.3568 0.1061 -0.0276 -0.0706 185 ASP A C 4679 O O . ASP C 184 ? 0.4972 0.4690 0.3208 0.1201 -0.0326 -0.0742 185 ASP A O 4680 C CB . ASP C 184 ? 0.4330 0.4794 0.3165 0.1007 -0.0140 -0.0595 185 ASP A CB 4681 C CG . ASP C 184 ? 0.5439 0.5976 0.4249 0.1113 -0.0154 -0.0574 185 ASP A CG 4682 O OD1 . ASP C 184 ? 0.6118 0.6615 0.4774 0.1280 -0.0200 -0.0609 185 ASP A OD1 4683 O OD2 . ASP C 184 ? 0.5945 0.6583 0.4879 0.1032 -0.0118 -0.0517 185 ASP A OD2 4684 N N . TYR C 185 ? 0.4875 0.4543 0.3284 0.0891 -0.0277 -0.0686 186 TYR A N 4685 C CA . TYR C 185 ? 0.4346 0.3671 0.2577 0.0850 -0.0345 -0.0704 186 TYR A CA 4686 C C . TYR C 185 ? 0.5314 0.4351 0.3287 0.0938 -0.0440 -0.0778 186 TYR A C 4687 O O . TYR C 185 ? 0.4392 0.3196 0.2188 0.1016 -0.0502 -0.0810 186 TYR A O 4688 C CB . TYR C 185 ? 0.4248 0.3487 0.2545 0.0652 -0.0329 -0.0652 186 TYR A CB 4689 C CG . TYR C 185 ? 0.4275 0.3189 0.2411 0.0598 -0.0405 -0.0654 186 TYR A CG 4690 C CD1 . TYR C 185 ? 0.5004 0.3874 0.3134 0.0624 -0.0409 -0.0640 186 TYR A CD1 4691 C CD2 . TYR C 185 ? 0.4727 0.3392 0.2721 0.0512 -0.0477 -0.0660 186 TYR A CD2 4692 C CE1 . TYR C 185 ? 0.4964 0.3558 0.2963 0.0575 -0.0479 -0.0635 186 TYR A CE1 4693 C CE2 . TYR C 185 ? 0.5508 0.3886 0.3364 0.0455 -0.0556 -0.0649 186 TYR A CE2 4694 C CZ . TYR C 185 ? 0.5415 0.3762 0.3279 0.0491 -0.0555 -0.0637 186 TYR A CZ 4695 O OH . TYR C 185 ? 0.5320 0.3401 0.3062 0.0435 -0.0634 -0.0620 186 TYR A OH 4696 N N . GLU C 186 ? 0.5361 0.4409 0.3308 0.0925 -0.0451 -0.0805 187 GLU A N 4697 C CA . GLU C 186 ? 0.5506 0.4271 0.3242 0.0968 -0.0541 -0.0855 187 GLU A CA 4698 C C . GLU C 186 ? 0.6039 0.4834 0.3717 0.1171 -0.0561 -0.0879 187 GLU A C 4699 O O . GLU C 186 ? 0.6664 0.5189 0.4160 0.1225 -0.0640 -0.0908 187 GLU A O 4700 C CB . GLU C 186 ? 0.4878 0.3666 0.2615 0.0882 -0.0545 -0.0866 187 GLU A CB 4701 C CG . GLU C 186 ? 0.5334 0.4081 0.3132 0.0665 -0.0532 -0.0808 187 GLU A CG 4702 C CD . GLU C 186 ? 0.8088 0.6466 0.5709 0.0565 -0.0625 -0.0796 187 GLU A CD 4703 O OE1 . GLU C 186 ? 0.9682 0.7808 0.7131 0.0652 -0.0704 -0.0835 187 GLU A OE1 4704 O OE2 . GLU C 186 ? 0.8702 0.7088 0.6412 0.0392 -0.0607 -0.0716 187 GLU A OE2 4705 N N . LYS C 187 ? 0.6229 0.5352 0.4055 0.1284 -0.0498 -0.0856 188 LYS A N 4706 C CA . LYS C 187 ? 0.6606 0.5799 0.4380 0.1485 -0.0519 -0.0860 188 LYS A CA 4707 C C . LYS C 187 ? 0.6579 0.5719 0.4290 0.1579 -0.0531 -0.0838 188 LYS A C 4708 O O . LYS C 187 ? 0.6697 0.5947 0.4376 0.1755 -0.0540 -0.0822 188 LYS A O 4709 C CB . LYS C 187 ? 0.7606 0.7217 0.5575 0.1567 -0.0458 -0.0830 188 LYS A CB 4710 C CG . LYS C 187 ? 0.8856 0.8786 0.7024 0.1553 -0.0385 -0.0769 188 LYS A CG 4711 C CD . LYS C 187 ? 1.0074 1.0419 0.8428 0.1648 -0.0346 -0.0722 188 LYS A CD 4712 C CE . LYS C 187 ? 1.0602 1.1073 0.9069 0.1566 -0.0316 -0.0733 188 LYS A CE 4713 N NZ . LYS C 187 ? 1.0650 1.1546 0.9325 0.1643 -0.0285 -0.0672 188 LYS A NZ 4714 N N . HIS C 188 ? 0.5951 0.4936 0.3642 0.1466 -0.0531 -0.0830 189 HIS A N 4715 C CA . HIS C 188 ? 0.5727 0.4640 0.3349 0.1542 -0.0543 -0.0811 189 HIS A CA 4716 C C . HIS C 188 ? 0.6031 0.4558 0.3496 0.1450 -0.0608 -0.0830 189 HIS A C 4717 O O . HIS C 188 ? 0.6486 0.4846 0.3931 0.1298 -0.0635 -0.0843 189 HIS A O 4718 C CB . HIS C 188 ? 0.5771 0.4974 0.3566 0.1513 -0.0467 -0.0764 189 HIS A CB 4719 C CG . HIS C 188 ? 0.6028 0.5629 0.3984 0.1608 -0.0413 -0.0724 189 HIS A CG 4720 N ND1 . HIS C 188 ? 0.6542 0.6397 0.4685 0.1519 -0.0356 -0.0707 189 HIS A ND1 4721 C CD2 . HIS C 188 ? 0.5884 0.5687 0.3845 0.1783 -0.0413 -0.0686 189 HIS A CD2 4722 C CE1 . HIS C 188 ? 0.6057 0.6251 0.4324 0.1627 -0.0327 -0.0659 189 HIS A CE1 4723 N NE2 . HIS C 188 ? 0.5929 0.6106 0.4089 0.1789 -0.0363 -0.0643 189 HIS A NE2 4724 N N . LYS C 189 ? 0.6252 0.4654 0.3607 0.1542 -0.0635 -0.0821 190 LYS A N 4725 C CA . LYS C 189 ? 0.7169 0.5193 0.4353 0.1487 -0.0713 -0.0834 190 LYS A CA 4726 C C . LYS C 189 ? 0.6945 0.4927 0.4161 0.1411 -0.0699 -0.0807 190 LYS A C 4727 O O . LYS C 189 ? 0.6983 0.4766 0.4178 0.1259 -0.0738 -0.0802 190 LYS A O 4728 C CB . LYS C 189 ? 0.8904 0.6744 0.5885 0.1663 -0.0776 -0.0849 190 LYS A CB 4729 C CG . LYS C 189 ? 1.1185 0.8619 0.7973 0.1611 -0.0870 -0.0860 190 LYS A CG 4730 C CD . LYS C 189 ? 1.3723 1.0986 1.0293 0.1802 -0.0927 -0.0872 190 LYS A CD 4731 C CE . LYS C 189 ? 1.5465 1.2328 1.1841 0.1750 -0.1023 -0.0875 190 LYS A CE 4732 N NZ . LYS C 189 ? 1.6655 1.3343 1.2796 0.1942 -0.1077 -0.0884 190 LYS A NZ 4733 N N . VAL C 190 ? 0.6095 0.4271 0.3357 0.1516 -0.0648 -0.0782 191 VAL A N 4734 C CA . VAL C 190 ? 0.7057 0.5192 0.4332 0.1462 -0.0636 -0.0759 191 VAL A CA 4735 C C . VAL C 190 ? 0.6078 0.4511 0.3553 0.1369 -0.0555 -0.0727 191 VAL A C 4736 O O . VAL C 190 ? 0.5627 0.4373 0.3219 0.1433 -0.0494 -0.0703 191 VAL A O 4737 C CB . VAL C 190 ? 0.9909 0.8022 0.7069 0.1633 -0.0641 -0.0742 191 VAL A CB 4738 C CG1 . VAL C 190 ? 1.0145 0.8561 0.7346 0.1804 -0.0594 -0.0718 191 VAL A CG1 4739 C CG2 . VAL C 190 ? 0.9334 0.7474 0.6532 0.1581 -0.0612 -0.0716 191 VAL A CG2 4740 N N . TYR C 191 ? 0.4981 0.3352 0.2556 0.1195 -0.0553 -0.0691 192 TYR A N 4741 C CA . TYR C 191 ? 0.4932 0.3571 0.2745 0.1067 -0.0478 -0.0632 192 TYR A CA 4742 C C . TYR C 191 ? 0.5583 0.4221 0.3446 0.1013 -0.0466 -0.0587 192 TYR A C 4743 O O . TYR C 191 ? 0.5472 0.3881 0.3268 0.0946 -0.0517 -0.0584 192 TYR A O 4744 C CB . TYR C 191 ? 0.4729 0.3338 0.2631 0.0902 -0.0476 -0.0625 192 TYR A CB 4745 C CG . TYR C 191 ? 0.5204 0.3900 0.3109 0.0942 -0.0466 -0.0658 192 TYR A CG 4746 C CD1 . TYR C 191 ? 0.4805 0.3270 0.2521 0.1005 -0.0537 -0.0716 192 TYR A CD1 4747 C CD2 . TYR C 191 ? 0.5069 0.4075 0.3162 0.0919 -0.0390 -0.0629 192 TYR A CD2 4748 C CE1 . TYR C 191 ? 0.4796 0.3359 0.2518 0.1046 -0.0527 -0.0747 192 TYR A CE1 4749 C CE2 . TYR C 191 ? 0.4490 0.3603 0.2604 0.0958 -0.0379 -0.0654 192 TYR A CE2 4750 C CZ . TYR C 191 ? 0.4168 0.3070 0.2100 0.1023 -0.0444 -0.0713 192 TYR A CZ 4751 O OH . TYR C 191 ? 0.4859 0.3886 0.2816 0.1064 -0.0431 -0.0738 192 TYR A OH 4752 N N . ALA C 192 ? 0.5884 0.4791 0.3868 0.1037 -0.0404 -0.0545 193 ALA A N 4753 C CA . ALA C 192 ? 0.5357 0.4287 0.3377 0.1005 -0.0391 -0.0504 193 ALA A CA 4754 C C . ALA C 192 ? 0.4988 0.4183 0.3204 0.0903 -0.0324 -0.0452 193 ALA A C 4755 O O . ALA C 192 ? 0.5199 0.4618 0.3508 0.0916 -0.0284 -0.0438 193 ALA A O 4756 C CB . ALA C 192 ? 0.4776 0.3720 0.2672 0.1177 -0.0398 -0.0500 193 ALA A CB 4757 N N . CYS C 193 ? 0.4766 0.3929 0.3039 0.0802 -0.0318 -0.0423 194 CYS A N 4758 C CA . CYS C 193 ? 0.5335 0.4722 0.3752 0.0726 -0.0263 -0.0377 194 CYS A CA 4759 C C . CYS C 193 ? 0.5486 0.4908 0.3877 0.0763 -0.0262 -0.0345 194 CYS A C 4760 O O . CYS C 193 ? 0.4848 0.4092 0.3167 0.0765 -0.0297 -0.0350 194 CYS A O 4761 C CB . CYS C 193 ? 0.5533 0.4892 0.4052 0.0568 -0.0246 -0.0366 194 CYS A CB 4762 S SG . CYS C 193 ? 0.7259 0.6405 0.5746 0.0479 -0.0284 -0.0353 194 CYS A SG 4763 N N . GLU C 194 ? 0.5177 0.4842 0.3627 0.0793 -0.0224 -0.0303 195 GLU A N 4764 C CA . GLU C 194 ? 0.5232 0.4981 0.3665 0.0826 -0.0214 -0.0260 195 GLU A CA 4765 C C . GLU C 194 ? 0.4541 0.4425 0.3100 0.0690 -0.0182 -0.0222 195 GLU A C 4766 O O . GLU C 194 ? 0.4385 0.4424 0.3033 0.0631 -0.0158 -0.0205 195 GLU A O 4767 C CB . GLU C 194 ? 0.6643 0.6579 0.5022 0.0973 -0.0203 -0.0225 195 GLU A CB 4768 C CG . GLU C 194 ? 0.8478 0.8555 0.6845 0.1010 -0.0183 -0.0162 195 GLU A CG 4769 C CD . GLU C 194 ? 0.9667 0.9952 0.7969 0.1169 -0.0171 -0.0111 195 GLU A CD 4770 O OE1 . GLU C 194 ? 0.9526 0.9743 0.7730 0.1298 -0.0190 -0.0145 195 GLU A OE1 4771 O OE2 . GLU C 194 ? 1.0567 1.1092 0.8909 0.1167 -0.0145 -0.0031 195 GLU A OE2 4772 N N . VAL C 195 ? 0.3838 0.3657 0.2398 0.0642 -0.0186 -0.0210 196 VAL A N 4773 C CA . VAL C 195 ? 0.3733 0.3642 0.2390 0.0515 -0.0162 -0.0184 196 VAL A CA 4774 C C . VAL C 195 ? 0.4876 0.4943 0.3536 0.0531 -0.0146 -0.0131 196 VAL A C 4775 O O . VAL C 195 ? 0.4622 0.4635 0.3222 0.0598 -0.0156 -0.0120 196 VAL A O 4776 C CB . VAL C 195 ? 0.3793 0.3521 0.2465 0.0429 -0.0179 -0.0206 196 VAL A CB 4777 C CG1 . VAL C 195 ? 0.3784 0.3601 0.2529 0.0325 -0.0156 -0.0181 196 VAL A CG1 4778 C CG2 . VAL C 195 ? 0.4081 0.3697 0.2765 0.0388 -0.0187 -0.0241 196 VAL A CG2 4779 N N . THR C 196 ? 0.4715 0.4977 0.3442 0.0464 -0.0123 -0.0092 197 THR A N 4780 C CA . THR C 196 ? 0.4626 0.5060 0.3363 0.0449 -0.0109 -0.0031 197 THR A CA 4781 C C . THR C 196 ? 0.4659 0.5074 0.3454 0.0313 -0.0103 -0.0035 197 THR A C 4782 O O . THR C 196 ? 0.4815 0.5216 0.3652 0.0220 -0.0101 -0.0052 197 THR A O 4783 C CB . THR C 196 ? 0.4976 0.5666 0.3729 0.0468 -0.0100 0.0035 197 THR A CB 4784 O OG1 . THR C 196 ? 0.6253 0.6984 0.4939 0.0620 -0.0103 0.0046 197 THR A OG1 4785 C CG2 . THR C 196 ? 0.4627 0.5505 0.3389 0.0431 -0.0087 0.0109 197 THR A CG2 4786 N N . HIS C 197 ? 0.4182 0.4594 0.2970 0.0309 -0.0099 -0.0018 198 HIS A N 4787 C CA . HIS C 197 ? 0.3876 0.4289 0.2708 0.0195 -0.0094 -0.0018 198 HIS A CA 4788 C C . HIS C 197 ? 0.3718 0.4258 0.2550 0.0209 -0.0082 0.0032 198 HIS A C 4789 O O . HIS C 197 ? 0.4158 0.4687 0.2953 0.0309 -0.0081 0.0049 198 HIS A O 4790 C CB . HIS C 197 ? 0.3870 0.4081 0.2714 0.0163 -0.0108 -0.0069 198 HIS A CB 4791 C CG . HIS C 197 ? 0.4076 0.4289 0.2956 0.0060 -0.0102 -0.0074 198 HIS A CG 4792 N ND1 . HIS C 197 ? 0.3770 0.4028 0.2668 0.0042 -0.0100 -0.0052 198 HIS A ND1 4793 C CD2 . HIS C 197 ? 0.3446 0.3617 0.2335 -0.0021 -0.0097 -0.0098 198 HIS A CD2 4794 C CE1 . HIS C 197 ? 0.3714 0.3962 0.2628 -0.0042 -0.0096 -0.0066 198 HIS A CE1 4795 N NE2 . HIS C 197 ? 0.3718 0.3902 0.2618 -0.0078 -0.0094 -0.0095 198 HIS A NE2 4796 N N . GLN C 198 ? 0.3458 0.4109 0.2320 0.0110 -0.0074 0.0057 199 GLN A N 4797 C CA . GLN C 198 ? 0.4052 0.4867 0.2919 0.0112 -0.0058 0.0117 199 GLN A CA 4798 C C . GLN C 198 ? 0.4705 0.5436 0.3587 0.0155 -0.0056 0.0107 199 GLN A C 4799 O O . GLN C 198 ? 0.4885 0.5724 0.3759 0.0214 -0.0038 0.0157 199 GLN A O 4800 C CB . GLN C 198 ? 0.3860 0.4790 0.2744 -0.0017 -0.0058 0.0140 199 GLN A CB 4801 C CG . GLN C 198 ? 0.3778 0.4574 0.2681 -0.0101 -0.0067 0.0084 199 GLN A CG 4802 C CD . GLN C 198 ? 0.4833 0.5703 0.3720 -0.0224 -0.0076 0.0095 199 GLN A CD 4803 O OE1 . GLN C 198 ? 0.5368 0.6322 0.4260 -0.0274 -0.0072 0.0115 199 GLN A OE1 4804 N NE2 . GLN C 198 ? 0.5166 0.6001 0.4029 -0.0276 -0.0093 0.0083 199 GLN A NE2 4805 N N . GLY C 199 ? 0.3634 0.4184 0.2536 0.0127 -0.0074 0.0053 200 GLY A N 4806 C CA . GLY C 199 ? 0.3757 0.4230 0.2685 0.0156 -0.0085 0.0053 200 GLY A CA 4807 C C . GLY C 199 ? 0.3989 0.4352 0.2871 0.0272 -0.0100 0.0056 200 GLY A C 4808 O O . GLY C 199 ? 0.4151 0.4459 0.3049 0.0303 -0.0115 0.0070 200 GLY A O 4809 N N . LEU C 200 ? 0.4095 0.4422 0.2915 0.0338 -0.0103 0.0043 201 LEU A N 4810 C CA . LEU C 200 ? 0.3837 0.4037 0.2580 0.0462 -0.0122 0.0037 201 LEU A CA 4811 C C . LEU C 200 ? 0.4608 0.4965 0.3304 0.0562 -0.0091 0.0096 201 LEU A C 4812 O O . LEU C 200 ? 0.4836 0.5417 0.3553 0.0536 -0.0058 0.0143 201 LEU A O 4813 C CB . LEU C 200 ? 0.3989 0.4071 0.2676 0.0499 -0.0140 -0.0009 201 LEU A CB 4814 C CG . LEU C 200 ? 0.4432 0.4364 0.3154 0.0414 -0.0165 -0.0058 201 LEU A CG 4815 C CD1 . LEU C 200 ? 0.4798 0.4689 0.3483 0.0441 -0.0168 -0.0092 201 LEU A CD1 4816 C CD2 . LEU C 200 ? 0.4065 0.3793 0.2771 0.0418 -0.0210 -0.0070 201 LEU A CD2 4817 N N . SER C 201 ? 0.4538 0.4774 0.3161 0.0675 -0.0106 0.0100 202 SER A N 4818 C CA . SER C 201 ? 0.5011 0.5381 0.3570 0.0795 -0.0072 0.0162 202 SER A CA 4819 C C . SER C 201 ? 0.5444 0.5906 0.3919 0.0891 -0.0057 0.0174 202 SER A C 4820 O O . SER C 201 ? 0.5858 0.6549 0.4307 0.0954 -0.0017 0.0249 202 SER A O 4821 C CB . SER C 201 ? 0.4915 0.5090 0.3400 0.0898 -0.0097 0.0158 202 SER A CB 4822 O OG . SER C 201 ? 0.6080 0.6010 0.4444 0.0990 -0.0141 0.0103 202 SER A OG 4823 N N . SER C 202 ? 0.4992 0.5294 0.3430 0.0902 -0.0090 0.0111 203 SER A N 4824 C CA . SER C 202 ? 0.6120 0.6511 0.4494 0.0988 -0.0082 0.0118 203 SER A CA 4825 C C . SER C 202 ? 0.5968 0.6194 0.4360 0.0930 -0.0117 0.0041 203 SER A C 4826 O O . SER C 202 ? 0.5744 0.5766 0.4164 0.0855 -0.0148 -0.0010 203 SER A O 4827 C CB . SER C 202 ? 0.6676 0.7013 0.4897 0.1189 -0.0081 0.0134 203 SER A CB 4828 O OG . SER C 202 ? 0.6983 0.6988 0.5110 0.1245 -0.0131 0.0060 203 SER A OG 4829 N N . PRO C 203 ? 0.5769 0.6105 0.4152 0.0963 -0.0112 0.0043 204 PRO A N 4830 C CA . PRO C 203 ? 0.5337 0.5533 0.3737 0.0919 -0.0138 -0.0025 204 PRO A CA 4831 C C . PRO C 203 ? 0.5209 0.5091 0.3520 0.0967 -0.0183 -0.0093 204 PRO A C 4832 O O . PRO C 203 ? 0.5896 0.5674 0.4078 0.1108 -0.0199 -0.0098 204 PRO A O 4833 C CB . PRO C 203 ? 0.5365 0.5738 0.3733 0.1014 -0.0127 0.0002 204 PRO A CB 4834 C CG . PRO C 203 ? 0.5552 0.6225 0.3959 0.1008 -0.0093 0.0099 204 PRO A CG 4835 C CD . PRO C 203 ? 0.5503 0.6137 0.3880 0.1024 -0.0080 0.0124 204 PRO A CD 4836 N N . VAL C 204 ? 0.5103 0.4833 0.3472 0.0849 -0.0207 -0.0138 205 VAL A N 4837 C CA . VAL C 204 ? 0.5858 0.5296 0.4151 0.0861 -0.0260 -0.0188 205 VAL A CA 4838 C C . VAL C 204 ? 0.6241 0.5575 0.4494 0.0875 -0.0283 -0.0239 205 VAL A C 4839 O O . VAL C 204 ? 0.6321 0.5745 0.4668 0.0787 -0.0263 -0.0247 205 VAL A O 4840 C CB . VAL C 204 ? 0.6066 0.5416 0.4443 0.0724 -0.0278 -0.0185 205 VAL A CB 4841 C CG1 . VAL C 204 ? 0.6542 0.5607 0.4845 0.0716 -0.0344 -0.0219 205 VAL A CG1 4842 C CG2 . VAL C 204 ? 0.7364 0.6810 0.5778 0.0719 -0.0260 -0.0136 205 VAL A CG2 4843 N N . THR C 205 ? 0.5963 0.5101 0.4069 0.0990 -0.0325 -0.0275 206 THR A N 4844 C CA . THR C 205 ? 0.5891 0.4919 0.3943 0.1011 -0.0352 -0.0327 206 THR A CA 4845 C C . THR C 205 ? 0.6120 0.4847 0.4109 0.0947 -0.0420 -0.0363 206 THR A C 4846 O O . THR C 205 ? 0.6009 0.4526 0.3883 0.0997 -0.0471 -0.0368 206 THR A O 4847 C CB . THR C 205 ? 0.5925 0.4960 0.3833 0.1199 -0.0356 -0.0344 206 THR A CB 4848 O OG1 . THR C 205 ? 0.5976 0.5333 0.3959 0.1243 -0.0298 -0.0296 206 THR A OG1 4849 C CG2 . THR C 205 ? 0.7110 0.5990 0.4943 0.1222 -0.0395 -0.0406 206 THR A CG2 4850 N N . LYS C 206 ? 0.5005 0.3719 0.3069 0.0833 -0.0423 -0.0376 207 LYS A N 4851 C CA . LYS C 206 ? 0.6143 0.4599 0.4140 0.0770 -0.0491 -0.0399 207 LYS A CA 4852 C C . LYS C 206 ? 0.6390 0.4795 0.4315 0.0821 -0.0504 -0.0448 207 LYS A C 4853 O O . LYS C 206 ? 0.7279 0.5892 0.5292 0.0824 -0.0449 -0.0451 207 LYS A O 4854 C CB . LYS C 206 ? 0.6244 0.4734 0.4372 0.0603 -0.0484 -0.0362 207 LYS A CB 4855 C CG . LYS C 206 ? 0.6435 0.4952 0.4624 0.0553 -0.0486 -0.0315 207 LYS A CG 4856 C CD . LYS C 206 ? 0.7523 0.5786 0.5596 0.0572 -0.0570 -0.0307 207 LYS A CD 4857 C CE . LYS C 206 ? 0.7583 0.5901 0.5736 0.0525 -0.0571 -0.0253 207 LYS A CE 4858 N NZ . LYS C 206 ? 0.7389 0.5461 0.5448 0.0522 -0.0662 -0.0232 207 LYS A NZ 4859 N N . SER C 207 ? 0.6648 0.4777 0.4409 0.0860 -0.0581 -0.0485 208 SER A N 4860 C CA . SER C 207 ? 0.6331 0.4402 0.4002 0.0923 -0.0598 -0.0537 208 SER A CA 4861 C C . SER C 207 ? 0.6436 0.4201 0.3978 0.0861 -0.0689 -0.0562 208 SER A C 4862 O O . SER C 207 ? 0.6137 0.3705 0.3635 0.0786 -0.0753 -0.0536 208 SER A O 4863 C CB . SER C 207 ? 0.6486 0.4571 0.4021 0.1127 -0.0592 -0.0571 208 SER A CB 4864 O OG . SER C 207 ? 0.7341 0.5134 0.4677 0.1212 -0.0664 -0.0593 208 SER A OG 4865 N N . PHE C 208 ? 0.5941 0.3684 0.3431 0.0885 -0.0699 -0.0605 209 PHE A N 4866 C CA . PHE C 208 ? 0.6104 0.3548 0.3434 0.0845 -0.0793 -0.0636 209 PHE A CA 4867 C C . PHE C 208 ? 0.6700 0.4113 0.3904 0.0974 -0.0802 -0.0707 209 PHE A C 4868 O O . PHE C 208 ? 0.6099 0.3776 0.3388 0.1064 -0.0726 -0.0717 209 PHE A O 4869 C CB . PHE C 208 ? 0.5251 0.2716 0.2695 0.0647 -0.0801 -0.0586 209 PHE A CB 4870 C CG . PHE C 208 ? 0.5291 0.3015 0.2883 0.0607 -0.0721 -0.0585 209 PHE A CG 4871 C CD1 . PHE C 208 ? 0.5550 0.3214 0.3067 0.0613 -0.0745 -0.0624 209 PHE A CD1 4872 C CD2 . PHE C 208 ? 0.4888 0.2905 0.2688 0.0559 -0.0626 -0.0542 209 PHE A CD2 4873 C CE1 . PHE C 208 ? 0.5137 0.3052 0.2801 0.0577 -0.0669 -0.0616 209 PHE A CE1 4874 C CE2 . PHE C 208 ? 0.5362 0.3601 0.3293 0.0522 -0.0555 -0.0537 209 PHE A CE2 4875 C CZ . PHE C 208 ? 0.4906 0.3105 0.2779 0.0532 -0.0574 -0.0571 209 PHE A CZ 4876 N N . ASN C 209 ? 0.7540 0.4679 0.4587 0.0969 -0.0891 -0.0726 210 ASN A N 4877 C CA . ASN C 209 ? 0.7748 0.4900 0.4738 0.1055 -0.0896 -0.0760 210 ASN A CA 4878 C C . ASN C 209 ? 0.7374 0.4495 0.4401 0.0901 -0.0920 -0.0752 210 ASN A C 4879 O O . ASN C 209 ? 0.8297 0.5220 0.5281 0.0758 -0.0991 -0.0717 210 ASN A O 4880 C CB . ASN C 209 ? 0.8714 0.5603 0.5494 0.1178 -0.0976 -0.0777 210 ASN A CB 4881 C CG . ASN C 209 ? 0.9505 0.6454 0.6232 0.1356 -0.0944 -0.0779 210 ASN A CG 4882 O OD1 . ASN C 209 ? 0.9778 0.7018 0.6609 0.1446 -0.0858 -0.0778 210 ASN A OD1 4883 N ND2 . ASN C 209 ? 1.0216 0.6900 0.6775 0.1404 -0.1015 -0.0773 210 ASN A ND2 4884 N N . ARG C 210 ? 0.6746 0.4083 0.3859 0.0928 -0.0861 -0.0775 211 ARG A N 4885 C CA . ARG C 210 ? 0.6807 0.4130 0.3944 0.0797 -0.0878 -0.0769 211 ARG A CA 4886 C C . ARG C 210 ? 0.7786 0.4803 0.4737 0.0791 -0.0983 -0.0778 211 ARG A C 4887 O O . ARG C 210 ? 0.8326 0.5190 0.5239 0.0635 -0.1045 -0.0742 211 ARG A O 4888 C CB . ARG C 210 ? 0.6046 0.3667 0.3302 0.0852 -0.0795 -0.0794 211 ARG A CB 4889 C CG . ARG C 210 ? 0.6337 0.3971 0.3617 0.0726 -0.0803 -0.0789 211 ARG A CG 4890 C CD . ARG C 210 ? 0.6265 0.4197 0.3659 0.0805 -0.0726 -0.0817 211 ARG A CD 4891 N NE . ARG C 210 ? 0.6598 0.4570 0.3935 0.1003 -0.0728 -0.0854 211 ARG A NE 4892 C CZ . ARG C 210 ? 0.6782 0.4564 0.3965 0.1073 -0.0796 -0.0886 211 ARG A CZ 4893 N NH1 . ARG C 210 ? 0.6675 0.4210 0.3749 0.0950 -0.0869 -0.0885 211 ARG A NH1 4894 N NH2 . ARG C 210 ? 0.6822 0.4662 0.3951 0.1266 -0.0795 -0.0910 211 ARG A NH2 4895 O OXT . ARG C 210 ? 0.7832 0.4749 0.4656 0.0945 -0.1013 -0.0813 211 ARG A OXT 4896 N N . GLN D 1 ? 0.8551 0.8384 0.7916 -0.0199 0.0861 -0.0589 1 GLN B N 4897 C CA . GLN D 1 ? 0.7246 0.7012 0.6616 -0.0149 0.0777 -0.0550 1 GLN B CA 4898 C C . GLN D 1 ? 0.5887 0.5750 0.5435 -0.0113 0.0736 -0.0584 1 GLN B C 4899 O O . GLN D 1 ? 0.4964 0.4942 0.4639 -0.0128 0.0767 -0.0639 1 GLN B O 4900 C CB . GLN D 1 ? 0.7776 0.7419 0.7042 -0.0185 0.0768 -0.0490 1 GLN B CB 4901 C CG . GLN D 1 ? 0.8355 0.7861 0.7420 -0.0196 0.0774 -0.0442 1 GLN B CG 4902 C CD . GLN D 1 ? 0.8469 0.7956 0.7486 -0.0129 0.0725 -0.0439 1 GLN B CD 4903 O OE1 . GLN D 1 ? 0.9188 0.8727 0.8203 -0.0118 0.0749 -0.0474 1 GLN B OE1 4904 N NE2 . GLN D 1 ? 0.8582 0.7997 0.7566 -0.0085 0.0654 -0.0404 1 GLN B NE2 4905 N N . VAL D 2 ? 0.5189 0.5005 0.4738 -0.0065 0.0666 -0.0551 2 VAL B N 4906 C CA . VAL D 2 ? 0.3939 0.3824 0.3624 -0.0021 0.0617 -0.0571 2 VAL B CA 4907 C C . VAL D 2 ? 0.4441 0.4268 0.4107 -0.0016 0.0576 -0.0530 2 VAL B C 4908 O O . VAL D 2 ? 0.4174 0.3903 0.3727 -0.0011 0.0556 -0.0482 2 VAL B O 4909 C CB . VAL D 2 ? 0.3425 0.3319 0.3133 0.0040 0.0569 -0.0573 2 VAL B CB 4910 C CG1 . VAL D 2 ? 0.3515 0.3467 0.3348 0.0084 0.0519 -0.0587 2 VAL B CG1 4911 C CG2 . VAL D 2 ? 0.3112 0.3052 0.2826 0.0041 0.0604 -0.0618 2 VAL B CG2 4912 N N . GLN D 3 ? 0.3491 0.3381 0.3269 -0.0012 0.0560 -0.0555 3 GLN B N 4913 C CA . GLN D 3 ? 0.3275 0.3121 0.3042 0.0000 0.0517 -0.0527 3 GLN B CA 4914 C C . GLN D 3 ? 0.3651 0.3555 0.3511 0.0060 0.0462 -0.0538 3 GLN B C 4915 O O . GLN D 3 ? 0.3547 0.3539 0.3517 0.0073 0.0461 -0.0583 3 GLN B O 4916 C CB . GLN D 3 ? 0.4512 0.4360 0.4307 -0.0058 0.0547 -0.0545 3 GLN B CB 4917 C CG . GLN D 3 ? 0.6997 0.6788 0.6771 -0.0045 0.0500 -0.0522 3 GLN B CG 4918 C CD . GLN D 3 ? 0.8760 0.8562 0.8591 -0.0103 0.0522 -0.0550 3 GLN B CD 4919 O OE1 . GLN D 3 ? 0.9396 0.9266 0.9298 -0.0154 0.0575 -0.0588 3 GLN B OE1 4920 N NE2 . GLN D 3 ? 0.9144 0.8886 0.8951 -0.0095 0.0480 -0.0537 3 GLN B NE2 4921 N N . LEU D 4 ? 0.3332 0.3189 0.3145 0.0098 0.0414 -0.0498 4 LEU B N 4922 C CA . LEU D 4 ? 0.2855 0.2757 0.2735 0.0149 0.0364 -0.0501 4 LEU B CA 4923 C C . LEU D 4 ? 0.3618 0.3512 0.3505 0.0149 0.0341 -0.0505 4 LEU B C 4924 O O . LEU D 4 ? 0.3434 0.3258 0.3238 0.0139 0.0337 -0.0477 4 LEU B O 4925 C CB . LEU D 4 ? 0.2471 0.2343 0.2301 0.0193 0.0330 -0.0455 4 LEU B CB 4926 C CG . LEU D 4 ? 0.3292 0.3150 0.3098 0.0196 0.0341 -0.0445 4 LEU B CG 4927 C CD1 . LEU D 4 ? 0.2892 0.2744 0.2693 0.0238 0.0301 -0.0408 4 LEU B CD1 4928 C CD2 . LEU D 4 ? 0.2500 0.2414 0.2384 0.0186 0.0364 -0.0493 4 LEU B CD2 4929 N N . GLN D 5 ? 0.3814 0.3777 0.3801 0.0163 0.0320 -0.0544 5 GLN B N 4930 C CA . GLN D 5 ? 0.3706 0.3665 0.3705 0.0167 0.0291 -0.0557 5 GLN B CA 4931 C C . GLN D 5 ? 0.3964 0.3953 0.3982 0.0233 0.0233 -0.0551 5 GLN B C 4932 O O . GLN D 5 ? 0.3325 0.3362 0.3399 0.0264 0.0216 -0.0562 5 GLN B O 4933 C CB . GLN D 5 ? 0.4722 0.4736 0.4822 0.0120 0.0314 -0.0615 5 GLN B CB 4934 C CG . GLN D 5 ? 0.6513 0.6486 0.6575 0.0044 0.0377 -0.0613 5 GLN B CG 4935 C CD . GLN D 5 ? 0.8550 0.8601 0.8731 -0.0010 0.0413 -0.0674 5 GLN B CD 4936 O OE1 . GLN D 5 ? 0.9845 0.9953 1.0122 0.0001 0.0379 -0.0717 5 GLN B OE1 4937 N NE2 . GLN D 5 ? 0.8526 0.8588 0.8701 -0.0069 0.0482 -0.0681 5 GLN B NE2 4938 N N . GLN D 6 ? 0.3439 0.3392 0.3401 0.0257 0.0200 -0.0534 6 GLN B N 4939 C CA . GLN D 6 ? 0.3879 0.3852 0.3826 0.0320 0.0150 -0.0519 6 GLN B CA 4940 C C . GLN D 6 ? 0.3520 0.3521 0.3507 0.0340 0.0109 -0.0560 6 GLN B C 4941 O O . GLN D 6 ? 0.3250 0.3226 0.3239 0.0309 0.0113 -0.0585 6 GLN B O 4942 C CB . GLN D 6 ? 0.4024 0.3949 0.3864 0.0344 0.0145 -0.0465 6 GLN B CB 4943 C CG . GLN D 6 ? 0.4200 0.4092 0.3996 0.0323 0.0180 -0.0429 6 GLN B CG 4944 C CD . GLN D 6 ? 0.4362 0.4235 0.4080 0.0355 0.0168 -0.0383 6 GLN B CD 4945 O OE1 . GLN D 6 ? 0.4780 0.4615 0.4448 0.0340 0.0187 -0.0360 6 GLN B OE1 4946 N NE2 . GLN D 6 ? 0.3576 0.3481 0.3283 0.0400 0.0137 -0.0370 6 GLN B NE2 4947 N N . TRP D 7 ? 0.2714 0.2757 0.2726 0.0393 0.0065 -0.0567 7 TRP B N 4948 C CA . TRP D 7 ? 0.3374 0.3439 0.3402 0.0427 0.0014 -0.0604 7 TRP B CA 4949 C C . TRP D 7 ? 0.4069 0.4146 0.4045 0.0497 -0.0031 -0.0575 7 TRP B C 4950 O O . TRP D 7 ? 0.3502 0.3569 0.3442 0.0510 -0.0020 -0.0526 7 TRP B O 4951 C CB . TRP D 7 ? 0.3361 0.3485 0.3519 0.0405 0.0004 -0.0676 7 TRP B CB 4952 C CG . TRP D 7 ? 0.4248 0.4427 0.4489 0.0417 0.0003 -0.0695 7 TRP B CG 4953 C CD1 . TRP D 7 ? 0.3634 0.3848 0.3906 0.0477 -0.0052 -0.0710 7 TRP B CD1 4954 C CD2 . TRP D 7 ? 0.4368 0.4568 0.4667 0.0372 0.0055 -0.0704 7 TRP B CD2 4955 N NE1 . TRP D 7 ? 0.3754 0.4007 0.4106 0.0475 -0.0042 -0.0731 7 TRP B NE1 4956 C CE2 . TRP D 7 ? 0.3753 0.4004 0.4126 0.0411 0.0026 -0.0730 7 TRP B CE2 4957 C CE3 . TRP D 7 ? 0.4161 0.4338 0.4448 0.0307 0.0121 -0.0694 7 TRP B CE3 4958 C CZ2 . TRP D 7 ? 0.3714 0.4003 0.4158 0.0389 0.0061 -0.0753 7 TRP B CZ2 4959 C CZ3 . TRP D 7 ? 0.4411 0.4626 0.4758 0.0282 0.0160 -0.0713 7 TRP B CZ3 4960 C CH2 . TRP D 7 ? 0.3919 0.4194 0.4349 0.0324 0.0131 -0.0746 7 TRP B CH2 4961 N N . GLY D 8 ? 0.3810 0.3903 0.3775 0.0539 -0.0082 -0.0604 8 GLY B N 4962 C CA . GLY D 8 ? 0.3389 0.3485 0.3278 0.0606 -0.0125 -0.0574 8 GLY B CA 4963 C C . GLY D 8 ? 0.3782 0.3866 0.3588 0.0638 -0.0149 -0.0579 8 GLY B C 4964 O O . GLY D 8 ? 0.4004 0.4059 0.3789 0.0610 -0.0126 -0.0583 8 GLY B O 4965 N N . ALA D 9 ? 0.4435 0.4535 0.4188 0.0702 -0.0200 -0.0582 9 ALA B N 4966 C CA . ALA D 9 ? 0.4715 0.4812 0.4383 0.0744 -0.0229 -0.0595 9 ALA B CA 4967 C C . ALA D 9 ? 0.4701 0.4783 0.4260 0.0752 -0.0190 -0.0533 9 ALA B C 4968 O O . ALA D 9 ? 0.5062 0.5150 0.4565 0.0766 -0.0173 -0.0472 9 ALA B O 4969 C CB . ALA D 9 ? 0.4143 0.4264 0.3774 0.0814 -0.0296 -0.0618 9 ALA B CB 4970 N N . GLY D 10 ? 0.4447 0.4510 0.3979 0.0743 -0.0179 -0.0550 10 GLY B N 4971 C CA . GLY D 10 ? 0.4942 0.5004 0.4388 0.0752 -0.0144 -0.0503 10 GLY B CA 4972 C C . GLY D 10 ? 0.6156 0.6248 0.5497 0.0820 -0.0169 -0.0506 10 GLY B C 4973 O O . GLY D 10 ? 0.7441 0.7557 0.6712 0.0835 -0.0137 -0.0465 10 GLY B O 4974 N N . LEU D 11 ? 0.5195 0.5295 0.4527 0.0863 -0.0226 -0.0560 11 LEU B N 4975 C CA . LEU D 11 ? 0.5066 0.5199 0.4289 0.0934 -0.0252 -0.0572 11 LEU B CA 4976 C C . LEU D 11 ? 0.4839 0.5006 0.3984 0.0977 -0.0263 -0.0530 11 LEU B C 4977 O O . LEU D 11 ? 0.4044 0.4205 0.3217 0.0992 -0.0307 -0.0550 11 LEU B O 4978 C CB . LEU D 11 ? 0.4928 0.5045 0.4168 0.0964 -0.0315 -0.0658 11 LEU B CB 4979 C CG . LEU D 11 ? 0.5737 0.5891 0.4858 0.1046 -0.0349 -0.0680 11 LEU B CG 4980 C CD1 . LEU D 11 ? 0.5170 0.5348 0.4215 0.1062 -0.0304 -0.0652 11 LEU B CD1 4981 C CD2 . LEU D 11 ? 0.5397 0.5528 0.4543 0.1077 -0.0422 -0.0773 11 LEU B CD2 4982 N N . LEU D 12 ? 0.4649 0.4852 0.3695 0.0999 -0.0225 -0.0474 12 LEU B N 4983 C CA . LEU D 12 ? 0.4581 0.4804 0.3535 0.1030 -0.0225 -0.0418 12 LEU B CA 4984 C C . LEU D 12 ? 0.4840 0.5118 0.3654 0.1089 -0.0216 -0.0407 12 LEU B C 4985 O O . LEU D 12 ? 0.5519 0.5834 0.4315 0.1096 -0.0187 -0.0423 12 LEU B O 4986 C CB . LEU D 12 ? 0.4600 0.4812 0.3577 0.0977 -0.0170 -0.0336 12 LEU B CB 4987 C CG . LEU D 12 ? 0.5003 0.5170 0.4109 0.0918 -0.0168 -0.0339 12 LEU B CG 4988 C CD1 . LEU D 12 ? 0.4466 0.4625 0.3578 0.0872 -0.0113 -0.0260 12 LEU B CD1 4989 C CD2 . LEU D 12 ? 0.4345 0.4485 0.3488 0.0939 -0.0229 -0.0370 12 LEU B CD2 4990 N N . LYS D 13 ? 0.3527 0.3810 0.2237 0.1134 -0.0241 -0.0381 13 LYS B N 4991 C CA . LYS D 13 ? 0.4394 0.4734 0.2953 0.1185 -0.0220 -0.0354 13 LYS B CA 4992 C C . LYS D 13 ? 0.4739 0.5088 0.3243 0.1148 -0.0155 -0.0248 13 LYS B C 4993 O O . LYS D 13 ? 0.4800 0.5092 0.3352 0.1108 -0.0158 -0.0201 13 LYS B O 4994 C CB . LYS D 13 ? 0.5021 0.5356 0.3477 0.1263 -0.0291 -0.0393 13 LYS B CB 4995 C CG . LYS D 13 ? 0.6043 0.6392 0.4518 0.1310 -0.0346 -0.0499 13 LYS B CG 4996 C CD . LYS D 13 ? 0.7386 0.7709 0.5821 0.1373 -0.0437 -0.0556 13 LYS B CD 4997 C CE . LYS D 13 ? 0.8365 0.8702 0.6817 0.1419 -0.0492 -0.0665 13 LYS B CE 4998 N NZ . LYS D 13 ? 0.9360 0.9666 0.7834 0.1463 -0.0590 -0.0738 13 LYS B NZ 4999 N N . PRO D 14 ? 0.5004 0.5428 0.3415 0.1160 -0.0097 -0.0212 14 PRO B N 5000 C CA . PRO D 14 ? 0.4685 0.5124 0.3042 0.1118 -0.0031 -0.0109 14 PRO B CA 5001 C C . PRO D 14 ? 0.5146 0.5507 0.3427 0.1122 -0.0063 -0.0048 14 PRO B C 5002 O O . PRO D 14 ? 0.5880 0.6214 0.4080 0.1185 -0.0128 -0.0080 14 PRO B O 5003 C CB . PRO D 14 ? 0.3935 0.4479 0.2171 0.1156 0.0018 -0.0104 14 PRO B CB 5004 C CG . PRO D 14 ? 0.3681 0.4269 0.1970 0.1195 -0.0006 -0.0205 14 PRO B CG 5005 C CD . PRO D 14 ? 0.3895 0.4397 0.2251 0.1213 -0.0092 -0.0272 14 PRO B CD 5006 N N . SER D 15 ? 0.4866 0.5186 0.3181 0.1058 -0.0026 0.0034 15 SER B N 5007 C CA . SER D 15 ? 0.5063 0.5289 0.3316 0.1051 -0.0054 0.0105 15 SER B CA 5008 C C . SER D 15 ? 0.5965 0.6106 0.4333 0.1051 -0.0126 0.0063 15 SER B C 5009 O O . SER D 15 ? 0.6226 0.6282 0.4580 0.1039 -0.0152 0.0115 15 SER B O 5010 C CB . SER D 15 ? 0.4470 0.4689 0.2527 0.1117 -0.0080 0.0132 15 SER B CB 5011 O OG . SER D 15 ? 0.5008 0.5201 0.3053 0.1188 -0.0170 0.0049 15 SER B OG 5012 N N . GLU D 16 ? 0.5644 0.5805 0.4125 0.1061 -0.0158 -0.0031 16 GLU B N 5013 C CA . GLU D 16 ? 0.4999 0.5101 0.3603 0.1056 -0.0217 -0.0078 16 GLU B CA 5014 C C . GLU D 16 ? 0.4838 0.4911 0.3569 0.0981 -0.0178 -0.0048 16 GLU B C 5015 O O . GLU D 16 ? 0.4723 0.4816 0.3449 0.0934 -0.0111 0.0010 16 GLU B O 5016 C CB . GLU D 16 ? 0.4660 0.4793 0.3343 0.1084 -0.0260 -0.0187 16 GLU B CB 5017 C CG . GLU D 16 ? 0.5529 0.5666 0.4116 0.1165 -0.0333 -0.0235 16 GLU B CG 5018 C CD . GLU D 16 ? 0.6180 0.6350 0.4844 0.1187 -0.0372 -0.0343 16 GLU B CD 5019 O OE1 . GLU D 16 ? 0.5437 0.5615 0.4230 0.1137 -0.0346 -0.0377 16 GLU B OE1 5020 O OE2 . GLU D 16 ? 0.6733 0.6914 0.5323 0.1255 -0.0432 -0.0393 16 GLU B OE2 5021 N N . THR D 17 ? 0.4471 0.4505 0.3320 0.0973 -0.0221 -0.0094 17 THR B N 5022 C CA . THR D 17 ? 0.4101 0.4103 0.3064 0.0911 -0.0193 -0.0074 17 THR B CA 5023 C C . THR D 17 ? 0.3881 0.3912 0.2985 0.0880 -0.0184 -0.0150 17 THR B C 5024 O O . THR D 17 ? 0.4097 0.4135 0.3262 0.0903 -0.0231 -0.0224 17 THR B O 5025 C CB . THR D 17 ? 0.4541 0.4466 0.3522 0.0923 -0.0246 -0.0055 17 THR B CB 5026 O OG1 . THR D 17 ? 0.5144 0.5020 0.3985 0.0938 -0.0246 0.0033 17 THR B OG1 5027 C CG2 . THR D 17 ? 0.4364 0.4263 0.3474 0.0866 -0.0222 -0.0053 17 THR B CG2 5028 N N . LEU D 18 ? 0.3981 0.4027 0.3134 0.0825 -0.0124 -0.0130 18 LEU B N 5029 C CA . LEU D 18 ? 0.3556 0.3612 0.2826 0.0787 -0.0109 -0.0186 18 LEU B CA 5030 C C . LEU D 18 ? 0.3834 0.3852 0.3207 0.0761 -0.0124 -0.0198 18 LEU B C 5031 O O . LEU D 18 ? 0.3448 0.3430 0.2820 0.0741 -0.0112 -0.0144 18 LEU B O 5032 C CB . LEU D 18 ? 0.3330 0.3412 0.2603 0.0746 -0.0046 -0.0159 18 LEU B CB 5033 C CG . LEU D 18 ? 0.3083 0.3157 0.2455 0.0702 -0.0026 -0.0201 18 LEU B CG 5034 C CD1 . LEU D 18 ? 0.3563 0.3644 0.2961 0.0717 -0.0053 -0.0275 18 LEU B CD1 5035 C CD2 . LEU D 18 ? 0.3062 0.3156 0.2424 0.0670 0.0026 -0.0168 18 LEU B CD2 5036 N N . SER D 19 ? 0.3604 0.3631 0.3068 0.0760 -0.0149 -0.0272 19 SER B N 5037 C CA . SER D 19 ? 0.3190 0.3202 0.2765 0.0736 -0.0158 -0.0299 19 SER B CA 5038 C C . SER D 19 ? 0.3579 0.3614 0.3250 0.0690 -0.0128 -0.0355 19 SER B C 5039 O O . SER D 19 ? 0.4251 0.4311 0.3960 0.0696 -0.0148 -0.0416 19 SER B O 5040 C CB . SER D 19 ? 0.3709 0.3716 0.3309 0.0785 -0.0228 -0.0337 19 SER B CB 5041 O OG . SER D 19 ? 0.5329 0.5292 0.4834 0.0822 -0.0257 -0.0276 19 SER B OG 5042 N N . LEU D 20 ? 0.3084 0.3104 0.2790 0.0642 -0.0082 -0.0334 20 LEU B N 5043 C CA . LEU D 20 ? 0.3085 0.3115 0.2861 0.0594 -0.0047 -0.0376 20 LEU B CA 5044 C C . LEU D 20 ? 0.2841 0.2870 0.2710 0.0567 -0.0036 -0.0398 20 LEU B C 5045 O O . LEU D 20 ? 0.2638 0.2645 0.2507 0.0576 -0.0043 -0.0365 20 LEU B O 5046 C CB . LEU D 20 ? 0.2256 0.2272 0.1977 0.0565 -0.0001 -0.0340 20 LEU B CB 5047 C CG . LEU D 20 ? 0.3380 0.3406 0.3017 0.0592 -0.0006 -0.0331 20 LEU B CG 5048 C CD1 . LEU D 20 ? 0.3311 0.3327 0.2909 0.0568 0.0036 -0.0299 20 LEU B CD1 5049 C CD2 . LEU D 20 ? 0.2787 0.2819 0.2448 0.0598 -0.0030 -0.0394 20 LEU B CD2 5050 N N . THR D 21 ? 0.3576 0.3629 0.3523 0.0533 -0.0017 -0.0455 21 THR B N 5051 C CA . THR D 21 ? 0.3122 0.3190 0.3158 0.0507 0.0001 -0.0485 21 THR B CA 5052 C C . THR D 21 ? 0.3434 0.3496 0.3480 0.0447 0.0060 -0.0495 21 THR B C 5053 O O . THR D 21 ? 0.2908 0.2962 0.2926 0.0426 0.0075 -0.0504 21 THR B O 5054 C CB . THR D 21 ? 0.3692 0.3812 0.3833 0.0527 -0.0035 -0.0556 21 THR B CB 5055 O OG1 . THR D 21 ? 0.4436 0.4547 0.4551 0.0589 -0.0098 -0.0542 21 THR B OG1 5056 C CG2 . THR D 21 ? 0.3306 0.3457 0.3545 0.0504 -0.0013 -0.0597 21 THR B CG2 5057 N N . CYS D 22 ? 0.2793 0.2849 0.2867 0.0425 0.0088 -0.0493 22 CYS B N 5058 C CA . CYS D 22 ? 0.3032 0.3077 0.3101 0.0371 0.0143 -0.0501 22 CYS B CA 5059 C C . CYS D 22 ? 0.3496 0.3589 0.3664 0.0352 0.0163 -0.0559 22 CYS B C 5060 O O . CYS D 22 ? 0.3669 0.3773 0.3879 0.0377 0.0145 -0.0567 22 CYS B O 5061 C CB . CYS D 22 ? 0.3374 0.3370 0.3369 0.0365 0.0161 -0.0444 22 CYS B CB 5062 S SG . CYS D 22 ? 0.6516 0.6473 0.6456 0.0311 0.0216 -0.0439 22 CYS B SG 5063 N N . GLY D 23 ? 0.3053 0.3175 0.3259 0.0307 0.0200 -0.0601 23 GLY B N 5064 C CA . GLY D 23 ? 0.1990 0.2171 0.2285 0.0281 0.0234 -0.0658 23 GLY B CA 5065 C C . GLY D 23 ? 0.2967 0.3114 0.3203 0.0238 0.0291 -0.0639 23 GLY B C 5066 O O . GLY D 23 ? 0.3457 0.3540 0.3598 0.0211 0.0311 -0.0598 23 GLY B O 5067 N N . VAL D 24 ? 0.2371 0.2555 0.2656 0.0238 0.0310 -0.0672 24 VAL B N 5068 C CA . VAL D 24 ? 0.2422 0.2579 0.2648 0.0202 0.0363 -0.0664 24 VAL B CA 5069 C C . VAL D 24 ? 0.2570 0.2802 0.2862 0.0157 0.0422 -0.0727 24 VAL B C 5070 O O . VAL D 24 ? 0.3054 0.3373 0.3458 0.0177 0.0418 -0.0789 24 VAL B O 5071 C CB . VAL D 24 ? 0.2600 0.2733 0.2815 0.0239 0.0341 -0.0652 24 VAL B CB 5072 C CG1 . VAL D 24 ? 0.2197 0.2301 0.2342 0.0206 0.0389 -0.0648 24 VAL B CG1 5073 C CG2 . VAL D 24 ? 0.3931 0.4000 0.4090 0.0275 0.0289 -0.0588 24 VAL B CG2 5074 N N . TYR D 25 ? 0.2306 0.2506 0.2527 0.0097 0.0477 -0.0711 25 TYR B N 5075 C CA . TYR D 25 ? 0.2121 0.2391 0.2390 0.0040 0.0546 -0.0762 25 TYR B CA 5076 C C . TYR D 25 ? 0.2659 0.2885 0.2819 0.0004 0.0604 -0.0744 25 TYR B C 5077 O O . TYR D 25 ? 0.3092 0.3214 0.3120 -0.0014 0.0609 -0.0685 25 TYR B O 5078 C CB . TYR D 25 ? 0.2644 0.2916 0.2933 -0.0011 0.0563 -0.0764 25 TYR B CB 5079 C CG . TYR D 25 ? 0.2546 0.2854 0.2927 0.0031 0.0497 -0.0783 25 TYR B CG 5080 C CD1 . TYR D 25 ? 0.3375 0.3803 0.3912 0.0044 0.0487 -0.0858 25 TYR B CD1 5081 C CD2 . TYR D 25 ? 0.3247 0.3473 0.3556 0.0064 0.0442 -0.0731 25 TYR B CD2 5082 C CE1 . TYR D 25 ? 0.3308 0.3764 0.3918 0.0089 0.0419 -0.0877 25 TYR B CE1 5083 C CE2 . TYR D 25 ? 0.2536 0.2793 0.2912 0.0107 0.0381 -0.0748 25 TYR B CE2 5084 C CZ . TYR D 25 ? 0.3200 0.3565 0.3720 0.0120 0.0367 -0.0819 25 TYR B CZ 5085 O OH . TYR D 25 ? 0.4445 0.4835 0.5021 0.0168 0.0300 -0.0838 25 TYR B OH 5086 N N . GLY D 26 ? 0.2401 0.2708 0.2614 0.0001 0.0644 -0.0799 26 GLY B N 5087 C CA . GLY D 26 ? 0.2626 0.2901 0.2733 -0.0025 0.0698 -0.0791 26 GLY B CA 5088 C C . GLY D 26 ? 0.3428 0.3696 0.3530 0.0036 0.0660 -0.0803 26 GLY B C 5089 O O . GLY D 26 ? 0.3496 0.3752 0.3525 0.0030 0.0694 -0.0813 26 GLY B O 5090 N N . GLU D 27 ? 0.3537 0.3807 0.3713 0.0096 0.0588 -0.0802 27 GLU B N 5091 C CA . GLU D 27 ? 0.3684 0.3929 0.3861 0.0152 0.0540 -0.0805 27 GLU B CA 5092 C C . GLU D 27 ? 0.3251 0.3536 0.3552 0.0209 0.0474 -0.0831 27 GLU B C 5093 O O . GLU D 27 ? 0.2929 0.3232 0.3280 0.0212 0.0451 -0.0824 27 GLU B O 5094 C CB . GLU D 27 ? 0.3783 0.3910 0.3836 0.0159 0.0509 -0.0730 27 GLU B CB 5095 C CG . GLU D 27 ? 0.4501 0.4592 0.4546 0.0203 0.0467 -0.0730 27 GLU B CG 5096 C CD . GLU D 27 ? 0.4921 0.4913 0.4864 0.0206 0.0437 -0.0659 27 GLU B CD 5097 O OE1 . GLU D 27 ? 0.5517 0.5469 0.5390 0.0180 0.0449 -0.0614 27 GLU B OE1 5098 O OE2 . GLU D 27 ? 0.5307 0.5265 0.5247 0.0236 0.0398 -0.0654 27 GLU B OE2 5099 N N . SER D 28 ? 0.2917 0.3206 0.3259 0.0256 0.0439 -0.0862 28 SER B N 5100 C CA . SER D 28 ? 0.3559 0.3851 0.3991 0.0316 0.0366 -0.0875 28 SER B CA 5101 C C . SER D 28 ? 0.3503 0.3685 0.3865 0.0337 0.0309 -0.0796 28 SER B C 5102 O O . SER D 28 ? 0.2645 0.2761 0.2908 0.0314 0.0324 -0.0748 28 SER B O 5103 C CB . SER D 28 ? 0.3242 0.3590 0.3759 0.0357 0.0353 -0.0956 28 SER B CB 5104 O OG . SER D 28 ? 0.3301 0.3581 0.3838 0.0412 0.0275 -0.0940 28 SER B OG 5105 N N . LEU D 29 ? 0.3222 0.3385 0.3635 0.0380 0.0244 -0.0781 29 LEU B N 5106 C CA . LEU D 29 ? 0.2880 0.2947 0.3234 0.0396 0.0195 -0.0706 29 LEU B CA 5107 C C . LEU D 29 ? 0.3234 0.3248 0.3583 0.0414 0.0170 -0.0710 29 LEU B C 5108 O O . LEU D 29 ? 0.2382 0.2319 0.2675 0.0410 0.0147 -0.0649 29 LEU B O 5109 C CB . LEU D 29 ? 0.2922 0.2977 0.3318 0.0437 0.0134 -0.0688 29 LEU B CB 5110 C CG . LEU D 29 ? 0.3259 0.3344 0.3644 0.0425 0.0141 -0.0669 29 LEU B CG 5111 C CD1 . LEU D 29 ? 0.3212 0.3277 0.3622 0.0474 0.0073 -0.0653 29 LEU B CD1 5112 C CD2 . LEU D 29 ? 0.3227 0.3266 0.3505 0.0387 0.0171 -0.0601 29 LEU B CD2 5113 N N . SER D 30 ? 0.2481 0.2542 0.2895 0.0434 0.0176 -0.0789 30 SER B N 5114 C CA . SER D 30 ? 0.3166 0.3181 0.3590 0.0459 0.0145 -0.0813 30 SER B CA 5115 C C . SER D 30 ? 0.3355 0.3306 0.3685 0.0429 0.0160 -0.0769 30 SER B C 5116 O O . SER D 30 ? 0.3839 0.3809 0.4098 0.0390 0.0216 -0.0761 30 SER B O 5117 C CB . SER D 30 ? 0.3446 0.3549 0.3941 0.0479 0.0169 -0.0916 30 SER B CB 5118 O OG . SER D 30 ? 0.6054 0.6117 0.6540 0.0498 0.0151 -0.0947 30 SER B OG 5119 N N . GLY D 31 ? 0.3464 0.3332 0.3794 0.0446 0.0105 -0.0740 31 GLY B N 5120 C CA . GLY D 31 ? 0.3245 0.3060 0.3513 0.0425 0.0107 -0.0718 31 GLY B CA 5121 C C . GLY D 31 ? 0.3413 0.3200 0.3599 0.0386 0.0127 -0.0639 31 GLY B C 5122 O O . GLY D 31 ? 0.3280 0.3039 0.3410 0.0369 0.0135 -0.0630 31 GLY B O 5123 N N . HIS D 32 ? 0.2519 0.2314 0.2698 0.0378 0.0130 -0.0589 32 HIS B N 5124 C CA . HIS D 32 ? 0.2851 0.2627 0.2958 0.0349 0.0146 -0.0522 32 HIS B CA 5125 C C . HIS D 32 ? 0.3136 0.2890 0.3254 0.0354 0.0116 -0.0458 32 HIS B C 5126 O O . HIS D 32 ? 0.2874 0.2627 0.3042 0.0380 0.0086 -0.0464 32 HIS B O 5127 C CB . HIS D 32 ? 0.2746 0.2565 0.2796 0.0325 0.0201 -0.0529 32 HIS B CB 5128 C CG . HIS D 32 ? 0.3588 0.3423 0.3598 0.0312 0.0241 -0.0579 32 HIS B CG 5129 N ND1 . HIS D 32 ? 0.3432 0.3317 0.3489 0.0322 0.0261 -0.0649 32 HIS B ND1 5130 C CD2 . HIS D 32 ? 0.3721 0.3529 0.3643 0.0292 0.0263 -0.0570 32 HIS B CD2 5131 C CE1 . HIS D 32 ? 0.3782 0.3672 0.3773 0.0305 0.0301 -0.0677 32 HIS B CE1 5132 N NE2 . HIS D 32 ? 0.3903 0.3739 0.3806 0.0287 0.0299 -0.0628 32 HIS B NE2 5133 N N . TYR D 33 ? 0.2253 0.1991 0.2320 0.0333 0.0122 -0.0400 33 TYR B N 5134 C CA . TYR D 33 ? 0.2348 0.2082 0.2405 0.0334 0.0109 -0.0339 33 TYR B CA 5135 C C . TYR D 33 ? 0.3040 0.2818 0.3054 0.0331 0.0141 -0.0338 33 TYR B C 5136 O O . TYR D 33 ? 0.2885 0.2681 0.2864 0.0316 0.0175 -0.0364 33 TYR B O 5137 C CB . TYR D 33 ? 0.2384 0.2093 0.2421 0.0313 0.0101 -0.0283 33 TYR B CB 5138 C CG . TYR D 33 ? 0.3154 0.2809 0.3240 0.0309 0.0063 -0.0275 33 TYR B CG 5139 C CD1 . TYR D 33 ? 0.2875 0.2511 0.2977 0.0303 0.0056 -0.0316 33 TYR B CD1 5140 C CD2 . TYR D 33 ? 0.2923 0.2537 0.3031 0.0311 0.0032 -0.0226 33 TYR B CD2 5141 C CE1 . TYR D 33 ? 0.2915 0.2494 0.3067 0.0298 0.0014 -0.0314 33 TYR B CE1 5142 C CE2 . TYR D 33 ? 0.2752 0.2301 0.2905 0.0301 -0.0007 -0.0215 33 TYR B CE2 5143 C CZ . TYR D 33 ? 0.2999 0.2531 0.3180 0.0295 -0.0017 -0.0262 33 TYR B CZ 5144 O OH . TYR D 33 ? 0.4042 0.3503 0.4274 0.0285 -0.0060 -0.0257 33 TYR B OH 5145 N N . TRP D 34 ? 0.2794 0.2582 0.2807 0.0346 0.0128 -0.0307 34 TRP B N 5146 C CA . TRP D 34 ? 0.2577 0.2402 0.2558 0.0347 0.0148 -0.0310 34 TRP B CA 5147 C C . TRP D 34 ? 0.2817 0.2642 0.2755 0.0353 0.0140 -0.0250 34 TRP B C 5148 O O . TRP D 34 ? 0.3569 0.3374 0.3514 0.0367 0.0112 -0.0214 34 TRP B O 5149 C CB . TRP D 34 ? 0.2420 0.2273 0.2452 0.0368 0.0138 -0.0356 34 TRP B CB 5150 C CG . TRP D 34 ? 0.2310 0.2181 0.2386 0.0360 0.0156 -0.0419 34 TRP B CG 5151 C CD1 . TRP D 34 ? 0.2134 0.1994 0.2269 0.0378 0.0133 -0.0451 34 TRP B CD1 5152 C CD2 . TRP D 34 ? 0.2179 0.2078 0.2235 0.0332 0.0203 -0.0456 34 TRP B CD2 5153 N NE1 . TRP D 34 ? 0.2854 0.2747 0.3009 0.0366 0.0166 -0.0512 34 TRP B NE1 5154 C CE2 . TRP D 34 ? 0.2564 0.2480 0.2668 0.0334 0.0213 -0.0512 34 TRP B CE2 5155 C CE3 . TRP D 34 ? 0.1888 0.1792 0.1886 0.0306 0.0237 -0.0446 34 TRP B CE3 5156 C CZ2 . TRP D 34 ? 0.2718 0.2665 0.2806 0.0306 0.0263 -0.0554 34 TRP B CZ2 5157 C CZ3 . TRP D 34 ? 0.1982 0.1901 0.1964 0.0275 0.0282 -0.0484 34 TRP B CZ3 5158 C CH2 . TRP D 34 ? 0.2485 0.2428 0.2508 0.0274 0.0298 -0.0535 34 TRP B CH2 5159 N N . SER D 35 ? 0.2645 0.2486 0.2529 0.0342 0.0163 -0.0239 35 SER B N 5160 C CA . SER D 35 ? 0.3458 0.3310 0.3302 0.0345 0.0163 -0.0187 35 SER B CA 5161 C C . SER D 35 ? 0.3155 0.3035 0.2953 0.0360 0.0169 -0.0186 35 SER B C 5162 O O . SER D 35 ? 0.2723 0.2606 0.2513 0.0359 0.0178 -0.0224 35 SER B O 5163 C CB . SER D 35 ? 0.3459 0.3306 0.3289 0.0324 0.0175 -0.0177 35 SER B CB 5164 O OG . SER D 35 ? 0.5172 0.5049 0.4973 0.0327 0.0180 -0.0138 35 SER B OG 5165 N N . TRP D 36 ? 0.2489 0.2391 0.2255 0.0373 0.0165 -0.0143 36 TRP B N 5166 C CA . TRP D 36 ? 0.2240 0.2171 0.1956 0.0394 0.0168 -0.0145 36 TRP B CA 5167 C C . TRP D 36 ? 0.3426 0.3387 0.3110 0.0392 0.0183 -0.0119 36 TRP B C 5168 O O . TRP D 36 ? 0.3533 0.3509 0.3233 0.0379 0.0189 -0.0082 36 TRP B O 5169 C CB . TRP D 36 ? 0.2715 0.2659 0.2414 0.0423 0.0147 -0.0128 36 TRP B CB 5170 C CG . TRP D 36 ? 0.2608 0.2538 0.2346 0.0434 0.0125 -0.0168 36 TRP B CG 5171 C CD1 . TRP D 36 ? 0.2272 0.2176 0.2056 0.0437 0.0104 -0.0171 36 TRP B CD1 5172 C CD2 . TRP D 36 ? 0.3202 0.3144 0.2945 0.0445 0.0119 -0.0216 36 TRP B CD2 5173 N NE1 . TRP D 36 ? 0.2633 0.2548 0.2457 0.0452 0.0087 -0.0222 36 TRP B NE1 5174 C CE2 . TRP D 36 ? 0.2813 0.2752 0.2615 0.0452 0.0098 -0.0250 36 TRP B CE2 5175 C CE3 . TRP D 36 ? 0.3526 0.3478 0.3233 0.0448 0.0126 -0.0238 36 TRP B CE3 5176 C CZ2 . TRP D 36 ? 0.2440 0.2399 0.2277 0.0458 0.0088 -0.0305 36 TRP B CZ2 5177 C CZ3 . TRP D 36 ? 0.2924 0.2881 0.2659 0.0450 0.0115 -0.0288 36 TRP B CZ3 5178 C CH2 . TRP D 36 ? 0.2443 0.2410 0.2247 0.0452 0.0098 -0.0321 36 TRP B CH2 5179 N N . VAL D 37 ? 0.2442 0.2412 0.2086 0.0405 0.0187 -0.0142 37 VAL B N 5180 C CA . VAL D 37 ? 0.3096 0.3099 0.2712 0.0413 0.0195 -0.0133 37 VAL B CA 5181 C C . VAL D 37 ? 0.3115 0.3137 0.2681 0.0448 0.0187 -0.0151 37 VAL B C 5182 O O . VAL D 37 ? 0.3751 0.3738 0.3306 0.0452 0.0176 -0.0184 37 VAL B O 5183 C CB . VAL D 37 ? 0.3275 0.3244 0.2890 0.0397 0.0198 -0.0155 37 VAL B CB 5184 C CG1 . VAL D 37 ? 0.3166 0.3169 0.2752 0.0418 0.0196 -0.0159 37 VAL B CG1 5185 C CG2 . VAL D 37 ? 0.2958 0.2912 0.2621 0.0367 0.0202 -0.0143 37 VAL B CG2 5186 N N . ARG D 38 ? 0.2716 0.2800 0.2258 0.0472 0.0192 -0.0135 38 ARG B N 5187 C CA . ARG D 38 ? 0.3141 0.3243 0.2633 0.0513 0.0180 -0.0161 38 ARG B CA 5188 C C . ARG D 38 ? 0.2916 0.3051 0.2388 0.0535 0.0180 -0.0178 38 ARG B C 5189 O O . ARG D 38 ? 0.2955 0.3123 0.2455 0.0522 0.0193 -0.0164 38 ARG B O 5190 C CB . ARG D 38 ? 0.3305 0.3458 0.2770 0.0538 0.0181 -0.0137 38 ARG B CB 5191 C CG . ARG D 38 ? 0.3706 0.3939 0.3166 0.0539 0.0208 -0.0096 38 ARG B CG 5192 C CD . ARG D 38 ? 0.3088 0.3356 0.2499 0.0562 0.0210 -0.0068 38 ARG B CD 5193 N NE . ARG D 38 ? 0.3532 0.3875 0.2936 0.0551 0.0246 -0.0019 38 ARG B NE 5194 C CZ . ARG D 38 ? 0.4072 0.4452 0.3418 0.0566 0.0258 0.0017 38 ARG B CZ 5195 N NH1 . ARG D 38 ? 0.3869 0.4215 0.3157 0.0600 0.0228 0.0006 38 ARG B NH1 5196 N NH2 . ARG D 38 ? 0.4433 0.4885 0.3775 0.0545 0.0299 0.0065 38 ARG B NH2 5197 N N . GLN D 39 ? 0.2823 0.2946 0.2250 0.0572 0.0159 -0.0214 39 GLN B N 5198 C CA . GLN D 39 ? 0.2637 0.2778 0.2040 0.0604 0.0147 -0.0241 39 GLN B CA 5199 C C . GLN D 39 ? 0.3224 0.3404 0.2582 0.0658 0.0131 -0.0270 39 GLN B C 5200 O O . GLN D 39 ? 0.3109 0.3226 0.2436 0.0672 0.0103 -0.0302 39 GLN B O 5201 C CB . GLN D 39 ? 0.3212 0.3251 0.2597 0.0592 0.0126 -0.0267 39 GLN B CB 5202 C CG . GLN D 39 ? 0.3353 0.3395 0.2714 0.0628 0.0105 -0.0294 39 GLN B CG 5203 C CD . GLN D 39 ? 0.3664 0.3591 0.2993 0.0610 0.0083 -0.0307 39 GLN B CD 5204 O OE1 . GLN D 39 ? 0.3393 0.3228 0.2697 0.0582 0.0080 -0.0310 39 GLN B OE1 5205 N NE2 . GLN D 39 ? 0.2936 0.2868 0.2261 0.0627 0.0069 -0.0316 39 GLN B NE2 5206 N N . PRO D 40 ? 0.3303 0.3593 0.2659 0.0686 0.0150 -0.0260 40 PRO B N 5207 C CA . PRO D 40 ? 0.4172 0.4514 0.3478 0.0746 0.0137 -0.0294 40 PRO B CA 5208 C C . PRO D 40 ? 0.4738 0.5037 0.4021 0.0787 0.0098 -0.0350 40 PRO B C 5209 O O . PRO D 40 ? 0.4830 0.5098 0.4135 0.0775 0.0091 -0.0355 40 PRO B O 5210 C CB . PRO D 40 ? 0.4134 0.4613 0.3452 0.0755 0.0178 -0.0267 40 PRO B CB 5211 C CG . PRO D 40 ? 0.3540 0.4017 0.2908 0.0692 0.0210 -0.0207 40 PRO B CG 5212 C CD . PRO D 40 ? 0.3118 0.3491 0.2518 0.0660 0.0189 -0.0217 40 PRO B CD 5213 N N . PRO D 41 ? 0.4976 0.5264 0.4210 0.0837 0.0066 -0.0395 41 PRO B N 5214 C CA . PRO D 41 ? 0.5543 0.5767 0.4748 0.0880 0.0019 -0.0451 41 PRO B CA 5215 C C . PRO D 41 ? 0.5175 0.5459 0.4399 0.0909 0.0019 -0.0468 41 PRO B C 5216 O O . PRO D 41 ? 0.5111 0.5534 0.4354 0.0936 0.0049 -0.0467 41 PRO B O 5217 C CB . PRO D 41 ? 0.5847 0.6103 0.5004 0.0939 -0.0006 -0.0494 41 PRO B CB 5218 C CG . PRO D 41 ? 0.5957 0.6231 0.5112 0.0912 0.0015 -0.0460 41 PRO B CG 5219 C CD . PRO D 41 ? 0.5129 0.5460 0.4328 0.0861 0.0068 -0.0396 41 PRO B CD 5220 N N . GLY D 42 ? 0.5169 0.5351 0.4389 0.0903 -0.0013 -0.0481 42 GLY B N 5221 C CA . GLY D 42 ? 0.5430 0.5654 0.4668 0.0937 -0.0027 -0.0505 42 GLY B CA 5222 C C . GLY D 42 ? 0.6438 0.6779 0.5747 0.0906 0.0020 -0.0469 42 GLY B C 5223 O O . GLY D 42 ? 0.5856 0.6278 0.5199 0.0941 0.0013 -0.0496 42 GLY B O 5224 N N . LYS D 43 ? 0.6956 0.7303 0.6293 0.0842 0.0062 -0.0413 43 LYS B N 5225 C CA . LYS D 43 ? 0.5456 0.5900 0.4864 0.0804 0.0104 -0.0376 43 LYS B CA 5226 C C . LYS D 43 ? 0.4043 0.4393 0.3471 0.0742 0.0107 -0.0341 43 LYS B C 5227 O O . LYS D 43 ? 0.4830 0.5049 0.4215 0.0727 0.0082 -0.0344 43 LYS B O 5228 C CB . LYS D 43 ? 0.5531 0.6086 0.4955 0.0788 0.0155 -0.0339 43 LYS B CB 5229 C CG . LYS D 43 ? 0.6063 0.6748 0.5473 0.0846 0.0167 -0.0371 43 LYS B CG 5230 C CD . LYS D 43 ? 0.7782 0.8577 0.7202 0.0818 0.0226 -0.0320 43 LYS B CD 5231 C CE . LYS D 43 ? 0.9210 1.0162 0.8620 0.0872 0.0251 -0.0351 43 LYS B CE 5232 N NZ . LYS D 43 ? 0.9820 1.0881 0.9235 0.0833 0.0318 -0.0291 43 LYS B NZ 5233 N N . ARG D 44 ? 0.3670 0.4093 0.3166 0.0704 0.0138 -0.0309 44 ARG B N 5234 C CA . ARG D 44 ? 0.4381 0.4727 0.3900 0.0652 0.0138 -0.0285 44 ARG B CA 5235 C C . ARG D 44 ? 0.4653 0.4957 0.4175 0.0602 0.0164 -0.0241 44 ARG B C 5236 O O . ARG D 44 ? 0.4597 0.4943 0.4108 0.0605 0.0184 -0.0222 44 ARG B O 5237 C CB . ARG D 44 ? 0.4094 0.4529 0.3695 0.0635 0.0149 -0.0280 44 ARG B CB 5238 C CG . ARG D 44 ? 0.3350 0.3880 0.3014 0.0590 0.0199 -0.0233 44 ARG B CG 5239 C CD . ARG D 44 ? 0.3398 0.4021 0.3157 0.0569 0.0208 -0.0234 44 ARG B CD 5240 N NE . ARG D 44 ? 0.3336 0.4097 0.3131 0.0612 0.0213 -0.0269 44 ARG B NE 5241 C CZ . ARG D 44 ? 0.3699 0.4565 0.3587 0.0607 0.0215 -0.0289 44 ARG B CZ 5242 N NH1 . ARG D 44 ? 0.2641 0.3478 0.2589 0.0561 0.0207 -0.0276 44 ARG B NH1 5243 N NH2 . ARG D 44 ? 0.3407 0.4412 0.3333 0.0651 0.0222 -0.0329 44 ARG B NH2 5244 N N . LEU D 45 ? 0.4312 0.4534 0.3843 0.0562 0.0159 -0.0228 45 LEU B N 5245 C CA . LEU D 45 ? 0.3832 0.4012 0.3374 0.0519 0.0177 -0.0196 45 LEU B CA 5246 C C . LEU D 45 ? 0.3892 0.4149 0.3496 0.0490 0.0207 -0.0154 45 LEU B C 5247 O O . LEU D 45 ? 0.3515 0.3836 0.3171 0.0480 0.0215 -0.0150 45 LEU B O 5248 C CB . LEU D 45 ? 0.3642 0.3719 0.3174 0.0490 0.0166 -0.0203 45 LEU B CB 5249 C CG . LEU D 45 ? 0.3791 0.3775 0.3250 0.0509 0.0140 -0.0236 45 LEU B CG 5250 C CD1 . LEU D 45 ? 0.3468 0.3380 0.2904 0.0496 0.0124 -0.0246 45 LEU B CD1 5251 C CD2 . LEU D 45 ? 0.4023 0.3949 0.3460 0.0493 0.0146 -0.0236 45 LEU B CD2 5252 N N . GLU D 46 ? 0.3786 0.4036 0.3386 0.0475 0.0221 -0.0124 46 GLU B N 5253 C CA . GLU D 46 ? 0.3528 0.3820 0.3172 0.0441 0.0246 -0.0076 46 GLU B CA 5254 C C . GLU D 46 ? 0.2922 0.3134 0.2577 0.0412 0.0239 -0.0057 46 GLU B C 5255 O O . GLU D 46 ? 0.3855 0.4024 0.3474 0.0426 0.0228 -0.0065 46 GLU B O 5256 C CB . GLU D 46 ? 0.4217 0.4592 0.3836 0.0459 0.0269 -0.0049 46 GLU B CB 5257 C CG . GLU D 46 ? 0.6290 0.6694 0.5943 0.0416 0.0296 0.0011 46 GLU B CG 5258 C CD . GLU D 46 ? 0.7477 0.7925 0.7073 0.0429 0.0318 0.0048 46 GLU B CD 5259 O OE1 . GLU D 46 ? 0.7708 0.8162 0.7239 0.0476 0.0307 0.0023 46 GLU B OE1 5260 O OE2 . GLU D 46 ? 0.7415 0.7886 0.7025 0.0392 0.0344 0.0105 46 GLU B OE2 5261 N N . TRP D 47 ? 0.2871 0.3066 0.2582 0.0373 0.0242 -0.0038 47 TRP B N 5262 C CA . TRP D 47 ? 0.3164 0.3289 0.2895 0.0350 0.0232 -0.0023 47 TRP B CA 5263 C C . TRP D 47 ? 0.3382 0.3512 0.3095 0.0350 0.0238 0.0022 47 TRP B C 5264 O O . TRP D 47 ? 0.3839 0.4025 0.3554 0.0338 0.0259 0.0064 47 TRP B O 5265 C CB . TRP D 47 ? 0.3342 0.3449 0.3138 0.0313 0.0227 -0.0018 47 TRP B CB 5266 C CG . TRP D 47 ? 0.3262 0.3296 0.3087 0.0292 0.0212 -0.0010 47 TRP B CG 5267 C CD1 . TRP D 47 ? 0.3202 0.3173 0.3021 0.0299 0.0197 -0.0046 47 TRP B CD1 5268 C CD2 . TRP D 47 ? 0.3179 0.3195 0.3045 0.0262 0.0210 0.0035 47 TRP B CD2 5269 N NE1 . TRP D 47 ? 0.3265 0.3187 0.3123 0.0283 0.0182 -0.0033 47 TRP B NE1 5270 C CE2 . TRP D 47 ? 0.3225 0.3163 0.3110 0.0260 0.0185 0.0018 47 TRP B CE2 5271 C CE3 . TRP D 47 ? 0.3119 0.3175 0.3007 0.0234 0.0227 0.0088 47 TRP B CE3 5272 C CZ2 . TRP D 47 ? 0.3594 0.3479 0.3515 0.0237 0.0169 0.0051 47 TRP B CZ2 5273 C CZ3 . TRP D 47 ? 0.3454 0.3453 0.3375 0.0201 0.0216 0.0128 47 TRP B CZ3 5274 C CH2 . TRP D 47 ? 0.3808 0.3716 0.3744 0.0206 0.0182 0.0109 47 TRP B CH2 5275 N N . ILE D 48 ? 0.3003 0.3078 0.2695 0.0364 0.0219 0.0014 48 ILE B N 5276 C CA . ILE D 48 ? 0.2779 0.2841 0.2441 0.0372 0.0213 0.0054 48 ILE B CA 5277 C C . ILE D 48 ? 0.3418 0.3413 0.3121 0.0346 0.0196 0.0080 48 ILE B C 5278 O O . ILE D 48 ? 0.2926 0.2910 0.2616 0.0331 0.0199 0.0136 48 ILE B O 5279 C CB . ILE D 48 ? 0.2733 0.2779 0.2352 0.0412 0.0192 0.0022 48 ILE B CB 5280 C CG1 . ILE D 48 ? 0.2978 0.3081 0.2547 0.0443 0.0202 0.0001 48 ILE B CG1 5281 C CG2 . ILE D 48 ? 0.2099 0.2114 0.1685 0.0426 0.0173 0.0058 48 ILE B CG2 5282 C CD1 . ILE D 48 ? 0.3252 0.3337 0.2789 0.0479 0.0177 -0.0040 48 ILE B CD1 5283 N N . GLY D 49 ? 0.2941 0.2887 0.2688 0.0340 0.0178 0.0039 49 GLY B N 5284 C CA . GLY D 49 ? 0.2513 0.2391 0.2304 0.0324 0.0155 0.0049 49 GLY B CA 5285 C C . GLY D 49 ? 0.2940 0.2784 0.2769 0.0332 0.0138 -0.0013 49 GLY B C 5286 O O . GLY D 49 ? 0.3327 0.3194 0.3144 0.0342 0.0150 -0.0057 49 GLY B O 5287 N N . GLU D 50 ? 0.2940 0.2726 0.2813 0.0327 0.0112 -0.0016 50 GLU B N 5288 C CA . GLU D 50 ? 0.3333 0.3096 0.3247 0.0335 0.0100 -0.0079 50 GLU B CA 5289 C C . GLU D 50 ? 0.3817 0.3517 0.3771 0.0347 0.0060 -0.0081 50 GLU B C 5290 O O . GLU D 50 ? 0.3354 0.3010 0.3302 0.0340 0.0040 -0.0027 50 GLU B O 5291 C CB . GLU D 50 ? 0.3311 0.3080 0.3247 0.0311 0.0116 -0.0107 50 GLU B CB 5292 C CG . GLU D 50 ? 0.2803 0.2540 0.2776 0.0283 0.0103 -0.0079 50 GLU B CG 5293 C CD . GLU D 50 ? 0.4418 0.4175 0.4399 0.0264 0.0117 -0.0102 50 GLU B CD 5294 O OE1 . GLU D 50 ? 0.3898 0.3695 0.3838 0.0270 0.0140 -0.0118 50 GLU B OE1 5295 O OE2 . GLU D 50 ? 0.5281 0.5006 0.5307 0.0245 0.0099 -0.0107 50 GLU B OE2 5296 N N . ILE D 51 ? 0.3178 0.2874 0.3175 0.0364 0.0048 -0.0145 51 ILE B N 5297 C CA . ILE D 51 ? 0.3843 0.3483 0.3886 0.0386 0.0003 -0.0162 51 ILE B CA 5298 C C . ILE D 51 ? 0.3982 0.3634 0.4081 0.0394 0.0005 -0.0242 51 ILE B C 5299 O O . ILE D 51 ? 0.3594 0.3303 0.3688 0.0389 0.0040 -0.0285 51 ILE B O 5300 C CB . ILE D 51 ? 0.4255 0.3888 0.4282 0.0425 -0.0028 -0.0155 51 ILE B CB 5301 C CG1 . ILE D 51 ? 0.4885 0.4439 0.4947 0.0452 -0.0087 -0.0156 51 ILE B CG1 5302 C CG2 . ILE D 51 ? 0.3356 0.3058 0.3400 0.0445 -0.0013 -0.0219 51 ILE B CG2 5303 C CD1 . ILE D 51 ? 0.5274 0.4806 0.5304 0.0495 -0.0128 -0.0139 51 ILE B CD1 5304 N N . LYS D 52 ? 0.3264 0.2861 0.3412 0.0405 -0.0033 -0.0262 52 LYS B N 5305 C CA . LYS D 52 ? 0.2877 0.2494 0.3082 0.0424 -0.0036 -0.0347 52 LYS B CA 5306 C C . LYS D 52 ? 0.4244 0.3829 0.4501 0.0471 -0.0090 -0.0381 52 LYS B C 5307 O O . LYS D 52 ? 0.4921 0.4559 0.5230 0.0498 -0.0088 -0.0457 52 LYS B O 5308 C CB . LYS D 52 ? 0.4317 0.3903 0.4537 0.0403 -0.0035 -0.0365 52 LYS B CB 5309 C CG . LYS D 52 ? 0.5547 0.5159 0.5817 0.0427 -0.0035 -0.0457 52 LYS B CG 5310 C CD . LYS D 52 ? 0.6811 0.6369 0.7104 0.0422 -0.0061 -0.0479 52 LYS B CD 5311 C CE . LYS D 52 ? 0.7163 0.6735 0.7407 0.0383 -0.0025 -0.0464 52 LYS B CE 5312 N NZ . LYS D 52 ? 0.7381 0.6899 0.7652 0.0381 -0.0057 -0.0489 52 LYS B NZ 5313 N N . HIS D 53 ? 0.4911 0.4410 0.5156 0.0481 -0.0140 -0.0324 53 HIS B N 5314 C CA . HIS D 53 ? 0.4073 0.3520 0.4353 0.0532 -0.0205 -0.0345 53 HIS B CA 5315 C C . HIS D 53 ? 0.4017 0.3426 0.4233 0.0544 -0.0229 -0.0272 53 HIS B C 5316 O O . HIS D 53 ? 0.4755 0.4116 0.4909 0.0509 -0.0220 -0.0187 53 HIS B O 5317 C CB . HIS D 53 ? 0.4667 0.4009 0.4982 0.0540 -0.0260 -0.0347 53 HIS B CB 5318 C CG . HIS D 53 ? 0.5360 0.4726 0.5725 0.0532 -0.0243 -0.0416 53 HIS B CG 5319 N ND1 . HIS D 53 ? 0.4891 0.4183 0.5263 0.0504 -0.0260 -0.0396 53 HIS B ND1 5320 C CD2 . HIS D 53 ? 0.6065 0.5522 0.6473 0.0547 -0.0211 -0.0506 53 HIS B CD2 5321 C CE1 . HIS D 53 ? 0.5731 0.5065 0.6142 0.0509 -0.0244 -0.0473 53 HIS B CE1 5322 N NE2 . HIS D 53 ? 0.6422 0.5856 0.6849 0.0533 -0.0210 -0.0539 53 HIS B NE2 5323 N N . ASN D 54 ? 0.4252 0.3689 0.4485 0.0593 -0.0260 -0.0309 54 ASN B N 5324 C CA . ASN D 54 ? 0.5456 0.4844 0.5621 0.0618 -0.0298 -0.0248 54 ASN B CA 5325 C C . ASN D 54 ? 0.7011 0.6256 0.7132 0.0614 -0.0348 -0.0172 54 ASN B C 5326 O O . ASN D 54 ? 0.7083 0.6253 0.7254 0.0637 -0.0400 -0.0203 54 ASN B O 5327 C CB . ASN D 54 ? 0.4846 0.4270 0.5054 0.0683 -0.0345 -0.0316 54 ASN B CB 5328 C CG . ASN D 54 ? 0.5767 0.5324 0.6000 0.0678 -0.0296 -0.0367 54 ASN B CG 5329 O OD1 . ASN D 54 ? 0.5210 0.4802 0.5380 0.0643 -0.0248 -0.0322 54 ASN B OD1 5330 N ND2 . ASN D 54 ? 0.5684 0.5316 0.6013 0.0713 -0.0309 -0.0464 54 ASN B ND2 5331 N N . GLY D 55 ? 0.7437 0.6642 0.7463 0.0583 -0.0332 -0.0075 55 GLY B N 5332 C CA . GLY D 55 ? 0.8117 0.7185 0.8092 0.0564 -0.0369 0.0010 55 GLY B CA 5333 C C . GLY D 55 ? 0.8266 0.7321 0.8252 0.0492 -0.0324 0.0054 55 GLY B C 5334 O O . GLY D 55 ? 0.7800 0.6750 0.7748 0.0458 -0.0342 0.0132 55 GLY B O 5335 N N . SER D 56 ? 0.8137 0.7296 0.8175 0.0466 -0.0269 0.0003 56 SER B N 5336 C CA . SER D 56 ? 0.6175 0.5343 0.6225 0.0402 -0.0226 0.0036 56 SER B CA 5337 C C . SER D 56 ? 0.5308 0.4600 0.5335 0.0376 -0.0153 0.0035 56 SER B C 5338 O O . SER D 56 ? 0.5133 0.4487 0.5203 0.0362 -0.0123 -0.0016 56 SER B O 5339 C CB . SER D 56 ? 0.5768 0.4913 0.5904 0.0398 -0.0244 -0.0031 56 SER B CB 5340 O OG . SER D 56 ? 0.6950 0.5969 0.7112 0.0422 -0.0317 -0.0032 56 SER B OG 5341 N N . PRO D 57 ? 0.3939 0.3264 0.3890 0.0375 -0.0130 0.0091 57 PRO B N 5342 C CA . PRO D 57 ? 0.4254 0.3691 0.4183 0.0358 -0.0069 0.0086 57 PRO B CA 5343 C C . PRO D 57 ? 0.4450 0.3905 0.4376 0.0300 -0.0029 0.0140 57 PRO B C 5344 O O . PRO D 57 ? 0.4980 0.4364 0.4912 0.0266 -0.0044 0.0195 57 PRO B O 5345 C CB . PRO D 57 ? 0.4859 0.4320 0.4709 0.0390 -0.0069 0.0113 57 PRO B CB 5346 C CG . PRO D 57 ? 0.4754 0.4109 0.4556 0.0394 -0.0111 0.0182 57 PRO B CG 5347 C CD . PRO D 57 ? 0.4353 0.3614 0.4226 0.0396 -0.0161 0.0155 57 PRO B CD 5348 N N . ASN D 58 ? 0.3945 0.3495 0.3867 0.0287 0.0018 0.0121 58 ASN B N 5349 C CA . ASN D 58 ? 0.4419 0.4014 0.4348 0.0239 0.0056 0.0162 58 ASN B CA 5350 C C . ASN D 58 ? 0.4113 0.3802 0.3984 0.0248 0.0098 0.0175 58 ASN B C 5351 O O . ASN D 58 ? 0.4469 0.4214 0.4336 0.0271 0.0112 0.0122 58 ASN B O 5352 C CB . ASN D 58 ? 0.5112 0.4723 0.5110 0.0218 0.0060 0.0111 58 ASN B CB 5353 C CG . ASN D 58 ? 0.7057 0.6705 0.7086 0.0167 0.0086 0.0148 58 ASN B CG 5354 O OD1 . ASN D 58 ? 0.8006 0.7661 0.8016 0.0138 0.0103 0.0216 58 ASN B OD1 5355 N ND2 . ASN D 58 ? 0.7581 0.7259 0.7658 0.0156 0.0089 0.0101 58 ASN B ND2 5356 N N . TYR D 59 ? 0.3328 0.3032 0.3149 0.0231 0.0119 0.0244 59 TYR B N 5357 C CA . TYR D 59 ? 0.3891 0.3683 0.3648 0.0250 0.0154 0.0254 59 TYR B CA 5358 C C . TYR D 59 ? 0.4364 0.4246 0.4139 0.0212 0.0202 0.0279 59 TYR B C 5359 O O . TYR D 59 ? 0.5005 0.4875 0.4831 0.0161 0.0210 0.0314 59 TYR B O 5360 C CB . TYR D 59 ? 0.3413 0.3173 0.3080 0.0272 0.0144 0.0308 59 TYR B CB 5361 C CG . TYR D 59 ? 0.4311 0.3997 0.3960 0.0320 0.0091 0.0278 59 TYR B CG 5362 C CD1 . TYR D 59 ? 0.4206 0.3912 0.3895 0.0352 0.0076 0.0197 59 TYR B CD1 5363 C CD2 . TYR D 59 ? 0.4561 0.4159 0.4154 0.0332 0.0056 0.0329 59 TYR B CD2 5364 C CE1 . TYR D 59 ? 0.4589 0.4247 0.4280 0.0395 0.0029 0.0162 59 TYR B CE1 5365 C CE2 . TYR D 59 ? 0.4702 0.4240 0.4287 0.0383 0.0000 0.0294 59 TYR B CE2 5366 C CZ . TYR D 59 ? 0.4430 0.4008 0.4073 0.0414 -0.0012 0.0207 59 TYR B CZ 5367 O OH . TYR D 59 ? 0.4870 0.4407 0.4524 0.0464 -0.0066 0.0164 59 TYR B OH 5368 N N . HIS D 60 ? 0.4201 0.4175 0.3941 0.0237 0.0230 0.0256 60 HIS B N 5369 C CA . HIS D 60 ? 0.4375 0.4452 0.4125 0.0213 0.0275 0.0278 60 HIS B CA 5370 C C . HIS D 60 ? 0.4650 0.4734 0.4342 0.0191 0.0301 0.0358 60 HIS B C 5371 O O . HIS D 60 ? 0.4361 0.4420 0.3963 0.0226 0.0292 0.0377 60 HIS B O 5372 C CB . HIS D 60 ? 0.4464 0.4627 0.4183 0.0257 0.0290 0.0227 60 HIS B CB 5373 C CG . HIS D 60 ? 0.5395 0.5673 0.5149 0.0240 0.0329 0.0225 60 HIS B CG 5374 N ND1 . HIS D 60 ? 0.5487 0.5841 0.5226 0.0216 0.0372 0.0278 60 HIS B ND1 5375 C CD2 . HIS D 60 ? 0.5710 0.6045 0.5514 0.0248 0.0330 0.0174 60 HIS B CD2 5376 C CE1 . HIS D 60 ? 0.5530 0.5996 0.5322 0.0209 0.0399 0.0253 60 HIS B CE1 5377 N NE2 . HIS D 60 ? 0.5693 0.6144 0.5524 0.0231 0.0369 0.0189 60 HIS B NE2 5378 N N . PRO D 61 ? 0.5116 0.5231 0.4856 0.0130 0.0332 0.0405 61 PRO B N 5379 C CA . PRO D 61 ? 0.5239 0.5345 0.4927 0.0091 0.0362 0.0493 61 PRO B CA 5380 C C . PRO D 61 ? 0.5644 0.5825 0.5221 0.0126 0.0397 0.0516 61 PRO B C 5381 O O . PRO D 61 ? 0.6667 0.6785 0.6146 0.0128 0.0395 0.0577 61 PRO B O 5382 C CB . PRO D 61 ? 0.5636 0.5816 0.5424 0.0020 0.0402 0.0513 61 PRO B CB 5383 C CG . PRO D 61 ? 0.6166 0.6319 0.6058 0.0019 0.0364 0.0447 61 PRO B CG 5384 C CD . PRO D 61 ? 0.5536 0.5693 0.5390 0.0092 0.0338 0.0374 61 PRO B CD 5385 N N . SER D 62 ? 0.5733 0.6038 0.5317 0.0159 0.0423 0.0463 62 SER B N 5386 C CA . SER D 62 ? 0.6494 0.6883 0.5977 0.0198 0.0456 0.0473 62 SER B CA 5387 C C . SER D 62 ? 0.7025 0.7336 0.6404 0.0263 0.0411 0.0457 62 SER B C 5388 O O . SER D 62 ? 0.7484 0.7836 0.6758 0.0298 0.0427 0.0473 62 SER B O 5389 C CB . SER D 62 ? 0.6538 0.7071 0.6064 0.0226 0.0483 0.0407 62 SER B CB 5390 O OG . SER D 62 ? 0.7471 0.7969 0.7025 0.0272 0.0436 0.0329 62 SER B OG 5391 N N . LEU D 63 ? 0.6529 0.6737 0.5942 0.0280 0.0355 0.0422 63 LEU B N 5392 C CA . LEU D 63 ? 0.6911 0.7056 0.6255 0.0341 0.0307 0.0393 63 LEU B CA 5393 C C . LEU D 63 ? 0.7675 0.7685 0.6994 0.0336 0.0261 0.0433 63 LEU B C 5394 O O . LEU D 63 ? 0.7489 0.7449 0.6744 0.0387 0.0220 0.0418 63 LEU B O 5395 C CB . LEU D 63 ? 0.5941 0.6091 0.5346 0.0373 0.0279 0.0304 63 LEU B CB 5396 C CG . LEU D 63 ? 0.5453 0.5706 0.4864 0.0400 0.0301 0.0249 63 LEU B CG 5397 C CD1 . LEU D 63 ? 0.5552 0.5773 0.5019 0.0416 0.0271 0.0177 63 LEU B CD1 5398 C CD2 . LEU D 63 ? 0.5136 0.5438 0.4444 0.0452 0.0305 0.0245 63 LEU B CD2 5399 N N . LYS D 64 ? 0.8514 0.8465 0.7888 0.0279 0.0264 0.0478 64 LYS B N 5400 C CA . LYS D 64 ? 0.8380 0.8189 0.7755 0.0274 0.0211 0.0503 64 LYS B CA 5401 C C . LYS D 64 ? 0.7082 0.6815 0.6337 0.0321 0.0172 0.0537 64 LYS B C 5402 O O . LYS D 64 ? 0.7255 0.6902 0.6518 0.0358 0.0110 0.0506 64 LYS B O 5403 C CB . LYS D 64 ? 0.9856 0.9615 0.9275 0.0200 0.0228 0.0571 64 LYS B CB 5404 C CG . LYS D 64 ? 1.1440 1.1041 1.0867 0.0194 0.0167 0.0595 64 LYS B CG 5405 C CD . LYS D 64 ? 1.2809 1.2354 1.2284 0.0115 0.0182 0.0661 64 LYS B CD 5406 C CE . LYS D 64 ? 1.3814 1.3187 1.3296 0.0115 0.0112 0.0680 64 LYS B CE 5407 N NZ . LYS D 64 ? 1.4447 1.3752 1.3981 0.0033 0.0121 0.0742 64 LYS B NZ 5408 N N . SER D 65 ? 0.5999 0.5772 0.5142 0.0322 0.0207 0.0595 65 SER B N 5409 C CA . SER D 65 ? 0.6238 0.5932 0.5245 0.0366 0.0169 0.0636 65 SER B CA 5410 C C . SER D 65 ? 0.6682 0.6396 0.5657 0.0449 0.0123 0.0560 65 SER B C 5411 O O . SER D 65 ? 0.7429 0.7053 0.6342 0.0495 0.0061 0.0563 65 SER B O 5412 C CB . SER D 65 ? 0.7025 0.6764 0.5908 0.0342 0.0227 0.0720 65 SER B CB 5413 O OG . SER D 65 ? 0.8023 0.7921 0.6918 0.0348 0.0287 0.0682 65 SER B OG 5414 N N . ARG D 66 ? 0.4826 0.4655 0.3849 0.0468 0.0148 0.0489 66 ARG B N 5415 C CA . ARG D 66 ? 0.4951 0.4805 0.3948 0.0538 0.0108 0.0416 66 ARG B CA 5416 C C . ARG D 66 ? 0.4623 0.4456 0.3740 0.0551 0.0068 0.0333 66 ARG B C 5417 O O . ARG D 66 ? 0.5701 0.5545 0.4817 0.0601 0.0030 0.0270 66 ARG B O 5418 C CB . ARG D 66 ? 0.4503 0.4484 0.3468 0.0558 0.0152 0.0384 66 ARG B CB 5419 C CG . ARG D 66 ? 0.4352 0.4388 0.3207 0.0543 0.0207 0.0455 66 ARG B CG 5420 C CD . ARG D 66 ? 0.4652 0.4811 0.3465 0.0585 0.0235 0.0406 66 ARG B CD 5421 N NE . ARG D 66 ? 0.4613 0.4861 0.3534 0.0561 0.0273 0.0358 66 ARG B NE 5422 C CZ . ARG D 66 ? 0.5189 0.5483 0.4150 0.0600 0.0256 0.0275 66 ARG B CZ 5423 N NH1 . ARG D 66 ? 0.5408 0.5674 0.4322 0.0659 0.0205 0.0226 66 ARG B NH1 5424 N NH2 . ARG D 66 ? 0.5030 0.5390 0.4076 0.0579 0.0286 0.0239 66 ARG B NH2 5425 N N . VAL D 67 ? 0.4297 0.4102 0.3516 0.0504 0.0077 0.0331 67 VAL B N 5426 C CA . VAL D 67 ? 0.3937 0.3745 0.3267 0.0508 0.0057 0.0251 67 VAL B CA 5427 C C . VAL D 67 ? 0.4109 0.3821 0.3489 0.0517 0.0002 0.0236 67 VAL B C 5428 O O . VAL D 67 ? 0.4198 0.3832 0.3575 0.0492 -0.0009 0.0291 67 VAL B O 5429 C CB . VAL D 67 ? 0.4676 0.4533 0.4087 0.0458 0.0104 0.0238 67 VAL B CB 5430 C CG1 . VAL D 67 ? 0.4731 0.4579 0.4239 0.0459 0.0087 0.0163 67 VAL B CG1 5431 C CG2 . VAL D 67 ? 0.5250 0.5209 0.4626 0.0461 0.0150 0.0232 67 VAL B CG2 5432 N N . THR D 68 ? 0.3485 0.3207 0.2918 0.0553 -0.0032 0.0159 68 THR B N 5433 C CA . THR D 68 ? 0.4146 0.3804 0.3656 0.0562 -0.0078 0.0124 68 THR B CA 5434 C C . THR D 68 ? 0.4044 0.3755 0.3656 0.0556 -0.0065 0.0038 68 THR B C 5435 O O . THR D 68 ? 0.4387 0.4160 0.4002 0.0573 -0.0058 -0.0010 68 THR B O 5436 C CB . THR D 68 ? 0.4331 0.3938 0.3800 0.0622 -0.0146 0.0114 68 THR B CB 5437 O OG1 . THR D 68 ? 0.4925 0.4474 0.4272 0.0629 -0.0156 0.0201 68 THR B OG1 5438 C CG2 . THR D 68 ? 0.3636 0.3179 0.3191 0.0636 -0.0196 0.0076 68 THR B CG2 5439 N N . ILE D 69 ? 0.3715 0.3397 0.3406 0.0529 -0.0063 0.0021 69 ILE B N 5440 C CA . ILE D 69 ? 0.3240 0.2964 0.3020 0.0521 -0.0050 -0.0058 69 ILE B CA 5441 C C . ILE D 69 ? 0.4135 0.3815 0.3988 0.0543 -0.0096 -0.0100 69 ILE B C 5442 O O . ILE D 69 ? 0.3669 0.3275 0.3528 0.0536 -0.0119 -0.0067 69 ILE B O 5443 C CB . ILE D 69 ? 0.3301 0.3046 0.3105 0.0472 0.0000 -0.0054 69 ILE B CB 5444 C CG1 . ILE D 69 ? 0.3494 0.3291 0.3235 0.0458 0.0039 -0.0020 69 ILE B CG1 5445 C CG2 . ILE D 69 ? 0.3094 0.2871 0.2968 0.0463 0.0014 -0.0130 69 ILE B CG2 5446 C CD1 . ILE D 69 ? 0.3442 0.3261 0.3204 0.0417 0.0080 -0.0017 69 ILE B CD1 5447 N N . SER D 70 ? 0.4056 0.3780 0.3968 0.0568 -0.0110 -0.0177 70 SER B N 5448 C CA . SER D 70 ? 0.4431 0.4134 0.4424 0.0596 -0.0153 -0.0231 70 SER B CA 5449 C C . SER D 70 ? 0.4537 0.4319 0.4623 0.0586 -0.0126 -0.0321 70 SER B C 5450 O O . SER D 70 ? 0.4501 0.4345 0.4582 0.0565 -0.0085 -0.0341 70 SER B O 5451 C CB . SER D 70 ? 0.4164 0.3837 0.4138 0.0655 -0.0222 -0.0234 70 SER B CB 5452 O OG . SER D 70 ? 0.4558 0.4294 0.4512 0.0675 -0.0222 -0.0259 70 SER B OG 5453 N N . LEU D 71 ? 0.3821 0.3597 0.3990 0.0602 -0.0148 -0.0374 71 LEU B N 5454 C CA . LEU D 71 ? 0.4333 0.4190 0.4593 0.0591 -0.0118 -0.0462 71 LEU B CA 5455 C C . LEU D 71 ? 0.4364 0.4273 0.4706 0.0639 -0.0162 -0.0535 71 LEU B C 5456 O O . LEU D 71 ? 0.3927 0.3787 0.4281 0.0690 -0.0230 -0.0536 71 LEU B O 5457 C CB . LEU D 71 ? 0.4518 0.4355 0.4823 0.0576 -0.0105 -0.0486 71 LEU B CB 5458 C CG . LEU D 71 ? 0.4313 0.4101 0.4560 0.0532 -0.0070 -0.0429 71 LEU B CG 5459 C CD1 . LEU D 71 ? 0.4481 0.4241 0.4780 0.0535 -0.0081 -0.0467 71 LEU B CD1 5460 C CD2 . LEU D 71 ? 0.4053 0.3894 0.4264 0.0487 -0.0004 -0.0428 71 LEU B CD2 5461 N N . ASP D 72 ? 0.3414 0.3419 0.3815 0.0622 -0.0127 -0.0598 72 ASP B N 5462 C CA . ASP D 72 ? 0.3586 0.3667 0.4100 0.0660 -0.0160 -0.0689 72 ASP B CA 5463 C C . ASP D 72 ? 0.3158 0.3308 0.3767 0.0636 -0.0114 -0.0762 72 ASP B C 5464 O O . ASP D 72 ? 0.3100 0.3332 0.3747 0.0591 -0.0053 -0.0802 72 ASP B O 5465 C CB . ASP D 72 ? 0.3543 0.3693 0.4074 0.0656 -0.0157 -0.0716 72 ASP B CB 5466 C CG . ASP D 72 ? 0.4202 0.4439 0.4864 0.0698 -0.0200 -0.0813 72 ASP B CG 5467 O OD1 . ASP D 72 ? 0.3815 0.4075 0.4563 0.0726 -0.0221 -0.0868 72 ASP B OD1 5468 O OD2 . ASP D 72 ? 0.4746 0.5034 0.5432 0.0706 -0.0217 -0.0841 72 ASP B OD2 5469 N N . MET D 73 ? 0.3104 0.3216 0.3744 0.0666 -0.0145 -0.0779 73 MET B N 5470 C CA . MET D 73 ? 0.3361 0.3523 0.4064 0.0646 -0.0100 -0.0839 73 MET B CA 5471 C C . MET D 73 ? 0.2893 0.3194 0.3725 0.0648 -0.0074 -0.0947 73 MET B C 5472 O O . MET D 73 ? 0.3105 0.3473 0.3964 0.0604 -0.0003 -0.0986 73 MET B O 5473 C CB . MET D 73 ? 0.3215 0.3295 0.3925 0.0688 -0.0154 -0.0838 73 MET B CB 5474 C CG . MET D 73 ? 0.3020 0.2978 0.3616 0.0663 -0.0156 -0.0737 73 MET B CG 5475 S SD . MET D 73 ? 0.5711 0.5532 0.6297 0.0717 -0.0249 -0.0707 73 MET B SD 5476 C CE . MET D 73 ? 0.2651 0.2517 0.3344 0.0741 -0.0248 -0.0814 73 MET B CE 5477 N N . SER D 74 ? 0.2810 0.3161 0.3722 0.0696 -0.0130 -0.0996 74 SER B N 5478 C CA . SER D 74 ? 0.2574 0.3075 0.3630 0.0696 -0.0106 -0.1105 74 SER B CA 5479 C C . SER D 74 ? 0.2397 0.2971 0.3447 0.0617 -0.0022 -0.1104 74 SER B C 5480 O O . SER D 74 ? 0.2711 0.3404 0.3855 0.0582 0.0039 -0.1178 74 SER B O 5481 C CB . SER D 74 ? 0.2219 0.2758 0.3363 0.0769 -0.0195 -0.1159 74 SER B CB 5482 O OG . SER D 74 ? 0.3840 0.4331 0.4910 0.0770 -0.0227 -0.1099 74 SER B OG 5483 N N . LYS D 75 ? 0.2176 0.2676 0.3113 0.0588 -0.0015 -0.1019 75 LYS B N 5484 C CA . LYS D 75 ? 0.2688 0.3233 0.3611 0.0518 0.0052 -0.1014 75 LYS B CA 5485 C C . LYS D 75 ? 0.3033 0.3508 0.3833 0.0457 0.0120 -0.0943 75 LYS B C 5486 O O . LYS D 75 ? 0.3774 0.4259 0.4540 0.0399 0.0171 -0.0928 75 LYS B O 5487 C CB . LYS D 75 ? 0.3127 0.3654 0.4025 0.0533 0.0007 -0.0988 75 LYS B CB 5488 C CG . LYS D 75 ? 0.2460 0.3054 0.3471 0.0596 -0.0068 -0.1060 75 LYS B CG 5489 C CD . LYS D 75 ? 0.3082 0.3653 0.4050 0.0607 -0.0110 -0.1034 75 LYS B CD 5490 C CE . LYS D 75 ? 0.3568 0.4182 0.4621 0.0683 -0.0202 -0.1095 75 LYS B CE 5491 N NZ . LYS D 75 ? 0.4376 0.4981 0.5389 0.0690 -0.0237 -0.1081 75 LYS B NZ 5492 N N . ASN D 76 ? 0.2913 0.3313 0.3648 0.0472 0.0113 -0.0904 76 ASN B N 5493 C CA . ASN D 76 ? 0.2511 0.2837 0.3127 0.0426 0.0161 -0.0836 76 ASN B CA 5494 C C . ASN D 76 ? 0.3164 0.3432 0.3684 0.0407 0.0158 -0.0764 76 ASN B C 5495 O O . ASN D 76 ? 0.2955 0.3211 0.3415 0.0356 0.0209 -0.0741 76 ASN B O 5496 C CB . ASN D 76 ? 0.2906 0.3288 0.3530 0.0368 0.0244 -0.0874 76 ASN B CB 5497 C CG . ASN D 76 ? 0.3747 0.4154 0.4410 0.0386 0.0255 -0.0922 76 ASN B CG 5498 O OD1 . ASN D 76 ? 0.3602 0.3933 0.4224 0.0418 0.0217 -0.0891 76 ASN B OD1 5499 N ND2 . ASN D 76 ? 0.3463 0.3977 0.4208 0.0364 0.0307 -0.1001 76 ASN B ND2 5500 N N . GLN D 77 ? 0.3506 0.3734 0.4007 0.0454 0.0093 -0.0730 77 GLN B N 5501 C CA . GLN D 77 ? 0.3654 0.3835 0.4065 0.0449 0.0083 -0.0667 77 GLN B CA 5502 C C . GLN D 77 ? 0.3723 0.3820 0.4055 0.0483 0.0041 -0.0594 77 GLN B C 5503 O O . GLN D 77 ? 0.2985 0.3057 0.3347 0.0519 0.0001 -0.0598 77 GLN B O 5504 C CB . GLN D 77 ? 0.3044 0.3276 0.3506 0.0469 0.0050 -0.0705 77 GLN B CB 5505 C CG . GLN D 77 ? 0.3457 0.3775 0.4006 0.0423 0.0096 -0.0774 77 GLN B CG 5506 C CD . GLN D 77 ? 0.3971 0.4346 0.4588 0.0441 0.0058 -0.0821 77 GLN B CD 5507 O OE1 . GLN D 77 ? 0.3381 0.3733 0.3977 0.0497 -0.0009 -0.0806 77 GLN B OE1 5508 N NE2 . GLN D 77 ? 0.2969 0.3417 0.3665 0.0391 0.0100 -0.0877 77 GLN B NE2 5509 N N . PHE D 78 ? 0.2844 0.2897 0.3079 0.0469 0.0051 -0.0529 78 PHE B N 5510 C CA . PHE D 78 ? 0.3025 0.3012 0.3188 0.0495 0.0017 -0.0458 78 PHE B CA 5511 C C . PHE D 78 ? 0.3493 0.3474 0.3579 0.0504 0.0009 -0.0417 78 PHE B C 5512 O O . PHE D 78 ? 0.2455 0.2465 0.2530 0.0483 0.0035 -0.0436 78 PHE B O 5513 C CB . PHE D 78 ? 0.2730 0.2670 0.2854 0.0467 0.0044 -0.0416 78 PHE B CB 5514 C CG . PHE D 78 ? 0.3177 0.3120 0.3248 0.0424 0.0096 -0.0399 78 PHE B CG 5515 C CD1 . PHE D 78 ? 0.2497 0.2468 0.2594 0.0391 0.0139 -0.0445 78 PHE B CD1 5516 C CD2 . PHE D 78 ? 0.3059 0.2975 0.3051 0.0419 0.0101 -0.0337 78 PHE B CD2 5517 C CE1 . PHE D 78 ? 0.2461 0.2415 0.2494 0.0356 0.0178 -0.0426 78 PHE B CE1 5518 C CE2 . PHE D 78 ? 0.2585 0.2498 0.2528 0.0388 0.0139 -0.0327 78 PHE B CE2 5519 C CZ . PHE D 78 ? 0.2184 0.2107 0.2142 0.0359 0.0173 -0.0369 78 PHE B CZ 5520 N N . SER D 79 ? 0.3048 0.2989 0.3077 0.0537 -0.0028 -0.0364 79 SER B N 5521 C CA . SER D 79 ? 0.3274 0.3218 0.3228 0.0558 -0.0043 -0.0335 79 SER B CA 5522 C C . SER D 79 ? 0.3868 0.3773 0.3726 0.0555 -0.0033 -0.0252 79 SER B C 5523 O O . SER D 79 ? 0.3740 0.3602 0.3592 0.0544 -0.0033 -0.0210 79 SER B O 5524 C CB . SER D 79 ? 0.3519 0.3470 0.3490 0.0612 -0.0105 -0.0362 79 SER B CB 5525 O OG . SER D 79 ? 0.4406 0.4419 0.4465 0.0612 -0.0110 -0.0443 79 SER B OG 5526 N N . LEU D 80 ? 0.2838 0.2765 0.2627 0.0563 -0.0025 -0.0234 80 LEU B N 5527 C CA . LEU D 80 ? 0.2792 0.2705 0.2489 0.0564 -0.0011 -0.0162 80 LEU B CA 5528 C C . LEU D 80 ? 0.3126 0.3041 0.2748 0.0612 -0.0048 -0.0145 80 LEU B C 5529 O O . LEU D 80 ? 0.3508 0.3456 0.3125 0.0637 -0.0065 -0.0189 80 LEU B O 5530 C CB . LEU D 80 ? 0.2848 0.2792 0.2518 0.0538 0.0034 -0.0158 80 LEU B CB 5531 C CG . LEU D 80 ? 0.3056 0.3017 0.2639 0.0546 0.0051 -0.0100 80 LEU B CG 5532 C CD1 . LEU D 80 ? 0.2708 0.2641 0.2282 0.0523 0.0063 -0.0034 80 LEU B CD1 5533 C CD2 . LEU D 80 ? 0.2205 0.2205 0.1767 0.0535 0.0083 -0.0114 80 LEU B CD2 5534 N N . ASN D 81 ? 0.3802 0.3676 0.3363 0.0624 -0.0062 -0.0080 81 ASN B N 5535 C CA . ASN D 81 ? 0.4325 0.4194 0.3783 0.0667 -0.0089 -0.0048 81 ASN B CA 5536 C C . ASN D 81 ? 0.4809 0.4693 0.4178 0.0649 -0.0045 0.0025 81 ASN B C 5537 O O . ASN D 81 ? 0.5087 0.4944 0.4463 0.0609 -0.0018 0.0078 81 ASN B O 5538 C CB . ASN D 81 ? 0.5593 0.5395 0.5035 0.0702 -0.0149 -0.0031 81 ASN B CB 5539 C CG . ASN D 81 ? 0.7734 0.7552 0.7210 0.0753 -0.0207 -0.0103 81 ASN B CG 5540 O OD1 . ASN D 81 ? 0.7170 0.7041 0.6731 0.0745 -0.0201 -0.0176 81 ASN B OD1 5541 N ND2 . ASN D 81 ? 1.1409 1.1178 1.0815 0.0804 -0.0267 -0.0082 81 ASN B ND2 5542 N N . LEU D 82 ? 0.4574 0.4507 0.3866 0.0677 -0.0038 0.0022 82 LEU B N 5543 C CA . LEU D 82 ? 0.4029 0.3999 0.3237 0.0665 0.0008 0.0080 82 LEU B CA 5544 C C . LEU D 82 ? 0.4243 0.4223 0.3326 0.0719 -0.0016 0.0098 82 LEU B C 5545 O O . LEU D 82 ? 0.4596 0.4612 0.3660 0.0761 -0.0039 0.0041 82 LEU B O 5546 C CB . LEU D 82 ? 0.3546 0.3585 0.2789 0.0646 0.0051 0.0047 82 LEU B CB 5547 C CG . LEU D 82 ? 0.4685 0.4791 0.3868 0.0637 0.0102 0.0087 82 LEU B CG 5548 C CD1 . LEU D 82 ? 0.3758 0.3850 0.2946 0.0587 0.0138 0.0163 82 LEU B CD1 5549 C CD2 . LEU D 82 ? 0.4339 0.4499 0.3567 0.0632 0.0125 0.0035 82 LEU B CD2 5550 N N . THR D 83 A 0.4599 0.4539 0.3593 0.0716 -0.0012 0.0177 82 THR B N 5551 C CA . THR D 83 A 0.5046 0.4980 0.3899 0.0769 -0.0038 0.0203 82 THR B CA 5552 C C . THR D 83 A 0.4850 0.4869 0.3609 0.0770 0.0020 0.0232 82 THR B C 5553 O O . THR D 83 A 0.4956 0.5034 0.3764 0.0724 0.0081 0.0246 82 THR B O 5554 C CB . THR D 83 A 0.5266 0.5096 0.4044 0.0769 -0.0068 0.0280 82 THR B CB 5555 O OG1 . THR D 83 A 0.5142 0.4961 0.3909 0.0704 -0.0009 0.0364 82 THR B OG1 5556 C CG2 . THR D 83 A 0.4641 0.4392 0.3514 0.0779 -0.0133 0.0243 82 THR B CG2 5557 N N . SER D 84 B 0.4369 0.4400 0.2997 0.0826 -0.0003 0.0235 82 SER B N 5558 C CA . SER D 84 B 0.4961 0.5077 0.3477 0.0838 0.0050 0.0263 82 SER B CA 5559 C C . SER D 84 B 0.4685 0.4908 0.3277 0.0825 0.0098 0.0210 82 SER B C 5560 O O . SER D 84 B 0.4620 0.4915 0.3201 0.0791 0.0166 0.0250 82 SER B O 5561 C CB . SER D 84 B 0.5509 0.5604 0.3947 0.0789 0.0103 0.0374 82 SER B CB 5562 O OG . SER D 84 B 0.6284 0.6255 0.4651 0.0798 0.0053 0.0429 82 SER B OG 5563 N N . VAL D 85 C 0.5066 0.5298 0.3737 0.0851 0.0061 0.0120 82 VAL B N 5564 C CA . VAL D 85 C 0.4772 0.5079 0.3513 0.0842 0.0093 0.0067 82 VAL B CA 5565 C C . VAL D 85 C 0.5536 0.5941 0.4180 0.0887 0.0121 0.0052 82 VAL B C 5566 O O . VAL D 85 C 0.5953 0.6364 0.4480 0.0942 0.0094 0.0048 82 VAL B O 5567 C CB . VAL D 85 C 0.3444 0.3722 0.2282 0.0856 0.0044 -0.0021 82 VAL B CB 5568 C CG1 . VAL D 85 C 0.2825 0.3029 0.1772 0.0809 0.0029 -0.0015 82 VAL B CG1 5569 C CG2 . VAL D 85 C 0.2748 0.3013 0.1525 0.0923 -0.0020 -0.0075 82 VAL B CG2 5570 N N . THR D 86 ? 0.5265 0.5750 0.3956 0.0867 0.0171 0.0039 83 THR B N 5571 C CA . THR D 86 ? 0.5058 0.5649 0.3685 0.0915 0.0195 0.0002 83 THR B CA 5572 C C . THR D 86 ? 0.4935 0.5545 0.3656 0.0925 0.0180 -0.0079 83 THR B C 5573 O O . THR D 86 ? 0.4812 0.5353 0.3634 0.0890 0.0159 -0.0096 83 THR B O 5574 C CB . THR D 86 ? 0.5563 0.6254 0.4148 0.0886 0.0276 0.0066 83 THR B CB 5575 O OG1 . THR D 86 ? 0.5163 0.5884 0.3872 0.0829 0.0314 0.0072 83 THR B OG1 5576 C CG2 . THR D 86 ? 0.4975 0.5619 0.3473 0.0856 0.0294 0.0163 83 THR B CG2 5577 N N . ALA D 87 ? 0.4802 0.5500 0.3484 0.0975 0.0191 -0.0129 84 ALA B N 5578 C CA . ALA D 87 ? 0.4404 0.5105 0.3159 0.0993 0.0168 -0.0207 84 ALA B CA 5579 C C . ALA D 87 ? 0.4234 0.4941 0.3098 0.0935 0.0203 -0.0188 84 ALA B C 5580 O O . ALA D 87 ? 0.4632 0.5300 0.3563 0.0934 0.0177 -0.0238 84 ALA B O 5581 C CB . ALA D 87 ? 0.3700 0.4500 0.2388 0.1064 0.0172 -0.0265 84 ALA B CB 5582 N N . ALA D 88 ? 0.4475 0.5224 0.3353 0.0884 0.0259 -0.0114 85 ALA B N 5583 C CA . ALA D 88 ? 0.4697 0.5455 0.3679 0.0827 0.0289 -0.0095 85 ALA B CA 5584 C C . ALA D 88 ? 0.5022 0.5656 0.4077 0.0782 0.0256 -0.0087 85 ALA B C 5585 O O . ALA D 88 ? 0.5623 0.6247 0.4763 0.0741 0.0268 -0.0084 85 ALA B O 5586 C CB . ALA D 88 ? 0.4043 0.4881 0.3023 0.0781 0.0357 -0.0019 85 ALA B CB 5587 N N . ASP D 89 ? 0.3942 0.4491 0.2968 0.0792 0.0215 -0.0089 86 ASP B N 5588 C CA . ASP D 89 ? 0.3721 0.4167 0.2819 0.0752 0.0187 -0.0090 86 ASP B CA 5589 C C . ASP D 89 ? 0.3803 0.4195 0.2932 0.0772 0.0143 -0.0163 86 ASP B C 5590 O O . ASP D 89 ? 0.3754 0.4071 0.2942 0.0740 0.0124 -0.0174 86 ASP B O 5591 C CB . ASP D 89 ? 0.3994 0.4382 0.3059 0.0747 0.0165 -0.0051 86 ASP B CB 5592 C CG . ASP D 89 ? 0.5158 0.5566 0.4193 0.0714 0.0205 0.0033 86 ASP B CG 5593 O OD1 . ASP D 89 ? 0.5331 0.5747 0.4433 0.0662 0.0239 0.0065 86 ASP B OD1 5594 O OD2 . ASP D 89 ? 0.5984 0.6393 0.4924 0.0738 0.0201 0.0068 86 ASP B OD2 5595 N N . THR D 90 ? 0.3662 0.4094 0.2752 0.0822 0.0130 -0.0215 87 THR B N 5596 C CA . THR D 90 ? 0.4049 0.4420 0.3165 0.0837 0.0088 -0.0282 87 THR B CA 5597 C C . THR D 90 ? 0.3745 0.4079 0.2929 0.0794 0.0101 -0.0282 87 THR B C 5598 O O . THR D 90 ? 0.3863 0.4255 0.3059 0.0794 0.0130 -0.0272 87 THR B O 5599 C CB . THR D 90 ? 0.4108 0.4526 0.3166 0.0904 0.0067 -0.0340 87 THR B CB 5600 O OG1 . THR D 90 ? 0.4311 0.4758 0.3293 0.0949 0.0050 -0.0345 87 THR B OG1 5601 C CG2 . THR D 90 ? 0.3343 0.3676 0.2426 0.0913 0.0020 -0.0404 87 THR B CG2 5602 N N . ALA D 91 ? 0.3509 0.3752 0.2739 0.0759 0.0081 -0.0296 88 ALA B N 5603 C CA . ALA D 91 ? 0.2924 0.3118 0.2203 0.0717 0.0092 -0.0293 88 ALA B CA 5604 C C . ALA D 91 ? 0.2929 0.3027 0.2243 0.0681 0.0072 -0.0314 88 ALA B C 5605 O O . ALA D 91 ? 0.2857 0.2940 0.2179 0.0684 0.0052 -0.0328 88 ALA B O 5606 C CB . ALA D 91 ? 0.3115 0.3344 0.2431 0.0678 0.0132 -0.0237 88 ALA B CB 5607 N N . VAL D 92 ? 0.2858 0.2898 0.2193 0.0649 0.0077 -0.0319 89 VAL B N 5608 C CA . VAL D 92 ? 0.3564 0.3529 0.2938 0.0600 0.0077 -0.0326 89 VAL B CA 5609 C C . VAL D 92 ? 0.3652 0.3637 0.3072 0.0564 0.0107 -0.0284 89 VAL B C 5610 O O . VAL D 92 ? 0.3149 0.3158 0.2573 0.0555 0.0127 -0.0256 89 VAL B O 5611 C CB . VAL D 92 ? 0.3705 0.3587 0.3062 0.0581 0.0071 -0.0345 89 VAL B CB 5612 C CG1 . VAL D 92 ? 0.2102 0.1920 0.1495 0.0522 0.0086 -0.0344 89 VAL B CG1 5613 C CG2 . VAL D 92 ? 0.1931 0.1772 0.1245 0.0615 0.0033 -0.0389 89 VAL B CG2 5614 N N . TYR D 93 ? 0.3777 0.3753 0.3236 0.0545 0.0104 -0.0286 90 TYR B N 5615 C CA . TYR D 93 ? 0.3185 0.3169 0.2689 0.0516 0.0123 -0.0254 90 TYR B CA 5616 C C . TYR D 93 ? 0.3322 0.3253 0.2866 0.0471 0.0136 -0.0273 90 TYR B C 5617 O O . TYR D 93 ? 0.3859 0.3765 0.3426 0.0458 0.0127 -0.0308 90 TYR B O 5618 C CB . TYR D 93 ? 0.2546 0.2558 0.2064 0.0534 0.0108 -0.0244 90 TYR B CB 5619 C CG . TYR D 93 ? 0.2909 0.2973 0.2375 0.0569 0.0107 -0.0209 90 TYR B CG 5620 C CD1 . TYR D 93 ? 0.2613 0.2708 0.2021 0.0610 0.0096 -0.0226 90 TYR B CD1 5621 C CD2 . TYR D 93 ? 0.2346 0.2425 0.1816 0.0560 0.0119 -0.0158 90 TYR B CD2 5622 C CE1 . TYR D 93 ? 0.2867 0.3020 0.2219 0.0642 0.0104 -0.0195 90 TYR B CE1 5623 C CE2 . TYR D 93 ? 0.2067 0.2193 0.1480 0.0585 0.0127 -0.0118 90 TYR B CE2 5624 C CZ . TYR D 93 ? 0.3247 0.3417 0.2601 0.0626 0.0123 -0.0137 90 TYR B CZ 5625 O OH . TYR D 93 ? 0.3510 0.3738 0.2799 0.0649 0.0138 -0.0100 90 TYR B OH 5626 N N . PHE D 94 ? 0.2435 0.2355 0.1989 0.0446 0.0156 -0.0251 91 PHE B N 5627 C CA . PHE D 94 ? 0.2629 0.2504 0.2208 0.0406 0.0173 -0.0266 91 PHE B CA 5628 C C . PHE D 94 ? 0.3155 0.3046 0.2792 0.0391 0.0181 -0.0256 91 PHE B C 5629 O O . PHE D 94 ? 0.3131 0.3047 0.2776 0.0401 0.0178 -0.0222 91 PHE B O 5630 C CB . PHE D 94 ? 0.2653 0.2494 0.2192 0.0394 0.0183 -0.0258 91 PHE B CB 5631 C CG . PHE D 94 ? 0.2631 0.2435 0.2109 0.0411 0.0169 -0.0273 91 PHE B CG 5632 C CD1 . PHE D 94 ? 0.2357 0.2093 0.1811 0.0387 0.0169 -0.0298 91 PHE B CD1 5633 C CD2 . PHE D 94 ? 0.3179 0.3013 0.2626 0.0447 0.0156 -0.0263 91 PHE B CD2 5634 C CE1 . PHE D 94 ? 0.1936 0.1617 0.1327 0.0403 0.0149 -0.0310 91 PHE B CE1 5635 C CE2 . PHE D 94 ? 0.3298 0.3092 0.2689 0.0470 0.0135 -0.0283 91 PHE B CE2 5636 C CZ . PHE D 94 ? 0.2678 0.2385 0.2037 0.0449 0.0127 -0.0305 91 PHE B CZ 5637 N N . CYS D 95 ? 0.2896 0.2771 0.2573 0.0366 0.0190 -0.0286 92 CYS B N 5638 C CA . CYS D 95 ? 0.2638 0.2519 0.2369 0.0353 0.0197 -0.0287 92 CYS B CA 5639 C C . CYS D 95 ? 0.2728 0.2575 0.2443 0.0322 0.0222 -0.0295 92 CYS B C 5640 O O . CYS D 95 ? 0.3008 0.2822 0.2677 0.0304 0.0236 -0.0307 92 CYS B O 5641 C CB . CYS D 95 ? 0.2805 0.2710 0.2602 0.0355 0.0188 -0.0324 92 CYS B CB 5642 S SG . CYS D 95 ? 0.3477 0.3377 0.3294 0.0318 0.0213 -0.0378 92 CYS B SG 5643 N N . ALA D 96 ? 0.2604 0.2450 0.2348 0.0316 0.0224 -0.0289 93 ALA B N 5644 C CA . ALA D 96 ? 0.2882 0.2697 0.2601 0.0292 0.0243 -0.0300 93 ALA B CA 5645 C C . ALA D 96 ? 0.3315 0.3135 0.3089 0.0289 0.0242 -0.0314 93 ALA B C 5646 O O . ALA D 96 ? 0.3691 0.3527 0.3516 0.0305 0.0220 -0.0303 93 ALA B O 5647 C CB . ALA D 96 ? 0.1719 0.1513 0.1381 0.0298 0.0236 -0.0271 93 ALA B CB 5648 N N . ARG D 97 ? 0.3627 0.3425 0.3380 0.0269 0.0262 -0.0339 94 ARG B N 5649 C CA . ARG D 97 ? 0.2432 0.2232 0.2231 0.0270 0.0258 -0.0361 94 ARG B CA 5650 C C . ARG D 97 ? 0.2113 0.1886 0.1889 0.0272 0.0240 -0.0338 94 ARG B C 5651 O O . ARG D 97 ? 0.2475 0.2225 0.2185 0.0266 0.0245 -0.0326 94 ARG B O 5652 C CB . ARG D 97 ? 0.2727 0.2529 0.2516 0.0250 0.0293 -0.0410 94 ARG B CB 5653 C CG . ARG D 97 ? 0.2911 0.2723 0.2751 0.0259 0.0286 -0.0446 94 ARG B CG 5654 C CD . ARG D 97 ? 0.3011 0.2834 0.2824 0.0238 0.0329 -0.0494 94 ARG B CD 5655 N NE . ARG D 97 ? 0.3612 0.3384 0.3317 0.0221 0.0344 -0.0477 94 ARG B NE 5656 C CZ . ARG D 97 ? 0.3690 0.3450 0.3337 0.0208 0.0374 -0.0508 94 ARG B CZ 5657 N NH1 . ARG D 97 ? 0.3080 0.2888 0.2778 0.0208 0.0397 -0.0562 94 ARG B NH1 5658 N NH2 . ARG D 97 ? 0.3903 0.3604 0.3438 0.0198 0.0379 -0.0488 94 ARG B NH2 5659 N N . ARG D 98 ? 0.1875 0.1648 0.1710 0.0281 0.0215 -0.0336 95 ARG B N 5660 C CA . ARG D 98 ? 0.1699 0.1451 0.1535 0.0278 0.0195 -0.0322 95 ARG B CA 5661 C C . ARG D 98 ? 0.3444 0.3178 0.3320 0.0280 0.0183 -0.0362 95 ARG B C 5662 O O . ARG D 98 ? 0.4324 0.4058 0.4264 0.0292 0.0165 -0.0371 95 ARG B O 5663 C CB . ARG D 98 ? 0.2006 0.1769 0.1875 0.0280 0.0173 -0.0270 95 ARG B CB 5664 C CG . ARG D 98 ? 0.2960 0.2721 0.2831 0.0270 0.0159 -0.0251 95 ARG B CG 5665 C CD . ARG D 98 ? 0.3402 0.3151 0.3344 0.0261 0.0133 -0.0227 95 ARG B CD 5666 N NE . ARG D 98 ? 0.3860 0.3571 0.3834 0.0259 0.0112 -0.0266 95 ARG B NE 5667 C CZ . ARG D 98 ? 0.3602 0.3281 0.3641 0.0253 0.0082 -0.0259 95 ARG B CZ 5668 N NH1 . ARG D 98 ? 0.3066 0.2740 0.3136 0.0243 0.0073 -0.0205 95 ARG B NH1 5669 N NH2 . ARG D 98 ? 0.3382 0.3027 0.3446 0.0257 0.0060 -0.0305 95 ARG B NH2 5670 N N . SER D 99 ? 0.3127 0.2841 0.2963 0.0275 0.0187 -0.0389 96 SER B N 5671 C CA . SER D 99 ? 0.3630 0.3331 0.3493 0.0283 0.0177 -0.0439 96 SER B CA 5672 C C . SER D 99 ? 0.3705 0.3377 0.3623 0.0286 0.0131 -0.0431 96 SER B C 5673 O O . SER D 99 ? 0.3110 0.2781 0.3044 0.0275 0.0114 -0.0386 96 SER B O 5674 C CB . SER D 99 ? 0.4405 0.4093 0.4181 0.0278 0.0203 -0.0476 96 SER B CB 5675 O OG . SER D 99 ? 0.4141 0.3846 0.3865 0.0265 0.0249 -0.0479 96 SER B OG 5676 N N . ASN D 100 ? 0.3434 0.3088 0.3388 0.0298 0.0113 -0.0480 97 ASN B N 5677 C CA . ASN D 100 ? 0.3856 0.3473 0.3874 0.0299 0.0064 -0.0480 97 ASN B CA 5678 C C . ASN D 100 ? 0.3893 0.3495 0.3878 0.0289 0.0047 -0.0484 97 ASN B C 5679 O O . ASN D 100 ? 0.3112 0.2721 0.3016 0.0294 0.0068 -0.0510 97 ASN B O 5680 C CB . ASN D 100 ? 0.3690 0.3287 0.3757 0.0323 0.0041 -0.0541 97 ASN B CB 5681 C CG . ASN D 100 ? 0.5101 0.4715 0.5213 0.0340 0.0046 -0.0547 97 ASN B CG 5682 O OD1 . ASN D 100 ? 0.5978 0.5596 0.6104 0.0333 0.0046 -0.0493 97 ASN B OD1 5683 N ND2 . ASN D 100 ? 0.5007 0.4639 0.5142 0.0367 0.0049 -0.0617 97 ASN B ND2 5684 N N . TRP D 101 ? 0.4040 0.3621 0.4091 0.0274 0.0008 -0.0457 98 TRP B N 5685 C CA . TRP D 101 ? 0.3914 0.3484 0.3965 0.0266 -0.0021 -0.0472 98 TRP B CA 5686 C C . TRP D 101 ? 0.3403 0.2952 0.3409 0.0291 -0.0032 -0.0546 98 TRP B C 5687 O O . TRP D 101 ? 0.4183 0.3712 0.4214 0.0308 -0.0040 -0.0588 98 TRP B O 5688 C CB . TRP D 101 ? 0.3217 0.2761 0.3371 0.0242 -0.0065 -0.0446 98 TRP B CB 5689 C CG . TRP D 101 ? 0.3254 0.2808 0.3433 0.0227 -0.0095 -0.0454 98 TRP B CG 5690 C CD1 . TRP D 101 ? 0.3449 0.3049 0.3653 0.0202 -0.0089 -0.0410 98 TRP B CD1 5691 C CD2 . TRP D 101 ? 0.2766 0.2289 0.2953 0.0238 -0.0138 -0.0517 98 TRP B CD2 5692 N NE1 . TRP D 101 ? 0.3373 0.2978 0.3610 0.0196 -0.0128 -0.0442 98 TRP B NE1 5693 C CE2 . TRP D 101 ? 0.3334 0.2888 0.3558 0.0218 -0.0161 -0.0507 98 TRP B CE2 5694 C CE3 . TRP D 101 ? 0.2685 0.2165 0.2855 0.0267 -0.0161 -0.0586 98 TRP B CE3 5695 C CZ2 . TRP D 101 ? 0.3413 0.2948 0.3655 0.0226 -0.0212 -0.0564 98 TRP B CZ2 5696 C CZ3 . TRP D 101 ? 0.3286 0.2745 0.3463 0.0276 -0.0209 -0.0641 98 TRP B CZ3 5697 C CH2 . TRP D 101 ? 0.3425 0.2909 0.3639 0.0255 -0.0237 -0.0630 98 TRP B CH2 5698 N N . PRO D 102 ? 0.3106 0.2657 0.3038 0.0297 -0.0035 -0.0566 99 PRO B N 5699 C CA . PRO D 102 ? 0.3395 0.2969 0.3306 0.0285 -0.0040 -0.0530 99 PRO B CA 5700 C C . PRO D 102 ? 0.3948 0.3540 0.3759 0.0290 0.0005 -0.0504 99 PRO B C 5701 O O . PRO D 102 ? 0.3652 0.3256 0.3427 0.0292 -0.0005 -0.0489 99 PRO B O 5702 C CB . PRO D 102 ? 0.3016 0.2567 0.2899 0.0301 -0.0082 -0.0582 99 PRO B CB 5703 C CG . PRO D 102 ? 0.3196 0.2720 0.2996 0.0326 -0.0064 -0.0637 99 PRO B CG 5704 C CD . PRO D 102 ? 0.2868 0.2397 0.2731 0.0322 -0.0042 -0.0635 99 PRO B CD 5705 N N . TYR D 103 ? 0.3753 0.3348 0.3525 0.0292 0.0048 -0.0503 100 TYR B N 5706 C CA . TYR D 103 ? 0.3180 0.2782 0.2861 0.0291 0.0089 -0.0479 100 TYR B CA 5707 C C . TYR D 103 ? 0.3397 0.3033 0.3127 0.0279 0.0107 -0.0428 100 TYR B C 5708 O O . TYR D 103 ? 0.3101 0.2748 0.2844 0.0277 0.0135 -0.0427 100 TYR B O 5709 C CB . TYR D 103 ? 0.3298 0.2886 0.2900 0.0295 0.0130 -0.0515 100 TYR B CB 5710 C CG . TYR D 103 ? 0.4070 0.3651 0.3577 0.0285 0.0173 -0.0491 100 TYR B CG 5711 C CD1 . TYR D 103 ? 0.4246 0.3794 0.3661 0.0290 0.0163 -0.0470 100 TYR B CD1 5712 C CD2 . TYR D 103 ? 0.4570 0.4174 0.4085 0.0272 0.0218 -0.0492 100 TYR B CD2 5713 C CE1 . TYR D 103 ? 0.4745 0.4268 0.4070 0.0279 0.0196 -0.0447 100 TYR B CE1 5714 C CE2 . TYR D 103 ? 0.4506 0.4096 0.3941 0.0257 0.0255 -0.0471 100 TYR B CE2 5715 C CZ . TYR D 103 ? 0.4868 0.4410 0.4204 0.0259 0.0243 -0.0446 100 TYR B CZ 5716 O OH . TYR D 103 ? 0.5037 0.4548 0.4291 0.0243 0.0274 -0.0424 100 TYR B OH 5717 N N . LEU D 104 A 0.3593 0.3251 0.3351 0.0275 0.0091 -0.0390 100 LEU B N 5718 C CA . LEU D 104 A 0.2565 0.2260 0.2377 0.0265 0.0103 -0.0342 100 LEU B CA 5719 C C . LEU D 104 A 0.3169 0.2884 0.2923 0.0271 0.0129 -0.0315 100 LEU B C 5720 O O . LEU D 104 A 0.2970 0.2717 0.2762 0.0268 0.0138 -0.0280 100 LEU B O 5721 C CB . LEU D 104 A 0.2855 0.2580 0.2749 0.0252 0.0075 -0.0317 100 LEU B CB 5722 C CG . LEU D 104 A 0.3104 0.2804 0.3079 0.0239 0.0042 -0.0333 100 LEU B CG 5723 C CD1 . LEU D 104 A 0.2854 0.2588 0.2906 0.0217 0.0018 -0.0312 100 LEU B CD1 5724 C CD2 . LEU D 104 A 0.2482 0.2162 0.2503 0.0234 0.0047 -0.0318 100 LEU B CD2 5725 N N . PRO D 105 B 0.2585 0.2273 0.2243 0.0281 0.0139 -0.0329 100 PRO B N 5726 C CA . PRO D 105 B 0.2480 0.2180 0.2097 0.0288 0.0154 -0.0303 100 PRO B CA 5727 C C . PRO D 105 B 0.3233 0.2937 0.2851 0.0281 0.0185 -0.0297 100 PRO B C 5728 O O . PRO D 105 B 0.3652 0.3350 0.3295 0.0272 0.0198 -0.0318 100 PRO B O 5729 C CB . PRO D 105 B 0.3277 0.2925 0.2783 0.0299 0.0149 -0.0319 100 PRO B CB 5730 C CG . PRO D 105 B 0.3216 0.2823 0.2685 0.0290 0.0158 -0.0352 100 PRO B CG 5731 C CD . PRO D 105 B 0.2818 0.2455 0.2387 0.0286 0.0138 -0.0365 100 PRO B CD 5732 N N . PHE D 106 C 0.3579 0.3298 0.3175 0.0288 0.0192 -0.0275 100 PHE B N 5733 C CA . PHE D 106 C 0.3265 0.2987 0.2860 0.0283 0.0215 -0.0275 100 PHE B CA 5734 C C . PHE D 106 C 0.3415 0.3084 0.2926 0.0271 0.0237 -0.0296 100 PHE B C 5735 O O . PHE D 106 C 0.3078 0.2707 0.2511 0.0278 0.0230 -0.0289 100 PHE B O 5736 C CB . PHE D 106 C 0.3069 0.2827 0.2672 0.0299 0.0210 -0.0248 100 PHE B CB 5737 C CG . PHE D 106 C 0.3472 0.3282 0.3145 0.0304 0.0199 -0.0219 100 PHE B CG 5738 C CD1 . PHE D 106 C 0.3740 0.3558 0.3473 0.0297 0.0198 -0.0214 100 PHE B CD1 5739 C CD2 . PHE D 106 C 0.3840 0.3690 0.3517 0.0316 0.0189 -0.0198 100 PHE B CD2 5740 C CE1 . PHE D 106 C 0.3478 0.3327 0.3262 0.0296 0.0188 -0.0178 100 PHE B CE1 5741 C CE2 . PHE D 106 C 0.3403 0.3303 0.3141 0.0311 0.0187 -0.0166 100 PHE B CE2 5742 C CZ . PHE D 106 C 0.3467 0.3358 0.3251 0.0298 0.0187 -0.0152 100 PHE B CZ 5743 N N . ASP D 107 ? 0.3125 0.2793 0.2651 0.0253 0.0263 -0.0321 101 ASP B N 5744 C CA . ASP D 107 ? 0.3094 0.2722 0.2549 0.0229 0.0295 -0.0338 101 ASP B CA 5745 C C . ASP D 107 ? 0.3167 0.2831 0.2679 0.0211 0.0327 -0.0372 101 ASP B C 5746 O O . ASP D 107 ? 0.3142 0.2829 0.2702 0.0217 0.0323 -0.0395 101 ASP B O 5747 C CB . ASP D 107 ? 0.3315 0.2880 0.2669 0.0227 0.0294 -0.0343 101 ASP B CB 5748 C CG . ASP D 107 ? 0.3993 0.3499 0.3249 0.0197 0.0329 -0.0347 101 ASP B CG 5749 O OD1 . ASP D 107 ? 0.4753 0.4231 0.3979 0.0188 0.0332 -0.0331 101 ASP B OD1 5750 O OD2 . ASP D 107 ? 0.5529 0.5014 0.4734 0.0181 0.0355 -0.0368 101 ASP B OD2 5751 N N . PRO D 108 ? 0.3432 0.3104 0.2948 0.0189 0.0354 -0.0382 102 PRO B N 5752 C CA . PRO D 108 ? 0.2284 0.1921 0.1751 0.0180 0.0355 -0.0362 102 PRO B CA 5753 C C . PRO D 108 ? 0.3003 0.2677 0.2528 0.0208 0.0323 -0.0346 102 PRO B C 5754 O O . PRO D 108 ? 0.2543 0.2266 0.2141 0.0230 0.0305 -0.0344 102 PRO B O 5755 C CB . PRO D 108 ? 0.2748 0.2394 0.2225 0.0138 0.0400 -0.0390 102 PRO B CB 5756 C CG . PRO D 108 ? 0.3310 0.3005 0.2835 0.0130 0.0427 -0.0428 102 PRO B CG 5757 C CD . PRO D 108 ? 0.3721 0.3442 0.3300 0.0170 0.0388 -0.0425 102 PRO B CD 5758 N N . TRP D 109 ? 0.2358 0.2001 0.1841 0.0207 0.0316 -0.0334 103 TRP B N 5759 C CA . TRP D 109 ? 0.2968 0.2643 0.2486 0.0236 0.0288 -0.0323 103 TRP B CA 5760 C C . TRP D 109 ? 0.3176 0.2863 0.2727 0.0220 0.0296 -0.0346 103 TRP B C 5761 O O . TRP D 109 ? 0.3100 0.2747 0.2621 0.0181 0.0322 -0.0360 103 TRP B O 5762 C CB . TRP D 109 ? 0.3199 0.2834 0.2645 0.0261 0.0261 -0.0299 103 TRP B CB 5763 C CG . TRP D 109 ? 0.3103 0.2745 0.2534 0.0283 0.0244 -0.0280 103 TRP B CG 5764 C CD1 . TRP D 109 ? 0.2438 0.2046 0.1830 0.0274 0.0248 -0.0281 103 TRP B CD1 5765 C CD2 . TRP D 109 ? 0.2638 0.2329 0.2093 0.0318 0.0220 -0.0261 103 TRP B CD2 5766 N NE1 . TRP D 109 ? 0.3071 0.2706 0.2476 0.0300 0.0224 -0.0267 103 TRP B NE1 5767 C CE2 . TRP D 109 ? 0.2300 0.1990 0.1746 0.0324 0.0210 -0.0253 103 TRP B CE2 5768 C CE3 . TRP D 109 ? 0.2850 0.2592 0.2333 0.0344 0.0208 -0.0252 103 TRP B CE3 5769 C CZ2 . TRP D 109 ? 0.2867 0.2612 0.2344 0.0348 0.0193 -0.0236 103 TRP B CZ2 5770 C CZ3 . TRP D 109 ? 0.3250 0.3045 0.2750 0.0369 0.0195 -0.0232 103 TRP B CZ3 5771 C CH2 . TRP D 109 ? 0.2746 0.2546 0.2250 0.0368 0.0190 -0.0224 103 TRP B CH2 5772 N N . GLY D 110 ? 0.3432 0.3171 0.3041 0.0247 0.0272 -0.0349 104 GLY B N 5773 C CA . GLY D 110 ? 0.3400 0.3150 0.3040 0.0240 0.0267 -0.0374 104 GLY B CA 5774 C C . GLY D 110 ? 0.3717 0.3409 0.3284 0.0247 0.0249 -0.0365 104 GLY B C 5775 O O . GLY D 110 ? 0.3686 0.3343 0.3187 0.0267 0.0237 -0.0339 104 GLY B O 5776 N N . GLN D 111 ? 0.4075 0.3757 0.3661 0.0234 0.0242 -0.0390 105 GLN B N 5777 C CA . GLN D 111 ? 0.3756 0.3366 0.3272 0.0240 0.0219 -0.0388 105 GLN B CA 5778 C C . GLN D 111 ? 0.3820 0.3462 0.3322 0.0302 0.0177 -0.0382 105 GLN B C 5779 O O . GLN D 111 ? 0.4150 0.3740 0.3591 0.0323 0.0151 -0.0382 105 GLN B O 5780 C CB . GLN D 111 ? 0.4774 0.4357 0.4321 0.0197 0.0224 -0.0421 105 GLN B CB 5781 C CG . GLN D 111 ? 0.6201 0.5847 0.5825 0.0222 0.0192 -0.0456 105 GLN B CG 5782 C CD . GLN D 111 ? 0.7334 0.7074 0.7066 0.0214 0.0207 -0.0482 105 GLN B CD 5783 O OE1 . GLN D 111 ? 0.7221 0.6987 0.6973 0.0197 0.0239 -0.0473 105 GLN B OE1 5784 N NE2 . GLN D 111 ? 0.7319 0.7108 0.7120 0.0230 0.0176 -0.0520 105 GLN B NE2 5785 N N . GLY D 112 ? 0.3751 0.3473 0.3304 0.0333 0.0169 -0.0377 106 GLY B N 5786 C CA . GLY D 112 ? 0.3707 0.3469 0.3239 0.0389 0.0139 -0.0367 106 GLY B CA 5787 C C . GLY D 112 ? 0.4204 0.3992 0.3763 0.0411 0.0108 -0.0400 106 GLY B C 5788 O O . GLY D 112 ? 0.4019 0.3773 0.3599 0.0384 0.0102 -0.0434 106 GLY B O 5789 N N . THR D 113 ? 0.4071 0.3919 0.3627 0.0458 0.0088 -0.0390 107 THR B N 5790 C CA . THR D 113 ? 0.3329 0.3202 0.2894 0.0492 0.0051 -0.0422 107 THR B CA 5791 C C . THR D 113 ? 0.3002 0.2901 0.2497 0.0549 0.0030 -0.0412 107 THR B C 5792 O O . THR D 113 ? 0.3519 0.3462 0.2989 0.0571 0.0043 -0.0373 107 THR B O 5793 C CB . THR D 113 ? 0.3986 0.3913 0.3610 0.0501 0.0042 -0.0426 107 THR B CB 5794 O OG1 . THR D 113 ? 0.5358 0.5278 0.5059 0.0452 0.0062 -0.0447 107 THR B OG1 5795 C CG2 . THR D 113 ? 0.4230 0.4181 0.3855 0.0542 -0.0005 -0.0464 107 THR B CG2 5796 N N . LEU D 114 ? 0.3271 0.3145 0.2738 0.0572 -0.0002 -0.0451 108 LEU B N 5797 C CA . LEU D 114 ? 0.3860 0.3766 0.3260 0.0634 -0.0024 -0.0454 108 LEU B CA 5798 C C . LEU D 114 ? 0.3715 0.3691 0.3104 0.0677 -0.0041 -0.0450 108 LEU B C 5799 O O . LEU D 114 ? 0.2997 0.2975 0.2417 0.0684 -0.0072 -0.0485 108 LEU B O 5800 C CB . LEU D 114 ? 0.4500 0.4349 0.3874 0.0651 -0.0061 -0.0504 108 LEU B CB 5801 C CG . LEU D 114 ? 0.5092 0.4978 0.4397 0.0723 -0.0089 -0.0524 108 LEU B CG 5802 C CD1 . LEU D 114 ? 0.4728 0.4647 0.3993 0.0740 -0.0060 -0.0489 108 LEU B CD1 5803 C CD2 . LEU D 114 ? 0.5356 0.5169 0.4643 0.0739 -0.0137 -0.0582 108 LEU B CD2 5804 N N . VAL D 115 ? 0.4219 0.4252 0.3563 0.0704 -0.0020 -0.0408 109 VAL B N 5805 C CA . VAL D 115 ? 0.4096 0.4185 0.3402 0.0746 -0.0033 -0.0393 109 VAL B CA 5806 C C . VAL D 115 ? 0.4673 0.4814 0.3896 0.0804 -0.0038 -0.0400 109 VAL B C 5807 O O . VAL D 115 ? 0.4337 0.4512 0.3537 0.0807 -0.0007 -0.0376 109 VAL B O 5808 C CB . VAL D 115 ? 0.3892 0.4005 0.3210 0.0723 -0.0001 -0.0329 109 VAL B CB 5809 C CG1 . VAL D 115 ? 0.3187 0.3342 0.2442 0.0766 -0.0015 -0.0305 109 VAL B CG1 5810 C CG2 . VAL D 115 ? 0.4242 0.4313 0.3644 0.0675 0.0000 -0.0333 109 VAL B CG2 5811 N N . THR D 116 ? 0.3875 0.4029 0.3058 0.0853 -0.0080 -0.0439 110 THR B N 5812 C CA . THR D 116 ? 0.3742 0.3951 0.2840 0.0917 -0.0090 -0.0459 110 THR B CA 5813 C C . THR D 116 ? 0.3562 0.3826 0.2587 0.0956 -0.0093 -0.0430 110 THR B C 5814 O O . THR D 116 ? 0.3708 0.3949 0.2734 0.0970 -0.0133 -0.0448 110 THR B O 5815 C CB . THR D 116 ? 0.3982 0.4151 0.3074 0.0952 -0.0145 -0.0539 110 THR B CB 5816 O OG1 . THR D 116 ? 0.4580 0.4672 0.3734 0.0906 -0.0147 -0.0559 110 THR B OG1 5817 C CG2 . THR D 116 ? 0.3991 0.4218 0.2997 0.1023 -0.0153 -0.0568 110 THR B CG2 5818 N N . VAL D 117 ? 0.3890 0.4225 0.2851 0.0973 -0.0050 -0.0386 111 VAL B N 5819 C CA . VAL D 117 ? 0.4253 0.4635 0.3121 0.1008 -0.0046 -0.0349 111 VAL B CA 5820 C C . VAL D 117 ? 0.4504 0.4959 0.3275 0.1077 -0.0049 -0.0385 111 VAL B C 5821 O O . VAL D 117 ? 0.4164 0.4685 0.2924 0.1083 -0.0007 -0.0380 111 VAL B O 5822 C CB . VAL D 117 ? 0.3909 0.4318 0.2768 0.0965 0.0012 -0.0259 111 VAL B CB 5823 C CG1 . VAL D 117 ? 0.3863 0.4295 0.2610 0.0997 0.0011 -0.0214 111 VAL B CG1 5824 C CG2 . VAL D 117 ? 0.3952 0.4290 0.2910 0.0901 0.0014 -0.0233 111 VAL B CG2 5825 N N . SER D 118 ? 0.3854 0.4303 0.2560 0.1134 -0.0103 -0.0429 112 SER B N 5826 C CA . SER D 118 ? 0.3956 0.4473 0.2564 0.1209 -0.0113 -0.0475 112 SER B CA 5827 C C . SER D 118 ? 0.3691 0.4202 0.2202 0.1268 -0.0166 -0.0497 112 SER B C 5828 O O . SER D 118 ? 0.5209 0.5653 0.3758 0.1255 -0.0213 -0.0502 112 SER B O 5829 C CB . SER D 118 ? 0.4333 0.4827 0.2990 0.1231 -0.0148 -0.0561 112 SER B CB 5830 O OG . SER D 118 ? 0.4904 0.5443 0.3522 0.1289 -0.0182 -0.0601 112 SER B OG 5831 N N . SER D 119 ? 0.4218 0.4800 0.2642 0.1320 -0.0161 -0.0501 113 SER B N 5832 C CA . SER D 119 ? 0.4690 0.5265 0.3033 0.1375 -0.0215 -0.0520 113 SER B CA 5833 C C . SER D 119 ? 0.4498 0.5035 0.2899 0.1414 -0.0297 -0.0619 113 SER B C 5834 O O . SER D 119 ? 0.4717 0.5237 0.3077 0.1461 -0.0358 -0.0653 113 SER B O 5835 C CB . SER D 119 ? 0.5787 0.6448 0.4032 0.1402 -0.0171 -0.0475 113 SER B CB 5836 O OG . SER D 119 ? 0.6806 0.7538 0.5092 0.1420 -0.0157 -0.0516 113 SER B OG 5837 N N . ALA D 120 ? 0.3908 0.4428 0.2406 0.1393 -0.0301 -0.0663 114 ALA B N 5838 C CA . ALA D 120 ? 0.4392 0.4864 0.2951 0.1418 -0.0378 -0.0750 114 ALA B CA 5839 C C . ALA D 120 ? 0.5289 0.5683 0.3888 0.1410 -0.0441 -0.0792 114 ALA B C 5840 O O . ALA D 120 ? 0.4966 0.5329 0.3575 0.1372 -0.0423 -0.0762 114 ALA B O 5841 C CB . ALA D 120 ? 0.4066 0.4511 0.2714 0.1386 -0.0370 -0.0776 114 ALA B CB 5842 N N . SER D 121 ? 0.5121 0.5489 0.3749 0.1446 -0.0519 -0.0866 115 SER B N 5843 C CA . SER D 121 ? 0.5306 0.5612 0.3996 0.1435 -0.0584 -0.0918 115 SER B CA 5844 C C . SER D 121 ? 0.4172 0.4403 0.2988 0.1382 -0.0608 -0.0972 115 SER B C 5845 O O . SER D 121 ? 0.4740 0.4960 0.3578 0.1380 -0.0607 -0.0989 115 SER B O 5846 C CB . SER D 121 ? 0.7100 0.7422 0.5751 0.1504 -0.0659 -0.0966 115 SER B CB 5847 O OG . SER D 121 ? 0.8336 0.8633 0.7001 0.1506 -0.0705 -0.0982 115 SER B OG 5848 N N . THR D 122 ? 0.4268 0.4448 0.3168 0.1337 -0.0629 -0.0999 116 THR B N 5849 C CA . THR D 122 ? 0.5165 0.5269 0.4190 0.1276 -0.0647 -0.1048 116 THR B CA 5850 C C . THR D 122 ? 0.5226 0.5306 0.4279 0.1303 -0.0718 -0.1114 116 THR B C 5851 O O . THR D 122 ? 0.4571 0.4682 0.3602 0.1359 -0.0779 -0.1153 116 THR B O 5852 C CB . THR D 122 ? 0.5323 0.5403 0.4470 0.1217 -0.0661 -0.1060 116 THR B CB 5853 O OG1 . THR D 122 ? 0.5548 0.5649 0.4709 0.1170 -0.0590 -0.0970 116 THR B OG1 5854 C CG2 . THR D 122 ? 0.4718 0.4721 0.3995 0.1144 -0.0674 -0.1106 116 THR B CG2 5855 N N . LYS D 123 ? 0.4960 0.4977 0.4055 0.1268 -0.0713 -0.1127 117 LYS B N 5856 C CA . LYS D 123 ? 0.4947 0.4930 0.4061 0.1296 -0.0779 -0.1185 117 LYS B CA 5857 C C . LYS D 123 ? 0.5050 0.4920 0.4246 0.1227 -0.0783 -0.1208 117 LYS B C 5858 O O . LYS D 123 ? 0.5162 0.4996 0.4347 0.1189 -0.0727 -0.1164 117 LYS B O 5859 C CB . LYS D 123 ? 0.4977 0.5024 0.3993 0.1368 -0.0770 -0.1165 117 LYS B CB 5860 C CG . LYS D 123 ? 0.4979 0.5007 0.4002 0.1416 -0.0844 -0.1229 117 LYS B CG 5861 C CD . LYS D 123 ? 0.6040 0.6158 0.4966 0.1497 -0.0829 -0.1211 117 LYS B CD 5862 C CE . LYS D 123 ? 0.6848 0.6955 0.5781 0.1555 -0.0906 -0.1280 117 LYS B CE 5863 N NZ . LYS D 123 ? 0.7516 0.7519 0.6511 0.1518 -0.0934 -0.1309 117 LYS B NZ 5864 N N . GLY D 124 ? 0.4912 0.4722 0.4187 0.1209 -0.0852 -0.1275 118 GLY B N 5865 C CA . GLY D 124 ? 0.5504 0.5189 0.4847 0.1141 -0.0863 -0.1298 118 GLY B CA 5866 C C . GLY D 124 ? 0.5298 0.4940 0.4587 0.1181 -0.0886 -0.1302 118 GLY B C 5867 O O . GLY D 124 ? 0.4365 0.4081 0.3591 0.1262 -0.0912 -0.1311 118 GLY B O 5899 N N . PRO D 129 ? 0.4890 0.4712 0.3403 -0.0541 -0.0080 0.0170 123 PRO B N 5900 C CA . PRO D 129 ? 0.4302 0.4042 0.2723 -0.0637 -0.0080 0.0195 123 PRO B CA 5901 C C . PRO D 129 ? 0.4259 0.3782 0.2602 -0.0563 -0.0077 0.0220 123 PRO B C 5902 O O . PRO D 129 ? 0.4735 0.4114 0.3032 -0.0479 -0.0092 0.0224 123 PRO B O 5903 C CB . PRO D 129 ? 0.4172 0.3820 0.2450 -0.0758 -0.0134 0.0208 123 PRO B CB 5904 C CG . PRO D 129 ? 0.4185 0.3773 0.2454 -0.0684 -0.0163 0.0202 123 PRO B CG 5905 C CD . PRO D 129 ? 0.4244 0.4016 0.2682 -0.0578 -0.0130 0.0168 123 PRO B CD 5906 N N . LEU D 130 ? 0.3442 0.2961 0.1776 -0.0595 -0.0057 0.0229 124 LEU B N 5907 C CA . LEU D 130 ? 0.4107 0.3412 0.2338 -0.0549 -0.0073 0.0244 124 LEU B CA 5908 C C . LEU D 130 ? 0.4990 0.4134 0.3031 -0.0676 -0.0131 0.0273 124 LEU B C 5909 O O . LEU D 130 ? 0.4309 0.3500 0.2323 -0.0768 -0.0121 0.0283 124 LEU B O 5910 C CB . LEU D 130 ? 0.4627 0.4018 0.2965 -0.0488 -0.0019 0.0231 124 LEU B CB 5911 C CG . LEU D 130 ? 0.4656 0.4175 0.3157 -0.0370 0.0037 0.0204 124 LEU B CG 5912 C CD1 . LEU D 130 ? 0.3284 0.2926 0.1901 -0.0336 0.0093 0.0190 124 LEU B CD1 5913 C CD2 . LEU D 130 ? 0.4115 0.3472 0.2567 -0.0271 0.0029 0.0194 124 LEU B CD2 5914 N N . ALA D 131 ? 0.5330 0.4278 0.3228 -0.0687 -0.0194 0.0285 125 ALA B N 5915 C CA . ALA D 131 ? 0.6112 0.4890 0.3805 -0.0823 -0.0257 0.0314 125 ALA B CA 5916 C C . ALA D 131 ? 0.6568 0.5111 0.4101 -0.0822 -0.0304 0.0330 125 ALA B C 5917 O O . ALA D 131 ? 0.6231 0.4652 0.3760 -0.0694 -0.0321 0.0311 125 ALA B O 5918 C CB . ALA D 131 ? 0.5652 0.4293 0.3244 -0.0830 -0.0315 0.0318 125 ALA B CB 5919 N N . PRO D 132 ? 0.8009 0.6487 0.5398 -0.0970 -0.0326 0.0358 126 PRO B N 5920 C CA . PRO D 132 ? 0.9186 0.7426 0.6449 -0.0969 -0.0383 0.0362 126 PRO B CA 5921 C C . PRO D 132 ? 1.1236 0.9186 0.8343 -0.0950 -0.0478 0.0359 126 PRO B C 5922 O O . PRO D 132 ? 1.1239 0.9183 0.8317 -0.1005 -0.0495 0.0365 126 PRO B O 5923 C CB . PRO D 132 ? 0.8500 0.6813 0.5730 -0.1142 -0.0365 0.0377 126 PRO B CB 5924 C CG . PRO D 132 ? 0.8190 0.6670 0.5454 -0.1257 -0.0339 0.0376 126 PRO B CG 5925 C CD . PRO D 132 ? 0.8312 0.6965 0.5717 -0.1138 -0.0298 0.0363 126 PRO B CD 5926 N N . SER D 133 ? 1.4116 1.1833 1.1124 -0.0869 -0.0543 0.0344 127 SER B N 5927 C CA . SER D 133 ? 1.7128 1.4560 1.3987 -0.0838 -0.0641 0.0330 127 SER B CA 5928 C C . SER D 133 ? 