data_4MA1 # _entry.id 4MA1 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4MA1 RCSB RCSB081654 WWPDB D_1000081654 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 4M7J 'Same protein in complex with Kdo(2.8)Kdo(2.4)Kdo trisaccharide' unspecified PDB 4M7Z 'Same protein, unliganded structure 1' unspecified PDB 4M93 'Same protein, unliganded structure 2' unspecified # _pdbx_database_status.entry_id 4MA1 _pdbx_database_status.status_code REL _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.recvd_initial_deposition_date 2013-08-15 _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 'Haji-Ghassemi, O.' 1 'Evans, S.V.' 2 # _citation.id primary _citation.title ;Groove-type Recognition of Chlamydiaceae-specific Lipopolysaccharide Antigen by a Family of Antibodies Possessing an Unusual Variable Heavy Chain N-Linked Glycan. ; _citation.journal_abbrev J.Biol.Chem. _citation.journal_volume 289 _citation.page_first 16644 _citation.page_last 16661 _citation.year 2014 _citation.journal_id_ASTM JBCHA3 _citation.country US _citation.journal_id_ISSN 0021-9258 _citation.journal_id_CSD 0071 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 24682362 _citation.pdbx_database_id_DOI 10.1074/jbc.M113.528224 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Haji-Ghassemi, O.' 1 primary 'Muller-Loennies, S.' 2 primary 'Saldova, R.' 3 primary 'Muniyappa, M.' 4 primary 'Brade, L.' 5 primary 'Rudd, P.M.' 6 primary 'Harvey, D.J.' 7 primary 'Kosma, P.' 8 primary 'Brade, H.' 9 primary 'Evans, S.V.' 10 # _cell.entry_id 4MA1 _cell.length_a 196.257 _cell.length_b 66.508 _cell.length_c 122.078 _cell.angle_alpha 90.00 _cell.angle_beta 113.46 _cell.angle_gamma 90.00 _cell.Z_PDB 12 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 4MA1 _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 nat 'S25-26 Fab (IgG1k) heavy chain' 23513.465 3 ? ? ? ? 2 polymer nat 'S25-26 Fab (IgG1k) light chain' 24356.043 3 ? ? ? ? 3 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 7 ? ? ? ? 4 non-polymer man ALPHA-L-FUCOSE 164.156 3 ? ? ? ? 5 non-polymer man BETA-D-MANNOSE 180.156 3 ? ? ? ? 6 non-polymer man ALPHA-D-MANNOSE 180.156 4 ? ? ? ? 7 non-polymer syn 'DI(HYDROXYETHYL)ETHER' 106.120 2 ? ? ? ? 8 non-polymer man BETA-D-GALACTOSE 180.156 1 ? ? ? ? 9 non-polymer man 'ALPHA D-GALACTOSE' 180.156 1 ? ? ? ? 10 non-polymer syn 'POTASSIUM ION' 39.098 1 ? ? ? ? 11 water nat water 18.015 243 ? ? ? ? # 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 yes ;(PCA)VQLKESGPGLVQPSQSLSITCTVSGFSLTTYGVHWVRQSPGKGLEWLGVIWSGGSTDYNAAFISRLSISKDNSKS HVFFKMNSLQANDTAIYYCARMRITTDWFAYWGQGTLVTVSAAKTTPPSVYPLAPGSAAQTNSMVTLGCLVKGYFPEPVT VTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSETVTCNVAHPASSTKVDKKIVPRD ; ;EVQLKESGPGLVQPSQSLSITCTVSGFSLTTYGVHWVRQSPGKGLEWLGVIWSGGSTDYNAAFISRLSISKDNSKSHVFF KMNSLQANDTAIYYCARMRITTDWFAYWGQGTLVTVSAAKTTPPSVYPLAPGSAAQTNSMVTLGCLVKGYFPEPVTVTWN SGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSETVTCNVAHPASSTKVDKKIVPRD ; B,E,H ? 2 'polypeptide(L)' no no ;DILMNQTPLSLPVSLGDQASISCRSSQYIVHRNGNTYLEWYLQKPGQSPKLLIYKVSNRFSGVPDRFSGSGSGTDFTLKI SRVEAEDLGVYYCFQGSHVPYTFGGGTKLELKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSER QNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC ; ;DILMNQTPLSLPVSLGDQASISCRSSQYIVHRNGNTYLEWYLQKPGQSPKLLIYKVSNRFSGVPDRFSGSGSGTDFTLKI SRVEAEDLGVYYCFQGSHVPYTFGGGTKLELKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSER QNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC ; C,F,L ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 PCA n 1 2 VAL n 1 3 GLN n 1 4 LEU n 1 5 LYS n 1 6 GLU n 1 7 SER n 1 8 GLY n 1 9 PRO n 1 10 GLY n 1 11 LEU n 1 12 VAL n 1 13 GLN n 1 14 PRO n 1 15 SER n 1 16 GLN n 1 17 SER n 1 18 LEU n 1 19 SER n 1 20 ILE n 1 21 THR n 1 22 CYS n 1 23 THR n 1 24 VAL n 1 25 SER n 1 26 GLY n 1 27 PHE n 1 28 SER n 1 29 LEU n 1 30 THR n 1 31 THR n 1 32 TYR n 1 33 GLY n 1 34 VAL n 1 35 HIS n 1 36 TRP n 1 37 VAL n 1 38 ARG n 1 39 GLN n 1 40 SER n 1 41 PRO n 1 42 GLY n 1 43 LYS n 1 44 GLY n 1 45 LEU n 1 46 GLU n 1 47 TRP n 1 48 LEU n 1 49 GLY n 1 50 VAL n 1 51 ILE n 1 52 TRP n 1 53 SER n 1 54 GLY n 1 55 GLY n 1 56 SER n 1 57 THR n 1 58 ASP n 1 59 TYR n 1 60 ASN n 1 61 ALA n 1 62 ALA n 1 63 PHE n 1 64 ILE n 1 65 SER n 1 66 ARG n 1 67 LEU n 1 68 SER n 1 69 ILE n 1 70 SER n 1 71 LYS n 1 72 ASP n 1 73 ASN n 1 74 SER n 1 75 LYS n 1 76 SER n 1 77 HIS n 1 78 VAL n 1 79 PHE n 1 80 PHE n 1 81 LYS n 1 82 MET n 1 83 ASN n 1 84 SER n 1 85 LEU n 1 86 GLN n 1 87 ALA n 1 88 ASN n 1 89 ASP n 1 90 THR n 1 91 ALA n 1 92 ILE n 1 93 TYR n 1 94 TYR n 1 95 CYS n 1 96 ALA n 1 97 ARG n 1 98 MET n 1 99 ARG n 1 100 ILE n 1 101 THR n 1 102 THR n 1 103 ASP n 1 104 TRP n 1 105 PHE n 1 106 ALA n 1 107 TYR n 1 108 TRP n 1 109 GLY n 1 110 GLN n 1 111 GLY n 1 112 THR n 1 113 LEU n 1 114 VAL n 1 115 THR n 1 116 VAL n 1 117 SER n 1 118 ALA n 1 119 ALA n 1 120 LYS n 1 121 THR n 1 122 THR n 1 123 PRO n 1 124 PRO n 1 125 SER n 1 126 VAL n 1 127 TYR n 1 128 PRO n 1 129 LEU n 1 130 ALA n 1 131 PRO n 1 132 GLY n 1 133 SER n 1 134 ALA n 1 135 ALA n 1 136 GLN n 1 137 THR n 1 138 ASN n 1 139 SER n 1 140 MET n 1 141 VAL n 1 142 THR n 1 143 LEU n 1 144 GLY n 1 145 CYS n 1 146 LEU n 1 147 VAL n 1 148 LYS n 1 149 GLY n 1 150 TYR n 1 151 PHE n 1 152 PRO n 1 153 GLU n 1 154 PRO n 1 155 VAL n 1 156 THR n 1 157 VAL n 1 158 THR n 1 159 TRP n 1 160 ASN n 1 161 SER n 1 162 GLY n 1 163 SER n 1 164 LEU n 1 165 SER n 1 166 SER n 1 167 GLY n 1 168 VAL n 1 169 HIS n 1 170 THR n 1 171 PHE n 1 172 PRO n 1 173 ALA n 1 174 VAL n 1 175 LEU n 1 176 GLN n 1 177 SER n 1 178 ASP n 1 179 LEU n 1 180 TYR n 1 181 THR n 1 182 LEU n 1 183 SER n 1 184 SER n 1 185 SER n 1 186 VAL n 1 187 THR n 1 188 VAL n 1 189 PRO n 1 190 SER n 1 191 SER n 1 192 THR n 1 193 TRP n 1 194 PRO n 1 195 SER n 1 196 GLU n 1 197 THR n 1 198 VAL n 1 199 THR n 1 200 CYS n 1 201 ASN n 1 202 VAL n 1 203 ALA n 1 204 HIS n 1 205 PRO n 1 206 ALA n 1 207 SER n 1 208 SER n 1 209 THR n 1 210 LYS n 1 211 VAL n 1 212 ASP n 1 213 LYS n 1 214 LYS n 1 215 ILE n 1 216 VAL n 1 217 PRO n 1 218 ARG n 1 219 ASP n 2 1 ASP n 2 2 ILE n 2 3 LEU n 2 4 MET n 2 5 ASN n 2 6 GLN n 2 7 THR n 2 8 PRO n 2 9 LEU n 2 10 SER n 2 11 LEU n 2 12 PRO n 2 13 VAL n 2 14 SER n 2 15 LEU n 2 16 GLY n 2 17 ASP n 2 18 GLN n 2 19 ALA n 2 20 SER n 2 21 ILE n 2 22 SER n 2 23 CYS n 2 24 ARG n 2 25 SER n 2 26 SER n 2 27 GLN n 2 28 TYR n 2 29 ILE n 2 30 VAL n 2 31 HIS n 2 32 ARG n 2 33 ASN n 2 34 GLY n 2 35 ASN n 2 36 THR n 2 37 TYR n 2 38 LEU n 2 39 GLU n 2 40 TRP n 2 41 TYR n 2 42 LEU n 2 43 GLN n 2 44 LYS n 2 45 PRO n 2 46 GLY n 2 47 GLN n 2 48 SER n 2 49 PRO n 2 50 LYS n 2 51 LEU n 2 52 LEU n 2 53 ILE n 2 54 TYR n 2 55 LYS n 2 56 VAL n 2 57 SER n 2 58 ASN n 2 59 ARG n 2 60 PHE n 2 61 SER n 2 62 GLY n 2 63 VAL n 2 64 PRO n 2 65 ASP n 2 66 ARG n 2 67 PHE n 2 68 SER n 2 69 GLY n 2 70 SER n 2 71 GLY n 2 72 SER n 2 73 GLY n 2 74 THR n 2 75 ASP n 2 76 PHE n 2 77 THR n 2 78 LEU n 2 79 LYS n 2 80 ILE n 2 81 SER n 2 82 ARG n 2 83 VAL n 2 84 GLU n 2 85 ALA n 2 86 GLU n 2 87 ASP n 2 88 LEU n 2 89 GLY n 2 90 VAL n 2 91 TYR n 2 92 TYR n 2 93 CYS n 2 94 PHE n 2 95 GLN n 2 96 GLY n 2 97 SER n 2 98 HIS n 2 99 VAL n 2 100 PRO n 2 101 TYR n 2 102 THR n 2 103 PHE n 2 104 GLY n 2 105 GLY n 2 106 GLY n 2 107 THR n 2 108 LYS n 2 109 LEU n 2 110 GLU n 2 111 LEU n 2 112 LYS n 2 113 ARG n 2 114 ALA n 2 115 ASP n 2 116 ALA n 2 117 ALA n 2 118 PRO n 2 119 THR n 2 120 VAL n 2 121 SER n 2 122 ILE n 2 123 PHE n 2 124 PRO n 2 125 PRO n 2 126 SER n 2 127 SER n 2 128 GLU n 2 129 GLN n 2 130 LEU n 2 131 THR n 2 132 SER n 2 133 GLY n 2 134 GLY n 2 135 ALA n 2 136 SER n 2 137 VAL n 2 138 VAL n 2 139 CYS n 2 140 PHE n 2 141 LEU n 2 142 ASN n 2 143 ASN n 2 144 PHE n 2 145 TYR n 2 146 PRO n 2 147 LYS n 2 148 ASP n 2 149 ILE n 2 150 ASN n 2 151 VAL n 2 152 LYS n 2 153 TRP n 2 154 LYS n 2 155 ILE n 2 156 ASP n 2 157 GLY n 2 158 SER n 2 159 GLU n 2 160 ARG n 2 161 GLN n 2 162 ASN n 2 163 GLY n 2 164 VAL n 2 165 LEU n 2 166 ASN n 2 167 SER n 2 168 TRP n 2 169 THR n 2 170 ASP n 2 171 GLN n 2 172 ASP n 2 173 SER n 2 174 LYS n 2 175 ASP n 2 176 SER n 2 177 THR n 2 178 TYR n 2 179 SER n 2 180 MET n 2 181 SER n 2 182 SER n 2 183 THR n 2 184 LEU n 2 185 THR n 2 186 LEU n 2 187 THR n 2 188 LYS n 2 189 ASP n 2 190 GLU n 2 191 TYR n 2 192 GLU n 2 193 ARG n 2 194 HIS n 2 195 ASN n 2 196 SER n 2 197 TYR n 2 198 THR n 2 199 CYS n 2 200 GLU n 2 201 ALA n 2 202 THR n 2 203 HIS n 2 204 LYS n 2 205 THR n 2 206 SER n 2 207 THR n 2 208 SER n 2 209 PRO n 2 210 ILE n 2 211 VAL n 2 212 LYS n 2 213 SER n 2 214 PHE n 2 215 ASN n 2 216 ARG n 2 217 ASN n 2 218 GLU n 2 219 CYS n # loop_ _entity_src_nat.entity_id _entity_src_nat.pdbx_src_id _entity_src_nat.pdbx_alt_source_flag _entity_src_nat.pdbx_beg_seq_num _entity_src_nat.pdbx_end_seq_num _entity_src_nat.common_name _entity_src_nat.pdbx_organism_scientific _entity_src_nat.pdbx_ncbi_taxonomy_id _entity_src_nat.genus _entity_src_nat.species _entity_src_nat.strain _entity_src_nat.tissue _entity_src_nat.tissue_fraction _entity_src_nat.pdbx_secretion _entity_src_nat.pdbx_fragment _entity_src_nat.pdbx_variant _entity_src_nat.pdbx_cell_line _entity_src_nat.pdbx_atcc _entity_src_nat.pdbx_cellular_location _entity_src_nat.pdbx_organ _entity_src_nat.pdbx_organelle _entity_src_nat.pdbx_cell _entity_src_nat.pdbx_plasmid_name _entity_src_nat.pdbx_plasmid_details _entity_src_nat.details 1 1 sample ? ? mouse 'Mus musculus' 10090 ? ? Balb/C ? ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 sample ? ? mouse 'Mus musculus' 10090 ? ? Balb/C ? ? ? ? ? ? ? ? ? ? ? ? ? ? # 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 4MA1 4MA1 1 ? ;EVQLKESGPGLVQPSQSLSITCTVSGFSLTTYGVHWVRQSPGKGLEWLGVIWSGGSTDYNAAFISRLSISKDNSKSHVFF KMNSLQANDTAIYYCARMRITTDWFAYWGQGTLVTVSAAKTTPPSVYPLAPGSAAQTNSMVTLGCLVKGYFPEPVTVTWN SGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSETVTCNVAHPASSTKVDKKIVPRD ; ? 2 PDB 4MA1 4MA1 2 ? ;DILMNQTPLSLPVSLGDQASISCRSSQYIVHRNGNTYLEWYLQKPGQSPKLLIYKVSNRFSGVPDRFSGSGSGTDFTLKI SRVEAEDLGVYYCFQGSHVPYTFGGGTKLELKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSER QNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC ; ? # 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 4MA1 B 1 ? 219 ? 4MA1 1 ? 214 ? 1 214 2 1 4MA1 E 1 ? 219 ? 4MA1 1 ? 214 ? 1 214 3 1 4MA1 H 1 ? 219 ? 4MA1 1 ? 214 ? 1 214 4 2 4MA1 C 1 ? 219 ? 4MA1 1 ? 214 ? 1 214 5 2 4MA1 F 1 ? 219 ? 4MA1 1 ? 214 ? 1 214 6 2 4MA1 L 1 ? 219 ? 4MA1 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 BMA D-saccharide . BETA-D-MANNOSE ? 'C6 H12 O6' 180.156 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 FUC saccharide . ALPHA-L-FUCOSE ? 'C6 H12 O5' 164.156 GAL D-saccharide . BETA-D-GALACTOSE ? 'C6 H12 O6' 180.156 GLA D-saccharide . 'ALPHA D-GALACTOSE' ? 'C6 H12 O6' 180.156 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 K non-polymer . 'POTASSIUM ION' ? 'K 1' 39.098 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PCA 'L-peptide linking' n 'PYROGLUTAMIC ACID' ? 'C5 H7 N O3' 129.114 PEG non-polymer . 'DI(HYDROXYETHYL)ETHER' ? 'C4 H10 O3' 106.120 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 4MA1 _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.54 _exptl_crystal.density_percent_sol 51.66 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _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 2011-12-01 _diffrn_detector.details 'VERTICAL FOCUSING MIRROR' # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'DOUBLE CRYSTAL MONOCHROMATOR' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.9794 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'CLSI BEAMLINE 08ID-1' _diffrn_source.pdbx_synchrotron_site CLSI _diffrn_source.pdbx_synchrotron_beamline 08ID-1 _diffrn_source.pdbx_wavelength 0.9794 _diffrn_source.pdbx_wavelength_list ? # _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 4MA1 _reflns.observed_criterion_sigma_I ? _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 30.000 _reflns.d_resolution_high 2.320 _reflns.number_obs 62649 _reflns.number_all ? _reflns.percent_possible_obs 99.9 _reflns.pdbx_Rmerge_I_obs 0.06200 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 13.1000 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 4.300 _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 2.32 _reflns_shell.d_res_low 2.40 _reflns_shell.percent_possible_all 100.0 _reflns_shell.Rmerge_I_obs 0.58100 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy 4.30 _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 4MA1 _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.ls_number_reflns_obs 51319 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.000 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 29.93 _refine.ls_d_res_high 2.32 _refine.ls_percent_reflns_obs 81.4 _refine.ls_R_factor_obs 0.231 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.229 _refine.ls_R_factor_R_free 0.260 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.100 _refine.ls_number_reflns_R_free 2621 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min 0.440 _refine.occupancy_max 1.000 _refine.correlation_coeff_Fo_to_Fc 0.920 _refine.correlation_coeff_Fo_to_Fc_free 0.895 _refine.B_iso_mean 48.25 _refine.aniso_B[1][1] -1.83000 _refine.aniso_B[2][2] 2.74000 _refine.aniso_B[3][3] -0.60000 _refine.aniso_B[1][2] -0.00000 _refine.aniso_B[1][3] -0.21000 _refine.aniso_B[2][3] 0.00000 _refine.solvent_model_details MASK _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING' _refine.pdbx_starting_model 'PDB ENTRY 4M7J' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R 0.739 _refine.pdbx_overall_ESU_R_Free 0.305 _refine.overall_SU_ML 0.206 _refine.pdbx_overall_phase_error ? _refine.overall_SU_B 17.046 _refine.overall_SU_R_Cruickshank_DPI 0.7385 _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 10061 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 242 _refine_hist.number_atoms_solvent 243 _refine_hist.number_atoms_total 10546 _refine_hist.d_res_high 2.32 _refine_hist.d_res_low 29.93 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function r_bond_refined_d 0.009 0.020 ? 10599 'X-RAY DIFFRACTION' ? r_bond_other_d 0.004 0.020 ? 9655 'X-RAY DIFFRACTION' ? r_angle_refined_deg 1.477 1.976 ? 14533 'X-RAY DIFFRACTION' ? r_angle_other_deg 1.242 3.002 ? 22292 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 6.902 5.000 ? 1305 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg 35.878 24.000 ? 405 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg 17.306 15.000 ? 1634 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg 22.659 15.000 ? 42 'X-RAY DIFFRACTION' ? r_chiral_restr 0.122 0.200 ? 1686 'X-RAY DIFFRACTION' ? r_gen_planes_refined 0.006 0.021 ? 11753 'X-RAY DIFFRACTION' ? r_gen_planes_other 0.004 0.020 ? 2363 'X-RAY DIFFRACTION' ? r_nbd_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcbond_it 0.403 1.132 ? 5235 'X-RAY DIFFRACTION' ? r_mcbond_other 0.403 1.131 ? 5234 'X-RAY DIFFRACTION' ? r_mcangle_it 0.732 1.695 ? 6535 'X-RAY DIFFRACTION' ? r_mcangle_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_scbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? r_scbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_scangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? r_scangle_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_long_range_B_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_long_range_B_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_rigid_bond_restr ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_free ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_bonded ? ? ? ? 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_restr_ncs.dom_id _refine_ls_restr_ncs.pdbx_auth_asym_id _refine_ls_restr_ncs.pdbx_number _refine_ls_restr_ncs.rms_dev_position _refine_ls_restr_ncs.weight_position _refine_ls_restr_ncs.pdbx_type _refine_ls_restr_ncs.pdbx_ens_id _refine_ls_restr_ncs.pdbx_ordinal _refine_ls_restr_ncs.pdbx_refine_id _refine_ls_restr_ncs.ncs_model_details _refine_ls_restr_ncs.rms_dev_B_iso _refine_ls_restr_ncs.weight_B_iso 1 B 10346 0.140 0.050 'interatomic distance' 1 1 'X-RAY DIFFRACTION' ? ? ? 2 E 10346 0.140 0.050 'interatomic distance' 1 2 'X-RAY DIFFRACTION' ? ? ? 1 B 10822 0.120 0.050 'interatomic distance' 2 3 'X-RAY DIFFRACTION' ? ? ? 2 H 10822 0.120 0.050 'interatomic distance' 2 4 'X-RAY DIFFRACTION' ? ? ? 1 E 10361 0.130 0.050 'interatomic distance' 3 5 'X-RAY DIFFRACTION' ? ? ? 2 H 10361 0.130 0.050 'interatomic distance' 3 6 'X-RAY DIFFRACTION' ? ? ? 1 C 11625 0.080 0.050 'interatomic distance' 4 7 'X-RAY DIFFRACTION' ? ? ? 2 F 11625 0.080 0.050 'interatomic distance' 4 8 'X-RAY DIFFRACTION' ? ? ? 1 C 11396 0.090 0.050 'interatomic distance' 5 9 'X-RAY DIFFRACTION' ? ? ? 2 L 11396 0.090 0.050 'interatomic distance' 5 10 'X-RAY DIFFRACTION' ? ? ? 1 F 11330 0.100 0.050 'interatomic distance' 6 11 'X-RAY DIFFRACTION' ? ? ? 2 L 11330 0.100 0.050 'interatomic distance' 6 12 'X-RAY DIFFRACTION' ? ? ? # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 2.32 _refine_ls_shell.d_res_low 2.38 _refine_ls_shell.number_reflns_R_work 1168 _refine_ls_shell.R_factor_R_work 0.3030 _refine_ls_shell.percent_reflns_obs 26.64 _refine_ls_shell.R_factor_R_free 0.3380 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 67 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.number_reflns_obs ? # loop_ _struct_ncs_dom.id _struct_ncs_dom.details _struct_ncs_dom.pdbx_ens_id 1 B 1 2 E 1 1 B 2 2 H 2 1 E 3 2 H 3 1 C 4 2 F 4 1 C 5 2 L 5 1 F 6 2 L 6 # loop_ _struct_ncs_dom_lim.dom_id _struct_ncs_dom_lim.beg_auth_asym_id _struct_ncs_dom_lim.beg_auth_seq_id _struct_ncs_dom_lim.end_auth_asym_id _struct_ncs_dom_lim.end_auth_seq_id _struct_ncs_dom_lim.pdbx_component_id _struct_ncs_dom_lim.pdbx_refine_code _struct_ncs_dom_lim.beg_label_asym_id _struct_ncs_dom_lim.beg_label_comp_id _struct_ncs_dom_lim.beg_label_seq_id _struct_ncs_dom_lim.beg_label_alt_id _struct_ncs_dom_lim.end_label_asym_id _struct_ncs_dom_lim.end_label_comp_id _struct_ncs_dom_lim.end_label_seq_id _struct_ncs_dom_lim.end_label_alt_id _struct_ncs_dom_lim.pdbx_ens_id _struct_ncs_dom_lim.selection_details 1 B 4 B 217 0 0 ? ? ? ? ? ? ? ? 1 ? 2 E 4 E 217 0 0 ? ? ? ? ? ? ? ? 1 ? 1 B 1 B 218 0 0 ? ? ? ? ? ? ? ? 2 ? 2 H 1 H 218 0 0 ? ? ? ? ? ? ? ? 2 ? 1 E 4 E 217 0 0 ? ? ? ? ? ? ? ? 3 ? 2 H 4 H 217 0 0 ? ? ? ? ? ? ? ? 3 ? 1 C 1 C 219 0 0 ? ? ? ? ? ? ? ? 4 ? 2 F 1 F 219 0 0 ? ? ? ? ? ? ? ? 4 ? 1 C 1 C 219 0 0 ? ? ? ? ? ? ? ? 5 ? 2 L 1 L 219 0 0 ? ? ? ? ? ? ? ? 5 ? 1 F 1 F 219 0 0 ? ? ? ? ? ? ? ? 6 ? 2 L 1 L 219 0 0 ? ? ? ? ? ? ? ? 6 ? # loop_ _struct_ncs_ens.id _struct_ncs_ens.details 1 ? 2 ? 3 ? 4 ? 5 ? 6 ? # _struct.entry_id 4MA1 _struct.title 'Unliganded 3 crystal structure of S25-26 Fab' _struct.pdbx_descriptor 'S25-26 Fab (IgG1k) heavy chain, S25-26 Fab (IgG1k) light chain' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 4MA1 _struct_keywords.pdbx_keywords 'IMMUNE SYSTEM' _struct_keywords.text 'Carbohydrate/Sugar Binding, IMMUNE SYSTEM' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 1 ? C N N 1 ? D N N 2 ? E N N 2 ? F N N 2 ? G N N 3 ? H N N 4 ? I N N 3 ? J N N 5 ? K N N 6 ? L N N 7 ? M N N 3 ? N N N 4 ? O N N 3 ? P N N 5 ? Q N N 6 ? R N N 3 ? S N N 4 ? T N N 3 ? U N N 5 ? V N N 6 ? W N N 3 ? X N N 8 ? Y N N 9 ? Z N N 6 ? AA N N 7 ? BA N N 10 ? CA N N 11 ? DA N N 11 ? EA N N 11 ? FA N N 11 ? GA N N 11 ? HA N N 11 ? # _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 ALA A 61 ? ILE A 64 ? ALA B 61 ILE B 64 5 ? 4 HELX_P HELX_P2 2 ASN A 73 ? LYS A 75 ? ASN B 73 LYS B 75 5 ? 3 HELX_P HELX_P3 3 GLN A 86 ? THR A 90 ? GLN B 83 THR B 87 5 ? 5 HELX_P HELX_P4 4 SER A 191 ? TRP A 193 ? SER B 186 TRP B 188 5 ? 3 HELX_P HELX_P5 5 PRO A 205 ? SER A 208 ? PRO B 200 SER B 203 5 ? 4 HELX_P HELX_P6 6 GLN B 86 ? THR B 90 ? GLN E 83 THR E 87 5 ? 5 HELX_P HELX_P7 7 SER B 161 ? SER B 163 ? SER E 156 SER E 158 5 ? 3 HELX_P HELX_P8 8 SER B 191 ? TRP B 193 ? SER E 186 TRP E 188 5 ? 3 HELX_P HELX_P9 9 ALA C 61 ? ILE C 64 ? ALA H 61 ILE H 64 5 ? 4 HELX_P HELX_P10 10 GLN C 86 ? THR C 90 ? GLN H 83 THR H 87 5 ? 5 HELX_P HELX_P11 11 SER C 161 ? SER C 163 ? SER H 156 SER H 158 5 ? 3 HELX_P HELX_P12 12 SER C 191 ? TRP C 193 ? SER H 186 TRP H 188 5 ? 3 HELX_P HELX_P13 13 PRO C 205 ? SER C 208 ? PRO H 200 SER H 203 5 ? 4 HELX_P HELX_P14 14 GLU D 84 ? LEU D 88 ? GLU C 79 LEU C 83 5 ? 5 HELX_P HELX_P15 15 SER D 126 ? SER D 132 ? SER C 121 SER C 127 1 ? 7 HELX_P HELX_P16 16 LYS D 188 ? GLU D 192 ? LYS C 183 GLU C 187 1 ? 5 HELX_P HELX_P17 17 ASN D 217 ? CYS D 219 ? ASN C 212 CYS C 214 5 ? 3 HELX_P HELX_P18 18 GLU E 84 ? LEU E 88 ? GLU F 79 LEU F 83 5 ? 5 HELX_P HELX_P19 19 SER E 126 ? SER E 132 ? SER F 121 SER F 127 1 ? 