1.8854 1.6025 1.5570 -0.0807 -0.0720 0.0315 127 SER B C 5929 O O . SER D 133 ? 1.8808 1.6030 1.5558 -0.0781 -0.0694 0.0312 127 SER B O 5930 C CB . SER D 133 ? 1.8119 1.5561 1.5042 -0.0686 -0.0647 0.0297 127 SER B CB 5931 O OG . SER D 133 ? 1.8305 1.5882 1.5345 -0.0562 -0.0594 0.0272 127 SER B OG 5932 N N . SER D 134 ? 2.0878 1.7763 1.7430 -0.0806 -0.0820 0.0301 128 SER B N 5933 C CA . SER D 134 ? 2.2805 1.9400 1.9192 -0.0779 -0.0913 0.0281 128 SER B CA 5934 C C . SER D 134 ? 2.5005 2.1585 2.1450 -0.0586 -0.0931 0.0230 128 SER B C 5935 O O . SER D 134 ? 2.4926 2.1331 2.1275 -0.0547 -0.0990 0.0210 128 SER B O 5936 C CB . SER D 134 ? 2.2176 1.8457 1.8371 -0.0811 -0.1022 0.0269 128 SER B CB 5937 O OG . SER D 134 ? 2.1846 1.8101 1.7946 -0.1010 -0.1016 0.0310 128 SER B OG 5938 N N . LYS D 135 ? 2.7669 2.4431 2.4264 -0.0468 -0.0883 0.0203 129 LYS B N 5939 C CA . LYS D 135 ? 3.0268 2.7084 2.6942 -0.0300 -0.0878 0.0146 129 LYS B CA 5940 C C . LYS D 135 ? 2.9542 2.6639 2.6364 -0.0321 -0.0764 0.0171 129 LYS B C 5941 O O . LYS D 135 ? 3.0436 2.7714 2.7387 -0.0223 -0.0703 0.0139 129 LYS B O 5942 C CB . LYS D 135 ? 3.1650 2.8490 2.8381 -0.0160 -0.0893 0.0086 129 LYS B CB 5943 C CG . LYS D 135 ? 3.1632 2.8705 2.8489 -0.0185 -0.0802 0.0105 129 LYS B CG 5944 C CD . LYS D 135 ? 3.2129 2.9141 2.8927 -0.0297 -0.0822 0.0148 129 LYS B CD 5945 C CE . LYS D 135 ? 3.2159 2.9397 2.9083 -0.0301 -0.0740 0.0161 129 LYS B CE 5946 N NZ . LYS D 135 ? 3.2194 2.9476 2.9176 -0.0148 -0.0732 0.0090 129 LYS B NZ 5947 N N . SER D 136 ? 2.8402 2.5527 2.5196 -0.0457 -0.0738 0.0222 130 SER B N 5948 C CA . SER D 136 ? 2.6689 2.4057 2.3608 -0.0489 -0.0641 0.0244 130 SER B CA 5949 C C . SER D 136 ? 2.5779 2.3069 2.2601 -0.0620 -0.0656 0.0279 130 SER B C 5950 O O . SER D 136 ? 2.5285 2.2779 2.2196 -0.0695 -0.0577 0.0305 130 SER B O 5951 C CB . SER D 136 ? 2.5709 2.3356 2.2778 -0.0550 -0.0540 0.0274 130 SER B CB 5952 O OG . SER D 136 ? 2.5060 2.2797 2.2228 -0.0422 -0.0510 0.0238 130 SER B OG 5953 N N . THR D 137 ? 2.5518 2.2507 2.2151 -0.0649 -0.0760 0.0273 131 THR B N 5954 C CA . THR D 137 ? 2.5040 2.1894 2.1536 -0.0774 -0.0789 0.0298 131 THR B CA 5955 C C . THR D 137 ? 2.4309 2.1054 2.0767 -0.0659 -0.0831 0.0266 131 THR B C 5956 O O . THR D 137 ? 2.4400 2.0849 2.0705 -0.0587 -0.0940 0.0232 131 THR B O 5957 C CB . THR D 137 ? 2.5341 2.1889 2.1618 -0.0877 -0.0886 0.0306 131 THR B CB 5958 O OG1 . THR D 137 ? 2.5297 2.1954 2.1612 -0.0976 -0.0851 0.0329 131 THR B OG1 5959 C CG2 . THR D 137 ? 2.5493 2.1897 2.1607 -0.1027 -0.0913 0.0329 131 THR B CG2 5960 N N . SER D 138 ? 2.3473 2.0455 2.0071 -0.0634 -0.0747 0.0271 132 SER B N 5961 C CA . SER D 138 ? 2.2820 1.9738 1.9403 -0.0520 -0.0777 0.0237 132 SER B CA 5962 C C . SER D 138 ? 2.2327 1.9090 1.8760 -0.0636 -0.0812 0.0264 132 SER B C 5963 O O . SER D 138 ? 2.2311 1.9261 1.8815 -0.0715 -0.0735 0.0291 132 SER B O 5964 C CB . SER D 138 ? 2.2315 1.9544 1.9102 -0.0442 -0.0672 0.0224 132 SER B CB 5965 O OG . SER D 138 ? 2.2105 1.9280 1.8881 -0.0320 -0.0704 0.0179 132 SER B OG 5966 N N . GLY D 139 ? 2.1570 1.7985 1.7788 -0.0646 -0.0929 0.0251 133 GLY B N 5967 C CA . GLY D 139 ? 2.0404 1.6613 1.6434 -0.0760 -0.0978 0.0272 133 GLY B CA 5968 C C . GLY D 139 ? 1.9339 1.5654 1.5340 -0.0992 -0.0914 0.0326 133 GLY B C 5969 O O . GLY D 139 ? 1.9673 1.6093 1.5682 -0.1087 -0.0864 0.0349 133 GLY B O 5970 N N . GLY D 140 ? 1.7669 1.3968 1.3640 -0.1084 -0.0917 0.0340 134 GLY B N 5971 C CA . GLY D 140 ? 1.5359 1.1767 1.1301 -0.1306 -0.0863 0.0376 134 GLY B CA 5972 C C . GLY D 140 ? 1.2136 0.8978 0.8335 -0.1342 -0.0726 0.0391 134 GLY B C 5973 O O . GLY D 140 ? 1.0792 0.7788 0.7006 -0.1518 -0.0672 0.0407 134 GLY B O 5974 N N . THR D 141 ? 1.1011 0.8049 0.7405 -0.1177 -0.0675 0.0377 135 THR B N 5975 C CA . THR D 141 ? 0.9671 0.7104 0.6306 -0.1186 -0.0552 0.0384 135 THR B CA 5976 C C . THR D 141 ? 0.8545 0.6092 0.5309 -0.1084 -0.0529 0.0373 135 THR B C 5977 O O . THR D 141 ? 0.8743 0.6187 0.5513 -0.0920 -0.0569 0.0348 135 THR B O 5978 C CB . THR D 141 ? 1.0133 0.7726 0.6889 -0.1094 -0.0498 0.0374 135 THR B CB 5979 O OG1 . THR D 141 ? 1.0440 0.7969 0.7092 -0.1207 -0.0507 0.0385 135 THR B OG1 5980 C CG2 . THR D 141 ? 0.9927 0.7911 0.6933 -0.1084 -0.0378 0.0371 135 THR B CG2 5981 N N . ALA D 142 ? 0.7291 0.5054 0.4154 -0.1182 -0.0466 0.0385 136 ALA B N 5982 C CA . ALA D 142 ? 0.6456 0.4336 0.3437 -0.1097 -0.0440 0.0377 136 ALA B CA 5983 C C . ALA D 142 ? 0.6764 0.4997 0.3974 -0.1056 -0.0330 0.0370 136 ALA B C 5984 O O . ALA D 142 ? 0.6794 0.5227 0.4084 -0.1141 -0.0268 0.0372 136 ALA B O 5985 C CB . ALA D 142 ? 0.5503 0.3347 0.2418 -0.1220 -0.0461 0.0389 136 ALA B CB 5986 N N . ALA D 143 ? 0.5711 0.4015 0.3019 -0.0928 -0.0309 0.0356 137 ALA B N 5987 C CA . ALA D 143 ? 0.5246 0.3859 0.2754 -0.0890 -0.0210 0.0346 137 ALA B CA 5988 C C . ALA D 143 ? 0.5326 0.4054 0.2917 -0.0897 -0.0192 0.0342 137 ALA B C 5989 O O . ALA D 143 ? 0.5487 0.4039 0.2989 -0.0852 -0.0248 0.0343 137 ALA B O 5990 C CB . ALA D 143 ? 0.4526 0.3172 0.2170 -0.0710 -0.0184 0.0309 137 ALA B CB 5991 N N . LEU D 144 ? 0.5306 0.4336 0.3078 -0.0946 -0.0117 0.0328 138 LEU B N 5992 C CA . LEU D 144 ? 0.4886 0.4058 0.2774 -0.0930 -0.0099 0.0312 138 LEU B CA 5993 C C . LEU D 144 ? 0.4453 0.3940 0.2602 -0.0863 -0.0018 0.0275 138 LEU B C 5994 O O . LEU D 144 ? 0.4386 0.3991 0.2620 -0.0854 0.0026 0.0264 138 LEU B O 5995 C CB . LEU D 144 ? 0.5046 0.4224 0.2815 -0.1105 -0.0125 0.0326 138 LEU B CB 5996 C CG . LEU D 144 ? 0.5755 0.5104 0.3513 -0.1276 -0.0088 0.0322 138 LEU B CG 5997 C CD1 . LEU D 144 ? 0.5626 0.5351 0.3624 -0.1287 -0.0022 0.0271 138 LEU B CD1 5998 C CD2 . LEU D 144 ? 0.6370 0.5544 0.3947 -0.1436 -0.0145 0.0337 138 LEU B CD2 5999 N N . GLY D 145 ? 0.4004 0.3613 0.2272 -0.0811 -0.0004 0.0254 139 GLY B N 6000 C CA . GLY D 145 ? 0.4501 0.4381 0.2994 -0.0742 0.0056 0.0216 139 GLY B CA 6001 C C . GLY D 145 ? 0.4517 0.4499 0.3104 -0.0689 0.0054 0.0193 139 GLY B C 6002 O O . GLY D 145 ? 0.4258 0.4140 0.2749 -0.0725 0.0010 0.0203 139 GLY B O 6003 N N . CYS D 146 ? 0.4366 0.4537 0.3133 -0.0599 0.0095 0.0159 140 CYS B N 6004 C CA . CYS D 146 ? 0.4193 0.4455 0.3046 -0.0532 0.0086 0.0132 140 CYS B CA 6005 C C . CYS D 146 ? 0.3989 0.4207 0.2915 -0.0383 0.0114 0.0128 140 CYS B C 6006 O O . CYS D 146 ? 0.3809 0.4091 0.2820 -0.0337 0.0157 0.0118 140 CYS B O 6007 C CB . CYS D 146 ? 0.3947 0.4505 0.2938 -0.0581 0.0094 0.0078 140 CYS B CB 6008 S SG . CYS D 146 ? 1.1018 1.1662 0.9931 -0.0757 0.0059 0.0062 140 CYS B SG 6009 N N . LEU D 147 ? 0.3912 0.4016 0.2794 -0.0317 0.0092 0.0133 141 LEU B N 6010 C CA . LEU D 147 ? 0.3919 0.3974 0.2845 -0.0195 0.0119 0.0126 141 LEU B CA 6011 C C . LEU D 147 ? 0.4570 0.4774 0.3593 -0.0146 0.0106 0.0093 141 LEU B C 6012 O O . LEU D 147 ? 0.3686 0.3897 0.2677 -0.0158 0.0061 0.0085 141 LEU B O 6013 C CB . LEU D 147 ? 0.3693 0.3522 0.2494 -0.0153 0.0105 0.0147 141 LEU B CB 6014 C CG . LEU D 147 ? 0.3763 0.3520 0.2571 -0.0050 0.0133 0.0139 141 LEU B CG 6015 C CD1 . LEU D 147 ? 0.3889 0.3668 0.2765 -0.0001 0.0193 0.0127 141 LEU B CD1 6016 C CD2 . LEU D 147 ? 0.4450 0.4012 0.3129 -0.0034 0.0116 0.0149 141 LEU B CD2 6017 N N . VAL D 148 ? 0.3324 0.3639 0.2459 -0.0087 0.0137 0.0069 142 VAL B N 6018 C CA . VAL D 148 ? 0.3446 0.3890 0.2667 -0.0025 0.0111 0.0028 142 VAL B CA 6019 C C . VAL D 148 ? 0.3430 0.3717 0.2606 0.0082 0.0122 0.0038 142 VAL B C 6020 O O . VAL D 148 ? 0.4078 0.4353 0.3294 0.0129 0.0165 0.0036 142 VAL B O 6021 C CB . VAL D 148 ? 0.3765 0.4452 0.3139 -0.0033 0.0127 -0.0017 142 VAL B CB 6022 C CG1 . VAL D 148 ? 0.3526 0.4356 0.2989 0.0037 0.0080 -0.0076 142 VAL B CG1 6023 C CG2 . VAL D 148 ? 0.3832 0.4657 0.3223 -0.0163 0.0131 -0.0025 142 VAL B CG2 6024 N N . LYS D 149 ? 0.3664 0.3825 0.2742 0.0111 0.0083 0.0048 143 LYS B N 6025 C CA . LYS D 149 ? 0.3957 0.3919 0.2938 0.0181 0.0100 0.0067 143 LYS B CA 6026 C C . LYS D 149 ? 0.3934 0.3870 0.2891 0.0260 0.0049 0.0045 143 LYS B C 6027 O O . LYS D 149 ? 0.4297 0.4319 0.3272 0.0264 -0.0016 0.0019 143 LYS B O 6028 C CB . LYS D 149 ? 0.4076 0.3857 0.2922 0.0151 0.0102 0.0099 143 LYS B CB 6029 C CG . LYS D 149 ? 0.4708 0.4294 0.3444 0.0200 0.0134 0.0112 143 LYS B CG 6030 C CD . LYS D 149 ? 0.4253 0.3698 0.2883 0.0168 0.0145 0.0128 143 LYS B CD 6031 C CE . LYS D 149 ? 0.4637 0.3922 0.3168 0.0201 0.0193 0.0126 143 LYS B CE 6032 N NZ . LYS D 149 ? 0.5990 0.5165 0.4414 0.0234 0.0161 0.0132 143 LYS B NZ 6033 N N . ASP D 150 ? 0.3774 0.3585 0.2681 0.0321 0.0076 0.0052 144 ASP B N 6034 C CA . ASP D 150 ? 0.3656 0.3353 0.2477 0.0398 0.0025 0.0042 144 ASP B CA 6035 C C . ASP D 150 ? 0.4314 0.4178 0.3239 0.0455 -0.0048 -0.0011 144 ASP B C 6036 O O . ASP D 150 ? 0.4456 0.4308 0.3337 0.0496 -0.0128 -0.0034 144 ASP B O 6037 C CB . ASP D 150 ? 0.4251 0.3791 0.2923 0.0391 -0.0013 0.0064 144 ASP B CB 6038 C CG . ASP D 150 ? 0.5457 0.4819 0.4011 0.0351 0.0052 0.0101 144 ASP B CG 6039 O OD1 . ASP D 150 ? 0.5722 0.5047 0.4285 0.0345 0.0123 0.0105 144 ASP B OD1 6040 O OD2 . ASP D 150 ? 0.5529 0.4800 0.3988 0.0327 0.0032 0.0116 144 ASP B OD2 6041 N N . TYR D 151 ? 0.3492 0.3519 0.2557 0.0466 -0.0026 -0.0040 145 TYR B N 6042 C CA . TYR D 151 ? 0.3603 0.3792 0.2772 0.0536 -0.0096 -0.0107 145 TYR B CA 6043 C C . TYR D 151 ? 0.3677 0.3763 0.2822 0.0615 -0.0091 -0.0113 145 TYR B C 6044 O O . TYR D 151 ? 0.3541 0.3488 0.2627 0.0595 -0.0015 -0.0070 145 TYR B O 6045 C CB . TYR D 151 ? 0.3701 0.4202 0.3063 0.0481 -0.0086 -0.0154 145 TYR B CB 6046 C CG . TYR D 151 ? 0.2979 0.3545 0.2420 0.0432 0.0002 -0.0134 145 TYR B CG 6047 C CD1 . TYR D 151 ? 0.3243 0.3766 0.2652 0.0340 0.0066 -0.0084 145 TYR B CD1 6048 C CD2 . TYR D 151 ? 0.1955 0.2618 0.1498 0.0485 0.0012 -0.0170 145 TYR B CD2 6049 C CE1 . TYR D 151 ? 0.3154 0.3727 0.2626 0.0303 0.0136 -0.0070 145 TYR B CE1 6050 C CE2 . TYR D 151 ? 0.2793 0.3519 0.2409 0.0443 0.0090 -0.0154 145 TYR B CE2 6051 C CZ . TYR D 151 ? 0.3321 0.4001 0.2900 0.0353 0.0151 -0.0104 145 TYR B CZ 6052 O OH . TYR D 151 ? 0.3958 0.4690 0.3599 0.0319 0.0219 -0.0093 145 TYR B OH 6053 N N . PHE D 152 ? 0.3921 0.4081 0.3113 0.0706 -0.0177 -0.0175 146 PHE B N 6054 C CA . PHE D 152 ? 0.3779 0.3831 0.2937 0.0790 -0.0193 -0.0190 146 PHE B CA 6055 C C . PHE D 152 ? 0.3442 0.3665 0.2707 0.0890 -0.0304 -0.0284 146 PHE B C 6056 O O . PHE D 152 ? 0.4360 0.4628 0.3613 0.0930 -0.0394 -0.0327 146 PHE B O 6057 C CB . PHE D 152 ? 0.4119 0.3811 0.3030 0.0818 -0.0202 -0.0136 146 PHE B CB 6058 C CG . PHE D 152 ? 0.4107 0.3641 0.2943 0.0890 -0.0220 -0.0144 146 PHE B CG 6059 C CD1 . PHE D 152 ? 0.4679 0.4139 0.3454 0.1004 -0.0344 -0.0194 146 PHE B CD1 6060 C CD2 . PHE D 152 ? 0.3291 0.2740 0.2107 0.0845 -0.0119 -0.0107 146 PHE B CD2 6061 C CE1 . PHE D 152 ? 0.5544 0.4826 0.4226 0.1069 -0.0370 -0.0201 146 PHE B CE1 6062 C CE2 . PHE D 152 ? 0.4754 0.4045 0.3488 0.0901 -0.0134 -0.0114 146 PHE B CE2 6063 C CZ . PHE D 152 ? 0.5452 0.4646 0.4110 0.1012 -0.0262 -0.0157 146 PHE B CZ 6064 N N . PRO D 153 ? 0.3199 0.3531 0.2576 0.0936 -0.0300 -0.0327 147 PRO B N 6065 C CA . PRO D 153 ? 0.3753 0.4072 0.3170 0.0889 -0.0194 -0.0287 147 PRO B CA 6066 C C . PRO D 153 ? 0.3963 0.4589 0.3581 0.0802 -0.0125 -0.0305 147 PRO B C 6067 O O . PRO D 153 ? 0.3599 0.4429 0.3306 0.0760 -0.0151 -0.0340 147 PRO B O 6068 C CB . PRO D 153 ? 0.3376 0.3658 0.2805 0.0997 -0.0251 -0.0337 147 PRO B CB 6069 C CG . PRO D 153 ? 0.3564 0.4071 0.3113 0.1078 -0.0369 -0.0440 147 PRO B CG 6070 C CD . PRO D 153 ? 0.3585 0.4053 0.3052 0.1055 -0.0414 -0.0429 147 PRO B CD 6071 N N . GLU D 154 ? 0.3489 0.4143 0.3169 0.0770 -0.0040 -0.0284 148 GLU B N 6072 C CA . GLU D 154 ? 0.3616 0.4556 0.3480 0.0701 0.0013 -0.0310 148 GLU B CA 6073 C C . GLU D 154 ? 0.3301 0.4528 0.3336 0.0758 -0.0058 -0.0415 148 GLU B C 6074 O O . GLU D 154 ? 0.3261 0.4437 0.3280 0.0871 -0.0141 -0.0466 148 GLU B O 6075 C CB . GLU D 154 ? 0.3764 0.4656 0.3648 0.0674 0.0108 -0.0273 148 GLU B CB 6076 C CG . GLU D 154 ? 0.4680 0.5361 0.4433 0.0608 0.0186 -0.0192 148 GLU B CG 6077 C CD . GLU D 154 ? 0.6058 0.6781 0.5878 0.0567 0.0278 -0.0175 148 GLU B CD 6078 O OE1 . GLU D 154 ? 0.6380 0.7299 0.6310 0.0503 0.0306 -0.0184 148 GLU B OE1 6079 O OE2 . GLU D 154 ? 0.6491 0.7050 0.6244 0.0593 0.0321 -0.0156 148 GLU B OE2 6080 N N . PRO D 155 ? 0.3254 0.4780 0.3445 0.0678 -0.0030 -0.0455 149 PRO B N 6081 C CA . PRO D 155 ? 0.3158 0.4730 0.3348 0.0542 0.0053 -0.0400 149 PRO B CA 6082 C C . PRO D 155 ? 0.3686 0.5375 0.3874 0.0462 0.0024 -0.0416 149 PRO B C 6083 O O . PRO D 155 ? 0.3292 0.5100 0.3522 0.0508 -0.0057 -0.0489 149 PRO B O 6084 C CB . PRO D 155 ? 0.3334 0.5154 0.3687 0.0505 0.0101 -0.0442 149 PRO B CB 6085 C CG . PRO D 155 ? 0.3595 0.5640 0.4087 0.0601 0.0020 -0.0558 149 PRO B CG 6086 C CD . PRO D 155 ? 0.2810 0.4656 0.3191 0.0716 -0.0075 -0.0568 149 PRO B CD 6087 N N . VAL D 156 ? 0.4054 0.5703 0.4187 0.0343 0.0086 -0.0354 150 VAL B N 6088 C CA . VAL D 156 ? 0.4139 0.5934 0.4283 0.0235 0.0073 -0.0372 150 VAL B CA 6089 C C . VAL D 156 ? 0.3965 0.5963 0.4194 0.0119 0.0133 -0.0384 150 VAL B C 6090 O O . VAL D 156 ? 0.3408 0.5357 0.3647 0.0116 0.0191 -0.0349 150 VAL B O 6091 C CB . VAL D 156 ? 0.3768 0.5322 0.3742 0.0181 0.0080 -0.0291 150 VAL B CB 6092 C CG1 . VAL D 156 ? 0.3694 0.5090 0.3580 0.0273 0.0011 -0.0292 150 VAL B CG1 6093 C CG2 . VAL D 156 ? 0.4335 0.5668 0.4215 0.0160 0.0151 -0.0206 150 VAL B CG2 6094 N N . THR D 157 ? 0.4549 0.6775 0.4832 0.0017 0.0120 -0.0438 151 THR B N 6095 C CA . THR D 157 ? 0.4209 0.6592 0.4524 -0.0124 0.0178 -0.0440 151 THR B CA 6096 C C . THR D 157 ? 0.3434 0.5721 0.3611 -0.0262 0.0184 -0.0390 151 THR B C 6097 O O . THR D 157 ? 0.3307 0.5592 0.3448 -0.0269 0.0136 -0.0409 151 THR B O 6098 C CB . THR D 157 ? 0.4775 0.7546 0.5274 -0.0153 0.0168 -0.0563 151 THR B CB 6099 O OG1 . THR D 157 ? 0.5008 0.7938 0.5555 -0.0145 0.0102 -0.0646 151 THR B OG1 6100 C CG2 . THR D 157 ? 0.4316 0.7167 0.4944 -0.0019 0.0162 -0.0611 151 THR B CG2 6101 N N . VAL D 158 ? 0.3347 0.5534 0.3433 -0.0365 0.0236 -0.0325 152 VAL B N 6102 C CA . VAL D 158 ? 0.3455 0.5509 0.3382 -0.0498 0.0236 -0.0271 152 VAL B CA 6103 C C . VAL D 158 ? 0.3515 0.5722 0.3428 -0.0667 0.0274 -0.0286 152 VAL B C 6104 O O . VAL D 158 ? 0.3884 0.6139 0.3837 -0.0676 0.0317 -0.0282 152 VAL B O 6105 C CB . VAL D 158 ? 0.3410 0.5105 0.3173 -0.0463 0.0245 -0.0168 152 VAL B CB 6106 C CG1 . VAL D 158 ? 0.2829 0.4369 0.2419 -0.0583 0.0225 -0.0121 152 VAL B CG1 6107 C CG2 . VAL D 158 ? 0.4118 0.5664 0.3887 -0.0306 0.0221 -0.0155 152 VAL B CG2 6108 N N . SER D 159 ? 0.4419 0.6699 0.4265 -0.0810 0.0260 -0.0306 153 SER B N 6109 C CA . SER D 159 ? 0.4484 0.6862 0.4262 -0.1002 0.0296 -0.0312 153 SER B CA 6110 C C . SER D 159 ? 0.4485 0.6652 0.4049 -0.1135 0.0274 -0.0253 153 SER B C 6111 O O . SER D 159 ? 0.4906 0.6956 0.4428 -0.1084 0.0231 -0.0239 153 SER B O 6112 C CB . SER D 159 ? 0.4449 0.7248 0.4399 -0.1076 0.0309 -0.0439 153 SER B CB 6113 O OG . SER D 159 ? 0.5473 0.8410 0.5471 -0.1084 0.0266 -0.0507 153 SER B OG 6114 N N . TRP D 160 ? 0.3909 0.6010 0.3322 -0.1305 0.0299 -0.0218 154 TRP B N 6115 C CA . TRP D 160 ? 0.4092 0.5970 0.3274 -0.1447 0.0273 -0.0162 154 TRP B CA 6116 C C . TRP D 160 ? 0.5044 0.7147 0.4187 -0.1674 0.0295 -0.0224 154 TRP B C 6117 O O . TRP D 160 ? 0.5800 0.8012 0.4981 -0.1720 0.0304 -0.0270 154 TRP B O 6118 C CB . TRP D 160 ? 0.3831 0.5343 0.2799 -0.1458 0.0265 -0.0058 154 TRP B CB 6119 C CG . TRP D 160 ? 0.4216 0.5484 0.3185 -0.1264 0.0238 -0.0004 154 TRP B CG 6120 C CD1 . TRP D 160 ? 0.4465 0.5732 0.3554 -0.1106 0.0261 0.0000 154 TRP B CD1 6121 C CD2 . TRP D 160 ? 0.4648 0.5652 0.3493 -0.1216 0.0188 0.0045 154 TRP B CD2 6122 N NE1 . TRP D 160 ? 0.4522 0.5546 0.3565 -0.0972 0.0232 0.0045 154 TRP B NE1 6123 C CE2 . TRP D 160 ? 0.4626 0.5490 0.3523 -0.1033 0.0187 0.0072 154 TRP B CE2 6124 C CE3 . TRP D 160 ? 0.4218 0.5095 0.2910 -0.1316 0.0145 0.0064 154 TRP B CE3 6125 C CZ2 . TRP D 160 ? 0.5136 0.5751 0.3941 -0.0948 0.0146 0.0112 154 TRP B CZ2 6126 C CZ3 . TRP D 160 ? 0.4556 0.5176 0.3160 -0.1221 0.0100 0.0108 154 TRP B CZ3 6127 C CH2 . TRP D 160 ? 0.4930 0.5429 0.3593 -0.1039 0.0102 0.0130 154 TRP B CH2 6128 N N . ASN D 161 ? 0.4806 0.6897 0.3873 -0.1762 0.0265 -0.0238 155 ASN B N 6129 C CA . ASN D 161 ? 0.5896 0.8176 0.4922 -0.1951 0.0269 -0.0317 155 ASN B CA 6130 C C . ASN D 161 ? 0.6157 0.8805 0.5383 -0.1899 0.0292 -0.0447 155 ASN B C 6131 O O . ASN D 161 ? 0.5988 0.8704 0.5129 -0.2001 0.0309 -0.0497 155 ASN B O 6132 C CB . ASN D 161 ? 0.5527 0.7521 0.4283 -0.2105 0.0248 -0.0259 155 ASN B CB 6133 C CG . ASN D 161 ? 0.6412 0.8003 0.4939 -0.2140 0.0206 -0.0145 155 ASN B CG 6134 O OD1 . ASN D 161 ? 0.6472 0.8014 0.4999 -0.2073 0.0199 -0.0115 155 ASN B OD1 6135 N ND2 . ASN D 161 ? 0.6818 0.8103 0.5130 -0.2228 0.0171 -0.0087 155 ASN B ND2 6136 N N . SER D 162 ? 0.6213 0.9073 0.5685 -0.1731 0.0290 -0.0502 156 SER B N 6137 C CA . SER D 162 ? 0.6165 0.9341 0.5828 -0.1638 0.0300 -0.0632 156 SER B CA 6138 C C . SER D 162 ? 0.6386 0.9575 0.6040 -0.1634 0.0324 -0.0647 156 SER B C 6139 O O . SER D 162 ? 0.7278 1.0675 0.6967 -0.1657 0.0343 -0.0749 156 SER B O 6140 C CB . SER D 162 ? 0.6194 0.9572 0.5843 -0.1728 0.0311 -0.0734 156 SER B CB 6141 O OG . SER D 162 ? 0.6560 0.9918 0.6227 -0.1726 0.0277 -0.0724 156 SER B OG 6142 N N . GLY D 163 ? 0.5768 0.8734 0.5374 -0.1599 0.0325 -0.0548 157 GLY B N 6143 C CA . GLY D 163 ? 0.4941 0.7902 0.4553 -0.1582 0.0338 -0.0555 157 GLY B CA 6144 C C . GLY D 163 ? 0.5697 0.8456 0.5077 -0.1754 0.0339 -0.0498 157 GLY B C 6145 O O . GLY D 163 ? 0.6340 0.9020 0.5699 -0.1745 0.0345 -0.0474 157 GLY B O 6146 N N . ALA D 164 ? 0.5736 0.8395 0.4933 -0.1910 0.0329 -0.0478 158 ALA B N 6147 C CA . ALA D 164 ? 0.6420 0.8851 0.5365 -0.2083 0.0314 -0.0427 158 ALA B CA 6148 C C . ALA D 164 ? 0.6844 0.8945 0.5709 -0.2035 0.0296 -0.0308 158 ALA B C 6149 O O . ALA D 164 ? 0.7594 0.9618 0.6403 -0.2061 0.0296 -0.0294 158 ALA B O 6150 C CB . ALA D 164 ? 0.5922 0.8255 0.4675 -0.2237 0.0297 -0.0417 158 ALA B CB 6151 N N . LEU D 165 ? 0.6375 0.8279 0.5224 -0.1956 0.0283 -0.0227 159 LEU B N 6152 C CA . LEU D 165 ? 0.5848 0.7411 0.4587 -0.1889 0.0267 -0.0119 159 LEU B CA 6153 C C . LEU D 165 ? 0.6162 0.7806 0.5091 -0.1701 0.0300 -0.0116 159 LEU B C 6154 O O . LEU D 165 ? 0.6323 0.8103 0.5416 -0.1570 0.0319 -0.0135 159 LEU B O 6155 C CB . LEU D 165 ? 0.5415 0.6707 0.4014 -0.1870 0.0237 -0.0041 159 LEU B CB 6156 C CG . LEU D 165 ? 0.5804 0.6706 0.4242 -0.1786 0.0205 0.0057 159 LEU B CG 6157 C CD1 . LEU D 165 ? 0.5732 0.6437 0.3999 -0.1891 0.0175 0.0080 159 LEU B CD1 6158 C CD2 . LEU D 165 ? 0.6006 0.6646 0.4288 -0.1770 0.0159 0.0114 159 LEU B CD2 6159 N N . THR D 166 ? 0.5752 0.7305 0.4649 -0.1690 0.0303 -0.0096 160 THR B N 6160 C CA . THR D 166 ? 0.5298 0.6929 0.4368 -0.1524 0.0333 -0.0101 160 THR B CA 6161 C C . THR D 166 ? 0.5499 0.6831 0.4437 -0.1476 0.0324 -0.0020 160 THR B C 6162 O O . THR D 166 ? 0.4697 0.6008 0.3733 -0.1323 0.0347 -0.0003 160 THR B O 6163 C CB . THR D 166 ? 0.5542 0.7467 0.4771 -0.1529 0.0351 -0.0193 160 THR B CB 6164 O OG1 . THR D 166 ? 0.7302 0.9322 0.6728 -0.1349 0.0373 -0.0208 160 THR B OG1 6165 C CG2 . THR D 166 ? 0.4657 0.6493 0.3742 -0.1653 0.0341 -0.0186 160 THR B CG2 6166 N N . SER D 167 ? 0.5826 0.6917 0.4531 -0.1604 0.0286 0.0022 161 SER B N 6167 C CA . SER D 167 ? 0.6173 0.6967 0.4726 -0.1563 0.0263 0.0088 161 SER B CA 6168 C C . SER D 167 ? 0.5851 0.6368 0.4291 -0.1460 0.0233 0.0152 161 SER B C 6169 O O . SER D 167 ? 0.5742 0.6119 0.4056 -0.1516 0.0194 0.0175 161 SER B O 6170 C CB . SER D 167 ? 0.7118 0.7733 0.5445 -0.1736 0.0221 0.0103 161 SER B CB 6171 O OG . SER D 167 ? 0.8067 0.8346 0.6210 -0.1692 0.0179 0.0167 161 SER B OG 6172 N N . GLY D 168 ? 0.5546 0.5990 0.4028 -0.1307 0.0247 0.0173 162 GLY B N 6173 C CA . GLY D 168 ? 0.5786 0.5972 0.4153 -0.1199 0.0213 0.0218 162 GLY B CA 6174 C C . GLY D 168 ? 0.5173 0.5489 0.3679 -0.1099 0.0245 0.0204 162 GLY B C 6175 O O . GLY D 168 ? 0.5422 0.5543 0.3855 -0.1006 0.0212 0.0228 162 GLY B O 6176 N N . VAL D 169 ? 0.3930 0.4573 0.2654 -0.1102 0.0297 0.0152 163 VAL B N 6177 C CA . VAL D 169 ? 0.3830 0.4605 0.2710 -0.0994 0.0319 0.0127 163 VAL B CA 6178 C C . VAL D 169 ? 0.4539 0.5335 0.3576 -0.0814 0.0349 0.0112 163 VAL B C 6179 O O . VAL D 169 ? 0.4633 0.5585 0.3785 -0.0793 0.0392 0.0087 163 VAL B O 6180 C CB . VAL D 169 ? 0.3468 0.4587 0.2516 -0.1057 0.0352 0.0064 163 VAL B CB 6181 C CG1 . VAL D 169 ? 0.2857 0.4072 0.2081 -0.0907 0.0352 0.0031 163 VAL B CG1 6182 C CG2 . VAL D 169 ? 0.3893 0.5001 0.2816 -0.1229 0.0317 0.0062 163 VAL B CG2 6183 N N . HIS D 170 ? 0.4639 0.5279 0.3675 -0.0692 0.0329 0.0125 164 HIS B N 6184 C CA . HIS D 170 ? 0.3838 0.4512 0.3024 -0.0534 0.0364 0.0103 164 HIS B CA 6185 C C . HIS D 170 ? 0.3551 0.4290 0.2837 -0.0458 0.0364 0.0084 164 HIS B C 6186 O O . HIS D 170 ? 0.3713 0.4287 0.2908 -0.0436 0.0329 0.0104 164 HIS B O 6187 C CB . HIS D 170 ? 0.3644 0.4066 0.2729 -0.0450 0.0345 0.0124 164 HIS B CB 6188 C CG . HIS D 170 ? 0.4794 0.5126 0.3774 -0.0498 0.0333 0.0138 164 HIS B CG 6189 N ND1 . HIS D 170 ? 0.4759 0.5237 0.3846 -0.0482 0.0379 0.0116 164 HIS B ND1 6190 C CD2 . HIS D 170 ? 0.5108 0.5199 0.3868 -0.0558 0.0272 0.0171 164 HIS B CD2 6191 C CE1 . HIS D 170 ? 0.5118 0.5455 0.4056 -0.0531 0.0349 0.0136 164 HIS B CE1 6192 N NE2 . HIS D 170 ? 0.5100 0.5190 0.3831 -0.0576 0.0281 0.0170 164 HIS B NE2 6193 N N . THR D 171 ? 0.3474 0.4448 0.2939 -0.0417 0.0397 0.0040 165 THR B N 6194 C CA . THR D 171 ? 0.3865 0.4880 0.3415 -0.0327 0.0390 0.0019 165 THR B CA 6195 C C . THR D 171 ? 0.3393 0.4356 0.3018 -0.0196 0.0425 0.0011 165 THR B C 6196 O O . THR D 171 ? 0.3564 0.4664 0.3307 -0.0163 0.0461 -0.0017 165 THR B O 6197 C CB . THR D 171 ? 0.3889 0.5181 0.3574 -0.0357 0.0386 -0.0036 165 THR B CB 6198 O OG1 . THR D 171 ? 0.4215 0.5557 0.3821 -0.0492 0.0358 -0.0037 165 THR B OG1 6199 C CG2 . THR D 171 ? 0.4193 0.5495 0.3946 -0.0246 0.0365 -0.0060 165 THR B CG2 6200 N N . PHE D 172 ? 0.2234 0.3002 0.1785 -0.0129 0.0417 0.0031 166 PHE B N 6201 C CA . PHE D 172 ? 0.2127 0.2820 0.1717 -0.0026 0.0456 0.0022 166 PHE B CA 6202 C C . PHE D 172 ? 0.2982 0.3776 0.2683 0.0049 0.0470 -0.0008 166 PHE B C 6203 O O . PHE D 172 ? 0.2904 0.3777 0.2628 0.0044 0.0435 -0.0020 166 PHE B O 6204 C CB . PHE D 172 ? 0.2047 0.2510 0.1511 0.0006 0.0445 0.0042 166 PHE B CB 6205 C CG . PHE D 172 ? 0.2880 0.3213 0.2230 -0.0039 0.0422 0.0060 166 PHE B CG 6206 C CD1 . PHE D 172 ? 0.3011 0.3300 0.2368 -0.0001 0.0448 0.0044 166 PHE B CD1 6207 C CD2 . PHE D 172 ? 0.3038 0.3285 0.2264 -0.0117 0.0367 0.0088 166 PHE B CD2 6208 C CE1 . PHE D 172 ? 0.3678 0.3827 0.2913 -0.0030 0.0410 0.0054 166 PHE B CE1 6209 C CE2 . PHE D 172 ? 0.3690 0.3783 0.2784 -0.0154 0.0332 0.0104 166 PHE B CE2 6210 C CZ . PHE D 172 ? 0.3588 0.3626 0.2683 -0.0105 0.0348 0.0086 166 PHE B CZ 6211 N N . PRO D 173 ? 0.3248 0.4037 0.3013 0.0120 0.0516 -0.0025 167 PRO B N 6212 C CA . PRO D 173 ? 0.2964 0.3784 0.2792 0.0195 0.0520 -0.0048 167 PRO B CA 6213 C C . PRO D 173 ? 0.2767 0.3420 0.2487 0.0224 0.0495 -0.0031 167 PRO B C 6214 O O . PRO D 173 ? 0.3697 0.4196 0.3312 0.0208 0.0500 -0.0008 167 PRO B O 6215 C CB . PRO D 173 ? 0.2587 0.3379 0.2460 0.0247 0.0580 -0.0063 167 PRO B CB 6216 C CG . PRO D 173 ? 0.3388 0.4195 0.3282 0.0190 0.0586 -0.0061 167 PRO B CG 6217 C CD . PRO D 173 ? 0.3824 0.4580 0.3599 0.0131 0.0559 -0.0029 167 PRO B CD 6218 N N . ALA D 174 ? 0.2571 0.3251 0.2310 0.0269 0.0461 -0.0048 168 ALA B N 6219 C CA . ALA D 174 ? 0.2912 0.3419 0.2533 0.0300 0.0434 -0.0031 168 ALA B CA 6220 C C . ALA D 174 ? 0.3567 0.3894 0.3111 0.0333 0.0488 -0.0022 168 ALA B C 6221 O O . ALA D 174 ? 0.3779 0.4133 0.3381 0.0356 0.0536 -0.0039 168 ALA B O 6222 C CB . ALA D 174 ? 0.3125 0.3688 0.2776 0.0354 0.0376 -0.0058 168 ALA B CB 6223 N N . VAL D 175 ? 0.3106 0.3260 0.2518 0.0327 0.0483 -0.0002 169 VAL B N 6224 C CA . VAL D 175 ? 0.2961 0.2952 0.2285 0.0349 0.0534 -0.0005 169 VAL B CA 6225 C C . VAL D 175 ? 0.3630 0.3481 0.2836 0.0377 0.0495 0.0006 169 VAL B C 6226 O O . VAL D 175 ? 0.3512 0.3360 0.2680 0.0373 0.0433 0.0020 169 VAL B O 6227 C CB . VAL D 175 ? 0.3479 0.3381 0.2736 0.0316 0.0572 -0.0006 169 VAL B CB 6228 C CG1 . VAL D 175 ? 0.3965 0.3979 0.3314 0.0295 0.0590 -0.0017 169 VAL B CG1 6229 C CG2 . VAL D 175 ? 0.4364 0.4175 0.3517 0.0292 0.0524 0.0017 169 VAL B CG2 6230 N N . LEU D 176 ? 0.3475 0.3205 0.2612 0.0402 0.0529 -0.0001 170 LEU B N 6231 C CA . LEU D 176 ? 0.3128 0.2676 0.2110 0.0423 0.0492 0.0013 170 LEU B CA 6232 C C . LEU D 176 ? 0.3808 0.3200 0.2646 0.0379 0.0528 0.0024 170 LEU B C 6233 O O . LEU D 176 ? 0.3754 0.3108 0.2571 0.0348 0.0605 0.0005 170 LEU B O 6234 C CB . LEU D 176 ? 0.3627 0.3082 0.2564 0.0458 0.0506 0.0001 170 LEU B CB 6235 C CG . LEU D 176 ? 0.4254 0.3468 0.2988 0.0478 0.0466 0.0017 170 LEU B CG 6236 C CD1 . LEU D 176 ? 0.4556 0.3780 0.3272 0.0526 0.0356 0.0024 170 LEU B CD1 6237 C CD2 . LEU D 176 ? 0.3906 0.3024 0.2596 0.0507 0.0478 0.0005 170 LEU B CD2 6238 N N . GLN D 177 ? 0.3828 0.3148 0.2575 0.0376 0.0470 0.0045 171 GLN B N 6239 C CA . GLN D 177 ? 0.3742 0.2923 0.2352 0.0335 0.0497 0.0051 171 GLN B CA 6240 C C . GLN D 177 ? 0.3318 0.2288 0.1746 0.0327 0.0523 0.0053 171 GLN B C 6241 O O . GLN D 177 ? 0.4124 0.3029 0.2515 0.0360 0.0502 0.0058 171 GLN B O 6242 C CB . GLN D 177 ? 0.3780 0.2959 0.2356 0.0332 0.0425 0.0072 171 GLN B CB 6243 C CG . GLN D 177 ? 0.4046 0.3400 0.2761 0.0315 0.0403 0.0071 171 GLN B CG 6244 C CD . GLN D 177 ? 0.5311 0.4676 0.3998 0.0308 0.0325 0.0089 171 GLN B CD 6245 O OE1 . GLN D 177 ? 0.5250 0.4584 0.3896 0.0274 0.0319 0.0095 171 GLN B OE1 6246 N NE2 . GLN D 177 ? 0.5233 0.4649 0.3946 0.0345 0.0260 0.0088 171 GLN B NE2 6247 N N . SER D 178 ? 0.3572 0.2426 0.1872 0.0280 0.0566 0.0046 172 SER B N 6248 C CA . SER D 178 ? 0.4068 0.2710 0.2164 0.0247 0.0600 0.0047 172 SER B CA 6249 C C . SER D 178 ? 0.4588 0.3068 0.2530 0.0277 0.0509 0.0086 172 SER B C 6250 O O . SER D 178 ? 0.4932 0.3198 0.2673 0.0257 0.0514 0.0097 172 SER B O 6251 C CB . SER D 178 ? 0.4237 0.2840 0.2262 0.0180 0.0673 0.0014 172 SER B CB 6252 O OG . SER D 178 ? 0.4998 0.3632 0.3024 0.0183 0.0634 0.0020 172 SER B OG 6253 N N . SER D 179 ? 0.4097 0.2674 0.2124 0.0322 0.0424 0.0102 173 SER B N 6254 C CA . SER D 179 ? 0.4928 0.3390 0.2843 0.0369 0.0323 0.0125 173 SER B CA 6255 C C . SER D 179 ? 0.5206 0.3666 0.3152 0.0438 0.0264 0.0121 173 SER B C 6256 O O . SER D 179 ? 0.5493 0.3817 0.3316 0.0489 0.0175 0.0130 173 SER B O 6257 C CB . SER D 179 ? 0.4818 0.3411 0.2826 0.0387 0.0255 0.0130 173 SER B CB 6258 O OG . SER D 179 ? 0.5019 0.3850 0.3248 0.0407 0.0245 0.0114 173 SER B OG 6259 N N . GLY D 180 ? 0.5438 0.4051 0.3549 0.0448 0.0305 0.0101 174 GLY B N 6260 C CA . GLY D 180 ? 0.5267 0.3918 0.3440 0.0521 0.0244 0.0085 174 GLY B CA 6261 C C . GLY D 180 ? 0.5001 0.3901 0.3374 0.0571 0.0172 0.0063 174 GLY B C 6262 O O . GLY D 180 ? 0.4340 0.3316 0.2790 0.0640 0.0107 0.0034 174 GLY B O 6263 N N . LEU D 181 ? 0.4283 0.3311 0.2734 0.0530 0.0181 0.0069 175 LEU B N 6264 C CA . LEU D 181 ? 0.3961 0.3237 0.2594 0.0546 0.0129 0.0045 175 LEU B CA 6265 C C . LEU D 181 ? 0.4185 0.3651 0.2983 0.0494 0.0203 0.0040 175 LEU B C 6266 O O . LEU D 181 ? 0.4050 0.3454 0.2815 0.0446 0.0283 0.0056 175 LEU B O 6267 C CB . LEU D 181 ? 0.4486 0.3753 0.3067 0.0532 0.0073 0.0055 175 LEU B CB 6268 C CG . LEU D 181 ? 0.4671 0.3742 0.3072 0.0583 -0.0010 0.0060 175 LEU B CG 6269 C CD1 . LEU D 181 ? 0.5375 0.4462 0.3745 0.0557 -0.0052 0.0068 175 LEU B CD1 6270 C CD2 . LEU D 181 ? 0.3997 0.3115 0.2439 0.0677 -0.0105 0.0017 175 LEU B CD2 6271 N N . TYR D 182 ? 0.3651 0.3352 0.2621 0.0502 0.0174 0.0011 176 TYR B N 6272 C CA . TYR D 182 ? 0.2965 0.2832 0.2073 0.0449 0.0235 0.0009 176 TYR B CA 6273 C C . TYR D 182 ? 0.3516 0.3444 0.2633 0.0381 0.0230 0.0024 176 TYR B C 6274 O O . TYR D 182 ? 0.3420 0.3349 0.2498 0.0377 0.0170 0.0024 176 TYR B O 6275 C CB . TYR D 182 ? 0.2214 0.2307 0.1494 0.0476 0.0216 -0.0034 176 TYR B CB 6276 C CG . TYR D 182 ? 0.2895 0.2931 0.2176 0.0542 0.0224 -0.0052 176 TYR B CG 6277 C CD1 . TYR D 182 ? 0.2888 0.2927 0.2214 0.0528 0.0304 -0.0048 176 TYR B CD1 6278 C CD2 . TYR D 182 ? 0.2637 0.2601 0.1862 0.0622 0.0144 -0.0076 176 TYR B CD2 6279 C CE1 . TYR D 182 ? 0.3013 0.2989 0.2331 0.0581 0.0311 -0.0065 176 TYR B CE1 6280 C CE2 . TYR D 182 ? 0.4132 0.4012 0.3335 0.0682 0.0142 -0.0092 176 TYR B CE2 6281 C CZ . TYR D 182 ? 0.3837 0.3725 0.3087 0.0656 0.0229 -0.0084 176 TYR B CZ 6282 O OH . TYR D 182 ? 0.4733 0.4527 0.3952 0.0710 0.0226 -0.0100 176 TYR B OH 6283 N N . SER D 183 ? 0.2649 0.2616 0.1809 0.0330 0.0289 0.0035 177 SER B N 6284 C CA . SER D 183 ? 0.3152 0.3161 0.2311 0.0262 0.0279 0.0049 177 SER B CA 6285 C C . SER D 183 ? 0.3717 0.3861 0.2980 0.0221 0.0316 0.0043 177 SER B C 6286 O O . SER D 183 ? 0.3388 0.3548 0.2704 0.0246 0.0367 0.0033 177 SER B O 6287 C CB . SER D 183 ? 0.3206 0.3026 0.2230 0.0245 0.0297 0.0073 177 SER B CB 6288 O OG . SER D 183 ? 0.5039 0.4877 0.4049 0.0184 0.0279 0.0086 177 SER B OG 6289 N N . LEU D 184 ? 0.3739 0.3966 0.3016 0.0151 0.0290 0.0049 178 LEU B N 6290 C CA . LEU D 184 ? 0.3617 0.3975 0.2973 0.0098 0.0312 0.0044 178 LEU B CA 6291 C C . LEU D 184 ? 0.3828 0.4152 0.3107 0.0008 0.0284 0.0067 178 LEU B C 6292 O O . LEU D 184 ? 0.4092 0.4370 0.3303 -0.0018 0.0240 0.0076 178 LEU B O 6293 C CB . LEU D 184 ? 0.3909 0.4497 0.3403 0.0103 0.0299 0.0005 178 LEU B CB 6294 C CG . LEU D 184 ? 0.4025 0.4819 0.3613 0.0028 0.0307 -0.0015 178 LEU B CG 6295 C CD1 . LEU D 184 ? 0.3555 0.4546 0.3291 0.0080 0.0309 -0.0067 178 LEU B CD1 6296 C CD2 . LEU D 184 ? 0.3682 0.4554 0.3238 -0.0069 0.0265 -0.0019 178 LEU B CD2 6297 N N . SER D 185 ? 0.3534 0.3864 0.2810 -0.0041 0.0305 0.0076 179 SER B N 6298 C CA . SER D 185 ? 0.4244 0.4532 0.3428 -0.0139 0.0270 0.0098 179 SER B CA 6299 C C . SER D 185 ? 0.3781 0.4224 0.3019 -0.0219 0.0282 0.0090 179 SER B C 6300 O O . SER D 185 ? 0.3846 0.4370 0.3170 -0.0189 0.0322 0.0075 179 SER B O 6301 C CB . SER D 185 ? 0.4879 0.4946 0.3936 -0.0129 0.0263 0.0119 179 SER B CB 6302 O OG . SER D 185 ? 0.5958 0.5886 0.4935 -0.0091 0.0241 0.0125 179 SER B OG 6303 N N . SER D 186 ? 0.3228 0.3713 0.2408 -0.0330 0.0248 0.0097 180 SER B N 6304 C CA . SER D 186 ? 0.3560 0.4157 0.2742 -0.0437 0.0259 0.0093 180 SER B CA 6305 C C . SER D 186 ? 0.4344 0.4740 0.3330 -0.0535 0.0219 0.0135 180 SER B C 6306 O O . SER D 186 ? 0.4371 0.4686 0.3263 -0.0583 0.0178 0.0148 180 SER B O 6307 C CB . SER D 186 ? 0.3006 0.3875 0.2298 -0.0504 0.0258 0.0047 180 SER B CB 6308 O OG . SER D 186 ? 0.3163 0.4147 0.2443 -0.0625 0.0275 0.0040 180 SER B OG 6309 N N . VAL D 187 ? 0.3654 0.3953 0.2568 -0.0559 0.0225 0.0154 181 VAL B N 6310 C CA . VAL D 187 ? 0.3666 0.3735 0.2366 -0.0644 0.0173 0.0193 181 VAL B CA 6311 C C . VAL D 187 ? 0.4010 0.4130 0.2641 -0.0778 0.0178 0.0201 181 VAL B C 6312 O O . VAL D 187 ? 0.3950 0.4273 0.2709 -0.0784 0.0227 0.0176 181 VAL B O 6313 C CB . VAL D 187 ? 0.4017 0.3841 0.2629 -0.0542 0.0151 0.0205 181 VAL B CB 6314 C CG1 . VAL D 187 ? 0.3215 0.2985 0.1877 -0.0424 0.0153 0.0191 181 VAL B CG1 6315 C CG2 . VAL D 187 ? 0.3739 0.3617 0.2428 -0.0487 0.0191 0.0189 181 VAL B CG2 6316 N N . VAL D 188 ? 0.4605 0.4528 0.3018 -0.0892 0.0124 0.0237 182 VAL B N 6317 C CA . VAL D 188 ? 0.4682 0.4591 0.2970 -0.1036 0.0122 0.0253 182 VAL B CA 6318 C C . VAL D 188 ? 0.5625 0.5173 0.3628 -0.1088 0.0041 0.0300 182 VAL B C 6319 O O . VAL D 188 ? 0.5608 0.4982 0.3506 -0.1078 -0.0011 0.0316 182 VAL B O 6320 C CB . VAL D 188 ? 0.4648 0.4802 0.2976 -0.1199 0.0150 0.0228 182 VAL B CB 6321 C CG1 . VAL D 188 ? 0.4711 0.4799 0.2953 -0.1263 0.0110 0.0235 182 VAL B CG1 6322 C CG2 . VAL D 188 ? 0.4406 0.4547 0.2648 -0.1341 0.0145 0.0229 182 VAL B CG2 6323 N N . THR D 189 ? 0.5695 0.5125 0.3603 -0.1118 0.0022 0.0312 183 THR B N 6324 C CA . THR D 189 ? 0.6240 0.5328 0.3917 -0.1155 -0.0070 0.0339 183 THR B CA 6325 C C . THR D 189 ? 0.6145 0.5235 0.3733 -0.1349 -0.0085 0.0341 183 THR B C 6326 O O . THR D 189 ? 0.6001 0.5304 0.3679 -0.1435 -0.0032 0.0320 183 THR B O 6327 C CB . THR D 189 ? 0.6620 0.5540 0.4224 -0.1063 -0.0098 0.0342 183 THR B CB 6328 O OG1 . THR D 189 ? 0.6896 0.6032 0.4615 -0.1098 -0.0033 0.0328 183 THR B OG1 6329 C CG2 . THR D 189 ? 0.6907 0.5775 0.4553 -0.0881 -0.0099 0.0328 183 THR B CG2 6330 N N . VAL D 190 ? 0.6797 0.5652 0.4209 -0.1422 -0.0156 0.0358 184 VAL B N 6331 C CA . VAL D 190 ? 0.6478 0.5301 0.3771 -0.1624 -0.0176 0.0356 184 VAL B CA 6332 C C . VAL D 190 ? 0.7193 0.5605 0.4220 -0.1658 -0.0281 0.0381 184 VAL B C 6333 O O . VAL D 190 ? 0.6499 0.4683 0.3457 -0.1520 -0.0341 0.0393 184 VAL B O 6334 C CB . VAL D 190 ? 0.6886 0.5897 0.4245 -0.1720 -0.0148 0.0338 184 VAL B CB 6335 C CG1 . VAL D 190 ? 0.6731 0.6159 0.4346 -0.1704 -0.0053 0.0298 184 VAL B CG1 6336 C CG2 . VAL D 190 ? 0.7133 0.5974 0.4442 -0.1625 -0.0196 0.0357 184 VAL B CG2 6337 N N . PRO D 191 ? 0.8419 0.6735 0.5288 -0.1841 -0.0308 0.0379 185 PRO B N 6338 C CA . PRO D 191 ? 0.8616 0.6524 0.5211 -0.1889 -0.0415 0.0397 185 PRO B CA 6339 C C . PRO D 191 ? 0.8359 0.6128 0.4893 -0.1870 -0.0464 0.0403 185 PRO B C 6340 O O . PRO D 191 ? 0.7813 0.5784 0.4429 -0.1956 -0.0421 0.0392 185 PRO B O 6341 C CB . PRO D 191 ? 0.8544 0.6450 0.5002 -0.2122 -0.0416 0.0384 185 PRO B CB 6342 C CG . PRO D 191 ? 0.8162 0.6432 0.4819 -0.2149 -0.0319 0.0359 185 PRO B CG 6343 C CD . PRO D 191 ? 0.8500 0.7067 0.5424 -0.2009 -0.0247 0.0350 185 PRO B CD 6344 N N . SER D 192 ? 0.9069 0.6508 0.5463 -0.1756 -0.0556 0.0412 186 SER B N 6345 C CA . SER D 192 ? 0.9645 0.6931 0.5972 -0.1730 -0.0611 0.0414 186 SER B CA 6346 C C . SER D 192 ? 0.9758 0.6960 0.5923 -0.1946 -0.0639 0.0414 186 SER B C 6347 O O . SER D 192 ? 0.9714 0.6965 0.5901 -0.1979 -0.0636 0.0413 186 SER B O 6348 C CB . SER D 192 ? 1.0183 0.7115 0.6370 -0.1580 -0.0718 0.0408 186 SER B CB 6349 O OG . SER D 192 ? 1.1101 0.8130 0.7441 -0.1379 -0.0693 0.0396 186 SER B OG 6350 N N . SER D 193 ? 1.0164 0.7240 0.6157 -0.2098 -0.0665 0.0411 187 SER B N 6351 C CA . SER D 193 ? 1.0602 0.7569 0.6396 -0.2322 -0.0700 0.0402 187 SER B CA 6352 C C . SER D 193 ? 1.0461 0.7811 0.6402 -0.2468 -0.0605 0.0380 187 SER B C 6353 O O . SER D 193 ? 1.0344 0.7692 0.6162 -0.2632 -0.0610 0.0371 187 SER B O 6354 C CB . SER D 193 ? 1.0373 0.7124 0.5939 -0.2441 -0.0747 0.0399 187 SER B CB 6355 O OG . SER D 193 ? 1.0218 0.7216 0.5921 -0.2456 -0.0670 0.0392 187 SER B OG 6356 N N . SER D 194 ? 1.0042 0.7752 0.6263 -0.2373 -0.0510 0.0374 188 SER B N 6357 C CA . SER D 194 ? 0.9978 0.8082 0.6364 -0.2486 -0.0423 0.0340 188 SER B CA 6358 C C . SER D 194 ? 0.9701 0.7916 0.6211 -0.2409 -0.0407 0.0344 188 SER B C 6359 O O . SER D 194 ? 0.9652 0.8149 0.6262 -0.2510 -0.0353 0.0311 188 SER B O 6360 C CB . SER D 194 ? 0.9449 0.7898 0.6064 -0.2439 -0.0331 0.0319 188 SER B CB 6361 O OG . SER D 194 ? 0.8340 0.6865 0.5139 -0.2216 -0.0303 0.0339 188 SER B OG 6362 N N . LEU D 195 ? 0.9489 0.7488 0.5986 -0.2227 -0.0456 0.0376 189 LEU B N 6363 C CA . LEU D 195 ? 1.0018 0.8113 0.6634 -0.2123 -0.0442 0.0381 189 LEU B CA 6364 C C . LEU D 195 ? 1.1525 0.9605 0.8048 -0.2275 -0.0463 0.0372 189 LEU B C 6365 O O . LEU D 195 ? 1.1767 1.0071 0.8426 -0.2258 -0.0419 0.0361 189 LEU B O 6366 C CB . LEU D 195 ? 0.8895 0.6727 0.5475 -0.1915 -0.0507 0.0403 189 LEU B CB 6367 C CG . LEU D 195 ? 0.8175 0.6077 0.4886 -0.1739 -0.0476 0.0404 189 LEU B CG 6368 C CD1 . LEU D 195 ? 0.7917 0.5575 0.4583 -0.1548 -0.0544 0.0408 189 LEU B CD1 6369 C CD2 . LEU D 195 ? 0.7220 0.5514 0.4179 -0.1692 -0.0375 0.0390 189 LEU B CD2 6370 N N . GLY D 196 ? 1.2578 1.0390 0.8858 -0.2425 -0.0531 0.0371 190 GLY B N 6371 C CA . GLY D 196 ? 1.3789 1.1558 0.9954 -0.2568 -0.0556 0.0363 190 GLY B CA 6372 C C . GLY D 196 ? 1.4756 1.2817 1.0943 -0.2748 -0.0482 0.0331 190 GLY B C 6373 O O . GLY D 196 ? 1.6047 1.4094 1.2133 -0.2851 -0.0486 0.0328 190 GLY B O 6374 N N . THR D 197 ? 1.3908 1.2238 1.0223 -0.2781 -0.0415 0.0300 191 THR B N 6375 C CA . THR D 197 ? 1.3244 1.1878 0.9587 -0.2937 -0.0342 0.0252 191 THR B CA 6376 C C . THR D 197 ? 1.2635 1.1717 0.9253 -0.2913 -0.0250 0.0198 191 THR B C 6377 O O . THR D 197 ? 1.2754 1.2171 0.9464 -0.2999 -0.0182 0.0140 191 THR B O 6378 C CB . THR D 197 ? 1.2763 1.1230 0.8904 -0.3042 -0.0363 0.0255 191 THR B CB 6379 O OG1 . THR D 197 ? 1.2567 1.0917 0.8728 -0.2948 -0.0384 0.0273 191 THR B OG1 6380 C CG2 . THR D 197 ? 1.2585 1.0663 0.8440 -0.3097 -0.0447 0.0293 191 THR B CG2 6381 N N . GLN D 198 ? 1.2336 1.1427 0.9078 -0.2789 -0.0250 0.0209 192 GLN B N 6382 C CA . GLN D 198 ? 1.1589 1.1087 0.8584 -0.2750 -0.0170 0.0157 192 GLN B CA 6383 C C . GLN D 198 ? 0.9972 0.9662 0.7186 -0.2593 -0.0130 0.0164 192 GLN B C 6384 O O . GLN D 198 ? 0.9648 0.9111 0.6840 -0.2432 -0.0166 0.0223 192 GLN B O 6385 C CB . GLN D 198 ? 1.2473 1.1901 0.9502 -0.2651 -0.0162 0.0182 192 GLN B CB 6386 C CG . GLN D 198 ? 1.3170 1.2993 1.0394 -0.2671 -0.0085 0.0117 192 GLN B CG 6387 C CD . GLN D 198 ? 1.4444 1.4377 1.1555 -0.2858 -0.0068 0.0061 192 GLN B CD 6388 O OE1 . GLN D 198 ? 1.5145 1.4808 1.2019 -0.2960 -0.0111 0.0091 192 GLN B OE1 6389 N NE2 . GLN D 198 ? 1.4545 1.4873 1.1835 -0.2870 0.0005 -0.0015 192 GLN B NE2 6390 N N . THR D 199 ? 0.8256 0.8370 0.5663 -0.2631 -0.0063 0.0090 193 THR B N 6391 C CA . THR D 199 ? 0.7435 0.7758 0.5035 -0.2489 -0.0026 0.0082 193 THR B CA 6392 C C . THR D 199 ? 0.7010 0.7518 0.4814 -0.2314 0.0022 0.0074 193 THR B C 6393 O O . THR D 199 ? 0.6823 0.7568 0.4741 -0.2357 0.0066 0.0020 193 THR B O 6394 C CB . THR D 199 ? 0.7453 0.8152 0.5157 -0.2615 0.0014 -0.0009 193 THR B CB 6395 O OG1 . THR D 199 ? 0.7919 0.8421 0.5461 -0.2702 -0.0021 0.0022 193 THR B OG1 6396 C CG2 . THR D 199 ? 0.7699 0.8695 0.5645 -0.2437 0.0045 -0.0057 193 THR B CG2 6397 N N . TYR D 200 ? 0.6407 0.6800 0.4244 -0.2115 0.0007 0.0118 194 TYR B N 6398 C CA . TYR D 200 ? 0.5963 0.6503 0.3997 -0.1936 0.0046 0.0107 194 TYR B CA 6399 C C . TYR D 200 ? 0.5743 0.6502 0.4027 -0.1770 0.0048 0.0050 194 TYR B C 6400 O O . TYR D 200 ? 0.5155 0.5752 0.3409 -0.1672 0.0004 0.0075 194 TYR B O 6401 C CB . TYR D 200 ? 0.5841 0.6038 0.3760 -0.1807 0.0012 0.0186 194 TYR B CB 6402 C CG . TYR D 200 ? 0.6029 0.6005 0.3806 -0.1903 -0.0015 0.0213 194 TYR B CG 6403 C CD1 . TYR D 200 ? 0.5959 0.6108 0.3820 -0.1957 0.0028 0.0181 194 TYR B CD1 6404 C CD2 . TYR D 200 ? 0.6011 0.5607 0.3563 -0.1937 -0.0092 0.0263 194 TYR B CD2 6405 C CE1 . TYR D 200 ? 0.6859 0.6798 0.4566 -0.2044 -0.0005 0.0202 194 TYR B CE1 6406 C CE2 . TYR D 200 ? 0.6951 0.6332 0.4350 -0.2020 -0.0128 0.0280 194 TYR B CE2 6407 C CZ . TYR D 200 ? 0.7439 0.6990 0.4909 -0.2076 -0.0084 0.0252 194 TYR B CZ 6408 O OH . TYR D 200 ? 0.7442 0.6771 0.4740 -0.2160 -0.0124 0.0267 194 TYR B OH 6409 N N . ILE D 201 ? 0.5534 0.6656 0.4054 -0.1739 0.0095 -0.0030 195 ILE B N 6410 C CA . ILE D 201 ? 0.5275 0.6613 0.4022 -0.1584 0.0089 -0.0095 195 ILE B CA 6411 C C . ILE D 201 ? 0.5655 0.7138 0.4599 -0.1427 0.0121 -0.0119 195 ILE B C 6412 O O . ILE D 201 ? 0.5619 0.7296 0.4636 -0.1490 0.0166 -0.0155 195 ILE B O 6413 C CB . ILE D 201 ? 0.5412 0.7098 0.4271 -0.1697 0.0095 -0.0202 195 ILE B CB 6414 C CG1 . ILE D 201 ? 0.6306 0.7847 0.4975 -0.1846 0.0061 -0.0182 195 ILE B CG1 6415 C CG2 . ILE D 201 ? 0.5379 0.7293 0.4475 -0.1519 0.0076 -0.0279 195 ILE B CG2 6416 C CD1 . ILE D 201 ? 0.6576 0.8466 0.5345 -0.1976 0.0070 -0.0298 195 ILE B CD1 6417 N N . CYS D 202 ? 0.5204 0.6585 0.4221 -0.1232 0.0100 -0.0099 196 CYS B N 6418 C CA . CYS D 202 ? 0.5246 0.6758 0.4444 -0.1083 0.0127 -0.0127 196 CYS B CA 6419 C C . CYS D 202 ? 0.4584 0.6387 0.3978 -0.1006 0.0108 -0.0225 196 CYS B C 6420 O O . CYS D 202 ? 0.4472 0.6257 0.3857 -0.0975 0.0064 -0.0242 196 CYS B O 6421 C CB . CYS D 202 ? 0.4601 0.5833 0.3754 -0.0922 0.0120 -0.0056 196 CYS B CB 6422 S SG . CYS D 202 ? 0.7349 0.8445 0.6494 -0.0785 0.0069 -0.0048 196 CYS B SG 6423 N N . ASN D 203 ? 0.4417 0.6487 0.3986 -0.0972 0.0136 -0.0295 197 ASN B N 6424 C CA . ASN D 203 ? 0.4091 0.6445 0.3853 -0.0881 0.0106 -0.0402 197 ASN B CA 6425 C C . ASN D 203 ? 0.3936 0.6232 0.3794 -0.0683 0.0099 -0.0395 197 ASN B C 6426 O O . ASN D 203 ? 0.3830 0.6147 0.3737 -0.0659 0.0140 -0.0383 197 ASN B O 6427 C CB . ASN D 203 ? 0.4081 0.6821 0.3976 -0.1002 0.0134 -0.0513 197 ASN B CB 6428 C CG . ASN D 203 ? 0.4927 0.7672 0.4679 -0.1237 0.0165 -0.0497 197 ASN B CG 6429 O OD1 . ASN D 203 ? 0.5504 0.8256 0.5200 -0.1351 0.0215 -0.0473 197 ASN B OD1 6430 N ND2 . ASN D 203 ? 0.4829 0.7549 0.4501 -0.1314 0.0132 -0.0509 197 ASN B ND2 6431 N N . VAL D 204 ? 0.4069 0.6277 0.3937 -0.0547 0.0045 -0.0402 198 VAL B N 6432 C CA . VAL D 204 ? 0.4060 0.6153 0.3972 -0.0370 0.0035 -0.0385 198 VAL B CA 6433 C C . VAL D 204 ? 0.3910 0.6236 0.3980 -0.0256 -0.0022 -0.0496 198 VAL B C 6434 O O . VAL D 204 ? 0.4611 0.7015 0.4695 -0.0241 -0.0081 -0.0552 198 VAL B O 6435 C CB . VAL D 204 ? 0.4188 0.5932 0.3945 -0.0295 0.0017 -0.0294 198 VAL B CB 6436 C CG1 . VAL D 204 ? 0.4320 0.5938 0.4100 -0.0134 0.0014 -0.0278 198 VAL B CG1 6437 C CG2 . VAL D 204 ? 0.4114 0.5632 0.3716 -0.0393 0.0059 -0.0200 198 VAL B CG2 6438 N N . ASN D 205 ? 0.3841 0.6276 0.4030 -0.0172 -0.0011 -0.0534 199 ASN B N 6439 C CA . ASN D 205 ? 0.4601 0.7246 0.4939 -0.0048 -0.0077 -0.0649 199 ASN B CA 6440 C C . ASN D 205 ? 0.3942 0.6377 0.4257 0.0125 -0.0103 -0.0616 199 ASN B C 6441 O O . ASN D 205 ? 0.4504 0.6842 0.4813 0.0142 -0.0048 -0.0564 199 ASN B O 6442 C CB . ASN D 205 ? 0.6065 0.9092 0.6585 -0.0110 -0.0055 -0.0759 199 ASN B CB 6443 C CG . ASN D 205 ? 0.7462 1.0769 0.8147 0.0000 -0.0139 -0.0910 199 ASN B CG 6444 O OD1 . ASN D 205 ? 0.8687 1.1919 0.9341 0.0100 -0.0220 -0.0937 199 ASN B OD1 6445 N ND2 . ASN D 205 ? 0.7028 1.0665 0.7887 -0.0015 -0.0125 -0.1018 199 ASN B ND2 6446 N N . HIS D 206 ? 0.4046 0.6398 0.4332 0.0249 -0.0188 -0.0649 200 HIS B N 6447 C CA . HIS D 206 ? 0.4369 0.6501 0.4601 0.0407 -0.0224 -0.0624 200 HIS B CA 6448 C C . HIS D 206 ? 0.4388 0.6690 0.4725 0.0541 -0.0332 -0.0752 200 HIS B C 6449 O O . HIS D 206 ? 0.4754 0.6968 0.5024 0.0617 -0.0417 -0.0777 200 HIS B O 6450 C CB . HIS D 206 ? 0.4004 0.5766 0.4031 0.0435 -0.0230 -0.0520 200 HIS B CB 6451 C CG . HIS D 206 ? 0.3900 0.5398 0.3830 0.0563 -0.0251 -0.0482 200 HIS B CG 6452 N ND1 . HIS D 206 ? 0.3864 0.5188 0.3689 0.0677 -0.0341 -0.0495 200 HIS B ND1 6453 C CD2 . HIS D 206 ? 0.3392 0.4758 0.3300 0.0587 -0.0192 -0.0432 200 HIS B CD2 6454 C CE1 . HIS D 206 ? 0.3806 0.4890 0.3533 0.0755 -0.0335 -0.0451 200 HIS B CE1 6455 N NE2 . HIS D 206 ? 0.4033 0.5148 0.3817 0.0702 -0.0243 -0.0415 200 HIS B NE2 6456 N N . LYS D 207 ? 0.4891 0.7437 0.5392 0.0575 -0.0333 -0.0838 201 LYS B N 6457 C CA . LYS D 207 ? 0.5838 0.8596 0.6467 0.0707 -0.0442 -0.0985 201 LYS B CA 6458 C C . LYS D 207 ? 0.6056 0.8530 0.6556 0.0886 -0.0552 -0.0981 201 LYS B C 6459 O O . LYS D 207 ? 0.5950 0.8525 0.6481 0.0974 -0.0664 -0.1084 201 LYS B O 6460 C CB . LYS D 207 ? 0.5562 0.8572 0.6368 0.0726 -0.0419 -0.1062 201 LYS B CB 6461 C CG . LYS D 207 ? 0.6318 0.9664 0.7258 0.0554 -0.0333 -0.1105 201 LYS B CG 6462 C CD . LYS D 207 ? 0.7188 1.0580 0.8177 0.0553 -0.0291 -0.1153 201 LYS B CD 6463 C CE . LYS D 207 ? 0.7778 1.1365 0.8796 0.0372 -0.0204 -0.1183 201 LYS B CE 6464 N NZ . LYS D 207 ? 0.8113 1.1733 0.9160 0.0375 -0.0180 -0.1229 201 LYS B NZ 6465 N N . PRO D 208 ? 0.5584 0.7703 0.5929 0.0934 -0.0524 -0.0870 202 PRO B N 6466 C CA . PRO D 208 ? 0.5378 0.7196 0.5563 0.1087 -0.0628 -0.0863 202 PRO B CA 6467 C C . PRO D 208 ? 0.5516 0.7206 0.5575 0.1113 -0.0706 -0.0861 202 PRO B C 6468 O O . PRO D 208 ? 0.6045 0.7613 0.6026 0.1255 -0.0831 -0.0914 202 PRO B O 6469 C CB . PRO D 208 ? 0.5084 0.6549 0.5103 0.1066 -0.0545 -0.0724 202 PRO B CB 6470 C CG . PRO D 208 ? 0.4797 0.6451 0.4959 0.0980 -0.0438 -0.0714 202 PRO B CG 6471 C CD . PRO D 208 ? 0.4992 0.6984 0.5304 0.0861 -0.0405 -0.0765 202 PRO B CD 6472 N N . SER D 209 ? 0.4903 0.6605 0.4930 0.0982 -0.0641 -0.0801 203 SER B N 6473 C CA . SER D 209 ? 0.4102 0.5701 0.4018 0.0996 -0.0708 -0.0799 203 SER B CA 6474 C C . SER D 209 ? 0.4243 0.6221 0.4329 0.0942 -0.0741 -0.0916 203 SER B C 6475 O O . SER D 209 ? 0.4064 0.6018 0.4090 0.0937 -0.0792 -0.0929 203 SER B O 6476 C CB . SER D 209 ? 0.4146 0.5467 0.3886 0.0892 -0.0622 -0.0655 203 SER B CB 6477 O OG . SER D 209 ? 0.4903 0.6396 0.4732 0.0734 -0.0517 -0.0624 203 SER B OG 6478 N N . ASN D 210 ? 0.4546 0.6879 0.4841 0.0894 -0.0707 -0.1005 204 ASN B N 6479 C CA . ASN D 210 ? 0.5273 0.8011 0.5743 0.0815 -0.0720 -0.1130 204 ASN B CA 6480 C C . ASN D 210 ? 0.5848 0.8553 0.6243 0.0646 -0.0649 -0.1053 204 ASN B C 6481 O O . ASN D 210 ? 0.6444 0.9274 0.6856 0.0625 -0.0701 -0.1119 204 ASN B O 6482 C CB . ASN D 210 ? 0.6146 0.9022 0.6676 0.0965 -0.0873 -0.1281 204 ASN B CB 6483 C CG . ASN D 210 ? 0.7333 1.0599 0.8074 0.0915 -0.0847 -0.1435 204 ASN B CG 6484 O OD1 . ASN D 210 ? 0.7452 1.0909 0.8302 0.0806 -0.0745 -0.1446 204 ASN B OD1 6485 N ND2 . ASN D 210 ? 0.7851 1.1182 0.8619 0.0988 -0.0917 -0.1546 204 ASN B ND2 6486 N N . THR D 211 ? 0.5898 0.8428 0.6205 0.0532 -0.0535 -0.0919 205 THR B N 6487 C CA . THR D 211 ? 0.6086 0.8515 0.6288 0.0384 -0.0474 -0.0831 205 THR B CA 6488 C C . THR D 211 ? 0.5748 0.8372 0.6022 0.0202 -0.0373 -0.0821 205 THR B C 6489 O O . THR D 211 ? 0.4993 0.7631 0.5310 0.0184 -0.0310 -0.0791 205 THR B O 6490 C CB . THR D 211 ? 0.6056 0.8053 0.6045 0.0406 -0.0440 -0.0677 205 THR B CB 6491 O OG1 . THR D 211 ? 0.6306 0.8096 0.6192 0.0556 -0.0533 -0.0681 205 THR B OG1 6492 C CG2 . THR D 211 ? 0.6482 0.8371 0.6362 0.0266 -0.0390 -0.0597 205 THR B CG2 6493 N N . LYS D 212 ? 0.6110 0.8874 0.6385 0.0065 -0.0361 -0.0846 206 LYS B N 6494 C CA . LYS D 212 ? 0.6158 0.9036 0.6438 -0.0131 -0.0270 -0.0819 206 LYS B CA 6495 C C . LYS D 212 ? 0.5720 0.8387 0.5829 -0.0248 -0.0249 -0.0727 206 LYS B C 6496 O O . LYS D 212 ? 0.5516 0.8226 0.5606 -0.0258 -0.0302 -0.0770 206 LYS B O 6497 C CB . LYS D 212 ? 0.6547 0.9875 0.7009 -0.0221 -0.0271 -0.0972 206 LYS B CB 6498 C CG . LYS D 212 ? 0.6857 1.0428 0.7497 -0.0141 -0.0274 -0.1066 206 LYS B CG 6499 C CD . LYS D 212 ? 0.7821 1.1786 0.8607 -0.0253 -0.0242 -0.1204 206 LYS B CD 6500 C CE . LYS D 212 ? 0.8789 1.2852 0.9676 -0.0178 -0.0206 -0.1264 206 LYS B CE 6501 N NZ . LYS D 212 ? 0.9643 1.3930 1.0568 -0.0289 -0.0136 -0.1364 206 LYS B NZ 6502 N N . VAL D 213 ? 0.5302 0.7740 0.5286 -0.0329 -0.0179 -0.0606 207 VAL B N 6503 C CA . VAL D 213 ? 0.4805 0.7007 0.4613 -0.0427 -0.0166 -0.0515 207 VAL B CA 6504 C C . VAL D 213 ? 0.4636 0.6846 0.4378 -0.0615 -0.0096 -0.0472 207 VAL B C 6505 O O . VAL D 213 ? 0.5041 0.7228 0.4795 -0.0629 -0.0044 -0.0436 207 VAL B O 6506 C CB . VAL D 213 ? 0.4810 0.6631 0.4474 -0.0319 -0.0168 -0.0402 207 VAL B CB 6507 C CG1 . VAL D 213 ? 0.5120 0.6704 0.4607 -0.0415 -0.0159 -0.0318 207 VAL B CG1 6508 C CG2 . VAL D 213 ? 0.5017 0.6782 0.4697 -0.0149 -0.0240 -0.0435 207 VAL B CG2 6509 N N . ASP D 214 ? 0.4966 0.7195 0.4626 -0.0762 -0.0101 -0.0476 208 ASP B N 6510 C CA . ASP D 214 ? 0.5547 0.7698 0.5080 -0.0948 -0.0049 -0.0419 208 ASP B CA 6511 C C . ASP D 214 ? 0.5798 0.7595 0.5122 -0.0976 -0.0067 -0.0316 208 ASP B C 6512 O O . ASP D 214 ? 0.6703 0.8470 0.5988 -0.0974 -0.0113 -0.0331 208 ASP B O 6513 C CB . ASP D 214 ? 0.6427 0.8894 0.6014 -0.1133 -0.0034 -0.0517 208 ASP B CB 6514 C CG . ASP D 214 ? 0.7793 1.0641 0.7594 -0.1118 -0.0013 -0.0635 208 ASP B CG 6515 O OD1 . ASP D 214 ? 0.8319 1.1156 0.8209 -0.0976 -0.0007 -0.0626 208 ASP B OD1 6516 O OD2 . ASP D 214 ? 0.8887 1.2053 0.8766 -0.1254 -0.0002 -0.0743 208 ASP B OD2 6517 N N . LYS D 215 ? 0.5371 0.6905 0.4563 -0.0993 -0.0038 -0.0218 209 LYS B N 6518 C CA . LYS D 215 ? 0.4868 0.6065 0.3864 -0.1006 -0.0062 -0.0130 209 LYS B CA 6519 C C . LYS D 215 ? 0.5414 0.6459 0.4235 -0.1172 -0.0043 -0.0074 209 LYS B C 6520 O O . LYS D 215 ? 0.5208 0.6218 0.4014 -0.1190 -0.0007 -0.0045 209 LYS B O 6521 C CB . LYS D 215 ? 0.4380 0.5341 0.3354 -0.0833 -0.0065 -0.0068 209 LYS B CB 6522 C CG . LYS D 215 ? 0.6239 0.6978 0.5106 -0.0771 -0.0111 -0.0032 209 LYS B CG 6523 C CD . LYS D 215 ? 0.7596 0.8077 0.6261 -0.0871 -0.0125 0.0033 209 LYS B CD 6524 C CE . LYS D 215 ? 0.8002 0.8313 0.6573 -0.0830 -0.0175 0.0051 209 LYS B CE 6525 N NZ . LYS D 215 ? 0.7593 0.7956 0.6095 -0.0974 -0.0207 0.0029 209 LYS B NZ 6526 N N . LYS D 216 ? 0.5436 0.6376 0.4112 -0.1293 -0.0075 -0.0060 210 LYS B N 6527 C CA . LYS D 216 ? 0.5915 0.6654 0.4378 -0.1456 -0.0074 -0.0003 210 LYS B CA 6528 C C . LYS D 216 ? 0.6221 0.6583 0.4529 -0.1365 -0.0102 0.0087 210 LYS B C 6529 O O . LYS D 216 ? 0.6645 0.6861 0.4931 -0.1256 -0.0138 0.0107 210 LYS B O 6530 C CB . LYS D 216 ? 0.7102 0.7857 0.5453 -0.1626 -0.0101 -0.0026 210 LYS B CB 6531 C CG . LYS D 216 ? 0.8764 0.9284 0.6859 -0.1813 -0.0109 0.0032 210 LYS B CG 6532 C CD . LYS D 216 ? 1.0193 1.0727 0.8168 -0.1996 -0.0132 0.0007 210 LYS B CD 6533 C CE . LYS D 216 ? 1.1263 1.1534 0.8950 -0.2196 -0.0144 0.0067 210 LYS B CE 6534 N NZ . LYS D 216 ? 1.2312 1.2574 0.9856 -0.2393 -0.0165 0.0043 210 LYS B NZ 6535 N N . VAL D 217 ? 0.6195 0.6410 0.4395 -0.1410 -0.0088 0.0133 211 VAL B N 6536 C CA . VAL D 217 ? 0.6089 0.5971 0.4155 -0.1315 -0.0119 0.0199 211 VAL B CA 6537 C C . VAL D 217 ? 0.6251 0.5851 0.4047 -0.1457 -0.0167 0.0249 211 VAL B C 6538 O O . VAL D 217 ? 0.6685 0.6257 0.4383 -0.1574 -0.0154 0.0264 211 VAL B O 6539 C CB . VAL D 217 ? 0.5456 0.5359 0.3615 -0.1209 -0.0078 0.0207 211 VAL B CB 6540 C CG1 . VAL D 217 ? 0.5980 0.5568 0.4016 -0.1104 -0.0113 0.0256 211 VAL B CG1 6541 C CG2 . VAL D 217 ? 0.5379 0.5537 0.3784 -0.1076 -0.0038 0.0159 211 VAL B CG2 6542 N N . GLU D 218 ? 0.6408 0.5781 0.4067 -0.1445 -0.0227 0.0274 212 GLU B N 6543 C CA . GLU D 218 ? 0.7972 0.7051 0.5351 -0.1581 -0.0287 0.0317 212 GLU B CA 6544 C C . GLU D 218 ? 0.8135 0.6878 0.5401 -0.1450 -0.0354 0.0352 212 GLU B C 6545 O O . GLU D 218 ? 0.7647 0.6404 0.5018 -0.1285 -0.0350 0.0342 212 GLU B O 6546 C CB . GLU D 218 ? 0.8782 0.7932 0.6102 -0.1734 -0.0304 0.0296 212 GLU B CB 6547 C CG . GLU D 218 ? 0.9951 0.9251 0.7434 -0.1628 -0.0304 0.0258 212 GLU B CG 6548 C CD . GLU D 218 ? 1.1369 1.0851 0.8858 -0.1781 -0.0303 0.0212 212 GLU B CD 6549 O OE1 . GLU D 218 ? 1.1922 1.1392 0.9268 -0.1984 -0.0298 0.0213 212 GLU B OE1 6550 O OE2 . GLU D 218 ? 1.1808 1.1443 0.9436 -0.1704 -0.0306 0.0171 212 GLU B OE2 6551 N N . PRO D 219 ? 0.8688 0.7143 0.5788 -0.1508 -0.0414 0.0373 213 PRO B N 6552 C CA . PRO D 219 ? 0.9699 0.7852 0.6706 -0.1378 -0.0486 0.0384 213 PRO B CA 6553 C C . PRO D 219 ? 1.0252 0.8352 0.7241 -0.1330 -0.0522 0.0378 213 PRO B C 6554 O O . PRO D 219 ? 0.9753 0.7943 0.6723 -0.1445 -0.0519 0.0375 213 PRO B O 6555 C CB . PRO D 219 ? 0.9726 0.7602 0.6539 -0.1487 -0.0551 0.0398 213 PRO B CB 6556 C CG . PRO D 219 ? 0.9455 0.7492 0.6291 -0.1625 -0.0497 0.0398 213 PRO B CG 6557 C CD . PRO D 219 ? 0.9065 0.7461 0.6057 -0.1685 -0.0419 0.0380 213 PRO B CD 6558 N N . LYS D 220 ? 1.1721 0.9690 0.8719 -0.1163 -0.0553 0.0370 214 LYS B N 6559 C CA . LYS D 220 ? 1.3134 1.1039 1.0115 -0.1105 -0.0590 0.0360 214 LYS B CA 6560 C C . LYS D 220 ? 1.3822 1.1402 1.0655 -0.1058 -0.0680 0.0354 214 LYS B C 6561 O O . LYS D 220 ? 1.4305 1.1742 1.1106 -0.0969 -0.0708 0.0341 214 LYS B O 6562 C CB . LYS D 220 ? 1.3607 1.1662 1.0727 -0.0952 -0.0546 0.0341 214 LYS B CB 6563 C CG . LYS D 220 ? 1.4045 1.2431 1.1360 -0.0974 -0.0466 0.0328 214 LYS B CG 6564 C CD . LYS D 220 ? 1.4485 1.2962 1.1782 -0.1090 -0.0480 0.0322 214 LYS B CD 6565 C CE . LYS D 220 ? 1.3917 1.2742 1.1428 -0.1103 -0.0412 0.0288 214 LYS B CE 6566 N NZ . LYS D 220 ? 1.3340 1.2281 1.0848 -0.1212 -0.0428 0.0265 214 LYS B NZ 6567 N N . ASP E 1 ? 0.6399 0.5299 0.6694 0.0456 -0.0414 0.0608 1 ASP C N 6568 C CA . ASP E 1 ? 0.5772 0.4800 0.6044 0.0423 -0.0392 0.0566 1 ASP C CA 6569 C C . ASP E 1 ? 0.5723 0.4947 0.6038 0.0483 -0.0445 0.0586 1 ASP C C 6570 O O . ASP E 1 ? 0.6046 0.5316 0.6345 0.0519 -0.0507 0.0671 1 ASP C O 6571 C CB . ASP E 1 ? 0.4959 0.3939 0.5085 0.0327 -0.0379 0.0619 1 ASP C CB 6572 C CG . ASP E 1 ? 0.5742 0.4548 0.5816 0.0250 -0.0318 0.0579 1 ASP C CG 6573 O OD1 . ASP E 1 ? 0.6160 0.4906 0.6313 0.0267 -0.0273 0.0489 1 ASP C OD1 6574 O OD2 . ASP E 1 ? 0.6102 0.4838 0.6056 0.0170 -0.0315 0.0638 1 ASP C OD2 6575 N N . ILE E 2 ? 0.4717 0.4057 0.5083 0.0488 -0.0420 0.0507 2 ILE C N 6576 C CA . ILE E 2 ? 0.4612 0.4140 0.5014 0.0536 -0.0463 0.0512 2 ILE C CA 6577 C C . ILE E 2 ? 0.4669 0.4260 0.4955 0.0496 -0.0490 0.0595 2 ILE C C 6578 O O . ILE E 2 ? 0.4291 0.3833 0.4495 0.0424 -0.0458 0.0605 2 ILE C O 6579 C CB . ILE E 2 ? 0.5342 0.4966 0.5823 0.0543 -0.0424 0.0403 2 ILE C CB 6580 C CG1 . ILE E 2 ? 0.5451 0.5063 0.6071 0.0603 -0.0413 0.0329 2 ILE C CG1 6581 C CG2 . ILE E 2 ? 0.5238 0.5045 0.5720 0.0566 -0.0458 0.0408 2 ILE C CG2 6582 C CD1 . ILE E 2 ? 0.6156 0.5828 0.6853 0.0597 -0.0363 0.0216 2 ILE C CD1 6583 N N . GLN E 3 ? 0.4094 0.3796 0.4375 0.0540 -0.0551 0.0657 3 GLN C N 6584 C CA . GLN E 3 ? 0.4492 0.4269 0.4671 0.0507 -0.0576 0.0734 3 GLN C CA 6585 C C . GLN E 3 ? 0.3891 0.3863 0.4098 0.0540 -0.0596 0.0705 3 GLN C C 6586 O O . GLN E 3 ? 0.4521 0.4580 0.4802 0.0602 -0.0631 0.0686 3 GLN C O 6587 C CB . GLN E 3 ? 0.5754 0.5480 0.5869 0.0511 -0.0629 0.0848 3 GLN C CB 6588 C CG . GLN E 3 ? 0.8094 0.7903 0.8102 0.0474 -0.0653 0.0931 3 GLN C CG 6589 C CD . GLN E 3 ? 0.9547 0.9274 0.9476 0.0458 -0.0696 0.1047 3 GLN C CD 6590 O OE1 . GLN E 3 ? 1.0571 1.0268 1.0536 0.0505 -0.0740 0.1083 3 GLN C OE1 6591 N NE2 . GLN E 3 ? 0.8984 0.8675 0.8811 0.0390 -0.0684 0.1109 3 GLN C NE2 6592 N N . MET E 4 ? 0.3526 0.3567 0.3681 0.0497 -0.0573 0.0702 4 MET C N 6593 C CA . MET E 4 ? 0.4267 0.4486 0.4435 0.0522 -0.0587 0.0677 4 MET C CA 6594 C C . MET E 4 ? 0.4156 0.4448 0.4236 0.0516 -0.0630 0.0774 4 MET C C 6595 O O . MET E 4 ? 0.5066 0.5294 0.5062 0.0468 -0.0627 0.0848 4 MET C O 6596 C CB . MET E 4 ? 0.5080 0.5340 0.5256 0.0484 -0.0535 0.0612 4 MET C CB 6597 C CG . MET E 4 ? 0.5914 0.6085 0.6153 0.0468 -0.0486 0.0526 4 MET C CG 6598 S SD . MET E 4 ? 0.9140 0.9338 0.9504 0.0537 -0.0496 0.0442 4 MET C SD 6599 C CE . MET E 4 ? 2.7252 2.7650 2.7663 0.0570 -0.0506 0.0380 4 MET C CE 6600 N N . THR E 5 ? 0.2555 0.2989 0.2654 0.0560 -0.0671 0.0774 5 THR C N 6601 C CA . THR E 5 ? 0.3827 0.4353 0.3841 0.0553 -0.0711 0.0859 5 THR C CA 6602 C C . THR E 5 ? 0.3486 0.4192 0.3508 0.0566 -0.0708 0.0805 5 THR C C 6603 O O . THR E 5 ? 0.3887 0.4673 0.3980 0.0609 -0.0723 0.0741 5 THR C O 6604 C CB . THR E 5 ? 0.4646 0.5157 0.4653 0.0588 -0.0779 0.0935 5 THR C CB 6605 O OG1 . THR E 5 ? 0.4999 0.5331 0.4997 0.0574 -0.0778 0.0984 5 THR C OG1 6606 C CG2 . THR E 5 ? 0.4138 0.4756 0.4049 0.0574 -0.0820 0.1023 5 THR C CG2 6607 N N . GLN E 6 ? 0.3038 0.3809 0.2993 0.0528 -0.0687 0.0829 6 GLN C N 6608 C CA . GLN E 6 ? 0.3894 0.4829 0.3855 0.0536 -0.0674 0.0773 6 GLN C CA 6609 C C . GLN E 6 ? 0.4069 0.5127 0.3954 0.0539 -0.0719 0.0838 6 GLN C C 6610 O O . GLN E 6 ? 0.3692 0.4709 0.3502 0.0518 -0.0746 0.0939 6 GLN C O 6611 C CB . GLN E 6 ? 0.3300 0.4241 0.3256 0.0496 -0.0614 0.0742 6 GLN C CB 6612 C CG . GLN E 6 ? 0.3773 0.4616 0.3803 0.0487 -0.0569 0.0669 6 GLN C CG 6613 C CD . GLN E 6 ? 0.3656 0.4503 0.3685 0.0446 -0.0518 0.0653 6 GLN C CD 6614 O OE1 . GLN E 6 ? 0.3800 0.4531 0.3824 0.0408 -0.0493 0.0674 6 GLN C OE1 6615 N NE2 . GLN E 6 ? 0.3803 0.4785 0.3839 0.0453 -0.0501 0.0615 6 GLN C NE2 6616 N N . SER E 7 ? 0.4251 0.5459 0.4150 0.0560 -0.0725 0.0779 7 SER C N 6617 C CA . SER E 7 ? 0.5034 0.6379 0.4853 0.0554 -0.0761 0.0829 7 SER C CA 6618 C C . SER E 7 ? 0.5379 0.6878 0.5206 0.0554 -0.0728 0.0739 7 SER C C 6619 O O . SER E 7 ? 0.5610 0.7129 0.5518 0.0577 -0.0709 0.0639 7 SER C O 6620 C CB . SER E 7 ? 0.4700 0.6062 0.4516 0.0587 -0.0837 0.0878 7 SER C CB 6621 O OG . SER E 7 ? 0.5304 0.6667 0.5223 0.0629 -0.0846 0.0798 7 SER C OG 6622 N N . PRO E 8 ? 0.5321 0.6926 0.5065 0.0525 -0.0718 0.0770 8 PRO C N 6623 C CA . PRO E 8 ? 0.5613 0.7203 0.5261 0.0491 -0.0734 0.0885 8 PRO C CA 6624 C C . PRO E 8 ? 0.5936 0.7408 0.5592 0.0461 -0.0687 0.0914 8 PRO C C 6625 O O . PRO E 8 ? 0.6229 0.7641 0.5962 0.0466 -0.0644 0.0843 8 PRO C O 6626 C CB . PRO E 8 ? 0.4971 0.6735 0.4549 0.0470 -0.0720 0.0874 8 PRO C CB 6627 C CG . PRO E 8 ? 0.4604 0.6471 0.4236 0.0496 -0.0709 0.0755 8 PRO C CG 6628 C CD . PRO E 8 ? 0.4762 0.6517 0.4505 0.0522 -0.0684 0.0684 8 PRO C CD 6629 N N . SER E 9 ? 0.5327 0.6769 0.4904 0.0425 -0.0698 0.1019 9 SER C N 6630 C CA . SER E 9 ? 0.5633 0.6983 0.5210 0.0388 -0.0657 0.1051 9 SER C CA 6631 C C . SER E 9 ? 0.5232 0.6701 0.4805 0.0366 -0.0601 0.1021 9 SER C C 6632 O O . SER E 9 ? 0.4679 0.6104 0.4300 0.0348 -0.0553 0.0999 9 SER C O 6633 C CB . SER E 9 ? 0.6229 0.7487 0.5729 0.0356 -0.0693 0.1178 9 SER C CB 6634 O OG . SER E 9 ? 0.7136 0.8253 0.6661 0.0377 -0.0731 0.1197 9 SER C OG 6635 N N . PHE E 10 ? 0.5200 0.6822 0.4718 0.0365 -0.0608 0.1020 10 PHE C N 6636 C CA . PHE E 10 ? 0.5143 0.6894 0.4659 0.0347 -0.0552 0.0984 10 PHE C CA 6637 C C . PHE E 10 ? 0.5444 0.7341 0.4965 0.0371 -0.0545 0.0890 10 PHE C C 6638 O O . PHE E 10 ? 0.5742 0.7702 0.5205 0.0379 -0.0595 0.0908 10 PHE C O 6639 C CB . PHE E 10 ? 0.5702 0.7505 0.5123 0.0303 -0.0556 0.1089 10 PHE C CB 6640 C CG . PHE E 10 ? 0.7458 0.9128 0.6870 0.0271 -0.0560 0.1181 10 PHE C CG 6641 C CD1 . PHE E 10 ? 0.7569 0.9224 0.7029 0.0247 -0.0506 0.1177 10 PHE C CD1 6642 C CD2 . PHE E 10 ? 0.8421 0.9942 0.7793 0.0255 -0.0604 0.1242 10 PHE C CD2 6643 C CE1 . PHE E 10 ? 0.7978 0.9511 0.7427 0.0209 -0.0510 0.1259 10 PHE C CE1 6644 C CE2 . PHE E 10 ? 0.8549 0.9910 0.7922 0.0215 -0.0592 0.1288 10 PHE C CE2 6645 C CZ . PHE E 10 ? 0.8541 0.9908 0.7949 0.0189 -0.0545 0.1294 10 PHE C CZ 6646 N N . VAL E 11 ? 0.5220 0.7170 0.4812 0.0381 -0.0484 0.0791 11 VAL C N 6647 C CA . VAL E 11 ? 0.4821 0.6910 0.4417 0.0397 -0.0468 0.0692 11 VAL C CA 6648 C C . VAL E 11 ? 0.4817 0.7018 0.4419 0.0379 -0.0398 0.0653 11 VAL C C 6649 O O . VAL E 11 ? 0.4283 0.6437 0.3958 0.0375 -0.0349 0.0641 11 VAL C O 6650 C CB . VAL E 11 ? 0.4860 0.6906 0.4554 0.0433 -0.0461 0.0583 11 VAL C CB 6651 C CG1 . VAL E 11 ? 0.4789 0.6977 0.4472 0.0445 -0.0456 0.0487 11 VAL C CG1 6652 C CG2 . VAL E 11 ? 0.5346 0.7270 0.5058 0.0453 -0.0519 0.0618 11 VAL C CG2 6653 N N . SER E 12 ? 0.5015 0.7366 0.4543 0.0367 -0.0394 0.0633 12 SER C N 6654 C CA . SER E 12 ? 0.5202 0.7674 0.4741 0.0353 -0.0321 0.0576 12 SER C CA 6655 C C . SER E 12 ? 0.5713 0.8296 0.5257 0.0367 -0.0302 0.0451 12 SER C C 6656 O O . SER E 12 ? 0.5937 0.8611 0.5389 0.0356 -0.0341 0.0453 12 SER C O 6657 C CB . SER E 12 ? 0.5359 0.7922 0.4793 0.0312 -0.0320 0.0667 12 SER C CB 6658 O OG . SER E 12 ? 0.6652 0.9332 0.6108 0.0300 -0.0241 0.0610 12 SER C OG 6659 N N . ALA E 13 ? 0.5910 0.8484 0.5560 0.0388 -0.0243 0.0344 13 ALA C N 6660 C CA . ALA E 13 ? 0.6098 0.8763 0.5761 0.0400 -0.0222 0.0217 13 ALA C CA 6661 C C . ALA E 13 ? 0.5717 0.8439 0.5458 0.0403 -0.0130 0.0119 13 ALA C C 6662 O O . ALA E 13 ? 0.5734 0.8395 0.5559 0.0409 -0.0088 0.0140 13 ALA C O 6663 C CB . ALA E 13 ? 0.5623 0.8200 0.5349 0.0430 -0.0260 0.0164 13 ALA C CB 6664 N N . SER E 14 ? 0.5707 0.8546 0.5423 0.0399 -0.0101 0.0013 14 SER C N 6665 C CA . SER E 14 ? 0.5886 0.8791 0.5670 0.0403 -0.0011 -0.0090 14 SER C CA 6666 C C . SER E 14 ? 0.5595 0.8421 0.5510 0.0434 0.0017 -0.0197 14 SER C C 6667 O O . SER E 14 ? 0.5748 0.8508 0.5676 0.0448 -0.0033 -0.0216 14 SER C O 6668 C CB . SER E 14 ? 0.6109 0.9180 0.5792 0.0375 0.0013 -0.0158 14 SER C CB 6669 O OG . SER E 14 ? 0.7021 1.0171 0.6576 0.0339 -0.0014 -0.0058 14 SER C OG 6670 N N . VAL E 15 ? 0.5187 0.8023 0.5203 0.0445 0.0097 -0.0264 15 VAL C N 6671 C CA . VAL E 15 ? 0.5178 0.7943 0.5321 0.0471 0.0130 -0.0369 15 VAL C CA 6672 C C . VAL E 15 ? 0.5324 0.8144 0.5429 0.0469 0.0117 -0.0482 15 VAL C C 6673 O O . VAL E 15 ? 0.5887 0.8837 0.5906 0.0448 0.0135 -0.0536 15 VAL C O 6674 C CB . VAL E 15 ? 0.3642 0.6431 0.3899 0.0483 0.0222 -0.0426 15 VAL C CB 6675 C CG1 . VAL E 15 ? 0.2890 0.5608 0.3273 0.0507 0.0254 -0.0538 15 VAL C CG1 6676 C CG2 . VAL E 15 ? 0.3570 0.6301 0.3882 0.0484 0.0230 -0.0311 15 VAL C CG2 6677 N N . GLY E 16 ? 0.5669 0.8395 0.5835 0.0486 0.0084 -0.0517 16 GLY C N 6678 C CA . GLY E 16 ? 0.6263 0.9034 0.6402 0.0482 0.0064 -0.0619 16 GLY C CA 6679 C C . GLY E 16 ? 0.6842 0.9622 0.6888 0.0475 -0.0028 -0.0558 16 GLY C C 6680 O O . GLY E 16 ? 0.7242 1.0023 0.7295 0.0477 -0.0061 -0.0621 16 GLY C O 6681 N N . ASP E 17 ? 0.6806 0.9591 0.6770 0.0465 -0.0069 -0.0433 17 ASP C N 6682 C CA . ASP E 17 ? 0.6359 0.9148 0.6243 0.0461 -0.0158 -0.0361 17 ASP C CA 6683 C C . ASP E 17 ? 0.6460 0.9117 0.6427 0.0487 -0.0201 -0.0347 17 ASP C C 6684 O O . ASP E 17 ? 0.6538 0.9083 0.6604 0.0503 -0.0169 -0.0347 17 ASP C O 6685 C CB . ASP E 17 ? 0.6318 0.9119 0.6109 0.0446 -0.0191 -0.0223 17 ASP C CB 6686 C CG . ASP E 17 ? 0.7483 1.0438 0.7156 0.0411 -0.0173 -0.0225 17 ASP C CG 6687 O OD1 . ASP E 17 ? 0.8723 1.1765 0.8402 0.0400 -0.0112 -0.0336 17 ASP C OD1 6688 O OD2 . ASP E 17 ? 0.7051 1.0039 0.6624 0.0391 -0.0218 -0.0117 17 ASP C OD2 6689 N N . ARG E 18 ? 0.6977 0.9653 0.6905 0.0490 -0.0272 -0.0335 18 ARG C N 6690 C CA . ARG E 18 ? 0.6285 0.8846 0.6285 0.0515 -0.0316 -0.0311 18 ARG C CA 6691 C C . ARG E 18 ? 0.5510 0.7999 0.5469 0.0519 -0.0365 -0.0172 18 ARG C C 6692 O O . ARG E 18 ? 0.5986 0.8543 0.5844 0.0506 -0.0411 -0.0100 18 ARG C O 6693 C CB . ARG E 18 ? 0.7065 0.9684 0.7064 0.0519 -0.0366 -0.0372 18 ARG C CB 6694 C CG . ARG E 18 ? 0.8202 1.0713 0.8282 0.0545 -0.0409 -0.0353 18 ARG C CG 6695 C CD . ARG E 18 ? 0.9322 1.1903 0.9419 0.0549 -0.0454 -0.0420 18 ARG C CD 6696 N NE . ARG E 18 ? 1.0383 1.2863 1.0573 0.0575 -0.0483 -0.0413 18 ARG C NE 6697 C CZ . ARG E 18 ? 1.0971 1.3489 1.1212 0.0584 -0.0518 -0.0473 18 ARG C CZ 6698 N NH1 . ARG E 18 ? 1.1825 1.4477 1.2027 0.0566 -0.0532 -0.0543 18 ARG C NH1 6699 N NH2 . ARG E 18 ? 1.0121 1.2546 1.0452 0.0607 -0.0536 -0.0465 18 ARG C NH2 6700 N N . VAL E 19 ? 0.5281 0.7629 0.5312 0.0532 -0.0356 -0.0133 19 VAL C N 6701 C CA . VAL E 19 ? 0.5004 0.7265 0.5002 0.0532 -0.0395 -0.0007 19 VAL C CA 6702 C C . VAL E 19 ? 0.4536 0.6684 0.4597 0.0555 -0.0436 0.0004 19 VAL C C 6703 O O . VAL E 19 ? 0.4483 0.6566 0.4637 0.0564 -0.0407 -0.0066 19 VAL C O 6704 C CB . VAL E 19 ? 0.4820 0.7010 0.4834 0.0519 -0.0346 0.0046 19 VAL C CB 6705 C CG1 . VAL E 19 ? 0.4564 0.6655 0.4539 0.0513 -0.0387 0.0173 19 VAL C CG1 6706 C CG2 . VAL E 19 ? 0.4650 0.6957 0.4611 0.0499 -0.0302 0.0036 19 VAL C CG2 6707 N N . THR E 20 ? 0.4835 0.6964 0.4849 0.0562 -0.0501 0.0090 20 THR C N 6708 C CA . THR E 20 ? 0.4724 0.6743 0.4800 0.0585 -0.0537 0.0108 20 THR C CA 6709 C C . THR E 20 ? 0.4493 0.6402 0.4532 0.0581 -0.0563 0.0229 20 THR C C 6710 O O . THR E 20 ? 0.5000 0.6951 0.4952 0.0571 -0.0599 0.0315 20 THR C O 6711 C CB . THR E 20 ? 0.5110 0.7205 0.5194 0.0607 -0.0598 0.0082 20 THR C CB 6712 O OG1 . THR E 20 ? 0.6579 0.8782 0.6559 0.0596 -0.0644 0.0144 20 THR C OG1 6713 C CG2 . THR E 20 ? 0.5037 0.7207 0.5179 0.0610 -0.0572 -0.0047 20 THR C CG2 6714 N N . ILE E 21 ? 0.4219 0.5988 0.4322 0.0584 -0.0545 0.0234 21 ILE C N 6715 C CA . ILE E 21 ? 0.4006 0.5650 0.4083 0.0578 -0.0565 0.0337 21 ILE C CA 6716 C C . ILE E 21 ? 0.4373 0.5930 0.4514 0.0605 -0.0598 0.0329 21 ILE C C 6717 O O . ILE E 21 ? 0.4732 0.6278 0.4956 0.0619 -0.0579 0.0241 21 ILE C O 6718 C CB . ILE E 21 ? 0.3895 0.5440 0.3986 0.0549 -0.0511 0.0355 21 ILE C CB 6719 C CG1 . ILE E 21 ? 0.4280 0.5916 0.4330 0.0526 -0.0472 0.0355 21 ILE C CG1 6720 C CG2 . ILE E 21 ? 0.4140 0.5554 0.4193 0.0534 -0.0533 0.0459 21 ILE C CG2 6721 C CD1 . ILE E 21 ? 0.4123 0.5676 0.4206 0.0499 -0.0421 0.0369 21 ILE C CD1 6722 N N . THR E 22 ? 0.4114 0.5607 0.4221 0.0613 -0.0645 0.0420 22 THR C N 6723 C CA . THR E 22 ? 0.4675 0.6086 0.4854 0.0643 -0.0673 0.0412 22 THR C CA 6724 C C . THR E 22 ? 0.4412 0.5651 0.4589 0.0630 -0.0662 0.0472 22 THR C C 6725 O O . THR E 22 ? 0.4505 0.5697 0.4606 0.0600 -0.0659 0.0553 22 THR C O 6726 C CB . THR E 22 ? 0.5375 0.6857 0.5543 0.0676 -0.0748 0.0455 22 THR C CB 6727 O OG1 . THR E 22 ? 0.6265 0.7680 0.6365 0.0669 -0.0785 0.0573 22 THR C OG1 6728 C CG2 . THR E 22 ? 0.5239 0.6899 0.5365 0.0673 -0.0765 0.0423 22 THR C CG2 6729 N N . CYS E 23 ? 0.4589 0.5739 0.4850 0.0648 -0.0654 0.0428 23 CYS C N 6730 C CA . CYS E 23 ? 0.4151 0.5134 0.4416 0.0633 -0.0639 0.0467 23 CYS C CA 6731 C C . CYS E 23 ? 0.4360 0.5294 0.4695 0.0676 -0.0674 0.0466 23 CYS C C 6732 O O . CYS E 23 ? 0.4812 0.5795 0.5237 0.0705 -0.0673 0.0385 23 CYS C O 6733 C CB . CYS E 23 ? 0.4130 0.5040 0.4433 0.0601 -0.0573 0.0401 23 CYS C CB 6734 S SG . CYS E 23 ? 0.6112 0.6818 0.6400 0.0565 -0.0546 0.0444 23 CYS C SG 6735 N N . ARG E 24 ? 0.3948 0.4788 0.4249 0.0679 -0.0706 0.0554 24 ARG C N 6736 C CA . ARG E 24 ? 0.3396 0.4178 0.3775 0.0724 -0.0739 0.0559 24 ARG C CA 6737 C C . ARG E 24 ? 0.3741 0.4338 0.4136 0.0705 -0.0702 0.0563 24 ARG C C 6738 O O . ARG E 24 ? 0.4980 0.5483 0.5293 0.0662 -0.0686 0.0623 24 ARG C O 6739 C CB . ARG E 24 ? 0.4106 0.4928 0.4447 0.0750 -0.0814 0.0658 24 ARG C CB 6740 C CG . ARG E 24 ? 0.7115 0.7901 0.7559 0.0806 -0.0855 0.0662 24 ARG C CG 6741 C CD . ARG E 24 ? 0.9633 1.0413 1.0036 0.0824 -0.0929 0.0780 24 ARG C CD 6742 N NE . ARG E 24 ? 1.1277 1.2214 1.1713 0.0862 -0.0996 0.0791 24 ARG C NE 6743 C CZ . ARG E 24 ? 1.2288 1.3237 1.2719 0.0888 -0.1071 0.0887 24 ARG C CZ 6744 N NH1 . ARG E 24 ? 1.2268 1.3076 1.2667 0.0883 -0.1087 0.0978 24 ARG C NH1 6745 N NH2 . ARG E 24 ? 1.2332 1.3434 1.2791 0.0916 -0.1134 0.0895 24 ARG C NH2 6746 N N . ALA E 25 ? 0.3574 0.4124 0.4076 0.0734 -0.0685 0.0495 25 ALA C N 6747 C CA . ALA E 25 ? 0.3723 0.4099 0.4248 0.0719 -0.0648 0.0487 25 ALA C CA 6748 C C . ALA E 25 ? 0.4404 0.4715 0.4987 0.0768 -0.0690 0.0532 25 ALA C C 6749 O O . ALA E 25 ? 0.4324 0.4727 0.4997 0.0825 -0.0731 0.0515 25 ALA C O 6750 C CB . ALA E 25 ? 0.2981 0.3341 0.3585 0.0709 -0.0588 0.0374 25 ALA C CB 6751 N N . SER E 26 ? 0.3870 0.4023 0.4408 0.0746 -0.0683 0.0590 26 SER C N 6752 C CA . SER E 26 ? 0.4345 0.4414 0.4936 0.0792 -0.0722 0.0642 26 SER C CA 6753 C C . SER E 26 ? 0.4648 0.4695 0.5392 0.0842 -0.0702 0.0556 26 SER C C 6754 O O . SER E 26 ? 0.4925 0.4953 0.5753 0.0898 -0.0744 0.0587 26 SER C O 6755 C CB . SER E 26 ? 0.4490 0.4379 0.4997 0.0748 -0.0708 0.0709 26 SER C CB 6756 O OG . SER E 26 ? 0.4672 0.4452 0.5161 0.0695 -0.0633 0.0645 26 SER C OG 6757 N N . GLN E 27 ? 0.4615 0.4665 0.5398 0.0819 -0.0638 0.0452 27 GLN C N 6758 C CA . GLN E 27 ? 0.4086 0.4150 0.5017 0.0862 -0.0612 0.0358 27 GLN C CA 6759 C C . GLN E 27 ? 0.4079 0.4270 0.5035 0.0846 -0.0581 0.0266 27 GLN C C 6760 O O . GLN E 27 ? 0.4872 0.5107 0.5733 0.0799 -0.0569 0.0271 27 GLN C O 6761 C CB . GLN E 27 ? 0.4968 0.4853 0.5927 0.0840 -0.0547 0.0315 27 GLN C CB 6762 C CG . GLN E 27 ? 0.7645 0.7376 0.8573 0.0846 -0.0566 0.0396 27 GLN C CG 6763 C CD . GLN E 27 ? 1.0001 0.9556 1.0950 0.0816 -0.0494 0.0339 27 GLN C CD 6764 O OE1 . GLN E 27 ? 1.0658 1.0219 1.1681 0.0811 -0.0436 0.0236 27 GLN C OE1 6765 N NE2 . GLN E 27 ? 1.0763 1.0159 1.1642 0.0792 -0.0494 0.0404 27 GLN C NE2 6766 N N . GLY E 28 ? 0.3710 0.3957 0.4802 0.0885 -0.0567 0.0182 28 GLY C N 6767 C CA . GLY E 28 ? 0.3768 0.4128 0.4894 0.0870 -0.0538 0.0090 28 GLY C CA 6768 C C . GLY E 28 ? 0.3885 0.4158 0.4956 0.0798 -0.0460 0.0033 28 GLY C C 6769 O O . GLY E 28 ? 0.4441 0.4574 0.5519 0.0775 -0.0412 0.0012 28 GLY C O 6770 N N . ILE E 29 ? 0.3515 0.3869 0.4530 0.0761 -0.0448 0.0008 29 ILE C N 6771 C CA . ILE E 29 ? 0.3500 0.3786 0.4468 0.0691 -0.0381 -0.0041 29 ILE C CA 6772 C C . ILE E 29 ? 0.4050 0.4453 0.5077 0.0684 -0.0360 -0.0132 29 ILE C C 6773 O O . ILE E 29 ? 0.3652 0.4036 0.4632 0.0628 -0.0320 -0.0161 29 ILE C O 6774 C CB . ILE E 29 ? 0.3446 0.3685 0.4273 0.0636 -0.0381 0.0033 29 ILE C CB 6775 C CG1 . ILE E 29 ? 0.3985 0.4368 0.4773 0.0651 -0.0426 0.0065 29 ILE C CG1 6776 C CG2 . ILE E 29 ? 0.3108 0.3217 0.3869 0.0629 -0.0397 0.0120 29 ILE C CG2 6777 C CD1 . ILE E 29 ? 0.4239 0.4595 0.4907 0.0598 -0.0418 0.0127 29 ILE C CD1 6778 N N . SER E 30 ? 0.4071 0.4591 0.5204 0.0741 -0.0390 -0.0173 30 SER C N 6779 C CA . SER E 30 ? 0.4167 0.4811 0.5366 0.0741 -0.0379 -0.0259 30 SER C CA 6780 C C . SER E 30 ? 0.4197 0.4896 0.5309 0.0699 -0.0375 -0.0256 30 SER C C 6781 O O . SER E 30 ? 0.4779 0.5556 0.5836 0.0716 -0.0421 -0.0203 30 SER C O 6782 C CB . SER E 30 ? 0.4534 0.5125 0.5812 0.0716 -0.0315 -0.0352 30 SER C CB 6783 O OG . SER E 30 ? 0.6247 0.6698 0.7446 0.0649 -0.0261 -0.0346 30 SER C OG 6784 N N . SER E 31 ? 0.3322 0.3982 0.4425 0.0644 -0.0320 -0.0312 31 SER C N 6785 C CA . SER E 31 ? 0.3367 0.4073 0.4406 0.0608 -0.0312 -0.0312 31 SER C CA 6786 C C . SER E 31 ? 0.4040 0.4622 0.4990 0.0543 -0.0274 -0.0273 31 SER C C 6787 O O . SER E 31 ? 0.4088 0.4689 0.5006 0.0506 -0.0255 -0.0283 31 SER C O 6788 C CB . SER E 31 ? 0.3485 0.4280 0.4598 0.0599 -0.0291 -0.0410 31 SER C CB 6789 O OG . SER E 31 ? 0.4786 0.5718 0.5963 0.0652 -0.0335 -0.0438 31 SER C OG 6790 N N . TYR E 32 ? 0.3417 0.3872 0.4330 0.0529 -0.0263 -0.0227 32 TYR C N 6791 C CA . TYR E 32 ? 0.3092 0.3429 0.3915 0.0461 -0.0232 -0.0183 32 TYR C CA 6792 C C . TYR E 32 ? 0.3325 0.3678 0.4054 0.0458 -0.0265 -0.0091 32 TYR C C 6793 O O . TYR E 32 ? 0.3126 0.3393 0.3788 0.0446 -0.0276 -0.0016 32 TYR C O 6794 C CB . TYR E 32 ? 0.2763 0.2957 0.3574 0.0440 -0.0206 -0.0174 32 TYR C CB 6795 C CG . TYR E 32 ? 0.3352 0.3517 0.4242 0.0422 -0.0157 -0.0268 32 TYR C CG 6796 C CD1 . TYR E 32 ? 0.3586 0.3807 0.4586 0.0480 -0.0162 -0.0326 32 TYR C CD1 6797 C CD2 . TYR E 32 ? 0.3295 0.3383 0.4150 0.0345 -0.0106 -0.0297 32 TYR C CD2 6798 C CE1 . TYR E 32 ? 0.3675 0.3878 0.4751 0.0462 -0.0113 -0.0415 32 TYR C CE1 6799 C CE2 . TYR E 32 ? 0.4168 0.4234 0.5088 0.0322 -0.0058 -0.0383 32 TYR C CE2 6800 C CZ . TYR E 32 ? 0.4554 0.4679 0.5586 0.0382 -0.0060 -0.0445 32 TYR C CZ 6801 O OH . TYR E 32 ? 0.5584 0.5695 0.6686 0.0357 -0.0008 -0.0533 32 TYR C OH 6802 N N . LEU E 33 ? 0.3272 0.3738 0.4000 0.0466 -0.0277 -0.0100 33 LEU C N 6803 C CA . LEU E 33 ? 0.2922 0.3427 0.3572 0.0467 -0.0305 -0.0021 33 LEU C CA 6804 C C . LEU E 33 ? 0.2965 0.3526 0.3606 0.0437 -0.0285 -0.0038 33 LEU C C 6805 O O . LEU E 33 ? 0.2924 0.3553 0.3629 0.0443 -0.0269 -0.0116 33 LEU C O 6806 C CB . LEU E 33 ? 0.3255 0.3871 0.3913 0.0529 -0.0358 -0.0001 33 LEU C CB 6807 C CG . LEU E 33 ? 0.4476 0.5127 0.5043 0.0526 -0.0386 0.0088 33 LEU C CG 6808 C CD1 . LEU E 33 ? 0.3699 0.4259 0.4210 0.0529 -0.0413 0.0177 33 LEU C CD1 6809 C CD2 . LEU E 33 ? 0.4768 0.5578 0.5343 0.0566 -0.0420 0.0074 33 LEU C CD2 6810 N N . ALA E 34 ? 0.2243 0.2775 0.2810 0.0405 -0.0284 0.0037 34 ALA C N 6811 C CA . ALA E 34 ? 0.2393 0.2983 0.2957 0.0385 -0.0268 0.0035 34 ALA C CA 6812 C C . ALA E 34 ? 0.2373 0.3027 0.2872 0.0397 -0.0294 0.0112 34 ALA C C 6813 O O . ALA E 34 ? 0.2476 0.3093 0.2915 0.0402 -0.0321 0.0185 34 ALA C O 6814 C CB . ALA E 34 ? 0.2872 0.3362 0.3428 0.0318 -0.0232 0.0046 34 ALA C CB 6815 N N . TRP E 35 ? 0.1898 0.2645 0.2412 0.0400 -0.0283 0.0093 35 TRP C N 6816 C CA . TRP E 35 ? 0.2377 0.3191 0.2834 0.0405 -0.0296 0.0159 35 TRP C CA 6817 C C . TRP E 35 ? 0.2948 0.3736 0.3406 0.0361 -0.0265 0.0191 35 TRP C C 6818 O O . TRP E 35 ? 0.3117 0.3892 0.3637 0.0343 -0.0235 0.0138 35 TRP C O 6819 C CB . TRP E 35 ? 0.2851 0.3813 0.3325 0.0448 -0.0307 0.0110 35 TRP C CB 6820 C CG . TRP E 35 ? 0.3339 0.4345 0.3801 0.0490 -0.0350 0.0105 35 TRP C CG 6821 C CD1 . TRP E 35 ? 0.3551 0.4571 0.4074 0.0516 -0.0359 0.0033 35 TRP C CD1 6822 C CD2 . TRP E 35 ? 0.3166 0.4213 0.3557 0.0508 -0.0391 0.0179 35 TRP C CD2 6823 N NE1 . TRP E 35 ? 0.3152 0.4220 0.3652 0.0553 -0.0407 0.0061 35 TRP C NE1 6824 C CE2 . TRP E 35 ? 0.3537 0.4620 0.3953 0.0548 -0.0429 0.0152 35 TRP C CE2 6825 C CE3 . TRP E 35 ? 0.2516 0.3576 0.2827 0.0493 -0.0402 0.0270 35 TRP C CE3 6826 C CZ2 . TRP E 35 ? 0.3495 0.4620 0.3858 0.0572 -0.0479 0.0216 35 TRP C CZ2 6827 C CZ3 . TRP E 35 ? 0.3489 0.4591 0.3741 0.0514 -0.0450 0.0330 35 TRP C CZ3 6828 C CH2 . TRP E 35 ? 0.3461 0.4592 0.3738 0.0553 -0.0489 0.0305 35 TRP C CH2 6829 N N . TYR E 36 ? 0.2412 0.3193 0.2806 0.0342 -0.0274 0.0283 36 TYR C N 6830 C CA . TYR E 36 ? 0.2518 0.3289 0.2920 0.0303 -0.0250 0.0325 36 TYR C CA 6831 C C . TYR E 36 ? 0.3272 0.4154 0.3647 0.0319 -0.0253 0.0368 36 TYR C C 6832 O O . TYR E 36 ? 0.3524 0.4457 0.3841 0.0343 -0.0280 0.0400 36 TYR C O 6833 C CB . TYR E 36 ? 0.2560 0.3201 0.2916 0.0247 -0.0253 0.0402 36 TYR C CB 6834 C CG . TYR E 36 ? 0.3133 0.3663 0.3508 0.0223 -0.0244 0.0359 36 TYR C CG 6835 C CD1 . TYR E 36 ? 0.2554 0.3031 0.2903 0.0241 -0.0261 0.0344 36 TYR C CD1 6836 C CD2 . TYR E 36 ? 0.2791 0.3270 0.3213 0.0181 -0.0216 0.0332 36 TYR C CD2 6837 C CE1 . TYR E 36 ? 0.2755 0.3135 0.3125 0.0219 -0.0246 0.0298 36 TYR C CE1 6838 C CE2 . TYR E 36 ? 0.2689 0.3072 0.3122 0.0153 -0.0204 0.0290 36 TYR C CE2 6839 C CZ . TYR E 36 ? 0.3284 0.3620 0.3691 0.0172 -0.0215 0.0269 36 TYR C CZ 6840 O OH . TYR E 36 ? 0.3140 0.3384 0.3561 0.0143 -0.0196 0.0221 36 TYR C OH 6841 N N . GLN E 37 ? 0.3268 0.4189 0.3691 0.0305 -0.0224 0.0369 37 GLN C N 6842 C CA . GLN E 37 ? 0.3106 0.4131 0.3516 0.0313 -0.0216 0.0409 37 GLN C CA 6843 C C . GLN E 37 ? 0.3728 0.4702 0.4127 0.0265 -0.0210 0.0505 37 GLN C C 6844 O O . GLN E 37 ? 0.3962 0.4870 0.4415 0.0233 -0.0194 0.0506 37 GLN C O 6845 C CB . GLN E 37 ? 0.2904 0.4029 0.3394 0.0342 -0.0181 0.0324 37 GLN C CB 6846 C CG . GLN E 37 ? 0.3033 0.4270 0.3525 0.0351 -0.0161 0.0352 37 GLN C CG 6847 C CD . GLN E 37 ? 0.3847 0.5150 0.4440 0.0370 -0.0117 0.0273 37 GLN C CD 6848 O OE1 . GLN E 37 ? 0.3474 0.4726 0.4145 0.0349 -0.0096 0.0279 37 GLN C OE1 6849 N NE2 . GLN E 37 ? 0.3345 0.4758 0.3938 0.0406 -0.0104 0.0198 37 GLN C NE2 6850 N N . GLN E 38 ? 0.3325 0.4330 0.3654 0.0255 -0.0227 0.0589 38 GLN C N 6851 C CA . GLN E 38 ? 0.2987 0.3952 0.3305 0.0205 -0.0225 0.0685 38 GLN C CA 6852 C C . GLN E 38 ? 0.2668 0.3754 0.2991 0.0211 -0.0210 0.0730 38 GLN C C 6853 O O . GLN E 38 ? 0.3329 0.4478 0.3581 0.0223 -0.0226 0.0765 38 GLN C O 6854 C CB . GLN E 38 ? 0.2255 0.3107 0.2478 0.0167 -0.0260 0.0764 38 GLN C CB 6855 C CG . GLN E 38 ? 0.2742 0.3531 0.2956 0.0103 -0.0260 0.0856 38 GLN C CG 6856 C CD . GLN E 38 ? 0.3407 0.4079 0.3521 0.0059 -0.0291 0.0930 38 GLN C CD 6857 O OE1 . GLN E 38 ? 0.3446 0.4118 0.3491 0.0079 -0.0315 0.0948 38 GLN C OE1 6858 N NE2 . GLN E 38 ? 0.2743 0.3313 0.2851 -0.0004 -0.0292 0.0974 38 GLN C NE2 6859 N N . LYS E 39 ? 0.3906 0.5027 0.4319 0.0202 -0.0180 0.0729 39 LYS C N 6860 C CA . LYS E 39 ? 0.4142 0.5373 0.4578 0.0202 -0.0159 0.0779 39 LYS C CA 6861 C C . LYS E 39 ? 0.4130 0.5311 0.4504 0.0147 -0.0184 0.0902 39 LYS C C 6862 O O . LYS E 39 ? 0.4597 0.5655 0.4948 0.0104 -0.0206 0.0941 39 LYS C O 6863 C CB . LYS E 39 ? 0.3687 0.4963 0.4256 0.0213 -0.0119 0.0740 39 LYS C CB 6864 C CG . LYS E 39 ? 0.3936 0.5261 0.4569 0.0263 -0.0091 0.0616 39 LYS C CG 6865 C CD . LYS E 39 ? 0.4692 0.6155 0.5295 0.0302 -0.0072 0.0575 39 LYS C CD 6866 C CE . LYS E 39 ? 0.4844 0.6366 0.5523 0.0346 -0.0037 0.0450 39 LYS C CE 6867 N NZ . LYS E 39 ? 0.4764 0.6429 0.5412 0.0376 -0.0013 0.0410 39 LYS C NZ 6868 N N . PRO E 40 ? 0.4360 0.5639 0.4704 0.0144 -0.0180 0.0962 40 PRO C N 6869 C CA . PRO E 40 ? 0.4457 0.5697 0.4743 0.0088 -0.0203 0.1082 40 PRO C CA 6870 C C . PRO E 40 ? 0.4239 0.5419 0.4598 0.0042 -0.0201 0.1131 40 PRO C C 6871 O O . PRO E 40 ? 0.4107 0.5349 0.4584 0.0057 -0.0169 0.1104 40 PRO C O 6872 C CB . PRO E 40 ? 0.4373 0.5763 0.4652 0.0099 -0.0185 0.1117 40 PRO C CB 6873 C CG . PRO E 40 ? 0.4325 0.5800 0.4590 0.0156 -0.0170 0.1023 40 PRO C CG 6874 C CD . PRO E 40 ? 0.4251 0.5680 0.4597 0.0187 -0.0154 0.0920 40 PRO C CD 6875 N N . GLY E 41 ? 0.3976 0.5033 0.4266 -0.0017 -0.0234 0.1201 41 GLY C N 6876 C CA . GLY E 41 ? 0.4072 0.5067 0.4412 -0.0074 -0.0240 0.1259 41 GLY C CA 6877 C C . GLY E 41 ? 0.5072 0.5994 0.5483 -0.0073 -0.0231 0.1192 41 GLY C C 6878 O O . GLY E 41 ? 0.5449 0.6326 0.5910 -0.0121 -0.0237 0.1238 41 GLY C O 6879 N N . LYS E 42 ? 0.4648 0.5560 0.5065 -0.0023 -0.0219 0.1089 42 LYS C N 6880 C CA . LYS E 42 ? 0.4108 0.4954 0.4592 -0.0022 -0.0209 0.1019 42 LYS C CA 6881 C C . LYS E 42 ? 0.3679 0.4399 0.4079 -0.0038 -0.0227 0.0982 42 LYS C C 6882 O O . LYS E 42 ? 0.3265 0.3955 0.3567 -0.0037 -0.0247 0.1001 42 LYS C O 6883 C CB . LYS E 42 ? 0.4059 0.5002 0.4640 0.0046 -0.0174 0.0918 42 LYS C CB 6884 C CG . LYS E 42 ? 0.4465 0.5541 0.5136 0.0071 -0.0146 0.0939 42 LYS C CG 6885 C CD . LYS E 42 ? 0.5132 0.6190 0.5902 0.0031 -0.0145 0.1000 42 LYS C CD 6886 C CE . LYS E 42 ? 0.6110 0.7304 0.6984 0.0059 -0.0114 0.1024 42 LYS C CE 6887 N NZ . LYS E 42 ? 0.6871 0.8052 0.7861 0.0024 -0.0117 0.1088 42 LYS C NZ 6888 N N . ALA E 43 ? 0.3788 0.4435 0.4233 -0.0053 -0.0220 0.0930 43 ALA C N 6889 C CA . ALA E 43 ? 0.3366 0.3908 0.3751 -0.0059 -0.0228 0.0875 43 ALA C CA 6890 C C . ALA E 43 ? 0.3026 0.3629 0.3432 0.0015 -0.0216 0.0774 43 ALA C C 6891 O O . ALA E 43 ? 0.2802 0.3510 0.3284 0.0062 -0.0195 0.0728 43 ALA C O 6892 C CB . ALA E 43 ? 0.2714 0.3163 0.3135 -0.0110 -0.0223 0.0858 43 ALA C CB 6893 N N . PRO E 44 ? 0.3445 0.3985 0.3785 0.0026 -0.0228 0.0738 44 PRO C N 6894 C CA . PRO E 44 ? 0.3520 0.4120 0.3887 0.0092 -0.0221 0.0641 44 PRO C CA 6895 C C . PRO E 44 ? 0.3504 0.4111 0.3967 0.0103 -0.0196 0.0553 44 PRO C C 6896 O O . PRO E 44 ? 0.3372 0.3898 0.3859 0.0054 -0.0189 0.0561 44 PRO C O 6897 C CB . PRO E 44 ? 0.3495 0.4005 0.3788 0.0091 -0.0242 0.0632 44 PRO C CB 6898 C CG . PRO E 44 ? 0.3494 0.3925 0.3704 0.0036 -0.0260 0.0734 44 PRO C CG 6899 C CD . PRO E 44 ? 0.2709 0.3128 0.2954 -0.0018 -0.0249 0.0783 44 PRO C CD 6900 N N . LYS E 45 ? 0.3620 0.4321 0.4132 0.0161 -0.0184 0.0472 45 LYS C N 6901 C CA . LYS E 45 ? 0.2956 0.3661 0.3555 0.0173 -0.0161 0.0381 45 LYS C CA 6902 C C . LYS E 45 ? 0.2393 0.3113 0.2986 0.0214 -0.0166 0.0293 45 LYS C C 6903 O O . LYS E 45 ? 0.2444 0.3243 0.3004 0.0258 -0.0179 0.0279 45 LYS C O 6904 C CB . LYS E 45 ? 0.3157 0.3962 0.3842 0.0200 -0.0135 0.0354 45 LYS C CB 6905 C CG . LYS E 45 ? 0.6331 0.7120 0.7062 0.0160 -0.0127 0.0431 45 LYS C CG 6906 C CD . LYS E 45 ? 0.6748 0.7609 0.7597 0.0187 -0.0096 0.0382 45 LYS C CD 6907 C CE . LYS E 45 ? 0.6755 0.7603 0.7667 0.0150 -0.0091 0.0465 45 LYS C CE 6908 N NZ . LYS E 45 ? 0.7257 0.8146 0.8302 0.0173 -0.0061 0.0415 45 LYS C NZ 6909 N N . LEU E 46 ? 0.2652 0.3301 0.3276 0.0196 -0.0157 0.0237 46 LEU C N 6910 C CA . LEU E 46 ? 0.2445 0.3111 0.3082 0.0231 -0.0160 0.0149 46 LEU C CA 6911 C C . LEU E 46 ? 0.2829 0.3618 0.3518 0.0284 -0.0151 0.0075 46 LEU C C 6912 O O . LEU E 46 ? 0.2267 0.3094 0.3023 0.0284 -0.0128 0.0047 46 LEU C O 6913 C CB . LEU E 46 ? 0.2631 0.3208 0.3306 0.0195 -0.0145 0.0100 46 LEU C CB 6914 C CG . LEU E 46 ? 0.2731 0.3329 0.3434 0.0228 -0.0145 0.0005 46 LEU C CG 6915 C CD1 . LEU E 46 ? 0.1666 0.2261 0.2308 0.0257 -0.0172 0.0026 46 LEU C CD1 6916 C CD2 . LEU E 46 ? 0.3356 0.3867 0.4094 0.0182 -0.0125 -0.0038 46 LEU C CD2 6917 N N . VAL E 47 ? 0.3130 0.3982 0.3789 0.0327 -0.0172 0.0044 47 VAL C N 6918 C CA . VAL E 47 ? 0.3448 0.4420 0.4143 0.0371 -0.0167 -0.0033 47 VAL C CA 6919 C C . VAL E 47 ? 0.4439 0.5411 0.5170 0.0388 -0.0173 -0.0121 47 VAL C C 6920 O O . VAL E 47 ? 0.5689 0.6678 0.6490 0.0388 -0.0151 -0.0200 47 VAL C O 6921 C CB . VAL E 47 ? 0.4391 0.5457 0.5019 0.0404 -0.0190 0.0004 47 VAL C CB 6922 C CG1 . VAL E 47 ? 0.4503 0.5695 0.5158 0.0441 -0.0185 -0.0081 47 VAL C CG1 6923 C CG2 . VAL E 47 ? 0.5075 0.6148 0.5671 0.0385 -0.0182 0.0091 47 VAL C CG2 6924 N N . ILE E 48 ? 0.5483 0.6435 0.6172 0.0403 -0.0203 -0.0102 48 ILE C N 6925 C CA . ILE E 48 ? 0.5501 0.6463 0.6229 0.0423 -0.0213 -0.0177 48 ILE C CA 6926 C C . ILE E 48 ? 0.4841 0.5689 0.5556 0.0403 -0.0218 -0.0149 48 ILE C C 6927 O O . ILE E 48 ? 0.3443 0.4227 0.4095 0.0390 -0.0231 -0.0067 48 ILE C O 6928 C CB . ILE E 48 ? 0.5398 0.6476 0.6104 0.0472 -0.0248 -0.0193 48 ILE C CB 6929 C CG1 . ILE E 48 ? 0.5702 0.6897 0.6417 0.0487 -0.0236 -0.0237 48 ILE C CG1 6930 C CG2 . ILE E 48 ? 0.5442 0.6536 0.6197 0.0495 -0.0264 -0.0259 48 ILE C CG2 6931 C CD1 . ILE E 48 ? 0.5807 0.7122 0.6504 0.0525 -0.0269 -0.0270 48 ILE C CD1 6932 N N . TYR E 49 ? 0.5735 0.6555 0.6509 0.0397 -0.0205 -0.0221 49 TYR C N 6933 C CA . TYR E 49 ? 0.5285 0.6009 0.6057 0.0384 -0.0205 -0.0215 49 TYR C CA 6934 C C . TYR E 49 ? 0.5159 0.5939 0.5999 0.0419 -0.0213 -0.0297 49 TYR C C 6935 O O . TYR E 49 ? 0.4059 0.4944 0.4941 0.0444 -0.0218 -0.0357 49 TYR C O 6936 C CB . TYR E 49 ? 0.4773 0.5382 0.5547 0.0320 -0.0169 -0.0210 49 TYR C CB 6937 C CG . TYR E 49 ? 0.4480 0.5111 0.5325 0.0299 -0.0141 -0.0283 49 TYR C CG 6938 C CD1 . TYR E 49 ? 0.4263 0.4930 0.5121 0.0288 -0.0131 -0.0276 49 TYR C CD1 6939 C CD2 . TYR E 49 ? 0.4102 0.4715 0.5004 0.0288 -0.0123 -0.0360 49 TYR C CD2 6940 C CE1 . TYR E 49 ? 0.4390 0.5066 0.5316 0.0269 -0.0106 -0.0341 49 TYR C CE1 6941 C CE2 . TYR E 49 ? 0.5006 0.5634 0.5970 0.0264 -0.0099 -0.0425 49 TYR C CE2 6942 C CZ . TYR E 49 ? 0.5953 0.6608 0.6928 0.0254 -0.0092 -0.0414 49 TYR C CZ 6943 O OH . TYR E 49 ? 0.7654 0.8315 0.8695 0.0230 -0.0069 -0.0476 49 TYR C OH 6944 N N . ALA E 50 ? 0.7420 0.8133 0.8274 0.0419 -0.0212 -0.0302 50 ALA C N 6945 C CA . ALA E 50 ? 0.8334 0.9105 0.9260 0.0458 -0.0225 -0.0368 50 ALA C CA 6946 C C . ALA E 50 ? 0.8867 0.9762 0.9788 0.0515 -0.0273 -0.0356 50 ALA C C 6947 O O . ALA E 50 ? 0.9336 1.0327 1.0320 0.0546 -0.0288 -0.0420 50 ALA C O 6948 C CB . ALA E 50 ? 0.8348 0.9150 0.9352 0.0439 -0.0195 -0.0464 50 ALA C CB 6949 N N . ALA E 51 ? 0.7945 0.8840 0.8786 0.0523 -0.0297 -0.0273 51 ALA C N 6950 C CA . ALA E 51 ? 0.6884 0.7889 0.7695 0.0566 -0.0343 -0.0242 51 ALA C CA 6951 C C . ALA E 51 ? 0.6885 0.8018 0.7705 0.0572 -0.0342 -0.0296 51 ALA C C 6952 O O . ALA E 51 ? 0.5249 0.6460 0.6013 0.0587 -0.0368 -0.0257 51 ALA C O 6953 C CB . ALA E 51 ? 0.6145 0.7184 0.7002 0.0612 -0.0382 -0.0250 51 ALA C CB 6954 N N . SER E 52 ? 0.8311 0.9462 0.9197 0.0556 -0.0312 -0.0384 52 SER C N 6955 C CA . SER E 52 ? 0.8492 0.9765 0.9397 0.0566 -0.0312 -0.0449 52 SER C CA 6956 C C . SER E 52 ? 0.8869 1.0125 0.9801 0.0531 -0.0265 -0.0503 52 SER C C 6957 O O . SER E 52 ? 0.8268 0.9613 0.9201 0.0536 -0.0261 -0.0545 52 SER C O 6958 C CB . SER E 52 ? 0.7789 0.9147 0.8764 0.0593 -0.0337 -0.0521 52 SER C CB 6959 O OG . SER E 52 ? 0.7786 0.9084 0.8838 0.0574 -0.0307 -0.0580 52 SER C OG 6960 N N . THR E 53 ? 0.9603 1.0747 1.0561 0.0494 -0.0231 -0.0502 53 THR C N 6961 C CA . THR E 53 ? 0.9677 1.0799 1.0673 0.0460 -0.0190 -0.0547 53 THR C CA 6962 C C . THR E 53 ? 0.9131 1.0194 1.0082 0.0434 -0.0172 -0.0475 53 THR C C 6963 O O . THR E 53 ? 0.8725 0.9698 0.9635 0.0413 -0.0172 -0.0400 53 THR C O 6964 C CB . THR E 53 ? 0.7951 0.8998 0.9012 0.0426 -0.0164 -0.0599 53 THR C CB 6965 O OG1 . THR E 53 ? 0.6930 0.7919 0.8012 0.0383 -0.0128 -0.0607 53 THR C OG1 6966 C CG2 . THR E 53 ? 0.8457 0.9407 0.9495 0.0413 -0.0166 -0.0550 53 THR C CG2 6967 N N . LEU E 54 ? 0.8845 0.9962 0.9811 0.0435 -0.0154 -0.0501 54 LEU C N 6968 C CA . LEU E 54 ? 0.7693 0.8777 0.8637 0.0417 -0.0135 -0.0437 54 LEU C CA 6969 C C . LEU E 54 ? 0.6185 0.7146 0.7153 0.0367 -0.0112 -0.0406 54 LEU C C 6970 O O . LEU E 54 ? 0.5892 0.6819 0.6853 0.0346 -0.0099 -0.0347 54 LEU C O 6971 C CB . LEU E 54 ? 0.7627 0.8795 0.8603 0.0431 -0.0114 -0.0489 54 LEU C CB 6972 C CG . LEU E 54 ? 0.7627 0.8928 0.8576 0.0470 -0.0132 -0.0535 54 LEU C CG 6973 C CD1 . LEU E 54 ? 0.8583 0.9950 0.9566 0.0475 -0.0100 -0.0592 54 LEU C CD1 6974 C CD2 . LEU E 54 ? 0.6984 0.8320 0.7844 0.0489 -0.0165 -0.0452 54 LEU C CD2 6975 N N . ARG E 61 ? 0.6031 0.7852 0.6869 0.0539 -0.0070 -0.0732 61 ARG C N 6976 C CA . ARG E 61 ? 0.6671 0.8571 0.7418 0.0546 -0.0079 -0.0670 61 ARG C CA 6977 C C . ARG E 61 ? 0.7263 0.9125 0.7945 0.0549 -0.0131 -0.0560 61 ARG C C 6978 O O . ARG E 61 ? 0.7363 0.9303 0.7958 0.0555 -0.0166 -0.0520 61 ARG C O 6979 C CB . ARG E 61 ? 0.7056 0.8948 0.7829 0.0543 -0.0027 -0.0645 61 ARG C CB 6980 C CG . ARG E 61 ? 0.8026 1.0011 0.8708 0.0546 -0.0028 -0.0588 61 ARG C CG 6981 C CD . ARG E 61 ? 0.8949 1.0967 0.9676 0.0547 0.0037 -0.0609 61 ARG C CD 6982 N NE . ARG E 61 ? 0.9449 1.1364 1.0253 0.0542 0.0058 -0.0544 61 ARG C NE 6983 C CZ . ARG E 61 ? 0.9325 1.1222 1.0097 0.0535 0.0050 -0.0434 61 ARG C CZ 6984 N NH1 . ARG E 61 ? 0.8898 1.0867 0.9562 0.0533 0.0024 -0.0375 61 ARG C NH1 6985 N NH2 . ARG E 61 ? 0.9130 1.0937 0.9978 0.0526 0.0067 -0.0378 61 ARG C NH2 6986 N N . PHE E 62 ? 0.7425 0.9164 0.8148 0.0540 -0.0136 -0.0511 62 PHE C N 6987 C CA . PHE E 62 ? 0.7512 0.9194 0.8187 0.0541 -0.0182 -0.0424 62 PHE C CA 6988 C C . PHE E 62 ? 0.7788 0.9459 0.8496 0.0550 -0.0213 -0.0474 62 PHE C C 6989 O O . PHE E 62 ? 0.7944 0.9610 0.8723 0.0545 -0.0193 -0.0563 62 PHE C O 6990 C CB . PHE E 62 ? 0.7224 0.8780 0.7920 0.0521 -0.0168 -0.0344 62 PHE C CB 6991 C CG . PHE E 62 ? 0.7477 0.9046 0.8137 0.0512 -0.0149 -0.0270 62 PHE C CG 6992 C CD1 . PHE E 62 ? 0.8156 0.9766 0.8864 0.0511 -0.0101 -0.0308 62 PHE C CD1 6993 C CD2 . PHE E 62 ? 0.7313 0.8852 0.7900 0.0505 -0.0177 -0.0163 62 PHE C CD2 6994 C CE1 . PHE E 62 ? 0.8141 0.9771 0.8829 0.0504 -0.0081 -0.0240 62 PHE C CE1 6995 C CE2 . PHE E 62 ? 0.7519 0.9076 0.8077 0.0494 -0.0159 -0.0092 62 PHE C CE2 6996 C CZ . PHE E 62 ? 0.7508 0.9116 0.8120 0.0494 -0.0111 -0.0131 62 PHE C CZ 6997 N N . SER E 63 ? 0.7686 0.9353 0.8348 0.0562 -0.0262 -0.0418 63 SER C N 6998 C CA . SER E 63 ? 0.7582 0.9239 0.8285 0.0574 -0.0292 -0.0456 63 SER C CA 6999 C C . SER E 63 ? 0.7374 0.8982 0.8039 0.0587 -0.0337 -0.0368 63 SER C C 7000 O O . SER E 63 ? 0.6455 0.8076 0.7045 0.0590 -0.0358 -0.0285 63 SER C O 7001 C CB . SER E 63 ? 0.7387 0.9177 0.8092 0.0588 -0.0313 -0.0537 63 SER C CB 7002 O OG . SER E 63 ? 0.7711 0.9600 0.8329 0.0598 -0.0346 -0.0492 63 SER C OG 7003 N N . GLY E 64 ? 0.8514 1.0064 0.9236 0.0593 -0.0350 -0.0388 64 GLY C N 7004 C CA . GLY E 64 ? 0.8864 1.0357 0.9567 0.0608 -0.0387 -0.0315 64 GLY C CA 7005 C C . GLY E 64 ? 0.8376 0.9914 0.9137 0.0636 -0.0424 -0.0356 64 GLY C C 7006 O O . GLY E 64 ? 0.9071 1.0658 0.9897 0.0635 -0.0413 -0.0447 64 GLY C O 7007 N N . SER E 65 ? 0.5783 0.7304 0.6524 0.0660 -0.0469 -0.0287 65 SER C N 7008 C CA . SER E 65 ? 0.5320 0.6884 0.6128 0.0692 -0.0509 -0.0313 65 SER C CA 7009 C C . SER E 65 ? 0.4186 0.5689 0.4979 0.0717 -0.0550 -0.0221 65 SER C C 7010 O O . SER E 65 ? 0.3999 0.5449 0.4712 0.0709 -0.0556 -0.0135 65 SER C O 7011 C CB . SER E 65 ? 0.5253 0.6980 0.6056 0.0707 -0.0547 -0.0354 65 SER C CB 7012 O OG . SER E 65 ? 0.5199 0.6988 0.5903 0.0709 -0.0580 -0.0282 65 SER C OG 7013 N N . GLY E 66 ? 0.5267 0.6778 0.6143 0.0748 -0.0577 -0.0241 66 GLY C N 7014 C CA . GLY E 66 ? 0.5541 0.6992 0.6424 0.0778 -0.0616 -0.0162 66 GLY C CA 7015 C C . GLY E 66 ? 0.5618 0.6955 0.6589 0.0783 -0.0584 -0.0192 66 GLY C C 7016 O O . GLY E 66 ? 0.5799 0.7094 0.6809 0.0756 -0.0530 -0.0264 66 GLY C O 7017 N N . SER E 67 ? 0.5699 0.6985 0.6703 0.0817 -0.0617 -0.0136 67 SER C N 7018 C CA . SER E 67 ? 0.5056 0.6240 0.6151 0.0827 -0.0587 -0.0168 67 SER C CA 7019 C C . SER E 67 ? 0.4491 0.5581 0.5585 0.0856 -0.0617 -0.0083 67 SER C C 7020 O O . SER E 67 ? 0.4974 0.6115 0.6035 0.0885 -0.0679 -0.0007 67 SER C O 7021 C CB . SER E 67 ? 0.5384 0.6667 0.6608 0.0855 -0.0595 -0.0253 67 SER C CB 7022 O OG . SER E 67 ? 0.6452 0.7641 0.7764 0.0854 -0.0549 -0.0303 67 SER C OG 7023 N N . GLY E 68 ? 0.4026 0.4975 0.5152 0.0845 -0.0571 -0.0095 68 GLY C N 7024 C CA . GLY E 68 ? 0.2240 0.3084 0.3382 0.0874 -0.0591 -0.0029 68 GLY C CA 7025 C C . GLY E 68 ? 0.3240 0.4006 0.4253 0.0852 -0.0609 0.0076 68 GLY C C 7026 O O . GLY E 68 ? 0.3768 0.4408 0.4715 0.0806 -0.0564 0.0089 68 GLY C O 7027 N N . THR E 69 ? 0.3548 0.4394 0.4523 0.0879 -0.0677 0.0152 69 THR C N 7028 C CA . THR E 69 ? 0.4436 0.5215 0.5295 0.0861 -0.0700 0.0258 69 THR C CA 7029 C C . THR E 69 ? 0.4569 0.5460 0.5322 0.0835 -0.0721 0.0291 69 THR C C 7030 O O . THR E 69 ? 0.4488 0.5335 0.5135 0.0808 -0.0731 0.0373 69 THR C O 7031 C CB . THR E 69 ? 0.4995 0.5748 0.5887 0.0910 -0.0765 0.0343 69 THR C CB 7032 O OG1 . THR E 69 ? 0.4604 0.5521 0.5536 0.0949 -0.0831 0.0353 69 THR C OG1 7033 C CG2 . THR E 69 ? 0.5379 0.6016 0.6387 0.0940 -0.0740 0.0308 69 THR C CG2 7034 N N . GLU E 70 ? 0.3943 0.4978 0.4724 0.0840 -0.0724 0.0224 70 GLU C N 7035 C CA . GLU E 70 ? 0.3716 0.4871 0.4404 0.0821 -0.0744 0.0247 70 GLU C CA 7036 C C . GLU E 70 ? 0.3588 0.4797 0.4273 0.0788 -0.0690 0.0156 70 GLU C C 7037 O O . GLU E 70 ? 0.3839 0.5096 0.4611 0.0798 -0.0673 0.0065 70 GLU C O 7038 C CB . GLU E 70 ? 0.2936 0.4236 0.3645 0.0859 -0.0819 0.0270 70 GLU C CB 7039 C CG . GLU E 70 ? 0.3256 0.4692 0.3864 0.0836 -0.0841 0.0290 70 GLU C CG 7040 C CD . GLU E 70 ? 0.5745 0.7135 0.6229 0.0811 -0.0855 0.0397 70 GLU C CD 7041 O OE1 . GLU E 70 ? 0.6373 0.7630 0.6851 0.0814 -0.0860 0.0466 70 GLU C OE1 7042 O OE2 . GLU E 70 ? 0.6894 0.8384 0.7288 0.0785 -0.0858 0.0411 70 GLU C OE2 7043 N N . PHE E 71 ? 0.3203 0.4402 0.3793 0.0747 -0.0663 0.0183 71 PHE C N 7044 C CA . PHE E 71 ? 0.3644 0.4877 0.4233 0.0716 -0.0609 0.0106 71 PHE C CA 7045 C C . PHE E 71 ? 0.4137 0.5468 0.4637 0.0696 -0.0612 0.0131 71 PHE C C 7046 O O . PHE E 71 ? 0.4386 0.5710 0.4801 0.0688 -0.0636 0.0222 71 PHE C O 7047 C CB . PHE E 71 ? 0.2869 0.3960 0.3462 0.0679 -0.0550 0.0096 71 PHE C CB 7048 C CG . PHE E 71 ? 0.3254 0.4246 0.3930 0.0690 -0.0535 0.0061 71 PHE C CG 7049 C CD1 . PHE E 71 ? 0.2377 0.3389 0.3141 0.0690 -0.0503 -0.0040 71 PHE C CD1 7050 C CD2 . PHE E 71 ? 0.3622 0.4500 0.4288 0.0699 -0.0550 0.0125 71 PHE C CD2 7051 C CE1 . PHE E 71 ? 0.3100 0.4029 0.3943 0.0698 -0.0484 -0.0076 71 PHE C CE1 7052 C CE2 . PHE E 71 ? 0.3642 0.4431 0.4390 0.0709 -0.0530 0.0085 71 PHE C CE2 7053 C CZ . PHE E 71 ? 0.2964 0.3782 0.3800 0.0709 -0.0495 -0.0016 71 PHE C CZ 7054 N N . THR E 72 ? 0.3462 0.4879 0.3981 0.0685 -0.0582 0.0048 72 THR C N 7055 C CA . THR E 72 ? 0.3554 0.5077 0.4001 0.0669 -0.0578 0.0052 72 THR C CA 7056 C C . THR E 72 ? 0.3738 0.5246 0.4201 0.0639 -0.0512 -0.0010 72 THR C C 7057 O O . THR E 72 ? 0.4132 0.5627 0.4672 0.0638 -0.0483 -0.0095 72 THR C O 7058 C CB . THR E 72 ? 0.4303 0.5985 0.4752 0.0690 -0.0618 0.0010 72 THR C CB 7059 O OG1 . THR E 72 ? 0.5401 0.7100 0.5837 0.0717 -0.0686 0.0081 72 THR C OG1 7060 C CG2 . THR E 72 ? 0.4314 0.6106 0.4683 0.0668 -0.0606 0.0005 72 THR C CG2 7061 N N . LEU E 73 ? 0.3695 0.5202 0.4090 0.0615 -0.0490 0.0039 73 LEU C N 7062 C CA . LEU E 73 ? 0.2993 0.4512 0.3406 0.0591 -0.0433 -0.0012 73 LEU C CA 7063 C C . LEU E 73 ? 0.3646 0.5313 0.4013 0.0593 -0.0434 -0.0038 73 LEU C C 7064 O O . LEU E 73 ? 0.3641 0.5364 0.3926 0.0592 -0.0462 0.0031 73 LEU C O 7065 C CB . LEU E 73 ? 0.3120 0.4537 0.3504 0.0560 -0.0404 0.0060 73 LEU C CB 7066 C CG . LEU E 73 ? 0.3534 0.4969 0.3933 0.0536 -0.0351 0.0035 73 LEU C CG 7067 C CD1 . LEU E 73 ? 0.2975 0.4357 0.3465 0.0528 -0.0313 -0.0048 73 LEU C CD1 7068 C CD2 . LEU E 73 ? 0.3748 0.5115 0.4098 0.0508 -0.0340 0.0134 73 LEU C CD2 7069 N N . THR E 74 ? 0.4205 0.5935 0.4621 0.0592 -0.0402 -0.0140 74 THR C N 7070 C CA . THR E 74 ? 0.4010 0.5880 0.4382 0.0590 -0.0396 -0.0180 74 THR C CA 7071 C C . THR E 74 ? 0.3621 0.5498 0.4023 0.0574 -0.0330 -0.0232 74 THR C C 7072 O O . THR E 74 ? 0.4016 0.5826 0.4501 0.0569 -0.0295 -0.0289 74 THR C O 7073 C CB . THR E 74 ? 0.4440 0.6407 0.4837 0.0606 -0.0425 -0.0263 74 THR C CB 7074 O OG1 . THR E 74 ? 0.4527 0.6500 0.4904 0.0625 -0.0491 -0.0206 74 THR C OG1 7075 C CG2 . THR E 74 ? 0.4345 0.6456 0.4686 0.0595 -0.0415 -0.0313 74 THR C CG2 7076 N N . ILE E 75 ? 0.3780 0.5738 0.4120 0.0564 -0.0312 -0.0210 75 ILE C N 7077 C CA . ILE E 75 ? 0.3726 0.5717 0.4102 0.0554 -0.0248 -0.0270 75 ILE C CA 7078 C C . ILE E 75 ? 0.4892 0.7026 0.5233 0.0554 -0.0242 -0.0355 75 ILE C C 7079 O O . ILE E 75 ? 0.5467 0.7698 0.5715 0.0548 -0.0264 -0.0318 75 ILE C O 7080 C CB . ILE E 75 ? 0.4056 0.6034 0.4398 0.0539 -0.0221 -0.0188 75 ILE C CB 7081 C CG1 . ILE E 75 ? 0.4104 0.5946 0.4455 0.0531 -0.0238 -0.0092 75 ILE C CG1 7082 C CG2 . ILE E 75 ? 0.4022 0.6020 0.4431 0.0535 -0.0152 -0.0252 75 ILE C CG2 7083 C CD1 . ILE E 75 ? 0.4471 0.6298 0.4797 0.0512 -0.0213 -0.0008 75 ILE C CD1 7084 N N . SER E 76 ? 0.6018 0.8166 0.6429 0.0557 -0.0214 -0.0467 76 SER C N 7085 C CA . SER E 76 ? 0.6669 0.8946 0.7047 0.0552 -0.0211 -0.0559 76 SER C CA 7086 C C . SER E 76 ? 0.7074 0.9443 0.7401 0.0539 -0.0164 -0.0573 76 SER C C 7087 O O . SER E 76 ? 0.7619 1.0108 0.7853 0.0528 -0.0183 -0.0580 76 SER C O 7088 C CB . SER E 76 ? 0.6856 0.9114 0.7328 0.0553 -0.0186 -0.0679 76 SER C CB 7089 O OG . SER E 76 ? 0.7113 0.9313 0.7662 0.0550 -0.0119 -0.0719 76 SER C OG 7090 N N . SER E 77 ? 0.6552 0.8870 0.6940 0.0539 -0.0104 -0.0576 77 SER C N 7091 C CA . SER E 77 ? 0.6431 0.8834 0.6791 0.0530 -0.0049 -0.0595 77 SER C CA 7092 C C . SER E 77 ? 0.6201 0.8541 0.6592 0.0531 -0.0020 -0.0506 77 SER C C 7093 O O . SER E 77 ? 0.6146 0.8403 0.6642 0.0538 0.0019 -0.0522 77 SER C O 7094 C CB . SER E 77 ? 0.5994 0.8430 0.6423 0.0531 0.0011 -0.0733 77 SER C CB 7095 O OG . SER E 77 ? 0.6230 0.8774 0.6616 0.0521 0.0062 -0.0768 77 SER C OG 7096 N N . LEU E 78 ? 0.5959 0.8342 0.6258 0.0521 -0.0042 -0.0408 78 LEU C N 7097 C CA . LEU E 78 ? 0.5192 0.7521 0.5507 0.0516 -0.0026 -0.0307 78 LEU C CA 7098 C C . LEU E 78 ? 0.4675 0.7029 0.5073 0.0519 0.0053 -0.0350 78 LEU C C 7099 O O . LEU E 78 ? 0.4945 0.7407 0.5330 0.0518 0.0098 -0.0428 78 LEU C O 7100 C CB . LEU E 78 ? 0.5629 0.8022 0.5819 0.0500 -0.0062 -0.0205 78 LEU C CB 7101 C CG . LEU E 78 ? 0.5331 0.7657 0.5513 0.0489 -0.0070 -0.0078 78 LEU C CG 7102 C CD1 . LEU E 78 ? 0.5135 0.7309 0.5361 0.0494 -0.0110 -0.0027 78 LEU C CD1 7103 C CD2 . LEU E 78 ? 0.5117 0.7520 0.5168 0.0469 -0.0106 0.0011 78 LEU C CD2 7104 N N . GLN E 79 ? 0.4372 0.6625 0.4860 0.0522 0.0069 -0.0299 79 GLN C N 7105 C CA . GLN E 79 ? 0.4342 0.6610 0.4924 0.0527 0.0137 -0.0314 79 GLN C CA 7106 C C . GLN E 79 ? 0.4493 0.6742 0.5061 0.0513 0.0131 -0.0184 79 GLN C C 7107 O O . GLN E 79 ? 0.4627 0.6806 0.5137 0.0500 0.0076 -0.0090 79 GLN C O 7108 C CB . GLN E 79 ? 0.3636 0.5804 0.4357 0.0540 0.0163 -0.0373 79 GLN C CB 7109 C CG . GLN E 79 ? 0.4468 0.6648 0.5212 0.0550 0.0171 -0.0504 79 GLN C CG 7110 C CD . GLN E 79 ? 0.6200 0.8515 0.6913 0.0553 0.0217 -0.0601 79 GLN C CD 7111 O OE1 . GLN E 79 ? 0.7580 0.9954 0.8221 0.0548 0.0197 -0.0669 79 GLN C OE1 7112 N NE2 . GLN E 79 ? 0.5565 0.7931 0.6334 0.0560 0.0281 -0.0610 79 GLN C NE2 7113 N N . PRO E 80 ? 0.4368 0.6681 0.4991 0.0515 0.0189 -0.0178 80 PRO C N 7114 C CA . PRO E 80 ? 0.4647 0.6961 0.5256 0.0497 0.0185 -0.0054 80 PRO C CA 7115 C C . PRO E 80 ? 0.4641 0.6813 0.5300 0.0486 0.0149 0.0036 80 PRO C C 7116 O O . PRO E 80 ? 0.4534 0.6684 0.5141 0.0462 0.0120 0.0149 80 PRO C O 7117 C CB . PRO E 80 ? 0.5293 0.7694 0.5999 0.0509 0.0263 -0.0091 80 PRO C CB 7118 C CG . PRO E 80 ? 0.5024 0.7509 0.5727 0.0525 0.0305 -0.0230 80 PRO C CG 7119 C CD . PRO E 80 ? 0.4651 0.7049 0.5350 0.0532 0.0263 -0.0289 80 PRO C CD 7120 N N . GLU E 81 ? 0.4691 0.6768 0.5445 0.0496 0.0151 -0.0015 81 GLU C N 7121 C CA . GLU E 81 ? 0.5639 0.7581 0.6440 0.0479 0.0122 0.0061 81 GLU C CA 7122 C C . GLU E 81 ? 0.5824 0.7682 0.6524 0.0462 0.0056 0.0109 81 GLU C C 7123 O O . GLU E 81 ? 0.6188 0.7931 0.6903 0.0440 0.0029 0.0172 81 GLU C O 7124 C CB . GLU E 81 ? 0.6803 0.8674 0.7739 0.0491 0.0147 -0.0010 81 GLU C CB 7125 C CG . GLU E 81 ? 0.8376 1.0317 0.9433 0.0513 0.0215 -0.0068 81 GLU C CG 7126 C CD . GLU E 81 ? 0.9291 1.1326 1.0337 0.0539 0.0252 -0.0198 81 GLU C CD 7127 O OE1 . GLU E 81 ? 0.8899 1.0924 0.9868 0.0539 0.0222 -0.0253 81 GLU C OE1 7128 O OE2 . GLU E 81 ? 0.9921 1.2040 1.1036 0.0557 0.0313 -0.0248 81 GLU C OE2 7129 N N . ASP E 82 ? 0.5102 0.7017 0.5701 0.0470 0.0030 0.0078 82 ASP C N 7130 C CA . ASP E 82 ? 0.4488 0.6327 0.5010 0.0463 -0.0030 0.0110 82 ASP C CA 7131 C C . ASP E 82 ? 0.4264 0.6082 0.4687 0.0439 -0.0070 0.0233 82 ASP C C 7132 O O . ASP E 82 ? 0.4193 0.5931 0.4562 0.0432 -0.0119 0.0272 82 ASP C O 7133 C CB . ASP E 82 ? 0.4705 0.6611 0.5174 0.0483 -0.0048 0.0026 82 ASP C CB 7134 C CG . ASP E 82 ? 0.5256 0.7159 0.5814 0.0501 -0.0019 -0.0097 82 ASP C CG 7135 O OD1 . ASP E 82 ? 0.5192 0.7012 0.5849 0.0497 0.0004 -0.0109 82 ASP C OD1 7136 O OD2 . ASP E 82 ? 0.5637 0.7620 0.6163 0.0514 -0.0021 -0.0178 82 ASP C OD2 7137 N N . PHE E 83 ? 0.3519 0.5411 0.3925 0.0427 -0.0048 0.0292 83 PHE C N 7138 C CA . PHE E 83 ? 0.3746 0.5623 0.4056 0.0400 -0.0085 0.0411 83 PHE C CA 7139 C C . PHE E 83 ? 0.3479 0.5206 0.3805 0.0374 -0.0113 0.0485 83 PHE C C 7140 O O . PHE E 83 ? 0.3797 0.5472 0.4217 0.0365 -0.0088 0.0485 83 PHE C O 7141 C CB . PHE E 83 ? 0.4694 0.6681 0.4995 0.0387 -0.0050 0.0459 83 PHE C CB 7142 C CG . PHE E 83 ? 0.5059 0.7005 0.5445 0.0367 -0.0025 0.0520 83 PHE C CG 7143 C CD1 . PHE E 83 ? 0.6278 0.8242 0.6798 0.0384 0.0026 0.0458 83 PHE C CD1 7144 C CD2 . PHE E 83 ? 0.5559 0.7448 0.5897 0.0330 -0.0056 0.0641 83 PHE C CD2 7145 C CE1 . PHE E 83 ? 0.7080 0.9011 0.7688 0.0366 0.0043 0.0522 83 PHE C CE1 7146 C CE2 . PHE E 83 ? 0.6019 0.7877 0.6436 0.0307 -0.0039 0.0702 83 PHE C CE2 7147 C CZ . PHE E 83 ? 0.6573 0.8455 0.7127 0.0325 0.0009 0.0646 83 PHE C CZ 7148 N N . ALA E 84 ? 0.3201 0.4858 0.3438 0.0361 -0.0165 0.0546 84 ALA C N 7149 C CA . ALA E 84 ? 0.3327 0.4836 0.3559 0.0331 -0.0192 0.0612 84 ALA C CA 7150 C C . ALA E 84 ? 0.2830 0.4281 0.2961 0.0327 -0.0246 0.0661 84 ALA C C 7151 O O . ALA E 84 ? 0.3632 0.5160 0.3701 0.0347 -0.0267 0.0652 84 ALA C O 7152 C CB . ALA E 84 ? 0.2597 0.4018 0.2917 0.0337 -0.0180 0.0542 84 ALA C CB 7153 N N . THR E 85 ? 0.3245 0.4558 0.3361 0.0299 -0.0269 0.0714 85 THR C N 7154 C CA . THR E 85 ? 0.3382 0.4611 0.3430 0.0302 -0.0316 0.0739 85 THR C CA 7155 C C . THR E 85 ? 0.3042 0.4191 0.3148 0.0320 -0.0315 0.0657 85 THR C C 7156 O O . THR E 85 ? 0.3361 0.4431 0.3523 0.0297 -0.0294 0.0642 85 THR C O 7157 C CB . THR E 85 ? 0.3607 0.4727 0.3592 0.0256 -0.0340 0.0849 85 THR C CB 7158 O OG1 . THR E 85 ? 0.3889 0.5089 0.3822 0.0235 -0.0340 0.0929 85 THR C OG1 7159 C CG2 . THR E 85 ? 0.2551 0.3581 0.2477 0.0266 -0.0385 0.0868 85 THR C CG2 7160 N N . TYR E 86 ? 0.2897 0.4071 0.2992 0.0357 -0.0340 0.0607 86 TYR C N 7161 C CA . TYR E 86 ? 0.3266 0.4377 0.3419 0.0375 -0.0340 0.0528 86 TYR C CA 7162 C C . TYR E 86 ? 0.3907 0.4894 0.4024 0.0370 -0.0375 0.0568 86 TYR C C 7163 O O . TYR E 86 ? 0.4519 0.5511 0.4570 0.0379 -0.0413 0.0625 86 TYR C O 7164 C CB . TYR E 86 ? 0.3409 0.4633 0.3591 0.0419 -0.0343 0.0437 86 TYR C CB 7165 C CG . TYR E 86 ? 0.3955 0.5279 0.4189 0.0424 -0.0298 0.0375 86 TYR C CG 7166 C CD1 . TYR E 86 ? 0.3777 0.5213 0.3973 0.0423 -0.0286 0.0402 86 TYR C CD1 7167 C CD2 . TYR E 86 ? 0.3462 0.4764 0.3786 0.0428 -0.0266 0.0289 86 TYR C CD2 7168 C CE1 . TYR E 86 ? 0.4009 0.5534 0.4263 0.0429 -0.0240 0.0340 86 TYR C CE1 7169 C CE2 . TYR E 86 ? 0.3235 0.4619 0.3616 0.0434 -0.0224 0.0231 86 TYR C CE2 7170 C CZ . TYR E 86 ? 0.4000 0.5493 0.4348 0.0437 -0.0210 0.0255 86 TYR C CZ 7171 O OH . TYR E 86 ? 0.3407 0.4978 0.3819 0.0445 -0.0162 0.0192 86 TYR C OH 7172 N N . TYR E 87 ? 0.3130 0.4003 0.3289 0.0352 -0.0360 0.0537 87 TYR C N 7173 C CA . TYR E 87 ? 0.3292 0.4038 0.3428 0.0345 -0.0382 0.0561 87 TYR C CA 7174 C C . TYR E 87 ? 0.3332 0.4053 0.3538 0.0373 -0.0377 0.0466 87 TYR C C 7175 O O . TYR E 87 ? 0.3731 0.4472 0.4003 0.0370 -0.0345 0.0392 87 TYR C O 7176 C CB . TYR E 87 ? 0.2582 0.3198 0.2692 0.0285 -0.0366 0.0616 87 TYR C CB 7177 C CG . TYR E 87 ? 0.3245 0.3859 0.3282 0.0250 -0.0377 0.0723 87 TYR C CG 7178 C CD1 . TYR E 87 ? 0.3615 0.4171 0.3576 0.0243 -0.0412 0.0799 87 TYR C CD1 7179 C CD2 . TYR E 87 ? 0.3327 0.3993 0.3377 0.0221 -0.0353 0.0750 87 TYR C CD2 7180 C CE1 . TYR E 87 ? 0.4257 0.4810 0.4149 0.0205 -0.0423 0.0898 87 TYR C CE1 7181 C CE2 . TYR E 87 ? 0.3683 0.4355 0.3672 0.0185 -0.0363 0.0849 87 TYR C CE2 7182 C CZ . TYR E 87 ? 0.4817 0.5433 0.4723 0.0175 -0.0398 0.0922 87 TYR C CZ 7183 O OH . TYR E 87 ? 0.5366 0.5989 0.5209 0.0136 -0.0408 0.1021 87 TYR C OH 7184 N N . CYS E 88 ? 0.2586 0.3264 0.2784 0.0399 -0.0407 0.0471 88 CYS C N 7185 C CA . CYS E 88 ? 0.2719 0.3353 0.2987 0.0419 -0.0400 0.0391 88 CYS C CA 7186 C C . CYS E 88 ? 0.3110 0.3581 0.3363 0.0380 -0.0385 0.0413 88 CYS C C 7187 O O . CYS E 88 ? 0.2783 0.3178 0.2966 0.0351 -0.0396 0.0497 88 CYS C O 7188 C CB . CYS E 88 ? 0.2665 0.3363 0.2953 0.0476 -0.0441 0.0374 88 CYS C CB 7189 S SG . CYS E 88 ? 0.4110 0.4744 0.4326 0.0487 -0.0492 0.0483 88 CYS C SG 7190 N N . GLN E 89 ? 0.3420 0.3839 0.3737 0.0375 -0.0357 0.0337 89 GLN C N 7191 C CA . GLN E 89 ? 0.2979 0.3244 0.3277 0.0331 -0.0335 0.0346 89 GLN C CA 7192 C C . GLN E 89 ? 0.3648 0.3872 0.4019 0.0352 -0.0320 0.0263 89 GLN C C 7193 O O . GLN E 89 ? 0.3459 0.3744 0.3902 0.0364 -0.0301 0.0180 89 GLN C O 7194 C CB . GLN E 89 ? 0.2726 0.2941 0.3004 0.0263 -0.0300 0.0355 89 GLN C CB 7195 C CG . GLN E 89 ? 0.2967 0.3023 0.3202 0.0203 -0.0280 0.0376 89 GLN C CG 7196 C CD . GLN E 89 ? 0.3471 0.3482 0.3717 0.0139 -0.0241 0.0348 89 GLN C CD 7197 O OE1 . GLN E 89 ? 0.3514 0.3603 0.3820 0.0147 -0.0227 0.0297 89 GLN C OE1 7198 N NE2 . GLN E 89 ? 0.2219 0.2101 0.2406 0.0071 -0.0226 0.0382 89 GLN C NE2 7199 N N . HIS E 90 ? 0.3184 0.3302 0.3540 0.0353 -0.0325 0.0285 90 HIS C N 7200 C CA . HIS E 90 ? 0.3356 0.3409 0.3779 0.0363 -0.0300 0.0211 90 HIS C CA 7201 C C . HIS E 90 ? 0.2774 0.2753 0.3192 0.0294 -0.0248 0.0167 90 HIS C C 7202 O O . HIS E 90 ? 0.3017 0.2919 0.3359 0.0231 -0.0236 0.0221 90 HIS C O 7203 C CB . HIS E 90 ? 0.3283 0.3223 0.3683 0.0374 -0.0314 0.0253 90 HIS C CB 7204 C CG . HIS E 90 ? 0.3541 0.3429 0.4025 0.0399 -0.0291 0.0177 90 HIS C CG 7205 N ND1 . HIS E 90 ? 0.3265 0.3013 0.3737 0.0389 -0.0277 0.0190 90 HIS C ND1 7206 C CD2 . HIS E 90 ? 0.3148 0.3108 0.3736 0.0434 -0.0276 0.0086 90 HIS C CD2 7207 C CE1 . HIS E 90 ? 0.3091 0.2829 0.3661 0.0419 -0.0252 0.0108 90 HIS C CE1 7208 N NE2 . HIS E 90 ? 0.3887 0.3756 0.4528 0.0445 -0.0252 0.0046 90 HIS C NE2 7209 N N . LEU E 91 ? 0.2329 0.2336 0.2827 0.0300 -0.0219 0.0073 91 LEU C N 7210 C CA . LEU E 91 ? 0.2980 0.2939 0.3475 0.0232 -0.0174 0.0033 91 LEU C CA 7211 C C . LEU E 91 ? 0.3633 0.3460 0.4122 0.0187 -0.0133 -0.0004 91 LEU C C 7212 O O . LEU E 91 ? 0.3595 0.3368 0.4066 0.0119 -0.0095 -0.0030 91 LEU C O 7213 C CB . LEU E 91 ? 0.2478 0.2549 0.3056 0.0251 -0.0163 -0.0046 91 LEU C CB 7214 C CG . LEU E 91 ? 0.2979 0.3159 0.3547 0.0267 -0.0187 -0.0016 91 LEU C CG 7215 C CD1 . LEU E 91 ? 0.3759 0.4043 0.4412 0.0287 -0.0176 -0.0101 91 LEU C CD1 7216 C CD2 . LEU E 91 ? 0.2423 0.2546 0.2920 0.0200 -0.0177 0.0052 91 LEU C CD2 7217 N N . ILE E 92 ? 0.3302 0.3078 0.3808 0.0225 -0.0139 -0.0005 92 ILE C N 7218 C CA . ILE E 92 ? 0.3533 0.3169 0.4022 0.0183 -0.0097 -0.0033 92 ILE C CA 7219 C C . ILE E 92 ? 0.3213 0.2759 0.3649 0.0198 -0.0121 0.0037 92 ILE C C 7220 O O . ILE E 92 ? 0.3658 0.3241 0.4050 0.0221 -0.0167 0.0118 92 ILE C O 7221 C CB . ILE E 92 ? 0.3424 0.3079 0.4023 0.0216 -0.0065 -0.0137 92 ILE C CB 7222 C CG1 . ILE E 92 ? 0.3522 0.3277 0.4214 0.0316 -0.0106 -0.0145 92 ILE C CG1 7223 C CG2 . ILE E 92 ? 0.3550 0.3265 0.4187 0.0179 -0.0033 -0.0206 92 ILE C CG2 7224 C CD1 . ILE E 92 ? 0.4297 0.4061 0.5106 0.0354 -0.0077 -0.0236 92 ILE C CD1 7225 N N . GLY E 93 ? 0.3262 0.2688 0.3704 0.0184 -0.0087 0.0005 93 GLY C N 7226 C CA . GLY E 93 ? 0.3939 0.3254 0.4327 0.0188 -0.0103 0.0068 93 GLY C CA 7227 C C . GLY E 93 ? 0.4347 0.3589 0.4600 0.0109 -0.0111 0.0153 93 GLY C C 7228 O O . GLY E 93 ? 0.4774 0.3958 0.4969 0.0024 -0.0074 0.0138 93 GLY C O 7229 N N . LEU E 94 ? 0.3023 0.2276 0.3227 0.0132 -0.0161 0.0246 94 LEU C N 7230 C CA . LEU E 94 ? 0.3664 0.2866 0.3748 0.0060 -0.0173 0.0335 94 LEU C CA 7231 C C . LEU E 94 ? 0.3582 0.2916 0.3656 0.0053 -0.0196 0.0369 94 LEU C C 7232 O O . LEU E 94 ? 0.3302 0.2623 0.3292 0.0002 -0.0210 0.0447 94 LEU C O 7233 C CB . LEU E 94 ? 0.4203 0.3343 0.4235 0.0079 -0.0214 0.0423 94 LEU C CB 7234 C CG . LEU E 94 ? 0.4118 0.3102 0.4148 0.0081 -0.0195 0.0407 94 LEU C CG 7235 C CD1 . LEU E 94 ? 0.3729 0.2647 0.3685 0.0079 -0.0238 0.0511 94 LEU C CD1 7236 C CD2 . LEU E 94 ? 0.3378 0.2234 0.3360 -0.0008 -0.0133 0.0353 94 LEU C CD2 7237 N N . ARG E 95 ? 0.3753 0.3215 0.3917 0.0105 -0.0197 0.0309 96 ARG C N 7238 C CA . ARG E 95 ? 0.3672 0.3258 0.3841 0.0104 -0.0210 0.0325 96 ARG C CA 7239 C C . ARG E 95 ? 0.3645 0.3290 0.3761 0.0122 -0.0257 0.0422 96 ARG C C 7240 O O . ARG E 95 ? 0.3875 0.3567 0.3955 0.0087 -0.0261 0.0468 96 ARG C O 7241 C CB . ARG E 95 ? 0.3864 0.3407 0.3993 0.0015 -0.0176 0.0321 96 ARG C CB 7242 C CG . ARG E 95 ? 0.4301 0.3856 0.4499 0.0002 -0.0135 0.0221 96 ARG C CG 7243 C CD . ARG E 95 ? 0.3364 0.2780 0.3514 -0.0081 -0.0091 0.0194 96 ARG C CD 7244 N NE . ARG E 95 ? 0.5308 0.4663 0.5501 -0.0050 -0.0066 0.0125 96 ARG C NE 7245 C CZ . ARG E 95 ? 0.5675 0.4991 0.5904 -0.0080 -0.0017 0.0038 96 ARG C CZ 7246 N NH1 . ARG E 95 ? 0.3316 0.2643 0.3536 -0.0146 0.0009 0.0013 96 ARG C NH1 7247 N NH2 . ARG E 95 ? 0.6994 0.6262 0.7274 -0.0044 0.0007 -0.0022 96 ARG C NH2 7248 N N . SER E 96 ? 0.3534 0.3180 0.3651 0.0177 -0.0291 0.0456 97 SER C N 7249 C CA . SER E 96 ? 0.3969 0.3655 0.4023 0.0186 -0.0335 0.0554 97 SER C CA 7250 C C . SER E 96 ? 0.3340 0.3199 0.3427 0.0232 -0.0359 0.0555 97 SER C C 7251 O O . SER E 96 ? 0.3551 0.3499 0.3717 0.0277 -0.0353 0.0479 97 SER C O 7252 C CB . SER E 96 ? 0.3902 0.3522 0.3945 0.0225 -0.0366 0.0595 97 SER C CB 7253 O OG . SER E 96 ? 0.3384 0.3086 0.3516 0.0306 -0.0387 0.0547 97 SER C OG 7254 N N . PHE E 97 ? 0.3071 0.2977 0.3093 0.0218 -0.0383 0.0640 98 PHE C N 7255 C CA . PHE E 97 ? 0.3110 0.3178 0.3148 0.0253 -0.0401 0.0647 98 PHE C CA 7256 C C . PHE E 97 ? 0.3779 0.3905 0.3789 0.0300 -0.0450 0.0704 98 PHE C C 7257 O O . PHE E 97 ? 0.3966 0.3999 0.3933 0.0296 -0.0473 0.0761 98 PHE C O 7258 C CB . PHE E 97 ? 0.2720 0.2819 0.2714 0.0199 -0.0388 0.0698 98 PHE C CB 7259 C CG . PHE E 97 ? 0.2743 0.2806 0.2769 0.0152 -0.0347 0.0651 98 PHE C CG 7260 C CD1 . PHE E 97 ? 0.2642 0.2561 0.2635 0.0091 -0.0326 0.0656 98 PHE C CD1 7261 C CD2 . PHE E 97 ? 0.3075 0.3245 0.3161 0.0164 -0.0329 0.0603 98 PHE C CD2 7262 C CE1 . PHE E 97 ? 0.2463 0.2352 0.2479 0.0040 -0.0293 0.0620 98 PHE C CE1 7263 C CE2 . PHE E 97 ? 0.3503 0.3638 0.3622 0.0118 -0.0295 0.0568 98 PHE C CE2 7264 C CZ . PHE E 97 ? 0.2924 0.2921 0.3005 0.0054 -0.0279 0.0580 98 PHE C CZ 7265 N N . GLY E 98 ? 0.3772 0.4052 0.3805 0.0341 -0.0466 0.0688 99 GLY C N 7266 C CA . GLY E 98 ? 0.3127 0.3483 0.3118 0.0373 -0.0514 0.0752 99 GLY C CA 7267 C C . GLY E 98 ? 0.3442 0.3814 0.3347 0.0327 -0.0518 0.0845 99 GLY C C 7268 O O . GLY E 98 ? 0.3421 0.3760 0.3313 0.0278 -0.0485 0.0853 99 GLY C O 7269 N N . GLN E 99 ? 0.3751 0.4178 0.3599 0.0341 -0.0559 0.0918 100 GLN C N 7270 C CA . GLN E 99 ? 0.4025 0.4466 0.3790 0.0295 -0.0563 0.1012 100 GLN C CA 7271 C C . GLN E 99 ? 0.4367 0.4959 0.4142 0.0290 -0.0538 0.0993 100 GLN C C 7272 O O . GLN E 99 ? 0.4756 0.5371 0.4483 0.0249 -0.0529 0.1057 100 GLN C O 7273 C CB . GLN E 99 ? 0.3675 0.4119 0.3372 0.0306 -0.0617 0.1103 100 GLN C CB 7274 C CG . GLN E 99 ? 0.3569 0.4182 0.3252 0.0341 -0.0644 0.1109 100 GLN C CG 7275 C CD . GLN E 99 ? 0.4487 0.5149 0.4235 0.0403 -0.0668 0.1040 100 GLN C CD 7276 O OE1 . GLN E 99 ? 0.4634 0.5208 0.4450 0.0424 -0.0659 0.0982 100 GLN C OE1 7277 N NE2 . GLN E 99 ? 0.4797 0.5605 0.4526 0.0429 -0.0697 0.1045 100 GLN C NE2 7278 N N . GLY E 100 ? 0.4344 0.5036 0.4185 0.0331 -0.0524 0.0902 101 GLY C N 7279 C CA . GLY E 100 ? 0.3930 0.4752 0.3794 0.0329 -0.0492 0.0867 101 GLY C CA 7280 C C . GLY E 100 ? 0.4183 0.5162 0.4014 0.0356 -0.0512 0.0874 101 GLY C C 7281 O O . GLY E 100 ? 0.3930 0.4920 0.3692 0.0357 -0.0553 0.0947 101 GLY C O 7282 N N . THR E 101 ? 0.3911 0.5009 0.3789 0.0373 -0.0481 0.0798 102 THR C N 7283 C CA . THR E 101 ? 0.3844 0.5101 0.3688 0.0391 -0.0489 0.0790 102 THR C CA 7284 C C . THR E 101 ? 0.4038 0.5385 0.3895 0.0370 -0.0440 0.0779 102 THR C C 7285 O O . THR E 101 ? 0.4414 0.5764 0.4350 0.0374 -0.0398 0.0706 102 THR C O 7286 C CB . THR E 101 ? 0.4184 0.5518 0.4074 0.0435 -0.0499 0.0693 102 THR C CB 7287 O OG1 . THR E 101 ? 0.4722 0.5987 0.4611 0.0459 -0.0548 0.0708 102 THR C OG1 7288 C CG2 . THR E 101 ? 0.4553 0.6056 0.4397 0.0443 -0.0503 0.0682 102 THR C CG2 7289 N N . LYS E 102 ? 0.3574 0.4995 0.3361 0.0348 -0.0444 0.0853 103 LYS C N 7290 C CA . LYS E 102 ? 0.4149 0.5664 0.3958 0.0330 -0.0394 0.0845 103 LYS C CA 7291 C C . LYS E 102 ? 0.3851 0.5525 0.3667 0.0357 -0.0373 0.0765 103 LYS C C 7292 O O . LYS E 102 ? 0.4001 0.5762 0.3743 0.0361 -0.0402 0.0784 103 LYS C O 7293 C CB . LYS E 102 ? 0.4226 0.5752 0.3963 0.0288 -0.0400 0.0960 103 LYS C CB 7294 C CG . LYS E 102 ? 0.4636 0.6244 0.4417 0.0269 -0.0345 0.0959 103 LYS C CG 7295 C CD . LYS E 102 ? 0.5513 0.7120 0.5233 0.0222 -0.0352 0.1077 103 LYS C CD 7296 C CE . LYS E 102 ? 0.5867 0.7574 0.5646 0.0208 -0.0295 0.1075 103 LYS C CE 7297 N NZ . LYS E 102 ? 0.6743 0.8469 0.6464 0.0160 -0.0302 0.1191 103 LYS C NZ 7298 N N . LEU E 103 ? 0.3630 0.5339 0.3535 0.0370 -0.0323 0.0674 104 LEU C N 7299 C CA . LEU E 103 ? 0.4422 0.6272 0.4341 0.0393 -0.0295 0.0583 104 LEU C CA 7300 C C . LEU E 103 ? 0.4239 0.6192 0.4175 0.0377 -0.0239 0.0586 104 LEU C C 7301 O O . LEU E 103 ? 0.4396 0.6313 0.4414 0.0370 -0.0200 0.0583 104 LEU C O 7302 C CB . LEU E 103 ? 0.4499 0.6322 0.4512 0.0421 -0.0275 0.0468 104 LEU C CB 7303 C CG . LEU E 103 ? 0.4903 0.6856 0.4946 0.0440 -0.0237 0.0358 104 LEU C CG 7304 C CD1 . LEU E 103 ? 0.4752 0.6822 0.4698 0.0444 -0.0270 0.0356 104 LEU C CD1 7305 C CD2 . LEU E 103 ? 0.5122 0.7027 0.5257 0.0463 -0.0224 0.0254 104 LEU C CD2 7306 N N . GLU E 104 ? 0.4834 0.6919 0.4693 0.0371 -0.0238 0.0594 105 GLU C N 7307 C CA . GLU E 104 ? 0.5086 0.7287 0.4955 0.0356 -0.0181 0.0594 105 GLU C CA 7308 C C . GLU E 104 ? 0.4307 0.6638 0.4194 0.0376 -0.0139 0.0474 105 GLU C C 7309 O O . GLU E 104 ? 0.4675 0.7045 0.4510 0.0388 -0.0170 0.0426 105 GLU C O 7310 C CB . GLU E 104 ? 0.6492 0.8748 0.6249 0.0321 -0.0205 0.0705 105 GLU C CB 7311 C CG . GLU E 104 ? 0.9053 1.1449 0.8810 0.0303 -0.0145 0.0704 105 GLU C CG 7312 C CD . GLU E 104 ? 1.1176 1.3653 1.0803 0.0267 -0.0171 0.0797 105 GLU C CD 7313 O OE1 . GLU E 104 ? 1.1916 1.4322 1.1461 0.0255 -0.0239 0.0874 105 GLU C OE1 7314 O OE2 . GLU E 104 ? 1.1407 1.4019 1.1020 0.0249 -0.0122 0.0791 105 GLU C OE2 7315 N N . ILE E 105 ? 0.4299 0.6695 0.4264 0.0379 -0.0069 0.0425 106 ILE C N 7316 C CA . ILE E 105 ? 0.5148 0.7664 0.5133 0.0395 -0.0020 0.0305 106 ILE C CA 7317 C C . ILE E 105 ? 0.6091 0.8762 0.5977 0.0370 0.0000 0.0322 106 ILE C C 7318 O O . ILE E 105 ? 0.6544 0.9252 0.6415 0.0347 0.0019 0.0401 106 ILE C O 7319 C CB . ILE E 105 ? 0.4834 0.7343 0.4966 0.0415 0.0052 0.0231 106 ILE C CB 7320 C CG1 . ILE E 105 ? 0.4627 0.6982 0.4852 0.0430 0.0031 0.0225 106 ILE C CG1 7321 C CG2 . ILE E 105 ? 0.4469 0.7085 0.4622 0.0431 0.0103 0.0094 106 ILE C CG2 7322 C CD1 . ILE E 105 ? 0.4095 0.6400 0.4295 0.0446 -0.0012 0.0163 106 ILE C CD1 7323 N N . LYS E 106 ? 0.6475 0.9241 0.6289 0.0370 -0.0006 0.0249 107 LYS C N 7324 C CA . LYS E 106 ? 0.6821 0.9744 0.6530 0.0340 0.0016 0.0249 107 LYS C CA 7325 C C . LYS E 106 ? 0.7777 1.0803 0.7554 0.0350 0.0107 0.0123 107 LYS C C 7326 O O . LYS E 106 ? 0.7750 1.0765 0.7583 0.0373 0.0125 0.0009 107 LYS C O 7327 C CB . LYS E 106 ? 0.7211 1.0181 0.6788 0.0326 -0.0051 0.0253 107 LYS C CB 7328 C CG . LYS E 106 ? 0.7986 1.1101 0.7423 0.0282 -0.0052 0.0296 107 LYS C CG 7329 C CD . LYS E 106 ? 0.8786 1.1957 0.8105 0.0268 -0.0119 0.0286 107 LYS C CD 7330 C CE . LYS E 106 ? 0.9184 1.2240 0.8467 0.0275 -0.0217 0.0395 107 LYS C CE 7331 N NZ . LYS E 106 ? 0.9348 1.2415 0.8529 0.0238 -0.0254 0.0536 107 LYS C NZ 7343 N N . THR E 108 ? 0.7513 1.2593 0.8023 0.0292 0.0805 -0.0883 109 THR C N 7344 C CA . THR E 108 ? 0.6896 1.2231 0.7336 0.0322 0.0855 -0.0889 109 THR C CA 7345 C C . THR E 108 ? 0.6670 1.1799 0.7115 0.0322 0.0882 -0.0702 109 THR C C 7346 O O . THR E 108 ? 0.5863 1.0681 0.6445 0.0277 0.0888 -0.0660 109 THR C O 7347 C CB . THR E 108 ? 0.6859 1.2407 0.7435 0.0275 0.0918 -0.1155 109 THR C CB 7348 O OG1 . THR E 108 ? 0.7910 1.3722 0.8409 0.0309 0.0964 -0.1156 109 THR C OG1 7349 C CG2 . THR E 108 ? 0.6306 1.1566 0.7105 0.0201 0.0959 -0.1237 109 THR C CG2 7350 N N . VAL E 109 ? 0.6744 1.2057 0.7035 0.0373 0.0899 -0.0591 110 VAL C N 7351 C CA . VAL E 109 ? 0.6758 1.1911 0.7028 0.0372 0.0925 -0.0401 110 VAL C CA 7352 C C . VAL E 109 ? 0.6909 1.1936 0.7387 0.0310 0.0984 -0.0487 110 VAL C C 7353 O O . VAL E 109 ? 0.7424 1.2643 0.7997 0.0291 0.1034 -0.0684 110 VAL C O 7354 C CB . VAL E 109 ? 0.6737 1.2166 0.6819 0.0429 0.0951 -0.0310 110 VAL C CB 7355 C CG1 . VAL E 109 ? 0.6714 1.1976 0.6777 0.0416 0.0984 -0.0115 110 VAL C CG1 7356 C CG2 . VAL E 109 ? 0.6875 1.2426 0.6735 0.0505 0.0894 -0.0213 110 VAL C CG2 7357 N N . ALA E 110 ? 0.6408 1.1115 0.6954 0.0284 0.0979 -0.0343 111 ALA C N 7358 C CA . ALA E 110 ? 0.6108 1.0681 0.6843 0.0237 0.1031 -0.0399 111 ALA C CA 7359 C C . ALA E 110 ? 0.6285 1.0732 0.6986 0.0235 0.1048 -0.0193 111 ALA C C 7360 O O . ALA E 110 ? 0.6510 1.0762 0.7123 0.0244 0.1004 -0.0002 111 ALA C O 7361 C CB . ALA E 110 ? 0.5103 0.9392 0.6008 0.0197 0.1010 -0.0473 111 ALA C CB 7362 N N . ALA E 111 ? 0.6147 1.0709 0.6919 0.0221 0.1113 -0.0239 112 ALA C N 7363 C CA . ALA E 111 ? 0.6199 1.0687 0.6946 0.0211 0.1140 -0.0063 112 ALA C CA 7364 C C . ALA E 111 ? 0.5827 0.9983 0.6730 0.0173 0.1131 -0.0001 112 ALA C C 7365 O O . ALA E 111 ? 0.5035 0.9073 0.6105 0.0156 0.1133 -0.0137 112 ALA C O 7366 C CB . ALA E 111 ? 0.6094 1.0858 0.6860 0.0211 0.1214 -0.0143 112 ALA C CB 7367 N N . PRO E 112 ? 0.5509 0.9515 0.6357 0.0161 0.1122 0.0205 113 PRO C N 7368 C CA . PRO E 112 ? 0.6019 0.9733 0.7008 0.0128 0.1113 0.0275 113 PRO C CA 7369 C C . PRO E 112 ? 0.6324 1.0093 0.7458 0.0106 0.1178 0.0224 113 PRO C C 7370 O O . PRO E 112 ? 0.5616 0.9604 0.6692 0.0105 0.1228 0.0244 113 PRO C O 7371 C CB . PRO E 112 ? 0.5598 0.9164 0.6445 0.0122 0.1079 0.0512 113 PRO C CB 7372 C CG . PRO E 112 ? 0.4641 0.8464 0.5307 0.0143 0.1109 0.0572 113 PRO C CG 7373 C CD . PRO E 112 ? 0.5018 0.9099 0.5656 0.0179 0.1115 0.0389 113 PRO C CD 7374 N N . SER E 113 ? 0.7079 1.0655 0.8396 0.0093 0.1177 0.0160 114 SER C N 7375 C CA . SER E 113 ? 0.7160 1.0748 0.8620 0.0079 0.1231 0.0134 114 SER C CA 7376 C C . SER E 113 ? 0.7534 1.0958 0.8984 0.0051 0.1217 0.0334 114 SER C C 7377 O O . SER E 113 ? 0.7642 1.0802 0.9140 0.0042 0.1169 0.0407 114 SER C O 7378 C CB . SER E 113 ? 0.7175 1.0626 0.8829 0.0088 0.1239 -0.0023 114 SER C CB 7379 O OG . SER E 113 ? 0.7536 1.1109 0.9201 0.0104 0.1251 -0.0212 114 SER C OG 7380 N N . VAL E 114 ? 0.7502 1.1089 0.8890 0.0032 0.1260 0.0420 115 VAL C N 7381 C CA . VAL E 114 ? 0.6910 1.0367 0.8264 -0.0006 0.1252 0.0615 115 VAL C CA 7382 C C . VAL E 114 ? 0.6340 0.9733 0.7875 -0.0026 0.1281 0.0606 115 VAL C C 7383 O O . VAL E 114 ? 0.6519 1.0104 0.8139 -0.0020 0.1340 0.0509 115 VAL C O 7384 C CB . VAL E 114 ? 0.6713 1.0364 0.7893 -0.0025 0.1289 0.0732 115 VAL C CB 7385 C CG1 . VAL E 114 ? 0.6187 0.9674 0.7321 -0.0074 0.1280 0.0936 115 VAL C CG1 7386 C CG2 . VAL E 114 ? 0.6955 1.0701 0.7948 0.0009 0.1263 0.0738 115 VAL C CG2 7387 N N . PHE E 115 ? 0.5955 0.9089 0.7546 -0.0045 0.1239 0.0707 116 PHE C N 7388 C CA . PHE E 115 ? 0.5130 0.8201 0.6882 -0.0062 0.1258 0.0720 116 PHE C CA 7389 C C . PHE E 115 ? 0.5152 0.8124 0.6845 -0.0118 0.1247 0.0913 116 PHE C C 7390 O O . PHE E 115 ? 0.5916 0.8778 0.7460 -0.0135 0.1209 0.1038 116 PHE C O 7391 C CB . PHE E 115 ? 0.4782 0.7631 0.6686 -0.0031 0.1221 0.0641 116 PHE C CB 7392 C CG . PHE E 115 ? 0.5115 0.8014 0.7077 0.0015 0.1232 0.0452 116 PHE C CG 7393 C CD1 . PHE E 115 ? 0.5658 0.8718 0.7734 0.0042 0.1291 0.0305 116 PHE C CD1 7394 C CD2 . PHE E 115 ? 0.5209 0.7992 0.7110 0.0030 0.1185 0.0417 116 PHE C CD2 7395 C CE1 . PHE E 115 ? 0.5912 0.9003 0.8041 0.0079 0.1306 0.0125 116 PHE C CE1 7396 C CE2 . PHE E 115 ? 0.5030 0.7857 0.6987 0.0062 0.1200 0.0236 116 PHE C CE2 7397 C CZ . PHE E 115 ? 0.5043 0.8016 0.7113 0.0084 0.1261 0.0089 116 PHE C CZ 7398 N N . ILE E 116 ? 0.4949 0.7958 0.6758 -0.0145 0.1281 0.0935 117 ILE C N 7399 C CA . ILE E 116 ? 0.4684 0.7600 0.6459 -0.0208 0.1274 0.1105 117 ILE C CA 7400 C C . ILE E 116 ? 0.4600 0.7419 0.6564 -0.0213 0.1268 0.1094 117 ILE C C 7401 O O . ILE E 116 ? 0.4316 0.7246 0.6426 -0.0177 0.1300 0.0969 117 ILE C O 7402 C CB . ILE E 116 ? 0.5644 0.8787 0.7317 -0.0260 0.1340 0.1179 117 ILE C CB 7403 C CG1 . ILE E 116 ? 0.5334 0.8347 0.6936 -0.0336 0.1333 0.1366 117 ILE C CG1 7404 C CG2 . ILE E 116 ? 0.5749 0.9143 0.7555 -0.0254 0.1408 0.1067 117 ILE C CG2 7405 C CD1 . ILE E 116 ? 0.5360 0.8553 0.6822 -0.0391 0.1396 0.1461 117 ILE C CD1 7406 N N . PHE E 117 ? 0.4666 0.7275 0.6623 -0.0251 0.1224 0.1221 118 PHE C N 7407 C CA . PHE E 117 ? 0.4470 0.6983 0.6596 -0.0254 0.1210 0.1222 118 PHE C CA 7408 C C . PHE E 117 ? 0.5096 0.7593 0.7199 -0.0337 0.1220 0.1368 118 PHE C C 7409 O O . PHE E 117 ? 0.5200 0.7560 0.7164 -0.0382 0.1193 0.1497 118 PHE C O 7410 C CB . PHE E 117 ? 0.3874 0.6119 0.6049 -0.0211 0.1137 0.1212 118 PHE C CB 7411 C CG . PHE E 117 ? 0.4102 0.6330 0.6295 -0.0140 0.1126 0.1074 118 PHE C CG 7412 C CD1 . PHE E 117 ? 0.3854 0.6050 0.5899 -0.0131 0.1102 0.1076 118 PHE C CD1 7413 C CD2 . PHE E 117 ? 0.3897 0.6135 0.6253 -0.0082 0.1141 0.0940 118 PHE C CD2 7414 C CE1 . PHE E 117 ? 0.4155 0.6344 0.6222 -0.0077 0.1094 0.0941 118 PHE C CE1 7415 C CE2 . PHE E 117 ? 0.4368 0.6574 0.6742 -0.0027 0.1137 0.0810 118 PHE C CE2 7416 C CZ . PHE E 117 ? 0.4639 0.6825 0.6871 -0.0030 0.1114 0.0806 118 PHE C CZ 7417 N N . PRO E 118 ? 0.5232 0.7868 0.7471 -0.0359 0.1260 0.1343 119 PRO C N 7418 C CA . PRO E 118 ? 0.5450 0.8077 0.7697 -0.0446 0.1272 0.1465 119 PRO C CA 7419 C C . PRO E 118 ? 0.5083 0.7451 0.7390 -0.0448 0.1202 0.1523 119 PRO C C 7420 O O . PRO E 118 ? 0.5242 0.7474 0.7614 -0.0374 0.1154 0.1455 119 PRO C O 7421 C CB . PRO E 118 ? 0.5419 0.8302 0.7819 -0.0449 0.1333 0.1385 119 PRO C CB 7422 C CG . PRO E 118 ? 0.5901 0.8940 0.8335 -0.0367 0.1362 0.1233 119 PRO C CG 7423 C CD . PRO E 118 ? 0.5478 0.8302 0.7870 -0.0302 0.1301 0.1194 119 PRO C CD 7424 N N . PRO E 119 ? 0.5439 0.7740 0.7723 -0.0533 0.1199 0.1645 120 PRO C N 7425 C CA . PRO E 119 ? 0.5842 0.7931 0.8206 -0.0533 0.1136 0.1686 120 PRO C CA 7426 C C . PRO E 119 ? 0.5634 0.7819 0.8211 -0.0486 0.1139 0.1588 120 PRO C C 7427 O O . PRO E 119 ? 0.5705 0.8134 0.8362 -0.0493 0.1199 0.1528 120 PRO C O 7428 C CB . PRO E 119 ? 0.5801 0.7837 0.8088 -0.0646 0.1148 0.1827 120 PRO C CB 7429 C CG . PRO E 119 ? 0.5734 0.8026 0.7986 -0.0705 0.1233 0.1832 120 PRO C CG 7430 C CD . PRO E 119 ? 0.5318 0.7722 0.7499 -0.0635 0.1254 0.1750 120 PRO C CD 7431 N N . SER E 120 ? 0.5321 0.7323 0.7982 -0.0433 0.1076 0.1573 121 SER C N 7432 C CA . SER E 120 ? 0.5213 0.7290 0.8067 -0.0378 0.1075 0.1492 121 SER C CA 7433 C C . SER E 120 ? 0.5674 0.7850 0.8606 -0.0457 0.1091 0.1551 121 SER C C 7434 O O . SER E 120 ? 0.6104 0.8215 0.8941 -0.0554 0.1089 0.1662 121 SER C O 7435 C CB . SER E 120 ? 0.5271 0.7117 0.8181 -0.0298 0.1005 0.1468 121 SER C CB 7436 O OG . SER E 120 ? 0.5218 0.6870 0.8087 -0.0347 0.0949 0.1578 121 SER C OG 7437 N N . ASP E 121 ? 0.5988 0.8322 0.9091 -0.0413 0.1109 0.1474 122 ASP C N 7438 C CA . ASP E 121 ? 0.6829 0.9290 1.0025 -0.0484 0.1123 0.1513 122 ASP C CA 7439 C C . ASP E 121 ? 0.6498 0.8742 0.9707 -0.0506 0.1052 0.1586 122 ASP C C 7440 O O . ASP E 121 ? 0.7102 0.9319 1.0241 -0.0593 0.1033 0.1625 122 ASP C O 7441 C CB . ASP E 121 ? 0.7930 1.0631 1.1305 -0.0414 0.1156 0.1402 122 ASP C CB 7442 C CG . ASP E 121 ? 0.8691 1.1678 1.2062 -0.0439 0.1238 0.1349 122 ASP C CG 7443 O OD1 . ASP E 121 ? 0.8798 1.1854 1.2063 -0.0549 0.1277 0.1422 122 ASP C OD1 7444 O OD2 . ASP E 121 ? 0.8927 1.2066 1.2398 -0.0345 0.1266 0.1234 122 ASP C OD2 7445 N N . GLU E 122 ? 0.6306 0.8345 0.9534 -0.0417 0.0992 0.1568 123 GLU C N 7446 C CA . GLU E 122 ? 0.6505 0.8335 0.9739 -0.0422 0.0918 0.1625 123 GLU C CA 7447 C C . GLU E 122 ? 0.6237 0.7826 0.9236 -0.0493 0.0865 0.1704 123 GLU C C 7448 O O . GLU E 122 ? 0.6018 0.7462 0.8957 -0.0522 0.0802 0.1731 123 GLU C O 7449 C CB . GLU E 122 ? 0.6700 0.8381 1.0011 -0.0300 0.0870 0.1576 123 GLU C CB 7450 C CG . GLU E 122 ? 0.7979 0.9556 1.1200 -0.0238 0.0871 0.1531 123 GLU C CG 7451 C CD . GLU E 122 ? 0.8667 1.0089 1.1957 -0.0121 0.0828 0.1472 123 GLU C CD 7452 O OE1 . GLU E 122 ? 0.9065 1.0592 1.2468 -0.0036 0.0857 0.1376 123 GLU C OE1 7453 O OE2 . GLU E 122 ? 0.8115 0.9306 1.1344 -0.0114 0.0769 0.1524 123 GLU C OE2 7454 N N . GLN E 123 ? 0.5874 0.7431 0.8738 -0.0511 0.0890 0.1731 124 GLN C N 7455 C CA . GLN E 123 ? 0.5743 0.7087 0.8369 -0.0563 0.0842 0.1795 124 GLN C CA 7456 C C . GLN E 123 ? 0.6176 0.7594 0.8707 -0.0670 0.0872 0.1823 124 GLN C C 7457 O O . GLN E 123 ? 0.6972 0.8211 0.9357 -0.0716 0.0823 0.1855 124 GLN C O 7458 C CB . GLN E 123 ? 0.5255 0.6557 0.7763 -0.0542 0.0860 0.1817 124 GLN C CB 7459 C CG . GLN E 123 ? 0.5193 0.6259 0.7456 -0.0568 0.0799 0.1870 124 GLN C CG 7460 C CD . GLN E 123 ? 0.5669 0.6761 0.7793 -0.0571 0.0835 0.1906 124 GLN C CD 7461 O OE1 . GLN E 123 ? 0.6149 0.7459 0.8347 -0.0570 0.0916 0.1893 124 GLN C OE1 7462 N NE2 . GLN E 123 ? 0.5540 0.6427 0.7462 -0.0567 0.0778 0.1941 124 GLN C NE2 7463 N N . LEU E 124 ? 0.6281 0.7968 0.8895 -0.0707 0.0956 0.1799 125 LEU C N 7464 C CA . LEU E 124 ? 0.6690 0.8472 0.9225 -0.0815 0.0998 0.1819 125 LEU C CA 7465 C C . LEU E 124 ? 0.7189 0.8920 0.9761 -0.0866 0.0961 0.1811 125 LEU C C 7466 O O . LEU E 124 ? 0.8177 0.9830 1.0617 -0.0957 0.0965 0.1841 125 LEU C O 7467 C CB . LEU E 124 ? 0.6704 0.8815 0.9346 -0.0830 0.1092 0.1774 125 LEU C CB 7468 C CG . LEU E 124 ? 0.6977 0.9178 0.9553 -0.0801 0.1143 0.1781 125 LEU C CG 7469 C CD1 . LEU E 124 ? 0.7183 0.9725 0.9903 -0.0781 0.1225 0.1704 125 LEU C CD1 7470 C CD2 . LEU E 124 ? 0.7027 0.9118 0.9363 -0.0878 0.1156 0.1858 125 LEU C CD2 7471 N N . LYS E 125 ? 0.7122 0.8897 0.9873 -0.0804 0.0930 0.1767 126 LYS C N 7472 C CA . LYS E 125 ? 0.7916 0.9672 1.0718 -0.0845 0.0894 0.1754 126 LYS C CA 7473 C C . LYS E 125 ? 0.8306 0.9758 1.0998 -0.0822 0.0802 0.1783 126 LYS C C 7474 O O . LYS E 125 ? 0.9146 1.0567 1.1914 -0.0813 0.0756 0.1765 126 LYS C O 7475 C CB . LYS E 125 ? 0.7575 0.9547 1.0620 -0.0783 0.0904 0.1691 126 LYS C CB 7476 C CG . LYS E 125 ? 0.7343 0.9244 1.0500 -0.0651 0.0867 0.1672 126 LYS C CG 7477 C CD . LYS E 125 ? 0.7649 0.9764 1.1036 -0.0581 0.0880 0.1604 126 LYS C CD 7478 C CE . LYS E 125 ? 0.8187 1.0201 1.1681 -0.0446 0.0847 0.1584 126 LYS C CE 7479 N NZ . LYS E 125 ? 0.8286 1.0500 1.1988 -0.0355 0.0859 0.1510 126 LYS C NZ 7480 N N . SER E 126 ? 0.8053 0.9301 1.0562 -0.0807 0.0774 0.1820 127 SER C N 7481 C CA . SER E 126 ? 0.7964 0.8937 1.0339 -0.0782 0.0687 0.1831 127 SER C CA 7482 C C . SER E 126 ? 0.7723 0.8552 0.9866 -0.0858 0.0694 0.1865 127 SER C C 7483 O O . SER E 126 ? 0.7715 0.8334 0.9728 -0.0853 0.0634 0.1861 127 SER C O 7484 C CB . SER E 126 ? 0.8554 0.9399 1.0922 -0.0669 0.0635 0.1824 127 SER C CB 7485 O OG . SER E 126 ? 0.9253 1.0058 1.1487 -0.0666 0.0659 0.1851 127 SER C OG 7486 N N . GLY E 127 ? 0.7164 0.8111 0.9255 -0.0923 0.0771 0.1892 128 GLY C N 7487 C CA . GLY E 127 ? 0.7240 0.8061 0.9120 -0.1000 0.0794 0.1929 128 GLY C CA 7488 C C . GLY E 127 ? 0.7527 0.8298 0.9257 -0.0974 0.0814 0.1971 128 GLY C C 7489 O O . GLY E 127 ? 0.7156 0.7843 0.8713 -0.1034 0.0847 0.2010 128 GLY C O 7490 N N . THR E 128 ? 0.8328 0.9148 1.0123 -0.0886 0.0800 0.1965 129 THR C N 7491 C CA . THR E 128 ? 0.8162 0.8946 0.9821 -0.0852 0.0813 0.2003 129 THR C CA 7492 C C . THR E 128 ? 0.6674 0.7702 0.8465 -0.0821 0.0876 0.1998 129 THR C C 7493 O O . THR E 128 ? 0.6529 0.7697 0.8521 -0.0789 0.0886 0.1953 129 THR C O 7494 C CB . THR E 128 ? 0.8960 0.9519 1.0523 -0.0767 0.0725 0.1991 129 THR C CB 7495 O OG1 . THR E 128 ? 0.9691 1.0061 1.1185 -0.0780 0.0664 0.1965 129 THR C OG1 7496 C CG2 . THR E 128 ? 0.9017 0.9504 1.0387 -0.0751 0.0735 0.2035 129 THR C CG2 7497 N N . ALA E 129 ? 0.5927 0.7014 0.7602 -0.0824 0.0923 0.2038 130 ALA C N 7498 C CA . ALA E 129 ? 0.5730 0.7062 0.7511 -0.0791 0.0988 0.2024 130 ALA C CA 7499 C C . ALA E 129 ? 0.6032 0.7307 0.7690 -0.0731 0.0978 0.2054 130 ALA C C 7500 O O . ALA E 129 ? 0.6389 0.7576 0.7846 -0.0751 0.0979 0.2110 130 ALA C O 7501 C CB . ALA E 129 ? 0.5072 0.6647 0.6862 -0.0864 0.1082 0.2029 130 ALA C CB 7502 N N . SER E 130 ? 0.5483 0.6812 0.7266 -0.0657 0.0973 0.2015 131 SER C N 7503 C CA . SER E 130 ? 0.5300 0.6611 0.6991 -0.0601 0.0971 0.2035 131 SER C CA 7504 C C . SER E 130 ? 0.5656 0.7260 0.7423 -0.0577 0.1055 0.1980 131 SER C C 7505 O O . SER E 130 ? 0.6651 0.8380 0.8585 -0.0541 0.1067 0.1865 131 SER C O 7506 C CB . SER E 130 ? 0.4713 0.5840 0.6458 -0.0528 0.0895 0.2004 131 SER C CB 7507 O OG . SER E 130 ? 0.5230 0.6090 0.6857 -0.0527 0.0801 0.2014 131 SER C OG 7508 N N . VAL E 131 ? 0.4279 0.5960 0.5877 -0.0576 0.1085 0.2011 132 VAL C N 7509 C CA . VAL E 131 ? 0.3783 0.5708 0.5391 -0.0531 0.1132 0.1899 132 VAL C CA 7510 C C . VAL E 131 ? 0.4135 0.6000 0.5641 -0.0452 0.1090 0.1852 132 VAL C C 7511 O O . VAL E 131 ? 0.4502 0.6255 0.5828 -0.0452 0.1066 0.1948 132 VAL C O 7512 C CB . VAL E 131 ? 0.3946 0.6070 0.5447 -0.0592 0.1212 0.1957 132 VAL C CB 7513 C CG1 . VAL E 131 ? 0.3609 0.6013 0.5155 -0.0546 0.1263 0.1824 132 VAL C CG1 7514 C CG2 . VAL E 131 ? 0.3345 0.5499 0.4924 -0.0689 0.1252 0.2027 132 VAL C CG2 7515 N N . VAL E 132 ? 0.3309 0.5247 0.4927 -0.0383 0.1081 0.1703 133 VAL C N 7516 C CA . VAL E 132 ? 0.3562 0.5436 0.5110 -0.0314 0.1037 0.1643 133 VAL C CA 7517 C C . VAL E 132 ? 0.4169 0.6285 0.5680 -0.0276 0.1081 0.1529 133 VAL C C 7518 O O . VAL E 132 ? 0.3747 0.6038 0.5383 -0.0263 0.1128 0.1416 133 VAL C O 7519 C CB . VAL E 132 ? 0.3362 0.5077 0.5056 -0.0265 0.0982 0.1559 133 VAL C CB 7520 C CG1 . VAL E 132 ? 0.3145 0.4797 0.4764 -0.0206 0.0939 0.1498 133 VAL C CG1 7521 C CG2 . VAL E 132 ? 0.3089 0.4578 0.4823 -0.0297 0.0934 0.1664 133 VAL C CG2 7522 N N . CYS E 133 ? 0.4624 0.6754 0.5958 -0.0252 0.1067 0.1558 134 CYS C N 7523 C CA . CYS E 133 ? 0.4872 0.7223 0.6162 -0.0208 0.1097 0.1440 134 CYS C CA 7524 C C . CYS E 133 ? 0.5915 0.8172 0.7211 -0.0148 0.1041 0.1343 134 CYS C C 7525 O O . CYS E 133 ? 0.6237 0.8291 0.7463 -0.0138 0.0980 0.1419 134 CYS C O 7526 C CB . CYS E 133 ? 0.4430 0.6913 0.5510 -0.0222 0.1130 0.1533 134 CYS C CB 7527 S SG . CYS E 133 ? 0.9814 1.2636 1.0848 -0.0177 0.1183 0.1390 134 CYS C SG 7528 N N . LEU E 134 ? 0.5279 0.7684 0.6660 -0.0110 0.1064 0.1174 135 LEU C N 7529 C CA . LEU E 134 ? 0.4685 0.7012 0.6092 -0.0063 0.1020 0.1065 135 LEU C CA 7530 C C . LEU E 134 ? 0.4583 0.7137 0.5904 -0.0030 0.1043 0.0950 135 LEU C C 7531 O O . LEU E 134 ? 0.5053 0.7826 0.6425 -0.0026 0.1102 0.0846 135 LEU C O 7532 C CB . LEU E 134 ? 0.4231 0.6465 0.5849 -0.0048 0.1021 0.0948 135 LEU C CB 7533 C CG . LEU E 134 ? 0.4156 0.6339 0.5830 -0.0007 0.0998 0.0801 135 LEU C CG 7534 C CD1 . LEU E 134 ? 0.4497 0.6478 0.6087 0.0001 0.0924 0.0871 135 LEU C CD1 7535 C CD2 . LEU E 134 ? 0.4296 0.6398 0.6171 0.0011 0.1016 0.0694 135 LEU C CD2 7536 N N . LEU E 135 ? 0.3660 0.6174 0.4852 -0.0004 0.0996 0.0966 136 LEU C N 7537 C CA . LEU E 135 ? 0.3847 0.6577 0.4963 0.0030 0.1008 0.0845 136 LEU C CA 7538 C C . LEU E 135 ? 0.4131 0.6771 0.5341 0.0054 0.0973 0.0702 136 LEU C C 7539 O O . LEU E 135 ? 0.3798 0.6255 0.4969 0.0063 0.0912 0.0755 136 LEU C O 7540 C CB . LEU E 135 ? 0.4760 0.7553 0.5646 0.0049 0.0985 0.0961 136 LEU C CB 7541 C CG . LEU E 135 ? 0.4511 0.7444 0.5253 0.0033 0.1029 0.1090 136 LEU C CG 7542 C CD1 . LEU E 135 ? 0.3649 0.6419 0.4431 -0.0020 0.1043 0.1239 136 LEU C CD1 7543 C CD2 . LEU E 135 ? 0.4399 0.7363 0.4911 0.0072 0.0996 0.1188 136 LEU C CD2 7544 N N . ASN E 136 ? 0.4631 0.7397 0.5963 0.0062 0.1015 0.0520 137 ASN C N 7545 C CA . ASN E 136 ? 0.5323 0.7974 0.6770 0.0072 0.0995 0.0380 137 ASN C CA 7546 C C . ASN E 136 ? 0.5037 0.7878 0.6433 0.0091 0.1000 0.0223 137 ASN C C 7547 O O . ASN E 136 ? 0.5124 0.8223 0.6490 0.0098 0.1048 0.0133 137 ASN C O 7548 C CB . ASN E 136 ? 0.6184 0.8776 0.7832 0.0068 0.1038 0.0282 137 ASN C CB 7549 C CG . ASN E 136 ? 0.6649 0.8973 0.8419 0.0071 0.1005 0.0246 137 ASN C CG 7550 O OD1 . ASN E 136 ? 0.6909 0.9038 0.8638 0.0067 0.0946 0.0361 137 ASN C OD1 7551 N ND2 . ASN E 136 ? 0.6181 0.8491 0.8097 0.0081 0.1044 0.0086 137 ASN C ND2 7552 N N . ASN E 137 ? 0.4020 0.6740 0.5406 0.0096 0.0950 0.0188 138 ASN C N 7553 C CA . ASN E 137 ? 0.4637 0.7510 0.6003 0.0105 0.0951 0.0018 138 ASN C CA 7554 C C . ASN E 137 ? 0.4677 0.7862 0.5883 0.0127 0.0964 0.0002 138 ASN C C 7555 O O . ASN E 137 ? 0.5411 0.8824 0.6646 0.0128 0.1018 -0.0135 138 ASN C O 7556 C CB . ASN E 137 ? 0.4984 0.7867 0.6527 0.0092 0.1004 -0.0181 138 ASN C CB 7557 C CG . ASN E 137 ? 0.5937 0.8516 0.7635 0.0080 0.0996 -0.0168 138 ASN C CG 7558 O OD1 . ASN E 137 ? 0.5881 0.8248 0.7559 0.0078 0.0940 -0.0055 138 ASN C OD1 7559 N ND2 . ASN E 137 ? 0.6105 0.8663 0.7954 0.0079 0.1052 -0.0283 138 ASN C ND2 7560 N N . PHE E 138 ? 0.3959 0.7152 0.4990 0.0149 0.0915 0.0141 139 PHE C N 7561 C CA . PHE E 138 ? 0.4120 0.7599 0.4975 0.0182 0.0922 0.0150 139 PHE C CA 7562 C C . PHE E 138 ? 0.4133 0.7631 0.4845 0.0217 0.0858 0.0181 139 PHE C C 7563 O O . PHE E 138 ? 0.3769 0.7047 0.4512 0.0211 0.0806 0.0216 139 PHE C O 7564 C CB . PHE E 138 ? 0.4250 0.7762 0.4998 0.0186 0.0945 0.0331 139 PHE C CB 7565 C CG . PHE E 138 ? 0.4371 0.7627 0.5038 0.0186 0.0896 0.0545 139 PHE C CG 7566 C CD1 . PHE E 138 ? 0.4443 0.7717 0.4908 0.0227 0.0851 0.0664 139 PHE C CD1 7567 C CD2 . PHE E 138 ? 0.4455 0.7455 0.5244 0.0150 0.0894 0.0623 139 PHE C CD2 7568 C CE1 . PHE E 138 ? 0.4148 0.7176 0.4536 0.0228 0.0808 0.0855 139 PHE C CE1 7569 C CE2 . PHE E 138 ? 0.4108 0.6877 0.4826 0.0146 0.0849 0.0810 139 PHE C CE2 7570 C CZ . PHE E 138 ? 0.4409 0.7184 0.4926 0.0184 0.0807 0.0926 139 PHE C CZ 7571 N N . TYR E 139 ? 0.4208 0.7985 0.4762 0.0257 0.0862 0.0168 140 TYR C N 7572 C CA . TYR E 139 ? 0.4861 0.8709 0.5253 0.0305 0.0803 0.0204 140 TYR C CA 7573 C C . TYR E 139 ? 0.6066 1.0218 0.6265 0.0357 0.0823 0.0241 140 TYR C C 7574 O O . TYR E 139 ? 0.6767 1.1165 0.6996 0.0351 0.0878 0.0123 140 TYR C O 7575 C CB . TYR E 139 ? 0.4725 0.8635 0.5204 0.0294 0.0781 0.0005 140 TYR C CB 7576 C CG . TYR E 139 ? 0.5302 0.9267 0.5629 0.0344 0.0714 0.0043 140 TYR C CG 7577 C CD1 . TYR E 139 ? 0.5439 0.9734 0.5618 0.0397 0.0710 -0.0013 140 TYR C CD1 7578 C CD2 . TYR E 139 ? 0.5211 0.8910 0.5541 0.0345 0.0653 0.0138 140 TYR C CD2 7579 C CE1 . TYR E 139 ? 0.5653 1.0012 0.5689 0.0452 0.0647 0.0024 140 TYR C CE1 7580 C CE2 . TYR E 139 ? 0.5133 0.8891 0.5324 0.0397 0.0590 0.0173 140 TYR C CE2 7581 C CZ . TYR E 139 ? 0.5547 0.9635 0.5590 0.0453 0.0587 0.0116 140 TYR C CZ 7582 O OH . TYR E 139 ? 0.4765 0.8926 0.4668 0.0514 0.0524 0.0150 140 TYR C OH 7583 N N . PRO E 140 ? 0.6341 1.0483 0.6337 0.0414 0.0778 0.0405 141 PRO C N 7584 C CA . PRO E 140 ? 0.5610 0.9495 0.5536 0.0436 0.0709 0.0546 141 PRO C CA 7585 C C . PRO E 140 ? 0.5166 0.8720 0.5135 0.0399 0.0708 0.0723 141 PRO C C 7586 O O . PRO E 140 ? 0.5081 0.8617 0.5116 0.0359 0.0762 0.0755 141 PRO C O 7587 C CB . PRO E 140 ? 0.6092 1.0146 0.5763 0.0520 0.0683 0.0656 141 PRO C CB 7588 C CG . PRO E 140 ? 0.6594 1.0872 0.6194 0.0528 0.0749 0.0674 141 PRO C CG 7589 C CD . PRO E 140 ? 0.6657 1.1080 0.6455 0.0472 0.0801 0.0458 141 PRO C CD 7590 N N . ARG E 141 ? 0.5627 0.8936 0.5559 0.0413 0.0645 0.0831 142 ARG C N 7591 C CA . ARG E 141 ? 0.6149 0.9135 0.6127 0.0377 0.0634 0.0988 142 ARG C CA 7592 C C . ARG E 141 ? 0.6919 0.9883 0.6752 0.0384 0.0666 0.1176 142 ARG C C 7593 O O . ARG E 141 ? 0.6650 0.9441 0.6561 0.0332 0.0692 0.1263 142 ARG C O 7594 C CB . ARG E 141 ? 0.6075 0.8835 0.6017 0.0402 0.0556 0.1059 142 ARG C CB 7595 C CG . ARG E 141 ? 0.6665 0.9098 0.6626 0.0374 0.0537 0.1231 142 ARG C CG 7596 C CD . ARG E 141 ? 0.7374 0.9600 0.7308 0.0401 0.0459 0.1282 142 ARG C CD 7597 N NE . ARG E 141 ? 0.8491 1.0435 0.8379 0.0390 0.0438 0.1472 142 ARG C NE 7598 C CZ . ARG E 141 ? 0.9603 1.1317 0.9485 0.0404 0.0375 0.1540 142 ARG C CZ 7599 N NH1 . ARG E 141 ? 1.0116 1.1852 1.0037 0.0428 0.0327 0.1437 142 ARG C NH1 7600 N NH2 . ARG E 141 ? 0.9619 1.1087 0.9460 0.0390 0.0362 0.1706 142 ARG C NH2 7601 N N . GLU E 142 ? 0.8079 1.1225 0.7701 0.0448 0.0666 0.1238 143 GLU C N 7602 C CA . GLU E 142 ? 0.8485 1.1611 0.7943 0.0458 0.0701 0.1425 143 GLU C CA 7603 C C . GLU E 142 ? 0.8322 1.1563 0.7874 0.0399 0.0782 0.1394 143 GLU C C 7604 O O . GLU E 142 ? 0.8497 1.2010 0.8105 0.0400 0.0820 0.1239 143 GLU C O 7605 C CB . GLU E 142 ? 0.9412 1.2745 0.8621 0.0550 0.0691 0.1479 143 GLU C CB 7606 C CG . GLU E 142 ? 1.0338 1.3582 0.9433 0.0623 0.0610 0.1517 143 GLU C CG 7607 C CD . GLU E 142 ? 1.0574 1.4002 0.9764 0.0641 0.0574 0.1305 143 GLU C CD 7608 O OE1 . GLU E 142 ? 1.0830 1.4578 1.0013 0.0659 0.0604 0.1168 143 GLU C OE1 7609 O OE2 . GLU E 142 ? 1.0203 1.3459 0.9473 0.0634 0.0517 0.1273 143 GLU C OE2 7610 N N . ALA E 143 ? 0.7720 1.0761 0.7294 0.0346 0.0809 0.1535 144 ALA C N 7611 C CA . ALA E 143 ? 0.6873 1.0014 0.6534 0.0287 0.0886 0.1522 144 ALA C CA 7612 C C . ALA E 143 ? 0.7374 1.0340 0.6942 0.0249 0.0914 0.1734 144 ALA C C 7613 O O . ALA E 143 ? 0.7706 1.0390 0.7241 0.0240 0.0872 0.1859 144 ALA C O 7614 C CB . ALA E 143 ? 0.6228 0.9314 0.6155 0.0229 0.0895 0.1376 144 ALA C CB 7615 N N . LYS E 144 ? 0.7727 1.0863 0.7252 0.0223 0.0988 0.1768 145 LYS C N 7616 C CA . LYS E 144 ? 0.8154 1.1154 0.7583 0.0176 0.1030 0.1964 145 LYS C CA 7617 C C . LYS E 144 ? 0.7259 1.0262 0.6878 0.0086 0.1087 0.1933 145 LYS C C 7618 O O . LYS E 144 ? 0.7803 1.1063 0.7483 0.0073 0.1145 0.1836 145 LYS C O 7619 C CB . LYS E 144 ? 0.9233 1.2423 0.8422 0.0221 0.1075 0.2061 145 LYS C CB 7620 C CG . LYS E 144 ? 1.0478 1.3559 0.9564 0.0163 0.1136 0.2254 145 LYS C CG 7621 C CD . LYS E 144 ? 1.1722 1.5008 1.0566 0.0214 0.1186 0.2344 145 LYS C CD 7622 C CE . LYS E 144 ? 1.2762 1.5861 1.1554 0.0145 0.1218 0.2458 145 LYS C CE 7623 N NZ . LYS E 144 ? 1.3592 1.6808 1.2185 0.0196 0.1238 0.2496 145 LYS C NZ 7624 N N . VAL E 145 ? 0.5952 0.8682 0.5666 0.0027 0.1069 0.2011 146 VAL C N 7625 C CA . VAL E 145 ? 0.6724 0.9453 0.6627 -0.0054 0.1116 0.1982 146 VAL C CA 7626 C C . VAL E 145 ? 0.7749 1.0355 0.7568 -0.0124 0.1162 0.2170 146 VAL C C 7627 O O . VAL E 145 ? 0.8239 1.0580 0.7976 -0.0137 0.1127 0.2307 146 VAL C O 7628 C CB . VAL E 145 ? 0.6609 0.9150 0.6729 -0.0073 0.1065 0.1897 146 VAL C CB 7629 C CG1 . VAL E 145 ? 0.6506 0.9062 0.6817 -0.0147 0.1113 0.1869 146 VAL C CG1 7630 C CG2 . VAL E 145 ? 0.6036 0.8685 0.6243 -0.0015 0.1029 0.1709 146 VAL C CG2 7631 N N . GLN E 146 ? 0.8059 1.0861 0.7898 -0.0172 0.1242 0.2170 147 GLN C N 7632 C CA . GLN E 146 ? 0.7722 1.0441 0.7483 -0.0251 0.1299 0.2338 147 GLN C CA 7633 C C . GLN E 146 ? 0.6603 0.9345 0.6580 -0.0340 0.1340 0.2296 147 GLN C C 7634 O O . GLN E 146 ? 0.6152 0.9115 0.6281 -0.0337 0.1368 0.2147 147 GLN C O 7635 C CB . GLN E 146 ? 0.8986 1.1918 0.8549 -0.0236 0.1367 0.2406 147 GLN C CB 7636 C CG . GLN E 146 ? 1.0285 1.3147 0.9610 -0.0145 0.1316 0.2459 147 GLN C CG 7637 C CD . GLN E 146 ? 1.1343 1.4280 1.0476 -0.0136 0.1353 0.2515 147 GLN C CD 7638 O OE1 . GLN E 146 ? 1.1888 1.4639 1.0828 -0.0093 0.1313 0.2597 147 GLN C OE1 7639 N NE2 . GLN E 146 ? 1.1296 1.4505 1.0486 -0.0175 0.1431 0.2466 147 GLN C NE2 7640 N N . TRP E 147 ? 0.6414 0.8916 0.6402 -0.0414 0.1337 0.2409 148 TRP C N 7641 C CA . TRP E 147 ? 0.6504 0.9021 0.6682 -0.0501 0.1372 0.2377 148 TRP C CA 7642 C C . TRP E 147 ? 0.7374 0.9924 0.7461 -0.0570 0.1427 0.2424 148 TRP C C 7643 O O . TRP E 147 ? 0.7540 0.9867 0.7447 -0.0587 0.1406 0.2513 148 TRP C O 7644 C CB . TRP E 147 ? 0.6044 0.8241 0.6320 -0.0534 0.1301 0.2395 148 TRP C CB 7645 C CG . TRP E 147 ? 0.6102 0.8272 0.6538 -0.0482 0.1251 0.2310 148 TRP C CG 7646 C CD1 . TRP E 147 ? 0.6386 0.8376 0.6761 -0.0416 0.1172 0.2311 148 TRP C CD1 7647 C CD2 . TRP E 147 ? 0.5552 0.7828 0.6228 -0.0479 0.1249 0.2155 148 TRP C CD2 7648 N NE1 . TRP E 147 ? 0.5663 0.7636 0.6224 -0.0379 0.1124 0.2169 148 TRP C NE1 7649 C CE2 . TRP E 147 ? 0.5500 0.7638 0.6244 -0.0413 0.1171 0.2074 148 TRP C CE2 7650 C CE3 . TRP E 147 ? 0.4749 0.7224 0.5584 -0.0521 0.1308 0.2079 148 TRP C CE3 7651 C CZ2 . TRP E 147 ? 0.5379 0.7553 0.6338 -0.0389 0.1153 0.1926 148 TRP C CZ2 7652 C CZ3 . TRP E 147 ? 0.4715 0.7232 0.5763 -0.0489 0.1286 0.1929 148 TRP C CZ3 7653 C CH2 . TRP E 147 ? 0.4747 0.7105 0.5852 -0.0423 0.1211 0.1857 148 TRP C CH2 7654 N N . LYS E 148 ? 0.8510 1.1334 0.8725 -0.0609 0.1499 0.2356 149 LYS C N 7655 C CA . LYS E 148 ? 1.0098 1.2979 1.0250 -0.0682 0.1559 0.2392 149 LYS C CA 7656 C C . LYS E 148 ? 0.9956 1.2880 1.0317 -0.0765 0.1587 0.2341 149 LYS C C 7657 O O . LYS E 148 ? 0.9685 1.2807 1.0250 -0.0749 0.1603 0.2237 149 LYS C O 7658 C CB . LYS E 148 ? 1.1789 1.5000 1.1857 -0.0644 0.1623 0.2354 149 LYS C CB 7659 C CG . LYS E 148 ? 1.3274 1.6473 1.3120 -0.0557 0.1596 0.2402 149 LYS C CG 7660 C CD . LYS E 148 ? 1.4600 1.8115 1.4347 -0.0525 0.1658 0.2366 149 LYS C CD 7661 C CE . LYS E 148 ? 1.5569 1.9082 1.5094 -0.0430 0.1626 0.2407 149 LYS C CE 7662 N NZ . LYS E 148 ? 1.6325 2.0130 1.5738 -0.0397 0.1680 0.2378 149 LYS C NZ 7663 N N . VAL E 149 ? 0.9745 1.2483 1.0055 -0.0851 0.1595 0.2405 150 VAL C N 7664 C CA . VAL E 149 ? 0.9677 1.2456 1.0168 -0.0935 0.1621 0.2359 150 VAL C CA 7665 C C . VAL E 149 ? 1.0756 1.3647 1.1173 -0.1013 0.1700 0.2387 150 VAL C C 7666 O O . VAL E 149 ? 1.0769 1.3451 1.1011 -0.1059 0.1708 0.2477 150 VAL C O 7667 C CB . VAL E 149 ? 0.8647 1.1097 0.9179 -0.0977 0.1556 0.2388 150 VAL C CB 7668 C CG1 . VAL E 149 ? 0.8219 1.0742 0.8938 -0.1058 0.1584 0.2333 150 VAL C CG1 7669 C CG2 . VAL E 149 ? 0.7683 1.0013 0.8284 -0.0898 0.1477 0.2363 150 VAL C CG2 7670 N N . ASP E 150 ? 1.1333 1.4545 1.1887 -0.1025 0.1760 0.2302 151 ASP C N 7671 C CA . ASP E 150 ? 1.1370 1.4752 1.1855 -0.1083 0.1841 0.2314 151 ASP C CA 7672 C C . ASP E 150 ? 1.1724 1.5097 1.1960 -0.1042 0.1858 0.2393 151 ASP C C 7673 O O . ASP E 150 ? 1.2129 1.5411 1.2213 -0.1099 0.1899 0.2474 151 ASP C O 7674 C CB . ASP E 150 ? 1.0952 1.4170 1.1446 -0.1200 0.1865 0.2360 151 ASP C CB 7675 C CG . ASP E 150 ? 1.0352 1.3672 1.1097 -0.1241 0.1864 0.2268 151 ASP C CG 7676 O OD1 . ASP E 150 ? 0.9683 1.3264 1.0592 -0.1187 0.1870 0.2163 151 ASP C OD1 7677 O OD2 . ASP E 150 ? 1.0177 1.3319 1.0953 -0.1324 0.1859 0.2292 151 ASP C OD2 7678 N N . ASN E 151 ? 1.1844 1.5311 1.2042 -0.0939 0.1828 0.2363 152 ASN C N 7679 C CA . ASN E 151 ? 1.2437 1.5929 1.2408 -0.0876 0.1833 0.2422 152 ASN C CA 7680 C C . ASN E 151 ? 1.1982 1.5111 1.1742 -0.0886 0.1796 0.2554 152 ASN C C 7681 O O . ASN E 151 ? 1.2496 1.5611 1.2050 -0.0865 0.1820 0.2625 152 ASN C O 7682 C CB . ASN E 151 ? 1.3906 1.7673 1.3817 -0.0894 0.1914 0.2405 152 ASN C CB 7683 C CG . ASN E 151 ? 1.4993 1.8961 1.4768 -0.0794 0.1917 0.2385 152 ASN C CG 7684 O OD1 . ASN E 151 ? 1.4797 1.8884 1.4635 -0.0712 0.1882 0.2302 152 ASN C OD1 7685 N ND2 . ASN E 151 ? 1.5995 2.0003 1.5582 -0.0799 0.1960 0.2455 152 ASN C ND2 7686 N N . ALA E 152 ? 1.0641 1.3476 1.0452 -0.0911 0.1737 0.2578 153 ALA C N 7687 C CA . ALA E 152 ? 0.9232 1.1704 0.8853 -0.0910 0.1693 0.2678 153 ALA C CA 7688 C C . ALA E 152 ? 0.9153 1.1467 0.8770 -0.0823 0.1601 0.2671 153 ALA C C 7689 O O . ALA E 152 ? 0.8758 1.1038 0.8553 -0.0823 0.1558 0.2613 153 ALA C O 7690 C CB . ALA E 152 ? 0.7522 0.9748 0.7172 -0.1021 0.1703 0.2708 153 ALA C CB 7691 N N . LEU E 153 ? 0.9292 1.1516 0.8704 -0.0745 0.1572 0.2728 154 LEU C N 7692 C CA . LEU E 153 ? 0.9320 1.1401 0.8704 -0.0656 0.1486 0.2724 154 LEU C CA 7693 C C . LEU E 153 ? 0.9543 1.1264 0.8962 -0.0695 0.1421 0.2737 154 LEU C C 7694 O O . LEU E 153 ? 0.9899 1.1371 0.9203 -0.0751 0.1427 0.2793 154 LEU C O 7695 C CB . LEU E 153 ? 0.9404 1.1451 0.8545 -0.0568 0.1469 0.2784 154 LEU C CB 7696 C CG . LEU E 153 ? 0.9814 1.1692 0.8891 -0.0473 0.1378 0.2786 154 LEU C CG 7697 C CD1 . LEU E 153 ? 0.9847 1.1993 0.9048 -0.0401 0.1360 0.2703 154 LEU C CD1 7698 C CD2 . LEU E 153 ? 1.0174 1.1929 0.8991 -0.0406 0.1361 0.2859 154 LEU C CD2 7699 N N . GLN E 154 ? 0.9016 1.0712 0.8592 -0.0664 0.1361 0.2679 155 GLN C N 7700 C CA . GLN E 154 ? 0.9127 1.0503 0.8746 -0.0688 0.1290 0.2673 155 GLN C CA 7701 C C . GLN E 154 ? 0.9079 1.0229 0.8538 -0.0602 0.1211 0.2701 155 GLN C C 7702 O O . GLN E 154 ? 0.8800 1.0084 0.8184 -0.0513 0.1200 0.2705 155 GLN C O 7703 C CB . GLN E 154 ? 0.9319 1.0771 0.9192 -0.0698 0.1264 0.2594 155 GLN C CB 7704 C CG . GLN E 154 ? 0.9518 1.1205 0.9569 -0.0774 0.1337 0.2550 155 GLN C CG 7705 C CD . GLN E 154 ? 0.9761 1.1303 0.9792 -0.0880 0.1367 0.2576 155 GLN C CD 7706 O OE1 . GLN E 154 ? 0.9779 1.1036 0.9785 -0.0908 0.1315 0.2583 155 GLN C OE1 7707 N NE2 . GLN E 154 ? 0.9706 1.1452 0.9742 -0.0941 0.1453 0.2581 155 GLN C NE2 7708 N N . SER E 155 ? 0.9202 1.0024 0.8606 -0.0628 0.1159 0.2708 156 SER C N 7709 C CA . SER E 155 ? 0.9469 1.0061 0.8716 -0.0551 0.1083 0.2722 156 SER C CA 7710 C C . SER E 155 ? 0.9184 0.9502 0.8494 -0.0564 0.1006 0.2671 156 SER C C 7711 O O . SER E 155 ? 0.9222 0.9404 0.8576 -0.0650 0.1018 0.2657 156 SER C O 7712 C CB . SER E 155 ? 1.0376 1.0822 0.9371 -0.0555 0.1112 0.2798 156 SER C CB 7713 O OG . SER E 155 ? 1.0951 1.1142 0.9797 -0.0491 0.1038 0.2802 156 SER C OG 7714 N N . GLY E 156 ? 0.8654 0.8908 0.7967 -0.0480 0.0927 0.2635 157 GLY C N 7715 C CA . GLY E 156 ? 0.8642 0.8639 0.7985 -0.0477 0.0847 0.2578 157 GLY C CA 7716 C C . GLY E 156 ? 0.8631 0.8648 0.8201 -0.0531 0.0837 0.2514 157 GLY C C 7717 O O . GLY E 156 ? 0.8439 0.8243 0.8021 -0.0557 0.0791 0.2468 157 GLY C O 7718 N N . ASN E 157 ? 0.8554 0.8838 0.8299 -0.0545 0.0882 0.2506 158 ASN C N 7719 C CA . ASN E 157 ? 0.7578 0.7908 0.7549 -0.0589 0.0875 0.2447 158 ASN C CA 7720 C C . ASN E 157 ? 0.6737 0.7286 0.6883 -0.0538 0.0874 0.2413 158 ASN C C 7721 O O . ASN E 157 ? 0.6536 0.7221 0.6878 -0.0574 0.0902 0.2378 158 ASN C O 7722 C CB . ASN E 157 ? 0.6496 0.6919 0.6527 -0.0691 0.0952 0.2464 158 ASN C CB 7723 C CG . ASN E 157 ? 0.6399 0.7085 0.6397 -0.0703 0.1041 0.2513 158 ASN C CG 7724 O OD1 . ASN E 157 ? 0.6117 0.6894 0.6008 -0.0635 0.1046 0.2544 158 ASN C OD1 7725 N ND2 . ASN E 157 ? 0.6217 0.7042 0.6301 -0.0788 0.1112 0.2513 158 ASN C ND2 7726 N N . SER E 158 ? 0.6745 0.7330 0.6817 -0.0454 0.0846 0.2421 159 SER C N 7727 C CA . SER E 158 ? 0.6363 0.7130 0.6581 -0.0404 0.0847 0.2387 159 SER C CA 7728 C C . SER E 158 ? 0.5980 0.6618 0.6135 -0.0320 0.0766 0.2365 159 SER C C 7729 O O . SER E 158 ? 0.5873 0.6352 0.5844 -0.0288 0.0724 0.2386 159 SER C O 7730 C CB . SER E 158 ? 0.6359 0.7448 0.6565 -0.0394 0.0936 0.2414 159 SER C CB 7731 O OG . SER E 158 ? 0.6729 0.7842 0.6727 -0.0330 0.0928 0.2457 159 SER C OG 7732 N N . GLN E 159 ? 0.5626 0.6332 0.5938 -0.0287 0.0748 0.2319 160 GLN C N 7733 C CA . GLN E 159 ? 0.6454 0.7067 0.6722 -0.0211 0.0677 0.2292 160 GLN C CA 7734 C C . GLN E 159 ? 0.6083 0.6926 0.6458 -0.0173 0.0718 0.2281 160 GLN C C 7735 O O . GLN E 159 ? 0.5777 0.6766 0.6326 -0.0201 0.0764 0.2208 160 GLN C O 7736 C CB . GLN E 159 ? 0.7055 0.7418 0.7396 -0.0212 0.0591 0.2222 160 GLN C CB 7737 C CG . GLN E 159 ? 0.7748 0.7878 0.7943 -0.0238 0.0549 0.2215 160 GLN C CG 7738 C CD . GLN E 159 ? 0.8178 0.8104 0.8426 -0.0234 0.0471 0.2128 160 GLN C CD 7739 O OE1 . GLN E 159 ? 0.8542 0.8330 0.8684 -0.0187 0.0408 0.2088 160 GLN C OE1 7740 N NE2 . GLN E 159 ? 0.8040 0.7965 0.8444 -0.0280 0.0477 0.2091 160 GLN C NE2 7741 N N . GLU E 160 ? 0.6154 0.7022 0.6420 -0.0100 0.0686 0.2286 161 GLU C N 7742 C CA . GLU E 160 ? 0.5678 0.6733 0.6024 -0.0052 0.0681 0.2118 161 GLU C CA 7743 C C . GLU E 160 ? 0.5473 0.6391 0.5900 -0.0012 0.0606 0.2048 161 GLU C C 7744 O O . GLU E 160 ? 0.5896 0.6615 0.6240 0.0008 0.0549 0.2137 161 GLU C O 7745 C CB . GLU E 160 ? 0.5728 0.6984 0.5893 0.0002 0.0700 0.2109 161 GLU C CB 7746 C CG . GLU E 160 ? 0.6924 0.8365 0.7022 -0.0032 0.0782 0.2151 161 GLU C CG 7747 C CD . GLU E 160 ? 0.8387 1.0045 0.8305 0.0029 0.0799 0.2139 161 GLU C CD 7748 O OE1 . GLU E 160 ? 0.9480 1.1115 0.9289 0.0099 0.0744 0.2132 161 GLU C OE1 7749 O OE2 . GLU E 160 ? 0.8049 0.9913 0.7931 0.0011 0.0868 0.2133 161 GLU C OE2 7750 N N . SER E 161 ? 0.5439 0.6461 0.6028 -0.0003 0.0611 0.1888 162 SER C N 7751 C CA . SER E 161 ? 0.4233 0.5166 0.4895 0.0035 0.0552 0.1801 162 SER C CA 7752 C C . SER E 161 ? 0.3950 0.5106 0.4650 0.0066 0.0573 0.1632 162 SER C C 7753 O O . SER E 161 ? 0.4811 0.6152 0.5574 0.0048 0.0635 0.1554 162 SER C O 7754 C CB . SER E 161 ? 0.4303 0.5067 0.5160 0.0004 0.0535 0.1780 162 SER C CB 7755 O OG . SER E 161 ? 0.4447 0.5101 0.5358 0.0038 0.0477 0.1716 162 SER C OG 7756 N N . VAL E 162 ? 0.3578 0.4725 0.4242 0.0110 0.0525 0.1570 163 VAL C N 7757 C CA . VAL E 162 ? 0.3740 0.5105 0.4426 0.0135 0.0544 0.1405 163 VAL C CA 7758 C C . VAL E 162 ? 0.4083 0.5356 0.4876 0.0148 0.0501 0.1296 163 VAL C C 7759 O O . VAL E 162 ? 0.4423 0.5528 0.5172 0.0166 0.0439 0.1361 163 VAL C O 7760 C CB . VAL E 162 ? 0.4892 0.6439 0.5366 0.0182 0.0540 0.1432 163 VAL C CB 7761 C CG1 . VAL E 162 ? 0.5537 0.6924 0.5852 0.0222 0.0473 0.1566 163 VAL C CG1 7762 C CG2 . VAL E 162 ? 0.4324 0.6098 0.4822 0.0207 0.0551 0.1250 163 VAL C CG2 7763 N N . THR E 163 ? 0.3647 0.5025 0.4580 0.0136 0.0537 0.1128 164 THR C N 7764 C CA . THR E 163 ? 0.3828 0.5113 0.4873 0.0138 0.0509 0.1018 164 THR C CA 7765 C C . THR E 163 ? 0.3819 0.5209 0.4752 0.0172 0.0470 0.0961 164 THR C C 7766 O O . THR E 163 ? 0.3981 0.5543 0.4754 0.0202 0.0470 0.0989 164 THR C O 7767 C CB . THR E 163 ? 0.4577 0.5928 0.5802 0.0114 0.0567 0.0852 164 THR C CB 7768 O OG1 . THR E 163 ? 0.4977 0.6598 0.6159 0.0120 0.0614 0.0740 164 THR C OG1 7769 C CG2 . THR E 163 ? 0.4880 0.6135 0.6226 0.0090 0.0601 0.0902 164 THR C CG2 7770 N N . GLU E 164 ? 0.3679 0.4967 0.4692 0.0170 0.0438 0.0884 165 GLU C N 7771 C CA . GLU E 164 ? 0.4659 0.6077 0.5608 0.0191 0.0412 0.0783 165 GLU C CA 7772 C C . GLU E 164 ? 0.4876 0.6536 0.5881 0.0175 0.0473 0.0601 165 GLU C C 7773 O O . GLU E 164 ? 0.5219 0.6900 0.6331 0.0149 0.0530 0.0551 165 GLU C O 7774 C CB . GLU E 164 ? 0.5082 0.6319 0.6119 0.0182 0.0370 0.0746 165 GLU C CB 7775 C CG . GLU E 164 ? 0.6239 0.7398 0.7479 0.0139 0.0417 0.0615 165 GLU C CG 7776 C CD . GLU E 164 ? 0.7423 0.8343 0.8756 0.0129 0.0380 0.0627 165 GLU C CD 7777 O OE1 . GLU E 164 ? 0.7737 0.8602 0.8984 0.0150 0.0318 0.0688 165 GLU C OE1 7778 O OE2 . GLU E 164 ? 0.8450 0.9240 0.9939 0.0104 0.0415 0.0577 165 GLU C OE2 7779 N N . GLN E 165 ? 0.4975 0.6826 0.5908 0.0192 0.0460 0.0496 166 GLN C N 7780 C CA . GLN E 165 ? 0.5123 0.7204 0.6118 0.0171 0.0516 0.0303 166 GLN C CA 7781 C C . GLN E 165 ? 0.5190 0.7139 0.6388 0.0122 0.0551 0.0168 166 GLN C C 7782 O O . GLN E 165 ? 0.5324 0.7077 0.6584 0.0109 0.0518 0.0176 166 GLN C O 7783 C CB . GLN E 165 ? 0.4778 0.7099 0.5660 0.0197 0.0491 0.0211 166 GLN C CB 7784 C CG . GLN E 165 ? 0.4732 0.7249 0.5411 0.0254 0.0476 0.0309 166 GLN C CG 7785 C CD . GLN E 165 ? 0.4673 0.7488 0.5256 0.0283 0.0463 0.0187 166 GLN C CD 7786 O OE1 . GLN E 165 ? 0.4151 0.6963 0.4698 0.0299 0.0412 0.0163 166 GLN C OE1 7787 N NE2 . GLN E 165 ? 0.4539 0.7627 0.5081 0.0292 0.0510 0.0104 166 GLN C NE2 7788 N N . ASP E 166 ? 0.5536 0.7586 0.6831 0.0099 0.0620 0.0046 167 ASP C N 7789 C CA . ASP E 166 ? 0.6050 0.7982 0.7527 0.0058 0.0662 -0.0096 167 ASP C CA 7790 C C . ASP E 166 ? 0.5961 0.7986 0.7447 0.0035 0.0655 -0.0256 167 ASP C C 7791 O O . ASP E 166 ? 0.5818 0.8110 0.7215 0.0042 0.0657 -0.0343 167 ASP C O 7792 C CB . ASP E 166 ? 0.6890 0.8919 0.8459 0.0047 0.0738 -0.0192 167 ASP C CB 7793 C CG . ASP E 166 ? 0.8063 0.9955 0.9811 0.0013 0.0787 -0.0341 167 ASP C CG 7794 O OD1 . ASP E 166 ? 0.8592 1.0234 1.0438 0.0013 0.0788 -0.0271 167 ASP C OD1 7795 O OD2 . ASP E 166 ? 0.8115 1.0148 0.9903 -0.0013 0.0827 -0.0528 167 ASP C OD2 7796 N N . SER E 167 ? 0.6285 0.8097 0.7879 0.0005 0.0648 -0.0296 168 SER C N 7797 C CA . SER E 167 ? 0.6395 0.8263 0.7996 -0.0026 0.0636 -0.0427 168 SER C CA 7798 C C . SER E 167 ? 0.5504 0.7579 0.7166 -0.0066 0.0700 -0.0657 168 SER C C 7799 O O . SER E 167 ? 0.5069 0.7257 0.6724 -0.0097 0.0694 -0.0784 168 SER C O 7800 C CB . SER E 167 ? 0.7056 0.8630 0.8768 -0.0054 0.0625 -0.0412 168 SER C CB 7801 O OG . SER E 167 ? 0.7699 0.9114 0.9566 -0.0079 0.0690 -0.0480 168 SER C OG 7802 N N . LYS E 168 ? 0.5486 0.7619 0.7207 -0.0067 0.0762 -0.0715 169 LYS C N 7803 C CA . LYS E 168 ? 0.5497 0.7802 0.7289 -0.0106 0.0829 -0.0941 169 LYS C CA 7804 C C . LYS E 168 ? 0.6368 0.9013 0.8059 -0.0079 0.0845 -0.0988 169 LYS C C 7805 O O . LYS E 168 ? 0.6622 0.9511 0.8287 -0.0100 0.0858 -0.1150 169 LYS C O 7806 C CB . LYS E 168 ? 0.5673 0.7775 0.7632 -0.0129 0.0899 -0.1013 169 LYS C CB 7807 C CG . LYS E 168 ? 0.6851 0.8609 0.8904 -0.0143 0.0885 -0.0942 169 LYS C CG 7808 C CD . LYS E 168 ? 0.7827 0.9416 1.0040 -0.0181 0.0961 -0.1093 169 LYS C CD 7809 C CE . LYS E 168 ? 0.8255 0.9512 1.0544 -0.0192 0.0946 -0.1018 169 LYS C CE 7810 N NZ . LYS E 168 ? 0.8277 0.9357 1.0706 -0.0234 0.1022 -0.1173 169 LYS C NZ 7811 N N . ASP E 169 ? 0.6408 0.9080 0.8041 -0.0035 0.0844 -0.0849 170 ASP C N 7812 C CA . ASP E 169 ? 0.6309 0.9299 0.7846 -0.0009 0.0866 -0.0886 170 ASP C CA 7813 C C . ASP E 169 ? 0.5430 0.8539 0.6774 0.0046 0.0806 -0.0705 170 ASP C C 7814 O O . ASP E 169 ? 0.5452 0.8821 0.6692 0.0076 0.0820 -0.0706 170 ASP C O 7815 C CB . ASP E 169 ? 0.7306 1.0288 0.8927 -0.0004 0.0930 -0.0901 170 ASP C CB 7816 C CG . ASP E 169 ? 0.8180 1.0958 0.9798 0.0022 0.0912 -0.0688 170 ASP C CG 7817 O OD1 . ASP E 169 ? 0.7754 1.0365 0.9315 0.0034 0.0851 -0.0532 170 ASP C OD1 7818 O OD2 . ASP E 169 ? 0.9224 1.2016 1.0901 0.0030 0.0960 -0.0683 170 ASP C OD2 7819 N N . SER E 170 ? 0.4903 0.7813 0.6196 0.0061 0.0742 -0.0550 171 SER C N 7820 C CA . SER E 170 ? 0.4330 0.7312 0.5433 0.0115 0.0681 -0.0380 171 SER C CA 7821 C C . SER E 170 ? 0.4760 0.7786 0.5772 0.0150 0.0695 -0.0227 171 SER C C 7822 O O . SER E 170 ? 0.5441 0.8624 0.6278 0.0198 0.0668 -0.0132 171 SER C O 7823 C CB . SER E 170 ? 0.3013 0.6302 0.3999 0.0137 0.0660 -0.0484 171 SER C CB 7824 O OG . SER E 170 ? 0.3846 0.7106 0.4907 0.0098 0.0645 -0.0619 171 SER C OG 7825 N N . THR E 171 ? 0.4319 0.7208 0.5444 0.0129 0.0739 -0.0199 172 THR C N 7826 C CA . THR E 171 ? 0.4476 0.7406 0.5531 0.0150 0.0759 -0.0059 172 THR C CA 7827 C C . THR E 171 ? 0.3675 0.6331 0.4706 0.0155 0.0719 0.0154 172 THR C C 7828 O O . THR E 171 ? 0.3102 0.5522 0.4203 0.0142 0.0682 0.0182 172 THR C O 7829 C CB . THR E 171 ? 0.5167 0.8155 0.6354 0.0126 0.0835 -0.0158 172 THR C CB 7830 O OG1 . THR E 171 ? 0.5197 0.7931 0.6564 0.0094 0.0848 -0.0201 172 THR C OG1 7831 C CG2 . THR E 171 ? 0.5223 0.8507 0.6417 0.0122 0.0879 -0.0366 172 THR C CG2 7832 N N . TYR E 172 ? 0.3750 0.6444 0.4683 0.0172 0.0729 0.0301 173 TYR C N 7833 C CA . TYR E 172 ? 0.3158 0.5606 0.4069 0.0169 0.0699 0.0498 173 TYR C CA 7834 C C . TYR E 172 ? 0.3822 0.6214 0.4847 0.0139 0.0752 0.0528 173 TYR C C 7835 O O . TYR E 172 ? 0.4365 0.6947 0.5436 0.0132 0.0812 0.0430 173 TYR C O 7836 C CB . TYR E 172 ? 0.3886 0.6384 0.4579 0.0207 0.0668 0.0667 173 TYR C CB 7837 C CG . TYR E 172 ? 0.4519 0.7053 0.5083 0.0250 0.0606 0.0670 173 TYR C CG 7838 C CD1 . TYR E 172 ? 0.4391 0.6686 0.4935 0.0260 0.0542 0.0769 173 TYR C CD1 7839 C CD2 . TYR E 172 ? 0.4009 0.6832 0.4469 0.0285 0.0611 0.0573 173 TYR C CD2 7840 C CE1 . TYR E 172 ? 0.4804 0.7145 0.5229 0.0305 0.0484 0.0771 173 TYR C CE1 7841 C CE2 . TYR E 172 ? 0.4480 0.7357 0.4820 0.0331 0.0554 0.0573 173 TYR C CE2 7842 C CZ . TYR E 172 ? 0.4882 0.7516 0.5205 0.0341 0.0490 0.0673 173 TYR C CZ 7843 O OH . TYR E 172 ? 0.4920 0.7620 0.5126 0.0391 0.0432 0.0671 173 TYR C OH 7844 N N . SER E 173 ? 0.3832 0.5977 0.4904 0.0124 0.0729 0.0660 174 SER C N 7845 C CA . SER E 173 ? 0.4694 0.6803 0.5840 0.0098 0.0772 0.0726 174 SER C CA 7846 C C . SER E 173 ? 0.5282 0.7249 0.6319 0.0092 0.0741 0.0937 174 SER C C 7847 O O . SER E 173 ? 0.5199 0.6988 0.6179 0.0104 0.0679 0.1023 174 SER C O 7848 C CB . SER E 173 ? 0.4865 0.6814 0.6221 0.0079 0.0788 0.0650 174 SER C CB 7849 O OG . SER E 173 ? 0.4740 0.6816 0.6196 0.0081 0.0831 0.0455 174 SER C OG 7850 N N . LEU E 174 ? 0.5249 0.7295 0.6255 0.0072 0.0785 0.1018 175 LEU C N 7851 C CA . LEU E 174 ? 0.4365 0.6288 0.5257 0.0057 0.0767 0.1216 175 LEU C CA 7852 C C . LEU E 174 ? 0.3933 0.5800 0.4934 0.0009 0.0807 0.1274 175 LEU C C 7853 O O . LEU E 174 ? 0.4121 0.6144 0.5225 -0.0004 0.0864 0.1182 175 LEU C O 7854 C CB . LEU E 174 ? 0.3799 0.5896 0.4478 0.0079 0.0782 0.1290 175 LEU C CB 7855 C CG . LEU E 174 ? 0.3838 0.5813 0.4362 0.0066 0.0772 0.1498 175 LEU C CG 7856 C CD1 . LEU E 174 ? 0.4496 0.6545 0.4793 0.0121 0.0746 0.1560 175 LEU C CD1 7857 C CD2 . LEU E 174 ? 0.3549 0.5623 0.4081 0.0018 0.0843 0.1559 175 LEU C CD2 7858 N N . SER E 175 ? 0.3322 0.4977 0.4303 -0.0015 0.0775 0.1423 176 SER C N 7859 C CA . SER E 175 ? 0.4146 0.5765 0.5206 -0.0067 0.0812 0.1498 176 SER C CA 7860 C C . SER E 175 ? 0.4339 0.5900 0.5232 -0.0097 0.0815 0.1680 176 SER C C 7861 O O . SER E 175 ? 0.4569 0.5986 0.5326 -0.0078 0.0765 0.1776 176 SER C O 7862 C CB . SER E 175 ? 0.4633 0.6041 0.5862 -0.0079 0.0778 0.1493 176 SER C CB 7863 O OG . SER E 175 ? 0.5457 0.6637 0.6614 -0.0072 0.0710 0.1595 176 SER C OG 7864 N N . SER E 176 ? 0.4426 0.6101 0.5327 -0.0145 0.0877 0.1725 177 SER C N 7865 C CA . SER E 176 ? 0.4464 0.6065 0.5229 -0.0190 0.0894 0.1899 177 SER C CA 7866 C C . SER E 176 ? 0.4590 0.6130 0.5494 -0.0261 0.0921 0.1941 177 SER C C 7867 O O . SER E 176 ? 0.4688 0.6397 0.5723 -0.0280 0.0973 0.1857 177 SER C O 7868 C CB . SER E 176 ? 0.5074 0.6894 0.5679 -0.0188 0.0952 0.1931 177 SER C CB 7869 O OG . SER E 176 ? 0.5426 0.7151 0.5886 -0.0234 0.0973 0.2107 177 SER C OG 7870 N N . THR E 177 ? 0.5076 0.6385 0.5954 -0.0296 0.0887 0.2065 178 THR C N 7871 C CA . THR E 177 ? 0.4697 0.5940 0.5717 -0.0363 0.0902 0.2098 178 THR C CA 7872 C C . THR E 177 ? 0.5822 0.7014 0.6724 -0.0437 0.0935 0.2231 178 THR C C 7873 O O . THR E 177 ? 0.6515 0.7472 0.7259 -0.0427 0.0865 0.2260 178 THR C O 7874 C CB . THR E 177 ? 0.4744 0.5749 0.5865 -0.0350 0.0829 0.2100 178 THR C CB 7875 O OG1 . THR E 177 ? 0.4695 0.5728 0.5928 -0.0284 0.0799 0.1959 178 THR C OG1 7876 C CG2 . THR E 177 ? 0.5023 0.5979 0.6284 -0.0411 0.0837 0.2111 178 THR C CG2 7877 N N . LEU E 178 ? 0.6118 0.7503 0.7079 -0.0494 0.1013 0.2230 179 LEU C N 7878 C CA . LEU E 178 ? 0.5697 0.7003 0.6546 -0.0561 0.1021 0.2273 179 LEU C CA 7879 C C . LEU E 178 ? 0.5947 0.7075 0.6902 -0.0605 0.0974 0.2241 179 LEU C C 7880 O O . LEU E 178 ? 0.6354 0.7585 0.7517 -0.0615 0.0991 0.2187 179 LEU C O 7881 C CB . LEU E 178 ? 0.5049 0.6646 0.5919 -0.0608 0.1124 0.2275 179 LEU C CB 7882 C CG . LEU E 178 ? 0.5693 0.7236 0.6409 -0.0677 0.1151 0.2332 179 LEU C CG 7883 C CD1 . LEU E 178 ? 0.5384 0.6824 0.5845 -0.0640 0.1136 0.2402 179 LEU C CD1 7884 C CD2 . LEU E 178 ? 0.5064 0.6904 0.5858 -0.0729 0.1248 0.2309 179 LEU C CD2 7885 N N . THR E 179 ? 0.5955 0.6830 0.6768 -0.0625 0.0918 0.2264 180 THR C N 7886 C CA . THR E 179 ? 0.6360 0.7080 0.7251 -0.0664 0.0873 0.2225 180 THR C CA 7887 C C . THR E 179 ? 0.6809 0.7511 0.7630 -0.0757 0.0918 0.2254 180 THR C C 7888 O O . THR E 179 ? 0.7392 0.7948 0.8015 -0.0776 0.0918 0.2298 180 THR C O 7889 C CB . THR E 179 ? 0.7048 0.7493 0.7851 -0.0615 0.0773 0.2198 180 THR C CB 7890 O OG1 . THR E 179 ? 0.7827 0.8286 0.8696 -0.0534 0.0733 0.2168 180 THR C OG1 7891 C CG2 . THR E 179 ? 0.6790 0.7111 0.7675 -0.0650 0.0731 0.2147 180 THR C CG2 7892 N N . LEU E 180 ? 0.6446 0.7299 0.7431 -0.0815 0.0962 0.2226 181 LEU C N 7893 C CA . LEU E 180 ? 0.6236 0.7096 0.7180 -0.0914 0.1013 0.2245 181 LEU C CA 7894 C C . LEU E 180 ? 0.6615 0.7416 0.7692 -0.0955 0.0982 0.2194 181 LEU C C 7895 O O . LEU E 180 ? 0.6177 0.6988 0.7407 -0.0905 0.0934 0.2144 181 LEU C O 7896 C CB . LEU E 180 ? 0.6284 0.7442 0.7287 -0.0957 0.1113 0.2256 181 LEU C CB 7897 C CG . LEU E 180 ? 0.6935 0.8224 0.7823 -0.0915 0.1156 0.2299 181 LEU C CG 7898 C CD1 . LEU E 180 ? 0.6915 0.8532 0.7891 -0.0954 0.1252 0.2282 181 LEU C CD1 7899 C CD2 . LEU E 180 ? 0.7041 0.8130 0.7671 -0.0924 0.1150 0.2371 181 LEU C CD2 7900 N N . SER E 181 ? 0.7063 0.7804 0.8078 -0.1047 0.1015 0.2207 182 SER C N 7901 C CA . SER E 181 ? 0.7056 0.7799 0.8204 -0.1100 0.1004 0.2160 182 SER C CA 7902 C C . SER E 181 ? 0.6718 0.7771 0.8063 -0.1136 0.1071 0.2131 182 SER C C 7903 O O . SER E 181 ? 0.6426 0.7670 0.7762 -0.1146 0.1140 0.2153 182 SER C O 7904 C CB . SER E 181 ? 0.8020 0.8585 0.9027 -0.1190 0.1023 0.2179 182 SER C CB 7905 O OG . SER E 181 ? 0.8777 0.9438 0.9700 -0.1266 0.1116 0.2226 182 SER C OG 7906 N N . LYS E 182 ? 0.6689 0.7808 0.8211 -0.1149 0.1051 0.2078 183 LYS C N 7907 C CA . LYS E 182 ? 0.7058 0.8480 0.8776 -0.1179 0.1112 0.2036 183 LYS C CA 7908 C C . LYS E 182 ? 0.7285 0.8836 0.8941 -0.1284 0.1205 0.2057 183 LYS C C 7909 O O . LYS E 182 ? 0.7712 0.9533 0.9452 -0.1292 0.1273 0.2037 183 LYS C O 7910 C CB . LYS E 182 ? 0.7255 0.8705 0.9149 -0.1183 0.1074 0.1979 183 LYS C CB 7911 C CG . LYS E 182 ? 0.7390 0.9167 0.9492 -0.1206 0.1136 0.1924 183 LYS C CG 7912 C CD . LYS E 182 ? 0.7405 0.9218 0.9661 -0.1223 0.1103 0.1874 183 LYS C CD 7913 C CE . LYS E 182 ? 0.7529 0.9686 0.9993 -0.1229 0.1162 0.1808 183 LYS C CE 7914 N NZ . LYS E 182 ? 0.7676 0.9901 1.0291 -0.1248 0.1136 0.1758 183 LYS C NZ 7915 N N . ALA E 183 ? 0.7039 0.8392 0.8542 -0.1362 0.1211 0.2091 184 ALA C N 7916 C CA . ALA E 183 ? 0.7262 0.8691 0.8690 -0.1469 0.1302 0.2115 184 ALA C CA 7917 C C . ALA E 183 ? 0.7825 0.9350 0.9137 -0.1452 0.1359 0.2166 184 ALA C C 7918 O O . ALA E 183 ? 0.7659 0.9446 0.9039 -0.1488 0.1436 0.2152 184 ALA C O 7919 C CB . ALA E 183 ? 0.6735 0.7884 0.8004 -0.1543 0.1299 0.2144 184 ALA C CB 7920 N N . ASP E 184 ? 0.8509 0.9835 0.9647 -0.1392 0.1321 0.2219 185 ASP C N 7921 C CA . ASP E 184 ? 0.9244 1.0648 1.0248 -0.1369 0.1370 0.2274 185 ASP C CA 7922 C C . ASP E 184 ? 0.8826 1.0537 0.9973 -0.1304 0.1393 0.2237 185 ASP C C 7923 O O . ASP E 184 ? 0.9075 1.0971 1.0170 -0.1308 0.1460 0.2257 185 ASP C O 7924 C CB . ASP E 184 ? 1.0356 1.1490 1.1152 -0.1304 0.1315 0.2330 185 ASP C CB 7925 C CG . ASP E 184 ? 1.1767 1.2610 1.2377 -0.1369 0.1319 0.2370 185 ASP C CG 7926 O OD1 . ASP E 184 ? 1.2099 1.2968 1.2709 -0.1473 0.1388 0.2373 185 ASP C OD1 7927 O OD2 . ASP E 184 ? 1.2167 1.2757 1.2629 -0.1314 0.1259 0.2393 185 ASP C OD2 7928 N N . TYR E 185 ? 0.7889 0.9655 0.9214 -0.1241 0.1340 0.2178 186 TYR C N 7929 C CA . TYR E 185 ? 0.7498 0.9542 0.8971 -0.1174 0.1366 0.2127 186 TYR C CA 7930 C C . TYR E 185 ? 0.7583 0.9936 0.9206 -0.1226 0.1442 0.2067 186 TYR C C 7931 O O . TYR E 185 ? 0.7170 0.9778 0.8820 -0.1203 0.1502 0.2041 186 TYR C O 7932 C CB . TYR E 185 ? 0.6996 0.8987 0.8619 -0.1087 0.1294 0.2080 186 TYR C CB 7933 C CG . TYR E 185 ? 0.6579 0.8849 0.8372 -0.1017 0.1329 0.2012 186 TYR C CG 7934 C CD1 . TYR E 185 ? 0.6198 0.8558 0.7923 -0.0957 0.1353 0.2021 186 TYR C CD1 7935 C CD2 . TYR E 185 ? 0.6200 0.8651 0.8219 -0.1005 0.1341 0.1929 186 TYR C CD2 7936 C CE1 . TYR E 185 ? 0.5962 0.8579 0.7843 -0.0890 0.1392 0.1940 186 TYR C CE1 7937 C CE2 . TYR E 185 ? 0.5885 0.8579 0.8058 -0.0930 0.1377 0.1851 186 TYR C CE2 7938 C CZ . TYR E 185 ? 0.5634 0.8407 0.7739 -0.0875 0.1403 0.1852 186 TYR C CZ 7939 O OH . TYR E 185 ? 0.5185 0.8198 0.7442 -0.0796 0.1442 0.1756 186 TYR C OH 7940 N N . GLU E 186 ? 0.8217 1.0560 0.9938 -0.1292 0.1438 0.2037 187 GLU C N 7941 C CA . GLU E 186 ? 0.9055 1.1693 1.0932 -0.1338 0.1504 0.1970 187 GLU C CA 7942 C C . GLU E 186 ? 0.9341 1.2084 1.1099 -0.1423 0.1591 0.2003 187 GLU C C 7943 O O . GLU E 186 ? 0.9343 1.2367 1.1208 -0.1451 0.1655 0.1947 187 GLU C O 7944 C CB . GLU E 186 ? 0.9582 1.2184 1.1593 -0.1384 0.1474 0.1928 187 GLU C CB 7945 C CG . GLU E 186 ? 1.0126 1.2686 1.2292 -0.1294 0.1396 0.1882 187 GLU C CG 7946 C CD . GLU E 186 ? 1.0695 1.3557 1.3069 -0.1217 0.1422 0.1794 187 GLU C CD 7947 O OE1 . GLU E 186 ? 1.1009 1.3849 1.3523 -0.1135 0.1369 0.1753 187 GLU C OE1 7948 O OE2 . GLU E 186 ? 1.0646 1.3762 1.3039 -0.1231 0.1496 0.1760 187 GLU C OE2 7949 N N . LYS E 187 ? 0.9475 1.1990 1.1010 -0.1458 0.1594 0.2092 188 LYS C N 7950 C CA . LYS E 187 ? 0.9951 1.2522 1.1354 -0.1539 0.1678 0.2138 188 LYS C CA 7951 C C . LYS E 187 ? 0.9911 1.2712 1.1265 -0.1487 0.1729 0.2140 188 LYS C C 7952 O O . LYS E 187 ? 1.0181 1.3201 1.1544 -0.1535 0.1807 0.2125 188 LYS C O 7953 C CB . LYS E 187 ? 1.0507 1.2733 1.1682 -0.1585 0.1667 0.2229 188 LYS C CB 7954 C CG . LYS E 187 ? 1.1947 1.4194 1.2959 -0.1655 0.1756 0.2291 188 LYS C CG 7955 C CD . LYS E 187 ? 1.3003 1.4922 1.3847 -0.1733 0.1765 0.2355 188 LYS C CD 7956 C CE . LYS E 187 ? 1.3623 1.5570 1.4322 -0.1808 0.1867 0.2416 188 LYS C CE 7957 N NZ . LYS E 187 ? 1.4298 1.5955 1.4874 -0.1903 0.1899 0.2460 188 LYS C NZ 7958 N N . HIS E 188 ? 0.9687 1.2448 1.0991 -0.1388 0.1685 0.2154 189 HIS C N 7959 C CA . HIS E 188 ? 0.9190 1.2156 1.0424 -0.1333 0.1728 0.2155 189 HIS C CA 7960 C C . HIS E 188 ? 0.8597 1.1872 1.0030 -0.1258 0.1739 0.2044 189 HIS C C 7961 O O . HIS E 188 ? 0.7801 1.1105 0.9425 -0.1237 0.1705 0.1975 189 HIS C O 7962 C CB . HIS E 188 ? 0.9304 1.2066 1.0349 -0.1267 0.1683 0.2230 189 HIS C CB 7963 C CG . HIS E 188 ? 0.9878 1.2337 1.0707 -0.1323 0.1677 0.2331 189 HIS C CG 7964 N ND1 . HIS E 188 ? 1.0176 1.2648 1.0821 -0.1358 0.1741 0.2397 189 HIS C ND1 7965 C CD2 . HIS E 188 ? 0.9901 1.2030 1.0666 -0.1344 0.1618 0.2368 189 HIS C CD2 7966 C CE1 . HIS E 188 ? 1.0352 1.2506 1.0829 -0.1398 0.1724 0.2472 189 HIS C CE1 7967 N NE2 . HIS E 188 ? 1.0389 1.2334 1.0935 -0.1390 0.1649 0.2451 189 HIS C NE2 7968 N N . LYS E 189 ? 0.9124 1.2626 1.0508 -0.1213 0.1786 0.2021 190 LYS C N 7969 C CA . LYS E 189 ? 0.9700 1.3510 1.1258 -0.1140 0.1809 0.1897 190 LYS C CA 7970 C C . LYS E 189 ? 0.9634 1.3474 1.1176 -0.1030 0.1781 0.1868 190 LYS C C 7971 O O . LYS E 189 ? 0.9664 1.3476 1.1353 -0.0966 0.1737 0.1809 190 LYS C O 7972 C CB . LYS E 189 ? 1.0133 1.4236 1.1677 -0.1169 0.1892 0.1854 190 LYS C CB 7973 C CG . LYS E 189 ? 1.0805 1.5061 1.2518 -0.1227 0.1924 0.1787 190 LYS C CG 7974 C CD . LYS E 189 ? 1.1089 1.5477 1.3039 -0.1149 0.1895 0.1662 190 LYS C CD 7975 C CE . LYS E 189 ? 1.1381 1.5933 1.3496 -0.1196 0.1924 0.1593 190 LYS C CE 7976 N NZ . LYS E 189 ? 1.1294 1.5964 1.3634 -0.1107 0.1894 0.1472 190 LYS C NZ 7977 N N . VAL E 190 ? 0.9488 1.3389 1.0852 -0.1007 0.1808 0.1905 191 VAL C N 7978 C CA . VAL E 190 ? 0.9089 1.3075 1.0432 -0.0905 0.1794 0.1859 191 VAL C CA 7979 C C . VAL E 190 ? 0.8654 1.2350 0.9871 -0.0875 0.1728 0.1953 191 VAL C C 7980 O O . VAL E 190 ? 0.9128 1.2616 1.0152 -0.0917 0.1714 0.2070 191 VAL C O 7981 C CB . VAL E 190 ? 0.9408 1.3642 1.0621 -0.0881 0.1853 0.1834 191 VAL C CB 7982 C CG1 . VAL E 190 ? 1.0037 1.4164 1.1035 -0.0956 0.1881 0.1963 191 VAL C CG1 7983 C CG2 . VAL E 190 ? 0.9388 1.3684 1.0540 -0.0782 0.1834 0.1795 191 VAL C CG2 7984 N N . TYR E 191 ? 0.7795 1.1471 0.9124 -0.0799 0.1687 0.1895 192 TYR C N 7985 C CA . TYR E 191 ? 0.7089 1.0513 0.8312 -0.0756 0.1621 0.1963 192 TYR C CA 7986 C C . TYR E 191 ? 0.7312 1.0830 0.8482 -0.0651 0.1599 0.1850 192 TYR C C 7987 O O . TYR E 191 ? 0.7348 1.0981 0.8668 -0.0589 0.1589 0.1690 192 TYR C O 7988 C CB . TYR E 191 ? 0.5982 0.9160 0.7347 -0.0749 0.1548 0.1948 192 TYR C CB 7989 C CG . TYR E 191 ? 0.6546 0.9572 0.7937 -0.0843 0.1540 0.2018 192 TYR C CG 7990 C CD1 . TYR E 191 ? 0.6877 1.0061 0.8435 -0.0885 0.1575 0.1950 192 TYR C CD1 7991 C CD2 . TYR E 191 ? 0.6560 0.9265 0.7791 -0.0881 0.1487 0.2123 192 TYR C CD2 7992 C CE1 . TYR E 191 ? 0.6997 1.0041 0.8568 -0.0970 0.1562 0.1987 192 TYR C CE1 7993 C CE2 . TYR E 191 ? 0.6869 0.9418 0.8111 -0.0963 0.1473 0.2151 192 TYR C CE2 7994 C CZ . TYR E 191 ? 0.7181 0.9908 0.8594 -0.1011 0.1512 0.2085 192 TYR C CZ 7995 O OH . TYR E 191 ? 0.7290 0.9883 0.8715 -0.1096 0.1503 0.2105 192 TYR C OH 7996 N N . ALA E 192 ? 0.7178 1.0650 0.8133 -0.0629 0.1592 0.1932 193 ALA C N 7997 C CA . ALA E 192 ? 0.7334 1.0941 0.8221 -0.0537 0.1579 0.1826 193 ALA C CA 7998 C C . ALA E 192 ? 0.7314 1.0694 0.8091 -0.0476 0.1499 0.1854 193 ALA C C 7999 O O . ALA E 192 ? 0.7117 1.0259 0.7783 -0.0505 0.1468 0.2000 193 ALA C O 8000 C CB . ALA E 192 ? 0.7445 1.1302 0.8171 -0.0547 0.1653 0.1869 193 ALA C CB 8001 N N . CYS E 193 ? 0.6973 1.0435 0.7783 -0.0393 0.1468 0.1708 194 CYS C N 8002 C CA . CYS E 193 ? 0.6630 0.9936 0.7338 -0.0330 0.1396 0.1709 194 CYS C CA 8003 C C . CYS E 193 ? 0.6637 1.0173 0.7201 -0.0270 0.1416 0.1652 194 CYS C C 8004 O O . CYS E 193 ? 0.6532 1.0292 0.7185 -0.0235 0.1440 0.1490 194 CYS C O 8005 C CB . CYS E 193 ? 0.6122 0.9295 0.7010 -0.0289 0.1335 0.1577 194 CYS C CB 8006 S SG . CYS E 193 ? 1.4912 1.7890 1.5698 -0.0220 0.1246 0.1570 194 CYS C SG 8007 N N . GLU E 194 ? 0.6629 1.0115 0.6968 -0.0254 0.1406 0.1784 195 GLU C N 8008 C CA . GLU E 194 ? 0.7429 1.1151 0.7608 -0.0195 0.1427 0.1748 195 GLU C CA 8009 C C . GLU E 194 ? 0.7752 1.1381 0.7834 -0.0117 0.1352 0.1721 195 GLU C C 8010 O O . GLU E 194 ? 0.8494 1.1922 0.8425 -0.0106 0.1313 0.1865 195 GLU C O 8011 C CB . GLU E 194 ? 0.8330 1.2123 0.8304 -0.0227 0.1488 0.1921 195 GLU C CB 8012 C CG . GLU E 194 ? 0.9536 1.3596 0.9332 -0.0160 0.1515 0.1897 195 GLU C CG 8013 C CD . GLU E 194 ? 1.0362 1.4530 0.9983 -0.0199 0.1594 0.2053 195 GLU C CD 8014 O OE1 . GLU E 194 ? 1.0560 1.4835 1.0278 -0.0271 0.1660 0.2055 195 GLU C OE1 8015 O OE2 . GLU E 194 ? 1.0630 1.4753 1.0022 -0.0154 0.1580 0.2162 195 GLU C OE2 8016 N N . VAL E 195 ? 0.7195 1.0976 0.7363 -0.0064 0.1333 0.1533 196 VAL C N 8017 C CA . VAL E 195 ? 0.6707 1.0419 0.6820 0.0002 0.1262 0.1476 196 VAL C CA 8018 C C . VAL E 195 ? 0.7533 1.1519 0.7482 0.0069 0.1273 0.1424 196 VAL C C 8019 O O . VAL E 195 ? 0.7150 1.1419 0.7136 0.0076 0.1325 0.1306 196 VAL C O 8020 C CB . VAL E 195 ? 0.5399 0.9051 0.5733 0.0010 0.1226 0.1293 196 VAL C CB 8021 C CG1 . VAL E 195 ? 0.4432 0.8058 0.4712 0.0072 0.1161 0.1215 196 VAL C CG1 8022 C CG2 . VAL E 195 ? 0.5184 0.8554 0.5665 -0.0041 0.1203 0.1352 196 VAL C CG2 8023 N N . THR E 196 ? 0.8491 1.2401 0.8258 0.0122 0.1224 0.1510 197 THR C N 8024 C CA . THR E 196 ? 0.8825 1.2992 0.8430 0.0197 0.1223 0.1459 197 THR C CA 8025 C C . THR E 196 ? 0.8752 1.2877 0.8374 0.0253 0.1146 0.1348 197 THR C C 8026 O O . THR E 196 ? 0.8841 1.2715 0.8417 0.0265 0.1085 0.1440 197 THR C O 8027 C CB . THR E 196 ? 0.9200 1.3366 0.8535 0.0228 0.1239 0.1665 197 THR C CB 8028 O OG1 . THR E 196 ? 0.9443 1.3628 0.8764 0.0163 0.1315 0.1777 197 THR C OG1 8029 C CG2 . THR E 196 ? 0.9491 1.3967 0.8661 0.0314 0.1242 0.1605 197 THR C CG2 8030 N N . HIS E 197 ? 0.8719 1.3097 0.8410 0.0282 0.1151 0.1146 198 HIS C N 8031 C CA . HIS E 197 ? 0.8449 1.2820 0.8173 0.0323 0.1087 0.1015 198 HIS C CA 8032 C C . HIS E 197 ? 0.8761 1.3495 0.8411 0.0379 0.1100 0.0865 198 HIS C C 8033 O O . HIS E 197 ? 0.9367 1.4358 0.9014 0.0376 0.1162 0.0806 198 HIS C O 8034 C CB . HIS E 197 ? 0.7633 1.1846 0.7612 0.0274 0.1073 0.0875 198 HIS C CB 8035 C CG . HIS E 197 ? 0.6656 1.0821 0.6681 0.0302 0.1010 0.0752 198 HIS C CG 8036 N ND1 . HIS E 197 ? 0.5942 1.0268 0.6097 0.0300 0.1021 0.0523 198 HIS C ND1 8037 C CD2 . HIS E 197 ? 0.6318 1.0293 0.6275 0.0328 0.0939 0.0823 198 HIS C CD2 8038 C CE1 . HIS E 197 ? 0.5349 0.9590 0.5518 0.0317 0.0961 0.0459 198 HIS C CE1 8039 N NE2 . HIS E 197 ? 0.5966 1.0002 0.6017 0.0337 0.0910 0.0638 198 HIS C NE2 8040 N N . GLN E 198 ? 0.8369 1.3136 0.7963 0.0431 0.1040 0.0799 199 GLN C N 8041 C CA . GLN E 198 ? 0.8465 1.3583 0.7973 0.0489 0.1042 0.0657 199 GLN C CA 8042 C C . GLN E 198 ? 0.8610 1.3948 0.8300 0.0456 0.1088 0.0417 199 GLN C C 8043 O O . GLN E 198 ? 0.8807 1.4482 0.8431 0.0490 0.1119 0.0315 199 GLN C O 8044 C CB . GLN E 198 ? 0.8477 1.3567 0.7925 0.0539 0.0965 0.0617 199 GLN C CB 8045 C CG . GLN E 198 ? 0.9084 1.4548 0.8415 0.0608 0.0958 0.0491 199 GLN C CG 8046 C CD . GLN E 198 ? 0.9608 1.5050 0.8876 0.0659 0.0880 0.0461 199 GLN C CD 8047 O OE1 . GLN E 198 ? 0.9797 1.4942 0.9052 0.0658 0.0830 0.0582 199 GLN C OE1 8048 N NE2 . GLN E 198 ? 0.9686 1.5457 0.8916 0.0702 0.0870 0.0293 199 GLN C NE2 8049 N N . GLY E 199 ? 0.8475 1.3620 0.8389 0.0393 0.1094 0.0327 200 GLY C N 8050 C CA . GLY E 199 ? 0.8649 1.3953 0.8745 0.0363 0.1137 0.0095 200 GLY C CA 8051 C C . GLY E 199 ? 0.9072 1.4471 0.9234 0.0332 0.1212 0.0098 200 GLY C C 8052 O O . GLY E 199 ? 0.8829 1.4341 0.9148 0.0310 0.1254 -0.0086 200 GLY C O 8053 N N . LEU E 200 ? 0.9659 1.5012 0.9702 0.0331 0.1233 0.0306 201 LEU C N 8054 C CA . LEU E 200 ? 0.9977 1.5435 1.0070 0.0299 0.1306 0.0327 201 LEU C CA 8055 C C . LEU E 200 ? 1.0304 1.6089 1.0206 0.0340 0.1348 0.0372 201 LEU C C 8056 O O . LEU E 200 ? 1.0376 1.6163 1.0067 0.0380 0.1326 0.0532 201 LEU C O 8057 C CB . LEU E 200 ? 0.9996 1.5159 1.0119 0.0249 0.1309 0.0522 201 LEU C CB 8058 C CG . LEU E 200 ? 0.9833 1.4675 1.0149 0.0210 0.1272 0.0492 201 LEU C CG 8059 C CD1 . LEU E 200 ? 1.0018 1.4585 1.0320 0.0169 0.1265 0.0705 201 LEU C CD1 8060 C CD2 . LEU E 200 ? 0.9371 1.4276 0.9910 0.0185 0.1314 0.0297 201 LEU C CD2 8061 N N . SER E 201 ? 1.0313 1.6373 1.0284 0.0336 0.1409 0.0231 202 SER C N 8062 C CA . SER E 201 ? 1.0711 1.7112 1.0514 0.0374 0.1457 0.0256 202 SER C CA 8063 C C . SER E 201 ? 1.0841 1.7157 1.0493 0.0360 0.1486 0.0515 202 SER C C 8064 O O . SER E 201 ? 1.0623 1.7069 1.0051 0.0408 0.1490 0.0638 202 SER C O 8065 C CB . SER E 201 ? 1.0719 1.7397 1.0654 0.0363 0.1522 0.0060 202 SER C CB 8066 O OG . SER E 201 ? 1.0909 1.7847 1.0687 0.0397 0.1539 0.0081 202 SER C OG 8067 N N . SER E 202 ? 1.0863 1.6961 1.0640 0.0293 0.1509 0.0594 203 SER C N 8068 C CA . SER E 202 ? 1.0569 1.6540 1.0233 0.0258 0.1540 0.0833 203 SER C CA 8069 C C . SER E 202 ? 0.9777 1.5389 0.9598 0.0191 0.1519 0.0903 203 SER C C 8070 O O . SER E 202 ? 0.8829 1.4375 0.8866 0.0168 0.1510 0.0753 203 SER C O 8071 C CB . SER E 202 ? 1.0525 1.6779 1.0162 0.0240 0.1628 0.0839 203 SER C CB 8072 O OG . SER E 202 ? 1.0405 1.6781 1.0262 0.0214 0.1662 0.0646 203 SER C OG 8073 N N . PRO E 203 ? 1.0092 1.5471 0.9802 0.0162 0.1512 0.1129 204 PRO C N 8074 C CA . PRO E 203 ? 1.0405 1.5437 1.0239 0.0101 0.1485 0.1213 204 PRO C CA 8075 C C . PRO E 203 ? 1.0623 1.5652 1.0705 0.0045 0.1520 0.1104 204 PRO C C 8076 O O . PRO E 203 ? 1.0537 1.5747 1.0647 0.0012 0.1590 0.1107 204 PRO C O 8077 C CB . PRO E 203 ? 1.0340 1.5251 0.9998 0.0067 0.1513 0.1461 204 PRO C CB 8078 C CG . PRO E 203 ? 1.0189 1.5247 0.9597 0.0141 0.1507 0.1524 204 PRO C CG 8079 C CD . PRO E 203 ? 1.0162 1.5586 0.9605 0.0191 0.1528 0.1320 204 PRO C CD 8080 N N . VAL E 204 ? 1.0657 1.5482 1.0914 0.0039 0.1470 0.1011 205 VAL C N 8081 C CA . VAL E 204 ? 1.0271 1.5049 1.0763 -0.0002 0.1494 0.0917 205 VAL C CA 8082 C C . VAL E 204 ? 0.9455 1.4017 0.9977 -0.0070 0.1502 0.1090 205 VAL C C 8083 O O . VAL E 204 ? 0.8718 1.3025 0.9159 -0.0082 0.1455 0.1233 205 VAL C O 8084 C CB . VAL E 204 ? 0.7153 1.1781 0.7812 0.0022 0.1440 0.0759 205 VAL C CB 8085 C CG1 . VAL E 204 ? 0.6860 1.1356 0.7741 -0.0014 0.1453 0.0713 205 VAL C CG1 8086 C CG2 . VAL E 204 ? 0.6951 1.1822 0.7626 0.0073 0.1448 0.0549 205 VAL C CG2 8087 N N . THR E 205 ? 0.9602 1.4275 1.0241 -0.0113 0.1563 0.1072 206 THR C N 8088 C CA . THR E 205 ? 0.9445 1.3948 1.0128 -0.0186 0.1577 0.1219 206 THR C CA 8089 C C . THR E 205 ? 0.8446 1.2918 0.9377 -0.0207 0.1587 0.1113 206 THR C C 8090 O O . THR E 205 ? 0.8817 1.3520 0.9840 -0.0214 0.1648 0.1025 206 THR C O 8091 C CB . THR E 205 ? 1.0159 1.4833 1.0711 -0.0235 0.1652 0.1351 206 THR C CB 8092 O OG1 . THR E 205 ? 1.0746 1.5759 1.1345 -0.0219 0.1716 0.1221 206 THR C OG1 8093 C CG2 . THR E 205 ? 1.0552 1.5195 1.0842 -0.0215 0.1641 0.1498 206 THR C CG2 8094 N N . LYS E 206 ? 0.7203 1.1394 0.8238 -0.0211 0.1528 0.1123 207 LYS C N 8095 C CA . LYS E 206 ? 0.7241 1.1371 0.8500 -0.0225 0.1533 0.1050 207 LYS C CA 8096 C C . LYS E 206 ? 0.7366 1.1377 0.8642 -0.0302 0.1545 0.1209 207 LYS C C 8097 O O . LYS E 206 ? 0.7223 1.1034 0.8381 -0.0335 0.1513 0.1364 207 LYS C O 8098 C CB . LYS E 206 ? 0.7092 1.0997 0.8463 -0.0180 0.1465 0.0958 207 LYS C CB 8099 C CG . LYS E 206 ? 0.7547 1.1576 0.8964 -0.0114 0.1464 0.0760 207 LYS C CG 8100 C CD . LYS E 206 ? 0.7708 1.1926 0.9293 -0.0097 0.1521 0.0607 207 LYS C CD 8101 C CE . LYS E 206 ? 0.7877 1.2180 0.9518 -0.0036 0.1521 0.0401 207 LYS C CE 8102 N NZ . LYS E 206 ? 0.8033 1.2481 0.9844 -0.0010 0.1574 0.0247 207 LYS C NZ 8103 N N . SER E 207 ? 0.7527 1.1667 0.8950 -0.0331 0.1594 0.1166 208 SER C N 8104 C CA . SER E 207 ? 0.7271 1.1353 0.8716 -0.0415 0.1617 0.1304 208 SER C CA 8105 C C . SER E 207 ? 0.7009 1.1147 0.8680 -0.0423 0.1636 0.1223 208 SER C C 8106 O O . SER E 207 ? 0.6570 1.0808 0.8375 -0.0358 0.1640 0.1059 208 SER C O 8107 C CB . SER E 207 ? 0.7368 1.1652 0.8662 -0.0472 0.1689 0.1407 208 SER C CB 8108 O OG . SER E 207 ? 0.7576 1.2184 0.8913 -0.0443 0.1750 0.1280 208 SER C OG 8109 N N . PHE E 208 ? 0.6850 1.0921 0.8558 -0.0500 0.1648 0.1337 209 PHE C N 8110 C CA . PHE E 208 ? 0.6681 1.0832 0.8594 -0.0513 0.1668 0.1276 209 PHE C CA 8111 C C . PHE E 208 ? 0.7025 1.1213 0.8926 -0.0623 0.1710 0.1413 209 PHE C C 8112 O O . PHE E 208 ? 0.7201 1.1247 0.8951 -0.0689 0.1705 0.1565 209 PHE C O 8113 C CB . PHE E 208 ? 0.6131 1.0042 0.8186 -0.0464 0.1597 0.1225 209 PHE C CB 8114 C CG . PHE E 208 ? 0.6629 1.0256 0.8640 -0.0517 0.1543 0.1371 209 PHE C CG 8115 C CD1 . PHE E 208 ? 0.6565 1.0160 0.8680 -0.0581 0.1548 0.1433 209 PHE C CD1 8116 C CD2 . PHE E 208 ? 0.7404 1.0805 0.9272 -0.0503 0.1487 0.1439 209 PHE C CD2 8117 C CE1 . PHE E 208 ? 0.6999 1.0336 0.9076 -0.0631 0.1499 0.1558 209 PHE C CE1 8118 C CE2 . PHE E 208 ? 0.7400 1.0538 0.9227 -0.0547 0.1437 0.1568 209 PHE C CE2 8119 C CZ . PHE E 208 ? 0.7082 1.0183 0.9013 -0.0613 0.1443 0.1626 209 PHE C CZ 8120 N N . ASN E 209 ? 0.7521 1.1901 0.9581 -0.0642 0.1754 0.1353 210 ASN C N 8121 C CA . ASN E 209 ? 0.8371 1.2795 1.0447 -0.0752 0.1792 0.1457 210 ASN C CA 8122 C C . ASN E 209 ? 0.8089 1.2377 1.0339 -0.0760 0.1749 0.1453 210 ASN C C 8123 O O . ASN E 209 ? 0.7884 1.2197 1.0296 -0.0676 0.1723 0.1328 210 ASN C O 8124 C CB . ASN E 209 ? 0.8892 1.3606 1.0985 -0.0771 0.1860 0.1380 210 ASN C CB 8125 C CG . ASN E 209 ? 0.9065 1.3928 1.0986 -0.0756 0.1901 0.1376 210 ASN C CG 8126 O OD1 . ASN E 209 ? 0.8973 1.3702 1.0698 -0.0788 0.1893 0.1492 210 ASN C OD1 8127 N ND2 . ASN E 209 ? 0.9288 1.4423 1.1276 -0.0698 0.1942 0.1236 210 ASN C ND2 8128 N N . ARG E 210 ? 0.8003 1.2085 1.0188 -0.0850 0.1722 0.1563 211 ARG C N 8129 C CA . ARG E 210 ? 0.7836 1.1775 1.0164 -0.0863 0.1674 0.1564 211 ARG C CA 8130 C C . ARG E 210 ? 0.8190 1.2366 1.0710 -0.0851 0.1704 0.1453 211 ARG C C 8131 O O . ARG E 210 ? 0.8334 1.2629 1.0838 -0.0929 0.1745 0.1456 211 ARG C O 8132 C CB . ARG E 210 ? 0.7507 1.1194 0.9704 -0.0969 0.1645 0.1686 211 ARG C CB 8133 C CG . ARG E 210 ? 0.7759 1.1298 1.0084 -0.0987 0.1590 0.1684 211 ARG C CG 8134 C CD . ARG E 210 ? 0.8971 1.2265 1.1154 -0.1092 0.1566 0.1786 211 ARG C CD 8135 N NE . ARG E 210 ? 1.0029 1.3435 1.2106 -0.1185 0.1635 0.1812 211 ARG C NE 8136 C CZ . ARG E 210 ? 1.0460 1.4051 1.2638 -0.1244 0.1680 0.1761 211 ARG C CZ 8137 N NH1 . ARG E 210 ? 1.0672 1.4369 1.3056 -0.1214 0.1660 0.1679 211 ARG C NH1 8138 N NH2 . ARG E 210 ? 1.0688 1.4362 1.2762 -0.1328 0.1746 0.1792 211 ARG C NH2 8139 O OXT . ARG E 210 ? 0.8734 1.2984 1.1429 -0.0759 0.1690 0.1356 211 ARG C OXT 8140 N N . GLN F 1 ? 0.9505 0.9342 1.0239 -0.0155 0.0205 0.0076 1 GLN D N 8141 C CA . GLN F 1 ? 0.6886 0.6631 0.7586 -0.0155 0.0210 0.0094 1 GLN D CA 8142 C C . GLN F 1 ? 0.5825 0.5536 0.6480 -0.0132 0.0191 0.0132 1 GLN D C 8143 O O . GLN F 1 ? 0.6474 0.6101 0.7097 -0.0117 0.0177 0.0153 1 GLN D O 8144 C CB . GLN F 1 ? 0.4934 0.4687 0.5629 -0.0189 0.0239 0.0083 1 GLN D CB 8145 C CG . GLN F 1 ? 0.4486 0.4139 0.5152 -0.0198 0.0251 0.0098 1 GLN D CG 8146 C CD . GLN F 1 ? 0.4454 0.4051 0.5152 -0.0200 0.0252 0.0077 1 GLN D CD 8147 O OE1 . GLN F 1 ? 0.5751 0.5255 0.6430 -0.0206 0.0258 0.0092 1 GLN D OE1 8148 N NE2 . GLN F 1 ? 0.5676 0.5324 0.6421 -0.0196 0.0249 0.0042 1 GLN D NE2 8149 N N . VAL F 2 ? 0.4061 0.3836 0.4713 -0.0132 0.0188 0.0139 2 VAL D N 8150 C CA . VAL F 2 ? 0.3688 0.3443 0.4309 -0.0106 0.0166 0.0165 2 VAL D CA 8151 C C . VAL F 2 ? 0.3178 0.2974 0.3837 -0.0088 0.0139 0.0166 2 VAL D C 8152 O O . VAL F 2 ? 0.2778 0.2648 0.3476 -0.0099 0.0145 0.0151 2 VAL D O 8153 C CB . VAL F 2 ? 0.4219 0.4014 0.4827 -0.0112 0.0178 0.0171 2 VAL D CB 8154 C CG1 . VAL F 2 ? 0.3705 0.3465 0.4275 -0.0085 0.0156 0.0192 2 VAL D CG1 8155 C CG2 . VAL F 2 ? 0.5241 0.5014 0.5827 -0.0138 0.0213 0.0166 2 VAL D CG2 8156 N N . GLN F 3 ? 0.2991 0.2740 0.3637 -0.0062 0.0110 0.0184 3 GLN D N 8157 C CA . GLN F 3 ? 0.3162 0.2947 0.3853 -0.0047 0.0086 0.0186 3 GLN D CA 8158 C C . GLN F 3 ? 0.3135 0.2898 0.3805 -0.0026 0.0056 0.0207 3 GLN D C 8159 O O . GLN F 3 ? 0.2982 0.2676 0.3599 -0.0016 0.0045 0.0218 3 GLN D O 8160 C CB . GLN F 3 ? 0.4300 0.4051 0.5025 -0.0036 0.0077 0.0176 3 GLN D CB 8161 C CG . GLN F 3 ? 0.6091 0.5912 0.6881 -0.0038 0.0082 0.0160 3 GLN D CG 8162 C CD . GLN F 3 ? 0.6202 0.6010 0.7033 -0.0040 0.0097 0.0132 3 GLN D CD 8163 O OE1 . GLN F 3 ? 0.6489 0.6274 0.7305 -0.0055 0.0120 0.0115 3 GLN D OE1 8164 N NE2 . GLN F 3 ? 0.6104 0.5926 0.6996 -0.0024 0.0087 0.0125 3 GLN D NE2 8165 N N . LEU F 4 ? 0.2235 0.2055 0.2942 -0.0022 0.0044 0.0213 4 LEU D N 8166 C CA . LEU F 4 ? 0.2240 0.2040 0.2942 -0.0003 0.0012 0.0229 4 LEU D CA 8167 C C . LEU F 4 ? 0.2636 0.2446 0.3393 0.0007 -0.0015 0.0234 4 LEU D C 8168 O O . LEU F 4 ? 0.2795 0.2664 0.3603 -0.0003 -0.0001 0.0228 4 LEU D O 8169 C CB . LEU F 4 ? 0.2639 0.2487 0.3348 -0.0007 0.0015 0.0236 4 LEU D CB 8170 C CG . LEU F 4 ? 0.3320 0.3187 0.4004 -0.0018 0.0042 0.0229 4 LEU D CG 8171 C CD1 . LEU F 4 ? 0.2352 0.2239 0.3049 -0.0007 0.0030 0.0238 4 LEU D CD1 8172 C CD2 . LEU F 4 ? 0.4075 0.3878 0.4698 -0.0020 0.0061 0.0222 4 LEU D CD2 8173 N N . GLN F 5 ? 0.2193 0.1949 0.2940 0.0027 -0.0051 0.0242 5 GLN D N 8174 C CA . GLN F 5 ? 0.2574 0.2343 0.3385 0.0036 -0.0081 0.0247 5 GLN D CA 8175 C C . GLN F 5 ? 0.2514 0.2249 0.3311 0.0050 -0.0120 0.0257 5 GLN D C 8176 O O . GLN F 5 ? 0.3060 0.2732 0.3785 0.0059 -0.0133 0.0256 5 GLN D O 8177 C CB . GLN F 5 ? 0.3741 0.3475 0.4578 0.0048 -0.0094 0.0240 5 GLN D CB 8178 C CG . GLN F 5 ? 0.3523 0.3295 0.4454 0.0053 -0.0112 0.0239 5 GLN D CG 8179 C CD . GLN F 5 ? 0.4153 0.4004 0.5141 0.0036 -0.0069 0.0226 5 GLN D CD 8180 O OE1 . GLN F 5 ? 0.5022 0.4902 0.5976 0.0019 -0.0033 0.0219 5 GLN D OE1 8181 N NE2 . GLN F 5 ? 0.4718 0.4608 0.5794 0.0039 -0.0073 0.0220 5 GLN D NE2 8182 N N . GLN F 6 ? 0.2360 0.2133 0.3221 0.0049 -0.0136 0.0265 6 GLN D N 8183 C CA . GLN F 6 ? 0.3192 0.2934 0.4048 0.0059 -0.0173 0.0270 6 GLN D CA 8184 C C . GLN F 6 ? 0.2578 0.2314 0.3501 0.0067 -0.0215 0.0273 6 GLN D C 8185 O O . GLN F 6 ? 0.2987 0.2766 0.3982 0.0061 -0.0207 0.0274 6 GLN D O 8186 C CB . GLN F 6 ? 0.4080 0.3867 0.4958 0.0049 -0.0160 0.0280 6 GLN D CB 8187 C CG . GLN F 6 ? 0.4880 0.4744 0.5833 0.0031 -0.0143 0.0295 6 GLN D CG 8188 C CD . GLN F 6 ? 0.4303 0.4208 0.5264 0.0020 -0.0130 0.0313 6 GLN D CD 8189 O OE1 . GLN F 6 ? 0.3567 0.3516 0.4512 0.0008 -0.0099 0.0315 6 GLN D OE1 8190 N NE2 . GLN F 6 ? 0.3518 0.3408 0.4510 0.0025 -0.0158 0.0325 6 GLN D NE2 8191 N N . TRP F 7 ? 0.2138 0.1822 0.3040 0.0078 -0.0258 0.0269 7 TRP D N 8192 C CA . TRP F 7 ? 0.2871 0.2548 0.3842 0.0084 -0.0306 0.0270 7 TRP D CA 8193 C C . TRP F 7 ? 0.3197 0.2837 0.4159 0.0088 -0.0344 0.0265 7 TRP D C 8194 O O . TRP F 7 ? 0.3296 0.2904 0.4184 0.0092 -0.0335 0.0257 7 TRP D O 8195 C CB . TRP F 7 ? 0.2681 0.2312 0.3637 0.0099 -0.0339 0.0264 7 TRP D CB 8196 C CG . TRP F 7 ? 0.3901 0.3448 0.4734 0.0111 -0.0360 0.0258 7 TRP D CG 8197 C CD1 . TRP F 7 ? 0.3869 0.3355 0.4653 0.0121 -0.0412 0.0250 7 TRP D CD1 8198 C CD2 . TRP F 7 ? 0.2557 0.2071 0.3297 0.0111 -0.0326 0.0259 7 TRP D CD2 8199 N NE1 . TRP F 7 ? 0.3318 0.2736 0.3974 0.0127 -0.0411 0.0247 7 TRP D NE1 8200 C CE2 . TRP F 7 ? 0.2920 0.2355 0.3551 0.0120 -0.0357 0.0255 7 TRP D CE2 8201 C CE3 . TRP F 7 ? 0.2607 0.2151 0.3343 0.0101 -0.0273 0.0261 7 TRP D CE3 8202 C CZ2 . TRP F 7 ? 0.3199 0.2584 0.3720 0.0118 -0.0332 0.0258 7 TRP D CZ2 8203 C CZ3 . TRP F 7 ? 0.3323 0.2817 0.3960 0.0100 -0.0252 0.0262 7 TRP D CZ3 8204 C CH2 . TRP F 7 ? 0.3914 0.3331 0.4446 0.0107 -0.0279 0.0263 7 TRP D CH2 8205 N N . GLY F 8 ? 0.3105 0.2754 0.4151 0.0086 -0.0383 0.0267 8 GLY D N 8206 C CA . GLY F 8 ? 0.3169 0.2784 0.4224 0.0086 -0.0423 0.0259 8 GLY D CA 8207 C C . GLY F 8 ? 0.2904 0.2567 0.4087 0.0071 -0.0437 0.0272 8 GLY D C 8208 O O . GLY F 8 ? 0.3675 0.3406 0.4930 0.0057 -0.0404 0.0290 8 GLY D O 8209 N N . ALA F 9 ? 0.3099 0.2726 0.4311 0.0070 -0.0486 0.0262 9 ALA D N 8210 C CA . ALA F 9 ? 0.4426 0.4092 0.5768 0.0051 -0.0504 0.0275 9 ALA D CA 8211 C C . ALA F 9 ? 0.4251 0.3971 0.5641 0.0030 -0.0456 0.0305 9 ALA D C 8212 O O . ALA F 9 ? 0.3726 0.3426 0.5063 0.0033 -0.0438 0.0309 9 ALA D O 8213 C CB . ALA F 9 ? 0.4669 0.4275 0.6022 0.0054 -0.0566 0.0253 9 ALA D CB 8214 N N . GLY F 10 ? 0.3980 0.3768 0.5471 0.0009 -0.0436 0.0327 10 GLY D N 8215 C CA . GLY F 10 ? 0.4195 0.4035 0.5724 -0.0016 -0.0393 0.0363 10 GLY D CA 8216 C C . GLY F 10 ? 0.5430 0.5269 0.7052 -0.0038 -0.0415 0.0384 10 GLY D C 8217 O O . GLY F 10 ? 0.6066 0.5924 0.7699 -0.0056 -0.0389 0.0417 10 GLY D O 8218 N N . LEU F 11 ? 0.4560 0.4374 0.6251 -0.0039 -0.0465 0.0366 11 LEU D N 8219 C CA . LEU F 11 ? 0.3916 0.3724 0.5707 -0.0065 -0.0488 0.0384 11 LEU D CA 8220 C C . LEU F 11 ? 0.3828 0.3547 0.5596 -0.0051 -0.0547 0.0356 11 LEU D C 8221 O O . LEU F 11 ? 0.4543 0.4221 0.6289 -0.0033 -0.0594 0.0317 11 LEU D O 8222 C CB . LEU F 11 ? 0.3000 0.2862 0.4921 -0.0086 -0.0498 0.0387 11 LEU D CB 8223 C CG . LEU F 11 ? 0.3549 0.3410 0.5585 -0.0119 -0.0516 0.0411 11 LEU D CG 8224 C CD1 . LEU F 11 ? 0.4045 0.3932 0.6079 -0.0145 -0.0466 0.0463 11 LEU D CD1 8225 C CD2 . LEU F 11 ? 0.2968 0.2890 0.5143 -0.0141 -0.0525 0.0409 11 LEU D CD2 8226 N N . LEU F 12 ? 0.3026 0.2714 0.4799 -0.0058 -0.0544 0.0374 12 LEU D N 8227 C CA . LEU F 12 ? 0.3520 0.3121 0.5267 -0.0043 -0.0591 0.0341 12 LEU D CA 8228 C C . LEU F 12 ? 0.3640 0.3218 0.5496 -0.0069 -0.0614 0.0362 12 LEU D C 8229 O O . LEU F 12 ? 0.4265 0.3884 0.6179 -0.0095 -0.0580 0.0414 12 LEU D O 8230 C CB . LEU F 12 ? 0.4577 0.4144 0.6215 -0.0017 -0.0567 0.0331 12 LEU D CB 8231 C CG . LEU F 12 ? 0.5607 0.5185 0.7128 0.0008 -0.0541 0.0311 12 LEU D CG 8232 C CD1 . LEU F 12 ? 0.5128 0.4685 0.6573 0.0026 -0.0512 0.0308 12 LEU D CD1 8233 C CD2 . LEU F 12 ? 0.6215 0.5743 0.7681 0.0025 -0.0586 0.0263 12 LEU D CD2 8234 N N . LYS F 13 ? 0.3428 0.2938 0.5307 -0.0065 -0.0672 0.0322 13 LYS D N 8235 C CA . LYS F 13 ? 0.3246 0.2714 0.5222 -0.0087 -0.0698 0.0333 13 LYS D CA 8236 C C . LYS F 13 ? 0.3607 0.3012 0.5527 -0.0064 -0.0692 0.0325 13 LYS D C 8237 O O . LYS F 13 ? 0.3706 0.3080 0.5514 -0.0031 -0.0688 0.0286 13 LYS D O 8238 C CB . LYS F 13 ? 0.3645 0.3067 0.5681 -0.0094 -0.0767 0.0288 13 LYS D CB 8239 C CG . LYS F 13 ? 0.4702 0.4192 0.6840 -0.0121 -0.0779 0.0300 13 LYS D CG 8240 C CD . LYS F 13 ? 0.5989 0.5437 0.8166 -0.0122 -0.0856 0.0247 13 LYS D CD 8241 C CE . LYS F 13 ? 0.6749 0.6253 0.9094 -0.0162 -0.0874 0.0267 13 LYS D CE 8242 N NZ . LYS F 13 ? 0.6503 0.6112 0.8891 -0.0172 -0.0820 0.0307 13 LYS D NZ 8243 N N . PRO F 14 ? 0.3774 0.3159 0.5775 -0.0083 -0.0689 0.0365 14 PRO D N 8244 C CA . PRO F 14 ? 0.3566 0.2887 0.5544 -0.0060 -0.0691 0.0357 14 PRO D CA 8245 C C . PRO F 14 ? 0.4366 0.3606 0.6285 -0.0030 -0.0730 0.0276 14 PRO D C 8246 O O . PRO F 14 ? 0.4423 0.3634 0.6369 -0.0039 -0.0776 0.0236 14 PRO D O 8247 C CB . PRO F 14 ? 0.3389 0.2685 0.5496 -0.0093 -0.0706 0.0405 14 PRO D CB 8248 C CG . PRO F 14 ? 0.4401 0.3780 0.6569 -0.0134 -0.0681 0.0463 14 PRO D CG 8249 C CD . PRO F 14 ? 0.3934 0.3358 0.6062 -0.0129 -0.0684 0.0422 14 PRO D CD 8250 N N . SER F 15 ? 0.3698 0.2908 0.5539 0.0005 -0.0711 0.0250 15 SER D N 8251 C CA . SER F 15 ? 0.4138 0.3274 0.5903 0.0037 -0.0733 0.0170 15 SER D CA 8252 C C . SER F 15 ? 0.4076 0.3229 0.5710 0.0053 -0.0727 0.0129 15 SER D C 8253 O O . SER F 15 ? 0.4247 0.3348 0.5790 0.0079 -0.0734 0.0066 15 SER D O 8254 C CB . SER F 15 ? 0.4138 0.3196 0.5976 0.0025 -0.0793 0.0127 15 SER D CB 8255 O OG . SER F 15 ? 0.4748 0.3817 0.6581 0.0007 -0.0831 0.0105 15 SER D OG 8256 N N . GLU F 16 ? 0.3699 0.2923 0.5321 0.0038 -0.0713 0.0163 16 GLU D N 8257 C CA . GLU F 16 ? 0.3945 0.3178 0.5448 0.0054 -0.0710 0.0131 16 GLU D CA 8258 C C . GLU F 16 ? 0.4008 0.3268 0.5412 0.0077 -0.0652 0.0138 16 GLU D C 8259 O O . GLU F 16 ? 0.4053 0.3334 0.5489 0.0080 -0.0617 0.0168 16 GLU D O 8260 C CB . GLU F 16 ? 0.4314 0.3606 0.5854 0.0033 -0.0721 0.0159 16 GLU D CB 8261 C CG . GLU F 16 ? 0.5112 0.4373 0.6718 0.0016 -0.0789 0.0132 16 GLU D CG 8262 C CD . GLU F 16 ? 0.6050 0.5377 0.7716 -0.0002 -0.0800 0.0158 16 GLU D CD 8263 O OE1 . GLU F 16 ? 0.6391 0.5789 0.8069 -0.0008 -0.0750 0.0203 16 GLU D OE1 8264 O OE2 . GLU F 16 ? 0.6707 0.6014 0.8411 -0.0011 -0.0860 0.0130 16 GLU D OE2 8265 N N . THR F 17 ? 0.3767 0.3024 0.5055 0.0091 -0.0646 0.0110 17 THR D N 8266 C CA . THR F 17 ? 0.3472 0.2750 0.4664 0.0110 -0.0592 0.0110 17 THR D CA 8267 C C . THR F 17 ? 0.3139 0.2489 0.4316 0.0100 -0.0561 0.0152 17 THR D C 8268 O O . THR F 17 ? 0.4136 0.3492 0.5292 0.0094 -0.0583 0.0150 17 THR D O 8269 C CB . THR F 17 ? 0.3412 0.2631 0.4470 0.0131 -0.0596 0.0049 17 THR D CB 8270 O OG1 . THR F 17 ? 0.4437 0.3589 0.5506 0.0141 -0.0620 0.0001 17 THR D OG1 8271 C CG2 . THR F 17 ? 0.3513 0.2758 0.4484 0.0146 -0.0535 0.0051 17 THR D CG2 8272 N N . LEU F 18 ? 0.3297 0.2700 0.4488 0.0100 -0.0512 0.0187 18 LEU D N 8273 C CA . LEU F 18 ? 0.3362 0.2829 0.4527 0.0092 -0.0475 0.0219 18 LEU D CA 8274 C C . LEU F 18 ? 0.3271 0.2721 0.4311 0.0109 -0.0452 0.0190 18 LEU D C 8275 O O . LEU F 18 ? 0.3545 0.2970 0.4530 0.0125 -0.0431 0.0165 18 LEU D O 8276 C CB . LEU F 18 ? 0.3379 0.2907 0.4595 0.0083 -0.0435 0.0264 18 LEU D CB 8277 C CG . LEU F 18 ? 0.3814 0.3407 0.4994 0.0076 -0.0392 0.0288 18 LEU D CG 8278 C CD1 . LEU F 18 ? 0.4239 0.3859 0.5443 0.0061 -0.0403 0.0297 18 LEU D CD1 8279 C CD2 . LEU F 18 ? 0.3589 0.3239 0.4813 0.0065 -0.0362 0.0331 18 LEU D CD2 8280 N N . SER F 19 ? 0.2480 0.1942 0.3483 0.0105 -0.0456 0.0195 19 SER D N 8281 C CA . SER F 19 ? 0.3722 0.3163 0.4606 0.0116 -0.0435 0.0177 19 SER D CA 8282 C C . SER F 19 ? 0.3886 0.3379 0.4770 0.0108 -0.0407 0.0206 19 SER D C 8283 O O . SER F 19 ? 0.3790 0.3289 0.4701 0.0103 -0.0433 0.0214 19 SER D O 8284 C CB . SER F 19 ? 0.3715 0.3086 0.4524 0.0125 -0.0482 0.0143 19 SER D CB 8285 O OG . SER F 19 ? 0.5287 0.4605 0.6078 0.0133 -0.0504 0.0106 19 SER D OG 8286 N N . LEU F 20 ? 0.3260 0.2791 0.4122 0.0107 -0.0355 0.0217 20 LEU D N 8287 C CA . LEU F 20 ? 0.2696 0.2272 0.3553 0.0098 -0.0325 0.0237 20 LEU D CA 8288 C C . LEU F 20 ? 0.3688 0.3234 0.4436 0.0105 -0.0297 0.0222 20 LEU D C 8289 O O . LEU F 20 ? 0.3638 0.3157 0.4327 0.0113 -0.0280 0.0202 20 LEU D O 8290 C CB . LEU F 20 ? 0.2499 0.2149 0.3421 0.0084 -0.0289 0.0265 20 LEU D CB 8291 C CG . LEU F 20 ? 0.2457 0.2139 0.3482 0.0071 -0.0308 0.0289 20 LEU D CG 8292 C CD1 . LEU F 20 ? 0.2204 0.1955 0.3266 0.0056 -0.0272 0.0320 20 LEU D CD1 8293 C CD2 . LEU F 20 ? 0.2406 0.2098 0.3483 0.0063 -0.0333 0.0294 20 LEU D CD2 8294 N N . THR F 21 ? 0.3053 0.2604 0.3780 0.0102 -0.0291 0.0231 21 THR D N 8295 C CA . THR F 21 ? 0.3168 0.2687 0.3797 0.0104 -0.0264 0.0224 21 THR D CA 8296 C C . THR F 21 ? 0.3335 0.2908 0.3989 0.0091 -0.0222 0.0239 21 THR D C 8297 O O . THR F 21 ? 0.2947 0.2560 0.3673 0.0085 -0.0227 0.0252 21 THR D O 8298 C CB . THR F 21 ? 0.3271 0.2722 0.3833 0.0112 -0.0305 0.0219 21 THR D CB 8299 O OG1 . THR F 21 ? 0.3310 0.2708 0.3833 0.0121 -0.0345 0.0199 21 THR D OG1 8300 C CG2 . THR F 21 ? 0.2506 0.1919 0.2963 0.0110 -0.0275 0.0221 21 THR D CG2 8301 N N . CYS F 22 ? 0.2620 0.2196 0.3219 0.0086 -0.0179 0.0234 22 CYS D N 8302 C CA . CYS F 22 ? 0.2805 0.2425 0.3420 0.0072 -0.0140 0.0243 22 CYS D CA 8303 C C . CYS F 22 ? 0.3099 0.2665 0.3631 0.0070 -0.0126 0.0241 22 CYS D C 8304 O O . CYS F 22 ? 0.3080 0.2606 0.3532 0.0071 -0.0111 0.0232 22 CYS D O 8305 C CB . CYS F 22 ? 0.3070 0.2749 0.3709 0.0063 -0.0102 0.0242 22 CYS D CB 8306 S SG . CYS F 22 ? 0.3980 0.3726 0.4650 0.0042 -0.0062 0.0248 22 CYS D SG 8307 N N . GLY F 23 ? 0.3184 0.2750 0.3739 0.0067 -0.0128 0.0249 23 GLY D N 8308 C CA . GLY F 23 ? 0.3195 0.2708 0.3683 0.0062 -0.0116 0.0252 23 GLY D CA 8309 C C . GLY F 23 ? 0.3377 0.2931 0.3877 0.0043 -0.0064 0.0248 23 GLY D C 8310 O O . GLY F 23 ? 0.3337 0.2958 0.3909 0.0035 -0.0049 0.0245 23 GLY D O 8311 N N . VAL F 24 ? 0.2431 0.1946 0.2856 0.0033 -0.0035 0.0249 24 VAL D N 8312 C CA . VAL F 24 ? 0.1853 0.1401 0.2289 0.0011 0.0012 0.0243 24 VAL D CA 8313 C C . VAL F 24 ? 0.3154 0.2639 0.3556 0.0004 0.0016 0.0253 24 VAL D C 8314 O O . VAL F 24 ? 0.2909 0.2314 0.3231 0.0008 0.0002 0.0267 24 VAL D O 8315 C CB . VAL F 24 ? 0.2557 0.2121 0.2954 0.0000 0.0050 0.0235 24 VAL D CB 8316 C CG1 . VAL F 24 ? 0.2332 0.1933 0.2751 -0.0026 0.0095 0.0228 24 VAL D CG1 8317 C CG2 . VAL F 24 ? 0.2517 0.2139 0.2961 0.0011 0.0042 0.0226 24 VAL D CG2 8318 N N . TYR F 25 ? 0.2227 0.1744 0.2689 -0.0007 0.0033 0.0244 25 TYR D N 8319 C CA . TYR F 25 ? 0.2083 0.1538 0.2535 -0.0011 0.0033 0.0251 25 TYR D CA 8320 C C . TYR F 25 ? 0.2870 0.2346 0.3332 -0.0040 0.0080 0.0238 25 TYR D C 8321 O O . TYR F 25 ? 0.3322 0.2879 0.3842 -0.0053 0.0101 0.0217 25 TYR D O 8322 C CB . TYR F 25 ? 0.2510 0.1975 0.3039 0.0006 0.0003 0.0245 25 TYR D CB 8323 C CG . TYR F 25 ? 0.2567 0.2029 0.3111 0.0031 -0.0045 0.0254 25 TYR D CG 8324 C CD1 . TYR F 25 ? 0.2641 0.2175 0.3228 0.0033 -0.0048 0.0246 25 TYR D CD1 8325 C CD2 . TYR F 25 ? 0.2625 0.2010 0.3143 0.0050 -0.0091 0.0272 25 TYR D CD2 8326 C CE1 . TYR F 25 ? 0.2906 0.2436 0.3515 0.0052 -0.0092 0.0253 25 TYR D CE1 8327 C CE2 . TYR F 25 ? 0.2602 0.1988 0.3141 0.0071 -0.0139 0.0277 25 TYR D CE2 8328 C CZ . TYR F 25 ? 0.2768 0.2227 0.3356 0.0071 -0.0138 0.0265 25 TYR D CZ 8329 O OH . TYR F 25 ? 0.2828 0.2288 0.3446 0.0087 -0.0185 0.0269 25 TYR D OH 8330 N N . GLY F 26 ? 0.3370 0.2773 0.3775 -0.0054 0.0095 0.0252 26 GLY D N 8331 C CA . GLY F 26 ? 0.3627 0.3038 0.4049 -0.0084 0.0137 0.0240 26 GLY D CA 8332 C C . GLY F 26 ? 0.3992 0.3410 0.4363 -0.0109 0.0178 0.0244 26 GLY D C 8333 O O . GLY F 26 ? 0.4166 0.3571 0.4539 -0.0138 0.0213 0.0240 26 GLY D O 8334 N N . GLU F 27 ? 0.3587 0.3027 0.3922 -0.0098 0.0176 0.0247 27 GLU D N 8335 C CA . GLU F 27 ? 0.3743 0.3190 0.4033 -0.0118 0.0218 0.0247 27 GLU D CA 8336 C C . GLU F 27 ? 0.3247 0.2675 0.3471 -0.0098 0.0205 0.0254 27 GLU D C 8337 O O . GLU F 27 ? 0.3040 0.2465 0.3270 -0.0070 0.0160 0.0256 27 GLU D O 8338 C CB . GLU F 27 ? 0.3932 0.3483 0.4300 -0.0136 0.0249 0.0221 27 GLU D CB 8339 C CG . GLU F 27 ? 0.5474 0.5105 0.5890 -0.0114 0.0229 0.0208 27 GLU D CG 8340 C CD . GLU F 27 ? 0.6248 0.5979 0.6738 -0.0131 0.0253 0.0188 27 GLU D CD 8341 O OE1 . GLU F 27 ? 0.7588 0.7332 0.8098 -0.0162 0.0284 0.0178 27 GLU D OE1 8342 O OE2 . GLU F 27 ? 0.3846 0.3641 0.4378 -0.0116 0.0237 0.0182 27 GLU D OE2 8343 N N . SER F 28 ? 0.3499 0.2915 0.3663 -0.0113 0.0244 0.0255 28 SER D N 8344 C CA . SER F 28 ? 0.3691 0.3088 0.3787 -0.0095 0.0238 0.0253 28 SER D CA 8345 C C . SER F 28 ? 0.3764 0.3255 0.3939 -0.0080 0.0240 0.0225 28 SER D C 8346 O O . SER F 28 ? 0.3308 0.2875 0.3579 -0.0085 0.0243 0.0214 28 SER D O 8347 C CB . SER F 28 ? 0.4236 0.3585 0.4234 -0.0118 0.0287 0.0261 28 SER D CB 8348 O OG . SER F 28 ? 0.4516 0.3943 0.4565 -0.0134 0.0342 0.0236 28 SER D OG 8349 N N . LEU F 29 ? 0.3419 0.2899 0.3550 -0.0062 0.0236 0.0215 29 LEU D N 8350 C CA . LEU F 29 ? 0.3254 0.2811 0.3462 -0.0045 0.0235 0.0191 29 LEU D CA 8351 C C . LEU F 29 ? 0.3389 0.3006 0.3632 -0.0061 0.0294 0.0170 29 LEU D C 8352 O O . LEU F 29 ? 0.3428 0.3120 0.3758 -0.0049 0.0295 0.0153 29 LEU D O 8353 C CB . LEU F 29 ? 0.3154 0.2672 0.3313 -0.0018 0.0203 0.0181 29 LEU D CB 8354 C CG . LEU F 29 ? 0.4213 0.3677 0.4348 -0.0001 0.0140 0.0198 29 LEU D CG 8355 C CD1 . LEU F 29 ? 0.4235 0.3660 0.4319 0.0021 0.0109 0.0183 29 LEU D CD1 8356 C CD2 . LEU F 29 ? 0.4080 0.3604 0.4326 0.0005 0.0110 0.0205 29 LEU D CD2 8357 N N . SER F 30 ? 0.3027 0.2611 0.3207 -0.0088 0.0342 0.0175 30 SER D N 8358 C CA . SER F 30 ? 0.3341 0.2981 0.3555 -0.0105 0.0405 0.0154 30 SER D CA 8359 C C . SER F 30 ? 0.3631 0.3371 0.3978 -0.0117 0.0414 0.0145 30 SER D C 8360 O O . SER F 30 ? 0.3640 0.3385 0.4018 -0.0132 0.0396 0.0158 30 SER D O 8361 C CB . SER F 30 ? 0.3393 0.2974 0.3512 -0.0139 0.0457 0.0168 30 SER D CB 8362 O OG . SER F 30 ? 0.4701 0.4198 0.4687 -0.0131 0.0455 0.0173 30 SER D OG 8363 N N . GLY F 31 ? 0.3094 0.2912 0.3519 -0.0110 0.0438 0.0119 31 GLY D N 8364 C CA . GLY F 31 ? 0.3000 0.2916 0.3546 -0.0125 0.0450 0.0109 31 GLY D CA 8365 C C . GLY F 31 ? 0.3294 0.3274 0.3932 -0.0103 0.0396 0.0110 31 GLY D C 8366 O O . GLY F 31 ? 0.2763 0.2827 0.3498 -0.0114 0.0394 0.0104 31 GLY D O 8367 N N . HIS F 32 ? 