7 HELX_P HELX_P20 20 LYS E 188 ? GLU E 192 ? LYS F 183 GLU F 187 1 ? 5 HELX_P HELX_P21 21 ASN E 217 ? CYS E 219 ? ASN F 212 CYS F 214 5 ? 3 HELX_P HELX_P22 22 GLU F 84 ? LEU F 88 ? GLU L 79 LEU L 83 5 ? 5 HELX_P HELX_P23 23 SER F 126 ? SER F 132 ? SER L 121 SER L 127 1 ? 7 HELX_P HELX_P24 24 LYS F 188 ? GLU F 192 ? LYS L 183 GLU L 187 1 ? 5 HELX_P HELX_P25 25 ASN F 217 ? CYS F 219 ? ASN L 212 CYS L 214 5 ? 3 # _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 22 SG ? ? ? 1_555 A CYS 95 SG ? ? B CYS 22 B CYS 92 1_555 ? ? ? ? ? ? ? 2.109 ? disulf2 disulf ? ? A CYS 145 SG ? ? ? 1_555 A CYS 200 SG ? ? B CYS 140 B CYS 195 1_555 ? ? ? ? ? ? ? 2.070 ? disulf3 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 95 SG ? ? E CYS 22 E CYS 92 1_555 ? ? ? ? ? ? ? 2.065 ? disulf4 disulf ? ? B CYS 145 SG ? ? ? 1_555 B CYS 200 SG ? ? E CYS 140 E CYS 195 1_555 ? ? ? ? ? ? ? 2.010 ? disulf5 disulf ? ? C CYS 22 SG ? ? ? 1_555 C CYS 95 SG ? ? H CYS 22 H CYS 92 1_555 ? ? ? ? ? ? ? 2.066 ? disulf6 disulf ? ? C CYS 145 SG A ? ? 1_555 C CYS 200 SG ? ? H CYS 140 H CYS 195 1_555 ? ? ? ? ? ? ? 2.029 ? disulf7 disulf ? ? C CYS 145 SG B ? ? 1_555 C CYS 200 SG ? ? H CYS 140 H CYS 195 1_555 ? ? ? ? ? ? ? 2.096 ? disulf8 disulf ? ? D CYS 23 SG ? ? ? 1_555 D CYS 93 SG ? ? C CYS 23 C CYS 88 1_555 ? ? ? ? ? ? ? 2.080 ? disulf9 disulf ? ? D CYS 139 SG ? ? ? 1_555 D CYS 199 SG ? ? C CYS 134 C CYS 194 1_555 ? ? ? ? ? ? ? 2.051 ? disulf10 disulf ? ? E CYS 23 SG ? ? ? 1_555 E CYS 93 SG ? ? F CYS 23 F CYS 88 1_555 ? ? ? ? ? ? ? 2.076 ? disulf11 disulf ? ? E CYS 139 SG ? ? ? 1_555 E CYS 199 SG ? ? F CYS 134 F CYS 194 1_555 ? ? ? ? ? ? ? 2.050 ? disulf12 disulf ? ? F CYS 23 SG ? ? ? 1_555 F CYS 93 SG ? ? L CYS 23 L CYS 88 1_555 ? ? ? ? ? ? ? 2.099 ? disulf13 disulf ? ? F CYS 139 SG ? ? ? 1_555 F CYS 199 SG ? ? L CYS 134 L CYS 194 1_555 ? ? ? ? ? ? ? 2.038 ? covale1 covale ? ? A PCA 1 C ? ? ? 1_555 A VAL 2 N ? ? B PCA 1 B VAL 2 1_555 ? ? ? ? ? ? ? 1.331 ? covale2 covale ? ? C PCA 1 C ? ? ? 1_555 C VAL 2 N ? ? H PCA 1 H VAL 2 1_555 ? ? ? ? ? ? ? 1.330 ? covale3 covale ? ? V MAN . O2 ? ? ? 1_555 W NAG . C1 ? ? H MAN 405 H NAG 406 1_555 ? ? ? ? ? ? ? 1.442 ? covale4 covale ? ? I NAG . O4 ? ? ? 1_555 J BMA . C1 ? ? B NAG 403 B BMA 404 1_555 ? ? ? ? ? ? ? 1.443 ? covale5 covale ? ? W NAG . O4 ? ? ? 1_555 X GAL . C1 ? ? H NAG 406 H GAL 407 1_555 ? ? ? ? ? ? ? 1.413 ? covale6 covale ? ? C ASN 88 ND2 ? ? ? 1_555 R NAG . C1 ? ? H ASN 85 H NAG 401 1_555 ? ? ? ? ? ? ? 1.338 ? covale7 covale ? ? O NAG . O4 ? ? ? 1_555 P BMA . C1 ? ? E NAG 403 E BMA 404 1_555 ? ? ? ? ? ? ? 1.432 ? covale8 covale ? ? B ASN 88 ND2 ? ? ? 1_555 M NAG . C1 ? ? E ASN 85 E NAG 401 1_555 ? ? ? ? ? ? ? 1.454 ? covale9 covale ? ? X GAL . O3 ? ? ? 1_555 Y GLA . C1 ? ? H GAL 407 H GLA 408 1_555 ? ? ? ? ? ? ? 1.421 ? covale10 covale ? ? M NAG . O6 ? ? ? 1_555 N FUC . C1 ? ? E NAG 401 E FUC 402 1_555 ? ? ? ? ? ? ? 1.450 ? covale11 covale ? ? U BMA . O3 ? ? ? 1_555 V MAN . C1 ? ? H BMA 404 H MAN 405 1_555 ? ? ? ? ? ? ? 1.439 ? covale12 covale ? ? J BMA . O6 ? ? ? 1_555 K MAN . C1 ? ? B BMA 404 B MAN 405 1_555 ? ? ? ? ? ? ? 1.458 ? covale13 covale ? ? M NAG . O4 ? ? ? 1_555 O NAG . C1 ? ? E NAG 401 E NAG 403 1_555 ? ? ? ? ? ? ? 1.458 ? covale14 covale ? ? U BMA . O6 ? ? ? 1_555 Z MAN . C1 ? ? H BMA 404 H MAN 409 1_555 ? ? ? ? ? ? ? 1.370 ? covale15 covale ? ? T NAG . O4 ? ? ? 1_555 U BMA . C1 ? ? H NAG 403 H BMA 404 1_555 ? ? ? ? ? ? ? 1.382 ? covale16 covale ? ? A ASN 88 ND2 ? ? ? 1_555 G NAG . C1 ? ? B ASN 85 B NAG 401 1_555 ? ? ? ? ? ? ? 1.397 ? covale17 covale ? ? R NAG . O4 ? ? ? 1_555 T NAG . C1 ? ? H NAG 401 H NAG 403 1_555 ? ? ? ? ? ? ? 1.034 ? covale18 covale ? ? G NAG . O4 ? ? ? 1_555 I NAG . C1 ? ? B NAG 401 B NAG 403 1_555 ? ? ? ? ? ? ? 1.552 ? metalc1 metalc ? ? BA K . K ? ? ? 1_555 HA HOH . O ? ? L K 301 L HOH 443 1_555 ? ? ? ? ? ? ? 2.920 ? metalc2 metalc ? ? F TYR 28 OH ? A ? 1_555 BA K . K ? ? L TYR 27 L K 301 1_555 ? ? ? ? ? ? ? 2.926 ? metalc3 metalc ? ? BA K . K ? ? ? 1_555 HA HOH . O ? ? L K 301 L HOH 444 1_555 ? ? ? ? ? ? ? 2.931 ? covale19 covale ? ? G NAG . O6 ? ? ? 1_555 H FUC . C1 ? ? B NAG 401 B FUC 402 1_555 ? ? ? ? ? ? ? 1.438 ? covale20 covale ? ? R NAG . O6 ? ? ? 1_555 S FUC . C1 ? ? H NAG 401 H FUC 402 1_555 ? ? ? ? ? ? ? 1.439 ? covale21 covale ? ? P BMA . O3 ? ? ? 1_555 Q MAN . C1 ? ? E BMA 404 E MAN 405 1_555 ? ? ? ? ? ? ? 1.432 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # 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 PHE 151 A . ? PHE 146 B PRO 152 A ? PRO 147 B 1 -1.42 2 GLU 153 A . ? GLU 148 B PRO 154 A ? PRO 149 B 1 -1.15 3 TRP 193 A . ? TRP 188 B PRO 194 A ? PRO 189 B 1 4.21 4 GLY 54 B . ? GLY 54 E GLY 55 B ? GLY 55 E 1 -17.68 5 ILE 64 B . ? ILE 64 E SER 65 B ? SER 65 E 1 -8.72 6 PHE 151 B . ? PHE 146 E PRO 152 B ? PRO 147 E 1 -2.78 7 GLU 153 B . ? GLU 148 E PRO 154 B ? PRO 149 E 1 -1.52 8 TRP 193 B . ? TRP 188 E PRO 194 B ? PRO 189 E 1 4.34 9 PHE 151 C . ? PHE 146 H PRO 152 C ? PRO 147 H 1 -5.41 10 GLU 153 C . ? GLU 148 H PRO 154 C ? PRO 149 H 1 -2.22 11 TRP 193 C . ? TRP 188 H PRO 194 C ? PRO 189 H 1 5.92 12 THR 7 D . ? THR 7 C PRO 8 D ? PRO 8 C 1 -3.47 13 VAL 99 D . ? VAL 94 C PRO 100 D ? PRO 95 C 1 -1.83 14 TYR 145 D . ? TYR 140 C PRO 146 D ? PRO 141 C 1 2.47 15 THR 7 E . ? THR 7 F PRO 8 E ? PRO 8 F 1 -6.06 16 VAL 99 E . ? VAL 94 F PRO 100 E ? PRO 95 F 1 -3.68 17 TYR 145 E . ? TYR 140 F PRO 146 E ? PRO 141 F 1 4.99 18 THR 7 F . ? THR 7 L PRO 8 F ? PRO 8 L 1 -7.88 19 VAL 99 F . ? VAL 94 L PRO 100 F ? PRO 95 L 1 1.68 20 TYR 145 F . ? TYR 140 L PRO 146 F ? PRO 141 L 1 3.64 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 4 ? B ? 6 ? C ? 4 ? D ? 4 ? E ? 3 ? F ? 4 ? G ? 6 ? H ? 4 ? I ? 4 ? J ? 3 ? K ? 4 ? L ? 6 ? M ? 4 ? N ? 4 ? O ? 3 ? P ? 4 ? Q ? 6 ? R ? 4 ? S ? 4 ? T ? 4 ? U ? 4 ? V ? 6 ? W ? 4 ? X ? 4 ? Y ? 4 ? Z ? 4 ? AA ? 6 ? AB ? 4 ? AC ? 4 ? AD ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel B 1 2 ? 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 F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel G 1 2 ? parallel G 2 3 ? anti-parallel G 3 4 ? anti-parallel G 4 5 ? anti-parallel G 5 6 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel L 1 2 ? parallel L 2 3 ? anti-parallel L 3 4 ? anti-parallel L 4 5 ? anti-parallel L 5 6 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel N 1 2 ? anti-parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel O 1 2 ? anti-parallel O 2 3 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel P 3 4 ? anti-parallel Q 1 2 ? parallel Q 2 3 ? anti-parallel Q 3 4 ? anti-parallel Q 4 5 ? anti-parallel Q 5 6 ? anti-parallel R 1 2 ? parallel R 2 3 ? anti-parallel R 3 4 ? anti-parallel S 1 2 ? anti-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 ? parallel V 2 3 ? anti-parallel V 3 4 ? anti-parallel V 4 5 ? anti-parallel V 5 6 ? anti-parallel W 1 2 ? parallel W 2 3 ? anti-parallel W 3 4 ? anti-parallel X 1 2 ? anti-parallel X 2 3 ? anti-parallel X 3 4 ? anti-parallel Y 1 2 ? anti-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 ? parallel AA 2 3 ? anti-parallel AA 3 4 ? anti-parallel AA 4 5 ? anti-parallel AA 5 6 ? anti-parallel AB 1 2 ? parallel AB 2 3 ? anti-parallel AB 3 4 ? anti-parallel AC 1 2 ? anti-parallel AC 2 3 ? anti-parallel AC 3 4 ? anti-parallel AD 1 2 ? anti-parallel AD 2 3 ? anti-parallel AD 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 GLN A 3 ? SER A 7 ? GLN B 3 SER B 7 A 2 LEU A 18 ? SER A 25 ? LEU B 18 SER B 25 A 3 HIS A 77 ? MET A 82 ? HIS B 77 MET B 82 A 4 LEU A 67 ? ASP A 72 ? LEU B 67 ASP B 72 B 1 LEU A 11 ? VAL A 12 ? LEU B 11 VAL B 12 B 2 THR A 112 ? VAL A 116 ? THR B 107 VAL B 111 B 3 ALA A 91 ? ALA A 96 ? ALA B 88 ALA B 93 B 4 VAL A 34 ? SER A 40 ? VAL B 34 SER B 40 B 5 GLY A 44 ? ILE A 51 ? GLY B 44 ILE B 51 B 6 THR A 57 ? TYR A 59 ? THR B 57 TYR B 59 C 1 SER A 125 ? LEU A 129 ? SER B 120 LEU B 124 C 2 MET A 140 ? TYR A 150 ? MET B 135 TYR B 145 C 3 LEU A 179 ? PRO A 189 ? LEU B 174 PRO B 184 C 4 VAL A 168 ? THR A 170 ? VAL B 163 THR B 165 D 1 SER A 125 ? LEU A 129 ? SER B 120 LEU B 124 D 2 MET A 140 ? TYR A 150 ? MET B 135 TYR B 145 D 3 LEU A 179 ? PRO A 189 ? LEU B 174 PRO B 184 D 4 VAL A 174 ? GLN A 176 ? VAL B 169 GLN B 171 E 1 THR A 156 ? TRP A 159 ? THR B 151 TRP B 154 E 2 THR A 199 ? HIS A 204 ? THR B 194 HIS B 199 E 3 THR A 209 ? LYS A 214 ? THR B 204 LYS B 209 F 1 LYS B 5 ? SER B 7 ? LYS E 5 SER E 7 F 2 LEU B 18 ? THR B 23 ? LEU E 18 THR E 23 F 3 HIS B 77 ? MET B 82 ? HIS E 77 MET E 82 F 4 LEU B 67 ? SER B 70 ? LEU E 67 SER E 70 G 1 LEU B 11 ? VAL B 12 ? LEU E 11 VAL E 12 G 2 THR B 112 ? VAL B 116 ? THR E 107 VAL E 111 G 3 ALA B 91 ? ALA B 96 ? ALA E 88 ALA E 93 G 4 VAL B 34 ? SER B 40 ? VAL E 34 SER E 40 G 5 GLY B 44 ? ILE B 51 ? GLY E 44 ILE E 51 G 6 THR B 57 ? TYR B 59 ? THR E 57 TYR E 59 H 1 SER B 125 ? LEU B 129 ? SER E 120 LEU E 124 H 2 MET B 140 ? TYR B 150 ? MET E 135 TYR E 145 H 3 LEU B 179 ? PRO B 189 ? LEU E 174 PRO E 184 H 4 VAL B 168 ? THR B 170 ? VAL E 163 THR E 165 I 1 SER B 125 ? LEU B 129 ? SER E 120 LEU E 124 I 2 MET B 140 ? TYR B 150 ? MET E 135 TYR E 145 I 3 LEU B 179 ? PRO B 189 ? LEU E 174 PRO E 184 I 4 VAL B 174 ? GLN B 176 ? VAL E 169 GLN E 171 J 1 THR B 156 ? TRP B 159 ? THR E 151 TRP E 154 J 2 THR B 199 ? HIS B 204 ? THR E 194 HIS E 199 J 3 THR B 209 ? LYS B 214 ? THR E 204 LYS E 209 K 1 LYS C 5 ? SER C 7 ? LYS H 5 SER H 7 K 2 LEU C 18 ? THR C 23 ? LEU H 18 THR H 23 K 3 HIS C 77 ? MET C 82 ? HIS H 77 MET H 82 K 4 LEU C 67 ? ASP C 72 ? LEU H 67 ASP H 72 L 1 LEU C 11 ? VAL C 12 ? LEU H 11 VAL H 12 L 2 THR C 112 ? VAL C 116 ? THR H 107 VAL H 111 L 3 ALA C 91 ? ALA C 96 ? ALA H 88 ALA H 93 L 4 VAL C 34 ? SER C 40 ? VAL H 34 SER H 40 L 5 GLY C 44 ? ILE C 51 ? GLY H 44 ILE H 51 L 6 THR C 57 ? TYR C 59 ? THR H 57 TYR H 59 M 1 SER C 125 ? LEU C 129 ? SER H 120 LEU H 124 M 2 MET C 140 ? TYR C 150 ? MET H 135 TYR H 145 M 3 LEU C 179 ? PRO C 189 ? LEU H 174 PRO H 184 M 4 VAL C 168 ? THR C 170 ? VAL H 163 THR H 165 N 1 SER C 125 ? LEU C 129 ? SER H 120 LEU H 124 N 2 MET C 140 ? TYR C 150 ? MET H 135 TYR H 145 N 3 LEU C 179 ? PRO C 189 ? LEU H 174 PRO H 184 N 4 VAL C 174 ? GLN C 176 ? VAL H 169 GLN H 171 O 1 THR C 156 ? TRP C 159 ? THR H 151 TRP H 154 O 2 THR C 199 ? HIS C 204 ? THR H 194 HIS H 199 O 3 THR C 209 ? LYS C 214 ? THR H 204 LYS H 209 P 1 MET D 4 ? THR D 7 ? MET C 4 THR C 7 P 2 ALA D 19 ? SER D 25 ? ALA C 19 SER C 25 P 3 ASP D 75 ? ILE D 80 ? ASP C 70 ILE C 75 P 4 PHE D 67 ? SER D 72 ? PHE C 62 SER C 67 Q 1 SER D 10 ? VAL D 13 ? SER C 10 VAL C 13 Q 2 THR D 107 ? LEU D 111 ? THR C 102 LEU C 106 Q 3 GLY D 89 ? GLN D 95 ? GLY C 84 GLN C 90 Q 4 LEU D 38 ? GLN D 43 ? LEU C 33 GLN C 38 Q 5 LYS D 50 ? TYR D 54 ? LYS C 45 TYR C 49 Q 6 ASN D 58 ? ARG D 59 ? ASN C 53 ARG C 54 R 1 SER D 10 ? VAL D 13 ? SER C 10 VAL C 13 R 2 THR D 107 ? LEU D 111 ? THR C 102 LEU C 106 R 3 GLY D 89 ? GLN D 95 ? GLY C 84 GLN C 90 R 4 THR D 102 ? PHE D 103 ? THR C 97 PHE C 98 S 1 THR D 119 ? PHE D 123 ? THR C 114 PHE C 118 S 2 GLY D 134 ? PHE D 144 ? GLY C 129 PHE C 139 S 3 TYR D 178 ? THR D 187 ? TYR C 173 THR C 182 S 4 VAL D 164 ? TRP D 168 ? VAL C 159 TRP C 163 T 1 SER D 158 ? GLU D 159 ? SER C 153 GLU C 154 T 2 ASN D 150 ? ILE D 155 ? ASN C 145 ILE C 150 T 3 SER D 196 ? THR D 202 ? SER C 191 THR C 197 T 4 ILE D 210 ? ASN D 215 ? ILE C 205 ASN C 210 U 1 MET E 4 ? THR E 7 ? MET F 4 THR F 7 U 2 ALA E 19 ? SER E 25 ? ALA F 19 SER F 25 U 3 ASP E 75 ? ILE E 80 ? ASP F 70 ILE F 75 U 4 PHE E 67 ? SER E 72 ? PHE F 62 SER F 67 V 1 SER E 10 ? VAL E 13 ? SER F 10 VAL F 13 V 2 THR E 107 ? LEU E 111 ? THR F 102 LEU F 106 V 3 GLY E 89 ? GLN E 95 ? GLY F 84 GLN F 90 V 4 LEU E 38 ? GLN E 43 ? LEU F 33 GLN F 38 V 5 PRO E 49 ? TYR E 54 ? PRO F 44 TYR F 49 V 6 ASN E 58 ? ARG E 59 ? ASN F 53 ARG F 54 W 1 SER E 10 ? VAL E 13 ? SER F 10 VAL F 13 W 2 THR E 107 ? LEU E 111 ? THR F 102 LEU F 106 W 3 GLY E 89 ? GLN E 95 ? GLY F 84 GLN F 90 W 4 THR E 102 ? PHE E 103 ? THR F 97 PHE F 98 X 1 THR E 119 ? PHE E 123 ? THR F 114 PHE F 118 X 2 GLY E 134 ? PHE E 144 ? GLY F 129 PHE F 139 X 3 TYR E 178 ? THR E 187 ? TYR F 173 THR F 182 X 4 VAL E 164 ? TRP E 168 ? VAL F 159 TRP F 163 Y 1 SER E 158 ? ARG E 160 ? SER F 153 ARG F 155 Y 2 ASN E 150 ? ILE E 155 ? ASN F 145 ILE F 150 Y 3 SER E 196 ? HIS E 203 ? SER F 191 HIS F 198 Y 4 SER E 206 ? ASN E 215 ? SER F 201 ASN F 210 Z 1 MET F 4 ? THR F 7 ? MET L 4 THR L 7 Z 2 ALA F 19 ? SER F 25 ? ALA L 19 SER L 25 Z 3 ASP F 75 ? ILE F 80 ? ASP L 70 ILE L 75 Z 4 PHE F 67 ? SER F 72 ? PHE L 62 SER L 67 AA 1 SER F 10 ? VAL F 13 ? SER L 10 VAL L 13 AA 2 THR F 107 ? LEU F 111 ? THR L 102 LEU L 106 AA 3 GLY F 89 ? GLN F 95 ? GLY L 84 GLN L 90 AA 4 LEU F 38 ? GLN F 43 ? LEU L 33 GLN L 38 AA 5 PRO F 49 ? TYR F 54 ? PRO L 44 TYR L 49 AA 6 ASN F 58 ? ARG F 59 ? ASN L 53 ARG L 54 AB 1 SER F 10 ? VAL F 13 ? SER L 10 VAL L 13 AB 2 THR F 107 ? LEU F 111 ? THR L 102 LEU L 106 AB 3 GLY F 89 ? GLN F 95 ? GLY L 84 GLN L 90 AB 4 THR F 102 ? PHE F 103 ? THR L 97 PHE L 98 AC 1 THR F 119 ? PHE F 123 ? THR L 114 PHE L 118 AC 2 GLY F 134 ? PHE F 144 ? GLY L 129 PHE L 139 AC 3 TYR F 178 ? THR F 187 ? TYR L 173 THR L 182 AC 4 VAL F 164 ? TRP F 168 ? VAL L 159 TRP L 163 AD 1 SER F 158 ? ARG F 160 ? SER L 153 ARG L 155 AD 2 ASN F 150 ? ILE F 155 ? ASN L 145 ILE L 150 AD 3 SER F 196 ? THR F 202 ? SER L 191 THR L 197 AD 4 ILE F 210 ? ASN F 215 ? ILE L 205 ASN L 210 # 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 LYS A 5 ? N LYS B 5 O THR A 23 ? O THR B 23 A 2 3 N CYS A 22 ? N CYS B 22 O VAL A 78 ? O VAL B 78 A 3 4 O PHE A 79 ? O PHE B 79 N SER A 70 ? N SER B 70 B 1 2 N VAL A 12 ? N VAL B 12 O THR A 115 ? O THR B 110 B 2 3 O VAL A 114 ? O VAL B 109 N ALA A 91 ? N ALA B 88 B 3 4 O TYR A 94 ? O TYR B 91 N VAL A 37 ? N VAL B 37 B 4 5 N TRP A 36 ? N TRP B 36 O LEU A 48 ? O LEU B 48 B 5 6 N VAL A 50 ? N VAL B 50 O ASP A 58 ? O ASP B 58 C 1 2 N TYR A 127 ? N TYR B 122 O LEU A 146 ? O LEU B 141 C 2 3 N VAL A 141 ? N VAL B 136 O VAL A 188 ? O VAL B 183 C 3 4 O SER A 185 ? O SER B 180 N HIS A 169 ? N HIS B 164 D 1 2 N TYR A 127 ? N TYR B 122 O LEU A 146 ? O LEU B 141 D 2 3 N VAL A 141 ? N VAL B 136 O VAL A 188 ? O VAL B 183 D 3 4 O LEU A 179 ? O LEU B 174 N GLN A 176 ? N GLN B 171 E 1 2 N THR A 158 ? N THR B 153 O ASN A 201 ? O ASN B 196 E 2 3 N VAL A 202 ? N VAL B 197 O VAL A 211 ? O VAL B 206 F 1 2 N LYS B 5 ? N LYS E 5 O THR B 23 ? O THR E 23 F 2 3 N CYS B 22 ? N CYS E 22 O VAL B 78 ? O VAL E 78 F 3 4 O LYS B 81 ? O LYS E 81 N SER B 68 ? N SER E 68 G 1 2 N VAL B 12 ? N VAL E 12 O THR B 115 ? O THR E 110 G 2 3 O VAL B 114 ? O VAL E 109 N ALA B 91 ? N ALA E 88 G 3 4 O TYR B 94 ? O TYR E 91 N VAL B 37 ? N VAL E 37 G 4 5 N TRP B 36 ? N TRP E 36 O LEU B 48 ? O LEU E 48 G 5 6 N VAL B 50 ? N VAL E 50 O ASP B 58 ? O ASP E 58 H 1 2 N TYR B 127 ? N TYR E 122 O LEU B 146 ? O LEU E 141 H 2 3 N LEU B 143 ? N LEU E 138 O VAL B 186 ? O VAL E 181 H 3 4 O SER B 185 ? O SER E 180 N HIS B 169 ? N HIS E 164 I 1 2 N TYR B 127 ? N TYR E 122 O LEU B 146 ? O LEU E 141 I 2 3 N LEU B 143 ? N LEU E 138 O VAL B 186 ? O VAL E 181 I 3 4 O LEU B 179 ? O LEU E 174 N GLN B 176 ? N GLN E 171 J 1 2 N THR B 158 ? N THR E 153 O ASN B 201 ? O ASN E 196 J 2 3 N VAL B 202 ? N VAL E 197 O VAL B 211 ? O VAL E 206 K 1 2 N LYS C 5 ? N LYS H 5 O THR C 23 ? O THR H 23 K 2 3 N ILE C 20 ? N ILE H 20 O PHE C 80 ? O PHE H 80 K 3 4 O PHE C 79 ? O PHE H 79 N SER C 70 ? N SER H 70 L 1 2 N VAL C 12 ? N VAL H 12 O THR C 115 ? O THR H 110 L 2 3 O VAL C 114 ? O VAL H 109 N ALA C 91 ? N ALA H 88 L 3 4 O TYR C 94 ? O TYR H 91 N VAL C 37 ? N VAL H 37 L 4 5 N TRP C 36 ? N TRP H 36 O LEU C 48 ? O LEU H 48 L 5 6 N VAL C 50 ? N VAL H 50 O ASP C 58 ? O ASP H 58 M 1 2 N TYR C 127 ? N TYR H 122 O LEU C 146 ? O LEU H 141 M 2 3 N VAL C 141 ? N VAL H 136 O VAL C 188 ? O VAL H 183 M 3 4 O SER C 185 ? O SER H 180 N HIS C 169 ? N HIS H 164 N 1 2 N TYR C 127 ? N TYR H 122 O LEU C 146 ? O LEU H 141 N 2 3 N VAL C 141 ? N VAL H 136 O VAL C 188 ? O VAL H 183 N 3 4 O LEU C 179 ? O LEU H 174 N GLN C 176 ? N GLN H 171 O 1 2 N THR C 158 ? N THR H 153 O ASN C 201 ? O ASN H 196 O 2 3 N VAL C 202 ? N VAL H 197 O VAL C 211 ? O VAL H 206 P 1 2 N ASN D 5 ? N ASN C 5 O ARG D 24 ? O ARG C 24 P 2 3 N ILE D 21 ? N ILE C 21 O LEU D 78 ? O LEU C 73 P 3 4 O LYS D 79 ? O LYS C 74 N SER D 68 ? N SER C 63 Q 1 2 N VAL D 13 ? N VAL C 13 O GLU D 110 ? O GLU C 105 Q 2 3 O THR D 107 ? O THR C 102 N TYR D 91 ? N TYR C 86 Q 3 4 O TYR D 92 ? O TYR C 87 N TYR D 41 ? N TYR C 36 Q 4 5 N TRP D 40 ? N TRP C 35 O LEU D 52 ? O LEU C 47 Q 5 6 N TYR D 54 ? N TYR C 49 O ASN D 58 ? O ASN C 53 R 1 2 N VAL D 13 ? N VAL C 13 O GLU D 110 ? O GLU C 105 R 2 3 O THR D 107 ? O THR C 102 N TYR D 91 ? N TYR C 86 R 3 4 N GLN D 95 ? N GLN C 90 O THR D 102 ? O THR C 97 S 1 2 N SER D 121 ? N SER C 116 O PHE D 140 ? O PHE C 135 S 2 3 N CYS D 139 ? N CYS C 134 O SER D 182 ? O SER C 177 S 3 4 O SER D 181 ? O SER C 176 N SER D 167 ? N SER C 162 T 1 2 O SER D 158 ? O SER C 153 N ILE D 155 ? N ILE C 150 T 2 3 N LYS D 152 ? N LYS C 147 O GLU D 200 ? O GLU C 195 T 3 4 N CYS D 199 ? N CYS C 194 O LYS D 212 ? O LYS C 207 U 1 2 N ASN E 5 ? N ASN F 5 O ARG E 24 ? O ARG F 24 U 2 3 N ILE E 21 ? N ILE F 21 O LEU E 78 ? O LEU F 73 U 3 4 O LYS E 79 ? O LYS F 74 N SER E 68 ? N SER F 63 V 1 2 N LEU E 11 ? N LEU F 11 O LYS E 108 ? O LYS F 103 V 2 3 O LEU E 109 ? O LEU F 104 N GLY E 89 ? N GLY F 84 V 3 4 O VAL E 90 ? O VAL F 85 N GLN E 43 ? N GLN F 38 V 4 5 N TRP E 40 ? N TRP F 35 O LEU E 52 ? O LEU F 47 V 5 6 N TYR E 54 ? N TYR F 49 O ASN E 58 ? O ASN F 53 W 1 2 N LEU E 11 ? N LEU F 11 O LYS E 108 ? O LYS F 103 W 2 3 O LEU E 109 ? O LEU F 104 N GLY E 89 ? N GLY F 84 W 3 4 N GLN E 95 ? N GLN F 90 O THR E 102 ? O THR F 97 X 1 2 N THR E 119 ? N THR F 114 O ASN E 142 ? O ASN F 137 X 2 3 N VAL E 137 ? N VAL F 132 O LEU E 184 ? O LEU F 179 X 3 4 O SER E 181 ? O SER F 176 N SER E 167 ? N SER F 162 Y 1 2 O SER E 158 ? O SER F 153 N ILE E 155 ? N ILE F 150 Y 2 3 N ASN E 150 ? N ASN F 145 O THR E 202 ? O THR F 197 Y 3 4 N CYS E 199 ? N CYS F 194 O LYS E 212 ? O LYS F 207 Z 1 2 N ASN F 5 ? N ASN L 5 O ARG F 24 ? O ARG L 24 Z 2 3 N CYS F 23 ? N CYS L 23 O PHE F 76 ? O PHE L 71 Z 3 4 O LYS F 79 ? O LYS L 74 N SER F 68 ? N SER L 63 AA 1 2 N VAL F 13 ? N VAL L 13 O GLU F 110 ? O GLU L 105 AA 2 3 O THR F 107 ? O THR L 102 N TYR F 91 ? N TYR L 86 AA 3 4 O TYR F 92 ? O TYR L 87 N TYR F 41 ? N TYR L 36 AA 4 5 N TRP F 40 ? N TRP L 35 O LEU F 52 ? O LEU L 47 AA 5 6 N TYR F 54 ? N TYR L 49 O ASN F 58 ? O ASN L 53 AB 1 2 N VAL F 13 ? N VAL L 13 O GLU F 110 ? O GLU L 105 AB 2 3 O THR F 107 ? O THR L 102 N TYR F 91 ? N TYR L 86 AB 3 4 N GLN F 95 ? N GLN L 90 O THR F 102 ? O THR L 97 AC 1 2 N THR F 119 ? N THR L 114 O ASN F 142 ? O ASN L 137 AC 2 3 N VAL F 137 ? N VAL L 132 O LEU F 184 ? O LEU L 179 AC 3 4 O THR F 183 ? O THR L 178 N LEU F 165 ? N LEU L 160 AD 1 2 O SER F 158 ? O SER L 153 N ILE F 155 ? N ILE L 150 AD 2 3 N ASN F 150 ? N ASN L 145 O THR F 202 ? O THR L 197 AD 3 4 N CYS F 199 ? N CYS L 194 O LYS F 212 ? O LYS L 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 ? ? ? ? 2 'BINDING SITE FOR RESIDUE PEG B 406' AC2 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE PEG H 410' AC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE K L 301' AC4 Software ? ? ? ? 2 'BINDING SITE FOR CHAIN B OF SUGAR BOUND TO ASN B 85 RESIDUES 401 TO 405' AC5 Software ? ? ? ? 5 'BINDING SITE FOR CHAIN E OF SUGAR BOUND TO ASN E 85 RESIDUES 401 TO 405' AC6 Software ? ? ? ? 8 'BINDING SITE FOR CHAIN H OF SUGAR BOUND TO ASN H 85 RESIDUES 401 TO 409' # 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 2 ASP A 58 ? ASP B 58 . ? 1_555 ? 2 AC1 2 HOH CA . ? HOH B 534 . ? 1_555 ? 3 AC2 3 TRP C 52 ? TRP H 52 . ? 1_555 ? 4 AC2 3 SER C 56 ? SER H 56 . ? 1_555 ? 5 AC2 3 HOH EA . ? HOH H 559 . ? 1_555 ? 6 AC3 5 TYR F 28 A TYR L 27 . ? 1_555 ? 7 AC3 5 HIS F 31 D HIS L 27 . ? 2_555 ? 8 AC3 5 SER F 72 ? SER L 67 . ? 1_555 ? 9 AC3 5 HOH HA . ? HOH L 443 . ? 1_555 ? 10 AC3 5 HOH HA . ? HOH L 444 . ? 1_555 ? 11 AC4 2 LYS A 43 ? LYS B 43 . ? 1_555 ? 12 AC4 2 ASN A 88 ? ASN B 85 . ? 1_555 ? 13 AC5 5 THR A 197 ? THR B 192 . ? 1_555 ? 14 AC5 5 THR A 199 ? THR B 194 . ? 1_555 ? 15 AC5 5 LYS A 214 ? LYS B 209 . ? 1_555 ? 16 AC5 5 LYS B 43 ? LYS E 43 . ? 1_555 ? 17 AC5 5 ASN B 88 ? ASN E 85 . ? 1_555 ? 18 AC6 8 THR A 30 ? THR B 30 . ? 4_555 ? 19 AC6 8 SER E 61 ? SER F 56 . ? 2_565 ? 20 AC6 8 GLY E 62 ? GLY F 57 . ? 2_565 ? 21 AC6 8 ARG C 38 ? ARG H 38 . ? 1_555 ? 22 AC6 8 ASN C 88 ? ASN H 85 . ? 1_555 ? 23 AC6 8 ASP C 212 ? ASP H 207 . ? 4_555 ? 24 AC6 8 LYS C 214 ? LYS H 209 . ? 4_555 ? 25 AC6 8 GLU F 128 ? GLU L 123 . ? 