0.2585 0.2526 0.3192 -0.0074 0.0349 0.0120 32 HIS D N 8368 C CA . HIS F 32 ? 0.2195 0.2189 0.2878 -0.0056 0.0299 0.0128 32 HIS D CA 8369 C C . HIS F 32 ? 0.2712 0.2695 0.3406 -0.0020 0.0272 0.0123 32 HIS D C 8370 O O . HIS F 32 ? 0.2345 0.2261 0.2965 -0.0007 0.0279 0.0114 32 HIS D O 8371 C CB . HIS F 32 ? 0.1764 0.1730 0.2420 -0.0063 0.0263 0.0149 32 HIS D CB 8372 C CG . HIS F 32 ? 0.2097 0.2077 0.2760 -0.0097 0.0282 0.0149 32 HIS D CG 8373 N ND1 . HIS F 32 ? 0.2614 0.2523 0.3204 -0.0116 0.0308 0.0154 32 HIS D ND1 8374 C CD2 . HIS F 32 ? 0.2462 0.2514 0.3192 -0.0116 0.0277 0.0145 32 HIS D CD2 8375 C CE1 . HIS F 32 ? 0.2446 0.2382 0.3069 -0.0146 0.0320 0.0150 32 HIS D CE1 8376 N NE2 . HIS F 32 ? 0.2609 0.2632 0.3313 -0.0147 0.0302 0.0141 32 HIS D NE2 8377 N N . TYR F 33 ? 0.2714 0.2761 0.3499 -0.0005 0.0239 0.0129 33 TYR D N 8378 C CA . TYR F 33 ? 0.1546 0.1576 0.2350 0.0026 0.0201 0.0133 33 TYR D CA 8379 C C . TYR F 33 ? 0.3355 0.3344 0.4120 0.0026 0.0158 0.0158 33 TYR D C 8380 O O . TYR F 33 ? 0.3291 0.3307 0.4064 0.0006 0.0148 0.0174 33 TYR D O 8381 C CB . TYR F 33 ? 0.2388 0.2497 0.3307 0.0041 0.0180 0.0137 33 TYR D CB 8382 C CG . TYR F 33 ? 0.2832 0.2981 0.3814 0.0052 0.0216 0.0107 33 TYR D CG 8383 C CD1 . TYR F 33 ? 0.3075 0.3197 0.4076 0.0084 0.0216 0.0086 33 TYR D CD1 8384 C CD2 . TYR F 33 ? 0.3226 0.3442 0.4259 0.0031 0.0250 0.0096 33 TYR D CD2 8385 C CE1 . TYR F 33 ? 0.3749 0.3912 0.4819 0.0098 0.0253 0.0054 33 TYR D CE1 8386 C CE2 . TYR F 33 ? 0.3568 0.3830 0.4674 0.0043 0.0286 0.0067 33 TYR D CE2 8387 C CZ . TYR F 33 ? 0.3556 0.3792 0.4682 0.0078 0.0290 0.0045 33 TYR D CZ 8388 O OH . TYR F 33 ? 0.4258 0.4543 0.5467 0.0091 0.0331 0.0009 33 TYR D OH 8389 N N . TRP F 34 ? 0.2357 0.2286 0.3087 0.0047 0.0133 0.0157 34 TRP D N 8390 C CA . TRP F 34 ? 0.2250 0.2145 0.2959 0.0048 0.0092 0.0179 34 TRP D CA 8391 C C . TRP F 34 ? 0.2944 0.2852 0.3716 0.0068 0.0052 0.0189 34 TRP D C 8392 O O . TRP F 34 ? 0.3324 0.3217 0.4115 0.0089 0.0052 0.0172 34 TRP D O 8393 C CB . TRP F 34 ? 0.2161 0.1969 0.2772 0.0050 0.0091 0.0172 34 TRP D CB 8394 C CG . TRP F 34 ? 0.2862 0.2654 0.3415 0.0028 0.0129 0.0169 34 TRP D CG 8395 C CD1 . TRP F 34 ? 0.3182 0.2955 0.3685 0.0020 0.0173 0.0151 34 TRP D CD1 8396 C CD2 . TRP F 34 ? 0.2151 0.1947 0.2697 0.0007 0.0129 0.0184 34 TRP D CD2 8397 N NE1 . TRP F 34 ? 0.2488 0.2246 0.2951 -0.0005 0.0199 0.0160 34 TRP D NE1 8398 C CE2 . TRP F 34 ? 0.2482 0.2252 0.2974 -0.0012 0.0171 0.0178 34 TRP D CE2 8399 C CE3 . TRP F 34 ? 0.2132 0.1949 0.2714 0.0002 0.0102 0.0200 34 TRP D CE3 8400 C CZ2 . TRP F 34 ? 0.2266 0.2023 0.2743 -0.0034 0.0181 0.0187 34 TRP D CZ2 8401 C CZ3 . TRP F 34 ? 0.2458 0.2267 0.3025 -0.0018 0.0115 0.0204 34 TRP D CZ3 8402 C CH2 . TRP F 34 ? 0.2609 0.2386 0.3126 -0.0035 0.0152 0.0197 34 TRP D CH2 8403 N N . SER F 35 ? 0.2372 0.2305 0.3178 0.0061 0.0022 0.0217 35 SER D N 8404 C CA . SER F 35 ? 0.2858 0.2816 0.3735 0.0073 -0.0012 0.0238 35 SER D CA 8405 C C . SER F 35 ? 0.2463 0.2396 0.3342 0.0070 -0.0047 0.0260 35 SER D C 8406 O O . SER F 35 ? 0.2495 0.2419 0.3339 0.0056 -0.0046 0.0265 35 SER D O 8407 C CB . SER F 35 ? 0.2631 0.2672 0.3569 0.0061 -0.0012 0.0257 35 SER D CB 8408 O OG . SER F 35 ? 0.3628 0.3688 0.4632 0.0073 -0.0047 0.0283 35 SER D OG 8409 N N . TRP F 36 ? 0.1947 0.1872 0.2878 0.0084 -0.0078 0.0274 36 TRP D N 8410 C CA . TRP F 36 ? 0.2488 0.2404 0.3443 0.0077 -0.0110 0.0301 36 TRP D CA 8411 C C . TRP F 36 ? 0.2424 0.2393 0.3447 0.0070 -0.0128 0.0340 36 TRP D C 8412 O O . TRP F 36 ? 0.2178 0.2162 0.3246 0.0085 -0.0134 0.0342 36 TRP D O 8413 C CB . TRP F 36 ? 0.2366 0.2211 0.3318 0.0093 -0.0137 0.0287 36 TRP D CB 8414 C CG . TRP F 36 ? 0.2215 0.2005 0.3091 0.0095 -0.0132 0.0259 36 TRP D CG 8415 C CD1 . TRP F 36 ? 0.2204 0.1950 0.3017 0.0107 -0.0115 0.0224 36 TRP D CD1 8416 C CD2 . TRP F 36 ? 0.2780 0.2553 0.3636 0.0084 -0.0146 0.0266 36 TRP D CD2 8417 N NE1 . TRP F 36 ? 0.2742 0.2440 0.3487 0.0104 -0.0122 0.0215 36 TRP D NE1 8418 C CE2 . TRP F 36 ? 0.2348 0.2063 0.3125 0.0092 -0.0143 0.0239 36 TRP D CE2 8419 C CE3 . TRP F 36 ? 0.2834 0.2639 0.3733 0.0069 -0.0159 0.0292 36 TRP D CE3 8420 C CZ2 . TRP F 36 ? 0.2704 0.2388 0.3452 0.0088 -0.0161 0.0240 36 TRP D CZ2 8421 C CZ3 . TRP F 36 ? 0.2254 0.2034 0.3133 0.0066 -0.0170 0.0287 36 TRP D CZ3 8422 C CH2 . TRP F 36 ? 0.1914 0.1634 0.2722 0.0077 -0.0175 0.0263 36 TRP D CH2 8423 N N . VAL F 37 ? 0.2289 0.2287 0.3319 0.0049 -0.0136 0.0370 37 VAL D N 8424 C CA . VAL F 37 ? 0.2342 0.2389 0.3418 0.0036 -0.0153 0.0415 37 VAL D CA 8425 C C . VAL F 37 ? 0.3188 0.3225 0.4283 0.0020 -0.0169 0.0442 37 VAL D C 8426 O O . VAL F 37 ? 0.3496 0.3527 0.4565 0.0010 -0.0157 0.0429 37 VAL D O 8427 C CB . VAL F 37 ? 0.2761 0.2881 0.3813 0.0014 -0.0133 0.0423 37 VAL D CB 8428 C CG1 . VAL F 37 ? 0.2701 0.2869 0.3778 -0.0005 -0.0153 0.0474 37 VAL D CG1 8429 C CG2 . VAL F 37 ? 0.1341 0.1480 0.2393 0.0026 -0.0118 0.0398 37 VAL D CG2 8430 N N . ARG F 38 ? 0.2766 0.2801 0.3913 0.0018 -0.0196 0.0482 38 ARG D N 8431 C CA . ARG F 38 ? 0.3049 0.3082 0.4222 -0.0003 -0.0207 0.0512 38 ARG D CA 8432 C C . ARG F 38 ? 0.3522 0.3611 0.4705 -0.0030 -0.0209 0.0567 38 ARG D C 8433 O O . ARG F 38 ? 0.3081 0.3200 0.4264 -0.0028 -0.0218 0.0589 38 ARG D O 8434 C CB . ARG F 38 ? 0.2999 0.2964 0.4225 0.0011 -0.0239 0.0511 38 ARG D CB 8435 C CG . ARG F 38 ? 0.2640 0.2589 0.3923 0.0021 -0.0268 0.0544 38 ARG D CG 8436 C CD . ARG F 38 ? 0.3041 0.2915 0.4376 0.0036 -0.0297 0.0531 38 ARG D CD 8437 N NE . ARG F 38 ? 0.3556 0.3404 0.4957 0.0049 -0.0327 0.0560 38 ARG D NE 8438 C CZ . ARG F 38 ? 0.3900 0.3680 0.5360 0.0061 -0.0357 0.0552 38 ARG D CZ 8439 N NH1 . ARG F 38 ? 0.3399 0.3134 0.4854 0.0059 -0.0363 0.0517 38 ARG D NH1 8440 N NH2 . ARG F 38 ? 0.3797 0.3550 0.5323 0.0074 -0.0384 0.0579 38 ARG D NH2 8441 N N . GLN F 39 ? 0.2911 0.3015 0.4103 -0.0057 -0.0202 0.0591 39 GLN D N 8442 C CA . GLN F 39 ? 0.2885 0.3043 0.4069 -0.0090 -0.0197 0.0644 39 GLN D CA 8443 C C . GLN F 39 ? 0.3365 0.3510 0.4599 -0.0112 -0.0203 0.0681 39 GLN D C 8444 O O . GLN F 39 ? 0.3022 0.3183 0.4259 -0.0128 -0.0179 0.0667 39 GLN D O 8445 C CB . GLN F 39 ? 0.3086 0.3310 0.4207 -0.0111 -0.0158 0.0627 39 GLN D CB 8446 C CG . GLN F 39 ? 0.2846 0.3132 0.3935 -0.0147 -0.0149 0.0677 39 GLN D CG 8447 C CD . GLN F 39 ? 0.3613 0.3959 0.4634 -0.0165 -0.0112 0.0647 39 GLN D CD 8448 O OE1 . GLN F 39 ? 0.3390 0.3733 0.4405 -0.0160 -0.0084 0.0598 39 GLN D OE1 8449 N NE2 . GLN F 39 ? 0.2639 0.3037 0.3610 -0.0187 -0.0115 0.0677 39 GLN D NE2 8450 N N . PRO F 40 ? 0.3691 0.3803 0.4973 -0.0112 -0.0237 0.0728 40 PRO D N 8451 C CA . PRO F 40 ? 0.4189 0.4285 0.5524 -0.0139 -0.0244 0.0770 40 PRO D CA 8452 C C . PRO F 40 ? 0.5071 0.5237 0.6369 -0.0183 -0.0208 0.0807 40 PRO D C 8453 O O . PRO F 40 ? 0.4564 0.4783 0.5796 -0.0193 -0.0195 0.0820 40 PRO D O 8454 C CB . PRO F 40 ? 0.4471 0.4522 0.5854 -0.0130 -0.0287 0.0819 40 PRO D CB 8455 C CG . PRO F 40 ? 0.4663 0.4689 0.6040 -0.0087 -0.0304 0.0779 40 PRO D CG 8456 C CD . PRO F 40 ? 0.3238 0.3325 0.4539 -0.0087 -0.0271 0.0743 40 PRO D CD 8457 N N . PRO F 41 ? 0.6480 0.6653 0.7822 -0.0210 -0.0191 0.0819 41 PRO D N 8458 C CA . PRO F 41 ? 0.7128 0.7371 0.8438 -0.0254 -0.0147 0.0846 41 PRO D CA 8459 C C . PRO F 41 ? 0.7008 0.7280 0.8267 -0.0283 -0.0151 0.0918 41 PRO D C 8460 O O . PRO F 41 ? 0.6717 0.6948 0.8016 -0.0291 -0.0183 0.0977 41 PRO D O 8461 C CB . PRO F 41 ? 0.7192 0.7422 0.8590 -0.0275 -0.0140 0.0855 41 PRO D CB 8462 C CG . PRO F 41 ? 0.7182 0.7345 0.8639 -0.0236 -0.0175 0.0805 41 PRO D CG 8463 C CD . PRO F 41 ? 0.6543 0.6657 0.7972 -0.0202 -0.0214 0.0806 41 PRO D CD 8464 N N . GLY F 42 ? 0.6439 0.6776 0.7609 -0.0299 -0.0121 0.0914 42 GLY D N 8465 C CA . GLY F 42 ? 0.7161 0.7530 0.8263 -0.0329 -0.0128 0.0981 42 GLY D CA 8466 C C . GLY F 42 ? 0.7482 0.7817 0.8580 -0.0301 -0.0185 0.1008 42 GLY D C 8467 O O . GLY F 42 ? 0.8465 0.8801 0.9536 -0.0320 -0.0212 0.1081 42 GLY D O 8468 N N . LYS F 43 ? 0.6753 0.7057 0.7879 -0.0255 -0.0204 0.0952 43 LYS D N 8469 C CA . LYS F 43 ? 0.6456 0.6736 0.7591 -0.0224 -0.0252 0.0965 43 LYS D CA 8470 C C . LYS F 43 ? 0.6045 0.6353 0.7144 -0.0197 -0.0242 0.0898 43 LYS D C 8471 O O . LYS F 43 ? 0.5547 0.5887 0.6606 -0.0205 -0.0200 0.0847 43 LYS D O 8472 C CB . LYS F 43 ? 0.6540 0.6736 0.7773 -0.0192 -0.0292 0.0971 43 LYS D CB 8473 C CG . LYS F 43 ? 0.7390 0.7550 0.8669 -0.0218 -0.0314 0.1049 43 LYS D CG 8474 C CD . LYS F 43 ? 0.8807 0.8890 1.0172 -0.0183 -0.0369 0.1068 43 LYS D CD 8475 C CE . LYS F 43 ? 0.9399 0.9415 1.0842 -0.0157 -0.0372 0.1013 43 LYS D CE 8476 N NZ . LYS F 43 ? 0.9597 0.9585 1.1088 -0.0191 -0.0365 0.1045 43 LYS D NZ 8477 N N . ARG F 44 ? 0.5699 0.5993 0.6819 -0.0166 -0.0280 0.0899 44 ARG D N 8478 C CA . ARG F 44 ? 0.5052 0.5381 0.6140 -0.0148 -0.0270 0.0844 44 ARG D CA 8479 C C . ARG F 44 ? 0.4437 0.4721 0.5567 -0.0111 -0.0258 0.0775 44 ARG D C 8480 O O . ARG F 44 ? 0.3534 0.3755 0.4723 -0.0093 -0.0270 0.0771 44 ARG D O 8481 C CB . ARG F 44 ? 0.4514 0.4865 0.5611 -0.0135 -0.0315 0.0877 44 ARG D CB 8482 C CG . ARG F 44 ? 0.3892 0.4186 0.5085 -0.0092 -0.0353 0.0879 44 ARG D CG 8483 C CD . ARG F 44 ? 0.4231 0.4556 0.5445 -0.0080 -0.0400 0.0915 44 ARG D CD 8484 N NE . ARG F 44 ? 0.4964 0.5297 0.6158 -0.0107 -0.0436 0.1003 44 ARG D NE 8485 C CZ . ARG F 44 ? 0.4699 0.5060 0.5903 -0.0103 -0.0487 0.1053 44 ARG D CZ 8486 N NH1 . ARG F 44 ? 0.4453 0.4843 0.5699 -0.0072 -0.0506 0.1018 44 ARG D NH1 8487 N NH2 . ARG F 44 ? 0.4931 0.5291 0.6104 -0.0132 -0.0520 0.1139 44 ARG D NH2 8488 N N . LEU F 45 ? 0.4659 0.4972 0.5753 -0.0103 -0.0235 0.0721 45 LEU D N 8489 C CA . LEU F 45 ? 0.3514 0.3786 0.4630 -0.0071 -0.0222 0.0660 45 LEU D CA 8490 C C . LEU F 45 ? 0.3060 0.3295 0.4242 -0.0035 -0.0254 0.0660 45 LEU D C 8491 O O . LEU F 45 ? 0.2918 0.3178 0.4124 -0.0030 -0.0283 0.0693 45 LEU D O 8492 C CB . LEU F 45 ? 0.3542 0.3854 0.4606 -0.0075 -0.0190 0.0611 45 LEU D CB 8493 C CG . LEU F 45 ? 0.3731 0.4079 0.4736 -0.0108 -0.0156 0.0601 45 LEU D CG 8494 C CD1 . LEU F 45 ? 0.3133 0.3543 0.4086 -0.0125 -0.0143 0.0584 45 LEU D CD1 8495 C CD2 . LEU F 45 ? 0.3986 0.4292 0.4992 -0.0098 -0.0128 0.0555 45 LEU D CD2 8496 N N . GLU F 46 ? 0.3540 0.3713 0.4750 -0.0009 -0.0249 0.0620 46 GLU D N 8497 C CA . GLU F 46 ? 0.3035 0.3169 0.4309 0.0028 -0.0271 0.0607 46 GLU D CA 8498 C C . GLU F 46 ? 0.2863 0.2966 0.4118 0.0051 -0.0243 0.0539 46 GLU D C 8499 O O . GLU F 46 ? 0.3254 0.3319 0.4479 0.0049 -0.0228 0.0510 46 GLU D O 8500 C CB . GLU F 46 ? 0.3134 0.3206 0.4468 0.0035 -0.0303 0.0637 46 GLU D CB 8501 C CG . GLU F 46 ? 0.5216 0.5231 0.6615 0.0076 -0.0319 0.0606 46 GLU D CG 8502 C CD . GLU F 46 ? 0.6944 0.6885 0.8398 0.0080 -0.0347 0.0621 46 GLU D CD 8503 O OE1 . GLU F 46 ? 0.6451 0.6387 0.7893 0.0051 -0.0349 0.0653 46 GLU D OE1 8504 O OE2 . GLU F 46 ? 0.7511 0.7402 0.9026 0.0113 -0.0364 0.0598 46 GLU D OE2 8505 N N . TRP F 47 ? 0.1592 0.1716 0.2869 0.0072 -0.0238 0.0514 47 TRP D N 8506 C CA . TRP F 47 ? 0.2184 0.2285 0.3440 0.0090 -0.0207 0.0453 47 TRP D CA 8507 C C . TRP F 47 ? 0.2938 0.2963 0.4224 0.0118 -0.0215 0.0425 47 TRP D C 8508 O O . TRP F 47 ? 0.2182 0.2187 0.3541 0.0140 -0.0242 0.0438 47 TRP D O 8509 C CB . TRP F 47 ? 0.2543 0.2699 0.3827 0.0100 -0.0196 0.0438 47 TRP D CB 8510 C CG . TRP F 47 ? 0.2634 0.2773 0.3909 0.0119 -0.0160 0.0379 47 TRP D CG 8511 C CD1 . TRP F 47 ? 0.2754 0.2895 0.3959 0.0105 -0.0120 0.0345 47 TRP D CD1 8512 C CD2 . TRP F 47 ? 0.3231 0.3348 0.4567 0.0153 -0.0157 0.0349 47 TRP D CD2 8513 N NE1 . TRP F 47 ? 0.3229 0.3350 0.4439 0.0125 -0.0090 0.0299 47 TRP D NE1 8514 C CE2 . TRP F 47 ? 0.3099 0.3209 0.4389 0.0155 -0.0109 0.0297 47 TRP D CE2 8515 C CE3 . TRP F 47 ? 0.3649 0.3749 0.5077 0.0182 -0.0188 0.0359 47 TRP D CE3 8516 C CZ2 . TRP F 47 ? 0.2900 0.2993 0.4228 0.0184 -0.0087 0.0252 47 TRP D CZ2 8517 C CZ3 . TRP F 47 ? 0.3411 0.3493 0.4887 0.0214 -0.0167 0.0311 47 TRP D CZ3 8518 C CH2 . TRP F 47 ? 0.2616 0.2698 0.4039 0.0214 -0.0115 0.0256 47 TRP D CH2 8519 N N . ILE F 48 ? 0.2802 0.2781 0.4030 0.0119 -0.0195 0.0386 48 ILE D N 8520 C CA . ILE F 48 ? 0.2612 0.2515 0.3849 0.0141 -0.0204 0.0354 48 ILE D CA 8521 C C . ILE F 48 ? 0.2517 0.2406 0.3741 0.0165 -0.0175 0.0299 48 ILE D C 8522 O O . ILE F 48 ? 0.3161 0.3011 0.4431 0.0192 -0.0183 0.0274 48 ILE D O 8523 C CB . ILE F 48 ? 0.2445 0.2304 0.3624 0.0127 -0.0207 0.0344 48 ILE D CB 8524 C CG1 . ILE F 48 ? 0.2381 0.2249 0.3595 0.0105 -0.0234 0.0394 48 ILE D CG1 8525 C CG2 . ILE F 48 ? 0.1631 0.1413 0.2796 0.0148 -0.0215 0.0298 48 ILE D CG2 8526 C CD1 . ILE F 48 ? 0.2745 0.2601 0.3915 0.0086 -0.0231 0.0390 48 ILE D CD1 8527 N N . GLY F 49 ? 0.2980 0.2899 0.4145 0.0155 -0.0137 0.0279 49 GLY D N 8528 C CA . GLY F 49 ? 0.2084 0.1998 0.3232 0.0171 -0.0100 0.0230 49 GLY D CA 8529 C C . GLY F 49 ? 0.2747 0.2679 0.3814 0.0151 -0.0059 0.0214 49 GLY D C 8530 O O . GLY F 49 ? 0.2881 0.2824 0.3906 0.0128 -0.0063 0.0237 49 GLY D O 8531 N N . GLU F 50 ? 0.2719 0.2652 0.3767 0.0160 -0.0018 0.0175 50 GLU D N 8532 C CA . GLU F 50 ? 0.2830 0.2772 0.3803 0.0139 0.0023 0.0162 50 GLU D CA 8533 C C . GLU F 50 ? 0.3319 0.3227 0.4245 0.0149 0.0066 0.0114 50 GLU D C 8534 O O . GLU F 50 ? 0.3449 0.3345 0.4417 0.0174 0.0071 0.0086 50 GLU D O 8535 C CB . GLU F 50 ? 0.2498 0.2525 0.3519 0.0121 0.0036 0.0180 50 GLU D CB 8536 C CG . GLU F 50 ? 0.3031 0.3113 0.4137 0.0137 0.0056 0.0160 50 GLU D CG 8537 C CD . GLU F 50 ? 0.3763 0.3934 0.4936 0.0122 0.0045 0.0186 50 GLU D CD 8538 O OE1 . GLU F 50 ? 0.2616 0.2806 0.3799 0.0111 0.0005 0.0226 50 GLU D OE1 8539 O OE2 . GLU F 50 ? 0.3053 0.3276 0.4266 0.0118 0.0077 0.0165 50 GLU D OE2 8540 N N . ILE F 51 ? 0.2951 0.2839 0.3786 0.0129 0.0100 0.0105 51 ILE D N 8541 C CA . ILE F 51 ? 0.3156 0.3002 0.3918 0.0132 0.0145 0.0066 51 ILE D CA 8542 C C . ILE F 51 ? 0.2759 0.2611 0.3452 0.0102 0.0188 0.0069 51 ILE D C 8543 O O . ILE F 51 ? 0.2813 0.2673 0.3491 0.0082 0.0174 0.0099 51 ILE D O 8544 C CB . ILE F 51 ? 0.3712 0.3467 0.4387 0.0143 0.0119 0.0051 51 ILE D CB 8545 C CG1 . ILE F 51 ? 0.4651 0.4365 0.5254 0.0151 0.0163 0.0003 51 ILE D CG1 8546 C CG2 . ILE F 51 ? 0.3864 0.3578 0.4455 0.0123 0.0097 0.0078 51 ILE D CG2 8547 C CD1 . ILE F 51 ? 0.5685 0.5307 0.6179 0.0156 0.0136 -0.0013 51 ILE D CD1 8548 N N . LYS F 52 ? 0.2341 0.2188 0.2996 0.0099 0.0243 0.0037 52 LYS D N 8549 C CA . LYS F 52 ? 0.3491 0.3329 0.4070 0.0068 0.0289 0.0041 52 LYS D CA 8550 C C . LYS F 52 ? 0.3497 0.3269 0.3962 0.0067 0.0329 0.0011 52 LYS D C 8551 O O . LYS F 52 ? 0.3765 0.3524 0.4237 0.0091 0.0336 -0.0024 52 LYS D O 8552 C CB . LYS F 52 ? 0.3173 0.3099 0.3842 0.0051 0.0329 0.0038 52 LYS D CB 8553 C CG . LYS F 52 ? 0.4127 0.4092 0.4849 0.0065 0.0378 -0.0003 52 LYS D CG 8554 C CD . LYS F 52 ? 0.4723 0.4793 0.5578 0.0057 0.0397 -0.0004 52 LYS D CD 8555 C CE . LYS F 52 ? 0.4051 0.4141 0.4877 0.0017 0.0450 -0.0002 52 LYS D CE 8556 N NZ . LYS F 52 ? 0.4727 0.4826 0.5543 0.0013 0.0525 -0.0041 52 LYS D NZ 8557 N N . HIS F 53 ? 0.3065 0.2793 0.3425 0.0039 0.0356 0.0025 53 HIS D N 8558 C CA . HIS F 53 ? 0.3987 0.3641 0.4208 0.0034 0.0388 0.0006 53 HIS D CA 8559 C C . HIS F 53 ? 0.4373 0.4061 0.4611 0.0038 0.0456 -0.0040 53 HIS D C 8560 O O . HIS F 53 ? 0.4782 0.4428 0.4960 0.0056 0.0462 -0.0076 53 HIS D O 8561 C CB . HIS F 53 ? 0.3185 0.2790 0.3302 -0.0001 0.0406 0.0038 53 HIS D CB 8562 C CG . HIS F 53 ? 0.4210 0.3735 0.4167 -0.0012 0.0438 0.0028 53 HIS D CG 8563 N ND1 . HIS F 53 ? 0.4280 0.3737 0.4145 0.0008 0.0405 0.0011 53 HIS D ND1 8564 C CD2 . HIS F 53 ? 0.4965 0.4467 0.4834 -0.0045 0.0501 0.0034 53 HIS D CD2 8565 C CE1 . HIS F 53 ? 0.5090 0.4486 0.4806 -0.0011 0.0444 0.0006 53 HIS D CE1 8566 N NE2 . HIS F 53 ? 0.5752 0.5173 0.5466 -0.0044 0.0504 0.0023 53 HIS D NE2 8567 N N . ASN F 54 ? 0.3795 0.3561 0.4119 0.0022 0.0507 -0.0044 54 ASN D N 8568 C CA . ASN F 54 ? 0.4436 0.4254 0.4811 0.0028 0.0575 -0.0091 54 ASN D CA 8569 C C . ASN F 54 ? 0.5718 0.5615 0.6265 0.0062 0.0552 -0.0112 54 ASN D C 8570 O O . ASN F 54 ? 0.6301 0.6288 0.6975 0.0057 0.0572 -0.0112 54 ASN D O 8571 C CB . ASN F 54 ? 0.3979 0.3842 0.4362 -0.0011 0.0648 -0.0087 54 ASN D CB 8572 C CG . ASN F 54 ? 0.3881 0.3661 0.4087 -0.0043 0.0693 -0.0078 54 ASN D CG 8573 O OD1 . ASN F 54 ? 0.5179 0.4926 0.5298 -0.0040 0.0737 -0.0112 54 ASN D OD1 8574 N ND2 . ASN F 54 ? 0.4507 0.4251 0.4656 -0.0076 0.0681 -0.0031 54 ASN D ND2 8575 N N . GLY F 55 ? 0.6304 0.6164 0.6856 0.0097 0.0505 -0.0128 55 GLY D N 8576 C CA . GLY F 55 ? 0.5204 0.5122 0.5913 0.0132 0.0471 -0.0139 55 GLY D CA 8577 C C . GLY F 55 ? 0.5520 0.5373 0.6209 0.0163 0.0416 -0.0151 55 GLY D C 8578 O O . GLY F 55 ? 0.5807 0.5576 0.6361 0.0159 0.0406 -0.0158 55 GLY D O 8579 N N . SER F 56 ? 0.6001 0.5893 0.6828 0.0193 0.0376 -0.0151 56 SER D N 8580 C CA . SER F 56 ? 0.5596 0.5430 0.6431 0.0222 0.0323 -0.0163 56 SER D CA 8581 C C . SER F 56 ? 0.4953 0.4790 0.5841 0.0223 0.0247 -0.0107 56 SER D C 8582 O O . SER F 56 ? 0.5477 0.5382 0.6441 0.0212 0.0236 -0.0069 56 SER D O 8583 C CB . SER F 56 ? 0.5642 0.5504 0.6598 0.0260 0.0341 -0.0213 56 SER D CB 8584 O OG . SER F 56 ? 0.6906 0.6770 0.7815 0.0259 0.0420 -0.0271 56 SER D OG 8585 N N . PRO F 57 ? 0.5307 0.5073 0.6156 0.0233 0.0195 -0.0103 57 PRO D N 8586 C CA . PRO F 57 ? 0.4830 0.4601 0.5736 0.0232 0.0128 -0.0051 57 PRO D CA 8587 C C . PRO F 57 ? 0.4502 0.4333 0.5566 0.0253 0.0107 -0.0037 57 PRO D C 8588 O O . PRO F 57 ? 0.4795 0.4636 0.5934 0.0281 0.0126 -0.0077 57 PRO D O 8589 C CB . PRO F 57 ? 0.5282 0.4965 0.6131 0.0241 0.0086 -0.0065 57 PRO D CB 8590 C CG . PRO F 57 ? 0.5885 0.5512 0.6599 0.0236 0.0126 -0.0111 57 PRO D CG 8591 C CD . PRO F 57 ? 0.5765 0.5444 0.6511 0.0242 0.0196 -0.0147 57 PRO D CD 8592 N N . ASN F 58 ? 0.3697 0.3568 0.4810 0.0241 0.0068 0.0019 58 ASN D N 8593 C CA . ASN F 58 ? 0.3793 0.3721 0.5043 0.0257 0.0039 0.0046 58 ASN D CA 8594 C C . ASN F 58 ? 0.3367 0.3275 0.4636 0.0250 -0.0024 0.0099 58 ASN D C 8595 O O . ASN F 58 ? 0.2981 0.2910 0.4207 0.0223 -0.0036 0.0139 58 ASN D O 8596 C CB . ASN F 58 ? 0.3053 0.3074 0.4349 0.0242 0.0063 0.0062 58 ASN D CB 8597 C CG . ASN F 58 ? 0.3388 0.3472 0.4823 0.0259 0.0026 0.0092 58 ASN D CG 8598 O OD1 . ASN F 58 ? 0.3788 0.3845 0.5299 0.0288 -0.0008 0.0094 58 ASN D OD1 8599 N ND2 . ASN F 58 ? 0.3268 0.3432 0.4736 0.0240 0.0028 0.0118 58 ASN D ND2 8600 N N . TYR F 59 ? 0.3155 0.3021 0.4490 0.0274 -0.0061 0.0098 59 TYR D N 8601 C CA . TYR F 59 ? 0.3141 0.2977 0.4488 0.0264 -0.0116 0.0147 59 TYR D CA 8602 C C . TYR F 59 ? 0.3949 0.3821 0.5415 0.0274 -0.0157 0.0196 59 TYR D C 8603 O O . TYR F 59 ? 0.3491 0.3393 0.5051 0.0301 -0.0154 0.0184 59 TYR D O 8604 C CB . TYR F 59 ? 0.2527 0.2272 0.3846 0.0275 -0.0135 0.0116 59 TYR D CB 8605 C CG . TYR F 59 ? 0.3277 0.2974 0.4471 0.0267 -0.0105 0.0070 59 TYR D CG 8606 C CD1 . TYR F 59 ? 0.3947 0.3653 0.5046 0.0238 -0.0097 0.0089 59 TYR D CD1 8607 C CD2 . TYR F 59 ? 0.3700 0.3341 0.4869 0.0289 -0.0089 0.0005 59 TYR D CD2 8608 C CE1 . TYR F 59 ? 0.3797 0.3455 0.4779 0.0231 -0.0077 0.0054 59 TYR D CE1 8609 C CE2 . TYR F 59 ? 0.4283 0.3877 0.5321 0.0279 -0.0066 -0.0033 59 TYR D CE2 8610 C CZ . TYR F 59 ? 0.4394 0.3996 0.5340 0.0250 -0.0063 -0.0004 59 TYR D CZ 8611 O OH . TYR F 59 ? 0.4862 0.4412 0.5677 0.0241 -0.0047 -0.0035 59 TYR D OH 8612 N N . HIS F 60 ? 0.3842 0.3709 0.5304 0.0253 -0.0196 0.0253 60 HIS D N 8613 C CA . HIS F 60 ? 0.3060 0.2940 0.4617 0.0258 -0.0243 0.0309 60 HIS D CA 8614 C C . HIS F 60 ? 0.2811 0.2618 0.4445 0.0290 -0.0267 0.0285 60 HIS D C 8615 O O . HIS F 60 ? 0.3268 0.3005 0.4862 0.0288 -0.0271 0.0258 60 HIS D O 8616 C CB . HIS F 60 ? 0.3262 0.3147 0.4782 0.0222 -0.0270 0.0370 60 HIS D CB 8617 C CG . HIS F 60 ? 0.3979 0.3903 0.5564 0.0215 -0.0309 0.0440 60 HIS D CG 8618 N ND1 . HIS F 60 ? 0.4681 0.4562 0.6355 0.0231 -0.0352 0.0472 60 HIS D ND1 8619 C CD2 . HIS F 60 ? 0.4190 0.4186 0.5758 0.0192 -0.0314 0.0487 60 HIS D CD2 8620 C CE1 . HIS F 60 ? 0.4495 0.4420 0.6201 0.0218 -0.0383 0.0541 60 HIS D CE1 8621 N NE2 . HIS F 60 ? 0.5110 0.5108 0.6748 0.0194 -0.0361 0.0549 60 HIS D NE2 8622 N N . PRO F 61 ? 0.2599 0.2421 0.4348 0.0320 -0.0285 0.0292 61 PRO D N 8623 C CA . PRO F 61 ? 0.3211 0.2962 0.5044 0.0355 -0.0302 0.0257 61 PRO D CA 8624 C C . PRO F 61 ? 0.3840 0.3512 0.5679 0.0343 -0.0344 0.0285 61 PRO D C 8625 O O . PRO F 61 ? 0.4595 0.4191 0.6448 0.0361 -0.0346 0.0233 61 PRO D O 8626 C CB . PRO F 61 ? 0.3093 0.2886 0.5061 0.0384 -0.0327 0.0285 61 PRO D CB 8627 C CG . PRO F 61 ? 0.2624 0.2518 0.4566 0.0371 -0.0301 0.0298 61 PRO D CG 8628 C CD . PRO F 61 ? 0.2531 0.2438 0.4343 0.0324 -0.0293 0.0328 61 PRO D CD 8629 N N . SER F 62 ? 0.4241 0.3929 0.6069 0.0311 -0.0376 0.0361 62 SER D N 8630 C CA . SER F 62 ? 0.5138 0.4759 0.6978 0.0293 -0.0412 0.0393 62 SER D CA 8631 C C . SER F 62 ? 0.4592 0.4161 0.6349 0.0281 -0.0396 0.0339 62 SER D C 8632 O O . SER F 62 ? 0.3480 0.2974 0.5268 0.0281 -0.0423 0.0327 62 SER D O 8633 C CB . SER F 62 ? 0.5082 0.4745 0.6901 0.0252 -0.0434 0.0482 62 SER D CB 8634 O OG . SER F 62 ? 0.6086 0.5785 0.7978 0.0260 -0.0462 0.0541 62 SER D OG 8635 N N . LEU F 63 ? 0.3210 0.2816 0.4863 0.0270 -0.0355 0.0307 63 LEU D N 8636 C CA . LEU F 63 ? 0.4301 0.3868 0.5864 0.0254 -0.0347 0.0270 63 LEU D CA 8637 C C . LEU F 63 ? 0.5144 0.4676 0.6648 0.0277 -0.0315 0.0185 63 LEU D C 8638 O O . LEU F 63 ? 0.5587 0.5082 0.7006 0.0265 -0.0312 0.0153 63 LEU D O 8639 C CB . LEU F 63 ? 0.3666 0.3290 0.5146 0.0220 -0.0329 0.0303 63 LEU D CB 8640 C CG . LEU F 63 ? 0.4636 0.4307 0.6151 0.0192 -0.0349 0.0383 63 LEU D CG 8641 C CD1 . LEU F 63 ? 0.5005 0.4746 0.6441 0.0166 -0.0319 0.0400 63 LEU D CD1 8642 C CD2 . LEU F 63 ? 0.4772 0.4394 0.6321 0.0172 -0.0384 0.0412 63 LEU D CD2 8643 N N . LYS F 64 ? 0.4795 0.4342 0.6342 0.0308 -0.0291 0.0150 64 LYS D N 8644 C CA . LYS F 64 ? 0.5071 0.4602 0.6551 0.0325 -0.0246 0.0072 64 LYS D CA 8645 C C . LYS F 64 ? 0.5544 0.4985 0.6973 0.0330 -0.0258 0.0013 64 LYS D C 8646 O O . LYS F 64 ? 0.6156 0.5580 0.7468 0.0322 -0.0232 -0.0029 64 LYS D O 8647 C CB . LYS F 64 ? 0.5164 0.4724 0.6733 0.0361 -0.0220 0.0041 64 LYS D CB 8648 C CG . LYS F 64 ? 0.6329 0.5898 0.7827 0.0373 -0.0159 -0.0032 64 LYS D CG 8649 C CD . LYS F 64 ? 0.8319 0.7915 0.9926 0.0412 -0.0132 -0.0071 64 LYS D CD 8650 C CE . LYS F 64 ? 0.9065 0.8677 1.0599 0.0419 -0.0061 -0.0144 64 LYS D CE 8651 N NZ . LYS F 64 ? 0.9057 0.8688 1.0707 0.0460 -0.0031 -0.0197 64 LYS D NZ 8652 N N . SER F 65 ? 0.4938 0.4320 0.6452 0.0341 -0.0301 0.0013 65 SER D N 8653 C CA . SER F 65 ? 0.4924 0.4217 0.6403 0.0346 -0.0319 -0.0049 65 SER D CA 8654 C C . SER F 65 ? 0.4816 0.4085 0.6203 0.0312 -0.0344 -0.0037 65 SER D C 8655 O O . SER F 65 ? 0.5443 0.4647 0.6765 0.0312 -0.0357 -0.0094 65 SER D O 8656 C CB . SER F 65 ? 0.5197 0.4431 0.6809 0.0363 -0.0363 -0.0048 65 SER D CB 8657 O OG . SER F 65 ? 0.6051 0.5300 0.7733 0.0340 -0.0404 0.0038 65 SER D OG 8658 N N . ARG F 66 ? 0.3819 0.3140 0.5200 0.0284 -0.0353 0.0033 66 ARG D N 8659 C CA . ARG F 66 ? 0.3840 0.3147 0.5160 0.0254 -0.0379 0.0050 66 ARG D CA 8660 C C . ARG F 66 ? 0.3727 0.3082 0.4936 0.0238 -0.0347 0.0059 66 ARG D C 8661 O O . ARG F 66 ? 0.4168 0.3506 0.5312 0.0220 -0.0365 0.0057 66 ARG D O 8662 C CB . ARG F 66 ? 0.4136 0.3457 0.5549 0.0230 -0.0417 0.0122 66 ARG D CB 8663 C CG . ARG F 66 ? 0.3822 0.3084 0.5350 0.0239 -0.0456 0.0123 66 ARG D CG 8664 C CD . ARG F 66 ? 0.3275 0.2566 0.4892 0.0214 -0.0480 0.0209 66 ARG D CD 8665 N NE . ARG F 66 ? 0.4764 0.4084 0.6342 0.0178 -0.0487 0.0242 66 ARG D NE 8666 C CZ . ARG F 66 ? 0.4097 0.3483 0.5688 0.0152 -0.0478 0.0312 66 ARG D CZ 8667 N NH1 . ARG F 66 ? 0.2167 0.1595 0.3799 0.0156 -0.0467 0.0360 66 ARG D NH1 8668 N NH2 . ARG F 66 ? 0.4210 0.3622 0.5774 0.0122 -0.0481 0.0331 66 ARG D NH2 8669 N N . VAL F 67 ? 0.3191 0.2606 0.4387 0.0245 -0.0303 0.0070 67 VAL D N 8670 C CA . VAL F 67 ? 0.3334 0.2798 0.4443 0.0228 -0.0272 0.0086 67 VAL D CA 8671 C C . VAL F 67 ? 0.3340 0.2785 0.4338 0.0237 -0.0232 0.0031 67 VAL D C 8672 O O . VAL F 67 ? 0.4106 0.3542 0.5111 0.0260 -0.0203 -0.0013 67 VAL D O 8673 C CB . VAL F 67 ? 0.3555 0.3103 0.4714 0.0223 -0.0248 0.0135 67 VAL D CB 8674 C CG1 . VAL F 67 ? 0.4817 0.4409 0.5889 0.0208 -0.0209 0.0139 67 VAL D CG1 8675 C CG2 . VAL F 67 ? 0.4786 0.4359 0.6019 0.0204 -0.0282 0.0200 67 VAL D CG2 8676 N N . THR F 68 ? 0.3060 0.2498 0.3957 0.0220 -0.0229 0.0034 68 THR D N 8677 C CA . THR F 68 ? 0.3612 0.3040 0.4392 0.0220 -0.0186 0.0000 68 THR D CA 8678 C C . THR F 68 ? 0.4018 0.3490 0.4750 0.0198 -0.0168 0.0039 68 THR D C 8679 O O . THR F 68 ? 0.3962 0.3430 0.4689 0.0183 -0.0200 0.0070 68 THR D O 8680 C CB . THR F 68 ? 0.4105 0.3452 0.4781 0.0222 -0.0207 -0.0048 68 THR D CB 8681 O OG1 . THR F 68 ? 0.5103 0.4405 0.5823 0.0243 -0.0222 -0.0094 68 THR D OG1 8682 C CG2 . THR F 68 ? 0.3743 0.3077 0.4285 0.0219 -0.0159 -0.0077 68 THR D CG2 8683 N N . ILE F 69 ? 0.4268 0.3781 0.4976 0.0197 -0.0115 0.0036 69 ILE D N 8684 C CA . ILE F 69 ? 0.3417 0.2962 0.4074 0.0176 -0.0093 0.0065 69 ILE D CA 8685 C C . ILE F 69 ? 0.3671 0.3181 0.4205 0.0172 -0.0053 0.0034 69 ILE D C 8686 O O . ILE F 69 ? 0.4211 0.3724 0.4734 0.0182 -0.0012 -0.0002 69 ILE D O 8687 C CB . ILE F 69 ? 0.2598 0.2228 0.3336 0.0170 -0.0066 0.0095 69 ILE D CB 8688 C CG1 . ILE F 69 ? 0.2742 0.2404 0.3583 0.0168 -0.0106 0.0134 69 ILE D CG1 8689 C CG2 . ILE F 69 ? 0.2993 0.2650 0.3677 0.0147 -0.0040 0.0115 69 ILE D CG2 8690 C CD1 . ILE F 69 ? 0.3159 0.2903 0.4067 0.0159 -0.0091 0.0167 69 ILE D CD1 8691 N N . SER F 70 ? 0.3382 0.2858 0.3826 0.0157 -0.0064 0.0049 70 SER D N 8692 C CA . SER F 70 ? 0.4037 0.3468 0.4349 0.0149 -0.0033 0.0028 70 SER D CA 8693 C C . SER F 70 ? 0.4431 0.3866 0.4690 0.0128 -0.0018 0.0062 70 SER D C 8694 O O . SER F 70 ? 0.3616 0.3064 0.3915 0.0121 -0.0051 0.0096 70 SER D O 8695 C CB . SER F 70 ? 0.4116 0.3463 0.4337 0.0156 -0.0073 0.0001 70 SER D CB 8696 O OG . SER F 70 ? 0.5337 0.4664 0.5571 0.0152 -0.0134 0.0029 70 SER D OG 8697 N N . LEU F 71 ? 0.4012 0.3436 0.4188 0.0116 0.0034 0.0053 71 LEU D N 8698 C CA . LEU F 71 ? 0.3915 0.3329 0.4033 0.0094 0.0050 0.0083 71 LEU D CA 8699 C C . LEU F 71 ? 0.4483 0.3808 0.4453 0.0088 0.0034 0.0084 71 LEU D C 8700 O O . LEU F 71 ? 0.4453 0.3735 0.4335 0.0093 0.0044 0.0052 71 LEU D O 8701 C CB . LEU F 71 ? 0.3881 0.3344 0.4011 0.0078 0.0120 0.0080 71 LEU D CB 8702 C CG . LEU F 71 ? 0.5193 0.4750 0.5461 0.0081 0.0140 0.0080 71 LEU D CG 8703 C CD1 . LEU F 71 ? 0.5238 0.4834 0.5504 0.0064 0.0208 0.0070 71 LEU D CD1 8704 C CD2 . LEU F 71 ? 0.5831 0.5425 0.6172 0.0075 0.0107 0.0115 71 LEU D CD2 8705 N N . ASP F 72 ? 0.4282 0.3581 0.4224 0.0077 0.0008 0.0120 72 ASP D N 8706 C CA . ASP F 72 ? 0.4363 0.3577 0.4162 0.0068 -0.0005 0.0133 72 ASP D CA 8707 C C . ASP F 72 ? 0.4092 0.3306 0.3867 0.0045 0.0035 0.0165 72 ASP D C 8708 O O . ASP F 72 ? 0.3565 0.2785 0.3392 0.0042 0.0010 0.0194 72 ASP D O 8709 C CB . ASP F 72 ? 0.5386 0.4553 0.5175 0.0080 -0.0087 0.0149 72 ASP D CB 8710 C CG . ASP F 72 ? 0.6885 0.5958 0.6513 0.0075 -0.0114 0.0156 72 ASP D CG 8711 O OD1 . ASP F 72 ? 0.7279 0.6319 0.6803 0.0056 -0.0068 0.0168 72 ASP D OD1 8712 O OD2 . ASP F 72 ? 0.7273 0.6304 0.6878 0.0087 -0.0183 0.0153 72 ASP D OD2 8713 N N . MET F 73 ? 0.3781 0.2989 0.3484 0.0027 0.0099 0.0155 73 MET D N 8714 C CA . MET F 73 ? 0.3952 0.3167 0.3647 0.0000 0.0147 0.0181 73 MET D CA 8715 C C . MET F 73 ? 0.4440 0.3575 0.4055 -0.0010 0.0111 0.0224 73 MET D C 8716 O O . MET F 73 ? 0.4300 0.3446 0.3972 -0.0021 0.0114 0.0249 73 MET D O 8717 C CB . MET F 73 ? 0.3657 0.2877 0.3286 -0.0020 0.0225 0.0162 73 MET D CB 8718 C CG . MET F 73 ? 0.4394 0.3698 0.4120 -0.0008 0.0264 0.0119 73 MET D CG 8719 S SD . MET F 73 ? 0.5756 0.5168 0.5673 -0.0006 0.0266 0.0124 73 MET D SD 8720 C CE . MET F 73 ? 0.3530 0.2960 0.3440 -0.0046 0.0335 0.0142 73 MET D CE 8721 N N . SER F 74 ? 0.5284 0.4335 0.4768 -0.0005 0.0074 0.0231 74 SER D N 8722 C CA . SER F 74 ? 0.5455 0.4423 0.4857 -0.0012 0.0034 0.0276 74 SER D CA 8723 C C . SER F 74 ? 0.4499 0.3475 0.4007 0.0008 -0.0034 0.0293 74 SER D C 8724 O O . SER F 74 ? 0.4946 0.3891 0.4467 0.0001 -0.0048 0.0328 74 SER D O 8725 C CB . SER F 74 ? 0.5950 0.4828 0.5177 -0.0013 0.0005 0.0279 74 SER D CB 8726 O OG . SER F 74 ? 0.6999 0.5882 0.6239 0.0013 -0.0049 0.0247 74 SER D OG 8727 N N . LYS F 75 ? 0.4482 0.3502 0.4074 0.0031 -0.0074 0.0268 75 LYS D N 8728 C CA . LYS F 75 ? 0.4495 0.3533 0.4197 0.0049 -0.0133 0.0281 75 LYS D CA 8729 C C . LYS F 75 ? 0.3875 0.2997 0.3719 0.0044 -0.0099 0.0279 75 LYS D C 8730 O O . LYS F 75 ? 0.4407 0.3547 0.4341 0.0054 -0.0133 0.0290 75 LYS D O 8731 C CB . LYS F 75 ? 0.5080 0.4129 0.4817 0.0071 -0.0189 0.0257 75 LYS D CB 8732 C CG . LYS F 75 ? 0.5380 0.4346 0.4990 0.0077 -0.0246 0.0258 75 LYS D CG 8733 C CD . LYS F 75 ? 0.6410 0.5393 0.6086 0.0097 -0.0308 0.0234 75 LYS D CD 8734 C CE . LYS F 75 ? 0.7455 0.6362 0.6993 0.0101 -0.0357 0.0220 75 LYS D CE 8735 N NZ . LYS F 75 ? 0.8262 0.7189 0.7873 0.0116 -0.0411 0.0189 75 LYS D NZ 8736 N N . ASN F 76 ? 0.3197 0.2371 0.3060 0.0029 -0.0033 0.0263 76 ASN D N 8737 C CA . ASN F 76 ? 0.2538 0.1796 0.2525 0.0022 -0.0002 0.0257 76 ASN D CA 8738 C C . ASN F 76 ? 0.3157 0.2478 0.3257 0.0041 -0.0037 0.0245 76 ASN D C 8739 O O . ASN F 76 ? 0.3665 0.3031 0.3857 0.0040 -0.0041 0.0251 76 ASN D O 8740 C CB . ASN F 76 ? 0.2827 0.2064 0.2833 0.0010 0.0002 0.0282 76 ASN D CB 8741 C CG . ASN F 76 ? 0.3256 0.2545 0.3305 -0.0015 0.0064 0.0275 76 ASN D CG 8742 O OD1 . ASN F 76 ? 0.3548 0.2834 0.3543 -0.0033 0.0112 0.0270 76 ASN D OD1 8743 N ND2 . ASN F 76 ? 0.2452 0.1791 0.2600 -0.0018 0.0065 0.0273 76 ASN D ND2 8744 N N . GLN F 77 ? 0.3359 0.2678 0.3448 0.0056 -0.0058 0.0227 77 GLN D N 8745 C CA . GLN F 77 ? 0.3529 0.2900 0.3719 0.0070 -0.0089 0.0218 77 GLN D CA 8746 C C . GLN F 77 ? 0.3487 0.2893 0.3697 0.0075 -0.0067 0.0193 77 GLN D C 8747 O O . GLN F 77 ? 0.4126 0.3505 0.4259 0.0073 -0.0039 0.0175 77 GLN D O 8748 C CB . GLN F 77 ? 0.2862 0.2186 0.3043 0.0086 -0.0157 0.0221 77 GLN D CB 8749 C CG . GLN F 77 ? 0.4243 0.3533 0.4424 0.0087 -0.0191 0.0245 77 GLN D CG 8750 C CD . GLN F 77 ? 0.5087 0.4322 0.5240 0.0103 -0.0262 0.0246 77 GLN D CD 8751 O OE1 . GLN F 77 ? 0.5258 0.4478 0.5382 0.0109 -0.0283 0.0225 77 GLN D OE1 8752 N NE2 . GLN F 77 ? 0.4559 0.3765 0.4727 0.0109 -0.0301 0.0266 77 GLN D NE2 8753 N N . PHE F 78 ? 0.3086 0.2553 0.3402 0.0082 -0.0079 0.0191 78 PHE D N 8754 C CA . PHE F 78 ? 0.3126 0.2612 0.3472 0.0093 -0.0076 0.0169 78 PHE D CA 8755 C C . PHE F 78 ? 0.3490 0.2992 0.3921 0.0103 -0.0123 0.0175 78 PHE D C 8756 O O . PHE F 78 ? 0.3432 0.2959 0.3919 0.0098 -0.0145 0.0196 78 PHE D O 8757 C CB . PHE F 78 ? 0.3195 0.2747 0.3591 0.0086 -0.0025 0.0164 78 PHE D CB 8758 C CG . PHE F 78 ? 0.3019 0.2644 0.3508 0.0076 -0.0022 0.0186 78 PHE D CG 8759 C CD1 . PHE F 78 ? 0.3139 0.2779 0.3621 0.0059 -0.0005 0.0200 78 PHE D CD1 8760 C CD2 . PHE F 78 ? 0.3143 0.2820 0.3722 0.0083 -0.0036 0.0191 78 PHE D CD2 8761 C CE1 . PHE F 78 ? 0.3414 0.3123 0.3971 0.0048 0.0000 0.0214 78 PHE D CE1 8762 C CE2 . PHE F 78 ? 0.3192 0.2937 0.3841 0.0071 -0.0033 0.0213 78 PHE D CE2 8763 C CZ . PHE F 78 ? 0.3235 0.2998 0.3870 0.0053 -0.0014 0.0221 78 PHE D CZ 8764 N N . SER F 79 ? 0.3285 0.2771 0.3726 0.0116 -0.0138 0.0153 79 SER D N 8765 C CA . SER F 79 ? 0.4044 0.3523 0.4551 0.0124 -0.0189 0.0155 79 SER D CA 8766 C C . SER F 79 ? 0.3848 0.3365 0.4444 0.0131 -0.0185 0.0151 79 SER D C 8767 O O . SER F 79 ? 0.3981 0.3515 0.4577 0.0138 -0.0149 0.0136 79 SER D O 8768 C CB . SER F 79 ? 0.4048 0.3449 0.4480 0.0133 -0.0230 0.0131 79 SER D CB 8769 O OG . SER F 79 ? 0.6747 0.6110 0.7106 0.0128 -0.0247 0.0143 79 SER D OG 8770 N N . LEU F 80 ? 0.3577 0.3106 0.4256 0.0130 -0.0223 0.0168 80 LEU D N 8771 C CA . LEU F 80 ? 0.3628 0.3173 0.4392 0.0137 -0.0233 0.0170 80 LEU D CA 8772 C C . LEU F 80 ? 0.3574 0.3067 0.4363 0.0142 -0.0285 0.0156 80 LEU D C 8773 O O . LEU F 80 ? 0.2901 0.2389 0.3708 0.0132 -0.0318 0.0171 80 LEU D O 8774 C CB . LEU F 80 ? 0.2824 0.2442 0.3676 0.0123 -0.0226 0.0213 80 LEU D CB 8775 C CG . LEU F 80 ? 0.2761 0.2391 0.3708 0.0126 -0.0247 0.0230 80 LEU D CG 8776 C CD1 . LEU F 80 ? 0.1659 0.1291 0.2620 0.0144 -0.0226 0.0212 80 LEU D CD1 8777 C CD2 . LEU F 80 ? 0.2297 0.1992 0.3311 0.0106 -0.0246 0.0279 80 LEU D CD2 8778 N N . ASN F 81 ? 0.3190 0.2644 0.3985 0.0157 -0.0293 0.0124 81 ASN D N 8779 C CA . ASN F 81 ? 0.4063 0.3473 0.4908 0.0160 -0.0342 0.0111 81 ASN D CA 8780 C C . ASN F 81 ? 0.4062 0.3490 0.5016 0.0165 -0.0345 0.0126 81 ASN D C 8781 O O . ASN F 81 ? 0.2886 0.2329 0.3853 0.0180 -0.0313 0.0115 81 ASN D O 8782 C CB . ASN F 81 ? 0.5440 0.4774 0.6198 0.0174 -0.0357 0.0053 81 ASN D CB 8783 C CG . ASN F 81 ? 0.7150 0.6449 0.7805 0.0167 -0.0379 0.0045 81 ASN D CG 8784 O OD1 . ASN F 81 ? 0.7271 0.6602 0.7919 0.0155 -0.0376 0.0079 81 ASN D OD1 8785 N ND2 . ASN F 81 ? 0.9448 0.8679 1.0020 0.0174 -0.0403 -0.0002 81 ASN D ND2 8786 N N . LEU F 82 ? 0.3989 0.3416 0.5029 0.0153 -0.0383 0.0152 82 LEU D N 8787 C CA . LEU F 82 ? 0.3725 0.3153 0.4870 0.0155 -0.0395 0.0172 82 LEU D CA 8788 C C . LEU F 82 ? 0.4096 0.3464 0.5289 0.0151 -0.0446 0.0153 82 LEU D C 8789 O O . LEU F 82 ? 0.4549 0.3924 0.5778 0.0129 -0.0474 0.0176 82 LEU D O 8790 C CB . LEU F 82 ? 0.3571 0.3072 0.4782 0.0135 -0.0383 0.0237 82 LEU D CB 8791 C CG . LEU F 82 ? 0.3488 0.2991 0.4804 0.0133 -0.0398 0.0274 82 LEU D CG 8792 C CD1 . LEU F 82 ? 0.3652 0.3147 0.4981 0.0161 -0.0382 0.0255 82 LEU D CD1 8793 C CD2 . LEU F 82 ? 0.3669 0.3241 0.5026 0.0106 -0.0388 0.0341 82 LEU D CD2 8794 N N . THR F 83 A 0.4695 0.4004 0.5897 0.0171 -0.0458 0.0107 82 THR D N 8795 C CA . THR F 83 A 0.4480 0.3720 0.5717 0.0167 -0.0509 0.0076 82 THR D CA 8796 C C . THR F 83 A 0.4220 0.3454 0.5595 0.0155 -0.0536 0.0117 82 THR D C 8797 O O . THR F 83 A 0.3054 0.2327 0.4489 0.0156 -0.0514 0.0162 82 THR D O 8798 C CB . THR F 83 A 0.4156 0.3326 0.5337 0.0193 -0.0509 -0.0001 82 THR D CB 8799 O OG1 . THR F 83 A 0.3337 0.2506 0.4583 0.0215 -0.0486 -0.0006 82 THR D OG1 8800 C CG2 . THR F 83 A 0.3575 0.2746 0.4609 0.0201 -0.0478 -0.0036 82 THR D CG2 8801 N N . SER F 84 B 0.3774 0.2961 0.5199 0.0140 -0.0585 0.0103 82 SER D N 8802 C CA . SER F 84 B 0.4354 0.3519 0.5910 0.0124 -0.0615 0.0138 82 SER D CA 8803 C C . SER F 84 B 0.3901 0.3138 0.5523 0.0100 -0.0595 0.0224 82 SER D C 8804 O O . SER F 84 B 0.3069 0.2303 0.4764 0.0102 -0.0591 0.0262 82 SER D O 8805 C CB . SER F 84 B 0.4040 0.3146 0.5645 0.0150 -0.0618 0.0107 82 SER D CB 8806 O OG . SER F 84 B 0.5004 0.4041 0.6547 0.0170 -0.0633 0.0021 82 SER D OG 8807 N N . VAL F 85 C 0.3472 0.2771 0.5066 0.0079 -0.0582 0.0254 82 VAL D N 8808 C CA . VAL F 85 C 0.3090 0.2462 0.4725 0.0056 -0.0555 0.0329 82 VAL D CA 8809 C C . VAL F 85 C 0.3847 0.3208 0.5602 0.0025 -0.0580 0.0379 82 VAL D C 8810 O O . VAL F 85 C 0.3904 0.3217 0.5717 0.0013 -0.0619 0.0357 82 VAL D O 8811 C CB . VAL F 85 C 0.3325 0.2766 0.4908 0.0041 -0.0532 0.0341 82 VAL D CB 8812 C CG1 . VAL F 85 C 0.3373 0.2825 0.4839 0.0067 -0.0502 0.0305 82 VAL D CG1 8813 C CG2 . VAL F 85 C 0.3024 0.2451 0.4639 0.0023 -0.0567 0.0322 82 VAL D CG2 8814 N N . THR F 86 ? 0.2863 0.2268 0.4652 0.0011 -0.0557 0.0446 83 THR D N 8815 C CA . THR F 86 ? 0.3226 0.2634 0.5114 -0.0026 -0.0570 0.0511 83 THR D CA 8816 C C . THR F 86 ? 0.3426 0.2926 0.5294 -0.0053 -0.0529 0.0574 83 THR D C 8817 O O . THR F 86 ? 0.2788 0.2341 0.4572 -0.0041 -0.0496 0.0564 83 THR D O 8818 C CB . THR F 86 ? 0.2817 0.2168 0.4774 -0.0017 -0.0590 0.0539 83 THR D CB 8819 O OG1 . THR F 86 ? 0.3599 0.2990 0.5513 0.0001 -0.0563 0.0571 83 THR D OG1 8820 C CG2 . THR F 86 ? 0.2212 0.1471 0.4188 0.0015 -0.0625 0.0467 83 THR D CG2 8821 N N . ALA F 87 ? 0.3989 0.3504 0.5931 -0.0093 -0.0529 0.0638 84 ALA D N 8822 C CA . ALA F 87 ? 0.3936 0.3538 0.5856 -0.0126 -0.0488 0.0697 84 ALA D CA 8823 C C . ALA F 87 ? 0.3877 0.3516 0.5724 -0.0110 -0.0463 0.0726 84 ALA D C 8824 O O . ALA F 87 ? 0.4685 0.4401 0.6482 -0.0129 -0.0426 0.0755 84 ALA D O 8825 C CB . ALA F 87 ? 0.3734 0.3336 0.5746 -0.0173 -0.0492 0.0765 84 ALA D CB 8826 N N . ALA F 88 ? 0.3641 0.3229 0.5487 -0.0076 -0.0485 0.0714 85 ALA D N 8827 C CA . ALA F 88 ? 0.3380 0.3005 0.5169 -0.0057 -0.0469 0.0734 85 ALA D CA 8828 C C . ALA F 88 ? 0.3482 0.3155 0.5178 -0.0036 -0.0438 0.0680 85 ALA D C 8829 O O . ALA F 88 ? 0.3417 0.3139 0.5059 -0.0029 -0.0417 0.0694 85 ALA D O 8830 C CB . ALA F 88 ? 0.2290 0.1850 0.4124 -0.0023 -0.0502 0.0731 85 ALA D CB 8831 N N . ASP F 89 ? 0.3250 0.2904 0.4926 -0.0027 -0.0438 0.0619 86 ASP D N 8832 C CA . ASP F 89 ? 0.2813 0.2499 0.4401 -0.0008 -0.0411 0.0570 86 ASP D CA 8833 C C . ASP F 89 ? 0.2771 0.2523 0.4330 -0.0035 -0.0381 0.0578 86 ASP D C 8834 O O . ASP F 89 ? 0.3283 0.3056 0.4777 -0.0023 -0.0361 0.0540 86 ASP D O 8835 C CB . ASP F 89 ? 0.2969 0.2591 0.4538 0.0021 -0.0430 0.0497 86 ASP D CB 8836 C CG . ASP F 89 ? 0.3877 0.3435 0.5473 0.0051 -0.0452 0.0475 86 ASP D CG 8837 O OD1 . ASP F 89 ? 0.3392 0.2970 0.4967 0.0071 -0.0436 0.0478 86 ASP D OD1 8838 O OD2 . ASP F 89 ? 0.2852 0.2342 0.4500 0.0055 -0.0486 0.0451 86 ASP D OD2 8839 N N . THR F 90 ? 0.2206 0.1988 0.3817 -0.0072 -0.0376 0.0628 87 THR D N 8840 C CA . THR F 90 ? 0.2425 0.2276 0.4020 -0.0098 -0.0342 0.0635 87 THR D CA 8841 C C . THR F 90 ? 0.2958 0.2874 0.4479 -0.0102 -0.0304 0.0655 87 THR D C 8842 O O . THR F 90 ? 0.2925 0.2860 0.4442 -0.0115 -0.0302 0.0706 87 THR D O 8843 C CB . THR F 90 ? 0.2697 0.2568 0.4374 -0.0140 -0.0340 0.0682 87 THR D CB 8844 O OG1 . THR F 90 ? 0.3242 0.3064 0.4989 -0.0139 -0.0373 0.0652 87 THR D OG1 8845 C CG2 . THR F 90 ? 0.2314 0.2272 0.3973 -0.0169 -0.0292 0.0694 87 THR D CG2 8846 N N . ALA F 91 ? 0.2311 0.2259 0.3774 -0.0092 -0.0278 0.0614 88 ALA D N 8847 C CA . ALA F 91 ? 0.2551 0.2556 0.3941 -0.0093 -0.0245 0.0618 88 ALA D CA 8848 C C . ALA F 91 ? 0.2819 0.2847 0.4165 -0.0085 -0.0218 0.0570 88 ALA D C 8849 O O . ALA F 91 ? 0.3112 0.3106 0.4478 -0.0073 -0.0232 0.0534 88 ALA D O 8850 C CB . ALA F 91 ? 0.2204 0.2185 0.3562 -0.0067 -0.0259 0.0615 88 ALA D CB 8851 N N . VAL F 92 ? 0.2251 0.2334 0.3539 -0.0093 -0.0185 0.0569 89 VAL D N 8852 C CA . VAL F 92 ? 0.2538 0.2630 0.3780 -0.0080 -0.0163 0.0521 89 VAL D CA 8853 C C . VAL F 92 ? 0.2727 0.2782 0.3920 -0.0051 -0.0173 0.0494 89 VAL D C 8854 O O . VAL F 92 ? 0.2839 0.2911 0.4011 -0.0050 -0.0172 0.0512 89 VAL D O 8855 C CB . VAL F 92 ? 0.2783 0.2947 0.3989 -0.0104 -0.0120 0.0524 89 VAL D CB 8856 C CG1 . VAL F 92 ? 0.2375 0.2537 0.3542 -0.0088 -0.0100 0.0474 89 VAL D CG1 8857 C CG2 . VAL F 92 ? 0.2254 0.2462 0.3509 -0.0135 -0.0100 0.0547 89 VAL D CG2 8858 N N . TYR F 93 ? 0.2483 0.2489 0.3659 -0.0028 -0.0182 0.0453 90 TYR D N 8859 C CA . TYR F 93 ? 0.1989 0.1959 0.3115 -0.0004 -0.0184 0.0426 90 TYR D CA 8860 C C . TYR F 93 ? 0.2841 0.2829 0.3908 -0.0003 -0.0154 0.0398 90 TYR D C 8861 O O . TYR F 93 ? 0.2341 0.2322 0.3404 -0.0004 -0.0148 0.0381 90 TYR D O 8862 C CB . TYR F 93 ? 0.1980 0.1874 0.3109 0.0019 -0.0216 0.0399 90 TYR D CB 8863 C CG . TYR F 93 ? 0.2238 0.2103 0.3425 0.0022 -0.0248 0.0418 90 TYR D CG 8864 C CD1 . TYR F 93 ? 0.3092 0.2966 0.4347 0.0003 -0.0264 0.0449 90 TYR D CD1 8865 C CD2 . TYR F 93 ? 0.2545 0.2372 0.3726 0.0044 -0.0259 0.0404 90 TYR D CD2 8866 C CE1 . TYR F 93 ? 0.3740 0.3579 0.5053 0.0003 -0.0294 0.0468 90 TYR D CE1 8867 C CE2 . TYR F 93 ? 0.3129 0.2922 0.4369 0.0049 -0.0288 0.0418 90 TYR D CE2 8868 C CZ . TYR F 93 ? 0.3541 0.3337 0.4847 0.0028 -0.0308 0.0452 90 TYR D CZ 8869 O OH . TYR F 93 ? 0.3494 0.3248 0.4865 0.0031 -0.0339 0.0468 90 TYR D OH 8870 N N . PHE F 94 ? 0.1965 0.1975 0.2996 -0.0001 -0.0136 0.0394 91 PHE D N 8871 C CA . PHE F 94 ? 0.2732 0.2756 0.3712 -0.0004 -0.0106 0.0368 91 PHE D CA 8872 C C . PHE F 94 ? 0.2715 0.2695 0.3654 0.0016 -0.0103 0.0341 91 PHE D C 8873 O O . PHE F 94 ? 0.2559 0.2533 0.3512 0.0028 -0.0112 0.0345 91 PHE D O 8874 C CB . PHE F 94 ? 0.2752 0.2846 0.3723 -0.0025 -0.0084 0.0382 91 PHE D CB 8875 C CG . PHE F 94 ? 0.2640 0.2785 0.3632 -0.0050 -0.0076 0.0406 91 PHE D CG 8876 C CD1 . PHE F 94 ? 0.2253 0.2416 0.3238 -0.0061 -0.0051 0.0386 91 PHE D CD1 8877 C CD2 . PHE F 94 ? 0.2803 0.2979 0.3823 -0.0062 -0.0090 0.0448 91 PHE D CD2 8878 C CE1 . PHE F 94 ? 0.2274 0.2490 0.3277 -0.0086 -0.0036 0.0403 91 PHE D CE1 8879 C CE2 . PHE F 94 ? 0.2672 0.2897 0.3700 -0.0090 -0.0077 0.0472 91 PHE D CE2 8880 C CZ . PHE F 94 ? 0.2418 0.2665 0.3437 -0.0102 -0.0046 0.0447 91 PHE D CZ 8881 N N . CYS F 95 ? 0.2317 0.2268 0.3210 0.0019 -0.0087 0.0316 92 CYS D N 8882 C CA . CYS F 95 ? 0.2513 0.2438 0.3358 0.0029 -0.0070 0.0293 92 CYS D CA 8883 C C . CYS F 95 ? 0.2094 0.2071 0.2928 0.0011 -0.0038 0.0289 92 CYS D C 8884 O O . CYS F 95 ? 0.2132 0.2148 0.2976 -0.0006 -0.0029 0.0295 92 CYS D O 8885 C CB . CYS F 95 ? 0.2179 0.2031 0.2968 0.0040 -0.0074 0.0272 92 CYS D CB 8886 S SG . CYS F 95 ? 0.3079 0.2918 0.3852 0.0032 -0.0069 0.0268 92 CYS D SG 8887 N N . ALA F 96 ? 0.1682 0.1664 0.2500 0.0013 -0.0019 0.0276 93 ALA D N 8888 C CA . ALA F 96 ? 0.1723 0.1758 0.2539 -0.0006 0.0007 0.0270 93 ALA D CA 8889 C C . ALA F 96 ? 0.2833 0.2852 0.3624 -0.0003 0.0034 0.0248 93 ALA D C 8890 O O . ALA F 96 ? 0.2929 0.2920 0.3718 0.0015 0.0033 0.0241 93 ALA D O 8891 C CB . ALA F 96 ? 0.1897 0.2004 0.2761 -0.0015 -0.0005 0.0292 93 ALA D CB 8892 N N . ARG F 97 ? 0.2640 0.2677 0.3414 -0.0023 0.0061 0.0235 94 ARG D N 8893 C CA . ARG F 97 ? 0.1401 0.1439 0.2164 -0.0029 0.0092 0.0217 94 ARG D CA 8894 C C . ARG F 97 ? 0.2379 0.2500 0.3202 -0.0038 0.0093 0.0218 94 ARG D C 8895 O O . ARG F 97 ? 0.2468 0.2643 0.3315 -0.0052 0.0079 0.0229 94 ARG D O 8896 C CB . ARG F 97 ? 0.2203 0.2212 0.2923 -0.0050 0.0120 0.0204 94 ARG D CB 8897 C CG . ARG F 97 ? 0.1777 0.1778 0.2481 -0.0061 0.0158 0.0188 94 ARG D CG 8898 C CD . ARG F 97 ? 0.2470 0.2447 0.3146 -0.0087 0.0184 0.0179 94 ARG D CD 8899 N NE . ARG F 97 ? 0.1822 0.1864 0.2542 -0.0109 0.0182 0.0172 94 ARG D NE 8900 C CZ . ARG F 97 ? 0.3090 0.3125 0.3804 -0.0135 0.0203 0.0158 94 ARG D CZ 8901 N NH1 . ARG F 97 ? 0.2428 0.2389 0.3097 -0.0142 0.0227 0.0157 94 ARG D NH1 8902 N NH2 . ARG F 97 ? 0.2574 0.2670 0.3324 -0.0155 0.0198 0.0145 94 ARG D NH2 8903 N N . ARG F 98 ? 0.1975 0.2109 0.2824 -0.0029 0.0109 0.0207 95 ARG D N 8904 C CA . ARG F 98 ? 0.2027 0.2242 0.2939 -0.0040 0.0114 0.0203 95 ARG D CA 8905 C C . ARG F 98 ? 0.2443 0.2661 0.3335 -0.0068 0.0153 0.0182 95 ARG D C 8906 O O . ARG F 98 ? 0.2839 0.3013 0.3698 -0.0069 0.0188 0.0166 95 ARG D O 8907 C CB . ARG F 98 ? 0.2034 0.2269 0.3004 -0.0016 0.0115 0.0196 95 ARG D CB 8908 C CG . ARG F 98 ? 0.1752 0.1967 0.2744 0.0013 0.0077 0.0216 95 ARG D CG 8909 C CD . ARG F 98 ? 0.1947 0.2207 0.3029 0.0035 0.0066 0.0214 95 ARG D CD 8910 N NE . ARG F 98 ? 0.2206 0.2554 0.3352 0.0021 0.0052 0.0225 95 ARG D NE 8911 C CZ . ARG F 98 ? 0.3032 0.3432 0.4269 0.0039 0.0025 0.0237 95 ARG D CZ 8912 N NH1 . ARG F 98 ? 0.2506 0.2878 0.3787 0.0073 0.0012 0.0237 95 ARG D NH1 8913 N NH2 . ARG F 98 ? 0.2338 0.2818 0.3625 0.0022 0.0006 0.0248 95 ARG D NH2 8914 N N . SER F 99 ? 0.2354 0.2619 0.3258 -0.0094 0.0147 0.0180 96 SER D N 8915 C CA . SER F 99 ? 0.2272 0.2536 0.3163 -0.0125 0.0180 0.0159 96 SER D CA 8916 C C . SER F 99 ? 0.2824 0.3135 0.3772 -0.0133 0.0206 0.0143 96 SER D C 8917 O O . SER F 99 ? 0.2271 0.2630 0.3279 -0.0114 0.0193 0.0147 96 SER D O 8918 C CB . SER F 99 ? 0.2458 0.2763 0.3352 -0.0150 0.0165 0.0155 96 SER D CB 8919 O OG . SER F 99 ? 0.4088 0.4482 0.5040 -0.0157 0.0140 0.0158 96 SER D OG 8920 N N . ASN F 100 ? 0.2018 0.2318 0.2956 -0.0162 0.0243 0.0125 97 ASN D N 8921 C CA . ASN F 100 ? 0.2498 0.2844 0.3496 -0.0176 0.0277 0.0107 97 ASN D CA 8922 C C . ASN F 100 ? 0.2977 0.3420 0.4055 -0.0202 0.0261 0.0095 97 ASN D C 8923 O O . ASN F 100 ? 0.2853 0.3342 0.3993 -0.0221 0.0288 0.0077 97 ASN D O 8924 C CB . ASN F 100 ? 0.2345 0.2623 0.3290 -0.0198 0.0329 0.0098 97 ASN D CB 8925 C CG . ASN F 100 ? 0.3425 0.3741 0.4423 -0.0208 0.0376 0.0082 97 ASN D CG 8926 O OD1 . ASN F 100 ? 0.2314 0.2667 0.3358 -0.0182 0.0376 0.0078 97 ASN D OD1 8927 N ND2 . ASN F 100 ? 0.3054 0.3362 0.4055 -0.0247 0.0417 0.0071 97 ASN D ND2 8928 N N . TRP F 101 ? 0.2556 0.3030 0.3631 -0.0203 0.0216 0.0104 98 TRP D N 8929 C CA . TRP F 101 ? 0.2737 0.3306 0.3878 -0.0225 0.0188 0.0095 98 TRP D CA 8930 C C . TRP F 101 ? 0.2362 0.3005 0.3593 -0.0201 0.0164 0.0105 98 TRP D C 8931 O O . TRP F 101 ? 0.1719 0.2333 0.2952 -0.0166 0.0165 0.0119 98 TRP D O 8932 C CB . TRP F 101 ? 0.2636 0.3214 0.3731 -0.0233 0.0149 0.0103 98 TRP D CB 8933 C CG . TRP F 101 ? 0.3612 0.4143 0.4654 -0.0262 0.0172 0.0080 98 TRP D CG 8934 C CD1 . TRP F 101 ? 0.3740 0.4252 0.4794 -0.0292 0.0209 0.0054 98 TRP D CD1 8935 C CD2 . TRP F 101 ? 0.4180 0.4673 0.5155 -0.0264 0.0162 0.0081 98 TRP D CD2 8936 N NE1 . TRP F 101 ? 0.5510 0.5970 0.6511 -0.0310 0.0218 0.0038 98 TRP D NE1 8937 C CE2 . TRP F 101 ? 0.4888 0.5338 0.5842 -0.0292 0.0191 0.0051 98 TRP D CE2 8938 C CE3 . TRP F 101 ? 0.5977 0.6470 0.6917 -0.0246 0.0133 0.0103 98 TRP D CE3 8939 C CZ2 . TRP F 101 ? 0.6230 0.6639 0.7134 -0.0298 0.0192 0.0039 98 TRP D CZ2 8940 C CZ3 . TRP F 101 ? 0.7063 0.7521 0.7951 -0.0255 0.0139 0.0091 98 TRP D CZ3 8941 C CH2 . TRP F 101 ? 0.7216 0.7633 0.8089 -0.0278 0.0168 0.0057 98 TRP D CH2 8942 N N . PRO F 102 ? 0.2445 0.3181 0.3756 -0.0219 0.0140 0.0095 99 PRO D N 8943 C CA . PRO F 102 ? 0.1808 0.2617 0.3220 -0.0193 0.0111 0.0107 99 PRO D CA 8944 C C . PRO F 102 ? 0.2437 0.3230 0.3830 -0.0156 0.0066 0.0144 99 PRO D C 8945 O O . PRO F 102 ? 0.2774 0.3552 0.4098 -0.0163 0.0034 0.0164 99 PRO D O 8946 C CB . PRO F 102 ? 0.1793 0.2701 0.3272 -0.0223 0.0074 0.0096 99 PRO D CB 8947 C CG . PRO F 102 ? 0.1344 0.2232 0.2789 -0.0267 0.0110 0.0064 99 PRO D CG 8948 C CD . PRO F 102 ? 0.1616 0.2396 0.2942 -0.0264 0.0139 0.0069 99 PRO D CD 8949 N N . TYR F 103 ? 0.1987 0.2781 0.3441 -0.0119 0.0068 0.0151 100 TYR D N 8950 C CA . TYR F 103 ? 0.2484 0.3257 0.3941 -0.0081 0.0027 0.0185 100 TYR D CA 8951 C C . TYR F 103 ? 0.2801 0.3473 0.4154 -0.0069 0.0044 0.0195 100 TYR D C 8952 O O . TYR F 103 ? 0.2530 0.3172 0.3879 -0.0041 0.0015 0.0222 100 TYR D O 8953 C CB . TYR F 103 ? 0.2946 0.3776 0.4414 -0.0087 -0.0041 0.0220 100 TYR D CB 8954 C CG . TYR F 103 ? 0.2616 0.3550 0.4195 -0.0094 -0.0074 0.0215 100 TYR D CG 8955 C CD1 . TYR F 103 ? 0.2737 0.3712 0.4435 -0.0058 -0.0096 0.0224 100 TYR D CD1 8956 C CD2 . TYR F 103 ? 0.2911 0.3902 0.4483 -0.0136 -0.0084 0.0198 100 TYR D CD2 8957 C CE1 . TYR F 103 ? 0.2831 0.3906 0.4645 -0.0062 -0.0131 0.0219 100 TYR D CE1 8958 C CE2 . TYR F 103 ? 0.2695 0.3785 0.4374 -0.0144 -0.0120 0.0192 100 TYR D CE2 8959 C CZ . TYR F 103 ? 0.3443 0.4577 0.5246 -0.0106 -0.0144 0.0205 100 TYR D CZ 8960 O OH . TYR F 103 ? 0.3930 0.5168 0.5854 -0.0112 -0.0185 0.0200 100 TYR D OH 8961 N N . LEU F 104 A 0.2866 0.3484 0.4144 -0.0090 0.0089 0.0173 100 LEU D N 8962 C CA . LEU F 104 A 0.2836 0.3358 0.4021 -0.0080 0.0105 0.0179 100 LEU D CA 8963 C C . LEU F 104 A 0.2706 0.3210 0.3850 -0.0073 0.0062 0.0212 100 LEU D C 8964 O O . LEU F 104 A 0.2481 0.2943 0.3619 -0.0045 0.0047 0.0229 100 LEU D O 8965 C CB . LEU F 104 A 0.1984 0.2459 0.3180 -0.0047 0.0129 0.0169 100 LEU D CB 8966 C CG . LEU F 104 A 0.2528 0.3030 0.3780 -0.0048 0.0177 0.0138 100 LEU D CG 8967 C CD1 . LEU F 104 A 0.3187 0.3634 0.4428 -0.0015 0.0201 0.0125 100 LEU D CD1 8968 C CD2 . LEU F 104 A 0.2146 0.2634 0.3353 -0.0086 0.0223 0.0118 100 LEU D CD2 8969 N N . PRO F 105 B 0.2530 0.3066 0.3644 -0.0101 0.0044 0.0218 100 PRO D N 8970 C CA . PRO F 105 B 0.1910 0.2433 0.2982 -0.0099 0.0012 0.0249 100 PRO D CA 8971 C C . PRO F 105 B 0.2498 0.2937 0.3502 -0.0093 0.0033 0.0246 100 PRO D C 8972 O O . PRO F 105 B 0.2762 0.3154 0.3737 -0.0096 0.0070 0.0221 100 PRO D O 8973 C CB . PRO F 105 B 0.2393 0.2975 0.3445 -0.0134 -0.0002 0.0246 100 PRO D CB 8974 C CG . PRO F 105 B 0.2404 0.2988 0.3458 -0.0157 0.0036 0.0205 100 PRO D CG 8975 C CD . PRO F 105 B 0.2413 0.2993 0.3527 -0.0138 0.0057 0.0194 100 PRO D CD 8976 N N . PHE F 106 C 0.2465 0.2886 0.3447 -0.0085 0.0009 0.0274 100 PHE D N 8977 C CA . PHE F 106 C 0.2685 0.3031 0.3622 -0.0074 0.0020 0.0274 100 PHE D CA 8978 C C . PHE F 106 C 0.2878 0.3213 0.3765 -0.0098 0.0039 0.0258 100 PHE D C 8979 O O . PHE F 106 C 0.2171 0.2543 0.3045 -0.0115 0.0028 0.0268 100 PHE D O 8980 C CB . PHE F 106 C 0.2062 0.2397 0.3015 -0.0057 -0.0013 0.0310 100 PHE D CB 8981 C CG . PHE F 106 C 0.2318 0.2636 0.3320 -0.0027 -0.0028 0.0318 100 PHE D CG 8982 C CD1 . PHE F 106 C 0.1776 0.2147 0.2839 -0.0021 -0.0039 0.0320 100 PHE D CD1 8983 C CD2 . PHE F 106 C 0.2567 0.2819 0.3565 -0.0005 -0.0033 0.0320 100 PHE D CD2 8984 C CE1 . PHE F 106 C 0.2690 0.3045 0.3810 0.0010 -0.0050 0.0322 100 PHE D CE1 8985 C CE2 . PHE F 106 C 0.3046 0.3278 0.4091 0.0024 -0.0045 0.0320 100 PHE D CE2 8986 C CZ . PHE F 106 C 0.3017 0.3301 0.4125 0.0032 -0.0052 0.0320 100 PHE D CZ 8987 N N . ASP F 107 ? 0.2454 0.2734 0.3312 -0.0098 0.0068 0.0233 101 ASP D N 8988 C CA . ASP F 107 ? 0.2253 0.2515 0.3076 -0.0117 0.0087 0.0213 101 ASP D CA 8989 C C . ASP F 107 ? 0.1831 0.2013 0.2623 -0.0110 0.0112 0.0197 101 ASP D C 8990 O O . ASP F 107 ? 0.2179 0.2349 0.2971 -0.0112 0.0130 0.0187 101 ASP D O 8991 C CB . ASP F 107 ? 0.2791 0.3114 0.3622 -0.0148 0.0096 0.0193 101 ASP D CB 8992 C CG . ASP F 107 ? 0.4557 0.4856 0.5359 -0.0167 0.0118 0.0165 101 ASP D CG 8993 O OD1 . ASP F 107 ? 0.5003 0.5298 0.5789 -0.0166 0.0114 0.0167 101 ASP D OD1 8994 O OD2 . ASP F 107 ? 0.5661 0.5945 0.6461 -0.0184 0.0141 0.0139 101 ASP D OD2 8995 N N . PRO F 108 ? 0.2437 0.2567 0.3204 -0.0104 0.0111 0.0195 102 PRO D N 8996 C CA . PRO F 108 ? 0.2317 0.2462 0.3091 -0.0102 0.0096 0.0204 102 PRO D CA 8997 C C . PRO F 108 ? 0.2386 0.2509 0.3171 -0.0078 0.0070 0.0230 102 PRO D C 8998 O O . PRO F 108 ? 0.2562 0.2659 0.3346 -0.0061 0.0062 0.0238 102 PRO D O 8999 C CB . PRO F 108 ? 0.1804 0.1898 0.2562 -0.0105 0.0112 0.0184 102 PRO D CB 9000 C CG . PRO F 108 ? 0.1879 0.1899 0.2607 -0.0093 0.0118 0.0184 102 PRO D CG 9001 C CD . PRO F 108 ? 0.1958 0.2009 0.2689 -0.0101 0.0129 0.0184 102 PRO D CD 9002 N N . TRP F 109 ? 0.3055 0.3190 0.3855 -0.0077 0.0059 0.0240 103 TRP D N 9003 C CA . TRP F 109 ? 0.2543 0.2659 0.3363 -0.0060 0.0033 0.0264 103 TRP D CA 9004 C C . TRP F 109 ? 0.2852 0.2918 0.3676 -0.0048 0.0027 0.0258 103 TRP D C 9005 O O . TRP F 109 ? 0.2510 0.2576 0.3335 -0.0056 0.0044 0.0240 103 TRP D O 9006 C CB . TRP F 109 ? 0.2014 0.2194 0.2860 -0.0072 0.0022 0.0289 103 TRP D CB 9007 C CG . TRP F 109 ? 0.3084 0.3315 0.3935 -0.0080 0.0014 0.0304 103 TRP D CG 9008 C CD1 . TRP F 109 ? 0.3027 0.3298 0.3865 -0.0097 0.0027 0.0289 103 TRP D CD1 9009 C CD2 . TRP F 109 ? 0.2186 0.2432 0.3067 -0.0072 -0.0014 0.0339 103 TRP D CD2 9010 N NE1 . TRP F 109 ? 0.3428 0.3744 0.4288 -0.0097 0.0006 0.0312 103 TRP D NE1 9011 C CE2 . TRP F 109 ? 0.2493 0.2791 0.3379 -0.0081 -0.0019 0.0344 103 TRP D CE2 9012 C CE3 . TRP F 109 ? 0.2365 0.2583 0.3275 -0.0058 -0.0038 0.0365 103 TRP D CE3 9013 C CZ2 . TRP F 109 ? 0.3120 0.3442 0.4041 -0.0073 -0.0049 0.0378 103 TRP D CZ2 9014 C CZ3 . TRP F 109 ? 0.2825 0.3062 0.3768 -0.0052 -0.0064 0.0397 103 TRP D CZ3 9015 C CH2 . TRP F 109 ? 0.2786 0.3073 0.3734 -0.0058 -0.0070 0.0405 103 TRP D CH2 9016 N N . GLY F 110 ? 0.1774 0.1799 0.2609 -0.0028 0.0000 0.0272 104 GLY D N 9017 C CA . GLY F 110 ? 0.2045 0.2034 0.2900 -0.0018 -0.0016 0.0270 104 GLY D CA 9018 C C . GLY F 110 ? 0.2599 0.2646 0.3505 -0.0031 -0.0012 0.0281 104 GLY D C 9019 O O . GLY F 110 ? 0.3048 0.3154 0.3957 -0.0049 0.0000 0.0293 104 GLY D O 9020 N N . GLN F 111 ? 0.2251 0.2284 0.3197 -0.0024 -0.0022 0.0277 105 GLN D N 9021 C CA . GLN F 111 ? 0.2055 0.2148 0.3053 -0.0040 -0.0007 0.0283 105 GLN D CA 9022 C C . GLN F 111 ? 0.3098 0.3214 0.4131 -0.0047 -0.0026 0.0316 105 GLN D C 9023 O O . GLN F 111 ? 0.3103 0.3277 0.4166 -0.0068 -0.0009 0.0330 105 GLN D O 9024 C CB . GLN F 111 ? 0.2452 0.2530 0.3500 -0.0030 -0.0008 0.0263 105 GLN D CB 9025 C CG . GLN F 111 ? 0.2301 0.2345 0.3399 -0.0013 -0.0048 0.0275 105 GLN D CG 9026 C CD . GLN F 111 ? 0.3275 0.3235 0.4328 0.0011 -0.0084 0.0271 105 GLN D CD 9027 O OE1 . GLN F 111 ? 0.2899 0.2829 0.3881 0.0013 -0.0076 0.0267 105 GLN D OE1 9028 N NE2 . GLN F 111 ? 0.2709 0.2633 0.3801 0.0026 -0.0123 0.0273 105 GLN D NE2 9029 N N . GLY F 112 ? 0.3013 0.3080 0.4040 -0.0031 -0.0060 0.0328 106 GLY D N 9030 C CA . GLY F 112 ? 0.3077 0.3153 0.4144 -0.0036 -0.0082 0.0359 106 GLY D CA 9031 C C . GLY F 112 ? 0.3461 0.3510 0.4588 -0.0028 -0.0109 0.0360 106 GLY D C 9032 O O . GLY F 112 ? 0.3062 0.3116 0.4221 -0.0026 -0.0103 0.0342 106 GLY D O 9033 N N . THR F 113 ? 0.2857 0.2878 0.4009 -0.0024 -0.0141 0.0378 107 THR D N 9034 C CA . THR F 113 ? 0.2977 0.2973 0.4194 -0.0020 -0.0174 0.0378 107 THR D CA 9035 C C . THR F 113 ? 0.2866 0.2880 0.4139 -0.0039 -0.0185 0.0414 107 THR D C 9036 O O . THR F 113 ? 0.2686 0.2675 0.3941 -0.0034 -0.0199 0.0428 107 THR D O 9037 C CB . THR F 113 ? 0.3350 0.3265 0.4535 0.0006 -0.0215 0.0355 107 THR D CB 9038 O OG1 . THR F 113 ? 0.4183 0.4074 0.5310 0.0021 -0.0206 0.0330 107 THR D OG1 9039 C CG2 . THR F 113 ? 0.3163 0.3056 0.4419 0.0007 -0.0256 0.0353 107 THR D CG2 9040 N N . LEU F 114 ? 0.3344 0.3401 0.4691 -0.0060 -0.0176 0.0429 108 LEU D N 9041 C CA . LEU F 114 ? 0.3203 0.3270 0.4608 -0.0081 -0.0187 0.0467 108 LEU D CA 9042 C C . LEU F 114 ? 0.3294 0.3293 0.4740 -0.0067 -0.0239 0.0457 108 LEU D C 9043 O O . LEU F 114 ? 0.2291 0.2272 0.3772 -0.0057 -0.0262 0.0431 108 LEU D O 9044 C CB . LEU F 114 ? 0.4092 0.4228 0.5565 -0.0113 -0.0155 0.0486 108 LEU D CB 9045 C CG . LEU F 114 ? 0.4355 0.4502 0.5891 -0.0142 -0.0162 0.0534 108 LEU D CG 9046 C CD1 . LEU F 114 ? 0.4469 0.4609 0.5949 -0.0149 -0.0161 0.0573 108 LEU D CD1 9047 C CD2 . LEU F 114 ? 0.5079 0.5302 0.6678 -0.0177 -0.0119 0.0550 108 LEU D CD2 9048 N N . VAL F 115 ? 0.2694 0.2655 0.4136 -0.0064 -0.0261 0.0476 109 VAL D N 9049 C CA . VAL F 115 ? 0.3071 0.2965 0.4553 -0.0054 -0.0310 0.0463 109 VAL D CA 9050 C C . VAL F 115 ? 0.3181 0.3082 0.4747 -0.0081 -0.0320 0.0506 109 VAL D C 9051 O O . VAL F 115 ? 0.3180 0.3087 0.4737 -0.0090 -0.0310 0.0544 109 VAL D O 9052 C CB . VAL F 115 ? 0.3853 0.3684 0.5269 -0.0024 -0.0330 0.0439 109 VAL D CB 9053 C CG1 . VAL F 115 ? 0.3581 0.3343 0.5040 -0.0016 -0.0379 0.0425 109 VAL D CG1 9054 C CG2 . VAL F 115 ? 0.3521 0.3336 0.4853 0.0000 -0.0322 0.0399 109 VAL D CG2 9055 N N . THR F 116 ? 0.2598 0.2497 0.4250 -0.0096 -0.0342 0.0504 110 THR D N 9056 C CA . THR F 116 ? 0.2875 0.2775 0.4617 -0.0127 -0.0351 0.0545 110 THR D CA 9057 C C . THR F 116 ? 0.3378 0.3197 0.5165 -0.0116 -0.0409 0.0522 110 THR D C 9058 O O . THR F 116 ? 0.3205 0.3000 0.5011 -0.0104 -0.0442 0.0480 110 THR D O 9059 C CB . THR F 116 ? 0.3378 0.3348 0.5207 -0.0161 -0.0326 0.0562 110 THR D CB 9060 O OG1 . THR F 116 ? 0.3636 0.3680 0.5418 -0.0173 -0.0268 0.0578 110 THR D OG1 9061 C CG2 . THR F 116 ? 0.3269 0.3236 0.5193 -0.0198 -0.0334 0.0609 110 THR D CG2 9062 N N . VAL F 117 ? 0.2902 0.2678 0.4705 -0.0119 -0.0425 0.0548 111 VAL D N 9063 C CA . VAL F 117 ? 0.2868 0.2563 0.4720 -0.0111 -0.0478 0.0525 111 VAL D CA 9064 C C . VAL F 117 ? 0.3648 0.3350 0.5622 -0.0152 -0.0489 0.0564 111 VAL D C 9065 O O . VAL F 117 ? 0.4574 0.4288 0.6577 -0.0177 -0.0470 0.0623 111 VAL D O 9066 C CB . VAL F 117 ? 0.3108 0.2742 0.4918 -0.0085 -0.0490 0.0521 111 VAL D CB 9067 C CG1 . VAL F 117 ? 0.3404 0.2950 0.5261 -0.0075 -0.0544 0.0485 111 VAL D CG1 9068 C CG2 . VAL F 117 ? 0.2553 0.2193 0.4249 -0.0050 -0.0469 0.0487 111 VAL D CG2 9069 N N . SER F 118 ? 0.3139 0.2833 0.5184 -0.0162 -0.0521 0.0535 112 SER D N 9070 C CA . SER F 118 ? 0.3460 0.3172 0.5634 -0.0206 -0.0527 0.0569 112 SER D CA 9071 C C . SER F 118 ? 0.4043 0.3713 0.6296 -0.0207 -0.0586 0.0521 112 SER D C 9072 O O . SER F 118 ? 0.3771 0.3420 0.5973 -0.0177 -0.0616 0.0464 112 SER D O 9073 C CB . SER F 118 ? 0.3708 0.3524 0.5913 -0.0236 -0.0472 0.0601 112 SER D CB 9074 O OG . SER F 118 ? 0.4339 0.4181 0.6676 -0.0282 -0.0472 0.0632 112 SER D OG 9075 N N . SER F 119 ? 0.3866 0.3521 0.6241 -0.0245 -0.0606 0.0547 113 SER D N 9076 C CA . SER F 119 ? 0.4273 0.3894 0.6741 -0.0254 -0.0665 0.0504 113 SER D CA 9077 C C . SER F 119 ? 0.4250 0.3960 0.6814 -0.0280 -0.0652 0.0506 113 SER D C 9078 O O . SER F 119 ? 0.4597 0.4298 0.7237 -0.0284 -0.0704 0.0465 113 SER D O 9079 C CB . SER F 119 ? 0.3881 0.3435 0.6448 -0.0283 -0.0696 0.0526 113 SER D CB 9080 O OG . SER F 119 ? 0.5529 0.4997 0.8023 -0.0254 -0.0713 0.0515 113 SER D OG 9081 N N . ALA F 120 ? 0.3707 0.3506 0.6270 -0.0298 -0.0584 0.0551 114 ALA D N 9082 C CA . ALA F 120 ? 0.3695 0.3589 0.6360 -0.0323 -0.0559 0.0553 114 ALA D CA 9083 C C . ALA F 120 ? 0.3642 0.3560 0.6264 -0.0284 -0.0578 0.0497 114 ALA D C 9084 O O . ALA F 120 ? 0.3427 0.3316 0.5914 -0.0244 -0.0576 0.0475 114 ALA D O 9085 C CB . ALA F 120 ? 0.3386 0.3363 0.6049 -0.0355 -0.0475 0.0614 114 ALA D CB 9086 N N . SER F 121 ? 0.3795 0.3766 0.6540 -0.0296 -0.0596 0.0476 115 SER D N 9087 C CA . SER F 121 ? 0.4955 0.4947 0.7676 -0.0259 -0.0622 0.0427 115 SER D CA 9088 C C . SER F 121 ? 0.4684 0.4769 0.7392 -0.0256 -0.0548 0.0441 115 SER D C 9089 O O . SER F 121 ? 0.4266 0.4415 0.7011 -0.0290 -0.0479 0.0484 115 SER D O 9090 C CB . SER F 121 ? 0.5975 0.5983 0.8844 -0.0269 -0.0686 0.0395 115 SER D CB 9091 O OG . SER F 121 ? 0.6627 0.6542 0.9492 -0.0268 -0.0762 0.0369 115 SER D OG 9092 N N . THR F 122 ? 0.4551 0.4641 0.7203 -0.0215 -0.0563 0.0404 116 THR D N 9093 C CA . THR F 122 ? 0.4233 0.4404 0.6881 -0.0207 -0.0498 0.0406 116 THR D CA 9094 C C . THR F 122 ? 0.3616 0.3887 0.6447 -0.0237 -0.0473 0.0408 116 THR D C 9095 O O . THR F 122 ? 0.3608 0.3882 0.6567 -0.0244 -0.0530 0.0389 116 THR D O 9096 C CB . THR F 122 ? 0.4653 0.4795 0.7213 -0.0157 -0.0528 0.0365 116 THR D CB 9097 O OG1 . THR F 122 ? 0.5291 0.5444 0.7963 -0.0146 -0.0591 0.0334 116 THR D OG1 9098 C CG2 . THR F 122 ? 0.4744 0.4783 0.7144 -0.0129 -0.0567 0.0354 116 THR D CG2 9099 N N . LYS F 123 ? 0.3489 0.3844 0.6335 -0.0254 -0.0387 0.0427 117 LYS D N 9100 C CA . LYS F 123 ? 0.3459 0.3921 0.6475 -0.0278 -0.0349 0.0421 117 LYS D CA 9101 C C . LYS F 123 ? 0.3158 0.3683 0.6141 -0.0256 -0.0286 0.0401 117 LYS D C 9102 O O . LYS F 123 ? 0.3033 0.3565 0.5896 -0.0260 -0.0224 0.0420 117 LYS D O 9103 C CB . LYS F 123 ? 0.4238 0.4751 0.7336 -0.0339 -0.0293 0.0469 117 LYS D CB 9104 C CG . LYS F 123 ? 0.6244 0.6870 0.9541 -0.0369 -0.0255 0.0461 117 LYS D CG 9105 C CD . LYS F 123 ? 0.8032 0.8688 1.1421 -0.0434 -0.0220 0.0511 117 LYS D CD 9106 C CE . LYS F 123 ? 0.8914 0.9673 1.2481 -0.0459 -0.0181 0.0496 117 LYS D CE 9107 N NZ . LYS F 123 ? 0.9412 1.0272 1.2985 -0.0454 -0.0091 0.0479 117 LYS D NZ 9108 N N . GLY F 124 ? 0.3216 0.3786 0.6311 -0.0231 -0.0306 0.0361 118 GLY D N 9109 C CA . GLY F 124 ? 0.2926 0.3553 0.6016 -0.0207 -0.0251 0.0335 118 GLY D CA 9110 C C . GLY F 124 ? 0.3254 0.3998 0.6442 -0.0248 -0.0150 0.0345 118 GLY D C 9111 O O . GLY F 124 ? 0.2550 0.3345 0.5866 -0.0291 -0.0135 0.0365 118 GLY D O 9143 N N . PRO F 129 ? 0.5073 0.4922 0.6469 0.0363 0.0628 0.0746 123 PRO D N 9144 C CA . PRO F 129 ? 0.4372 0.4247 0.5671 0.0433 0.0638 0.0701 123 PRO D CA 9145 C C . PRO F 129 ? 0.4844 0.4784 0.6079 0.0480 0.0682 0.0745 123 PRO D C 9146 O O . PRO F 129 ? 0.5494 0.5510 0.6784 0.0474 0.0723 0.0824 123 PRO D O 9147 C CB . PRO F 129 ? 0.4028 0.3965 0.5376 0.0454 0.0650 0.0689 123 PRO D CB 9148 C CG . PRO F 129 ? 0.4432 0.4395 0.5907 0.0393 0.0653 0.0746 123 PRO D CG 9149 C CD . PRO F 129 ? 0.4777 0.4700 0.6274 0.0345 0.0650 0.0794 123 PRO D CD 9150 N N . LEU F 130 ? 0.4979 0.4896 0.6100 0.0524 0.0671 0.0698 124 LEU D N 9151 C CA . LEU F 130 ? 0.4727 0.4722 0.5766 0.0578 0.0711 0.0725 124 LEU D CA 9152 C C . LEU F 130 ? 0.5244 0.5293 0.6228 0.0644 0.0729 0.0670 124 LEU D C 9153 O O . LEU F 130 ? 0.5422 0.5423 0.6317 0.0677 0.0698 0.0594 124 LEU D O 9154 C CB . LEU F 130 ? 0.4499 0.4439 0.5443 0.0585 0.0685 0.0710 124 LEU D CB 9155 C CG . LEU F 130 ? 0.3937 0.3812 0.4933 0.0529 0.0665 0.0754 124 LEU D CG 9156 C CD1 . LEU F 130 ? 0.3681 0.3495 0.4590 0.0539 0.0630 0.0724 124 LEU D CD1 9157 C CD2 . LEU F 130 ? 0.4371 0.4317 0.5428 0.0515 0.0708 0.0858 124 LEU D CD2 9158 N N . ALA F 131 ? 0.4813 0.4963 0.5860 0.0663 0.0777 0.0710 125 ALA D N 9159 C CA . ALA F 131 ? 0.5145 0.5348 0.6167 0.0728 0.0799 0.0657 125 ALA D CA 9160 C C . ALA F 131 ? 0.5521 0.5772 0.6401 0.0804 0.0822 0.0619 125 ALA D C 9161 O O . ALA F 131 ? 0.5909 0.6236 0.6742 0.0816 0.0858 0.0678 125 ALA D O 9162 C CB . ALA F 131 ? 0.4851 0.5164 0.5984 0.0731 0.0851 0.0723 125 ALA D CB 9163 N N . PRO F 132 ? 0.6297 0.6506 0.7113 0.0853 0.0799 0.0521 126 PRO D N 9164 C CA . PRO F 132 ? 0.6926 0.7175 0.7600 0.0930 0.0816 0.0465 126 PRO D CA 9165 C C . PRO F 132 ? 0.8658 0.9060 0.9332 0.0994 0.0897 0.0496 126 PRO D C 9166 O O . PRO F 132 ? 0.8157 0.8609 0.8947 0.0994 0.0926 0.0524 126 PRO D O 9167 C CB . PRO F 132 ? 0.6092 0.6235 0.6738 0.0954 0.0760 0.0351 126 PRO D CB 9168 C CG . PRO F 132 ? 0.5684 0.5799 0.6477 0.0917 0.0747 0.0363 126 PRO D CG 9169 C CD . PRO F 132 ? 0.6312 0.6434 0.7193 0.0839 0.0751 0.0457 126 PRO D CD 9170 N N . SER F 133 ? 1.1441 1.1927 1.1990 0.1046 0.0932 0.0495 127 SER D N 9171 C CA . SER F 133 ? 1.3981 1.4634 1.4520 0.1111 0.1015 0.0530 127 SER D CA 9172 C C . SER F 133 ? 1.5811 1.6520 1.6171 0.1191 0.1034 0.0463 127 SER D C 9173 O O . SER F 133 ? 1.6016 1.6642 1.6261 0.1185 0.0983 0.0409 127 SER D O 9174 C CB . SER F 133 ? 1.4655 1.5424 1.5275 0.1067 0.1061 0.0675 127 SER D CB 9175 O OG . SER F 133 ? 1.5066 1.5806 1.5628 0.1024 0.1035 0.0720 127 SER D OG 9176 N N . SER F 134 ? 1.6696 1.7555 1.7033 0.1267 0.1109 0.0466 128 SER D N 9177 C CA . SER F 134 ? 1.7434 1.8361 1.7594 0.1352 0.1135 0.0390 128 SER D CA 9178 C C . SER F 134 ? 1.8242 1.9252 1.8291 0.1335 0.1146 0.0460 128 SER D C 9179 O O . SER F 134 ? 1.8282 1.9315 1.8162 0.1385 0.1141 0.0392 128 SER D O 9180 C CB . SER F 134 ? 1.7062 1.8144 1.7234 0.1442 0.1221 0.0381 128 SER D CB 9181 O OG . SER F 134 ? 1.6792 1.7790 1.7050 0.1471 0.1206 0.0300 128 SER D OG 9182 N N . LYS F 135 ? 1.9079 2.0135 1.9228 0.1264 0.1157 0.0596 129 LYS D N 9183 C CA . LYS F 135 ? 2.0085 2.1195 2.0156 0.1234 0.1152 0.0674 129 LYS D CA 9184 C C . LYS F 135 ? 1.9936 2.0864 2.0006 0.1163 0.1064 0.0650 129 LYS D C 9185 O O . LYS F 135 ? 2.0133 2.1059 2.0240 0.1103 0.1049 0.0746 129 LYS D O 9186 C CB . LYS F 135 ? 2.0702 2.1962 2.0888 0.1197 0.1209 0.0840 129 LYS D CB 9187 C CG . LYS F 135 ? 2.0877 2.2060 2.1260 0.1116 0.1189 0.0914 129 LYS D CG 9188 C CD . LYS F 135 ? 2.1104 2.2348 2.1605 0.1141 0.1234 0.0920 129 LYS D CD 9189 C CE . LYS F 135 ? 2.0874 2.2038 2.1562 0.1055 0.1206 0.0988 129 LYS D CE 9190 N NZ . LYS F 135 ? 2.0895 2.2107 2.1657 0.0988 0.1209 0.1128 129 LYS D NZ 9191 N N . SER F 136 ? 1.9975 2.0754 2.0010 0.1175 0.1006 0.0525 130 SER D N 9192 C CA . SER F 136 ? 1.9441 2.0053 1.9463 0.1119 0.0921 0.0487 130 SER D CA 9193 C C . SER F 136 ? 1.8782 1.9282 1.8714 0.1161 0.0867 0.0339 130 SER D C 9194 O O . SER F 136 ? 1.8088 1.8440 1.8040 0.1119 0.0794 0.0293 130 SER D O 9195 C CB . SER F 136 ? 1.9110 1.9628 1.9301 0.1042 0.0894 0.0539 130 SER D CB 9196 O OG . SER F 136 ? 1.8911 1.9498 1.9178 0.0993 0.0922 0.0669 130 SER D OG 9197 N N . THR F 137 ? 1.8810 1.9384 1.8646 0.1244 0.0905 0.0266 131 THR D N 9198 C CA . THR F 137 ? 1.8571 1.9041 1.8311 0.1291 0.0853 0.0121 131 THR D CA 9199 C C . THR F 137 ? 1.7974 1.8464 1.7523 0.1313 0.0828 0.0083 131 THR D C 9200 O O . THR F 137 ? 1.8606 1.9214 1.8032 0.1383 0.0876 0.0051 131 THR D O 9201 C CB . THR F 137 ? 1.8901 1.9425 1.8649 0.1377 0.0905 0.0047 131 THR D CB 9202 O OG1 . THR F 137 ? 1.8839 1.9356 1.8771 0.1351 0.0927 0.0095 131 THR D OG1 9203 C CG2 . THR F 137 ? 1.9228 1.9623 1.8889 0.1424 0.0843 -0.0109 131 THR D CG2 9204 N N . SER F 138 ? 1.6957 1.7343 1.6484 0.1253 0.0752 0.0090 132 SER D N 9205 C CA . SER F 138 ? 1.6356 1.6756 1.5712 0.1261 0.0717 0.0065 132 SER D CA 9206 C C . SER F 138 ? 1.5878 1.6167 1.5121 0.1303 0.0651 -0.0088 132 SER D C 9207 O O . SER F 138 ? 1.5977 1.6119 1.5240 0.1260 0.0564 -0.0129 132 SER D O 9208 C CB . SER F 138 ? 1.6049 1.6395 1.5438 0.1178 0.0666 0.0150 132 SER D CB 9209 O OG . SER F 138 ? 1.6081 1.6450 1.5312 0.1182 0.0628 0.0136 132 SER D OG 9210 N N . GLY F 139 ? 1.5380 1.5745 1.4508 0.1387 0.0691 -0.0170 133 GLY D N 9211 C CA . GLY F 139 ? 1.4966 1.5231 1.3972 0.1436 0.0631 -0.0325 133 GLY D CA 9212 C C . GLY F 139 ? 1.4479 1.4573 1.3601 0.1429 0.0571 -0.0406 133 GLY D C 9213 O O . GLY F 139 ? 1.4401 1.4351 1.3492 0.1402 0.0475 -0.0474 133 GLY D O 9214 N N . GLY F 140 ? 1.3775 1.3890 1.3037 0.1450 0.0626 -0.0391 134 GLY D N 9215 C CA . GLY F 140 ? 1.2847 1.2819 1.2232 0.1447 0.0575 -0.0457 134 GLY D CA 9216 C C . GLY F 140 ? 1.1603 1.1481 1.1136 0.1350 0.0521 -0.0380 134 GLY D C 9217 O O . GLY F 140 ? 1.1030 1.0790 1.0669 0.1333 0.0468 -0.0421 134 GLY D O 9218 N N . THR F 141 ? 1.1428 1.1360 1.0970 0.1288 0.0535 -0.0266 135 THR D N 9219 C CA . THR F 141 ? 1.0654 1.0511 1.0328 0.1201 0.0493 -0.0192 135 THR D CA 9220 C C . THR F 141 ? 0.9743 0.9700 0.9533 0.1169 0.0567 -0.0069 135 THR D C 9221 O O . THR F 141 ? 1.0500 1.0576 1.0241 0.1173 0.0623 0.0005 135 THR D O 9222 C CB . THR F 141 ? 1.1120 1.0922 1.0720 0.1147 0.0423 -0.0169 135 THR D CB 9223 O OG1 . THR F 141 ? 1.1411 1.1087 1.0956 0.1154 0.0332 -0.0274 135 THR D OG1 9224 C CG2 . THR F 141 ? 1.1224 1.0991 1.0954 0.1065 0.0407 -0.0072 135 THR D CG2 9225 N N . ALA F 142 ? 0.7085 0.6996 0.7032 0.1134 0.0563 -0.0045 136 ALA D N 9226 C CA . ALA F 142 ? 0.5446 0.5432 0.5513 0.1095 0.0622 0.0065 136 ALA D CA 9227 C C . ALA F 142 ? 0.5993 0.5909 0.6132 0.1009 0.0577 0.0130 136 ALA D C 9228 O O . ALA F 142 ? 0.6816 0.6618 0.6980 0.0976 0.0505 0.0088 136 ALA D O 9229 C CB . ALA F 142 ? 0.4192 0.4192 0.4387 0.1113 0.0653 0.0055 136 ALA D CB 9230 N N . ALA F 143 ? 0.4920 0.4908 0.5098 0.0974 0.0620 0.0233 137 ALA D N 9231 C CA . ALA F 143 ? 0.4858 0.4785 0.5114 0.0898 0.0589 0.0294 137 ALA D CA 9232 C C . ALA F 143 ? 0.4510 0.4454 0.4917 0.0860 0.0620 0.0352 137 ALA D C 9233 O O . ALA F 143 ? 0.5024 0.5069 0.5470 0.0878 0.0685 0.0404 137 ALA D O 9234 C CB . ALA F 143 ? 0.3919 0.3894 0.4115 0.0881 0.0601 0.0368 137 ALA D CB 9235 N N . LEU F 144 ? 0.3782 0.3634 0.4273 0.0806 0.0573 0.0346 138 LEU D N 9236 C CA . LEU F 144 ? 0.3862 0.3722 0.4491 0.0759 0.0593 0.0399 138 LEU D CA 9237 C C . LEU F 144 ? 0.3718 0.3499 0.4392 0.0692 0.0551 0.0424 138 LEU D C 9238 O O . LEU F 144 ? 0.3800 0.3522 0.4410 0.0686 0.0505 0.0397 138 LEU D O 9239 C CB . LEU F 144 ? 0.3378 0.3224 0.4081 0.0770 0.0584 0.0351 138 LEU D CB 9240 C CG . LEU F 144 ? 0.4226 0.3970 0.4922 0.0762 0.0510 0.0274 138 LEU D CG 9241 C CD1 . LEU F 144 ? 0.4547 0.4237 0.5348 0.0691 0.0473 0.0296 138 LEU D CD1 9242 C CD2 . LEU F 144 ? 0.5233 0.4985 0.5938 0.0818 0.0511 0.0209 138 LEU D CD2 9243 N N . GLY F 145 ? 0.3147 0.2931 0.3932 0.0643 0.0566 0.0475 139 GLY D N 9244 C CA . GLY F 145 ? 0.3157 0.2870 0.3984 0.0585 0.0532 0.0492 139 GLY D CA 9245 C C . GLY F 145 ? 0.3787 0.3495 0.4732 0.0530 0.0542 0.0532 139 GLY D C 9246 O O . GLY F 145 ? 0.3348 0.3105 0.4360 0.0529 0.0567 0.0547 139 GLY D O 9247 N N . CYS F 146 ? 0.4370 0.4020 0.5342 0.0485 0.0520 0.0547 140 CYS D N 9248 C CA . CYS F 146 ? 0.4588 0.4219 0.5661 0.0429 0.0522 0.0576 140 CYS D CA 9249 C C . CYS F 146 ? 0.4241 0.3847 0.5331 0.0407 0.0534 0.0628 140 CYS D C 9250 O O . CYS F 146 ? 0.3902 0.3475 0.4935 0.0420 0.0520 0.0623 140 CYS D O 9251 C CB . CYS F 146 ? 0.4077 0.3649 0.5179 0.0392 0.0473 0.0525 140 CYS D CB 9252 S SG . CYS F 146 ? 0.7996 0.7600 0.9145 0.0393 0.0459 0.0490 140 CYS D SG 9253 N N . LEU F 147 ? 0.4558 0.4179 0.5735 0.0373 0.0558 0.0680 141 LEU D N 9254 C CA . LEU F 147 ? 0.4185 0.3768 0.5403 0.0346 0.0564 0.0729 141 LEU D CA 9255 C C . LEU F 147 ? 0.4355 0.3860 0.5636 0.0292 0.0534 0.0697 141 LEU D C 9256 O O . LEU F 147 ? 0.4516 0.4029 0.5865 0.0256 0.0531 0.0697 141 LEU D O 9257 C CB . LEU F 147 ? 0.3263 0.2913 0.4542 0.0343 0.0606 0.0816 141 LEU D CB 9258 C CG . LEU F 147 ? 0.3980 0.3588 0.5334 0.0308 0.0608 0.0877 141 LEU D CG 9259 C CD1 . LEU F 147 ? 0.3945 0.3517 0.5246 0.0330 0.0601 0.0884 141 LEU D CD1 9260 C CD2 . LEU F 147 ? 0.4678 0.4371 0.6103 0.0301 0.0646 0.0972 141 LEU D CD2 9261 N N . VAL F 148 ? 0.3554 0.2991 0.4810 0.0289 0.0511 0.0670 142 VAL D N 9262 C CA . VAL F 148 ? 0.3972 0.3339 0.5271 0.0245 0.0484 0.0630 142 VAL D CA 9263 C C . VAL F 148 ? 0.4452 0.3764 0.5812 0.0225 0.0494 0.0668 142 VAL D C 9264 O O . VAL F 148 ? 0.4177 0.3455 0.5515 0.0247 0.0494 0.0676 142 VAL D O 9265 C CB . VAL F 148 ? 0.3177 0.2513 0.4412 0.0258 0.0452 0.0568 142 VAL D CB 9266 C CG1 . VAL F 148 ? 0.2830 0.2116 0.4101 0.0215 0.0427 0.0522 142 VAL D CG1 9267 C CG2 . VAL F 148 ? 0.3065 0.2450 0.4248 0.0281 0.0437 0.0538 142 VAL D CG2 9268 N N . LYS F 149 ? 0.4000 0.3303 0.5445 0.0183 0.0498 0.0694 143 LYS D N 9269 C CA . LYS F 149 ? 0.4150 0.3405 0.5670 0.0165 0.0507 0.0746 143 LYS D CA 9270 C C . LYS F 149 ? 0.3978 0.3141 0.5561 0.0116 0.0482 0.0705 143 LYS D C 9271 O O . LYS F 149 ? 0.4680 0.3841 0.6272 0.0080 0.0462 0.0659 143 LYS D O 9272 C CB . LYS F 149 ? 0.4246 0.3572 0.5827 0.0157 0.0534 0.0833 143 LYS D CB 9273 C CG . LYS F 149 ? 0.4959 0.4258 0.6615 0.0149 0.0545 0.0911 143 LYS D CG 9274 C CD . LYS F 149 ? 0.6010 0.5382 0.7750 0.0127 0.0565 0.1003 143 LYS D CD 9275 C CE . LYS F 149 ? 0.6943 0.6271 0.8784 0.0105 0.0563 0.1081 143 LYS D CE 9276 N NZ . LYS F 149 ? 0.8477 0.7868 1.0422 0.0070 0.0574 0.1175 143 LYS D NZ 9277 N N . ASP F 150 ? 0.4473 0.3562 0.6100 0.0117 0.0481 0.0721 144 ASP D N 9278 C CA . ASP F 150 ? 0.4965 0.3955 0.6661 0.0075 0.0459 0.0686 144 ASP D CA 9279 C C . ASP F 150 ? 0.4451 0.3399 0.6096 0.0064 0.0435 0.0582 144 ASP D C 9280 O O . ASP F 150 ? 0.4706 0.3649 0.6366 0.0019 0.0414 0.0543 144 ASP D O 9281 C CB . ASP F 150 ? 0.5693 0.4692 0.7478 0.0020 0.0451 0.0727 144 ASP D CB 9282 C CG . ASP F 150 ? 0.6452 0.5502 0.8303 0.0026 0.0475 0.0840 144 ASP D CG 9283 O OD1 . ASP F 150 ? 0.5857 0.4900 0.7707 0.0062 0.0491 0.0883 144 ASP D OD1 9284 O OD2 . ASP F 150 ? 0.7415 0.6521 0.9323 -0.0007 0.0477 0.0891 144 ASP D OD2 9285 N N . TYR F 151 ? 0.3883 0.2812 0.5471 0.0104 0.0437 0.0545 145 TYR D N 9286 C CA . TYR F 151 ? 0.3727 0.2630 0.5269 0.0098 0.0419 0.0454 145 TYR D CA 9287 C C . TYR F 151 ? 0.3744 0.2573 0.5291 0.0129 0.0423 0.0422 145 TYR D C 9288 O O . TYR F 151 ? 0.3709 0.2522 0.5281 0.0164 0.0439 0.0475 145 TYR D O 9289 C CB . TYR F 151 ? 0.2304 0.1290 0.3761 0.0116 0.0413 0.0431 145 TYR D CB 9290 C CG . TYR F 151 ? 0.3673 0.2693 0.5077 0.0170 0.0425 0.0461 145 TYR D CG 9291 C CD1 . TYR F 151 ? 0.3608 0.2609 0.4978 0.0200 0.0422 0.0429 145 TYR D CD1 9292 C CD2 . TYR F 151 ? 0.3816 0.2896 0.5203 0.0191 0.0439 0.0521 145 TYR D CD2 9293 C CE1 . TYR F 151 ? 0.3063 0.2098 0.4388 0.0244 0.0426 0.0461 145 TYR D CE1 9294 C CE2 . TYR F 151 ? 0.2756 0.1866 0.4086 0.0236 0.0444 0.0544 145 TYR D CE2 9295 C CZ . TYR F 151 ? 0.3089 0.2175 0.4391 0.0260 0.0435 0.0516 145 TYR D CZ 9296 O OH . TYR F 151 ? 0.3129 0.2247 0.4378 0.0300 0.0434 0.0544 145 TYR D OH 9297 N N . PHE F 152 ? 0.3480 0.2276 0.5006 0.0117 0.0409 0.0339 146 PHE D N 9298 C CA . PHE F 152 ? 0.2661 0.1392 0.4192 0.0150 0.0416 0.0294 146 PHE D CA 9299 C C . PHE F 152 ? 0.3889 0.2639 0.5360 0.0141 0.0402 0.0202 146 PHE D C 9300 O O . PHE F 152 ? 0.4736 0.3493 0.6199 0.0093 0.0383 0.0161 146 PHE D O 9301 C CB . PHE F 152 ? 0.2642 0.1260 0.4268 0.0138 0.0415 0.0298 146 PHE D CB 9302 C CG . PHE F 152 ? 0.3970 0.2513 0.5615 0.0178 0.0425 0.0250 146 PHE D CG 9303 C CD1 . PHE F 152 ? 0.2784 0.1278 0.4411 0.0169 0.0415 0.0147 146 PHE D CD1 9304 C CD2 . PHE F 152 ? 0.3205 0.1732 0.4887 0.0228 0.0445 0.0308 146 PHE D CD2 9305 C CE1 . PHE F 152 ? 0.2992 0.1421 0.4638 0.0214 0.0430 0.0098 146 PHE D CE1 9306 C CE2 . PHE F 152 ? 0.3450 0.1911 0.5162 0.0270 0.0456 0.0267 146 PHE D CE2 9307 C CZ . PHE F 152 ? 0.3751 0.2162 0.5445 0.0267 0.0451 0.0160 146 PHE D CZ 9308 N N . PRO F 153 ? 0.4007 0.2779 0.5437 0.0186 0.0413 0.0177 147 PRO D N 9309 C CA . PRO F 153 ? 0.3979 0.2757 0.5414 0.0240 0.0431 0.0231 147 PRO D CA 9310 C C . PRO F 153 ? 0.4082 0.2959 0.5456 0.0253 0.0425 0.0275 147 PRO D C 9311 O O . PRO F 153 ? 0.4139 0.3074 0.5476 0.0222 0.0408 0.0266 147 PRO D O 9312 C CB . PRO F 153 ? 0.3570 0.2327 0.4997 0.0276 0.0442 0.0170 147 PRO D CB 9313 C CG . PRO F 153 ? 0.3782 0.2596 0.5146 0.0246 0.0426 0.0099 147 PRO D CG 9314 C CD . PRO F 153 ? 0.3172 0.1968 0.4551 0.0185 0.0406 0.0092 147 PRO D CD 9315 N N . GLU F 154 ? 0.3804 0.2699 0.5171 0.0298 0.0435 0.0321 148 GLU D N 9316 C CA . GLU F 154 ? 0.4192 0.3173 0.5496 0.0313 0.0422 0.0351 148 GLU D CA 9317 C C . GLU F 154 ? 0.4104 0.3138 0.5361 0.0311 0.0406 0.0296 148 GLU D C 9318 O O . GLU F 154 ? 0.4055 0.3066 0.5324 0.0313 0.0414 0.0242 148 GLU D O 9319 C CB . GLU F 154 ? 0.3696 0.2681 0.5006 0.0358 0.0432 0.0414 148 GLU D CB 9320 C CG . GLU F 154 ? 0.4927 0.3900 0.6263 0.0359 0.0442 0.0486 148 GLU D CG 9321 C CD . GLU F 154 ? 0.6017 0.5011 0.7349 0.0399 0.0446 0.0551 148 GLU D CD 9322 O OE1 . GLU F 154 ? 0.7080 0.6130 0.8359 0.0404 0.0437 0.0592 148 GLU D OE1 9323 O OE2 . GLU F 154 ? 0.5771 0.4727 0.7152 0.0425 0.0457 0.0559 148 GLU D OE2 9324 N N . PRO F 155 ? 0.4048 0.3157 0.5253 0.0308 0.0383 0.0311 149 PRO D N 9325 C CA . PRO F 155 ? 0.3872 0.3012 0.5051 0.0307 0.0371 0.0357 149 PRO D CA 9326 C C . PRO F 155 ? 0.3798 0.2963 0.4968 0.0267 0.0356 0.0338 149 PRO D C 9327 O O . PRO F 155 ? 0.3866 0.3031 0.5048 0.0234 0.0351 0.0293 149 PRO D O 9328 C CB . PRO F 155 ? 0.3600 0.2798 0.4735 0.0330 0.0347 0.0373 149 PRO D CB 9329 C CG . PRO F 155 ? 0.3088 0.2320 0.4219 0.0319 0.0336 0.0326 149 PRO D CG 9330 C CD . PRO F 155 ? 0.2665 0.1838 0.3837 0.0316 0.0366 0.0286 149 PRO D CD 9331 N N . VAL F 156 ? 0.3613 0.2804 0.4763 0.0271 0.0351 0.0373 150 VAL D N 9332 C CA . VAL F 156 ? 0.3752 0.2983 0.4892 0.0244 0.0332 0.0360 150 VAL D CA 9333 C C . VAL F 156 ? 0.3954 0.3231 0.5046 0.0264 0.0303 0.0369 150 VAL D C 9334 O O . VAL F 156 ? 0.3505 0.2780 0.4568 0.0297 0.0301 0.0394 150 VAL D O 9335 C CB . VAL F 156 ? 0.4764 0.3988 0.5931 0.0232 0.0352 0.0387 150 VAL D CB 9336 C CG1 . VAL F 156 ? 0.5561 0.4736 0.6786 0.0203 0.0370 0.0380 150 VAL D CG1 9337 C CG2 . VAL F 156 ? 0.5348 0.4576 0.6491 0.0270 0.0369 0.0437 150 VAL D CG2 9338 N N . THR F 157 ? 0.3586 0.2902 0.4674 0.0243 0.0276 0.0351 151 THR D N 9339 C CA . THR F 157 ? 0.3766 0.3114 0.4819 0.0260 0.0241 0.0357 151 THR D CA 9340 C C . THR F 157 ? 0.3650 0.3010 0.4707 0.0259 0.0242 0.0359 151 THR D C 9341 O O . THR F 157 ? 0.3503 0.2877 0.4600 0.0229 0.0243 0.0348 151 THR D O 9342 C CB . THR F 157 ? 0.3710 0.3100 0.4768 0.0240 0.0200 0.0339 151 THR D CB 9343 O OG1 . THR F 157 ? 0.5164 0.4554 0.6219 0.0247 0.0207 0.0337 151 THR D OG1 9344 C CG2 . THR F 157 ? 0.3545 0.2956 0.4576 0.0255 0.0156 0.0348 151 THR D CG2 9345 N N . VAL F 158 ? 0.2612 0.1971 0.3627 0.0295 0.0241 0.0373 152 VAL D N 9346 C CA . VAL F 158 ? 0.3519 0.2893 0.4533 0.0305 0.0246 0.0371 152 VAL D CA 9347 C C . VAL F 158 ? 0.3686 0.3071 0.4672 0.0321 0.0199 0.0351 152 VAL D C 9348 O O . VAL F 158 ? 0.3875 0.3249 0.4813 0.0341 0.0174 0.0352 152 VAL D O 9349 C CB . VAL F 158 ? 0.3658 0.3030 0.4645 0.0337 0.0289 0.0401 152 VAL D CB 9350 C CG1 . VAL F 158 ? 0.3688 0.3091 0.4678 0.0353 0.0302 0.0397 152 VAL D CG1 9351 C CG2 . VAL F 158 ? 0.3334 0.2688 0.4365 0.0318 0.0328 0.0428 152 VAL D CG2 9352 N N . SER F 159 ? 0.3943 0.3348 0.4967 0.0309 0.0184 0.0335 153 SER D N 9353 C CA . SER F 159 ? 0.3525 0.2930 0.4538 0.0326 0.0137 0.0313 153 SER D CA 9354 C C . SER F 159 ? 0.3593 0.3008 0.4616 0.0352 0.0158 0.0302 153 SER D C 9355 O O . SER F 159 ? 0.3006 0.2442 0.4065 0.0344 0.0201 0.0318 153 SER D O 9356 C CB . SER F 159 ? 0.3405 0.2829 0.4471 0.0287 0.0086 0.0308 153 SER D CB 9357 O OG . SER F 159 ? 0.3534 0.2967 0.4599 0.0262 0.0080 0.0320 153 SER D OG 9358 N N . TRP F 160 ? 0.3953 0.3354 0.4949 0.0384 0.0125 0.0274 154 TRP D N 9359 C CA . TRP F 160 ? 0.3784 0.3197 0.4796 0.0417 0.0143 0.0256 154 TRP D CA 9360 C C . TRP F 160 ? 0.3882 0.3289 0.4957 0.0408 0.0088 0.0233 154 TRP D C 9361 O O . TRP F 160 ? 0.3481 0.2859 0.4547 0.0402 0.0027 0.0219 154 TRP D O 9362 C CB . TRP F 160 ? 0.3886 0.3287 0.4806 0.0475 0.0161 0.0235 154 TRP D CB 9363 C CG . TRP F 160 ? 0.3474 0.2901 0.4354 0.0485 0.0222 0.0269 154 TRP D CG 9364 C CD1 . TRP F 160 ? 0.3800 0.3214 0.4630 0.0479 0.0226 0.0294 154 TRP D CD1 9365 C CD2 . TRP F 160 ? 0.3838 0.3312 0.4737 0.0501 0.0285 0.0294 154 TRP D CD2 9366 N NE1 . TRP F 160 ? 0.3651 0.3098 0.4470 0.0489 0.0286 0.0332 154 TRP D NE1 9367 C CE2 . TRP F 160 ? 0.4356 0.3842 0.5216 0.0501 0.0323 0.0335 154 TRP D CE2 9368 C CE3 . TRP F 160 ? 0.3481 0.2994 0.4435 0.0515 0.0314 0.0293 154 TRP D CE3 9369 C CZ2 . TRP F 160 ? 0.4182 0.3718 0.5058 0.0511 0.0384 0.0377 154 TRP D CZ2 9370 C CZ3 . TRP F 160 ? 0.3182 0.2751 0.4149 0.0527 0.0378 0.0333 154 TRP D CZ3 9371 C CH2 . TRP F 160 ? 0.3894 0.3474 0.4822 0.0523 0.0410 0.0377 154 TRP D CH2 9372 N N . ASN F 161 ? 0.2757 0.2194 0.3905 0.0405 0.0107 0.0238 155 ASN D N 9373 C CA . ASN F 161 ? 0.3676 0.3115 0.4907 0.0396 0.0058 0.0227 155 ASN D CA 9374 C C . ASN F 161 ? 0.3355 0.2796 0.4627 0.0341 -0.0002 0.0245 155 ASN D C 9375 O O . ASN F 161 ? 0.3836 0.3255 0.5138 0.0340 -0.0065 0.0233 155 ASN D O 9376 C CB . ASN F 161 ? 0.3898 0.3295 0.5099 0.0453 0.0032 0.0179 155 ASN D CB 9377 C CG . ASN F 161 ? 0.4447 0.3863 0.5621 0.0512 0.0095 0.0161 155 ASN D CG 9378 O OD1 . ASN F 161 ? 0.4334 0.3802 0.5533 0.0504 0.0154 0.0195 155 ASN D OD1 9379 N ND2 . ASN F 161 ? 0.4170 0.3549 0.5295 0.0571 0.0081 0.0107 155 ASN D ND2 9380 N N . SER F 162 ? 0.2991 0.2461 0.4267 0.0296 0.0016 0.0274 156 SER D N 9381 C CA . SER F 162 ? 0.3705 0.3199 0.5014 0.0244 -0.0029 0.0294 156 SER D CA 9382 C C . SER F 162 ? 0.3421 0.2886 0.4687 0.0251 -0.0080 0.0288 156 SER D C 9383 O O . SER F 162 ? 0.3743 0.3233 0.5056 0.0217 -0.0135 0.0306 156 SER D O 9384 C CB . SER F 162 ? 0.2830 0.2367 0.4243 0.0209 -0.0066 0.0312 156 SER D CB 9385 O OG . SER F 162 ? 0.3026 0.2606 0.4479 0.0178 -0.0026 0.0332 156 SER D OG 9386 N N . GLY F 163 ? 0.3599 0.3020 0.4781 0.0293 -0.0064 0.0268 157 GLY D N 9387 C CA . GLY F 163 ? 0.3122 0.2517 0.4260 0.0299 -0.0112 0.0267 157 GLY D CA 9388 C C . GLY F 163 ? 0.3394 0.2738 0.4515 0.0334 -0.0161 0.0233 157 GLY D C 9389 O O . GLY F 163 ? 0.3536 0.2850 0.4608 0.0343 -0.0201 0.0228 157 GLY D O 9390 N N . ALA F 164 ? 0.3170 0.2505 0.4334 0.0355 -0.0158 0.0209 158 ALA D N 9391 C CA . ALA F 164 ? 0.3368 0.2646 0.4527 0.0392 -0.0208 0.0167 158 ALA D CA 9392 C C . ALA F 164 ? 0.4323 0.3559 0.5365 0.0449 -0.0181 0.0124 158 ALA D C 9393 O O . ALA F 164 ? 0.4397 0.3578 0.5404 0.0476 -0.0232 0.0083 158 ALA D O 9394 C CB . ALA F 164 ? 0.2067 0.1349 0.3316 0.0404 -0.0208 0.0154 158 ALA D CB 9395 N N . LEU F 165 ? 0.3748 0.3014 0.4733 0.0464 -0.0105 0.0135 159 LEU D N 9396 C CA . LEU F 165 ? 0.3236 0.2485 0.4109 0.0514 -0.0073 0.0106 159 LEU D CA 9397 C C . LEU F 165 ? 0.3887 0.3148 0.4694 0.0498 -0.0057 0.0141 159 LEU D C 9398 O O . LEU F 165 ? 0.3807 0.3106 0.4634 0.0475 -0.0008 0.0182 159 LEU D O 9399 C CB . LEU F 165 ? 0.3607 0.2893 0.4474 0.0552 0.0005 0.0098 159 LEU D CB 9400 C CG . LEU F 165 ? 0.4368 0.3666 0.5121 0.0604 0.0053 0.0080 159 LEU D CG 9401 C CD1 . LEU F 165 ? 0.4898 0.4145 0.5576 0.0651 0.0007 0.0013 159 LEU D CD1 9402 C CD2 . LEU F 165 ? 0.4361 0.3719 0.5134 0.0630 0.0134 0.0095 159 LEU D CD2 9403 N N . THR F 166 ? 0.4226 0.3453 0.4960 0.0510 -0.0103 0.0126 160 THR D N 9404 C CA . THR F 166 ? 0.4510 0.3750 0.5193 0.0495 -0.0098 0.0166 160 THR D CA 9405 C C . THR F 166 ? 0.4735 0.3962 0.5300 0.0534 -0.0096 0.0147 160 THR D C 9406 O O . THR F 166 ? 0.5302 0.4555 0.5822 0.0533 -0.0066 0.0185 160 THR D O 9407 C CB . THR F 166 ? 0.4448 0.3679 0.5175 0.0452 -0.0167 0.0191 160 THR D CB 9408 O OG1 . THR F 166 ? 0.5348 0.4531 0.6069 0.0458 -0.0247 0.0155 160 THR D OG1 9409 C CG2 . THR F 166 ? 0.4168 0.3434 0.5000 0.0409 -0.0162 0.0220 160 THR D CG2 9410 N N . SER F 167 ? 0.4685 0.3874 0.5201 0.0568 -0.0131 0.0087 161 SER D N 9411 C CA . SER F 167 ? 0.5062 0.4244 0.5453 0.0605 -0.0134 0.0061 161 SER D CA 9412 C C . SER F 167 ? 0.4915 0.4151 0.5252 0.0645 -0.0045 0.0064 161 SER D C 9413 O O . SER F 167 ? 0.5043 0.4299 0.5427 0.0663 0.0001 0.0050 161 SER D O 9414 C CB . SER F 167 ? 0.5691 0.4808 0.6040 0.0631 -0.0206 -0.0015 161 SER D CB 9415 O OG . SER F 167 ? 0.7703 0.6811 0.8075 0.0670 -0.0179 -0.0068 161 SER D OG 9416 N N . GLY F 168 ? 0.5071 0.4340 0.5319 0.0656 -0.0022 0.0092 162 GLY D N 9417 C CA . GLY F 168 ? 0.4707 0.4043 0.4903 0.0691 0.0058 0.0109 162 GLY D CA 9418 C C . GLY F 168 ? 0.5377 0.4759 0.5657 0.0665 0.0124 0.0181 162 GLY D C 9419 O O . GLY F 168 ? 0.5537 0.4979 0.5803 0.0687 0.0193 0.0207 162 GLY D O 9420 N N . VAL F 169 ? 0.4411 0.3767 0.4776 0.0617 0.0101 0.0213 163 VAL D N 9421 C CA . VAL F 169 ? 0.4298 0.3682 0.4745 0.0589 0.0155 0.0270 163 VAL D CA 9422 C C . VAL F 169 ? 0.4415 0.3817 0.4843 0.0577 0.0170 0.0332 163 VAL D C 9423 O O . VAL F 169 ? 0.4562 0.3941 0.4972 0.0562 0.0123 0.0342 163 VAL D O 9424 C CB . VAL F 169 ? 0.3899 0.3255 0.4450 0.0547 0.0128 0.0267 163 VAL D CB 9425 C CG1 . VAL F 169 ? 0.3422 0.2800 0.4047 0.0517 0.0179 0.0317 163 VAL D CG1 9426 C CG2 . VAL F 169 ? 0.4513 0.3858 0.5103 0.0558 0.0115 0.0218 163 VAL D CG2 9427 N N . HIS F 170 ? 0.4326 0.3772 0.4769 0.0582 0.0235 0.0380 164 HIS D N 9428 C CA . HIS F 170 ? 0.4407 0.3866 0.4861 0.0568 0.0255 0.0447 164 HIS D CA 9429 C C . HIS F 170 ? 0.4168 0.3624 0.4727 0.0539 0.0297 0.0482 164 HIS D C 9430 O O . HIS F 170 ? 0.4701 0.4191 0.5287 0.0544 0.0347 0.0503 164 HIS D O 9431 C CB . HIS F 170 ? 0.4598 0.4116 0.4973 0.0599 0.0286 0.0484 164 HIS D CB 9432 C CG . HIS F 170 ? 0.6764 0.6285 0.7026 0.0622 0.0239 0.0455 164 HIS D CG 9433 N ND1 . HIS F 170 ? 0.7253 0.6797 0.7424 0.0660 0.0239 0.0403 164 HIS D ND1 9434 C CD2 . HIS F 170 ? 0.7364 0.6867 0.7589 0.0612 0.0189 0.0469 164 HIS D CD2 9435 C CE1 . HIS F 170 ? 0.7390 0.6924 0.7466 0.0670 0.0186 0.0380 164 HIS D CE1 9436 N NE2 . HIS F 170 ? 0.8076 0.7587 0.8185 0.0639 0.0153 0.0425 164 HIS D NE2 9437 N N . THR F 171 ? 0.3881 0.3299 0.4499 0.0508 0.0277 0.0489 165 THR D N 9438 C CA . THR F 171 ? 0.4365 0.3770 0.5073 0.0481 0.0312 0.0516 165 THR D CA 9439 C C . THR F 171 ? 0.4656 0.4059 0.5378 0.0482 0.0329 0.0576 165 THR D C 9440 O O . THR F 171 ? 0.5154 0.4540 0.5872 0.0480 0.0301 0.0584 165 THR D O 9441 C CB . THR F 171 ? 0.3964 0.3336 0.4731 0.0449 0.0284 0.0481 165 THR D CB 9442 O OG1 . THR F 171 ? 0.4169 0.3546 0.4933 0.0447 0.0263 0.0434 165 THR D OG1 9443 C CG2 . THR F 171 ? 0.3740 0.3095 0.4590 0.0420 0.0319 0.0498 165 THR D CG2 9444 N N . PHE F 172 ? 0.4419 0.3846 0.5168 0.0485 0.0376 0.0625 166 PHE D N 9445 C CA . PHE F 172 ? 0.4315 0.3746 0.5087 0.0489 0.0393 0.0693 166 PHE D CA 9446 C C . PHE F 172 ? 0.4848 0.4222 0.5710 0.0466 0.0395 0.0698 166 PHE D C 9447 O O . PHE F 172 ? 0.4777 0.4120 0.5692 0.0442 0.0399 0.0661 166 PHE D O 9448 C CB . PHE F 172 ? 0.3991 0.3473 0.4777 0.0496 0.0439 0.0752 166 PHE D CB 9449 C CG . PHE F 172 ? 0.4866 0.4419 0.5551 0.0529 0.0444 0.0754 166 PHE D CG 9450 C CD1 . PHE F 172 ? 0.4986 0.4582 0.5607 0.0549 0.0437 0.0800 166 PHE D CD1 9451 C CD2 . PHE F 172 ? 0.4613 0.4194 0.5267 0.0541 0.0454 0.0708 166 PHE D CD2 9452 C CE1 . PHE F 172 ? 0.5161 0.4827 0.5675 0.0580 0.0440 0.0793 166 PHE D CE1 9453 C CE2 . PHE F 172 ? 0.4934 0.4580 0.5488 0.0577 0.0461 0.0699 166 PHE D CE2 9454 C CZ . PHE F 172 ? 0.5519 0.5208 0.5997 0.0597 0.0454 0.0738 166 PHE D CZ 9455 N N . PRO F 173 ? 0.4762 0.4127 0.5641 0.0475 0.0391 0.0743 167 PRO D N 9456 C CA . PRO F 173 ? 0.4972 0.4281 0.5939 0.0463 0.0399 0.0748 167 PRO D CA 9457 C C . PRO F 173 ? 0.4614 0.3895 0.5665 0.0443 0.0434 0.0765 167 PRO D C 9458 O O . PRO F 173 ? 0.4638 0.3955 0.5693 0.0444 0.0458 0.0815 167 PRO D O 9459 C CB . PRO F 173 ? 0.4432 0.3752 0.5404 0.0483 0.0394 0.0811 167 PRO D CB 9460 C CG . PRO F 173 ? 0.4806 0.4180 0.5673 0.0500 0.0364 0.0814 167 PRO D CG 9461 C CD . PRO F 173 ? 0.4696 0.4102 0.5510 0.0499 0.0376 0.0788 167 PRO D CD 9462 N N . ALA F 174 ? 0.4665 0.3888 0.5781 0.0423 0.0436 0.0726 168 ALA D N 9463 C CA . ALA F 174 ? 0.4425 0.3608 0.5625 0.0398 0.0461 0.0737 168 ALA D CA 9464 C C . ALA F 174 ? 0.4927 0.4096 0.6195 0.0407 0.0480 0.0816 168 ALA D C 9465 O O . ALA F 174 ? 0.4934 0.4099 0.6205 0.0430 0.0475 0.0849 168 ALA D O 9466 C CB . ALA F 174 ? 0.3789 0.2911 0.5033 0.0376 0.0453 0.0670 168 ALA D CB 9467 N N . VAL F 175 ? 0.4716 0.3881 0.6046 0.0385 0.0500 0.0856 169 VAL D N 9468 C CA . VAL F 175 ? 0.4429 0.3578 0.5846 0.0386 0.0515 0.0940 169 VAL D CA 9469 C C . VAL F 175 ? 0.4759 0.3816 0.6287 0.0356 0.0517 0.0922 169 VAL D C 9470 O O . VAL F 175 ? 0.5012 0.4057 0.6555 0.0324 0.0517 0.0886 169 VAL D O 9471 C CB . VAL F 175 ? 0.4369 0.3607 0.5775 0.0386 0.0535 0.1024 169 VAL D CB 9472 C CG1 . VAL F 175 ? 0.4853 0.4071 0.6380 0.0372 0.0548 0.1115 169 VAL D CG1 9473 C CG2 . VAL F 175 ? 0.4132 0.3453 0.5432 0.0421 0.0531 0.1051 169 VAL D CG2 9474 N N . LEU F 176 ? 0.4811 0.3799 0.6420 0.0366 0.0516 0.0944 170 LEU D N 9475 C CA . LEU F 176 ? 0.4681 0.3570 0.6404 0.0340 0.0514 0.0930 170 LEU D CA 9476 C C . LEU F 176 ? 0.4425 0.3340 0.6227 0.0311 0.0522 0.1021 170 LEU D C 9477 O O . LEU F 176 ? 0.4868 0.3843 0.6690 0.0325 0.0529 0.1114 170 LEU D O 9478 C CB . LEU F 176 ? 0.4612 0.3448 0.6381 0.0359 0.0505 0.0909 170 LEU D CB 9479 C CG . LEU F 176 ? 0.4847 0.3592 0.6702 0.0332 0.0492 0.0857 170 LEU D CG 9480 C CD1 . LEU F 176 ? 0.5204 0.3894 0.7025 0.0312 0.0486 0.0752 170 LEU D CD1 9481 C CD2 . LEU F 176 ? 0.4291 0.2994 0.6194 0.0360 0.0487 0.0846 170 LEU D CD2 9482 N N . GLN F 177 ? 0.4455 0.3339 0.6301 0.0269 0.0516 0.0997 171 GLN D N 9483 C CA . GLN F 177 ? 0.4623 0.3544 0.6551 0.0235 0.0518 0.1083 171 GLN D CA 9484 C C . GLN F 177 ? 0.5077 0.3928 0.7112 0.0211 0.0493 0.1079 171 GLN D C 9485 O O . GLN F 177 ? 0.3843 0.2611 0.5881 0.0222 0.0478 0.1001 171 GLN D O 9486 C CB . GLN F 177 ? 0.4576 0.3519 0.6500 0.0199 0.0522 0.1068 171 GLN D CB 9487 C CG . GLN F 177 ? 0.5503 0.4562 0.7297 0.0222 0.0538 0.1052 171 GLN D CG 9488 C CD . GLN F 177 ? 0.7328 0.6416 0.9109 0.0188 0.0535 0.1011 171 GLN D CD 9489 O OE1 . GLN F 177 ? 0.8133 0.7322 0.9894 0.0188 0.0554 0.1059 171 GLN D OE1 9490 N NE2 . GLN F 177 ? 0.8134 0.7139 0.9925 0.0161 0.0512 0.0922 171 GLN D NE2 9491 N N . SER F 178 ? 0.5665 0.4552 0.7790 0.0180 0.0487 0.1164 172 SER D N 9492 C CA . SER F 178 ? 0.6088 0.4907 0.8326 0.0153 0.0457 0.1169 172 SER D CA 9493 C C . SER F 178 ? 0.5846 0.4549 0.8098 0.0122 0.0430 0.1056 172 SER D C 9494 O O . SER F 178 ? 0.5687 0.4294 0.7991 0.0121 0.0407 0.1007 172 SER D O 9495 C CB . SER F 178 ? 0.6543 0.5437 0.8878 0.0120 0.0453 0.1287 172 SER D CB 9496 O OG . SER F 178 ? 0.7356 0.6378 0.9660 0.0147 0.0483 0.1393 172 SER D OG 9497 N N . SER F 179 ? 0.5399 0.4113 0.7602 0.0099 0.0434 0.1015 173 SER D N 9498 C CA . SER F 179 ? 0.5422 0.4042 0.7629 0.0063 0.0408 0.0914 173 SER D CA 9499 C C . SER F 179 ? 0.5201 0.3739 0.7344 0.0094 0.0406 0.0797 173 SER D C 9500 O O . SER F 179 ? 0.5945 0.4389 0.8100 0.0071 0.0382 0.0708 173 SER D O 9501 C CB . SER F 179 ? 0.5591 0.4265 0.7763 0.0032 0.0415 0.0911 173 SER D CB 9502 O OG . SER F 179 ? 0.5408 0.4139 0.7480 0.0070 0.0446 0.0899 173 SER D OG 9503 N N . GLY F 180 ? 0.4567 0.3145 0.6640 0.0145 0.0432 0.0799 174 GLY D N 9504 C CA . GLY F 180 ? 0.4676 0.3201 0.6687 0.0179 0.0435 0.0700 174 GLY D CA 9505 C C . GLY F 180 ? 0.4370 0.2933 0.6289 0.0183 0.0447 0.0651 174 GLY D C 9506 O O . GLY F 180 ? 0.4432 0.2975 0.6293 0.0212 0.0453 0.0579 174 GLY D O 9507 N N . LEU F 181 ? 0.3618 0.2240 0.5529 0.0153 0.0452 0.0693 175 LEU D N 9508 C CA . LEU F 181 ? 0.3874 0.2562 0.5687 0.0155 0.0457 0.0651 175 LEU D CA 9509 C C . LEU F 181 ? 0.4204 0.2992 0.5942 0.0198 0.0477 0.0703 175 LEU D C 9510 O O . LEU F 181 ? 0.4695 0.3511 0.6468 0.0216 0.0490 0.0793 175 LEU D O 9511 C CB . LEU F 181 ? 0.3598 0.2323 0.5425 0.0102 0.0446 0.0658 175 LEU D CB 9512 C CG . LEU F 181 ? 0.3797 0.2425 0.5706 0.0048 0.0419 0.0620 175 LEU D CG 9513 C CD1 . LEU F 181 ? 0.3493 0.2178 0.5422 -0.0005 0.0408 0.0646 175 LEU D CD1 9514 C CD2 . LEU F 181 ? 0.3502 0.2061 0.5366 0.0049 0.0404 0.0500 175 LEU D CD2 9515 N N . TYR F 182 ? 0.3832 0.2677 0.5469 0.0211 0.0474 0.0649 176 TYR D N 9516 C CA . TYR F 182 ? 0.3357 0.2287 0.4915 0.0250 0.0484 0.0685 176 TYR D CA 9517 C C . TYR F 182 ? 0.3997 0.3016 0.5514 0.0239 0.0490 0.0711 176 TYR D C 9518 O O . TYR F 182 ? 0.3255 0.2278 0.4792 0.0202 0.0483 0.0687 176 TYR D O 9519 C CB . TYR F 182 ? 0.3552 0.2489 0.5033 0.0276 0.0473 0.0619 176 TYR D CB 9520 C CG . TYR F 182 ? 0.3645 0.2518 0.5162 0.0304 0.0475 0.0608 176 TYR D CG 9521 C CD1 . TYR F 182 ? 0.3770 0.2564 0.5326 0.0293 0.0470 0.0539 176 TYR D CD1 9522 C CD2 . TYR F 182 ? 0.3603 0.2498 0.5115 0.0344 0.0483 0.0668 176 TYR D CD2 9523 C CE1 . TYR F 182 ? 0.4436 0.3174 0.6031 0.0326 0.0477 0.0526 176 TYR D CE1 9524 C CE2 . TYR F 182 ? 0.4467 0.3309 0.6024 0.0373 0.0487 0.0664 176 TYR D CE2 9525 C CZ . TYR F 182 ? 0.4229 0.2992 0.5830 0.0367 0.0486 0.0592 176 TYR D CZ 9526 O OH . TYR F 182 ? 0.4790 0.3502 0.6441 0.0404 0.0494 0.0585 176 TYR D OH 9527 N N . SER F 183 ? 0.4258 0.3349 0.5718 0.0272 0.0502 0.0758 177 SER D N 9528 C CA . SER F 183 ? 0.4770 0.3950 0.6183 0.0275 0.0512 0.0777 177 SER D CA 9529 C C . SER F 183 ? 0.4036 0.3274 0.5346 0.0319 0.0510 0.0776 177 SER D C 9530 O O . SER F 183 ? 0.3563 0.2795 0.4857 0.0345 0.0509 0.0806 177 SER D O 9531 C CB . SER F 183 ? 0.5377 0.4598 0.6857 0.0263 0.0535 0.0866 177 SER D CB 9532 O OG . SER F 183 ? 0.6624 0.5944 0.8053 0.0277 0.0553 0.0886 177 SER D OG 9533 N N . LEU F 184 ? 0.3801 0.3092 0.5047 0.0326 0.0505 0.0741 178 LEU D N 9534 C CA . LEU F 184 ? 0.3993 0.3336 0.5140 0.0366 0.0498 0.0736 178 LEU D CA 9535 C C . LEU F 184 ? 0.4385 0.3792 0.5489 0.0375 0.0505 0.0717 178 LEU D C 9536 O O . LEU F 184 ? 0.4922 0.4335 0.6075 0.0350 0.0512 0.0707 178 LEU D O 9537 C CB . LEU F 184 ? 0.4406 0.3711 0.5507 0.0375 0.0464 0.0679 178 LEU D CB 9538 C CG . LEU F 184 ? 0.5288 0.4584 0.6369 0.0359 0.0436 0.0605 178 LEU D CG 9539 C CD1 . LEU F 184 ? 0.5343 0.4621 0.6385 0.0371 0.0404 0.0573 178 LEU D CD1 9540 C CD2 . LEU F 184 ? 0.6344 0.5603 0.7499 0.0317 0.0439 0.0580 178 LEU D CD2 9541 N N . SER F 185 ? 0.3623 0.3077 0.4637 0.0414 0.0501 0.0713 179 SER D N 9542 C CA . SER F 185 ? 0.4502 0.4010 0.5468 0.0434 0.0506 0.0684 179 SER D CA 9543 C C . SER F 185 ? 0.4992 0.4484 0.5875 0.0456 0.0465 0.0621 179 SER D C 9544 O O . SER F 185 ? 0.4854 0.4325 0.5692 0.0466 0.0443 0.0623 179 SER D O 9545 C CB . SER F 185 ? 0.5458 0.5051 0.6391 0.0465 0.0545 0.0740 179 SER D CB 9546 O OG . SER F 185 ? 0.6241 0.5867 0.7262 0.0443 0.0580 0.0797 179 SER D OG 9547 N N . SER F 186 ? 0.4219 0.3721 0.5091 0.0460 0.0453 0.0571 180 SER D N 9548 C CA . SER F 186 ? 0.4708 0.4197 0.5509 0.0482 0.0411 0.0514 180 SER D CA 9549 C C . SER F 186 ? 0.4906 0.4449 0.5656 0.0523 0.0429 0.0497 180 SER D C 9550 O O . SER F 186 ? 0.4848 0.4427 0.5647 0.0522 0.0459 0.0503 180 SER D O 9551 C CB . SER F 186 ? 0.4060 0.3508 0.4906 0.0450 0.0372 0.0467 180 SER D CB 9552 O OG . SER F 186 ? 0.3728 0.3161 0.4520 0.0467 0.0324 0.0421 180 SER D OG 9553 N N . VAL F 187 ? 0.4702 0.4255 0.5353 0.0560 0.0411 0.0475 181 VAL D N 9554 C CA . VAL F 187 ? 0.3928 0.3532 0.4516 0.0607 0.0430 0.0449 181 VAL D CA 9555 C C . VAL F 187 ? 0.4393 0.3957 0.4912 0.0631 0.0375 0.0374 181 VAL D C 9556 O O . VAL F 187 ? 0.4668 0.4182 0.5160 0.0615 0.0324 0.0361 181 VAL D O 9557 C CB . VAL F 187 ? 0.4596 0.4272 0.5115 0.0638 0.0470 0.0499 181 VAL D CB 9558 C CG1 . VAL F 187 ? 0.3869 0.3589 0.4471 0.0614 0.0522 0.0582 181 VAL D CG1 9559 C CG2 . VAL F 187 ? 0.5004 0.4655 0.5447 0.0639 0.0433 0.0507 181 VAL D CG2 9560 N N . VAL F 188 ? 0.3952 0.3537 0.4449 0.0668 0.0383 0.0326 182 VAL D N 9561 C CA . VAL F 188 ? 0.3881 0.3420 0.4318 0.0694 0.0328 0.0250 182 VAL D CA 9562 C C . VAL F 188 ? 0.5183 0.4772 0.5539 0.0759 0.0359 0.0209 182 VAL D C 9563 O O . VAL F 188 ? 0.5407 0.5066 0.5795 0.0781 0.0421 0.0231 182 VAL D O 9564 C CB . VAL F 188 ? 0.4422 0.3906 0.4950 0.0668 0.0285 0.0214 182 VAL D CB 9565 C CG1 . VAL F 188 ? 0.4317 0.3842 0.4939 0.0666 0.0332 0.0229 182 VAL D CG1 9566 C CG2 . VAL F 188 ? 0.4571 0.4000 0.5052 0.0695 0.0223 0.0137 182 VAL D CG2 9567 N N . THR F 189 ? 0.5880 0.5438 0.6130 0.0790 0.0316 0.0151 183 THR D N 9568 C CA . THR F 189 ? 0.6292 0.5889 0.6450 0.0857 0.0338 0.0092 183 THR D CA 9569 C C . THR F 189 ? 0.6236 0.5761 0.6421 0.0880 0.0291 0.0004 183 THR D C 9570 O O . THR F 189 ? 0.6415 0.5854 0.6621 0.0850 0.0215 -0.0026 183 THR D O 9571 C CB . THR F 189 ? 0.7129 0.6742 0.7138 0.0881 0.0319 0.0078 183 THR D CB 9572 O OG1 . THR F 189 ? 0.7874 0.7398 0.7865 0.0846 0.0234 0.0056 183 THR D OG1 9573 C CG2 . THR F 189 ? 0.6547 0.6249 0.6535 0.0868 0.0374 0.0172 183 THR D CG2 9574 N N . VAL F 190 ? 0.5445 0.5013 0.5642 0.0933 0.0337 -0.0032 184 VAL D N 9575 C CA . VAL F 190 ? 0.5143 0.4648 0.5389 0.0960 0.0300 -0.0110 184 VAL D CA 9576 C C . VAL F 190 ? 0.5830 0.5372 0.5984 0.1047 0.0335 -0.0187 184 VAL D C 9577 O O . VAL F 190 ? 0.6223 0.5862 0.6292 0.1082 0.0400 -0.0164 184 VAL D O 9578 C CB . VAL F 190 ? 0.4222 0.3739 0.4629 0.0931 0.0323 -0.0071 184 VAL D CB 9579 C CG1 . VAL F 190 ? 0.4282 0.3754 0.4770 0.0849 0.0279 -0.0016 184 VAL D CG1 9580 C CG2 . VAL F 190 ? 0.5026 0.4660 0.5462 0.0950 0.0418 -0.0010 184 VAL D CG2 9581 N N . PRO F 191 ? 0.6099 0.5566 0.6270 0.1084 0.0290 -0.0277 185 PRO D N 9582 C CA . PRO F 191 ? 0.6269 0.5773 0.6365 0.1175 0.0331 -0.0358 185 PRO D CA 9583 C C . PRO F 191 ? 0.6603 0.6223 0.6776 0.1210 0.0429 -0.0313 185 PRO D C 9584 O O . PRO F 191 ? 0.6228 0.5845 0.6552 0.1177 0.0435 -0.0268 185 PRO D O 9585 C CB . PRO F 191 ? 0.6334 0.5713 0.6472 0.1196 0.0253 -0.0456 185 PRO D CB 9586 C CG . PRO F 191 ? 0.5831 0.5113 0.6002 0.1118 0.0158 -0.0433 185 PRO D CG 9587 C CD . PRO F 191 ? 0.5878 0.5222 0.6119 0.1048 0.0194 -0.0315 185 PRO D CD 9588 N N . SER F 192 ? 0.7005 0.6735 0.7077 0.1275 0.0504 -0.0321 186 SER D N 9589 C CA . SER F 192 ? 0.7123 0.6982 0.7264 0.1314 0.0601 -0.0274 186 SER D CA 9590 C C . SER F 192 ? 0.7177 0.7002 0.7439 0.1355 0.0601 -0.0326 186 SER D C 9591 O O . SER F 192 ? 0.6832 0.6732 0.7222 0.1351 0.0654 -0.0261 186 SER D O 9592 C CB . SER F 192 ? 0.7473 0.7459 0.7469 0.1389 0.0674 -0.0291 186 SER D CB 9593 O OG . SER F 192 ? 0.7891 0.7931 0.7797 0.1349 0.0682 -0.0221 186 SER D OG 9594 N N . SER F 193 ? 0.7045 0.6755 0.7274 0.1393 0.0536 -0.0440 187 SER D N 9595 C CA . SER F 193 ? 0.6868 0.6534 0.7211 0.1441 0.0528 -0.0500 187 SER D CA 9596 C C . SER F 193 ? 0.6975 0.6575 0.7501 0.1364 0.0477 -0.0441 187 SER D C 9597 O O . SER F 193 ? 0.7346 0.6930 0.8001 0.1391 0.0476 -0.0460 187 SER D O 9598 C CB . SER F 193 ? 0.7113 0.6661 0.7364 0.1502 0.0464 -0.0642 187 SER D CB 9599 O OG . SER F 193 ? 0.7152 0.6574 0.7364 0.1436 0.0360 -0.0658 187 SER D OG 9600 N N . SER F 194 ? 0.6852 0.6422 0.7389 0.1271 0.0435 -0.0371 188 SER D N 9601 C CA . SER F 194 ? 0.6469 0.5988 0.7163 0.1193 0.0385 -0.0315 188 SER D CA 9602 C C . SER F 194 ? 0.5940 0.5567 0.6737 0.1150 0.0450 -0.0204 188 SER D C 9603 O O . SER F 194 ? 0.5470 0.5080 0.6403 0.1091 0.0422 -0.0155 188 SER D O 9604 C CB . SER F 194 ? 0.6268 0.5695 0.6924 0.1117 0.0300 -0.0304 188 SER D CB 9605 O OG . SER F 194 ? 0.6115 0.5604 0.6715 0.1070 0.0335 -0.0227 188 SER D OG 9606 N N . LEU F 195 ? 0.5402 0.5143 0.6135 0.1176 0.0534 -0.0162 189 LEU D N 9607 C CA . LEU F 195 ? 0.5839 0.5680 0.6662 0.1131 0.0592 -0.0052 189 LEU D CA 9608 C C . LEU F 195 ? 0.6788 0.6680 0.7770 0.1145 0.0621 -0.0027 189 LEU D C 9609 O O . LEU F 195 ? 0.7271 0.7219 0.8358 0.1089 0.0644 0.0063 189 LEU D O 9610 C CB . LEU F 195 ? 0.5741 0.5703 0.6469 0.1162 0.0673 -0.0009 189 LEU D CB 9611 C CG . LEU F 195 ? 0.6557 0.6499 0.7154 0.1131 0.0654 0.0006 189 LEU D CG 9612 C CD1 . LEU F 195 ? 0.6489 0.6571 0.7031 0.1151 0.0737 0.0077 189 LEU D CD1 9613 C CD2 . LEU F 195 ? 0.6518 0.6383 0.7176 0.1033 0.0596 0.0057 189 LEU D CD2 9614 N N . GLY F 196 ? 0.6937 0.6804 0.7938 0.1220 0.0617 -0.0106 190 GLY D N 9615 C CA . GLY F 196 ? 0.7881 0.7801 0.9040 0.1243 0.0645 -0.0082 190 GLY D CA 9616 C C . GLY F 196 ? 0.8433 0.8249 0.9716 0.1203 0.0562 -0.0100 190 GLY D C 9617 O O . GLY F 196 ? 0.8586 0.8442 1.0023 0.1191 0.0570 -0.0054 190 GLY D O 9618 N N . THR F 197 ? 0.8402 0.8094 0.9624 0.1178 0.0478 -0.0157 191 THR D N 9619 C CA . THR F 197 ? 0.8479 0.8075 0.9816 0.1142 0.0392 -0.0173 191 THR D CA 9620 C C . THR F 197 ? 0.7704 0.7264 0.9067 0.1032 0.0333 -0.0109 191 THR D C 9621 O O . THR F 197 ? 0.7111 0.6671 0.8610 0.0975 0.0298 -0.0059 191 THR D O 9622 C CB . THR F 197 ? 0.8949 0.8425 1.0223 0.1199 0.0329 -0.0289 191 THR D CB 9623 O OG1 . THR F 197 ? 0.9289 0.8701 1.0420 0.1167 0.0285 -0.0315 191 THR D OG1 9624 C CG2 . THR F 197 ? 0.9597 0.9109 1.0812 0.1316 0.0393 -0.0367 191 THR D CG2 9625 N N . GLN F 198 ? 0.6915 0.6451 0.8146 0.1003 0.0324 -0.0110 192 GLN D N 9626 C CA . GLN F 198 ? 0.6192 0.5690 0.7432 0.0910 0.0269 -0.0063 192 GLN D CA 9627 C C . GLN F 198 ? 0.6132 0.5712 0.7385 0.0853 0.0321 0.0026 192 GLN D C 9628 O O . GLN F 198 ? 0.6070 0.5709 0.7243 0.0878 0.0386 0.0044 192 GLN D O 9629 C CB . GLN F 198 ? 0.6337 0.5755 0.7439 0.0910 0.0220 -0.0112 192 GLN D CB 9630 C CG . GLN F 198 ? 0.6504 0.5892 0.7604 0.0823 0.0170 -0.0064 192 GLN D CG 9631 C CD . GLN F 198 ? 0.6499 0.5835 0.7715 0.0773 0.0089 -0.0055 192 GLN D CD 9632 O OE1 . GLN F 198 ? 0.6984 0.6249 0.8222 0.0800 0.0029 -0.0110 192 GLN D OE1 9633 N NE2 . GLN F 198 ? 0.5865 0.5239 0.7157 0.0699 0.0084 0.0016 192 GLN D NE2 9634 N N . THR F 199 ? 0.5823 0.5408 0.7179 0.0776 0.0291 0.0084 193 THR D N 9635 C CA . THR F 199 ? 0.5696 0.5340 0.7065 0.0717 0.0329 0.0159 193 THR D CA 9636 C C . THR F 199 ? 0.4861 0.4456 0.6141 0.0670 0.0298 0.0164 193 THR D C 9637 O O . THR F 199 ? 0.4816 0.4340 0.6076 0.0653 0.0230 0.0132 193 THR D O 9638 C CB . THR F 199 ? 0.5495 0.5177 0.7010 0.0654 0.0314 0.0217 193 THR D CB 9639 O OG1 . THR F 199 ? 0.6676 0.6299 0.8230 0.0604 0.0233 0.0208 193 THR D OG1 9640 C CG2 . THR F 199 ? 0.4608 0.4344 0.6228 0.0701 0.0342 0.0220 193 THR D CG2 9641 N N . TYR F 200 ? 0.3961 0.3596 0.5196 0.0651 0.0346 0.0208 194 TYR D N 9642 C CA . TYR F 200 ? 0.3642 0.3238 0.4804 0.0611 0.0325 0.0219 194 TYR D CA 9643 C C . TYR F 200 ? 0.3902 0.3525 0.5125 0.0542 0.0341 0.0282 194 TYR D C 9644 O O . TYR F 200 ? 0.3505 0.3189 0.4767 0.0538 0.0394 0.0327 194 TYR D O 9645 C CB . TYR F 200 ? 0.3951 0.3555 0.4988 0.0658 0.0362 0.0207 194 TYR D CB 9646 C CG . TYR F 200 ? 0.4636 0.4202 0.5594 0.0723 0.0338 0.0133 194 TYR D CG 9647 C CD1 . TYR F 200 ? 0.4396 0.3882 0.5305 0.0713 0.0267 0.0091 194 TYR D CD1 9648 C CD2 . TYR F 200 ? 0.4751 0.4364 0.5686 0.0795 0.0385 0.0104 194 TYR D CD2 9649 C CE1 . TYR F 200 ? 0.4995 0.4436 0.5833 0.0768 0.0236 0.0019 194 TYR D CE1 9650 C CE2 . TYR F 200 ? 0.4922 0.4492 0.5778 0.0858 0.0361 0.0024 194 TYR D CE2 9651 C CZ . TYR F 200 ? 0.5494 0.4972 0.6301 0.0842 0.0283 -0.0020 194 TYR D CZ 9652 O OH . TYR F 200 ? 0.5518 0.4944 0.6248 0.0899 0.0250 -0.0105 194 TYR D OH 9653 N N . ILE F 201 ? 0.3701 0.3282 0.4934 0.0486 0.0291 0.0284 195 ILE D N 9654 C CA . ILE F 201 ? 0.3522 0.3119 0.4807 0.0420 0.0297 0.0329 195 ILE D CA 9655 C C . ILE F 201 ? 0.3618 0.3170 0.4835 0.0396 0.0281 0.0328 195 ILE D C 9656 O O . ILE F 201 ? 0.3553 0.3066 0.4738 0.0394 0.0231 0.0300 195 ILE D O 9657 C CB . ILE F 201 ? 0.3513 0.3123 0.4897 0.0371 0.0255 0.0336 195 ILE D CB 9658 C CG1 . ILE F 201 ? 0.4101 0.3758 0.5568 0.0398 0.0270 0.0343 195 ILE D CG1 9659 C CG2 . ILE F 201 ? 0.3741 0.3366 0.5164 0.0302 0.0258 0.0371 195 ILE D CG2 9660 C CD1 . ILE F 201 ? 0.3411 0.3080 0.4979 0.0360 0.0217 0.0348 195 ILE D CD1 9661 N N . CYS F 202 ? 0.3624 0.3184 0.4827 0.0379 0.0320 0.0362 196 CYS D N 9662 C CA . CYS F 202 ? 0.4321 0.3840 0.5476 0.0358 0.0305 0.0363 196 CYS D CA 9663 C C . CYS F 202 ? 0.3918 0.3431 0.5132 0.0294 0.0281 0.0369 196 CYS D C 9664 O O . CYS F 202 ? 0.3521 0.3062 0.4802 0.0260 0.0297 0.0390 196 CYS D O 9665 C CB . CYS F 202 ? 0.4488 0.4010 0.5603 0.0374 0.0354 0.0396 196 CYS D CB 9666 S SG . CYS F 202 ? 0.7511 0.7054 0.8704 0.0329 0.0394 0.0448 196 CYS D SG 9667 N N . ASN F 203 ? 0.3262 0.2747 0.4449 0.0278 0.0242 0.0350 197 ASN D N 9668 C CA . ASN F 203 ? 0.3700 0.3190 0.4927 0.0223 0.0219 0.0349 197 ASN D CA 9669 C C . ASN F 203 ? 0.3524 0.2981 0.4717 0.0213 0.0236 0.0353 197 ASN D C 9670 O O . ASN F 203 ? 0.4094 0.3527 0.5233 0.0237 0.0226 0.0347 197 ASN D O 9671 C CB . ASN F 203 ? 0.3896 0.3397 0.5134 0.0210 0.0160 0.0332 197 ASN D CB 9672 C CG . ASN F 203 ? 0.3238 0.2748 0.4498 0.0237 0.0138 0.0323 197 ASN D CG 9673 O OD1 . ASN F 203 ? 0.3865 0.3348 0.5081 0.0276 0.0117 0.0305 197 ASN D OD1 9674 N ND2 . ASN F 203 ? 0.3302 0.2849 0.4637 0.0219 0.0139 0.0334 197 ASN D ND2 9675 N N . VAL F 204 ? 0.2922 0.2377 0.4152 0.0178 0.0259 0.0363 198 VAL D N 9676 C CA . VAL F 204 ? 0.3063 0.2478 0.4276 0.0173 0.0279 0.0365 198 VAL D CA 9677 C C . VAL F 204 ? 0.3244 0.2657 0.4475 0.0127 0.0259 0.0340 198 VAL D C 9678 O O . VAL F 204 ? 0.2579 0.2014 0.3854 0.0085 0.0252 0.0335 198 VAL D O 9679 C CB . VAL F 204 ? 0.3620 0.3019 0.4860 0.0173 0.0322 0.0397 198 VAL D CB 9680 C CG1 . VAL F 204 ? 0.3267 0.2614 0.4503 0.0169 0.0338 0.0399 198 VAL D CG1 9681 C CG2 . VAL F 204 ? 0.3322 0.2741 0.4535 0.0222 0.0347 0.0424 198 VAL D CG2 9682 N N . ASN F 205 ? 0.3086 0.2481 0.4280 0.0138 0.0251 0.0324 199 ASN D N 9683 C CA . ASN F 205 ? 0.2657 0.2060 0.3856 0.0105 0.0237 0.0294 199 ASN D CA 9684 C C . ASN F 205 ? 0.2923 0.2270 0.4113 0.0116 0.0266 0.0283 199 ASN D C 9685 O O . ASN F 205 ? 0.4121 0.3446 0.5283 0.0155 0.0275 0.0294 199 ASN D O 9686 C CB . ASN F 205 ? 0.2421 0.1871 0.3598 0.0107 0.0200 0.0285 199 ASN D CB 9687 C CG . ASN F 205 ? 0.3703 0.3189 0.4884 0.0070 0.0186 0.0257 199 ASN D CG 9688 O OD1 . ASN F 205 ? 0.4078 0.3548 0.5274 0.0040 0.0201 0.0235 199 ASN D OD1 9689 N ND2 . ASN F 205 ? 0.3617 0.3159 0.4785 0.0069 0.0154 0.0259 199 ASN D ND2 9690 N N . HIS F 206 ? 0.3328 0.2649 0.4546 0.0082 0.0276 0.0262 200 HIS D N 9691 C CA . HIS F 206 ? 0.3413 0.2672 0.4632 0.0091 0.0299 0.0241 200 HIS D CA 9692 C C . HIS F 206 ? 0.3168 0.2444 0.4377 0.0061 0.0284 0.0187 200 HIS D C 9693 O O . HIS F 206 ? 0.2962 0.2228 0.4193 0.0017 0.0278 0.0162 200 HIS D O 9694 C CB . HIS F 206 ? 0.2718 0.1916 0.3984 0.0081 0.0322 0.0262 200 HIS D CB 9695 C CG . HIS F 206 ? 0.3057 0.2179 0.4340 0.0093 0.0342 0.0244 200 HIS D CG 9696 N ND1 . HIS F 206 ? 0.2623 0.1693 0.3940 0.0056 0.0340 0.0207 200 HIS D ND1 9697 C CD2 . HIS F 206 ? 0.2833 0.1918 0.4111 0.0138 0.0360 0.0258 200 HIS D CD2 9698 C CE1 . HIS F 206 ? 0.2315 0.1312 0.3650 0.0081 0.0357 0.0195 200 HIS D CE1 9699 N NE2 . HIS F 206 ? 0.2892 0.1901 0.4207 0.0132 0.0371 0.0229 200 HIS D NE2 9700 N N . LYS F 207 ? 0.2569 0.1879 0.3743 0.0084 0.0277 0.0171 201 LYS D N 9701 C CA . LYS F 207 ? 0.3469 0.2824 0.4622 0.0060 0.0265 0.0123 201 LYS D CA 9702 C C . LYS F 207 ? 0.3745 0.3037 0.4903 0.0049 0.0284 0.0067 201 LYS D C 9703 O O . LYS F 207 ? 0.4390 0.3711 0.5536 0.0007 0.0269 0.0024 201 LYS D O 9704 C CB . LYS F 207 ? 0.3624 0.3037 0.4746 0.0094 0.0259 0.0129 201 LYS D CB 9705 C CG . LYS F 207 ? 0.4529 0.4008 0.5649 0.0094 0.0226 0.0174 201 LYS D CG 9706 C CD . LYS F 207 ? 0.6772 0.6300 0.7872 0.0127 0.0216 0.0193 201 LYS D CD 9707 C CE . LYS F 207 ? 0.8515 0.8137 0.9603 0.0107 0.0201 0.0173 201 LYS D CE 9708 N NZ . LYS F 207 ? 0.8894 0.8595 0.9996 0.0060 0.0159 0.0189 201 LYS D NZ 9709 N N . PRO F 208 ? 0.4282 0.3485 0.5459 0.0084 0.0313 0.0066 202 PRO D N 9710 C CA . PRO F 208 ? 0.3763 0.2890 0.4954 0.0074 0.0326 0.0006 202 PRO D CA 9711 C C . PRO F 208 ? 0.3933 0.3036 0.5146 0.0012 0.0307 -0.0016 202 PRO D C 9712 O O . PRO F 208 ? 0.4166 0.3248 0.5364 -0.0012 0.0301 -0.0083 202 PRO D O 9713 C CB . PRO F 208 ? 0.3408 0.2443 0.4643 0.0116 0.0354 0.0036 202 PRO D CB 9714 C CG . PRO F 208 ? 0.3668 0.2751 0.4884 0.0161 0.0360 0.0088 202 PRO D CG 9715 C CD . PRO F 208 ? 0.3578 0.2750 0.4766 0.0135 0.0332 0.0115 202 PRO D CD 9716 N N . SER F 209 ? 0.3320 0.2431 0.4568 -0.0011 0.0298 0.0040 203 SER D N 9717 C CA . SER F 209 ? 0.4131 0.3227 0.5411 -0.0072 0.0279 0.0034 203 SER D CA 9718 C C . SER F 209 ? 0.4807 0.4008 0.6072 -0.0113 0.0249 0.0046 203 SER D C 9719 O O . SER F 209 ? 0.5150 0.4359 0.6447 -0.0166 0.0229 0.0053 203 SER D O 9720 C CB . SER F 209 ? 0.4250 0.3292 0.5596 -0.0073 0.0291 0.0095 203 SER D CB 9721 O OG . SER F 209 ? 0.4454 0.3552 0.5800 -0.0046 0.0300 0.0160 203 SER D OG 9722 N N . ASN F 210 ? 0.5444 0.4725 0.6671 -0.0089 0.0243 0.0056 204 ASN D N 9723 C CA . ASN F 210 ? 0.4918 0.4300 0.6145 -0.0122 0.0212 0.0080 204 ASN D CA 9724 C C . ASN F 210 ? 0.4363 0.3751 0.5644 -0.0135 0.0209 0.0138 204 ASN D C 9725 O O . ASN F 210 ? 0.3903 0.3342 0.5212 -0.0183 0.0184 0.0150 204 ASN D O 9726 C CB . ASN F 210 ? 0.4619 0.4050 0.5826 -0.0179 0.0185 0.0033 204 ASN D CB 9727 C CG . ASN F 210 ? 0.6326 0.5832 0.7477 -0.0167 0.0179 0.0000 204 ASN D CG 9728 O OD1 . ASN F 210 ? 0.6560 0.6034 0.7672 -0.0150 0.0196 -0.0058 204 ASN D OD1 9729 N ND2 . ASN F 210 ? 0.6971 0.6579 0.8122 -0.0174 0.0154 0.0039 204 ASN D ND2 9730 N N . THR F 211 ? 0.4412 0.3755 0.5708 -0.0091 0.0235 0.0176 205 THR D N 9731 C CA . THR F 211 ? 0.4041 0.3397 0.5383 -0.0092 0.0240 0.0230 205 THR D CA 9732 C C . THR F 211 ? 0.5084 0.4496 0.6412 -0.0058 0.0232 0.0259 205 THR D C 9733 O O . THR F 211 ? 0.5690 0.5085 0.6981 -0.0010 0.0243 0.0263 205 THR D O 9734 C CB . THR F 211 ? 0.4365 0.3648 0.5733 -0.0067 0.0274 0.0260 205 THR D CB 9735 O OG1 . THR F 211 ? 0.5353 0.4574 0.6751 -0.0103 0.0274 0.0235 205 THR D OG1 9736 C CG2 . THR F 211 ? 0.4471 0.3787 0.5881 -0.0061 0.0286 0.0319 205 THR D CG2 9737 N N . LYS F 212 ? 0.5264 0.4739 0.6625 -0.0084 0.0210 0.0279 206 LYS D N 9738 C CA . LYS F 212 ? 0.5000 0.4517 0.6361 -0.0053 0.0198 0.0304 206 LYS D CA 9739 C C . LYS F 212 ? 0.5334 0.4870 0.6750 -0.0049 0.0210 0.0343 206 LYS D C 9740 O O . LYS F 212 ? 0.5803 0.5384 0.7274 -0.0091 0.0194 0.0358 206 LYS D O 9741 C CB . LYS F 212 ? 0.4510 0.4097 0.5874 -0.0080 0.0154 0.0295 206 LYS D CB 9742 C CG . LYS F 212 ? 0.4063 0.3654 0.5372 -0.0066 0.0144 0.0268 206 LYS D CG 9743 C CD . LYS F 212 ? 0.3709 0.3386 0.5028 -0.0101 0.0100 0.0270 206 LYS D CD 9744 C CE . LYS F 212 ? 0.3577 0.3273 0.4847 -0.0084 0.0093 0.0252 206 LYS D CE 9745 N NZ . LYS F 212 ? 0.5183 0.4978 0.6459 -0.0127 0.0056 0.0254 206 LYS D NZ 9746 N N . VAL F 213 ? 0.4726 0.4236 0.6128 0.0002 0.0241 0.0364 207 VAL D N 9747 C CA . VAL F 213 ? 0.4717 0.4251 0.6165 0.0016 0.0264 0.0402 207 VAL D CA 9748 C C . VAL F 213 ? 0.4820 0.4375 0.6248 0.0072 0.0265 0.0407 207 VAL D C 9749 O O . VAL F 213 ? 0.4836 0.4361 0.6201 0.0113 0.0267 0.0392 207 VAL D O 9750 C CB . VAL F 213 ? 0.4657 0.4154 0.6112 0.0026 0.0306 0.0429 207 VAL D CB 9751 C CG1 . VAL F 213 ? 0.5038 0.4580 0.6536 0.0051 0.0336 0.0476 207 VAL D CG1 9752 C CG2 . VAL F 213 ? 0.4310 0.3778 0.5800 -0.0032 0.0299 0.0423 207 VAL D CG2 9753 N N . ASP F 214 ? 0.4795 0.4399 0.6278 0.0072 0.0260 0.0425 208 ASP D N 9754 C CA . ASP F 214 ? 0.4644 0.4263 0.6117 0.0130 0.0265 0.0424 208 ASP D CA 9755 C C . ASP F 214 ? 0.4846 0.4496 0.6350 0.0159 0.0314 0.0459 208 ASP D C 9756 O O . ASP F 214 ? 0.4995 0.4685 0.6574 0.0124 0.0323 0.0492 208 ASP D O 9757 C CB . ASP F 214 ? 0.4423 0.4077 0.5944 0.0120 0.0221 0.0416 208 ASP D CB 9758 C CG . ASP F 214 ? 0.4714 0.4358 0.6211 0.0090 0.0172 0.0393 208 ASP D CG 9759 O OD1 . ASP F 214 ? 0.4128 0.3733 0.5556 0.0117 0.0165 0.0371 208 ASP D OD1 9760 O OD2 . ASP F 214 ? 0.5347 0.5032 0.6896 0.0038 0.0139 0.0402 208 ASP D OD2 9761 N N . LYS F 215 ? 0.3755 0.3395 0.5201 0.0219 0.0344 0.0457 209 LYS D N 9762 C CA . LYS F 215 ? 0.3377 0.3062 0.4845 0.0250 0.0396 0.0496 209 LYS D CA 9763 C C . LYS F 215 ? 0.3519 0.3231 0.4957 0.0321 0.0411 0.0477 209 LYS D C 9764 O O . LYS F 215 ? 0.3608 0.3287 0.4960 0.0364 0.0407 0.0444 209 LYS D O 9765 C CB . LYS F 215 ? 0.4123 0.3787 0.5550 0.0254 0.0430 0.0522 209 LYS D CB 9766 C CG . LYS F 215 ? 0.5922 0.5640 0.7413 0.0245 0.0475 0.0585 209 LYS D CG 9767 C CD . LYS F 215 ? 0.7161 0.6883 0.8743 0.0173 0.0454 0.0606 209 LYS D CD 9768 C CE . LYS F 215 ? 0.7931 0.7720 0.9597 0.0160 0.0491 0.0676 209 LYS D CE 9769 N NZ . LYS F 215 ? 0.8513 0.8294 1.0261 0.0081 0.0464 0.0697 209 LYS D NZ 9770 N N . LYS F 216 ? 0.3439 0.3212 0.4951 0.0335 0.0428 0.0495 210 LYS D N 9771 C CA . LYS F 216 ? 0.4332 0.4133 0.5823 0.0410 0.0448 0.0472 210 LYS D CA 9772 C C . LYS F 216 ? 0.4440 0.4280 0.5872 0.0459 0.0509 0.0495 210 LYS D C 9773 O O . LYS F 216 ? 0.4370 0.4259 0.5844 0.0437 0.0547 0.0556 210 LYS D O 9774 C CB . LYS F 216 ? 0.4676 0.4537 0.6276 0.0413 0.0451 0.0489 210 LYS D CB 9775 C CG . LYS F 216 ? 0.6645 0.6521 0.8233 0.0493 0.0462 0.0448 210 LYS D CG 9776 C CD . LYS F 216 ? 0.7921 0.7856 0.9636 0.0497 0.0464 0.0471 210 LYS D CD 9777 C CE . LYS F 216 ? 0.8667 0.8610 1.0375 0.0586 0.0478 0.0422 210 LYS D CE 9778 N NZ . LYS F 216 ? 0.8784 0.8796 1.0627 0.0601 0.0491 0.0451 210 LYS D NZ 9779 N N . VAL F 217 ? 0.3899 0.3723 0.5235 0.0522 0.0514 0.0451 211 VAL D N 9780 C CA . VAL F 217 ? 0.3931 0.3806 0.5199 0.0571 0.0570 0.0473 211 VAL D CA 9781 C C . VAL F 217 ? 0.4798 0.4734 0.6055 0.0650 0.0605 0.0446 211 VAL D C 9782 O O . VAL F 217 ? 0.5571 0.5465 0.6762 0.0697 0.0580 0.0376 211 VAL D O 9783 C CB . VAL F 217 ? 0.3722 0.3541 0.4870 0.0584 0.0553 0.0447 211 VAL D CB 9784 C CG1 . VAL F 217 ? 0.3213 0.3101 0.4299 0.0624 0.0611 0.0486 211 VAL D CG1 9785 C CG2 . VAL F 217 ? 0.3428 0.3181 0.4590 0.0515 0.0517 0.0461 211 VAL D CG2 9786 N N . GLU F 218 ? 0.5047 0.5082 0.6374 0.0663 0.0661 0.0502 212 GLU D N 9787 C CA . GLU F 218 ? 0.5908 0.6016 0.7240 0.0742 0.0703 0.0480 212 GLU D CA 9788 C C . GLU F 218 ? 0.5599 0.5801 0.6854 0.0799 0.0771 0.0509 212 GLU D C 9789 O O . GLU F 218 ? 0.5842 0.6081 0.7096 0.0764 0.0795 0.0581 212 GLU D O 9790 C CB . GLU F 218 ? 0.6850 0.7026 0.8330 0.0725 0.0720 0.0528 212 GLU D CB 9791 C CG . GLU F 218 ? 0.7719 0.7828 0.9287 0.0667 0.0655 0.0512 212 GLU D CG 9792 C CD . GLU F 218 ? 0.9237 0.9426 1.0953 0.0644 0.0672 0.0573 212 GLU D CD 9793 O OE1 . GLU F 218 ? 1.0425 1.0722 1.2178 0.0681 0.0736 0.0624 212 GLU D OE1 9794 O OE2 . GLU F 218 ? 0.9240 0.9397 1.1040 0.0588 0.0621 0.0577 212 GLU D OE2 9795 N N . PRO F 219 ? 0.6438 0.6681 0.7631 0.0887 0.0802 0.0454 213 PRO D N 9796 C CA . PRO F 219 ? 0.7452 0.7813 0.8574 0.0946 0.0874 0.0485 213 PRO D CA 9797 C C . PRO F 219 ? 0.8855 0.9349 1.0095 0.0934 0.0936 0.0590 213 PRO D C 9798 O O . PRO F 219 ? 0.9259 0.9791 1.0611 0.0943 0.0947 0.0599 213 PRO D O 9799 C CB . PRO F 219 ? 0.6845 0.7213 0.7892 0.1045 0.0888 0.0388 213 PRO D CB 9800 C CG . PRO F 219 ? 0.6062 0.6283 0.7112 0.1027 0.0806 0.0303 213 PRO D CG 9801 C CD . PRO F 219 ? 0.5822 0.6005 0.7006 0.0937 0.0769 0.0359 213 PRO D CD 9802 N N . LYS F 220 ? 1.0364 1.0930 1.1590 0.0909 0.0970 0.0676 214 LYS D N 9803 C CA . LYS F 220 ? 1.1903 1.2599 1.3248 0.0889 0.1023 0.0790 214 LYS D CA 9804 C C . LYS F 220 ? 1.2792 1.3611 1.4074 0.0917 0.1083 0.0861 214 LYS D C 9805 O O . LYS F 220 ? 1.3218 1.4000 1.4382 0.0921 0.1069 0.0842 214 LYS D O 9806 C CB . LYS F 220 ? 1.2695 1.3328 1.4158 0.0783 0.0979 0.0852 214 LYS D CB 9807 C CG . LYS F 220 ? 1.3222 1.3784 1.4780 0.0750 0.0931 0.0812 214 LYS D CG 9808 C CD . LYS F 220 ? 1.3157 1.3630 1.4785 0.0645 0.0875 0.0845 214 LYS D CD 9809 C CE . LYS F 220 ? 1.2995 1.3403 1.4698 0.0612 0.0823 0.0802 214 LYS D CE 9810 N NZ . LYS F 220 ? 1.3006 1.3328 1.4756 0.0514 0.0766 0.0818 214 LYS D NZ 9811 N N . ASP G 1 ? 0.7643 0.6074 0.6380 0.1340 -0.0480 -0.0531 1 ASP E N 9812 C CA . ASP G 1 ? 0.6286 0.4903 0.5095 0.1234 -0.0435 -0.0498 1 ASP E CA 9813 C C . ASP G 1 ? 0.6304 0.5145 0.5189 0.1293 -0.0360 -0.0527 1 ASP E C 9814 O O . ASP G 1 ? 0.6196 0.5002 0.5015 0.1348 -0.0341 -0.0597 1 ASP E O 9815 C CB . ASP G 1 ? 0.6325 0.4801 0.5023 0.1079 -0.0449 -0.0517 1 ASP E CB 9816 C CG . ASP G 1 ? 0.7498 0.5785 0.6127 0.0990 -0.0518 -0.0474 1 ASP E CG 9817 O OD1 . ASP G 1 ? 0.7137 0.5447 0.5830 0.1031 -0.0551 -0.0412 1 ASP E OD1 9818 O OD2 . ASP G 1 ? 0.8509 0.6633 0.7019 0.0873 -0.0540 -0.0500 1 ASP E OD2 9819 N N . ILE G 2 ? 0.5682 0.4750 0.4699 0.1273 -0.0317 -0.0471 2 ILE E N 9820 C CA . ILE G 2 ? 0.5206 0.4501 0.4303 0.1321 -0.0248 -0.0482 2 ILE E CA 9821 C C . ILE G 2 ? 0.5408 0.4696 0.4440 0.1243 -0.0221 -0.0523 2 ILE E C 9822 O O . ILE G 2 ? 0.5411 0.4624 0.4409 0.1121 -0.0234 -0.0513 2 ILE E O 9823 C CB . ILE G 2 ? 0.6001 0.5520 0.5251 0.1303 -0.0212 -0.0405 2 ILE E CB 9824 C CG1 . ILE G 2 ? 0.6127 0.5707 0.5455 0.1406 -0.0231 -0.0370 2 ILE E CG1 9825 C CG2 . ILE G 2 ? 0.5632 0.5365 0.4950 0.1317 -0.0141 -0.0406 2 ILE E CG2 9826 C CD1 . ILE G 2 ? 0.6427 0.6165 0.5878 0.1359 -0.0219 -0.0290 2 ILE E CD1 9827 N N . GLN G 3 ? 0.6073 0.5449 0.5090 0.1311 -0.0183 -0.0570 3 GLN E N 9828 C CA . GLN G 3 ? 0.6200 0.5586 0.5154 0.1248 -0.0163 -0.0610 3 GLN E CA 9829 C C . GLN G 3 ? 0.5376 0.5016 0.4426 0.1275 -0.0102 -0.0585 3 GLN E C 9830 O O . GLN G 3 ? 0.5275 0.5041 0.4374 0.1377 -0.0073 -0.0587 3 GLN E O 9831 C CB . GLN G 3 ? 0.7829 0.7049 0.6635 0.1288 -0.0185 -0.0699 3 GLN E CB 9832 C CG . GLN G 3 ? 0.9471 0.8587 0.8168 0.1180 -0.0199 -0.0741 3 GLN E CG 9833 C CD . GLN G 3 ? 1.0501 0.9335 0.9047 0.1158 -0.0253 -0.0797 3 GLN E CD 9834 O OE1 . GLN G 3 ? 1.0647 0.9343 0.9184 0.1185 -0.0292 -0.0779 3 GLN E OE1 9835 N NE2 . GLN G 3 ? 1.1481 1.0228 0.9904 0.1106 -0.0259 -0.0863 3 GLN E NE2 9836 N N . MET G 4 ? 0.5168 0.4885 0.4248 0.1184 -0.0081 -0.0561 4 MET E N 9837 C CA . MET G 4 ? 0.4697 0.4643 0.3864 0.1200 -0.0028 -0.0528 4 MET E CA 9838 C C . MET G 4 ? 0.5179 0.5146 0.4259 0.1197 -0.0021 -0.0580 4 MET E C 9839 O O . MET G 4 ? 0.5067 0.4925 0.4070 0.1119 -0.0047 -0.0612 4 MET E O 9840 C CB . MET G 4 ? 0.5265 0.5303 0.4543 0.1110 -0.0005 -0.0459 4 MET E CB 9841 C CG . MET G 4 ? 0.5341 0.5344 0.4690 0.1078 -0.0014 -0.0411 4 MET E CG 9842 S SD . MET G 4 ? 0.9135 0.9227 0.8546 0.1193 -0.0007 -0.0386 4 MET E SD 9843 C CE . MET G 4 ? 1.7524 1.7888 1.7048 0.1231 0.0063 -0.0339 4 MET E CE 9844 N N . THR G 5 ? 0.4961 0.5080 0.4051 0.1274 0.0015 -0.0588 5 THR E N 9845 C CA . THR G 5 ? 0.4628 0.4800 0.3638 0.1266 0.0024 -0.0629 5 THR E CA 9846 C C . THR G 5 ? 0.4415 0.4832 0.3520 0.1275 0.0069 -0.0567 5 THR E C 9847 O O . THR G 5 ? 0.4784 0.5331 0.3962 0.1341 0.0104 -0.0535 5 THR E O 9848 C CB . THR G 5 ? 0.5388 0.5484 0.4276 0.1346 0.0021 -0.0717 5 THR E CB 9849 O OG1 . THR G 5 ? 0.6492 0.6349 0.5303 0.1351 -0.0022 -0.0765 5 THR E OG1 9850 C CG2 . THR G 5 ? 0.5016 0.5139 0.3796 0.1312 0.0022 -0.0768 5 THR E CG2 9851 N N . GLN G 6 ? 0.3138 0.3620 0.2244 0.1206 0.0068 -0.0547 6 GLN E N 9852 C CA . GLN G 6 ? 0.3965 0.4665 0.3156 0.1208 0.0105 -0.0478 6 GLN E CA 9853 C C . GLN G 6 ? 0.4335 0.5129 0.3429 0.1232 0.0111 -0.0516 6 GLN E C 9854 O O . GLN G 6 ? 0.3802 0.4487 0.2768 0.1214 0.0083 -0.0592 6 GLN E O 9855 C CB . GLN G 6 ? 0.3546 0.4280 0.2830 0.1121 0.0101 -0.0415 6 GLN E CB 9856 C CG . GLN G 6 ? 0.3772 0.4412 0.3142 0.1082 0.0100 -0.0385 6 GLN E CG 9857 C CD . GLN G 6 ? 0.3671 0.4332 0.3132 0.0995 0.0103 -0.0337 6 GLN E CD 9858 O OE1 . GLN G 6 ? 0.4280 0.4819 0.3758 0.0934 0.0089 -0.0346 6 GLN E OE1 9859 N NE2 . GLN G 6 ? 0.4134 0.4953 0.3657 0.0990 0.0122 -0.0286 6 GLN E NE2 9860 N N . SER G 7 ? 0.4549 0.5542 0.3696 0.1266 0.0149 -0.0464 7 SER E N 9861 C CA . SER G 7 ? 0.4479 0.5589 0.3537 0.1273 0.0156 -0.0485 7 SER E CA 9862 C C . SER G 7 ? 0.5110 0.6435 0.4265 0.1259 0.0183 -0.0384 7 SER E C 9863 O O . SER G 7 ? 0.5250 0.6660 0.4514 0.1286 0.0216 -0.0320 7 SER E O 9864 C CB . SER G 7 ? 0.4480 0.5591 0.3443 0.1355 0.0180 -0.0564 7 SER E CB 9865 O OG . SER G 7 ? 0.5671 0.6915 0.4724 0.1417 0.0224 -0.0520 7 SER E OG 9866 N N . PRO G 8 ? 0.4830 0.6242 0.3944 0.1213 0.0165 -0.0365 8 PRO E N 9867 C CA . PRO G 8 ? 0.5133 0.6461 0.4118 0.1168 0.0124 -0.0436 8 PRO E CA 9868 C C . PRO G 8 ? 0.5609 0.6798 0.4634 0.1101 0.0087 -0.0438 8 PRO E C 9869 O O . PRO G 8 ? 0.5297 0.6461 0.4449 0.1091 0.0097 -0.0383 8 PRO E O 9870 C CB . PRO G 8 ? 0.5425 0.6943 0.4390 0.1138 0.0120 -0.0384 8 PRO E CB 9871 C CG . PRO G 8 ? 0.6005 0.7693 0.5061 0.1180 0.0164 -0.0299 8 PRO E CG 9872 C CD . PRO G 8 ? 0.5156 0.6771 0.4343 0.1201 0.0184 -0.0265 8 PRO E CD 9873 N N . SER G 9 ? 0.5962 0.7065 0.4876 0.1051 0.0049 -0.0503 9 SER E N 9874 C CA . SER G 9 ? 0.5570 0.6566 0.4521 0.0976 0.0015 -0.0504 9 SER E CA 9875 C C . SER G 9 ? 0.5238 0.6394 0.4279 0.0924 0.0003 -0.0424 9 SER E C 9876 O O . SER G 9 ? 0.5019 0.6154 0.4170 0.0877 -0.0006 -0.0385 9 SER E O 9877 C CB . SER G 9 ? 0.5690 0.6510 0.4480 0.0939 -0.0020 -0.0612 9 SER E CB 9878 O OG . SER G 9 ? 0.5421 0.6079 0.4142 0.0993 -0.0011 -0.0679 9 SER E OG 9879 N N . PHE G 10 ? 0.5640 0.6959 0.4637 0.0934 0.0002 -0.0400 10 PHE E N 9880 C CA . PHE G 10 ? 0.5522 0.7011 0.4606 0.0894 -0.0016 -0.0313 10 PHE E CA 9881 C C . PHE G 10 ? 0.5797 0.7475 0.4925 0.0940 0.0012 -0.0228 10 PHE E C 9882 O O . PHE G 10 ? 0.5616 0.7336 0.4637 0.0980 0.0030 -0.0263 10 PHE E O 9883 C CB . PHE G 10 ? 0.5835 0.7347 0.4803 0.0831 -0.0063 -0.0361 10 PHE E CB 9884 C CG . PHE G 10 ? 0.8009 0.9339 0.6920 0.0774 -0.0092 -0.0445 10 PHE E CG 9885 C CD1 . PHE G 10 ? 0.8610 0.9928 0.7638 0.0717 -0.0109 -0.0412 10 PHE E CD1 9886 C CD2 . PHE G 10 ? 0.8635 0.9802 0.7374 0.0774 -0.0098 -0.0559 10 PHE E CD2 9887 C CE1 . PHE G 10 ? 0.8523 0.9677 0.7492 0.0654 -0.0134 -0.0489 10 PHE E CE1 9888 C CE2 . PHE G 10 ? 0.8580 0.9568 0.7257 0.0714 -0.0125 -0.0632 10 PHE E CE2 9889 C CZ . PHE G 10 ? 0.8495 0.9482 0.7284 0.0650 -0.0144 -0.0596 10 PHE E CZ 9890 N N . VAL G 11 ? 0.5788 0.7576 0.5076 0.0934 0.0018 -0.0117 11 VAL E N 9891 C CA . VAL G 11 ? 0.5444 0.7410 0.4778 0.0966 0.0040 -0.0022 11 VAL E CA 9892 C C . VAL G 11 ? 0.5744 0.7852 0.5175 0.0930 0.0008 0.0080 11 VAL E C 9893 O O . VAL G 11 ? 0.5444 0.7518 0.5008 0.0904 -0.0001 0.0116 11 VAL E O 9894 C CB . VAL G 11 ? 0.5408 0.7362 0.4858 0.1012 0.0092 0.0032 11 VAL E CB 9895 C CG1 . VAL G 11 ? 0.5309 0.7442 0.4779 0.1040 0.0116 0.0123 11 VAL E CG1 9896 C CG2 . VAL G 11 ? 0.5385 0.7199 0.4767 0.1050 0.0117 -0.0060 11 VAL E CG2 9897 N N . SER G 12 ? 0.5855 0.8127 0.5220 0.0929 -0.0007 0.0126 12 SER E N 9898 C CA . SER G 12 ? 0.4987 0.7416 0.4447 0.0905 -0.0040 0.0242 12 SER E CA 9899 C C . SER G 12 ? 0.5161 0.7729 0.4653 0.0939 -0.0013 0.0347 12 SER E C 9900 O O . SER G 12 ? 0.5788 0.8429 0.5143 0.0950 -0.0002 0.0324 12 SER E O 9901 C CB . SER G 12 ? 0.4987 0.7498 0.4329 0.0853 -0.0099 0.0211 12 SER E CB 9902 O OG . SER G 12 ? 0.5949 0.8625 0.5391 0.0832 -0.0139 0.0331 12 SER E OG 9903 N N . ALA G 13 ? 0.5791 0.8391 0.5461 0.0952 0.0002 0.0459 13 ALA E N 9904 C CA . ALA G 13 ? 0.5947 0.8662 0.5655 0.0978 0.0030 0.0567 13 ALA E CA 9905 C C . ALA G 13 ? 0.5633 0.8431 0.5513 0.0973 0.0010 0.0709 13 ALA E C 9906 O O . ALA G 13 ? 0.5602 0.8346 0.5606 0.0960 -0.0009 0.0718 13 ALA E O 9907 C CB . ALA G 13 ? 0.5969 0.8595 0.5710 0.1017 0.0096 0.0544 13 ALA E CB 9908 N N . SER G 14 ? 0.5545 0.8473 0.5431 0.0983 0.0016 0.0821 14 SER E N 9909 C CA . SER G 14 ? 0.5270 0.8280 0.5310 0.0982 -0.0007 0.0969 14 SER E CA 9910 C C . SER G 14 ? 0.5488 0.8417 0.5691 0.1009 0.0049 0.1035 14 SER E C 9911 O O . SER G 14 ? 0.5421 0.8282 0.5594 0.1024 0.0105 0.0991 14 SER E O 9912 C CB . SER G 14 ? 0.5136 0.8330 0.5088 0.0969 -0.0040 0.1069 14 SER E CB 9913 O OG . SER G 14 ? 0.5798 0.9072 0.5585 0.0935 -0.0090 0.1003 14 SER E OG 9914 N N . VAL G 15 ? 0.5343 0.8283 0.5723 0.1014 0.0035 0.1141 15 VAL E N 9915 C CA . VAL G 15 ? 0.5275 0.8138 0.5813 0.1033 0.0089 0.1213 15 VAL E CA 9916 C C . VAL G 15 ? 0.5514 0.8439 0.5987 0.1040 0.0124 0.1282 15 VAL E C 9917 O O . VAL G 15 ? 0.6326 0.9391 0.6735 0.1033 0.0091 0.1372 15 VAL E O 9918 C CB . VAL G 15 ? 0.4601 0.7488 0.5337 0.1043 0.0063 0.1329 15 VAL E CB 9919 C CG1 . VAL G 15 ? 0.4781 0.7591 0.5664 0.1060 0.0123 0.1413 15 VAL E CG1 9920 C CG2 . VAL G 15 ? 0.3345 0.6167 0.4170 0.1034 0.0042 0.1254 15 VAL E CG2 9921 N N . GLY G 16 ? 0.5630 0.8461 0.6115 0.1046 0.0190 0.1240 16 GLY E N 9922 C CA . GLY G 16 ? 0.6119 0.9008 0.6548 0.1047 0.0232 0.1296 16 GLY E CA 9923 C C . GLY G 16 ? 0.6567 0.9487 0.6822 0.1050 0.0253 0.1189 16 GLY E C 9924 O O . GLY G 16 ? 0.6950 0.9909 0.7165 0.1051 0.0299 0.1208 16 GLY E O 9925 N N . ASP G 17 ? 0.6411 0.9315 0.6563 0.1051 0.0221 0.1075 17 ASP E N 9926 C CA . ASP G 17 ? 0.6414 0.9329 0.6409 0.1062 0.0242 0.0960 17 ASP E CA 9927 C C . ASP G 17 ? 0.6098 0.8886 0.6140 0.1080 0.0296 0.0885 17 ASP E C 9928 O O . ASP G 17 ? 0.5169 0.7836 0.5338 0.1075 0.0306 0.0883 17 ASP E O 9929 C CB . ASP G 17 ? 0.6586 0.9493 0.6460 0.1054 0.0193 0.0856 17 ASP E CB 9930 C CG . ASP G 17 ? 0.7221 1.0286 0.6991 0.1031 0.0144 0.0909 17 ASP E CG 9931 O OD1 . ASP G 17 ? 0.7465 1.0640 0.7273 0.1021 0.0140 0.1039 17 ASP E OD1 9932 O OD2 . ASP G 17 ? 0.7398 1.0475 0.7044 0.1016 0.0109 0.0822 17 ASP E OD2 9933 N N . ARG G 18 ? 0.7037 0.9861 0.6977 0.1099 0.0332 0.0823 18 ARG E N 9934 C CA . ARG G 18 ? 0.7015 0.9735 0.6983 0.1119 0.0374 0.0743 18 ARG E CA 9935 C C . ARG G 18 ? 0.5969 0.8593 0.5846 0.1135 0.0349 0.0606 18 ARG E C 9936 O O . ARG G 18 ? 0.6128 0.8810 0.5864 0.1149 0.0338 0.0541 18 ARG E O 9937 C CB . ARG G 18 ? 0.8006 1.0822 0.7932 0.1135 0.0427 0.0750 18 ARG E CB 9938 C CG . ARG G 18 ? 0.8546 1.1275 0.8509 0.1158 0.0467 0.0676 18 ARG E CG 9939 C CD . ARG G 18 ? 0.9006 1.1852 0.8958 0.1169 0.0522 0.0700 18 ARG E CD 9940 N NE . ARG G 18 ? 0.9952 1.2704 0.9962 0.1177 0.0547 0.0648 18 ARG E NE 9941 C CZ . ARG G 18 ? 1.1179 1.3950 1.1196 0.1159 0.0569 0.0656 18 ARG E CZ 9942 N NH1 . ARG G 18 ? 1.1771 1.4688 1.1749 0.1148 0.0588 0.0715 18 ARG E NH1 9943 N NH2 . ARG G 18 ? 1.1251 1.3901 1.1310 0.1148 0.0570 0.0608 18 ARG E NH2 9944 N N . VAL G 19 ? 0.5527 0.7999 0.5478 0.1128 0.0343 0.0561 19 VAL E N 9945 C CA . VAL G 19 ? 0.5334 0.7692 0.5202 0.1136 0.0316 0.0438 19 VAL E CA 9946 C C . VAL G 19 ? 0.4991 0.7246 0.4872 0.1160 0.0347 0.0368 19 VAL E C 9947 O O . VAL G 19 ? 0.5715 0.7923 0.5712 0.1148 0.0376 0.0408 19 VAL E O 9948 C CB . VAL G 19 ? 0.5307 0.7570 0.5232 0.1100 0.0274 0.0432 19 VAL E CB 9949 C CG1 . VAL G 19 ? 0.5156 0.7291 0.4984 0.1099 0.0247 0.0305 19 VAL E CG1 9950 C CG2 . VAL G 19 ? 0.5742 0.8122 0.5664 0.1079 0.0235 0.0504 19 VAL E CG2 9951 N N . THR G 20 ? 0.5067 0.7287 0.4829 0.1193 0.0342 0.0264 20 THR E N 9952 C CA . THR G 20 ? 0.5023 0.7140 0.4793 0.1222 0.0360 0.0196 20 THR E CA 9953 C C . THR G 20 ? 0.4980 0.6940 0.4664 0.1224 0.0321 0.0089 20 THR E C 9954 O O . THR G 20 ? 0.4936 0.6901 0.4501 0.1229 0.0295 0.0032 20 THR E O 9955 C CB . THR G 20 ? 0.5684 0.7905 0.5408 0.1275 0.0400 0.0174 20 THR E CB 9956 O OG1 . THR G 20 ? 0.6064 0.8327 0.5644 0.1302 0.0388 0.0102 20 THR E OG1 9957 C CG2 . THR G 20 ? 0.5766 0.8143 0.5561 0.1264 0.0440 0.0281 20 THR E CG2 9958 N N . ILE G 21 ? 0.5119 0.6940 0.4860 0.1212 0.0317 0.0064 21 ILE E N 9959 C CA . ILE G 21 ? 0.5029 0.6680 0.4694 0.1207 0.0280 -0.0031 21 ILE E CA 9960 C C . ILE G 21 ? 0.4827 0.6406 0.4489 0.1251 0.0294 -0.0079 21 ILE E C 9961 O O . ILE G 21 ? 0.4780 0.6382 0.4544 0.1249 0.0321 -0.0030 21 ILE E O 9962 C CB . ILE G 21 ? 0.5037 0.6577 0.4769 0.1140 0.0256 -0.0017 21 ILE E CB 9963 C CG1 . ILE G 21 ? 0.5163 0.6786 0.4908 0.1103 0.0236 0.0029 21 ILE E CG1 9964 C CG2 . ILE G 21 ? 0.5010 0.6366 0.4661 0.1126 0.0220 -0.0110 21 ILE E CG2 9965 C CD1 . ILE G 21 ? 0.5166 0.6708 0.4999 0.1041 0.0220 0.0047 21 ILE E CD1 9966 N N . THR G 22 ? 0.4627 0.6120 0.4175 0.1292 0.0274 -0.0172 22 THR E N 9967 C CA . THR G 22 ? 0.4616 0.6048 0.4166 0.1346 0.0282 -0.0214 22 THR E CA 9968 C C . THR G 22 ? 0.4607 0.5825 0.4113 0.1328 0.0240 -0.0275 22 THR E C 9969 O O . THR G 22 ? 0.4109 0.5219 0.3529 0.1293 0.0205 -0.0323 22 THR E O 9970 C CB . THR G 22 ? 0.5685 0.7194 0.5152 0.1426 0.0303 -0.0272 22 THR E CB 9971 O OG1 . THR G 22 ? 0.7212 0.8623 0.6540 0.1430 0.0274 -0.0359 22 THR E OG1 9972 C CG2 . THR G 22 ? 0.5428 0.7155 0.4922 0.1435 0.0346 -0.0212 22 THR E CG2 9973 N N . CYS G 23 ? 0.4928 0.6089 0.4490 0.1347 0.0241 -0.0270 23 CYS E N 9974 C CA . CYS G 23 ? 0.5271 0.6230 0.4792 0.1331 0.0199 -0.0318 23 CYS E CA 9975 C C . CYS G 23 ? 0.4816 0.5744 0.4316 0.1418 0.0196 -0.0361 23 CYS E C 9976 O O . CYS G 23 ? 0.4678 0.5730 0.4263 0.1460 0.0227 -0.0322 23 CYS E O 9977 C CB . CYS G 23 ? 0.4842 0.5751 0.4459 0.1254 0.0195 -0.0262 23 CYS E CB 9978 S SG . CYS G 23 ? 0.7014 0.7673 0.6570 0.1200 0.0140 -0.0309 23 CYS E SG 9979 N N . ARG G 24 ? 0.5668 0.6430 0.5057 0.1446 0.0160 -0.0441 24 ARG E N 9980 C CA . ARG G 24 ? 0.6101 0.6814 0.5481 0.1537 0.0153 -0.0482 24 ARG E CA 9981 C C . ARG G 24 ? 0.5729 0.6223 0.5079 0.1514 0.0099 -0.0498 24 ARG E C 9982 O O . ARG G 24 ? 0.5390 0.5718 0.4651 0.1453 0.0063 -0.0532 24 ARG E O 9983 C CB . ARG G 24 ? 0.6474 0.7182 0.5750 0.1611 0.0164 -0.0565 24 ARG E CB 9984 C CG . ARG G 24 ? 0.8551 0.9318 0.7881 0.1673 0.0175 -0.0565 24 ARG E CG 9985 C CD . ARG G 24 ? 1.0666 1.1307 0.9895 0.1730 0.0162 -0.0657 24 ARG E CD 9986 N NE . ARG G 24 ? 1.2634 1.3331 1.1770 0.1722 0.0187 -0.0707 24 ARG E NE 9987 C CZ . ARG G 24 ? 1.3940 1.4576 1.2996 0.1764 0.0194 -0.0786 24 ARG E CZ 9988 N NH1 . ARG G 24 ? 1.4421 1.4937 1.3488 0.1824 0.0179 -0.0822 24 ARG E NH1 9989 N NH2 . ARG G 24 ? 1.4203 1.4901 1.3170 0.1744 0.0217 -0.0829 24 ARG E NH2 9990 N N . ALA G 25 ? 0.5016 0.5519 0.4441 0.1557 0.0092 -0.0470 25 ALA E N 9991 C CA . ALA G 25 ? 0.4810 0.5118 0.4210 0.1539 0.0037 -0.0474 25 ALA E CA 9992 C C . ALA G 25 ? 0.5392 0.5598 0.4739 0.1649 0.0014 -0.0536 25 ALA E C 9993 O O . ALA G 25 ? 0.5744 0.6082 0.5152 0.1729 0.0042 -0.0536 25 ALA E O 9994 C CB . ALA G 25 ? 0.4030 0.4410 0.3549 0.1501 0.0036 -0.0394 25 ALA E CB 9995 N N . SER G 26 ? 0.5338 0.5303 0.4575 0.1630 -0.0038 -0.0582 26 SER E N 9996 C CA . SER G 26 ? 0.5111 0.4938 0.4290 0.1733 -0.0063 -0.0643 26 SER E CA 9997 C C . SER G 26 ? 0.5418 0.5311 0.4713 0.1812 -0.0075 -0.0597 26 SER E C 9998 O O . SER G 26 ? 0.6204 0.6083 0.5509 0.1882 -0.0076 -0.0624 26 SER E O 9999 C CB . SER G 26 ? 0.5171 0.4709 0.4215 0.1678 -0.0124 -0.0682 26 SER E CB 10000 O OG . SER G 26 ? 0.6414 0.5872 0.5485 0.1590 -0.0167 -0.0617 26 SER E OG 10001 N N . GLN G 27 ? 0.4969 0.4943 0.4359 0.1756 -0.0084 -0.0515 27 GLN E N 10002 C CA . GLN G 27 ? 0.6086 0.6173 0.5601 0.1819 -0.0092 -0.0462 27 GLN E CA 10003 C C . GLN G 27 ? 0.5941 0.6249 0.5574 0.1756 -0.0054 -0.0384 27 GLN E C 10004 O O . GLN G 27 ? 0.6114 0.6437 0.5732 0.1650 -0.0035 -0.0363 27 GLN E O 10005 C CB . GLN G 27 ? 0.6564 0.6455 0.6054 0.1811 -0.0169 -0.0437 27 GLN E CB 10006 C CG . GLN G 27 ? 0.8092 0.7746 0.7475 0.1886 -0.0212 -0.0505 27 GLN E CG 10007 C CD . GLN G 27 ? 0.9595 0.9053 0.8951 0.1863 -0.0294 -0.0464 27 GLN E CD 10008 O OE1 . GLN G 27 ? 0.9199 0.8684 0.8595 0.1768 -0.0320 -0.0390 27 GLN E OE1 10009 N NE2 . GLN G 27 ? 1.0147 0.9399 0.9429 0.1945 -0.0336 -0.0511 27 GLN E NE2 10010 N N . GLY G 28 ? 0.5186 0.5657 0.4939 0.1787 -0.0043 -0.0336 28 GLY E N 10011 C CA . GLY G 28 ? 0.4232 0.4909 0.4096 0.1729 -0.0004 -0.0265 28 GLY E CA 10012 C C . GLY G 28 ? 0.4216 0.4819 0.4079 0.1617 -0.0031 -0.0214 28 GLY E C 10013 O O . GLY G 28 ? 0.4466 0.4906 0.4290 0.1589 -0.0094 -0.0203 28 GLY E O 10014 N N . ILE G 29 ? 0.3994 0.4703 0.3894 0.1528 0.0016 -0.0180 29 ILE E N 10015 C CA . ILE G 29 ? 0.3835 0.4483 0.3742 0.1392 0.0005 -0.0133 29 ILE E CA 10016 C C . ILE G 29 ? 0.4144 0.4994 0.4167 0.1340 0.0058 -0.0070 29 ILE E C 10017 O O . ILE G 29 ? 0.4342 0.5169 0.4379 0.1225 0.0073 -0.0039 29 ILE E O 10018 C CB . ILE G 29 ? 0.3548 0.4058 0.3365 0.1309 0.0007 -0.0165 29 ILE E CB 10019 C CG1 . ILE G 29 ? 0.3184 0.3824 0.3018 0.1324 0.0068 -0.0176 29 ILE E CG1 10020 C CG2 . ILE G 29 ? 0.3956 0.4243 0.3646 0.1334 -0.0048 -0.0226 29 ILE E CG2 10021 C CD1 . ILE G 29 ? 0.3585 0.4124 0.3355 0.1242 0.0072 -0.0198 29 ILE E CD1 10022 N N . SER G 30 ? 0.4399 0.5445 0.4506 0.1422 0.0089 -0.0054 30 SER E N 10023 C CA . SER G 30 ? 0.4251 0.5497 0.4466 0.1377 0.0140 0.0007 30 SER E CA 10024 C C . SER G 30 ? 0.4488 0.5765 0.4706 0.1296 0.0195 0.0023 30 SER E C 10025 O O . SER G 30 ? 0.4885 0.6206 0.5076 0.1340 0.0226 -0.0002 30 SER E O 10026 C CB . SER G 30 ? 0.5247 0.6485 0.5510 0.1301 0.0108 0.0058 30 SER E CB 10027 O OG . SER G 30 ? 0.6993 0.8414 0.7354 0.1246 0.0159 0.0114 30 SER E OG 10028 N N . SER G 31 ? 0.3627 0.4881 0.3880 0.1179 0.0207 0.0065 31 SER E N 10029 C CA . SER G 31 ? 0.3698 0.4972 0.3971 0.1103 0.0259 0.0085 31 SER E CA 10030 C C . SER G 31 ? 0.4121 0.5209 0.4343 0.1003 0.0239 0.0069 31 SER E C 10031 O O . SER G 31 ? 0.4114 0.5201 0.4368 0.0928 0.0280 0.0088 31 SER E O 10032 C CB . SER G 31 ? 0.4022 0.5458 0.4400 0.1049 0.0313 0.0148 31 SER E CB 10033 O OG . SER G 31 ? 0.5458 0.7083 0.5884 0.1133 0.0339 0.0163 31 SER E OG 10034 N N . TYR G 32 ? 0.3347 0.4278 0.3493 0.1003 0.0178 0.0035 32 TYR E N 10035 C CA . TYR G 32 ? 0.3387 0.4139 0.3473 0.0905 0.0156 0.0014 32 TYR E CA 10036 C C . TYR G 32 ? 0.3404 0.4088 0.3432 0.0916 0.0163 -0.0028 32 TYR E C 10037 O O . TYR G 32 ? 0.3714 0.4255 0.3645 0.0934 0.0117 -0.0077 32 TYR E O 10038 C CB . TYR G 32 ? 0.3692 0.4295 0.3703 0.0898 0.0084 -0.0004 32 TYR E CB 10039 C CG . TYR G 32 ? 0.3991 0.4651 0.4054 0.0859 0.0068 0.0044 32 TYR E CG 10040 C CD1 . TYR G 32 ? 0.4762 0.5544 0.4875 0.0953 0.0051 0.0067 32 TYR E CD1 10041 C CD2 . TYR G 32 ? 0.4085 0.4687 0.4151 0.0725 0.0071 0.0065 32 TYR E CD2 10042 C CE1 . TYR G 32 ? 0.4854 0.5705 0.5019 0.0914 0.0032 0.0115 32 TYR E CE1 10043 C CE2 . TYR G 32 ? 0.4034 0.4695 0.4139 0.0679 0.0054 0.0109 32 TYR E CE2 10044 C CZ . TYR G 32 ? 0.4764 0.5553 0.4920 0.0774 0.0031 0.0138 32 TYR E CZ 10045 O OH . TYR G 32 ? 0.5439 0.6302 0.5638 0.0724 0.0009 0.0186 32 TYR E OH 10046 N N . LEU G 33 ? 0.2957 0.3742 0.3044 0.0902 0.0219 -0.0007 33 LEU E N 10047 C CA . LEU G 33 ? 0.3294 0.4047 0.3338 0.0914 0.0224 -0.0038 33 LEU E CA 10048 C C . LEU G 33 ? 0.3632 0.4442 0.3757 0.0847 0.0277 -0.0002 33 LEU E C 10049 O O . LEU G 33 ? 0.2860 0.3790 0.3077 0.0834 0.0324 0.0050 33 LEU E O 10050 C CB . LEU G 33 ? 0.3065 0.3912 0.3078 0.1028 0.0225 -0.0055 33 LEU E CB 10051 C CG . LEU G 33 ? 0.3946 0.4758 0.3893 0.1042 0.0219 -0.0093 33 LEU E CG 10052 C CD1 . LEU G 33 ? 0.3618 0.4278 0.3440 0.1078 0.0164 -0.0163 33 LEU E CD1 10053 C CD2 . LEU G 33 ? 0.4401 0.5384 0.4375 0.1105 0.0257 -0.0070 33 LEU E CD2 10054 N N . ALA G 34 ? 0.3047 0.3771 0.3141 0.0805 0.0270 -0.0030 34 ALA E N 10055 C CA . ALA G 34 ? 0.2614 0.3393 0.2792 0.0758 0.0317 0.0001 34 ALA E CA 10056 C C . ALA G 34 ? 0.3145 0.3936 0.3281 0.0794 0.0304 -0.0020 34 ALA E C 10057 O O . ALA G 34 ? 0.2811 0.3533 0.2842 0.0830 0.0259 -0.0072 34 ALA E O 10058 C CB . ALA G 34 ? 0.2171 0.2851 0.2386 0.0647 0.0331 -0.0005 34 ALA E CB 10059 N N . TRP G 35 ? 0.2331 0.3210 0.2551 0.0782 0.0342 0.0023 35 TRP E N 10060 C CA . TRP G 35 ? 0.2465 0.3373 0.2664 0.0802 0.0329 0.0014 35 TRP E CA 10061 C C . TRP G 35 ? 0.3245 0.4112 0.3520 0.0726 0.0347 0.0020 35 TRP E C 10062 O O . TRP G 35 ? 0.3402 0.4282 0.3784 0.0680 0.0393 0.0058 35 TRP E O 10063 C CB . TRP G 35 ? 0.2776 0.3847 0.3007 0.0867 0.0353 0.0069 35 TRP E CB 10064 C CG . TRP G 35 ? 0.3166 0.4295 0.3315 0.0949 0.0337 0.0051 35 TRP E CG 10065 C CD1 . TRP G 35 ? 0.2715 0.3918 0.2887 0.0986 0.0359 0.0075 35 TRP E CD1 10066 C CD2 . TRP G 35 ? 0.2583 0.3712 0.2617 0.1003 0.0302 0.0000 35 TRP E CD2 10067 N NE1 . TRP G 35 ? 0.2912 0.4163 0.2999 0.1065 0.0342 0.0040 35 TRP E NE1 10068 C CE2 . TRP G 35 ? 0.2417 0.3617 0.2414 0.1076 0.0308 -0.0007 35 TRP E CE2 10069 C CE3 . TRP G 35 ? 0.2828 0.3907 0.2788 0.0993 0.0267 -0.0042 35 TRP E CE3 10070 C CZ2 . TRP G 35 ? 0.2867 0.4080 0.2756 0.1141 0.0286 -0.0061 35 TRP E CZ2 10071 C CZ3 . TRP G 35 ? 0.2950 0.4039 0.2792 0.1050 0.0242 -0.0092 35 TRP E CZ3 10072 C CH2 . TRP G 35 ? 0.3257 0.4406 0.3063 0.1125 0.0254 -0.0104 35 TRP E CH2 10073 N N . TYR G 36 ? 0.2982 0.3800 0.3205 0.0711 0.0314 -0.0022 36 TYR E N 10074 C CA . TYR G 36 ? 0.2780 0.3576 0.3084 0.0645 0.0330 -0.0022 36 TYR E CA 10075 C C . TYR G 36 ? 0.3027 0.3914 0.3344 0.0674 0.0314 -0.0006 36 TYR E C 10076 O O . TYR G 36 ? 0.3071 0.3987 0.3286 0.0723 0.0276 -0.0027 36 TYR E O 10077 C CB . TYR G 36 ? 0.1997 0.2643 0.2238 0.0569 0.0305 -0.0092 36 TYR E CB 10078 C CG . TYR G 36 ? 0.2721 0.3276 0.2943 0.0528 0.0313 -0.0104 36 TYR E CG 10079 C CD1 . TYR G 36 ? 0.2516 0.3010 0.2625 0.0564 0.0273 -0.0129 36 TYR E CD1 10080 C CD2 . TYR G 36 ? 0.2781 0.3314 0.3101 0.0454 0.0361 -0.0090 36 TYR E CD2 10081 C CE1 . TYR G 36 ? 0.2728 0.3152 0.2823 0.0526 0.0273 -0.0131 36 TYR E CE1 10082 C CE2 . TYR G 36 ? 0.3080 0.3540 0.3375 0.0406 0.0365 -0.0098 36 TYR E CE2 10083 C CZ . TYR G 36 ? 0.3208 0.3619 0.3392 0.0443 0.0318 -0.0114 36 TYR E CZ 10084 O OH . TYR G 36 ? 0.3296 0.3645 0.3458 0.0395 0.0315 -0.0114 36 TYR E OH 10085 N N . GLN G 37 ? 0.2225 0.3159 0.2672 0.0643 0.0344 0.0031 37 GLN E N 10086 C CA . GLN G 37 ? 0.2934 0.3961 0.3414 0.0662 0.0325 0.0054 37 GLN E CA 10087 C C . GLN G 37 ? 0.2443 0.3408 0.2953 0.0592 0.0315 0.0004 37 GLN E C 10088 O O . GLN G 37 ? 0.3393 0.4304 0.3998 0.0536 0.0355 -0.0003 37 GLN E O 10089 C CB . GLN G 37 ? 0.2838 0.3985 0.3459 0.0694 0.0364 0.0148 37 GLN E CB 10090 C CG . GLN G 37 ? 0.3414 0.4666 0.4094 0.0710 0.0342 0.0186 37 GLN E CG 10091 C CD . GLN G 37 ? 0.3668 0.5007 0.4511 0.0730 0.0383 0.0282 37 GLN E CD 10092 O OE1 . GLN G 37 ? 0.3125 0.4424 0.4102 0.0694 0.0425 0.0291 37 GLN E OE1 10093 N NE2 . GLN G 37 ? 0.3652 0.5105 0.4481 0.0787 0.0374 0.0355 37 GLN E NE2 10094 N N . GLN G 38 ? 0.2315 0.3289 0.2741 0.0590 0.0266 -0.0036 38 GLN E N 10095 C CA . GLN G 38 ? 0.3515 0.4447 0.3969 0.0519 0.0256 -0.0085 38 GLN E CA 10096 C C . GLN G 38 ? 0.3023 0.4085 0.3530 0.0533 0.0229 -0.0058 38 GLN E C 10097 O O . GLN G 38 ? 0.3100 0.4211 0.3498 0.0563 0.0182 -0.0067 38 GLN E O 10098 C CB . GLN G 38 ? 0.3044 0.3833 0.3334 0.0472 0.0216 -0.0174 38 GLN E CB 10099 C CG . GLN G 38 ? 0.2995 0.3730 0.3311 0.0381 0.0214 -0.0229 38 GLN E CG 10100 C CD . GLN G 38 ? 0.3588 0.4167 0.3732 0.0326 0.0173 -0.0312 38 GLN E CD 10101 O OE1 . GLN G 38 ? 0.3711 0.4246 0.3710 0.0365 0.0132 -0.0335 38 GLN E OE1 10102 N NE2 . GLN G 38 ? 0.3649 0.4139 0.3807 0.0234 0.0188 -0.0358 38 GLN E NE2 10103 N N . LYS G 39 ? 0.3110 0.4231 0.3787 0.0510 0.0261 -0.0026 39 LYS E N 10104 C CA . LYS G 39 ? 0.3477 0.4725 0.4230 0.0514 0.0234 -0.0002 39 LYS E CA 10105 C C . LYS G 39 ? 0.4581 0.5776 0.5263 0.0440 0.0201 -0.0090 39 LYS E C 10106 O O . LYS G 39 ? 0.4128 0.5193 0.4775 0.0375 0.0220 -0.0155 39 LYS E O 10107 C CB . LYS G 39 ? 0.2959 0.4284 0.3937 0.0524 0.0283 0.0063 39 LYS E CB 10108 C CG . LYS G 39 ? 0.3586 0.4961 0.4640 0.0591 0.0316 0.0158 39 LYS E CG 10109 C CD . LYS G 39 ? 0.4066 0.5591 0.5110 0.0654 0.0271 0.0234 39 LYS E CD 10110 C CE . LYS G 39 ? 0.4017 0.5599 0.5153 0.0712 0.0306 0.0338 39 LYS E CE 10111 N NZ . LYS G 39 ? 0.3657 0.5396 0.4797 0.0764 0.0260 0.0422 39 LYS E NZ 10112 N N . PRO G 40 ? 0.4694 0.5994 0.5349 0.0441 0.0151 -0.0089 40 PRO E N 10113 C CA . PRO G 40 ? 0.3937 0.5203 0.4526 0.0363 0.0118 -0.0170 40 PRO E CA 10114 C C . PRO G 40 ? 0.3484 0.4717 0.4210 0.0294 0.0162 -0.0204 40 PRO E C 10115 O O . PRO G 40 ? 0.3562 0.4889 0.4486 0.0315 0.0201 -0.0150 40 PRO E O 10116 C CB . PRO G 40 ? 0.4548 0.5988 0.5158 0.0384 0.0068 -0.0133 40 PRO E CB 10117 C CG . PRO G 40 ? 0.4146 0.5653 0.4711 0.0468 0.0056 -0.0062 40 PRO E CG 10118 C CD . PRO G 40 ? 0.4265 0.5723 0.4932 0.0508 0.0118 -0.0013 40 PRO E CD 10119 N N . GLY G 41 ? 0.3744 0.4838 0.4362 0.0211 0.0159 -0.0292 41 GLY E N 10120 C CA . GLY G 41 ? 0.3519 0.4576 0.4240 0.0130 0.0203 -0.0338 41 GLY E CA 10121 C C . GLY G 41 ? 0.4206 0.5192 0.5027 0.0130 0.0274 -0.0320 41 GLY E C 10122 O O . GLY G 41 ? 0.5239 0.6210 0.6170 0.0067 0.0324 -0.0354 41 GLY E O 10123 N N . LYS G 42 ? 0.3079 0.4027 0.3862 0.0194 0.0283 -0.0273 42 LYS E N 10124 C CA . LYS G 42 ? 0.2662 0.3550 0.3532 0.0190 0.0349 -0.0254 42 LYS E CA 10125 C C . LYS G 42 ? 0.3114 0.3851 0.3821 0.0174 0.0341 -0.0281 42 LYS E C 10126 O O . LYS G 42 ? 0.2650 0.3337 0.3189 0.0191 0.0286 -0.0302 42 LYS E O 10127 C CB . LYS G 42 ? 0.3470 0.4468 0.4483 0.0279 0.0378 -0.0157 42 LYS E CB 10128 C CG . LYS G 42 ? 0.4275 0.5423 0.5473 0.0306 0.0385 -0.0114 42 LYS E CG 10129 C CD . LYS G 42 ? 0.4632 0.5764 0.5978 0.0237 0.0444 -0.0160 42 LYS E CD 10130 C CE . LYS G 42 ? 0.5207 0.6496 0.6754 0.0271 0.0450 -0.0117 42 LYS E CE 10131 N NZ . LYS G 42 ? 0.5597 0.6874 0.7295 0.0206 0.0514 -0.0174 42 LYS E NZ 10132 N N . ALA G 43 ? 0.3230 0.3898 0.3992 0.0140 0.0397 -0.0281 43 ALA E N 10133 C CA . ALA G 43 ? 0.2877 0.3424 0.3512 0.0129 0.0391 -0.0293 43 ALA E CA 10134 C C . ALA G 43 ? 0.3041 0.3645 0.3665 0.0229 0.0383 -0.0224 43 ALA E C 10135 O O . ALA G 43 ? 0.3122 0.3841 0.3871 0.0288 0.0407 -0.0159 43 ALA E O 10136 C CB . ALA G 43 ? 0.2689 0.3160 0.3386 0.0050 0.0454 -0.0315 43 ALA E CB 10137 N N . PRO G 44 ? 0.3069 0.3594 0.3545 0.0249 0.0349 -0.0235 44 PRO E N 10138 C CA . PRO G 44 ? 0.3488 0.4072 0.3955 0.0337 0.0348 -0.0175 44 PRO E CA 10139 C C . PRO G 44 ? 0.3121 0.3739 0.3725 0.0335 0.0415 -0.0123 44 PRO E C 10140 O O . PRO G 44 ? 0.3174 0.3726 0.3830 0.0257 0.0456 -0.0149 44 PRO E O 10141 C CB . PRO G 44 ? 0.3592 0.4063 0.3894 0.0339 0.0307 -0.0211 44 PRO E CB 10142 C CG . PRO G 44 ? 0.3831 0.4189 0.4032 0.0266 0.0271 -0.0284 44 PRO E CG 10143 C CD . PRO G 44 ? 0.3200 0.3577 0.3520 0.0188 0.0312 -0.0301 44 PRO E CD 10144 N N . LYS G 45 ? 0.2631 0.3350 0.3287 0.0411 0.0429 -0.0053 45 LYS E N 10145 C CA . LYS G 45 ? 0.2457 0.3198 0.3225 0.0407 0.0491 -0.0002 45 LYS E CA 10146 C C . LYS G 45 ? 0.2596 0.3367 0.3298 0.0463 0.0482 0.0034 45 LYS E C 10147 O O . LYS G 45 ? 0.2641 0.3487 0.3284 0.0537 0.0447 0.0058 45 LYS E O 10148 C CB . LYS G 45 ? 0.2793 0.3634 0.3724 0.0437 0.0529 0.0060 45 LYS E CB 10149 C CG . LYS G 45 ? 0.5122 0.5960 0.6139 0.0393 0.0536 0.0026 45 LYS E CG 10150 C CD . LYS G 45 ? 0.6163 0.7051 0.7377 0.0397 0.0599 0.0076 45 LYS E CD 10151 C CE . LYS G 45 ? 0.6445 0.7362 0.7755 0.0372 0.0599 0.0045 45 LYS E CE 10152 N NZ . LYS G 45 ? 0.6267 0.7168 0.7761 0.0339 0.0678 0.0050 45 LYS E NZ 10153 N N . LEU G 46 ? 0.2221 0.2941 0.2928 0.0422 0.0513 0.0034 46 LEU E N 10154 C CA . LEU G 46 ? 0.1971 0.2732 0.2632 0.0469 0.0510 0.0067 46 LEU E CA 10155 C C . LEU G 46 ? 0.2808 0.3699 0.3543 0.0537 0.0534 0.0145 46 LEU E C 10156 O O . LEU G 46 ? 0.2804 0.3724 0.3663 0.0521 0.0583 0.0188 46 LEU E O 10157 C CB . LEU G 46 ? 0.2203 0.2904 0.2883 0.0399 0.0546 0.0063 46 LEU E CB 10158 C CG . LEU G 46 ? 0.2440 0.3194 0.3077 0.0440 0.0540 0.0095 46 LEU E CG 10159 C CD1 . LEU G 46 ? 0.2089 0.2818 0.2591 0.0492 0.0472 0.0059 46 LEU E CD1 10160 C CD2 . LEU G 46 ? 0.1515 0.2226 0.2183 0.0358 0.0578 0.0095 46 LEU E CD2 10161 N N . VAL G 47 ? 0.3409 0.4373 0.4065 0.0612 0.0501 0.0162 47 VAL E N 10162 C CA . VAL G 47 ? 0.4282 0.5375 0.4987 0.0671 0.0522 0.0238 47 VAL E CA 10163 C C . VAL G 47 ? 0.4737 0.5871 0.5434 0.0681 0.0546 0.0265 47 VAL E C 10164 O O . VAL G 47 ? 0.5686 0.6861 0.6472 0.0662 0.0597 0.0321 47 VAL E O 10165 C CB . VAL G 47 ? 0.4799 0.5972 0.5422 0.0744 0.0476 0.0240 47 VAL E CB 10166 C CG1 . VAL G 47 ? 0.4720 0.6031 0.5374 0.0797 0.0498 0.0319 47 VAL E CG1 10167 C CG2 . VAL G 47 ? 0.5123 0.6283 0.5763 0.0731 0.0451 0.0223 47 VAL E CG2 10168 N N . ILE G 48 ? 0.5887 0.7004 0.6476 0.0710 0.0508 0.0222 48 ILE E N 10169 C CA . ILE G 48 ? 0.6462 0.7642 0.7038 0.0733 0.0521 0.0242 48 ILE E CA 10170 C C . ILE G 48 ? 0.5660 0.6749 0.6162 0.0714 0.0487 0.0185 48 ILE E C 10171 O O . ILE G 48 ? 0.4830 0.5837 0.5243 0.0728 0.0438 0.0129 48 ILE E O 10172 C CB . ILE G 48 ? 0.7163 0.8472 0.7689 0.0822 0.0508 0.0265 48 ILE E CB 10173 C CG1 . ILE G 48 ? 0.7446 0.8862 0.8053 0.0830 0.0548 0.0345 48 ILE E CG1 10174 C CG2 . ILE G 48 ? 0.7156 0.8523 0.7647 0.0857 0.0506 0.0260 48 ILE E CG2 10175 C CD1 . ILE G 48 ? 0.7531 0.9054 0.8071 0.0886 0.0531 0.0368 48 ILE E CD1 10176 N N . TYR G 49 ? 0.5801 0.6903 0.6337 0.0678 0.0510 0.0204 49 TYR E N 10177 C CA . TYR G 49 ? 0.5340 0.6378 0.5813 0.0665 0.0474 0.0166 49 TYR E CA 10178 C C . TYR G 49 ? 0.5727 0.6888 0.6211 0.0712 0.0480 0.0197 49 TYR E C 10179 O O . TYR G 49 ? 0.4988 0.6275 0.5525 0.0742 0.0519 0.0246 49 TYR E O 10180 C CB . TYR G 49 ? 0.4763 0.5695 0.5265 0.0554 0.0490 0.0151 49 TYR E CB 10181 C CG . TYR G 49 ? 0.4100 0.5086 0.4705 0.0492 0.0557 0.0200 49 TYR E CG 10182 C CD1 . TYR G 49 ? 0.3791 0.4775 0.4481 0.0464 0.0607 0.0223 49 TYR E CD1 10183 C CD2 . TYR G 49 ? 0.4047 0.5085 0.4668 0.0462 0.0570 0.0223 49 TYR E CD2 10184 C CE1 . TYR G 49 ? 0.4392 0.5406 0.5175 0.0407 0.0672 0.0265 49 TYR E CE1 10185 C CE2 . TYR G 49 ? 0.4551 0.5631 0.5259 0.0397 0.0634 0.0263 49 TYR E CE2 10186 C CZ . TYR G 49 ? 0.5574 0.6633 0.6360 0.0370 0.0687 0.0283 49 TYR E CZ 10187 O OH . TYR G 49 ? 0.6536 0.7617 0.7406 0.0304 0.0754 0.0321 49 TYR E OH 10188 N N . ALA G 50 ? 0.7563 0.8690 0.7999 0.0718 0.0441 0.0173 50 ALA E N 10189 C CA . ALA G 50 ? 0.7933 0.9187 0.8384 0.0773 0.0439 0.0196 50 ALA E CA 10190 C C . ALA G 50 ? 0.8601 0.9973 0.9035 0.0879 0.0444 0.0200 50 ALA E C 10191 O O . ALA G 50 ? 0.9002 1.0526 0.9480 0.0914 0.0472 0.0235 50 ALA E O 10192 C CB . ALA G 50 ? 0.7652 0.8993 0.8192 0.0705 0.0491 0.0249 50 ALA E CB 10193 N N . ALA G 51 ? 0.8068 0.9376 0.8436 0.0917 0.0420 0.0162 51 ALA E N 10194 C CA . ALA G 51 ? 0.7448 0.8848 0.7777 0.1007 0.0420 0.0154 51 ALA E CA 10195 C C . ALA G 51 ? 0.7730 0.9234 0.8106 0.0985 0.0461 0.0212 51 ALA E C 10196 O O . ALA G 51 ? 0.6776 0.8313 0.7102 0.1021 0.0453 0.0207 51 ALA E O 10197 C CB . ALA G 51 ? 0.6177 0.7640 0.6473 0.1085 0.0398 0.0131 51 ALA E CB 10198 N N . SER G 52 ? 0.8309 0.9848 0.8767 0.0917 0.0501 0.0267 52 SER E N 10199 C CA . SER G 52 ? 0.8042 0.9659 0.8531 0.0893 0.0531 0.0326 52 SER E CA 10200 C C . SER G 52 ? 0.7748 0.9332 0.8323 0.0815 0.0573 0.0378 52 SER E C 10201 O O . SER G 52 ? 0.7744 0.9363 0.8338 0.0808 0.0590 0.0425 52 SER E O 10202 C CB . SER G 52 ? 0.8074 0.9794 0.8564 0.0901 0.0538 0.0347 52 SER E CB 10203 O OG . SER G 52 ? 0.8421 1.0141 0.8970 0.0850 0.0553 0.0358 52 SER E OG 10204 N N . THR G 53 ? 0.7879 0.9398 0.8509 0.0756 0.0593 0.0370 53 THR E N 10205 C CA . THR G 53 ? 0.8430 0.9904 0.9145 0.0676 0.0641 0.0411 53 THR E CA 10206 C C . THR G 53 ? 0.7833 0.9219 0.8580 0.0662 0.0648 0.0397 53 THR E C 10207 O O . THR G 53 ? 0.6554 0.7874 0.7266 0.0673 0.0622 0.0345 53 THR E O 10208 C CB . THR G 53 ? 0.6023 0.7478 0.6783 0.0601 0.0670 0.0410 53 THR E CB 10209 O OG1 . THR G 53 ? 0.5776 0.7141 0.6608 0.0519 0.0715 0.0420 53 THR E OG1 10210 C CG2 . THR G 53 ? 0.5325 0.6757 0.6044 0.0619 0.0640 0.0360 53 THR E CG2 10211 N N . LEU G 54 ? 0.8034 0.9407 0.8844 0.0633 0.0676 0.0444 54 LEU E N 10212 C CA . LEU G 54 ? 0.7324 0.8631 0.8186 0.0623 0.0684 0.0440 54 LEU E CA 10213 C C . LEU G 54 ? 0.6609 0.7810 0.7529 0.0548 0.0719 0.0403 54 LEU E C 10214 O O . LEU G 54 ? 0.6055 0.7185 0.7003 0.0532 0.0716 0.0374 54 LEU E O 10215 C CB . LEU G 54 ? 0.7311 0.8639 0.8235 0.0620 0.0706 0.0510 54 LEU E CB 10216 C CG . LEU G 54 ? 0.7073 0.8516 0.7946 0.0677 0.0688 0.0562 54 LEU E CG 10217 C CD1 . LEU G 54 ? 0.7481 0.8941 0.8429 0.0671 0.0716 0.0645 54 LEU E CD1 10218 C CD2 . LEU G 54 ? 0.6248 0.7745 0.7036 0.0750 0.0638 0.0530 54 LEU E CD2 10219 N N . ARG G 61 ? 0.6271 0.8149 0.7176 0.0865 0.0658 0.0915 61 ARG E N 10220 C CA . ARG G 61 ? 0.7080 0.9075 0.7905 0.0922 0.0613 0.0909 61 ARG E CA 10221 C C . ARG G 61 ? 0.8115 1.0084 0.8835 0.0940 0.0581 0.0794 61 ARG E C 10222 O O . ARG G 61 ? 0.8683 1.0748 0.9297 0.0978 0.0565 0.0768 61 ARG E O 10223 C CB . ARG G 61 ? 0.7032 0.9035 0.7937 0.0940 0.0588 0.0953 61 ARG E CB 10224 C CG . ARG G 61 ? 0.7858 0.9956 0.8672 0.0984 0.0533 0.0922 61 ARG E CG 10225 C CD . ARG G 61 ? 0.9222 1.1381 1.0089 0.0995 0.0500 0.1010 61 ARG E CD 10226 N NE . ARG G 61 ? 0.9841 1.1904 1.0859 0.0977 0.0507 0.1025 61 ARG E NE 10227 C CZ . ARG G 61 ? 0.9378 1.1385 1.0414 0.0971 0.0477 0.0956 61 ARG E CZ 10228 N NH1 . ARG G 61 ? 0.9115 1.1139 1.0021 0.0979 0.0434 0.0870 61 ARG E NH1 10229 N NH2 . ARG G 61 ? 0.9128 1.1054 1.0307 0.0952 0.0491 0.0968 61 ARG E NH2 10230 N N . PHE G 62 ? 0.8455 1.0297 0.9210 0.0914 0.0575 0.0725 62 PHE E N 10231 C CA . PHE G 62 ? 0.8591 1.0386 0.9259 0.0926 0.0550 0.0622 62 PHE E CA 10232 C C . PHE G 62 ? 0.9103 1.0890 0.9726 0.0912 0.0568 0.0599 62 PHE E C 10233 O O . PHE G 62 ? 0.9270 1.1029 0.9956 0.0867 0.0604 0.0639 62 PHE E O 10234 C CB . PHE G 62 ? 0.8284 0.9952 0.9008 0.0892 0.0547 0.0565 62 PHE E CB 10235 C CG . PHE G 62 ? 0.8272 0.9950 0.9020 0.0907 0.0516 0.0562 62 PHE E CG 10236 C CD1 . PHE G 62 ? 0.8017 0.9739 0.8866 0.0906 0.0523 0.0644 62 PHE E CD1 10237 C CD2 . PHE G 62 ? 0.7974 0.9593 0.8633 0.0909 0.0470 0.0475 62 PHE E CD2 10238 C CE1 . PHE G 62 ? 0.7702 0.9429 0.8570 0.0909 0.0483 0.0639 62 PHE E CE1 10239 C CE2 . PHE G 62 ? 0.7505 0.9122 0.8172 0.0903 0.0433 0.0465 62 PHE E CE2 10240 C CZ . PHE G 62 ? 0.7234 0.8915 0.8010 0.0904 0.0439 0.0548 62 PHE E CZ 10241 N N . SER G 63 ? 0.9315 1.1129 0.9834 0.0951 0.0543 0.0534 63 SER E N 10242 C CA . SER G 63 ? 0.9132 1.0948 0.9618 0.0945 0.0552 0.0508 63 SER E CA 10243 C C . SER G 63 ? 0.8795 1.0579 0.9192 0.0988 0.0518 0.0417 63 SER E C 10244 O O . SER G 63 ? 0.8702 1.0499 0.9032 0.1034 0.0490 0.0377 63 SER E O 10245 C CB . SER G 63 ? 0.8597 1.0541 0.9058 0.0958 0.0570 0.0564 63 SER E CB 10246 O OG . SER G 63 ? 0.8356 1.0398 0.8721 0.1018 0.0549 0.0543 63 SER E OG 10247 N N . GLY G 64 ? 0.9071 1.0816 0.9470 0.0975 0.0520 0.0386 64 GLY E N 10248 C CA . GLY G 64 ? 0.9064 1.0770 0.9390 0.1020 0.0488 0.0307 64 GLY E CA 10249 C C . GLY G 64 ? 0.8617 1.0390 0.8922 0.1041 0.0491 0.0299 64 GLY E C 10250 O O . GLY G 64 ? 0.9555 1.1381 0.9914 0.1002 0.0518 0.0349 64 GLY E O 10251 N N . SER G 65 ? 0.6760 0.8529 0.6989 0.1104 0.0462 0.0235 65 SER E N 10252 C CA . SER G 65 ? 0.6125 0.7963 0.6341 0.1133 0.0463 0.0221 65 SER E CA 10253 C C . SER G 65 ? 0.5753 0.7534 0.5901 0.1202 0.0429 0.0141 65 SER E C 10254 O O . SER G 65 ? 0.5208 0.6906 0.5295 0.1231 0.0404 0.0091 65 SER E O 10255 C CB . SER G 65 ? 0.5976 0.7952 0.6169 0.1147 0.0486 0.0255 65 SER E CB 10256 O OG . SER G 65 ? 0.6781 0.8779 0.6889 0.1198 0.0473 0.0217 65 SER E OG 10257 N N . GLY G 66 ? 0.4931 0.6759 0.5093 0.1229 0.0427 0.0127 66 GLY E N 10258 C CA . GLY G 66 ? 0.5446 0.7222 0.5557 0.1300 0.0396 0.0056 66 GLY E CA 10259 C C . GLY G 66 ? 0.6004 0.7699 0.6157 0.1299 0.0371 0.0047 66 GLY E C 10260 O O . GLY G 66 ? 0.5755 0.7421 0.5965 0.1239 0.0378 0.0086 66 GLY E O 10261 N N . SER G 67 ? 0.6092 0.7754 0.6219 0.1367 0.0343 -0.0003 67 SER E N 10262 C CA . SER G 67 ? 0.5948 0.7540 0.6109 0.1380 0.0311 -0.0009 67 SER E CA 10263 C C . SER G 67 ? 0.5945 0.7435 0.6041 0.1467 0.0270 -0.0080 67 SER E C 10264 O O . SER G 67 ? 0.6337 0.7832 0.6371 0.1514 0.0276 -0.0126 67 SER E O 10265 C CB . SER G 67 ? 0.6134 0.7856 0.6388 0.1359 0.0327 0.0040 67 SER E CB 10266 O OG . SER G 67 ? 0.6878 0.8555 0.7179 0.1349 0.0299 0.0055 67 SER E OG 10267 N N . GLY G 68 ? 0.5318 0.6711 0.5425 0.1487 0.0228 -0.0087 68 GLY E N 10268 C CA . GLY G 68 ? 0.5591 0.6863 0.5640 0.1570 0.0185 -0.0148 68 GLY E CA 10269 C C . GLY G 68 ? 0.5665 0.6772 0.5599 0.1587 0.0164 -0.0210 68 GLY E C 10270 O O . GLY G 68 ? 0.5812 0.6784 0.5711 0.1565 0.0134 -0.0216 68 GLY E O 10271 N N . THR G 69 ? 0.5016 0.6135 0.4885 0.1625 0.0181 -0.0260 69 THR E N 10272 C CA . THR G 69 ? 0.5139 0.6104 0.4889 0.1643 0.0161 -0.0327 69 THR E CA 10273 C C . THR G 69 ? 0.4847 0.5886 0.4553 0.1607 0.0197 -0.0331 69 THR E C 10274 O O . THR G 69 ? 0.5625 0.6556 0.5232 0.1610 0.0183 -0.0385 69 THR E O 10275 C CB . THR G 69 ? 0.5531 0.6404 0.5216 0.1728 0.0142 -0.0401 69 THR E CB 10276 O OG1 . THR G 69 ? 0.5965 0.6997 0.5679 0.1758 0.0184 -0.0408 69 THR E OG1 10277 C CG2 . THR G 69 ? 0.5583 0.6357 0.5304 0.1772 0.0096 -0.0396 69 THR E CG2 10278 N N . GLU G 70 ? 0.4657 0.5877 0.4433 0.1570 0.0239 -0.0274 70 GLU E N 10279 C CA . GLU G 70 ? 0.4484 0.5788 0.4225 0.1540 0.0269 -0.0265 70 GLU E CA 10280 C C . GLU G 70 ? 0.4507 0.5904 0.4331 0.1463 0.0295 -0.0181 70 GLU E C 10281 O O . GLU G 70 ? 0.4696 0.6197 0.4604 0.1438 0.0317 -0.0125 70 GLU E O 10282 C CB . GLU G 70 ? 0.6068 0.7499 0.5788 0.1580 0.0298 -0.0284 70 GLU E CB 10283 C CG . GLU G 70 ? 0.8053 0.9577 0.7723 0.1557 0.0323 -0.0277 70 GLU E CG 10284 C CD . GLU G 70 ? 1.0398 1.1803 0.9953 0.1568 0.0301 -0.0345 70 GLU E CD 10285 O OE1 . GLU G 70 ? 1.1363 1.2663 1.0841 0.1621 0.0283 -0.0426 70 GLU E OE1 10286 O OE2 . GLU G 70 ? 1.1189 1.2602 1.0733 0.1524 0.0301 -0.0318 70 GLU E OE2 10287 N N . PHE G 71 ? 0.4625 0.5982 0.4424 0.1424 0.0294 -0.0174 71 PHE E N 10288 C CA . PHE G 71 ? 0.3875 0.5300 0.3760 0.1351 0.0320 -0.0096 71 PHE E CA 10289 C C . PHE G 71 ? 0.4050 0.5544 0.3906 0.1336 0.0336 -0.0079 71 PHE E C 10290 O O . PHE G 71 ? 0.3779 0.5230 0.3543 0.1366 0.0320 -0.0137 71 PHE E O 10291 C CB . PHE G 71 ? 0.3953 0.5262 0.3876 0.1311 0.0304 -0.0090 71 PHE E CB 10292 C CG . PHE G 71 ? 0.4098 0.5345 0.4046 0.1329 0.0282 -0.0100 71 PHE E CG 10293 C CD1 . PHE G 71 ? 0.3953 0.5062 0.3820 0.1382 0.0238 -0.0168 71 PHE E CD1 10294 C CD2 . PHE G 71 ? 0.3620 0.4939 0.3667 0.1287 0.0302 -0.0039 71 PHE E CD2 10295 C CE1 . PHE G 71 ? 0.4511 0.5566 0.4405 0.1400 0.0210 -0.0167 71 PHE E CE1 10296 C CE2 . PHE G 71 ? 0.4273 0.5559 0.4347 0.1307 0.0279 -0.0043 71 PHE E CE2 10297 C CZ . PHE G 71 ? 0.4435 0.5590 0.4435 0.1367 0.0230 -0.0103 71 PHE E CZ 10298 N N . THR G 72 ? 0.4704 0.6304 0.4637 0.1286 0.0367 0.0001 72 THR E N 10299 C CA . THR G 72 ? 0.4604 0.6296 0.4523 0.1276 0.0382 0.0034 72 THR E CA 10300 C C . THR G 72 ? 0.3935 0.5630 0.3951 0.1211 0.0399 0.0108 72 THR E C 10301 O O . THR G 72 ? 0.4050 0.5754 0.4152 0.1165 0.0420 0.0163 72 THR E O 10302 C CB . THR G 72 ? 0.5083 0.6927 0.4985 0.1295 0.0407 0.0064 72 THR E CB 10303 O OG1 . THR G 72 ? 0.6028 0.7883 0.5824 0.1357 0.0396 -0.0014 72 THR E OG1 10304 C CG2 . THR G 72 ? 0.5688 0.7645 0.5615 0.1266 0.0428 0.0139 72 THR E CG2 10305 N N . LEU G 73 ? 0.4197 0.5872 0.4199 0.1198 0.0385 0.0107 73 LEU E N 10306 C CA . LEU G 73 ? 0.3805 0.5490 0.3904 0.1137 0.0399 0.0181 73 LEU E CA 10307 C C . LEU G 73 ? 0.4111 0.5941 0.4202 0.1149 0.0410 0.0239 73 LEU E C 10308 O O . LEU G 73 ? 0.4403 0.6261 0.4397 0.1172 0.0383 0.0205 73 LEU E O 10309 C CB . LEU G 73 ? 0.4107 0.5648 0.4203 0.1086 0.0364 0.0147 73 LEU E CB 10310 C CG . LEU G 73 ? 0.4494 0.6039 0.4706 0.1029 0.0381 0.0215 73 LEU E CG 10311 C CD1 . LEU G 73 ? 0.4586 0.6119 0.4908 0.0995 0.0426 0.0260 73 LEU E CD1 10312 C CD2 . LEU G 73 ? 0.4426 0.5854 0.4630 0.0982 0.0347 0.0171 73 LEU E CD2 10313 N N . THR G 74 ? 0.4117 0.6035 0.4303 0.1128 0.0447 0.0330 74 THR E N 10314 C CA . THR G 74 ? 0.4670 0.6731 0.4850 0.1137 0.0457 0.0401 74 THR E CA 10315 C C . THR G 74 ? 0.4703 0.6760 0.4993 0.1092 0.0463 0.0490 74 THR E C 10316 O O . THR G 74 ? 0.5179 0.7178 0.5571 0.1052 0.0492 0.0528 74 THR E O 10317 C CB . THR G 74 ? 0.5276 0.7433 0.5436 0.1143 0.0485 0.0435 74 THR E CB 10318 O OG1 . THR G 74 ? 0.6218 0.8388 0.6274 0.1189 0.0475 0.0352 74 THR E OG1 10319 C CG2 . THR G 74 ? 0.5776 0.8093 0.5939 0.1147 0.0502 0.0524 74 THR E CG2 10320 N N . ILE G 75 ? 0.4477 0.6584 0.4742 0.1090 0.0432 0.0519 75 ILE E N 10321 C CA . ILE G 75 ? 0.4981 0.7114 0.5355 0.1062 0.0436 0.0618 75 ILE E CA 10322 C C . ILE G 75 ? 0.5373 0.7665 0.5723 0.1077 0.0446 0.0708 75 ILE E C 10323 O O . ILE G 75 ? 0.5243 0.7624 0.5487 0.1095 0.0415 0.0698 75 ILE E O 10324 C CB . ILE G 75 ? 0.4973 0.7062 0.5356 0.1046 0.0388 0.0602 75 ILE E CB 10325 C CG1 . ILE G 75 ? 0.5297 0.7233 0.5681 0.1024 0.0376 0.0506 75 ILE E CG1 10326 C CG2 . ILE G 75 ? 0.4770 0.6887 0.5291 0.1026 0.0393 0.0707 75 ILE E CG2 10327 C CD1 . ILE G 75 ? 0.5117 0.7015 0.5515 0.0999 0.0332 0.0484 75 ILE E CD1 10328 N N . SER G 76 ? 0.6749 0.9073 0.7189 0.1062 0.0489 0.0794 76 SER E N 10329 C CA . SER G 76 ? 0.7685 1.0155 0.8093 0.1068 0.0505 0.0882 76 SER E CA 10330 C C . SER G 76 ? 0.8059 1.0603 0.8466 0.1064 0.0465 0.0964 76 SER E C 10331 O O . SER G 76 ? 0.8597 1.1271 0.8902 0.1074 0.0450 0.0991 76 SER E O 10332 C CB . SER G 76 ? 0.8834 1.1301 0.9342 0.1042 0.0562 0.0958 76 SER E CB 10333 O OG . SER G 76 ? 0.9378 1.1754 1.0022 0.1014 0.0568 0.1021 76 SER E OG 10334 N N . SER G 77 ? 0.7065 0.9533 0.7585 0.1049 0.0447 0.1003 77 SER E N 10335 C CA . SER G 77 ? 0.6442 0.8984 0.6987 0.1049 0.0403 0.1092 77 SER E CA 10336 C C . SER G 77 ? 0.5802 0.8264 0.6419 0.1044 0.0364 0.1057 77 SER E C 10337 O O . SER G 77 ? 0.6658 0.9041 0.7425 0.1033 0.0380 0.1098 77 SER E O 10338 C CB . SER G 77 ? 0.5933 0.8503 0.6584 0.1037 0.0430 0.1232 77 SER E CB 10339 O OG . SER G 77 ? 0.5817 0.8481 0.6478 0.1041 0.0381 0.1331 77 SER E OG 10340 N N . LEU G 78 ? 0.4341 0.6826 0.4850 0.1049 0.0316 0.0979 78 LEU E N 10341 C CA . LEU G 78 ? 0.3873 0.6290 0.4428 0.1037 0.0279 0.0928 78 LEU E CA 10342 C C . LEU G 78 ? 0.4619 0.7052 0.5341 0.1033 0.0263 0.1029 78 LEU E C 10343 O O . LEU G 78 ? 0.5298 0.7839 0.6046 0.1042 0.0246 0.1143 78 LEU E O 10344 C CB . LEU G 78 ? 0.4602 0.7084 0.5004 0.1036 0.0223 0.0860 78 LEU E CB 10345 C CG . LEU G 78 ? 0.5128 0.7540 0.5541 0.1015 0.0183 0.0784 78 LEU E CG 10346 C CD1 . LEU G 78 ? 0.4864 0.7110 0.5309 0.1004 0.0218 0.0690 78 LEU E CD1 10347 C CD2 . LEU G 78 ? 0.5353 0.7825 0.5591 0.1008 0.0134 0.0713 78 LEU E CD2 10348 N N . GLN G 79 ? 0.4136 0.6462 0.4972 0.1018 0.0271 0.0986 79 GLN E N 10349 C CA . GLN G 79 ? 0.4310 0.6644 0.5322 0.1020 0.0260 0.1064 79 GLN E CA 10350 C C . GLN G 79 ? 0.4478 0.6803 0.5502 0.1004 0.0216 0.0991 79 GLN E C 10351 O O . GLN G 79 ? 0.5044 0.7305 0.5958 0.0983 0.0209 0.0875 79 GLN E O 10352 C CB . GLN G 79 ? 0.4261 0.6476 0.5431 0.1013 0.0328 0.1087 79 GLN E CB 10353 C CG . GLN G 79 ? 0.5591 0.7818 0.6769 0.1021 0.0374 0.1174 79 GLN E CG 10354 C CD . GLN G 79 ? 0.6433 0.8778 0.7652 0.1045 0.0344 0.1318 79 GLN E CD 10355 O OE1 . GLN G 79 ? 0.6682 0.9104 0.7812 0.1049 0.0348 0.1378 79 GLN E OE1 10356 N NE2 . GLN G 79 ? 0.5909 0.8253 0.7248 0.1049 0.0314 0.1368 79 GLN E NE2 10357 N N . PRO G 80 ? 0.5111 0.7501 0.6268 0.1012 0.0184 0.1062 80 PRO E N 10358 C CA . PRO G 80 ? 0.5319 0.7721 0.6500 0.0991 0.0141 0.0997 80 PRO E CA 10359 C C . PRO G 80 ? 0.5251 0.7501 0.6461 0.0957 0.0180 0.0877 80 PRO E C 10360 O O . PRO G 80 ? 0.5144 0.7375 0.6272 0.0926 0.0150 0.0781 80 PRO E O 10361 C CB . PRO G 80 ? 0.5430 0.7916 0.6807 0.1014 0.0120 0.1110 80 PRO E CB 10362 C CG . PRO G 80 ? 0.5191 0.7745 0.6555 0.1041 0.0117 0.1237 80 PRO E CG 10363 C CD . PRO G 80 ? 0.5203 0.7673 0.6490 0.1042 0.0179 0.1211 80 PRO E CD 10364 N N . GLU G 81 ? 0.5196 0.7337 0.6514 0.0955 0.0248 0.0884 81 GLU E N 10365 C CA . GLU G 81 ? 0.5405 0.7405 0.6765 0.0915 0.0290 0.0782 81 GLU E CA 10366 C C . GLU G 81 ? 0.5542 0.7453 0.6718 0.0889 0.0292 0.0673 81 GLU E C 10367 O O . GLU G 81 ? 0.5540 0.7334 0.6716 0.0848 0.0315 0.0583 81 GLU E O 10368 C CB . GLU G 81 ? 0.6994 0.8906 0.8511 0.0915 0.0364 0.0822 81 GLU E CB 10369 C CG . GLU G 81 ? 0.9266 1.1214 1.0866 0.0940 0.0365 0.0948 81 GLU E CG 10370 C CD . GLU G 81 ? 1.0708 1.2515 1.2391 0.0917 0.0437 0.0968 81 GLU E CD 10371 O OE1 . GLU G 81 ? 1.0901 1.2594 1.2674 0.0880 0.0478 0.0904 81 GLU E OE1 10372 O OE2 . GLU G 81 ? 1.1358 1.3179 1.3014 0.0932 0.0454 0.1047 81 GLU E OE2 10373 N N . ASP G 82 ? 0.5162 0.7130 0.6184 0.0912 0.0268 0.0681 82 ASP E N 10374 C CA . ASP G 82 ? 0.4451 0.6336 0.5317 0.0902 0.0277 0.0591 82 ASP E CA 10375 C C . ASP G 82 ? 0.4796 0.6653 0.5518 0.0881 0.0227 0.0489 82 ASP E C 10376 O O . ASP G 82 ? 0.5593 0.7360 0.6195 0.0874 0.0232 0.0407 82 ASP E O 10377 C CB . ASP G 82 ? 0.4270 0.6227 0.5045 0.0940 0.0285 0.0639 82 ASP E CB 10378 C CG . ASP G 82 ? 0.5259 0.7215 0.6149 0.0951 0.0341 0.0726 82 ASP E CG 10379 O OD1 . ASP G 82 ? 0.5807 0.7662 0.6811 0.0925 0.0385 0.0715 82 ASP E OD1 10380 O OD2 . ASP G 82 ? 0.4939 0.6994 0.5799 0.0978 0.0342 0.0804 82 ASP E OD2 10381 N N . PHE G 83 ? 0.3907 0.5841 0.4642 0.0870 0.0179 0.0495 83 PHE E N 10382 C CA . PHE G 83 ? 0.3837 0.5742 0.4431 0.0839 0.0132 0.0397 83 PHE E CA 10383 C C . PHE G 83 ? 0.3172 0.4916 0.3769 0.0792 0.0153 0.0301 83 PHE E C 10384 O O . PHE G 83 ? 0.3322 0.5027 0.4068 0.0767 0.0184 0.0312 83 PHE E O 10385 C CB . PHE G 83 ? 0.4354 0.6385 0.4979 0.0825 0.0077 0.0426 83 PHE E CB 10386 C CG . PHE G 83 ? 0.4933 0.6931 0.5685 0.0782 0.0077 0.0396 83 PHE E CG 10387 C CD1 . PHE G 83 ? 0.5905 0.7935 0.6869 0.0794 0.0109 0.0469 83 PHE E CD1 10388 C CD2 . PHE G 83 ? 0.5347 0.7278 0.6006 0.0728 0.0049 0.0292 83 PHE E CD2 10389 C CE1 . PHE G 83 ? 0.6676 0.8686 0.7766 0.0756 0.0115 0.0434 83 PHE E CE1 10390 C CE2 . PHE G 83 ? 0.5641 0.7554 0.6417 0.0682 0.0053 0.0260 83 PHE E CE2 10391 C CZ . PHE G 83 ? 0.6261 0.8220 0.7256 0.0697 0.0088 0.0330 83 PHE E CZ 10392 N N . ALA G 84 ? 0.3314 0.4964 0.3745 0.0778 0.0136 0.0209 84 ALA E N 10393 C CA . ALA G 84 ? 0.3077 0.4564 0.3473 0.0728 0.0145 0.0117 84 ALA E CA 10394 C C . ALA G 84 ? 0.3697 0.5093 0.3894 0.0732 0.0118 0.0032 84 ALA E C 10395 O O . ALA G 84 ? 0.3369 0.4833 0.3457 0.0770 0.0095 0.0034 84 ALA E O 10396 C CB . ALA G 84 ? 0.2169 0.3575 0.2672 0.0721 0.0204 0.0134 84 ALA E CB 10397 N N . THR G 85 ? 0.3736 0.4974 0.3885 0.0691 0.0123 -0.0042 85 THR E N 10398 C CA . THR G 85 ? 0.3784 0.4908 0.3765 0.0706 0.0106 -0.0114 85 THR E CA 10399 C C . THR G 85 ? 0.3687 0.4739 0.3704 0.0725 0.0147 -0.0101 85 THR E C 10400 O O . THR G 85 ? 0.3234 0.4225 0.3346 0.0682 0.0175 -0.0095 85 THR E O 10401 C CB . THR G 85 ? 0.3475 0.4461 0.3349 0.0641 0.0071 -0.0208 85 THR E CB 10402 O OG1 . THR G 85 ? 0.3771 0.4838 0.3606 0.0617 0.0031 -0.0221 85 THR E OG1 10403 C CG2 . THR G 85 ? 0.2803 0.3651 0.2513 0.0664 0.0054 -0.0276 85 THR E CG2 10404 N N . TYR G 86 ? 0.3110 0.4180 0.3054 0.0788 0.0152 -0.0098 86 TYR E N 10405 C CA . TYR G 86 ? 0.2987 0.4014 0.2965 0.0810 0.0186 -0.0082 86 TYR E CA 10406 C C . TYR G 86 ? 0.3736 0.4613 0.3587 0.0814 0.0163 -0.0159 86 TYR E C 10407 O O . TYR G 86 ? 0.4033 0.4882 0.3754 0.0847 0.0132 -0.0211 86 TYR E O 10408 C CB . TYR G 86 ? 0.2965 0.4133 0.2975 0.0877 0.0214 -0.0016 86 TYR E CB 10409 C CG . TYR G 86 ? 0.2921 0.4218 0.3067 0.0873 0.0239 0.0075 86 TYR E CG 10410 C CD1 . TYR G 86 ? 0.3180 0.4581 0.3321 0.0877 0.0213 0.0102 86 TYR E CD1 10411 C CD2 . TYR G 86 ? 0.2773 0.4085 0.3052 0.0861 0.0287 0.0137 86 TYR E CD2 10412 C CE1 . TYR G 86 ? 0.3269 0.4783 0.3541 0.0878 0.0230 0.0194 86 TYR E CE1 10413 C CE2 . TYR G 86 ? 0.3060 0.4472 0.3467 0.0861 0.0310 0.0223 86 TYR E CE2 10414 C CZ . TYR G 86 ? 0.3975 0.5488 0.4382 0.0873 0.0280 0.0254 86 TYR E CZ 10415 O OH . TYR G 86 ? 0.4029 0.5637 0.4568 0.0878 0.0297 0.0347 86 TYR E OH 10416 N N . TYR G 87 ? 0.3416 0.4193 0.3306 0.0779 0.0177 -0.0165 87 TYR E N 10417 C CA . TYR G 87 ? 0.3323 0.3953 0.3109 0.0781 0.0152 -0.0223 87 TYR E CA 10418 C C . TYR G 87 ? 0.3298 0.3950 0.3131 0.0818 0.0179 -0.0188 87 TYR E C 10419 O O . TYR G 87 ? 0.3426 0.4130 0.3377 0.0790 0.0219 -0.0134 87 TYR E O 10420 C CB . TYR G 87 ? 0.3112 0.3593 0.2882 0.0689 0.0135 -0.0264 87 TYR E CB 10421 C CG . TYR G 87 ? 0.3763 0.4201 0.3468 0.0641 0.0103 -0.0313 87 TYR E CG 10422 C CD1 . TYR G 87 ? 0.3220 0.3743 0.3027 0.0595 0.0119 -0.0288 87 TYR E CD1 10423 C CD2 . TYR G 87 ? 0.4129 0.4442 0.3677 0.0640 0.0056 -0.0384 87 TYR E CD2 10424 C CE1 . TYR G 87 ? 0.3931 0.4434 0.3686 0.0547 0.0088 -0.0331 87 TYR E CE1 10425 C CE2 . TYR G 87 ? 0.4029 0.4306 0.3512 0.0586 0.0027 -0.0430 87 TYR E CE2 10426 C CZ . TYR G 87 ? 0.4535 0.4918 0.4124 0.0538 0.0042 -0.0403 87 TYR E CZ 10427 O OH . TYR G 87 ? 0.5118 0.5484 0.4651 0.0480 0.0011 -0.0448 87 TYR E OH 10428 N N . CYS G 88 ? 0.2896 0.3507 0.2641 0.0880 0.0159 -0.0220 88 CYS E N 10429 C CA . CYS G 88 ? 0.2531 0.3143 0.2315 0.0905 0.0173 -0.0196 88 CYS E CA 10430 C C . CYS G 88 ? 0.3435 0.3867 0.3162 0.0853 0.0138 -0.0235 88 CYS E C 10431 O O . CYS G 88 ? 0.3165 0.3469 0.2795 0.0822 0.0100 -0.0290 88 CYS E O 10432 C CB . CYS G 88 ? 0.3126 0.3815 0.2868 0.1007 0.0175 -0.0203 88 CYS E CB 10433 S SG . CYS G 88 ? 0.4417 0.4977 0.3991 0.1061 0.0125 -0.0296 88 CYS E SG 10434 N N . GLN G 89 ? 0.3456 0.3881 0.3240 0.0834 0.0150 -0.0203 89 GLN E N 10435 C CA . GLN G 89 ? 0.2790 0.3054 0.2521 0.0776 0.0115 -0.0228 89 GLN E CA 10436 C C . GLN G 89 ? 0.3340 0.3613 0.3089 0.0811 0.0106 -0.0202 89 GLN E C 10437 O O . GLN G 89 ? 0.3516 0.3920 0.3364 0.0823 0.0146 -0.0151 89 GLN E O 10438 C CB . GLN G 89 ? 0.1925 0.2147 0.1713 0.0658 0.0136 -0.0218 89 GLN E CB 10439 C CG . GLN G 89 ? 0.3232 0.3278 0.2940 0.0581 0.0096 -0.0249 89 GLN E CG 10440 C CD . GLN G 89 ? 0.3495 0.3523 0.3272 0.0466 0.0128 -0.0232 89 GLN E CD 10441 O OE1 . GLN G 89 ? 0.3080 0.3222 0.2976 0.0450 0.0184 -0.0195 89 GLN E OE1 10442 N NE2 . GLN G 89 ? 0.3053 0.2932 0.2753 0.0381 0.0096 -0.0261 89 GLN E NE2 10443 N N . HIS G 90 ? 0.2600 0.2732 0.2254 0.0826 0.0053 -0.0236 90 HIS E N 10444 C CA . HIS G 90 ? 0.3277 0.3397 0.2947 0.0845 0.0031 -0.0209 90 HIS E CA 10445 C C . HIS G 90 ? 0.3409 0.3494 0.3121 0.0725 0.0040 -0.0178 90 HIS E C 10446 O O . HIS G 90 ? 0.4203 0.4172 0.3869 0.0633 0.0031 -0.0204 90 HIS E O 10447 C CB . HIS G 90 ? 0.3947 0.3906 0.3500 0.0894 -0.0034 -0.0251 90 HIS E CB 10448 C CG . HIS G 90 ? 0.4523 0.4490 0.4100 0.0944 -0.0063 -0.0220 90 HIS E CG 10449 N ND1 . HIS G 90 ? 0.4863 0.4664 0.4352 0.0966 -0.0128 -0.0238 90 HIS E ND1 10450 C CD2 . HIS G 90 ? 0.4485 0.4612 0.4169 0.0976 -0.0038 -0.0168 90 HIS E CD2 10451 C CE1 . HIS G 90 ? 0.4864 0.4730 0.4412 0.1014 -0.0145 -0.0196 90 HIS E CE1 10452 N NE2 . HIS G 90 ? 0.4977 0.5047 0.4643 0.1019 -0.0090 -0.0155 90 HIS E NE2 10453 N N . LEU G 91 ? 0.3533 0.3724 0.3332 0.0720 0.0063 -0.0127 91 LEU E N 10454 C CA . LEU G 91 ? 0.3447 0.3624 0.3293 0.0598 0.0085 -0.0101 91 LEU E CA 10455 C C . LEU G 91 ? 0.3356 0.3423 0.3142 0.0547 0.0030 -0.0093 91 LEU E C 10456 O O . LEU G 91 ? 0.2915 0.2944 0.2710 0.0431 0.0041 -0.0081 91 LEU E O 10457 C CB . LEU G 91 ? 0.3423 0.3778 0.3396 0.0595 0.0149 -0.0050 91 LEU E CB 10458 C CG . LEU G 91 ? 0.3780 0.4219 0.3815 0.0605 0.0205 -0.0048 91 LEU E CG 10459 C CD1 . LEU G 91 ? 0.2415 0.3012 0.2570 0.0598 0.0269 0.0008 91 LEU E CD1 10460 C CD2 . LEU G 91 ? 0.3643 0.3975 0.3661 0.0509 0.0215 -0.0080 91 LEU E CD2 10461 N N . ILE G 92 ? 0.2953 0.2966 0.2678 0.0634 -0.0029 -0.0099 92 ILE E N 10462 C CA . ILE G 92 ? 0.3772 0.3648 0.3421 0.0591 -0.0096 -0.0091 92 ILE E CA 10463 C C . ILE G 92 ? 0.3696 0.3399 0.3222 0.0648 -0.0157 -0.0136 92 ILE E C 10464 O O . ILE G 92 ? 0.3550 0.3228 0.3040 0.0688 -0.0143 -0.0182 92 ILE E O 10465 C CB . ILE G 92 ? 0.3874 0.3852 0.3583 0.0636 -0.0118 -0.0036 92 ILE E CB 10466 C CG1 . ILE G 92 ? 0.3474 0.3566 0.3228 0.0795 -0.0116 -0.0038 92 ILE E CG1 10467 C CG2 . ILE G 92 ? 0.4270 0.4385 0.4077 0.0547 -0.0065 0.0007 92 ILE E CG2 10468 C CD1 . ILE G 92 ? 0.4825 0.5047 0.4658 0.0845 -0.0133 0.0015 92 ILE E CD1 10469 N N . GLY G 93 ? 0.4309 0.3891 0.3767 0.0647 -0.0227 -0.0121 93 GLY E N 10470 C CA . GLY G 93 ? 0.3853 0.3241 0.3187 0.0692 -0.0288 -0.0161 93 GLY E CA 10471 C C . GLY G 93 ? 0.4001 0.3238 0.3235 0.0579 -0.0289 -0.0206 93 GLY E C 10472 O O . GLY G 93 ? 0.4573 0.3767 0.3791 0.0445 -0.0286 -0.0192 93 GLY E O 10473 N N . LEU G 94 ? 0.3772 0.2935 0.2939 0.0626 -0.0289 -0.0263 94 LEU E N 10474 C CA . LEU G 94 ? 0.4315 0.3356 0.3394 0.0520 -0.0287 -0.0310 94 LEU E CA 10475 C C . LEU G 94 ? 0.4473 0.3665 0.3640 0.0482 -0.0213 -0.0323 94 LEU E C 10476 O O . LEU G 94 ? 0.4480 0.3614 0.3602 0.0402 -0.0202 -0.0362 94 LEU E O 10477 C CB . LEU G 94 ? 0.4122 0.2996 0.3072 0.0574 -0.0329 -0.0368 94 LEU E CB 10478 C CG . LEU G 94 ? 0.5396 0.4063 0.4235 0.0594 -0.0409 -0.0361 94 LEU E CG 10479 C CD1 . LEU G 94 ? 0.5804 0.4268 0.4493 0.0586 -0.0442 -0.0427 94 LEU E CD1 10480 C CD2 . LEU G 94 ? 0.5133 0.3731 0.3950 0.0473 -0.0442 -0.0311 94 LEU E CD2 10481 N N . ARG G 95 ? 0.4106 0.3495 0.3403 0.0539 -0.0164 -0.0286 96 ARG E N 10482 C CA . ARG G 95 ? 0.3842 0.3378 0.3239 0.0509 -0.0094 -0.0283 96 ARG E CA 10483 C C . ARG G 95 ? 0.3705 0.3235 0.3061 0.0536 -0.0085 -0.0332 96 ARG E C 10484 O O . ARG G 95 ? 0.3677 0.3244 0.3070 0.0467 -0.0049 -0.0344 96 ARG E O 10485 C CB . ARG G 95 ? 0.4335 0.3851 0.3762 0.0363 -0.0067 -0.0273 96 ARG E CB 10486 C CG . ARG G 95 ? 0.4724 0.4338 0.4244 0.0328 -0.0040 -0.0219 96 ARG E CG 10487 C CD . ARG G 95 ? 0.4176 0.3666 0.3631 0.0208 -0.0073 -0.0212 96 ARG E CD 10488 N NE . ARG G 95 ? 0.5928 0.5368 0.5333 0.0259 -0.0138 -0.0180 96 ARG E NE 10489 C CZ . ARG G 95 ? 0.5689 0.5161 0.5119 0.0209 -0.0150 -0.0132 96 ARG E CZ 10490 N NH1 . ARG G 95 ? 0.5199 0.4742 0.4695 0.0100 -0.0096 -0.0119 96 ARG E NH1 10491 N NH2 . ARG G 95 ? 0.5144 0.4577 0.4536 0.0268 -0.0216 -0.0099 96 ARG E NH2 10492 N N . SER G 96 ? 0.3575 0.3063 0.2859 0.0637 -0.0115 -0.0362 97 SER E N 10493 C CA . SER G 96 ? 0.4537 0.3997 0.3754 0.0652 -0.0116 -0.0416 97 SER E CA 10494 C C . SER G 96 ? 0.4557 0.4218 0.3871 0.0699 -0.0061 -0.0401 97 SER E C 10495 O O . SER G 96 ? 0.4075 0.3886 0.3494 0.0747 -0.0025 -0.0353 97 SER E O 10496 C CB . SER G 96 ? 0.4816 0.4149 0.3913 0.0737 -0.0163 -0.0461 97 SER E CB 10497 O OG . SER G 96 ? 0.5112 0.4555 0.4261 0.0863 -0.0150 -0.0444 97 SER E OG 10498 N N . PHE G 97 ? 0.3967 0.3632 0.3241 0.0679 -0.0057 -0.0439 98 PHE E N 10499 C CA . PHE G 97 ? 0.3708 0.3555 0.3062 0.0715 -0.0015 -0.0420 98 PHE E CA 10500 C C . PHE G 97 ? 0.4090 0.3955 0.3359 0.0802 -0.0028 -0.0462 98 PHE E C 10501 O O . PHE G 97 ? 0.4723 0.4435 0.3863 0.0813 -0.0069 -0.0519 98 PHE E O 10502 C CB . PHE G 97 ? 0.3338 0.3211 0.2731 0.0620 0.0002 -0.0424 98 PHE E CB 10503 C CG . PHE G 97 ? 0.3307 0.3200 0.2808 0.0536 0.0035 -0.0386 98 PHE E CG 10504 C CD1 . PHE G 97 ? 0.3031 0.2776 0.2482 0.0450 0.0012 -0.0404 98 PHE E CD1 10505 C CD2 . PHE G 97 ? 0.2886 0.2938 0.2531 0.0538 0.0089 -0.0334 98 PHE E CD2 10506 C CE1 . PHE G 97 ? 0.3160 0.2923 0.2701 0.0365 0.0048 -0.0378 98 PHE E CE1 10507 C CE2 . PHE G 97 ? 0.3344 0.3404 0.3086 0.0459 0.0125 -0.0308 98 PHE E CE2 10508 C CZ . PHE G 97 ? 0.3069 0.2988 0.2757 0.0370 0.0107 -0.0334 98 PHE E CZ 10509 N N . GLY G 98 ? 0.3648 0.3694 0.2983 0.0858 0.0008 -0.0434 99 GLY E N 10510 C CA . GLY G 98 ? 0.3730 0.3816 0.2984 0.0918 0.0003 -0.0475 99 GLY E CA 10511 C C . GLY G 98 ? 0.3763 0.3812 0.2956 0.0845 -0.0016 -0.0511 99 GLY E C 10512 O O . GLY G 98 ? 0.4243 0.4255 0.3477 0.0755 -0.0019 -0.0501 99 GLY E O 10513 N N . GLN G 99 ? 0.4467 0.4535 0.3565 0.0878 -0.0027 -0.0557 100 GLN E N 10514 C CA . GLN G 99 ? 0.4376 0.4415 0.3406 0.0805 -0.0051 -0.0596 100 GLN E CA 10515 C C . GLN G 99 ? 0.4977 0.5207 0.4123 0.0773 -0.0027 -0.0539 100 GLN E C 10516 O O . GLN G 99 ? 0.5030 0.5268 0.4162 0.0703 -0.0045 -0.0555 100 GLN E O 10517 C CB . GLN G 99 ? 0.4053 0.4039 0.2928 0.0842 -0.0072 -0.0671 100 GLN E CB 10518 C CG . GLN G 99 ? 0.4274 0.4454 0.3159 0.0897 -0.0048 -0.0655 100 GLN E CG 10519 C CD . GLN G 99 ? 0.4938 0.5193 0.3856 0.1002 -0.0016 -0.0636 100 GLN E CD 10520 O OE1 . GLN G 99 ? 0.5544 0.5735 0.4510 0.1035 -0.0010 -0.0619 100 GLN E OE1 10521 N NE2 . GLN G 99 ? 0.5116 0.5518 0.4009 0.1051 0.0005 -0.0638 100 GLN E NE2 10522 N N . GLY G 100 ? 0.4511 0.4898 0.3776 0.0824 0.0011 -0.0468 101 GLY E N 10523 C CA . GLY G 100 ? 0.3929 0.4486 0.3318 0.0802 0.0034 -0.0402 101 GLY E CA 10524 C C . GLY G 100 ? 0.4786 0.5501 0.4147 0.0849 0.0037 -0.0385 101 GLY E C 10525 O O . GLY G 100 ? 0.5614 0.6297 0.4839 0.0864 0.0013 -0.0447 101 GLY E O 10526 N N . THR G 101 ? 0.4513 0.5396 0.3999 0.0867 0.0068 -0.0301 102 THR E N 10527 C CA . THR G 101 ? 0.4088 0.5137 0.3555 0.0902 0.0069 -0.0269 102 THR E CA 10528 C C . THR G 101 ? 0.4632 0.5804 0.4210 0.0859 0.0065 -0.0202 102 THR E C 10529 O O . THR G 101 ? 0.4605 0.5830 0.4333 0.0854 0.0095 -0.0129 102 THR E O 10530 C CB . THR G 101 ? 0.3721 0.4879 0.3226 0.0975 0.0108 -0.0220 102 THR E CB 10531 O OG1 . THR G 101 ? 0.3910 0.4975 0.3315 0.1027 0.0110 -0.0286 102 THR E OG1 10532 C CG2 . THR G 101 ? 0.3855 0.5195 0.3343 0.0998 0.0110 -0.0176 102 THR E CG2 10533 N N . LYS G 102 ? 0.4758 0.5974 0.4267 0.0827 0.0028 -0.0227 103 LYS E N 10534 C CA . LYS G 102 ? 0.4605 0.5954 0.4225 0.0792 0.0017 -0.0160 103 LYS E CA 10535 C C . LYS G 102 ? 0.4117 0.5655 0.3778 0.0839 0.0029 -0.0072 103 LYS E C 10536 O O . LYS G 102 ? 0.4067 0.5669 0.3607 0.0865 0.0017 -0.0091 103 LYS E O 10537 C CB . LYS G 102 ? 0.5028 0.6367 0.4563 0.0731 -0.0032 -0.0216 103 LYS E CB 10538 C CG . LYS G 102 ? 0.5684 0.7156 0.5358 0.0693 -0.0046 -0.0149 103 LYS E CG 10539 C CD . LYS G 102 ? 0.7075 0.8536 0.6679 0.0621 -0.0094 -0.0210 103 LYS E CD 10540 C CE . LYS G 102 ? 0.7934 0.9553 0.7698 0.0593 -0.0109 -0.0137 103 LYS E CE 10541 N NZ . LYS G 102 ? 0.8901 1.0538 0.8611 0.0517 -0.0156 -0.0191 103 LYS E NZ 10542 N N . LEU G 103 ? 0.3566 0.5186 0.3395 0.0846 0.0054 0.0024 104 LEU E N 10543 C CA . LEU G 103 ? 0.3686 0.5479 0.3566 0.0883 0.0063 0.0122 104 LEU E CA 10544 C C . LEU G 103 ? 0.4156 0.6071 0.4125 0.0854 0.0030 0.0187 104 LEU E C 10545 O O . LEU G 103 ? 0.5077 0.6964 0.5180 0.0823 0.0033 0.0204 104 LEU E O 10546 C CB . LEU G 103 ? 0.4430 0.6228 0.4432 0.0916 0.0117 0.0193 104 LEU E CB 10547 C CG . LEU G 103 ? 0.5140 0.7101 0.5206 0.0948 0.0131 0.0306 104 LEU E CG 10548 C CD1 . LEU G 103 ? 0.4877 0.6934 0.4788 0.0977 0.0118 0.0292 104 LEU E CD1 10549 C CD2 . LEU G 103 ? 0.5326 0.7263 0.5504 0.0968 0.0187 0.0363 104 LEU E CD2 10550 N N . GLU G 104 ? 0.4723 0.6782 0.4619 0.0861 -0.0002 0.0222 105 GLU E N 10551 C CA . GLU G 104 ? 0.5028 0.7227 0.5004 0.0837 -0.0044 0.0294 105 GLU E CA 10552 C C . GLU G 104 ? 0.4897 0.7256 0.4935 0.0874 -0.0039 0.0421 105 GLU E C 10553 O O . GLU G 104 ? 0.5071 0.7471 0.5008 0.0903 -0.0022 0.0429 105 GLU E O 10554 C CB . GLU G 104 ? 0.5744 0.7985 0.5570 0.0794 -0.0100 0.0228 105 GLU E CB 10555 C CG . GLU G 104 ? 0.7518 0.9926 0.7427 0.0766 -0.0152 0.0305 105 GLU E CG 10556 C CD . GLU G 104 ? 0.9176 1.1694 0.8913 0.0734 -0.0204 0.0279 105 GLU E CD 10557 O OE1 . GLU G 104 ? 1.0069 1.2523 0.9691 0.0684 -0.0232 0.0177 105 GLU E OE1 10558 O OE2 . GLU G 104 ? 0.9092 1.1760 0.8803 0.0754 -0.0217 0.0361 105 GLU E OE2 10559 N N . ILE G 105 ? 0.4698 0.7146 0.4903 0.0873 -0.0053 0.0522 106 ILE E N 10560 C CA . ILE G 105 ? 0.4636 0.7229 0.4905 0.0904 -0.0055 0.0655 106 ILE E CA 10561 C C . ILE G 105 ? 0.5639 0.8401 0.5809 0.0884 -0.0120 0.0692 106 ILE E C 10562 O O . ILE G 105 ? 0.6352 0.9162 0.6534 0.0848 -0.0170 0.0672 106 ILE E O 10563 C CB . ILE G 105 ? 0.4417 0.7022 0.4921 0.0919 -0.0040 0.0756 106 ILE E CB 10564 C CG1 . ILE G 105 ? 0.4156 0.6590 0.4753 0.0920 0.0022 0.0703 106 ILE E CG1 10565 C CG2 . ILE G 105 ? 0.4714 0.7433 0.5277 0.0953 -0.0034 0.0897 106 ILE E CG2 10566 C CD1 . ILE G 105 ? 0.4364 0.6721 0.4887 0.0943 0.0075 0.0682 106 ILE E CD1 10567 N N . LYS G 106 ? 0.5985 0.8845 0.6054 0.0900 -0.0119 0.0742 107 LYS E N 10568 C CA . LYS G 106 ? 0.6824 0.9859 0.6793 0.0875 -0.0179 0.0790 107 LYS E CA 10569 C C . LYS G 106 ? 0.7372 1.0547 0.7490 0.0892 -0.0204 0.0959 107 LYS E C 10570 O O . LYS G 106 ? 0.6589 0.9744 0.6805 0.0928 -0.0162 0.1041 107 LYS E O 10571 C CB . LYS G 106 ? 0.7248 1.0319 0.7005 0.0875 -0.0163 0.0742 107 LYS E CB 10572 C CG . LYS G 106 ? 0.7989 1.1204 0.7584 0.0829 -0.0222 0.0731 107 LYS E CG 10573 C CD . LYS G 106 ? 0.8612 1.1907 0.8034 0.0832 -0.0199 0.0728 107 LYS E CD 10574 C CE . LYS G 106 ? 0.8933 1.2082 0.8260 0.0862 -0.0133 0.0601 107 LYS E CE 10575 N NZ . LYS G 106 ? 0.8856 1.1881 0.8074 0.0838 -0.0144 0.0449 107 LYS E NZ 10587 N N . THR G 108 ? 0.9358 1.5899 0.9875 0.1715 -0.1154 0.1292 109 THR E N 10588 C CA . THR G 108 ? 0.8471 1.5324 0.8883 0.1823 -0.1168 0.1224 109 THR E CA 10589 C C . THR G 108 ? 0.8481 1.5374 0.8889 0.1802 -0.1247 0.0887 109 THR E C 10590 O O . THR G 108 ? 0.8703 1.5405 0.9302 0.1715 -0.1300 0.0789 109 THR E O 10591 C CB . THR G 108 ? 0.7380 1.4328 0.7970 0.1875 -0.1165 0.1515 109 THR E CB 10592 O OG1 . THR G 108 ? 0.7276 1.4022 0.8147 0.1804 -0.1223 0.1564 109 THR E OG1 10593 C CG2 . THR G 108 ? 0.6471 1.3393 0.7057 0.1889 -0.1080 0.1828 109 THR E CG2 10594 N N . VAL G 109 ? 0.8464 1.5598 0.8659 0.1880 -0.1250 0.0709 110 VAL E N 10595 C CA . VAL G 109 ? 0.7639 1.4813 0.7800 0.1855 -0.1318 0.0377 110 VAL E CA 10596 C C . VAL G 109 ? 0.7107 1.4277 0.7540 0.1834 -0.1384 0.0415 110 VAL E C 10597 O O . VAL G 109 ? 0.7038 1.4365 0.7569 0.1908 -0.1383 0.0641 110 VAL E O 10598 C CB . VAL G 109 ? 0.7508 1.4956 0.7414 0.1955 -0.1306 0.0241 110 VAL E CB 10599 C CG1 . VAL G 109 ? 0.7569 1.5013 0.7437 0.1910 -0.1372 -0.0106 110 VAL E CG1 10600 C CG2 . VAL G 109 ? 0.7290 1.4745 0.6933 0.1990 -0.1230 0.0209 110 VAL E CG2 10601 N N . ALA G 110 ? 0.7035 1.4016 0.7593 0.1732 -0.1435 0.0189 111 ALA E N 10602 C CA . ALA G 110 ? 0.6851 1.3816 0.7670 0.1710 -0.1494 0.0187 111 ALA E CA 10603 C C . ALA G 110 ? 0.6496 1.3507 0.7250 0.1673 -0.1545 -0.0167 111 ALA E C 10604 O O . ALA G 110 ? 0.5887 1.2752 0.6509 0.1591 -0.1545 -0.0455 111 ALA E O 10605 C CB . ALA G 110 ? 0.6490 1.3054 0.7552 0.1591 -0.1469 0.0259 111 ALA E CB 10606 N N . ALA G 111 ? 0.6373 1.3565 0.7220 0.1726 -0.1585 -0.0140 112 ALA E N 10607 C CA . ALA G 111 ? 0.7005 1.4266 0.7792 0.1698 -0.1633 -0.0439 112 ALA E CA 10608 C C . ALA G 111 ? 0.7228 1.4257 0.8241 0.1582 -0.1671 -0.0621 112 ALA E C 10609 O O . ALA G 111 ? 0.7070 1.3968 0.8343 0.1563 -0.1670 -0.0457 112 ALA E O 10610 C CB . ALA G 111 ? 0.7206 1.4772 0.7994 0.1805 -0.1658 -0.0324 112 ALA E CB 10611 N N . PRO G 112 ? 0.7334 1.4273 0.8247 0.1498 -0.1690 -0.0959 113 PRO E N 10612 C CA . PRO G 112 ? 0.6817 1.3508 0.7922 0.1374 -0.1713 -0.1167 113 PRO E CA 10613 C C . PRO G 112 ? 0.6184 1.3004 0.7503 0.1403 -0.1760 -0.1129 113 PRO E C 10614 O O . PRO G 112 ? 0.5825 1.2895 0.7049 0.1473 -0.1786 -0.1129 113 PRO E O 10615 C CB . PRO G 112 ? 0.6976 1.3513 0.7849 0.1279 -0.1696 -0.1515 113 PRO E CB 10616 C CG . PRO G 112 ? 0.7089 1.3774 0.7659 0.1358 -0.1661 -0.1480 113 PRO E CG 10617 C CD . PRO G 112 ? 0.7238 1.4255 0.7840 0.1509 -0.1676 -0.1163 113 PRO E CD 10618 N N . SER G 113 ? 0.6883 1.3444 0.8463 0.1337 -0.1742 -0.1087 114 SER E N 10619 C CA . SER G 113 ? 0.6790 1.3449 0.8586 0.1351 -0.1790 -0.1104 114 SER E CA 10620 C C . SER G 113 ? 0.6640 1.3158 0.8417 0.1232 -0.1810 -0.1457 114 SER E C 10621 O O . SER G 113 ? 0.6443 1.2540 0.8279 0.1101 -0.1750 -0.1588 114 SER E O 10622 C CB . SER G 113 ? 0.6501 1.2883 0.8561 0.1335 -0.1742 -0.0887 114 SER E CB 10623 O OG . SER G 113 ? 0.6690 1.3193 0.8777 0.1438 -0.1729 -0.0552 114 SER E OG 10624 N N . VAL G 114 ? 0.6063 1.2776 0.7708 0.1252 -0.1841 -0.1578 115 VAL E N 10625 C CA . VAL G 114 ? 0.5461 1.1991 0.7028 0.1133 -0.1835 -0.1889 115 VAL E CA 10626 C C . VAL G 114 ? 0.5622 1.2114 0.7434 0.1093 -0.1861 -0.1945 115 VAL E C 10627 O O . VAL G 114 ? 0.6002 1.2767 0.7911 0.1178 -0.1906 -0.1823 115 VAL E O 10628 C CB . VAL G 114 ? 0.5834 1.2549 0.7128 0.1167 -0.1846 -0.1998 115 VAL E CB 10629 C CG1 . VAL G 114 ? 0.5366 1.1802 0.6559 0.1035 -0.1810 -0.2297 115 VAL E CG1 10630 C CG2 . VAL G 114 ? 0.6325 1.3153 0.7385 0.1245 -0.1822 -0.1895 115 VAL E CG2 10631 N N . PHE G 115 ? 0.5611 1.1753 0.7517 0.0963 -0.1824 -0.2127 116 PHE E N 10632 C CA . PHE G 115 ? 0.5576 1.1640 0.7700 0.0915 -0.1834 -0.2204 116 PHE E CA 10633 C C . PHE G 115 ? 0.5722 1.1562 0.7713 0.0793 -0.1796 -0.2476 116 PHE E C 10634 O O . PHE G 115 ? 0.6099 1.1753 0.7865 0.0733 -0.1742 -0.2603 116 PHE E O 10635 C CB . PHE G 115 ? 0.5142 1.0953 0.7538 0.0877 -0.1809 -0.2149 116 PHE E CB 10636 C CG . PHE G 115 ? 0.5744 1.1598 0.8241 0.0983 -0.1789 -0.1826 116 PHE E CG 10637 C CD1 . PHE G 115 ? 0.6094 1.1775 0.8466 0.0980 -0.1733 -0.1704 116 PHE E CD1 10638 C CD2 . PHE G 115 ? 0.5866 1.1887 0.8570 0.1079 -0.1812 -0.1626 116 PHE E CD2 10639 C CE1 . PHE G 115 ? 0.5921 1.1599 0.8376 0.1066 -0.1707 -0.1387 116 PHE E CE1 10640 C CE2 . PHE G 115 ? 0.6120 1.2131 0.8904 0.1169 -0.1785 -0.1314 116 PHE E CE2 10641 C CZ . PHE G 115 ? 0.5877 1.1715 0.8538 0.1160 -0.1734 -0.1193 116 PHE E CZ 10642 N N . ILE G 116 ? 0.5565 1.1412 0.7705 0.0765 -0.1812 -0.2540 117 ILE E N 10643 C CA . ILE G 116 ? 0.5189 1.0803 0.7242 0.0654 -0.1763 -0.2758 117 ILE E CA 10644 C C . ILE G 116 ? 0.4998 1.0443 0.7299 0.0596 -0.1746 -0.2802 117 ILE E C 10645 O O . ILE G 116 ? 0.5032 1.0683 0.7558 0.0666 -0.1800 -0.2676 117 ILE E O 10646 C CB . ILE G 116 ? 0.5725 1.1605 0.7621 0.0691 -0.1809 -0.2807 117 ILE E CB 10647 C CG1 . ILE G 116 ? 0.5397 1.1002 0.7190 0.0581 -0.1744 -0.3001 117 ILE E CG1 10648 C CG2 . ILE G 116 ? 0.5877 1.2110 0.7947 0.0773 -0.1894 -0.2694 117 ILE E CG2 10649 C CD1 . ILE G 116 ? 0.5167 1.0981 0.6789 0.0609 -0.1785 -0.3056 117 ILE E CD1 10650 N N . PHE G 117 ? 0.4994 1.0052 0.7257 0.0479 -0.1655 -0.2955 118 PHE E N 10651 C CA . PHE G 117 ? 0.4712 0.9575 0.7184 0.0424 -0.1622 -0.3002 118 PHE E CA 10652 C C . PHE G 117 ? 0.5361 1.0091 0.7756 0.0351 -0.1572 -0.3135 118 PHE E C 10653 O O . PHE G 117 ? 0.5462 0.9963 0.7675 0.0292 -0.1492 -0.3204 118 PHE E O 10654 C CB . PHE G 117 ? 0.3904 0.8361 0.6453 0.0360 -0.1537 -0.3007 118 PHE E CB 10655 C CG . PHE G 117 ? 0.4687 0.9235 0.7341 0.0422 -0.1584 -0.2863 118 PHE E CG 10656 C CD1 . PHE G 117 ? 0.4342 0.9018 0.7293 0.0491 -0.1637 -0.2735 118 PHE E CD1 10657 C CD2 . PHE G 117 ? 0.5122 0.9623 0.7598 0.0423 -0.1569 -0.2831 118 PHE E CD2 10658 C CE1 . PHE G 117 ? 0.4687 0.9438 0.7767 0.0565 -0.1670 -0.2559 118 PHE E CE1 10659 C CE2 . PHE G 117 ? 0.5421 1.0018 0.8013 0.0486 -0.1613 -0.2670 118 PHE E CE2 10660 C CZ . PHE G 117 ? 0.5219 0.9909 0.8104 0.0560 -0.1650 -0.2514 118 PHE E CZ 10661 N N . PRO G 118 ? 0.6052 1.0939 0.8608 0.0362 -0.1617 -0.3143 119 PRO E N 10662 C CA . PRO G 118 ? 0.5554 1.0320 0.8084 0.0293 -0.1575 -0.3248 119 PRO E CA 10663 C C . PRO G 118 ? 0.5095 0.9433 0.7696 0.0214 -0.1455 -0.3292 119 PRO E C 10664 O O . PRO G 118 ? 0.4151 0.8330 0.6873 0.0218 -0.1426 -0.3250 119 PRO E O 10665 C CB . PRO G 118 ? 0.5224 1.0332 0.7933 0.0343 -0.1672 -0.3210 119 PRO E CB 10666 C CG . PRO G 118 ? 0.5679 1.1125 0.8466 0.0454 -0.1761 -0.3062 119 PRO E CG 10667 C CD . PRO G 118 ? 0.5934 1.1160 0.8712 0.0454 -0.1713 -0.3020 119 PRO E CD 10668 N N . PRO G 119 ? 0.5786 0.9941 0.8315 0.0148 -0.1385 -0.3353 120 PRO E N 10669 C CA . PRO G 119 ? 0.5440 0.9228 0.8041 0.0089 -0.1267 -0.3356 120 PRO E CA 10670 C C . PRO G 119 ? 0.4854 0.8689 0.7702 0.0107 -0.1292 -0.3362 120 PRO E C 10671 O O . PRO G 119 ? 0.3977 0.8126 0.6929 0.0141 -0.1391 -0.3373 120 PRO E O 10672 C CB . PRO G 119 ? 0.5993 0.9692 0.8480 0.0032 -0.1222 -0.3387 120 PRO E CB 10673 C CG . PRO G 119 ? 0.5860 0.9915 0.8290 0.0061 -0.1340 -0.3430 120 PRO E CG 10674 C CD . PRO G 119 ? 0.5934 1.0216 0.8316 0.0131 -0.1414 -0.3398 120 PRO E CD 10675 N N . SER G 120 ? 0.4715 0.8246 0.7658 0.0089 -0.1203 -0.3338 121 SER E N 10676 C CA . SER G 120 ? 0.5166 0.8695 0.8351 0.0108 -0.1213 -0.3346 121 SER E CA 10677 C C . SER G 120 ? 0.5754 0.9295 0.8977 0.0076 -0.1190 -0.3393 121 SER E C 10678 O O . SER G 120 ? 0.5664 0.9075 0.8736 0.0027 -0.1124 -0.3399 121 SER E O 10679 C CB . SER G 120 ? 0.5937 0.9101 0.9191 0.0098 -0.1114 -0.3304 121 SER E CB 10680 O OG . SER G 120 ? 0.6470 0.9324 0.9576 0.0044 -0.0980 -0.3265 121 SER E OG 10681 N N . ASP G 121 ? 0.6892 1.0602 1.0331 0.0106 -0.1249 -0.3408 122 ASP E N 10682 C CA . ASP G 121 ? 0.7788 1.1534 1.1286 0.0076 -0.1237 -0.3451 122 ASP E CA 10683 C C . ASP G 121 ? 0.7347 1.0721 1.0841 0.0039 -0.1096 -0.3449 122 ASP E C 10684 O O . ASP G 121 ? 0.7317 1.0660 1.0790 0.0002 -0.1061 -0.3467 122 ASP E O 10685 C CB . ASP G 121 ? 0.8439 1.2479 1.2189 0.0124 -0.1333 -0.3439 122 ASP E CB 10686 C CG . ASP G 121 ? 0.8967 1.3443 1.2716 0.0170 -0.1468 -0.3392 122 ASP E CG 10687 O OD1 . ASP G 121 ? 0.9511 1.4059 1.3049 0.0147 -0.1492 -0.3412 122 ASP E OD1 10688 O OD2 . ASP G 121 ? 0.8786 1.3539 1.2751 0.0239 -0.1545 -0.3314 122 ASP E OD2 10689 N N . GLU G 122 ? 0.7089 1.0196 1.0605 0.0052 -0.1018 -0.3403 123 GLU E N 10690 C CA . GLU G 122 ? 0.6708 0.9496 1.0217 0.0029 -0.0883 -0.3353 123 GLU E CA 10691 C C . GLU G 122 ? 0.6338 0.8955 0.9601 -0.0024 -0.0800 -0.3273 123 GLU E C 10692 O O . GLU G 122 ? 0.6538 0.8991 0.9758 -0.0055 -0.0713 -0.3211 123 GLU E O 10693 C CB . GLU G 122 ? 0.6856 0.9433 1.0491 0.0063 -0.0835 -0.3306 123 GLU E CB 10694 C CG . GLU G 122 ? 0.7787 1.0113 1.1251 0.0039 -0.0755 -0.3193 123 GLU E CG 10695 C CD . GLU G 122 ? 0.8679 1.0770 1.2259 0.0061 -0.0700 -0.3119 123 GLU E CD 10696 O OE1 . GLU G 122 ? 0.8717 1.0870 1.2525 0.0112 -0.0763 -0.3183 123 GLU E OE1 10697 O OE2 . GLU G 122 ? 0.8946 1.0795 1.2380 0.0024 -0.0601 -0.2980 123 GLU E OE2 10698 N N . GLN G 123 ? 0.5460 0.8134 0.8566 -0.0033 -0.0836 -0.3262 124 GLN E N 10699 C CA . GLN G 123 ? 0.5833 0.8370 0.8713 -0.0083 -0.0776 -0.3187 124 GLN E CA 10700 C C . GLN G 123 ? 0.6882 0.9569 0.9711 -0.0112 -0.0815 -0.3245 124 GLN E C 10701 O O . GLN G 123 ? 0.7715 1.0388 1.0576 -0.0120 -0.0746 -0.3296 124 GLN E O 10702 C CB . GLN G 123 ? 0.4705 0.7256 0.7440 -0.0079 -0.0802 -0.3164 124 GLN E CB 10703 C CG . GLN G 123 ? 0.4562 0.7052 0.7165 -0.0105 -0.0741 -0.3153 124 GLN E CG 10704 C CD . GLN G 123 ? 0.4581 0.7141 0.7000 -0.0106 -0.0795 -0.3141 124 GLN E CD 10705 O OE1 . GLN G 123 ? 0.5485 0.8238 0.7902 -0.0076 -0.0891 -0.3181 124 GLN E OE1 10706 N NE2 . GLN G 123 ? 0.4110 0.6630 0.6475 -0.0114 -0.0733 -0.3154 124 GLN E NE2 10707 N N . LEU G 124 ? 0.6779 0.9754 0.9678 -0.0091 -0.0928 -0.3340 125 LEU E N 10708 C CA . LEU G 124 ? 0.6948 1.0086 0.9787 -0.0123 -0.0987 -0.3389 125 LEU E CA 10709 C C . LEU G 124 ? 0.7724 1.0763 1.0634 -0.0155 -0.0926 -0.3396 125 LEU E C 10710 O O . LEU G 124 ? 0.8487 1.1594 1.1374 -0.0175 -0.0920 -0.3467 125 LEU E O 10711 C CB . LEU G 124 ? 0.6513 1.0013 0.9460 -0.0090 -0.1122 -0.3470 125 LEU E CB 10712 C CG . LEU G 124 ? 0.6073 0.9788 0.8919 -0.0055 -0.1210 -0.3480 125 LEU E CG 10713 C CD1 . LEU G 124 ? 0.5525 0.9633 0.8482 -0.0017 -0.1348 -0.3515 125 LEU E CD1 10714 C CD2 . LEU G 124 ? 0.6159 0.9815 0.8780 -0.0092 -0.1199 -0.3472 125 LEU E CD2 10715 N N . LYS G 125 ? 0.7924 1.0857 1.0974 -0.0142 -0.0879 -0.3368 126 LYS E N 10716 C CA . LYS G 125 ? 0.8320 1.1233 1.1507 -0.0148 -0.0821 -0.3421 126 LYS E CA 10717 C C . LYS G 125 ? 0.7966 1.0748 1.1195 -0.0139 -0.0693 -0.3435 126 LYS E C 10718 O O . LYS G 125 ? 0.7963 1.0713 1.1322 -0.0137 -0.0629 -0.3460 126 LYS E O 10719 C CB . LYS G 125 ? 0.8648 1.1512 1.1983 -0.0129 -0.0816 -0.3387 126 LYS E CB 10720 C CG . LYS G 125 ? 0.9102 1.1760 1.2493 -0.0090 -0.0735 -0.3324 126 LYS E CG 10721 C CD . LYS G 125 ? 0.9884 1.2526 1.3505 -0.0052 -0.0711 -0.3356 126 LYS E CD 10722 C CE . LYS G 125 ? 1.0346 1.2748 1.4003 -0.0023 -0.0617 -0.3265 126 LYS E CE 10723 N NZ . LYS G 125 ? 1.0466 1.2826 1.4338 0.0015 -0.0579 -0.3284 126 LYS E NZ 10724 N N . SER G 126 ? 0.8211 1.0939 1.1338 -0.0137 -0.0663 -0.3410 127 SER E N 10725 C CA . SER G 126 ? 0.8632 1.1280 1.1802 -0.0139 -0.0555 -0.3407 127 SER E CA 10726 C C . SER G 126 ? 0.8860 1.1610 1.1937 -0.0167 -0.0575 -0.3472 127 SER E C 10727 O O . SER G 126 ? 0.9055 1.1771 1.2163 -0.0178 -0.0500 -0.3476 127 SER E O 10728 C CB . SER G 126 ? 0.8335 1.0835 1.1477 -0.0123 -0.0497 -0.3317 127 SER E CB 10729 O OG . SER G 126 ? 0.8307 1.0829 1.1280 -0.0128 -0.0551 -0.3302 127 SER E OG 10730 N N . GLY G 127 ? 0.8680 1.1565 1.1645 -0.0182 -0.0683 -0.3517 128 GLY E N 10731 C CA . GLY G 127 ? 0.8753 1.1741 1.1624 -0.0208 -0.0718 -0.3583 128 GLY E CA 10732 C C . GLY G 127 ? 0.8909 1.1887 1.1627 -0.0201 -0.0728 -0.3559 128 GLY E C 10733 O O . GLY G 127 ? 0.9383 1.2396 1.2037 -0.0218 -0.0723 -0.3602 128 GLY E O 10734 N N . THR G 128 ? 0.8651 1.1575 1.1307 -0.0178 -0.0744 -0.3489 129 THR E N 10735 C CA . THR G 128 ? 0.8021 1.0934 1.0524 -0.0169 -0.0758 -0.3458 129 THR E CA 10736 C C . THR G 128 ? 0.7515 1.0465 0.9929 -0.0148 -0.0839 -0.3403 129 THR E C 10737 O O . THR G 128 ? 0.7801 1.0692 1.0295 -0.0138 -0.0841 -0.3355 129 THR E O 10738 C CB . THR G 128 ? 0.7644 1.0394 1.0179 -0.0167 -0.0648 -0.3397 129 THR E CB 10739 O OG1 . THR G 128 ? 0.8075 1.0807 1.0723 -0.0187 -0.0571 -0.3433 129 THR E OG1 10740 C CG2 . THR G 128 ? 0.6771 0.9522 0.9143 -0.0164 -0.0663 -0.3376 129 THR E CG2 10741 N N . ALA G 129 ? 0.6640 0.9695 0.8890 -0.0141 -0.0911 -0.3407 130 ALA E N 10742 C CA . ALA G 129 ? 0.6052 0.9184 0.8212 -0.0121 -0.1000 -0.3347 130 ALA E CA 10743 C C . ALA G 129 ? 0.5727 0.8815 0.7738 -0.0103 -0.0995 -0.3297 130 ALA E C 10744 O O . ALA G 129 ? 0.5914 0.9068 0.7812 -0.0099 -0.1005 -0.3337 130 ALA E O 10745 C CB . ALA G 129 ? 0.5911 0.9289 0.8021 -0.0123 -0.1124 -0.3385 130 ALA E CB 10746 N N . SER G 130 ? 0.5243 0.8242 0.7275 -0.0087 -0.0982 -0.3226 131 SER E N 10747 C CA . SER G 130 ? 0.5042 0.8031 0.6963 -0.0063 -0.0981 -0.3193 131 SER E CA 10748 C C . SER G 130 ? 0.4846 0.8171 0.6811 0.0011 -0.1095 -0.3257 131 SER E C 10749 O O . SER G 130 ? 0.4999 0.8440 0.7131 0.0042 -0.1139 -0.3278 131 SER E O 10750 C CB . SER G 130 ? 0.5195 0.7884 0.7136 -0.0086 -0.0883 -0.3090 131 SER E CB 10751 O OG . SER G 130 ? 0.5137 0.7711 0.7171 -0.0107 -0.0779 -0.3118 131 SER E OG 10752 N N . VAL G 131 ? 0.4537 0.8033 0.6350 0.0044 -0.1147 -0.3273 132 VAL E N 10753 C CA . VAL G 131 ? 0.4318 0.8166 0.6136 0.0125 -0.1259 -0.3295 132 VAL E CA 10754 C C . VAL G 131 ? 0.5216 0.9010 0.6938 0.0150 -0.1239 -0.3240 132 VAL E C 10755 O O . VAL G 131 ? 0.5588 0.9214 0.7156 0.0122 -0.1177 -0.3215 132 VAL E O 10756 C CB . VAL G 131 ? 0.5113 0.9266 0.6821 0.0163 -0.1349 -0.3345 132 VAL E CB 10757 C CG1 . VAL G 131 ? 0.5619 1.0182 0.7362 0.0258 -0.1471 -0.3327 132 VAL E CG1 10758 C CG2 . VAL G 131 ? 0.4192 0.8330 0.5961 0.0115 -0.1355 -0.3396 132 VAL E CG2 10759 N N . VAL G 132 ? 0.4843 0.8784 0.6664 0.0202 -0.1298 -0.3206 133 VAL E N 10760 C CA . VAL G 132 ? 0.5055 0.8932 0.6807 0.0220 -0.1284 -0.3144 133 VAL E CA 10761 C C . VAL G 132 ? 0.5148 0.9444 0.6857 0.0324 -0.1405 -0.3095 133 VAL E C 10762 O O . VAL G 132 ? 0.5545 1.0135 0.7394 0.0386 -0.1502 -0.3053 133 VAL E O 10763 C CB . VAL G 132 ? 0.4455 0.8071 0.6372 0.0184 -0.1237 -0.3098 133 VAL E CB 10764 C CG1 . VAL G 132 ? 0.3776 0.7353 0.5634 0.0201 -0.1242 -0.3027 133 VAL E CG1 10765 C CG2 . VAL G 132 ? 0.4013 0.7217 0.5944 0.0096 -0.1102 -0.3094 133 VAL E CG2 10766 N N . CYS G 133 ? 0.4347 0.8681 0.5866 0.0352 -0.1396 -0.3067 134 CYS E N 10767 C CA . CYS G 133 ? 0.4651 0.9367 0.6111 0.0463 -0.1494 -0.2973 134 CYS E CA 10768 C C . CYS G 133 ? 0.4394 0.8994 0.5869 0.0463 -0.1477 -0.2881 134 CYS E C 10769 O O . CYS G 133 ? 0.4993 0.9257 0.6376 0.0389 -0.1380 -0.2914 134 CYS E O 10770 C CB . CYS G 133 ? 0.4115 0.9016 0.5338 0.0514 -0.1506 -0.2999 134 CYS E CB 10771 S SG . CYS G 133 ? 0.9194 1.4605 1.0322 0.0675 -0.1616 -0.2846 134 CYS E SG 10772 N N . LEU G 134 ? 0.4368 0.9248 0.5984 0.0549 -0.1569 -0.2732 135 LEU E N 10773 C CA . LEU G 134 ? 0.4326 0.9129 0.6006 0.0555 -0.1570 -0.2611 135 LEU E CA 10774 C C . LEU G 134 ? 0.4377 0.9569 0.5961 0.0690 -0.1634 -0.2424 135 LEU E C 10775 O O . LEU G 134 ? 0.3904 0.9472 0.5541 0.0807 -0.1705 -0.2290 135 LEU E O 10776 C CB . LEU G 134 ? 0.4266 0.9001 0.6273 0.0548 -0.1600 -0.2529 135 LEU E CB 10777 C CG . LEU G 134 ? 0.5167 0.9727 0.7256 0.0573 -0.1554 -0.2291 135 LEU E CG 10778 C CD1 . LEU G 134 ? 0.3405 0.7592 0.5357 0.0462 -0.1477 -0.2381 135 LEU E CD1 10779 C CD2 . LEU G 134 ? 0.3430 0.7780 0.5786 0.0574 -0.1523 -0.2157 135 LEU E CD2 10780 N N . LEU G 135 ? 0.3772 0.8855 0.5206 0.0677 -0.1596 -0.2394 136 LEU E N 10781 C CA . LEU G 135 ? 0.4264 0.9677 0.5608 0.0808 -0.1637 -0.2180 136 LEU E CA 10782 C C . LEU G 135 ? 0.3873 0.9005 0.5340 0.0799 -0.1558 -0.1924 136 LEU E C 10783 O O . LEU G 135 ? 0.4056 0.8814 0.5485 0.0694 -0.1485 -0.1981 136 LEU E O 10784 C CB . LEU G 135 ? 0.5362 1.0740 0.6376 0.0806 -0.1584 -0.2268 136 LEU E CB 10785 C CG . LEU G 135 ? 0.5196 1.0629 0.6039 0.0808 -0.1569 -0.2433 136 LEU E CG 10786 C CD1 . LEU G 135 ? 0.5086 1.0462 0.5647 0.0818 -0.1505 -0.2494 136 LEU E CD1 10787 C CD2 . LEU G 135 ? 0.6437 1.2302 0.7329 0.0936 -0.1655 -0.2310 136 LEU E CD2 10788 N N . ASN G 136 ? 0.4157 0.9460 0.5772 0.0906 -0.1574 -0.1637 137 ASN E N 10789 C CA . ASN G 136 ? 0.4842 0.9846 0.6613 0.0889 -0.1509 -0.1391 137 ASN E CA 10790 C C . ASN G 136 ? 0.5038 1.0204 0.6733 0.0990 -0.1496 -0.1088 137 ASN E C 10791 O O . ASN G 136 ? 0.5655 1.1238 0.7328 0.1127 -0.1551 -0.0930 137 ASN E O 10792 C CB . ASN G 136 ? 0.4847 0.9825 0.6888 0.0915 -0.1529 -0.1283 137 ASN E CB 10793 C CG . ASN G 136 ? 0.6022 1.0494 0.8225 0.0815 -0.1458 -0.1235 137 ASN E CG 10794 O OD1 . ASN G 136 ? 0.6101 1.0219 0.8238 0.0691 -0.1401 -0.1397 137 ASN E OD1 10795 N ND2 . ASN G 136 ? 0.6711 1.1142 0.9123 0.0872 -0.1462 -0.1011 137 ASN E ND2 10796 N N . ASN G 137 ? 0.4639 0.9476 0.6298 0.0920 -0.1424 -0.1004 138 ASN E N 10797 C CA . ASN G 137 ? 0.5409 1.0332 0.7027 0.0996 -0.1402 -0.0694 138 ASN E CA 10798 C C . ASN G 137 ? 0.5673 1.1054 0.7071 0.1121 -0.1438 -0.0648 138 ASN E C 10799 O O . ASN G 137 ? 0.5559 1.1330 0.6993 0.1256 -0.1494 -0.0475 138 ASN E O 10800 C CB . ASN G 137 ? 0.5116 1.0065 0.6972 0.1066 -0.1420 -0.0386 138 ASN E CB 10801 C CG . ASN G 137 ? 0.5539 1.0049 0.7608 0.0962 -0.1390 -0.0424 138 ASN E CG 10802 O OD1 . ASN G 137 ? 0.4881 0.8985 0.6926 0.0829 -0.1333 -0.0579 138 ASN E OD1 10803 N ND2 . ASN G 137 ? 0.6281 1.0871 0.8555 0.1027 -0.1426 -0.0283 138 ASN E ND2 10804 N N . PHE G 138 ? 0.5989 1.1319 0.7154 0.1081 -0.1406 -0.0797 139 PHE E N 10805 C CA . PHE G 138 ? 0.6355 1.2094 0.7283 0.1205 -0.1434 -0.0765 139 PHE E CA 10806 C C . PHE G 138 ? 0.6502 1.2106 0.7230 0.1176 -0.1367 -0.0747 139 PHE E C 10807 O O . PHE G 138 ? 0.6712 1.1908 0.7437 0.1038 -0.1305 -0.0872 139 PHE E O 10808 C CB . PHE G 138 ? 0.6419 1.2403 0.7208 0.1225 -0.1503 -0.1067 139 PHE E CB 10809 C CG . PHE G 138 ? 0.6084 1.1756 0.6774 0.1079 -0.1477 -0.1417 139 PHE E CG 10810 C CD1 . PHE G 138 ? 0.5476 1.1129 0.5898 0.1065 -0.1451 -0.1562 139 PHE E CD1 10811 C CD2 . PHE G 138 ? 0.5896 1.1304 0.6762 0.0962 -0.1481 -0.1598 139 PHE E CD2 10812 C CE1 . PHE G 138 ? 0.5211 1.0578 0.5547 0.0930 -0.1429 -0.1881 139 PHE E CE1 10813 C CE2 . PHE G 138 ? 0.5618 1.0749 0.6402 0.0828 -0.1459 -0.1914 139 PHE E CE2 10814 C CZ . PHE G 138 ? 0.5170 1.0279 0.5691 0.0809 -0.1434 -0.2056 139 PHE E CZ 10815 N N . TYR G 139 ? 0.6331 1.2291 0.6895 0.1312 -0.1377 -0.0580 140 TYR E N 10816 C CA . TYR G 139 ? 0.6288 1.2206 0.6627 0.1316 -0.1318 -0.0564 140 TYR E CA 10817 C C . TYR G 139 ? 0.6407 1.2786 0.6483 0.1468 -0.1364 -0.0608 140 TYR E C 10818 O O . TYR G 139 ? 0.7018 1.3753 0.7121 0.1598 -0.1410 -0.0451 140 TYR E O 10819 C CB . TYR G 139 ? 0.6105 1.1923 0.6547 0.1328 -0.1264 -0.0203 140 TYR E CB 10820 C CG . TYR G 139 ? 0.5835 1.1548 0.6075 0.1309 -0.1192 -0.0181 140 TYR E CG 10821 C CD1 . TYR G 139 ? 0.5950 1.2038 0.5978 0.1456 -0.1192 -0.0051 140 TYR E CD1 10822 C CD2 . TYR G 139 ? 0.5553 1.0798 0.5812 0.1147 -0.1122 -0.0288 140 TYR E CD2 10823 C CE1 . TYR G 139 ? 0.6215 1.2215 0.6057 0.1445 -0.1122 -0.0026 140 TYR E CE1 10824 C CE2 . TYR G 139 ? 0.5520 1.0674 0.5598 0.1129 -0.1054 -0.0264 140 TYR E CE2 10825 C CZ . TYR G 139 ? 0.5800 1.1333 0.5671 0.1279 -0.1053 -0.0131 140 TYR E CZ 10826 O OH . TYR G 139 ? 0.5954 1.1404 0.5644 0.1268 -0.0982 -0.0101 140 TYR E OH 10827 N N . PRO G 140 ? 0.5963 1.2294 0.5772 0.1448 -0.1337 -0.0821 141 PRO E N 10828 C CA . PRO G 140 ? 0.5752 1.1644 0.5503 0.1292 -0.1265 -0.1012 141 PRO E CA 10829 C C . PRO G 140 ? 0.5743 1.1394 0.5528 0.1158 -0.1291 -0.1376 141 PRO E C 10830 O O . PRO G 140 ? 0.4869 1.0696 0.4727 0.1183 -0.1367 -0.1482 141 PRO E O 10831 C CB . PRO G 140 ? 0.5679 1.1726 0.5106 0.1371 -0.1236 -0.1059 141 PRO E CB 10832 C CG . PRO G 140 ? 0.6183 1.2510 0.5504 0.1489 -0.1244 -0.1091 141 PRO E CG 10833 C CD . PRO G 140 ? 0.6046 1.2627 0.5587 0.1566 -0.1310 -0.0855 141 PRO E CD 10834 N N . ARG G 141 ? 0.6315 1.1578 0.6046 0.1017 -0.1227 -0.1557 142 ARG E N 10835 C CA . ARG G 141 ? 0.6676 1.1654 0.6458 0.0871 -0.1237 -0.1887 142 ARG E CA 10836 C C . ARG G 141 ? 0.6938 1.1917 0.6604 0.0887 -0.1201 -0.2078 142 ARG E C 10837 O O . ARG G 141 ? 0.6946 1.1776 0.6736 0.0812 -0.1206 -0.2235 142 ARG E O 10838 C CB . ARG G 141 ? 0.7447 1.1981 0.7188 0.0725 -0.1144 -0.1993 142 ARG E CB 10839 C CG . ARG G 141 ? 0.8153 1.2216 0.7997 0.0563 -0.1063 -0.2226 142 ARG E CG 10840 C CD . ARG G 141 ? 0.8443 1.2051 0.8265 0.0431 -0.0948 -0.2256 142 ARG E CD 10841 N NE . ARG G 141 ? 