4_555 ? # _atom_sites.entry_id 4MA1 _atom_sites.fract_transf_matrix[1][1] 0.005095 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.002211 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.015036 _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] 0.008930 _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 K 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 HETATM 1 N N . PCA A 1 1 ? 43.900 -4.972 29.477 1.00 70.73 ? 1 PCA B N 1 HETATM 2 C CA . PCA A 1 1 ? 44.628 -5.458 30.653 1.00 66.74 ? 1 PCA B CA 1 HETATM 3 C CB . PCA A 1 1 ? 43.616 -5.304 31.800 1.00 69.40 ? 1 PCA B CB 1 HETATM 4 C CG . PCA A 1 1 ? 42.258 -5.021 31.151 1.00 73.24 ? 1 PCA B CG 1 HETATM 5 C CD . PCA A 1 1 ? 42.603 -4.738 29.705 1.00 74.36 ? 1 PCA B CD 1 HETATM 6 O OE . PCA A 1 1 ? 41.778 -4.331 28.889 1.00 78.35 ? 1 PCA B OE 1 HETATM 7 C C . PCA A 1 1 ? 45.099 -6.883 30.543 1.00 60.23 ? 1 PCA B C 1 HETATM 8 O O . PCA A 1 1 ? 44.681 -7.613 29.632 1.00 58.73 ? 1 PCA B O 1 ATOM 9 N N . VAL A 1 2 ? 45.968 -7.286 31.467 1.00 55.78 ? 2 VAL B N 1 ATOM 10 C CA . VAL A 1 2 ? 46.375 -8.682 31.579 1.00 50.93 ? 2 VAL B CA 1 ATOM 11 C C . VAL A 1 2 ? 45.235 -9.514 32.184 1.00 50.00 ? 2 VAL B C 1 ATOM 12 O O . VAL A 1 2 ? 44.648 -9.162 33.216 1.00 51.85 ? 2 VAL B O 1 ATOM 13 C CB . VAL A 1 2 ? 47.656 -8.846 32.422 1.00 48.70 ? 2 VAL B CB 1 ATOM 14 C CG1 . VAL A 1 2 ? 48.004 -10.320 32.615 1.00 45.23 ? 2 VAL B CG1 1 ATOM 15 C CG2 . VAL A 1 2 ? 48.808 -8.119 31.755 1.00 49.65 ? 2 VAL B CG2 1 ATOM 16 N N . GLN A 1 3 ? 44.920 -10.622 31.535 1.00 47.11 ? 3 GLN B N 1 ATOM 17 C CA . GLN A 1 3 ? 43.903 -11.522 32.065 1.00 45.44 ? 3 GLN B CA 1 ATOM 18 C C . GLN A 1 3 ? 44.287 -12.956 31.769 1.00 41.00 ? 3 GLN B C 1 ATOM 19 O O . GLN A 1 3 ? 44.858 -13.265 30.721 1.00 39.75 ? 3 GLN B O 1 ATOM 20 C CB . GLN A 1 3 ? 42.502 -11.216 31.482 1.00 48.80 ? 3 GLN B CB 1 ATOM 21 C CG . GLN A 1 3 ? 41.426 -10.941 32.532 1.00 51.18 ? 3 GLN B CG 1 ATOM 22 C CD . GLN A 1 3 ? 40.056 -10.610 31.938 1.00 54.68 ? 3 GLN B CD 1 ATOM 23 O OE1 . GLN A 1 3 ? 39.918 -9.684 31.132 1.00 57.03 ? 3 GLN B OE1 1 ATOM 24 N NE2 . GLN A 1 3 ? 39.025 -11.346 32.372 1.00 54.75 ? 3 GLN B NE2 1 ATOM 25 N N . LEU A 1 4 ? 43.989 -13.817 32.729 1.00 38.52 ? 4 LEU B N 1 ATOM 26 C CA . LEU A 1 4 ? 44.165 -15.235 32.584 1.00 35.66 ? 4 LEU B CA 1 ATOM 27 C C . LEU A 1 4 ? 42.874 -15.994 32.917 1.00 35.17 ? 4 LEU B C 1 ATOM 28 O O . LEU A 1 4 ? 42.563 -16.247 34.067 1.00 35.11 ? 4 LEU B O 1 ATOM 29 C CB . LEU A 1 4 ? 45.286 -15.689 33.476 1.00 34.01 ? 4 LEU B CB 1 ATOM 30 C CG . LEU A 1 4 ? 46.675 -15.270 32.968 1.00 34.05 ? 4 LEU B CG 1 ATOM 31 C CD1 . LEU A 1 4 ? 47.112 -13.925 33.545 1.00 35.60 ? 4 LEU B CD1 1 ATOM 32 C CD2 . LEU A 1 4 ? 47.779 -16.290 33.184 1.00 32.28 ? 4 LEU B CD2 1 ATOM 33 N N . LYS A 1 5 ? 42.124 -16.333 31.887 1.00 35.26 ? 5 LYS B N 1 ATOM 34 C CA . LYS A 1 5 ? 40.872 -17.079 32.032 1.00 35.77 ? 5 LYS B CA 1 ATOM 35 C C . LYS A 1 5 ? 41.186 -18.561 31.981 1.00 32.99 ? 5 LYS B C 1 ATOM 36 O O . LYS A 1 5 ? 41.912 -18.996 31.115 1.00 32.56 ? 5 LYS B O 1 ATOM 37 C CB . LYS A 1 5 ? 39.896 -16.700 30.922 1.00 38.53 ? 5 LYS B CB 1 ATOM 38 C CG . LYS A 1 5 ? 39.541 -15.219 30.894 1.00 41.70 ? 5 LYS B CG 1 ATOM 39 C CD . LYS A 1 5 ? 38.908 -14.791 29.571 1.00 45.21 ? 5 LYS B CD 1 ATOM 40 C CE . LYS A 1 5 ? 38.162 -13.460 29.665 1.00 48.93 ? 5 LYS B CE 1 ATOM 41 N NZ . LYS A 1 5 ? 36.739 -13.624 30.074 1.00 51.61 ? 5 LYS B NZ 1 ATOM 42 N N . GLU A 1 6 ? 40.657 -19.320 32.927 1.00 31.97 ? 6 GLU B N 1 ATOM 43 C CA . GLU A 1 6 ? 40.846 -20.768 32.966 1.00 30.35 ? 6 GLU B CA 1 ATOM 44 C C . GLU A 1 6 ? 39.552 -21.478 32.658 1.00 30.82 ? 6 GLU B C 1 ATOM 45 O O . GLU A 1 6 ? 38.493 -21.017 33.053 1.00 32.06 ? 6 GLU B O 1 ATOM 46 C CB . GLU A 1 6 ? 41.285 -21.219 34.341 1.00 29.66 ? 6 GLU B CB 1 ATOM 47 C CG . GLU A 1 6 ? 42.590 -20.590 34.766 1.00 29.04 ? 6 GLU B CG 1 ATOM 48 C CD . GLU A 1 6 ? 43.094 -21.106 36.108 1.00 28.75 ? 6 GLU B CD 1 ATOM 49 O OE1 . GLU A 1 6 ? 42.569 -22.143 36.611 1.00 29.09 ? 6 GLU B OE1 1 ATOM 50 O OE2 . GLU A 1 6 ? 43.997 -20.438 36.659 1.00 28.18 ? 6 GLU B OE2 1 ATOM 51 N N . SER A 1 7 ? 39.642 -22.602 31.965 1.00 29.97 ? 7 SER B N 1 ATOM 52 C CA . SER A 1 7 ? 38.474 -23.425 31.741 1.00 31.26 ? 7 SER B CA 1 ATOM 53 C C . SER A 1 7 ? 38.838 -24.888 31.962 1.00 30.62 ? 7 SER B C 1 ATOM 54 O O . SER A 1 7 ? 39.886 -25.352 31.553 1.00 29.42 ? 7 SER B O 1 ATOM 55 C CB . SER A 1 7 ? 37.943 -23.227 30.331 1.00 32.89 ? 7 SER B CB 1 ATOM 56 O OG . SER A 1 7 ? 38.899 -23.680 29.415 1.00 32.18 ? 7 SER B OG 1 ATOM 57 N N . GLY A 1 8 ? 37.952 -25.620 32.601 1.00 31.79 ? 8 GLY B N 1 ATOM 58 C CA . GLY A 1 8 ? 38.235 -27.010 32.929 1.00 31.92 ? 8 GLY B CA 1 ATOM 59 C C . GLY A 1 8 ? 37.279 -27.602 33.939 1.00 33.02 ? 8 GLY B C 1 ATOM 60 O O . GLY A 1 8 ? 36.485 -26.877 34.521 1.00 33.68 ? 8 GLY B O 1 ATOM 61 N N . PRO A 1 9 ? 37.385 -28.927 34.166 1.00 33.82 ? 9 PRO B N 1 ATOM 62 C CA . PRO A 1 9 ? 36.461 -29.689 35.010 1.00 35.36 ? 9 PRO B CA 1 ATOM 63 C C . PRO A 1 9 ? 36.559 -29.327 36.485 1.00 35.03 ? 9 PRO B C 1 ATOM 64 O O . PRO A 1 9 ? 37.647 -29.054 36.980 1.00 33.45 ? 9 PRO B O 1 ATOM 65 C CB . PRO A 1 9 ? 36.881 -31.143 34.771 1.00 35.98 ? 9 PRO B CB 1 ATOM 66 C CG . PRO A 1 9 ? 38.310 -31.066 34.400 1.00 34.53 ? 9 PRO B CG 1 ATOM 67 C CD . PRO A 1 9 ? 38.497 -29.765 33.675 1.00 33.30 ? 9 PRO B CD 1 ATOM 68 N N . GLY A 1 10 ? 35.411 -29.272 37.153 1.00 37.01 ? 10 GLY B N 1 ATOM 69 C CA . GLY A 1 10 ? 35.346 -29.168 38.603 1.00 37.78 ? 10 GLY B CA 1 ATOM 70 C C . GLY A 1 10 ? 35.550 -30.512 39.285 1.00 39.08 ? 10 GLY B C 1 ATOM 71 O O . GLY A 1 10 ? 35.893 -30.560 40.474 1.00 39.67 ? 10 GLY B O 1 ATOM 72 N N . LEU A 1 11 ? 35.331 -31.600 38.540 1.00 40.26 ? 11 LEU B N 1 ATOM 73 C CA . LEU A 1 11 ? 35.344 -32.958 39.083 1.00 41.94 ? 11 LEU B CA 1 ATOM 74 C C . LEU A 1 11 ? 36.034 -33.964 38.163 1.00 42.02 ? 11 LEU B C 1 ATOM 75 O O . LEU A 1 11 ? 35.743 -34.013 36.968 1.00 42.41 ? 11 LEU B O 1 ATOM 76 C CB . LEU A 1 11 ? 33.904 -33.398 39.317 1.00 44.73 ? 11 LEU B CB 1 ATOM 77 C CG . LEU A 1 11 ? 33.686 -34.803 39.912 1.00 47.23 ? 11 LEU B CG 1 ATOM 78 C CD1 . LEU A 1 11 ? 34.098 -34.791 41.370 1.00 47.53 ? 11 LEU B CD1 1 ATOM 79 C CD2 . LEU A 1 11 ? 32.260 -35.339 39.765 1.00 50.02 ? 11 LEU B CD2 1 ATOM 80 N N . VAL A 1 12 ? 36.911 -34.785 38.739 1.00 42.29 ? 12 VAL B N 1 ATOM 81 C CA . VAL A 1 12 ? 37.630 -35.808 37.995 1.00 43.16 ? 12 VAL B CA 1 ATOM 82 C C . VAL A 1 12 ? 37.567 -37.158 38.715 1.00 45.65 ? 12 VAL B C 1 ATOM 83 O O . VAL A 1 12 ? 37.727 -37.228 39.930 1.00 46.14 ? 12 VAL B O 1 ATOM 84 C CB . VAL A 1 12 ? 39.099 -35.405 37.801 1.00 41.50 ? 12 VAL B CB 1 ATOM 85 C CG1 . VAL A 1 12 ? 39.865 -36.466 37.021 1.00 42.82 ? 12 VAL B CG1 1 ATOM 86 C CG2 . VAL A 1 12 ? 39.202 -34.062 37.074 1.00 39.53 ? 12 VAL B CG2 1 ATOM 87 N N . GLN A 1 13 ? 37.346 -38.226 37.955 1.00 47.53 ? 13 GLN B N 1 ATOM 88 C CA . GLN A 1 13 ? 37.364 -39.585 38.496 1.00 50.79 ? 13 GLN B CA 1 ATOM 89 C C . GLN A 1 13 ? 38.775 -39.972 38.941 1.00 50.61 ? 13 GLN B C 1 ATOM 90 O O . GLN A 1 13 ? 39.744 -39.570 38.314 1.00 48.75 ? 13 GLN B O 1 ATOM 91 C CB . GLN A 1 13 ? 36.884 -40.596 37.439 1.00 53.72 ? 13 GLN B CB 1 ATOM 92 C CG . GLN A 1 13 ? 35.471 -40.391 36.911 1.00 54.63 ? 13 GLN B CG 1 ATOM 93 C CD . GLN A 1 13 ? 34.413 -40.644 37.961 1.00 56.61 ? 13 GLN B CD 1 ATOM 94 O OE1 . GLN A 1 13 ? 34.308 -41.751 38.516 1.00 59.59 ? 13 GLN B OE1 1 ATOM 95 N NE2 . GLN A 1 13 ? 33.603 -39.626 38.234 1.00 55.56 ? 13 GLN B NE2 1 ATOM 96 N N . PRO A 1 14 ? 38.895 -40.759 40.030 1.00 52.80 ? 14 PRO B N 1 ATOM 97 C CA . PRO A 1 14 ? 40.188 -41.330 40.410 1.00 53.90 ? 14 PRO B CA 1 ATOM 98 C C . PRO A 1 14 ? 40.845 -42.107 39.277 1.00 55.39 ? 14 PRO B C 1 ATOM 99 O O . PRO A 1 14 ? 40.207 -42.957 38.659 1.00 57.61 ? 14 PRO B O 1 ATOM 100 C CB . PRO A 1 14 ? 39.838 -42.277 41.550 1.00 57.19 ? 14 PRO B CB 1 ATOM 101 C CG . PRO A 1 14 ? 38.661 -41.643 42.184 1.00 56.41 ? 14 PRO B CG 1 ATOM 102 C CD . PRO A 1 14 ? 37.889 -40.969 41.077 1.00 54.39 ? 14 PRO B CD 1 ATOM 103 N N . SER A 1 15 ? 42.113 -41.783 39.023 1.00 54.36 ? 15 SER B N 1 ATOM 104 C CA . SER A 1 15 ? 42.917 -42.373 37.948 1.00 55.93 ? 15 SER B CA 1 ATOM 105 C C . SER A 1 15 ? 42.642 -41.812 36.545 1.00 54.13 ? 15 SER B C 1 ATOM 106 O O . SER A 1 15 ? 43.226 -42.290 35.584 1.00 55.85 ? 15 SER B O 1 ATOM 107 C CB . SER A 1 15 ? 42.726 -43.883 37.871 1.00 60.54 ? 15 SER B CB 1 ATOM 108 O OG . SER A 1 15 ? 41.740 -44.179 36.903 1.00 61.62 ? 15 SER B OG 1 ATOM 109 N N . GLN A 1 16 ? 41.723 -40.865 36.407 1.00 51.47 ? 16 GLN B N 1 ATOM 110 C CA . GLN A 1 16 ? 41.538 -40.169 35.133 1.00 49.83 ? 16 GLN B CA 1 ATOM 111 C C . GLN A 1 16 ? 42.318 -38.854 35.109 1.00 46.02 ? 16 GLN B C 1 ATOM 112 O O . GLN A 1 16 ? 42.846 -38.408 36.132 1.00 44.85 ? 16 GLN B O 1 ATOM 113 C CB . GLN A 1 16 ? 40.050 -39.914 34.849 1.00 49.82 ? 16 GLN B CB 1 ATOM 114 C CG . GLN A 1 16 ? 39.172 -41.152 34.644 1.00 53.60 ? 16 GLN B CG 1 ATOM 115 C CD . GLN A 1 16 ? 39.721 -42.143 33.641 1.00 56.77 ? 16 GLN B CD 1 ATOM 116 O OE1 . GLN A 1 16 ? 40.377 -41.764 32.666 1.00 56.26 ? 16 GLN B OE1 1 ATOM 117 N NE2 . GLN A 1 16 ? 39.421 -43.421 33.850 1.00 60.66 ? 16 GLN B NE2 1 ATOM 118 N N . SER A 1 17 ? 42.369 -38.231 33.938 1.00 44.64 ? 17 SER B N 1 ATOM 119 C CA . SER A 1 17 ? 43.231 -37.073 33.710 1.00 41.76 ? 17 SER B CA 1 ATOM 120 C C . SER A 1 17 ? 42.526 -35.739 33.888 1.00 38.63 ? 17 SER B C 1 ATOM 121 O O . SER A 1 17 ? 41.319 -35.643 33.764 1.00 39.21 ? 17 SER B O 1 ATOM 122 C CB . SER A 1 17 ? 43.824 -37.128 32.299 1.00 42.78 ? 17 SER B CB 1 ATOM 123 O OG . SER A 1 17 ? 42.858 -36.749 31.329 1.00 42.97 ? 17 SER B OG 1 ATOM 124 N N . LEU A 1 18 ? 43.310 -34.711 34.168 1.00 36.08 ? 18 LEU B N 1 ATOM 125 C CA . LEU A 1 18 ? 42.813 -33.356 34.372 1.00 33.55 ? 18 LEU B CA 1 ATOM 126 C C . LEU A 1 18 ? 43.363 -32.471 33.282 1.00 32.28 ? 18 LEU B C 1 ATOM 127 O O . LEU A 1 18 ? 44.583 -32.379 33.141 1.00 31.87 ? 18 LEU B O 1 ATOM 128 C CB . LEU A 1 18 ? 43.294 -32.809 35.715 1.00 32.13 ? 18 LEU B CB 1 ATOM 129 C CG . LEU A 1 18 ? 43.180 -31.295 35.897 1.00 30.11 ? 18 LEU B CG 1 ATOM 130 C CD1 . LEU A 1 18 ? 41.751 -30.825 35.740 1.00 30.24 ? 18 LEU B CD1 1 ATOM 131 C CD2 . LEU A 1 18 ? 43.703 -30.877 37.257 1.00 29.82 ? 18 LEU B CD2 1 ATOM 132 N N . SER A 1 19 ? 42.478 -31.797 32.557 1.00 31.77 ? 19 SER B N 1 ATOM 133 C CA . SER A 1 19 ? 42.862 -30.897 31.494 1.00 31.25 ? 19 SER B CA 1 ATOM 134 C C . SER A 1 19 ? 42.288 -29.518 31.751 1.00 29.91 ? 19 SER B C 1 ATOM 135 O O . SER A 1 19 ? 41.076 -29.354 31.849 1.00 30.73 ? 19 SER B O 1 ATOM 136 C CB . SER A 1 19 ? 42.375 -31.428 30.149 1.00 33.19 ? 19 SER B CB 1 ATOM 137 O OG . SER A 1 19 ? 43.106 -32.589 29.855 1.00 34.99 ? 19 SER B OG 1 ATOM 138 N N . ILE A 1 20 ? 43.174 -28.533 31.867 1.00 28.52 ? 20 ILE B N 1 ATOM 139 C CA . ILE A 1 20 ? 42.773 -27.147 32.012 1.00 27.48 ? 20 ILE B CA 1 ATOM 140 C C . ILE A 1 20 ? 43.393 -26.328 30.910 1.00 27.12 ? 20 ILE B C 1 ATOM 141 O O . ILE A 1 20 ? 44.551 -26.513 30.574 1.00 26.37 ? 20 ILE B O 1 ATOM 142 C CB . ILE A 1 20 ? 43.220 -26.564 33.361 1.00 26.57 ? 20 ILE B CB 1 ATOM 143 C CG1 . ILE A 1 20 ? 42.687 -27.423 34.510 1.00 27.36 ? 20 ILE B CG1 1 ATOM 144 C CG2 . ILE A 1 20 ? 42.741 -25.120 33.497 1.00 26.27 ? 20 ILE B CG2 1 ATOM 145 C CD1 . ILE A 1 20 ? 43.272 -27.059 35.858 1.00 26.98 ? 20 ILE B CD1 1 ATOM 146 N N . THR A 1 21 ? 42.599 -25.420 30.362 1.00 27.74 ? 21 THR B N 1 ATOM 147 C CA . THR A 1 21 ? 43.048 -24.519 29.342 1.00 28.05 ? 21 THR B CA 1 ATOM 148 C C . THR A 1 21 ? 43.082 -23.112 29.934 1.00 27.60 ? 21 THR B C 1 ATOM 149 O O . THR A 1 21 ? 42.104 -22.611 30.499 1.00 28.14 ? 21 THR B O 1 ATOM 150 C CB . THR A 1 21 ? 42.152 -24.595 28.097 1.00 30.00 ? 21 THR B CB 1 ATOM 151 O OG1 . THR A 1 21 ? 42.289 -25.893 27.509 1.00 30.85 ? 21 THR B OG1 1 ATOM 152 C CG2 . THR A 1 21 ? 42.566 -23.551 27.059 1.00 30.53 ? 21 THR B CG2 1 ATOM 153 N N . CYS A 1 22 ? 44.245 -22.502 29.834 1.00 27.10 ? 22 CYS B N 1 ATOM 154 C CA . CYS A 1 22 ? 44.425 -21.146 30.287 1.00 27.54 ? 22 CYS B CA 1 ATOM 155 C C . CYS A 1 22 ? 44.417 -20.273 29.039 1.00 28.33 ? 22 CYS B C 1 ATOM 156 O O . CYS A 1 22 ? 45.226 -20.450 28.143 1.00 28.52 ? 22 CYS B O 1 ATOM 157 C CB . CYS A 1 22 ? 45.735 -21.041 31.084 1.00 26.78 ? 22 CYS B CB 1 ATOM 158 S SG . CYS A 1 22 ? 46.240 -19.384 31.608 1.00 27.61 ? 22 CYS B SG 1 ATOM 159 N N . THR A 1 23 ? 43.466 -19.366 28.955 1.00 29.37 ? 23 THR B N 1 ATOM 160 C CA . THR A 1 23 ? 43.455 -18.446 27.823 1.00 31.07 ? 23 THR B CA 1 ATOM 161 C C . THR A 1 23 ? 43.887 -17.037 28.257 1.00 31.17 ? 23 THR B C 1 ATOM 162 O O . THR A 1 23 ? 43.293 -16.417 29.150 1.00 31.76 ? 23 THR B O 1 ATOM 163 C CB . THR A 1 23 ? 42.217 -18.576 26.890 1.00 33.52 ? 23 THR B CB 1 ATOM 164 O OG1 . THR A 1 23 ? 41.679 -17.297 26.536 1.00 35.74 ? 23 THR B OG1 1 ATOM 165 C CG2 . THR A 1 23 ? 41.161 -19.449 27.489 1.00 33.77 ? 23 THR B CG2 1 ATOM 166 N N . VAL A 1 24 ? 44.932 -16.557 27.589 1.00 30.83 ? 24 VAL B N 1 ATOM 167 C CA . VAL A 1 24 ? 45.672 -15.382 27.990 1.00 30.89 ? 24 VAL B CA 1 ATOM 168 C C . VAL A 1 24 ? 45.283 -14.183 27.132 1.00 33.05 ? 24 VAL B C 1 ATOM 169 O O . VAL A 1 24 ? 45.058 -14.323 25.943 1.00 33.99 ? 24 VAL B O 1 ATOM 170 C CB . VAL A 1 24 ? 47.193 -15.674 27.880 1.00 29.63 ? 24 VAL B CB 1 ATOM 171 C CG1 . VAL A 1 24 ? 47.959 -14.554 27.189 1.00 31.10 ? 24 VAL B CG1 1 ATOM 172 C CG2 . VAL A 1 24 ? 47.774 -15.975 29.242 1.00 27.92 ? 24 VAL B CG2 1 ATOM 173 N N . SER A 1 25 ? 45.281 -13.002 27.746 1.00 34.04 ? 25 SER B N 1 ATOM 174 C CA . SER A 1 25 ? 45.041 -11.759 27.031 1.00 36.76 ? 25 SER B CA 1 ATOM 175 C C . SER A 1 25 ? 45.750 -10.624 27.725 1.00 37.21 ? 25 SER B C 1 ATOM 176 O O . SER A 1 25 ? 45.903 -10.630 28.949 1.00 36.22 ? 25 SER B O 1 ATOM 177 C CB . SER A 1 25 ? 43.568 -11.450 26.991 1.00 39.25 ? 25 SER B CB 1 ATOM 178 O OG . SER A 1 25 ? 43.115 -11.028 28.255 1.00 39.69 ? 25 SER B OG 1 ATOM 179 N N . GLY A 1 26 ? 46.160 -9.644 26.929 1.00 39.27 ? 26 GLY B N 1 ATOM 180 C CA . GLY A 1 26 ? 46.918 -8.476 27.419 1.00 40.34 ? 26 GLY B CA 1 ATOM 181 C C . GLY A 1 26 ? 48.432 -8.581 27.192 1.00 39.06 ? 26 GLY B C 1 ATOM 182 O O . GLY A 1 26 ? 49.151 -7.577 27.247 1.00 40.49 ? 26 GLY B O 1 ATOM 183 N N . PHE A 1 27 ? 48.918 -9.804 26.985 1.00 36.61 ? 27 PHE B N 1 ATOM 184 C CA . PHE A 1 27 ? 50.311 -10.045 26.675 1.00 35.70 ? 27 PHE B CA 1 ATOM 185 C C . PHE A 1 27 ? 50.463 -11.312 25.829 1.00 34.23 ? 27 PHE B C 1 ATOM 186 O O . PHE A 1 27 ? 49.552 -12.149 25.751 1.00 33.39 ? 27 PHE B O 1 ATOM 187 C CB . PHE A 1 27 ? 51.115 -10.214 27.952 1.00 34.37 ? 27 PHE B CB 1 ATOM 188 C CG . PHE A 1 27 ? 50.818 -11.492 28.685 1.00 32.42 ? 27 PHE B CG 1 ATOM 189 C CD1 . PHE A 1 27 ? 49.797 -11.557 29.606 1.00 32.44 ? 27 PHE B CD1 1 ATOM 190 C CD2 . PHE A 1 27 ? 51.575 -12.636 28.442 1.00 31.17 ? 27 PHE B CD2 1 ATOM 191 C CE1 . PHE A 1 27 ? 49.540 -12.745 30.279 1.00 30.79 ? 27 PHE B CE1 1 ATOM 192 C CE2 . PHE A 1 27 ? 51.323 -13.817 29.098 1.00 29.44 ? 27 PHE B CE2 1 ATOM 193 C CZ . PHE A 1 27 ? 50.302 -13.879 30.021 1.00 29.25 ? 27 PHE B CZ 1 ATOM 194 N N . SER A 1 28 ? 51.645 -11.463 25.245 1.00 34.07 ? 28 SER B N 1 ATOM 195 C CA . SER A 1 28 ? 51.884 -12.489 24.248 1.00 33.76 ? 28 SER B CA 1 ATOM 196 C C . SER A 1 28 ? 52.677 -13.665 24.821 1.00 31.74 ? 28 SER B C 1 ATOM 197 O O . SER A 1 28 ? 53.687 -13.478 25.519 1.00 31.00 ? 28 SER B O 1 ATOM 198 C CB . SER A 1 28 ? 52.655 -11.896 23.086 1.00 35.75 ? 28 SER B CB 1 ATOM 199 O OG . SER A 1 28 ? 52.818 -12.874 22.090 1.00 36.29 ? 28 SER B OG 1 ATOM 200 N N . LEU A 1 29 ? 52.252 -14.873 24.481 1.00 31.14 ? 29 LEU B N 1 ATOM 201 C CA . LEU A 1 29 ? 52.935 -16.067 24.955 1.00 30.00 ? 29 LEU B CA 1 ATOM 202 C C . LEU A 1 29 ? 54.313 -16.274 24.316 1.00 31.27 ? 29 LEU B C 1 ATOM 203 O O . LEU A 1 29 ? 55.122 -17.063 24.815 1.00 30.78 ? 29 LEU B O 1 ATOM 204 C CB . LEU A 1 29 ? 52.082 -17.305 24.723 1.00 29.78 ? 29 LEU B CB 1 ATOM 205 C CG . LEU A 1 29 ? 50.821 -17.431 25.575 1.00 28.75 ? 29 LEU B CG 1 ATOM 206 C CD1 . LEU A 1 29 ? 49.934 -18.532 25.002 1.00 29.31 ? 29 LEU B CD1 1 ATOM 207 C CD2 . LEU A 1 29 ? 51.143 -17.697 27.041 1.00 27.02 ? 29 LEU B CD2 1 ATOM 208 N N . THR A 1 30 ? 54.585 -15.590 23.206 1.00 33.42 ? 30 THR B N 1 ATOM 209 C CA . THR A 1 30 ? 55.936 -15.583 22.631 1.00 34.81 ? 30 THR B CA 1 ATOM 210 C C . THR A 1 30 ? 56.904 -14.760 23.462 1.00 34.34 ? 30 THR B C 1 ATOM 211 O O . THR A 1 30 ? 58.100 -14.891 23.304 1.00 35.38 ? 30 THR B O 1 ATOM 212 C CB . THR A 1 30 ? 55.977 -14.984 21.207 1.00 37.66 ? 30 THR B CB 1 ATOM 213 O OG1 . THR A 1 30 ? 55.549 -13.607 21.247 1.00 38.43 ? 30 THR B OG1 1 ATOM 214 C CG2 . THR A 1 30 ? 55.121 -15.798 20.233 1.00 38.70 ? 30 THR B CG2 1 ATOM 215 N N . THR A 1 31 ? 56.385 -13.888 24.317 1.00 33.53 ? 31 THR B N 1 ATOM 216 C CA . THR A 1 31 ? 57.216 -13.000 25.120 1.00 33.61 ? 31 THR B CA 1 ATOM 217 C C . THR A 1 31 ? 57.341 -13.460 26.576 1.00 32.07 ? 31 THR B C 1 ATOM 218 O O . THR A 1 31 ? 58.367 -13.237 27.206 1.00 32.42 ? 31 THR B O 1 ATOM 219 C CB . THR A 1 31 ? 56.644 -11.572 25.120 1.00 34.78 ? 31 THR B CB 1 ATOM 220 O OG1 . THR A 1 31 ? 56.408 -11.140 23.767 1.00 36.73 ? 31 THR B OG1 1 ATOM 221 C CG2 . THR A 1 31 ? 57.618 -10.607 25.771 1.00 35.88 ? 31 THR B CG2 1 ATOM 222 N N . TYR A 1 32 ? 56.303 -14.088 27.124 1.00 30.62 ? 32 TYR B N 1 ATOM 223 C CA . TYR A 1 32 ? 56.294 -14.413 28.550 1.00 29.46 ? 32 TYR B CA 1 ATOM 224 C C . TYR A 1 32 ? 55.951 -15.884 28.808 1.00 28.35 ? 32 TYR B C 1 ATOM 225 O O . TYR A 1 32 ? 55.172 -16.492 28.085 1.00 28.08 ? 32 TYR B O 1 ATOM 226 C CB . TYR A 1 32 ? 55.291 -13.523 29.280 1.00 29.25 ? 32 TYR B CB 1 ATOM 227 C CG . TYR A 1 32 ? 55.540 -12.054 29.194 1.00 30.97 ? 32 TYR B CG 1 ATOM 228 C CD1 . TYR A 1 32 ? 54.992 -11.311 28.154 1.00 32.47 ? 32 TYR B CD1 1 ATOM 229 C CD2 . TYR A 1 32 ? 56.265 -11.387 30.161 1.00 31.67 ? 32 TYR B CD2 1 ATOM 230 C CE1 . TYR A 1 32 ? 55.191 -9.949 28.059 1.00 34.37 ? 32 TYR B CE1 1 ATOM 231 C CE2 . TYR A 1 32 ? 56.467 -10.023 30.081 1.00 33.67 ? 32 TYR B CE2 1 ATOM 232 C CZ . TYR A 1 32 ? 55.926 -9.312 29.029 1.00 35.04 ? 32 TYR B CZ 1 ATOM 233 O OH . TYR A 1 32 ? 56.127 -7.955 28.928 1.00 37.65 ? 32 TYR B OH 1 ATOM 234 N N . GLY A 1 33 ? 56.543 -16.439 29.856 1.00 28.20 ? 33 GLY B N 1 ATOM 235 C CA . GLY A 1 33 ? 56.242 -17.799 30.296 1.00 27.50 ? 33 GLY B CA 1 ATOM 236 C C . GLY A 1 33 ? 55.034 -17.824 31.228 1.00 26.60 ? 33 GLY B C 1 ATOM 237 O O . GLY A 1 33 ? 54.675 -16.794 31.834 1.00 26.73 ? 33 GLY B O 1 ATOM 238 N N . VAL A 1 34 ? 54.403 -19.000 31.329 1.00 25.60 ? 34 VAL B N 1 ATOM 239 C CA . VAL A 1 34 ? 53.245 -19.175 32.166 1.00 24.75 ? 34 VAL B CA 1 ATOM 240 C C . VAL A 1 34 ? 53.446 -20.362 33.103 1.00 24.61 ? 34 VAL B C 1 ATOM 241 O O . VAL A 1 34 ? 53.750 -21.473 32.640 1.00 24.68 ? 34 VAL B O 1 ATOM 242 C CB . VAL A 1 34 ? 51.972 -19.387 31.335 1.00 24.75 ? 34 VAL B CB 1 ATOM 243 C CG1 . VAL A 1 34 ? 50.782 -19.717 32.250 1.00 24.26 ? 34 VAL B CG1 1 ATOM 244 C CG2 . VAL A 1 34 ? 51.681 -18.156 30.489 1.00 25.27 ? 34 VAL B CG2 1 ATOM 245 N N . HIS A 1 35 ? 53.265 -20.115 34.409 1.00 24.23 ? 35 HIS B N 1 ATOM 246 C CA . HIS A 1 35 ? 53.459 -21.132 35.432 1.00 24.62 ? 35 HIS B CA 1 ATOM 247 C C . HIS A 1 35 ? 52.125 -21.753 35.845 1.00 24.20 ? 35 HIS B C 1 ATOM 248 O O . HIS A 1 35 ? 51.047 -21.187 35.634 1.00 23.13 ? 35 HIS B O 1 ATOM 249 C CB . HIS A 1 35 ? 54.157 -20.539 36.656 1.00 25.51 ? 35 HIS B CB 1 ATOM 250 C CG . HIS A 1 35 ? 55.433 -19.823 36.340 1.00 26.08 ? 35 HIS B CG 1 ATOM 251 N ND1 . HIS A 1 35 ? 56.666 -20.304 36.712 1.00 27.25 ? 35 HIS B ND1 1 ATOM 252 C CD2 . HIS A 1 35 ? 55.667 -18.656 35.693 1.00 26.10 ? 35 HIS B CD2 1 ATOM 253 C CE1 . HIS A 1 35 ? 57.604 -19.468 36.317 1.00 27.99 ? 35 HIS B CE1 1 ATOM 254 N NE2 . HIS A 1 35 ? 57.029 -18.455 35.700 1.00 27.24 ? 35 HIS B NE2 1 ATOM 255 N N . TRP A 1 36 ? 52.213 -22.945 36.409 1.00 25.21 ? 36 TRP B N 1 ATOM 256 C CA . TRP A 1 36 ? 51.039 -23.603 36.975 1.00 25.56 ? 36 TRP B CA 1 ATOM 257 C C . TRP A 1 36 ? 51.287 -23.903 38.431 1.00 26.67 ? 36 TRP B C 1 ATOM 258 O O . TRP A 1 36 ? 52.341 -24.408 38.804 1.00 27.83 ? 36 TRP B O 1 ATOM 259 C CB . TRP A 1 36 ? 50.679 -24.856 36.183 1.00 25.63 ? 36 TRP B CB 1 ATOM 260 C CG . TRP A 1 36 ? 50.143 -24.493 34.856 1.00 25.07 ? 36 TRP B CG 1 ATOM 261 C CD1 . TRP A 1 36 ? 50.866 -24.209 33.737 1.00 25.43 ? 36 TRP B CD1 1 ATOM 262 C CD2 . TRP A 1 36 ? 48.763 -24.313 34.494 1.00 24.96 ? 36 TRP B CD2 1 ATOM 263 N NE1 . TRP A 1 36 ? 50.027 -23.885 32.692 1.00 25.17 ? 36 TRP B NE1 1 ATOM 264 C CE2 . TRP A 1 36 ? 48.731 -23.941 33.131 1.00 24.81 ? 