0.9289 1.2457 0.9218 0.0300 -0.0854 -0.2374 142 ARG E NE 10842 C CZ . ARG G 141 ? 1.0035 1.2771 0.9971 0.0184 -0.0744 -0.2356 142 ARG E CZ 10843 N NH1 . ARG G 141 ? 1.0286 1.2947 1.0130 0.0169 -0.0709 -0.2279 142 ARG E NH1 10844 N NH2 . ARG G 141 ? 1.0074 1.2476 1.0097 0.0090 -0.0676 -0.2380 142 ARG E NH2 10845 N N . GLU G 142 ? 0.7823 1.2966 0.7277 0.0988 -0.1166 -0.2039 143 GLU E N 10846 C CA . GLU G 142 ? 0.8220 1.3355 0.7589 0.1004 -0.1142 -0.2193 143 GLU E CA 10847 C C . GLU G 142 ? 0.8079 1.3477 0.7534 0.1062 -0.1226 -0.2221 143 GLU E C 10848 O O . GLU G 142 ? 0.8432 1.4210 0.7880 0.1191 -0.1290 -0.2051 143 GLU E O 10849 C CB . GLU G 142 ? 0.9160 1.4469 0.8309 0.1122 -0.1105 -0.2117 143 GLU E CB 10850 C CG . GLU G 142 ? 1.0133 1.5167 0.9191 0.1064 -0.1015 -0.2102 143 GLU E CG 10851 C CD . GLU G 142 ? 1.0807 1.5920 0.9855 0.1088 -0.1014 -0.1901 143 GLU E CD 10852 O OE1 . GLU G 142 ? 1.1476 1.6969 1.0496 0.1227 -0.1065 -0.1683 143 GLU E OE1 10853 O OE2 . GLU G 142 ? 1.0628 1.5412 0.9714 0.0966 -0.0962 -0.1930 143 GLU E OE2 10854 N N . ALA G 143 ? 0.7110 1.2295 0.6661 0.0964 -0.1218 -0.2404 144 ALA E N 10855 C CA . ALA G 143 ? 0.6556 1.1957 0.6196 0.1001 -0.1294 -0.2448 144 ALA E CA 10856 C C . ALA G 143 ? 0.7132 1.2315 0.6789 0.0917 -0.1267 -0.2631 144 ALA E C 10857 O O . ALA G 143 ? 0.7434 1.2231 0.7116 0.0797 -0.1192 -0.2708 144 ALA E O 10858 C CB . ALA G 143 ? 0.5808 1.1217 0.5667 0.0959 -0.1349 -0.2401 144 ALA E CB 10859 N N . LYS G 144 ? 0.7280 1.2712 0.6932 0.0980 -0.1332 -0.2670 145 LYS E N 10860 C CA . LYS G 144 ? 0.7754 1.3035 0.7412 0.0915 -0.1327 -0.2815 145 LYS E CA 10861 C C . LYS G 144 ? 0.7620 1.2971 0.7444 0.0881 -0.1385 -0.2873 145 LYS E C 10862 O O . LYS G 144 ? 0.7436 1.3140 0.7278 0.0977 -0.1464 -0.2812 145 LYS E O 10863 C CB . LYS G 144 ? 0.8612 1.4110 0.8077 0.1020 -0.1353 -0.2822 145 LYS E CB 10864 C CG . LYS G 144 ? 0.9669 1.5080 0.9128 0.0970 -0.1377 -0.2953 145 LYS E CG 10865 C CD . LYS G 144 ? 1.0670 1.6377 0.9949 0.1097 -0.1428 -0.2949 145 LYS E CD 10866 C CE . LYS G 144 ? 1.1111 1.6734 1.0373 0.1046 -0.1466 -0.3075 145 LYS E CE 10867 N NZ . LYS G 144 ? 1.1632 1.7564 1.0727 0.1174 -0.1529 -0.3076 145 LYS E NZ 10868 N N . VAL G 145 ? 0.7898 1.2916 0.7849 0.0748 -0.1344 -0.2966 146 VAL E N 10869 C CA . VAL G 145 ? 0.8249 1.3314 0.8361 0.0711 -0.1391 -0.3022 146 VAL E CA 10870 C C . VAL G 145 ? 0.8695 1.3656 0.8782 0.0658 -0.1394 -0.3126 146 VAL E C 10871 O O . VAL G 145 ? 0.8383 1.3022 0.8433 0.0572 -0.1328 -0.3157 146 VAL E O 10872 C CB . VAL G 145 ? 0.8540 1.3328 0.8852 0.0607 -0.1346 -0.3021 146 VAL E CB 10873 C CG1 . VAL G 145 ? 0.8271 1.3224 0.8644 0.0665 -0.1382 -0.2913 146 VAL E CG1 10874 C CG2 . VAL G 145 ? 0.8748 1.3087 0.9053 0.0491 -0.1235 -0.3033 146 VAL E CG2 10875 N N . GLN G 146 ? 0.9462 1.4702 0.9565 0.0711 -0.1479 -0.3159 147 GLN E N 10876 C CA . GLN G 146 ? 0.9942 1.5113 1.0030 0.0660 -0.1501 -0.3254 147 GLN E CA 10877 C C . GLN G 146 ? 0.9297 1.4490 0.9575 0.0609 -0.1537 -0.3291 147 GLN E C 10878 O O . GLN G 146 ? 0.9336 1.4790 0.9706 0.0668 -0.1593 -0.3246 147 GLN E O 10879 C CB . GLN G 146 ? 1.1124 1.6603 1.1042 0.0765 -0.1575 -0.3268 147 GLN E CB 10880 C CG . GLN G 146 ? 1.1756 1.7336 1.1488 0.0861 -0.1556 -0.3206 147 GLN E CG 10881 C CD . GLN G 146 ? 1.2572 1.8487 1.2145 0.0980 -0.1631 -0.3207 147 GLN E CD 10882 O OE1 . GLN G 146 ? 1.3047 1.9218 1.2508 0.1104 -0.1642 -0.3116 147 GLN E OE1 10883 N NE2 . GLN G 146 ? 1.3005 1.8918 1.2565 0.0944 -0.1683 -0.3299 147 GLN E NE2 10884 N N . TRP G 147 ? 0.8661 1.3588 0.9000 0.0501 -0.1505 -0.3354 148 TRP E N 10885 C CA . TRP G 147 ? 0.7762 1.2712 0.8274 0.0454 -0.1537 -0.3390 148 TRP E CA 10886 C C . TRP G 147 ? 0.8338 1.3451 0.8794 0.0461 -0.1618 -0.3458 148 TRP E C 10887 O O . TRP G 147 ? 0.8963 1.3910 0.9309 0.0415 -0.1607 -0.3499 148 TRP E O 10888 C CB . TRP G 147 ? 0.6585 1.1137 0.7218 0.0333 -0.1445 -0.3391 148 TRP E CB 10889 C CG . TRP G 147 ? 0.6012 1.0437 0.6760 0.0320 -0.1385 -0.3330 148 TRP E CG 10890 C CD1 . TRP G 147 ? 0.5761 0.9909 0.6472 0.0282 -0.1294 -0.3275 148 TRP E CD1 10891 C CD2 . TRP G 147 ? 0.6050 1.0614 0.6968 0.0345 -0.1419 -0.3312 148 TRP E CD2 10892 N NE1 . TRP G 147 ? 0.6178 1.0274 0.7021 0.0278 -0.1269 -0.3231 148 TRP E NE1 10893 C CE2 . TRP G 147 ? 0.5954 1.0297 0.6927 0.0317 -0.1346 -0.3254 148 TRP E CE2 10894 C CE3 . TRP G 147 ? 0.5481 1.0329 0.6511 0.0386 -0.1507 -0.3328 148 TRP E CE3 10895 C CZ2 . TRP G 147 ? 0.5202 0.9590 0.6342 0.0329 -0.1364 -0.3221 148 TRP E CZ2 10896 C CZ3 . TRP G 147 ? 0.5576 1.0479 0.6778 0.0401 -0.1524 -0.3282 148 TRP E CZ3 10897 C CH2 . TRP G 147 ? 0.5260 0.9929 0.6516 0.0373 -0.1455 -0.3234 148 TRP E CH2 10898 N N . LYS G 148 ? 0.8586 1.4021 0.9118 0.0516 -0.1705 -0.3457 149 LYS E N 10899 C CA . LYS G 148 ? 0.9785 1.5400 1.0275 0.0523 -0.1793 -0.3514 149 LYS E CA 10900 C C . LYS G 148 ? 1.0147 1.5786 1.0831 0.0465 -0.1826 -0.3538 149 LYS E C 10901 O O . LYS G 148 ? 1.0165 1.5961 1.0995 0.0497 -0.1847 -0.3489 149 LYS E O 10902 C CB . LYS G 148 ? 0.9995 1.6019 1.0370 0.0654 -0.1879 -0.3474 149 LYS E CB 10903 C CG . LYS G 148 ? 1.0268 1.6294 1.0431 0.0721 -0.1854 -0.3456 149 LYS E CG 10904 C CD . LYS G 148 ? 1.0918 1.7352 1.0957 0.0856 -0.1937 -0.3409 149 LYS E CD 10905 C CE . LYS G 148 ? 1.1743 1.8175 1.1566 0.0928 -0.1907 -0.3391 149 LYS E CE 10906 N NZ . LYS G 148 ? 1.2729 1.9552 1.2418 0.1066 -0.1981 -0.3340 149 LYS E NZ 10907 N N . VAL G 149 ? 1.0413 1.5895 1.1096 0.0380 -0.1834 -0.3604 150 VAL E N 10908 C CA . VAL G 149 ? 1.0263 1.5762 1.1119 0.0320 -0.1866 -0.3628 150 VAL E CA 10909 C C . VAL G 149 ? 1.0869 1.6576 1.1663 0.0323 -0.1975 -0.3677 150 VAL E C 10910 O O . VAL G 149 ? 1.0828 1.6392 1.1488 0.0279 -0.1984 -0.3726 150 VAL E O 10911 C CB . VAL G 149 ? 0.9395 1.4497 1.0331 0.0205 -0.1774 -0.3643 150 VAL E CB 10912 C CG1 . VAL G 149 ? 0.9342 1.4482 1.0451 0.0151 -0.1808 -0.3664 150 VAL E CG1 10913 C CG2 . VAL G 149 ? 0.8995 1.3880 0.9990 0.0199 -0.1667 -0.3588 150 VAL E CG2 10914 N N . ASP G 150 ? 1.1319 1.7356 1.2212 0.0373 -0.2061 -0.3654 151 ASP E N 10915 C CA . ASP G 150 ? 1.1742 1.8044 1.2568 0.0397 -0.2176 -0.3680 151 ASP E CA 10916 C C . ASP G 150 ? 1.2562 1.8950 1.3150 0.0469 -0.2202 -0.3691 151 ASP E C 10917 O O . ASP G 150 ? 1.2996 1.9385 1.3458 0.0447 -0.2262 -0.3749 151 ASP E O 10918 C CB . ASP G 150 ? 1.0978 1.7117 1.1843 0.0285 -0.2203 -0.3748 151 ASP E CB 10919 C CG . ASP G 150 ? 1.0255 1.6400 1.1358 0.0232 -0.2202 -0.3731 151 ASP E CG 10920 O OD1 . ASP G 150 ? 1.0157 1.6535 1.1392 0.0294 -0.2222 -0.3668 151 ASP E OD1 10921 O OD2 . ASP G 150 ? 0.9519 1.5440 1.0676 0.0132 -0.2182 -0.3770 151 ASP E OD2 10922 N N . ASN G 151 ? 1.2960 1.9416 1.3488 0.0555 -0.2158 -0.3631 152 ASN E N 10923 C CA . ASN G 151 ? 1.3089 1.9622 1.3394 0.0637 -0.2164 -0.3627 152 ASN E CA 10924 C C . ASN G 151 ? 1.2362 1.8559 1.2523 0.0565 -0.2120 -0.3700 152 ASN E C 10925 O O . ASN G 151 ? 1.2703 1.8956 1.2688 0.0593 -0.2173 -0.3739 152 ASN E O 10926 C CB . ASN G 151 ? 1.4056 2.0969 1.4273 0.0726 -0.2277 -0.3612 152 ASN E CB 10927 C CG . ASN G 151 ? 1.4920 2.2012 1.4943 0.0852 -0.2277 -0.3562 152 ASN E CG 10928 O OD1 . ASN G 151 ? 1.4928 2.2006 1.4943 0.0906 -0.2210 -0.3493 152 ASN E OD1 10929 N ND2 . ASN G 151 ? 1.5795 2.3054 1.5658 0.0902 -0.2354 -0.3594 152 ASN E ND2 10930 N N . ALA G 152 ? 1.1419 1.7262 1.1653 0.0474 -0.2024 -0.3706 153 ALA E N 10931 C CA . ALA G 152 ? 1.1148 1.6648 1.1259 0.0404 -0.1971 -0.3742 153 ALA E CA 10932 C C . ALA G 152 ? 1.0898 1.6148 1.1016 0.0392 -0.1853 -0.3690 153 ALA E C 10933 O O . ALA G 152 ? 1.0420 1.5559 1.0702 0.0354 -0.1791 -0.3655 153 ALA E O 10934 C CB . ALA G 152 ? 1.0910 1.6185 1.1093 0.0280 -0.1979 -0.3788 153 ALA E CB 10935 N N . LEU G 153 ? 1.0811 1.5971 1.0750 0.0424 -0.1825 -0.3683 154 LEU E N 10936 C CA . LEU G 153 ? 1.0309 1.5257 1.0236 0.0420 -0.1721 -0.3624 154 LEU E CA 10937 C C . LEU G 153 ? 1.0161 1.4786 1.0211 0.0316 -0.1631 -0.3654 154 LEU E C 10938 O O . LEU G 153 ? 1.0438 1.5003 1.0486 0.0284 -0.1632 -0.3757 154 LEU E O 10939 C CB . LEU G 153 ? 1.0162 1.5125 0.9869 0.0487 -0.1719 -0.3617 154 LEU E CB 10940 C CG . LEU G 153 ? 1.0297 1.5074 0.9969 0.0492 -0.1621 -0.3549 154 LEU E CG 10941 C CD1 . LEU G 153 ? 1.0305 1.5260 1.0093 0.0553 -0.1598 -0.3487 154 LEU E CD1 10942 C CD2 . LEU G 153 ? 1.0430 1.5253 0.9882 0.0567 -0.1628 -0.3552 154 LEU E CD2 10943 N N . GLN G 154 ? 0.9586 1.4066 0.9768 0.0281 -0.1557 -0.3584 155 GLN E N 10944 C CA . GLN G 154 ? 0.9191 1.3436 0.9529 0.0208 -0.1461 -0.3621 155 GLN E CA 10945 C C . GLN G 154 ? 0.9527 1.3626 0.9799 0.0216 -0.1383 -0.3617 155 GLN E C 10946 O O . GLN G 154 ? 0.9675 1.3832 0.9791 0.0278 -0.1392 -0.3567 155 GLN E O 10947 C CB . GLN G 154 ? 0.8704 1.2849 0.9208 0.0172 -0.1415 -0.3545 155 GLN E CB 10948 C CG . GLN G 154 ? 0.8460 1.2746 0.9047 0.0162 -0.1492 -0.3535 155 GLN E CG 10949 C CD . GLN G 154 ? 0.7915 1.2218 0.8592 0.0112 -0.1518 -0.3640 155 GLN E CD 10950 O OE1 . GLN G 154 ? 0.7206 1.1343 0.7997 0.0061 -0.1445 -0.3689 155 GLN E OE1 10951 N NE2 . GLN G 154 ? 0.8198 1.2710 0.8824 0.0128 -0.1626 -0.3666 155 GLN E NE2 10952 N N . SER G 155 ? 0.9529 1.3450 0.9920 0.0156 -0.1308 -0.3662 156 SER E N 10953 C CA . SER G 155 ? 0.9648 1.3427 0.9998 0.0154 -0.1234 -0.3650 156 SER E CA 10954 C C . SER G 155 ? 0.9956 1.3542 1.0493 0.0081 -0.1140 -0.3661 156 SER E C 10955 O O . SER G 155 ? 0.9304 1.2882 0.9948 0.0038 -0.1147 -0.3732 156 SER E O 10956 C CB . SER G 155 ? 0.9533 1.3388 0.9715 0.0191 -0.1283 -0.3726 156 SER E CB 10957 O OG . SER G 155 ? 0.9328 1.3060 0.9455 0.0195 -0.1217 -0.3704 156 SER E OG 10958 N N . GLY G 156 ? 1.1050 1.4488 1.1620 0.0069 -0.1055 -0.3584 157 GLY E N 10959 C CA . GLY G 156 ? 1.1360 1.4627 1.2096 0.0007 -0.0961 -0.3576 157 GLY E CA 10960 C C . GLY G 156 ? 1.0317 1.3526 1.1249 -0.0034 -0.0925 -0.3554 157 GLY E C 10961 O O . GLY G 156 ? 1.0923 1.4042 1.2006 -0.0082 -0.0863 -0.3572 157 GLY E O 10962 N N . ASN G 157 ? 0.8360 1.1627 0.9288 -0.0011 -0.0963 -0.3510 158 ASN E N 10963 C CA . ASN G 157 ? 0.7086 1.0300 0.8189 -0.0042 -0.0936 -0.3488 158 ASN E CA 10964 C C . ASN G 157 ? 0.6745 0.9912 0.7841 -0.0025 -0.0932 -0.3388 158 ASN E C 10965 O O . ASN G 157 ? 0.6757 0.9911 0.7962 -0.0036 -0.0937 -0.3367 158 ASN E O 10966 C CB . ASN G 157 ? 0.6329 0.9686 0.7465 -0.0045 -0.1014 -0.3566 158 ASN E CB 10967 C CG . ASN G 157 ? 0.6862 1.0410 0.7832 0.0005 -0.1124 -0.3574 158 ASN E CG 10968 O OD1 . ASN G 157 ? 0.7862 1.1451 0.8677 0.0049 -0.1143 -0.3538 158 ASN E OD1 10969 N ND2 . ASN G 157 ? 0.6431 1.0111 0.7434 0.0002 -0.1199 -0.3615 158 ASN E ND2 10970 N N . SER G 158 ? 0.6776 0.9913 0.7739 0.0003 -0.0925 -0.3324 159 SER E N 10971 C CA . SER G 158 ? 0.6483 0.9558 0.7423 0.0015 -0.0924 -0.3222 159 SER E CA 10972 C C . SER G 158 ? 0.6509 0.9409 0.7429 -0.0001 -0.0843 -0.3148 159 SER E C 10973 O O . SER G 158 ? 0.7094 0.9973 0.7960 -0.0004 -0.0811 -0.3170 159 SER E O 10974 C CB . SER G 158 ? 0.6774 1.0038 0.7544 0.0074 -0.1025 -0.3196 159 SER E CB 10975 O OG . SER G 158 ? 0.7285 1.0606 0.7881 0.0114 -0.1035 -0.3195 159 SER E OG 10976 N N . GLN G 159 ? 0.6388 0.9158 0.7348 -0.0014 -0.0816 -0.3057 160 GLN E N 10977 C CA . GLN G 159 ? 0.6102 0.8699 0.7034 -0.0033 -0.0748 -0.2974 160 GLN E CA 10978 C C . GLN G 159 ? 0.6427 0.8991 0.7262 -0.0015 -0.0787 -0.2877 160 GLN E C 10979 O O . GLN G 159 ? 0.5696 0.8304 0.6574 -0.0007 -0.0840 -0.2860 160 GLN E O 10980 C CB . GLN G 159 ? 0.6092 0.8507 0.7213 -0.0088 -0.0649 -0.2953 160 GLN E CB 10981 C CG . GLN G 159 ? 0.7072 0.9515 0.8289 -0.0113 -0.0603 -0.3028 160 GLN E CG 10982 C CD . GLN G 159 ? 0.7808 1.0101 0.9203 -0.0161 -0.0504 -0.2989 160 GLN E CD 10983 O OE1 . GLN G 159 ? 0.7625 0.9863 0.9148 -0.0171 -0.0486 -0.2968 160 GLN E OE1 10984 N NE2 . GLN G 159 ? 0.8339 1.0577 0.9742 -0.0188 -0.0441 -0.2975 160 GLN E NE2 10985 N N . GLU G 160 ? 0.6372 0.8869 0.7081 -0.0008 -0.0767 -0.2812 161 GLU E N 10986 C CA . GLU G 160 ? 0.5695 0.8270 0.6362 0.0029 -0.0811 -0.2767 161 GLU E CA 10987 C C . GLU G 160 ? 0.6293 0.8580 0.6990 -0.0028 -0.0738 -0.2663 161 GLU E C 10988 O O . GLU G 160 ? 0.6539 0.8631 0.7235 -0.0074 -0.0654 -0.2624 161 GLU E O 10989 C CB . GLU G 160 ? 0.6033 0.8885 0.6541 0.0114 -0.0866 -0.2800 161 GLU E CB 10990 C CG . GLU G 160 ? 0.7776 1.0950 0.8237 0.0187 -0.0949 -0.2892 161 GLU E CG 10991 C CD . GLU G 160 ? 0.9380 1.2834 0.9664 0.0287 -0.0998 -0.2898 161 GLU E CD 10992 O OE1 . GLU G 160 ? 0.9735 1.3350 0.9986 0.0348 -0.1022 -0.2854 161 GLU E OE1 10993 O OE2 . GLU G 160 ? 1.0234 1.3751 1.0404 0.0308 -0.1014 -0.2936 161 GLU E OE2 10994 N N . SER G 161 ? 0.5467 0.7849 0.6268 -0.0002 -0.0778 -0.2675 162 SER E N 10995 C CA . SER G 161 ? 0.5283 0.7413 0.6114 -0.0051 -0.0725 -0.2583 162 SER E CA 10996 C C . SER G 161 ? 0.5155 0.7553 0.5999 0.0017 -0.0815 -0.2613 162 SER E C 10997 O O . SER G 161 ? 0.5174 0.7913 0.6083 0.0092 -0.0923 -0.2678 162 SER E O 10998 C CB . SER G 161 ? 0.5584 0.7455 0.6567 -0.0111 -0.0675 -0.2532 162 SER E CB 10999 O OG . SER G 161 ? 0.5261 0.6866 0.6259 -0.0159 -0.0622 -0.2428 162 SER E OG 11000 N N . VAL G 162 ? 0.4120 0.6391 0.4895 -0.0006 -0.0785 -0.2543 163 VAL E N 11001 C CA . VAL G 162 ? 0.4365 0.6922 0.5130 0.0060 -0.0886 -0.2537 163 VAL E CA 11002 C C . VAL G 162 ? 0.4587 0.6874 0.5463 -0.0012 -0.0867 -0.2464 163 VAL E C 11003 O O . VAL G 162 ? 0.5435 0.7336 0.6263 -0.0096 -0.0750 -0.2390 163 VAL E O 11004 C CB . VAL G 162 ? 0.5088 0.7851 0.5628 0.0126 -0.0892 -0.2516 163 VAL E CB 11005 C CG1 . VAL G 162 ? 0.5225 0.8408 0.5739 0.0228 -0.1024 -0.2449 163 VAL E CG1 11006 C CG2 . VAL G 162 ? 0.5379 0.8314 0.5807 0.0180 -0.0892 -0.2578 163 VAL E CG2 11007 N N . THR G 163 ? 0.4203 0.6711 0.5248 0.0023 -0.0997 -0.2445 164 THR E N 11008 C CA . THR G 163 ? 0.4657 0.6913 0.5852 -0.0045 -0.0996 -0.2344 164 THR E CA 11009 C C . THR G 163 ? 0.4725 0.6972 0.5769 -0.0022 -0.0950 -0.2161 164 THR E C 11010 O O . THR G 163 ? 0.4153 0.6701 0.4998 0.0057 -0.0970 -0.2165 164 THR E O 11011 C CB . THR G 163 ? 0.5329 0.7659 0.6743 0.0037 -0.1029 -0.2091 164 THR E CB 11012 O OG1 . THR G 163 ? 0.4766 0.7491 0.6117 0.0184 -0.1071 -0.1853 164 THR E OG1 11013 C CG2 . THR G 163 ? 0.5873 0.8281 0.7435 0.0040 -0.1078 -0.2245 164 THR E CG2 11014 N N . GLU G 164 ? 0.5296 0.7194 0.6432 -0.0091 -0.0891 -0.1999 165 GLU E N 11015 C CA . GLU G 164 ? 0.5489 0.7380 0.6531 -0.0065 -0.0852 -0.1760 165 GLU E CA 11016 C C . GLU G 164 ? 0.5511 0.7742 0.6613 0.0085 -0.0902 -0.1442 165 GLU E C 11017 O O . GLU G 164 ? 0.6062 0.8456 0.7304 0.0152 -0.0958 -0.1400 165 GLU E O 11018 C CB . GLU G 164 ? 0.5359 0.6765 0.6501 -0.0191 -0.0785 -0.1676 165 GLU E CB 11019 C CG . GLU G 164 ? 0.6559 0.7793 0.7945 -0.0188 -0.0805 -0.1492 165 GLU E CG 11020 C CD . GLU G 164 ? 0.8153 0.8866 0.9634 -0.0325 -0.0746 -0.1469 165 GLU E CD 11021 O OE1 . GLU G 164 ? 0.9304 0.9857 1.0694 -0.0381 -0.0697 -0.1378 165 GLU E OE1 11022 O OE2 . GLU G 164 ? 0.8676 0.9140 1.0319 -0.0375 -0.0749 -0.1541 165 GLU E OE2 11023 N N . GLN G 165 ? 0.5149 0.7492 0.6150 0.0140 -0.0880 -0.1212 166 GLN E N 11024 C CA . GLN G 165 ? 0.5271 0.7908 0.6344 0.0274 -0.0921 -0.0878 166 GLN E CA 11025 C C . GLN G 165 ? 0.6013 0.8390 0.7342 0.0240 -0.0929 -0.0682 166 GLN E C 11026 O O . GLN G 165 ? 0.6852 0.8789 0.8258 0.0114 -0.0883 -0.0698 166 GLN E O 11027 C CB . GLN G 165 ? 0.5002 0.7765 0.5929 0.0324 -0.0887 -0.0658 166 GLN E CB 11028 C CG . GLN G 165 ? 0.4832 0.8111 0.5579 0.0482 -0.0926 -0.0625 166 GLN E CG 11029 C CD . GLN G 165 ? 0.4903 0.8323 0.5509 0.0544 -0.0888 -0.0392 166 GLN E CD 11030 O OE1 . GLN G 165 ? 0.4866 0.7996 0.5428 0.0447 -0.0822 -0.0370 166 GLN E OE1 11031 N NE2 . GLN G 165 ? 0.5168 0.9045 0.5704 0.0708 -0.0928 -0.0211 166 GLN E NE2 11032 N N . ASP G 166 ? 0.6254 0.8897 0.7708 0.0355 -0.0990 -0.0501 167 ASP E N 11033 C CA . ASP G 166 ? 0.6489 0.8910 0.8176 0.0343 -0.1003 -0.0287 167 ASP E CA 11034 C C . ASP G 166 ? 0.6783 0.9056 0.8485 0.0325 -0.0975 0.0020 167 ASP E C 11035 O O . ASP G 166 ? 0.6859 0.9421 0.8444 0.0405 -0.0975 0.0187 167 ASP E O 11036 C CB . ASP G 166 ? 0.7490 1.0264 0.9300 0.0480 -0.1075 -0.0154 167 ASP E CB 11037 C CG . ASP G 166 ? 0.8730 1.1241 1.0783 0.0463 -0.1091 0.0004 167 ASP E CG 11038 O OD1 . ASP G 166 ? 0.9343 1.1479 1.1478 0.0358 -0.1066 -0.0176 167 ASP E OD1 11039 O OD2 . ASP G 166 ? 0.9028 1.1701 1.1185 0.0557 -0.1128 0.0309 167 ASP E OD2 11040 N N . SER G 167 ? 0.7548 0.9371 0.9392 0.0221 -0.0953 0.0097 168 SER E N 11041 C CA . SER G 167 ? 0.7929 0.9552 0.9786 0.0176 -0.0928 0.0365 168 SER E CA 11042 C C . SER G 167 ? 0.8156 1.0001 1.0136 0.0288 -0.0981 0.0748 168 SER E C 11043 O O . SER G 167 ? 0.8466 1.0171 1.0484 0.0258 -0.0973 0.1013 168 SER E O 11044 C CB . SER G 167 ? 0.8201 0.9245 1.0157 0.0020 -0.0892 0.0306 168 SER E CB 11045 O OG . SER G 167 ? 0.8915 0.9788 1.1067 0.0029 -0.0930 0.0347 168 SER E OG 11046 N N . LYS G 168 ? 0.7531 0.9726 0.9577 0.0414 -0.1037 0.0783 169 LYS E N 11047 C CA . LYS G 168 ? 0.7800 1.0219 0.9975 0.0526 -0.1090 0.1141 169 LYS E CA 11048 C C . LYS G 168 ? 0.7283 1.0294 0.9352 0.0685 -0.1121 0.1235 169 LYS E C 11049 O O . LYS G 168 ? 0.7360 1.0583 0.9437 0.0760 -0.1136 0.1545 169 LYS E O 11050 C CB . LYS G 168 ? 0.8270 1.0551 1.0658 0.0544 -0.1134 0.1171 169 LYS E CB 11051 C CG . LYS G 168 ? 0.8899 1.0589 1.1399 0.0403 -0.1110 0.1130 169 LYS E CG 11052 C CD . LYS G 168 ? 0.9679 1.1234 1.2397 0.0445 -0.1160 0.1312 169 LYS E CD 11053 C CE . LYS G 168 ? 0.9899 1.0848 1.2707 0.0311 -0.1140 0.1303 169 LYS E CE 11054 N NZ . LYS G 168 ? 1.0010 1.0800 1.3019 0.0355 -0.1192 0.1509 169 LYS E NZ 11055 N N . ASP G 169 ? 0.6548 0.9828 0.8517 0.0738 -0.1134 0.0975 170 ASP E N 11056 C CA . ASP G 169 ? 0.6545 1.0385 0.8403 0.0895 -0.1169 0.1048 170 ASP E CA 11057 C C . ASP G 169 ? 0.5818 0.9831 0.7415 0.0898 -0.1140 0.0781 170 ASP E C 11058 O O . ASP G 169 ? 0.5559 1.0026 0.7030 0.1026 -0.1170 0.0786 170 ASP E O 11059 C CB . ASP G 169 ? 0.7114 1.1220 0.9099 0.0996 -0.1235 0.1040 170 ASP E CB 11060 C CG . ASP G 169 ? 0.8369 1.2408 1.0325 0.0946 -0.1239 0.0665 170 ASP E CG 11061 O OD1 . ASP G 169 ? 0.8781 1.2458 1.0684 0.0812 -0.1191 0.0429 170 ASP E OD1 11062 O OD2 . ASP G 169 ? 0.9187 1.3545 1.1181 0.1040 -0.1292 0.0614 170 ASP E OD2 11063 N N . SER G 170 ? 0.4539 0.8183 0.6055 0.0757 -0.1084 0.0547 171 SER E N 11064 C CA . SER G 170 ? 0.4257 0.7988 0.5520 0.0741 -0.1047 0.0317 171 SER E CA 11065 C C . SER G 170 ? 0.4529 0.8576 0.5668 0.0809 -0.1088 0.0041 171 SER E C 11066 O O . SER G 170 ? 0.4220 0.8514 0.5131 0.0866 -0.1082 -0.0062 171 SER E O 11067 C CB . SER G 170 ? 0.3692 0.7662 0.4816 0.0823 -0.1024 0.0562 171 SER E CB 11068 O OG . SER G 170 ? 0.4765 0.8451 0.6005 0.0753 -0.0992 0.0827 171 SER E OG 11069 N N . THR G 171 ? 0.4157 0.8190 0.5442 0.0804 -0.1133 -0.0077 172 THR E N 11070 C CA . THR G 171 ? 0.4744 0.9054 0.5932 0.0852 -0.1180 -0.0343 172 THR E CA 11071 C C . THR G 171 ? 0.4936 0.8927 0.6095 0.0710 -0.1155 -0.0708 172 THR E C 11072 O O . THR G 171 ? 0.3510 0.7058 0.4754 0.0578 -0.1103 -0.0750 172 THR E O 11073 C CB . THR G 171 ? 0.5314 0.9888 0.6674 0.0950 -0.1252 -0.0249 172 THR E CB 11074 O OG1 . THR G 171 ? 0.4999 0.9226 0.6604 0.0874 -0.1243 -0.0185 172 THR E OG1 11075 C CG2 . THR G 171 ? 0.5320 1.0307 0.6674 0.1111 -0.1286 0.0078 172 THR E CG2 11076 N N . TYR G 172 ? 0.3628 0.7850 0.4667 0.0738 -0.1198 -0.0967 173 TYR E N 11077 C CA . TYR G 172 ? 0.4322 0.8299 0.5333 0.0613 -0.1187 -0.1321 173 TYR E CA 11078 C C . TYR G 172 ? 0.5094 0.9193 0.6248 0.0628 -0.1251 -0.1453 173 TYR E C 11079 O O . TYR G 172 ? 0.5068 0.9537 0.6268 0.0753 -0.1315 -0.1326 173 TYR E O 11080 C CB . TYR G 172 ? 0.4192 0.8295 0.4921 0.0612 -0.1184 -0.1554 173 TYR E CB 11081 C CG . TYR G 172 ? 0.4801 0.8789 0.5363 0.0595 -0.1115 -0.1463 173 TYR E CG 11082 C CD1 . TYR G 172 ? 0.4405 0.7952 0.4964 0.0446 -0.1040 -0.1572 173 TYR E CD1 11083 C CD2 . TYR G 172 ? 0.4691 0.9025 0.5094 0.0732 -0.1123 -0.1272 173 TYR E CD2 11084 C CE1 . TYR G 172 ? 0.4650 0.8101 0.5059 0.0431 -0.0976 -0.1485 173 TYR E CE1 11085 C CE2 . TYR G 172 ? 0.4337 0.8582 0.4587 0.0723 -0.1057 -0.1181 173 TYR E CE2 11086 C CZ . TYR G 172 ? 0.4741 0.8544 0.4997 0.0570 -0.0984 -0.1288 173 TYR E CZ 11087 O OH . TYR G 172 ? 0.5283 0.9004 0.5392 0.0561 -0.0917 -0.1191 173 TYR E OH 11088 N N . SER G 173 ? 0.5410 0.9205 0.6637 0.0500 -0.1234 -0.1703 174 SER E N 11089 C CA . SER G 173 ? 0.5179 0.9101 0.6503 0.0500 -0.1294 -0.1890 174 SER E CA 11090 C C . SER G 173 ? 0.4310 0.8139 0.5491 0.0399 -0.1295 -0.2249 174 SER E C 11091 O O . SER G 173 ? 0.4442 0.7957 0.5536 0.0293 -0.1230 -0.2359 174 SER E O 11092 C CB . SER G 173 ? 0.5218 0.8872 0.6814 0.0451 -0.1279 -0.1827 174 SER E CB 11093 O OG . SER G 173 ? 0.5498 0.9302 0.7233 0.0560 -0.1300 -0.1511 174 SER E OG 11094 N N . LEU G 174 ? 0.4081 0.8184 0.5242 0.0431 -0.1371 -0.2426 175 LEU E N 11095 C CA . LEU G 174 ? 0.4460 0.8287 0.5459 0.0355 -0.1261 -0.2607 175 LEU E CA 11096 C C . LEU G 174 ? 0.4769 0.8568 0.5905 0.0332 -0.1265 -0.2698 175 LEU E C 11097 O O . LEU G 174 ? 0.4835 0.8977 0.6092 0.0413 -0.1372 -0.2655 175 LEU E O 11098 C CB . LEU G 174 ? 0.4140 0.8199 0.4881 0.0436 -0.1255 -0.2613 175 LEU E CB 11099 C CG . LEU G 174 ? 0.4707 0.8554 0.5327 0.0386 -0.1158 -0.2725 175 LEU E CG 11100 C CD1 . LEU G 174 ? 0.5178 0.9102 0.5567 0.0436 -0.1127 -0.2696 175 LEU E CD1 11101 C CD2 . LEU G 174 ? 0.4687 0.8739 0.5346 0.0424 -0.1209 -0.2800 175 LEU E CD2 11102 N N . SER G 175 ? 0.5043 0.8456 0.6175 0.0233 -0.1145 -0.2777 176 SER E N 11103 C CA . SER G 175 ? 0.5415 0.8815 0.6650 0.0215 -0.1140 -0.2851 176 SER E CA 11104 C C . SER G 175 ? 0.5796 0.9142 0.6885 0.0197 -0.1080 -0.2900 176 SER E C 11105 O O . SER G 175 ? 0.6446 0.9582 0.7405 0.0156 -0.1000 -0.2866 176 SER E O 11106 C CB . SER G 175 ? 0.5938 0.8963 0.7348 0.0127 -0.1064 -0.2841 176 SER E CB 11107 O OG . SER G 175 ? 0.6417 0.9042 0.7740 0.0041 -0.0928 -0.2788 176 SER E OG 11108 N N . SER G 176 ? 0.5972 0.9517 0.7095 0.0227 -0.1131 -0.2967 177 SER E N 11109 C CA . SER G 176 ? 0.5447 0.8921 0.6473 0.0197 -0.1091 -0.3010 177 SER E CA 11110 C C . SER G 176 ? 0.5573 0.8969 0.6746 0.0152 -0.1082 -0.3053 177 SER E C 11111 O O . SER G 176 ? 0.5372 0.9014 0.6655 0.0197 -0.1164 -0.3096 177 SER E O 11112 C CB . SER G 176 ? 0.5191 0.9026 0.6069 0.0288 -0.1172 -0.3048 177 SER E CB 11113 O OG . SER G 176 ? 0.4781 0.8528 0.5578 0.0252 -0.1146 -0.3092 177 SER E OG 11114 N N . THR G 177 ? 0.5400 0.8468 0.6571 0.0068 -0.0986 -0.3020 178 THR E N 11115 C CA . THR G 177 ? 0.5440 0.8421 0.6739 0.0026 -0.0969 -0.3042 178 THR E CA 11116 C C . THR G 177 ? 0.6040 0.9034 0.7252 0.0003 -0.0974 -0.3076 178 THR E C 11117 O O . THR G 177 ? 0.6168 0.9052 0.7351 -0.0021 -0.0908 -0.3089 178 THR E O 11118 C CB . THR G 177 ? 0.5225 0.7835 0.6596 -0.0046 -0.0862 -0.2945 178 THR E CB 11119 O OG1 . THR G 177 ? 0.5741 0.8313 0.7198 -0.0030 -0.0862 -0.2915 178 THR E OG1 11120 C CG2 . THR G 177 ? 0.5403 0.7976 0.6914 -0.0071 -0.0847 -0.2974 178 THR E CG2 11121 N N . LEU G 178 ? 0.6197 0.9457 0.7461 0.0038 -0.1058 -0.3163 179 LEU E N 11122 C CA . LEU G 178 ? 0.5607 0.8884 0.6807 0.0011 -0.1078 -0.3205 179 LEU E CA 11123 C C . LEU G 178 ? 0.5233 0.8414 0.6621 -0.0032 -0.1026 -0.3248 179 LEU E C 11124 O O . LEU G 178 ? 0.5170 0.8361 0.6656 -0.0039 -0.1054 -0.3225 179 LEU E O 11125 C CB . LEU G 178 ? 0.5633 0.9298 0.6815 0.0080 -0.1198 -0.3295 179 LEU E CB 11126 C CG . LEU G 178 ? 0.5694 0.9402 0.6808 0.0053 -0.1238 -0.3348 179 LEU E CG 11127 C CD1 . LEU G 178 ? 0.6270 0.9961 0.7212 0.0065 -0.1229 -0.3371 179 LEU E CD1 11128 C CD2 . LEU G 178 ? 0.5280 0.9360 0.6442 0.0111 -0.1355 -0.3420 179 LEU E CD2 11129 N N . THR G 179 ? 0.5587 0.8695 0.7033 -0.0056 -0.0955 -0.3308 180 THR E N 11130 C CA . THR G 179 ? 0.6676 0.9719 0.8308 -0.0090 -0.0901 -0.3347 180 THR E CA 11131 C C . THR G 179 ? 0.7791 1.0974 0.9434 -0.0101 -0.0947 -0.3451 180 THR E C 11132 O O . THR G 179 ? 0.8213 1.1440 0.9775 -0.0102 -0.0953 -0.3503 180 THR E O 11133 C CB . THR G 179 ? 0.6611 0.9471 0.8339 -0.0116 -0.0782 -0.3319 180 THR E CB 11134 O OG1 . THR G 179 ? 0.7210 0.9924 0.8938 -0.0113 -0.0742 -0.3219 180 THR E OG1 11135 C CG2 . THR G 179 ? 0.6393 0.9216 0.8310 -0.0143 -0.0729 -0.3356 180 THR E CG2 11136 N N . LEU G 180 ? 0.8096 1.1343 0.9838 -0.0112 -0.0985 -0.3478 181 LEU E N 11137 C CA . LEU G 180 ? 0.8459 1.1824 1.0229 -0.0132 -0.1030 -0.3571 181 LEU E CA 11138 C C . LEU G 180 ? 0.8361 1.1649 1.0324 -0.0162 -0.0972 -0.3590 181 LEU E C 11139 O O . LEU G 180 ? 0.8080 1.1229 1.0150 -0.0162 -0.0895 -0.3531 181 LEU E O 11140 C CB . LEU G 180 ? 0.8345 1.1917 1.0032 -0.0117 -0.1159 -0.3587 181 LEU E CB 11141 C CG . LEU G 180 ? 0.8326 1.2006 0.9842 -0.0073 -0.1228 -0.3534 181 LEU E CG 11142 C CD1 . LEU G 180 ? 0.8231 1.2140 0.9715 -0.0060 -0.1355 -0.3530 181 LEU E CD1 11143 C CD2 . LEU G 180 ? 0.8921 1.2616 1.0286 -0.0055 -0.1225 -0.3571 181 LEU E CD2 11144 N N . SER G 181 ? 0.8774 1.2152 1.0777 -0.0188 -0.1010 -0.3669 182 SER E N 11145 C CA . SER G 181 ? 0.9003 1.2345 1.1179 -0.0212 -0.0975 -0.3687 182 SER E CA 11146 C C . SER G 181 ? 0.8176 1.1636 1.0371 -0.0208 -0.1065 -0.3674 182 SER E C 11147 O O . SER G 181 ? 0.8256 1.1857 1.0331 -0.0193 -0.1162 -0.3665 182 SER E O 11148 C CB . SER G 181 ? 0.9554 1.2927 1.1769 -0.0248 -0.0972 -0.3773 182 SER E CB 11149 O OG . SER G 181 ? 0.9689 1.2977 1.2080 -0.0266 -0.0893 -0.3774 182 SER E OG 11150 N N . LYS G 182 ? 0.7384 1.0802 0.9734 -0.0220 -0.1036 -0.3665 183 LYS E N 11151 C CA . LYS G 182 ? 0.7484 1.1025 0.9872 -0.0221 -0.1125 -0.3644 183 LYS E CA 11152 C C . LYS G 182 ? 0.8345 1.2093 1.0666 -0.0246 -0.1243 -0.3703 183 LYS E C 11153 O O . LYS G 182 ? 0.8717 1.2634 1.0984 -0.0238 -0.1349 -0.3669 183 LYS E O 11154 C CB . LYS G 182 ? 0.7427 1.0887 0.9997 -0.0231 -0.1072 -0.3634 183 LYS E CB 11155 C CG . LYS G 182 ? 0.7605 1.1204 1.0232 -0.0237 -0.1168 -0.3602 183 LYS E CG 11156 C CD . LYS G 182 ? 0.7922 1.1451 1.0727 -0.0247 -0.1119 -0.3604 183 LYS E CD 11157 C CE . LYS G 182 ? 0.8233 1.1908 1.1111 -0.0251 -0.1215 -0.3549 183 LYS E CE 11158 N NZ . LYS G 182 ? 0.8216 1.1800 1.1268 -0.0250 -0.1159 -0.3538 183 LYS E NZ 11159 N N . ALA G 183 ? 0.8432 1.2175 1.0764 -0.0277 -0.1229 -0.3782 184 ALA E N 11160 C CA . ALA G 183 ? 0.8857 1.2774 1.1127 -0.0309 -0.1340 -0.3845 184 ALA E CA 11161 C C . ALA G 183 ? 0.9432 1.3483 1.1520 -0.0284 -0.1429 -0.3838 184 ALA E C 11162 O O . ALA G 183 ? 0.9304 1.3547 1.1354 -0.0286 -0.1546 -0.3826 184 ALA E O 11163 C CB . ALA G 183 ? 0.8383 1.2237 1.0675 -0.0345 -0.1302 -0.3927 184 ALA E CB 11164 N N . ASP G 184 ? 1.0502 1.4462 1.2484 -0.0256 -0.1375 -0.3838 185 ASP E N 11165 C CA . ASP G 184 ? 1.1313 1.5388 1.3112 -0.0223 -0.1448 -0.3831 185 ASP E CA 11166 C C . ASP G 184 ? 1.1061 1.5252 1.2832 -0.0187 -0.1509 -0.3741 185 ASP E C 11167 O O . ASP G 184 ? 1.1389 1.5765 1.3041 -0.0163 -0.1610 -0.3729 185 ASP E O 11168 C CB . ASP G 184 ? 1.2027 1.5966 1.3738 -0.0200 -0.1366 -0.3833 185 ASP E CB 11169 C CG . ASP G 184 ? 1.2809 1.6650 1.4554 -0.0235 -0.1311 -0.3909 185 ASP E CG 11170 O OD1 . ASP G 184 ? 1.3165 1.6998 1.5032 -0.0276 -0.1308 -0.3949 185 ASP E OD1 11171 O OD2 . ASP G 184 ? 1.3044 1.6823 1.4698 -0.0222 -0.1275 -0.3921 185 ASP E OD2 11172 N N . TYR G 185 ? 0.9694 1.3781 1.1579 -0.0181 -0.1449 -0.3672 186 TYR E N 11173 C CA . TYR G 185 ? 0.8326 1.2548 1.0231 -0.0138 -0.1502 -0.3599 186 TYR E CA 11174 C C . TYR G 185 ? 0.8436 1.2977 1.0466 -0.0124 -0.1614 -0.3639 186 TYR E C 11175 O O . TYR G 185 ? 0.8210 1.3055 1.0259 -0.0057 -0.1699 -0.3642 186 TYR E O 11176 C CB . TYR G 185 ? 0.6786 1.0839 0.8817 -0.0124 -0.1407 -0.3554 186 TYR E CB 11177 C CG . TYR G 185 ? 0.5836 1.0139 0.7988 -0.0051 -0.1464 -0.3557 186 TYR E CG 11178 C CD1 . TYR G 185 ? 0.5622 1.0090 0.7682 0.0014 -0.1507 -0.3545 186 TYR E CD1 11179 C CD2 . TYR G 185 ? 0.5989 1.0376 0.8349 -0.0042 -0.1479 -0.3559 186 TYR E CD2 11180 C CE1 . TYR G 185 ? 0.5669 1.0382 0.7840 0.0084 -0.1568 -0.3520 186 TYR E CE1 11181 C CE2 . TYR G 185 ? 0.6029 1.0650 0.8509 0.0026 -0.1541 -0.3537 186 TYR E CE2 11182 C CZ . TYR G 185 ? 0.5892 1.0678 0.8277 0.0090 -0.1587 -0.3510 186 TYR E CZ 11183 O OH . TYR G 185 ? 0.5967 1.1000 0.8478 0.0164 -0.1654 -0.3456 186 TYR E OH 11184 N N . GLU G 186 ? 0.8651 1.3136 1.0770 -0.0184 -0.1617 -0.3652 187 GLU E N 11185 C CA . GLU G 186 ? 0.9009 1.3790 1.1261 -0.0180 -0.1723 -0.3675 187 GLU E CA 11186 C C . GLU G 186 ? 0.9157 1.4152 1.1283 -0.0186 -0.1840 -0.3708 187 GLU E C 11187 O O . GLU G 186 ? 0.9082 1.4408 1.1274 -0.0150 -0.1947 -0.3708 187 GLU E O 11188 C CB . GLU G 186 ? 0.9367 1.4022 1.1758 -0.0244 -0.1689 -0.3675 187 GLU E CB 11189 C CG . GLU G 186 ? 0.9418 1.3829 1.1922 -0.0240 -0.1566 -0.3643 187 GLU E CG 11190 C CD . GLU G 186 ? 0.9769 1.4357 1.2454 -0.0174 -0.1585 -0.3631 187 GLU E CD 11191 O OE1 . GLU G 186 ? 0.9691 1.4082 1.2470 -0.0164 -0.1492 -0.3609 187 GLU E OE1 11192 O OE2 . GLU G 186 ? 0.9971 1.4897 1.2709 -0.0131 -0.1696 -0.3630 187 GLU E OE2 11193 N N . LYS G 187 ? 0.9983 1.4785 1.1927 -0.0229 -0.1820 -0.3724 188 LYS E N 11194 C CA . LYS G 187 ? 1.1375 1.6324 1.3184 -0.0245 -0.1929 -0.3762 188 LYS E CA 11195 C C . LYS G 187 ? 1.1346 1.6585 1.3065 -0.0157 -0.2005 -0.3768 188 LYS E C 11196 O O . LYS G 187 ? 1.1702 1.7171 1.3361 -0.0150 -0.2118 -0.3792 188 LYS E O 11197 C CB . LYS G 187 ? 1.2413 1.7203 1.4127 -0.0269 -0.1877 -0.3865 188 LYS E CB 11198 C CG . LYS G 187 ? 1.3113 1.7771 1.4960 -0.0330 -0.1822 -0.3928 188 LYS E CG 11199 C CD . LYS G 187 ? 1.3830 1.8355 1.5599 -0.0347 -0.1774 -0.4021 188 LYS E CD 11200 C CE . LYS G 187 ? 1.4201 1.8607 1.6113 -0.0403 -0.1718 -0.4071 188 LYS E CE 11201 N NZ . LYS G 187 ? 1.4559 1.8849 1.6409 -0.0421 -0.1679 -0.4150 188 LYS E NZ 11202 N N . HIS G 188 ? 1.0818 1.6050 1.2525 -0.0090 -0.1946 -0.3739 189 HIS E N 11203 C CA . HIS G 188 ? 1.0193 1.5692 1.1799 0.0002 -0.2008 -0.3730 189 HIS E CA 11204 C C . HIS G 188 ? 0.9094 1.4860 1.0857 0.0080 -0.2036 -0.3675 189 HIS E C 11205 O O . HIS G 188 ? 0.8423 1.4126 1.0370 0.0061 -0.1996 -0.3653 189 HIS E O 11206 C CB . HIS G 188 ? 1.0823 1.6124 1.2254 0.0024 -0.1934 -0.3725 189 HIS E CB 11207 C CG . HIS G 188 ? 1.1202 1.6247 1.2474 -0.0044 -0.1912 -0.3757 189 HIS E CG 11208 N ND1 . HIS G 188 ? 1.1219 1.5987 1.2554 -0.0118 -0.1829 -0.3781 189 HIS E ND1 11209 C CD2 . HIS G 188 ? 1.1135 1.6206 1.2210 -0.0034 -0.1962 -0.3787 189 HIS E CD2 11210 C CE1 . HIS G 188 ? 1.1170 1.5896 1.2407 -0.0130 -0.1829 -0.3874 189 HIS E CE1 11211 N NE2 . HIS G 188 ? 1.1001 1.5884 1.2067 -0.0085 -0.1911 -0.3874 189 HIS E NE2 11212 N N . LYS G 189 ? 0.9208 1.5271 1.0896 0.0171 -0.2106 -0.3643 190 LYS E N 11213 C CA . LYS G 189 ? 0.9684 1.6049 1.1519 0.0253 -0.2153 -0.3560 190 LYS E CA 11214 C C . LYS G 189 ? 0.9520 1.5939 1.1290 0.0342 -0.2122 -0.3498 190 LYS E C 11215 O O . LYS G 189 ? 0.9461 1.5822 1.1365 0.0362 -0.2075 -0.3444 190 LYS E O 11216 C CB . LYS G 189 ? 1.0213 1.6965 1.2057 0.0296 -0.2282 -0.3531 190 LYS E CB 11217 C CG . LYS G 189 ? 1.0953 1.7701 1.2872 0.0210 -0.2334 -0.3579 190 LYS E CG 11218 C CD . LYS G 189 ? 1.0994 1.7751 1.3172 0.0182 -0.2319 -0.3539 190 LYS E CD 11219 C CE . LYS G 189 ? 1.0734 1.7548 1.2994 0.0105 -0.2386 -0.3569 190 LYS E CE 11220 N NZ . LYS G 189 ? 1.0415 1.7282 1.2938 0.0090 -0.2377 -0.3520 190 LYS E NZ 11221 N N . VAL G 190 ? 0.9864 1.6396 1.1432 0.0398 -0.2152 -0.3500 191 VAL E N 11222 C CA . VAL G 190 ? 0.9813 1.6458 1.1306 0.0495 -0.2138 -0.3423 191 VAL E CA 11223 C C . VAL G 190 ? 0.9454 1.5754 1.0848 0.0463 -0.2029 -0.3455 191 VAL E C 11224 O O . VAL G 190 ? 0.9754 1.5823 1.1015 0.0405 -0.1987 -0.3529 191 VAL E O 11225 C CB . VAL G 190 ? 1.0370 1.7324 1.1685 0.0585 -0.2219 -0.3395 191 VAL E CB 11226 C CG1 . VAL G 190 ? 1.0310 1.7389 1.1544 0.0692 -0.2200 -0.3296 191 VAL E CG1 11227 C CG2 . VAL G 190 ? 1.0688 1.7993 1.2104 0.0622 -0.2326 -0.3342 191 VAL E CG2 11228 N N . TYR G 191 ? 0.8673 1.4941 1.0143 0.0500 -0.1986 -0.3383 192 TYR E N 11229 C CA . TYR G 191 ? 0.7487 1.3446 0.8878 0.0473 -0.1885 -0.3394 192 TYR E CA 11230 C C . TYR G 191 ? 0.6935 1.3071 0.8256 0.0575 -0.1898 -0.3295 192 TYR E C 11231 O O . TYR G 191 ? 0.6394 1.2678 0.7858 0.0626 -0.1926 -0.3194 192 TYR E O 11232 C CB . TYR G 191 ? 0.6654 1.2302 0.8219 0.0393 -0.1803 -0.3407 192 TYR E CB 11233 C CG . TYR G 191 ? 0.6508 1.1934 0.8116 0.0293 -0.1768 -0.3486 192 TYR E CG 11234 C CD1 . TYR G 191 ? 0.7066 1.2642 0.8819 0.0275 -0.1829 -0.3499 192 TYR E CD1 11235 C CD2 . TYR G 191 ? 0.6773 1.1849 0.8281 0.0219 -0.1677 -0.3524 192 TYR E CD2 11236 C CE1 . TYR G 191 ? 0.7516 1.2903 0.9306 0.0186 -0.1801 -0.3558 192 TYR E CE1 11237 C CE2 . TYR G 191 ? 0.7700 1.2584 0.9245 0.0132 -0.1648 -0.3566 192 TYR E CE2 11238 C CZ . TYR G 191 ? 0.8010 1.3051 0.9693 0.0116 -0.1712 -0.3588 192 TYR E CZ 11239 O OH . TYR G 191 ? 0.8498 1.3361 1.0216 0.0032 -0.1688 -0.3621 192 TYR E OH 11240 N N . ALA G 192 ? 0.6791 1.2911 0.7901 0.0607 -0.1879 -0.3307 193 ALA E N 11241 C CA . ALA G 192 ? 0.6911 1.3242 0.7927 0.0716 -0.1898 -0.3200 193 ALA E CA 11242 C C . ALA G 192 ? 0.6820 1.2880 0.7728 0.0695 -0.1808 -0.3203 193 ALA E C 11243 O O . ALA G 192 ? 0.6919 1.2660 0.7766 0.0610 -0.1735 -0.3288 193 ALA E O 11244 C CB . ALA G 192 ? 0.7190 1.3841 0.8038 0.0807 -0.1971 -0.3183 193 ALA E CB 11245 N N . CYS G 193 ? 0.6911 1.3110 0.7807 0.0775 -0.1815 -0.3083 194 CYS E N 11246 C CA . CYS G 193 ? 0.7102 1.3092 0.7900 0.0765 -0.1740 -0.3062 194 CYS E CA 11247 C C . CYS G 193 ? 0.7692 1.3979 0.8320 0.0895 -0.1774 -0.2951 194 CYS E C 11248 O O . CYS G 193 ? 0.8057 1.4605 0.8750 0.0984 -0.1823 -0.2796 194 CYS E O 11249 C CB . CYS G 193 ? 0.7244 1.3049 0.8222 0.0721 -0.1705 -0.3008 194 CYS E CB 11250 S SG . CYS G 193 ? 1.3150 1.8761 1.4028 0.0721 -0.1633 -0.2944 194 CYS E SG 11251 N N . GLU G 194 ? 0.8221 1.4464 0.8642 0.0910 -0.1745 -0.3008 195 GLU E N 11252 C CA . GLU G 194 ? 0.8800 1.5319 0.9041 0.1039 -0.1767 -0.2906 195 GLU E CA 11253 C C . GLU G 194 ? 0.8039 1.4403 0.8202 0.1045 -0.1698 -0.2843 195 GLU E C 11254 O O . GLU G 194 ? 0.7555 1.3572 0.7686 0.0952 -0.1621 -0.2932 195 GLU E O 11255 C CB . GLU G 194 ? 1.0013 1.6604 1.0074 0.1068 -0.1785 -0.2995 195 GLU E CB 11256 C CG . GLU G 194 ? 1.1118 1.8045 1.0998 0.1218 -0.1816 -0.2887 195 GLU E CG 11257 C CD . GLU G 194 ? 1.1869 1.8901 1.1602 0.1250 -0.1857 -0.2977 195 GLU E CD 11258 O OE1 . GLU G 194 ? 1.2187 1.9199 1.1994 0.1188 -0.1903 -0.3071 195 GLU E OE1 11259 O OE2 . GLU G 194 ? 1.2297 1.9426 1.1839 0.1337 -0.1845 -0.2949 195 GLU E OE2 11260 N N . VAL G 195 ? 0.7856 1.4477 0.7998 0.1155 -0.1723 -0.2664 196 VAL E N 11261 C CA . VAL G 195 ? 0.8180 1.4685 0.8271 0.1163 -0.1668 -0.2573 196 VAL E CA 11262 C C . VAL G 195 ? 0.8535 1.5306 0.8424 0.1303 -0.1667 -0.2439 196 VAL E C 11263 O O . VAL G 195 ? 0.8733 1.5852 0.8628 0.1422 -0.1718 -0.2271 196 VAL E O 11264 C CB . VAL G 195 ? 0.7821 1.4331 0.8124 0.1155 -0.1691 -0.2429 196 VAL E CB 11265 C CG1 . VAL G 195 ? 0.7713 1.4108 0.7966 0.1160 -0.1643 -0.2322 196 VAL E CG1 11266 C CG2 . VAL G 195 ? 0.7111 1.3347 0.7619 0.1022 -0.1684 -0.2560 196 VAL E CG2 11267 N N . THR G 196 ? 0.8171 1.4767 0.7894 0.1290 -0.1599 -0.2496 197 THR E N 11268 C CA . THR G 196 ? 0.8498 1.5317 0.8028 0.1422 -0.1583 -0.2368 197 THR E CA 11269 C C . THR G 196 ? 0.8253 1.4961 0.7766 0.1420 -0.1529 -0.2240 197 THR E C 11270 O O . THR G 196 ? 0.7896 1.4253 0.7432 0.1305 -0.1472 -0.2340 197 THR E O 11271 C CB . THR G 196 ? 0.8753 1.5501 0.8098 0.1431 -0.1554 -0.2505 197 THR E CB 11272 O OG1 . THR G 196 ? 0.9054 1.5877 0.8424 0.1417 -0.1612 -0.2624 197 THR E OG1 11273 C CG2 . THR G 196 ? 0.8528 1.5546 0.7682 0.1586 -0.1540 -0.2366 197 THR E CG2 11274 N N . HIS G 197 ? 0.8437 1.5436 0.7919 0.1547 -0.1542 -0.1999 198 HIS E N 11275 C CA . HIS G 197 ? 0.8201 1.5138 0.7688 0.1557 -0.1502 -0.1824 198 HIS E CA 11276 C C . HIS G 197 ? 0.8654 1.5930 0.8038 0.1722 -0.1492 -0.1560 198 HIS E C 11277 O O . HIS G 197 ? 0.8878 1.6448 0.8270 0.1820 -0.1531 -0.1468 198 HIS E O 11278 C CB . HIS G 197 ? 0.7806 1.4635 0.7550 0.1482 -0.1538 -0.1741 198 HIS E CB 11279 C CG . HIS G 197 ? 0.7800 1.4560 0.7590 0.1485 -0.1509 -0.1536 198 HIS E CG 11280 N ND1 . HIS G 197 ? 0.7728 1.4652 0.7707 0.1551 -0.1539 -0.1239 198 HIS E ND1 11281 C CD2 . HIS G 197 ? 0.7726 1.4252 0.7416 0.1427 -0.1448 -0.1569 198 HIS E CD2 11282 C CE1 . HIS G 197 ? 0.7646 1.4445 0.7645 0.1534 -0.1501 -0.1092 198 HIS E CE1 11283 N NE2 . HIS G 197 ? 0.7578 1.4151 0.7393 0.1459 -0.1452 -0.1294 198 HIS E NE2 11284 N N . GLN G 198 ? 0.8893 1.6116 0.8186 0.1749 -0.1431 -0.1431 199 GLN E N 11285 C CA . GLN G 198 ? 0.9743 1.7247 0.8931 0.1900 -0.1396 -0.1173 199 GLN E CA 11286 C C . GLN G 198 ? 0.9660 1.7417 0.9023 0.1978 -0.1434 -0.0889 199 GLN E C 11287 O O . GLN G 198 ? 1.0496 1.8530 0.9788 0.2107 -0.1415 -0.0713 199 GLN E O 11288 C CB . GLN G 198 ? 1.0368 1.7731 0.9482 0.1892 -0.1323 -0.1054 199 GLN E CB 11289 C CG . GLN G 198 ? 1.1280 1.8890 1.0253 0.2041 -0.1263 -0.0829 199 GLN E CG 11290 C CD . GLN G 198 ? 1.1886 1.9370 1.0837 0.2029 -0.1194 -0.0651 199 GLN E CD 11291 O OE1 . GLN G 198 ? 1.1804 1.9116 1.0916 0.1943 -0.1208 -0.0551 199 GLN E OE1 11292 N NE2 . GLN G 198 ? 1.2297 1.9863 1.1065 0.2115 -0.1120 -0.0604 199 GLN E NE2 11293 N N . GLY G 199 ? 0.8875 1.6515 0.8482 0.1898 -0.1481 -0.0845 200 GLY E N 11294 C CA . GLY G 199 ? 0.8717 1.6526 0.8534 0.1957 -0.1507 -0.0564 200 GLY E CA 11295 C C . GLY G 199 ? 0.8991 1.7003 0.8871 0.1993 -0.1568 -0.0623 200 GLY E C 11296 O O . GLY G 199 ? 0.8939 1.7074 0.9007 0.2035 -0.1592 -0.0411 200 GLY E O 11297 N N . LEU G 200 ? 0.9175 1.7202 0.8906 0.1974 -0.1591 -0.0905 201 LEU E N 11298 C CA . LEU G 200 ? 0.9401 1.7618 0.9178 0.2001 -0.1652 -0.0978 201 LEU E CA 11299 C C . LEU G 200 ? 1.0502 1.8993 1.0060 0.2122 -0.1640 -0.0983 201 LEU E C 11300 O O . LEU G 200 ? 1.0221 1.8667 0.9566 0.2141 -0.1598 -0.1106 201 LEU E O 11301 C CB . LEU G 200 ? 0.8689 1.6696 0.8511 0.1873 -0.1693 -0.1290 201 LEU E CB 11302 C CG . LEU G 200 ? 0.8228 1.5974 0.8293 0.1752 -0.1710 -0.1315 201 LEU E CG 11303 C CD1 . LEU G 200 ? 0.8420 1.5937 0.8496 0.1622 -0.1730 -0.1635 201 LEU E CD1 11304 C CD2 . LEU G 200 ? 0.7574 1.5464 0.7898 0.1794 -0.1750 -0.1082 201 LEU E CD2 11305 N N . SER G 201 ? 1.1525 2.0291 1.1148 0.2206 -0.1674 -0.0848 202 SER E N 11306 C CA . SER G 201 ? 1.2159 2.1208 1.1598 0.2324 -0.1672 -0.0850 202 SER E CA 11307 C C . SER G 201 ? 1.2032 2.1018 1.1322 0.2281 -0.1704 -0.1174 202 SER E C 11308 O O . SER G 201 ? 1.2018 2.1090 1.1100 0.2352 -0.1678 -0.1247 202 SER E O 11309 C CB . SER G 201 ? 1.2727 2.2053 1.2294 0.2398 -0.1710 -0.0663 202 SER E CB 11310 O OG . SER G 201 ? 1.3694 2.3297 1.3088 0.2510 -0.1712 -0.0678 202 SER E OG 11311 N N . SER G 202 ? 1.1933 2.0751 1.1347 0.2163 -0.1757 -0.1358 203 SER E N 11312 C CA . SER G 202 ? 1.1938 2.0640 1.1259 0.2095 -0.1788 -0.1654 203 SER E CA 11313 C C . SER G 202 ? 1.1551 1.9985 1.1056 0.1942 -0.1819 -0.1807 203 SER E C 11314 O O . SER G 202 ? 1.1045 1.9496 1.0759 0.1919 -0.1842 -0.1678 203 SER E O 11315 C CB . SER G 202 ? 1.2053 2.1049 1.1309 0.2179 -0.1843 -0.1673 203 SER E CB 11316 O OG . SER G 202 ? 1.1874 2.1065 1.1313 0.2203 -0.1891 -0.1516 203 SER E OG 11317 N N . PRO G 203 ? 1.1675 1.9844 1.1119 0.1836 -0.1811 -0.2067 204 PRO E N 11318 C CA . PRO G 203 ? 1.1181 1.9049 1.0786 0.1680 -0.1821 -0.2229 204 PRO E CA 11319 C C . PRO G 203 ? 1.0600 1.8573 1.0439 0.1655 -0.1882 -0.2164 204 PRO E C 11320 O O . PRO G 203 ? 1.0618 1.8832 1.0475 0.1705 -0.1941 -0.2148 204 PRO E O 11321 C CB . PRO G 203 ? 1.1519 1.9244 1.1017 0.1619 -0.1828 -0.2466 204 PRO E CB 11322 C CG . PRO G 203 ? 1.1762 1.9529 1.1032 0.1705 -0.1785 -0.2453 204 PRO E CG 11323 C CD . PRO G 203 ? 1.1885 2.0002 1.1109 0.1861 -0.1785 -0.2206 204 PRO E CD 11324 N N . VAL G 204 ? 0.9988 1.7772 1.0011 0.1579 -0.1868 -0.2123 205 VAL E N 11325 C CA . VAL G 204 ? 0.9480 1.7334 0.9757 0.1558 -0.1918 -0.2040 205 VAL E CA 11326 C C . VAL G 204 ? 0.9003 1.6578 0.9408 0.1411 -0.1923 -0.2256 205 VAL E C 11327 O O . VAL G 204 ? 0.8555 1.5797 0.8958 0.1309 -0.1869 -0.2379 205 VAL E O 11328 C CB . VAL G 204 ? 0.8772 1.6621 0.9215 0.1589 -0.1902 -0.1801 205 VAL E CB 11329 C CG1 . VAL G 204 ? 0.7853 1.5688 0.8592 0.1550 -0.1942 -0.1741 205 VAL E CG1 11330 C CG2 . VAL G 204 ? 0.9199 1.7346 0.9559 0.1739 -0.1894 -0.1538 205 VAL E CG2 11331 N N . THR G 205 ? 0.9002 1.6708 0.9521 0.1402 -0.1982 -0.2291 206 THR E N 11332 C CA . THR G 205 ? 0.8566 1.6030 0.9203 0.1269 -0.1983 -0.2483 206 THR E CA 11333 C C . THR G 205 ? 0.8037 1.5544 0.8957 0.1250 -0.2020 -0.2395 206 THR E C 11334 O O . THR G 205 ? 0.8218 1.6024 0.9233 0.1343 -0.2070 -0.2224 206 THR E O 11335 C CB . THR G 205 ? 0.9050 1.6581 0.9574 0.1252 -0.2018 -0.2636 206 THR E CB 11336 O OG1 . THR G 205 ? 0.9848 1.7356 1.0124 0.1286 -0.1988 -0.2698 206 THR E OG1 11337 C CG2 . THR G 205 ? 0.8806 1.6040 0.9437 0.1108 -0.2002 -0.2820 206 THR E CG2 11338 N N . LYS G 206 ? 0.7658 1.4850 0.8720 0.1133 -0.1984 -0.2503 207 LYS E N 11339 C CA . LYS G 206 ? 0.7584 1.4769 0.8922 0.1101 -0.2011 -0.2461 207 LYS E CA 11340 C C . LYS G 206 ? 0.7168 1.4164 0.8538 0.0985 -0.2004 -0.2670 207 LYS E C 11341 O O . LYS G 206 ? 0.6560 1.3261 0.7813 0.0894 -0.1944 -0.2832 207 LYS E O 11342 C CB . LYS G 206 ? 0.7666 1.4638 0.9177 0.1071 -0.1971 -0.2379 207 LYS E CB 11343 C CG . LYS G 206 ? 0.7922 1.5055 0.9431 0.1182 -0.1972 -0.2138 207 LYS E CG 11344 C CD . LYS G 206 ? 0.8330 1.5780 1.0015 0.1298 -0.2022 -0.1897 207 LYS E CD 11345 C CE . LYS G 206 ? 0.8359 1.5919 1.0058 0.1404 -0.2005 -0.1626 207 LYS E CE 11346 N NZ . LYS G 206 ? 0.8293 1.6096 1.0186 0.1510 -0.2033 -0.1368 207 LYS E NZ 11347 N N . SER G 207 ? 0.8203 1.5362 0.9739 0.0991 -0.2058 -0.2646 208 SER E N 11348 C CA . SER G 207 ? 0.8507 1.5530 1.0069 0.0890 -0.2059 -0.2819 208 SER E CA 11349 C C . SER G 207 ? 0.8136 1.5194 0.9971 0.0867 -0.2085 -0.2782 208 SER E C 11350 O O . SER G 207 ? 0.7920 1.5155 0.9933 0.0943 -0.2112 -0.2609 208 SER E O 11351 C CB . SER G 207 ? 0.8891 1.6131 1.0281 0.0922 -0.2113 -0.2874 208 SER E CB 11352 O OG . SER G 207 ? 0.8858 1.6487 1.0316 0.1026 -0.2192 -0.2724 208 SER E OG 11353 N N . PHE G 208 ? 0.8186 1.5069 1.0063 0.0765 -0.2071 -0.2930 209 PHE E N 11354 C CA . PHE G 208 ? 0.8367 1.5300 1.0491 0.0742 -0.2096 -0.2907 209 PHE E CA 11355 C C . PHE G 208 ? 0.9031 1.5921 1.1131 0.0660 -0.2113 -0.3044 209 PHE E C 11356 O O . PHE G 208 ? 0.9800 1.6472 1.1734 0.0589 -0.2073 -0.3176 209 PHE E O 11357 C CB . PHE G 208 ? 0.8623 1.5263 1.0931 0.0691 -0.2028 -0.2908 209 PHE E CB 11358 C CG . PHE G 208 ? 0.9070 1.5285 1.1305 0.0566 -0.1937 -0.3078 209 PHE E CG 11359 C CD1 . PHE G 208 ? 0.8755 1.4832 1.1075 0.0483 -0.1917 -0.3176 209 PHE E CD1 11360 C CD2 . PHE G 208 ? 0.9285 1.5237 1.1377 0.0537 -0.1863 -0.3115 209 PHE E CD2 11361 C CE1 . PHE G 208 ? 0.8846 1.4531 1.1106 0.0381 -0.1820 -0.3291 209 PHE E CE1 11362 C CE2 . PHE G 208 ? 0.9226 1.4778 1.1261 0.0432 -0.1764 -0.3233 209 PHE E CE2 11363 C CZ . PHE G 208 ? 0.9207 1.4625 1.1327 0.0357 -0.1739 -0.3311 209 PHE E CZ 11364 N N . ASN G 209 ? 0.8519 1.5616 1.0800 0.0675 -0.2171 -0.2992 210 ASN E N 11365 C CA . ASN G 209 ? 0.8331 1.5393 1.0637 0.0593 -0.2193 -0.3100 210 ASN E CA 11366 C C . ASN G 209 ? 0.7575 1.4376 1.0076 0.0513 -0.2132 -0.3147 210 ASN E C 11367 O O . ASN G 209 ? 0.7665 1.4500 1.0373 0.0553 -0.2123 -0.3050 210 ASN E O 11368 C CB . ASN G 209 ? 0.8267 1.5728 1.0646 0.0654 -0.2296 -0.3013 210 ASN E CB 11369 C CG . ASN G 209 ? 0.8158 1.5891 1.0347 0.0746 -0.2352 -0.2952 210 ASN E CG 11370 O OD1 . ASN G 209 ? 0.8210 1.5848 1.0169 0.0724 -0.2343 -0.3050 210 ASN E OD1 11371 N ND2 . ASN G 209 ? 0.8327 1.6391 1.0616 0.0855 -0.2404 -0.2776 210 ASN E ND2 11372 N N . ARG G 210 ? 0.7060 1.3595 0.9501 0.0408 -0.2087 -0.3280 211 ARG E N 11373 C CA . ARG G 210 ? 0.7182 1.3448 0.9783 0.0332 -0.2017 -0.3326 211 ARG E CA 11374 C C . ARG G 210 ? 0.7969 1.4461 1.0822 0.0354 -0.2073 -0.3257 211 ARG E C 11375 O O . ARG G 210 ? 0.7948 1.4744 1.0822 0.0379 -0.2163 -0.3220 211 ARG E O 11376 C CB . ARG G 210 ? 0.6980 1.2960 0.9462 0.0227 -0.1963 -0.3447 211 ARG E CB 11377 C CG . ARG G 210 ? 0.7092 1.2795 0.9721 0.0154 -0.1884 -0.3484 211 ARG E CG 11378 C CD . ARG G 210 ? 0.8011 1.3440 1.0514 0.0061 -0.1828 -0.3564 211 ARG E CD 11379 N NE . ARG G 210 ? 0.9137 1.4770 1.1563 0.0042 -0.1923 -0.3591 211 ARG E NE 11380 C CZ . ARG G 210 ? 0.9460 1.5230 1.2010 0.0007 -0.1982 -0.3596 211 ARG E CZ 11381 N NH1 . ARG G 210 ? 0.9306 1.5042 1.2066 -0.0006 -0.1953 -0.3575 211 ARG E NH1 11382 N NH2 . ARG G 210 ? 0.9784 1.5727 1.2252 -0.0014 -0.2074 -0.3619 211 ARG E NH2 11383 O OXT . ARG G 210 ? 0.8486 1.4860 1.1532 0.0349 -0.2027 -0.3230 211 ARG E OXT 11384 N N . GLN H 1 ? 0.6254 0.6461 0.8296 -0.0204 -0.0066 0.0052 1 GLN F N 11385 C CA . GLN H 1 ? 0.6157 0.6268 0.8178 -0.0219 -0.0068 -0.0043 1 GLN F CA 11386 C C . GLN H 1 ? 0.5155 0.5176 0.6958 -0.0212 -0.0040 -0.0104 1 GLN F C 11387 O O . GLN H 1 ? 0.6311 0.6285 0.8097 -0.0229 -0.0013 -0.0134 1 GLN F O 11388 C CB . GLN H 1 ? 0.6137 0.6244 0.8208 -0.0207 -0.0105 -0.0074 1 GLN F CB 11389 C CG . GLN H 1 ? 0.6894 0.7088 0.9214 -0.0214 -0.0131 -0.0012 1 GLN F CG 11390 C CD . GLN H 1 ? 0.6497 0.6703 0.9007 -0.0243 -0.0126 -0.0010 1 GLN F CD 11391 O OE1 . GLN H 1 ? 0.5579 0.5738 0.8175 -0.0256 -0.0143 -0.0085 1 GLN F OE1 11392 N NE2 . GLN H 1 ? 0.7942 0.8215 1.0521 -0.0250 -0.0104 0.0075 1 GLN F NE2 11393 N N . VAL H 2 ? 0.4015 0.4013 0.5666 -0.0186 -0.0042 -0.0117 2 VAL F N 11394 C CA . VAL H 2 ? 0.1866 0.1782 0.3320 -0.0174 -0.0012 -0.0163 2 VAL F CA 11395 C C . VAL H 2 ? 0.1974 0.1892 0.3385 -0.0182 0.0018 -0.0140 2 VAL F C 11396 O O . VAL H 2 ? 0.2864 0.2856 0.4301 -0.0176 0.0010 -0.0082 2 VAL F O 11397 C CB . VAL H 2 ? 0.3517 0.3424 0.4837 -0.0143 -0.0020 -0.0163 2 VAL F CB 11398 C CG1 . VAL H 2 ? 0.4248 0.4064 0.5393 -0.0129 0.0013 -0.0216 2 VAL F CG1 11399 C CG2 . VAL H 2 ? 0.4965 0.4898 0.6366 -0.0135 -0.0062 -0.0172 2 VAL F CG2 11400 N N . GLN H 3 ? 0.2289 0.2132 0.3644 -0.0191 0.0051 -0.0185 3 GLN F N 11401 C CA . GLN H 3 ? 0.2624 0.2454 0.3937 -0.0197 0.0076 -0.0178 3 GLN F CA 11402 C C . GLN H 3 ? 0.2540 0.2279 0.3707 -0.0182 0.0112 -0.0221 3 GLN F C 11403 O O . GLN H 3 ? 0.2643 0.2323 0.3761 -0.0174 0.0129 -0.0259 3 GLN F O 11404 C CB . GLN H 3 ? 0.1988 0.1820 0.3426 -0.0228 0.0085 -0.0177 3 GLN F CB 11405 C CG . GLN H 3 ? 0.4011 0.3944 0.5602 -0.0240 0.0056 -0.0117 3 GLN F CG 11406 C CD . GLN H 3 ? 0.5490 0.5431 0.7179 -0.0265 0.0066 -0.0108 3 GLN F CD 11407 O OE1 . GLN H 3 ? 0.7239 0.7144 0.8867 -0.0267 0.0084 -0.0128 3 GLN F OE1 11408 N NE2 . GLN H 3 ? 0.5561 0.5550 0.7420 -0.0285 0.0054 -0.0079 3 GLN F NE2 11409 N N . LEU H 4 ? 0.1776 0.1511 0.2881 -0.0175 0.0124 -0.0214 4 LEU F N 11410 C CA . LEU H 4 ? 0.1901 0.1551 0.2905 -0.0162 0.0166 -0.0245 4 LEU F CA 11411 C C . LEU H 4 ? 0.2774 0.2396 0.3838 -0.0182 0.0188 -0.0256 4 LEU F C 11412 O O . LEU H 4 ? 0.3387 0.3067 0.4528 -0.0196 0.0163 -0.0238 4 LEU F O 11413 C CB . LEU H 4 ? 0.2499 0.2153 0.3396 -0.0135 0.0163 -0.0237 4 LEU F CB 11414 C CG . LEU H 4 ? 0.3225 0.2922 0.4070 -0.0113 0.0135 -0.0217 4 LEU F CG 11415 C CD1 . LEU H 4 ? 0.2771 0.2433 0.3499 -0.0085 0.0152 -0.0221 4 LEU F CD1 11416 C CD2 . LEU H 4 ? 0.3149 0.2834 0.4005 -0.0112 0.0124 -0.0229 4 LEU F CD2 11417 N N . GLN H 5 ? 0.2512 0.2050 0.3548 -0.0179 0.0237 -0.0280 5 GLN F N 11418 C CA . GLN H 5 ? 0.2858 0.2361 0.3965 -0.0197 0.0262 -0.0290 5 GLN F CA 11419 C C . GLN H 5 ? 0.2816 0.2235 0.3858 -0.0176 0.0317 -0.0303 5 GLN F C 11420 O O . GLN H 5 ? 0.3140 0.2515 0.4103 -0.0155 0.0350 -0.0306 5 GLN F O 11421 C CB . GLN H 5 ? 0.3257 0.2754 0.4475 -0.0223 0.0272 -0.0294 5 GLN F CB 11422 C CG . GLN H 5 ? 0.3682 0.3172 0.5012 -0.0248 0.0279 -0.0296 5 GLN F CG 11423 C CD . GLN H 5 ? 0.4139 0.3722 0.5537 -0.0261 0.0221 -0.0276 5 GLN F CD 11424 O OE1 . GLN H 5 ? 0.4508 0.4163 0.5878 -0.0252 0.0183 -0.0253 5 GLN F OE1 11425 N NE2 . GLN H 5 ? 0.3901 0.3488 0.5392 -0.0278 0.0215 -0.0282 5 GLN F NE2 11426 N N . GLN H 6 ? 0.2550 0.1951 0.3632 -0.0179 0.0325 -0.0310 6 GLN F N 11427 C CA . GLN H 6 ? 0.3150 0.2477 0.4195 -0.0158 0.0378 -0.0312 6 GLN F CA 11428 C C . GLN H 6 ? 0.3211 0.2484 0.4374 -0.0173 0.0417 -0.0319 6 GLN F C 11429 O O . GLN H 6 ? 0.3856 0.3158 0.5127 -0.0201 0.0389 -0.0330 6 GLN F O 11430 C CB . GLN H 6 ? 0.3453 0.2798 0.4445 -0.0139 0.0355 -0.0317 6 GLN F CB 11431 C CG . GLN H 6 ? 0.4038 0.3443 0.5096 -0.0153 0.0300 -0.0337 6 GLN F CG 11432 C CD . GLN H 6 ? 0.3988 0.3421 0.4980 -0.0129 0.0275 -0.0347 6 GLN F CD 11433 O OE1 . GLN H 6 ? 0.3898 0.3407 0.4841 -0.0121 0.0230 -0.0339 6 GLN F OE1 11434 N NE2 . GLN H 6 ? 0.3680 0.3054 0.4684 -0.0114 0.0308 -0.0362 6 GLN F NE2 11435 N N . TRP H 7 ? 0.2810 0.2009 0.3961 -0.0152 0.0485 -0.0307 7 TRP F N 11436 C CA . TRP H 7 ? 0.2562 0.1705 0.3844 -0.0162 0.0533 -0.0305 7 TRP F CA 11437 C C . TRP H 7 ? 0.2772 0.1853 0.4050 -0.0131 0.0593 -0.0285 7 TRP F C 11438 O O . TRP H 7 ? 0.3472 0.2550 0.4630 -0.0100 0.0606 -0.0269 7 TRP F O 11439 C CB . TRP H 7 ? 0.2524 0.1641 0.3840 -0.0169 0.0577 -0.0293 7 TRP F CB 11440 C CG . TRP H 7 ? 0.3787 0.2880 0.4970 -0.0133 0.0624 -0.0276 7 TRP F CG 11441 C CD1 . TRP H 7 ? 0.3351 0.2385 0.4499 -0.0095 0.0707 -0.0246 7 TRP F CD1 11442 C CD2 . TRP H 7 ? 0.2868 0.2002 0.3943 -0.0125 0.0589 -0.0288 7 TRP F CD2 11443 N NE1 . TRP H 7 ? 0.3467 0.2507 0.4470 -0.0061 0.0721 -0.0244 7 TRP F NE1 11444 C CE2 . TRP H 7 ? 0.3105 0.2204 0.4070 -0.0082 0.0646 -0.0276 7 TRP F CE2 11445 C CE3 . TRP H 7 ? 0.2623 0.1826 0.3694 -0.0148 0.0515 -0.0306 7 TRP F CE3 11446 C CZ2 . TRP H 7 ? 0.3358 0.2486 0.4210 -0.0062 0.0622 -0.0294 7 TRP F CZ2 11447 C CZ3 . TRP H 7 ? 0.3698 0.2925 0.4679 -0.0133 0.0496 -0.0317 7 TRP F CZ3 11448 C CH2 . TRP H 7 ? 0.3193 0.2381 0.4065 -0.0091 0.0545 -0.0318 7 TRP F CH2 11449 N N . GLY H 8 ? 0.3090 0.2124 0.4518 -0.0139 0.0630 -0.0282 8 GLY F N 11450 C CA . GLY H 8 ? 0.2171 0.1149 0.3643 -0.0112 0.0691 -0.0256 8 GLY F CA 11451 C C . GLY H 8 ? 0.3490 0.2516 0.5114 -0.0127 0.0659 -0.0270 8 GLY F C 11452 O O . GLY H 8 ? 0.3186 0.2269 0.4862 -0.0154 0.0585 -0.0310 8 GLY F O 11453 N N . ALA H 9 ? 0.3639 0.2641 0.5340 -0.0105 0.0715 -0.0237 9 ALA F N 11454 C CA . ALA H 9 ? 0.3456 0.2502 0.5325 -0.0116 0.0691 -0.0251 9 ALA F CA 11455 C C . ALA H 9 ? 0.4383 0.3462 0.6279 -0.0128 0.0603 -0.0317 9 ALA F C 11456 O O . ALA H 9 ? 0.3855 0.2908 0.5685 -0.0113 0.0597 -0.0331 9 ALA F O 11457 C CB . ALA H 9 ? 0.3517 0.2534 0.5476 -0.0087 0.0774 -0.0197 9 ALA F CB 11458 N N . GLY H 10 ? 0.4908 0.4043 0.6903 -0.0150 0.0538 -0.0359 10 GLY F N 11459 C CA . GLY H 10 ? 0.4693 0.3862 0.6718 -0.0156 0.0452 -0.0431 10 GLY F CA 11460 C C . GLY H 10 ? 0.4336 0.3516 0.6512 -0.0146 0.0441 -0.0457 10 GLY F C 11461 O O . GLY H 10 ? 0.5175 0.4378 0.7376 -0.0144 0.0373 -0.0526 10 GLY F O 11462 N N . LEU H 11 ? 0.3407 0.2574 0.5694 -0.0138 0.0509 -0.0407 11 LEU F N 11463 C CA . LEU H 11 ? 0.3541 0.2725 0.6005 -0.0130 0.0504 -0.0426 11 LEU F CA 11464 C C . LEU H 11 ? 0.3958 0.3099 0.6456 -0.0107 0.0597 -0.0360 11 LEU F C 11465 O O . LEU H 11 ? 0.4561 0.3681 0.7058 -0.0097 0.0681 -0.0286 11 LEU F O 11466 C CB . LEU H 11 ? 0.2869 0.2099 0.5506 -0.0141 0.0489 -0.0431 11 LEU F CB 11467 C CG . LEU H 11 ? 0.3923 0.3178 0.6777 -0.0134 0.0480 -0.0456 11 LEU F CG 11468 C CD1 . LEU H 11 ? 0.4245 0.3520 0.7112 -0.0133 0.0387 -0.0550 11 LEU F CD1 11469 C CD2 . LEU H 11 ? 0.3895 0.3194 0.6924 -0.0142 0.0475 -0.0451 11 LEU F CD2 11470 N N . LEU H 12 ? 0.3571 0.2703 0.6104 -0.0094 0.0583 -0.0388 12 LEU F N 11471 C CA . LEU H 12 ? 0.4361 0.3458 0.6943 -0.0070 0.0668 -0.0324 12 LEU F CA 11472 C C . LEU H 12 ? 0.4063 0.3189 0.6856 -0.0068 0.0649 -0.0356 12 LEU F C 11473 O O . LEU H 12 ? 0.4832 0.3986 0.7663 -0.0076 0.0562 -0.0444 12 LEU F O 11474 C CB . LEU H 12 ? 0.4419 0.3467 0.6821 -0.0051 0.0685 -0.0311 12 LEU F CB 11475 C CG . LEU H 12 ? 0.5061 0.4081 0.7251 -0.0053 0.0688 -0.0296 12 LEU F CG 11476 C CD1 . LEU H 12 ? 0.5043 0.4026 0.7089 -0.0032 0.0683 -0.0305 12 LEU F CD1 11477 C CD2 . LEU H 12 ? 0.5925 0.4917 0.8087 -0.0040 0.0781 -0.0210 12 LEU F CD2 11478 N N . LYS H 13 ? 0.4178 0.3301 0.7117 -0.0053 0.0733 -0.0285 13 LYS F N 11479 C CA . LYS H 13 ? 0.3871 0.3018 0.7023 -0.0048 0.0728 -0.0306 13 LYS F CA 11480 C C . LYS H 13 ? 0.3657 0.2767 0.6737 -0.0028 0.0751 -0.0294 13 LYS F C 11481 O O . LYS H 13 ? 0.4047 0.3110 0.6958 -0.0010 0.0809 -0.0230 13 LYS F O 11482 C CB . LYS H 13 ? 0.4149 0.3319 0.7517 -0.0040 0.0814 -0.0230 13 LYS F CB 11483 C CG . LYS H 13 ? 0.4661 0.3880 0.8160 -0.0058 0.0784 -0.0253 13 LYS F CG 11484 C CD . LYS H 13 ? 0.5157 0.4414 0.8940 -0.0049 0.0848 -0.0203 13 LYS F CD 11485 C CE . LYS H 13 ? 0.4555 0.3869 0.8509 -0.0065 0.0796 -0.0248 13 LYS F CE 11486 N NZ . LYS H 13 ? 0.4554 0.3860 0.8366 -0.0071 0.0804 -0.0226 13 LYS F NZ 11487 N N . PRO H 14 ? 0.4163 0.3293 0.7371 -0.0029 0.0702 -0.0357 14 PRO F N 11488 C CA . PRO H 14 ? 0.3685 0.2784 0.6852 -0.0008 0.0726 -0.0343 14 PRO F CA 11489 C C . PRO H 14 ? 0.4438 0.3506 0.7617 0.0017 0.0851 -0.0216 14 PRO F C 11490 O O . PRO H 14 ? 0.4667 0.3757 0.8007 0.0020 0.0916 -0.0152 14 PRO F O 11491 C CB . PRO H 14 ? 0.3600 0.2740 0.6994 -0.0013 0.0673 -0.0419 14 PRO F CB 11492 C CG . PRO H 14 ? 0.3784 0.2969 0.7231 -0.0035 0.0579 -0.0511 14 PRO F CG 11493 C CD . PRO H 14 ? 0.3945 0.3131 0.7347 -0.0045 0.0619 -0.0449 14 PRO F CD 11494 N N . SER H 15 ? 0.3575 0.2597 0.6583 0.0041 0.0881 -0.0180 15 SER F N 11495 C CA . SER H 15 ? 0.4381 0.3368 0.7352 0.0076 0.0996 -0.0057 15 SER F CA 11496 C C . SER H 15 ? 0.4046 0.3001 0.6830 0.0091 0.1052 0.0012 15 SER F C 11497 O O . SER H 15 ? 0.4104 0.3024 0.6795 0.0130 0.1137 0.0106 15 SER F O 11498 C CB . SER H 15 ? 0.4949 0.3970 0.8185 0.0086 0.1074 0.0013 15 SER F CB 11499 O OG . SER H 15 ? 0.5930 0.4977 0.9258 0.0079 0.1114 0.0051 15 SER F OG 11500 N N . GLU H 16 ? 0.3406 0.2372 0.6132 0.0065 0.1004 -0.0035 16 GLU F N 11501 C CA . GLU H 16 ? 0.3903 0.2838 0.6459 0.0078 0.1053 0.0020 16 GLU F CA 11502 C C . GLU H 16 ? 0.3382 0.2273 0.5686 0.0088 0.1021 -0.0002 16 GLU F C 11503 O O . GLU H 16 ? 0.3862 0.2749 0.6124 0.0086 0.0963 -0.0057 16 GLU F O 11504 C CB . GLU H 16 ? 0.4151 0.3119 0.6754 0.0047 0.1018 -0.0015 16 GLU F CB 11505 C CG . GLU H 16 ? 0.5039 0.4046 0.7875 0.0049 0.1079 0.0033 16 GLU F CG 11506 C CD . GLU H 16 ? 0.5881 0.4928 0.8787 0.0018 0.1032 -0.0012 16 GLU F CD 11507 O OE1 . GLU H 16 ? 0.5610 0.4655 0.8379 -0.0005 0.0956 -0.0075 16 GLU F OE1 11508 O OE2 . GLU H 16 ? 0.6627 0.5712 0.9738 0.0019 0.1073 0.0020 16 GLU F OE2 11509 N N . THR H 17 ? 0.4334 0.3192 0.6479 0.0103 0.1060 0.0040 17 THR F N 11510 C CA . THR H 17 ? 0.4436 0.3252 0.6354 0.0119 0.1041 0.0028 17 THR F CA 11511 C C . THR H 17 ? 0.4055 0.2882 0.5874 0.0084 0.0967 -0.0043 17 THR F C 11512 O O . THR H 17 ? 0.3433 0.2270 0.5267 0.0070 0.0983 -0.0033 17 THR F O 11513 C CB . THR H 17 ? 0.4537 0.3301 0.6325 0.0176 0.1145 0.0131 17 THR F CB 11514 O OG1 . THR H 17 ? 0.4791 0.3552 0.6670 0.0214 0.1218 0.0210 17 THR F OG1 11515 C CG2 . THR H 17 ? 0.4117 0.2862 0.5667 0.0196 0.1113 0.0113 17 THR F CG2 11516 N N . LEU H 18 ? 0.4041 0.2873 0.5768 0.0071 0.0890 -0.0113 18 LEU F N 11517 C CA . LEU H 18 ? 0.3721 0.2568 0.5349 0.0042 0.0823 -0.0173 18 LEU F CA 11518 C C . LEU H 18 ? 0.4073 0.2927 0.5493 0.0062 0.0849 -0.0128 18 LEU F C 11519 O O . LEU H 18 ? 0.3872 0.2735 0.5162 0.0097 0.0870 -0.0087 18 LEU F O 11520 C CB . LEU H 18 ? 0.4113 0.2994 0.5706 0.0029 0.0733 -0.0254 18 LEU F CB 11521 C CG . LEU H 18 ? 0.4392 0.3340 0.5854 0.0002 0.0653 -0.0299 18 LEU F CG 11522 C CD1 . LEU H 18 ? 0.5835 0.4779 0.7401 -0.0031 0.0644 -0.0319 18 LEU F CD1 11523 C CD2 . LEU H 18 ? 0.3940 0.2942 0.5376 -0.0002 0.0569 -0.0371 18 LEU F CD2 11524 N N . SER H 19 ? 0.3101 0.1967 0.4492 0.0041 0.0839 -0.0137 19 SER F N 11525 C CA . SER H 19 ? 0.4082 0.2975 0.5285 0.0056 0.0847 -0.0111 19 SER F CA 11526 C C . SER H 19 ? 0.4775 0.3714 0.5943 0.0016 0.0774 -0.0165 19 SER F C 11527 O O . SER H 19 ? 0.5289 0.4215 0.6569 -0.0012 0.0777 -0.0180 19 SER F O 11528 C CB . SER H 19 ? 0.4139 0.2990 0.5348 0.0089 0.0946 -0.0043 19 SER F CB 11529 O OG . SER H 19 ? 0.6862 0.5697 0.8014 0.0142 0.1011 0.0025 19 SER F OG 11530 N N . LEU H 20 ? 0.4138 0.3132 0.5164 0.0013 0.0710 -0.0188 20 LEU F N 11531 C CA . LEU H 20 ? 0.3360 0.2405 0.4356 -0.0020 0.0646 -0.0226 20 LEU F CA 11532 C C . LEU H 20 ? 0.3770 0.2841 0.4608 -0.0002 0.0642 -0.0211 20 LEU F C 11533 O O . LEU H 20 ? 0.3193 0.2265 0.3917 0.0033 0.0656 -0.0185 20 LEU F O 11534 C CB . LEU H 20 ? 0.2359 0.1460 0.3367 -0.0041 0.0563 -0.0272 20 LEU F CB 11535 C CG . LEU H 20 ? 0.3323 0.2409 0.4483 -0.0055 0.0550 -0.0307 20 LEU F CG 11536 C CD1 . LEU H 20 ? 0.2949 0.2100 0.4078 -0.0060 0.0470 -0.0353 20 LEU F CD1 11537 C CD2 . LEU H 20 ? 0.3509 0.2576 0.4814 -0.0085 0.0555 -0.0322 20 LEU F CD2 11538 N N . THR H 21 ? 0.3304 0.2397 0.4148 -0.0025 0.0619 -0.0229 21 THR F N 11539 C CA . THR H 21 ? 0.3400 0.2523 0.4124 -0.0013 0.0601 -0.0231 21 THR F CA 11540 C C . THR H 21 ? 0.3510 0.2699 0.4254 -0.0048 0.0521 -0.0263 21 THR F C 11541 O O . THR H 21 ? 0.2567 0.1770 0.3422 -0.0083 0.0500 -0.0279 21 THR F O 11542 C CB . THR H 21 ? 0.3910 0.2998 0.4630 0.0001 0.0659 -0.0222 21 THR F CB 11543 O OG1 . THR H 21 ? 0.4609 0.3644 0.5316 0.0042 0.0744 -0.0178 21 THR F OG1 11544 C CG2 . THR H 21 ? 0.3588 0.2710 0.4188 0.0019 0.0632 -0.0239 21 THR F CG2 11545 N N . CYS H 22 ? 0.2726 0.1959 0.3374 -0.0037 0.0478 -0.0266 22 CYS F N 11546 C CA . CYS H 22 ? 0.2688 0.1988 0.3366 -0.0064 0.0410 -0.0282 22 CYS F CA 11547 C C . CYS H 22 ? 0.3412 0.2723 0.4061 -0.0061 0.0401 -0.0295 22 CYS F C 11548 O O . CYS H 22 ? 0.3341 0.2645 0.3886 -0.0028 0.0407 -0.0296 22 CYS F O 11549 C CB . CYS H 22 ? 0.3016 0.2368 0.3641 -0.0056 0.0362 -0.0275 22 CYS F CB 11550 S SG . CYS H 22 ? 0.3752 0.3200 0.4438 -0.0083 0.0286 -0.0276 22 CYS F SG 11551 N N . GLY H 23 ? 0.2628 0.1960 0.3377 -0.0093 0.0383 -0.0309 23 GLY F N 11552 C CA . GLY H 23 ? 0.1997 0.1345 0.2750 -0.0093 0.0366 -0.0331 23 GLY F CA 11553 C C . GLY H 23 ? 0.2442 0.1864 0.3226 -0.0106 0.0296 -0.0330 23 GLY F C 11554 O O . GLY H 23 ? 0.2554 0.2024 0.3406 -0.0129 0.0264 -0.0309 23 GLY F O 11555 N N . VAL H 24 ? 0.2581 0.2017 0.3320 -0.0088 0.0270 -0.0350 24 VAL F N 11556 C CA . VAL H 24 ? 0.2484 0.1991 0.3282 -0.0099 0.0206 -0.0345 24 VAL F CA 11557 C C . VAL H 24 ? 0.2978 0.2500 0.3877 -0.0114 0.0184 -0.0378 24 VAL F C 11558 O O . VAL H 24 ? 0.3913 0.3398 0.4762 -0.0092 0.0198 -0.0422 24 VAL F O 11559 C CB . VAL H 24 ? 0.2381 0.1901 0.3072 -0.0066 0.0181 -0.0343 24 VAL F CB 11560 C CG1 . VAL H 24 ? 0.1979 0.1571 0.2756 -0.0077 0.0118 -0.0332 24 VAL F CG1 11561 C CG2 . VAL H 24 ? 0.2076 0.1581 0.2683 -0.0052 0.0204 -0.0311 24 VAL F CG2 11562 N N . TYR H 25 ? 0.2428 0.2008 0.3474 -0.0146 0.0150 -0.0356 25 TYR F N 11563 C CA . TYR H 25 ? 0.2221 0.1817 0.3404 -0.0166 0.0132 -0.0382 25 TYR F CA 11564 C C . TYR H 25 ? 0.2538 0.2209 0.3836 -0.0174 0.0072 -0.0365 25 TYR F C 11565 O O . TYR H 25 ? 0.2553 0.2284 0.3893 -0.0182 0.0052 -0.0308 25 TYR F O 11566 C CB . TYR H 25 ? 0.2209 0.1808 0.3508 -0.0200 0.0155 -0.0361 25 TYR F CB 11567 C CG . TYR H 25 ? 0.2380 0.1912 0.3603 -0.0196 0.0214 -0.0366 25 TYR F CG 11568 C CD1 . TYR H 25 ? 0.2028 0.1558 0.3196 -0.0195 0.0226 -0.0334 25 TYR F CD1 11569 C CD2 . TYR H 25 ? 0.2191 0.1662 0.3408 -0.0190 0.0259 -0.0404 25 TYR F CD2 11570 C CE1 . TYR H 25 ? 0.1993 0.1460 0.3123 -0.0192 0.0279 -0.0338 25 TYR F CE1 11571 C CE2 . TYR H 25 ? 0.2805 0.2215 0.3975 -0.0185 0.0319 -0.0399 25 TYR F CE2 11572 C CZ . TYR H 25 ? 0.2803 0.2211 0.3940 -0.0188 0.0327 -0.0365 25 TYR F CZ 11573 O OH . TYR H 25 ? 0.3360 0.2708 0.4481 -0.0183 0.0385 -0.0359 25 TYR F OH 11574 N N . GLY H 26 ? 0.2947 0.2617 0.4305 -0.0167 0.0044 -0.0416 26 GLY F N 11575 C CA . GLY H 26 ? 0.3703 0.3442 0.5218 -0.0177 -0.0013 -0.0402 26 GLY F CA 11576 C C . GLY H 26 ? 0.4627 0.4376 0.6080 -0.0147 -0.0055 -0.0427 26 GLY F C 11577 O O . GLY H 26 ? 0.4724 0.4514 0.6318 -0.0150 -0.0106 -0.0442 26 GLY F O 11578 N N . GLU H 27 ? 0.3753 0.3465 0.5009 -0.0118 -0.0036 -0.0431 27 GLU F N 11579 C CA . GLU H 27 ? 0.3196 0.2910 0.4370 -0.0084 -0.0074 -0.0461 27 GLU F CA 11580 C C . GLU H 27 ? 0.3473 0.3124 0.4424 -0.0046 -0.0035 -0.0487 27 GLU F C 11581 O O . GLU H 27 ? 0.2794 0.2402 0.3667 -0.0049 0.0024 -0.0469 27 GLU F O 11582 C CB . GLU H 27 ? 0.3610 0.3386 0.4826 -0.0085 -0.0104 -0.0395 27 GLU F CB 11583 C CG . GLU H 27 ? 0.5792 0.5558 0.6873 -0.0078 -0.0064 -0.0339 27 GLU F CG 11584 C CD . GLU H 27 ? 0.6891 0.6721 0.8009 -0.0072 -0.0092 -0.0277 27 GLU F CD 11585 O OE1 . GLU H 27 ? 0.7649 0.7537 0.8924 -0.0079 -0.0136 -0.0262 27 GLU F OE1 11586 O OE2 . GLU H 27 ? 0.4821 0.4646 0.5824 -0.0058 -0.0066 -0.0243 27 GLU F OE2 11587 N N . SER H 28 ? 0.2615 0.2264 0.3476 -0.0008 -0.0069 -0.0526 28 SER F N 11588 C CA . SER H 28 ? 0.3599 0.3201 0.4249 0.0036 -0.0033 -0.0537 28 SER F CA 11589 C C . SER H 28 ? 0.3315 0.2924 0.3888 0.0040 -0.0017 -0.0468 28 SER F C 11590 O O . SER H 28 ? 0.3189 0.2843 0.3860 0.0014 -0.0039 -0.0421 28 SER F O 11591 C CB . SER H 28 ? 0.3935 0.3540 0.4510 0.0082 -0.0079 -0.0608 28 SER F CB 11592 O OG . SER H 28 ? 0.3879 0.3524 0.4455 0.0093 -0.0134 -0.0590 28 SER F OG 11593 N N . LEU H 29 ? 0.2995 0.2563 0.3397 0.0077 0.0023 -0.0461 29 LEU F N 11594 C CA . LEU H 29 ? 0.3108 0.2676 0.3440 0.0084 0.0043 -0.0402 29 LEU F CA 11595 C C . LEU H 29 ? 0.3912 0.3522 0.4226 0.0105 -0.0014 -0.0394 29 LEU F C 11596 O O . LEU H 29 ? 0.4285 0.3909 0.4581 0.0105 -0.0008 -0.0344 29 LEU F O 11597 C CB . LEU H 29 ? 0.2273 0.1783 0.2456 0.0117 0.0113 -0.0387 29 LEU F CB 11598 C CG . LEU H 29 ? 0.3596 0.3059 0.3800 0.0099 0.0179 -0.0383 29 LEU F CG 11599 C CD1 . LEU H 29 ? 0.4021 0.3433 0.4102 0.0136 0.0250 -0.0354 29 LEU F CD1 11600 C CD2 . LEU H 29 ? 0.3698 0.3178 0.4027 0.0050 0.0179 -0.0353 29 LEU F CD2 11601 N N . SER H 30 ? 0.3269 0.2899 0.3595 0.0126 -0.0070 -0.0448 30 SER F N 11602 C CA . SER H 30 ? 0.3075 0.2742 0.3385 0.0151 -0.0129 -0.0449 30 SER F CA 11603 C C . SER H 30 ? 0.2835 0.2555 0.3284 0.0120 -0.0161 -0.0397 30 SER F C 11604 O O . SER H 30 ? 0.3798 0.3546 0.4400 0.0082 -0.0169 -0.0384 30 SER F O 11605 C CB . SER H 30 ? 0.3355 0.3040 0.3687 0.0175 -0.0195 -0.0531 30 SER F CB 11606 O OG . SER H 30 ? 0.4224 0.3874 0.4386 0.0223 -0.0168 -0.0574 30 SER F OG 11607 N N . GLY H 31 ? 0.2857 0.2595 0.3256 0.0141 -0.0175 -0.0360 31 GLY F N 11608 C CA . GLY H 31 ? 0.2949 0.2742 0.3472 0.0123 -0.0203 -0.0307 31 GLY F CA 11609 C C . GLY H 31 ? 0.3051 0.2851 0.3581 0.0103 -0.0152 -0.0240 31 GLY F C 11610 O O . GLY H 31 ? 0.3055 0.2908 0.3683 0.0094 -0.0167 -0.0190 31 GLY F O 11611 N N . HIS H 32 ? 0.3063 0.2813 0.3495 0.0101 -0.0091 -0.0238 32 HIS F N 11612 C CA . HIS H 32 ? 0.3361 0.3117 0.3796 0.0086 -0.0048 -0.0190 32 HIS F CA 11613 C C . HIS H 32 ? 0.3576 0.3276 0.3872 0.0106 0.0006 -0.0182 32 HIS F C 11614 O O . HIS H 32 ? 0.3279 0.2927 0.3484 0.0124 0.0031 -0.0209 32 HIS F O 11615 C CB . HIS H 32 ? 0.3569 0.3333 0.4095 0.0051 -0.0032 -0.0193 32 HIS F CB 11616 C CG . HIS H 32 ? 0.3827 0.3655 0.4520 0.0029 -0.0076 -0.0180 32 HIS F CG 11617 N ND1 . HIS H 32 ? 0.3107 0.2936 0.3885 0.0019 -0.0109 -0.0224 32 HIS F ND1 11618 C CD2 . HIS H 32 ? 0.1635 0.1534 0.2438 0.0020 -0.0087 -0.0124 32 HIS F CD2 11619 C CE1 . HIS H 32 ? 0.3337 0.3231 0.4288 0.0000 -0.0141 -0.0194 32 HIS F CE1 11620 N NE2 . HIS H 32 ? 0.2996 0.2936 0.3962 0.0002 -0.0125 -0.0127 32 HIS F NE2 11621 N N . TYR H 33 ? 0.2518 0.2233 0.2809 0.0107 0.0027 -0.0143 33 TYR F N 11622 C CA . TYR H 33 ? 0.3029 0.2693 0.3239 0.0116 0.0082 -0.0139 33 TYR F CA 11623 C C . TYR H 33 ? 0.2983 0.2627 0.3238 0.0088 0.0111 -0.0155 33 TYR F C 11624 O O . TYR H 33 ? 0.3088 0.2778 0.3435 0.0063 0.0090 -0.0152 33 TYR F O 11625 C CB . TYR H 33 ? 0.3604 0.3294 0.3803 0.0130 0.0090 -0.0104 33 TYR F CB 11626 C CG . TYR H 33 ? 0.3943 0.3641 0.4092 0.0161 0.0073 -0.0082 33 TYR F CG 11627 C CD1 . TYR H 33 ? 0.4130 0.3779 0.4187 0.0188 0.0107 -0.0075 33 TYR F CD1 11628 C CD2 . TYR H 33 ? 0.4142 0.3901 0.4354 0.0164 0.0024 -0.0061 33 TYR F CD2 11629 C CE1 . TYR H 33 ? 0.3622 0.3284 0.3639 0.0218 0.0090 -0.0050 33 TYR F CE1 11630 C CE2 . TYR H 33 ? 0.4401 0.4170 0.4578 0.0192 0.0005 -0.0041 33 TYR F CE2 11631 C CZ . TYR H 33 ? 0.4391 0.4112 0.4465 0.0219 0.0037 -0.0036 33 TYR F CZ 11632 O OH . TYR H 33 ? 0.5437 0.5172 0.5481 0.0248 0.0016 -0.0012 33 TYR F OH 11633 N N . TRP H 34 ? 0.3007 0.2588 0.3208 0.0094 0.0160 -0.0167 34 TRP F N 11634 C CA . TRP H 34 ? 0.2925 0.2481 0.3177 0.0069 0.0189 -0.0184 34 TRP F CA 11635 C C . TRP H 34 ? 0.3079 0.2600 0.3316 0.0077 0.0229 -0.0179 34 TRP F C 11636 O O . TRP H 34 ? 0.3763 0.3244 0.3938 0.0103 0.0260 -0.0167 34 TRP F O 11637 C CB . TRP H 34 ? 0.3118 0.2626 0.3355 0.0067 0.0213 -0.0208 34 TRP F CB 11638 C CG . TRP H 34 ? 0.3022 0.2564 0.3286 0.0062 0.0167 -0.0225 34 TRP F CG 11639 C CD1 . TRP H 34 ? 0.3708 0.3258 0.3914 0.0089 0.0140 -0.0235 34 TRP F CD1 11640 C CD2 . TRP H 34 ? 0.2944 0.2524 0.3319 0.0029 0.0138 -0.0237 34 TRP F CD2 11641 N NE1 . TRP H 34 ? 0.3512 0.3097 0.3794 0.0073 0.0094 -0.0261 34 TRP F NE1 11642 C CE2 . TRP H 34 ? 0.2750 0.2354 0.3142 0.0036 0.0095 -0.0259 34 TRP F CE2 11643 C CE3 . TRP H 34 ? 0.2665 0.2264 0.3135 -0.0004 0.0141 -0.0233 34 TRP F CE3 11644 C CZ2 . TRP H 34 ? 0.2256 0.1897 0.2771 0.0009 0.0060 -0.0273 34 TRP F CZ2 11645 C CZ3 . TRP H 34 ? 0.1875 0.1515 0.2455 -0.0028 0.0110 -0.0239 34 TRP F CZ3 11646 C CH2 . TRP H 34 ? 0.2643 0.2302 0.3252 -0.0023 0.0072 -0.0258 34 TRP F CH2 11647 N N . SER H 35 ? 0.2545 0.2086 0.2849 0.0056 0.0225 -0.0190 35 SER F N 11648 C CA . SER H 35 ? 0.2294 0.1822 0.2602 0.0066 0.0245 -0.0197 35 SER F CA 11649 C C . SER H 35 ? 0.3017 0.2515 0.3396 0.0046 0.0265 -0.0226 35 SER F C 11650 O O . SER H 35 ? 0.2785 0.2293 0.3219 0.0020 0.0254 -0.0237 35 SER F O 11651 C CB . SER H 35 ? 0.2810 0.2413 0.3121 0.0075 0.0208 -0.0187 35 SER F CB 11652 O OG . SER H 35 ? 0.4949 0.4542 0.5261 0.0090 0.0222 -0.0206 35 SER F OG 11653 N N . TRP H 36 ? 0.2532 0.1991 0.2925 0.0058 0.0292 -0.0241 36 TRP F N 11654 C CA . TRP H 36 ? 0.2409 0.1846 0.2891 0.0042 0.0300 -0.0277 36 TRP F CA 11655 C C . TRP H 36 ? 0.2722 0.2199 0.3220 0.0056 0.0273 -0.0307 36 TRP F C 11656 O O . TRP H 36 ? 0.2831 0.2313 0.3282 0.0082 0.0277 -0.0299 36 TRP F O 11657 C CB . TRP H 36 ? 0.2863 0.2213 0.3385 0.0046 0.0360 -0.0274 36 TRP F CB 11658 C CG . TRP H 36 ? 0.3218 0.2532 0.3735 0.0037 0.0391 -0.0254 36 TRP F CG 11659 C CD1 . TRP H 36 ? 0.2373 0.1665 0.2806 0.0058 0.0419 -0.0220 36 TRP F CD1 11660 C CD2 . TRP H 36 ? 0.2960 0.2262 0.3557 0.0008 0.0396 -0.0269 36 TRP F CD2 11661 N NE1 . TRP H 36 ? 0.3030 0.2296 0.3479 0.0047 0.0443 -0.0218 36 TRP F NE1 11662 C CE2 . TRP H 36 ? 0.3292 0.2561 0.3846 0.0015 0.0432 -0.0245 36 TRP F CE2 11663 C CE3 . TRP H 36 ? 0.2556 0.1873 0.3254 -0.0019 0.0372 -0.0303 36 TRP F CE3 11664 C CZ2 . TRP H 36 ? 0.2910 0.2158 0.3526 -0.0007 0.0451 -0.0252 36 TRP F CZ2 11665 C CZ3 . TRP H 36 ? 0.2970 0.2267 0.3736 -0.0043 0.0387 -0.0305 36 TRP F CZ3 11666 C CH2 . TRP H 36 ? 0.3201 0.2461 0.3929 -0.0038 0.0429 -0.0279 36 TRP F CH2 11667 N N . VAL H 37 ? 0.3130 0.2638 0.3694 0.0042 0.0245 -0.0345 37 VAL F N 11668 C CA . VAL H 37 ? 0.3165 0.2725 0.3739 0.0061 0.0211 -0.0387 37 VAL F CA 11669 C C . VAL H 37 ? 0.3415 0.2951 0.4096 0.0047 0.0203 -0.0443 37 VAL F C 11670 O O . VAL H 37 ? 0.3626 0.3146 0.4365 0.0018 0.0206 -0.0439 37 VAL F O 11671 C CB . VAL H 37 ? 0.2583 0.2250 0.3108 0.0069 0.0165 -0.0369 37 VAL F CB 11672 C CG1 . VAL H 37 ? 0.2208 0.1940 0.2737 0.0095 0.0128 -0.0418 37 VAL F CG1 11673 C CG2 . VAL H 37 ? 0.2597 0.2290 0.3042 0.0086 0.0170 -0.0316 37 VAL F CG2 11674 N N . ARG H 38 ? 0.3015 0.2547 0.3737 0.0066 0.0192 -0.0499 38 ARG F N 11675 C CA . ARG H 38 ? 0.2749 0.2267 0.3589 0.0053 0.0171 -0.0561 38 ARG F CA 11676 C C . ARG H 38 ? 0.3221 0.2821 0.4053 0.0080 0.0110 -0.0628 38 ARG F C 11677 O O . ARG H 38 ? 0.3066 0.2720 0.3809 0.0114 0.0096 -0.0630 38 ARG F O 11678 C CB . ARG H 38 ? 0.2312 0.1729 0.3264 0.0050 0.0218 -0.0580 38 ARG F CB 11679 C CG . ARG H 38 ? 0.2027 0.1423 0.2982 0.0081 0.0229 -0.0606 38 ARG F CG 11680 C CD . ARG H 38 ? 0.2819 0.2118 0.3925 0.0076 0.0278 -0.0617 38 ARG F CD 11681 N NE . ARG H 38 ? 0.3810 0.3087 0.4953 0.0105 0.0289 -0.0648 38 ARG F NE 11682 C CZ . ARG H 38 ? 0.3663 0.2863 0.4956 0.0108 0.0333 -0.0653 38 ARG F CZ 11683 N NH1 . ARG H 38 ? 0.2788 0.1925 0.4201 0.0085 0.0374 -0.0625 38 ARG F NH1 11684 N NH2 . ARG H 38 ? 0.3185 0.2369 0.4517 0.0136 0.0340 -0.0682 38 ARG F NH2 11685 N N . GLN H 39 ? 0.2705 0.2320 0.3631 0.0069 0.0073 -0.0683 39 GLN F N 11686 C CA . GLN H 39 ? 0.2943 0.2647 0.3859 0.0099 0.0007 -0.0755 39 GLN F CA 11687 C C . GLN H 39 ? 0.3166 0.2828 0.4237 0.0091 -0.0019 -0.0843 39 GLN F C 11688 O O . GLN H 39 ? 0.3431 0.3090 0.4589 0.0063 -0.0036 -0.0848 39 GLN F O 11689 C CB . GLN H 39 ? 0.3016 0.2826 0.3865 0.0100 -0.0032 -0.0719 39 GLN F CB 11690 C CG . GLN H 39 ? 0.3249 0.3175 0.4048 0.0146 -0.0098 -0.0776 39 GLN F CG 11691 C CD . GLN H 39 ? 0.3271 0.3311 0.4004 0.0153 -0.0124 -0.0716 39 GLN F CD 11692 O OE1 . GLN H 39 ? 0.3713 0.3741 0.4494 0.0114 -0.0114 -0.0664 39 GLN F OE1 11693 N NE2 . GLN H 39 ? 0.2954 0.3109 0.3582 0.0207 -0.0155 -0.0718 39 GLN F NE2 11694 N N . PRO H 40 ? 0.3642 0.3270 0.4771 0.0115 -0.0022 -0.0912 40 PRO F N 11695 C CA . PRO H 40 ? 0.3920 0.3517 0.5219 0.0113 -0.0058 -0.1011 40 PRO F CA 11696 C C . PRO H 40 ? 0.4499 0.4204 0.5779 0.0132 -0.0145 -0.1079 40 PRO F C 11697 O O . PRO H 40 ? 0.4378 0.4187 0.5504 0.0165 -0.0173 -0.1063 40 PRO F O 11698 C CB . PRO H 40 ? 0.3822 0.3385 0.5157 0.0145 -0.0051 -0.1072 40 PRO F CB 11699 C CG . PRO H 40 ? 0.3927 0.3461 0.5147 0.0148 0.0016 -0.0978 40 PRO F CG 11700 C CD . PRO H 40 ? 0.3045 0.2656 0.4103 0.0144 0.0010 -0.0903 40 PRO F CD 11701 N N . PRO H 41 ? 0.5506 0.5193 0.6949 0.0116 -0.0186 -0.1149 41 PRO F N 11702 C CA . PRO H 41 ? 0.5004 0.4798 0.6434 0.0136 -0.0274 -0.1212 41 PRO F CA 11703 C C . PRO H 41 ? 0.4313 0.4214 0.5620 0.0202 -0.0334 -0.1290 41 PRO F C 11704 O O . PRO H 41 ? 0.3952 0.3825 0.5313 0.0230 -0.0348 -0.1379 41 PRO F O 11705 C CB . PRO H 41 ? 0.5213 0.4946 0.6875 0.0112 -0.0305 -0.1293 41 PRO F CB 11706 C CG . PRO H 41 ? 0.5908 0.5508 0.7687 0.0065 -0.0214 -0.1220 41 PRO F CG 11707 C CD . PRO H 41 ? 0.5501 0.5069 0.7157 0.0081 -0.0150 -0.1164 41 PRO F CD 11708 N N . GLY H 42 ? 0.4494 0.4519 0.5642 0.0231 -0.0365 -0.1251 42 GLY F N 11709 C CA . GLY H 42 ? 0.5444 0.5593 0.6458 0.0304 -0.0421 -0.1313 42 GLY F CA 11710 C C . GLY H 42 ? 0.5242 0.5391 0.6134 0.0339 -0.0377 -0.1292 42 GLY F C 11711 O O . GLY H 42 ? 0.5136 0.5375 0.5928 0.0405 -0.0415 -0.1357 42 GLY F O 11712 N N . LYS H 43 ? 0.5179 0.5232 0.6076 0.0300 -0.0296 -0.1203 43 LYS F N 11713 C CA . LYS H 43 ? 0.4643 0.4688 0.5439 0.0328 -0.0252 -0.1175 43 LYS F CA 11714 C C . LYS H 43 ? 0.5277 0.5344 0.5955 0.0314 -0.0199 -0.1035 43 LYS F C 11715 O O . LYS H 43 ? 0.5030 0.5116 0.5709 0.0281 -0.0197 -0.0965 43 LYS F O 11716 C CB . LYS H 43 ? 0.4415 0.4326 0.5339 0.0306 -0.0207 -0.1206 43 LYS F CB 11717 C CG . LYS H 43 ? 0.5093 0.4966 0.6190 0.0311 -0.0256 -0.1341 43 LYS F CG 11718 C CD . LYS H 43 ? 0.6711 0.6507 0.7888 0.0327 -0.0226 -0.1394 43 LYS F CD 11719 C CE . LYS H 43 ? 0.7662 0.7546 0.8701 0.0396 -0.0253 -0.1451 43 LYS F CE 11720 N NZ . LYS H 43 ? 0.8100 0.7909 0.9207 0.0410 -0.0213 -0.1482 43 LYS F NZ 11721 N N . ARG H 44 ? 0.5089 0.5154 0.5678 0.0338 -0.0160 -0.0999 44 ARG F N 11722 C CA . ARG H 44 ? 0.4815 0.4910 0.5300 0.0332 -0.0119 -0.0876 44 ARG F CA 11723 C C . ARG H 44 ? 0.4183 0.4167 0.4728 0.0271 -0.0062 -0.0801 44 ARG F C 11724 O O . ARG H 44 ? 0.3904 0.3783 0.4561 0.0240 -0.0043 -0.0834 44 ARG F O 11725 C CB . ARG H 44 ? 0.4887 0.5024 0.5267 0.0383 -0.0098 -0.0864 44 ARG F CB 11726 C CG . ARG H 44 ? 0.3882 0.3905 0.4308 0.0368 -0.0049 -0.0867 44 ARG F CG 11727 C CD . ARG H 44 ? 0.4510 0.4582 0.4840 0.0422 -0.0032 -0.0859 44 ARG F CD 11728 N NE . ARG H 44 ? 0.4250 0.4384 0.4561 0.0481 -0.0076 -0.0971 44 ARG F NE 11729 C CZ . ARG H 44 ? 0.4141 0.4345 0.4356 0.0542 -0.0071 -0.0983 44 ARG F CZ 11730 N NH1 . ARG H 44 ? 0.3288 0.3507 0.3429 0.0549 -0.0025 -0.0883 44 ARG F NH1 11731 N NH2 . ARG H 44 ? 0.4272 0.4534 0.4471 0.0600 -0.0115 -0.1100 44 ARG F NH2 11732 N N . LEU H 45 ? 0.4022 0.4033 0.4496 0.0260 -0.0036 -0.0698 45 LEU F N 11733 C CA . LEU H 45 ? 0.3449 0.3370 0.3953 0.0213 0.0013 -0.0629 45 LEU F CA 11734 C C . LEU H 45 ? 0.3975 0.3821 0.4465 0.0221 0.0057 -0.0620 45 LEU F C 11735 O O . LEU H 45 ? 0.4151 0.4036 0.4581 0.0263 0.0055 -0.0635 45 LEU F O 11736 C CB . LEU H 45 ? 0.3805 0.3788 0.4254 0.0202 0.0017 -0.0534 45 LEU F CB 11737 C CG . LEU H 45 ? 0.4306 0.4362 0.4784 0.0191 -0.0019 -0.0524 45 LEU F CG 11738 C CD1 . LEU H 45 ? 0.4537 0.4705 0.4950 0.0214 -0.0027 -0.0443 45 LEU F CD1 11739 C CD2 . LEU H 45 ? 0.3500 0.3476 0.4066 0.0134 -0.0002 -0.0507 45 LEU F CD2 11740 N N . GLU H 46 ? 0.3287 0.3032 0.3832 0.0185 0.0099 -0.0592 46 GLU F N 11741 C CA . GLU H 46 ? 0.3434 0.3109 0.3971 0.0193 0.0145 -0.0570 46 GLU F CA 11742 C C . GLU H 46 ? 0.3021 0.2643 0.3537 0.0164 0.0184 -0.0490 46 GLU F C 11743 O O . GLU H 46 ? 0.3090 0.2661 0.3663 0.0132 0.0200 -0.0481 46 GLU F O 11744 C CB . GLU H 46 ? 0.3710 0.3305 0.4361 0.0194 0.0160 -0.0637 46 GLU F CB 11745 C CG . GLU H 46 ? 0.5832 0.5348 0.6498 0.0198 0.0216 -0.0598 46 GLU F CG 11746 C CD . GLU H 46 ? 0.7973 0.7398 0.8792 0.0189 0.0246 -0.0638 46 GLU F CD 11747 O OE1 . GLU H 46 ? 0.7708 0.7129 0.8628 0.0179 0.0216 -0.0706 46 GLU F OE1 11748 O OE2 . GLU H 46 ? 0.9032 0.8392 0.9880 0.0195 0.0298 -0.0597 46 GLU F OE2 11749 N N . TRP H 47 ? 0.2834 0.2471 0.3269 0.0179 0.0199 -0.0435 47 TRP F N 11750 C CA . TRP H 47 ? 0.2108 0.1703 0.2510 0.0163 0.0229 -0.0368 47 TRP F CA 11751 C C . TRP H 47 ? 0.2907 0.2403 0.3358 0.0159 0.0278 -0.0365 47 TRP F C 11752 O O . TRP H 47 ? 0.3576 0.3043 0.4057 0.0180 0.0297 -0.0386 47 TRP F O 11753 C CB . TRP H 47 ? 0.2091 0.1734 0.2410 0.0186 0.0224 -0.0318 47 TRP F CB 11754 C CG . TRP H 47 ? 0.3235 0.2844 0.3514 0.0178 0.0244 -0.0258 47 TRP F CG 11755 C CD1 . TRP H 47 ? 0.3235 0.2858 0.3500 0.0156 0.0231 -0.0225 47 TRP F CD1 11756 C CD2 . TRP H 47 ? 0.3879 0.3443 0.4128 0.0197 0.0275 -0.0228 47 TRP F CD2 11757 N NE1 . TRP H 47 ? 0.3211 0.2802 0.3433 0.0163 0.0247 -0.0186 47 TRP F NE1 11758 C CE2 . TRP H 47 ? 0.3475 0.3031 0.3681 0.0188 0.0275 -0.0182 47 TRP F CE2 11759 C CE3 . TRP H 47 ? 0.3681 0.3213 0.3942 0.0222 0.0301 -0.0238 47 TRP F CE3 11760 C CZ2 . TRP H 47 ? 0.3551 0.3074 0.3714 0.0207 0.0297 -0.0143 47 TRP F CZ2 11761 C CZ3 . TRP H 47 ? 0.3322 0.2818 0.3550 0.0238 0.0329 -0.0190 47 TRP F CZ3 11762 C CH2 . TRP H 47 ? 0.3271 0.2765 0.3443 0.0232 0.0325 -0.0143 47 TRP F CH2 11763 N N . ILE H 48 ? 0.3125 0.2573 0.3593 0.0135 0.0304 -0.0336 48 ILE F N 11764 C CA . ILE H 48 ? 0.2943 0.2304 0.3455 0.0138 0.0360 -0.0317 48 ILE F CA 11765 C C . ILE H 48 ? 0.2932 0.2280 0.3355 0.0156 0.0386 -0.0253 48 ILE F C 11766 O O . ILE H 48 ? 0.3442 0.2749 0.3873 0.0179 0.0425 -0.0228 48 ILE F O 11767 C CB . ILE H 48 ? 0.3176 0.2492 0.3760 0.0111 0.0382 -0.0320 48 ILE F CB 11768 C CG1 . ILE H 48 ? 0.2800 0.2116 0.3499 0.0097 0.0360 -0.0386 48 ILE F CG1 11769 C CG2 . ILE H 48 ? 0.2375 0.1612 0.2986 0.0123 0.0451 -0.0275 48 ILE F CG2 11770 C CD1 . ILE H 48 ? 0.2921 0.2209 0.3695 0.0066 0.0370 -0.0389 48 ILE F CD1 11771 N N . GLY H 49 ? 0.3295 0.2682 0.3642 0.0148 0.0360 -0.0226 49 GLY F N 11772 C CA . GLY H 49 ? 0.3431 0.2812 0.3694 0.0166 0.0373 -0.0176 49 GLY F CA 11773 C C . GLY H 49 ? 0.3507 0.2926 0.3723 0.0150 0.0339 -0.0165 49 GLY F C 11774 O O . GLY H 49 ? 0.3990 0.3437 0.4246 0.0124 0.0314 -0.0188 49 GLY F O 11775 N N . GLU H 50 ? 0.3444 0.2869 0.3586 0.0168 0.0335 -0.0131 50 GLU F N 11776 C CA . GLU H 50 ? 0.3141 0.2601 0.3254 0.0157 0.0298 -0.0128 50 GLU F CA 11777 C C . GLU H 50 ? 0.4155 0.3593 0.4187 0.0185 0.0310 -0.0102 50 GLU F C 11778 O O . GLU H 50 ? 0.3509 0.2919 0.3503 0.0215 0.0342 -0.0075 50 GLU F O 11779 C CB . GLU H 50 ? 0.3238 0.2774 0.3363 0.0152 0.0245 -0.0123 50 GLU F CB 11780 C CG . GLU H 50 ? 0.3963 0.3521 0.4048 0.0181 0.0237 -0.0095 50 GLU F CG 11781 C CD . GLU H 50 ? 0.4713 0.4348 0.4828 0.0180 0.0198 -0.0084 50 GLU F CD 11782 O OE1 . GLU H 50 ? 0.4168 0.3832 0.4323 0.0171 0.0195 -0.0102 50 GLU F OE1 11783 O OE2 . GLU H 50 ? 0.4422 0.4093 0.4525 0.0192 0.0169 -0.0056 50 GLU F OE2 11784 N N . ILE H 51 ? 0.3356 0.2812 0.3367 0.0178 0.0281 -0.0113 51 ILE F N 11785 C CA . ILE H 51 ? 0.3105 0.2547 0.3031 0.0210 0.0285 -0.0103 51 ILE F CA 11786 C C . ILE H 51 ? 0.3122 0.2608 0.3052 0.0200 0.0225 -0.0129 51 ILE F C 11787 O O . ILE H 51 ? 0.2994 0.2505 0.3004 0.0165 0.0200 -0.0150 51 ILE F O 11788 C CB . ILE H 51 ? 0.4366 0.3749 0.4266 0.0223 0.0348 -0.0099 51 ILE F CB 11789 C CG1 . ILE H 51 ? 0.4285 0.3661 0.4073 0.0274 0.0364 -0.0077 51 ILE F CG1 11790 C CG2 . ILE H 51 ? 0.3684 0.3061 0.3636 0.0192 0.0346 -0.0135 51 ILE F CG2 11791 C CD1 . ILE H 51 ? 0.4450 0.3778 0.4208 0.0296 0.0433 -0.0064 51 ILE F CD1 11792 N N . LYS H 52 ? 0.3114 0.2613 0.2971 0.0232 0.0199 -0.0128 52 LYS F N 11793 C CA . LYS H 52 ? 0.3834 0.3365 0.3701 0.0229 0.0144 -0.0167 52 LYS F CA 11794 C C . LYS H 52 ? 0.3916 0.3433 0.3666 0.0277 0.0149 -0.0178 52 LYS F C 11795 O O . LYS H 52 ? 0.3984 0.3481 0.3649 0.0315 0.0186 -0.0141 52 LYS F O 11796 C CB . LYS H 52 ? 0.4533 0.4125 0.4468 0.0217 0.0076 -0.0164 52 LYS F CB 11797 C CG . LYS H 52 ? 0.5493 0.5106 0.5364 0.0256 0.0041 -0.0152 52 LYS F CG 11798 C CD . LYS H 52 ? 0.6088 0.5745 0.6025 0.0248 0.0012 -0.0117 52 LYS F CD 11799 C CE . LYS H 52 ? 0.5191 0.4902 0.5193 0.0250 -0.0066 -0.0132 52 LYS F CE 11800 N NZ . LYS H 52 ? 0.5282 0.4991 0.5191 0.0293 -0.0098 -0.0154 52 LYS F NZ 11801 N N . HIS H 53 ? 0.3618 0.3150 0.3367 0.0280 0.0110 -0.0229 53 HIS F N 11802 C CA . HIS H 53 ? 0.4190 0.3715 0.3816 0.0333 0.0115 -0.0253 53 HIS F CA 11803 C C . HIS H 53 ? 0.4038 0.3589 0.3567 0.0383 0.0087 -0.0231 53 HIS F C 11804 O O . HIS H 53 ? 0.4808 0.4341 0.4219 0.0433 0.0136 -0.0198 53 HIS F O 11805 C CB . HIS H 53 ? 0.3134 0.2681 0.2800 0.0326 0.0061 -0.0327 53 HIS F CB 11806 C CG . HIS H 53 ? 0.4541 0.4092 0.4074 0.0387 0.0056 -0.0367 53 HIS F CG 11807 N ND1 . HIS H 53 ? 0.5074 0.4590 0.4482 0.0432 0.0134 -0.0339 53 HIS F ND1 11808 C CD2 . HIS H 53 ? 0.5307 0.4896 0.4813 0.0416 -0.0019 -0.0435 53 HIS F CD2 11809 C CE1 . HIS H 53 ? 0.5488 0.5027 0.4781 0.0491 0.0111 -0.0384 53 HIS F CE1 11810 N NE2 . HIS H 53 ? 0.5414 0.4997 0.4762 0.0482 0.0014 -0.0450 53 HIS F NE2 11811 N N . ASN H 54 ? 0.4184 0.3782 0.3771 0.0374 0.0011 -0.0243 54 ASN F N 11812 C CA . ASN H 54 ? 0.4757 0.4382 0.4271 0.0417 -0.0020 -0.0217 54 ASN F CA 11813 C C . ASN H 54 ? 0.5417 0.5033 0.4968 0.0401 0.0014 -0.0148 54 ASN F C 11814 O O . ASN H 54 ? 0.5218 0.4868 0.4860 0.0378 -0.0030 -0.0138 54 ASN F O 11815 C CB . ASN H 54 ? 0.4422 0.4103 0.3993 0.0420 -0.0123 -0.0266 54 ASN F CB 11816 C CG . ASN H 54 ? 0.4890 0.4584 0.4395 0.0456 -0.0164 -0.0344 54 ASN F CG 11817 O OD1 . ASN H 54 ? 0.5116 0.4817 0.4472 0.0518 -0.0159 -0.0348 54 ASN F OD1 11818 N ND2 . ASN H 54 ? 0.4544 0.4248 0.4163 0.0421 -0.0205 -0.0406 54 ASN F ND2 11819 N N . GLY H 55 ? 0.5849 0.5423 0.5342 0.0417 0.0095 -0.0102 55 GLY F N 11820 C CA . GLY H 55 ? 0.5128 0.4687 0.4664 0.0403 0.0132 -0.0047 55 GLY F CA 11821 C C . GLY H 55 ? 0.5320 0.4824 0.4821 0.0418 0.0224 -0.0008 55 GLY F C 11822 O O . GLY H 55 ? 0.5835 0.5318 0.5264 0.0447 0.0262 -0.0009 55 GLY F O 11823 N N . SER H 56 ? 0.4888 0.4373 0.4451 0.0401 0.0260 0.0026 56 SER F N 11824 C CA . SER H 56 ? 0.5853 0.5287 0.5422 0.0413 0.0344 0.0066 56 SER F CA 11825 C C . SER H 56 ? 0.5751 0.5158 0.5432 0.0365 0.0367 0.0046 56 SER F C 11826 O O . SER H 56 ? 0.5787 0.5224 0.5528 0.0331 0.0322 0.0021 56 SER F O 11827 C CB . SER H 56 ? 0.6187 0.5621 0.5732 0.0451 0.0367 0.0126 56 SER F CB 11828 O OG . SER H 56 ? 0.7365 0.6832 0.6800 0.0502 0.0342 0.0146 56 SER F OG 11829 N N . PRO H 57 ? 0.6068 0.5425 0.5784 0.0365 0.0436 0.0058 57 PRO F N 11830 C CA . PRO H 57 ? 0.4782 0.4112 0.4610 0.0324 0.0455 0.0035 57 PRO F CA 11831 C C . PRO H 57 ? 0.4437 0.3778 0.4318 0.0320 0.0446 0.0042 57 PRO F C 11832 O O . PRO H 57 ? 0.4578 0.3913 0.4438 0.0353 0.0468 0.0085 57 PRO F O 11833 C CB . PRO H 57 ? 0.5537 0.4810 0.5399 0.0339 0.0535 0.0062 57 PRO F CB 11834 C CG . PRO H 57 ? 0.6297 0.5574 0.6050 0.0377 0.0551 0.0084 57 PRO F CG 11835 C CD . PRO H 57 ? 0.6494 0.5820 0.6151 0.0406 0.0498 0.0095 57 PRO F CD 11836 N N . ASN H 58 ? 0.4523 0.3884 0.4470 0.0283 0.0414 0.0001 58 ASN F N 11837 C CA . ASN H 58 ? 0.4133 0.3511 0.4127 0.0283 0.0405 -0.0003 58 ASN F CA 11838 C C . ASN H 58 ? 0.4141 0.3496 0.4231 0.0259 0.0423 -0.0045 58 ASN F C 11839 O O . ASN H 58 ? 0.3949 0.3325 0.4065 0.0229 0.0395 -0.0082 58 ASN F O 11840 C CB . ASN H 58 ? 0.3425 0.2871 0.3397 0.0275 0.0342 -0.0011 58 ASN F CB 11841 C CG . ASN H 58 ? 0.4836 0.4306 0.4842 0.0284 0.0337 -0.0011 58 ASN F CG 11842 O OD1 . ASN H 58 ? 0.6147 0.5581 0.6183 0.0301 0.0377 -0.0004 58 ASN F OD1 11843 N ND2 . ASN H 58 ? 0.3923 0.3456 0.3935 0.0276 0.0292 -0.0017 58 ASN F ND2 11844 N N . TYR H 59 ? 0.3784 0.3099 0.3938 0.0273 0.0466 -0.0040 59 TYR F N 11845 C CA . TYR H 59 ? 0.3232 0.2518 0.3495 0.0253 0.0482 -0.0087 59 TYR F CA 11846 C C . TYR H 59 ? 0.4132 0.3436 0.4451 0.0258 0.0465 -0.0128 59 TYR F C 11847 O O . TYR H 59 ? 0.3998 0.3322 0.4286 0.0282 0.0461 -0.0108 59 TYR F O 11848 C CB . TYR H 59 ? 0.3338 0.2553 0.3673 0.0264 0.0550 -0.0060 59 TYR F CB 11849 C CG . TYR H 59 ? 0.3911 0.3107 0.4191 0.0270 0.0580 -0.0020 59 TYR F CG 11850 C CD1 . TYR H 59 ? 0.3601 0.2808 0.3866 0.0242 0.0557 -0.0049 59 TYR F CD1 11851 C CD2 . TYR H 59 ? 0.3779 0.2950 0.4023 0.0309 0.0633 0.0048 59 TYR F CD2 11852 C CE1 . TYR H 59 ? 0.4526 0.3716 0.4739 0.0252 0.0586 -0.0019 59 TYR F CE1 11853 C CE2 . TYR H 59 ? 0.4185 0.3345 0.4365 0.0324 0.0663 0.0082 59 TYR F CE2 11854 C CZ . TYR H 59 ? 0.4662 0.3829 0.4825 0.0295 0.0639 0.0044 59 TYR F CZ 11855 O OH . TYR H 59 ? 0.4981 0.4138 0.5077 0.0315 0.0670 0.0072 59 TYR F OH 11856 N N . HIS H 60 ? 0.3959 0.3259 0.4363 0.0239 0.0455 -0.0188 60 HIS F N 11857 C CA . HIS H 60 ? 0.3615 0.2923 0.4088 0.0250 0.0444 -0.0243 60 HIS F CA 11858 C C . HIS H 60 ? 0.3766 0.3008 0.4339 0.0269 0.0499 -0.0228 60 HIS F C 11859 O O . HIS H 60 ? 0.3763 0.2948 0.4417 0.0262 0.0541 -0.0213 60 HIS F O 11860 C CB . HIS H 60 ? 0.3776 0.3101 0.4315 0.0228 0.0411 -0.0317 60 HIS F CB 11861 C CG . HIS H 60 ? 0.4562 0.3927 0.5130 0.0245 0.0378 -0.0387 60 HIS F CG 11862 N ND1 . HIS H 60 ? 0.5125 0.4450 0.5801 0.0262 0.0397 -0.0431 60 HIS F ND1 11863 C CD2 . HIS H 60 ? 0.4050 0.3496 0.4557 0.0253 0.0328 -0.0421 60 HIS F CD2 11864 C CE1 . HIS H 60 ? 0.4741 0.4121 0.5411 0.0281 0.0357 -0.0500 60 HIS F CE1 11865 N NE2 . HIS H 60 ? 0.4634 0.4091 0.5194 0.0278 0.0317 -0.0490 60 HIS F NE2 11866 N N . PRO H 61 ? 0.4114 0.3364 0.4693 0.0296 0.0505 -0.0227 61 PRO F N 11867 C CA . PRO H 61 ? 0.4436 0.3629 0.5120 0.0318 0.0560 -0.0200 61 PRO F CA 11868 C C . PRO H 61 ? 0.4694 0.3830 0.5556 0.0308 0.0586 -0.0247 61 PRO F C 11869 O O . PRO H 61 ? 0.5459 0.4538 0.6417 0.0318 0.0646 -0.0196 61 PRO F O 11870 C CB . PRO H 61 ? 0.4416 0.3642 0.5087 0.0344 0.0543 -0.0222 61 PRO F CB 11871 C CG . PRO H 61 ? 0.4649 0.3949 0.5172 0.0342 0.0495 -0.0210 61 PRO F CG 11872 C CD . PRO H 61 ? 0.4727 0.4046 0.5221 0.0310 0.0462 -0.0241 61 PRO F CD 11873 N N . SER H 62 ? 0.4359 0.3516 0.5273 0.0293 0.0540 -0.0341 62 SER F N 11874 C CA . SER H 62 ? 0.4645 0.3754 0.5744 0.0282 0.0549 -0.0401 62 SER F CA 11875 C C . SER H 62 ? 0.5081 0.4143 0.6233 0.0260 0.0588 -0.0354 62 SER F C 11876 O O . SER H 62 ? 0.5128 0.4135 0.6463 0.0254 0.0620 -0.0369 62 SER F O 11877 C CB . SER H 62 ? 0.6163 0.5320 0.7275 0.0273 0.0479 -0.0514 62 SER F CB 11878 O OG . SER H 62 ? 0.7907 0.7121 0.8943 0.0299 0.0443 -0.0555 62 SER F OG 11879 N N . LEU H 63 ? 0.4445 0.3530 0.5449 0.0249 0.0586 -0.0298 63 LEU F N 11880 C CA . LEU H 63 ? 0.4354 0.3406 0.5385 0.0230 0.0618 -0.0260 63 LEU F CA 11881 C C . LEU H 63 ? 0.4693 0.3721 0.5650 0.0252 0.0681 -0.0154 63 LEU F C 11882 O O . LEU H 63 ? 0.5061 0.4057 0.6042 0.0248 0.0724 -0.0112 63 LEU F O 11883 C CB . LEU H 63 ? 0.4051 0.3151 0.4983 0.0201 0.0563 -0.0294 63 LEU F CB 11884 C CG . LEU H 63 ? 0.4104 0.3233 0.5112 0.0182 0.0503 -0.0394 63 LEU F CG 11885 C CD1 . LEU H 63 ? 0.3427 0.2621 0.4318 0.0161 0.0448 -0.0409 63 LEU F CD1 11886 C CD2 . LEU H 63 ? 0.4354 0.3424 0.5557 0.0167 0.0527 -0.0423 63 LEU F CD2 11887 N N . LYS H 64 ? 0.4340 0.3387 0.5208 0.0280 0.0688 -0.0110 64 LYS F N 11888 C CA . LYS H 64 ? 0.5133 0.4179 0.5890 0.0307 0.0729 -0.0015 64 LYS F CA 11889 C C . LYS H 64 ? 0.5009 0.4000 0.5858 0.0326 0.0813 0.0057 64 LYS F C 11890 O O . LYS H 64 ? 0.5517 0.4512 0.6267 0.0341 0.0841 0.0115 64 LYS F O 11891 C CB . LYS H 64 ? 0.4969 0.4038 0.5664 0.0337 0.0725 0.0020 64 LYS F CB 11892 C CG . LYS H 64 ? 0.6060 0.5144 0.6618 0.0369 0.0750 0.0109 64 LYS F CG 11893 C CD . LYS H 64 ? 0.7047 0.6152 0.7570 0.0400 0.0748 0.0146 64 LYS F CD 11894 C CE . LYS H 64 ? 0.7918 0.7039 0.8321 0.0439 0.0774 0.0238 64 LYS F CE 11895 N NZ . LYS H 64 ? 0.8673 0.7808 0.9074 0.0473 0.0784 0.0287 64 LYS F NZ 11896 N N . SER H 65 ? 0.4520 0.3464 0.5567 0.0330 0.0855 0.0052 65 SER F N 11897 C CA . SER H 65 ? 0.4233 0.3129 0.5400 0.0356 0.0947 0.0137 65 SER F CA 11898 C C . SER H 65 ? 0.4852 0.3719 0.6093 0.0335 0.0972 0.0131 65 SER F C 11899 O O . SER H 65 ? 0.5718 0.4551 0.7039 0.0360 0.1054 0.0213 65 SER F O 11900 C CB . SER H 65 ? 0.5256 0.4111 0.6646 0.0369 0.0985 0.0138 65 SER F CB 11901 O OG . SER H 65 ? 0.5816 0.4653 0.7364 0.0333 0.0941 0.0029 65 SER F OG 11902 N N . ARG H 66 ? 0.3548 0.2432 0.4768 0.0293 0.0905 0.0043 66 ARG F N 11903 C CA . ARG H 66 ? 0.3520 0.2377 0.4826 0.0269 0.0922 0.0030 66 ARG F CA 11904 C C . ARG H 66 ? 0.4304 0.3199 0.5429 0.0251 0.0884 0.0018 66 ARG F C 11905 O O . ARG H 66 ? 0.4445 0.3320 0.5613 0.0236 0.0906 0.0022 66 ARG F O 11906 C CB . ARG H 66 ? 0.3505 0.2345 0.5000 0.0233 0.0878 -0.0069 66 ARG F CB 11907 C CG . ARG H 66 ? 0.4310 0.3111 0.6021 0.0247 0.0904 -0.0082 66 ARG F CG 11908 C CD . ARG H 66 ? 0.4149 0.2966 0.5976 0.0215 0.0823 -0.0210 66 ARG F CD 11909 N NE . ARG H 66 ? 0.4646 0.3483 0.6530 0.0176 0.0792 -0.0247 66 ARG F NE 11910 C CZ . ARG H 66 ? 0.4511 0.3382 0.6380 0.0148 0.0708 -0.0348 66 ARG F CZ 11911 N NH1 . ARG H 66 ? 0.2806 0.1697 0.4601 0.0157 0.0647 -0.0427 66 ARG F NH1 11912 N NH2 . ARG H 66 ? 0.4788 0.3679 0.6717 0.0116 0.0688 -0.0365 66 ARG F NH2 11913 N N . VAL H 67 ? 0.4200 0.3147 0.5140 0.0253 0.0829 0.0005 67 VAL F N 11914 C CA . VAL H 67 ? 0.4304 0.3291 0.5101 0.0232 0.0780 -0.0019 67 VAL F CA 11915 C C . VAL H 67 ? 0.4164 0.3169 0.4791 0.0265 0.0804 0.0046 67 VAL F C 11916 O O . VAL H 67 ? 0.4464 0.3481 0.5013 0.0301 0.0819 0.0094 67 VAL F O 11917 C CB . VAL H 67 ? 0.4289 0.3333 0.5014 0.0208 0.0691 -0.0089 67 VAL F CB 11918 C CG1 . VAL H 67 ? 0.4833 0.3920 0.5442 0.0187 0.0644 -0.0106 67 VAL F CG1 11919 C CG2 . VAL H 67 ? 0.5958 0.4998 0.6826 0.0183 0.0657 -0.0165 67 VAL F CG2 11920 N N . THR H 68 ? 0.3693 0.2702 0.4267 0.0254 0.0805 0.0042 68 THR F N 11921 C CA . THR H 68 ? 0.3651 0.2691 0.4050 0.0280 0.0800 0.0071 68 THR F CA 11922 C C . THR H 68 ? 0.3685 0.2760 0.4030 0.0241 0.0733 0.0010 68 THR F C 11923 O O . THR H 68 ? 0.4283 0.3342 0.4715 0.0210 0.0734 -0.0021 68 THR F O 11924 C CB . THR H 68 ? 0.4724 0.3735 0.5106 0.0322 0.0887 0.0140 68 THR F CB 11925 O OG1 . THR H 68 ? 0.6811 0.5784 0.7302 0.0352 0.0961 0.0203 68 THR F OG1 11926 C CG2 . THR H 68 ? 0.4383 0.3434 0.4569 0.0365 0.0878 0.0167 68 THR F CG2 11927 N N . ILE H 69 ? 0.3382 0.2508 0.3603 0.0245 0.0674 -0.0004 69 ILE F N 11928 C CA . ILE H 69 ? 0.4258 0.3421 0.4436 0.0216 0.0614 -0.0050 69 ILE F CA 11929 C C . ILE H 69 ? 0.4597 0.3778 0.4641 0.0250 0.0615 -0.0033 69 ILE F C 11930 O O . ILE H 69 ? 0.4685 0.3884 0.4635 0.0288 0.0611 -0.0003 69 ILE F O 11931 C CB . ILE H 69 ? 0.3637 0.2853 0.3810 0.0190 0.0537 -0.0086 69 ILE F CB 11932 C CG1 . ILE H 69 ? 0.3956 0.3164 0.4247 0.0163 0.0529 -0.0117 69 ILE F CG1 11933 C CG2 . ILE H 69 ? 0.2519 0.1778 0.2664 0.0165 0.0481 -0.0120 69 ILE F CG2 11934 C CD1 . ILE H 69 ? 0.3408 0.2674 0.3686 0.0152 0.0466 -0.0142 69 ILE F CD1 11935 N N . SER H 70 ? 0.3664 0.2841 0.3701 0.0240 0.0619 -0.0055 70 SER F N 11936 C CA . SER H 70 ? 0.4467 0.3662 0.4378 0.0279 0.0619 -0.0053 70 SER F CA 11937 C C . SER H 70 ? 0.4159 0.3385 0.4067 0.0249 0.0559 -0.0112 70 SER F C 11938 O O . SER H 70 ? 0.4080 0.3305 0.4091 0.0200 0.0539 -0.0142 70 SER F O 11939 C CB . SER H 70 ? 0.4845 0.4000 0.4736 0.0321 0.0710 -0.0009 70 SER F CB 11940 O OG . SER H 70 ? 0.5399 0.4516 0.5413 0.0287 0.0746 -0.0020 70 SER F OG 11941 N N . LEU H 71 ? 0.3749 0.3006 0.3547 0.0282 0.0527 -0.0129 71 LEU F N 11942 C CA . LEU H 71 ? 0.4326 0.3613 0.4133 0.0260 0.0471 -0.0188 71 LEU F CA 11943 C C . LEU H 71 ? 0.4576 0.3848 0.4311 0.0299 0.0510 -0.0204 71 LEU F C 11944 O O . LEU H 71 ? 0.4071 0.3334 0.3697 0.0359 0.0559 -0.0170 71 LEU F O 11945 C CB . LEU H 71 ? 0.4952 0.4293 0.4714 0.0266 0.0387 -0.0213 71 LEU F CB 11946 C CG . LEU H 71 ? 0.5861 0.5235 0.5694 0.0229 0.0334 -0.0206 71 LEU F CG 11947 C CD1 . LEU H 71 ? 0.6542 0.5967 0.6335 0.0245 0.0259 -0.0227 71 LEU F CD1 11948 C CD2 . LEU H 71 ? 0.6418 0.5801 0.6382 0.0172 0.0315 -0.0227 71 LEU F CD2 11949 N N . ASP H 72 ? 0.4505 0.3779 0.4301 0.0270 0.0491 -0.0253 72 ASP F N 11950 C CA . ASP H 72 ? 0.4256 0.3528 0.3980 0.0309 0.0512 -0.0287 72 ASP F CA 11951 C C . ASP H 72 ? 0.3621 0.2934 0.3382 0.0286 0.0427 -0.0362 72 ASP F C 11952 O O . ASP H 72 ? 0.3506 0.2815 0.3390 0.0237 0.0414 -0.0390 72 ASP F O 11953 C CB . ASP H 72 ? 0.4712 0.3936 0.4500 0.0302 0.0594 -0.0270 72 ASP F CB 11954 C CG . ASP H 72 ? 0.6504 0.5723 0.6187 0.0362 0.0640 -0.0288 72 ASP F CG 11955 O OD1 . ASP H 72 ? 0.6711 0.5966 0.6333 0.0382 0.0584 -0.0354 72 ASP F OD1 11956 O OD2 . ASP H 72 ? 0.7512 0.6696 0.7181 0.0395 0.0734 -0.0236 72 ASP F OD2 11957 N N . MET H 73 ? 0.4148 0.3501 0.3819 0.0322 0.0367 -0.0392 73 MET F N 11958 C CA . MET H 73 ? 0.4500 0.3896 0.4233 0.0300 0.0276 -0.0462 73 MET F CA 11959 C C . MET H 73 ? 0.4620 0.4009 0.4401 0.0295 0.0278 -0.0526 73 MET F C 11960 O O . MET H 73 ? 0.5864 0.5271 0.5787 0.0247 0.0228 -0.0563 73 MET F O 11961 C CB . MET H 73 ? 0.4981 0.4419 0.4603 0.0351 0.0214 -0.0489 73 MET F CB 11962 C CG . MET H 73 ? 0.5039 0.4488 0.4617 0.0360 0.0209 -0.0427 73 MET F CG 11963 S SD . MET H 73 ? 0.5641 0.5108 0.5386 0.0284 0.0165 -0.0397 73 MET F SD 11964 C CE . MET H 73 ? 0.4411 0.3934 0.4253 0.0268 0.0057 -0.0472 73 MET F CE 11965 N N . SER H 74 ? 0.4281 0.3647 0.3952 0.0350 0.0339 -0.0536 74 SER F N 11966 C CA . SER H 74 ? 0.4710 0.4070 0.4416 0.0354 0.0344 -0.0603 74 SER F CA 11967 C C . SER H 74 ? 0.4748 0.4070 0.4605 0.0293 0.0392 -0.0580 74 SER F C 11968 O O . SER H 74 ? 0.5359 0.4686 0.5328 0.0263 0.0367 -0.0633 74 SER F O 11969 C CB . SER H 74 ? 0.4630 0.3985 0.4159 0.0441 0.0400 -0.0619 74 SER F CB 11970 O OG . SER H 74 ? 0.6146 0.5462 0.5618 0.0464 0.0504 -0.0531 74 SER F OG 11971 N N . LYS H 75 ? 0.4352 0.3639 0.4227 0.0276 0.0458 -0.0502 75 LYS F N 11972 C CA . LYS H 75 ? 0.4059 0.3315 0.4085 0.0219 0.0495 -0.0480 75 LYS F CA 11973 C C . LYS H 75 ? 0.3898 0.3183 0.4071 0.0149 0.0426 -0.0479 75 LYS F C 11974 O O . LYS H 75 ? 0.3849 0.3126 0.4160 0.0100 0.0432 -0.0476 75 LYS F O 11975 C CB . LYS H 75 ? 0.4243 0.3452 0.4256 0.0229 0.0585 -0.0405 75 LYS F CB 11976 C CG . LYS H 75 ? 0.6031 0.5212 0.5933 0.0298 0.0673 -0.0388 75 LYS F CG 11977 C CD . LYS H 75 ? 0.7041 0.6175 0.6985 0.0301 0.0765 -0.0307 75 LYS F CD 11978 C CE . LYS H 75 ? 0.8078 0.7190 0.7930 0.0374 0.0865 -0.0276 75 LYS F CE 11979 N NZ . LYS H 75 ? 0.8555 0.7619 0.8490 0.0373 0.0958 -0.0191 75 LYS F NZ 11980 N N . ASN H 76 ? 0.4032 0.3356 0.4175 0.0150 0.0363 -0.0477 76 ASN F N 11981 C CA . ASN H 76 ? 0.2770 0.2131 0.3034 0.0095 0.0305 -0.0462 76 ASN F CA 11982 C C . ASN H 76 ? 0.3344 0.2684 0.3665 0.0063 0.0344 -0.0406 76 ASN F C 11983 O O . ASN H 76 ? 0.3466 0.2829 0.3913 0.0016 0.0319 -0.0396 76 ASN F O 11984 C CB . ASN H 76 ? 0.3730 0.3120 0.4142 0.0057 0.0258 -0.0505 76 ASN F CB 11985 C CG . ASN H 76 ? 0.3513 0.2964 0.4003 0.0036 0.0177 -0.0509 76 ASN F CG 11986 O OD1 . ASN H 76 ? 0.4078 0.3550 0.4499 0.0067 0.0134 -0.0530 76 ASN F OD1 11987 N ND2 . ASN H 76 ? 0.2998 0.2481 0.3641 -0.0014 0.0154 -0.0484 76 ASN F ND2 11988 N N . GLN H 77 ? 0.3565 0.2866 0.3796 0.0094 0.0403 -0.0369 77 GLN F N 11989 C CA . GLN H 77 ? 0.3427 0.2701 0.3713 0.0072 0.0441 -0.0325 77 GLN F CA 11990 C C . GLN H 77 ? 0.3609 0.2883 0.3813 0.0098 0.0446 -0.0288 77 GLN F C 11991 O O . GLN H 77 ? 0.3308 0.2587 0.3393 0.0143 0.0445 -0.0285 77 GLN F O 11992 C CB . GLN H 77 ? 0.3061 0.2279 0.3370 0.0081 0.0524 -0.0309 77 GLN F CB 11993 C CG . GLN H 77 ? 0.4194 0.3403 0.4589 0.0058 0.0533 -0.0340 77 GLN F CG 11994 C CD . GLN H 77 ? 0.3963 0.3116 0.4370 0.0079 0.0624 -0.0317 77 GLN F CD 11995 O OE1 . GLN H 77 ? 0.5030 0.4150 0.5394 0.0109 0.0681 -0.0273 77 GLN F OE1 11996 N NE2 . GLN H 77 ? 0.4554 0.3695 0.5032 0.0065 0.0642 -0.0343 77 GLN F NE2 11997 N N . PHE H 78 ? 0.3341 0.2611 0.3609 0.0073 0.0449 -0.0264 78 PHE F N 11998 C CA . PHE H 78 ? 0.3311 0.2565 0.3523 0.0100 0.0474 -0.0228 78 PHE F CA 11999 C C . PHE H 78 ? 0.3842 0.3058 0.4150 0.0082 0.0518 -0.0209 78 PHE F C 12000 O O . PHE H 78 ? 0.3794 0.3011 0.4210 0.0043 0.0507 -0.0228 78 PHE F O 12001 C CB . PHE H 78 ? 0.3836 0.3141 0.4018 0.0098 0.0411 -0.0226 78 PHE F CB 12002 C CG . PHE H 78 ? 0.4237 0.3585 0.4516 0.0055 0.0361 -0.0237 78 PHE F CG 12003 C CD1 . PHE H 78 ? 0.3095 0.2486 0.3434 0.0028 0.0315 -0.0260 78 PHE F CD1 12004 C CD2 . PHE H 78 ? 0.3760 0.3113 0.4071 0.0048 0.0361 -0.0225 78 PHE F CD2 12005 C CE1 . PHE H 78 ? 0.2711 0.2154 0.3135 -0.0004 0.0274 -0.0257 78 PHE F CE1 12006 C CE2 . PHE H 78 ? 0.2675 0.2080 0.3057 0.0019 0.0316 -0.0233 78 PHE F CE2 12007 C CZ . PHE H 78 ? 0.2799 0.2251 0.3234 -0.0005 0.0275 -0.0244 78 PHE F CZ 12008 N N . SER H 79 ? 0.4067 0.3249 0.4346 0.0113 0.0565 -0.0173 79 SER F N 12009 C CA . SER H 79 ? 0.4015 0.3149 0.4402 0.0105 0.0619 -0.0156 79 SER F CA 12010 C C . SER H 79 ? 0.4051 0.3181 0.4466 0.0110 0.0616 -0.0143 79 SER F C 12011 O O . SER H 79 ? 0.3699 0.2854 0.4028 0.0132 0.0594 -0.0130 79 SER F O 12012 C CB . SER H 79 ? 0.4368 0.3453 0.4739 0.0143 0.0706 -0.0116 79 SER F CB 12013 O OG . SER H 79 ? 0.5965 0.5053 0.6304 0.0145 0.0713 -0.0134 79 SER F OG 12014 N N . LEU H 80 ? 0.3780 0.2879 0.4329 0.0090 0.0636 -0.0151 80 LEU F N 12015 C CA . LEU H 80 ? 0.3203 0.2290 0.3812 0.0096 0.0640 -0.0149 80 LEU F CA 12016 C C . LEU H 80 ? 0.3682 0.2704 0.4411 0.0110 0.0718 -0.0116 80 LEU F C 12017 O O . LEU H 80 ? 0.3884 0.2878 0.4717 0.0091 0.0744 -0.0122 80 LEU F O 12018 C CB . LEU H 80 ? 0.3050 0.2174 0.3731 0.0060 0.0572 -0.0204 80 LEU F CB 12019 C CG . LEU H 80 ? 0.3234 0.2338 0.4014 0.0064 0.0575 -0.0223 80 LEU F CG 12020 C CD1 . LEU H 80 ? 0.2525 0.1641 0.3223 0.0096 0.0575 -0.0202 80 LEU F CD1 12021 C CD2 . LEU H 80 ? 0.3398 0.2542 0.4255 0.0034 0.0510 -0.0287 80 LEU F CD2 12022 N N . ASN H 81 ? 0.3648 0.2648 0.4376 0.0144 0.0758 -0.0077 81 ASN F N 12023 C CA . ASN H 81 ? 0.4287 0.3229 0.5159 0.0161 0.0834 -0.0037 81 ASN F CA 12024 C C . ASN H 81 ? 0.4310 0.3242 0.5290 0.0158 0.0816 -0.0062 81 ASN F C 12025 O O . ASN H 81 ? 0.4398 0.3356 0.5296 0.0174 0.0791 -0.0060 81 ASN F O 12026 C CB . ASN H 81 ? 0.6444 0.5367 0.7239 0.0216 0.0916 0.0048 81 ASN F CB 12027 C CG . ASN H 81 ? 0.8433 0.7336 0.9227 0.0228 0.0974 0.0080 81 ASN F CG 12028 O OD1 . ASN H 81 ? 0.7762 0.6666 0.8599 0.0191 0.0948 0.0036 81 ASN F OD1 12029 N ND2 . ASN H 81 ? 1.1639 1.0528 1.2384 0.0284 0.1057 0.0161 81 ASN F ND2 12030 N N . LEU H 82 ? 0.3671 0.2568 0.4847 0.0137 0.0827 -0.0090 82 LEU F N 12031 C CA . LEU H 82 ? 0.3717 0.2599 0.5026 0.0139 0.0816 -0.0120 82 LEU F CA 12032 C C . LEU H 82 ? 0.4002 0.2819 0.5528 0.0150 0.0896 -0.0079 82 LEU F C 12033 O O . LEU H 82 ? 0.3928 0.2724 0.5591 0.0125 0.0902 -0.0098 82 LEU F O 12034 C CB . LEU H 82 ? 0.4361 0.3279 0.5713 0.0102 0.0724 -0.0222 82 LEU F CB 12035 C CG . LEU H 82 ? 0.4629 0.3546 0.6089 0.0107 0.0692 -0.0279 82 LEU F CG 12036 C CD1 . LEU H 82 ? 