36 TRP B CE2 1 ATOM 265 C CE3 . TRP A 1 36 ? 47.555 -24.451 35.184 1.00 24.98 ? 36 TRP B CE3 1 ATOM 266 C CZ2 . TRP A 1 36 ? 47.538 -23.713 32.442 1.00 25.23 ? 36 TRP B CZ2 1 ATOM 267 C CZ3 . TRP A 1 36 ? 46.381 -24.221 34.510 1.00 25.22 ? 36 TRP B CZ3 1 ATOM 268 C CH2 . TRP A 1 36 ? 46.373 -23.859 33.146 1.00 25.27 ? 36 TRP B CH2 1 ATOM 269 N N . VAL A 1 37 ? 50.319 -23.522 39.248 1.00 27.02 ? 37 VAL B N 1 ATOM 270 C CA . VAL A 1 37 ? 50.410 -23.615 40.694 1.00 28.54 ? 37 VAL B CA 1 ATOM 271 C C . VAL A 1 37 ? 49.102 -24.222 41.203 1.00 29.01 ? 37 VAL B C 1 ATOM 272 O O . VAL A 1 37 ? 48.036 -24.015 40.613 1.00 28.38 ? 37 VAL B O 1 ATOM 273 C CB . VAL A 1 37 ? 50.632 -22.218 41.301 1.00 29.26 ? 37 VAL B CB 1 ATOM 274 C CG1 . VAL A 1 37 ? 50.515 -22.241 42.815 1.00 31.48 ? 37 VAL B CG1 1 ATOM 275 C CG2 . VAL A 1 37 ? 52.005 -21.705 40.915 1.00 29.51 ? 37 VAL B CG2 1 ATOM 276 N N . ARG A 1 38 ? 49.181 -24.992 42.277 1.00 30.38 ? 38 ARG B N 1 ATOM 277 C CA . ARG A 1 38 ? 47.976 -25.487 42.917 1.00 31.03 ? 38 ARG B CA 1 ATOM 278 C C . ARG A 1 38 ? 48.019 -25.265 44.399 1.00 33.33 ? 38 ARG B C 1 ATOM 279 O O . ARG A 1 38 ? 49.078 -25.080 44.996 1.00 34.01 ? 38 ARG B O 1 ATOM 280 C CB . ARG A 1 38 ? 47.759 -26.968 42.643 1.00 31.27 ? 38 ARG B CB 1 ATOM 281 C CG . ARG A 1 38 ? 48.518 -27.908 43.552 1.00 33.16 ? 38 ARG B CG 1 ATOM 282 C CD . ARG A 1 38 ? 48.252 -29.339 43.157 1.00 33.61 ? 38 ARG B CD 1 ATOM 283 N NE . ARG A 1 38 ? 48.991 -30.256 44.006 1.00 36.11 ? 38 ARG B NE 1 ATOM 284 C CZ . ARG A 1 38 ? 48.912 -31.578 43.931 1.00 37.48 ? 38 ARG B CZ 1 ATOM 285 N NH1 . ARG A 1 38 ? 48.130 -32.158 43.025 1.00 36.79 ? 38 ARG B NH1 1 ATOM 286 N NH2 . ARG A 1 38 ? 49.633 -32.319 44.756 1.00 39.97 ? 38 ARG B NH2 1 ATOM 287 N N . GLN A 1 39 ? 46.844 -25.348 44.989 1.00 34.75 ? 39 GLN B N 1 ATOM 288 C CA . GLN A 1 39 ? 46.669 -24.970 46.361 1.00 37.94 ? 39 GLN B CA 1 ATOM 289 C C . GLN A 1 39 ? 45.704 -25.906 47.048 1.00 40.26 ? 39 GLN B C 1 ATOM 290 O O . GLN A 1 39 ? 44.608 -26.170 46.543 1.00 39.89 ? 39 GLN B O 1 ATOM 291 C CB . GLN A 1 39 ? 46.184 -23.541 46.404 1.00 37.82 ? 39 GLN B CB 1 ATOM 292 C CG . GLN A 1 39 ? 45.319 -23.196 47.564 1.00 40.37 ? 39 GLN B CG 1 ATOM 293 C CD . GLN A 1 39 ? 45.437 -21.722 47.826 1.00 41.29 ? 39 GLN B CD 1 ATOM 294 O OE1 . GLN A 1 39 ? 45.038 -20.897 47.013 1.00 40.22 ? 39 GLN B OE1 1 ATOM 295 N NE2 . GLN A 1 39 ? 46.049 -21.385 48.928 1.00 43.74 ? 39 GLN B NE2 1 ATOM 296 N N . SER A 1 40 ? 46.134 -26.421 48.189 1.00 43.48 ? 40 SER B N 1 ATOM 297 C CA . SER A 1 40 ? 45.288 -27.282 49.017 1.00 46.67 ? 40 SER B CA 1 ATOM 298 C C . SER A 1 40 ? 45.428 -26.849 50.473 1.00 50.57 ? 40 SER B C 1 ATOM 299 O O . SER A 1 40 ? 46.461 -26.302 50.869 1.00 51.69 ? 40 SER B O 1 ATOM 300 C CB . SER A 1 40 ? 45.677 -28.766 48.864 1.00 47.43 ? 40 SER B CB 1 ATOM 301 O OG . SER A 1 40 ? 47.068 -28.973 49.090 1.00 48.33 ? 40 SER B OG 1 ATOM 302 N N . PRO A 1 41 ? 44.394 -27.083 51.283 1.00 53.34 ? 41 PRO B N 1 ATOM 303 C CA . PRO A 1 41 ? 44.522 -26.700 52.691 1.00 57.82 ? 41 PRO B CA 1 ATOM 304 C C . PRO A 1 41 ? 45.753 -27.334 53.367 1.00 60.73 ? 41 PRO B C 1 ATOM 305 O O . PRO A 1 41 ? 46.405 -26.695 54.189 1.00 63.30 ? 41 PRO B O 1 ATOM 306 C CB . PRO A 1 41 ? 43.206 -27.199 53.313 1.00 59.52 ? 41 PRO B CB 1 ATOM 307 C CG . PRO A 1 41 ? 42.679 -28.222 52.359 1.00 57.06 ? 41 PRO B CG 1 ATOM 308 C CD . PRO A 1 41 ? 43.127 -27.775 50.999 1.00 53.05 ? 41 PRO B CD 1 ATOM 309 N N . GLY A 1 42 ? 46.067 -28.574 53.000 1.00 61.42 ? 42 GLY B N 1 ATOM 310 C CA . GLY A 1 42 ? 47.173 -29.307 53.605 1.00 64.98 ? 42 GLY B CA 1 ATOM 311 C C . GLY A 1 42 ? 48.554 -28.856 53.161 1.00 65.10 ? 42 GLY B C 1 ATOM 312 O O . GLY A 1 42 ? 49.445 -28.701 53.991 1.00 69.35 ? 42 GLY B O 1 ATOM 313 N N . LYS A 1 43 ? 48.737 -28.640 51.860 1.00 62.09 ? 43 LYS B N 1 ATOM 314 C CA . LYS A 1 43 ? 50.073 -28.370 51.284 1.00 61.45 ? 43 LYS B CA 1 ATOM 315 C C . LYS A 1 43 ? 50.415 -26.890 51.055 1.00 58.39 ? 43 LYS B C 1 ATOM 316 O O . LYS A 1 43 ? 51.542 -26.579 50.663 1.00 57.95 ? 43 LYS B O 1 ATOM 317 C CB . LYS A 1 43 ? 50.232 -29.119 49.949 1.00 60.26 ? 43 LYS B CB 1 ATOM 318 C CG . LYS A 1 43 ? 50.578 -30.590 50.107 1.00 63.91 ? 43 LYS B CG 1 ATOM 319 C CD . LYS A 1 43 ? 52.061 -30.753 50.419 1.00 67.54 ? 43 LYS B CD 1 ATOM 320 C CE . LYS A 1 43 ? 52.329 -31.964 51.296 1.00 73.17 ? 43 LYS B CE 1 ATOM 321 N NZ . LYS A 1 43 ? 52.438 -33.210 50.486 1.00 73.75 ? 43 LYS B NZ 1 ATOM 322 N N . GLY A 1 44 ? 49.459 -25.990 51.297 1.00 56.28 ? 44 GLY B N 1 ATOM 323 C CA . GLY A 1 44 ? 49.612 -24.572 50.964 1.00 53.55 ? 44 GLY B CA 1 ATOM 324 C C . GLY A 1 44 ? 49.771 -24.447 49.460 1.00 48.36 ? 44 GLY B C 1 ATOM 325 O O . GLY A 1 44 ? 49.166 -25.217 48.695 1.00 46.22 ? 44 GLY B O 1 ATOM 326 N N . LEU A 1 45 ? 50.615 -23.517 49.025 1.00 45.99 ? 45 LEU B N 1 ATOM 327 C CA . LEU A 1 45 ? 50.815 -23.311 47.587 1.00 41.43 ? 45 LEU B CA 1 ATOM 328 C C . LEU A 1 45 ? 51.938 -24.171 47.080 1.00 40.21 ? 45 LEU B C 1 ATOM 329 O O . LEU A 1 45 ? 52.975 -24.301 47.706 1.00 42.81 ? 45 LEU B O 1 ATOM 330 C CB . LEU A 1 45 ? 51.137 -21.863 47.272 1.00 40.99 ? 45 LEU B CB 1 ATOM 331 C CG . LEU A 1 45 ? 49.968 -20.893 47.350 1.00 41.00 ? 45 LEU B CG 1 ATOM 332 C CD1 . LEU A 1 45 ? 50.458 -19.460 47.314 1.00 41.85 ? 45 LEU B CD1 1 ATOM 333 C CD2 . LEU A 1 45 ? 49.017 -21.149 46.193 1.00 38.26 ? 45 LEU B CD2 1 ATOM 334 N N . GLU A 1 46 ? 51.752 -24.702 45.899 1.00 36.98 ? 46 GLU B N 1 ATOM 335 C CA . GLU A 1 46 ? 52.641 -25.705 45.364 1.00 36.56 ? 46 GLU B CA 1 ATOM 336 C C . GLU A 1 46 ? 52.919 -25.449 43.876 1.00 33.58 ? 46 GLU B C 1 ATOM 337 O O . GLU A 1 46 ? 52.026 -25.525 43.051 1.00 31.41 ? 46 GLU B O 1 ATOM 338 C CB . GLU A 1 46 ? 51.976 -27.054 45.550 1.00 37.31 ? 46 GLU B CB 1 ATOM 339 C CG . GLU A 1 46 ? 52.913 -28.234 45.499 1.00 39.08 ? 46 GLU B CG 1 ATOM 340 C CD . GLU A 1 46 ? 52.327 -29.466 46.162 1.00 41.04 ? 46 GLU B CD 1 ATOM 341 O OE1 . GLU A 1 46 ? 51.143 -29.457 46.577 1.00 41.03 ? 46 GLU B OE1 1 ATOM 342 O OE2 . GLU A 1 46 ? 53.063 -30.453 46.280 1.00 43.21 ? 46 GLU B OE2 1 ATOM 343 N N . TRP A 1 47 ? 54.171 -25.155 43.547 1.00 33.68 ? 47 TRP B N 1 ATOM 344 C CA . TRP A 1 47 ? 54.561 -24.898 42.171 1.00 31.62 ? 47 TRP B CA 1 ATOM 345 C C . TRP A 1 47 ? 54.699 -26.205 41.397 1.00 31.55 ? 47 TRP B C 1 ATOM 346 O O . TRP A 1 47 ? 55.400 -27.121 41.831 1.00 33.60 ? 47 TRP B O 1 ATOM 347 C CB . TRP A 1 47 ? 55.878 -24.148 42.135 1.00 32.50 ? 47 TRP B CB 1 ATOM 348 C CG . TRP A 1 47 ? 56.280 -23.780 40.777 1.00 31.00 ? 47 TRP B CG 1 ATOM 349 C CD1 . TRP A 1 47 ? 55.897 -22.678 40.090 1.00 29.23 ? 47 TRP B CD1 1 ATOM 350 C CD2 . TRP A 1 47 ? 57.174 -24.504 39.922 1.00 31.47 ? 47 TRP B CD2 1 ATOM 351 N NE1 . TRP A 1 47 ? 56.497 -22.661 38.865 1.00 28.63 ? 47 TRP B NE1 1 ATOM 352 C CE2 . TRP A 1 47 ? 57.277 -23.776 38.727 1.00 30.00 ? 47 TRP B CE2 1 ATOM 353 C CE3 . TRP A 1 47 ? 57.886 -25.702 40.047 1.00 33.52 ? 47 TRP B CE3 1 ATOM 354 C CZ2 . TRP A 1 47 ? 58.054 -24.204 37.658 1.00 30.52 ? 47 TRP B CZ2 1 ATOM 355 C CZ3 . TRP A 1 47 ? 58.666 -26.125 38.982 1.00 34.15 ? 47 TRP B CZ3 1 ATOM 356 C CH2 . TRP A 1 47 ? 58.751 -25.375 37.807 1.00 32.54 ? 47 TRP B CH2 1 ATOM 357 N N . LEU A 1 48 ? 54.056 -26.263 40.236 1.00 29.63 ? 48 LEU B N 1 ATOM 358 C CA . LEU A 1 48 ? 53.932 -27.501 39.472 1.00 30.00 ? 48 LEU B CA 1 ATOM 359 C C . LEU A 1 48 ? 54.783 -27.486 38.210 1.00 29.90 ? 48 LEU B C 1 ATOM 360 O O . LEU A 1 48 ? 55.486 -28.452 37.904 1.00 31.75 ? 48 LEU B O 1 ATOM 361 C CB . LEU A 1 48 ? 52.472 -27.733 39.090 1.00 28.60 ? 48 LEU B CB 1 ATOM 362 C CG . LEU A 1 48 ? 51.511 -27.979 40.241 1.00 29.15 ? 48 LEU B CG 1 ATOM 363 C CD1 . LEU A 1 48 ? 50.092 -28.023 39.696 1.00 28.05 ? 48 LEU B CD1 1 ATOM 364 C CD2 . LEU A 1 48 ? 51.855 -29.262 40.972 1.00 31.60 ? 48 LEU B CD2 1 ATOM 365 N N . GLY A 1 49 ? 54.702 -26.407 37.455 1.00 28.20 ? 49 GLY B N 1 ATOM 366 C CA . GLY A 1 49 ? 55.530 -26.311 36.269 1.00 28.63 ? 49 GLY B CA 1 ATOM 367 C C . GLY A 1 49 ? 55.443 -24.993 35.555 1.00 27.08 ? 49 GLY B C 1 ATOM 368 O O . GLY A 1 49 ? 54.744 -24.095 35.985 1.00 26.09 ? 49 GLY B O 1 ATOM 369 N N . VAL A 1 50 ? 56.161 -24.897 34.448 1.00 27.57 ? 50 VAL B N 1 ATOM 370 C CA . VAL A 1 50 ? 56.205 -23.678 33.664 1.00 26.59 ? 50 VAL B CA 1 ATOM 371 C C . VAL A 1 50 ? 56.448 -24.022 32.206 1.00 27.18 ? 50 VAL B C 1 ATOM 372 O O . VAL A 1 50 ? 57.196 -24.952 31.901 1.00 28.87 ? 50 VAL B O 1 ATOM 373 C CB . VAL A 1 50 ? 57.306 -22.735 34.185 1.00 27.36 ? 50 VAL B CB 1 ATOM 374 C CG1 . VAL A 1 50 ? 58.659 -23.424 34.151 1.00 29.54 ? 50 VAL B CG1 1 ATOM 375 C CG2 . VAL A 1 50 ? 57.342 -21.434 33.392 1.00 26.66 ? 50 VAL B CG2 1 ATOM 376 N N . ILE A 1 51 ? 55.784 -23.292 31.311 1.00 26.44 ? 51 ILE B N 1 ATOM 377 C CA . ILE A 1 51 ? 56.170 -23.283 29.910 1.00 27.50 ? 51 ILE B CA 1 ATOM 378 C C . ILE A 1 51 ? 56.723 -21.891 29.577 1.00 27.80 ? 51 ILE B C 1 ATOM 379 O O . ILE A 1 51 ? 56.018 -20.872 29.644 1.00 26.99 ? 51 ILE B O 1 ATOM 380 C CB . ILE A 1 51 ? 55.033 -23.708 28.956 1.00 27.27 ? 51 ILE B CB 1 ATOM 381 C CG1 . ILE A 1 51 ? 55.580 -23.859 27.528 1.00 29.12 ? 51 ILE B CG1 1 ATOM 382 C CG2 . ILE A 1 51 ? 53.865 -22.735 28.980 1.00 25.70 ? 51 ILE B CG2 1 ATOM 383 C CD1 . ILE A 1 51 ? 54.779 -24.825 26.681 1.00 30.17 ? 51 ILE B CD1 1 ATOM 384 N N . TRP A 1 52 ? 57.996 -21.865 29.207 1.00 29.46 ? 52 TRP B N 1 ATOM 385 C CA . TRP A 1 52 ? 58.701 -20.627 28.920 1.00 29.99 ? 52 TRP B CA 1 ATOM 386 C C . TRP A 1 52 ? 58.286 -20.121 27.550 1.00 30.68 ? 52 TRP B C 1 ATOM 387 O O . TRP A 1 52 ? 57.743 -20.872 26.753 1.00 31.34 ? 52 TRP B O 1 ATOM 388 C CB . TRP A 1 52 ? 60.209 -20.871 28.976 1.00 31.87 ? 52 TRP B CB 1 ATOM 389 C CG . TRP A 1 52 ? 60.670 -21.412 30.307 1.00 32.09 ? 52 TRP B CG 1 ATOM 390 C CD1 . TRP A 1 52 ? 61.047 -22.696 30.583 1.00 33.39 ? 52 TRP B CD1 1 ATOM 391 C CD2 . TRP A 1 52 ? 60.776 -20.688 31.546 1.00 31.39 ? 52 TRP B CD2 1 ATOM 392 N NE1 . TRP A 1 52 ? 61.399 -22.811 31.907 1.00 33.59 ? 52 TRP B NE1 1 ATOM 393 C CE2 . TRP A 1 52 ? 61.241 -21.602 32.523 1.00 32.38 ? 52 TRP B CE2 1 ATOM 394 C CE3 . TRP A 1 52 ? 60.540 -19.359 31.918 1.00 30.47 ? 52 TRP B CE3 1 ATOM 395 C CZ2 . TRP A 1 52 ? 61.479 -21.232 33.844 1.00 32.68 ? 52 TRP B CZ2 1 ATOM 396 C CZ3 . TRP A 1 52 ? 60.782 -18.989 33.244 1.00 30.84 ? 52 TRP B CZ3 1 ATOM 397 C CH2 . TRP A 1 52 ? 61.236 -19.932 34.187 1.00 31.88 ? 52 TRP B CH2 1 ATOM 398 N N . SER A 1 53 ? 58.522 -18.841 27.292 1.00 31.00 ? 53 SER B N 1 ATOM 399 C CA . SER A 1 53 ? 58.120 -18.228 26.042 1.00 31.94 ? 53 SER B CA 1 ATOM 400 C C . SER A 1 53 ? 58.707 -18.927 24.819 1.00 34.12 ? 53 SER B C 1 ATOM 401 O O . SER A 1 53 ? 58.048 -19.020 23.799 1.00 35.15 ? 53 SER B O 1 ATOM 402 C CB . SER A 1 53 ? 58.533 -16.773 26.018 1.00 32.31 ? 53 SER B CB 1 ATOM 403 O OG . SER A 1 53 ? 59.924 -16.682 26.157 1.00 33.87 ? 53 SER B OG 1 ATOM 404 N N . GLY A 1 54 ? 59.953 -19.381 24.909 1.00 35.58 ? 54 GLY B N 1 ATOM 405 C CA . GLY A 1 54 ? 60.575 -20.143 23.808 1.00 38.08 ? 54 GLY B CA 1 ATOM 406 C C . GLY A 1 54 ? 60.046 -21.565 23.643 1.00 38.51 ? 54 GLY B C 1 ATOM 407 O O . GLY A 1 54 ? 60.442 -22.266 22.714 1.00 41.10 ? 54 GLY B O 1 ATOM 408 N N . GLY A 1 55 ? 59.195 -22.016 24.566 1.00 36.34 ? 55 GLY B N 1 ATOM 409 C CA . GLY A 1 55 ? 58.441 -23.233 24.379 1.00 36.59 ? 55 GLY B CA 1 ATOM 410 C C . GLY A 1 55 ? 59.037 -24.435 25.067 1.00 37.65 ? 55 GLY B C 1 ATOM 411 O O . GLY A 1 55 ? 58.519 -25.534 24.915 1.00 38.40 ? 55 GLY B O 1 ATOM 412 N N . SER A 1 56 ? 60.108 -24.245 25.838 1.00 38.18 ? 56 SER B N 1 ATOM 413 C CA . SER A 1 56 ? 60.607 -25.329 26.681 1.00 39.32 ? 56 SER B CA 1 ATOM 414 C C . SER A 1 56 ? 59.855 -25.301 28.005 1.00 37.16 ? 56 SER B C 1 ATOM 415 O O . SER A 1 56 ? 59.219 -24.302 28.343 1.00 34.82 ? 56 SER B O 1 ATOM 416 C CB . SER A 1 56 ? 62.118 -25.236 26.911 1.00 41.39 ? 56 SER B CB 1 ATOM 417 O OG . SER A 1 56 ? 62.511 -24.008 27.502 1.00 39.94 ? 56 SER B OG 1 ATOM 418 N N . THR A 1 57 ? 59.919 -26.417 28.729 1.00 38.33 ? 57 THR B N 1 ATOM 419 C CA . THR A 1 57 ? 59.154 -26.601 29.939 1.00 36.74 ? 57 THR B CA 1 ATOM 420 C C . THR A 1 57 ? 60.086 -26.944 31.094 1.00 38.34 ? 57 THR B C 1 ATOM 421 O O . THR A 1 57 ? 61.260 -27.259 30.887 1.00 40.53 ? 57 THR B O 1 ATOM 422 C CB . THR A 1 57 ? 58.113 -27.706 29.743 1.00 36.99 ? 57 THR B CB 1 ATOM 423 O OG1 . THR A 1 57 ? 58.742 -28.798 29.078 1.00 39.98 ? 57 THR B OG1 1 ATOM 424 C CG2 . THR A 1 57 ? 56.968 -27.228 28.862 1.00 35.51 ? 57 THR B CG2 1 ATOM 425 N N . ASP A 1 58 ? 59.566 -26.801 32.314 1.00 37.02 ? 58 ASP B N 1 ATOM 426 C CA . ASP A 1 58 ? 60.227 -27.321 33.512 1.00 38.61 ? 58 ASP B CA 1 ATOM 427 C C . ASP A 1 58 ? 59.132 -27.753 34.475 1.00 37.22 ? 58 ASP B C 1 ATOM 428 O O . ASP A 1 58 ? 58.110 -27.093 34.583 1.00 34.59 ? 58 ASP B O 1 ATOM 429 C CB . ASP A 1 58 ? 61.140 -26.262 34.158 1.00 38.95 ? 58 ASP B CB 1 ATOM 430 C CG . ASP A 1 58 ? 62.465 -26.029 33.382 1.00 41.30 ? 58 ASP B CG 1 ATOM 431 O OD1 . ASP A 1 58 ? 63.310 -26.955 33.273 1.00 44.48 ? 58 ASP B OD1 1 ATOM 432 O OD2 . ASP A 1 58 ? 62.678 -24.897 32.893 1.00 40.35 ? 58 ASP B OD2 1 ATOM 433 N N . TYR A 1 59 ? 59.356 -28.862 35.170 1.00 39.43 ? 59 TYR B N 1 ATOM 434 C CA . TYR A 1 59 ? 58.338 -29.490 35.994 1.00 39.07 ? 59 TYR B CA 1 ATOM 435 C C . TYR A 1 59 ? 58.863 -29.803 37.380 1.00 40.93 ? 59 TYR B C 1 ATOM 436 O O . TYR A 1 59 ? 60.008 -30.224 37.523 1.00 43.64 ? 59 TYR B O 1 ATOM 437 C CB . TYR A 1 59 ? 57.884 -30.799 35.358 1.00 40.61 ? 59 TYR B CB 1 ATOM 438 C CG . TYR A 1 59 ? 57.272 -30.649 33.990 1.00 39.41 ? 59 TYR B CG 1 ATOM 439 C CD1 . TYR A 1 59 ? 56.089 -29.949 33.808 1.00 36.50 ? 59 TYR B CD1 1 ATOM 440 C CD2 . TYR A 1 59 ? 57.880 -31.218 32.868 1.00 41.68 ? 59 TYR B CD2 1 ATOM 441 C CE1 . TYR A 1 59 ? 55.525 -29.812 32.550 1.00 35.75 ? 59 TYR B CE1 1 ATOM 442 C CE2 . TYR A 1 59 ? 57.325 -31.081 31.604 1.00 40.82 ? 59 TYR B CE2 1 ATOM 443 C CZ . TYR A 1 59 ? 56.143 -30.382 31.458 1.00 37.96 ? 59 TYR B CZ 1 ATOM 444 O OH . TYR A 1 59 ? 55.575 -30.243 30.221 1.00 37.83 ? 59 TYR B OH 1 ATOM 445 N N . ASN A 1 60 ? 58.001 -29.617 38.380 1.00 39.76 ? 60 ASN B N 1 ATOM 446 C CA . ASN A 1 60 ? 58.247 -30.094 39.708 1.00 42.05 ? 60 ASN B CA 1 ATOM 447 C C . ASN A 1 60 ? 58.592 -31.586 39.625 1.00 45.55 ? 60 ASN B C 1 ATOM 448 O O . ASN A 1 60 ? 57.829 -32.356 39.052 1.00 45.56 ? 60 ASN B O 1 ATOM 449 C CB . ASN A 1 60 ? 57.004 -29.879 40.565 1.00 40.38 ? 60 ASN B CB 1 ATOM 450 C CG . ASN A 1 60 ? 57.275 -30.156 42.024 1.00 42.46 ? 60 ASN B CG 1 ATOM 451 O OD1 . ASN A 1 60 ? 58.204 -30.872 42.340 1.00 45.32 ? 60 ASN B OD1 1 ATOM 452 N ND2 . ASN A 1 60 ? 56.494 -29.563 42.915 1.00 41.57 ? 60 ASN B ND2 1 ATOM 453 N N . ALA A 1 61 ? 59.732 -31.977 40.195 1.00 49.36 ? 61 ALA B N 1 ATOM 454 C CA . ALA A 1 61 ? 60.257 -33.335 40.054 1.00 53.54 ? 61 ALA B CA 1 ATOM 455 C C . ALA A 1 61 ? 59.214 -34.397 40.406 1.00 54.57 ? 61 ALA B C 1 ATOM 456 O O . ALA A 1 61 ? 59.136 -35.437 39.759 1.00 56.72 ? 61 ALA B O 1 ATOM 457 C CB . ALA A 1 61 ? 61.511 -33.513 40.907 1.00 57.50 ? 61 ALA B CB 1 ATOM 458 N N . ALA A 1 62 ? 58.395 -34.112 41.412 1.00 53.60 ? 62 ALA B N 1 ATOM 459 C CA . ALA A 1 62 ? 57.382 -35.045 41.877 1.00 54.65 ? 62 ALA B CA 1 ATOM 460 C C . ALA A 1 62 ? 56.233 -35.275 40.883 1.00 52.52 ? 62 ALA B C 1 ATOM 461 O O . ALA A 1 62 ? 55.433 -36.189 41.079 1.00 53.64 ? 62 ALA B O 1 ATOM 462 C CB . ALA A 1 62 ? 56.818 -34.564 43.200 1.00 54.23 ? 62 ALA B CB 1 ATOM 463 N N . PHE A 1 63 ? 56.148 -34.456 39.832 1.00 49.77 ? 63 PHE B N 1 ATOM 464 C CA . PHE A 1 63 ? 55.088 -34.576 38.842 1.00 47.58 ? 63 PHE B CA 1 ATOM 465 C C . PHE A 1 63 ? 55.567 -34.979 37.464 1.00 48.91 ? 63 PHE B C 1 ATOM 466 O O . PHE A 1 63 ? 54.744 -35.300 36.611 1.00 48.53 ? 63 PHE B O 1 ATOM 467 C CB . PHE A 1 63 ? 54.334 -33.264 38.788 1.00 43.65 ? 63 PHE B CB 1 ATOM 468 C CG . PHE A 1 63 ? 53.607 -32.971 40.055 1.00 42.90 ? 63 PHE B CG 1 ATOM 469 C CD1 . PHE A 1 63 ? 54.277 -32.469 41.157 1.00 43.74 ? 63 PHE B CD1 1 ATOM 470 C CD2 . PHE A 1 63 ? 52.258 -33.247 40.162 1.00 42.12 ? 63 PHE B CD2 1 ATOM 471 C CE1 . PHE A 1 63 ? 53.602 -32.211 42.334 1.00 43.64 ? 63 PHE B CE1 1 ATOM 472 C CE2 . PHE A 1 63 ? 51.575 -32.995 41.336 1.00 41.83 ? 63 PHE B CE2 1 ATOM 473 C CZ . PHE A 1 63 ? 52.248 -32.471 42.422 1.00 42.58 ? 63 PHE B CZ 1 ATOM 474 N N . ILE A 1 64 ? 56.883 -34.993 37.252 1.00 51.16 ? 64 ILE B N 1 ATOM 475 C CA . ILE A 1 64 ? 57.427 -35.197 35.895 1.00 52.40 ? 64 ILE B CA 1 ATOM 476 C C . ILE A 1 64 ? 56.794 -36.395 35.172 1.00 54.07 ? 64 ILE B C 1 ATOM 477 O O . ILE A 1 64 ? 56.552 -36.302 33.969 1.00 53.82 ? 64 ILE B O 1 ATOM 478 C CB . ILE A 1 64 ? 59.004 -35.202 35.862 1.00 55.52 ? 64 ILE B CB 1 ATOM 479 C CG1 . ILE A 1 64 ? 59.493 -34.090 34.925 1.00 53.49 ? 64 ILE B CG1 1 ATOM 480 C CG2 . ILE A 1 64 ? 59.620 -36.542 35.425 1.00 60.35 ? 64 ILE B CG2 1 ATOM 481 C CD1 . ILE A 1 64 ? 60.969 -33.761 35.042 1.00 55.65 ? 64 ILE B CD1 1 ATOM 482 N N . SER A 1 65 ? 56.450 -37.466 35.895 1.00 56.06 ? 65 SER B N 1 ATOM 483 C CA . SER A 1 65 ? 55.949 -38.692 35.266 1.00 58.60 ? 65 SER B CA 1 ATOM 484 C C . SER A 1 65 ? 54.507 -38.579 34.747 1.00 55.88 ? 65 SER B C 1 ATOM 485 O O . SER A 1 65 ? 54.046 -39.454 34.007 1.00 58.04 ? 65 SER B O 1 ATOM 486 C CB . SER A 1 65 ? 56.041 -39.840 36.261 1.00 62.22 ? 65 SER B CB 1 ATOM 487 O OG . SER A 1 65 ? 55.014 -39.734 37.236 1.00 60.28 ? 65 SER B OG 1 ATOM 488 N N . ARG A 1 66 ? 53.783 -37.540 35.150 1.00 51.55 ? 66 ARG B N 1 ATOM 489 C CA . ARG A 1 66 ? 52.366 -37.462 34.793 1.00 49.50 ? 66 ARG B CA 1 ATOM 490 C C . ARG A 1 66 ? 51.828 -36.072 34.429 1.00 45.06 ? 66 ARG B C 1 ATOM 491 O O . ARG A 1 66 ? 50.628 -35.882 34.277 1.00 43.60 ? 66 ARG B O 1 ATOM 492 C CB . ARG A 1 66 ? 51.554 -38.106 35.918 1.00 50.45 ? 66 ARG B CB 1 ATOM 493 C CG . ARG A 1 66 ? 51.821 -37.560 37.310 1.00 49.71 ? 66 ARG B CG 1 ATOM 494 C CD . ARG A 1 66 ? 50.727 -38.009 38.265 1.00 50.18 ? 66 ARG B CD 1 ATOM 495 N NE . ARG A 1 66 ? 50.683 -37.121 39.418 1.00 48.49 ? 66 ARG B NE 1 ATOM 496 C CZ . ARG A 1 66 ? 49.609 -36.840 40.140 1.00 47.18 ? 66 ARG B CZ 1 ATOM 497 N NH1 . ARG A 1 66 ? 48.415 -37.312 39.819 1.00 47.34 ? 66 ARG B NH1 1 ATOM 498 N NH2 . ARG A 1 66 ? 49.738 -36.027 41.172 1.00 46.33 ? 66 ARG B NH2 1 ATOM 499 N N . LEU A 1 67 ? 52.725 -35.129 34.212 1.00 43.36 ? 67 LEU B N 1 ATOM 500 C CA . LEU A 1 67 ? 52.342 -33.757 33.959 1.00 39.91 ? 67 LEU B CA 1 ATOM 501 C C . LEU A 1 67 ? 52.971 -33.232 32.687 1.00 39.51 ? 67 LEU B C 1 ATOM 502 O O . LEU A 1 67 ? 54.182 -33.293 32.530 1.00 40.80 ? 67 LEU B O 1 ATOM 503 C CB . LEU A 1 67 ? 52.807 -32.849 35.109 1.00 38.60 ? 67 LEU B CB 1 ATOM 504 C CG . LEU A 1 67 ? 52.441 -31.345 34.999 1.00 35.52 ? 67 LEU B CG 1 ATOM 505 C CD1 . LEU A 1 67 ? 51.036 -31.155 34.461 1.00 34.39 ? 67 LEU B CD1 1 ATOM 506 C CD2 . LEU A 1 67 ? 52.569 -30.508 36.268 1.00 34.90 ? 67 LEU B CD2 1 ATOM 507 N N . SER A 1 68 ? 52.153 -32.682 31.799 1.00 37.86 ? 68 SER B N 1 ATOM 508 C CA . SER A 1 68 ? 52.661 -31.998 30.625 1.00 37.83 ? 68 SER B CA 1 ATOM 509 C C . SER A 1 68 ? 51.931 -30.679 30.422 1.00 34.82 ? 68 SER B C 1 ATOM 510 O O . SER A 1 68 ? 50.723 -30.604 30.577 1.00 34.20 ? 68 SER B O 1 ATOM 511 C CB . SER A 1 68 ? 52.561 -32.919 29.404 1.00 40.59 ? 68 SER B CB 1 ATOM 512 O OG . SER A 1 68 ? 51.219 -33.252 29.130 1.00 40.71 ? 68 SER B OG 1 ATOM 513 N N . ILE A 1 69 ? 52.696 -29.634 30.144 1.00 33.76 ? 69 ILE B N 1 ATOM 514 C CA . ILE A 1 69 ? 52.174 -28.316 29.831 1.00 31.78 ? 69 ILE B CA 1 ATOM 515 C C . ILE A 1 69 ? 52.570 -28.000 28.392 1.00 32.70 ? 69 ILE B C 1 ATOM 516 O O . ILE A 1 69 ? 53.695 -28.283 27.975 1.00 34.31 ? 69 ILE B O 1 ATOM 517 C CB . ILE A 1 69 ? 52.789 -27.254 30.764 1.00 30.68 ? 69 ILE B CB 1 ATOM 518 C CG1 . ILE A 1 69 ? 52.429 -27.567 32.223 1.00 30.33 ? 69 ILE B CG1 1 ATOM 519 C CG2 . ILE A 1 69 ? 52.287 -25.865 30.401 1.00 29.26 ? 69 ILE B CG2 1 ATOM 520 C CD1 . ILE A 1 69 ? 53.374 -26.971 33.231 1.00 30.50 ? 69 ILE B CD1 1 ATOM 521 N N . SER A 1 70 ? 51.659 -27.422 27.626 1.00 32.07 ? 70 SER B N 1 ATOM 522 C CA . SER A 1 70 ? 51.964 -27.047 26.248 1.00 33.33 ? 70 SER B CA 1 ATOM 523 C C . SER A 1 70 ? 51.160 -25.826 25.881 1.00 32.43 ? 70 SER B C 1 ATOM 524 O O . SER A 1 70 ? 50.472 -25.277 26.734 1.00 30.85 ? 70 SER B O 1 ATOM 525 C CB . SER A 1 70 ? 51.679 -28.198 25.294 1.00 35.76 ? 70 SER B CB 1 ATOM 526 O OG . SER A 1 70 ? 50.321 -28.553 25.356 1.00 35.71 ? 70 SER B OG 1 ATOM 527 N N . LYS A 1 71 ? 51.246 -25.376 24.630 1.00 34.08 ? 71 LYS B N 1 ATOM 528 C CA . LYS A 1 71 ? 50.545 -24.148 24.263 1.00 33.67 ? 71 LYS B CA 1 ATOM 529 C C . LYS A 1 71 ? 