0.4155 0.3096 0.5484 0.0136 0.0689 -0.0255 82 LEU F CD1 12037 C CD2 . LEU H 82 ? 0.5422 0.4386 0.6912 0.0078 0.0601 -0.0380 82 LEU F CD2 12038 N N . THR H 83 A 0.4023 0.2814 0.5588 0.0189 0.0958 -0.0014 82 THR F N 12039 C CA . THR H 83 A 0.3694 0.2457 0.5464 0.0201 0.1034 0.0045 82 THR F CA 12040 C C . THR H 83 A 0.4282 0.3086 0.6243 0.0172 0.0984 -0.0019 82 THR F C 12041 O O . THR H 83 A 0.3687 0.2502 0.5619 0.0163 0.0914 -0.0096 82 THR F O 12042 C CB . THR H 83 A 0.4193 0.2925 0.5922 0.0262 0.1133 0.0162 82 THR F CB 12043 O OG1 . THR H 83 A 0.4391 0.3134 0.6065 0.0278 0.1105 0.0151 82 THR F OG1 12044 C CG2 . THR H 83 A 0.4058 0.2809 0.5560 0.0290 0.1164 0.0222 82 THR F CG2 12045 N N . SER H 84 B 0.4039 0.2868 0.6198 0.0163 0.1022 0.0014 82 SER F N 12046 C CA . SER H 84 B 0.3869 0.2736 0.6240 0.0141 0.0984 -0.0040 82 SER F CA 12047 C C . SER H 84 B 0.4080 0.2976 0.6451 0.0106 0.0868 -0.0171 82 SER F C 12048 O O . SER H 84 B 0.4252 0.3157 0.6647 0.0109 0.0819 -0.0234 82 SER F O 12049 C CB . SER H 84 B 0.4113 0.2969 0.6521 0.0172 0.1019 -0.0001 82 SER F CB 12050 O OG . SER H 84 B 0.4712 0.3548 0.7113 0.0213 0.1129 0.0130 82 SER F OG 12051 N N . VAL H 85 C 0.3299 0.2213 0.5640 0.0079 0.0825 -0.0212 82 VAL F N 12052 C CA . VAL H 85 C 0.3627 0.2574 0.5947 0.0054 0.0718 -0.0329 82 VAL F CA 12053 C C . VAL H 85 C 0.3886 0.2877 0.6421 0.0038 0.0668 -0.0398 82 VAL F C 12054 O O . VAL H 85 C 0.2843 0.1849 0.5570 0.0035 0.0713 -0.0357 82 VAL F O 12055 C CB . VAL H 85 C 0.3286 0.2246 0.5525 0.0029 0.0686 -0.0347 82 VAL F CB 12056 C CG1 . VAL H 85 C 0.2362 0.1282 0.4387 0.0043 0.0721 -0.0298 82 VAL F CG1 12057 C CG2 . VAL H 85 C 0.2626 0.1608 0.5022 0.0013 0.0724 -0.0306 82 VAL F CG2 12058 N N . THR H 86 ? 0.2668 0.1684 0.5175 0.0035 0.0578 -0.0505 83 THR F N 12059 C CA . THR H 86 ? 0.3547 0.2612 0.6236 0.0023 0.0511 -0.0594 83 THR F CA 12060 C C . THR H 86 ? 0.3308 0.2410 0.5913 0.0012 0.0413 -0.0692 83 THR F C 12061 O O . THR H 86 ? 0.3374 0.2465 0.5795 0.0010 0.0405 -0.0684 83 THR F O 12062 C CB . THR H 86 ? 0.4086 0.3153 0.6852 0.0042 0.0496 -0.0639 83 THR F CB 12063 O OG1 . THR H 86 ? 0.4326 0.3387 0.6905 0.0061 0.0449 -0.0698 83 THR F OG1 12064 C CG2 . THR H 86 ? 0.3921 0.2953 0.6763 0.0057 0.0595 -0.0533 83 THR F CG2 12065 N N . ALA H 87 ? 0.3254 0.2405 0.6003 0.0006 0.0340 -0.0785 84 ALA F N 12066 C CA . ALA H 87 ? 0.3992 0.3191 0.6679 0.0003 0.0242 -0.0883 84 ALA F CA 12067 C C . ALA H 87 ? 0.4022 0.3220 0.6498 0.0026 0.0204 -0.0935 84 ALA F C 12068 O O . ALA H 87 ? 0.3948 0.3183 0.6321 0.0027 0.0140 -0.0993 84 ALA F O 12069 C CB . ALA H 87 ? 0.3990 0.3244 0.6875 0.0005 0.0169 -0.0981 84 ALA F CB 12070 N N . ALA H 88 ? 0.3202 0.2366 0.5622 0.0047 0.0245 -0.0910 85 ALA F N 12071 C CA . ALA H 88 ? 0.3699 0.2865 0.5927 0.0075 0.0220 -0.0950 85 ALA F CA 12072 C C . ALA H 88 ? 0.3825 0.2966 0.5871 0.0069 0.0254 -0.0885 85 ALA F C 12073 O O . ALA H 88 ? 0.3176 0.2333 0.5068 0.0090 0.0228 -0.0919 85 ALA F O 12074 C CB . ALA H 88 ? 0.3516 0.2654 0.5754 0.0101 0.0259 -0.0937 85 ALA F CB 12075 N N . ASP H 89 ? 0.3948 0.3055 0.6019 0.0044 0.0312 -0.0793 86 ASP F N 12076 C CA . ASP H 89 ? 0.4080 0.3162 0.5993 0.0038 0.0346 -0.0732 86 ASP F CA 12077 C C . ASP H 89 ? 0.3424 0.2542 0.5321 0.0012 0.0298 -0.0759 86 ASP F C 12078 O O . ASP H 89 ? 0.4078 0.3189 0.5860 0.0002 0.0315 -0.0717 86 ASP F O 12079 C CB . ASP H 89 ? 0.3448 0.2473 0.5370 0.0035 0.0445 -0.0615 86 ASP F CB 12080 C CG . ASP H 89 ? 0.4594 0.3583 0.6520 0.0065 0.0498 -0.0575 86 ASP F CG 12081 O OD1 . ASP H 89 ? 0.3786 0.2774 0.5604 0.0089 0.0481 -0.0606 86 ASP F OD1 12082 O OD2 . ASP H 89 ? 0.4608 0.3576 0.6654 0.0067 0.0559 -0.0511 86 ASP F OD2 12083 N N . THR H 90 ? 0.3647 0.2814 0.5667 0.0002 0.0235 -0.0828 87 THR F N 12084 C CA . THR H 90 ? 0.3688 0.2900 0.5704 -0.0017 0.0177 -0.0864 87 THR F CA 12085 C C . THR H 90 ? 0.3500 0.2756 0.5346 -0.0001 0.0125 -0.0910 87 THR F C 12086 O O . THR H 90 ? 0.3507 0.2818 0.5294 0.0030 0.0074 -0.0977 87 THR F O 12087 C CB . THR H 90 ? 0.3440 0.2704 0.5620 -0.0020 0.0109 -0.0943 87 THR F CB 12088 O OG1 . THR H 90 ? 0.3710 0.2955 0.6057 -0.0039 0.0159 -0.0884 87 THR F OG1 12089 C CG2 . THR H 90 ? 0.3332 0.2654 0.5491 -0.0030 0.0033 -0.0996 87 THR F CG2 12090 N N . ALA H 91 ? 0.2895 0.2180 0.4624 -0.0021 0.0137 -0.0841 88 ALA F N 12091 C CA . ALA H 91 ? 0.3396 0.2779 0.4929 -0.0007 0.0094 -0.0828 88 ALA F CA 12092 C C . ALA H 91 ? 0.3224 0.2623 0.4700 -0.0036 0.0110 -0.0756 88 ALA F C 12093 O O . ALA H 91 ? 0.3576 0.2906 0.5132 -0.0063 0.0164 -0.0711 88 ALA F O 12094 C CB . ALA H 91 ? 0.2040 0.1429 0.3427 0.0021 0.0123 -0.0792 88 ALA F CB 12095 N N . VAL H 92 ? 0.2846 0.2342 0.4194 -0.0028 0.0065 -0.0743 89 VAL F N 12096 C CA . VAL H 92 ? 0.2429 0.1944 0.3707 -0.0051 0.0086 -0.0667 89 VAL F CA 12097 C C . VAL H 92 ? 0.2186 0.1679 0.3336 -0.0039 0.0134 -0.0604 89 VAL F C 12098 O O . VAL H 92 ? 0.2510 0.2046 0.3563 -0.0009 0.0118 -0.0610 89 VAL F O 12099 C CB . VAL H 92 ? 0.2571 0.2203 0.3789 -0.0045 0.0022 -0.0667 89 VAL F CB 12100 C CG1 . VAL H 92 ? 0.1926 0.1572 0.3096 -0.0069 0.0046 -0.0587 89 VAL F CG1 12101 C CG2 . VAL H 92 ? 0.2663 0.2326 0.4003 -0.0052 -0.0034 -0.0730 89 VAL F CG2 12102 N N . TYR H 93 ? 0.2531 0.1960 0.3683 -0.0059 0.0193 -0.0548 90 TYR F N 12103 C CA . TYR H 93 ? 0.2470 0.1883 0.3500 -0.0046 0.0231 -0.0492 90 TYR F CA 12104 C C . TYR H 93 ? 0.3349 0.2816 0.4305 -0.0059 0.0217 -0.0447 90 TYR F C 12105 O O . TYR H 93 ? 0.2873 0.2336 0.3890 -0.0085 0.0219 -0.0437 90 TYR F O 12106 C CB . TYR H 93 ? 0.2482 0.1795 0.3547 -0.0046 0.0307 -0.0459 90 TYR F CB 12107 C CG . TYR H 93 ? 0.2501 0.1760 0.3646 -0.0028 0.0331 -0.0487 90 TYR F CG 12108 C CD1 . TYR H 93 ? 0.2850 0.2093 0.4150 -0.0037 0.0310 -0.0547 90 TYR F CD1 12109 C CD2 . TYR H 93 ? 0.2106 0.1333 0.3190 -0.0002 0.0371 -0.0455 90 TYR F CD2 12110 C CE1 . TYR H 93 ? 0.2931 0.2125 0.4335 -0.0021 0.0330 -0.0577 90 TYR F CE1 12111 C CE2 . TYR H 93 ? 0.3116 0.2294 0.4295 0.0015 0.0396 -0.0477 90 TYR F CE2 12112 C CZ . TYR H 93 ? 0.2701 0.1861 0.4048 0.0005 0.0376 -0.0539 90 TYR F CZ 12113 O OH . TYR H 93 ? 0.2687 0.1798 0.4159 0.0021 0.0398 -0.0565 90 TYR F OH 12114 N N . PHE H 94 ? 0.2418 0.1937 0.3263 -0.0040 0.0201 -0.0420 91 PHE F N 12115 C CA . PHE H 94 ? 0.2777 0.2348 0.3574 -0.0050 0.0187 -0.0376 91 PHE F CA 12116 C C . PHE H 94 ? 0.3085 0.2619 0.3800 -0.0040 0.0221 -0.0337 91 PHE F C 12117 O O . PHE H 94 ? 0.2833 0.2348 0.3489 -0.0016 0.0235 -0.0333 91 PHE F O 12118 C CB . PHE H 94 ? 0.3023 0.2703 0.3777 -0.0032 0.0135 -0.0369 91 PHE F CB 12119 C CG . PHE H 94 ? 0.2783 0.2522 0.3594 -0.0030 0.0092 -0.0406 91 PHE F CG 12120 C CD1 . PHE H 94 ? 0.2517 0.2300 0.3393 -0.0053 0.0070 -0.0392 91 PHE F CD1 12121 C CD2 . PHE H 94 ? 0.3143 0.2904 0.3943 -0.0002 0.0069 -0.0459 91 PHE F CD2 12122 C CE1 . PHE H 94 ? 0.2243 0.2092 0.3167 -0.0047 0.0024 -0.0424 91 PHE F CE1 12123 C CE2 . PHE H 94 ? 0.2422 0.2248 0.3265 0.0007 0.0020 -0.0502 91 PHE F CE2 12124 C CZ . PHE H 94 ? 0.2664 0.2536 0.3564 -0.0015 -0.0004 -0.0482 91 PHE F CZ 12125 N N . CYS H 95 ? 0.2420 0.1948 0.3138 -0.0058 0.0230 -0.0311 92 CYS F N 12126 C CA . CYS H 95 ? 0.2597 0.2120 0.3233 -0.0045 0.0239 -0.0281 92 CYS F CA 12127 C C . CYS H 95 ? 0.2544 0.2158 0.3172 -0.0045 0.0191 -0.0257 92 CYS F C 12128 O O . CYS H 95 ? 0.2409 0.2085 0.3098 -0.0058 0.0161 -0.0255 92 CYS F O 12129 C CB . CYS H 95 ? 0.2400 0.1865 0.3040 -0.0055 0.0275 -0.0275 92 CYS F CB 12130 S SG . CYS H 95 ? 0.3865 0.3354 0.4603 -0.0091 0.0260 -0.0279 92 CYS F SG 12131 N N . ALA H 96 ? 0.1706 0.1334 0.2268 -0.0026 0.0184 -0.0233 93 ALA F N 12132 C CA . ALA H 96 ? 0.2245 0.1960 0.2821 -0.0023 0.0144 -0.0202 93 ALA F CA 12133 C C . ALA H 96 ? 0.2422 0.2132 0.2956 -0.0011 0.0138 -0.0183 93 ALA F C 12134 O O . ALA H 96 ? 0.2858 0.2513 0.3318 0.0006 0.0161 -0.0190 93 ALA F O 12135 C CB . ALA H 96 ? 0.2558 0.2336 0.3112 0.0000 0.0126 -0.0194 93 ALA F CB 12136 N N . ARG H 97 ? 0.2244 0.2015 0.2838 -0.0019 0.0105 -0.0158 94 ARG F N 12137 C CA . ARG H 97 ? 0.1643 0.1426 0.2223 -0.0007 0.0085 -0.0143 94 ARG F CA 12138 C C . ARG H 97 ? 0.2712 0.2561 0.3281 0.0016 0.0067 -0.0103 94 ARG F C 12139 O O . ARG H 97 ? 0.2734 0.2653 0.3350 0.0018 0.0057 -0.0076 94 ARG F O 12140 C CB . ARG H 97 ? 0.1699 0.1511 0.2383 -0.0028 0.0057 -0.0140 94 ARG F CB 12141 C CG . ARG H 97 ? 0.1611 0.1443 0.2309 -0.0015 0.0024 -0.0133 94 ARG F CG 12142 C CD . ARG H 97 ? 0.2002 0.1872 0.2842 -0.0036 -0.0009 -0.0132 94 ARG F CD 12143 N NE . ARG H 97 ? 0.2046 0.2006 0.3006 -0.0042 -0.0026 -0.0074 94 ARG F NE 12144 C CZ . ARG H 97 ? 0.2749 0.2763 0.3868 -0.0056 -0.0055 -0.0053 94 ARG F CZ 12145 N NH1 . ARG H 97 ? 0.2077 0.2057 0.3252 -0.0068 -0.0077 -0.0099 94 ARG F NH1 12146 N NH2 . ARG H 97 ? 0.3254 0.3357 0.4480 -0.0055 -0.0061 0.0016 94 ARG F NH2 12147 N N . ARG H 98 ? 0.2437 0.2270 0.2945 0.0039 0.0064 -0.0097 95 ARG F N 12148 C CA . ARG H 98 ? 0.2394 0.2296 0.2920 0.0060 0.0043 -0.0053 95 ARG F CA 12149 C C . ARG H 98 ? 0.2811 0.2756 0.3443 0.0049 0.0005 -0.0032 95 ARG F C 12150 O O . ARG H 98 ? 0.2696 0.2604 0.3322 0.0048 -0.0012 -0.0058 95 ARG F O 12151 C CB . ARG H 98 ? 0.2042 0.1911 0.2473 0.0089 0.0055 -0.0052 95 ARG F CB 12152 C CG . ARG H 98 ? 0.2535 0.2354 0.2887 0.0099 0.0093 -0.0076 95 ARG F CG 12153 C CD . ARG H 98 ? 0.2325 0.2138 0.2612 0.0130 0.0104 -0.0061 95 ARG F CD 12154 N NE . ARG H 98 ? 0.2788 0.2684 0.3107 0.0149 0.0088 -0.0021 95 ARG F NE 12155 C CZ . ARG H 98 ? 0.3305 0.3214 0.3582 0.0178 0.0101 -0.0009 95 ARG F CZ 12156 N NH1 . ARG H 98 ? 0.3295 0.3137 0.3507 0.0190 0.0129 -0.0033 95 ARG F NH1 12157 N NH2 . ARG H 98 ? 0.2887 0.2878 0.3196 0.0200 0.0092 0.0033 95 ARG F NH2 12158 N N . SER H 99 ? 0.3101 0.3130 0.3841 0.0045 -0.0008 0.0013 96 SER F N 12159 C CA . SER H 99 ? 0.3361 0.3438 0.4244 0.0034 -0.0043 0.0039 96 SER F CA 12160 C C . SER H 99 ? 0.3785 0.3881 0.4683 0.0056 -0.0067 0.0062 96 SER F C 12161 O O . SER H 99 ? 0.2426 0.2513 0.3227 0.0081 -0.0053 0.0072 96 SER F O 12162 C CB . SER H 99 ? 0.3092 0.3262 0.4098 0.0030 -0.0043 0.0099 96 SER F CB 12163 O OG . SER H 99 ? 0.3624 0.3867 0.4621 0.0063 -0.0034 0.0159 96 SER F OG 12164 N N . ASN H 100 ? 0.1497 0.1621 0.2534 0.0046 -0.0105 0.0068 97 ASN F N 12165 C CA . ASN H 100 ? 0.2694 0.2836 0.3778 0.0063 -0.0139 0.0084 97 ASN F CA 12166 C C . ASN H 100 ? 0.3165 0.3404 0.4375 0.0079 -0.0139 0.0173 97 ASN F C 12167 O O . ASN H 100 ? 0.4034 0.4305 0.5341 0.0091 -0.0169 0.0199 97 ASN F O 12168 C CB . ASN H 100 ? 0.2516 0.2637 0.3701 0.0047 -0.0188 0.0033 97 ASN F CB 12169 C CG . ASN H 100 ? 0.2413 0.2533 0.3607 0.0068 -0.0232 0.0021 97 ASN F CG 12170 O OD1 . ASN H 100 ? 0.2447 0.2536 0.3498 0.0091 -0.0220 0.0018 97 ASN F OD1 12171 N ND2 . ASN H 100 ? 0.2160 0.2315 0.3537 0.0061 -0.0284 0.0015 97 ASN F ND2 12172 N N . TRP H 101 ? 0.2864 0.3157 0.4076 0.0085 -0.0104 0.0222 98 TRP F N 12173 C CA . TRP H 101 ? 0.2611 0.3004 0.3909 0.0113 -0.0090 0.0315 98 TRP F CA 12174 C C . TRP H 101 ? 0.2132 0.2518 0.3309 0.0147 -0.0073 0.0326 98 TRP F C 12175 O O . TRP H 101 ? 0.2349 0.2658 0.3367 0.0148 -0.0064 0.0267 98 TRP F O 12176 C CB . TRP H 101 ? 0.2568 0.3026 0.3871 0.0119 -0.0058 0.0358 98 TRP F CB 12177 C CG . TRP H 101 ? 0.3489 0.3992 0.4974 0.0094 -0.0071 0.0387 98 TRP F CG 12178 C CD1 . TRP H 101 ? 0.3794 0.4317 0.5480 0.0078 -0.0103 0.0408 98 TRP F CD1 12179 C CD2 . TRP H 101 ? 0.3778 0.4310 0.5276 0.0083 -0.0054 0.0397 98 TRP F CD2 12180 N NE1 . TRP H 101 ? 0.4478 0.5040 0.6307 0.0057 -0.0103 0.0433 98 TRP F NE1 12181 C CE2 . TRP H 101 ? 0.4287 0.4858 0.6000 0.0060 -0.0073 0.0431 98 TRP F CE2 12182 C CE3 . TRP H 101 ? 0.4637 0.5169 0.5998 0.0091 -0.0030 0.0379 98 TRP F CE3 12183 C CZ2 . TRP H 101 ? 0.5481 0.6090 0.7269 0.0045 -0.0063 0.0454 98 TRP F CZ2 12184 C CZ3 . TRP H 101 ? 0.5540 0.6113 0.6972 0.0077 -0.0026 0.0398 98 TRP F CZ3 12185 C CH2 . TRP H 101 ? 0.6318 0.6930 0.7959 0.0054 -0.0040 0.0439 98 TRP F CH2 12186 N N . PRO H 102 ? 0.2625 0.3092 0.3892 0.0178 -0.0066 0.0408 99 PRO F N 12187 C CA . PRO H 102 ? 0.2505 0.2973 0.3672 0.0213 -0.0047 0.0425 99 PRO F CA 12188 C C . PRO H 102 ? 0.3067 0.3498 0.4036 0.0228 -0.0011 0.0383 99 PRO F C 12189 O O . PRO H 102 ? 0.3432 0.3896 0.4371 0.0231 0.0010 0.0386 99 PRO F O 12190 C CB . PRO H 102 ? 0.2884 0.3468 0.4186 0.0248 -0.0027 0.0534 99 PRO F CB 12191 C CG . PRO H 102 ? 0.2821 0.3445 0.4343 0.0223 -0.0057 0.0569 99 PRO F CG 12192 C CD . PRO H 102 ? 0.2452 0.3015 0.3939 0.0181 -0.0073 0.0494 99 PRO F CD 12193 N N . TYR H 103 ? 0.2204 0.2568 0.3055 0.0237 -0.0007 0.0342 100 TYR F N 12194 C CA . TYR H 103 ? 0.3035 0.3351 0.3721 0.0251 0.0025 0.0295 100 TYR F CA 12195 C C . TYR H 103 ? 0.2970 0.3210 0.3588 0.0218 0.0025 0.0221 100 TYR F C 12196 O O . TYR H 103 ? 0.2448 0.2639 0.2955 0.0224 0.0048 0.0176 100 TYR F O 12197 C CB . TYR H 103 ? 0.3169 0.3566 0.3825 0.0290 0.0059 0.0334 100 TYR F CB 12198 C CG . TYR H 103 ? 0.3561 0.4034 0.4275 0.0331 0.0072 0.0411 100 TYR F CG 12199 C CD1 . TYR H 103 ? 0.3877 0.4319 0.4522 0.0355 0.0085 0.0405 100 TYR F CD1 12200 C CD2 . TYR H 103 ? 0.3754 0.4331 0.4604 0.0347 0.0075 0.0498 100 TYR F CD2 12201 C CE1 . TYR H 103 ? 0.4217 0.4728 0.4923 0.0393 0.0101 0.0478 100 TYR F CE1 12202 C CE2 . TYR H 103 ? 0.3406 0.4055 0.4323 0.0387 0.0093 0.0578 100 TYR F CE2 12203 C CZ . TYR H 103 ? 0.3973 0.4587 0.4814 0.0410 0.0105 0.0566 100 TYR F CZ 12204 O OH . TYR H 103 ? 0.4350 0.5034 0.5265 0.0451 0.0127 0.0648 100 TYR F OH 12205 N N . LEU H 104 A 0.2916 0.3143 0.3614 0.0184 -0.0001 0.0208 100 LEU F N 12206 C CA . LEU H 104 A 0.2487 0.2640 0.3135 0.0153 0.0000 0.0143 100 LEU F CA 12207 C C . LEU H 104 A 0.3002 0.3157 0.3590 0.0154 0.0027 0.0121 100 LEU F C 12208 O O . LEU H 104 A 0.2645 0.2730 0.3138 0.0151 0.0047 0.0069 100 LEU F O 12209 C CB . LEU H 104 A 0.1803 0.1862 0.2351 0.0152 0.0002 0.0092 100 LEU F CB 12210 C CG . LEU H 104 A 0.2365 0.2416 0.2930 0.0163 -0.0027 0.0104 100 LEU F CG 12211 C CD1 . LEU H 104 A 0.2457 0.2421 0.2903 0.0169 -0.0018 0.0058 100 LEU F CD1 12212 C CD2 . LEU H 104 A 0.2442 0.2524 0.3142 0.0144 -0.0072 0.0110 100 LEU F CD2 12213 N N . PRO H 105 B 0.3237 0.3479 0.3893 0.0159 0.0028 0.0161 100 PRO F N 12214 C CA . PRO H 105 B 0.2043 0.2295 0.2646 0.0162 0.0043 0.0133 100 PRO F CA 12215 C C . PRO H 105 B 0.2854 0.3032 0.3461 0.0122 0.0040 0.0077 100 PRO F C 12216 O O . PRO H 105 B 0.3494 0.3639 0.4163 0.0094 0.0025 0.0072 100 PRO F O 12217 C CB . PRO H 105 B 0.2906 0.3279 0.3592 0.0182 0.0040 0.0203 100 PRO F CB 12218 C CG . PRO H 105 B 0.2577 0.2974 0.3406 0.0163 0.0020 0.0253 100 PRO F CG 12219 C CD . PRO H 105 B 0.3190 0.3523 0.3990 0.0162 0.0012 0.0235 100 PRO F CD 12220 N N . PHE H 106 C 0.3057 0.3215 0.3610 0.0121 0.0051 0.0033 100 PHE F N 12221 C CA . PHE H 106 C 0.2771 0.2854 0.3332 0.0086 0.0055 -0.0018 100 PHE F CA 12222 C C . PHE H 106 C 0.2762 0.2898 0.3426 0.0063 0.0040 0.0005 100 PHE F C 12223 O O . PHE H 106 C 0.2830 0.3037 0.3508 0.0076 0.0034 0.0019 100 PHE F O 12224 C CB . PHE H 106 C 0.1626 0.1663 0.2118 0.0093 0.0072 -0.0075 100 PHE F CB 12225 C CG . PHE H 106 C 0.3189 0.3154 0.3601 0.0108 0.0093 -0.0102 100 PHE F CG 12226 C CD1 . PHE H 106 C 0.3165 0.3161 0.3539 0.0139 0.0095 -0.0071 100 PHE F CD1 12227 C CD2 . PHE H 106 C 0.3089 0.2960 0.3479 0.0094 0.0117 -0.0151 100 PHE F CD2 12228 C CE1 . PHE H 106 C 0.3139 0.3071 0.3450 0.0154 0.0116 -0.0091 100 PHE F CE1 12229 C CE2 . PHE H 106 C 0.3909 0.3720 0.4242 0.0112 0.0141 -0.0165 100 PHE F CE2 12230 C CZ . PHE H 106 C 0.2844 0.2685 0.3136 0.0141 0.0139 -0.0136 100 PHE F CZ 12231 N N . ASP H 107 ? 0.2790 0.2896 0.3527 0.0033 0.0032 0.0007 101 ASP F N 12232 C CA . ASP H 107 ? 0.2321 0.2471 0.3177 0.0009 0.0019 0.0030 101 ASP F CA 12233 C C . ASP H 107 ? 0.2263 0.2346 0.3175 -0.0024 0.0015 0.0001 101 ASP F C 12234 O O . ASP H 107 ? 0.1871 0.1934 0.2786 -0.0020 0.0004 0.0001 101 ASP F O 12235 C CB . ASP H 107 ? 0.3088 0.3356 0.4039 0.0028 0.0005 0.0111 101 ASP F CB 12236 C CG . ASP H 107 ? 0.3885 0.4199 0.4987 0.0003 -0.0007 0.0145 101 ASP F CG 12237 O OD1 . ASP H 107 ? 0.4243 0.4568 0.5356 -0.0008 -0.0004 0.0134 101 ASP F OD1 12238 O OD2 . ASP H 107 ? 0.5174 0.5515 0.6399 -0.0006 -0.0020 0.0182 101 ASP F OD2 12239 N N . PRO H 108 ? 0.2151 0.2203 0.3109 -0.0052 0.0021 -0.0027 102 PRO F N 12240 C CA . PRO H 108 ? 0.2431 0.2497 0.3390 -0.0059 0.0029 -0.0035 102 PRO F CA 12241 C C . PRO H 108 ? 0.2802 0.2779 0.3663 -0.0060 0.0053 -0.0096 102 PRO F C 12242 O O . PRO H 108 ? 0.3061 0.2966 0.3845 -0.0054 0.0070 -0.0123 102 PRO F O 12243 C CB . PRO H 108 ? 0.2130 0.2203 0.3219 -0.0092 0.0023 -0.0030 102 PRO F CB 12244 C CG . PRO H 108 ? 0.2234 0.2232 0.3325 -0.0106 0.0027 -0.0065 102 PRO F CG 12245 C CD . PRO H 108 ? 0.1433 0.1445 0.2473 -0.0080 0.0015 -0.0048 102 PRO F CD 12246 N N . TRP H 109 ? 0.2978 0.2965 0.3857 -0.0067 0.0053 -0.0112 103 TRP F N 12247 C CA . TRP H 109 ? 0.2358 0.2268 0.3184 -0.0069 0.0075 -0.0167 103 TRP F CA 12248 C C . TRP H 109 ? 0.2869 0.2722 0.3767 -0.0103 0.0090 -0.0193 103 TRP F C 12249 O O . TRP H 109 ? 0.2798 0.2694 0.3790 -0.0122 0.0076 -0.0171 103 TRP F O 12250 C CB . TRP H 109 ? 0.2745 0.2709 0.3540 -0.0044 0.0057 -0.0180 103 TRP F CB 12251 C CG . TRP H 109 ? 0.3027 0.3042 0.3743 -0.0005 0.0050 -0.0162 103 TRP F CG 12252 C CD1 . TRP H 109 ? 0.1940 0.2038 0.2661 0.0014 0.0037 -0.0102 103 TRP F CD1 12253 C CD2 . TRP H 109 ? 0.2903 0.2892 0.3539 0.0022 0.0057 -0.0201 103 TRP F CD2 12254 N NE1 . TRP H 109 ? 0.2244 0.2368 0.2883 0.0052 0.0038 -0.0101 103 TRP F NE1 12255 C CE2 . TRP H 109 ? 0.2890 0.2948 0.3474 0.0058 0.0049 -0.0164 103 TRP F CE2 12256 C CE3 . TRP H 109 ? 0.2893 0.2806 0.3516 0.0020 0.0072 -0.0262 103 TRP F CE3 12257 C CZ2 . TRP H 109 ? 0.3824 0.3877 0.4332 0.0092 0.0055 -0.0191 103 TRP F CZ2 12258 C CZ3 . TRP H 109 ? 0.3325 0.3232 0.3885 0.0053 0.0075 -0.0290 103 TRP F CZ3 12259 C CH2 . TRP H 109 ? 0.3491 0.3467 0.3988 0.0088 0.0067 -0.0257 103 TRP F CH2 12260 N N . GLY H 110 ? 0.2189 0.1950 0.3057 -0.0107 0.0123 -0.0233 104 GLY F N 12261 C CA . GLY H 110 ? 0.1972 0.1679 0.2915 -0.0134 0.0143 -0.0256 104 GLY F CA 12262 C C . GLY H 110 ? 0.2954 0.2709 0.3960 -0.0139 0.0116 -0.0270 104 GLY F C 12263 O O . GLY H 110 ? 0.2843 0.2671 0.3816 -0.0116 0.0084 -0.0266 104 GLY F O 12264 N N . GLN H 111 ? 0.2362 0.2080 0.3457 -0.0165 0.0128 -0.0288 105 GLN F N 12265 C CA . GLN H 111 ? 0.2579 0.2349 0.3746 -0.0169 0.0093 -0.0304 105 GLN F CA 12266 C C . GLN H 111 ? 0.2858 0.2594 0.4009 -0.0153 0.0090 -0.0355 105 GLN F C 12267 O O . GLN H 111 ? 0.2945 0.2733 0.4134 -0.0146 0.0049 -0.0383 105 GLN F O 12268 C CB . GLN H 111 ? 0.2478 0.2226 0.3768 -0.0204 0.0102 -0.0302 105 GLN F CB 12269 C CG . GLN H 111 ? 0.2521 0.2164 0.3864 -0.0219 0.0145 -0.0338 105 GLN F CG 12270 C CD . GLN H 111 ? 0.2928 0.2483 0.4224 -0.0219 0.0205 -0.0329 105 GLN F CD 12271 O OE1 . GLN H 111 ? 0.2856 0.2423 0.4068 -0.0207 0.0208 -0.0310 105 GLN F OE1 12272 N NE2 . GLN H 111 ? 0.3258 0.2728 0.4613 -0.0229 0.0254 -0.0343 105 GLN F NE2 12273 N N . GLY H 112 ? 0.2469 0.2121 0.3570 -0.0144 0.0131 -0.0370 106 GLY F N 12274 C CA . GLY H 112 ? 0.1945 0.1556 0.3056 -0.0130 0.0135 -0.0418 106 GLY F CA 12275 C C . GLY H 112 ? 0.3482 0.3014 0.4716 -0.0152 0.0164 -0.0443 106 GLY F C 12276 O O . GLY H 112 ? 0.3759 0.3302 0.5082 -0.0177 0.0155 -0.0439 106 GLY F O 12277 N N . THR H 113 ? 0.3363 0.2816 0.4613 -0.0142 0.0204 -0.0462 107 THR F N 12278 C CA . THR H 113 ? 0.3506 0.2883 0.4895 -0.0158 0.0239 -0.0480 107 THR F CA 12279 C C . THR H 113 ? 0.3644 0.3008 0.5106 -0.0143 0.0216 -0.0538 107 THR F C 12280 O O . THR H 113 ? 0.2943 0.2286 0.4349 -0.0119 0.0230 -0.0545 107 THR F O 12281 C CB . THR H 113 ? 0.4301 0.3586 0.5677 -0.0156 0.0323 -0.0437 107 THR F CB 12282 O OG1 . THR H 113 ? 0.5385 0.4676 0.6725 -0.0170 0.0342 -0.0400 107 THR F OG1 12283 C CG2 . THR H 113 ? 0.3933 0.3140 0.5467 -0.0163 0.0368 -0.0447 107 THR F CG2 12284 N N . LEU H 114 ? 0.3826 0.3203 0.5422 -0.0158 0.0176 -0.0584 108 LEU F N 12285 C CA . LEU H 114 ? 0.3750 0.3109 0.5448 -0.0144 0.0150 -0.0653 108 LEU F CA 12286 C C . LEU H 114 ? 0.3706 0.2953 0.5521 -0.0148 0.0227 -0.0636 108 LEU F C 12287 O O . LEU H 114 ? 0.3791 0.3029 0.5673 -0.0163 0.0266 -0.0587 108 LEU F O 12288 C CB . LEU H 114 ? 0.2772 0.2183 0.4591 -0.0155 0.0077 -0.0713 108 LEU F CB 12289 C CG . LEU H 114 ? 0.4481 0.3874 0.6429 -0.0140 0.0039 -0.0801 108 LEU F CG 12290 C CD1 . LEU H 114 ? 0.4178 0.3630 0.6001 -0.0100 -0.0005 -0.0849 108 LEU F CD1 12291 C CD2 . LEU H 114 ? 0.5101 0.4533 0.7196 -0.0154 -0.0028 -0.0858 108 LEU F CD2 12292 N N . VAL H 115 ? 0.3018 0.2233 0.4818 -0.0122 0.0248 -0.0648 109 VAL F N 12293 C CA . VAL H 115 ? 0.2555 0.1724 0.4437 -0.0114 0.0314 -0.0603 109 VAL F CA 12294 C C . VAL H 115 ? 0.3165 0.2361 0.5184 -0.0104 0.0272 -0.0665 109 VAL F C 12295 O O . VAL H 115 ? 0.3187 0.2391 0.5181 -0.0084 0.0233 -0.0726 109 VAL F O 12296 C CB . VAL H 115 ? 0.3172 0.2282 0.4955 -0.0091 0.0383 -0.0554 109 VAL F CB 12297 C CG1 . VAL H 115 ? 0.3361 0.2441 0.5250 -0.0078 0.0443 -0.0513 109 VAL F CG1 12298 C CG2 . VAL H 115 ? 0.2196 0.1280 0.3859 -0.0098 0.0431 -0.0491 109 VAL F CG2 12299 N N . THR H 116 ? 0.2864 0.2078 0.5034 -0.0116 0.0276 -0.0654 110 THR F N 12300 C CA . THR H 116 ? 0.2953 0.2195 0.5282 -0.0108 0.0236 -0.0713 110 THR F CA 12301 C C . THR H 116 ? 0.3133 0.2340 0.5568 -0.0098 0.0313 -0.0657 110 THR F C 12302 O O . THR H 116 ? 0.3098 0.2287 0.5577 -0.0105 0.0385 -0.0578 110 THR F O 12303 C CB . THR H 116 ? 0.3376 0.2672 0.5838 -0.0123 0.0181 -0.0749 110 THR F CB 12304 O OG1 . THR H 116 ? 0.3233 0.2570 0.5608 -0.0128 0.0103 -0.0807 110 THR F OG1 12305 C CG2 . THR H 116 ? 0.3381 0.2706 0.6027 -0.0112 0.0140 -0.0812 110 THR F CG2 12306 N N . VAL H 117 ? 0.2782 0.1983 0.5262 -0.0080 0.0301 -0.0696 111 VAL F N 12307 C CA . VAL H 117 ? 0.2809 0.1988 0.5424 -0.0070 0.0369 -0.0645 111 VAL F CA 12308 C C . VAL H 117 ? 0.3252 0.2477 0.6095 -0.0073 0.0323 -0.0705 111 VAL F C 12309 O O . VAL H 117 ? 0.3709 0.2961 0.6591 -0.0063 0.0252 -0.0796 111 VAL F O 12310 C CB . VAL H 117 ? 0.3239 0.2378 0.5777 -0.0047 0.0399 -0.0637 111 VAL F CB 12311 C CG1 . VAL H 117 ? 0.2999 0.2117 0.5687 -0.0038 0.0480 -0.0568 111 VAL F CG1 12312 C CG2 . VAL H 117 ? 0.3024 0.2122 0.5339 -0.0040 0.0432 -0.0591 111 VAL F CG2 12313 N N . SER H 118 ? 0.3125 0.2365 0.6124 -0.0084 0.0363 -0.0656 112 SER F N 12314 C CA . SER H 118 ? 0.3885 0.3176 0.7124 -0.0087 0.0319 -0.0709 112 SER F CA 12315 C C . SER H 118 ? 0.3857 0.3151 0.7271 -0.0091 0.0403 -0.0622 112 SER F C 12316 O O . SER H 118 ? 0.3294 0.2561 0.6622 -0.0094 0.0477 -0.0536 112 SER F O 12317 C CB . SER H 118 ? 0.4391 0.3730 0.7625 -0.0097 0.0221 -0.0789 112 SER F CB 12318 O OG . SER H 118 ? 0.4779 0.4167 0.8256 -0.0098 0.0183 -0.0830 112 SER F OG 12319 N N . SER H 119 ? 0.2935 0.2265 0.6602 -0.0089 0.0392 -0.0649 113 SER F N 12320 C CA . SER H 119 ? 0.3569 0.2916 0.7440 -0.0089 0.0471 -0.0571 113 SER F CA 12321 C C . SER H 119 ? 0.3382 0.2772 0.7347 -0.0100 0.0435 -0.0588 113 SER F C 12322 O O . SER H 119 ? 0.3778 0.3181 0.7873 -0.0100 0.0504 -0.0516 113 SER F O 12323 C CB . SER H 119 ? 0.2833 0.2205 0.6967 -0.0081 0.0483 -0.0586 113 SER F CB 12324 O OG . SER H 119 ? 0.3247 0.2579 0.7325 -0.0068 0.0546 -0.0537 113 SER F OG 12325 N N . ALA H 120 ? 0.3206 0.2621 0.7110 -0.0106 0.0328 -0.0681 114 ALA F N 12326 C CA . ALA H 120 ? 0.3411 0.2871 0.7414 -0.0114 0.0280 -0.0706 114 ALA F CA 12327 C C . ALA H 120 ? 0.3953 0.3394 0.7853 -0.0123 0.0352 -0.0614 114 ALA F C 12328 O O . ALA H 120 ? 0.3813 0.3208 0.7497 -0.0125 0.0402 -0.0562 114 ALA F O 12329 C CB . ALA H 120 ? 0.3688 0.3175 0.7604 -0.0114 0.0157 -0.0816 114 ALA F CB 12330 N N . SER H 121 ? 0.3518 0.2996 0.7583 -0.0125 0.0356 -0.0598 115 SER F N 12331 C CA . SER H 121 ? 0.3807 0.3273 0.7812 -0.0129 0.0431 -0.0512 115 SER F CA 12332 C C . SER H 121 ? 0.3976 0.3444 0.7803 -0.0142 0.0373 -0.0538 115 SER F C 12333 O O . SER H 121 ? 0.4553 0.4049 0.8381 -0.0146 0.0269 -0.0622 115 SER F O 12334 C CB . SER H 121 ? 0.4097 0.3606 0.8372 -0.0122 0.0468 -0.0478 115 SER F CB 12335 O OG . SER H 121 ? 0.4856 0.4368 0.9310 -0.0110 0.0537 -0.0439 115 SER F OG 12336 N N . THR H 122 ? 0.3767 0.3208 0.7448 -0.0146 0.0440 -0.0466 116 THR F N 12337 C CA . THR H 122 ? 0.3445 0.2892 0.6983 -0.0159 0.0397 -0.0477 116 THR F CA 12338 C C . THR H 122 ? 0.3655 0.3154 0.7365 -0.0161 0.0349 -0.0501 116 THR F C 12339 O O . THR H 122 ? 0.3561 0.3078 0.7450 -0.0153 0.0402 -0.0460 116 THR F O 12340 C CB . THR H 122 ? 0.3657 0.3068 0.7036 -0.0159 0.0486 -0.0395 116 THR F CB 12341 O OG1 . THR H 122 ? 0.4885 0.4247 0.8089 -0.0156 0.0517 -0.0379 116 THR F OG1 12342 C CG2 . THR H 122 ? 0.3110 0.2537 0.6383 -0.0174 0.0444 -0.0404 116 THR F CG2 12343 N N . LYS H 123 ? 0.4106 0.3630 0.7771 -0.0170 0.0251 -0.0566 117 LYS F N 12344 C CA . LYS H 123 ? 0.4601 0.4172 0.8415 -0.0170 0.0200 -0.0588 117 LYS F CA 12345 C C . LYS H 123 ? 0.3961 0.3542 0.7631 -0.0183 0.0149 -0.0599 117 LYS F C 12346 O O . LYS H 123 ? 0.3948 0.3528 0.7481 -0.0189 0.0086 -0.0647 117 LYS F O 12347 C CB . LYS H 123 ? 0.5547 0.5157 0.9557 -0.0159 0.0111 -0.0676 117 LYS F CB 12348 C CG . LYS H 123 ? 0.7010 0.6665 1.1193 -0.0155 0.0057 -0.0699 117 LYS F CG 12349 C CD . LYS H 123 ? 0.8119 0.7815 1.2512 -0.0138 -0.0037 -0.0794 117 LYS F CD 12350 C CE . LYS H 123 ? 0.8587 0.8324 1.3158 -0.0131 -0.0090 -0.0813 117 LYS F CE 12351 N NZ . LYS H 123 ? 0.8459 0.8198 1.2876 -0.0141 -0.0133 -0.0811 117 LYS F NZ 12352 N N . GLY H 124 ? 0.3444 0.3038 0.7158 -0.0185 0.0177 -0.0552 118 GLY F N 12353 C CA . GLY H 124 ? 0.3311 0.2920 0.6922 -0.0197 0.0133 -0.0553 118 GLY F CA 12354 C C . GLY H 124 ? 0.4069 0.3723 0.7789 -0.0195 0.0018 -0.0629 118 GLY F C 12355 O O . GLY H 124 ? 0.3799 0.3475 0.7715 -0.0181 -0.0016 -0.0669 118 GLY F O 12387 N N . PRO H 129 ? 0.4936 0.6758 0.7001 0.0738 -0.0505 -0.1424 123 PRO F N 12388 C CA . PRO H 129 ? 0.4050 0.6006 0.6004 0.0854 -0.0537 -0.1349 123 PRO F CA 12389 C C . PRO H 129 ? 0.4332 0.6543 0.6320 0.0930 -0.0634 -0.1435 123 PRO F C 12390 O O . PRO H 129 ? 0.4177 0.6547 0.6326 0.0918 -0.0679 -0.1571 123 PRO F O 12391 C CB . PRO H 129 ? 0.4470 0.6535 0.6494 0.0905 -0.0501 -0.1320 123 PRO F CB 12392 C CG . PRO H 129 ? 0.4554 0.6680 0.6778 0.0839 -0.0491 -0.1441 123 PRO F CG 12393 C CD . PRO H 129 ? 0.4449 0.6340 0.6666 0.0715 -0.0462 -0.1467 123 PRO F CD 12394 N N . LEU H 130 ? 0.4298 0.6547 0.6136 0.1002 -0.0663 -0.1359 124 LEU F N 12395 C CA . LEU H 130 ? 0.3752 0.6280 0.5596 0.1096 -0.0749 -0.1417 124 LEU F CA 12396 C C . LEU H 130 ? 0.4817 0.7458 0.6572 0.1185 -0.0736 -0.1312 124 LEU F C 12397 O O . LEU H 130 ? 0.5277 0.7882 0.6885 0.1239 -0.0723 -0.1190 124 LEU F O 12398 C CB . LEU H 130 ? 0.3866 0.6337 0.5575 0.1100 -0.0781 -0.1395 124 LEU F CB 12399 C CG . LEU H 130 ? 0.3815 0.6133 0.5565 0.1004 -0.0794 -0.1483 124 LEU F CG 12400 C CD1 . LEU H 130 ? 0.2821 0.5086 0.4427 0.1020 -0.0822 -0.1447 124 LEU F CD1 12401 C CD2 . LEU H 130 ? 0.3581 0.6057 0.5498 0.0983 -0.0846 -0.1650 124 LEU F CD2 12402 N N . ALA H 131 ? 0.5421 0.8190 0.7273 0.1197 -0.0737 -0.1358 125 ALA F N 12403 C CA . ALA H 131 ? 0.4924 0.7779 0.6731 0.1276 -0.0718 -0.1259 125 ALA F CA 12404 C C . ALA H 131 ? 0.5336 0.8313 0.6974 0.1352 -0.0753 -0.1188 125 ALA F C 12405 O O . ALA H 131 ? 0.5249 0.8340 0.6850 0.1349 -0.0802 -0.1269 125 ALA F O 12406 C CB . ALA H 131 ? 0.5576 0.8551 0.7537 0.1265 -0.0718 -0.1344 125 ALA F CB 12407 N N . PRO H 132 ? 0.6258 0.9208 0.7798 0.1422 -0.0723 -0.1038 126 PRO F N 12408 C CA . PRO H 132 ? 0.7798 1.0865 0.9188 0.1498 -0.0746 -0.0953 126 PRO F CA 12409 C C . PRO H 132 ? 0.9913 1.3181 1.1346 0.1545 -0.0777 -0.0993 126 PRO F C 12410 O O . PRO H 132 ? 1.0075 1.3364 1.1645 0.1536 -0.0765 -0.1036 126 PRO F O 12411 C CB . PRO H 132 ? 0.6904 0.9851 0.8220 0.1549 -0.0693 -0.0784 126 PRO F CB 12412 C CG . PRO H 132 ? 0.6209 0.9052 0.7667 0.1525 -0.0645 -0.0794 126 PRO F CG 12413 C CD . PRO H 132 ? 0.6155 0.8959 0.7732 0.1433 -0.0657 -0.0944 126 PRO F CD 12414 N N . SER H 133 ? 1.1778 1.5197 1.3098 0.1596 -0.0814 -0.0983 127 SER F N 12415 C CA . SER H 133 ? 1.3826 1.7450 1.5177 0.1645 -0.0849 -0.1031 127 SER F CA 12416 C C . SER H 133 ? 1.5686 1.9449 1.6876 0.1724 -0.0869 -0.0956 127 SER F C 12417 O O . SER H 133 ? 1.5822 1.9538 1.6883 0.1725 -0.0861 -0.0899 127 SER F O 12418 C CB . SER H 133 ? 1.3879 1.7590 1.5340 0.1586 -0.0886 -0.1222 127 SER F CB 12419 O OG . SER H 133 ? 1.3735 1.7401 1.5144 0.1536 -0.0902 -0.1295 127 SER F OG 12420 N N . SER H 134 ? 1.7247 2.1190 1.8448 0.1789 -0.0894 -0.0959 128 SER F N 12421 C CA . SER H 134 ? 1.8565 2.2657 1.9620 0.1873 -0.0910 -0.0878 128 SER F CA 12422 C C . SER H 134 ? 1.9773 2.3969 2.0732 0.1859 -0.0937 -0.0970 128 SER F C 12423 O O . SER H 134 ? 2.0125 2.4400 2.0941 0.1913 -0.0934 -0.0891 128 SER F O 12424 C CB . SER H 134 ? 1.8459 2.2733 1.9561 0.1945 -0.0936 -0.0881 128 SER F CB 12425 O OG . SER H 134 ? 1.8308 2.2488 1.9483 0.1975 -0.0905 -0.0773 128 SER F OG 12426 N N . LYS H 135 ? 2.0840 2.5038 2.1888 0.1789 -0.0959 -0.1139 129 LYS F N 12427 C CA . LYS H 135 ? 2.1499 2.5759 2.2476 0.1767 -0.0977 -0.1237 129 LYS F CA 12428 C C . LYS H 135 ? 2.0388 2.4439 2.1336 0.1701 -0.0950 -0.1210 129 LYS F C 12429 O O . LYS H 135 ? 2.0923 2.4926 2.1914 0.1638 -0.0963 -0.1335 129 LYS F O 12430 C CB . LYS H 135 ? 2.2282 2.6661 2.3372 0.1733 -0.1015 -0.1440 129 LYS F CB 12431 C CG . LYS H 135 ? 2.2469 2.6709 2.3733 0.1643 -0.1013 -0.1546 129 LYS F CG 12432 C CD . LYS H 135 ? 2.2798 2.7038 2.4186 0.1649 -0.1007 -0.1522 129 LYS F CD 12433 C CE . LYS H 135 ? 2.2746 2.6835 2.4304 0.1555 -0.0993 -0.1610 129 LYS F CE 12434 N NZ . LYS H 135 ? 2.2817 2.6967 2.4478 0.1501 -0.1021 -0.1805 129 LYS F NZ 12435 N N . SER H 136 ? 1.9398 2.3323 2.0275 0.1721 -0.0913 -0.1045 130 SER F N 12436 C CA . SER H 136 ? 1.8118 2.1854 1.8945 0.1674 -0.0885 -0.0992 130 SER F CA 12437 C C . SER H 136 ? 1.7626 2.1294 1.8348 0.1726 -0.0844 -0.0797 130 SER F C 12438 O O . SER H 136 ? 1.7104 2.0590 1.7808 0.1696 -0.0811 -0.0723 130 SER F O 12439 C CB . SER H 136 ? 1.6976 2.0531 1.7940 0.1593 -0.0875 -0.1053 130 SER F CB 12440 O OG . SER H 136 ? 1.6426 2.0011 1.7475 0.1534 -0.0907 -0.1228 130 SER F OG 12441 N N . THR H 137 ? 1.7953 2.1766 1.8609 0.1808 -0.0846 -0.0715 131 THR F N 12442 C CA . THR H 137 ? 1.8295 2.2059 1.8850 0.1866 -0.0807 -0.0526 131 THR F CA 12443 C C . THR H 137 ? 1.8520 2.2394 1.8921 0.1897 -0.0803 -0.0490 131 THR F C 12444 O O . THR H 137 ? 1.8732 2.2799 1.9068 0.1964 -0.0817 -0.0471 131 THR F O 12445 C CB . THR H 137 ? 1.8615 2.2458 1.9201 0.1943 -0.0806 -0.0440 131 THR F CB 12446 O OG1 . THR H 137 ? 1.8621 2.2381 1.9364 0.1913 -0.0806 -0.0491 131 THR F OG1 12447 C CG2 . THR H 137 ? 1.8712 2.2472 1.9207 0.2000 -0.0758 -0.0239 131 THR F CG2 12448 N N . SER H 138 ? 1.8753 2.2513 1.9099 0.1848 -0.0784 -0.0485 132 SER F N 12449 C CA . SER H 138 ? 1.8966 2.2826 1.9178 0.1868 -0.0775 -0.0464 132 SER F CA 12450 C C . SER H 138 ? 1.8896 2.2732 1.8999 0.1925 -0.0728 -0.0266 132 SER F C 12451 O O . SER H 138 ? 1.8960 2.2637 1.9024 0.1897 -0.0692 -0.0183 132 SER F O 12452 C CB . SER H 138 ? 1.8978 2.2731 1.9188 0.1791 -0.0775 -0.0551 132 SER F CB 12453 O OG . SER H 138 ? 1.9007 2.2866 1.9100 0.1809 -0.0763 -0.0538 132 SER F OG 12454 N N . GLY H 139 ? 1.8562 2.2558 1.8619 0.2005 -0.0729 -0.0192 133 GLY F N 12455 C CA . GLY H 139 ? 1.7883 2.1872 1.7841 0.2066 -0.0684 0.0001 133 GLY F CA 12456 C C . GLY H 139 ? 1.6906 2.0673 1.6912 0.2066 -0.0645 0.0133 133 GLY F C 12457 O O . GLY H 139 ? 1.7297 2.0945 1.7238 0.2067 -0.0595 0.0264 133 GLY F O 12458 N N . GLY H 140 ? 1.5555 1.9268 1.5681 0.2065 -0.0663 0.0094 134 GLY F N 12459 C CA . GLY H 140 ? 1.4367 1.7876 1.4558 0.2069 -0.0623 0.0203 134 GLY F CA 12460 C C . GLY H 140 ? 1.3092 1.6388 1.3345 0.1988 -0.0605 0.0154 134 GLY F C 12461 O O . GLY H 140 ? 1.2629 1.5741 1.2932 0.1986 -0.0562 0.0238 134 GLY F O 12462 N N . THR H 141 ? 1.2237 1.5558 1.2489 0.1923 -0.0635 0.0016 135 THR F N 12463 C CA . THR H 141 ? 1.0453 1.3586 1.0762 0.1845 -0.0624 -0.0042 135 THR F CA 12464 C C . THR H 141 ? 0.9119 1.2277 0.9555 0.1793 -0.0668 -0.0216 135 THR F C 12465 O O . THR H 141 ? 0.9101 1.2407 0.9535 0.1779 -0.0712 -0.0339 135 THR F O 12466 C CB . THR H 141 ? 0.9709 1.2814 0.9919 0.1805 -0.0617 -0.0051 135 THR F CB 12467 O OG1 . THR H 141 ? 0.9233 1.2266 0.9347 0.1840 -0.0563 0.0118 135 THR F OG1 12468 C CG2 . THR H 141 ? 0.9313 1.2254 0.9591 0.1725 -0.0622 -0.0144 135 THR F CG2 12469 N N . ALA H 142 ? 0.7964 1.0976 0.8515 0.1764 -0.0650 -0.0227 136 ALA F N 12470 C CA . ALA H 142 ? 0.7199 1.0222 0.7884 0.1711 -0.0682 -0.0382 136 ALA F CA 12471 C C . ALA H 142 ? 0.6854 0.9727 0.7569 0.1631 -0.0679 -0.0457 136 ALA F C 12472 O O . ALA H 142 ? 0.7057 0.9760 0.7746 0.1619 -0.0637 -0.0377 136 ALA F O 12473 C CB . ALA H 142 ? 0.6813 0.9799 0.7622 0.1733 -0.0662 -0.0360 136 ALA F CB 12474 N N . ALA H 143 ? 0.5841 0.8773 0.6614 0.1577 -0.0723 -0.0612 137 ALA F N 12475 C CA . ALA H 143 ? 0.5223 0.8013 0.6045 0.1501 -0.0726 -0.0693 137 ALA F CA 12476 C C . ALA H 143 ? 0.5391 0.8131 0.6382 0.1458 -0.0726 -0.0785 137 ALA F C 12477 O O . ALA H 143 ? 0.5190 0.8056 0.6264 0.1462 -0.0750 -0.0863 137 ALA F O 12478 C CB . ALA H 143 ? 0.4076 0.6940 0.4854 0.1466 -0.0768 -0.0803 137 ALA F CB 12479 N N . LEU H 144 ? 0.4874 0.7430 0.5916 0.1417 -0.0694 -0.0776 138 LEU F N 12480 C CA . LEU H 144 ? 0.4975 0.7471 0.6183 0.1365 -0.0686 -0.0869 138 LEU F CA 12481 C C . LEU H 144 ? 0.5321 0.7581 0.6511 0.1267 -0.0663 -0.0898 138 LEU F C 12482 O O . LEU H 144 ? 0.5015 0.7161 0.6073 0.1255 -0.0650 -0.0831 138 LEU F O 12483 C CB . LEU H 144 ? 0.5085 0.7528 0.6351 0.1396 -0.0630 -0.0793 138 LEU F CB 12484 C CG . LEU H 144 ? 0.6152 0.8353 0.7292 0.1382 -0.0550 -0.0640 138 LEU F CG 12485 C CD1 . LEU H 144 ? 0.6747 0.8663 0.7902 0.1265 -0.0482 -0.0651 138 LEU F CD1 12486 C CD2 . LEU H 144 ? 0.6220 0.8494 0.7366 0.1477 -0.0524 -0.0533 138 LEU F CD2 12487 N N . GLY H 145 ? 0.4918 0.7081 0.6223 0.1183 -0.0650 -0.0989 139 GLY F N 12488 C CA . GLY H 145 ? 0.4380 0.6295 0.5649 0.1078 -0.0625 -0.1006 139 GLY F CA 12489 C C . GLY H 145 ? 0.3621 0.5409 0.5012 0.0982 -0.0595 -0.1080 139 GLY F C 12490 O O . GLY H 145 ? 0.3663 0.5529 0.5172 0.0986 -0.0579 -0.1114 139 GLY F O 12491 N N . CYS H 146 ? 0.3804 0.5393 0.5163 0.0895 -0.0586 -0.1101 140 CYS F N 12492 C CA . CYS H 146 ? 0.4058 0.5495 0.5512 0.0794 -0.0553 -0.1156 140 CYS F CA 12493 C C . CYS H 146 ? 0.4152 0.5567 0.5660 0.0746 -0.0607 -0.1259 140 CYS F C 12494 O O . CYS H 146 ? 0.3888 0.5256 0.5300 0.0755 -0.0639 -0.1244 140 CYS F O 12495 C CB . CYS H 146 ? 0.4175 0.5332 0.5523 0.0724 -0.0470 -0.1052 140 CYS F CB 12496 S SG . CYS H 146 ? 1.1719 1.2860 1.3066 0.0749 -0.0390 -0.0963 140 CYS F SG 12497 N N . LEU H 147 ? 0.3914 0.5364 0.5589 0.0696 -0.0616 -0.1365 141 LEU F N 12498 C CA . LEU H 147 ? 0.2826 0.4227 0.4581 0.0641 -0.0659 -0.1465 141 LEU F CA 12499 C C . LEU H 147 ? 0.3800 0.4920 0.5554 0.0529 -0.0596 -0.1430 141 LEU F C 12500 O O . LEU H 147 ? 0.3873 0.4956 0.5717 0.0477 -0.0544 -0.1437 141 LEU F O 12501 C CB . LEU H 147 ? 0.2132 0.3770 0.4089 0.0659 -0.0714 -0.1618 141 LEU F CB 12502 C CG . LEU H 147 ? 0.2797 0.4400 0.4883 0.0600 -0.0758 -0.1744 141 LEU F CG 12503 C CD1 . LEU H 147 ? 0.2298 0.3900 0.4296 0.0635 -0.0818 -0.1758 141 LEU F CD1 12504 C CD2 . LEU H 147 ? 0.3267 0.5118 0.5569 0.0615 -0.0802 -0.1899 141 LEU F CD2 12505 N N . VAL H 148 ? 0.3635 0.4567 0.5284 0.0494 -0.0602 -0.1389 142 VAL F N 12506 C CA . VAL H 148 ? 0.3493 0.4157 0.5118 0.0393 -0.0549 -0.1344 142 VAL F CA 12507 C C . VAL H 148 ? 0.3503 0.4121 0.5251 0.0344 -0.0595 -0.1444 142 VAL F C 12508 O O . VAL H 148 ? 0.3092 0.3678 0.4796 0.0362 -0.0648 -0.1462 142 VAL F O 12509 C CB . VAL H 148 ? 0.3715 0.4189 0.5136 0.0386 -0.0522 -0.1223 142 VAL F CB 12510 C CG1 . VAL H 148 ? 0.3301 0.3512 0.4684 0.0287 -0.0471 -0.1173 142 VAL F CG1 12511 C CG2 . VAL H 148 ? 0.3927 0.4443 0.5239 0.0436 -0.0477 -0.1130 142 VAL F CG2 12512 N N . LYS H 149 ? 0.4116 0.4732 0.6030 0.0282 -0.0572 -0.1511 143 LYS F N 12513 C CA . LYS H 149 ? 0.4802 0.5406 0.6878 0.0240 -0.0616 -0.1624 143 LYS F CA 12514 C C . LYS H 149 ? 0.4983 0.5324 0.7087 0.0130 -0.0565 -0.1587 143 LYS F C 12515 O O . LYS H 149 ? 0.4910 0.5139 0.6980 0.0072 -0.0485 -0.1511 143 LYS F O 12516 C CB . LYS H 149 ? 0.5835 0.6684 0.8122 0.0257 -0.0643 -0.1761 143 LYS F CB 12517 C CG . LYS H 149 ? 0.6942 0.8043 0.9283 0.0347 -0.0736 -0.1872 143 LYS F CG 12518 C CD . LYS H 149 ? 0.7005 0.8306 0.9589 0.0339 -0.0769 -0.2035 143 LYS F CD 12519 C CE . LYS H 149 ? 0.7141 0.8264 0.9882 0.0234 -0.0753 -0.2096 143 LYS F CE 12520 N NZ . LYS H 149 ? 0.7067 0.8390 1.0059 0.0230 -0.0801 -0.2280 143 LYS F NZ 12521 N N . ASP H 150 ? 0.4429 0.4679 0.6598 0.0105 -0.0612 -0.1641 144 ASP F N 12522 C CA . ASP H 150 ? 0.4300 0.4322 0.6541 0.0004 -0.0576 -0.1625 144 ASP F CA 12523 C C . ASP H 150 ? 0.4302 0.4072 0.6355 -0.0048 -0.0509 -0.1468 144 ASP F C 12524 O O . ASP H 150 ? 0.4988 0.4665 0.7048 -0.0119 -0.0430 -0.1414 144 ASP F O 12525 C CB . ASP H 150 ? 0.4720 0.4811 0.7167 -0.0058 -0.0534 -0.1701 144 ASP F CB 12526 C CG . ASP H 150 ? 0.6031 0.6360 0.8693 -0.0021 -0.0603 -0.1875 144 ASP F CG 12527 O OD1 . ASP H 150 ? 0.5846 0.6294 0.8487 0.0057 -0.0683 -0.1935 144 ASP F OD1 12528 O OD2 . ASP H 150 ? 0.7029 0.7435 0.9882 -0.0070 -0.0577 -0.1958 144 ASP F OD2 12529 N N . TYR H 151 ? 0.3098 0.2769 0.4985 -0.0013 -0.0541 -0.1401 145 TYR F N 12530 C CA . TYR H 151 ? 0.3795 0.3231 0.5505 -0.0060 -0.0488 -0.1263 145 TYR F CA 12531 C C . TYR H 151 ? 0.4205 0.3478 0.5868 -0.0063 -0.0540 -0.1243 145 TYR F C 12532 O O . TYR H 151 ? 0.3909 0.3267 0.5639 -0.0010 -0.0619 -0.1328 145 TYR F O 12533 C CB . TYR H 151 ? 0.4065 0.3541 0.5584 -0.0013 -0.0459 -0.1175 145 TYR F CB 12534 C CG . TYR H 151 ? 0.3581 0.3175 0.5018 0.0080 -0.0527 -0.1193 145 TYR F CG 12535 C CD1 . TYR H 151 ? 0.3213 0.3053 0.4710 0.0155 -0.0561 -0.1264 145 TYR F CD1 12536 C CD2 . TYR H 151 ? 0.3596 0.3064 0.4895 0.0094 -0.0558 -0.1137 145 TYR F CD2 12537 C CE1 . TYR H 151 ? 0.3559 0.3515 0.4977 0.0237 -0.0617 -0.1274 145 TYR F CE1 12538 C CE2 . TYR H 151 ? 0.3592 0.3176 0.4822 0.0174 -0.0615 -0.1155 145 TYR F CE2 12539 C CZ . TYR H 151 ? 0.3868 0.3694 0.5156 0.0243 -0.0641 -0.1221 145 TYR F CZ 12540 O OH . TYR H 151 ? 0.3660 0.3609 0.4876 0.0320 -0.0691 -0.1233 145 TYR F OH 12541 N N . PHE H 152 ? 0.3839 0.2885 0.5386 -0.0122 -0.0495 -0.1131 146 PHE F N 12542 C CA . PHE H 152 ? 0.3320 0.2193 0.4802 -0.0124 -0.0539 -0.1090 146 PHE F CA 12543 C C . PHE H 152 ? 0.4505 0.3182 0.5793 -0.0171 -0.0480 -0.0946 146 PHE F C 12544 O O . PHE H 152 ? 0.5220 0.3825 0.6503 -0.0241 -0.0402 -0.0892 146 PHE F O 12545 C CB . PHE H 152 ? 0.3528 0.2313 0.5202 -0.0168 -0.0567 -0.1156 146 PHE F CB 12546 C CG . PHE H 152 ? 0.4090 0.2726 0.5727 -0.0151 -0.0627 -0.1132 146 PHE F CG 12547 C CD1 . PHE H 152 ? 0.4412 0.3182 0.6098 -0.0075 -0.0706 -0.1213 146 PHE F CD1 12548 C CD2 . PHE H 152 ? 0.3975 0.2376 0.5502 -0.0203 -0.0595 -0.1007 146 PHE F CD2 12549 C CE1 . PHE H 152 ? 0.4166 0.2836 0.5806 -0.0052 -0.0751 -0.1176 146 PHE F CE1 12550 C CE2 . PHE H 152 ? 0.3627 0.1925 0.5099 -0.0176 -0.0644 -0.0967 146 PHE F CE2 12551 C CZ . PHE H 152 ? 0.4447 0.2879 0.5982 -0.0101 -0.0722 -0.1054 146 PHE F CZ 12552 N N . PRO H 153 ? 0.4761 0.3364 0.5891 -0.0133 -0.0517 -0.0888 147 PRO F N 12553 C CA . PRO H 153 ? 0.4262 0.2953 0.5387 -0.0052 -0.0605 -0.0948 147 PRO F CA 12554 C C . PRO H 153 ? 0.4629 0.3492 0.5654 0.0014 -0.0606 -0.0951 147 PRO F C 12555 O O . PRO H 153 ? 0.4118 0.3042 0.5102 0.0003 -0.0544 -0.0920 147 PRO F O 12556 C CB . PRO H 153 ? 0.3971 0.2468 0.4971 -0.0059 -0.0630 -0.0864 147 PRO F CB 12557 C CG . PRO H 153 ? 0.4769 0.3157 0.5606 -0.0113 -0.0547 -0.0744 147 PRO F CG 12558 C CD . PRO H 153 ? 0.4472 0.2889 0.5416 -0.0174 -0.0474 -0.0758 147 PRO F CD 12559 N N . GLU H 154 ? 0.4301 0.3239 0.5292 0.0083 -0.0675 -0.0988 148 GLU F N 12560 C CA . GLU H 154 ? 0.4220 0.3285 0.5089 0.0142 -0.0674 -0.0968 148 GLU F CA 12561 C C . GLU H 154 ? 0.4461 0.3379 0.5136 0.0115 -0.0629 -0.0848 148 GLU F C 12562 O O . GLU H 154 ? 0.3686 0.2421 0.4313 0.0069 -0.0624 -0.0793 148 GLU F O 12563 C CB . GLU H 154 ? 0.4630 0.3820 0.5522 0.0217 -0.0757 -0.1043 148 GLU F CB 12564 C CG . GLU H 154 ? 0.6069 0.5437 0.7148 0.0251 -0.0805 -0.1174 148 GLU F CG 12565 C CD . GLU H 154 ? 0.6602 0.6153 0.7678 0.0333 -0.0871 -0.1245 148 GLU F CD 12566 O OE1 . GLU H 154 ? 0.6211 0.5916 0.7215 0.0378 -0.0855 -0.1228 148 GLU F OE1 12567 O OE2 . GLU H 154 ? 0.6524 0.6065 0.7669 0.0354 -0.0937 -0.1314 148 GLU F OE2 12568 N N . PRO H 155 ? 0.4110 0.3107 0.4674 0.0143 -0.0594 -0.0808 149 PRO F N 12569 C CA . PRO H 155 ? 0.4007 0.3210 0.4609 0.0197 -0.0589 -0.0849 149 PRO F CA 12570 C C . PRO H 155 ? 0.4227 0.3458 0.4848 0.0168 -0.0512 -0.0821 149 PRO F C 12571 O O . PRO H 155 ? 0.3918 0.3011 0.4512 0.0102 -0.0456 -0.0769 149 PRO F O 12572 C CB . PRO H 155 ? 0.3584 0.2811 0.4040 0.0239 -0.0594 -0.0802 149 PRO F CB 12573 C CG . PRO H 155 ? 0.3786 0.2816 0.4110 0.0182 -0.0549 -0.0711 149 PRO F CG 12574 C CD . PRO H 155 ? 0.4137 0.3021 0.4521 0.0129 -0.0566 -0.0717 149 PRO F CD 12575 N N . VAL H 156 ? 0.3890 0.3309 0.4558 0.0222 -0.0511 -0.0854 150 VAL F N 12576 C CA . VAL H 156 ? 0.4220 0.3680 0.4881 0.0214 -0.0439 -0.0817 150 VAL F CA 12577 C C . VAL H 156 ? 0.3717 0.3252 0.4270 0.0272 -0.0426 -0.0768 150 VAL F C 12578 O O . VAL H 156 ? 0.3653 0.3265 0.4172 0.0325 -0.0478 -0.0784 150 VAL F O 12579 C CB . VAL H 156 ? 0.4168 0.3791 0.4995 0.0231 -0.0443 -0.0893 150 VAL F CB 12580 C CG1 . VAL H 156 ? 0.4987 0.4529 0.5938 0.0163 -0.0442 -0.0940 150 VAL F CG1 12581 C CG2 . VAL H 156 ? 0.3963 0.3797 0.4850 0.0313 -0.0514 -0.0966 150 VAL F CG2 12582 N N . THR H 157 ? 0.2961 0.2474 0.3468 0.0260 -0.0354 -0.0710 151 THR F N 12583 C CA . THR H 157 ? 0.3401 0.2980 0.3826 0.0313 -0.0332 -0.0660 151 THR F CA 12584 C C . THR H 157 ? 0.3664 0.3392 0.4172 0.0356 -0.0304 -0.0668 151 THR F C 12585 O O . THR H 157 ? 0.4036 0.3735 0.4599 0.0320 -0.0252 -0.0666 151 THR F O 12586 C CB . THR H 157 ? 0.4310 0.3726 0.4599 0.0271 -0.0271 -0.0580 151 THR F CB 12587 O OG1 . THR H 157 ? 0.5296 0.4594 0.5501 0.0243 -0.0306 -0.0572 151 THR F OG1 12588 C CG2 . THR H 157 ? 0.5131 0.4608 0.5358 0.0322 -0.0242 -0.0531 151 THR F CG2 12589 N N . VAL H 158 ? 0.3772 0.3667 0.4290 0.0435 -0.0338 -0.0675 152 VAL F N 12590 C CA . VAL H 158 ? 0.3353 0.3404 0.3944 0.0490 -0.0321 -0.0676 152 VAL F CA 12591 C C . VAL H 158 ? 0.3773 0.3830 0.4276 0.0534 -0.0278 -0.0589 152 VAL F C 12592 O O . VAL H 158 ? 0.4126 0.4209 0.4550 0.0570 -0.0302 -0.0560 152 VAL F O 12593 C CB . VAL H 158 ? 0.3885 0.4159 0.4576 0.0554 -0.0395 -0.0754 152 VAL F CB 12594 C CG1 . VAL H 158 ? 0.3666 0.4113 0.4425 0.0619 -0.0381 -0.0748 152 VAL F CG1 12595 C CG2 . VAL H 158 ? 0.4108 0.4374 0.4912 0.0508 -0.0434 -0.0849 152 VAL F CG2 12596 N N . SER H 159 ? 0.3968 0.4000 0.4494 0.0530 -0.0213 -0.0551 153 SER F N 12597 C CA . SER H 159 ? 0.3637 0.3675 0.4109 0.0577 -0.0168 -0.0472 153 SER F CA 12598 C C . SER H 159 ? 0.3120 0.3328 0.3694 0.0647 -0.0165 -0.0474 153 SER F C 12599 O O . SER H 159 ? 0.3335 0.3628 0.4020 0.0642 -0.0182 -0.0539 153 SER F O 12600 C CB . SER H 159 ? 0.3884 0.3729 0.4291 0.0516 -0.0087 -0.0421 153 SER F CB 12601 O OG . SER H 159 ? 0.4609 0.4306 0.4920 0.0453 -0.0092 -0.0419 153 SER F OG 12602 N N . TRP H 160 ? 0.3401 0.3659 0.3942 0.0712 -0.0143 -0.0401 154 TRP F N 12603 C CA . TRP H 160 ? 0.3661 0.4067 0.4291 0.0786 -0.0136 -0.0386 154 TRP F CA 12604 C C . TRP H 160 ? 0.3515 0.3813 0.4127 0.0793 -0.0054 -0.0306 154 TRP F C 12605 O O . TRP H 160 ? 0.3072 0.3260 0.3590 0.0787 -0.0022 -0.0239 154 TRP F O 12606 C CB . TRP H 160 ? 0.3522 0.4134 0.4147 0.0881 -0.0197 -0.0372 154 TRP F CB 12607 C CG . TRP H 160 ? 0.3706 0.4472 0.4394 0.0888 -0.0277 -0.0472 154 TRP F CG 12608 C CD1 . TRP H 160 ? 0.4052 0.4816 0.4696 0.0862 -0.0328 -0.0520 154 TRP F CD1 12609 C CD2 . TRP H 160 ? 0.3832 0.4781 0.4650 0.0923 -0.0314 -0.0547 154 TRP F CD2 12610 N NE1 . TRP H 160 ? 0.3749 0.4678 0.4492 0.0878 -0.0394 -0.0622 154 TRP F NE1 12611 C CE2 . TRP H 160 ? 0.3551 0.4600 0.4403 0.0914 -0.0387 -0.0642 154 TRP F CE2 12612 C CE3 . TRP H 160 ? 0.4097 0.5144 0.5019 0.0963 -0.0295 -0.0548 154 TRP F CE3 12613 C CZ2 . TRP H 160 ? 0.3737 0.4978 0.4721 0.0939 -0.0439 -0.0743 154 TRP F CZ2 12614 C CZ3 . TRP H 160 ? 0.4002 0.5246 0.5051 0.0990 -0.0348 -0.0645 154 TRP F CZ3 12615 C CH2 . TRP H 160 ? 0.4480 0.5820 0.5560 0.0975 -0.0419 -0.0743 154 TRP F CH2 12616 N N . ASN H 161 ? 0.3118 0.3453 0.3832 0.0805 -0.0022 -0.0321 155 ASN F N 12617 C CA . ASN H 161 ? 0.3859 0.4095 0.4583 0.0812 0.0058 -0.0262 155 ASN F CA 12618 C C . ASN H 161 ? 0.3690 0.3700 0.4318 0.0728 0.0118 -0.0239 155 ASN F C 12619 O O . ASN H 161 ? 0.3737 0.3657 0.4321 0.0742 0.0167 -0.0171 155 ASN F O 12620 C CB . ASN H 161 ? 0.4431 0.4755 0.5149 0.0914 0.0057 -0.0174 155 ASN F CB 12621 C CG . ASN H 161 ? 0.5004 0.5560 0.5823 0.1006 0.0005 -0.0191 155 ASN F CG 12622 O OD1 . ASN H 161 ? 0.5428 0.6074 0.6343 0.0990 -0.0018 -0.0275 155 ASN F OD1 12623 N ND2 . ASN H 161 ? 0.4919 0.5580 0.5720 0.1101 -0.0011 -0.0110 155 ASN F ND2 12624 N N . SER H 162 ? 0.2798 0.2723 0.3399 0.0641 0.0113 -0.0297 156 SER F N 12625 C CA . SER H 162 ? 0.3673 0.3401 0.4180 0.0557 0.0162 -0.0287 156 SER F CA 12626 C C . SER H 162 ? 0.4397 0.4055 0.4790 0.0564 0.0155 -0.0233 156 SER F C 12627 O O . SER H 162 ? 0.5110 0.4627 0.5439 0.0524 0.0211 -0.0204 156 SER F O 12628 C CB . SER H 162 ? 0.4553 0.4192 0.5095 0.0532 0.0249 -0.0277 156 SER F CB 12629 O OG . SER H 162 ? 0.5058 0.4747 0.5699 0.0506 0.0262 -0.0336 156 SER F OG 12630 N N . GLY H 163 ? 0.3482 0.3250 0.3854 0.0613 0.0088 -0.0226 157 GLY F N 12631 C CA . GLY H 163 ? 0.3432 0.3156 0.3704 0.0618 0.0078 -0.0181 157 GLY F CA 12632 C C . GLY H 163 ? 0.4315 0.4098 0.4588 0.0695 0.0098 -0.0101 157 GLY F C 12633 O O . GLY H 163 ? 0.5119 0.4904 0.5323 0.0709 0.0085 -0.0062 157 GLY F O 12634 N N . ALA H 164 ? 0.4088 0.3922 0.4446 0.0746 0.0131 -0.0074 158 ALA F N 12635 C CA . ALA H 164 ? 0.4700 0.4573 0.5066 0.0822 0.0157 0.0016 158 ALA F CA 12636 C C . ALA H 164 ? 0.5201 0.5268 0.5561 0.0904 0.0090 0.0043 158 ALA F C 12637 O O . ALA H 164 ? 0.5017 0.5111 0.5347 0.0958 0.0104 0.0128 158 ALA F O 12638 C CB . ALA H 164 ? 0.3478 0.3349 0.3944 0.0859 0.0208 0.0037 158 ALA F CB 12639 N N . LEU H 165 ? 0.4566 0.4769 0.4955 0.0912 0.0020 -0.0030 159 LEU F N 12640 C CA . LEU H 165 ? 0.4262 0.4672 0.4645 0.0987 -0.0049 -0.0024 159 LEU F CA 12641 C C . LEU H 165 ? 0.4765 0.5195 0.5082 0.0948 -0.0106 -0.0082 159 LEU F C 12642 O O . LEU H 165 ? 0.4023 0.4446 0.4370 0.0899 -0.0142 -0.0173 159 LEU F O 12643 C CB . LEU H 165 ? 0.4115 0.4710 0.4605 0.1045 -0.0091 -0.0071 159 LEU F CB 12644 C CG . LEU H 165 ? 0.4525 0.5366 0.5019 0.1123 -0.0171 -0.0088 159 LEU F CG 12645 C CD1 . LEU H 165 ? 0.5007 0.5914 0.5433 0.1199 -0.0160 0.0027 159 LEU F CD1 12646 C CD2 . LEU H 165 ? 0.4278 0.5297 0.4892 0.1173 -0.0208 -0.0147 159 LEU F CD2 12647 N N . THR H 166 ? 0.4457 0.4913 0.4691 0.0970 -0.0113 -0.0029 160 THR F N 12648 C CA . THR H 166 ? 0.4795 0.5267 0.4967 0.0936 -0.0163 -0.0081 160 THR F CA 12649 C C . THR H 166 ? 0.5485 0.6177 0.5633 0.1011 -0.0220 -0.0075 160 THR F C 12650 O O . THR H 166 ? 0.5935 0.6720 0.6084 0.1004 -0.0286 -0.0158 160 THR F O 12651 C CB . THR H 166 ? 0.5332 0.5619 0.5416 0.0874 -0.0116 -0.0043 160 THR F CB 12652 O OG1 . THR H 166 ? 0.5468 0.5739 0.5525 0.0912 -0.0061 0.0064 160 THR F OG1 12653 C CG2 . THR H 166 ? 0.4723 0.4807 0.4814 0.0791 -0.0073 -0.0072 160 THR F CG2 12654 N N . SER H 167 ? 0.5157 0.5932 0.5286 0.1081 -0.0195 0.0024 161 SER F N 12655 C CA . SER H 167 ? 0.4901 0.5893 0.4991 0.1152 -0.0241 0.0044 161 SER F CA 12656 C C . SER H 167 ? 0.5240 0.6464 0.5401 0.1218 -0.0310 -0.0022 161 SER F C 12657 O O . SER H 167 ? 0.5989 0.7237 0.6228 0.1246 -0.0303 -0.0020 161 SER F O 12658 C CB . SER H 167 ? 0.5295 0.6296 0.5338 0.1206 -0.0186 0.0186 161 SER F CB 12659 O OG . SER H 167 ? 0.6179 0.7243 0.6283 0.1275 -0.0171 0.0243 161 SER F OG 12660 N N . GLY H 168 ? 0.5761 0.7164 0.5902 0.1242 -0.0378 -0.0089 162 GLY F N 12661 C CA . GLY H 168 ? 0.5827 0.7470 0.6039 0.1301 -0.0450 -0.0171 162 GLY F CA 12662 C C . GLY H 168 ? 0.5327 0.6932 0.5628 0.1241 -0.0491 -0.0312 162 GLY F C 12663 O O . GLY H 168 ? 0.5831 0.7626 0.6209 0.1276 -0.0554 -0.0407 162 GLY F O 12664 N N . VAL H 169 ? 0.4382 0.5743 0.4675 0.1151 -0.0455 -0.0325 163 VAL F N 12665 C CA . VAL H 169 ? 0.4443 0.5726 0.4815 0.1084 -0.0483 -0.0440 163 VAL F CA 12666 C C . VAL H 169 ? 0.5071 0.6404 0.5436 0.1062 -0.0547 -0.0538 163 VAL F C 12667 O O . VAL H 169 ? 0.4782 0.6039 0.5062 0.1039 -0.0541 -0.0514 163 VAL F O 12668 C CB . VAL H 169 ? 0.4162 0.5167 0.4519 0.0998 -0.0417 -0.0408 163 VAL F CB 12669 C CG1 . VAL H 169 ? 0.4162 0.5076 0.4583 0.0925 -0.0445 -0.0513 163 VAL F CG1 12670 C CG2 . VAL H 169 ? 0.4144 0.5104 0.4538 0.1016 -0.0357 -0.0338 163 VAL F CG2 12671 N N . HIS H 170 ? 0.4383 0.5846 0.4852 0.1069 -0.0608 -0.0656 164 HIS F N 12672 C CA . HIS H 170 ? 0.4439 0.5937 0.4934 0.1045 -0.0671 -0.0768 164 HIS F CA 12673 C C . HIS H 170 ? 0.4028 0.5403 0.4629 0.0975 -0.0683 -0.0858 164 HIS F C 12674 O O . HIS H 170 ? 0.4168 0.5654 0.4885 0.0987 -0.0706 -0.0929 164 HIS F O 12675 C CB . HIS H 170 ? 0.5899 0.7698 0.6428 0.1124 -0.0741 -0.0843 164 HIS F CB 12676 C CG . HIS H 170 ? 0.7156 0.9089 0.7572 0.1190 -0.0733 -0.0757 164 HIS F CG 12677 N ND1 . HIS H 170 ? 0.7135 0.9298 0.7542 0.1274 -0.0744 -0.0723 164 HIS F ND1 12678 C CD2 . HIS H 170 ? 0.7833 0.9700 0.8139 0.1180 -0.0711 -0.0695 164 HIS F CD2 12679 C CE1 . HIS H 170 ? 0.7505 0.9716 0.7792 0.1304 -0.0719 -0.0635 164 HIS F CE1 12680 N NE2 . HIS H 170 ? 0.7850 0.9909 0.8087 0.1258 -0.0707 -0.0623 164 HIS F NE2 12681 N N . THR H 171 ? 0.3968 0.5119 0.4533 0.0900 -0.0665 -0.0853 165 THR F N 12682 C CA . THR H 171 ? 0.4075 0.5099 0.4732 0.0830 -0.0676 -0.0929 165 THR F CA 12683 C C . THR H 171 ? 0.4492 0.5558 0.5188 0.0825 -0.0747 -0.1034 165 THR F C 12684 O O . THR H 171 ? 0.4518 0.5492 0.5134 0.0810 -0.0755 -0.1015 165 THR F O 12685 C CB . THR H 171 ? 0.4220 0.4967 0.4814 0.0751 -0.0611 -0.0855 165 THR F CB 12686 O OG1 . THR H 171 ? 0.4463 0.5182 0.5035 0.0759 -0.0544 -0.0770 165 THR F OG1 12687 C CG2 . THR H 171 ? 0.3723 0.4340 0.4406 0.0678 -0.0619 -0.0922 165 THR F CG2 12688 N N . PHE H 172 ? 0.3961 0.5175 0.4792 0.0841 -0.0800 -0.1151 166 PHE F N 12689 C CA . PHE H 172 ? 0.4169 0.5458 0.5064 0.0848 -0.0873 -0.1269 166 PHE F CA 12690 C C . PHE H 172 ? 0.3740 0.4787 0.4662 0.0769 -0.0875 -0.1292 166 PHE F C 12691 O O . PHE H 172 ? 0.3671 0.4534 0.4607 0.0706 -0.0828 -0.1249 166 PHE F O 12692 C CB . PHE H 172 ? 0.4610 0.6133 0.5659 0.0884 -0.0926 -0.1398 166 PHE F CB 12693 C CG . PHE H 172 ? 0.4801 0.6597 0.5820 0.0974 -0.0940 -0.1385 166 PHE F CG 12694 C CD1 . PHE H 172 ? 0.5046 0.6889 0.6062 0.0997 -0.0898 -0.1314 166 PHE F CD1 12695 C CD2 . PHE H 172 ? 0.5413 0.7336 0.6349 0.1013 -0.0950 -0.1412 166 PHE F CD2 12696 C CE1 . PHE H 172 ? 0.4883 0.6943 0.5843 0.1074 -0.0898 -0.1281 166 PHE F CE1 12697 C CE2 . PHE H 172 ? 0.4862 0.6962 0.5713 0.1070 -0.0926 -0.1368 166 PHE F CE2 12698 C CZ . PHE H 172 ? 0.4626 0.6790 0.5484 0.1100 -0.0904 -0.1299 166 PHE F CZ 12699 N N . PRO H 173 ? 0.4789 0.5839 0.5715 0.0776 -0.0929 -0.1356 167 PRO F N 12700 C CA . PRO H 173 ? 0.4775 0.5617 0.5747 0.0713 -0.0946 -0.1390 167 PRO F CA 12701 C C . PRO H 173 ? 0.4426 0.5243 0.5567 0.0672 -0.0957 -0.1476 167 PRO F C 12702 O O . PRO H 173 ? 0.4587 0.5615 0.5846 0.0709 -0.0994 -0.1578 167 PRO F O 12703 C CB . PRO H 173 ? 0.4188 0.5127 0.5168 0.0754 -0.1014 -0.1472 167 PRO F CB 12704 C CG . PRO H 173 ? 0.4549 0.5669 0.5416 0.0820 -0.1006 -0.1424 167 PRO F CG 12705 C CD . PRO H 173 ? 0.4475 0.5724 0.5352 0.0846 -0.0972 -0.1389 167 PRO F CD 12706 N N . ALA H 174 ? 0.4500 0.5075 0.5655 0.0595 -0.0924 -0.1436 168 ALA F N 12707 C CA . ALA H 174 ? 0.4540 0.5071 0.5859 0.0545 -0.0924 -0.1507 168 ALA F CA 12708 C C . ALA H 174 ? 0.4428 0.5047 0.5902 0.0561 -0.1001 -0.1656 168 ALA F C 12709 O O . ALA H 174 ? 0.4002 0.4626 0.5446 0.0591 -0.1049 -0.1687 168 ALA F O 12710 C CB . ALA H 174 ? 0.3910 0.4157 0.5196 0.0459 -0.0872 -0.1424 168 ALA F CB 12711 N N . VAL H 175 ? 0.4302 0.4999 0.5954 0.0541 -0.1012 -0.1755 169 VAL F N 12712 C CA . VAL H 175 ? 0.4661 0.5420 0.6481 0.0547 -0.1064 -0.1882 169 VAL F CA 12713 C C . VAL H 175 ? 0.4808 0.5354 0.6751 0.0460 -0.1034 -0.1879 169 VAL F C 12714 O O . VAL H 175 ? 0.4878 0.5362 0.6862 0.0405 -0.0994 -0.1869 169 VAL F O 12715 C CB . VAL H 175 ? 0.5356 0.6413 0.7285 0.0610 -0.1079 -0.1983 169 VAL F CB 12716 C CG1 . VAL H 175 ? 0.6394 0.7492 0.8490 0.0619 -0.1093 -0.2077 169 VAL F CG1 12717 C CG2 . VAL H 175 ? 0.5375 0.6630 0.7158 0.0698 -0.1088 -0.1958 169 VAL F CG2 12718 N N . LEU H 176 ? 0.4351 0.4787 0.6349 0.0447 -0.1049 -0.1878 170 LEU F N 12719 C CA . LEU H 176 ? 0.4671 0.4927 0.6795 0.0369 -0.1022 -0.1869 170 LEU F CA 12720 C C . LEU H 176 ? 0.4538 0.4969 0.6878 0.0373 -0.1028 -0.1989 170 LEU F C 12721 O O . LEU H 176 ? 0.4228 0.4850 0.6648 0.0438 -0.1067 -0.2080 170 LEU F O 12722 C CB . LEU H 176 ? 0.5125 0.5209 0.7233 0.0359 -0.1043 -0.1823 170 LEU F CB 12723 C CG . LEU H 176 ? 0.5373 0.5245 0.7585 0.0277 -0.1011 -0.1791 170 LEU F CG 12724 C CD1 . LEU H 176 ? 0.4336 0.4024 0.6468 0.0200 -0.0945 -0.1695 170 LEU F CD1 12725 C CD2 . LEU H 176 ? 0.6113 0.5829 0.8301 0.0280 -0.1040 -0.1745 170 LEU F CD2 12726 N N . GLN H 177 ? 0.4167 0.4538 0.6603 0.0304 -0.0982 -0.1993 171 GLN F N 12727 C CA . GLN H 177 ? 0.4939 0.5476 0.7586 0.0301 -0.0981 -0.2110 171 GLN F CA 12728 C C . GLN H 177 ? 0.5077 0.5473 0.7876 0.0247 -0.0972 -0.2124 171 GLN F C 12729 O O . GLN H 177 ? 0.4563 0.4716 0.7293 0.0202 -0.0959 -0.2028 171 GLN F O 12730 C CB . GLN H 177 ? 0.4828 0.5412 0.7517 0.0259 -0.0936 -0.2119 171 GLN F CB 12731 C CG . GLN H 177 ? 0.5412 0.6166 0.7974 0.0318 -0.0950 -0.2117 171 GLN F CG 12732 C CD . GLN H 177 ? 0.6242 0.7001 0.8834 0.0268 -0.0903 -0.2109 171 GLN F CD 12733 O OE1 . GLN H 177 ? 0.6450 0.7452 0.9102 0.0310 -0.0917 -0.2181 171 GLN F OE1 12734 N NE2 . GLN H 177 ? 0.5860 0.6358 0.8408 0.0181 -0.0844 -0.2016 171 GLN F NE2 12735 N N . SER H 178 ? 0.5994 0.6545 0.8998 0.0255 -0.0978 -0.2243 172 SER F N 12736 C CA . SER H 178 ? 0.7099 0.7538 1.0271 0.0207 -0.0971 -0.2272 172 SER F CA 12737 C C . SER H 178 ? 0.7141 0.7308 1.0308 0.0099 -0.0907 -0.2169 172 SER F C 12738 O O . SER H 178 ? 0.6670 0.6657 0.9900 0.0054 -0.0897 -0.2135 172 SER F O 12739 C CB . SER H 178 ? 0.7973 0.8639 1.1370 0.0230 -0.0978 -0.2425 172 SER F CB 12740 O OG . SER H 178 ? 0.8351 0.9279 1.1738 0.0335 -0.1027 -0.2519 172 SER F OG 12741 N N . SER H 179 ? 0.6286 0.6428 0.9377 0.0059 -0.0860 -0.2117 173 SER F N 12742 C CA . SER H 179 ? 0.5748 0.5653 0.8823 -0.0043 -0.0787 -0.2017 173 SER F CA 12743 C C . SER H 179 ? 0.5512 0.5148 0.8393 -0.0069 -0.0775 -0.1868 173 SER F C 12744 O O . SER H 179 ? 0.5467 0.4881 0.8319 -0.0151 -0.0715 -0.1771 173 SER F O 12745 C CB . SER H 179 ? 0.5104 0.5090 0.8163 -0.0070 -0.0740 -0.2017 173 SER F CB 12746 O OG . SER H 179 ? 0.5669 0.5718 0.8549 -0.0013 -0.0764 -0.1983 173 SER F OG 12747 N N . GLY H 180 ? 0.5244 0.4905 0.7988 0.0003 -0.0829 -0.1849 174 GLY F N 12748 C CA . GLY H 180 ? 0.5185 0.4619 0.7732 -0.0009 -0.0823 -0.1715 174 GLY F CA 12749 C C . GLY H 180 ? 0.5595 0.5001 0.7962 -0.0012 -0.0793 -0.1641 174 GLY F C 12750 O O . GLY H 180 ? 0.5747 0.4982 0.7937 -0.0018 -0.0785 -0.1532 174 GLY F O 12751 N N . LEU H 181 ? 0.5320 0.4901 0.7739 -0.0005 -0.0776 -0.1706 175 LEU F N 12752 C CA . LEU H 181 ? 0.5027 0.4602 0.7299 -0.0002 -0.0747 -0.1652 175 LEU F CA 12753 C C . LEU H 181 ? 0.4734 0.4510 0.6924 0.0095 -0.0806 -0.1705 175 LEU F C 12754 O O . LEU H 181 ? 0.4688 0.4675 0.6974 0.0156 -0.0860 -0.1807 175 LEU F O 12755 C CB . LEU H 181 ? 0.4860 0.4497 0.7238 -0.0056 -0.0688 -0.1685 175 LEU F CB 12756 C CG . LEU H 181 ? 0.4440 0.3910 0.6913 -0.0159 -0.0616 -0.1639 175 LEU F CG 12757 C CD1 . LEU H 181 ? 0.4229 0.3821 0.6830 -0.0200 -0.0565 -0.1697 175 LEU F CD1 12758 C CD2 . LEU H 181 ? 0.4601 0.3792 0.6899 -0.0213 -0.0568 -0.1485 175 LEU F CD2 12759 N N . TYR H 182 ? 0.4226 0.3961 0.6217 0.0115 -0.0780 -0.1603 176 TYR F N 12760 C CA . TYR H 182 ? 0.3886 0.3815 0.5767 0.0206 -0.0815 -0.1609 176 TYR F CA 12761 C C . TYR H 182 ? 0.4122 0.4254 0.6016 0.0234 -0.0783 -0.1620 176 TYR F C 12762 O O . TYR H 182 ? 0.4422 0.4508 0.6356 0.0179 -0.0718 -0.1587 176 TYR F O 12763 C CB . TYR H 182 ? 0.3812 0.3604 0.5464 0.0220 -0.0798 -0.1476 176 TYR F CB 12764 C CG . TYR H 182 ? 0.4297 0.3925 0.5919 0.0216 -0.0844 -0.1467 176 TYR F CG 12765 C CD1 . TYR H 182 ? 0.4476 0.4219 0.6120 0.0284 -0.0922 -0.1550 176 TYR F CD1 12766 C CD2 . TYR H 182 ? 0.4918 0.4285 0.6488 0.0147 -0.0809 -0.1375 176 TYR F CD2 12767 C CE1 . TYR H 182 ? 0.4598 0.4213 0.6215 0.0286 -0.0956 -0.1523 176 TYR F CE1 12768 C CE2 . TYR H 182 ? 0.5222 0.4440 0.6766 0.0150 -0.0855 -0.1361 176 TYR F CE2 12769 C CZ . TYR H 182 ? 0.5079 0.4435 0.6643 0.0221 -0.0922 -0.1424 176 TYR F CZ 12770 O OH . TYR H 182 ? 0.5582 0.4827 0.7114 0.0230 -0.0955 -0.1385 176 TYR F OH 12771 N N . SER H 183 ? 0.4000 0.4363 0.5864 0.0321 -0.0827 -0.1665 177 SER F N 12772 C CA . SER H 183 ? 0.4420 0.4968 0.6256 0.0364 -0.0799 -0.1645 177 SER F CA 12773 C C . SER H 183 ? 0.4556 0.5256 0.6254 0.0457 -0.0833 -0.1616 177 SER F C 12774 O O . SER H 183 ? 0.5612 0.6368 0.7300 0.0498 -0.0895 -0.1669 177 SER F O 12775 C CB . SER H 183 ? 0.4130 0.4884 0.6175 0.0369 -0.0820 -0.1778 177 SER F CB 12776 O OG . SER H 183 ? 0.4062 0.5093 0.6131 0.0461 -0.0887 -0.1865 177 SER F OG 12777 N N . LEU H 184 ? 0.4312 0.5079 0.5909 0.0491 -0.0790 -0.1531 178 LEU F N 12778 C CA . LEU H 184 ? 0.4659 0.5568 0.6127 0.0576 -0.0811 -0.1488 178 LEU F CA 12779 C C . LEU H 184 ? 0.4237 0.5317 0.5697 0.0627 -0.0782 -0.1453 178 LEU F C 12780 O O . LEU H 184 ? 0.3902 0.4972 0.5446 0.0593 -0.0741 -0.1456 178 LEU F O 12781 C CB . LEU H 184 ? 0.4955 0.5663 0.6236 0.0560 -0.0780 -0.1366 178 LEU F CB 12782 C CG . LEU H 184 ? 0.5265 0.5883 0.6393 0.0561 -0.0709 -0.1227 178 LEU F CG 12783 C CD1 . LEU H 184 ? 0.5907 0.6341 0.6884 0.0540 -0.0699 -0.1148 178 LEU F CD1 12784 C CD2 . LEU H 184 ? 0.6168 0.6672 0.7331 0.0500 -0.0638 -0.1184 178 LEU F CD2 12785 N N . SER H 185 ? 0.4612 0.5854 0.5978 0.0710 -0.0804 -0.1420 179 SER F N 12786 C CA . SER H 185 ? 0.4916 0.6308 0.6256 0.0770 -0.0777 -0.1365 179 SER F CA 12787 C C . SER H 185 ? 0.4802 0.6125 0.5958 0.0803 -0.0739 -0.1226 179 SER F C 12788 O O . SER H 185 ? 0.5242 0.6496 0.6297 0.0804 -0.0755 -0.1200 179 SER F O 12789 C CB . SER H 185 ? 0.5161 0.6873 0.6590 0.0853 -0.0845 -0.1465 179 SER F CB 12790 O OG . SER H 185 ? 0.6305 0.8093 0.7923 0.0820 -0.0876 -0.1602 179 SER F OG 12791 N N . SER H 186 ? 0.3267 0.4606 0.4389 0.0828 -0.0688 -0.1141 180 SER F N 12792 C CA . SER H 186 ? 0.3474 0.4763 0.4442 0.0864 -0.0648 -0.1012 180 SER F CA 12793 C C . SER H 186 ? 0.3891 0.5392 0.4871 0.0954 -0.0647 -0.0975 180 SER F C 12794 O O . SER H 186 ? 0.4224 0.5761 0.5290 0.0956 -0.0623 -0.0981 180 SER F O 12795 C CB . SER H 186 ? 0.2926 0.3946 0.3825 0.0792 -0.0568 -0.0921 180 SER F CB 12796 O OG . SER H 186 ? 0.3214 0.4192 0.3988 0.0826 -0.0524 -0.0803 180 SER F OG 12797 N N . VAL H 187 ? 0.3325 0.4971 0.4220 0.1029 -0.0674 -0.0935 181 VAL F N 12798 C CA . VAL H 187 ? 0.3709 0.5573 0.4609 0.1124 -0.0682 -0.0894 181 VAL F CA 12799 C C . VAL H 187 ? 0.4744 0.6545 0.5505 0.1163 -0.0631 -0.0743 181 VAL F C 12800 O O . VAL H 187 ? 0.4838 0.6503 0.5492 0.1132 -0.0610 -0.0691 181 VAL F O 12801 C CB . VAL H 187 ? 0.4467 0.6629 0.5405 0.1197 -0.0766 -0.0987 181 VAL F CB 12802 C CG1 . VAL H 187 ? 0.3426 0.5674 0.4529 0.1164 -0.0816 -0.1148 181 VAL F CG1 12803 C CG2 . VAL H 187 ? 0.4738 0.6908 0.5568 0.1204 -0.0792 -0.0981 181 VAL F CG2 12804 N N . VAL H 188 ? 0.4635 0.6539 0.5409 0.1231 -0.0610 -0.0673 182 VAL F N 12805 C CA . VAL H 188 ? 0.4720 0.6573 0.5381 0.1275 -0.0559 -0.0525 182 VAL F CA 12806 C C . VAL H 188 ? 0.4629 0.6740 0.5301 0.1390 -0.0587 -0.0480 182 VAL F C 12807 O O . VAL H 188 ? 0.4478 0.6738 0.5260 0.1427 -0.0616 -0.0538 182 VAL F O 12808 C CB . VAL H 188 ? 0.4062 0.5656 0.4716 0.1219 -0.0473 -0.0445 182 VAL F CB 12809 C CG1 . VAL H 188 ? 0.4649 0.6273 0.5433 0.1220 -0.0461 -0.0487 182 VAL F CG1 12810 C CG2 . VAL H 188 ? 0.4243 0.5774 0.4798 0.1263 -0.0417 -0.0296 182 VAL F CG2 12811 N N . THR H 189 ? 0.4537 0.6714 0.5096 0.1448 -0.0582 -0.0380 183 THR F N 12812 C CA . THR H 189 ? 0.4229 0.6601 0.4759 0.1540 -0.0591 -0.0307 183 THR F CA 12813 C C . THR H 189 ? 0.4735 0.6995 0.5248 0.1587 -0.0524 -0.0153 183 THR F C 12814 O O . THR H 189 ? 0.5797 0.7845 0.6230 0.1541 -0.0462 -0.0068 183 THR F O 12815 C CB . THR H 189 ? 0.5252 0.7744 0.5651 0.1554 -0.0610 -0.0285 183 THR F CB 12816 O OG1 . THR H 189 ? 0.6000 0.8368 0.6323 0.1531 -0.0587 -0.0237 183 THR F OG1 12817 C CG2 . THR H 189 ? 0.5420 0.8052 0.5842 0.1521 -0.0669 -0.0440 183 THR F CG2 12818 N N . VAL H 190 ? 0.4547 0.6890 0.5120 0.1638 -0.0521 -0.0125 184 VAL F N 12819 C CA . VAL H 190 ? 0.4318 0.6556 0.4905 0.1689 -0.0458 0.0009 184 VAL F CA 12820 C C . VAL H 190 ? 0.4735 0.7122 0.5285 0.1760 -0.0466 0.0093 184 VAL F C 12821 O O . VAL H 190 ? 0.4678 0.7257 0.5216 0.1769 -0.0520 0.0023 184 VAL F O 12822 C CB . VAL H 190 ? 0.4388 0.6481 0.5096 0.1636 -0.0422 -0.0047 184 VAL F CB 12823 C CG1 . VAL H 190 ? 0.4797 0.6673 0.5502 0.1507 -0.0398 -0.0131 184 VAL F CG1 12824 C CG2 . VAL H 190 ? 0.3762 0.6076 0.4594 0.1677 -0.0481 -0.0147 184 VAL F CG2 12825 N N . PRO H 191 ? 0.5191 0.7485 0.5723 0.1813 -0.0408 0.0242 185 PRO F N 12826 C CA . PRO H 191 ? 0.5765 0.8191 0.6279 0.1886 -0.0417 0.0322 185 PRO F CA 12827 C C . PRO H 191 ? 0.6345 0.8899 0.6978 0.1899 -0.0459 0.0222 185 PRO F C 12828 O O . PRO H 191 ? 0.5701 0.8161 0.6455 0.1878 -0.0439 0.0175 185 PRO F O 12829 C CB . PRO H 191 ? 0.5936 0.8183 0.6453 0.1925 -0.0340 0.0482 185 PRO F CB 12830 C CG . PRO H 191 ? 0.6264 0.8321 0.6733 0.1876 -0.0293 0.0511 185 PRO F CG 12831 C CD . PRO H 191 ? 0.5781 0.7843 0.6296 0.1808 -0.0332 0.0349 185 PRO F CD 12832 N N . SER H 192 ? 0.7784 1.0553 0.8382 0.1931 -0.0512 0.0187 186 SER F N 12833 C CA . SER H 192 ? 0.7646 1.0557 0.8352 0.1943 -0.0557 0.0084 186 SER F CA 12834 C C . SER H 192 ? 0.7419 1.0281 0.8219 0.1997 -0.0526 0.0160 186 SER F C 12835 O O . SER H 192 ? 0.7446 1.0358 0.8375 0.1991 -0.0544 0.0072 186 SER F O 12836 C CB . SER H 192 ? 0.7984 1.1135 0.8616 0.1978 -0.0613 0.0044 186 SER F CB 12837 O OG . SER H 192 ? 0.8219 1.1510 0.8957 0.1974 -0.0660 -0.0085 186 SER F OG 12838 N N . SER H 193 ? 0.7493 1.0251 0.8234 0.2048 -0.0477 0.0323 187 SER F N 12839 C CA . SER H 193 ? 0.8143 1.0839 0.8970 0.2106 -0.0444 0.0407 187 SER F CA 12840 C C . SER H 193 ? 0.8009 1.0478 0.8936 0.2069 -0.0379 0.0407 187 SER F C 12841 O O . SER H 193 ? 0.8567 1.0953 0.9578 0.2109 -0.0341 0.0467 187 SER F O 12842 C CB . SER H 193 ? 0.8602 1.1281 0.9327 0.2179 -0.0415 0.0585 187 SER F CB 12843 O OG . SER H 193 ? 0.8780 1.1261 0.9436 0.2151 -0.0352 0.0680 187 SER F OG 12844 N N . SER H 194 ? 0.7332 0.9697 0.8248 0.1995 -0.0365 0.0338 188 SER F N 12845 C CA . SER H 194 ? 0.7134 0.9288 0.8134 0.1957 -0.0299 0.0325 188 SER F CA 12846 C C . SER H 194 ? 0.5886 0.8095 0.7022 0.1910 -0.0320 0.0163 188 SER F C 12847 O O . SER H 194 ? 0.4495 0.6559 0.5717 0.1880 -0.0265 0.0130 188 SER F O 12848 C CB . SER H 194 ? 0.6978 0.8966 0.7883 0.1909 -0.0260 0.0356 188 SER F CB 12849 O OG . SER H 194 ? 0.6820 0.8901 0.7682 0.1855 -0.0315 0.0244 188 SER F OG 12850 N N . LEU H 195 ? 0.5576 0.7993 0.6729 0.1901 -0.0395 0.0061 189 LEU F N 12851 C CA . LEU H 195 ? 0.5617 0.8100 0.6901 0.1846 -0.0419 -0.0099 189 LEU F CA 12852 C C . LEU H 195 ? 0.6573 0.9047 0.8009 0.1870 -0.0386 -0.0114 189 LEU F C 12853 O O . LEU H 195 ? 0.7193 0.9633 0.8746 0.1815 -0.0366 -0.0223 189 LEU F O 12854 C CB . LEU H 195 ? 0.5003 0.7711 0.6273 0.1837 -0.0501 -0.0198 189 LEU F CB 12855 C CG . LEU H 195 ? 0.5111 0.7842 0.6268 0.1792 -0.0537 -0.0243 189 LEU F CG 12856 C CD1 . LEU H 195 ? 0.4888 0.7833 0.6052 0.1782 -0.0610 -0.0361 189 LEU F CD1 12857 C CD2 . LEU H 195 ? 0.4300 0.6869 0.5493 0.1713 -0.0510 -0.0311 189 LEU F CD2 12858 N N . GLY H 196 ? 0.6542 0.9047 0.7978 0.1949 -0.0379 -0.0008 190 GLY F N 12859 C CA . GLY H 196 ? 0.7455 0.9956 0.9039 0.1979 -0.0348 -0.0017 190 GLY F CA 12860 C C . GLY H 196 ? 0.8285 1.0549 0.9896 0.1982 -0.0257 0.0058 190 GLY F C 12861 O O . GLY H 196 ? 0.8873 1.1097 1.0616 0.1991 -0.0215 0.0032 190 GLY F O 12862 N N . THR H 197 ? 0.8389 1.0495 0.9876 0.1970 -0.0221 0.0145 191 THR F N 12863 C CA . THR H 197 ? 0.8274 1.0138 0.9765 0.1974 -0.0128 0.0231 191 THR F CA 12864 C C . THR H 197 ? 0.7475 0.9107 0.8917 0.1822 -0.0073 0.0158 191 THR F C 12865 O O . THR H 197 ? 0.7628 0.9065 0.9117 0.1764 0.0004 0.0149 191 THR F O 12866 C CB . THR H 197 ? 0.9528 1.1301 1.0890 0.2018 -0.0110 0.0398 191 THR F CB 12867 O OG1 . THR H 197 ? 1.0390 1.2326 1.1743 0.2093 -0.0164 0.0460 191 THR F OG1 12868 C CG2 . THR H 197 ? 0.9553 1.1070 1.0943 0.2019 -0.0010 0.0485 191 THR F CG2 12869 N N . GLN H 198 ? 0.6837 0.8495 0.8185 0.1759 -0.0114 0.0104 192 GLN F N 12870 C CA . GLN H 198 ? 0.7020 0.8458 0.8297 0.1622 -0.0071 0.0056 192 GLN F CA 12871 C C . GLN H 198 ? 0.6444 0.7947 0.7771 0.1538 -0.0107 -0.0096 192 GLN F C 12872 O O . GLN H 198 ? 0.6452 0.8167 0.7795 0.1570 -0.0186 -0.0157 192 GLN F O 12873 C CB . GLN H 198 ? 0.7591 0.8960 0.8709 0.1611 -0.0078 0.0133 192 GLN F CB 12874 C CG . GLN H 198 ? 0.8078 0.9241 0.9113 0.1480 -0.0045 0.0085 192 GLN F CG 12875 C CD . GLN H 198 ? 0.8826 0.9724 0.9841 0.1425 0.0050 0.0138 192 GLN F CD 12876 O OE1 . GLN H 198 ? 0.9302 1.0146 1.0327 0.1487 0.0092 0.0243 192 GLN F OE1 12877 N NE2 . GLN H 198 ? 0.9126 0.9861 1.0118 0.1308 0.0084 0.0066 192 GLN F NE2 12878 N N . THR H 199 ? 0.6455 0.7779 0.7811 0.1431 -0.0048 -0.0157 193 THR F N 12879 C CA . THR H 199 ? 0.6796 0.8143 0.8197 0.1339 -0.0070 -0.0288 193 THR F CA 12880 C C . THR H 199 ? 0.6342 0.7566 0.7613 0.1255 -0.0083 -0.0300 193 THR F C 12881 O O . THR H 199 ? 0.6823 0.7853 0.7987 0.1217 -0.0035 -0.0230 193 THR F O 12882 C CB . THR H 199 ? 0.7878 0.9106 0.9374 0.1261 0.0001 -0.0347 193 THR F CB 12883 O OG1 . THR H 199 ? 0.8410 0.9433 0.9859 0.1249 0.0083 -0.0266 193 THR F OG1 12884 C CG2 . THR H 199 ? 0.8598 1.0025 1.0264 0.1322 -0.0016 -0.0405 193 THR F CG2 12885 N N . TYR H 200 ? 0.5046 0.6389 0.6338 0.1227 -0.0148 -0.0394 194 TYR F N 12886 C CA . TYR H 200 ? 0.4542 0.5792 0.5726 0.1159 -0.0171 -0.0414 194 TYR F CA 12887 C C . TYR H 200 ? 0.4243 0.5400 0.5476 0.1045 -0.0161 -0.0518 194 TYR F C 12888 O O . TYR H 200 ? 0.4650 0.5941 0.6007 0.1037 -0.0192 -0.0614 194 TYR F O 12889 C CB . TYR H 200 ? 0.4554 0.6015 0.5707 0.1229 -0.0260 -0.0429 194 TYR F CB 12890 C CG . TYR H 200 ? 0.4429 0.5946 0.5496 0.1327 -0.0262 -0.0306 194 TYR F CG 12891 C CD1 . TYR H 200 ? 0.5016 0.6355 0.5952 0.1303 -0.0220 -0.0213 194 TYR F CD1 12892 C CD2 . TYR H 200 ? 0.4160 0.5909 0.5279 0.1444 -0.0303 -0.0278 194 TYR F CD2 12893 C CE1 . TYR H 200 ? 0.5145 0.6525 0.6009 0.1386 -0.0214 -0.0094 194 TYR F CE1 12894 C CE2 . TYR H 200 ? 0.4582 0.6375 0.5620 0.1534 -0.0300 -0.0150 194 TYR F CE2 12895 C CZ . TYR H 200 ? 0.5619 0.7219 0.6530 0.1501 -0.0252 -0.0056 194 TYR F CZ 12896 O OH . TYR H 200 ? 0.5879 0.7513 0.6715 0.1584 -0.0242 0.0076 194 TYR F OH 12897 N N . ILE H 201 ? 0.3662 0.4590 0.4799 0.0957 -0.0116 -0.0495 195 ILE F N 12898 C CA . ILE H 201 ? 0.3317 0.4124 0.4481 0.0845 -0.0094 -0.0569 195 ILE F CA 12899 C C . ILE H 201 ? 0.3587 0.4281 0.4640 0.0788 -0.0123 -0.0575 195 ILE F C 12900 O O . ILE H 201 ? 0.4203 0.4772 0.5131 0.0784 -0.0102 -0.0502 195 ILE F O 12901 C CB . ILE H 201 ? 0.3445 0.4068 0.4605 0.0783 0.0000 -0.0540 195 ILE F CB 12902 C CG1 . ILE H 201 ? 0.4624 0.5359 0.5911 0.0840 0.0031 -0.0543 195 ILE F CG1 12903 C CG2 . ILE H 201 ? 0.2757 0.3254 0.3926 0.0666 0.0025 -0.0602 195 ILE F CG2 12904 C CD1 . ILE H 201 ? 0.5073 0.5650 0.6370 0.0785 0.0126 -0.0525 195 ILE F CD1 12905 N N . CYS H 202 ? 0.2829 0.3568 0.3936 0.0745 -0.0172 -0.0666 196 CYS F N 12906 C CA . CYS H 202 ? 0.3644 0.4259 0.4660 0.0686 -0.0196 -0.0675 196 CYS F CA 12907 C C . CYS H 202 ? 0.3834 0.4233 0.4826 0.0578 -0.0135 -0.0675 196 CYS F C 12908 O O . CYS H 202 ? 0.3647 0.4044 0.4740 0.0532 -0.0104 -0.0722 196 CYS F O 12909 C CB . CYS H 202 ? 0.5089 0.5847 0.6175 0.0696 -0.0281 -0.0771 196 CYS F CB 12910 S SG . CYS H 202 ? 0.7772 0.8555 0.9030 0.0623 -0.0285 -0.0889 196 CYS F SG 12911 N N . ASN H 203 ? 0.3270 0.3495 0.4127 0.0539 -0.0116 -0.0621 197 ASN F N 12912 C CA . ASN H 203 ? 0.3705 0.3729 0.4513 0.0440 -0.0063 -0.0613 197 ASN F CA 12913 C C . ASN H 203 ? 0.3122 0.3076 0.3897 0.0392 -0.0114 -0.0649 197 ASN F C 12914 O O . ASN H 203 ? 0.3231 0.3176 0.3922 0.0417 -0.0158 -0.0631 197 ASN F O 12915 C CB . ASN H 203 ? 0.3375 0.3252 0.4059 0.0428 0.0000 -0.0530 197 ASN F CB 12916 C CG . ASN H 203 ? 0.3602 0.3562 0.4310 0.0505 0.0030 -0.0483 197 ASN F CG 12917 O OD1 . ASN H 203 ? 0.3846 0.3857 0.4502 0.0570 0.0005 -0.0437 197 ASN F OD1 12918 N ND2 . ASN H 203 ? 0.3250 0.3225 0.4042 0.0500 0.0086 -0.0492 197 ASN F ND2 12919 N N . VAL H 204 ? 0.3117 0.3025 0.3967 0.0323 -0.0108 -0.0701 198 VAL F N 12920 C CA . VAL H 204 ? 0.2896 0.2739 0.3744 0.0280 -0.0159 -0.0740 198 VAL F CA 12921 C C . VAL H 204 ? 0.2692 0.2321 0.3466 0.0185 -0.0111 -0.0704 198 VAL F C 12922 O O . VAL H 204 ? 0.3034 0.2615 0.3856 0.0127 -0.0051 -0.0706 198 VAL F O 12923 C CB . VAL H 204 ? 0.2992 0.2969 0.4010 0.0281 -0.0204 -0.0838 198 VAL F CB 12924 C CG1 . VAL H 204 ? 0.3703 0.3590 0.4732 0.0233 -0.0253 -0.0878 198 VAL F CG1 12925 C CG2 . VAL H 204 ? 0.3198 0.3409 0.4280 0.0379 -0.0261 -0.0879 198 VAL F CG2 12926 N N . ASN H 205 ? 0.2461 0.1972 0.3115 0.0171 -0.0137 -0.0670 199 ASN F N 12927 C CA . ASN H 205 ? 0.2833 0.2149 0.3399 0.0089 -0.0101 -0.0630 199 ASN F CA 12928 C C . ASN H 205 ? 0.3425 0.2676 0.4005 0.0064 -0.0165 -0.0658 199 ASN F C 12929 O O . ASN H 205 ? 0.3411 0.2682 0.3948 0.0107 -0.0228 -0.0666 199 ASN F O 12930 C CB . ASN H 205 ? 0.3932 0.3149 0.4336 0.0091 -0.0068 -0.0557 199 ASN F CB 12931 C CG . ASN H 205 ? 0.4250 0.3285 0.4553 0.0009 -0.0024 -0.0513 199 ASN F CG 12932 O OD1 . ASN H 205 ? 0.5081 0.4056 0.5432 -0.0052 -0.0007 -0.0524 199 ASN F OD1 12933 N ND2 . ASN H 205 ? 0.3864 0.2816 0.4028 0.0005 -0.0003 -0.0462 199 ASN F ND2 12934 N N . HIS H 206 ? 0.3490 0.2665 0.4139 -0.0004 -0.0145 -0.0675 200 HIS F N 12935 C CA . HIS H 206 ? 0.3645 0.2723 0.4312 -0.0036 -0.0196 -0.0691 200 HIS F CA 12936 C C . HIS H 206 ? 0.3729 0.2608 0.4285 -0.0115 -0.0146 -0.0616 200 HIS F C 12937 O O . HIS H 206 ? 0.4138 0.2958 0.4748 -0.0183 -0.0094 -0.0609 200 HIS F O 12938 C CB . HIS H 206 ? 0.3584 0.2742 0.4444 -0.0050 -0.0222 -0.0777 200 HIS F CB 12939 C CG . HIS H 206 ? 0.4408 0.3463 0.5311 -0.0078 -0.0276 -0.0799 200 HIS F CG 12940 N ND1 . HIS H 206 ? 0.4028 0.2960 0.4999 -0.0159 -0.0245 -0.0792 200 HIS F ND1 12941 C CD2 . HIS H 206 ? 0.4288 0.3342 0.5182 -0.0036 -0.0357 -0.0828 200 HIS F CD2 12942 C CE1 . HIS H 206 ? 0.5100 0.3950 0.6105 -0.0163 -0.0306 -0.0812 200 HIS F CE1 12943 N NE2 . HIS H 206 ? 0.4817 0.3743 0.5779 -0.0087 -0.0376 -0.0839 200 HIS F NE2 12944 N N . LYS H 207 ? 0.4450 0.3237 0.4849 -0.0105 -0.0160 -0.0560 201 LYS F N 12945 C CA . LYS H 207 ? 0.4454 0.3072 0.4719 -0.0169 -0.0114 -0.0483 201 LYS F CA 12946 C C . LYS H 207 ? 0.4750 0.3234 0.5048 -0.0236 -0.0116 -0.0465 201 LYS F C 12947 O O . LYS H 207 ? 0.4896 0.3283 0.5135 -0.0304 -0.0049 -0.0410 201 LYS F O 12948 C CB . LYS H 207 ? 0.5127 0.3693 0.5235 -0.0137 -0.0147 -0.0443 201 LYS F CB 12949 C CG . LYS H 207 ? 0.6095 0.4764 0.6157 -0.0085 -0.0127 -0.0443 201 LYS F CG 12950 C CD . LYS H 207 ? 0.6872 0.5498 0.6796 -0.0058 -0.0157 -0.0412 201 LYS F CD 12951 C CE . LYS H 207 ? 0.8778 0.7270 0.8556 -0.0115 -0.0108 -0.0350 201 LYS F CE 12952 N NZ . LYS H 207 ? 0.9202 0.7706 0.8956 -0.0141 -0.0017 -0.0334 201 LYS F NZ 12953 N N . PRO H 208 ? 0.4722 0.3201 0.5117 -0.0218 -0.0190 -0.0509 202 PRO F N 12954 C CA . PRO H 208 ? 0.4301 0.2632 0.4729 -0.0283 -0.0187 -0.0479 202 PRO F CA 12955 C C . PRO H 208 ? 0.4917 0.3241 0.5448 -0.0356 -0.0111 -0.0482 202 PRO F C 12956 O O . PRO H 208 ? 0.5444 0.3626 0.5941 -0.0427 -0.0071 -0.0419 202 PRO F O 12957 C CB . PRO H 208 ? 0.4620 0.2979 0.5176 -0.0242 -0.0279 -0.0550 202 PRO F CB 12958 C CG . PRO H 208 ? 0.5265 0.3734 0.5766 -0.0159 -0.0336 -0.0581 202 PRO F CG 12959 C CD . PRO H 208 ? 0.5417 0.4003 0.5878 -0.0142 -0.0278 -0.0577 202 PRO F CD 12960 N N . SER H 209 ? 0.5233 0.3715 0.5887 -0.0338 -0.0089 -0.0551 203 SER F N 12961 C CA . SER H 209 ? 0.4177 0.2682 0.4950 -0.0404 -0.0016 -0.0568 203 SER F CA 12962 C C . SER H 209 ? 0.4742 0.3295 0.5440 -0.0418 0.0070 -0.0537 203 SER F C 12963 O O . SER H 209 ? 0.4877 0.3479 0.5674 -0.0464 0.0136 -0.0559 203 SER F O 12964 C CB . SER H 209 ? 0.4324 0.2987 0.5314 -0.0376 -0.0053 -0.0681 203 SER F CB 12965 O OG . SER H 209 ? 0.4569 0.3411 0.5567 -0.0296 -0.0073 -0.0727 203 SER F OG 12966 N N . ASN H 210 ? 0.4811 0.3353 0.5346 -0.0379 0.0070 -0.0493 204 ASN F N 12967 C CA . ASN H 210 ? 0.5165 0.3760 0.5636 -0.0379 0.0145 -0.0475 204 ASN F CA 12968 C C . ASN H 210 ? 0.4821 0.3592 0.5451 -0.0347 0.0162 -0.0548 204 ASN F C 12969 O O . ASN H 210 ? 0.5215 0.4020 0.5884 -0.0384 0.0241 -0.0550 204 ASN F O 12970 C CB . ASN H 210 ? 0.6604 0.5087 0.6994 -0.0468 0.0234 -0.0412 204 ASN F CB 12971 C CG . ASN H 210 ? 0.8823 0.7155 0.9019 -0.0488 0.0224 -0.0331 204 ASN F CG 12972 O OD1 . ASN H 210 ? 0.9053 0.7261 0.9222 -0.0539 0.0218 -0.0286 204 ASN F OD1 12973 N ND2 . ASN H 210 ? 0.9471 0.7813 0.9535 -0.0448 0.0223 -0.0312 204 ASN F ND2 12974 N N . THR H 211 ? 0.4582 0.3474 0.5306 -0.0275 0.0088 -0.0609 205 THR F N 12975 C CA . THR H 211 ? 0.4207 0.3285 0.5079 -0.0231 0.0090 -0.0679 205 THR F CA 12976 C C . THR H 211 ? 0.4673 0.3845 0.5477 -0.0147 0.0081 -0.0666 205 THR F C 12977 O O . THR H 211 ? 0.4279 0.3455 0.5008 -0.0092 0.0021 -0.0655 205 THR F O 12978 C CB . THR H 211 ? 0.4355 0.3536 0.5392 -0.0204 0.0015 -0.0766 205 THR F CB 12979 O OG1 . THR H 211 ? 0.4787 0.3874 0.5912 -0.0287 0.0031 -0.0779 205 THR F OG1 12980 C CG2 . THR H 211 ? 0.3963 0.3359 0.5147 -0.0151 0.0011 -0.0839 205 THR F CG2 12981 N N . LYS H 212 ? 0.4923 0.4166 0.5756 -0.0140 0.0146 -0.0666 206 LYS F N 12982 C CA . LYS H 212 ? 0.4079 0.3418 0.4880 -0.0057 0.0143 -0.0654 206 LYS F CA 12983 C C . LYS H 212 ? 0.4440 0.3965 0.5404 -0.0013 0.0150 -0.0712 206 LYS F C 12984 O O . LYS H 212 ? 0.4437 0.3981 0.5470 -0.0050 0.0218 -0.0725 206 LYS F O 12985 C CB . LYS H 212 ? 0.3247 0.2483 0.3914 -0.0079 0.0217 -0.0590 206 LYS F CB 12986 C CG . LYS H 212 ? 0.3621 0.2710 0.4116 -0.0098 0.0198 -0.0534 206 LYS F CG 12987 C CD . LYS H 212 ? 0.4114 0.3095 0.4490 -0.0145 0.0279 -0.0487 206 LYS F CD 12988 C CE . LYS H 212 ? 0.4800 0.3646 0.5011 -0.0166 0.0255 -0.0438 206 LYS F CE 12989 N NZ . LYS H 212 ? 0.6237 0.4980 0.6330 -0.0226 0.0332 -0.0401 206 LYS F NZ 12990 N N . VAL H 213 ? 0.3794 0.3467 0.4821 0.0069 0.0077 -0.0750 207 VAL F N 12991 C CA . VAL H 213 ? 0.3920 0.3792 0.5105 0.0121 0.0069 -0.0810 207 VAL F CA 12992 C C . VAL H 213 ? 0.4351 0.4337 0.5504 0.0224 0.0050 -0.0780 207 VAL F C 12993 O O . VAL H 213 ? 0.4643 0.4640 0.5713 0.0277 -0.0003 -0.0754 207 VAL F O 12994 C CB . VAL H 213 ? 0.3932 0.3922 0.5255 0.0128 -0.0004 -0.0899 207 VAL F CB 12995 C CG1 . VAL H 213 ? 0.4278 0.4497 0.5762 0.0188 -0.0019 -0.0966 207 VAL F CG1 12996 C CG2 . VAL H 213 ? 0.3544 0.3416 0.4921 0.0023 0.0019 -0.0926 207 VAL F CG2 12997 N N . ASP H 214 ? 0.3594 0.3665 0.4819 0.0253 0.0098 -0.0781 208 ASP F N 12998 C CA . ASP H 214 ? 0.3977 0.4175 0.5206 0.0358 0.0082 -0.0752 208 ASP F CA 12999 C C . ASP H 214 ? 0.4173 0.4603 0.5570 0.0417 0.0039 -0.0825 208 ASP F C 13000 O O . ASP H 214 ? 0.5808 0.6300 0.7327 0.0397 0.0079 -0.0868 208 ASP F O 13001 C CB . ASP H 214 ? 0.3985 0.4107 0.5175 0.0359 0.0167 -0.0696 208 ASP F CB 13002 C CG . ASP H 214 ? 0.5018 0.4938 0.6039 0.0316 0.0204 -0.0628 208 ASP F CG 13003 O OD1 . ASP H 214 ? 0.4366 0.4258 0.5287 0.0350 0.0158 -0.0589 208 ASP F OD1 13004 O OD2 . ASP H 214 ? 0.6535 0.6335 0.7522 0.0247 0.0278 -0.0616 208 ASP F OD2 13005 N N . LYS H 215 ? 0.3041 0.3611 0.4447 0.0490 -0.0044 -0.0846 209 LYS F N 13006 C CA . LYS H 215 ? 0.3739 0.4551 0.5302 0.0550 -0.0095 -0.0924 209 LYS F CA 13007 C C . LYS H 215 ? 0.3965 0.4936 0.5516 0.0673 -0.0122 -0.0878 209 LYS F C 13008 O O . LYS H 215 ? 0.4323 0.5308 0.5768 0.0728 -0.0163 -0.0829 209 LYS F O 13009 C CB . LYS H 215 ? 0.4124 0.5017 0.5739 0.0539 -0.0174 -0.1009 209 LYS F CB 13010 C CG . LYS H 215 ? 0.4882 0.5957 0.6697 0.0533 -0.0199 -0.1124 209 LYS F CG 13011 C CD . LYS H 215 ? 0.5867 0.6819 0.7759 0.0424 -0.0123 -0.1149 209 LYS F CD 13012 C CE . LYS H 215 ? 0.6719 0.7844 0.8825 0.0404 -0.0141 -0.1271 209 LYS F CE 13013 N NZ . LYS H 215 ? 0.7703 0.8704 0.9881 0.0292 -0.0059 -0.1288 209 LYS F NZ 13014 N N . LYS H 216 ? 0.3319 0.4412 0.4982 0.0716 -0.0097 -0.0891 210 LYS F N 13015 C CA . LYS H 216 ? 0.4125 0.5389 0.5797 0.0841 -0.0128 -0.0848 210 LYS F CA 13016 C C . LYS H 216 ? 0.4189 0.5694 0.5920 0.0908 -0.0227 -0.0916 210 LYS F C 13017 O O . LYS H 216 ? 0.4166 0.5768 0.6017 0.0869 -0.0260 -0.1026 210 LYS F O 13018 C CB . LYS H 216 ? 0.3854 0.5194 0.5647 0.0873 -0.0080 -0.0853 210 LYS F CB 13019 C CG . LYS H 216 ? 0.3890 0.5016 0.5634 0.0816 0.0019 -0.0795 210 LYS F CG 13020 C CD . LYS H 216 ? 0.5325 0.6542 0.7200 0.0858 0.0064 -0.0807 210 LYS F CD 13021 C CE . LYS H 216 ? 0.7422 0.8437 0.9241 0.0815 0.0162 -0.0747 210 LYS F CE 13022 N NZ . LYS H 216 ? 0.9061 1.0168 1.1003 0.0881 0.0201 -0.0746 210 LYS F NZ 13023 N N . VAL H 217 ? 0.4201 0.5802 0.5847 0.1006 -0.0271 -0.0851 211 VAL F N 13024 C CA . VAL H 217 ? 0.4205 0.6059 0.5891 0.1081 -0.0364 -0.0910 211 VAL F CA 13025 C C . VAL H 217 ? 0.4458 0.6522 0.6179 0.1210 -0.0387 -0.0863 211 VAL F C 13026 O O . VAL H 217 ? 0.5261 0.7304 0.6868 0.1279 -0.0381 -0.0748 211 VAL F O 13027 C CB . VAL H 217 ? 0.4046 0.5862 0.5592 0.1085 -0.0408 -0.0883 211 VAL F CB 13028 C CG1 . VAL H 217 ? 0.3413 0.5510 0.5000 0.1165 -0.0503 -0.0953 211 VAL F CG1 13029 C CG2 . VAL H 217 ? 0.4498 0.6108 0.6015 0.0966 -0.0391 -0.0927 211 VAL F CG2 13030 N N . GLU H 218 ? 0.4897 0.7163 0.6781 0.1240 -0.0413 -0.0950 212 GLU F N 13031 C CA . GLU H 218 ? 0.5678 0.8149 0.7618 0.1363 -0.0434 -0.0911 212 GLU F CA 13032 C C . GLU H 218 ? 0.6388 0.9132 0.8363 0.1416 -0.0526 -0.0985 212 GLU F C 13033 O O . GLU H 218 ? 0.6110 0.8911 0.8149 0.1352 -0.0563 -0.1109 212 GLU F O 13034 C CB . GLU H 218 ? 0.5526 0.7976 0.7604 0.1344 -0.0374 -0.0934 212 GLU F CB 13035 C CG . GLU H 218 ? 0.5999 0.8154 0.8009 0.1276 -0.0273 -0.0852 212 GLU F CG 13036 C CD . GLU H 218 ? 0.5813 0.7949 0.7972 0.1228 -0.0211 -0.0910 212 GLU F CD 13037 O OE1 . GLU H 218 ? 0.5003 0.7317 0.7319 0.1215 -0.0243 -0.1028 212 GLU F OE1 13038 O OE2 . GLU H 218 ? 0.6053 0.8002 0.8179 0.1200 -0.0129 -0.0843 212 GLU F OE2 13039 N N . PRO H 219 ? 0.7578 1.0435 0.9473 0.1505 -0.0550 -0.0896 213 PRO F N 13040 C CA . PRO H 219 ? 0.8514 1.1582 1.0394 0.1532 -0.0621 -0.0952 213 PRO F CA 13041 C C . PRO H 219 ? 1.0023 1.3200 1.2077 0.1486 -0.0633 -0.1092 213 PRO F C 13042 O O . PRO H 219 ? 1.0301 1.3485 1.2462 0.1501 -0.0596 -0.1083 213 PRO F O 13043 C CB . PRO H 219 ? 0.8096 1.1233 0.9896 0.1637 -0.0622 -0.0817 213 PRO F CB 13044 C CG . PRO H 219 ? 0.7740 1.0689 0.9454 0.1660 -0.0567 -0.0680 213 PRO F CG 13045 C CD . PRO H 219 ? 0.7733 1.0515 0.9544 0.1585 -0.0510 -0.0737 213 PRO F CD 13046 N N . LYS H 220 ? 1.1871 1.5128 1.3959 0.1431 -0.0680 -0.1224 214 LYS F N 13047 C CA . LYS H 220 ? 1.3797 1.7153 1.6058 0.1378 -0.0690 -0.1368 214 LYS F CA 13048 C C . LYS H 220 ? 1.5091 1.8640 1.7329 0.1394 -0.0762 -0.1465 214 LYS F C 13049 O O . LYS H 220 ? 1.5566 1.9129 1.7692 0.1395 -0.0800 -0.1479 214 LYS F O 13050 C CB . LYS H 220 ? 1.4310 1.7532 1.6693 0.1268 -0.0656 -0.1464 214 LYS F CB 13051 C CG . LYS H 220 ? 1.4848 1.7886 1.7272 0.1244 -0.0575 -0.1394 214 LYS F CG 13052 C CD . LYS H 220 ? 1.5198 1.8105 1.7736 0.1133 -0.0542 -0.1487 214 LYS F CD 13053 C CE . LYS H 220 ? 1.5448 1.8111 1.7961 0.1084 -0.0444 -0.1403 214 LYS F CE 13054 N NZ . LYS H 220 ? 1.5510 1.7955 1.8041 0.0938 -0.0397 -0.1450 214 LYS F NZ # 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 L . n A 1 2 ILE 2 2 2 ILE ILE L . n A 1 3 GLN 3 3 3 GLN GLN L . n A 1 4 MET 4 4 4 MET MET L . n A 1 5 THR 5 5 5 THR THR L . n A 1 6 GLN 6 6 6 GLN GLN L . n A 1 7 SER 7 7 7 SER SER L . n A 1 8 PRO 8 8 8 PRO PRO L . n A 1 9 SER 9 9 9 SER SER L . n A 1 10 PHE 10 10 10 PHE PHE L . n A 1 11 VAL 11 11 11 VAL VAL L . n A 1 12 SER 12 12 12 SER SER L . n A 1 13 ALA 13 13 13 ALA ALA L . n A 1 14 SER 14 14 14 SER SER L . n A 1 15 VAL 15 15 15 VAL VAL L . n A 1 16 GLY 16 16 16 GLY GLY L . n A 1 17 ASP 17 17 17 ASP ASP L . n A 1 18 ARG 18 18 18 ARG ARG L . n A 1 19 VAL 19 19 19 VAL VAL L . n A 1 20 THR 20 20 20 THR THR L . n A 1 21 ILE 21 21 21 ILE ILE L . n A 1 22 THR 22 22 22 THR THR L . n A 1 23 CYS 23 23 23 CYS CYS L . n A 1 24 ARG 24 24 24 ARG ARG L . n A 1 25 ALA 25 25 25 ALA ALA L . n A 1 26 SER 26 26 26 SER SER L . n A 1 27 GLN 27 27 27 GLN GLN L . n A 1 28 GLY 28 28 28 GLY GLY L . n A 1 29 ILE 29 29 29 ILE ILE L . n A 1 30 SER 30 30 30 SER SER L . n A 1 31 SER 31 31 31 SER SER L . n A 1 32 TYR 32 32 32 TYR TYR L . n A 1 33 LEU 33 33 33 LEU LEU L . n A 1 34 ALA 34 34 34 ALA ALA L . n A 1 35 TRP 35 35 35 TRP TRP L . n A 1 36 TYR 36 36 36 TYR TYR L . n A 1 37 GLN 37 37 37 GLN GLN L . n A 1 38 GLN 38 38 38 GLN GLN L . n A 1 39 LYS 39 39 39 LYS LYS L . n A 1 40 PRO 40 40 40 PRO PRO L . n A 1 41 GLY 41 41 41 GLY GLY L . n A 1 42 LYS 42 42 42 LYS LYS L . n A 1 43 ALA 43 43 43 ALA ALA L . n A 1 44 PRO 44 44 44 PRO PRO L . n A 1 45 LYS 45 45 45 LYS LYS L . n A 1 46 LEU 46 46 46 LEU LEU L . n A 1 47 VAL 47 47 47 VAL VAL L . n A 1 48 ILE 48 48 48 ILE ILE L . n A 1 49 TYR 49 49 49 TYR TYR L . n A 1 50 ALA 50 50 50 ALA ALA L . n A 1 51 ALA 51 51 51 ALA ALA L . n A 1 52 SER 52 52 52 SER SER L . n A 1 53 THR 53 53 53 THR THR L . n A 1 54 LEU 54 54 54 LEU LEU L . n A 1 55 GLN 55 55 55 GLN GLN L . n A 1 56 SER 56 56 56 SER SER L . n A 1 57 GLY 57 57 57 GLY GLY L . n A 1 58 VAL 58 58 58 VAL VAL L . n A 1 59 PRO 59 59 59 PRO PRO L . n A 1 60 SER 60 60 60 SER SER L . n A 1 61 ARG 61 61 61 ARG ARG L . n A 1 62 PHE 62 62 62 PHE PHE L . n A 1 63 SER 63 63 63 SER SER L . n A 1 64 GLY 64 64 64 GLY GLY L . n A 1 65 SER 65 65 65 SER SER L . n A 1 66 GLY 66 66 66 GLY GLY L . n A 1 67 SER 67 67 67 SER SER L . n A 1 68 GLY 68 68 68 GLY GLY L . n A 1 69 THR 69 69 69 THR THR L . n A 1 70 GLU 70 70 70 GLU GLU L . n A 1 71 PHE 71 71 71 PHE PHE L . n A 1 72 THR 72 72 72 THR THR L . n A 1 73 LEU 73 73 73 LEU LEU L . n A 1 74 THR 74 74 74 THR THR L . n A 1 75 ILE 75 75 75 ILE ILE L . n A 1 76 SER 76 76 76 SER SER L . n A 1 77 SER 77 77 77 SER SER L . n A 1 78 LEU 78 78 78 LEU LEU L . n A 1 79 GLN 79 79 79 GLN GLN L . n A 1 80 PRO 80 80 80 PRO PRO L . n A 1 81 GLU 81 81 81 GLU GLU L . n A 1 82 ASP 82 82 82 ASP ASP L . n A 1 83 PHE 83 83 83 PHE PHE L . n A 1 84 ALA 84 84 84 ALA ALA L . n A 1 85 THR 85 85 85 THR THR L . n A 1 86 TYR 86 86 86 TYR TYR L . n A 1 87 TYR 87 87 87 TYR TYR L . n A 1 88 CYS 88 88 88 CYS CYS L . n A 1 89 GLN 89 89 89 GLN GLN L . n A 1 90 HIS 90 90 90 HIS HIS L . n A 1 91 LEU 91 91 91 LEU LEU L . n A 1 92 ILE 92 92 92 ILE ILE L . n A 1 93 GLY 93 93 93 GLY GLY L . n A 1 94 LEU 94 94 94 LEU LEU L . n A 1 95 ARG 95 96 96 ARG ARG L . n A 1 96 SER 96 97 97 SER SER L . n A 1 97 PHE 97 98 98 PHE PHE L . n A 1 98 GLY 98 99 99 GLY GLY L . n A 1 99 GLN 99 100 100 GLN GLN L . n A 1 100 GLY 100 101 101 GLY GLY L . n A 1 101 THR 101 102 102 THR THR L . n A 1 102 LYS 102 103 103 LYS LYS L . n A 1 103 LEU 103 104 104 LEU LEU L . n A 1 104 GLU 104 105 105 GLU GLU L . n A 1 105 ILE 105 106 106 ILE ILE L . n A 1 106 LYS 106 107 107 LYS LYS L . n A 1 107 ARG 107 108 108 ARG ARG L . n A 1 108 THR 108 109 109 THR THR L . n A 1 109 VAL 109 110 110 VAL VAL L . n A 1 110 ALA 110 111 111 ALA ALA L . n A 1 111 ALA 111 112 112 ALA ALA L . n A 1 112 PRO 112 113 113 PRO PRO L . n A 1 113 SER 113 114 114 SER SER L . n A 1 114 VAL 114 115 115 VAL VAL L . n A 1 115 PHE 115 116 116 PHE PHE L . n A 1 116 ILE 116 117 117 ILE ILE L . n A 1 117 PHE 117 118 118 PHE PHE L . n A 1 118 PRO 118 119 119 PRO PRO L . n A 1 119 PRO 119 120 120 PRO PRO L . n A 1 120 SER 120 121 121 SER SER L . n A 1 121 ASP 121 122 122 ASP ASP L . n A 1 122 GLU 122 123 123 GLU GLU L . n A 1 123 GLN 123 124 124 GLN GLN L . n A 1 124 LEU 124 125 125 LEU LEU L . n A 1 125 LYS 125 126 126 LYS LYS L . n A 1 126 SER 126 127 127 SER SER L . n A 1 127 GLY 127 128 128 GLY GLY L . n A 1 128 THR 128 129 129 THR THR L . n A 1 129 ALA 129 130 130 ALA ALA L . n A 1 130 SER 130 131 131 SER SER L . n A 1 131 VAL 131 132 132 VAL VAL L . n A 1 132 VAL 132 133 133 VAL VAL L . n A 1 133 CYS 133 134 134 CYS CYS L . n A 1 134 LEU 134 135 135 LEU LEU L . n A 1 135 LEU 135 136 136 LEU LEU L . n A 1 136 ASN 136 137 137 ASN ASN L . n A 1 137 ASN 137 138 138 ASN ASN L . n A 1 138 PHE 138 139 139 PHE PHE L . n A 1 139 TYR 139 140 140 TYR TYR L . n A 1 140 PRO 140 141 141 PRO PRO L . n A 1 141 ARG 141 142 142 ARG ARG L . n A 1 142 GLU 142 143 143 GLU GLU L . n A 1 143 ALA 143 144 144 ALA ALA L . n A 1 144 LYS 144 145 145 LYS LYS L . n A 1 145 VAL 145 146 146 VAL VAL L . n A 1 146 GLN 146 147 147 GLN GLN L . n A 1 147 TRP 147 148 148 TRP TRP L . n A 1 148 LYS 148 149 149 LYS LYS L . n A 1 149 VAL 149 150 150 VAL VAL L . n A 1 150 ASP 150 151 151 ASP ASP L . n A 1 151 ASN 151 152 152 ASN ASN L . n A 1 152 ALA 152 153 153 ALA ALA L . n A 1 153 LEU 153 154 154 LEU LEU L . n A 1 154 GLN 154 155 155 GLN GLN L . n A 1 155 SER 155 156 156 SER SER L . n A 1 156 GLY 156 157 157 GLY GLY L . n A 1 157 ASN 157 158 158 ASN ASN L . n A 1 158 SER 158 159 159 SER SER L . n A 1 159 GLN 159 160 160 GLN GLN L . n A 1 160 GLU 160 161 161 GLU GLU L . n A 1 161 SER 161 162 162 SER SER L . n A 1 162 VAL 162 163 163 VAL VAL L . n A 1 163 THR 163 164 164 THR THR L . n A 1 164 GLU 164 165 165 GLU GLU L . n A 1 165 GLN 165 166 166 GLN GLN L . n A 1 166 ASP 166 167 167 ASP ASP L . n A 1 167 SER 167 168 168 SER SER L . n A 1 168 LYS 168 169 169 LYS LYS L . n A 1 169 ASP 169 170 170 ASP ASP L . n A 1 170 SER 170 171 171 SER SER L . n A 1 171 THR 171 172 172 THR THR L . n A 1 172 TYR 172 173 173 TYR TYR L . n A 1 173 SER 173 174 174 SER SER L . n A 1 174 LEU 174 175 175 LEU LEU L . n A 1 175 SER 175 176 176 SER SER L . n A 1 176 SER 176 177 177 SER SER L . n A 1 177 THR 177 178 178 THR THR L . n A 1 178 LEU 178 179 179 LEU LEU L . n A 1 179 THR 179 180 180 THR THR L . n A 1 180 LEU 180 181 181 LEU LEU L . n A 1 181 SER 181 182 182 SER SER L . n A 1 182 LYS 182 183 183 LYS LYS L . n A 1 183 ALA 183 184 184 ALA ALA L . n A 1 184 ASP 184 185 185 ASP ASP L . n A 1 185 TYR 185 186 186 TYR TYR L . n A 1 186 GLU 186 187 187 GLU GLU L . n A 1 187 LYS 187 188 188 LYS LYS L . n A 1 188 HIS 188 189 189 HIS HIS L . n A 1 189 LYS 189 190 190 LYS LYS L . n A 1 190 VAL 190 191 191 VAL VAL L . n A 1 191 TYR 191 192 192 TYR TYR L . n A 1 192 ALA 192 193 193 ALA ALA L . n A 1 193 CYS 193 194 194 CYS CYS L . n A 1 194 GLU 194 195 195 GLU GLU L . n A 1 195 VAL 195 196 196 VAL VAL L . n A 1 196 THR 196 197 197 THR THR L . n A 1 197 HIS 197 198 198 HIS HIS L . n A 1 198 GLN 198 199 199 GLN GLN L . n A 1 199 GLY 199 200 200 GLY GLY L . n A 1 200 LEU 200 201 201 LEU LEU L . n A 1 201 SER 201 202 202 SER SER L . n A 1 202 SER 202 203 203 SER SER L . n A 1 203 PRO 203 204 204 PRO PRO L . n A 1 204 VAL 204 205 205 VAL VAL L . n A 1 205 THR 205 206 206 THR THR L . n A 1 206 LYS 206 207 207 LYS LYS L . n A 1 207 SER 207 208 208 SER SER L . n A 1 208 PHE 208 209 209 PHE PHE L . n A 1 209 ASN 209 210 210 ASN ASN L . n A 1 210 ARG 210 211 211 ARG ARG L . n B 2 1 GLN 1 1 1 GLN GLN H . n B 2 2 VAL 2 2 2 VAL VAL H . n B 2 3 GLN 3 3 3 GLN GLN H . n B 2 4 LEU 4 4 4 LEU LEU H . n B 2 5 GLN 5 5 5 GLN GLN H . n B 2 6 GLN 6 6 6 GLN GLN H . n B 2 7 TRP 7 7 7 TRP TRP H . n B 2 8 GLY 8 8 8 GLY GLY H . n B 2 9 ALA 9 9 9 ALA ALA H . n B 2 10 GLY 10 10 10 GLY GLY H . n B 2 11 LEU 11 11 11 LEU LEU H . n B 2 12 LEU 12 12 12 LEU LEU H . n B 2 13 LYS 13 13 13 LYS LYS H . n B 2 14 PRO 14 14 14 PRO PRO H . n B 2 15 SER 15 15 15 SER SER H . n B 2 16 GLU 16 16 16 GLU GLU H . n B 2 17 THR 17 17 17 THR THR H . n B 2 18 LEU 18 18 18 LEU LEU H . n B 2 19 SER 19 19 19 SER SER H . n B 2 20 LEU 20 20 20 LEU LEU H . n B 2 21 THR 21 21 21 THR THR H . n B 2 22 CYS 22 22 22 CYS CYS H . n B 2 23 GLY 23 23 23 GLY GLY H . n B 2 24 VAL 24 24 24 VAL VAL H . n B 2 25 TYR 25 25 25 TYR TYR H . n B 2 26 GLY 26 26 26 GLY GLY H . n B 2 27 GLU 27 27 27 GLU GLU H . n B 2 28 SER 28 28 28 SER SER H . n B 2 29 LEU 29 29 29 LEU LEU H . n B 2 30 SER 30 30 30 SER SER H . n B 2 31 GLY 31 31 31 GLY GLY H . n B 2 32 HIS 32 32 32 HIS HIS H . n B 2 33 TYR 33 33 33 TYR TYR H . n B 2 34 TRP 34 34 34 TRP TRP H . n B 2 35 SER 35 35 35 SER SER H . n B 2 36 TRP 36 36 36 TRP TRP H . n B 2 37 VAL 37 37 37 VAL VAL H . n B 2 38 ARG 38 38 38 ARG ARG H . n B 2 39 GLN 39 39 39 GLN GLN H . n B 2 40 PRO 40 40 40 PRO PRO H . n B 2 41 PRO 41 41 41 PRO PRO H . n B 2 42 GLY 42 42 42 GLY GLY H . n B 2 43 LYS 43 43 43 LYS LYS H . n B 2 44 ARG 44 44 44 ARG ARG H . n B 2 45 LEU 45 45 45 LEU LEU H . n B 2 46 GLU 46 46 46 GLU GLU H . n B 2 47 TRP 47 47 47 TRP TRP H . n B 2 48 ILE 48 48 48 ILE ILE H . n B 2 49 GLY 49 49 49 GLY GLY H . n B 2 50 GLU 50 50 50 GLU GLU H . n B 2 51 ILE 51 51 51 ILE ILE H . n B 2 52 LYS 52 52 52 LYS LYS H . n B 2 53 HIS 53 53 53 HIS HIS H . n B 2 54 ASN 54 54 54 ASN ASN H . n B 2 55 GLY 55 55 55 GLY GLY H . n B 2 56 SER 56 56 56 SER SER H . n B 2 57 PRO 57 57 57 PRO PRO H . n B 2 58 ASN 58 58 58 ASN ASN H . n B 2 59 TYR 59 59 59 TYR TYR H . n B 2 60 HIS 60 60 60 HIS HIS H . n B 2 61 PRO 61 61 61 PRO PRO H . n B 2 62 SER 62 62 62 SER SER H . n B 2 63 LEU 63 63 63 LEU LEU H . n B 2 64 LYS 64 64 64 LYS LYS H . n B 2 65 SER 65 65 65 SER SER H . n B 2 66 ARG 66 66 66 ARG ARG H . n B 2 67 VAL 67 67 67 VAL VAL H . n B 2 68 THR 68 68 68 THR THR H . n B 2 69 ILE 69 69 69 ILE ILE H . n B 2 70 SER 70 70 70 SER SER H . n B 2 71 LEU 71 71 71 LEU LEU H . n B 2 72 ASP 72 72 72 ASP ASP H . n B 2 73 MET 73 73 73 MET MET H . n B 2 74 SER 74 74 74 SER SER H . n B 2 75 LYS 75 75 75 LYS LYS H . n B 2 76 ASN 76 76 76 ASN ASN H . n B 2 77 GLN 77 77 77 GLN GLN H . n B 2 78 PHE 78 78 78 PHE PHE H . n B 2 79 SER 79 79 79 SER SER H . n B 2 80 LEU 80 80 80 LEU LEU H . n B 2 81 ASN 81 81 81 ASN ASN H . n B 2 82 LEU 82 82 82 LEU LEU H . n B 2 83 THR 83 82 82 THR THR H A n B 2 84 SER 84 82 82 SER SER H B n B 2 85 VAL 85 82 82 VAL VAL H C n B 2 86 THR 86 83 83 THR THR H . n B 2 87 ALA 87 84 84 ALA ALA H . n B 2 88 ALA 88 85 85 ALA ALA H . n B 2 89 ASP 89 86 86 ASP ASP H . n B 2 90 THR 90 87 87 THR THR H . n B 2 91 ALA 91 88 88 ALA ALA H . n B 2 92 VAL 92 89 89 VAL VAL H . n B 2 93 TYR 93 90 90 TYR TYR H . n B 2 94 PHE 94 91 91 PHE PHE H . n B 2 95 CYS 95 92 92 CYS CYS H . n B 2 96 ALA 96 93 93 ALA ALA H . n B 2 97 ARG 97 94 94 ARG ARG H . n B 2 98 ARG 98 95 95 ARG ARG H . n B 2 99 SER 99 96 96 SER SER H . n B 2 100 ASN 100 97 97 ASN ASN H . n B 2 101 TRP 101 98 98 TRP TRP H . n B 2 102 PRO 102 99 99 PRO PRO H . n B 2 103 TYR 103 100 100 TYR TYR H . n B 2 104 LEU 104 100 100 LEU LEU H A n B 2 105 PRO 105 100 100 PRO PRO H B n B 2 106 PHE 106 100 100 PHE PHE H C n B 2 107 ASP 107 101 101 ASP ASP H . n B 2 108 PRO 108 102 102 PRO PRO H . n B 2 109 TRP 109 103 103 TRP TRP H . n B 2 110 GLY 110 104 104 GLY GLY H . n B 2 111 GLN 111 105 105 GLN GLN H . n B 2 112 GLY 112 106 106 GLY GLY H . n B 2 113 THR 113 107 107 THR THR H . n B 2 114 LEU 114 108 108 LEU LEU H . n B 2 115 VAL 115 109 109 VAL VAL H . n B 2 116 THR 116 110 110 THR THR H . n B 2 117 VAL 117 111 111 VAL VAL H . n B 2 118 SER 118 112 112 SER SER H . n B 2 119 SER 119 113 113 SER SER H . n B 2 120 ALA 120 114 114 ALA ALA H . n B 2 121 SER 121 115 115 SER SER H . n B 2 122 THR 122 116 116 THR THR H . n B 2 123 LYS 123 117 117 LYS LYS H . n B 2 124 GLY 124 118 118 GLY GLY H . n B 2 125 PRO 125 119 119 PRO PRO H . n B 2 126 SER 126 120 120 SER SER H . n B 2 127 VAL 127 121 121 VAL VAL H . n B 2 128 PHE 128 122 122 PHE PHE H . n B 2 129 PRO 129 123 123 PRO PRO H . n B 2 130 LEU 130 124 124 LEU LEU H . n B 2 131 ALA 131 125 125 ALA ALA H . n B 2 132 PRO 132 126 126 PRO PRO H . n B 2 133 SER 133 127 127 SER SER H . n B 2 134 SER 134 128 128 SER SER H . n B 2 135 LYS 135 129 129 LYS LYS H . n B 2 136 SER 136 130 130 SER SER H . n B 2 137 THR 137 131 131 THR THR H . n B 2 138 SER 138 132 132 SER SER H . n B 2 139 GLY 139 133 133 GLY GLY H . n B 2 140 GLY 140 134 134 GLY GLY H . n B 2 141 THR 141 135 135 THR THR H . n B 2 142 ALA 142 136 136 ALA ALA H . n B 2 143 ALA 143 137 137 ALA ALA H . n B 2 144 LEU 144 138 138 LEU LEU H . n B 2 145 GLY 145 139 139 GLY GLY H . n B 2 146 CYS 146 140 140 CYS CYS H . n B 2 147 LEU 147 141 141 LEU LEU H . n B 2 148 VAL 148 142 142 VAL VAL H . n B 2 149 LYS 149 143 143 LYS LYS H . n B 2 150 ASP 150 144 144 ASP ASP H . n B 2 151 TYR 151 145 145 TYR TYR H . n B 2 152 PHE 152 146 146 PHE PHE H . n B 2 153 PRO 153 147 147 PRO PRO H . n B 2 154 GLU 154 148 148 GLU GLU H . n B 2 155 PRO 155 149 149 PRO PRO H . n B 2 156 VAL 156 150 150 VAL VAL H . n B 2 157 THR 157 151 151 THR THR H . n B 2 158 VAL 158 152 152 VAL VAL H . n B 2 159 SER 159 153 153 SER SER H . n B 2 160 TRP 160 154 154 TRP TRP H . n B 2 161 ASN 161 155 155 ASN ASN H . n B 2 162 SER 162 156 156 SER SER H . n B 2 163 GLY 163 157 157 GLY GLY H . n B 2 164 ALA 164 158 158 ALA ALA H . n B 2 165 LEU 165 159 159 LEU LEU H . n B 2 166 THR 166 160 160 THR THR H . n B 2 167 SER 167 161 161 SER SER H . n B 2 168 GLY 168 162 162 GLY GLY H . n B 2 169 VAL 169 163 163 VAL VAL H . n B 2 170 HIS 170 164 164 HIS HIS H . n B 2 171 THR 171 165 165 THR THR H . n B 2 172 PHE 172 166 166 PHE PHE H . n B 2 173 PRO 173 167 167 PRO PRO H . n B 2 174 ALA 174 168 168 ALA ALA H . n B 2 175 VAL 175 169 169 VAL VAL H . n B 2 176 LEU 176 170 170 LEU LEU H . n B 2 177 GLN 177 171 171 GLN GLN H . n B 2 178 SER 178 172 172 SER SER H . n B 2 179 SER 179 173 173 SER SER H . n B 2 180 GLY 180 174 174 GLY GLY H . n B 2 181 LEU 181 175 175 LEU LEU H . n B 2 182 TYR 182 176 176 TYR TYR H . n B 2 183 SER 183 177 177 SER SER H . n B 2 184 LEU 184 178 178 LEU LEU H . n B 2 185 SER 185 179 179 SER SER H . n B 2 186 SER 186 180 180 SER SER H . n B 2 187 VAL 187 181 181 VAL VAL H . n B 2 188 VAL 188 182 182 VAL VAL H . n B 2 189 THR 189 183 183 THR THR H . n B 2 190 VAL 190 184 184 VAL VAL H . n B 2 191 PRO 191 185 185 PRO PRO H . n B 2 192 SER 192 186 186 SER SER H . n B 2 193 SER 193 187 187 SER SER H . n B 2 194 SER 194 188 188 SER SER H . n B 2 195 LEU 195 189 189 LEU LEU H . n B 2 196 GLY 196 190 190 GLY GLY H . n B 2 197 THR 197 191 191 THR THR H . n B 2 198 GLN 198 192 192 GLN GLN H . n B 2 199 THR 199 193 193 THR THR H . n B 2 200 TYR 200 194 194 TYR TYR H . n B 2 201 ILE 201 195 195 ILE ILE H . n B 2 202 CYS 202 196 196 CYS CYS H . n B 2 203 ASN 203 197 197 ASN ASN H . n B 2 204 VAL 204 198 198 VAL VAL H . n B 2 205 ASN 205 199 199 ASN ASN H . n B 2 206 HIS 206 200 200 HIS HIS H . n B 2 207 LYS 207 201 201 LYS LYS H . n B 2 208 PRO 208 202 202 PRO PRO H . n B 2 209 SER 209 203 203 SER SER H . n B 2 210 ASN 210 204 204 ASN ASN H . n B 2 211 THR 211 205 205 THR THR H . n B 2 212 LYS 212 206 206 LYS LYS H . n B 2 213 VAL 213 207 207 VAL VAL H . n B 2 214 ASP 214 208 208 ASP ASP H . n B 2 215 LYS 215 209 209 LYS LYS H . n B 2 216 LYS 216 210 210 LYS LYS H . n B 2 217 VAL 217 211 211 VAL VAL H . n B 2 218 GLU 218 212 212 GLU GLU H . n B 2 219 PRO 219 213 213 PRO PRO H . n B 2 220 LYS 220 214 214 LYS LYS H . n C 1 1 ASP 1 1 1 ASP ASP A . n C 1 2 ILE 2 2 2 ILE ILE A . n C 1 3 GLN 3 3 3 GLN GLN A . n C 1 4 MET 4 4 4 MET MET A . n C 1 5 THR 5 5 5 THR THR A . n C 1 6 GLN 6 6 6 GLN GLN A . n C 1 7 SER 7 7 7 SER SER A . n C 1 8 PRO 8 8 8 PRO PRO A . n C 1 9 SER 9 9 9 SER SER A . n C 1 10 PHE 10 10 10 PHE PHE A . n C 1 11 VAL 11 11 11 VAL VAL A . n C 1 12 SER 12 12 12 SER SER A . n C 1 13 ALA 13 13 13 ALA ALA A . n C 1 14 SER 14 14 14 SER SER A . n C 1 15 VAL 15 15 15 VAL VAL A . n C 1 16 GLY 16 16 16 GLY GLY A . n C 1 17 ASP 17 17 17 ASP ASP A . n C 1 18 ARG 18 18 18 ARG ARG A . n C 1 19 VAL 19 19 19 VAL VAL A . n C 1 20 THR 20 20 20 THR THR A . n C 1 21 ILE 21 21 21 ILE ILE A . n C 1 22 THR 22 22 22 THR THR A . n C 1 23 CYS 23 23 23 CYS CYS A . n C 1 24 ARG 24 24 24 ARG ARG A . n C 1 25 ALA 25 25 25 ALA ALA A . n C 1 26 SER 26 26 26 SER SER A . n C 1 27 GLN 27 27 27 GLN GLN A . n C 1 28 GLY 28 28 28 GLY GLY A . n C 1 29 ILE 29 29 29 ILE ILE A . n C 1 30 SER 30 30 30 SER SER A . n C 1 31 SER 31 31 31 SER SER A . n C 1 32 TYR 32 32 32 TYR TYR A . n C 1 33 LEU 33 33 33 LEU LEU A . n C 1 34 ALA 34 34 34 ALA ALA A . n C 1 35 TRP 35 35 35 TRP TRP A . n C 1 36 TYR 36 36 36 TYR TYR A . n C 1 37 GLN 37 37 37 GLN GLN A . n C 1 38 GLN 38 38 38 GLN GLN A . n C 1 39 LYS 39 39 39 LYS LYS A . n C 1 40 PRO 40 40 40 PRO PRO A . n C 1 41 GLY 41 41 41 GLY GLY A . n C 1 42 LYS 42 42 42 LYS LYS A . n C 1 43 ALA 43 43 43 ALA ALA A . n C 1 44 PRO 44 44 44 PRO PRO A . n C 1 45 LYS 45 45 45 LYS LYS A . n C 1 46 LEU 46 46 46 LEU LEU A . n C 1 47 VAL 47 47 47 VAL VAL A . n C 1 48 ILE 48 48 48 ILE ILE A . n C 1 49 TYR 49 49 49 TYR TYR A . n C 1 50 ALA 50 50 50 ALA ALA A . n C 1 51 ALA 51 51 51 ALA ALA A . n C 1 52 SER 52 52 52 SER SER A . n C 1 53 THR 53 53 53 THR THR A . n C 1 54 LEU 54 54 54 LEU LEU A . n C 1 55 GLN 55 55 55 GLN GLN A . n C 1 56 SER 56 56 56 SER SER A . n C 1 57 GLY 57 57 57 GLY GLY A . n C 1 58 VAL 58 58 58 VAL VAL A . n C 1 59 PRO 59 59 59 PRO PRO A . n C 1 60 SER 60 60 60 SER SER A . n C 1 61 ARG 61 61 61 ARG ARG A . n C 1 62 PHE 62 62 62 PHE PHE A . n C 1 63 SER 63 63 63 SER SER A . n C 1 64 GLY 64 64 64 GLY GLY A . n C 1 65 SER 65 65 65 SER SER A . n C 1 66 GLY 66 66 66 GLY GLY A . n C 1 67 SER 67 67 67 SER SER A . n C 1 68 GLY 68 68 68 GLY GLY A . n C 1 69 THR 69 69 69 THR THR A . n C 1 70 GLU 70 70 70 GLU GLU A . n C 1 71 PHE 71 71 71 PHE PHE A . n C 1 72 THR 72 72 72 THR THR A . n C 1 73 LEU 73 73 73 LEU LEU A . n C 1 74 THR 74 74 74 THR THR A . n C 1 75 ILE 75 75 75 ILE ILE A . n C 1 76 SER 76 76 76 SER SER A . n C 1 77 SER 77 77 77 SER SER A . n C 1 78 LEU 78 78 78 LEU LEU A . n C 1 79 GLN 79 79 79 GLN GLN A . n C 1 80 PRO 80 80 80 PRO PRO A . n C 1 81 GLU 81 81 81 GLU GLU A . n C 1 82 ASP 82 82 82 ASP ASP A . n C 1 83 PHE 83 83 83 PHE PHE A . n C 1 84 ALA 84 84 84 ALA ALA A . n C 1 85 THR 85 85 85 THR THR A . n C 1 86 TYR 86 86 86 TYR TYR A . n C 1 87 TYR 87 87 87 TYR TYR A . n C 1 88 CYS 88 88 88 CYS CYS A . n C 1 89 GLN 89 89 89 GLN GLN A . n C 1 90 HIS 90 90 90 HIS HIS A . n C 1 91 LEU 91 91 91 LEU LEU A . n C 1 92 ILE 92 92 92 ILE ILE A . n C 1 93 GLY 93 93 93 GLY GLY A . n C 1 94 LEU 94 94 94 LEU LEU A . n C 1 95 ARG 95 96 96 ARG ARG A . n C 1 96 SER 96 97 97 SER SER A . n C 1 97 PHE 97 98 98 PHE PHE A . n C 1 98 GLY 98 99 99 GLY GLY A . n C 1 99 GLN 99 100 100 GLN GLN A . n C 1 100 GLY 100 101 101 GLY GLY A . n C 1 101 THR 101 102 102 THR THR A . n C 1 102 LYS 102 103 103 LYS LYS A . n C 1 103 LEU 103 104 104 LEU LEU A . n C 1 104 GLU 104 105 105 GLU GLU A . n C 1 105 ILE 105 106 106 ILE ILE A . n C 1 106 LYS 106 107 107 LYS LYS A . n C 1 107 ARG 107 108 108 ARG ARG A . n C 1 108 THR 108 109 109 THR THR A . n C 1 109 VAL 109 110 110 VAL VAL A . n C 1 110 ALA 110 111 111 ALA ALA A . n C 1 111 ALA 111 112 112 ALA ALA A . n C 1 112 PRO 112 113 113 PRO PRO A . n C 1 113 SER 113 114 114 SER SER A . n C 1 114 VAL 114 115 115 VAL VAL A . n C 1 115 PHE 115 116 116 PHE PHE A . n C 1 116 ILE 116 117 117 ILE ILE A . n C 1 117 PHE 117 118 118 PHE PHE A . n C 1 118 PRO 118 119 119 PRO PRO A . n C 1 119 PRO 119 120 120 PRO PRO A . n C 1 120 SER 120 121 121 SER SER A . n C 1 121 ASP 121 122 122 ASP ASP A . n C 1 122 GLU 122 123 123 GLU GLU A . n C 1 123 GLN 123 124 124 GLN GLN A . n C 1 124 LEU 124 125 125 LEU LEU A . n C 1 125 LYS 125 126 126 LYS LYS A . n C 1 126 SER 126 127 127 SER SER A . n C 1 127 GLY 127 128 128 GLY GLY A . n C 1 128 THR 128 129 129 THR THR A . n C 1 129 ALA 129 130 130 ALA ALA A . n C 1 130 SER 130 131 131 SER SER A . n C 1 131 VAL 131 132 132 VAL VAL A . n C 1 132 VAL 132 133 133 VAL VAL A . n C 1 133 CYS 133 134 134 CYS CYS A . n C 1 134 LEU 134 135 135 LEU LEU A . n C 1 135 LEU 135 136 136 LEU LEU A . n C 1 136 ASN 136 137 137 ASN ASN A . n C 1 137 ASN 137 138 138 ASN ASN A . n C 1 138 PHE 138 139 139 PHE PHE A . n C 1 139 TYR 139 140 140 TYR TYR A . n C 1 140 PRO 140 141 141 PRO PRO A . n C 1 141 ARG 141 142 142 ARG ARG A . n C 1 142 GLU 142 143 143 GLU GLU A . n C 1 143 ALA 143 144 144 ALA ALA A . n C 1 144 LYS 144 145 145 LYS LYS A . n C 1 145 VAL 145 146 146 VAL VAL A . n C 1 146 GLN 146 147 147 GLN GLN A . n C 1 147 TRP 147 148 148 TRP TRP A . n C 1 148 LYS 148 149 149 LYS LYS A . n C 1 149 VAL 149 150 150 VAL VAL A . n C 1 150 ASP 150 151 151 ASP ASP A . n C 1 151 ASN 151 152 152 ASN ASN A . n C 1 152 ALA 152 153 153 ALA ALA A . n C 1 153 LEU 153 154 154 LEU LEU A . n C 1 154 GLN 154 155 155 GLN GLN A . n C 1 155 SER 155 156 156 SER SER A . n C 1 156 GLY 156 157 157 GLY GLY A . n C 1 157 ASN 157 158 158 ASN ASN A . n C 1 158 SER 158 159 159 SER SER A . n C 1 159 GLN 159 160 160 GLN GLN A . n C 1 160 GLU 160 161 161 GLU GLU A . n C 1 161 SER 161 162 162 SER SER A . n C 1 162 VAL 162 163 163 VAL VAL A . n C 1 163 THR 163 164 164 THR THR A . n C 1 164 GLU 164 165 165 GLU GLU A . n C 1 165 GLN 165 166 166 GLN GLN A . n C 1 166 ASP 166 167 167 ASP ASP A . n C 1 167 SER 167 168 168 SER SER A . n C 1 168 LYS 168 169 169 LYS LYS A . n C 1 169 ASP 169 170 170 ASP ASP A . n C 1 170 SER 170 171 171 SER SER A . n C 1 171 THR 171 172 172 THR THR A . n C 1 172 TYR 172 173 173 TYR TYR A . n C 1 173 SER 173 174 174 SER SER A . n C 1 174 LEU 174 175 175 LEU LEU A . n C 1 175 SER 175 176 176 SER SER A . n C 1 176 SER 176 177 177 SER SER A . n C 1 177 THR 177 178 178 THR THR A . n C 1 178 LEU 178 179 179 LEU LEU A . n C 1 179 THR 179 180 180 THR THR A . n C 1 180 LEU 180 181 181 LEU LEU A . n C 1 181 SER 181 182 182 SER SER A . n C 1 182 LYS 182 183 183 LYS LYS A . n C 1 183 ALA 183 184 184 ALA ALA A . n C 1 184 ASP 184 185 185 ASP ASP A . n C 1 185 TYR 185 186 186 TYR TYR A . n C 1 186 GLU 186 187 187 GLU GLU A . n C 1 187 LYS 187 188 188 LYS LYS A . n C 1 188 HIS 188 189 189 HIS HIS A . n C 1 189 LYS 189 190 190 LYS LYS A . n C 1 190 VAL 190 191 191 VAL VAL A . n C 1 191 TYR 191 192 192 TYR TYR A . n C 1 192 ALA 192 193 193 ALA ALA A . n C 1 193 CYS 193 194 194 CYS CYS A . n C 1 194 GLU 194 195 195 GLU GLU A . n C 1 195 VAL 195 196 196 VAL VAL A . n C 1 196 THR 196 197 197 THR THR A . n C 1 197 HIS 197 198 198 HIS HIS A . n C 1 198 GLN 198 199 199 GLN GLN A . n C 1 199 GLY 199 200 200 GLY GLY A . n C 1 200 LEU 200 201 201 LEU LEU A . n C 1 201 SER 201 202 202 SER SER A . n C 1 202 SER 202 203 203 SER SER A . n C 1 203 PRO 203 204 204 PRO PRO A . n C 1 204 VAL 204 205 205 VAL VAL A . n C 1 205 THR 205 206 206 THR THR A . n C 1 206 LYS 206 207 207 LYS LYS A . n C 1 207 SER 207 208 208 SER SER A . n C 1 208 PHE 208 209 209 PHE PHE A . n C 1 209 ASN 209 210 210 ASN ASN A . n C 1 210 ARG 210 211 211 ARG ARG A . n D 2 1 GLN 1 1 1 GLN GLN B . n D 2 2 VAL 2 2 2 VAL VAL B . n D 2 3 GLN 3 3 3 GLN GLN B . n D 2 4 LEU 4 4 4 LEU LEU B . n D 2 5 GLN 5 5 5 GLN GLN B . n D 2 6 GLN 6 6 6 GLN GLN B . n D 2 7 TRP 7 7 7 TRP TRP B . n D 2 8 GLY 8 8 8 GLY GLY B . n D 2 9 ALA 9 9 9 ALA ALA B . n D 2 10 GLY 10 10 10 GLY GLY B . n D 2 11 LEU 11 11 11 LEU LEU B . n D 2 12 LEU 12 12 12 LEU LEU B . n D 2 13 LYS 13 13 13 LYS LYS B . n D 2 14 PRO 14 14 14 PRO PRO B . n D 2 15 SER 15 15 15 SER SER B . n D 2 16 GLU 16 16 16 GLU GLU B . n D 2 17 THR 17 17 17 THR THR B . n D 2 18 LEU 18 18 18 LEU LEU B . n D 2 19 SER 19 19 19 SER SER B . n D 2 20 LEU 20 20 20 LEU LEU B . n D 2 21 THR 21 21 21 THR THR B . n D 2 22 CYS 22 22 22 CYS CYS B . n D 2 23 GLY 23 23 23 GLY GLY B . n D 2 24 VAL 24 24 24 VAL VAL B . n D 2 25 TYR 25 25 25 TYR TYR B . n D 2 26 GLY 26 26 26 GLY GLY B . n D 2 27 GLU 27 27 27 GLU GLU B . n D 2 28 SER 28 28 28 SER SER B . n D 2 29 LEU 29 29 29 LEU LEU B . n D 2 30 SER 30 30 30 SER SER B . n D 2 31 GLY 31 31 31 GLY GLY B . n D 2 32 HIS 32 32 32 HIS HIS B . n D 2 33 TYR 33 33 33 TYR TYR B . n D 2 34 TRP 34 34 34 TRP TRP B . n D 2 35 SER 35 35 35 SER SER B . n D 2 36 TRP 36 36 36 TRP TRP B . n D 2 37 VAL 37 37 37 VAL VAL B . n D 2 38 ARG 38 38 38 ARG ARG B . n D 2 39 GLN 39 39 39 GLN GLN B . n D 2 40 PRO 40 40 40 PRO PRO B . n D 2 41 PRO 41 41 41 PRO PRO B . n D 2 42 GLY 42 42 42 GLY GLY B . n D 2 43 LYS 43 43 43 LYS LYS B . n D 2 44 ARG 44 44 44 ARG ARG B . n D 2 45 LEU 45 45 45 LEU LEU B . n D 2 46 GLU 46 46 46 GLU GLU B . n D 2 47 TRP 47 47 47 TRP TRP B . n D 2 48 ILE 48 48 48 ILE ILE B . n D 2 49 GLY 49 49 49 GLY GLY B . n D 2 50 GLU 50 50 50 GLU GLU B . n D 2 51 ILE 51 51 51 ILE ILE B . n D 2 52 LYS 52 52 52 LYS LYS B . n D 2 53 HIS 53 53 53 HIS HIS B . n D 2 54 ASN 54 54 54 ASN ASN B . n D 2 55 GLY 55 55 55 GLY GLY B . n D 2 56 SER 56 56 56 SER SER B . n D 2 57 PRO 57 57 57 PRO PRO B . n D 2 58 ASN 58 58 58 ASN ASN B . n D 2 59 TYR 59 59 59 TYR TYR B . n D 2 60 HIS 60 60 60 HIS HIS B . n D 2 61 PRO 61 61 61 PRO PRO B . n D 2 62 SER 62 62 62 SER SER B . n D 2 63 LEU 63 63 63 LEU LEU B . n D 2 64 LYS 64 64 64 LYS LYS B . n D 2 65 SER 65 65 65 SER SER B . n D 2 66 ARG 66 66 66 ARG ARG B . n D 2 67 VAL 67 67 67 VAL VAL B . n D 2 68 THR 68 68 68 THR THR B . n D 2 69 ILE 69 69 69 ILE ILE B . n D 2 70 SER 70 70 70 SER SER B . n D 2 71 LEU 71 71 71 LEU LEU B . n D 2 72 ASP 72 72 72 ASP ASP B . n D 2 73 MET 73 73 73 MET MET B . n D 2 74 SER 74 74 74 SER SER B . n D 2 75 LYS 75 75 75 LYS LYS B . n D 2 76 ASN 76 76 76 ASN ASN B . n D 2 77 GLN 77 77 77 GLN GLN B . n D 2 78 PHE 78 78 78 PHE PHE B . n D 2 79 SER 79 79 79 SER SER B . n D 2 80 LEU 80 80 80 LEU LEU B . n D 2 81 ASN 81 81 81 ASN ASN B . n D 2 82 LEU 82 82 82 LEU LEU B . n D 2 83 THR 83 82 82 THR THR B A n D 2 84 SER 84 82 82 SER SER B B n D 2 85 VAL 85 82 82 VAL VAL B C n D 2 86 THR 86 83 83 THR THR B . n D 2 87 ALA 87 84 84 ALA ALA B . n D 2 88 ALA 88 85 85 ALA ALA B . n D 2 89 ASP 89 86 86 ASP ASP B . n D 2 90 THR 90 87 87 THR THR B . n D 2 91 ALA 91 88 88 ALA ALA B . n D 2 92 VAL 92 89 89 VAL VAL B . n D 2 93 TYR 93 90 90 TYR TYR B . n D 2 94 PHE 94 91 91 PHE PHE B . n D 2 95 CYS 95 92 92 CYS CYS B . n D 2 96 ALA 96 93 93 ALA ALA B . n D 2 97 ARG 97 94 94 ARG ARG B . n D 2 98 ARG 98 95 95 ARG ARG B . n D 2 99 SER 99 96 96 SER SER B . n D 2 100 ASN 100 97 97 ASN ASN B . n D 2 101 TRP 101 98 98 TRP TRP B . n D 2 102 PRO 102 99 99 PRO PRO B . n D 2 103 TYR 103 100 100 TYR TYR B . n D 2 104 LEU 104 100 100 LEU LEU B A n D 2 105 PRO 105 100 100 PRO PRO B B n D 2 106 PHE 106 100 100 PHE PHE B C n D 2 107 ASP 107 101 101 ASP ASP B . n D 2 108 PRO 108 102 102 PRO PRO B . n D 2 109 TRP 109 103 103 TRP TRP B . n D 2 110 GLY 110 104 104 GLY GLY B . n D 2 111 GLN 111 105 105 GLN GLN B . n D 2 112 GLY 112 106 106 GLY GLY B . n D 2 113 THR 113 107 107 THR THR B . n D 2 114 LEU 114 108 108 LEU LEU B . n D 2 115 VAL 115 109 109 VAL VAL B . n D 2 116 THR 116 110 110 THR THR B . n D 2 117 VAL 117 111 111 VAL VAL B . n D 2 118 SER 118 112 112 SER SER B . n D 2 119 SER 119 113 113 SER SER B . n D 2 120 ALA 120 114 114 ALA ALA B . n D 2 121 SER 121 115 115 SER SER B . n D 2 122 THR 122 116 116 THR THR B . n D 2 123 LYS 123 117 117 LYS LYS B . n D 2 124 GLY 124 118 118 GLY GLY B . n D 2 125 PRO 125 119 119 PRO PRO B . n D 2 126 SER 126 120 120 SER SER B . n D 2 127 VAL 127 121 121 VAL VAL B . n D 2 128 PHE 128 122 122 PHE PHE B . n D 2 129 PRO 129 123 123 PRO PRO B . n D 2 130 LEU 130 124 124 LEU LEU B . n D 2 131 ALA 131 125 125 ALA ALA B . n D 2 132 PRO 132 126 126 PRO PRO B . n D 2 133 SER 133 127 127 SER SER B . n D 2 134 SER 134 128 128 SER SER B . n D 2 135 LYS 135 129 129 LYS LYS B . n D 2 136 SER 136 130 130 SER SER B . n D 2 137 THR 137 131 131 THR THR B . n D 2 138 SER 138 132 132 SER SER B . n D 2 139 GLY 139 133 133 GLY GLY B . n D 2 140 GLY 140 134 134 GLY GLY B . n D 2 141 THR 141 135 135 THR THR B . n D 2 142 ALA 142 136 136 ALA ALA B . n D 2 143 ALA 143 137 137 ALA ALA B . n D 2 144 LEU 144 138 138 LEU LEU B . n D 2 145 GLY 145 139 139 GLY GLY B . n D 2 146 CYS 146 140 140 CYS CYS B . n D 2 147 LEU 147 141 141 LEU LEU B . n D 2 148 VAL 148 142 142 VAL VAL B . n D 2 149 LYS 149 143 143 LYS LYS B . n D 2 150 ASP 150 144 144 ASP ASP B . n D 2 151 TYR 151 145 145 TYR TYR B . n D 2 152 PHE 152 146 146 PHE PHE B . n D 2 153 PRO 153 147 147 PRO PRO B . n D 2 154 GLU 154 148 148 GLU GLU B . n D 2 155 PRO 155 149 149 PRO PRO B . n D 2 156 VAL 156 150 150 VAL VAL B . n D 2 157 THR 157 151 151 THR THR B . n D 2 158 VAL 158 152 152 VAL VAL B . n D 2 159 SER 159 153 153 SER SER B . n D 2 160 TRP 160 154 154 TRP TRP B . n D 2 161 ASN 161 155 155 ASN ASN B . n D 2 162 SER 162 156 156 SER SER B . n D 2 163 GLY 163 157 157 GLY GLY B . n D 2 164 ALA 164 158 158 ALA ALA B . n D 2 165 LEU 165 159 159 LEU LEU B . n D 2 166 THR 166 160 160 THR THR B . n D 2 167 SER 167 161 161 SER SER B . n D 2 168 GLY 168 162 162 GLY GLY B . n D 2 169 VAL 169 163 163 VAL VAL B . n D 2 170 HIS 170 164 164 HIS HIS B . n D 2 171 THR 171 165 165 THR THR B . n D 2 172 PHE 172 166 166 PHE PHE B . n D 2 173 PRO 173 167 167 PRO PRO B . n D 2 174 ALA 174 168 168 ALA ALA B . n D 2 175 VAL 175 169 169 VAL VAL B . n D 2 176 LEU 176 170 170 LEU LEU B . n D 2 177 GLN 177 171 171 GLN GLN B . n D 2 178 SER 178 172 172 SER SER B . n D 2 179 SER 179 173 173 SER SER B . n D 2 180 GLY 180 174 174 GLY GLY B . n D 2 181 LEU 181 175 175 LEU LEU B . n D 2 182 TYR 182 176 176 TYR TYR B . n D 2 183 SER 183 177 177 SER SER B . n D 2 184 LEU 184 178 178 LEU LEU B . n D 2 185 SER 185 179 179 SER SER B . n D 2 186 SER 186 180 180 SER SER B . n D 2 187 VAL 187 181 181 VAL VAL B . n D 2 188 VAL 188 182 182 VAL VAL B . n D 2 189 THR 189 183 183 THR THR B . n D 2 190 VAL 190 184 184 VAL VAL B . n D 2 191 PRO 191 185 185 PRO PRO B . n D 2 192 SER 192 186 186 SER SER B . n D 2 193 SER 193 187 187 SER SER B . n D 2 194 SER 194 188 188 SER SER B . n D 2 195 LEU 195 189 189 LEU LEU B . n D 2 196 GLY 196 190 190 GLY GLY B . n D 2 197 THR 197 191 191 THR THR B . n D 2 198 GLN 198 192 192 GLN GLN B . n D 2 199 THR 199 193 193 THR THR B . n D 2 200 TYR 200 194 194 TYR TYR B . n D 2 201 ILE 201 195 195 ILE ILE B . n D 2 202 CYS 202 196 196 CYS CYS B . n D 2 203 ASN 203 197 197 ASN ASN B . n D 2 204 VAL 204 198 198 VAL VAL B . n D 2 205 ASN 205 199 199 ASN ASN B . n D 2 206 HIS 206 200 200 HIS HIS B . n D 2 207 LYS 207 201 201 LYS LYS B . n D 2 208 PRO 208 202 202 PRO PRO B . n D 2 209 SER 209 203 203 SER SER B . n D 2 210 ASN 210 204 204 ASN ASN B . n D 2 211 THR 211 205 205 THR THR B . n D 2 212 LYS 212 206 206 LYS LYS B . n D 2 213 VAL 213 207 207 VAL VAL B . n D 2 214 ASP 214 208 208 ASP ASP B . n D 2 215 LYS 215 209 209 LYS LYS B . n D 2 216 LYS 216 210 210 LYS LYS B . n D 2 217 VAL 217 211 211 VAL VAL B . n D 2 218 GLU 218 212 212 GLU GLU B . n D 2 219 PRO 219 213 213 PRO PRO B . n D 2 220 LYS 220 214 214 LYS LYS B . n E 1 1 ASP 1 1 1 ASP ASP C . n E 1 2 ILE 2 2 2 ILE ILE C . n E 1 3 GLN 3 3 3 GLN GLN C . n E 1 4 MET 4 4 4 MET MET C . n E 1 5 THR 5 5 5 THR THR C . n E 1 6 GLN 6 6 6 GLN GLN C . n E 1 7 SER 7 7 7 SER SER C . n E 1 8 PRO 8 8 8 PRO PRO C . n E 1 9 SER 9 9 9 SER SER C . n E 1 10 PHE 10 10 10 PHE PHE C . n E 1 11 VAL 11 11 11 VAL VAL C . n E 1 12 SER 12 12 12 SER SER C . n E 1 13 ALA 13 13 13 ALA ALA C . n E 1 14 SER 14 14 14 SER SER C . n E 1 15 VAL 15 15 15 VAL VAL C . n E 1 16 GLY 16 16 16 GLY GLY C . n E 1 17 ASP 17 17 17 ASP ASP C . n E 1 18 ARG 18 18 18 ARG ARG C . n E 1 19 VAL 19 19 19 VAL VAL C . n E 1 20 THR 20 20 20 THR THR C . n E 1 21 ILE 21 21 21 ILE ILE C . n E 1 22 THR 22 22 22 THR THR C . n E 1 23 CYS 23 23 23 CYS CYS C . n E 1 24 ARG 24 24 24 ARG ARG C . n E 1 25 ALA 25 25 25 ALA ALA C . n E 1 26 SER 26 26 26 SER SER C . n E 1 27 GLN 27 27 27 GLN GLN C . n E 1 28 GLY 28 28 28 GLY GLY C . n E 1 29 ILE 29 29 29 ILE ILE C . n E 1 30 SER 30 30 30 SER SER C . n E 1 31 SER 31 31 31 SER SER C . n E 1 32 TYR 32 32 32 TYR TYR C . n E 1 33 LEU 33 33 33 LEU LEU C . n E 1 34 ALA 34 34 34 ALA ALA C . n E 1 35 TRP 35 35 35 TRP TRP C . n E 1 36 TYR 36 36 36 TYR TYR C . n E 1 37 GLN 37 37 37 GLN GLN C . n E 1 38 GLN 38 38 38 GLN GLN C . n E 1 39 LYS 39 39 39 LYS LYS C . n E 1 40 PRO 40 40 40 PRO PRO C . n E 1 41 GLY 41 41 41 GLY GLY C . n E 1 42 LYS 42 42 42 LYS LYS C . n E 1 43 ALA 43 43 43 ALA ALA C . n E 1 44 PRO 44 44 44 PRO PRO C . n E 1 45 LYS 45 45 45 LYS LYS C . n E 1 46 LEU 46 46 46 LEU LEU C . n E 1 47 VAL 47 47 47 VAL VAL C . n E 1 48 ILE 48 48 48 ILE ILE C . n E 1 49 TYR 49 49 49 TYR TYR C . n E 1 50 ALA 50 50 50 ALA ALA C . n E 1 51 ALA 51 51 51 ALA ALA C . n E 1 52 SER 52 52 52 SER SER C . n E 1 53 THR 53 53 53 THR THR C . n E 1 54 LEU 54 54 54 LEU LEU C . n E 1 55 GLN 55 55 ? ? ? C . n E 1 56 SER 56 56 ? ? ? C . n E 1 57 GLY 57 57 ? ? ? C . n E 1 58 VAL 58 58 ? ? ? C . n E 1 59 PRO 59 59 ? ? ? C . n E 1 60 SER 60 60 ? ? ? C . n E 1 61 ARG 61 61 61 ARG ARG C . n E 1 62 PHE 62 62 62 PHE PHE C . n E 1 63 SER 63 63 63 SER SER C . n E 1 64 GLY 64 64 64 GLY GLY C . n E 1 65 SER 65 65 65 SER SER C . n E 1 66 GLY 66 66 66 GLY GLY C . n E 1 67 SER 67 67 67 SER SER C . n E 1 68 GLY 68 68 68 GLY GLY C . n E 1 69 THR 69 69 69 THR THR C . n E 1 70 GLU 70 70 70 GLU GLU C . n E 1 71 PHE 71 71 71 PHE PHE C . n E 1 72 THR 72 72 72 THR THR C . n E 1 73 LEU 73 73 73 LEU LEU C . n E 1 74 THR 74 74 74 THR THR C . n E 1 75 ILE 75 75 75 ILE ILE C . n E 1 76 SER 76 76 76 SER SER C . n E 1 77 SER 77 77 77 SER SER C . n E 1 78 LEU 78 78 78 LEU LEU C . n E 1 79 GLN 79 79 79 GLN GLN C . n E 1 80 PRO 80 80 80 PRO PRO C . n E 1 81 GLU 81 81 81 GLU GLU C . n E 1 82 ASP 82 82 82 ASP ASP C . n E 1 83 PHE 83 83 83 PHE PHE C . n E 1 84 ALA 84 84 84 ALA ALA C . n E 1 85 THR 85 85 85 THR THR C . n E 1 86 TYR 86 86 86 TYR TYR C . n E 1 87 TYR 87 87 87 TYR TYR C . n E 1 88 CYS 88 88 88 CYS CYS C . n E 1 89 GLN 89 89 89 GLN GLN C . n E 1 90 HIS 90 90 90 HIS HIS C . n E 1 91 LEU 91 91 91 LEU LEU C . n E 1 92 ILE 92 92 92 ILE ILE C . n E 1 93 GLY 93 93 93 GLY GLY C . n E 1 94 LEU 94 94 94 LEU LEU C . n E 1 95 ARG 95 96 96 ARG ARG C . n E 1 96 SER 96 97 97 SER SER C . n E 1 97 PHE 97 98 98 PHE PHE C . n E 1 98 GLY 98 99 99 GLY GLY C . n E 1 99 GLN 99 100 100 GLN GLN C . n E 1 100 GLY 100 101 101 GLY GLY C . n E 1 101 THR 101 102 102 THR THR C . n E 1 102 LYS 102 103 103 LYS LYS C . n E 1 103 LEU 103 104 104 LEU LEU C . n E 1 104 GLU 104 105 105 GLU GLU C . n E 1 105 ILE 105 106 106 ILE ILE C . n E 1 106 LYS 106 107 107 LYS LYS C . n E 1 107 ARG 107 108 108 ARG ARG C . n E 1 108 THR 108 109 109 THR THR C . n E 1 109 VAL 109 110 110 VAL VAL C . n E 1 110 ALA 110 111 111 ALA ALA C . n E 1 111 ALA 111 112 112 ALA ALA C . n E 1 112 PRO 112 113 113 PRO PRO C . n E 1 113 SER 113 114 114 SER SER C . n E 1 114 VAL 114 115 115 VAL VAL C . n E 1 115 PHE 115 116 116 PHE PHE C . n E 1 116 ILE 116 117 117 ILE ILE C . n E 1 117 PHE 117 118 118 PHE PHE C . n E 1 118 PRO 118 119 119 PRO PRO C . n E 1 119 PRO 119 120 120 PRO PRO C . n E 1 120 SER 120 121 121 SER SER C . n E 1 121 ASP 121 122 122 ASP ASP C . n E 1 122 GLU 122 123 123 GLU GLU C . n E 1 123 GLN 123 124 124 GLN GLN C . n E 1 124 LEU 124 125 125 LEU LEU C . n E 1 125 LYS 125 126 126 LYS LYS C . n E 1 126 SER 126 127 127 SER SER C . n E 1 127 GLY 127 128 128 GLY GLY C . n E 1 128 THR 128 129 129 THR THR C . n E 1 129 ALA 129 130 130 ALA ALA C . n E 1 130 SER 130 131 131 SER SER C . n E 1 131 VAL 131 132 132 VAL VAL C . n E 1 132 VAL 132 133 133 VAL VAL C . n E 1 133 CYS 133 134 134 CYS CYS C . n E 1 134 LEU 134 135 135 LEU LEU C . n E 1 135 LEU 135 136 136 LEU LEU C . n E 1 136 ASN 136 137 137 ASN ASN C . n E 1 137 ASN 137 138 138 ASN ASN C . n E 1 138 PHE 138 139 139 PHE PHE C . n E 1 139 TYR 139 140 140 TYR TYR C . n E 1 140 PRO 140 141 141 PRO PRO C . n E 1 141 ARG 141 142 142 ARG ARG C . n E 1 142 GLU 142 143 143 GLU GLU C . n E 1 143 ALA 143 144 144 ALA ALA C . n E 1 144 LYS 144 145 145 LYS LYS C . n E 1 145 VAL 145 146 146 VAL VAL C . n E 1 146 GLN 146 147 147 GLN GLN C . n E 1 147 TRP 147 148 148 TRP TRP C . n E 1 148 LYS 148 149 149 LYS LYS C . n E 1 149 VAL 149 150 150 VAL VAL C . n E 1 150 ASP 150 151 151 ASP ASP C . n E 1 151 ASN 151 152 152 ASN ASN C . n E 1 152 ALA 152 153 153 ALA ALA C . n E 1 153 LEU 153 154 154 LEU LEU C . n E 1 154 GLN 154 155 155 GLN GLN C . n E 1 155 SER 155 156 156 SER SER C . n E 1 156 GLY 156 157 157 GLY GLY C . n E 1 157 ASN 157 158 158 ASN ASN C . n E 1 158 SER 158 159 159 SER SER C . n E 1 159 GLN 159 160 160 GLN GLN C . n E 1 160 GLU 160 161 161 GLU GLU C . n E 1 161 SER 161 162 162 SER SER C . n E 1 162 VAL 162 163 163 VAL VAL C . n E 1 163 THR 163 164 164 THR THR C . n E 1 164 GLU 164 165 165 GLU GLU C . n E 1 165 GLN 165 166 166 GLN GLN C . n E 1 166 ASP 166 167 167 ASP ASP C . n E 1 167 SER 167 168 168 SER SER C . n E 1 168 LYS 168 169 169 LYS LYS C . n E 1 169 ASP 169 170 170 ASP ASP C . n E 1 170 SER 170 171 171 SER SER C . n E 1 171 THR 171 172 172 THR THR C . n E 1 172 TYR 172 173 173 TYR TYR C . n E 1 173 SER 173 174 174 SER SER C . n E 1 174 LEU 174 175 175 LEU LEU C . n E 1 175 SER 175 176 176 SER SER C . n E 1 176 SER 176 177 177 SER SER C . n E 1 177 THR 177 178 178 THR THR C . n E 1 178 LEU 178 179 179 LEU LEU C . n E 1 179 THR 179 180 180 THR THR C . n E 1 180 LEU 180 181 181 LEU LEU C . n E 1 181 SER 181 182 182 SER SER C . n E 1 182 LYS 182 183 183 LYS LYS C . n E 1 183 ALA 183 184 184 ALA ALA C . n E 1 184 ASP 184 185 185 ASP ASP C . n E 1 185 TYR 185 186 186 TYR TYR C . n E 1 186 GLU 186 187 187 GLU GLU C . n E 1 187 LYS 187 188 188 LYS LYS C . n E 1 188 HIS 188 189 189 HIS HIS C . n E 1 189 LYS 189 190 190 LYS LYS C . n E 1 190 VAL 190 191 191 VAL VAL C . n E 1 191 TYR 191 192 192 TYR TYR C . n E 1 192 ALA 192 193 193 ALA ALA C . n E 1 193 CYS 193 194 194 CYS CYS C . n E 1 194 GLU 194 195 195 GLU GLU C . n E 1 195 VAL 195 196 196 VAL VAL C . n E 1 196 THR 196 197 197 THR THR C . n E 1 197 HIS 197 198 198 HIS HIS C . n E 1 198 GLN 198 199 199 GLN GLN C . n E 1 199 GLY 199 200 200 GLY GLY C . n E 1 200 LEU 200 201 201 LEU LEU C . n E 1 201 SER 201 202 202 SER SER C . n E 1 202 SER 202 203 203 SER SER C . n E 1 203 PRO 203 204 204 PRO PRO C . n E 1 204 VAL 204 205 205 VAL VAL C . n E 1 205 THR 205 206 206 THR THR C . n E 1 206 LYS 206 207 207 LYS LYS C . n E 1 207 SER 207 208 208 SER SER C . n E 1 208 PHE 208 209 209 PHE PHE C . n E 1 209 ASN 209 210 210 ASN ASN C . n E 1 210 ARG 210 211 211 ARG ARG C . n F 2 1 GLN 1 1 1 GLN GLN D . n F 2 2 VAL 2 2 2 VAL VAL D . n F 2 3 GLN 3 3 3 GLN GLN D . n F 2 4 LEU 4 4 4 LEU LEU D . n F 2 5 GLN 5 5 5 GLN GLN D . n F 2 6 GLN 6 6 6 GLN GLN D . n F 2 7 TRP 7 7 7 TRP TRP D . n F 2 8 GLY 8 8 8 GLY GLY D . n F 2 9 ALA 9 9 9 ALA ALA D . n F 2 10 GLY 10 10 10 GLY GLY D . n F 2 11 LEU 11 11 11 LEU LEU D . n F 2 12 LEU 12 12 12 LEU LEU D . n F 2 13 LYS 13 13 13 LYS LYS D . n F 2 14 PRO 14 14 14 PRO PRO D . n F 2 15 SER 15 15 15 SER SER D . n F 2 16 GLU 16 16 16 GLU GLU D . n F 2 17 THR 17 17 17 THR THR D . n F 2 18 LEU 18 18 18 LEU LEU D . n F 2 19 SER 19 19 19 SER SER D . n F 2 20 LEU 20 20 20 LEU LEU D . n F 2 21 THR 21 21 21 THR THR D . n F 2 22 CYS 22 22 22 CYS CYS D . n F 2 23 GLY 23 23 23 GLY GLY D . n F 2 24 VAL 24 24 24 VAL VAL D . n F 2 25 TYR 25 25 25 TYR TYR D . n F 2 26 GLY 26 26 26 GLY GLY D . n F 2 27 GLU 27 27 27 GLU GLU D . n F 2 28 SER 28 28 28 SER SER D . n F 2 29 LEU 29 29 29 LEU LEU D . n F 2 30 SER 30 30 30 SER SER D . n F 2 31 GLY 31 31 31 GLY GLY D . n F 2 32 HIS 32 32 32 HIS HIS D . n F 2 33 TYR 33 33 33 TYR TYR D . n F 2 34 TRP 34 34 34 TRP TRP D . n F 2 35 SER 35 35 35 SER SER D . n F 2 36 TRP 36 36 36 TRP TRP D . n F 2 37 VAL 37 37 37 VAL VAL D . n F 2 38 ARG 38 38 38 ARG ARG D . n F 2 39 GLN 39 39 39 GLN GLN D . n F 2 40 PRO 40 40 40 PRO PRO D . n F 2 41 PRO 41 41 41 PRO PRO D . n F 2 42 GLY 42 42 42 GLY GLY D . n F 2 43 LYS 43 43 43 LYS LYS D . n F 2 44 ARG 44 44 44 ARG ARG D . n F 2 45 LEU 45 45 45 LEU LEU D . n F 2 46 GLU 46 46 46 GLU GLU D . n F 2 47 TRP 47 47 47 TRP TRP D . n F 2 48 ILE 48 48 48 ILE ILE D . n F 2 49 GLY 49 49 49 GLY GLY D . n F 2 50 GLU 50 50 50 GLU GLU D . n F 2 51 ILE 51 51 51 ILE ILE D . n F 2 52 LYS 52 52 52 LYS LYS D . n F 2 53 HIS 53 53 53 HIS HIS D . n F 2 54 ASN 54 54 54 ASN ASN D . n F 2 55 GLY 55 55 55 GLY GLY D . n F 2 56 SER 56 56 56 SER SER D . n F 2 57 PRO 57 57 57 PRO PRO D . n F 2 58 ASN 58 58 58 ASN ASN D . n F 2 59 TYR 59 59 59 TYR TYR D . n F 2 60 HIS 60 60 60 HIS HIS D . n F 2 61 PRO 61 61 61 PRO PRO D . n F 2 62 SER 62 62 62 SER SER D . n F 2 63 LEU 63 63 63 LEU LEU D . n F 2 64 LYS 64 64 64 LYS LYS D . n F 2 65 SER 65 65 65 SER SER D . n F 2 66 ARG 66 66 66 ARG ARG D . n F 2 67 VAL 67 67 67 VAL VAL D . n F 2 68 THR 68 68 68 THR THR D . n F 2 69 ILE 69 69 69 ILE ILE D . n F 2 70 SER 70 70 70 SER SER D . n F 2 71 LEU 71 71 71 LEU LEU D . n F 2 72 ASP 72 72 72 ASP ASP D . n F 2 73 MET 73 73 73 MET MET D . n F 2 74 SER 74 74 74 SER SER D . n F 2 75 LYS 75 75 75 LYS LYS D . n F 2 76 ASN 76 76 76 ASN ASN D . n F 2 77 GLN 77 77 77 GLN GLN D . n F 2 78 PHE 78 78 78 PHE PHE D . n F 2 79 SER 79 79 79 SER SER D . n F 2 80 LEU 80 80 80 LEU LEU D . n F 2 81 ASN 81 81 81 ASN ASN D . n F 2 82 LEU 82 82 82 LEU LEU D . n F 2 83 THR 83 82 82 THR THR D A n F 2 84 SER 84 82 82 SER SER D B n F 2 85 VAL 85 82 82 VAL VAL D C n F 2 86 THR 86 83 83 THR THR D . n F 2 87 ALA 87 84 84 ALA ALA D . n F 2 88 ALA 88 85 85 ALA ALA D . n F 2 89 ASP 89 86 86 ASP ASP D . n F 2 90 THR 90 87 87 THR THR D . n F 2 91 ALA 91 88 88 ALA ALA D . n F 2 92 VAL 92 89 89 VAL VAL D . n F 2 93 TYR 93 90 90 TYR TYR D . n F 2 94 PHE 94 91 91 PHE PHE D . n F 2 95 CYS 95 92 92 CYS CYS D . n F 2 96 ALA 96 93 93 ALA ALA D . n F 2 97 ARG 97 94 94 ARG ARG D . n F 2 98 ARG 98 95 95 ARG ARG D . n F 2 99 SER 99 96 96 SER SER D . n F 2 100 ASN 100 97 97 ASN ASN D . n F 2 101 TRP 101 98 98 TRP TRP D . n F 2 102 PRO 102 99 99 PRO PRO D . n F 2 103 TYR 103 100 100 TYR TYR D . n F 2 104 LEU 104 100 100 LEU LEU D A n F 2 105 PRO 105 100 100 PRO PRO D B n F 2 106 PHE 106 100 100 PHE PHE D C n F 2 107 ASP 107 101 101 ASP ASP D . n F 2 108 PRO 108 102 102 PRO PRO D . n F 2 109 TRP 109 103 103 TRP TRP D . n F 2 110 GLY 110 104 104 GLY GLY D . n F 2 111 GLN 111 105 105 GLN GLN D . n F 2 112 GLY 112 106 106 GLY GLY D . n F 2 113 THR 113 107 107 THR THR D . n F 2 114 LEU 114 108 108 LEU LEU D . n F 2 115 VAL 115 109 109 VAL VAL D . n F 2 116 THR 116 110 110 THR THR D . n F 2 117 VAL 117 111 111 VAL VAL D . n F 2 118 SER 118 112 112 SER SER D . n F 2 119 SER 119 113 113 SER SER D . n F 2 120 ALA 120 114 114 ALA ALA D . n F 2 121 SER 121 115 115 SER SER D . n F 2 122 THR 122 116 116 THR THR D . n F 2 123 LYS 123 117 117 LYS LYS D . n F 2 124 GLY 124 118 118 GLY GLY D . n F 2 125 PRO 125 119 119 PRO PRO D . n F 2 126 SER 126 120 120 SER SER D . n F 2 127 VAL 127 121 121 VAL VAL D . n F 2 128 PHE 128 122 122 PHE PHE D . n F 2 129 PRO 129 123 123 PRO PRO D . n F 2 130 LEU 130 124 124 LEU LEU D . n F 2 131 ALA 131 125 125 ALA ALA D . n F 2 132 PRO 132 126 126 PRO PRO D . n F 2 133 SER 133 127 127 SER SER D . n F 2 134 SER 134 128 128 SER SER D . n F 2 135 LYS 135 129 129 LYS LYS D . n F 2 136 SER 136 130 130 SER SER D . n F 2 137 THR 137 131 131 THR THR D . n F 2 138 SER 138 132 132 SER SER D . n F 2 139 GLY 139 133 133 GLY GLY D . n F 2 140 GLY 140 134 134 GLY GLY D . n F 2 141 THR 141 135 135 THR THR D . n F 2 142 ALA 142 136 136 ALA ALA D . n F 2 143 ALA 143 137 137 ALA ALA D . n F 2 144 LEU 144 138 138 LEU LEU D . n F 2 145 GLY 145 139 139 GLY GLY D . n F 2 146 CYS 146 140 140 CYS CYS D . n F 2 147 LEU 147 141 141 LEU LEU D . n F 2 148 VAL 148 142 142 VAL VAL D . n F 2 149 LYS 149 143 143 LYS LYS D . n F 2 150 ASP 150 144 144 ASP ASP D . n F 2 151 TYR 151 145 145 TYR TYR D . n F 2 152 PHE 152 146 146 PHE PHE D . n F 2 153 PRO 153 147 147 PRO PRO D . n F 2 154 GLU 154 148 148 GLU GLU D . n F 2 155 PRO 155 149 149 PRO PRO D . n F 2 156 VAL 156 150 150 VAL VAL D . n F 2 157 THR 157 151 151 THR THR D . n F 2 158 VAL 158 152 152 VAL VAL D . n F 2 159 SER 159 153 153 SER SER D . n F 2 160 TRP 160 154 154 TRP TRP D . n F 2 161 ASN 161 155 155 ASN ASN D . n F 2 162 SER 162 156 156 SER SER D . n F 2 163 GLY 163 157 157 GLY GLY D . n F 2 164 ALA 164 158 158 ALA ALA D . n F 2 165 LEU 165 159 159 LEU LEU D . n F 2 166 THR 166 160 160 THR THR D . n F 2 167 SER 167 161 161 SER SER D . n F 2 168 GLY 168 162 162 GLY GLY D . n F 2 169 VAL 169 163 163 VAL VAL D . n F 2 170 HIS 170 164 164 HIS HIS D . n F 2 171 THR 171 165 165 THR THR D . n F 2 172 PHE 172 166 166 PHE PHE D . n F 2 173 PRO 173 167 167 PRO PRO D . n F 2 174 ALA 174 168 168 ALA ALA D . n F 2 175 VAL 175 169 169 VAL VAL D . n F 2 176 LEU 176 170 170 LEU LEU D . n F 2 177 GLN 177 171 171 GLN GLN D . n F 2 178 SER 178 172 172 SER SER D . n F 2 179 SER 179 173 173 SER SER D . n F 2 180 GLY 180 174 174 GLY GLY D . n F 2 181 LEU 181 175 175 LEU LEU D . n F 2 182 TYR 182 176 176 TYR TYR D . n F 2 183 SER 183 177 177 SER SER D . n F 2 184 LEU 184 178 178 LEU LEU D . n F 2 185 SER 185 179 179 SER SER D . n F 2 186 SER 186 180 180 SER SER D . n F 2 187 VAL 187 181 181 VAL VAL D . n F 2 188 VAL 188 182 182 VAL VAL D . n F 2 189 THR 189 183 183 THR THR D . n F 2 190 VAL 190 184 184 VAL VAL D . n F 2 191 PRO 191 185 185 PRO PRO D . n F 2 192 SER 192 186 186 SER SER D . n F 2 193 SER 193 187 187 SER SER D . n F 2 194 SER 194 188 188 SER SER D . n F 2 195 LEU 195 189 189 LEU LEU D . n F 2 196 GLY 196 190 190 GLY GLY D . n F 2 197 THR 197 191 191 THR THR D . n F 2 198 GLN 198 192 192 GLN GLN D . n F 2 199 THR 199 193 193 THR THR D . n F 2 200 TYR 200 194 194 TYR TYR D . n F 2 201 ILE 201 195 195 ILE ILE D . n F 2 202 CYS 202 196 196 CYS CYS D . n F 2 203 ASN 203 197 197 ASN ASN D . n F 2 204 VAL 204 198 198 VAL VAL D . n F 2 205 ASN 205 199 199 ASN ASN D . n F 2 206 HIS 206 200 200 HIS HIS D . n F 2 207 LYS 207 201 201 LYS LYS D . n F 2 208 PRO 208 202 202 PRO PRO D . n F 2 209 SER 209 203 203 SER SER D . n F 2 210 ASN 210 204 204 ASN ASN D . n F 2 211 THR 211 205 205 THR THR D . n F 2 212 LYS 212 206 206 LYS LYS D . n F 2 213 VAL 213 207 207 VAL VAL D . n F 2 214 ASP 214 208 208 ASP ASP D . n F 2 215 LYS 215 209 209 LYS LYS D . n F 2 216 LYS 216 210 210 LYS LYS D . n F 2 217 VAL 217 211 211 VAL VAL D . n F 2 218 GLU 218 212 212 GLU GLU D . n F 2 219 PRO 219 213 213 PRO PRO D . n F 2 220 LYS 220 214 214 LYS LYS D . n G 1 1 ASP 1 1 1 ASP ASP E . n G 1 2 ILE 2 2 2 ILE ILE E . n G 1 3 GLN 3 3 3 GLN GLN E . n G 1 4 MET 4 4 4 MET MET E . n G 1 5 THR 5 5 5 THR THR E . n G 1 6 GLN 6 6 6 GLN GLN E . n G 1 7 SER 7 7 7 SER SER E . n G 1 8 PRO 8 8 8 PRO PRO E . n G 1 9 SER 9 9 9 SER SER E . n G 1 10 PHE 10 10 10 PHE PHE E . n G 1 11 VAL 11 11 11 VAL VAL E . n G 1 12 SER 12 12 12 SER SER E . n G 1 13 ALA 13 13 13 ALA ALA E . n G 1 14 SER 14 14 14 SER SER E . n G 1 15 VAL 15 15 15 VAL VAL E . n G 1 16 GLY 16 16 16 GLY GLY E . n G 1 17 ASP 17 17 17 ASP ASP E . n G 1 18 ARG 18 18 18 ARG ARG E . n G 1 19 VAL 19 19 19 VAL VAL E . n G 1 20 THR 20 20 20 THR THR E . n G 1 21 ILE 21 21 21 ILE ILE E . n G 1 22 THR 22 22 22 THR THR E . n G 1 23 CYS 23 23 23 CYS CYS E . n G 1 24 ARG 24 24 24 ARG ARG E . n G 1 25 ALA 25 25 25 ALA ALA E . n G 1 26 SER 26 26 26 SER SER E . n G 1 27 GLN 27 27 27 GLN GLN E . n G 1 28 GLY 28 28 28 GLY GLY E . n G 1 29 ILE 29 29 29 ILE ILE E . n G 1 30 SER 30 30 30 SER SER E . n G 1 31 SER 31 31 31 SER SER E . n G 1 32 TYR 32 32 32 TYR TYR E . n G 1 33 LEU 33 33 33 LEU LEU E . n G 1 34 ALA 34 34 34 ALA ALA E . n G 1 35 TRP 35 35 35 TRP TRP E . n G 1 36 TYR 36 36 36 TYR TYR E . n G 1 37 GLN 37 37 37 GLN GLN E . n G 1 38 GLN 38 38 38 GLN GLN E . n G 1 39 LYS 39 39 39 LYS LYS E . n G 1 40 PRO 40 40 40 PRO PRO E . n G 1 41 GLY 41 41 41 GLY GLY E . n G 1 42 LYS 42 42 42 LYS LYS E . n G 1 43 ALA 43 43 43 ALA ALA E . n G 1 44 PRO 44 44 44 PRO PRO E . n G 1 45 LYS 45 45 45 LYS LYS E . n G 1 46 LEU 46 46 46 LEU LEU E . n G 1 47 VAL 47 47 47 VAL VAL E . n G 1 48 ILE 48 48 48 ILE ILE E . n G 1 49 TYR 49 49 49 TYR TYR E . n G 1 50 ALA 50 50 50 ALA ALA E . n G 1 51 ALA 51 51 51 ALA ALA E . n G 1 52 SER 52 52 52 SER SER E . n G 1 53 THR 53 53 53 THR THR E . n G 1 54 LEU 54 54 54 LEU LEU E . n G 1 55 GLN 55 55 ? ? ? E . n G 1 56 SER 56 56 ? ? ? E . n G 1 57 GLY 57 57 ? ? ? E . n G 1 58 VAL 58 58 ? ? ? E . n G 1 59 PRO 59 59 ? ? ? E . n G 1 60 SER 60 60 ? ? ? E . n G 1 61 ARG 61 61 61 ARG ARG E . n G 1 62 PHE 62 62 62 PHE PHE E . n G 1 63 SER 63 63 63 SER SER E . n G 1 64 GLY 64 64 64 GLY GLY E . n G 1 65 SER 65 65 65 SER SER E . n G 1 66 GLY 66 66 66 GLY GLY E . n G 1 67 SER 67 67 67 SER SER E . n G 1 68 GLY 68 68 68 GLY GLY E . n G 1 69 THR 69 69 69 THR THR E . n G 1 70 GLU 70 70 70 GLU GLU E . n G 1 71 PHE 71 71 71 PHE PHE E . n G 1 72 THR 72 72 72 THR THR E . n G 1 73 LEU 73 73 73 LEU LEU E . n G 1 74 THR 74 74 74 THR THR E . n G 1 75 ILE 75 75 75 ILE ILE E . n G 1 76 SER 76 76 76 SER SER E . n G 1 77 SER 77 77 77 SER SER E . n G 1 78 LEU 78 78 78 LEU LEU E . n G 1 79 GLN 79 79 79 GLN GLN E . n G 1 80 PRO 80 80 80 PRO PRO E . n G 1 81 GLU 81 81 81 GLU GLU E . n G 1 82 ASP 82 82 82 ASP ASP E . n G 1 83 PHE 83 83 83 PHE PHE E . n G 1 84 ALA 84 84 84 ALA ALA E . n G 1 85 THR 85 85 85 THR THR E . n G 1 86 TYR 86 86 86 TYR TYR E . n G 1 87 TYR 87 87 87 TYR TYR E . n G 1 88 CYS 88 88 88 CYS CYS E . n G 1 89 GLN 89 89 89 GLN GLN E . n G 1 90 HIS 90 90 90 HIS HIS E . n G 1 91 LEU 91 91 91 LEU LEU E . n G 1 92 ILE 92 92 92 ILE ILE E . n G 1 93 GLY 93 93 93 GLY GLY E . n G 1 94 LEU 94 94 94 LEU LEU E . n G 1 95 ARG 95 96 96 ARG ARG E . n G 1 96 SER 96 97 97 SER SER E . n G 1 97 PHE 97 98 98 PHE PHE E . n G 1 98 GLY 98 99 99 GLY GLY E . n G 1 99 GLN 99 100 100 GLN GLN E . n G 1 100 GLY 100 101 101 GLY GLY E . n G 1 101 THR 101 102 102 THR THR E . n G 1 102 LYS 102 103 103 LYS LYS E . n G 1 103 LEU 103 104 104 LEU LEU E . n G 1 104 GLU 104 105 105 GLU GLU E . n G 1 105 ILE 105 106 106 ILE ILE E . n G 1 106 LYS 106 107 107 LYS LYS E . n G 1 107 ARG 107 108 108 ARG ARG E . n G 1 108 THR 108 109 109 THR THR E . n G 1 109 VAL 109 110 110 VAL VAL E . n G 1 110 ALA 110 111 111 ALA ALA E . n G 1 111 ALA 111 112 112 ALA ALA E . n G 1 112 PRO 112 113 113 PRO PRO E . n G 1 113 SER 113 114 114 SER SER E . n G 1 114 VAL 114 115 115 VAL VAL E . n G 1 115 PHE 115 116 116 PHE PHE E . n G 1 116 ILE 116 117 117 ILE ILE E . n G 1 117 PHE 117 118 118 PHE PHE E . n G 1 118 PRO 118 119 119 PRO PRO E . n G 1 119 PRO 119 120 120 PRO PRO E . n G 1 120 SER 120 121 121 SER SER E . n G 1 121 ASP 121 122 122 ASP ASP E . n G 1 122 GLU 122 123 123 GLU GLU E . n G 1 123 GLN 123 124 124 GLN GLN E . n G 1 124 LEU 124 125 125 LEU LEU E . n G 1 125 LYS 125 126 126 LYS LYS E . n G 1 126 SER 126 127 127 SER SER E . n G 1 127 GLY 127 128 128 GLY GLY E . n G 1 128 THR 128 129 129 THR THR E . n G 1 129 ALA 129 130 130 ALA ALA E . n G 1 130 SER 130 131 131 SER SER E . n G 1 131 VAL 131 132 132 VAL VAL E . n G 1 132 VAL 132 133 133 VAL VAL E . n G 1 133 CYS 133 134 134 CYS CYS E . n G 1 134 LEU 134 135 135 LEU LEU E . n G 1 135 LEU 135 136 136 LEU LEU E . n G 1 136 ASN 136 137 137 ASN ASN E . n G 1 137 ASN 137 138 138 ASN ASN E . n G 1 138 PHE 138 139 139 PHE PHE E . n G 1 139 TYR 139 140 140 TYR TYR E . n G 1 140 PRO 140 141 141 PRO PRO E . n G 1 141 ARG 141 142 142 ARG ARG E . n G 1 142 GLU 142 143 143 GLU GLU E . n G 1 143 ALA 143 144 144 ALA ALA E . n G 1 144 LYS 144 145 145 LYS LYS E . n G 1 145 VAL 145 146 146 VAL VAL E . n G 1 146 GLN 146 147 147 GLN GLN E . n G 1 147 TRP 147 148 148 TRP TRP E . n G 1 148 LYS 148 149 149 LYS LYS E . n G 1 149 VAL 149 150 150 VAL VAL E . n G 1 150 ASP 150 151 151 ASP ASP E . n G 1 151 ASN 151 152 152 ASN ASN E . n G 1 152 ALA 152 153 153 ALA ALA E . n G 1 153 LEU 153 154 154 LEU LEU E . n G 1 154 GLN 154 155 155 GLN GLN E . n G 1 155 SER 155 156 156 SER SER E . n G 1 156 GLY 156 157 157 GLY GLY E . n G 1 157 ASN 157 158 158 ASN ASN E . n G 1 158 SER 158 159 159 SER SER E . n G 1 159 GLN 159 160 160 GLN GLN E . n G 1 160 GLU 160 161 161 GLU GLU E . n G 1 161 SER 161 162 162 SER SER E . n G 1 162 VAL 162 163 163 VAL VAL E . n G 1 163 THR 163 164 164 THR THR E . n G 1 164 GLU 164 165 165 GLU GLU E . n G 1 165 GLN 165 166 166 GLN GLN E . n G 1 166 ASP 166 167 167 ASP ASP E . n G 1 167 SER 167 168 168 SER SER E . n G 1 168 LYS 168 169 169 LYS LYS E . n G 1 169 ASP 169 170 170 ASP ASP E . n G 1 170 SER 170 171 171 SER SER E . n G 1 171 THR 171 172 172 THR THR E . n G 1 172 TYR 172 173 173 TYR TYR E . n G 1 173 SER 173 174 174 SER SER E . n G 1 174 LEU 174 175 175 LEU LEU E . n G 1 175 SER 175 176 176 SER SER E . n G 1 176 SER 176 177 177 SER SER E . n G 1 177 THR 177 178 178 THR THR E . n G 1 178 LEU 178 179 179 LEU LEU E . n G 1 179 THR 179 180 180 THR THR E . n G 1 180 LEU 180 181 181 LEU LEU E . n G 1 181 SER 181 182 182 SER SER E . n G 1 182 LYS 182 183 183 LYS LYS E . n G 1 183 ALA 183 184 184 ALA ALA E . n G 1 184 ASP 184 185 185 ASP ASP E . n G 1 185 TYR 185 186 186 TYR TYR E . n G 1 186 GLU 186 187 187 GLU GLU E . n G 1 187 LYS 187 188 188 LYS LYS E . n G 1 188 HIS 188 189 189 HIS HIS E . n G 1 189 LYS 189 190 190 LYS LYS E . n G 1 190 VAL 190 191 191 VAL VAL E . n G 1 191 TYR 191 192 192 TYR TYR E . n G 1 192 ALA 192 193 193 ALA ALA E . n G 1 193 CYS 193 194 194 CYS CYS E . n G 1 194 GLU 194 195 195 GLU GLU E . n G 1 195 VAL 195 196 196 VAL VAL E . n G 1 196 THR 196 197 197 THR THR E . n G 1 197 HIS 197 198 198 HIS HIS E . n G 1 198 GLN 198 199 199 GLN GLN E . n G 1 199 GLY 199 200 200 GLY GLY E . n G 1 200 LEU 200 201 201 LEU LEU E . n G 1 201 SER 201 202 202 SER SER E . n G 1 202 SER 202 203 203 SER SER E . n G 1 203 PRO 203 204 204 PRO PRO E . n G 1 204 VAL 204 205 205 VAL VAL E . n G 1 205 THR 205 206 206 THR THR E . n G 1 206 LYS 206 207 207 LYS LYS E . n G 1 207 SER 207 208 208 SER SER E . n G 1 208 PHE 208 209 209 PHE PHE E . n G 1 209 ASN 209 210 210 ASN ASN E . n G 1 210 ARG 210 211 211 ARG ARG E . n H 2 1 GLN 1 1 1 GLN GLN F . n H 2 2 VAL 2 2 2 VAL VAL F . n H 2 3 GLN 3 3 3 GLN GLN F . n H 2 4 LEU 4 4 4 LEU LEU F . n H 2 5 GLN 5 5 5 GLN GLN F . n H 2 6 GLN 6 6 6 GLN GLN F . n H 2 7 TRP 7 7 7 TRP TRP F . n H 2 8 GLY 8 8 8 GLY GLY F . n H 2 9 ALA 9 9 9 ALA ALA F . n H 2 10 GLY 10 10 10 GLY GLY F . n H 2 11 LEU 11 11 11 LEU LEU F . n H 2 12 LEU 12 12 12 LEU LEU F . n H 2 13 LYS 13 13 13 LYS LYS F . n H 2 14 PRO 14 14 14 PRO PRO F . n H 2 15 SER 15 15 15 SER SER F . n H 2 16 GLU 16 16 16 GLU GLU F . n H 2 17 THR 17 17 17 THR THR F . n H 2 18 LEU 18 18 18 LEU LEU F . n H 2 19 SER 19 19 19 SER SER F . n H 2 20 LEU 20 20 20 LEU LEU F . n H 2 21 THR 21 21 21 THR THR F . n H 2 22 CYS 22 22 22 CYS CYS F . n H 2 23 GLY 23 23 23 GLY GLY F . n H 2 24 VAL 24 24 24 VAL VAL F . n H 2 25 TYR 25 25 25 TYR TYR F . n H 2 26 GLY 26 26 26 GLY GLY F . n H 2 27 GLU 27 27 27 GLU GLU F . n H 2 28 SER 28 28 28 SER SER F . n H 2 29 LEU 29 29 29 LEU LEU F . n H 2 30 SER 30 30 30 SER SER F . n H 2 31 GLY 31 31 31 GLY GLY F . n H 2 32 HIS 32 32 32 HIS HIS F . n H 2 33 TYR 33 33 33 TYR TYR F . n H 2 34 TRP 34 34 34 TRP TRP F . n H 2 35 SER 35 35 35 SER SER F . n H 2 36 TRP 36 36 36 TRP TRP F . n H 2 37 VAL 37 37 37 VAL VAL F . n H 2 38 ARG 38 38 38 ARG ARG F . n H 2 39 GLN 39 39 39 GLN GLN F . n H 2 40 PRO 40 40 40 PRO PRO F . n H 2 41 PRO 41 41 41 PRO PRO F . n H 2 42 GLY 42 42 42 GLY GLY F . n H 2 43 LYS 43 43 43 LYS LYS F . n H 2 44 ARG 44 44 44 ARG ARG F . n H 2 45 LEU 45 45 45 LEU LEU F . n H 2 46 GLU 46 46 46 GLU GLU F . n H 2 47 TRP 47 47 47 TRP TRP F . n H 2 48 ILE 48 48 48 ILE ILE F . n H 2 49 GLY 49 49 49 GLY GLY F . n H 2 50 GLU 50 50 50 GLU GLU F . n H 2 51 ILE 51 51 51 ILE ILE F . n H 2 52 LYS 52 52 52 LYS LYS F . n H 2 53 HIS 53 53 53 HIS HIS F . n H 2 54 ASN 54 54 54 ASN ASN F . n H 2 55 GLY 55 55 55 GLY GLY F . n H 2 56 SER 56 56 56 SER SER F . n H 2 57 PRO 57 57 57 PRO PRO F . n H 2 58 ASN 58 58 58 ASN ASN F . n H 2 59 TYR 59 59 59 TYR TYR F . n H 2 60 HIS 60 60 60 HIS HIS F . n H 2 61 PRO 61 61 61 PRO PRO F . n H 2 62 SER 62 62 62 SER SER F . n H 2 63 LEU 63 63 63 LEU LEU F . n H 2 64 LYS 64 64 64 LYS LYS F . n H 2 65 SER 65 65 65 SER SER F . n H 2 66 ARG 66 66 66 ARG ARG F . n H 2 67 VAL 67 67 67 VAL VAL F . n H 2 68 THR 68 68 68 THR THR F . n H 2 69 ILE 69 69 69 ILE ILE F . n H 2 70 SER 70 70 70 SER SER F . n H 2 71 LEU 71 71 71 LEU LEU F . n H 2 72 ASP 72 72 72 ASP ASP F . n H 2 73 MET 73 73 73 MET MET F . n H 2 74 SER 74 74 74 SER SER F . n H 2 75 LYS 75 75 75 LYS LYS F . n H 2 76 ASN 76 76 76 ASN ASN F . n H 2 77 GLN 77 77 77 GLN GLN F . n H 2 78 PHE 78 78 78 PHE PHE F . n H 2 79 SER 79 79 79 SER SER F . n H 2 80 LEU 80 80 80 LEU LEU F . n H 2 81 ASN 81 81 81 ASN ASN F . n H 2 82 LEU 82 82 82 LEU LEU F . n H 2 83 THR 83 82 82 THR THR F A n H 2 84 SER 84 82 82 SER SER F B n H 2 85 VAL 85 82 82 VAL VAL F C n H 2 86 THR 86 83 83 THR THR F . n H 2 87 ALA 87 84 84 ALA ALA F . n H 2 88 ALA 88 85 85 ALA ALA F . n H 2 89 ASP 89 86 86 ASP ASP F . n H 2 90 THR 90 87 87 THR THR F . n H 2 91 ALA 91 88 88 ALA ALA F . n H 2 92 VAL 92 89 89 VAL VAL F . n H 2 93 TYR 93 90 90 TYR TYR F . n H 2 94 PHE 94 91 91 PHE PHE F . n H 2 95 CYS 95 92 92 CYS CYS F . n H 2 96 ALA 96 93 93 ALA ALA F . n H 2 97 ARG 97 94 94 ARG ARG F . n H 2 98 ARG 98 95 95 ARG ARG F . n H 2 99 SER 99 96 96 SER SER F . n H 2 100 ASN 100 97 97 ASN ASN F . n H 2 101 TRP 101 98 98 TRP TRP F . n H 2 102 PRO 102 99 99 PRO PRO F . n H 2 103 TYR 103 100 100 TYR TYR F . n H 2 104 LEU 104 100 100 LEU LEU F A n H 2 105 PRO 105 100 100 PRO PRO F B n H 2 106 PHE 106 100 100 PHE PHE F C n H 2 107 ASP 107 101 101 ASP ASP F . n H 2 108 PRO 108 102 102 PRO PRO F . n H 2 109 TRP 109 103 103 TRP TRP F . n H 2 110 GLY 110 104 104 GLY GLY F . n H 2 111 GLN 111 105 105 GLN GLN F . n H 2 112 GLY 112 106 106 GLY GLY F . n H 2 113 THR 113 107 107 THR THR F . n H 2 114 LEU 114 108 108 LEU LEU F . n H 2 115 VAL 115 109 109 VAL VAL F . n H 2 116 THR 116 110 110 THR THR F . n H 2 117 VAL 117 111 111 VAL VAL F . n H 2 118 SER 118 112 112 SER SER F . n H 2 119 SER 119 113 113 SER SER F . n H 2 120 ALA 120 114 114 ALA ALA F . n H 2 121 SER 121 115 115 SER SER F . n H 2 122 THR 122 116 116 THR THR F . n H 2 123 LYS 123 117 117 LYS LYS F . n H 2 124 GLY 124 118 118 GLY GLY F . n H 2 125 PRO 125 119 119 PRO PRO F . n H 2 126 SER 126 120 120 SER SER F . n H 2 127 VAL 127 121 121 VAL VAL F . n H 2 128 PHE 128 122 122 PHE PHE F . n H 2 129 PRO 129 123 123 PRO PRO F . n H 2 130 LEU 130 124 124 LEU LEU F . n H 2 131 ALA 131 125 125 ALA ALA F . n H 2 132 PRO 132 126 126 PRO PRO F . n H 2 133 SER 133 127 127 SER SER F . n H 2 134 SER 134 128 128 SER SER F . n H 2 135 LYS 135 129 129 LYS LYS F . n H 2 136 SER 136 130 130 SER SER F . n H 2 137 THR 137 131 131 THR THR F . n H 2 138 SER 138 132 132 SER SER F . n H 2 139 GLY 139 133 133 GLY GLY F . n H 2 140 GLY 140 134 134 GLY GLY F . n H 2 141 THR 141 135 135 THR THR F . n H 2 142 ALA 142 136 136 ALA ALA F . n H 2 143 ALA 143 137 137 ALA ALA F . n H 2 144 LEU 144 138 138 LEU LEU F . n H 2 145 GLY 145 139 139 GLY GLY F . n H 2 146 CYS 146 140 140 CYS CYS F . n H 2 147 LEU 147 141 141 LEU LEU F . n H 2 148 VAL 148 142 142 VAL VAL F . n H 2 149 LYS 149 143 143 LYS LYS F . n H 2 150 ASP 150 144 144 ASP ASP F . n H 2 151 TYR 151 145 145 TYR TYR F . n H 2 152 PHE 152 146 146 PHE PHE F . n H 2 153 PRO 153 147 147 PRO PRO F . n H 2 154 GLU 154 148 148 GLU GLU F . n H 2 155 PRO 155 149 149 PRO PRO F . n H 2 156 VAL 156 150 150 VAL VAL F . n H 2 157 THR 157 151 151 THR THR F . n H 2 158 VAL 158 152 152 VAL VAL F . n H 2 159 SER 159 153 153 SER SER F . n H 2 160 TRP 160 154 154 TRP TRP F . n H 2 161 ASN 161 155 155 ASN ASN F . n H 2 162 SER 162 156 156 SER SER F . n H 2 163 GLY 163 157 157 GLY GLY F . n H 2 164 ALA 164 158 158 ALA ALA F . n H 2 165 LEU 165 159 159 LEU LEU F . n H 2 166 THR 166 160 160 THR THR F . n H 2 167 SER 167 161 161 SER SER F . n H 2 168 GLY 168 162 162 GLY GLY F . n H 2 169 VAL 169 163 163 VAL VAL F . n H 2 170 HIS 170 164 164 HIS HIS F . n H 2 171 THR 171 165 165 THR THR F . n H 2 172 PHE 172 166 166 PHE PHE F . n H 2 173 PRO 173 167 167 PRO PRO F . n H 2 174 ALA 174 168 168 ALA ALA F . n H 2 175 VAL 175 169 169 VAL VAL F . n H 2 176 LEU 176 170 170 LEU LEU F . n H 2 177 GLN 177 171 171 GLN GLN F . n H 2 178 SER 178 172 172 SER SER F . n H 2 179 SER 179 173 173 SER SER F . n H 2 180 GLY 180 174 174 GLY GLY F . n H 2 181 LEU 181 175 175 LEU LEU F . n H 2 182 TYR 182 176 176 TYR TYR F . n H 2 183 SER 183 177 177 SER SER F . n H 2 184 LEU 184 178 178 LEU LEU F . n H 2 185 SER 185 179 179 SER SER F . n H 2 186 SER 186 180 180 SER SER F . n H 2 187 VAL 187 181 181 VAL VAL F . n H 2 188 VAL 188 182 182 VAL VAL F . n H 2 189 THR 189 183 183 THR THR F . n H 2 190 VAL 190 184 184 VAL VAL F . n H 2 191 PRO 191 185 185 PRO PRO F . n H 2 192 SER 192 186 186 SER SER F . n H 2 193 SER 193 187 187 SER SER F . n H 2 194 SER 194 188 188 SER SER F . n H 2 195 LEU 195 189 189 LEU LEU F . n H 2 196 GLY 196 190 190 GLY GLY F . n H 2 197 THR 197 191 191 THR THR F . n H 2 198 GLN 198 192 192 GLN GLN F . n H 2 199 THR 199 193 193 THR THR F . n H 2 200 TYR 200 194 194 TYR TYR F . n H 2 201 ILE 201 195 195 ILE ILE F . n H 2 202 CYS 202 196 196 CYS CYS F . n H 2 203 ASN 203 197 197 ASN ASN F . n H 2 204 VAL 204 198 198 VAL VAL F . n H 2 205 ASN 205 199 199 ASN ASN F . n H 2 206 HIS 206 200 200 HIS HIS F . n H 2 207 LYS 207 201 201 LYS LYS F . n H 2 208 PRO 208 202 202 PRO PRO F . n H 2 209 SER 209 203 203 SER SER F . n H 2 210 ASN 210 204 204 ASN ASN F . n H 2 211 THR 211 205 205 THR THR F . n H 2 212 LYS 212 206 206 LYS LYS F . n H 2 213 VAL 213 207 207 VAL VAL F . n H 2 214 ASP 214 208 208 ASP ASP F . n H 2 215 LYS 215 209 209 LYS LYS F . n H 2 216 LYS 216 210 210 LYS LYS F . n H 2 217 VAL 217 211 211 VAL VAL F . n H 2 218 GLU 218 212 212 GLU GLU F . n H 2 219 PRO 219 213 213 PRO PRO F . n H 2 220 LYS 220 214 214 LYS LYS F . n # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 F ASN 81 D ASN 81 ? ASN 'GLYCOSYLATION SITE' 2 H ASN 81 F ASN 81 ? ASN 'GLYCOSYLATION SITE' 3 B ASN 81 H ASN 81 ? ASN 'GLYCOSYLATION SITE' 4 D ASN 81 B ASN 81 ? ASN 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PISA dimeric 2 2 author_and_software_defined_assembly PISA dimeric 2 3 author_and_software_defined_assembly PISA dimeric 2 4 author_and_software_defined_assembly PISA dimeric 2 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,B,I,J,K,L,M,N,O,P,Q,R,S,T,WA,XA 2 1 C,D,U,V,W,X,Y,Z,AA,BA,CA,DA,EA,FA,GA,HA,YA,ZA 3 1 E,F,IA,JA,KA,LA,MA,AB,BB 4 1 G,H,NA,OA,PA,QA,RA,SA,TA,UA,VA,CB,DB # 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)' 5630 ? 1 MORE -133 ? 1 'SSA (A^2)' 19930 ? 2 'ABSA (A^2)' 6160 ? 2 MORE -172 ? 2 'SSA (A^2)' 19880 ? 3 'ABSA (A^2)' 4830 ? 3 MORE -78 ? 3 'SSA (A^2)' 19140 ? 4 'ABSA (A^2)' 5290 ? 4 MORE -111 ? 4 'SSA (A^2)' 19210 ? # _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_struct_special_symmetry.id _pdbx_struct_special_symmetry.PDB_model_num _pdbx_struct_special_symmetry.auth_asym_id _pdbx_struct_special_symmetry.auth_comp_id _pdbx_struct_special_symmetry.auth_seq_id _pdbx_struct_special_symmetry.PDB_ins_code _pdbx_struct_special_symmetry.label_asym_id _pdbx_struct_special_symmetry.label_comp_id _pdbx_struct_special_symmetry.label_seq_id 1 1 L SO4 304 ? L SO4 . 2 1 L HOH 482 ? WA HOH . # 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 2014-09-10 2 'Structure model' 1 1 2014-10-22 # _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 ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Database references' # 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 11.2187 5.0522 -8.1012 0.1367 0.1124 0.1698 0.0090 0.0008 0.0091 1.0863 0.6080 0.6822 -0.4193 -0.2784 0.0471 0.0071 -0.0216 -0.1756 -0.0557 -0.0201 0.1595 -0.1067 -0.0468 0.0002 'X-RAY DIFFRACTION' 2 ? refined 9.5922 33.2414 -30.1418 0.2171 0.1984 0.1006 0.0079 -0.0178 0.0035 0.3395 0.4487 1.2886 0.0146 -0.0248 -0.3249 -0.1106 0.0454 -0.0008 0.1198 0.0208 -0.0079 -0.2186 -0.0358 -0.1052 'X-RAY DIFFRACTION' 3 ? refined 28.2500 -1.3927 -21.2138 0.1503 0.1325 0.1478 0.0412 -0.0040 -0.0024 0.5767 0.8319 0.5170 -0.0241 -0.2363 -0.4609 0.0414 0.0394 -0.0792 -0.0910 -0.0252 0.0393 0.0345 0.0454 -0.0000 'X-RAY DIFFRACTION' 4 ? refined 24.9495 34.2101 -26.9994 0.2371 0.2852 0.2134 -0.0250 -0.0643 -0.0287 0.2291 0.4316 1.0755 0.0887 0.1853 -0.5859 -0.0557 0.0482 0.1270 0.1570 0.0280 -0.1661 -0.0778 0.2800 0.0000 'X-RAY DIFFRACTION' 5 ? refined 88.0433 -22.9233 -6.3429 0.1496 0.1604 0.1300 -0.0215 0.0290 -0.0022 0.7134 1.0628 1.0075 -0.8986 0.5594 0.0070 0.0542 -0.0329 0.1306 0.1102 -0.1134 -0.0327 0.0691 0.0289 0.0001 'X-RAY DIFFRACTION' 6 ? refined 87.3162 -51.4373 -29.0260 0.2629 0.1993 0.1353 0.0262 -0.0181 -0.0319 0.7210 -0.1633 1.5585 -0.2668 0.3734 -1.0158 0.1417 0.0605 -0.1043 -0.0270 -0.0543 -0.0000 0.3114 0.2297 0.0020 'X-RAY DIFFRACTION' 7 ? refined 72.2703 -15.1691 -20.2913 0.1690 0.1634 0.1407 0.0441 0.0129 -0.0189 0.7763 0.8801 0.8876 -0.1694 0.3587 0.4156 0.0330 0.1137 0.0901 -0.0743 -0.1028 0.0850 -0.0302 0.0132 -0.0791 'X-RAY DIFFRACTION' 8 ? refined 71.9923 -49.3635 -26.5756 0.2173 0.2845 0.1229 -0.0624 0.0150 0.0074 0.3912 0.6539 1.5509 0.2450 0.5089 0.9910 0.1435 -0.1577 0.0213 -0.0471 -0.1633 0.1331 0.3363 -0.4541 -0.0165 'X-RAY DIFFRACTION' 9 ? refined 50.7388 -23.8657 11.8066 0.1962 0.3064 0.2234 0.0480 -0.0396 0.0308 0.7476 0.5616 0.4948 0.4455 -0.0056 -0.0829 0.0153 -0.3406 -0.0058 0.0707 0.1269 -0.0994 0.1280 -0.0000 0.0011 'X-RAY DIFFRACTION' 10 ? refined 15.7211 -26.2724 21.9303 0.3399 0.5788 0.4361 -0.0233 0.1112 0.1640 0.8524 0.1825 1.1612 -0.2084 -0.2793 0.2886 -0.0085 -0.7406 0.0930 0.2257 0.0345 0.2221 0.2348 -0.1568 0.1249 'X-RAY DIFFRACTION' 11 ? refined 42.5290 -26.8467 -8.6835 0.1461 0.1277 0.2357 0.0079 -0.0141 0.0283 0.8072 0.8603 0.4213 0.1556 0.0818 0.1057 0.0579 -0.0294 -0.1322 -0.1061 -0.0092 0.0177 0.0241 0.0451 0.0138 'X-RAY DIFFRACTION' 12 ? refined 16.2038 -18.3741 8.1433 0.2140 0.1664 0.3127 0.0427 0.0429 0.0476 1.1918 0.4962 0.5397 0.0361 0.2897 -0.4335 -0.1037 -0.2073 -0.0754 0.1347 0.0900 0.1130 0.0073 -0.0972 -0.0000 'X-RAY DIFFRACTION' 13 ? refined 47.9869 6.0142 12.2015 0.1781 0.2896 0.1746 0.0976 0.0261 -0.0031 0.8667 0.5870 0.9719 0.5319 -0.0868 0.0153 -0.1265 -0.3356 -0.0596 0.0833 0.0837 -0.0051 -0.2089 -0.0808 -0.0055 'X-RAY DIFFRACTION' 14 ? refined 82.5528 8.5263 23.9512 0.3783 0.9485 0.5009 0.0430 -0.1977 -0.3686 0.5277 0.3721 0.6594 -0.2729 0.2519 -0.5882 -0.2377 -1.1830 -0.3265 0.3128 0.3040 -0.3410 -0.0741 0.3409 0.1665 'X-RAY DIFFRACTION' 15 ? refined 57.3669 9.6941 -7.5546 0.1907 0.1240 0.2505 0.0008 0.0367 -0.0283 1.3958 0.8174 0.0189 -0.5435 -0.0451 -0.1516 0.0581 -0.0208 0.1306 -0.0897 0.0075 -0.2028 -0.0870 -0.0772 0.1360 'X-RAY DIFFRACTION' 16 ? refined 82.7612 0.7573 10.1029 0.2032 0.3133 0.3179 0.0772 -0.0486 -0.0954 1.3924 0.5164 0.6303 -0.0913 -0.1140 0.3358 -0.1858 -0.4464 0.1643 -0.0611 0.1828 -0.2722 0.0146 0.1991 0.0135 # 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 L and resid 1:107' 'X-RAY DIFFRACTION' 2 2 ? ? ? ? ? ? ? ? ? 'chain L and resid 109:211' 'X-RAY DIFFRACTION' 3 3 ? ? ? ? ? ? ? ? ? 'chain H and resid 1:118' 'X-RAY DIFFRACTION' 4 4 ? ? ? ? ? ? ? ? ? 'chain H and resid 123:214' 'X-RAY DIFFRACTION' 5 5 ? ? ? ? ? ? ? ? ? 'chain A and resid 1:107' 'X-RAY DIFFRACTION' 6 6 ? ? ? ? ? ? ? ? ? 'chain A and resid 109:211' 'X-RAY DIFFRACTION' 7 7 ? ? ? ? ? ? ? ? ? 'chain B and resid 1:118' 'X-RAY DIFFRACTION' 8 8 ? ? ? ? ? ? ? ? ? 'chain B and resid 123:214' 'X-RAY DIFFRACTION' 9 9 ? ? ? ? ? ? ? ? ? 'chain C and resid 1:107' 'X-RAY DIFFRACTION' 10 10 ? ? ? ? ? ? ? ? ? 'chain C and resid 109:211' 'X-RAY DIFFRACTION' 11 11 ? ? ? ? ? ? ? ? ? 'chain D and resid 1:118' 'X-RAY DIFFRACTION' 12 12 ? ? ? ? ? ? ? ? ? 'chain D and resid 123:214' 'X-RAY DIFFRACTION' 13 13 ? ? ? ? ? ? ? ? ? 'chain E and resid 1:107' 'X-RAY DIFFRACTION' 14 14 ? ? ? ? ? ? ? ? ? 'chain E and resid 109:211' 'X-RAY DIFFRACTION' 15 15 ? ? ? ? ? ? ? ? ? 'chain F and resid 1:118' 'X-RAY DIFFRACTION' 16 16 ? ? ? ? ? ? ? ? ? 'chain F and resid 123:214' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal MOLREP phasing . ? 1 PHENIX refinement 1.9_1692 ? 2 HKL-2000 'data reduction' . ? 3 HKL-2000 'data scaling' . ? 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 O3 F SO4 303 ? ? O F HOH 405 ? ? 2.14 2 1 O A HOH 444 ? ? O A HOH 456 ? ? 2.15 3 1 O L HOH 587 ? ? O L HOH 598 ? ? 2.17 4 1 O D HOH 520 ? ? O D HOH 540 ? ? 2.17 5 1 O E HOH 443 ? ? O E HOH 445 ? ? 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 SER L 30 ? ? 41.06 -116.09 2 1 ALA L 51 ? ? 68.68 -39.77 3 1 SER L 77 ? ? -160.45 106.15 4 1 ALA L 84 ? ? -179.09 -179.85 5 1 SER H 15 ? ? 78.50 -4.05 6 1 ASP H 101 ? ? -177.26 126.30 7 1 LYS H 129 ? ? -96.31 45.58 8 1 SER H 130 ? ? -160.40 17.92 9 1 THR H 160 ? ? -131.16 -30.27 10 1 SER A 30 ? ? 41.37 -116.34 11 1 ALA A 51 ? ? 75.21 -37.90 12 1 SER A 77 ? ? -163.50 106.87 13 1 ALA A 84 ? ? -166.34 -169.61 14 1 SER B 15 ? ? 83.05 -12.84 15 1 ASP B 101 ? ? -174.88 128.45 16 1 LYS B 129 ? ? -93.88 47.32 17 1 SER B 130 ? ? -160.49 15.63 18 1 THR B 191 ? ? -138.91 -30.41 19 1 SER C 30 ? ? 44.51 -110.42 20 1 ALA C 51 ? ? 68.57 -28.52 21 1 ALA C 84 ? ? 176.96 -179.16 22 1 ASN C 138 ? ? 51.57 74.31 23 1 LYS C 190 ? ? -110.98 -71.35 24 1 SER D 15 ? ? 80.94 -8.56 25 1 ASP D 101 ? ? -171.70 128.34 26 1 LYS D 129 ? ? -91.62 36.52 27 1 SER D 130 ? ? -159.08 19.90 28 1 ASP D 144 ? ? 62.39 68.87 29 1 SER E 30 ? ? 56.04 -115.11 30 1 ALA E 51 ? ? 67.50 -22.49 31 1 ALA E 84 ? ? 178.91 -172.03 32 1 ASN E 138 ? ? 54.53 84.61 33 1 LYS E 190 ? ? -120.34 -61.25 34 1 PRO E 204 ? ? -35.91 123.57 35 1 SER F 15 ? ? 86.20 -12.60 36 1 TYR F 100 ? ? 70.31 -0.61 37 1 LYS F 129 ? ? -91.82 46.06 38 1 SER F 130 ? ? -164.94 22.22 39 1 ASP F 144 ? ? 62.43 67.15 # 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 C GLN 55 ? E GLN 55 2 1 Y 1 C SER 56 ? E SER 56 3 1 Y 1 C GLY 57 ? E GLY 57 4 1 Y 1 C VAL 58 ? E VAL 58 5 1 Y 1 C PRO 59 ? E PRO 59 6 1 Y 1 C SER 60 ? E SER 60 7 1 Y 1 E GLN 55 ? G GLN 55 8 1 Y 1 E SER 56 ? G SER 56 9 1 Y 1 E GLY 57 ? G GLY 57 10 1 Y 1 E VAL 58 ? G VAL 58 11 1 Y 1 E PRO 59 ? G PRO 59 12 1 Y 1 E SER 60 ? G SER 60 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 'SULFATE ION' SO4 4 N-ACETYL-D-GLUCOSAMINE NAG 5 water HOH # 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 I 3 SO4 1 301 301 SO4 SO4 L . J 3 SO4 1 302 302 SO4 SO4 L . K 3 SO4 1 303 303 SO4 SO4 L . L 3 SO4 1 304 304 SO4 SO4 L . M 3 SO4 1 305 305 SO4 SO4 L . N 3 SO4 1 306 306 SO4 SO4 L . O 4 NAG 1 301 301 NAG NAG H . P 3 SO4 1 302 302 SO4 SO4 H . Q 3 SO4 1 303 303 SO4 SO4 H . R 3 SO4 1 304 304 SO4 SO4 H . S 3 SO4 1 305 305 SO4 SO4 H . T 3 SO4 1 306 306 SO4 SO4 H . U 3 SO4 1 301 301 SO4 SO4 A . V 3 SO4 1 302 302 SO4 SO4 A . W 3 SO4 1 303 303 SO4 SO4 A . X 3 SO4 1 304 304 SO4 SO4 A . Y 3 SO4 1 305 305 SO4 SO4 A . Z 4 NAG 1 301 301 NAG NAG B . AA 3 SO4 1 302 302 SO4 SO4 B . BA 3 SO4 1 303 303 SO4 SO4 B . CA 3 SO4 1 304 304 SO4 SO4 B . DA 3 SO4 1 305 305 SO4 SO4 B . EA 3 SO4 1 306 306 SO4 SO4 B . FA 3 SO4 1 307 307 SO4 SO4 B . GA 3 SO4 1 308 308 SO4 SO4 B . HA 3 SO4 1 309 309 SO4 SO4 B . IA 3 SO4 1 301 301 SO4 SO4 C . JA 3 SO4 1 302 302 SO4 SO4 C . KA 3 SO4 1 303 303 SO4 SO4 C . LA 4 NAG 1 301 301 NAG NAG D . MA 3 SO4 1 302 302 SO4 SO4 D . NA 3 SO4 1 301 301 SO4 SO4 E . OA 3 SO4 1 302 302 SO4 SO4 E . PA 4 NAG 1 301 301 NAG NAG F . QA 3 SO4 1 302 302 SO4 SO4 F . RA 3 SO4 1 303 303 SO4 SO4 F . SA 3 SO4 1 304 303 SO4 SO4 F . TA 3 SO4 1 305 304 SO4 SO4 F . UA 3 SO4 1 306 305 SO4 SO4 F . VA 3 SO4 1 307 306 SO4 SO4 F . WA 5 HOH 1 401 401 HOH HOH L . WA 5 HOH 2 402 402 HOH HOH L . WA 5 HOH 3 403 403 HOH HOH L . WA 5 HOH 4 404 404 HOH HOH L . WA 5 HOH 5 405 405 HOH HOH L . WA 5 HOH 6 406 406 HOH HOH L . WA 5 HOH 7 407 407 HOH HOH L . WA 5 HOH 8 408 408 HOH HOH L . WA 5 HOH 9 409 409 HOH HOH L . WA 5 HOH 10 410 411 HOH HOH L . WA 5 HOH 11 411 412 HOH HOH L . WA 5 HOH 12 412 413 HOH HOH L . WA 5 HOH 13 413 414 HOH HOH L . WA 5 HOH 14 414 415 HOH HOH L . WA 5 HOH 15 415 416 HOH HOH L . WA 5 HOH 16 416 417 HOH HOH L . WA 5 HOH 17 417 418 HOH HOH L . WA 5 HOH 18 418 419 HOH HOH L . WA 5 HOH 19 419 420 HOH HOH L . WA 5 HOH 20 420 421 HOH HOH L . WA 5 HOH 21 421 422 HOH HOH L . WA 5 HOH 22 422 423 HOH HOH L . WA 5 HOH 23 423 424 HOH HOH L . WA 5 HOH 24 424 425 HOH HOH L . WA 5 HOH 25 425 426 HOH HOH L . WA 5 HOH 26 426 427 HOH HOH L . WA 5 HOH 27 427 428 HOH HOH L . WA 5 HOH 28 428 429 HOH HOH L . WA 5 HOH 29 429 430 HOH HOH L . WA 5 HOH 30 430 431 HOH HOH L . WA 5 HOH 31 431 432 HOH HOH L . WA 5 HOH 32 432 433 HOH HOH L . WA 5 HOH 33 433 434 HOH HOH L . WA 5 HOH 34 434 435 HOH HOH L . WA 5 HOH 35 435 436 HOH HOH L . WA 5 HOH 36 436 437 HOH HOH L . WA 5 HOH 37 437 438 HOH HOH L . WA 5 HOH 38 438 439 HOH HOH L . WA 5 HOH 39 439 440 HOH HOH L . WA 5 HOH 40 440 441 HOH HOH L . WA 5 HOH 41 441 442 HOH HOH L . WA 5 HOH 42 442 443 HOH HOH L . WA 5 HOH 43 443 444 HOH HOH L . WA 5 HOH 44 444 445 HOH HOH L . WA 5 HOH 45 445 446 HOH HOH L . WA 5 HOH 46 446 447 HOH HOH L . WA 5 HOH 47 447 448 HOH HOH L . WA 5 HOH 48 448 449 HOH HOH L . WA 5 HOH 49 449 450 HOH HOH L . WA 5 HOH 50 450 451 HOH HOH L . WA 5 HOH 51 451 452 HOH HOH L . WA 5 HOH 52 452 453 HOH HOH L . WA 5 HOH 53 453 454 HOH HOH L . WA 5 HOH 54 454 455 HOH HOH L . WA 5 HOH 55 455 456 HOH HOH L . WA 5 HOH 56 456 457 HOH HOH L . WA 5 HOH 57 457 458 HOH HOH L . WA 5 HOH 58 458 459 HOH HOH L . WA 5 HOH 59 459 460 HOH HOH L . WA 5 HOH 60 460 461 HOH HOH L . WA 5 HOH 61 461 462 HOH HOH L . WA 5 HOH 62 462 463 HOH HOH L . WA 5 HOH 63 463 464 HOH HOH L . WA 5 HOH 64 464 465 HOH HOH L . WA 5 HOH 65 465 466 HOH HOH L . WA 5 HOH 66 466 467 HOH HOH L . WA 5 HOH 67 467 468 HOH HOH L . WA 5 HOH 68 468 469 HOH HOH L . WA 5 HOH 69 469 470 HOH HOH L . WA 5 HOH 70 470 471 HOH HOH L . WA 5 HOH 71 471 472 HOH HOH L . WA 5 HOH 72 472 473 HOH HOH L . WA 5 HOH 73 473 474 HOH HOH L . WA 5 HOH 74 474 475 HOH HOH L . WA 5 HOH 75 475 476 HOH HOH L . WA 5 HOH 76 476 477 HOH HOH L . WA 5 HOH 77 477 478 HOH HOH L . WA 5 HOH 78 478 479 HOH HOH L . WA 5 HOH 79 479 480 HOH HOH L . WA 5 HOH 80 480 481 HOH HOH L . WA 5 HOH 81 481 482 HOH HOH L . WA 5 HOH 82 482 483 HOH HOH L . WA 5 HOH 83 483 484 HOH HOH L . WA 5 HOH 84 484 485 HOH HOH L . WA 5 HOH 85 485 486 HOH HOH L . WA 5 HOH 86 486 487 HOH HOH L . WA 5 HOH 87 487 488 HOH HOH L . WA 5 HOH 88 488 489 HOH HOH L . WA 5 HOH 89 489 490 HOH HOH L . WA 5 HOH 90 490 491 HOH HOH L . WA 5 HOH 91 491 492 HOH HOH L . WA 5 HOH 92 492 493 HOH HOH L . WA 5 HOH 93 493 494 HOH HOH L . WA 5 HOH 94 494 495 HOH HOH L . WA 5 HOH 95 495 496 HOH HOH L . WA 5 HOH 96 496 497 HOH HOH L . WA 5 HOH 97 497 498 HOH HOH L . WA 5 HOH 98 498 499 HOH HOH L . WA 5 HOH 99 499 500 HOH HOH L . WA 5 HOH 100 500 501 HOH HOH L . WA 5 HOH 101 501 502 HOH HOH L . WA 5 HOH 102 502 503 HOH HOH L . WA 5 HOH 103 503 504 HOH HOH L . WA 5 HOH 104 504 505 HOH HOH L . WA 5 HOH 105 505 506 HOH HOH L . WA 5 HOH 106 506 507 HOH HOH L . WA 5 HOH 107 507 508 HOH HOH L . WA 5 HOH 108 508 509 HOH HOH L . WA 5 HOH 109 509 510 HOH HOH L . WA 5 HOH 110 510 511 HOH HOH L . WA 5 HOH 111 511 512 HOH HOH L . WA 5 HOH 112 512 513 HOH HOH L . WA 5 HOH 113 513 514 HOH HOH L . WA 5 HOH 114 514 515 HOH HOH L . WA 5 HOH 115 515 516 HOH HOH L . WA 5 HOH 116 516 517 HOH HOH L . WA 5 HOH 117 517 518 HOH HOH L . WA 5 HOH 118 518 519 HOH HOH L . WA 5 HOH 119 519 520 HOH HOH L . WA 5 HOH 120 520 521 HOH HOH L . WA 5 HOH 121 521 522 HOH HOH L . WA 5 HOH 122 522 523 HOH HOH L . WA 5 HOH 123 523 524 HOH HOH L . WA 5 HOH 124 524 525 HOH HOH L . WA 5 HOH 125 525 527 HOH HOH L . WA 5 HOH 126 526 528 HOH HOH L . WA 5 HOH 127 527 529 HOH HOH L . WA 5 HOH 128 528 530 HOH HOH L . WA 5 HOH 129 529 531 HOH HOH L . WA 5 HOH 130 530 532 HOH HOH L . WA 5 HOH 131 531 533 HOH HOH L . WA 5 HOH 132 532 535 HOH HOH L . WA 5 HOH 133 533 536 HOH HOH L . WA 5 HOH 134 534 537 HOH HOH L . WA 5 HOH 135 535 538 HOH HOH L . WA 5 HOH 136 536 539 HOH HOH L . WA 5 HOH 137 537 540 HOH HOH L . WA 5 HOH 138 538 541 HOH HOH L . WA 5 HOH 139 539 542 HOH HOH L . WA 5 HOH 140 540 543 HOH HOH L . WA 5 HOH 141 541 544 HOH HOH L . WA 5 HOH 142 542 545 HOH HOH L . WA 5 HOH 143 543 546 HOH HOH L . WA 5 HOH 144 544 547 HOH HOH L . WA 5 HOH 145 545 548 HOH HOH L . WA 5 HOH 146 546 549 HOH HOH L . WA 5 HOH 147 547 550 HOH HOH L . WA 5 HOH 148 548 551 HOH HOH L . WA 5 HOH 149 549 552 HOH HOH L . WA 5 HOH 150 550 553 HOH HOH L . WA 5 HOH 151 551 554 HOH HOH L . WA 5 HOH 152 552 555 HOH HOH L . WA 5 HOH 153 553 556 HOH HOH L . WA 5 HOH 154 554 557 HOH HOH L . WA 5 HOH 155 555 558 HOH HOH L . WA 5 HOH 156 556 559 HOH HOH L . WA 5 HOH 157 557 560 HOH HOH L . WA 5 HOH 158 558 561 HOH HOH L . WA 5 HOH 159 559 562 HOH HOH L . WA 5 HOH 160 560 563 HOH HOH L . WA 5 HOH 161 561 564 HOH HOH L . WA 5 HOH 162 562 565 HOH HOH L . WA 5 HOH 163 563 566 HOH HOH L . WA 5 HOH 164 564 567 HOH HOH L . WA 5 HOH 165 565 568 HOH HOH L . WA 5 HOH 166 566 569 HOH HOH L . WA 5 HOH 167 567 570 HOH HOH L . WA 5 HOH 168 568 571 HOH HOH L . WA 5 HOH 169 569 572 HOH HOH L . WA 5 HOH 170 570 573 HOH HOH L . WA 5 HOH 171 571 574 HOH HOH L . WA 5 HOH 172 572 575 HOH HOH L . WA 5 HOH 173 573 576 HOH HOH L . WA 5 HOH 174 574 577 HOH HOH L . WA 5 HOH 175 575 578 HOH HOH L . WA 5 HOH 176 576 579 HOH HOH L . WA 5 HOH 177 577 580 HOH HOH L . WA 5 HOH 178 578 581 HOH HOH L . WA 5 HOH 179 579 582 HOH HOH L . WA 5 HOH 180 580 583 HOH HOH L . WA 5 HOH 181 581 584 HOH HOH L . WA 5 HOH 182 582 585 HOH HOH L . WA 5 HOH 183 583 586 HOH HOH L . WA 5 HOH 184 584 587 HOH HOH L . WA 5 HOH 185 585 588 HOH HOH L . WA 5 HOH 186 586 589 HOH HOH L . WA 5 HOH 187 587 590 HOH HOH L . WA 5 HOH 188 588 591 HOH HOH L . WA 5 HOH 189 589 592 HOH HOH L . WA 5 HOH 190 590 593 HOH HOH L . WA 5 HOH 191 591 594 HOH HOH L . WA 5 HOH 192 592 595 HOH HOH L . WA 5 HOH 193 593 596 HOH HOH L . WA 5 HOH 194 594 597 HOH HOH L . WA 5 HOH 195 595 598 HOH HOH L . WA 5 HOH 196 596 599 HOH HOH L . WA 5 HOH 197 597 600 HOH HOH L . WA 5 HOH 198 598 601 HOH HOH L . WA 5 HOH 199 599 602 HOH HOH L . WA 5 HOH 200 600 603 HOH HOH L . WA 5 HOH 201 601 604 HOH HOH L . WA 5 HOH 202 602 605 HOH HOH L . WA 5 HOH 203 603 606 HOH HOH L . WA 5 HOH 204 604 607 HOH HOH L . WA 5 HOH 205 605 608 HOH HOH L . WA 5 HOH 206 606 609 HOH HOH L . WA 5 HOH 207 607 610 HOH HOH L . WA 5 HOH 208 608 611 HOH HOH L . WA 5 HOH 209 609 612 HOH HOH L . WA 5 HOH 210 610 613 HOH HOH L . WA 5 HOH 211 611 614 HOH HOH L . WA 5 HOH 212 612 615 HOH HOH L . WA 5 HOH 213 613 616 HOH HOH L . WA 5 HOH 214 614 617 HOH HOH L . XA 5 HOH 1 401 410 HOH HOH H . XA 5 HOH 2 402 526 HOH HOH H . XA 5 HOH 3 403 534 HOH HOH H . XA 5 HOH 4 404 618 HOH HOH H . XA 5 HOH 5 405 401 HOH HOH H . XA 5 HOH 6 406 402 HOH HOH H . XA 5 HOH 7 407 403 HOH HOH H . XA 5 HOH 8 408 404 HOH HOH H . XA 5 HOH 9 409 405 HOH HOH H . XA 5 HOH 10 410 406 HOH HOH H . XA 5 HOH 11 411 407 HOH HOH H . XA 5 HOH 12 412 408 HOH HOH H . XA 5 HOH 13 413 410 HOH HOH H . XA 5 HOH 14 414 411 HOH HOH H . XA 5 HOH 15 415 412 HOH HOH H . XA 5 HOH 16 416 413 HOH HOH H . XA 5 HOH 17 417 414 HOH HOH H . XA 5 HOH 18 418 415 HOH HOH H . XA 5 HOH 19 419 416 HOH HOH H . XA 5 HOH 20 420 417 HOH HOH H . XA 5 HOH 21 421 418 HOH HOH H . XA 5 HOH 22 422 419 HOH HOH H . XA 5 HOH 23 423 420 HOH HOH H . XA 5 HOH 24 424 421 HOH HOH H . XA 5 HOH 25 425 422 HOH HOH H . XA 5 HOH 26 426 423 HOH HOH H . XA 5 HOH 27 427 424 HOH HOH H . XA 5 HOH 28 428 426 HOH HOH H . XA 5 HOH 29 429 427 HOH HOH H . XA 5 HOH 30 430 428 HOH HOH H . XA 5 HOH 31 431 429 HOH HOH H . XA 5 HOH 32 432 430 HOH HOH H . XA 5 HOH 33 433 431 HOH HOH H . XA 5 HOH 34 434 432 HOH HOH H . XA 5 HOH 35 435 433 HOH HOH H . XA 5 HOH 36 436 434 HOH HOH H . XA 5 HOH 37 437 435 HOH HOH H . XA 5 HOH 38 438 436 HOH HOH H . XA 5 HOH 39 439 437 HOH HOH H . XA 5 HOH 40 440 438 HOH HOH H . XA 5 HOH 41 441 439 HOH HOH H . XA 5 HOH 42 442 440 HOH HOH H . XA 5 HOH 43 443 441 HOH HOH H . XA 5 HOH 44 444 442 HOH HOH H . XA 5 HOH 45 445 443 HOH HOH H . XA 5 HOH 46 446 444 HOH HOH H . XA 5 HOH 47 447 445 HOH HOH H . XA 5 HOH 48 448 446 HOH HOH H . XA 5 HOH 49 449 447 HOH HOH H . XA 5 HOH 50 450 448 HOH HOH H . XA 5 HOH 51 451 449 HOH HOH H . XA 5 HOH 52 452 450 HOH HOH H . XA 5 HOH 53 453 451 HOH HOH H . XA 5 HOH 54 454 452 HOH HOH H . XA 5 HOH 55 455 453 HOH HOH H . XA 5 HOH 56 456 454 HOH HOH H . XA 5 HOH 57 457 455 HOH HOH H . XA 5 HOH 58 458 456 HOH HOH H . XA 5 HOH 59 459 457 HOH HOH H . XA 5 HOH 60 460 458 HOH HOH H . XA 5 HOH 61 461 459 HOH HOH H . XA 5 HOH 62 462 460 HOH HOH H . XA 5 HOH 63 463 461 HOH HOH H . XA 5 HOH 64 464 462 HOH HOH H . XA 5 HOH 65 465 463 HOH HOH H . XA 5 HOH 66 466 464 HOH HOH H . XA 5 HOH 67 467 465 HOH HOH H . XA 5 HOH 68 468 466 HOH HOH H . XA 5 HOH 69 469 467 HOH HOH H . XA 5 HOH 70 470 468 HOH HOH H . XA 5 HOH 71 471 469 HOH HOH H . XA 5 HOH 72 472 470 HOH HOH H . XA 5 HOH 73 473 471 HOH HOH H . XA 5 HOH 74 474 472 HOH HOH H . XA 5 HOH 75 475 473 HOH HOH H . XA 5 HOH 76 476 474 HOH HOH H . XA 5 HOH 77 477 475 HOH HOH H . XA 5 HOH 78 478 476 HOH HOH H . XA 5 HOH 79 479 477 HOH HOH H . XA 5 HOH 80 480 478 HOH HOH H . XA 5 HOH 81 481 479 HOH HOH H . XA 5 HOH 82 482 480 HOH HOH H . XA 5 HOH 83 483 481 HOH HOH H . XA 5 HOH 84 484 482 HOH HOH H . XA 5 HOH 85 485 483 HOH HOH H . XA 5 HOH 86 486 484 HOH HOH H . XA 5 HOH 87 487 485 HOH HOH H . XA 5 HOH 88 488 486 HOH HOH H . XA 5 HOH 89 489 487 HOH HOH H . XA 5 HOH 90 490 488 HOH HOH H . XA 5 HOH 91 491 489 HOH HOH H . XA 5 HOH 92 492 490 HOH HOH H . XA 5 HOH 93 493 491 HOH HOH H . XA 5 HOH 94 494 492 HOH HOH H . XA 5 HOH 95 495 493 HOH HOH H . XA 5 HOH 96 496 494 HOH HOH H . XA 5 HOH 97 497 495 HOH HOH H . XA 5 HOH 98 498 496 HOH HOH H . XA 5 HOH 99 499 497 HOH HOH H . XA 5 HOH 100 500 498 HOH HOH H . XA 5 HOH 101 501 499 HOH HOH H . XA 5 HOH 102 502 500 HOH HOH H . XA 5 HOH 103 503 501 HOH HOH H . XA 5 HOH 104 504 502 HOH HOH H . XA 5 HOH 105 505 503 HOH HOH H . XA 5 HOH 106 506 504 HOH HOH H . XA 5 HOH 107 507 505 HOH HOH H . XA 5 HOH 108 508 506 HOH HOH H . XA 5 HOH 109 509 507 HOH HOH H . XA 5 HOH 110 510 508 HOH HOH H . XA 5 HOH 111 511 509 HOH HOH H . XA 5 HOH 112 512 510 HOH HOH H . XA 5 HOH 113 513 511 HOH HOH H . XA 5 HOH 114 514 512 HOH HOH H . XA 5 HOH 115 515 513 HOH HOH H . XA 5 HOH 116 516 514 HOH HOH H . XA 5 HOH 117 517 515 HOH HOH H . XA 5 HOH 118 518 516 HOH HOH H . XA 5 HOH 119 519 517 HOH HOH H . XA 5 HOH 120 520 518 HOH HOH H . XA 5 HOH 121 521 519 HOH HOH H . XA 5 HOH 122 522 520 HOH HOH H . XA 5 HOH 123 523 521 HOH HOH H . XA 5 HOH 124 524 522 HOH HOH H . XA 5 HOH 125 525 523 HOH HOH H . XA 5 HOH 126 526 524 HOH HOH H . XA 5 HOH 127 527 525 HOH HOH H . XA 5 HOH 128 528 526 HOH HOH H . XA 5 HOH 129 529 527 HOH HOH H . XA 5 HOH 130 530 528 HOH HOH H . XA 5 HOH 131 531 529 HOH HOH H . XA 5 HOH 132 532 530 HOH HOH H . XA 5 HOH 133 533 531 HOH HOH H . XA 5 HOH 134 534 532 HOH HOH H . XA 5 HOH 135 535 533 HOH HOH H . XA 5 HOH 136 536 534 HOH HOH H . XA 5 HOH 137 537 535 HOH HOH H . XA 5 HOH 138 538 536 HOH HOH H . XA 5 HOH 139 539 537 HOH HOH H . XA 5 HOH 140 540 538 HOH HOH H . XA 5 HOH 141 541 539 HOH HOH H . XA 5 HOH 142 542 540 HOH HOH H . XA 5 HOH 143 543 541 HOH HOH H . XA 5 HOH 144 544 542 HOH HOH H . XA 5 HOH 145 545 543 HOH HOH H . XA 5 HOH 146 546 544 HOH HOH H . XA 5 HOH 147 547 545 HOH HOH H . XA 5 HOH 148 548 546 HOH HOH H . XA 5 HOH 149 549 547 HOH HOH H . XA 5 HOH 150 550 548 HOH HOH H . XA 5 HOH 151 551 549 HOH HOH H . XA 5 HOH 152 552 550 HOH HOH H . XA 5 HOH 153 553 551 HOH HOH H . XA 5 HOH 154 554 552 HOH HOH H . XA 5 HOH 155 555 553 HOH HOH H . XA 5 HOH 156 556 554 HOH HOH H . XA 5 HOH 157 557 555 HOH HOH H . XA 5 HOH 158 558 556 HOH HOH H . XA 5 HOH 159 559 557 HOH HOH H . XA 5 HOH 160 560 558 HOH HOH H . XA 5 HOH 161 561 559 HOH HOH H . XA 5 HOH 162 562 560 HOH HOH H . XA 5 HOH 163 563 561 HOH HOH H . XA 5 HOH 164 564 562 HOH HOH H . XA 5 HOH 165 565 563 HOH HOH H . XA 5 HOH 166 566 564 HOH HOH H . XA 5 HOH 167 567 565 HOH HOH H . XA 5 HOH 168 568 566 HOH HOH H . XA 5 HOH 169 569 567 HOH HOH H . XA 5 HOH 170 570 568 HOH HOH H . XA 5 HOH 171 571 569 HOH HOH H . XA 5 HOH 172 572 570 HOH HOH H . XA 5 HOH 173 573 571 HOH HOH H . XA 5 HOH 174 574 572 HOH HOH H . XA 5 HOH 175 575 573 HOH HOH H . XA 5 HOH 176 576 574 HOH HOH H . XA 5 HOH 177 577 575 HOH HOH H . XA 5 HOH 178 578 576 HOH HOH H . XA 5 HOH 179 579 577 HOH HOH H . XA 5 HOH 180 580 578 HOH HOH H . XA 5 HOH 181 581 579 HOH HOH H . XA 5 HOH 182 582 580 HOH HOH H . XA 5 HOH 183 583 581 HOH HOH H . XA 5 HOH 184 584 582 HOH HOH H . XA 5 HOH 185 585 432 HOH HOH H . XA 5 HOH 186 586 445 HOH HOH H . XA 5 HOH 187 587 466 HOH HOH H . XA 5 HOH 188 588 505 HOH HOH H . XA 5 HOH 189 589 534 HOH HOH H . YA 5 HOH 1 401 401 HOH HOH A . YA 5 HOH 2 402 402 HOH HOH A . YA 5 HOH 3 403 403 HOH HOH A . YA 5 HOH 4 404 404 HOH HOH A . YA 5 HOH 5 405 405 HOH HOH A . YA 5 HOH 6 406 406 HOH HOH A . YA 5 HOH 7 407 407 HOH HOH A . YA 5 HOH 8 408 408 HOH HOH A . YA 5 HOH 9 409 409 HOH HOH A . YA 5 HOH 10 410 410 HOH HOH A . YA 5 HOH 11 411 411 HOH HOH A . YA 5 HOH 12 412 412 HOH HOH A . YA 5 HOH 13 413 413 HOH HOH A . YA 5 HOH 14 414 414 HOH HOH A . YA 5 HOH 15 415 415 HOH HOH A . YA 5 HOH 16 416 416 HOH HOH A . YA 5 HOH 17 417 417 HOH HOH A . YA 5 HOH 18 418 418 HOH HOH A . YA 5 HOH 19 419 419 HOH HOH A . YA 5 HOH 20 420 420 HOH HOH A . YA 5 HOH 21 421 421 HOH HOH A . YA 5 HOH 22 422 422 HOH HOH A . YA 5 HOH 23 423 423 HOH HOH A . YA 5 HOH 24 424 424 HOH HOH A . YA 5 HOH 25 425 425 HOH HOH A . YA 5 HOH 26 426 426 HOH HOH A . YA 5 HOH 27 427 427 HOH HOH A . YA 5 HOH 28 428 428 HOH HOH A . YA 5 HOH 29 429 429 HOH HOH A . YA 5 HOH 30 430 430 HOH HOH A . YA 5 HOH 31 431 431 HOH HOH A . YA 5 HOH 32 432 432 HOH HOH A . YA 5 HOH 33 433 433 HOH HOH A . YA 5 HOH 34 434 434 HOH HOH A . YA 5 HOH 35 435 435 HOH HOH A . YA 5 HOH 36 436 436 HOH HOH A . YA 5 HOH 37 437 438 HOH HOH A . YA 5 HOH 38 438 439 HOH HOH A . YA 5 HOH 39 439 440 HOH HOH A . YA 5 HOH 40 440 441 HOH HOH A . YA 5 HOH 41 441 442 HOH HOH A . YA 5 HOH 42 442 443 HOH HOH A . YA 5 HOH 43 443 444 HOH HOH A . YA 5 HOH 44 444 445 HOH HOH A . YA 5 HOH 45 445 446 HOH HOH A . YA 5 HOH 46 446 447 HOH HOH A . YA 5 HOH 47 447 448 HOH HOH A . YA 5 HOH 48 448 449 HOH HOH A . YA 5 HOH 49 449 450 HOH HOH A . YA 5 HOH 50 450 451 HOH HOH A . YA 5 HOH 51 451 452 HOH HOH A . YA 5 HOH 52 452 454 HOH HOH A . YA 5 HOH 53 453 455 HOH HOH A . YA 5 HOH 54 454 456 HOH HOH A . YA 5 HOH 55 455 457 HOH HOH A . YA 5 HOH 56 456 458 HOH HOH A . YA 5 HOH 57 457 459 HOH HOH A . YA 5 HOH 58 458 460 HOH HOH A . YA 5 HOH 59 459 461 HOH HOH A . YA 5 HOH 60 460 462 HOH HOH A . YA 5 HOH 61 461 463 HOH HOH A . YA 5 HOH 62 462 464 HOH HOH A . YA 5 HOH 63 463 465 HOH HOH A . YA 5 HOH 64 464 466 HOH HOH A . YA 5 HOH 65 465 467 HOH HOH A . YA 5 HOH 66 466 468 HOH HOH A . YA 5 HOH 67 467 469 HOH HOH A . YA 5 HOH 68 468 470 HOH HOH A . YA 5 HOH 69 469 471 HOH HOH A . YA 5 HOH 70 470 472 HOH HOH A . YA 5 HOH 71 471 473 HOH HOH A . YA 5 HOH 72 472 474 HOH HOH A . YA 5 HOH 73 473 475 HOH HOH A . YA 5 HOH 74 474 476 HOH HOH A . YA 5 HOH 75 475 477 HOH HOH A . YA 5 HOH 76 476 478 HOH HOH A . YA 5 HOH 77 477 479 HOH HOH A . YA 5 HOH 78 478 480 HOH HOH A . YA 5 HOH 79 479 481 HOH HOH A . YA 5 HOH 80 480 482 HOH HOH A . YA 5 HOH 81 481 483 HOH HOH A . YA 5 HOH 82 482 484 HOH HOH A . YA 5 HOH 83 483 485 HOH HOH A . YA 5 HOH 84 484 486 HOH HOH A . YA 5 HOH 85 485 487 HOH HOH A . YA 5 HOH 86 486 488 HOH HOH A . YA 5 HOH 87 487 489 HOH HOH A . YA 5 HOH 88 488 490 HOH HOH A . YA 5 HOH 89 489 491 HOH HOH A . YA 5 HOH 90 490 492 HOH HOH A . YA 5 HOH 91 491 493 HOH HOH A . YA 5 HOH 92 492 494 HOH HOH A . YA 5 HOH 93 493 495 HOH HOH A . YA 5 HOH 94 494 496 HOH HOH A . YA 5 HOH 95 495 497 HOH HOH A . YA 5 HOH 96 496 498 HOH HOH A . YA 5 HOH 97 497 499 HOH HOH A . YA 5 HOH 98 498 500 HOH HOH A . YA 5 HOH 99 499 501 HOH HOH A . YA 5 HOH 100 500 502 HOH HOH A . YA 5 HOH 101 501 503 HOH HOH A . YA 5 HOH 102 502 504 HOH HOH A . YA 5 HOH 103 503 505 HOH HOH A . YA 5 HOH 104 504 506 HOH HOH A . YA 5 HOH 105 505 507 HOH HOH A . YA 5 HOH 106 506 508 HOH HOH A . YA 5 HOH 107 507 509 HOH HOH A . YA 5 HOH 108 508 510 HOH HOH A . YA 5 HOH 109 509 511 HOH HOH A . YA 5 HOH 110 510 512 HOH HOH A . YA 5 HOH 111 511 513 HOH HOH A . YA 5 HOH 112 512 514 HOH HOH A . YA 5 HOH 113 513 515 HOH HOH A . YA 5 HOH 114 514 516 HOH HOH A . YA 5 HOH 115 515 517 HOH HOH A . YA 5 HOH 116 516 518 HOH HOH A . YA 5 HOH 117 517 519 HOH HOH A . YA 5 HOH 118 518 520 HOH HOH A . YA 5 HOH 119 519 521 HOH HOH A . YA 5 HOH 120 520 522 HOH HOH A . YA 5 HOH 121 521 523 HOH HOH A . YA 5 HOH 122 522 524 HOH HOH A . YA 5 HOH 123 523 525 HOH HOH A . YA 5 HOH 124 524 526 HOH HOH A . YA 5 HOH 125 525 527 HOH HOH A . YA 5 HOH 126 526 528 HOH HOH A . YA 5 HOH 127 527 529 HOH HOH A . YA 5 HOH 128 528 530 HOH HOH A . YA 5 HOH 129 529 531 HOH HOH A . YA 5 HOH 130 530 532 HOH HOH A . YA 5 HOH 131 531 533 HOH HOH A . YA 5 HOH 132 532 534 HOH HOH A . YA 5 HOH 133 533 535 HOH HOH A . YA 5 HOH 134 534 536 HOH HOH A . YA 5 HOH 135 535 537 HOH HOH A . YA 5 HOH 136 536 538 HOH HOH A . YA 5 HOH 137 537 539 HOH HOH A . YA 5 HOH 138 538 540 HOH HOH A . YA 5 HOH 139 539 541 HOH HOH A . YA 5 HOH 140 540 542 HOH HOH A . YA 5 HOH 141 541 543 HOH HOH A . YA 5 HOH 142 542 544 HOH HOH A . YA 5 HOH 143 543 545 HOH HOH A . YA 5 HOH 144 544 546 HOH HOH A . YA 5 HOH 145 545 547 HOH HOH A . YA 5 HOH 146 546 548 HOH HOH A . YA 5 HOH 147 547 549 HOH HOH A . YA 5 HOH 148 548 550 HOH HOH A . YA 5 HOH 149 549 551 HOH HOH A . YA 5 HOH 150 550 552 HOH HOH A . YA 5 HOH 151 551 553 HOH HOH A . YA 5 HOH 152 552 554 HOH HOH A . YA 5 HOH 153 553 555 HOH HOH A . YA 5 HOH 154 554 556 HOH HOH A . YA 5 HOH 155 555 557 HOH HOH A . YA 5 HOH 156 556 558 HOH HOH A . YA 5 HOH 157 557 559 HOH HOH A . YA 5 HOH 158 558 560 HOH HOH A . YA 5 HOH 159 559 561 HOH HOH A . YA 5 HOH 160 560 562 HOH HOH A . YA 5 HOH 161 561 563 HOH HOH A . YA 5 HOH 162 562 564 HOH HOH A . YA 5 HOH 163 563 565 HOH HOH A . YA 5 HOH 164 564 566 HOH HOH A . YA 5 HOH 165 565 567 HOH HOH A . YA 5 HOH 166 566 568 HOH HOH A . YA 5 HOH 167 567 569 HOH HOH A . YA 5 HOH 168 568 570 HOH HOH A . YA 5 HOH 169 569 571 HOH HOH A . YA 5 HOH 170 570 572 HOH HOH A . YA 5 HOH 171 571 573 HOH HOH A . YA 5 HOH 172 572 574 HOH HOH A . YA 5 HOH 173 573 575 HOH HOH A . YA 5 HOH 174 574 576 HOH HOH A . YA 5 HOH 175 575 577 HOH HOH A . YA 5 HOH 176 576 578 HOH HOH A . YA 5 HOH 177 577 579 HOH HOH A . YA 5 HOH 178 578 580 HOH HOH A . YA 5 HOH 179 579 581 HOH HOH A . YA 5 HOH 180 580 582 HOH HOH A . YA 5 HOH 181 581 583 HOH HOH A . YA 5 HOH 182 582 404 HOH HOH A . YA 5 HOH 183 583 438 HOH HOH A . YA 5 HOH 184 584 444 HOH HOH A . YA 5 HOH 185 585 476 HOH HOH A . YA 5 HOH 186 586 490 HOH HOH A . ZA 5 HOH 1 401 437 HOH HOH B . ZA 5 HOH 2 402 453 HOH HOH B . ZA 5 HOH 3 403 401 HOH HOH B . ZA 5 HOH 4 404 402 HOH HOH B . ZA 5 HOH 5 405 403 HOH HOH B . ZA 5 HOH 6 406 405 HOH HOH B . ZA 5 HOH 7 407 406 HOH HOH B . ZA 5 HOH 8 408 407 HOH HOH B . ZA 5 HOH 9 409 408 HOH HOH B . ZA 5 HOH 10 410 409 HOH HOH B . ZA 5 HOH 11 411 410 HOH HOH B . ZA 5 HOH 12 412 411 HOH HOH B . ZA 5 HOH 13 413 412 HOH HOH B . ZA 5 HOH 14 414 413 HOH HOH B . ZA 5 HOH 15 415 414 HOH HOH B . ZA 5 HOH 16 416 415 HOH HOH B . ZA 5 HOH 17 417 416 HOH HOH B . ZA 5 HOH 18 418 417 HOH HOH B . ZA 5 HOH 19 419 418 HOH HOH B . ZA 5 HOH 20 420 419 HOH HOH B . ZA 5 HOH 21 421 420 HOH HOH B . ZA 5 HOH 22 422 421 HOH HOH B . ZA 5 HOH 23 423 422 HOH HOH B . ZA 5 HOH 24 424 424 HOH HOH B . ZA 5 HOH 25 425 425 HOH HOH B . ZA 5 HOH 26 426 426 HOH HOH B . ZA 5 HOH 27 427 427 HOH HOH B . ZA 5 HOH 28 428 428 HOH HOH B . ZA 5 HOH 29 429 429 HOH HOH B . ZA 5 HOH 30 430 430 HOH HOH B . ZA 5 HOH 31 431 431 HOH HOH B . ZA 5 HOH 32 432 432 HOH HOH B . ZA 5 HOH 33 433 433 HOH HOH B . ZA 5 HOH 34 434 434 HOH HOH B . ZA 5 HOH 35 435 435 HOH HOH B . ZA 5 HOH 36 436 436 HOH HOH B . ZA 5 HOH 37 437 437 HOH HOH B . ZA 5 HOH 38 438 439 HOH HOH B . ZA 5 HOH 39 439 440 HOH HOH B . ZA 5 HOH 40 440 441 HOH HOH B . ZA 5 HOH 41 441 442 HOH HOH B . ZA 5 HOH 42 442 443 HOH HOH B . ZA 5 HOH 43 443 445 HOH HOH B . ZA 5 HOH 44 444 446 HOH HOH B . ZA 5 HOH 45 445 447 HOH HOH B . ZA 5 HOH 46 446 448 HOH HOH B . ZA 5 HOH 47 447 449 HOH HOH B . ZA 5 HOH 48 448 450 HOH HOH B . ZA 5 HOH 49 449 451 HOH HOH B . ZA 5 HOH 50 450 452 HOH HOH B . ZA 5 HOH 51 451 453 HOH HOH B . ZA 5 HOH 52 452 454 HOH HOH B . ZA 5 HOH 53 453 455 HOH HOH B . ZA 5 HOH 54 454 456 HOH HOH B . ZA 5 HOH 55 455 457 HOH HOH B . ZA 5 HOH 56 456 458 HOH HOH B . ZA 5 HOH 57 457 459 HOH HOH B . ZA 5 HOH 58 458 460 HOH HOH B . ZA 5 HOH 59 459 461 HOH HOH B . ZA 5 HOH 60 460 462 HOH HOH B . ZA 5 HOH 61 461 463 HOH HOH B . ZA 5 HOH 62 462 464 HOH HOH B . ZA 5 HOH 63 463 465 HOH HOH B . ZA 5 HOH 64 464 466 HOH HOH B . ZA 5 HOH 65 465 467 HOH HOH B . ZA 5 HOH 66 466 468 HOH HOH B . ZA 5 HOH 67 467 469 HOH HOH B . ZA 5 HOH 68 468 470 HOH HOH B . ZA 5 HOH 69 469 471 HOH HOH B . ZA 5 HOH 70 470 472 HOH HOH B . ZA 5 HOH 71 471 473 HOH HOH B . ZA 5 HOH 72 472 474 HOH HOH B . ZA 5 HOH 73 473 475 HOH HOH B . ZA 5 HOH 74 474 477 HOH HOH B . ZA 5 HOH 75 475 478 HOH HOH B . ZA 5 HOH 76 476 479 HOH HOH B . ZA 5 HOH 77 477 480 HOH HOH B . ZA 5 HOH 78 478 481 HOH HOH B . ZA 5 HOH 79 479 482 HOH HOH B . ZA 5 HOH 80 480 483 HOH HOH B . ZA 5 HOH 81 481 484 HOH HOH B . ZA 5 HOH 82 482 485 HOH HOH B . ZA 5 HOH 83 483 486 HOH HOH B . ZA 5 HOH 84 484 487 HOH HOH B . ZA 5 HOH 85 485 488 HOH HOH B . ZA 5 HOH 86 486 489 HOH HOH B . ZA 5 HOH 87 487 491 HOH HOH B . ZA 5 HOH 88 488 492 HOH HOH B . ZA 5 HOH 89 489 493 HOH HOH B . ZA 5 HOH 90 490 494 HOH HOH B . ZA 5 HOH 91 491 495 HOH HOH B . ZA 5 HOH 92 492 496 HOH HOH B . ZA 5 HOH 93 493 497 HOH HOH B . ZA 5 HOH 94 494 498 HOH HOH B . ZA 5 HOH 95 495 499 HOH HOH B . ZA 5 HOH 96 496 500 HOH HOH B . ZA 5 HOH 97 497 501 HOH HOH B . ZA 5 HOH 98 498 502 HOH HOH B . ZA 5 HOH 99 499 503 HOH HOH B . ZA 5 HOH 100 500 504 HOH HOH B . ZA 5 HOH 101 501 505 HOH HOH B . ZA 5 HOH 102 502 506 HOH HOH B . ZA 5 HOH 103 503 507 HOH HOH B . ZA 5 HOH 104 504 508 HOH HOH B . ZA 5 HOH 105 505 509 HOH HOH B . ZA 5 HOH 106 506 510 HOH HOH B . ZA 5 HOH 107 507 511 HOH HOH B . ZA 5 HOH 108 508 512 HOH HOH B . ZA 5 HOH 109 509 513 HOH HOH B . ZA 5 HOH 110 510 514 HOH HOH B . ZA 5 HOH 111 511 515 HOH HOH B . ZA 5 HOH 112 512 516 HOH HOH B . ZA 5 HOH 113 513 517 HOH HOH B . ZA 5 HOH 114 514 518 HOH HOH B . ZA 5 HOH 115 515 519 HOH HOH B . ZA 5 HOH 116 516 520 HOH HOH B . ZA 5 HOH 117 517 521 HOH HOH B . ZA 5 HOH 118 518 522 HOH HOH B . ZA 5 HOH 119 519 523 HOH HOH B . ZA 5 HOH 120 520 524 HOH HOH B . ZA 5 HOH 121 521 525 HOH HOH B . ZA 5 HOH 122 522 526 HOH HOH B . ZA 5 HOH 123 523 527 HOH HOH B . ZA 5 HOH 124 524 528 HOH HOH B . ZA 5 HOH 125 525 529 HOH HOH B . ZA 5 HOH 126 526 530 HOH HOH B . ZA 5 HOH 127 527 531 HOH HOH B . ZA 5 HOH 128 528 532 HOH HOH B . ZA 5 HOH 129 529 533 HOH HOH B . ZA 5 HOH 130 530 534 HOH HOH B . ZA 5 HOH 131 531 535 HOH HOH B . ZA 5 HOH 132 532 536 HOH HOH B . ZA 5 HOH 133 533 537 HOH HOH B . ZA 5 HOH 134 534 538 HOH HOH B . ZA 5 HOH 135 535 539 HOH HOH B . ZA 5 HOH 136 536 540 HOH HOH B . ZA 5 HOH 137 537 541 HOH HOH B . ZA 5 HOH 138 538 542 HOH HOH B . ZA 5 HOH 139 539 543 HOH HOH B . ZA 5 HOH 140 540 544 HOH HOH B . ZA 5 HOH 141 541 545 HOH HOH B . ZA 5 HOH 142 542 546 HOH HOH B . ZA 5 HOH 143 543 547 HOH HOH B . ZA 5 HOH 144 544 548 HOH HOH B . ZA 5 HOH 145 545 549 HOH HOH B . ZA 5 HOH 146 546 550 HOH HOH B . ZA 5 HOH 147 547 551 HOH HOH B . ZA 5 HOH 148 548 552 HOH HOH B . ZA 5 HOH 149 549 553 HOH HOH B . ZA 5 HOH 150 550 554 HOH HOH B . ZA 5 HOH 151 551 555 HOH HOH B . ZA 5 HOH 152 552 560 HOH HOH B . AB 5 HOH 1 401 401 HOH HOH C . AB 5 HOH 2 402 402 HOH HOH C . AB 5 HOH 3 403 403 HOH HOH C . AB 5 HOH 4 404 404 HOH HOH C . AB 5 HOH 5 405 405 HOH HOH C . AB 5 HOH 6 406 406 HOH HOH C . AB 5 HOH 7 407 407 HOH HOH C . AB 5 HOH 8 408 408 HOH HOH C . AB 5 HOH 9 409 409 HOH HOH C . AB 5 HOH 10 410 410 HOH HOH C . AB 5 HOH 11 411 411 HOH HOH C . AB 5 HOH 12 412 412 HOH HOH C . AB 5 HOH 13 413 413 HOH HOH C . AB 5 HOH 14 414 414 HOH HOH C . AB 5 HOH 15 415 415 HOH HOH C . AB 5 HOH 16 416 416 HOH HOH C . AB 5 HOH 17 417 417 HOH HOH C . AB 5 HOH 18 418 418 HOH HOH C . AB 5 HOH 19 419 419 HOH HOH C . AB 5 HOH 20 420 420 HOH HOH C . AB 5 HOH 21 421 422 HOH HOH C . AB 5 HOH 22 422 423 HOH HOH C . AB 5 HOH 23 423 424 HOH HOH C . AB 5 HOH 24 424 425 HOH HOH C . AB 5 HOH 25 425 426 HOH HOH C . AB 5 HOH 26 426 427 HOH HOH C . AB 5 HOH 27 427 428 HOH HOH C . AB 5 HOH 28 428 429 HOH HOH C . AB 5 HOH 29 429 430 HOH HOH C . AB 5 HOH 30 430 431 HOH HOH C . AB 5 HOH 31 431 432 HOH HOH C . AB 5 HOH 32 432 433 HOH HOH C . AB 5 HOH 33 433 434 HOH HOH C . AB 5 HOH 34 434 435 HOH HOH C . AB 5 HOH 35 435 436 HOH HOH C . AB 5 HOH 36 436 437 HOH HOH C . AB 5 HOH 37 437 438 HOH HOH C . AB 5 HOH 38 438 439 HOH HOH C . AB 5 HOH 39 439 440 HOH HOH C . AB 5 HOH 40 440 441 HOH HOH C . AB 5 HOH 41 441 442 HOH HOH C . AB 5 HOH 42 442 443 HOH HOH C . AB 5 HOH 43 443 444 HOH HOH C . AB 5 HOH 44 444 445 HOH HOH C . AB 5 HOH 45 445 446 HOH HOH C . AB 5 HOH 46 446 447 HOH HOH C . AB 5 HOH 47 447 448 HOH HOH C . AB 5 HOH 48 448 449 HOH HOH C . AB 5 HOH 49 449 450 HOH HOH C . AB 5 HOH 50 450 451 HOH HOH C . AB 5 HOH 51 451 452 HOH HOH C . AB 5 HOH 52 452 453 HOH HOH C . AB 5 HOH 53 453 454 HOH HOH C . AB 5 HOH 54 454 455 HOH HOH C . AB 5 HOH 55 455 456 HOH HOH C . AB 5 HOH 56 456 457 HOH HOH C . AB 5 HOH 57 457 458 HOH HOH C . AB 5 HOH 58 458 459 HOH HOH C . AB 5 HOH 59 459 460 HOH HOH C . AB 5 HOH 60 460 461 HOH HOH C . AB 5 HOH 61 461 462 HOH HOH C . AB 5 HOH 62 462 463 HOH HOH C . AB 5 HOH 63 463 464 HOH HOH C . AB 5 HOH 64 464 465 HOH HOH C . AB 5 HOH 65 465 466 HOH HOH C . AB 5 HOH 66 466 467 HOH HOH C . AB 5 HOH 67 467 468 HOH HOH C . AB 5 HOH 68 468 469 HOH HOH C . AB 5 HOH 69 469 470 HOH HOH C . AB 5 HOH 70 470 471 HOH HOH C . AB 5 HOH 71 471 472 HOH HOH C . AB 5 HOH 72 472 473 HOH HOH C . AB 5 HOH 73 473 474 HOH HOH C . AB 5 HOH 74 474 475 HOH HOH C . AB 5 HOH 75 475 476 HOH HOH C . AB 5 HOH 76 476 477 HOH HOH C . AB 5 HOH 77 477 478 HOH HOH C . AB 5 HOH 78 478 479 HOH HOH C . AB 5 HOH 79 479 480 HOH HOH C . AB 5 HOH 80 480 481 HOH HOH C . AB 5 HOH 81 481 482 HOH HOH C . AB 5 HOH 82 482 483 HOH HOH C . AB 5 HOH 83 483 484 HOH HOH C . AB 5 HOH 84 484 485 HOH HOH C . AB 5 HOH 85 485 486 HOH HOH C . AB 5 HOH 86 486 487 HOH HOH C . AB 5 HOH 87 487 488 HOH HOH C . AB 5 HOH 88 488 489 HOH HOH C . AB 5 HOH 89 489 490 HOH HOH C . AB 5 HOH 90 490 491 HOH HOH C . AB 5 HOH 91 491 492 HOH HOH C . AB 5 HOH 92 492 493 HOH HOH C . AB 5 HOH 93 493 494 HOH HOH C . AB 5 HOH 94 494 495 HOH HOH C . AB 5 HOH 95 495 496 HOH HOH C . AB 5 HOH 96 496 497 HOH HOH C . AB 5 HOH 97 497 498 HOH HOH C . AB 5 HOH 98 498 499 HOH HOH C . AB 5 HOH 99 499 500 HOH HOH C . AB 5 HOH 100 500 501 HOH HOH C . AB 5 HOH 101 501 502 HOH HOH C . BB 5 HOH 1 401 421 HOH HOH D . BB 5 HOH 2 402 409 HOH HOH D . BB 5 HOH 3 403 425 HOH HOH D . BB 5 HOH 4 404 401 HOH HOH D . BB 5 HOH 5 405 402 HOH HOH D . BB 5 HOH 6 406 403 HOH HOH D . BB 5 HOH 7 407 404 HOH HOH D . BB 5 HOH 8 408 405 HOH HOH D . BB 5 HOH 9 409 406 HOH HOH D . BB 5 HOH 10 410 407 HOH HOH D . BB 5 HOH 11 411 408 HOH HOH D . BB 5 HOH 12 412 409 HOH HOH D . BB 5 HOH 13 413 410 HOH HOH D . BB 5 HOH 14 414 411 HOH HOH D . BB 5 HOH 15 415 412 HOH HOH D . BB 5 HOH 16 416 413 HOH HOH D . BB 5 HOH 17 417 414 HOH HOH D . BB 5 HOH 18 418 415 HOH HOH D . BB 5 HOH 19 419 416 HOH HOH D . BB 5 HOH 20 420 417 HOH HOH D . BB 5 HOH 21 421 418 HOH HOH D . BB 5 HOH 22 422 419 HOH HOH D . BB 5 HOH 23 423 420 HOH HOH D . BB 5 HOH 24 424 421 HOH HOH D . BB 5 HOH 25 425 422 HOH HOH D . BB 5 HOH 26 426 423 HOH HOH D . BB 5 HOH 27 427 424 HOH HOH D . BB 5 HOH 28 428 425 HOH HOH D . BB 5 HOH 29 429 426 HOH HOH D . BB 5 HOH 30 430 427 HOH HOH D . BB 5 HOH 31 431 428 HOH HOH D . BB 5 HOH 32 432 429 HOH HOH D . BB 5 HOH 33 433 430 HOH HOH D . BB 5 HOH 34 434 431 HOH HOH D . BB 5 HOH 35 435 433 HOH HOH D . BB 5 HOH 36 436 434 HOH HOH D . BB 5 HOH 37 437 435 HOH HOH D . BB 5 HOH 38 438 436 HOH HOH D . BB 5 HOH 39 439 437 HOH HOH D . BB 5 HOH 40 440 438 HOH HOH D . BB 5 HOH 41 441 439 HOH HOH D . BB 5 HOH 42 442 440 HOH HOH D . BB 5 HOH 43 443 441 HOH HOH D . BB 5 HOH 44 444 442 HOH HOH D . BB 5 HOH 45 445 443 HOH HOH D . BB 5 HOH 46 446 444 HOH HOH D . BB 5 HOH 47 447 446 HOH HOH D . BB 5 HOH 48 448 447 HOH HOH D . BB 5 HOH 49 449 448 HOH HOH D . BB 5 HOH 50 450 449 HOH HOH D . BB 5 HOH 51 451 451 HOH HOH D . BB 5 HOH 52 452 452 HOH HOH D . BB 5 HOH 53 453 453 HOH HOH D . BB 5 HOH 54 454 454 HOH HOH D . BB 5 HOH 55 455 455 HOH HOH D . BB 5 HOH 56 456 456 HOH HOH D . BB 5 HOH 57 457 457 HOH HOH D . BB 5 HOH 58 458 458 HOH HOH D . BB 5 HOH 59 459 459 HOH HOH D . BB 5 HOH 60 460 460 HOH HOH D . BB 5 HOH 61 461 461 HOH HOH D . BB 5 HOH 62 462 462 HOH HOH D . BB 5 HOH 63 463 463 HOH HOH D . BB 5 HOH 64 464 464 HOH HOH D . BB 5 HOH 65 465 465 HOH HOH D . BB 5 HOH 66 466 467 HOH HOH D . BB 5 HOH 67 467 468 HOH HOH D . BB 5 HOH 68 468 469 HOH HOH D . BB 5 HOH 69 469 470 HOH HOH D . BB 5 HOH 70 470 471 HOH HOH D . BB 5 HOH 71 471 472 HOH HOH D . BB 5 HOH 72 472 473 HOH HOH D . BB 5 HOH 73 473 474 HOH HOH D . BB 5 HOH 74 474 475 HOH HOH D . BB 5 HOH 75 475 476 HOH HOH D . BB 5 HOH 76 476 477 HOH HOH D . BB 5 HOH 77 477 478 HOH HOH D . BB 5 HOH 78 478 479 HOH HOH D . BB 5 HOH 79 479 480 HOH HOH D . BB 5 HOH 80 480 481 HOH HOH D . BB 5 HOH 81 481 482 HOH HOH D . BB 5 HOH 82 482 483 HOH HOH D . BB 5 HOH 83 483 484 HOH HOH D . BB 5 HOH 84 484 485 HOH HOH D . BB 5 HOH 85 485 486 HOH HOH D . BB 5 HOH 86 486 487 HOH HOH D . BB 5 HOH 87 487 488 HOH HOH D . BB 5 HOH 88 488 489 HOH HOH D . BB 5 HOH 89 489 490 HOH HOH D . BB 5 HOH 90 490 491 HOH HOH D . BB 5 HOH 91 491 492 HOH HOH D . BB 5 HOH 92 492 493 HOH HOH D . BB 5 HOH 93 493 494 HOH HOH D . BB 5 HOH 94 494 495 HOH HOH D . BB 5 HOH 95 495 496 HOH HOH D . BB 5 HOH 96 496 497 HOH HOH D . BB 5 HOH 97 497 498 HOH HOH D . BB 5 HOH 98 498 499 HOH HOH D . BB 5 HOH 99 499 500 HOH HOH D . BB 5 HOH 100 500 501 HOH HOH D . BB 5 HOH 101 501 502 HOH HOH D . BB 5 HOH 102 502 503 HOH HOH D . BB 5 HOH 103 503 504 HOH HOH D . BB 5 HOH 104 504 506 HOH HOH D . BB 5 HOH 105 505 507 HOH HOH D . BB 5 HOH 106 506 508 HOH HOH D . BB 5 HOH 107 507 509 HOH HOH D . BB 5 HOH 108 508 510 HOH HOH D . BB 5 HOH 109 509 511 HOH HOH D . BB 5 HOH 110 510 512 HOH HOH D . BB 5 HOH 111 511 513 HOH HOH D . BB 5 HOH 112 512 514 HOH HOH D . BB 5 HOH 113 513 515 HOH HOH D . BB 5 HOH 114 514 516 HOH HOH D . BB 5 HOH 115 515 517 HOH HOH D . BB 5 HOH 116 516 518 HOH HOH D . BB 5 HOH 117 517 519 HOH HOH D . BB 5 HOH 118 518 520 HOH HOH D . BB 5 HOH 119 519 521 HOH HOH D . BB 5 HOH 120 520 522 HOH HOH D . BB 5 HOH 121 521 524 HOH HOH D . BB 5 HOH 122 522 525 HOH HOH D . BB 5 HOH 123 523 526 HOH HOH D . BB 5 HOH 124 524 527 HOH HOH D . BB 5 HOH 125 525 528 HOH HOH D . BB 5 HOH 126 526 529 HOH HOH D . BB 5 HOH 127 527 530 HOH HOH D . BB 5 HOH 128 528 531 HOH HOH D . BB 5 HOH 129 529 532 HOH HOH D . BB 5 HOH 130 530 533 HOH HOH D . BB 5 HOH 131 531 535 HOH HOH D . BB 5 HOH 132 532 536 HOH HOH D . BB 5 HOH 133 533 537 HOH HOH D . BB 5 HOH 134 534 538 HOH HOH D . BB 5 HOH 135 535 539 HOH HOH D . BB 5 HOH 136 536 540 HOH HOH D . BB 5 HOH 137 537 541 HOH HOH D . BB 5 HOH 138 538 542 HOH HOH D . BB 5 HOH 139 539 543 HOH HOH D . BB 5 HOH 140 540 544 HOH HOH D . BB 5 HOH 141 541 545 HOH HOH D . BB 5 HOH 142 542 546 HOH HOH D . BB 5 HOH 143 543 549 HOH HOH D . BB 5 HOH 144 544 550 HOH HOH D . BB 5 HOH 145 545 552 HOH HOH D . BB 5 HOH 146 546 553 HOH HOH D . BB 5 HOH 147 547 554 HOH HOH D . BB 5 HOH 148 548 556 HOH HOH D . BB 5 HOH 149 549 557 HOH HOH D . BB 5 HOH 150 550 558 HOH HOH D . BB 5 HOH 151 551 559 HOH HOH D . BB 5 HOH 152 552 561 HOH HOH D . BB 5 HOH 153 553 562 HOH HOH D . BB 5 HOH 154 554 563 HOH HOH D . BB 5 HOH 155 555 564 HOH HOH D . BB 5 HOH 156 556 565 HOH HOH D . BB 5 HOH 157 557 566 HOH HOH D . BB 5 HOH 158 558 567 HOH HOH D . BB 5 HOH 159 559 568 HOH HOH D . BB 5 HOH 160 560 569 HOH HOH D . BB 5 HOH 161 561 570 HOH HOH D . BB 5 HOH 162 562 571 HOH HOH D . BB 5 HOH 163 563 573 HOH HOH D . BB 5 HOH 164 564 574 HOH HOH D . CB 5 HOH 1 401 401 HOH HOH E . CB 5 HOH 2 402 402 HOH HOH E . CB 5 HOH 3 403 403 HOH HOH E . CB 5 HOH 4 404 404 HOH HOH E . CB 5 HOH 5 405 405 HOH HOH E . CB 5 HOH 6 406 406 HOH HOH E . CB 5 HOH 7 407 407 HOH HOH E . CB 5 HOH 8 408 408 HOH HOH E . CB 5 HOH 9 409 409 HOH HOH E . CB 5 HOH 10 410 410 HOH HOH E . CB 5 HOH 11 411 411 HOH HOH E . CB 5 HOH 12 412 412 HOH HOH E . CB 5 HOH 13 413 413 HOH HOH E . CB 5 HOH 14 414 414 HOH HOH E . CB 5 HOH 15 415 415 HOH HOH E . CB 5 HOH 16 416 416 HOH HOH E . CB 5 HOH 17 417 417 HOH HOH E . CB 5 HOH 18 418 418 HOH HOH E . CB 5 HOH 19 419 419 HOH HOH E . CB 5 HOH 20 420 420 HOH HOH E . CB 5 HOH 21 421 421 HOH HOH E . CB 5 HOH 22 422 422 HOH HOH E . CB 5 HOH 23 423 423 HOH HOH E . CB 5 HOH 24 424 424 HOH HOH E . CB 5 HOH 25 425 425 HOH HOH E . CB 5 HOH 26 426 426 HOH HOH E . CB 5 HOH 27 427 427 HOH HOH E . CB 5 HOH 28 428 428 HOH HOH E . CB 5 HOH 29 429 429 HOH HOH E . CB 5 HOH 30 430 430 HOH HOH E . CB 5 HOH 31 431 431 HOH HOH E . CB 5 HOH 32 432 432 HOH HOH E . CB 5 HOH 33 433 433 HOH HOH E . CB 5 HOH 34 434 434 HOH HOH E . CB 5 HOH 35 435 435 HOH HOH E . CB 5 HOH 36 436 436 HOH HOH E . CB 5 HOH 37 437 437 HOH HOH E . CB 5 HOH 38 438 438 HOH HOH E . CB 5 HOH 39 439 439 HOH HOH E . CB 5 HOH 40 440 440 HOH HOH E . CB 5 HOH 41 441 441 HOH HOH E . CB 5 HOH 42 442 442 HOH HOH E . CB 5 HOH 43 443 443 HOH HOH E . CB 5 HOH 44 444 444 HOH HOH E . CB 5 HOH 45 445 445 HOH HOH E . CB 5 HOH 46 446 446 HOH HOH E . CB 5 HOH 47 447 448 HOH HOH E . CB 5 HOH 48 448 449 HOH HOH E . CB 5 HOH 49 449 450 HOH HOH E . CB 5 HOH 50 450 451 HOH HOH E . CB 5 HOH 51 451 452 HOH HOH E . CB 5 HOH 52 452 453 HOH HOH E . CB 5 HOH 53 453 454 HOH HOH E . CB 5 HOH 54 454 455 HOH HOH E . CB 5 HOH 55 455 456 HOH HOH E . CB 5 HOH 56 456 457 HOH HOH E . CB 5 HOH 57 457 458 HOH HOH E . CB 5 HOH 58 458 459 HOH HOH E . CB 5 HOH 59 459 460 HOH HOH E . CB 5 HOH 60 460 461 HOH HOH E . CB 5 HOH 61 461 462 HOH HOH E . CB 5 HOH 62 462 463 HOH HOH E . CB 5 HOH 63 463 464 HOH HOH E . CB 5 HOH 64 464 465 HOH HOH E . CB 5 HOH 65 465 436 HOH HOH E . CB 5 HOH 66 466 480 HOH HOH E . DB 5 HOH 1 401 447 HOH HOH F . DB 5 HOH 2 402 423 HOH HOH F . DB 5 HOH 3 403 450 HOH HOH F . DB 5 HOH 4 404 523 HOH HOH F . DB 5 HOH 5 405 547 HOH HOH F . DB 5 HOH 6 406 548 HOH HOH F . DB 5 HOH 7 407 551 HOH HOH F . DB 5 HOH 8 408 572 HOH HOH F . DB 5 HOH 9 409 401 HOH HOH F . DB 5 HOH 10 410 402 HOH HOH F . DB 5 HOH 11 411 403 HOH HOH F . DB 5 HOH 12 412 404 HOH HOH F . DB 5 HOH 13 413 405 HOH HOH F . DB 5 HOH 14 414 406 HOH HOH F . DB 5 HOH 15 415 407 HOH HOH F . DB 5 HOH 16 416 408 HOH HOH F . DB 5 HOH 17 417 409 HOH HOH F . DB 5 HOH 18 418 410 HOH HOH F . DB 5 HOH 19 419 411 HOH HOH F . DB 5 HOH 20 420 412 HOH HOH F . DB 5 HOH 21 421 413 HOH HOH F . DB 5 HOH 22 422 414 HOH HOH F . DB 5 HOH 23 423 415 HOH HOH F . DB 5 HOH 24 424 416 HOH HOH F . DB 5 HOH 25 425 417 HOH HOH F . DB 5 HOH 26 426 418 HOH HOH F . DB 5 HOH 27 427 419 HOH HOH F . DB 5 HOH 28 428 420 HOH HOH F . DB 5 HOH 29 429 421 HOH HOH F . DB 5 HOH 30 430 422 HOH HOH F . DB 5 HOH 31 431 423 HOH HOH F . DB 5 HOH 32 432 424 HOH HOH F . DB 5 HOH 33 433 425 HOH HOH F . DB 5 HOH 34 434 426 HOH HOH F . DB 5 HOH 35 435 427 HOH HOH F . DB 5 HOH 36 436 428 HOH HOH F . DB 5 HOH 37 437 429 HOH HOH F . DB 5 HOH 38 438 430 HOH HOH F . DB 5 HOH 39 439 431 HOH HOH F . DB 5 HOH 40 440 432 HOH HOH F . DB 5 HOH 41 441 433 HOH HOH F . DB 5 HOH 42 442 434 HOH HOH F . DB 5 HOH 43 443 435 HOH HOH F . DB 5 HOH 44 444 437 HOH HOH F . DB 5 HOH 45 445 438 HOH HOH F . DB 5 HOH 46 446 439 HOH HOH F . DB 5 HOH 47 447 440 HOH HOH F . DB 5 HOH 48 448 441 HOH HOH F . DB 5 HOH 49 449 442 HOH HOH F . DB 5 HOH 50 450 443 HOH HOH F . DB 5 HOH 51 451 444 HOH HOH F . DB 5 HOH 52 452 445 HOH HOH F . DB 5 HOH 53 453 446 HOH HOH F . DB 5 HOH 54 454 447 HOH HOH F . DB 5 HOH 55 455 448 HOH HOH F . DB 5 HOH 56 456 449 HOH HOH F . DB 5 HOH 57 457 450 HOH HOH F . DB 5 HOH 58 458 451 HOH HOH F . DB 5 HOH 59 459 452 HOH HOH F . DB 5 HOH 60 460 453 HOH HOH F . DB 5 HOH 61 461 454 HOH HOH F . DB 5 HOH 62 462 455 HOH HOH F . DB 5 HOH 63 463 456 HOH HOH F . DB 5 HOH 64 464 457 HOH HOH F . DB 5 HOH 65 465 458 HOH HOH F . DB 5 HOH 66 466 459 HOH HOH F . DB 5 HOH 67 467 460 HOH HOH F . DB 5 HOH 68 468 461 HOH HOH F . DB 5 HOH 69 469 462 HOH HOH F . DB 5 HOH 70 470 463 HOH HOH F . DB 5 HOH 71 471 464 HOH HOH F . DB 5 HOH 72 472 465 HOH HOH F . DB 5 HOH 73 473 466 HOH HOH F . DB 5 HOH 74 474 467 HOH HOH F . DB 5 HOH 75 475 468 HOH HOH F . DB 5 HOH 76 476 469 HOH HOH F . DB 5 HOH 77 477 470 HOH HOH F . DB 5 HOH 78 478 471 HOH HOH F . DB 5 HOH 79 479 472 HOH HOH F . DB 5 HOH 80 480 473 HOH HOH F . DB 5 HOH 81 481 474 HOH HOH F . DB 5 HOH 82 482 475 HOH HOH F . DB 5 HOH 83 483 476 HOH HOH F . DB 5 HOH 84 484 477 HOH HOH F . DB 5 HOH 85 485 478 HOH HOH F . DB 5 HOH 86 486 479 HOH HOH F . DB 5 HOH 87 487 481 HOH HOH F . DB 5 HOH 88 488 482 HOH HOH F . DB 5 HOH 89 489 483 HOH HOH F . DB 5 HOH 90 490 484 HOH HOH F . DB 5 HOH 91 491 485 HOH HOH F . DB 5 HOH 92 492 486 HOH HOH F . DB 5 HOH 93 493 487 HOH HOH F . DB 5 HOH 94 494 488 HOH HOH F . DB 5 HOH 95 495 489 HOH HOH F . DB 5 HOH 96 496 490 HOH HOH F . DB 5 HOH 97 497 491 HOH HOH F . DB 5 HOH 98 498 492 HOH HOH F . DB 5 HOH 99 499 493 HOH HOH F . DB 5 HOH 100 500 494 HOH HOH F . DB 5 HOH 101 501 495 HOH HOH F . DB 5 HOH 102 502 496 HOH HOH F . DB 5 HOH 103 503 497 HOH HOH F . DB 5 HOH 104 504 498 HOH HOH F . DB 5 HOH 105 505 499 HOH HOH F . DB 5 HOH 106 506 500 HOH HOH F . DB 5 HOH 107 507 501 HOH HOH F . DB 5 HOH 108 508 502 HOH HOH F . DB 5 HOH 109 509 503 HOH HOH F . DB 5 HOH 110 510 504 HOH HOH F . DB 5 HOH 111 511 505 HOH HOH F . DB 5 HOH 112 512 506 HOH HOH F . DB 5 HOH 113 513 507 HOH HOH F . DB 5 HOH 114 514 508 HOH HOH F . DB 5 HOH 115 515 509 HOH HOH F . DB 5 HOH 116 516 510 HOH HOH F . DB 5 HOH 117 517 511 HOH HOH F . DB 5 HOH 118 518 512 HOH HOH F . DB 5 HOH 119 519 513 HOH HOH F . DB 5 HOH 120 520 514 HOH HOH F . DB 5 HOH 121 521 515 HOH HOH F . DB 5 HOH 122 522 516 HOH HOH F . DB 5 HOH 123 523 517 HOH HOH F . DB 5 HOH 124 524 518 HOH HOH F . DB 5 HOH 125 525 519 HOH HOH F . DB 5 HOH 126 526 520 HOH HOH F . DB 5 HOH 127 527 521 HOH HOH F . DB 5 HOH 128 528 522 HOH HOH F . DB 5 HOH 129 529 523 HOH HOH F . DB 5 HOH 130 530 524 HOH HOH F . DB 5 HOH 131 531 525 HOH HOH F . DB 5 HOH 132 532 526 HOH HOH F . DB 5 HOH 133 533 527 HOH HOH F . DB 5 HOH 134 534 528 HOH HOH F . DB 5 HOH 135 535 529 HOH HOH F . DB 5 HOH 136 536 530 HOH HOH F . DB 5 HOH 137 537 531 HOH HOH F . DB 5 HOH 138 538 532 HOH HOH F . DB 5 HOH 139 539 533 HOH HOH F . DB 5 HOH 140 540 534 HOH HOH F . DB 5 HOH 141 541 535 HOH HOH F . DB 5 HOH 142 542 536 HOH HOH F . DB 5 HOH 143 543 537 HOH HOH F . DB 5 HOH 144 544 538 HOH HOH F . DB 5 HOH 145 545 539 HOH HOH F . DB 5 HOH 146 546 540 HOH HOH F . DB 5 HOH 147 547 541 HOH HOH F . DB 5 HOH 148 548 542 HOH HOH F . DB 5 HOH 149 549 543 HOH HOH F . DB 5 HOH 150 550 544 HOH HOH F . DB 5 HOH 151 551 545 HOH HOH F . DB 5 HOH 152 552 546 HOH HOH F . DB 5 HOH 153 553 547 HOH HOH F . DB 5 HOH 154 554 548 HOH HOH F . DB 5 HOH 155 555 549 HOH HOH F . DB 5 HOH 156 556 550 HOH HOH F . DB 5 HOH 157 557 551 HOH HOH F . DB 5 HOH 158 558 552 HOH HOH F . DB 5 HOH 159 559 553 HOH HOH F . DB 5 HOH 160 560 554 HOH HOH F . DB 5 HOH 161 561 555 HOH HOH F . #