50.379 -23.896 22.760 1.00 36.31 ? 71 LYS B C 1 ATOM 530 O O . LYS A 1 71 ? 51.012 -24.538 21.923 1.00 38.09 ? 71 LYS B O 1 ATOM 531 C CB . LYS A 1 71 ? 51.282 -22.949 24.862 1.00 32.09 ? 71 LYS B CB 1 ATOM 532 C CG . LYS A 1 71 ? 52.697 -22.779 24.339 1.00 33.27 ? 71 LYS B CG 1 ATOM 533 C CD . LYS A 1 71 ? 53.264 -21.422 24.725 1.00 32.38 ? 71 LYS B CD 1 ATOM 534 C CE . LYS A 1 71 ? 54.732 -21.278 24.344 1.00 33.31 ? 71 LYS B CE 1 ATOM 535 N NZ . LYS A 1 71 ? 55.211 -19.882 24.507 1.00 32.73 ? 71 LYS B NZ 1 ATOM 536 N N . ASP A 1 72 ? 49.516 -22.928 22.457 1.00 36.58 ? 72 ASP B N 1 ATOM 537 C CA . ASP A 1 72 ? 49.280 -22.448 21.092 1.00 39.17 ? 72 ASP B CA 1 ATOM 538 C C . ASP A 1 72 ? 49.407 -20.928 21.104 1.00 38.39 ? 72 ASP B C 1 ATOM 539 O O . ASP A 1 72 ? 48.453 -20.223 21.449 1.00 37.71 ? 72 ASP B O 1 ATOM 540 C CB . ASP A 1 72 ? 47.900 -22.901 20.588 1.00 41.08 ? 72 ASP B CB 1 ATOM 541 C CG . ASP A 1 72 ? 47.555 -22.323 19.205 1.00 44.73 ? 72 ASP B CG 1 ATOM 542 O OD1 . ASP A 1 72 ? 48.135 -21.285 18.799 1.00 45.64 ? 72 ASP B OD1 1 ATOM 543 O OD2 . ASP A 1 72 ? 46.703 -22.907 18.502 1.00 47.52 ? 72 ASP B OD2 1 ATOM 544 N N . ASN A 1 73 ? 50.589 -20.437 20.723 1.00 38.61 ? 73 ASN B N 1 ATOM 545 C CA . ASN A 1 73 ? 50.894 -19.012 20.776 1.00 38.27 ? 73 ASN B CA 1 ATOM 546 C C . ASN A 1 73 ? 49.836 -18.168 20.082 1.00 40.11 ? 73 ASN B C 1 ATOM 547 O O . ASN A 1 73 ? 49.370 -17.190 20.666 1.00 39.50 ? 73 ASN B O 1 ATOM 548 C CB . ASN A 1 73 ? 52.274 -18.741 20.159 1.00 39.43 ? 73 ASN B CB 1 ATOM 549 C CG . ASN A 1 73 ? 53.415 -19.033 21.105 1.00 37.76 ? 73 ASN B CG 1 ATOM 550 O OD1 . ASN A 1 73 ? 53.295 -18.947 22.322 1.00 35.87 ? 73 ASN B OD1 1 ATOM 551 N ND2 . ASN A 1 73 ? 54.541 -19.367 20.543 1.00 39.29 ? 73 ASN B ND2 1 ATOM 552 N N . SER A 1 74 ? 49.444 -18.550 18.865 1.00 42.75 ? 74 SER B N 1 ATOM 553 C CA . SER A 1 74 ? 48.531 -17.710 18.075 1.00 45.35 ? 74 SER B CA 1 ATOM 554 C C . SER A 1 74 ? 47.133 -17.586 18.686 1.00 44.73 ? 74 SER B C 1 ATOM 555 O O . SER A 1 74 ? 46.467 -16.570 18.523 1.00 46.32 ? 74 SER B O 1 ATOM 556 C CB . SER A 1 74 ? 48.408 -18.228 16.637 1.00 49.04 ? 74 SER B CB 1 ATOM 557 O OG . SER A 1 74 ? 47.629 -19.408 16.589 1.00 49.62 ? 74 SER B OG 1 ATOM 558 N N . LYS A 1 75 ? 46.681 -18.631 19.364 1.00 43.12 ? 75 LYS B N 1 ATOM 559 C CA . LYS A 1 75 ? 45.380 -18.615 20.029 1.00 42.57 ? 75 LYS B CA 1 ATOM 560 C C . LYS A 1 75 ? 45.463 -18.195 21.505 1.00 39.31 ? 75 LYS B C 1 ATOM 561 O O . LYS A 1 75 ? 44.463 -18.200 22.205 1.00 39.10 ? 75 LYS B O 1 ATOM 562 C CB . LYS A 1 75 ? 44.738 -19.990 19.883 1.00 43.51 ? 75 LYS B CB 1 ATOM 563 C CG . LYS A 1 75 ? 44.357 -20.291 18.430 1.00 47.68 ? 75 LYS B CG 1 ATOM 564 C CD . LYS A 1 75 ? 43.027 -21.028 18.335 1.00 49.50 ? 75 LYS B CD 1 ATOM 565 C CE . LYS A 1 75 ? 42.749 -21.553 16.939 1.00 53.87 ? 75 LYS B CE 1 ATOM 566 N NZ . LYS A 1 75 ? 42.858 -20.493 15.894 1.00 57.09 ? 75 LYS B NZ 1 ATOM 567 N N . SER A 1 76 ? 46.657 -17.827 21.963 1.00 37.36 ? 76 SER B N 1 ATOM 568 C CA . SER A 1 76 ? 46.909 -17.415 23.348 1.00 34.81 ? 76 SER B CA 1 ATOM 569 C C . SER A 1 76 ? 46.447 -18.449 24.387 1.00 32.93 ? 76 SER B C 1 ATOM 570 O O . SER A 1 76 ? 45.940 -18.123 25.469 1.00 31.62 ? 76 SER B O 1 ATOM 571 C CB . SER A 1 76 ? 46.357 -16.006 23.689 1.00 35.63 ? 76 SER B CB 1 ATOM 572 O OG . SER A 1 76 ? 46.808 -15.030 22.770 1.00 37.34 ? 76 SER B OG 1 ATOM 573 N N . HIS A 1 77 ? 46.705 -19.706 24.066 1.00 32.92 ? 77 HIS B N 1 ATOM 574 C CA . HIS A 1 77 ? 46.234 -20.833 24.876 1.00 31.90 ? 77 HIS B CA 1 ATOM 575 C C . HIS A 1 77 ? 47.398 -21.567 25.517 1.00 30.12 ? 77 HIS B C 1 ATOM 576 O O . HIS A 1 77 ? 48.373 -21.904 24.845 1.00 30.87 ? 77 HIS B O 1 ATOM 577 C CB . HIS A 1 77 ? 45.440 -21.849 24.030 1.00 33.99 ? 77 HIS B CB 1 ATOM 578 C CG . HIS A 1 77 ? 44.060 -21.409 23.622 1.00 35.94 ? 77 HIS B CG 1 ATOM 579 N ND1 . HIS A 1 77 ? 43.240 -20.653 24.431 1.00 35.67 ? 77 HIS B ND1 1 ATOM 580 C CD2 . HIS A 1 77 ? 43.338 -21.669 22.505 1.00 38.76 ? 77 HIS B CD2 1 ATOM 581 C CE1 . HIS A 1 77 ? 42.088 -20.436 23.820 1.00 37.98 ? 77 HIS B CE1 1 ATOM 582 N NE2 . HIS A 1 77 ? 42.119 -21.046 22.650 1.00 39.90 ? 77 HIS B NE2 1 ATOM 583 N N . VAL A 1 78 ? 47.295 -21.835 26.814 1.00 28.28 ? 78 VAL B N 1 ATOM 584 C CA . VAL A 1 78 ? 48.242 -22.723 27.476 1.00 27.24 ? 78 VAL B CA 1 ATOM 585 C C . VAL A 1 78 ? 47.449 -23.908 27.968 1.00 27.21 ? 78 VAL B C 1 ATOM 586 O O . VAL A 1 78 ? 46.344 -23.745 28.486 1.00 27.22 ? 78 VAL B O 1 ATOM 587 C CB . VAL A 1 78 ? 48.982 -22.025 28.628 1.00 25.94 ? 78 VAL B CB 1 ATOM 588 C CG1 . VAL A 1 78 ? 50.029 -22.960 29.231 1.00 25.78 ? 78 VAL B CG1 1 ATOM 589 C CG2 . VAL A 1 78 ? 49.628 -20.737 28.131 1.00 26.15 ? 78 VAL B CG2 1 ATOM 590 N N . PHE A 1 79 ? 47.990 -25.103 27.763 1.00 27.83 ? 79 PHE B N 1 ATOM 591 C CA . PHE A 1 79 ? 47.287 -26.331 28.087 1.00 28.48 ? 79 PHE B CA 1 ATOM 592 C C . PHE A 1 79 ? 48.013 -27.009 29.211 1.00 28.12 ? 79 PHE B C 1 ATOM 593 O O . PHE A 1 79 ? 49.185 -27.334 29.062 1.00 28.50 ? 79 PHE B O 1 ATOM 594 C CB . PHE A 1 79 ? 47.236 -27.237 26.855 1.00 30.65 ? 79 PHE B CB 1 ATOM 595 C CG . PHE A 1 79 ? 46.590 -26.585 25.661 1.00 31.76 ? 79 PHE B CG 1 ATOM 596 C CD1 . PHE A 1 79 ? 45.275 -26.141 25.742 1.00 31.76 ? 79 PHE B CD1 1 ATOM 597 C CD2 . PHE A 1 79 ? 47.274 -26.427 24.465 1.00 33.21 ? 79 PHE B CD2 1 ATOM 598 C CE1 . PHE A 1 79 ? 44.659 -25.540 24.661 1.00 33.15 ? 79 PHE B CE1 1 ATOM 599 C CE2 . PHE A 1 79 ? 46.654 -25.839 23.370 1.00 34.70 ? 79 PHE B CE2 1 ATOM 600 C CZ . PHE A 1 79 ? 45.351 -25.379 23.476 1.00 34.68 ? 79 PHE B CZ 1 ATOM 601 N N . PHE A 1 80 ? 47.314 -27.183 30.335 1.00 27.73 ? 80 PHE B N 1 ATOM 602 C CA . PHE A 1 80 ? 47.783 -27.957 31.468 1.00 27.95 ? 80 PHE B CA 1 ATOM 603 C C . PHE A 1 80 ? 47.113 -29.321 31.416 1.00 30.37 ? 80 PHE B C 1 ATOM 604 O O . PHE A 1 80 ? 45.906 -29.414 31.204 1.00 30.75 ? 80 PHE B O 1 ATOM 605 C CB . PHE A 1 80 ? 47.401 -27.247 32.757 1.00 26.43 ? 80 PHE B CB 1 ATOM 606 C CG . PHE A 1 80 ? 47.677 -28.035 34.005 1.00 26.77 ? 80 PHE B CG 1 ATOM 607 C CD1 . PHE A 1 80 ? 46.795 -29.008 34.443 1.00 27.66 ? 80 PHE B CD1 1 ATOM 608 C CD2 . PHE A 1 80 ? 48.813 -27.783 34.766 1.00 26.54 ? 80 PHE B CD2 1 ATOM 609 C CE1 . PHE A 1 80 ? 47.038 -29.717 35.614 1.00 28.39 ? 80 PHE B CE1 1 ATOM 610 C CE2 . PHE A 1 80 ? 49.057 -28.483 35.941 1.00 27.47 ? 80 PHE B CE2 1 ATOM 611 C CZ . PHE A 1 80 ? 48.175 -29.459 36.360 1.00 28.28 ? 80 PHE B CZ 1 ATOM 612 N N . LYS A 1 81 ? 47.885 -30.372 31.650 1.00 32.79 ? 81 LYS B N 1 ATOM 613 C CA . LYS A 1 81 ? 47.364 -31.715 31.565 1.00 35.74 ? 81 LYS B CA 1 ATOM 614 C C . LYS A 1 81 ? 48.101 -32.659 32.521 1.00 37.29 ? 81 LYS B C 1 ATOM 615 O O . LYS A 1 81 ? 49.315 -32.829 32.431 1.00 38.29 ? 81 LYS B O 1 ATOM 616 C CB . LYS A 1 81 ? 47.462 -32.186 30.121 1.00 38.46 ? 81 LYS B CB 1 ATOM 617 C CG . LYS A 1 81 ? 47.532 -33.680 29.984 1.00 42.23 ? 81 LYS B CG 1 ATOM 618 C CD . LYS A 1 81 ? 47.256 -34.086 28.580 1.00 45.04 ? 81 LYS B CD 1 ATOM 619 C CE . LYS A 1 81 ? 47.728 -35.516 28.348 1.00 48.96 ? 81 LYS B CE 1 ATOM 620 N NZ . LYS A 1 81 ? 47.351 -36.412 29.481 1.00 49.68 ? 81 LYS B NZ 1 ATOM 621 N N . MET A 1 82 ? 47.357 -33.271 33.428 1.00 38.34 ? 82 MET B N 1 ATOM 622 C CA . MET A 1 82 ? 47.923 -34.163 34.434 1.00 40.66 ? 82 MET B CA 1 ATOM 623 C C . MET A 1 82 ? 47.192 -35.494 34.458 1.00 42.66 ? 82 MET B C 1 ATOM 624 O O . MET A 1 82 ? 45.964 -35.503 34.515 1.00 41.96 ? 82 MET B O 1 ATOM 625 C CB . MET A 1 82 ? 47.804 -33.522 35.814 1.00 40.30 ? 82 MET B CB 1 ATOM 626 C CG . MET A 1 82 ? 48.619 -34.217 36.894 1.00 43.10 ? 82 MET B CG 1 ATOM 627 S SD . MET A 1 82 ? 48.873 -33.165 38.348 1.00 43.72 ? 82 MET B SD 1 ATOM 628 C CE . MET A 1 82 ? 47.396 -33.485 39.284 1.00 43.57 ? 82 MET B CE 1 ATOM 629 N N . ASN A 1 83 A 47.944 -36.597 34.482 1.00 45.09 ? 82 ASN B N 1 ATOM 630 C CA . ASN A 1 83 A 47.372 -37.929 34.435 1.00 47.92 ? 82 ASN B CA 1 ATOM 631 C C . ASN A 1 83 A 47.182 -38.434 35.854 1.00 48.52 ? 82 ASN B C 1 ATOM 632 O O . ASN A 1 83 A 47.689 -37.838 36.803 1.00 47.02 ? 82 ASN B O 1 ATOM 633 C CB . ASN A 1 83 A 48.280 -38.891 33.666 1.00 51.51 ? 82 ASN B CB 1 ATOM 634 C CG . ASN A 1 83 A 48.313 -38.597 32.190 1.00 51.89 ? 82 ASN B CG 1 ATOM 635 O OD1 . ASN A 1 83 A 47.341 -38.079 31.644 1.00 51.51 ? 82 ASN B OD1 1 ATOM 636 N ND2 . ASN A 1 83 A 49.417 -38.938 31.526 1.00 53.92 ? 82 ASN B ND2 1 ATOM 637 N N . SER A 1 84 B 46.438 -39.529 35.973 1.00 50.84 ? 82 SER B N 1 ATOM 638 C CA . SER A 1 84 B 46.331 -40.362 37.189 1.00 52.98 ? 82 SER B CA 1 ATOM 639 C C . SER A 1 84 B 46.058 -39.627 38.496 1.00 51.05 ? 82 SER B C 1 ATOM 640 O O . SER A 1 84 B 46.779 -39.797 39.484 1.00 52.10 ? 82 SER B O 1 ATOM 641 C CB . SER A 1 84 B 47.560 -41.262 37.350 1.00 56.21 ? 82 SER B CB 1 ATOM 642 O OG . SER A 1 84 B 47.978 -41.766 36.104 1.00 58.16 ? 82 SER B OG 1 ATOM 643 N N . LEU A 1 85 C 44.996 -38.834 38.505 1.00 48.64 ? 82 LEU B N 1 ATOM 644 C CA . LEU A 1 85 C 44.663 -38.051 39.684 1.00 47.33 ? 82 LEU B CA 1 ATOM 645 C C . LEU A 1 85 C 44.082 -38.934 40.758 1.00 50.23 ? 82 LEU B C 1 ATOM 646 O O . LEU A 1 85 C 43.356 -39.877 40.464 1.00 52.38 ? 82 LEU B O 1 ATOM 647 C CB . LEU A 1 85 C 43.697 -36.922 39.350 1.00 44.58 ? 82 LEU B CB 1 ATOM 648 C CG . LEU A 1 85 C 44.378 -35.662 38.819 1.00 41.66 ? 82 LEU B CG 1 ATOM 649 C CD1 . LEU A 1 85 C 44.804 -35.858 37.380 1.00 41.86 ? 82 LEU B CD1 1 ATOM 650 C CD2 . LEU A 1 85 C 43.463 -34.459 38.925 1.00 39.49 ? 82 LEU B CD2 1 ATOM 651 N N . GLN A 1 86 ? 44.414 -38.627 42.005 1.00 51.01 ? 83 GLN B N 1 ATOM 652 C CA . GLN A 1 86 ? 43.899 -39.361 43.143 1.00 54.22 ? 83 GLN B CA 1 ATOM 653 C C . GLN A 1 86 ? 43.368 -38.353 44.143 1.00 53.53 ? 83 GLN B C 1 ATOM 654 O O . GLN A 1 86 ? 43.467 -37.149 43.919 1.00 50.66 ? 83 GLN B O 1 ATOM 655 C CB . GLN A 1 86 ? 44.991 -40.244 43.746 1.00 57.61 ? 83 GLN B CB 1 ATOM 656 C CG . GLN A 1 86 ? 45.658 -41.186 42.744 1.00 59.44 ? 83 GLN B CG 1 ATOM 657 C CD . GLN A 1 86 ? 44.703 -42.203 42.126 1.00 61.18 ? 83 GLN B CD 1 ATOM 658 O OE1 . GLN A 1 86 ? 43.555 -42.343 42.541 1.00 61.08 ? 83 GLN B OE1 1 ATOM 659 N NE2 . GLN A 1 86 ? 45.187 -42.913 41.113 1.00 62.86 ? 83 GLN B NE2 1 ATOM 660 N N . ALA A 1 87 ? 42.791 -38.843 45.233 1.00 56.87 ? 84 ALA B N 1 ATOM 661 C CA . ALA A 1 87 ? 42.156 -37.977 46.226 1.00 57.26 ? 84 ALA B CA 1 ATOM 662 C C . ALA A 1 87 ? 43.023 -36.759 46.586 1.00 56.35 ? 84 ALA B C 1 ATOM 663 O O . ALA A 1 87 ? 42.550 -35.621 46.538 1.00 53.65 ? 84 ALA B O 1 ATOM 664 C CB . ALA A 1 87 ? 41.800 -38.775 47.478 1.00 60.92 ? 84 ALA B CB 1 ATOM 665 N N . ASN A 1 88 ? 44.292 -37.004 46.913 1.00 59.27 ? 85 ASN B N 1 ATOM 666 C CA . ASN A 1 88 ? 45.229 -35.931 47.303 1.00 59.54 ? 85 ASN B CA 1 ATOM 667 C C . ASN A 1 88 ? 45.656 -34.980 46.176 1.00 54.04 ? 85 ASN B C 1 ATOM 668 O O . ASN A 1 88 ? 46.452 -34.075 46.398 1.00 53.24 ? 85 ASN B O 1 ATOM 669 C CB . ASN A 1 88 ? 46.460 -36.518 48.024 1.00 66.26 ? 85 ASN B CB 1 ATOM 670 C CG . ASN A 1 88 ? 47.286 -37.470 47.160 1.00 72.29 ? 85 ASN B CG 1 ATOM 671 O OD1 . ASN A 1 88 ? 47.081 -37.593 45.949 1.00 70.07 ? 85 ASN B OD1 1 ATOM 672 N ND2 . ASN A 1 88 ? 48.244 -38.157 47.809 1.00 84.10 ? 85 ASN B ND2 1 ATOM 673 N N . ASP A 1 89 ? 45.128 -35.175 44.973 1.00 50.25 ? 86 ASP B N 1 ATOM 674 C CA . ASP A 1 89 ? 45.277 -34.189 43.903 1.00 45.66 ? 86 ASP B CA 1 ATOM 675 C C . ASP A 1 89 ? 44.137 -33.163 43.898 1.00 42.92 ? 86 ASP B C 1 ATOM 676 O O . ASP A 1 89 ? 44.114 -32.272 43.059 1.00 40.30 ? 86 ASP B O 1 ATOM 677 C CB . ASP A 1 89 ? 45.372 -34.874 42.542 1.00 44.91 ? 86 ASP B CB 1 ATOM 678 C CG . ASP A 1 89 ? 46.642 -35.652 42.371 1.00 46.41 ? 86 ASP B CG 1 ATOM 679 O OD1 . ASP A 1 89 ? 47.726 -35.056 42.523 1.00 45.77 ? 86 ASP B OD1 1 ATOM 680 O OD2 . ASP A 1 89 ? 46.561 -36.855 42.054 1.00 48.34 ? 86 ASP B OD2 1 ATOM 681 N N . THR A 1 90 ? 43.198 -33.300 44.833 1.00 43.57 ? 87 THR B N 1 ATOM 682 C CA . THR A 1 90 ? 42.137 -32.316 45.019 1.00 42.07 ? 87 THR B CA 1 ATOM 683 C C . THR A 1 90 ? 42.756 -30.990 45.448 1.00 40.45 ? 87 THR B C 1 ATOM 684 O O . THR A 1 90 ? 43.475 -30.928 46.440 1.00 42.01 ? 87 THR B O 1 ATOM 685 C CB . THR A 1 90 ? 41.107 -32.789 46.075 1.00 44.48 ? 87 THR B CB 1 ATOM 686 O OG1 . THR A 1 90 ? 40.364 -33.897 45.547 1.00 44.88 ? 87 THR B OG1 1 ATOM 687 C CG2 . THR A 1 90 ? 40.134 -31.657 46.462 1.00 44.32 ? 87 THR B CG2 1 ATOM 688 N N . ALA A 1 91 ? 42.463 -29.940 44.695 1.00 37.60 ? 88 ALA B N 1 ATOM 689 C CA . ALA A 1 91 ? 43.083 -28.631 44.903 1.00 36.18 ? 88 ALA B CA 1 ATOM 690 C C . ALA A 1 91 ? 42.481 -27.614 43.979 1.00 34.18 ? 88 ALA B C 1 ATOM 691 O O . ALA A 1 91 ? 41.775 -27.981 43.045 1.00 33.41 ? 88 ALA B O 1 ATOM 692 C CB . ALA A 1 91 ? 44.573 -28.699 44.626 1.00 35.25 ? 88 ALA B CB 1 ATOM 693 N N . ILE A 1 92 ? 42.784 -26.343 44.230 1.00 33.53 ? 89 ILE B N 1 ATOM 694 C CA . ILE A 1 92 ? 42.519 -25.283 43.286 1.00 31.99 ? 89 ILE B CA 1 ATOM 695 C C . ILE A 1 92 ? 43.750 -25.103 42.425 1.00 30.30 ? 89 ILE B C 1 ATOM 696 O O . ILE A 1 92 ? 44.823 -24.840 42.955 1.00 30.38 ? 89 ILE B O 1 ATOM 697 C CB . ILE A 1 92 ? 42.237 -23.945 43.979 1.00 33.15 ? 89 ILE B CB 1 ATOM 698 C CG1 . ILE A 1 92 ? 41.044 -24.081 44.926 1.00 35.42 ? 89 ILE B CG1 1 ATOM 699 C CG2 . ILE A 1 92 ? 41.981 -22.861 42.932 1.00 32.17 ? 89 ILE B CG2 1 ATOM 700 C CD1 . ILE A 1 92 ? 40.870 -22.915 45.874 1.00 37.42 ? 89 ILE B CD1 1 ATOM 701 N N . TYR A 1 93 ? 43.574 -25.167 41.103 1.00 28.94 ? 90 TYR B N 1 ATOM 702 C CA . TYR A 1 93 ? 44.667 -25.057 40.144 1.00 27.58 ? 90 TYR B CA 1 ATOM 703 C C . TYR A 1 93 ? 44.657 -23.685 39.467 1.00 26.86 ? 90 TYR B C 1 ATOM 704 O O . TYR A 1 93 ? 43.606 -23.206 39.039 1.00 26.89 ? 90 TYR B O 1 ATOM 705 C CB . TYR A 1 93 ? 44.554 -26.169 39.100 1.00 27.24 ? 90 TYR B CB 1 ATOM 706 C CG . TYR A 1 93 ? 44.885 -27.520 39.671 1.00 28.21 ? 90 TYR B CG 1 ATOM 707 C CD1 . TYR A 1 93 ? 43.983 -28.188 40.489 1.00 29.48 ? 90 TYR B CD1 1 ATOM 708 C CD2 . TYR A 1 93 ? 46.107 -28.134 39.402 1.00 28.22 ? 90 TYR B CD2 1 ATOM 709 C CE1 . TYR A 1 93 ? 44.284 -29.429 41.023 1.00 30.74 ? 90 TYR B CE1 1 ATOM 710 C CE2 . TYR A 1 93 ? 46.414 -29.375 39.936 1.00 29.66 ? 90 TYR B CE2 1 ATOM 711 C CZ . TYR A 1 93 ? 45.493 -30.013 40.745 1.00 30.93 ? 90 TYR B CZ 1 ATOM 712 O OH . TYR A 1 93 ? 45.771 -31.237 41.288 1.00 32.96 ? 90 TYR B OH 1 ATOM 713 N N . TYR A 1 94 ? 45.836 -23.065 39.380 1.00 26.51 ? 91 TYR B N 1 ATOM 714 C CA . TYR A 1 94 ? 45.994 -21.742 38.763 1.00 26.03 ? 91 TYR B CA 1 ATOM 715 C C . TYR A 1 94 ? 47.040 -21.797 37.660 1.00 25.24 ? 91 TYR B C 1 ATOM 716 O O . TYR A 1 94 ? 48.035 -22.493 37.808 1.00 24.83 ? 91 TYR B O 1 ATOM 717 C CB . TYR A 1 94 ? 46.481 -20.715 39.792 1.00 26.85 ? 91 TYR B CB 1 ATOM 718 C CG . TYR A 1 94 ? 45.682 -20.523 41.073 1.00 28.19 ? 91 TYR B CG 1 ATOM 719 C CD1 . TYR A 1 94 ? 45.975 -21.250 42.204 1.00 28.96 ? 91 TYR B CD1 1 ATOM 720 C CD2 . TYR A 1 94 ? 44.700 -19.538 41.168 1.00 29.50 ? 91 TYR B CD2 1 ATOM 721 C CE1 . TYR A 1 94 ? 45.289 -21.045 43.385 1.00 31.05 ? 91 TYR B CE1 1 ATOM 722 C CE2 . TYR A 1 94 ? 43.990 -19.327 42.348 1.00 31.25 ? 91 TYR B CE2 1 ATOM 723 C CZ . TYR A 1 94 ? 44.301 -20.089 43.452 1.00 32.06 ? 91 TYR B CZ 1 ATOM 724 O OH . TYR A 1 94 ? 43.653 -19.934 44.640 1.00 34.27 ? 91 TYR B OH 1 ATOM 725 N N . CYS A 1 95 ? 46.797 -21.099 36.547 1.00 25.45 ? 92 CYS B N 1 ATOM 726 C CA . CYS A 1 95 ? 47.866 -20.644 35.669 1.00 25.26 ? 92 CYS B CA 1 ATOM 727 C C . CYS A 1 95 ? 48.235 -19.244 36.184 1.00 25.72 ? 92 CYS B C 1 ATOM 728 O O . CYS A 1 95 ? 47.403 -18.567 36.778 1.00 26.48 ? 92 CYS B O 1 ATOM 729 C CB . CYS A 1 95 ? 47.465 -20.642 34.179 1.00 25.35 ? 92 CYS B CB 1 ATOM 730 S SG . CYS A 1 95 ? 46.162 -19.484 33.713 1.00 27.11 ? 92 CYS B SG 1 ATOM 731 N N . ALA A 1 96 ? 49.487 -18.833 35.984 1.00 25.64 ? 93 ALA B N 1 ATOM 732 C CA . ALA A 1 96 ? 49.953 -17.558 36.516 1.00 26.77 ? 93 ALA B CA 1 ATOM 733 C C . ALA A 1 96 ? 51.237 -17.054 35.895 1.00 26.72 ? 93 ALA B C 1 ATOM 734 O O . ALA A 1 96 ? 52.112 -17.824 35.503 1.00 26.13 ? 93 ALA B O 1 ATOM 735 C CB . ALA A 1 96 ? 50.130 -17.665 38.036 1.00 27.83 ? 93 ALA B CB 1 ATOM 736 N N . ARG A 1 97 ? 51.342 -15.736 35.837 1.00 28.15 ? 94 ARG B N 1 ATOM 737 C CA . ARG A 1 97 ? 52.603 -15.061 35.596 1.00 29.26 ? 94 ARG B CA 1 ATOM 738 C C . ARG A 1 97 ? 53.377 -14.933 36.926 1.00 30.78 ? 94 ARG B C 1 ATOM 739 O O . ARG A 1 97 ? 52.874 -14.380 37.919 1.00 31.56 ? 94 ARG B O 1 ATOM 740 C CB . ARG A 1 97 ? 52.358 -13.689 34.982 1.00 30.56 ? 94 ARG B CB 1 ATOM 741 C CG . ARG A 1 97 ? 51.884 -13.726 33.521 1.00 30.67 ? 94 ARG B CG 1 ATOM 742 C CD . ARG A 1 97 ? 52.841 -13.059 32.521 1.00 31.66 ? 94 ARG B CD 1 ATOM 743 N NE . ARG A 1 97 ? 54.226 -13.141 32.978 1.00 32.38 ? 94 ARG B NE 1 ATOM 744 C CZ . ARG A 1 97 ? 55.056 -12.121 33.167 1.00 33.79 ? 94 ARG B CZ 1 ATOM 745 N NH1 . ARG A 1 97 ? 56.268 -12.375 33.600 1.00 34.03 ? 94 ARG B NH1 1 ATOM 746 N NH2 . ARG A 1 97 ? 54.698 -10.863 32.907 1.00 35.88 ? 94 ARG B NH2 1 ATOM 747 N N . MET A 1 98 ? 54.600 -15.455 36.934 1.00 31.15 ? 95 MET B N 1 ATOM 748 C CA . MET A 1 98 ? 55.476 -15.426 38.112 1.00 32.98 ? 95 MET B CA 1 ATOM 749 C C . MET A 1 98 ? 56.907 -15.149 37.661 1.00 33.65 ? 95 MET B C 1 ATOM 750 O O . MET A 1 98 ? 57.184 -15.203 36.477 1.00 33.44 ? 95 MET B O 1 ATOM 751 C CB . MET A 1 98 ? 55.475 -16.773 38.824 1.00 32.95 ? 95 MET B CB 1 ATOM 752 C CG . MET A 1 98 ? 54.111 -17.350 39.097 1.00 32.57 ? 95 MET B CG 1 ATOM 753 S SD . MET A 1 98 ? 54.175 -18.822 40.138 1.00 33.58 ? 95 MET B SD 1 ATOM 754 C CE . MET A 1 98 ? 54.558 -18.044 41.704 1.00 36.27 ? 95 MET B CE 1 ATOM 755 N N . ARG A 1 99 ? 57.817 -14.935 38.609 1.00 35.17 ? 96 ARG B N 1 ATOM 756 C CA . ARG A 1 99 ? 59.194 -14.499 38.347 1.00 36.84 ? 96 ARG B CA 1 ATOM 757 C C . ARG A 1 99 ? 59.132 -13.223 37.574 1.00 36.57 ? 96 ARG B C 1 ATOM 758 O O . ARG A 1 99 ? 59.551 -13.181 36.429 1.00 36.48 ? 96 ARG B O 1 ATOM 759 C CB . ARG A 1 99 ? 60.024 -15.497 37.530 1.00 36.90 ? 96 ARG B CB 1 ATOM 760 C CG . ARG A 1 99 ? 60.015 -16.925 38.047 1.00 37.10 ? 96 ARG B CG 1 ATOM 761 C CD . ARG A 1 99 ? 61.330 -17.633 37.760 1.00 39.01 ? 96 ARG B CD 1 ATOM 762 N NE . ARG A 1 99 ? 61.924 -17.183 36.511 1.00 39.60 ? 96 ARG B NE 1 ATOM 763 C CZ . ARG A 1 99 ? 63.198 -17.339 36.166 1.00 41.40 ? 96 ARG B CZ 1 ATOM 764 N NH1 . ARG A 1 99 ? 64.050 -17.982 36.940 1.00 43.36 ? 96 ARG B NH1 1 ATOM 765 N NH2 . ARG A 1 99 ? 63.603 -16.862 35.002 1.00 41.66 ? 96 ARG B NH2 1 ATOM 766 N N . ILE A 1 100 ? 58.582 -12.190 38.178 1.00 37.43 ? 97 ILE B N 1 ATOM 767 C CA . ILE A 1 100 ? 58.227 -11.041 37.393 1.00 37.85 ? 97 ILE B CA 1 ATOM 768 C C . ILE A 1 100 ? 59.307 -9.961 37.437 1.00 40.50 ? 97 ILE B C 1 ATOM 769 O O . ILE A 1 100 ? 60.088 -9.849 38.383 1.00 42.46 ? 97 ILE B O 1 ATOM 770 C CB . ILE A 1 100 ? 56.788 -10.545 37.707 1.00 37.82 ? 97 ILE B CB 1 ATOM 771 C CG1 . ILE A 1 100 ? 56.769 -9.600 38.867 1.00 40.63 ? 97 ILE B CG1 1 ATOM 772 C CG2 . ILE A 1 100 ? 55.814 -11.688 37.936 1.00 35.69 ? 97 ILE B CG2 1 ATOM 773 C CD1 . ILE A 1 100 ? 56.765 -8.164 38.414 1.00 42.82 ? 97 ILE B CD1 1 ATOM 774 N N . THR A 1 101 ? 59.314 -9.171 36.370 1.00 40.81 ? 98 THR B N 1 ATOM 775 C CA . THR A 1 101 ? 60.365 -8.217 36.047 1.00 42.96 ? 98 THR B CA 1 ATOM 776 C C . THR A 1 101 ? 59.838 -6.771 35.934 1.00 45.04 ? 98 THR B C 1 ATOM 777 O O . THR A 1 101 ? 60.595 -5.816 36.007 1.00 47.30 ? 98 THR B O 1 ATOM 778 C CB . THR A 1 101 ? 61.039 -8.723 34.747 1.00 41.96 ? 98 THR B CB 1 ATOM 779 O OG1 . THR A 1 101 ? 62.212 -9.453 35.112 1.00 42.43 ? 98 THR B OG1 1 ATOM 780 C CG2 . THR A 1 101 ? 61.400 -7.603 33.757 1.00 43.85 ? 98 THR B CG2 1 ATOM 781 N N . THR A 1 102 ? 58.522 -6.635 35.804 1.00 44.63 ? 99 THR B N 1 ATOM 782 C CA . THR A 1 102 ? 57.858 -5.411 35.372 1.00 46.77 ? 99 THR B CA 1 ATOM 783 C C . THR A 1 102 ? 56.789 -4.975 36.368 1.00 47.73 ? 99 THR B C 1 ATOM 784 O O . THR A 1 102 ? 56.221 -5.801 37.054 1.00 45.81 ? 99 THR B O 1 ATOM 785 C CB . THR A 1 102 ? 57.151 -5.647 34.011 1.00 45.45 ? 99 THR B CB 1 ATOM 786 O OG1 . THR A 1 102 ? 56.300 -4.535 33.689 1.00 48.22 ? 99 THR B OG1 1 ATOM 787 C CG2 . THR A 1 102 ? 56.311 -6.916 34.016 1.00 42.35 ? 99 THR B CG2 1 ATOM 788 N N . ASP A 1 103 ? 56.481 -3.683 36.386 1.00 50.79 ? 100 ASP B N 1 ATOM 789 C CA . ASP A 1 103 ? 55.354 -3.153 37.180 1.00 52.80 ? 100 ASP B CA 1 ATOM 790 C C . ASP A 1 103 ? 53.992 -3.776 36.926 1.00 50.98 ? 100 ASP B C 1 ATOM 791 O O . ASP A 1 103 ? 53.117 -3.721 37.785 1.00 51.43 ? 100 ASP B O 1 ATOM 792 C CB . ASP A 1 103 ? 55.156 -1.657 36.922 1.00 56.79 ? 100 ASP B CB 1 ATOM 793 C CG . ASP A 1 103 ? 55.749 -0.831 37.967 1.00 60.56 ? 100 ASP B CG 1 ATOM 794 O OD1 . ASP A 1 103 ? 56.060 -1.405 39.028 1.00 60.47 ? 100 ASP B OD1 1 ATOM 795 O OD2 . ASP A 1 103 ? 55.876 0.390 37.747 1.00 64.44 ? 100 ASP B OD2 1 ATOM 796 N N . TRP A 1 104 A 53.816 -4.327 35.732 1.00 49.06 ? 100 TRP B N 1 ATOM 797 C CA . TRP A 1 104 A 52.505 -4.321 35.087 1.00 49.44 ? 100 TRP B CA 1 ATOM 798 C C . TRP A 1 104 A 51.931 -5.648 34.634 1.00 45.94 ? 100 TRP B C 1 ATOM 799 O O . TRP A 1 104 A 50.821 -5.991 34.997 1.00 45.47 ? 100 TRP B O 1 ATOM 800 C CB . TRP A 1 104 A 52.542 -3.408 33.859 1.00 51.66 ? 100 TRP B CB 1 ATOM 801 C CG . TRP A 1 104 A 51.163 -3.153 33.360 1.00 53.44 ? 100 TRP B CG 1 ATOM 802 C CD1 . TRP A 1 104 A 50.502 -3.782 32.322 1.00 51.87 ? 100 TRP B CD1 1 ATOM 803 C CD2 . TRP A 1 104 A 50.235 -2.217 33.922 1.00 57.36 ? 100 TRP B CD2 1 ATOM 804 N NE1 . TRP A 1 104 A 49.223 -3.270 32.205 1.00 54.65 ? 100 TRP B NE1 1 ATOM 805 C CE2 . TRP A 1 104 A 49.035 -2.310 33.172 1.00 57.90 ? 100 TRP B CE2 1 ATOM 806 C CE3 . TRP A 1 104 A 50.307 -1.301 34.981 1.00 60.82 ? 100 TRP B CE3 1 ATOM 807 C CZ2 . TRP A 1 104 A 47.914 -1.516 33.452 1.00 61.70 ? 100 TRP B CZ2 1 ATOM 808 C CZ3 . TRP A 1 104 A 49.195 -0.510 35.259 1.00 64.73 ? 100 TRP B CZ3 1 ATOM 809 C CH2 . TRP A 1 104 A 48.013 -0.625 34.495 1.00 65.24 ? 100 TRP B CH2 1 ATOM 810 N N . PHE A 1 105 B 52.684 -6.365 33.814 1.00 44.18 ? 100 PHE B N 1 ATOM 811 C CA . PHE A 1 105 B 52.140 -7.431 32.969 1.00 42.32 ? 100 PHE B CA 1 ATOM 812 C C . PHE A 1 105 B 52.078 -8.789 33.686 1.00 40.44 ? 100 PHE B C 1 ATOM 813 O O . PHE A 1 105 B 52.569 -9.800 33.155 1.00 38.98 ? 100 PHE B O 1 ATOM 814 C CB . PHE A 1 105 B 52.950 -7.553 31.663 1.00 41.96 ? 100 PHE B CB 1 ATOM 815 C CG . PHE A 1 105 B 52.769 -6.393 30.699 1.00 44.59 ? 100 PHE B CG 1 ATOM 816 C CD1 . PHE A 1 105 B 51.543 -6.158 30.081 1.00 45.74 ? 100 PHE B CD1 1 ATOM 817 C CD2 . PHE A 1 105 B 53.838 -5.561 30.374 1.00 46.19 ? 100 PHE B CD2 1 ATOM 818 C CE1 . PHE A 1 105 B 51.381 -5.097 29.185 1.00 48.68 ? 100 PHE B CE1 1 ATOM 819 C CE2 . PHE A 1 105 B 53.683 -4.504 29.477 1.00 48.79 ? 100 PHE B CE2 1 ATOM 820 C CZ . PHE A 1 105 B 52.453 -4.268 28.884 1.00 50.19 ? 100 PHE B CZ 1 ATOM 821 N N . ALA A 1 106 ? 51.463 -8.807 34.872 1.00 40.93 ? 101 ALA B N 1 ATOM 822 C CA . ALA A 1 106 ? 51.575 -9.900 35.813 1.00 39.63 ? 101 ALA B CA 1 ATOM 823 C C . ALA A 1 106 ? 50.211 -10.214 36.413 1.00 40.03 ? 101 ALA B C 1 ATOM 824 O O . ALA A 1 106 ? 49.726 -9.457 37.246 1.00 42.76 ? 101 ALA B O 1 ATOM 825 C CB . ALA A 1 106 ? 52.561 -9.505 36.916 1.00 41.17 ? 101 ALA B CB 1 ATOM 826 N N . TYR A 1 107 ? 49.586 -11.304 35.980 1.00 37.77 ? 102 TYR B N 1 ATOM 827 C CA . TYR A 1 107 ? 48.413 -11.774 36.692 1.00 38.14 ? 102 TYR B CA 1 ATOM 828 C C . TYR A 1 107 ? 48.354 -13.260 36.877 1.00 35.72 ? 102 TYR B C 1 ATOM 829 O O . TYR A 1 107 ? 49.178 -14.044 36.389 1.00 33.32 ? 102 TYR B O 1 ATOM 830 C CB . TYR A 1 107 ? 47.079 -11.306 36.045 1.00 39.87 ? 102 TYR B CB 1 ATOM 831 C CG . TYR A 1 107 ? 46.155 -10.660 37.038 1.00 43.15 ? 102 TYR B CG 1 ATOM 832 C CD1 . TYR A 1 107 ? 46.594 -9.591 37.797 1.00 45.99 ? 102 TYR B CD1 1 ATOM 833 C CD2 . TYR A 1 107 ? 44.837 -11.110 37.224 1.00 44.39 ? 102 TYR B CD2 1 ATOM 834 C CE1 . TYR A 1 107 ? 45.763 -8.969 38.715 1.00 49.51 ? 102 TYR B CE1 1 ATOM 835 C CE2 . TYR A 1 107 ? 43.992 -10.495 38.147 1.00 47.50 ? 102 TYR B CE2 1 ATOM 836 C CZ . TYR A 1 107 ? 44.458 -9.428 38.890 1.00 50.19 ? 102 TYR B CZ 1 ATOM 837 O OH . TYR A 1 107 ? 43.623 -8.810 39.798 1.00 53.65 ? 102 TYR B OH 1 ATOM 838 N N . TRP A 1 108 ? 47.328 -13.611 37.624 1.00 35.83 ? 103 TRP B N 1 ATOM 839 C CA . TRP A 1 108 ? 46.972 -14.995 37.870 1.00 34.61 ? 103 TRP B CA 1 ATOM 840 C C . TRP A 1 108 ? 45.603 -15.317 37.309 1.00 34.25 ? 103 TRP B C 1 ATOM 841 O O . TRP A 1 108 ? 44.722 -14.453 37.328 1.00 35.82 ? 103 TRP B O 1 ATOM 842 C CB . TRP A 1 108 ? 46.895 -15.239 39.361 1.00 35.90 ? 103 TRP B CB 1 ATOM 843 C CG . TRP A 1 108 ? 48.191 -15.350 39.999 1.00 36.32 ? 103 TRP B CG 1 ATOM 844 C CD1 . TRP A 1 108 ? 49.234 -14.469 39.914 1.00 37.09 ? 103 TRP B CD1 1 ATOM 845 C CD2 . TRP A 1 108 ? 48.616 -16.399 40.865 1.00 36.51 ? 103 TRP B CD2 1 ATOM 846 N NE1 . TRP A 1 108 ? 50.285 -14.920 40.665 1.00 37.27 ? 103 TRP B NE1 1 ATOM 847 C CE2 . TRP A 1 108 ? 49.931 -16.099 41.265 1.00 36.84 ? 103 TRP B CE2 1 ATOM 848 C CE3 . TRP A 1 108 ? 48.008 -17.565 41.345 1.00 36.55 ? 103 TRP B CE3 1 ATOM 849 C CZ2 . TRP A 1 108 ? 50.647 -16.914 42.122 1.00 37.61 ? 103 TRP B CZ2 1 ATOM 850 C CZ3 . TRP A 1 108 ? 48.723 -18.384 42.191 1.00 37.15 ? 103 TRP B CZ3 1 ATOM 851 C CH2 . TRP A 1 108 ? 50.037 -18.050 42.579 1.00 38.01 ? 103 TRP B CH2 1 ATOM 852 N N . GLY A 1 109 ? 45.423 -16.571 36.876 1.00 32.47 ? 104 GLY B N 1 ATOM 853 C CA . GLY A 1 109 ? 44.118 -17.082 36.494 1.00 32.96 ? 104 GLY B CA 1 ATOM 854 C C . GLY A 1 109 ? 43.188 -17.082 37.694 1.00 34.94 ? 104 GLY B C 1 ATOM 855 O O . GLY A 1 109 ? 43.647 -17.037 38.857 1.00 34.76 ? 104 GLY B O 1 ATOM 856 N N . GLN A 1 110 ? 41.884 -17.126 37.416 1.00 36.86 ? 105 GLN B N 1 ATOM 857 C CA . GLN A 1 110 ? 40.876 -17.091 38.475 1.00 39.32 ? 105 GLN B CA 1 ATOM 858 C C . GLN A 1 110 ? 41.001 -18.301 39.382 1.00 37.86 ? 105 GLN B C 1 ATOM 859 O O . GLN A 1 110 ? 40.765 -18.191 40.589 1.00 40.35 ? 105 GLN B O 1 ATOM 860 C CB . GLN A 1 110 ? 39.433 -17.054 37.940 1.00 42.67 ? 105 GLN B CB 1 ATOM 861 C CG . GLN A 1 110 ? 39.222 -16.389 36.576 1.00 45.17 ? 105 GLN B CG 1 ATOM 862 C CD . GLN A 1 110 ? 39.005 -17.407 35.441 1.00 45.29 ? 105 GLN B CD 1 ATOM 863 O OE1 . GLN A 1 110 ? 39.626 -18.479 35.424 1.00 44.88 ? 105 GLN B OE1 1 ATOM 864 N NE2 . GLN A 1 110 ? 38.112 -17.085 34.503 1.00 47.38 ? 105 GLN B NE2 1 ATOM 865 N N . GLY A 1 111 ? 41.335 -19.457 38.819 1.00 34.78 ? 106 GLY B N 1 ATOM 866 C CA . GLY A 1 111 ? 41.503 -20.660 39.636 1.00 33.89 ? 106 GLY B CA 1 ATOM 867 C C . GLY A 1 111 ? 40.407 -21.682 39.405 1.00 33.75 ? 106 GLY B C 1 ATOM 868 O O . GLY A 1 111 ? 39.228 -21.346 39.388 1.00 35.29 ? 106 GLY B O 1 ATOM 869 N N . THR A 1 112 ? 40.803 -22.934 39.229 1.00 31.95 ? 107 THR B N 1 ATOM 870 C CA . THR A 1 112 ? 39.881 -24.012 38.918 1.00 32.01 ? 107 THR B CA 1 ATOM 871 C C . THR A 1 112 ? 39.904 -25.021 40.072 1.00 32.01 ? 107 THR B C 1 ATOM 872 O O . THR A 1 112 ? 40.882 -25.738 40.245 1.00 30.83 ? 107 THR B O 1 ATOM 873 C CB . THR A 1 112 ? 40.291 -24.722 37.602 1.00 30.93 ? 107 THR B CB 1 ATOM 874 O OG1 . THR A 1 112 ? 40.434 -23.761 36.553 1.00 30.43 ? 107 THR B OG1 1 ATOM 875 C CG2 . THR A 1 112 ? 39.273 -25.779 37.206 1.00 31.98 ? 107 THR B CG2 1 ATOM 876 N N . LEU A 1 113 ? 38.822 -25.075 40.846 1.00 33.54 ? 108 LEU B N 1 ATOM 877 C CA . LEU A 1 113 ? 38.705 -26.050 41.938 1.00 34.47 ? 108 LEU B CA 1 ATOM 878 C C . LEU A 1 113 ? 38.462 -27.428 41.361 1.00 33.98 ? 108 LEU B C 1 ATOM 879 O O . LEU A 1 113 ? 37.467 -27.646 40.700 1.00 34.33 ? 108 LEU B O 1 ATOM 880 C CB . LEU A 1 113 ? 37.568 -25.688 42.890 1.00 36.98 ? 108 LEU B CB 1 ATOM 881 C CG . LEU A 1 113 ? 37.248 -26.734 43.972 1.00 39.05 ? 108 LEU B CG 1 ATOM 882 C CD1 . LEU A 1 113 ? 38.480 -27.115 44.786 1.00 38.83 ? 108 LEU B CD1 1 ATOM 883 C CD2 . LEU A 1 113 ? 36.139 -26.232 44.888 1.00 41.78 ? 108 LEU B CD2 1 ATOM 884 N N . VAL A 1 114 ? 39.383 -28.348 41.613 1.00 33.37 ? 109 VAL B N 1 ATOM 885 C CA . VAL A 1 114 ? 39.254 -29.702 41.115 1.00 33.80 ? 109 VAL B CA 1 ATOM 886 C C . VAL A 1 114 ? 39.139 -30.738 42.236 1.00 35.50 ? 109 VAL B C 1 ATOM 887 O O . VAL A 1 114 ? 40.041 -30.920 43.038 1.00 35.66 ? 109 VAL B O 1 ATOM 888 C CB . VAL A 1 114 ? 40.431 -30.080 40.205 1.00 32.41 ? 109 VAL B CB 1 ATOM 889 C CG1 . VAL A 1 114 ? 40.237 -31.493 39.647 1.00 33.66 ? 109 VAL B CG1 1 ATOM 890 C CG2 . VAL A 1 114 ? 40.541 -29.087 39.070 1.00 30.84 ? 109 VAL B CG2 1 ATOM 891 N N . THR A 1 115 ? 38.027 -31.452 42.245 1.00 37.19 ? 110 THR B N 1 ATOM 892 C CA . THR A 1 115 ? 37.806 -32.513 43.213 1.00 39.39 ? 110 THR B CA 1 ATOM 893 C C . THR A 1 115 ? 37.947 -33.851 42.527 1.00 40.17 ? 110 THR B C 1 ATOM 894 O O . THR A 1 115 ? 37.386 -34.064 41.454 1.00 40.18 ? 110 THR B O 1 ATOM 895 C CB . THR A 1 115 ? 36.424 -32.394 43.838 1.00 41.26 ? 110 THR B CB 1 ATOM 896 O OG1 . THR A 1 115 ? 36.266 -31.059 44.317 1.00 40.76 ? 110 THR B OG1 1 ATOM 897 C CG2 . THR A 1 115 ? 36.260 -33.413 44.974 1.00 43.95 ? 110 THR B CG2 1 ATOM 898 N N . VAL A 1 116 ? 38.711 -34.746 43.138 1.00 41.44 ? 111 VAL B N 1 ATOM 899 C CA . VAL A 1 116 ? 38.932 -36.056 42.565 1.00 42.93 ? 111 VAL B CA 1 ATOM 900 C C . VAL A 1 116 ? 38.140 -37.064 43.365 1.00 45.91 ? 111 VAL B C 1 ATOM 901 O O . VAL A 1 116 ? 38.493 -37.353 44.494 1.00 47.51 ? 111 VAL B O 1 ATOM 902 C CB . VAL A 1 116 ? 40.423 -36.434 42.556 1.00 42.85 ? 111 VAL B CB 1 ATOM 903 C CG1 . VAL A 1 116 ? 40.645 -37.719 41.782 1.00 44.60 ? 111 VAL B CG1 1 ATOM 904 C CG2 . VAL A 1 116 ? 41.245 -35.334 41.914 1.00 40.05 ? 111 VAL B CG2 1 ATOM 905 N N . SER A 1 117 ? 37.070 -37.588 42.780 1.00 46.00 ? 112 SER B N 1 ATOM 906 C CA . SER A 1 117 ? 36.181 -38.511 43.486 1.00 46.35 ? 112 SER B CA 1 ATOM 907 C C . SER A 1 117 ? 35.303 -39.310 42.528 1.00 47.43 ? 112 SER B C 1 ATOM 908 O O . SER A 1 117 ? 35.009 -38.857 41.426 1.00 47.06 ? 112 SER B O 1 ATOM 909 C CB . SER A 1 117 ? 35.299 -37.738 44.459 1.00 44.44 ? 112 SER B CB 1 ATOM 910 O OG . SER A 1 117 ? 34.146 -38.483 44.763 1.00 44.76 ? 112 SER B OG 1 ATOM 911 N N . ALA A 1 118 ? 34.886 -40.498 42.970 1.00 49.33 ? 113 ALA B N 1 ATOM 912 C CA . ALA A 1 118 ? 33.993 -41.361 42.194 1.00 51.11 ? 113 ALA B CA 1 ATOM 913 C C . ALA A 1 118 ? 32.582 -41.340 42.761 1.00 50.92 ? 113 ALA B C 1 ATOM 914 O O . ALA A 1 118 ? 31.746 -42.137 42.359 1.00 52.97 ? 113 ALA B O 1 ATOM 915 C CB . ALA A 1 118 ? 34.484 -42.796 42.214 1.00 54.07 ? 113 ALA B CB 1 ATOM 916 N N . ALA A 1 119 ? 32.315 -40.461 43.716 1.00 49.12 ? 114 ALA B N 1 ATOM 917 C CA . ALA A 1 119 ? 30.997 -40.411 44.323 1.00 49.06 ? 114 ALA B CA 1 ATOM 918 C C . ALA A 1 119 ? 29.957 -39.973 43.299 1.00 49.44 ? 114 ALA B C 1 ATOM 919 O O . ALA A 1 119 ? 30.233 -39.140 42.440 1.00 48.66 ? 114 ALA B O 1 ATOM 920 C CB . ALA A 1 119 ? 31.002 -39.458 45.494 1.00 46.92 ? 114 ALA B CB 1 ATOM 921 N N . LYS A 1 120 ? 28.756 -40.523 43.404 1.00 51.30 ? 115 LYS B N 1 ATOM 922 C CA . LYS A 1 120 ? 27.667 -40.137 42.513 1.00 52.45 ? 115 LYS B CA 1 ATOM 923 C C . LYS A 1 120 ? 26.951 -38.955 43.131 1.00 50.62 ? 115 LYS B C 1 ATOM 924 O O . LYS A 1 120 ? 27.026 -38.748 44.340 1.00 49.36 ? 115 LYS B O 1 ATOM 925 C CB . LYS A 1 120 ? 26.601 -41.242 42.359 1.00 55.99 ? 115 LYS B CB 1 ATOM 926 C CG . LYS A 1 120 ? 25.963 -41.224 40.972 1.00 58.31 ? 115 LYS B CG 1 ATOM 927 C CD . LYS A 1 120 ? 24.544 -41.789 40.967 1.00 61.70 ? 115 LYS B CD 1 ATOM 928 C CE . LYS A 1 120 ? 23.793 -41.396 39.700 1.00 63.82 ? 115 LYS B CE 1 ATOM 929 N NZ . LYS A 1 120 ? 22.402 -41.928 39.719 1.00 67.55 ? 115 LYS B NZ 1 ATOM 930 N N . THR A 1 121 ? 26.200 -38.216 42.321 1.00 51.06 ? 116 THR B N 1 ATOM 931 C CA . THR A 1 121 ? 25.322 -37.195 42.868 1.00 50.31 ? 116 THR B CA 1 ATOM 932 C C . THR A 1 121 ? 24.439 -37.832 43.933 1.00 51.08 ? 116 THR B C 1 ATOM 933 O O . THR A 1 121 ? 23.860 -38.901 43.723 1.00 53.91 ? 116 THR B O 1 ATOM 934 C CB . THR A 1 121 ? 24.455 -36.549 41.784 1.00 52.11 ? 116 THR B CB 1 ATOM 935 O OG1 . THR A 1 121 ? 25.321 -35.994 40.793 1.00 51.58 ? 116 THR B OG1 1 ATOM 936 C CG2 . THR A 1 121 ? 23.582 -35.437 42.370 1.00 51.71 ? 116 THR B CG2 1 ATOM 937 N N . THR A 1 122 ? 24.380 -37.201 45.091 1.00 48.98 ? 117 THR B N 1 ATOM 938 C CA . THR A 1 122 ? 23.642 -37.750 46.215 1.00 49.62 ? 117 THR B CA 1 ATOM 939 C C . THR A 1 122 ? 23.031 -36.628 47.041 1.00 48.30 ? 117 THR B C 1 ATOM 940 O O . THR A 1 122 ? 23.746 -35.736 47.502 1.00 46.36 ? 117 THR B O 1 ATOM 941 C CB . THR A 1 122 ? 24.557 -38.581 47.137 1.00 49.13 ? 117 THR B CB 1 ATOM 942 O OG1 . THR A 1 122 ? 25.359 -39.457 46.347 1.00 50.30 ? 117 THR B OG1 1 ATOM 943 C CG2 . THR A 1 122 ? 23.735 -39.417 48.120 1.00 50.85 ? 117 THR B CG2 1 ATOM 944 N N . PRO A 1 123 ? 21.714 -36.680 47.263 1.00 49.84 ? 118 PRO B N 1 ATOM 945 C CA . PRO A 1 123 ? 21.125 -35.641 48.092 1.00 48.73 ? 118 PRO B CA 1 ATOM 946 C C . PRO A 1 123 ? 21.521 -35.807 49.557 1.00 47.09 ? 118 PRO B C 1 ATOM 947 O O . PRO A 1 123 ? 21.918 -36.890 49.973 1.00 47.61 ? 118 PRO B O 1 ATOM 948 C CB . PRO A 1 123 ? 19.619 -35.848 47.898 1.00 51.97 ? 118 PRO B CB 1 ATOM 949 C CG . PRO A 1 123 ? 19.458 -37.277 47.487 1.00 54.37 ? 118 PRO B CG 1 ATOM 950 C CD . PRO A 1 123 ? 20.726 -37.672 46.790 1.00 53.18 ? 118 PRO B CD 1 ATOM 951 N N . PRO A 1 124 ? 21.426 -34.731 50.336 1.00 45.41 ? 119 PRO B N 1 ATOM 952 C CA . PRO A 1 124 ? 21.734 -34.785 51.753 1.00 44.16 ? 119 PRO B CA 1 ATOM 953 C C . PRO A 1 124 ? 20.592 -35.338 52.569 1.00 45.67 ? 119 PRO B C 1 ATOM 954 O O . PRO A 1 124 ? 19.447 -35.148 52.204 1.00 47.42 ? 119 PRO B O 1 ATOM 955 C CB . PRO A 1 124 ? 21.922 -33.311 52.112 1.00 42.63 ? 119 PRO B CB 1 ATOM 956 C CG . PRO A 1 124 ? 21.006 -32.587 51.181 1.00 43.81 ? 119 PRO B CG 1 ATOM 957 C CD . PRO A 1 124 ? 20.974 -33.391 49.917 1.00 45.27 ? 119 PRO B CD 1 ATOM 958 N N . SER A 1 125 ? 20.900 -36.022 53.663 1.00 45.44 ? 120 SER B N 1 ATOM 959 C CA . SER A 1 125 ? 19.912 -36.252 54.721 1.00 46.58 ? 120 SER B CA 1 ATOM 960 C C . SER A 1 125 ? 20.028 -35.053 55.647 1.00 44.70 ? 120 SER B C 1 ATOM 961 O O . SER A 1 125 ? 21.133 -34.616 55.939 1.00 43.08 ? 120 SER B O 1 ATOM 962 C CB . SER A 1 125 ? 20.216 -37.516 55.514 1.00 47.72 ? 120 SER B CB 1 ATOM 963 O OG . SER A 1 125 ? 20.064 -38.682 54.749 1.00 49.88 ? 120 SER B OG 1 ATOM 964 N N . VAL A 1 126 ? 18.905 -34.524 56.112 1.00 45.51 ? 121 VAL B N 1 ATOM 965 C CA . VAL A 1 126 ? 18.910 -33.340 56.972 1.00 44.24 ? 121 VAL B CA 1 ATOM 966 C C . VAL A 1 126 ? 18.287 -33.667 58.329 1.00 45.31 ? 121 VAL B C 1 ATOM 967 O O . VAL A 1 126 ? 17.161 -34.115 58.403 1.00 47.27 ? 121 VAL B O 1 ATOM 968 C CB . VAL A 1 126 ? 18.162 -32.169 56.319 1.00 44.52 ? 121 VAL B CB 1 ATOM 969 C CG1 . VAL A 1 126 ? 18.283 -30.918 57.177 1.00 43.49 ? 121 VAL B CG1 1 ATOM 970 C CG2 . VAL A 1 126 ? 18.716 -31.911 54.932 1.00 43.96 ? 121 VAL B CG2 1 ATOM 971 N N . TYR A 1 127 ? 19.034 -33.434 59.403 1.00 44.41 ? 122 TYR B N 1 ATOM 972 C CA . TYR A 1 127 ? 18.562 -33.762 60.738 1.00 45.68 ? 122 TYR B CA 1 ATOM 973 C C . TYR A 1 127 ? 18.560 -32.521 61.599 1.00 44.85 ? 122 TYR B C 1 ATOM 974 O O . TYR A 1 127 ? 19.521 -31.749 61.574 1.00 43.12 ? 122 TYR B O 1 ATOM 975 C CB . TYR A 1 127 ? 19.444 -34.822 61.382 1.00 46.04 ? 122 TYR B CB 1 ATOM 976 C CG . TYR A 1 127 ? 19.581 -36.055 60.537 1.00 47.37 ? 122 TYR B CG 1 ATOM 977 C CD1 . TYR A 1 127 ? 18.474 -36.831 60.230 1.00 49.95 ? 122 TYR B CD1 1 ATOM 978 C CD2 . TYR A 1 127 ? 20.816 -36.440 60.032 1.00 46.64 ? 122 TYR B CD2 1 ATOM 979 C CE1 . TYR A 1 127 ? 18.591 -37.970 59.447 1.00 51.75 ? 122 TYR B CE1 1 ATOM 980 C CE2 . TYR A 1 127 ? 20.950 -37.568 59.242 1.00 48.09 ? 122 TYR B CE2 1 ATOM 981 C CZ . TYR A 1 127 ? 19.838 -38.335 58.950 1.00 50.79 ? 122 TYR B CZ 1 ATOM 982 O OH . TYR A 1 127 ? 19.962 -39.464 58.164 1.00 52.79 ? 122 TYR B OH 1 ATOM 983 N N . PRO A 1 128 ? 17.485 -32.334 62.376 1.00 46.43 ? 123 PRO B N 1 ATOM 984 C CA . PRO A 1 128 ? 17.409 -31.214 63.292 1.00 46.14 ? 123 PRO B CA 1 ATOM 985 C C . PRO A 1 128 ? 18.248 -31.460 64.533 1.00 45.83 ? 123 PRO B C 1 ATOM 986 O O . PRO A 1 128 ? 18.352 -32.603 65.001 1.00 46.85 ? 123 PRO B O 1 ATOM 987 C CB . PRO A 1 128 ? 15.941 -31.195 63.690 1.00 48.29 ? 123 PRO B CB 1 ATOM 988 C CG . PRO A 1 128 ? 15.553 -32.636 63.672 1.00 49.97 ? 123 PRO B CG 1 ATOM 989 C CD . PRO A 1 128 ? 16.335 -33.243 62.536 1.00 49.11 ? 123 PRO B CD 1 ATOM 990 N N . LEU A 1 129 ? 18.825 -30.384 65.057 1.00 44.90 ? 124 LEU B N 1 ATOM 991 C CA . LEU A 1 129 ? 19.572 -30.441 66.290 1.00 45.08 ? 124 LEU B CA 1 ATOM 992 C C . LEU A 1 129 ? 18.847 -29.573 67.301 1.00 46.03 ? 124 LEU B C 1 ATOM 993 O O . LEU A 1 129 ? 18.992 -28.350 67.288 1.00 45.86 ? 124 LEU B O 1 ATOM 994 C CB . LEU A 1 129 ? 21.010 -29.957 66.068 1.00 43.84 ? 124 LEU B CB 1 ATOM 995 C CG . LEU A 1 129 ? 21.709 -30.654 64.902 1.00 42.89 ? 124 LEU B CG 1 ATOM 996 C CD1 . LEU A 1 129 ? 23.014 -29.956 64.548 1.00 42.11 ? 124 LEU B CD1 1 ATOM 997 C CD2 . LEU A 1 129 ? 21.942 -32.119 65.215 1.00 43.84 ? 124 LEU B CD2 1 ATOM 998 N N . ALA A 1 130 ? 18.033 -30.213 68.141 1.00 47.52 ? 125 ALA B N 1 ATOM 999 C CA . ALA A 1 130 ? 17.380 -29.549 69.267 1.00 48.66 ? 125 ALA B CA 1 ATOM 1000 C C . ALA A 1 130 ? 18.152 -29.879 70.541 1.00 49.44 ? 125 ALA B C 1 ATOM 1001 O O . ALA A 1 130 ? 18.762 -30.956 70.650 1.00 49.69 ? 125 ALA B O 1 ATOM 1002 C CB . ALA A 1 130 ? 15.940 -29.998 69.382 1.00 50.37 ? 125 ALA B CB 1 ATOM 1003 N N . PRO A 1 131 ? 18.164 -28.946 71.506 1.00 50.07 ? 126 PRO B N 1 ATOM 1004 C CA . PRO A 1 131 ? 18.834 -29.278 72.764 1.00 51.31 ? 126 PRO B CA 1 ATOM 1005 C C . PRO A 1 131 ? 18.241 -30.533 73.420 1.00 53.11 ? 126 PRO B C 1 ATOM 1006 O O . PRO A 1 131 ? 17.056 -30.817 73.262 1.00 53.50 ? 126 PRO B O 1 ATOM 1007 C CB . PRO A 1 131 ? 18.605 -28.031 73.637 1.00 52.18 ? 126 PRO B CB 1 ATOM 1008 C CG . PRO A 1 131 ? 17.526 -27.249 72.958 1.00 51.83 ? 126 PRO B CG 1 ATOM 1009 C CD . PRO A 1 131 ? 17.598 -27.588 71.505 1.00 50.19 ? 126 PRO B CD 1 ATOM 1010 N N . GLY A 1 132 ? 19.077 -31.274 74.140 1.00 54.66 ? 127 GLY B N 1 ATOM 1011 C CA . GLY A 1 132 ? 18.645 -32.456 74.895 1.00 57.18 ? 127 GLY B CA 1 ATOM 1012 C C . GLY A 1 132 ? 17.560 -32.173 75.925 1.00 58.98 ? 127 GLY B C 1 ATOM 1013 O O . GLY A 1 132 ? 17.385 -31.028 76.362 1.00 58.54 ? 127 GLY B O 1 ATOM 1014 N N . SER A 1 133 ? 16.818 -33.222 76.285 1.00 61.43 ? 128 SER B N 1 ATOM 1015 C CA . SER A 1 133 ? 15.719 -33.125 77.257 1.00 63.78 ? 128 SER B CA 1 ATOM 1016 C C . SER A 1 133 ? 16.161 -32.528 78.590 1.00 65.08 ? 128 SER B C 1 ATOM 1017 O O . SER A 1 133 ? 15.496 -31.653 79.142 1.00 65.32 ? 128 SER B O 1 ATOM 1018 C CB . SER A 1 133 ? 15.113 -34.501 77.534 1.00 66.78 ? 128 SER B CB 1 ATOM 1019 O OG . SER A 1 133 ? 14.730 -35.156 76.340 1.00 66.54 ? 128 SER B OG 1 ATOM 1020 N N . ALA A 1 134 ? 17.276 -33.022 79.114 1.00 66.39 ? 129 ALA B N 1 ATOM 1021 C CA . ALA A 1 134 ? 17.830 -32.493 80.368 1.00 68.21 ? 129 ALA B CA 1 ATOM 1022 C C . ALA A 1 134 ? 18.835 -31.324 80.217 1.00 66.63 ? 129 ALA B C 1 ATOM 1023 O O . ALA A 1 134 ? 19.638 -31.077 81.115 1.00 68.19 ? 129 ALA B O 1 ATOM 1024 C CB . ALA A 1 134 ? 18.429 -33.636 81.190 1.00 71.29 ? 129 ALA B CB 1 ATOM 1025 N N . ALA A 1 135 ? 18.767 -30.579 79.114 1.00 64.03 ? 130 ALA B N 1 ATOM 1026 C CA . ALA A 1 135 ? 19.590 -29.390 78.955 1.00 63.16 ? 130 ALA B CA 1 ATOM 1027 C C . ALA A 1 135 ? 19.044 -28.277 79.833 1.00 64.57 ? 130 ALA B C 1 ATOM 1028 O O . ALA A 1 135 ? 17.839 -28.216 80.110 1.00 65.01 ? 130 ALA B O 1 ATOM 1029 C CB . ALA A 1 135 ? 19.634 -28.940 77.499 1.00 60.36 ? 130 ALA B CB 1 ATOM 1030 N N . GLN A 1 136 ? 19.947 -27.416 80.295 1.00 65.75 ? 131 GLN B N 1 ATOM 1031 C CA . GLN A 1 136 ? 19.563 -26.207 80.986 1.00 67.00 ? 131 GLN B CA 1 ATOM 1032 C C . GLN A 1 136 ? 19.011 -25.232 79.969 1.00 65.01 ? 131 GLN B C 1 ATOM 1033 O O . GLN A 1 136 ? 19.532 -25.119 78.858 1.00 62.91 ? 131 GLN B O 1 ATOM 1034 C CB . GLN A 1 136 ? 20.777 -25.570 81.675 1.00 69.13 ? 131 GLN B CB 1 ATOM 1035 C CG . GLN A 1 136 ? 21.412 -26.401 82.785 1.00 72.04 ? 131 GLN B CG 1 ATOM 1036 C CD . GLN A 1 136 ? 20.414 -26.839 83.859 1.00 74.11 ? 131 GLN B CD 1 ATOM 1037 O OE1 . GLN A 1 136 ? 19.811 -27.904 83.740 1.00 74.18 ? 131 GLN B OE1 1 ATOM 1038 N NE2 . GLN A 1 136 ? 20.226 -26.017 84.900 1.00 76.31 ? 131 GLN B NE2 1 ATOM 1039 N N . THR A 1 137 ? 17.954 -24.528 80.349 1.00 66.00 ? 132 THR B N 1 ATOM 1040 C CA . THR A 1 137 ? 17.512 -23.371 79.590 1.00 65.47 ? 132 THR B CA 1 ATOM 1041 C C . THR A 1 137 ? 18.423 -22.217 80.008 1.00 66.84 ? 132 THR B C 1 ATOM 1042 O O . THR A 1 137 ? 18.588 -21.966 81.204 1.00 69.29 ? 132 THR B O 1 ATOM 1043 C CB . THR A 1 137 ? 16.039 -23.046 79.884 1.00 66.52 ? 132 THR B CB 1 ATOM 1044 O OG1 . THR A 1 137 ? 15.273 -24.257 79.963 1.00 66.20 ? 132 THR B OG1 1 ATOM 1045 C CG2 . THR A 1 137 ? 15.445 -22.159 78.801 1.00 65.85 ? 132 THR B CG2 1 ATOM 1046 N N . ASN A 1 138 ? 19.042 -21.556 79.028 1.00 65.66 ? 133 ASN B N 1 ATOM 1047 C CA . ASN A 1 138 ? 19.807 -20.322 79.254 1.00 67.44 ? 133 ASN B CA 1 ATOM 1048 C C . ASN A 1 138 ? 19.309 -19.207 78.312 1.00 67.05 ? 133 ASN B C 1 ATOM 1049 O O . ASN A 1 138 ? 18.671 -19.507 77.307 1.00 65.45 ? 133 ASN B O 1 ATOM 1050 C CB . ASN A 1 138 ? 21.312 -20.565 79.110 1.00 67.43 ? 133 ASN B CB 1 ATOM 1051 C CG . ASN A 1 138 ? 21.927 -21.112 80.407 1.00 69.62 ? 133 ASN B CG 1 ATOM 1052 O OD1 . ASN A 1 138 ? 22.213 -22.308 80.509 1.00 68.85 ? 133 ASN B OD1 1 ATOM 1053 N ND2 . ASN A 1 138 ? 22.062 -20.253 81.427 1.00 72.60 ? 133 ASN B ND2 1 ATOM 1054 N N . SER A 1 139 ? 19.589 -17.942 78.639 1.00 69.14 ? 134 SER B N 1 ATOM 1055 C CA . SER A 1 139 ? 18.875 -16.792 78.042 1.00 69.87 ? 134 SER B CA 1 ATOM 1056 C C . SER A 1 139 ? 18.872 -16.741 76.499 1.00 67.54 ? 134 SER B C 1 ATOM 1057 O O . SER A 1 139 ? 17.904 -16.285 75.895 1.00 67.82 ? 134 SER B O 1 ATOM 1058 C CB . SER A 1 139 ? 19.393 -15.486 78.636 1.00 73.51 ? 134 SER B CB 1 ATOM 1059 O OG . SER A 1 139 ? 20.778 -15.355 78.433 1.00 74.24 ? 134 SER B OG 1 ATOM 1060 N N . MET A 1 140 ? 19.954 -17.196 75.875 1.00 65.52 ? 135 MET B N 1 ATOM 1061 C CA . MET A 1 140 ? 19.973 -17.514 74.445 1.00 62.85 ? 135 MET B CA 1 ATOM 1062 C C . MET A 1 140 ? 19.902 -19.032 74.297 1.00 59.68 ? 135 MET B C 1 ATOM 1063 O O . MET A 1 140 ? 20.393 -19.769 75.150 1.00 59.86 ? 135 MET B O 1 ATOM 1064 C CB . MET A 1 140 ? 21.248 -16.977 73.785 1.00 63.24 ? 135 MET B CB 1 ATOM 1065 C CG . MET A 1 140 ? 21.299 -15.460 73.632 1.00 66.49 ? 135 MET B CG 1 ATOM 1066 S SD . MET A 1 140 ? 19.808 -14.710 72.936 1.00 67.46 ? 135 MET B SD 1 ATOM 1067 C CE . MET A 1 140 ? 20.255 -14.426 71.219 1.00 66.58 ? 135 MET B CE 1 ATOM 1068 N N . VAL A 1 141 ? 19.257 -19.499 73.241 1.00 57.36 ? 136 VAL B N 1 ATOM 1069 C CA . VAL A 1 141 ? 19.248 -20.926 72.929 1.00 54.82 ? 136 VAL B CA 1 ATOM 1070 C C . VAL A 1 141 ? 19.825 -21.162 71.528 1.00 52.81 ? 136 VAL B C 1 ATOM 1071 O O . VAL A 1 141 ? 19.485 -20.452 70.588 1.00 52.66 ? 136 VAL B O 1 ATOM 1072 C CB . VAL A 1 141 ? 17.820 -21.519 73.072 1.00 54.78 ? 136 VAL B CB 1 ATOM 1073 C CG1 . VAL A 1 141 ? 16.869 -21.002 71.994 1.00 54.91 ? 136 VAL B CG1 1 ATOM 1074 C CG2 . VAL A 1 141 ? 17.848 -23.045 73.105 1.00 53.23 ? 136 VAL B CG2 1 ATOM 1075 N N . THR A 1 142 ? 20.705 -22.152 71.409 1.00 51.37 ? 137 THR B N 1 ATOM 1076 C CA . THR A 1 142 ? 21.339 -22.465 70.150 1.00 49.83 ? 137 THR B CA 1 ATOM 1077 C C . THR A 1 142 ? 20.708 -23.723 69.571 1.00 48.48 ? 137 THR B C 1 ATOM 1078 O O . THR A 1 142 ? 20.561 -24.729 70.267 1.00 48.26 ? 137 THR B O 1 ATOM 1079 C CB . THR A 1 142 ? 22.856 -22.646 70.320 1.00 49.83 ? 137 THR B CB 1 ATOM 1080 O OG1 . THR A 1 142 ? 23.404 -21.458 70.897 1.00 51.93 ? 137 THR B OG1 1 ATOM 1081 C CG2 . THR A 1 142 ? 23.529 -22.920 68.976 1.00 48.33 ? 137 THR B CG2 1 ATOM 1082 N N . LEU A 1 143 ? 20.318 -23.636 68.298 1.00 48.03 ? 138 LEU B N 1 ATOM 1083 C CA . LEU A 1 143 ? 19.781 -24.764 67.559 1.00 47.26 ? 138 LEU B CA 1 ATOM 1084 C C . LEU A 1 143 ? 20.659 -25.026 66.359 1.00 46.18 ? 138 LEU B C 1 ATOM 1085 O O . LEU A 1 143 ? 21.552 -24.235 66.042 1.00 46.16 ? 138 LEU B O 1 ATOM 1086 C CB . LEU A 1 143 ? 18.364 -24.455 67.083 1.00 48.21 ? 138 LEU B CB 1 ATOM 1087 C CG . LEU A 1 143 ? 17.390 -23.985 68.157 1.00 50.13 ? 138 LEU B CG 1 ATOM 1088 C CD1 . LEU A 1 143 ? 16.103 -23.483 67.530 1.00 51.59 ? 138 LEU B CD1 1 ATOM 1089 C CD2 . LEU A 1 143 ? 17.112 -25.124 69.129 1.00 50.43 ? 138 LEU B CD2 1 ATOM 1090 N N . GLY A 1 144 ? 20.396 -26.130 65.670 1.00 45.76 ? 139 GLY B N 1 ATOM 1091 C CA . GLY A 1 144 ? 21.175 -26.460 64.496 1.00 44.86 ? 139 GLY B CA 1 ATOM 1092 C C . GLY A 1 144 ? 20.503 -27.376 63.500 1.00 44.89 ? 139 GLY B C 1 ATOM 1093 O O . GLY A 1 144 ? 19.348 -27.788 63.636 1.00 45.75 ? 139 GLY B O 1 ATOM 1094 N N . CYS A 1 145 ? 21.256 -27.668 62.464 1.00 44.36 ? 140 CYS B N 1 ATOM 1095 C CA . CYS A 1 145 ? 20.792 -28.476 61.366 1.00 44.76 ? 140 CYS B CA 1 ATOM 1096 C C . CYS A 1 145 ? 22.002 -29.299 60.885 1.00 43.27 ? 140 CYS B C 1 ATOM 1097 O O . CYS A 1 145 ? 23.077 -28.741 60.631 1.00 42.22 ? 140 CYS B O 1 ATOM 1098 C CB . CYS A 1 145 ? 20.320 -27.422 60.337 1.00 45.85 ? 140 CYS B CB 1 ATOM 1099 S SG . CYS A 1 145 ? 19.631 -27.821 58.723 1.00 47.78 ? 140 CYS B SG 1 ATOM 1100 N N . LEU A 1 146 ? 21.858 -30.626 60.820 1.00 43.03 ? 141 LEU B N 1 ATOM 1101 C CA . LEU A 1 146 ? 22.939 -31.484 60.362 1.00 42.33 ? 141 LEU B CA 1 ATOM 1102 C C . LEU A 1 146 ? 22.614 -31.964 58.970 1.00 42.01 ? 141 LEU B C 1 ATOM 1103 O O . LEU A 1 146 ? 21.612 -32.648 58.761 1.00 43.14 ? 141 LEU B O 1 ATOM 1104 C CB . LEU A 1 146 ? 23.110 -32.688 61.282 1.00 43.54 ? 141 LEU B CB 1 ATOM 1105 C CG . LEU A 1 146 ? 24.120 -33.771 60.864 1.00 43.99 ? 141 LEU B CG 1 ATOM 1106 C CD1 . LEU A 1 146 ? 25.526 -33.217 60.747 1.00 43.17 ? 141 LEU B CD1 1 ATOM 1107 C CD2 . LEU A 1 146 ? 24.093 -34.916 61.869 1.00 45.76 ? 141 LEU B CD2 1 ATOM 1108 N N . VAL A 1 147 ? 23.482 -31.621 58.029 1.00 41.04 ? 142 VAL B N 1 ATOM 1109 C CA . VAL A 1 147 ? 23.296 -31.949 56.629 1.00 41.18 ? 142 VAL B CA 1 ATOM 1110 C C . VAL A 1 147 ? 24.340 -32.974 56.236 1.00 40.86 ? 142 VAL B C 1 ATOM 1111 O O . VAL A 1 147 ? 25.519 -32.645 56.096 1.00 40.09 ? 142 VAL B O 1 ATOM 1112 C CB . VAL A 1 147 ? 23.445 -30.701 55.741 1.00 40.96 ? 142 VAL B CB 1 ATOM 1113 C CG1 . VAL A 1 147 ? 23.067 -31.040 54.305 1.00 41.61 ? 142 VAL B CG1 1 ATOM 1114 C CG2 . VAL A 1 147 ? 22.570 -29.572 56.269 1.00 41.54 ? 142 VAL B CG2 1 ATOM 1115 N N . LYS A 1 148 ? 23.894 -34.205 56.021 1.00 41.71 ? 143 LYS B N 1 ATOM 1116 C CA . LYS A 1 148 ? 24.799 -35.337 55.989 1.00 42.51 ? 143 LYS B CA 1 ATOM 1117 C C . LYS A 1 148 ? 24.750 -36.123 54.689 1.00 43.17 ? 143 LYS B C 1 ATOM 1118 O O . LYS A 1 148 ? 23.702 -36.239 54.063 1.00 44.27 ? 143 LYS B O 1 ATOM 1119 C CB . LYS A 1 148 ? 24.458 -36.261 57.145 1.00 44.53 ? 143 LYS B CB 1 ATOM 1120 C CG . LYS A 1 148 ? 25.527 -37.278 57.489 1.00 46.04 ? 143 LYS B CG 1 ATOM 1121 C CD . LYS A 1 148 ? 25.474 -37.603 58.974 1.00 47.54 ? 143 LYS B CD 1 ATOM 1122 C CE . LYS A 1 148 ? 26.639 -38.478 59.399 1.00 49.44 ? 143 LYS B CE 1 ATOM 1123 N NZ . LYS A 1 148 ? 26.627 -39.761 58.651 1.00 51.63 ? 143 LYS B NZ 1 ATOM 1124 N N . GLY A 1 149 ? 25.903 -36.647 54.286 1.00 42.90 ? 144 GLY B N 1 ATOM 1125 C CA . GLY A 1 149 ? 25.974 -37.589 53.190 1.00 44.04 ? 144 GLY B CA 1 ATOM 1126 C C . GLY A 1 149 ? 25.473 -37.053 51.855 1.00 43.45 ? 144 GLY B C 1 ATOM 1127 O O . GLY A 1 149 ? 24.567 -37.633 51.265 1.00 45.10 ? 144 GLY B O 1 ATOM 1128 N N . TYR A 1 150 ? 26.031 -35.936 51.392 1.00 41.49 ? 145 TYR B N 1 ATOM 1129 C CA . TYR A 1 150 ? 25.695 -35.418 50.068 1.00 41.35 ? 145 TYR B CA 1 ATOM 1130 C C . TYR A 1 150 ? 26.914 -35.299 49.180 1.00 40.69 ? 145 TYR B C 1 ATOM 1131 O O . TYR A 1 150 ? 28.041 -35.268 49.647 1.00 39.90 ? 145 TYR B O 1 ATOM 1132 C CB . TYR A 1 150 ? 25.005 -34.061 50.144 1.00 40.63 ? 145 TYR B CB 1 ATOM 1133 C CG . TYR A 1 150 ? 25.854 -32.960 50.712 1.00 39.11 ? 145 TYR B CG 1 ATOM 1134 C CD1 . TYR A 1 150 ? 25.947 -32.778 52.075 1.00 38.69 ? 145 TYR B CD1 1 ATOM 1135 C CD2 . TYR A 1 150 ? 26.553 -32.093 49.884 1.00 38.83 ? 145 TYR B CD2 1 ATOM 1136 C CE1 . TYR A 1 150 ? 26.716 -31.766 52.618 1.00 37.97 ? 145 TYR B CE1 1 ATOM 1137 C CE2 . TYR A 1 150 ? 27.335 -31.074 50.414 1.00 38.27 ? 145 TYR B CE2 1 ATOM 1138 C CZ . TYR A 1 150 ? 27.405 -30.916 51.798 1.00 37.75 ? 145 TYR B CZ 1 ATOM 1139 O OH . TYR A 1 150 ? 28.147 -29.923 52.379 1.00 37.16 ? 145 TYR B OH 1 ATOM 1140 N N . PHE A 1 151 ? 26.659 -35.240 47.885 1.00 41.26 ? 146 PHE B N 1 ATOM 1141 C CA . PHE A 1 151 ? 27.713 -35.057 46.907 1.00 40.92 ? 146 PHE B CA 1 ATOM 1142 C C . PHE A 1 151 ? 27.097 -34.650 45.574 1.00 41.80 ? 146 PHE B C 1 ATOM 1143 O O . PHE A 1 151 ? 26.082 -35.218 45.180 1.00 43.08 ? 146 PHE B O 1 ATOM 1144 C CB . PHE A 1 151 ? 28.499 -36.352 46.719 1.00 41.76 ? 146 PHE B CB 1 ATOM 1145 C CG . PHE A 1 151 ? 29.665 -36.202 45.806 1.00 41.56 ? 146 PHE B CG 1 ATOM 1146 C CD1 . PHE A 1 151 ? 29.496 -36.287 44.425 1.00 42.43 ? 146 PHE B CD1 1 ATOM 1147 C CD2 . PHE A 1 151 ? 30.923 -35.943 46.321 1.00 40.71 ? 146 PHE B CD2 1 ATOM 1148 C CE1 . PHE A 1 151 ? 30.575 -36.114 43.585 1.00 42.45 ? 146 PHE B CE1 1 ATOM 1149 C CE2 . PHE A 1 151 ? 32.003 -35.777 45.486 1.00 40.96 ? 146 PHE B CE2 1 ATOM 1150 C CZ . PHE A 1 151 ? 31.824 -35.857 44.117 1.00 41.68 ? 146 PHE B CZ 1 ATOM 1151 N N . PRO A 1 152 ? 27.708 -33.672 44.872 1.00 41.43 ? 147 PRO B N 1 ATOM 1152 C CA . PRO A 1 152 ? 28.895 -32.904 45.227 1.00 40.29 ? 147 PRO B CA 1 ATOM 1153 C C . PRO A 1 152 ? 28.541 -31.683 46.062 1.00 39.91 ? 147 PRO B C 1 ATOM 1154 O O . PRO A 1 152 ? 27.374 -31.468 46.371 1.00 40.14 ? 147 PRO B O 1 ATOM 1155 C CB . PRO A 1 152 ? 29.412 -32.448 43.867 1.00 40.81 ? 147 PRO B CB 1 ATOM 1156 C CG . PRO A 1 152 ? 28.172 -32.251 43.063 1.00 42.10 ? 147 PRO B CG 1 ATOM 1157 C CD . PRO A 1 152 ? 27.186 -33.272 43.550 1.00 42.67 ? 147 PRO B CD 1 ATOM 1158 N N . GLU A 1 153 ? 29.553 -30.900 46.422 1.00 39.72 ? 148 GLU B N 1 ATOM 1159 C CA . GLU A 1 153 ? 29.333 -29.563 46.947 1.00 40.24 ? 148 GLU B CA 1 ATOM 1160 C C . GLU A 1 153 ? 28.790 -28.642 45.853 1.00 41.55 ? 148 GLU B C 1 ATOM 1161 O O . GLU A 1 153 ? 28.981 -28.911 44.682 1.00 42.23 ? 148 GLU B O 1 ATOM 1162 C CB . GLU A 1 153 ? 30.634 -28.978 47.488 1.00 40.47 ? 148 GLU B CB 1 ATOM 1163 C CG . GLU A 1 153 ? 31.163 -29.699 48.713 1.00 40.23 ? 148 GLU B CG 1 ATOM 1164 C CD . GLU A 1 153 ? 32.066 -28.846 49.555 1.00 41.30 ? 148 GLU B CD 1 ATOM 1165 O OE1 . GLU A 1 153 ? 33.308 -28.978 49.419 1.00 42.48 ? 148 GLU B OE1 1 ATOM 1166 O OE2 . GLU A 1 153 ? 31.527 -28.049 50.348 1.00 41.76 ? 148 GLU B OE2 1 ATOM 1167 N N . PRO A 1 154 ? 28.113 -27.548 46.232 1.00 42.46 ? 149 PRO B N 1 ATOM 1168 C CA . PRO A 1 154 ? 27.796 -27.117 47.591 1.00 42.21 ? 149 PRO B CA 1 ATOM 1169 C C . PRO A 1 154 ? 26.345 -27.413 47.994 1.00 42.77 ? 149 PRO B C 1 ATOM 1170 O O . PRO A 1 154 ? 25.525 -27.798 47.151 1.00 43.35 ? 149 PRO B O 1 ATOM 1171 C CB . PRO A 1 154 ? 27.985 -25.604 47.504 1.00 43.35 ? 149 PRO B CB 1 ATOM 1172 C CG . PRO A 1 154 ? 27.532 -25.277 46.113 1.00 44.98 ? 149 PRO B CG 1 ATOM 1173 C CD . PRO A 1 154 ? 27.741 -26.507 45.258 1.00 44.17 ? 149 PRO B CD 1 ATOM 1174 N N . VAL A 1 155 ? 26.066 -27.228 49.287 1.00 42.71 ? 150 VAL B N 1 ATOM 1175 C CA . VAL A 1 155 ? 24.712 -27.008 49.777 1.00 43.71 ? 150 VAL B CA 1 ATOM 1176 C C . VAL A 1 155 ? 24.643 -25.572 50.281 1.00 45.00 ? 150 VAL B C 1 ATOM 1177 O O . VAL A 1 155 ? 25.663 -24.983 50.632 1.00 44.67 ? 150 VAL B O 1 ATOM 1178 C CB . VAL A 1 155 ? 24.305 -27.973 50.921 1.00 43.01 ? 150 VAL B CB 1 ATOM 1179 C CG1 . VAL A 1 155 ? 24.229 -29.410 50.424 1.00 43.00 ? 150 VAL B CG1 1 ATOM 1180 C CG2 . VAL A 1 155 ? 25.251 -27.876 52.106 1.00 41.98 ? 150 VAL B CG2 1 ATOM 1181 N N . THR A 1 156 ? 23.442 -25.004 50.311 1.00 47.12 ? 151 THR B N 1 ATOM 1182 C CA . THR A 1 156 ? 23.228 -23.712 50.963 1.00 48.55 ? 151 THR B CA 1 ATOM 1183 C C . THR A 1 156 ? 22.259 -23.963 52.096 1.00 48.46 ? 151 THR B C 1 ATOM 1184 O O . THR A 1 156 ? 21.374 -24.806 51.974 1.00 48.71 ? 151 THR B O 1 ATOM 1185 C CB . THR A 1 156 ? 22.655 -22.634 50.016 1.00 51.52 ? 151 THR B CB 1 ATOM 1186 O OG1 . THR A 1 156 ? 21.283 -22.912 49.720 1.00 53.28 ? 151 THR B OG1 1 ATOM 1187 C CG2 . THR A 1 156 ? 23.442 -22.558 48.719 1.00 51.95 ? 151 THR B CG2 1 ATOM 1188 N N . VAL A 1 157 ? 22.440 -23.240 53.197 1.00 48.50 ? 152 VAL B N 1 ATOM 1189 C CA . VAL A 1 157 ? 21.562 -23.331 54.345 1.00 48.29 ? 152 VAL B CA 1 ATOM 1190 C C . VAL A 1 157 ? 21.063 -21.927 54.665 1.00 50.64 ? 152 VAL B C 1 ATOM 1191 O O . VAL A 1 157 ? 21.841 -20.971 54.702 1.00 51.33 ? 152 VAL B O 1 ATOM 1192 C CB . VAL A 1 157 ? 22.292 -23.927 55.568 1.00 46.41 ? 152 VAL B CB 1 ATOM 1193 C CG1 . VAL A 1 157 ? 21.343 -24.089 56.749 1.00 46.61 ? 152 VAL B CG1 1 ATOM 1194 C CG2 . VAL A 1 157 ? 22.892 -25.277 55.220 1.00 44.81 ? 152 VAL B CG2 1 ATOM 1195 N N . THR A 1 158 ? 19.756 -21.802 54.868 1.00 52.30 ? 153 THR B N 1 ATOM 1196 C CA . THR A 1 158 ? 19.188 -20.575 55.402 1.00 54.67 ? 153 THR B CA 1 ATOM 1197 C C . THR A 1 158 ? 18.261 -20.958 56.541 1.00 54.40 ? 153 THR B C 1 ATOM 1198 O O . THR A 1 158 ? 17.945 -22.124 56.725 1.00 53.10 ? 153 THR B O 1 ATOM 1199 C CB . THR A 1 158 ? 18.429 -19.778 54.327 1.00 58.16 ? 153 THR B CB 1 ATOM 1200 O OG1 . THR A 1 158 ? 17.324 -20.547 53.844 1.00 59.24 ? 153 THR B OG1 1 ATOM 1201 C CG2 . THR A 1 158 ? 19.329 -19.445 53.150 1.00 58.43 ? 153 THR B CG2 1 ATOM 1202 N N . TRP A 1 159 ? 17.846 -19.980 57.326 1.00 56.01 ? 154 TRP B N 1 ATOM 1203 C CA . TRP A 1 159 ? 16.961 -20.231 58.442 1.00 56.17 ? 154 TRP B CA 1 ATOM 1204 C C . TRP A 1 159 ? 15.737 -19.345 58.301 1.00 59.83 ? 154 TRP B C 1 ATOM 1205 O O . TRP A 1 159 ? 15.858 -18.138 58.068 1.00 62.07 ? 154 TRP B O 1 ATOM 1206 C CB . TRP A 1 159 ? 17.677 -19.946 59.756 1.00 55.17 ? 154 TRP B CB 1 ATOM 1207 C CG . TRP A 1 159 ? 18.731 -20.949 60.097 1.00 52.09 ? 154 TRP B CG 1 ATOM 1208 C CD1 . TRP A 1 159 ? 20.056 -20.868 59.813 1.00 50.96 ? 154 TRP B CD1 1 ATOM 1209 C CD2 . TRP A 1 159 ? 18.547 -22.181 60.810 1.00 50.42 ? 154 TRP B CD2 1 ATOM 1210 N NE1 . TRP A 1 159 ? 20.714 -21.973 60.302 1.00 48.75 ? 154 TRP B NE1 1 ATOM 1211 C CE2 . TRP A 1 159 ? 19.808 -22.797 60.913 1.00 48.32 ? 154 TRP B CE2 1 ATOM 1212 C CE3 . TRP A 1 159 ? 17.436 -22.818 61.375 1.00 50.89 ? 154 TRP B CE3 1 ATOM 1213 C CZ2 . TRP A 1 159 ? 19.993 -24.024 61.557 1.00 46.93 ? 154 TRP B CZ2 1 ATOM 1214 C CZ3 . TRP A 1 159 ? 17.620 -24.036 62.019 1.00 49.31 ? 154 TRP B CZ3 1 ATOM 1215 C CH2 . TRP A 1 159 ? 18.889 -24.626 62.102 1.00 47.47 ? 154 TRP B CH2 1 ATOM 1216 N N . ASN A 1 160 ? 14.561 -19.953 58.442 1.00 60.78 ? 155 ASN B N 1 ATOM 1217 C CA . ASN A 1 160 ? 13.287 -19.254 58.252 1.00 64.85 ? 155 ASN B CA 1 ATOM 1218 C C . ASN A 1 160 ? 13.288 -18.457 56.936 1.00 67.62 ? 155 ASN B C 1 ATOM 1219 O O . ASN A 1 160 ? 12.926 -17.282 56.890 1.00 70.93 ? 155 ASN B O 1 ATOM 1220 C CB . ASN A 1 160 ? 12.973 -18.363 59.464 1.00 66.40 ? 155 ASN B CB 1 ATOM 1221 C CG . ASN A 1 160 ? 12.592 -19.158 60.708 1.00 64.95 ? 155 ASN B CG 1 ATOM 1222 O OD1 . ASN A 1 160 ? 12.354 -20.367 60.655 1.00 63.37 ? 155 ASN B OD1 1 ATOM 1223 N ND2 . ASN A 1 160 ? 12.510 -18.464 61.840 1.00 65.91 ? 155 ASN B ND2 1 ATOM 1224 N N . SER A 1 161 ? 13.694 -19.140 55.870 1.00 66.43 ? 156 SER B N 1 ATOM 1225 C CA . SER A 1 161 ? 14.034 -18.533 54.590 1.00 68.31 ? 156 SER B CA 1 ATOM 1226 C C . SER A 1 161 ? 15.189 -17.562 54.813 1.00 68.02 ? 156 SER B C 1 ATOM 1227 O O . SER A 1 161 ? 16.253 -17.974 55.254 1.00 65.02 ? 156 SER B O 1 ATOM 1228 C CB . SER A 1 161 ? 12.800 -17.967 53.889 1.00 73.15 ? 156 SER B CB 1 ATOM 1229 O OG . SER A 1 161 ? 11.859 -19.011 53.728 1.00 73.52 ? 156 SER B OG 1 ATOM 1230 N N . GLY A 1 162 ? 14.985 -16.289 54.535 1.00 71.81 ? 157 GLY B N 1 ATOM 1231 C CA . GLY A 1 162 ? 16.006 -15.255 54.814 1.00 72.20 ? 157 GLY B CA 1 ATOM 1232 C C . GLY A 1 162 ? 15.834 -14.546 56.158 1.00 73.05 ? 157 GLY B C 1 ATOM 1233 O O . GLY A 1 162 ? 16.593 -13.644 56.494 1.00 74.14 ? 157 GLY B O 1 ATOM 1234 N N . SER A 1 163 ? 14.843 -14.967 56.935 1.00 72.92 ? 158 SER B N 1 ATOM 1235 C CA . SER A 1 163 ? 14.328 -14.192 58.070 1.00 75.02 ? 158 SER B CA 1 ATOM 1236 C C . SER A 1 163 ? 15.364 -14.088 59.171 1.00 72.54 ? 158 SER B C 1 ATOM 1237 O O . SER A 1 163 ? 15.569 -13.011 59.729 1.00 75.28 ? 158 SER B O 1 ATOM 1238 C CB . SER A 1 163 ? 13.051 -14.831 58.647 1.00 75.31 ? 158 SER B CB 1 ATOM 1239 O OG . SER A 1 163 ? 12.279 -13.869 59.335 1.00 79.33 ? 158 SER B OG 1 ATOM 1240 N N . LEU A 1 164 ? 15.994 -15.221 59.479 1.00 67.83 ? 159 LEU B N 1 ATOM 1241 C CA . LEU A 1 164 ? 17.043 -15.306 60.490 1.00 65.37 ? 159 LEU B CA 1 ATOM 1242 C C . LEU A 1 164 ? 18.406 -15.201 59.825 1.00 63.86 ? 159 LEU B C 1 ATOM 1243 O O . LEU A 1 164 ? 18.896 -16.175 59.260 1.00 60.89 ? 159 LEU B O 1 ATOM 1244 C CB . LEU A 1 164 ? 16.949 -16.626 61.271 1.00 61.94 ? 159 LEU B CB 1 ATOM 1245 C CG . LEU A 1 164 ? 16.094 -16.623 62.535 1.00 62.83 ? 159 LEU B CG 1 ATOM 1246 C CD1 . LEU A 1 164 ? 16.028 -18.038 63.086 1.00 59.76 ? 159 LEU B CD1 1 ATOM 1247 C CD2 . LEU A 1 164 ? 16.642 -15.664 63.585 1.00 64.25 ? 159 LEU B CD2 1 ATOM 1248 N N . SER A 1 165 ? 19.000 -14.013 59.884 1.00 59.45 ? 160 SER B N 1 ATOM 1249 C CA . SER A 1 165 ? 20.351 -13.783 59.368 1.00 58.60 ? 160 SER B CA 1 ATOM 1250 C C . SER A 1 165 ? 21.364 -13.788 60.505 1.00 56.97 ? 160 SER B C 1 ATOM 1251 O O . SER A 1 165 ? 22.353 -14.508 60.471 1.00 54.59 ? 160 SER B O 1 ATOM 1252 C CB . SER A 1 165 ? 20.411 -12.439 58.648 1.00 62.07 ? 160 SER B CB 1 ATOM 1253 O OG . SER A 1 165 ? 19.273 -12.280 57.829 1.00 64.30 ? 160 SER B OG 1 ATOM 1254 N N . SER A 1 166 ? 21.090 -12.983 61.522 1.00 58.63 ? 161 SER B N 1 ATOM 1255 C CA . SER A 1 166 ? 21.989 -12.821 62.662 1.00 58.07 ? 161 SER B CA 1 ATOM 1256 C C . SER A 1 166 ? 22.133 -14.101 63.483 1.00 55.15 ? 161 SER B C 1 ATOM 1257 O O . SER A 1 166 ? 21.243 -14.950 63.494 1.00 53.89 ? 161 SER B O 1 ATOM 1258 C CB . SER A 1 166 ? 21.467 -11.699 63.567 1.00 60.87 ? 161 SER B CB 1 ATOM 1259 O OG . SER A 1 166 ? 21.415 -10.463 62.878 1.00 64.03 ? 161 SER B OG 1 ATOM 1260 N N . GLY A 1 167 ? 23.272 -14.226 64.155 1.00 54.51 ? 162 GLY B N 1 ATOM 1261 C CA . GLY A 1 167 ? 23.550 -15.367 65.013 1.00 52.71 ? 162 GLY B CA 1 ATOM 1262 C C . GLY A 1 167 ? 23.636 -16.706 64.298 1.00 50.28 ? 162 GLY B C 1 ATOM 1263 O O . GLY A 1 167 ? 23.416 -17.752 64.914 1.00 49.23 ? 162 GLY B O 1 ATOM 1264 N N . VAL A 1 168 ? 23.971 -16.687 63.010 1.00 49.88 ? 163 VAL B N 1 ATOM 1265 C CA . VAL A 1 168 ? 24.111 -17.920 62.229 1.00 47.90 ? 163 VAL B CA 1 ATOM 1266 C C . VAL A 1 168 ? 25.585 -18.226 61.958 1.00 47.39 ? 163 VAL B C 1 ATOM 1267 O O . VAL A 1 168 ? 26.376 -17.322 61.695 1.00 48.77 ? 163 VAL B O 1 ATOM 1268 C CB . VAL A 1 168 ? 23.369 -17.829 60.877 1.00 48.03 ? 163 VAL B CB 1 ATOM 1269 C CG1 . VAL A 1 168 ? 23.663 -19.047 60.007 1.00 46.20 ? 163 VAL B CG1 1 ATOM 1270 C CG2 . VAL A 1 168 ? 21.873 -17.688 61.094 1.00 48.99 ? 163 VAL B CG2 1 ATOM 1271 N N . HIS A 1 169 ? 25.936 -19.509 62.031 1.00 46.01 ? 164 HIS B N 1 ATOM 1272 C CA . HIS A 1 169 ? 27.226 -20.011 61.571 1.00 45.60 ? 164 HIS B CA 1 ATOM 1273 C C . HIS A 1 169 ? 26.966 -21.268 60.761 1.00 44.24 ? 164 HIS B C 1 ATOM 1274 O O . HIS A 1 169 ? 26.414 -22.242 61.283 1.00 43.71 ? 164 HIS B O 1 ATOM 1275 C CB . HIS A 1 169 ? 28.139 -20.371 62.746 1.00 45.95 ? 164 HIS B CB 1 ATOM 1276 C CG . HIS A 1 169 ? 28.356 -19.252 63.712 1.00 47.76 ? 164 HIS B CG 1 ATOM 1277 N ND1 . HIS A 1 169 ? 29.076 -18.121 63.393 1.00 49.46 ? 164 HIS B ND1 1 ATOM 1278 C CD2 . HIS A 1 169 ? 27.970 -19.100 64.998 1.00 48.70 ? 164 HIS B CD2 1 ATOM 1279 C CE1 . HIS A 1 169 ? 29.113 -17.313 64.434 1.00 51.32 ? 164 HIS B CE1 1 ATOM 1280 N NE2 . HIS A 1 169 ? 28.451 -17.885 65.424 1.00 50.91 ? 164 HIS B NE2 1 ATOM 1281 N N . THR A 1 170 ? 27.328 -21.244 59.486 1.00 44.20 ? 165 THR B N 1 ATOM 1282 C CA . THR A 1 170 ? 27.302 -22.448 58.682 1.00 43.16 ? 165 THR B CA 1 ATOM 1283 C C . THR A 1 170 ? 28.737 -22.845 58.447 1.00 42.94 ? 165 THR B C 1 ATOM 1284 O O . THR A 1 170 ? 29.505 -22.071 57.907 1.00 43.87 ? 165 THR B O 1 ATOM 1285 C CB . THR A 1 170 ? 26.598 -22.223 57.341 1.00 43.51 ? 165 THR B CB 1 ATOM 1286 O OG1 . THR A 1 170 ? 25.285 -21.699 57.569 1.00 44.22 ? 165 THR B OG1 1 ATOM 1287 C CG2 . THR A 1 170 ? 26.506 -23.548 56.564 1.00 42.75 ? 165 THR B CG2 1 ATOM 1288 N N . PHE A 1 171 ? 29.094 -24.056 58.848 1.00 42.14 ? 166 PHE B N 1 ATOM 1289 C CA . PHE A 1 171 ? 30.490 -24.468 58.835 1.00 42.40 ? 166 PHE B CA 1 ATOM 1290 C C . PHE A 1 171 ? 30.866 -25.080 57.497 1.00 41.88 ? 166 PHE B C 1 ATOM 1291 O O . PHE A 1 171 ? 30.006 -25.617 56.821 1.00 41.60 ? 166 PHE B O 1 ATOM 1292 C CB . PHE A 1 171 ? 30.747 -25.442 59.983 1.00 42.55 ? 166 PHE B CB 1 ATOM 1293 C CG . PHE A 1 171 ? 30.526 -24.819 61.329 1.00 43.24 ? 166 PHE B CG 1 ATOM 1294 C CD1 . PHE A 1 171 ? 31.517 -24.061 61.935 1.00 44.91 ? 166 PHE B CD1 1 ATOM 1295 C CD2 . PHE A 1 171 ? 29.313 -24.940 61.962 1.00 42.93 ? 166 PHE B CD2 1 ATOM 1296 C CE1 . PHE A 1 171 ? 31.303 -23.465 63.170 1.00 45.72 ? 166 PHE B CE1 1 ATOM 1297 C CE2 . PHE A 1 171 ? 29.090 -24.348 63.192 1.00 43.75 ? 166 PHE B CE2 1 ATOM 1298 C CZ . PHE A 1 171 ? 30.083 -23.606 63.793 1.00 45.15 ? 166 PHE B CZ 1 ATOM 1299 N N . PRO A 1 172 ? 32.146 -24.989 57.099 1.00 42.50 ? 167 PRO B N 1 ATOM 1300 C CA . PRO A 1 172 ? 32.577 -25.648 55.861 1.00 42.32 ? 167 PRO B CA 1 ATOM 1301 C C . PRO A 1 172 ? 32.391 -27.161 55.887 1.00 41.79 ? 167 PRO B C 1 ATOM 1302 O O . PRO A 1 172 ? 32.589 -27.793 56.934 1.00 42.01 ? 167 PRO B O 1 ATOM 1303 C CB . PRO A 1 172 ? 34.070 -25.323 55.786 1.00 43.79 ? 167 PRO B CB 1 ATOM 1304 C CG . PRO A 1 172 ? 34.233 -24.072 56.570 1.00 44.84 ? 167 PRO B CG 1 ATOM 1305 C CD . PRO A 1 172 ? 33.211 -24.146 57.674 1.00 43.98 ? 167 PRO B CD 1 ATOM 1306 N N . ALA A 1 173 ? 32.032 -27.726 54.737 1.00 41.35 ? 168 ALA B N 1 ATOM 1307 C CA . ALA A 1 173 ? 31.843 -29.159 54.595 1.00 41.36 ? 168 ALA B CA 1 ATOM 1308 C C . ALA A 1 173 ? 33.136 -29.914 54.849 1.00 42.68 ? 168 ALA B C 1 ATOM 1309 O O . ALA A 1 173 ? 34.217 -29.360 54.730 1.00 43.85 ? 168 ALA B O 1 ATOM 1310 C CB . ALA A 1 173 ? 31.301 -29.475 53.202 1.00 41.29 ? 168 ALA B CB 1 ATOM 1311 N N . VAL A 1 174 ? 33.020 -31.175 55.234 1.00 43.55 ? 169 VAL B N 1 ATOM 1312 C CA . VAL A 1 174 ? 34.168 -32.080 55.279 1.00 45.69 ? 169 VAL B CA 1 ATOM 1313 C C . VAL A 1 174 ? 33.792 -33.434 54.699 1.00 46.54 ? 169 VAL B C 1 ATOM 1314 O O . VAL A 1 174 ? 32.642 -33.856 54.820 1.00 46.17 ? 169 VAL B O 1 ATOM 1315 C CB . VAL A 1 174 ? 34.697 -32.291 56.709 1.00 47.03 ? 169 VAL B CB 1 ATOM 1316 C CG1 . VAL A 1 174 ? 35.082 -30.960 57.337 1.00 47.09 ? 169 VAL B CG1 1 ATOM 1317 C CG2 . VAL A 1 174 ? 33.666 -32.996 57.575 1.00 46.95 ? 169 VAL B CG2 1 ATOM 1318 N N . LEU A 1 175 ? 34.714 -34.116 54.055 1.00 48.40 ? 170 LEU B N 1 ATOM 1319 C CA . LEU A 1 175 ? 34.382 -35.399 53.497 1.00 49.88 ? 170 LEU B CA 1 ATOM 1320 C C . LEU A 1 175 ? 34.275 -36.460 54.568 1.00 51.66 ? 170 LEU B C 1 ATOM 1321 O O . LEU A 1 175 ? 35.089 -36.520 55.458 1.00 52.86 ? 170 LEU B O 1 ATOM 1322 C CB . LEU A 1 175 ? 35.404 -35.798 52.453 1.00 51.66 ? 170 LEU B CB 1 ATOM 1323 C CG . LEU A 1 175 ? 34.900 -36.543 51.227 1.00 51.96 ? 170 LEU B CG 1 ATOM 1324 C CD1 . LEU A 1 175 ? 33.725 -35.864 50.556 1.00 50.05 ? 170 LEU B CD1 1 ATOM 1325 C CD2 . LEU A 1 175 ? 36.052 -36.669 50.273 1.00 53.30 ? 170 LEU B CD2 1 ATOM 1326 N N . GLN A 1 176 ? 33.248 -37.288 54.482 1.00 52.44 ? 171 GLN B N 1 ATOM 1327 C CA . GLN A 1 176 ? 33.107 -38.411 55.380 1.00 54.70 ? 171 GLN B CA 1 ATOM 1328 C C . GLN A 1 176 ? 32.901 -39.641 54.544 1.00 56.25 ? 171 GLN B C 1 ATOM 1329 O O . GLN A 1 176 ? 31.836 -39.863 54.005 1.00 55.64 ? 171 GLN B O 1 ATOM 1330 C CB . GLN A 1 176 ? 31.893 -38.198 56.273 1.00 54.11 ? 171 GLN B CB 1 ATOM 1331 C CG . GLN A 1 176 ? 31.746 -39.234 57.354 1.00 56.61 ? 171 GLN B CG 1 ATOM 1332 C CD . GLN A 1 176 ? 30.773 -38.792 58.404 1.00 56.25 ? 171 GLN B CD 1 ATOM 1333 O OE1 . GLN A 1 176 ? 29.899 -37.982 58.140 1.00 54.61 ? 171 GLN B OE1 1 ATOM 1334 N NE2 . GLN A 1 176 ? 30.918 -39.322 59.602 1.00 58.36 ? 171 GLN B NE2 1 ATOM 1335 N N . SER A 1 177 ? 33.924 -40.469 54.440 1.00 58.50 ? 172 SER B N 1 ATOM 1336 C CA . SER A 1 177 ? 33.980 -41.452 53.376 1.00 60.13 ? 172 SER B CA 1 ATOM 1337 C C . SER A 1 177 ? 33.884 -40.656 52.077 1.00 57.64 ? 172 SER B C 1 ATOM 1338 O O . SER A 1 177 ? 34.484 -39.613 51.965 1.00 56.20 ? 172 SER B O 1 ATOM 1339 C CB . SER A 1 177 ? 32.842 -42.467 53.496 1.00 61.67 ? 172 SER B CB 1 ATOM 1340 O OG . SER A 1 177 ? 33.302 -43.795 53.315 1.00 65.28 ? 172 SER B OG 1 ATOM 1341 N N . ASP A 1 178 ? 33.045 -41.076 51.157 1.00 57.49 ? 173 ASP B N 1 ATOM 1342 C CA . ASP A 1 178 ? 32.977 -40.431 49.868 1.00 55.62 ? 173 ASP B CA 1 ATOM 1343 C C . ASP A 1 178 ? 31.977 -39.297 49.857 1.00 52.61 ? 173 ASP B C 1 ATOM 1344 O O . ASP A 1 178 ? 31.705 -38.737 48.826 1.00 51.70 ? 173 ASP B O 1 ATOM 1345 C CB . ASP A 1 178 ? 32.682 -41.458 48.761 1.00 57.78 ? 173 ASP B CB 1 ATOM 1346 C CG . ASP A 1 178 ? 31.254 -41.978 48.792 1.00 58.57 ? 173 ASP B CG 1 ATOM 1347 O OD1 . ASP A 1 178 ? 30.795 -42.400 49.864 1.00 59.03 ? 173 ASP B OD1 1 ATOM 1348 O OD2 . ASP A 1 178 ? 30.594 -41.968 47.745 1.00 59.07 ? 173 ASP B OD2 1 ATOM 1349 N N . LEU A 1 179 ? 31.404 -38.973 51.003 1.00 51.08 ? 174 LEU B N 1 ATOM 1350 C CA . LEU A 1 179 ? 30.327 -38.005 51.034 1.00 48.95 ? 174 LEU B CA 1 ATOM 1351 C C . LEU A 1 179 ? 30.578 -36.833 51.960 1.00 47.05 ? 174 LEU B C 1 ATOM 1352 O O . LEU A 1 179 ? 31.336 -36.949 52.894 1.00 47.55 ? 174 LEU B O 1 ATOM 1353 C CB . LEU A 1 179 ? 29.032 -38.695 51.407 1.00 49.64 ? 174 LEU B CB 1 ATOM 1354 C CG . LEU A 1 179 ? 28.416 -39.668 50.425 1.00 51.95 ? 174 LEU B CG 1 ATOM 1355 C CD1 . LEU A 1 179 ? 27.192 -40.306 51.043 1.00 53.09 ? 174 LEU B CD1 1 ATOM 1356 C CD2 . LEU A 1 179 ? 28.026 -38.953 49.153 1.00 51.93 ? 174 LEU B CD2 1 ATOM 1357 N N . TYR A 1 180 ? 29.947 -35.702 51.678 1.00 45.29 ? 175 TYR B N 1 ATOM 1358 C CA . TYR A 1 180 ? 30.153 -34.483 52.450 1.00 43.82 ? 175 TYR B CA 1 ATOM 1359 C C . TYR A 1 180 ? 29.163 -34.377 53.596 1.00 43.31 ? 175 TYR B C 1 ATOM 1360 O O . TYR A 1 180 ? 28.083 -34.967 53.583 1.00 44.19 ? 175 TYR B O 1 ATOM 1361 C CB . TYR A 1 180 ? 30.054 -33.241 51.558 1.00 42.94 ? 175 TYR B CB 1 ATOM 1362 C CG . TYR A 1 180 ? 31.220 -33.088 50.608 1.00 43.62 ? 175 TYR B CG 1 ATOM 1363 C CD1 . TYR A 1 180 ? 32.438 -32.565 51.045 1.00 43.70 ? 175 TYR B CD1 1 ATOM 1364 C CD2 . TYR A 1 180 ? 31.114 -33.472 49.279 1.00 44.33 ? 175 TYR B CD2 1 ATOM 1365 C CE1 . TYR A 1 180 ? 33.510 -32.431 50.183 1.00 44.62 ? 175 TYR B CE1 1 ATOM 1366 C CE2 . TYR A 1 180 ? 32.182 -33.345 48.418 1.00 45.25 ? 175 TYR B CE2 1 ATOM 1367 C CZ . TYR A 1 180 ? 33.376 -32.822 48.872 1.00 45.34 ? 175 TYR B CZ 1 ATOM 1368 O OH . TYR A 1 180 ? 34.450 -32.692 48.019 1.00 46.61 ? 175 TYR B OH 1 ATOM 1369 N N . THR A 1 181 ? 29.562 -33.622 54.599 1.00 42.61 ? 176 THR B N 1 ATOM 1370 C CA . THR A 1 181 ? 28.716 -33.332 55.743 1.00 42.21 ? 176 THR B CA 1 ATOM 1371 C C . THR A 1 181 ? 29.024 -31.933 56.207 1.00 41.08 ? 176 THR B C 1 ATOM 1372 O O . THR A 1 181 ? 30.190 -31.547 56.286 1.00 41.05 ? 176 THR B O 1 ATOM 1373 C CB . THR A 1 181 ? 29.035 -34.249 56.934 1.00 43.41 ? 176 THR B CB 1 ATOM 1374 O OG1 . THR A 1 181 ? 28.887 -35.611 56.527 1.00 45.01 ? 176 THR B OG1 1 ATOM 1375 C CG2 . THR A 1 181 ? 28.104 -33.953 58.108 1.00 43.34 ? 176 THR B CG2 1 ATOM 1376 N N . LEU A 1 182 ? 27.987 -31.176 56.514 1.00 40.29 ? 177 LEU B N 1 ATOM 1377 C CA . LEU A 1 182 ? 28.185 -29.969 57.291 1.00 39.77 ? 177 LEU B CA 1 ATOM 1378 C C . LEU A 1 182 ? 27.039 -29.765 58.241 1.00 39.62 ? 177 LEU B C 1 ATOM 1379 O O . LEU A 1 182 ? 26.041 -30.494 58.188 1.00 39.47 ? 177 LEU B O 1 ATOM 1380 C CB . LEU A 1 182 ? 28.342 -28.755 56.386 1.00 39.49 ? 177 LEU B CB 1 ATOM 1381 C CG . LEU A 1 182 ? 27.201 -28.287 55.485 1.00 39.42 ? 177 LEU B CG 1 ATOM 1382 C CD1 . LEU A 1 182 ? 26.070 -27.654 56.278 1.00 39.59 ? 177 LEU B CD1 1 ATOM 1383 C CD2 . LEU A 1 182 ? 27.767 -27.272 54.503 1.00 39.77 ? 177 LEU B CD2 1 ATOM 1384 N N . SER A 1 183 ? 27.193 -28.757 59.097 1.00 39.56 ? 178 SER B N 1 ATOM 1385 C CA . SER A 1 183 ? 26.133 -28.357 59.995 1.00 39.80 ? 178 SER B CA 1 ATOM 1386 C C . SER A 1 183 ? 26.081 -26.847 60.064 1.00 39.53 ? 178 SER B C 1 ATOM 1387 O O . SER A 1 183 ? 27.036 -26.169 59.724 1.00 39.74 ? 178 SER B O 1 ATOM 1388 C CB . SER A 1 183 ? 26.356 -28.941 61.387 1.00 40.73 ? 178 SER B CB 1 ATOM 1389 O OG . SER A 1 183 ? 27.675 -28.662 61.821 1.00 41.86 ? 178 SER B OG 1 ATOM 1390 N N . SER A 1 184 ? 24.959 -26.337 60.539 1.00 39.72 ? 179 SER B N 1 ATOM 1391 C CA . SER A 1 184 ? 24.729 -24.920 60.654 1.00 40.15 ? 179 SER B CA 1 ATOM 1392 C C . SER A 1 184 ? 24.133 -24.703 62.013 1.00 40.85 ? 179 SER B C 1 ATOM 1393 O O . SER A 1 184 ? 23.304 -25.503 62.452 1.00 41.01 ? 179 SER B O 1 ATOM 1394 C CB . SER A 1 184 ? 23.743 -24.458 59.588 1.00 40.55 ? 179 SER B CB 1 ATOM 1395 O OG . SER A 1 184 ? 23.534 -23.060 59.685 1.00 41.63 ? 179 SER B OG 1 ATOM 1396 N N . SER A 1 185 ? 24.547 -23.640 62.688 1.00 41.58 ? 180 SER B N 1 ATOM 1397 C CA . SER A 1 185 ? 24.001 -23.331 63.991 1.00 42.55 ? 180 SER B CA 1 ATOM 1398 C C . SER A 1 185 ? 23.318 -21.993 63.919 1.00 43.85 ? 180 SER B C 1 ATOM 1399 O O . SER A 1 185 ? 23.683 -21.139 63.107 1.00 44.18 ? 180 SER B O 1 ATOM 1400 C CB . SER A 1 185 ? 25.087 -23.326 65.068 1.00 43.13 ? 180 SER B CB 1 ATOM 1401 O OG . SER A 1 185 ? 25.756 -22.088 65.144 1.00 43.93 ? 180 SER B OG 1 ATOM 1402 N N . VAL A 1 186 ? 22.302 -21.824 64.756 1.00 45.11 ? 181 VAL B N 1 ATOM 1403 C CA . VAL A 1 186 ? 21.630 -20.545 64.882 1.00 46.82 ? 181 VAL B CA 1 ATOM 1404 C C . VAL A 1 186 ? 21.285 -20.336 66.346 1.00 47.94 ? 181 VAL B C 1 ATOM 1405 O O . VAL A 1 186 ? 20.885 -21.264 67.044 1.00 47.61 ? 181 VAL B O 1 ATOM 1406 C CB . VAL A 1 186 ? 20.379 -20.446 63.980 1.00 47.62 ? 181 VAL B CB 1 ATOM 1407 C CG1 . VAL A 1 186 ? 19.341 -21.505 64.345 1.00 47.79 ? 181 VAL B CG1 1 ATOM 1408 C CG2 . VAL A 1 186 ? 19.772 -19.047 64.053 1.00 49.71 ? 181 VAL B CG2 1 ATOM 1409 N N . THR A 1 187 ? 21.475 -19.110 66.808 1.00 49.49 ? 182 THR B N 1 ATOM 1410 C CA . THR A 1 187 ? 21.259 -18.786 68.204 1.00 50.93 ? 182 THR B CA 1 ATOM 1411 C C . THR A 1 187 ? 20.205 -17.706 68.305 1.00 53.11 ? 182 THR B C 1 ATOM 1412 O O . THR A 1 187 ? 20.377 -16.628 67.724 1.00 54.29 ? 182 THR B O 1 ATOM 1413 C CB . THR A 1 187 ? 22.545 -18.303 68.867 1.00 51.49 ? 182 THR B CB 1 ATOM 1414 O OG1 . THR A 1 187 ? 23.508 -19.361 68.821 1.00 49.93 ? 182 THR B OG1 1 ATOM 1415 C CG2 . THR A 1 187 ? 22.291 -17.919 70.327 1.00 53.43 ? 182 THR B CG2 1 ATOM 1416 N N . VAL A 1 188 ? 19.138 -18.008 69.053 1.00 54.06 ? 183 VAL B N 1 ATOM 1417 C CA . VAL A 1 188 ? 18.012 -17.108 69.221 1.00 56.44 ? 183 VAL B CA 1 ATOM 1418 C C . VAL A 1 188 ? 17.743 -16.899 70.707 1.00 58.24 ? 183 VAL B C 1 ATOM 1419 O O . VAL A 1 188 ? 18.307 -17.620 71.543 1.00 57.47 ? 183 VAL B O 1 ATOM 1420 C CB . VAL A 1 188 ? 16.731 -17.650 68.534 1.00 56.59 ? 183 VAL B CB 1 ATOM 1421 C CG1 . VAL A 1 188 ? 16.891 -17.647 67.025 1.00 55.57 ? 183 VAL B CG1 1 ATOM 1422 C CG2 . VAL A 1 188 ? 16.370 -19.046 69.038 1.00 55.66 ? 183 VAL B CG2 1 ATOM 1423 N N . PRO A 1 189 ? 16.898 -15.898 71.040 1.00 60.95 ? 184 PRO B N 1 ATOM 1424 C CA . PRO A 1 189 ? 16.449 -15.720 72.419 1.00 62.94 ? 184 PRO B CA 1 ATOM 1425 C C . PRO A 1 189 ? 15.593 -16.892 72.885 1.00 62.86 ? 184 PRO B C 1 ATOM 1426 O O . PRO A 1 189 ? 14.684 -17.317 72.179 1.00 62.55 ? 184 PRO B O 1 ATOM 1427 C CB . PRO A 1 189 ? 15.639 -14.418 72.369 1.00 65.81 ? 184 PRO B CB 1 ATOM 1428 C CG . PRO A 1 189 ? 16.135 -13.701 71.163 1.00 65.57 ? 184 PRO B CG 1 ATOM 1429 C CD . PRO A 1 189 ? 16.476 -14.777 70.179 1.00 62.54 ? 184 PRO B CD 1 ATOM 1430 N N . SER A 1 190 ? 15.916 -17.414 74.065 1.00 63.52 ? 185 SER B N 1 ATOM 1431 C CA . SER A 1 190 ? 15.214 -18.553 74.665 1.00 64.04 ? 185 SER B CA 1 ATOM 1432 C C . SER A 1 190 ? 13.698 -18.353 74.717 1.00 66.12 ? 185 SER B C 1 ATOM 1433 O O . SER A 1 190 ? 12.934 -19.289 74.481 1.00 65.87 ? 185 SER B O 1 ATOM 1434 C CB . SER A 1 190 ? 15.748 -18.797 76.081 1.00 65.48 ? 185 SER B CB 1 ATOM 1435 O OG . SER A 1 190 ? 15.534 -20.128 76.517 1.00 65.60 ? 185 SER B OG 1 ATOM 1436 N N . SER A 1 191 ? 13.269 -17.128 75.015 1.00 68.50 ? 186 SER B N 1 ATOM 1437 C CA . SER A 1 191 ? 11.841 -16.817 75.096 1.00 71.22 ? 186 SER B CA 1 ATOM 1438 C C . SER A 1 191 ? 11.107 -17.204 73.803 1.00 70.68 ? 186 SER B C 1 ATOM 1439 O O . SER A 1 191 ? 9.982 -17.680 73.837 1.00 72.40 ? 186 SER B O 1 ATOM 1440 C CB . SER A 1 191 ? 11.646 -15.329 75.424 1.00 73.89 ? 186 SER B CB 1 ATOM 1441 O OG . SER A 1 191 ? 12.269 -14.526 74.425 1.00 73.09 ? 186 SER B OG 1 ATOM 1442 N N . THR A 1 192 ? 11.784 -17.065 72.675 1.00 68.77 ? 187 THR B N 1 ATOM 1443 C CA . THR A 1 192 ? 11.149 -17.132 71.365 1.00 68.97 ? 187 THR B CA 1 ATOM 1444 C C . THR A 1 192 ? 11.231 -18.520 70.680 1.00 66.81 ? 187 THR B C 1 ATOM 1445 O O . THR A 1 192 ? 10.785 -18.682 69.547 1.00 67.01 ? 187 THR B O 1 ATOM 1446 C CB . THR A 1 192 ? 11.748 -16.043 70.452 1.00 68.87 ? 187 THR B CB 1 ATOM 1447 O OG1 . THR A 1 192 ? 10.749 -15.554 69.547 1.00 71.35 ? 187 THR B OG1 1 ATOM 1448 C CG2 . THR A 1 192 ? 12.972 -16.541 69.679 1.00 65.42 ? 187 THR B CG2 1 ATOM 1449 N N . TRP A 1 193 ? 11.839 -19.499 71.345 1.00 65.14 ? 188 TRP B N 1 ATOM 1450 C CA . TRP A 1 193 ? 11.763 -20.890 70.919 1.00 63.63 ? 188 TRP B CA 1 ATOM 1451 C C . TRP A 1 193 ? 11.438 -21.766 72.129 1.00 64.91 ? 188 TRP B C 1 ATOM 1452 O O . TRP A 1 193 ? 12.018 -21.577 73.194 1.00 65.43 ? 188 TRP B O 1 ATOM 1453 C CB . TRP A 1 193 ? 13.084 -21.327 70.290 1.00 60.32 ? 188 TRP B CB 1 ATOM 1454 C CG . TRP A 1 193 ? 13.032 -22.706 69.716 1.00 58.87 ? 188 TRP B CG 1 ATOM 1455 C CD1 . TRP A 1 193 ? 12.590 -23.062 68.477 1.00 58.51 ? 188 TRP B CD1 1 ATOM 1456 C CD2 . TRP A 1 193 ? 13.405 -23.921 70.374 1.00 58.19 ? 188 TRP B CD2 1 ATOM 1457 N NE1 . TRP A 1 193 ? 12.660 -24.421 68.322 1.00 57.74 ? 188 TRP B NE1 1 ATOM 1458 C CE2 . TRP A 1 193 ? 13.165 -24.974 69.468 1.00 57.59 ? 188 TRP B CE2 1 ATOM 1459 C CE3 . TRP A 1 193 ? 13.913 -24.223 71.644 1.00 58.52 ? 188 TRP B CE3 1 ATOM 1460 C CZ2 . TRP A 1 193 ? 13.425 -26.304 69.784 1.00 57.42 ? 188 TRP B CZ2 1 ATOM 1461 C CZ3 . TRP A 1 193 ? 14.173 -25.544 71.959 1.00 58.40 ? 188 TRP B CZ3 1 ATOM 1462 C CH2 . TRP A 1 193 ? 13.931 -26.571 71.030 1.00 57.94 ? 188 TRP B CH2 1 ATOM 1463 N N . PRO A 1 194 ? 10.529 -22.744 71.971 1.00 66.00 ? 189 PRO B N 1 ATOM 1464 C CA . PRO A 1 194 ? 9.835 -23.165 70.748 1.00 66.26 ? 189 PRO B CA 1 ATOM 1465 C C . PRO A 1 194 ? 8.575 -22.375 70.368 1.00 68.98 ? 189 PRO B C 1 ATOM 1466 O O . PRO A 1 194 ? 7.951 -22.714 69.367 1.00 69.64 ? 189 PRO B O 1 ATOM 1467 C CB . PRO A 1 194 ? 9.486 -24.628 71.037 1.00 66.80 ? 189 PRO B CB 1 ATOM 1468 C CG . PRO A 1 194 ? 9.306 -24.675 72.509 1.00 68.51 ? 189 PRO B CG 1 ATOM 1469 C CD . PRO A 1 194 ? 10.219 -23.636 73.104 1.00 67.38 ? 189 PRO B CD 1 ATOM 1470 N N . SER A 1 195 ? 8.233 -21.319 71.105 1.00 70.89 ? 190 SER B N 1 ATOM 1471 C CA . SER A 1 195 ? 6.983 -20.579 70.852 1.00 74.45 ? 190 SER B CA 1 ATOM 1472 C C . SER A 1 195 ? 6.896 -20.042 69.417 1.00 74.56 ? 190 SER B C 1 ATOM 1473 O O . SER A 1 195 ? 5.828 -20.098 68.800 1.00 77.32 ? 190 SER B O 1 ATOM 1474 C CB . SER A 1 195 ? 6.788 -19.453 71.878 1.00 76.46 ? 190 SER B CB 1 ATOM 1475 O OG . SER A 1 195 ? 7.990 -18.729 72.074 1.00 74.50 ? 190 SER B OG 1 ATOM 1476 N N . GLU A 1 196 ? 8.010 -19.524 68.894 1.00 72.10 ? 191 GLU B N 1 ATOM 1477 C CA . GLU A 1 196 ? 8.088 -19.090 67.491 1.00 72.09 ? 191 GLU B CA 1 ATOM 1478 C C . GLU A 1 196 ? 8.887 -20.158 66.728 1.00 68.98 ? 191 GLU B C 1 ATOM 1479 O O . GLU A 1 196 ? 9.871 -20.692 67.240 1.00 66.41 ? 191 GLU B O 1 ATOM 1480 C CB . GLU A 1 196 ? 8.736 -17.691 67.344 1.00 72.26 ? 191 GLU B CB 1 ATOM 1481 C CG . GLU A 1 196 ? 7.932 -16.443 67.820 1.00 76.18 ? 191 GLU B CG 1 ATOM 1482 C CD . GLU A 1 196 ? 7.173 -16.595 69.140 1.00 78.16 ? 191 GLU B CD 1 ATOM 1483 O OE1 . GLU A 1 196 ? 7.629 -16.062 70.174 1.00 78.16 ? 191 GLU B OE1 1 ATOM 1484 O OE2 . GLU A 1 196 ? 6.090 -17.213 69.145 1.00 80.13 ? 191 GLU B OE2 1 ATOM 1485 N N . THR A 1 197 ? 8.436 -20.482 65.519 1.00 69.74 ? 192 THR B N 1 ATOM 1486 C CA . THR A 1 197 ? 9.045 -21.519 64.671 1.00 67.25 ? 192 THR B CA 1 ATOM 1487 C C . THR A 1 197 ? 10.481 -21.212 64.234 1.00 63.92 ? 192 THR B C 1 ATOM 1488 O O . THR A 1 197 ? 10.824 -20.062 63.964 1.00 64.34 ? 192 THR B O 1 ATOM 1489 C CB . THR A 1 197 ? 8.159 -21.761 63.411 1.00 69.74 ? 192 THR B CB 1 ATOM 1490 O OG1 . THR A 1 197 ? 7.227 -22.816 63.671 1.00 71.55 ? 192 THR B OG1 1 ATOM 1491 C CG2 . THR A 1 197 ? 8.968 -22.138 62.181 1.00 67.89 ? 192 THR B CG2 1 ATOM 1492 N N . VAL A 1 198 ? 11.304 -22.260 64.170 1.00 60.93 ? 193 VAL B N 1 ATOM 1493 C CA . VAL A 1 198 ? 12.650 -22.173 63.615 1.00 57.98 ? 193 VAL B CA 1 ATOM 1494 C C . VAL A 1 198 ? 12.885 -23.352 62.657 1.00 56.63 ? 193 VAL B C 1 ATOM 1495 O O . VAL A 1 198 ? 12.846 -24.525 63.051 1.00 55.65 ? 193 VAL B O 1 ATOM 1496 C CB . VAL A 1 198 ? 13.722 -22.148 64.725 1.00 56.13 ? 193 VAL B CB 1 ATOM 1497 C CG1 . VAL A 1 198 ? 15.115 -22.323 64.135 1.00 53.56 ? 193 VAL B CG1 1 ATOM 1498 C CG2 . VAL A 1 198 ? 13.641 -20.852 65.527 1.00 57.36 ? 193 VAL B CG2 1 ATOM 1499 N N . THR A 1 199 ? 13.131 -23.017 61.395 1.00 56.53 ? 194 THR B N 1 ATOM 1500 C CA . THR A 1 199 ? 13.197 -24.001 60.329 1.00 56.16 ? 194 THR B CA 1 ATOM 1501 C C . THR A 1 199 ? 14.438 -23.753 59.487 1.00 54.22 ? 194 THR B C 1 ATOM 1502 O O . THR A 1 199 ? 14.626 -22.650 58.971 1.00 54.94 ? 194 THR B O 1 ATOM 1503 C CB . THR A 1 199 ? 11.964 -23.890 59.418 1.00 59.19 ? 194 THR B CB 1 ATOM 1504 O OG1 . THR A 1 199 ? 10.775 -23.890 60.218 1.00 61.72 ? 194 THR B OG1 1 ATOM 1505 C CG2 . THR A 1 199 ? 11.913 -25.036 58.411 1.00 59.25 ? 194 THR B CG2 1 ATOM 1506 N N . CYS A 1 200 ? 15.283 -24.771 59.343 1.00 52.30 ? 195 CYS B N 1 ATOM 1507 C CA . CYS A 1 200 ? 16.448 -24.635 58.470 1.00 51.11 ? 195 CYS B CA 1 ATOM 1508 C C . CYS A 1 200 ? 16.074 -25.085 57.059 1.00 51.64 ? 195 CYS B C 1 ATOM 1509 O O . CYS A 1 200 ? 15.448 -26.127 56.875 1.00 52.36 ? 195 CYS B O 1 ATOM 1510 C CB . CYS A 1 200 ? 17.666 -25.404 59.007 1.00 49.43 ? 195 CYS B CB 1 ATOM 1511 S SG . CYS A 1 200 ? 17.668 -27.170 58.646 1.00 50.14 ? 195 CYS B SG 1 ATOM 1512 N N . ASN A 1 201 ? 16.449 -24.271 56.076 1.00 51.66 ? 196 ASN B N 1 ATOM 1513 C CA . ASN A 1 201 ? 16.155 -24.526 54.671 1.00 52.67 ? 196 ASN B CA 1 ATOM 1514 C C . ASN A 1 201 ? 17.444 -24.958 53.998 1.00 50.52 ? 196 ASN B C 1 ATOM 1515 O O . ASN A 1 201 ? 18.424 -24.226 53.985 1.00 49.51 ? 196 ASN B O 1 ATOM 1516 C CB . ASN A 1 201 ? 15.613 -23.262 54.019 1.00 55.18 ? 196 ASN B CB 1 ATOM 1517 C CG . ASN A 1 201 ? 14.726 -22.475 54.958 1.00 56.80 ? 196 ASN B CG 1 ATOM 1518 O OD1 . ASN A 1 201 ? 15.099 -21.401 55.428 1.00 56.72 ? 196 ASN B OD1 1 ATOM 1519 N ND2 . ASN A 1 201 ? 13.573 -23.035 55.285 1.00 58.43 ? 196 ASN B ND2 1 ATOM 1520 N N . VAL A 1 202 ? 17.450 -26.163 53.459 1.00 50.05 ? 197 VAL B N 1 ATOM 1521 C CA . VAL A 1 202 ? 18.642 -26.709 52.837 1.00 48.37 ? 197 VAL B CA 1 ATOM 1522 C C . VAL A 1 202 ? 18.419 -26.906 51.335 1.00 49.90 ? 197 VAL B C 1 ATOM 1523 O O . VAL A 1 202 ? 17.445 -27.514 50.910 1.00 51.92 ? 197 VAL B O 1 ATOM 1524 C CB . VAL A 1 202 ? 19.043 -28.038 53.497 1.00 46.89 ? 197 VAL B CB 1 ATOM 1525 C CG1 . VAL A 1 202 ? 20.296 -28.600 52.848 1.00 45.64 ? 197 VAL B CG1 1 ATOM 1526 C CG2 . VAL A 1 202 ? 19.282 -27.827 54.988 1.00 45.71 ? 197 VAL B CG2 1 ATOM 1527 N N . ALA A 1 203 ? 19.330 -26.382 50.535 1.00 49.38 ? 198 ALA B N 1 ATOM 1528 C CA . ALA A 1 203 ? 19.264 -26.551 49.087 1.00 51.20 ? 198 ALA B CA 1 ATOM 1529 C C . ALA A 1 203 ? 20.517 -27.260 48.590 1.00 49.67 ? 198 ALA B C 1 ATOM 1530 O O . ALA A 1 203 ? 21.638 -26.937 49.007 1.00 47.86 ? 198 ALA B O 1 ATOM 1531 C CB . ALA A 1 203 ? 19.113 -25.206 48.392 1.00 53.07 ? 198 ALA B CB 1 ATOM 1532 N N . HIS A 1 204 ? 20.309 -28.227 47.703 1.00 50.72 ? 199 HIS B N 1 ATOM 1533 C CA . HIS A 1 204 ? 21.390 -28.935 47.043 1.00 50.01 ? 199 HIS B CA 1 ATOM 1534 C C . HIS A 1 204 ? 21.108 -28.973 45.538 1.00 52.60 ? 199 HIS B C 1 ATOM 1535 O O . HIS A 1 204 ? 20.563 -29.957 45.019 1.00 54.04 ? 199 HIS B O 1 ATOM 1536 C CB . HIS A 1 204 ? 21.521 -30.340 47.621 1.00 49.00 ? 199 HIS B CB 1 ATOM 1537 C CG . HIS A 1 204 ? 22.713 -31.083 47.117 1.00 48.36 ? 199 HIS B CG 1 ATOM 1538 N ND1 . HIS A 1 204 ? 22.614 -32.288 46.460 1.00 49.62 ? 199 HIS B ND1 1 ATOM 1539 C CD2 . HIS A 1 204 ? 24.034 -30.789 47.171 1.00 46.95 ? 199 HIS B CD2 1 ATOM 1540 C CE1 . HIS A 1 204 ? 23.822 -32.710 46.136 1.00 49.02 ? 199 HIS B CE1 1 ATOM 1541 N NE2 . HIS A 1 204 ? 24.703 -31.817 46.552 1.00 47.43 ? 199 HIS B NE2 1 ATOM 1542 N N . PRO A 1 205 ? 21.463 -27.882 44.837 1.00 53.63 ? 200 PRO B N 1 ATOM 1543 C CA . PRO A 1 205 ? 21.127 -27.697 43.418 1.00 56.88 ? 200 PRO B CA 1 ATOM 1544 C C . PRO A 1 205 ? 21.520 -28.866 42.517 1.00 57.66 ? 200 PRO B C 1 ATOM 1545 O O . PRO A 1 205 ? 20.809 -29.169 41.562 1.00 60.59 ? 200 PRO B O 1 ATOM 1546 C CB . PRO A 1 205 ? 21.916 -26.449 43.025 1.00 57.12 ? 200 PRO B CB 1 ATOM 1547 C CG . PRO A 1 205 ? 22.095 -25.703 44.295 1.00 55.11 ? 200 PRO B CG 1 ATOM 1548 C CD . PRO A 1 205 ? 22.220 -26.738 45.376 1.00 52.34 ? 200 PRO B CD 1 ATOM 1549 N N . ALA A 1 206 ? 22.634 -29.515 42.831 1.00 55.49 ? 201 ALA B N 1 ATOM 1550 C CA . ALA A 1 206 ? 23.131 -30.628 42.021 1.00 56.39 ? 201 ALA B CA 1 ATOM 1551 C C . ALA A 1 206 ? 22.130 -31.772 41.924 1.00 58.17 ? 201 ALA B C 1 ATOM 1552 O O . ALA A 1 206 ? 21.956 -32.358 40.842 1.00 61.01 ? 201 ALA B O 1 ATOM 1553 C CB . ALA A 1 206 ? 24.453 -31.142 42.568 1.00 53.92 ? 201 ALA B CB 1 ATOM 1554 N N . SER A 1 207 ? 21.486 -32.102 43.044 1.00 57.05 ? 202 SER B N 1 ATOM 1555 C CA . SER A 1 207 ? 20.438 -33.135 43.054 1.00 59.16 ? 202 SER B CA 1 ATOM 1556 C C . SER A 1 207 ? 19.015 -32.557 42.939 1.00 61.92 ? 202 SER B C 1 ATOM 1557 O O . SER A 1 207 ? 18.038 -33.302 42.998 1.00 63.80 ? 202 SER B O 1 ATOM 1558 C CB . SER A 1 207 ? 20.552 -34.007 44.313 1.00 57.23 ? 202 SER B CB 1 ATOM 1559 O OG . SER A 1 207 ? 20.348 -33.259 45.499 1.00 55.22 ? 202 SER B OG 1 ATOM 1560 N N . SER A 1 208 ? 18.918 -31.235 42.765 1.00 62.62 ? 203 SER B N 1 ATOM 1561 C CA . SER A 1 208 ? 17.645 -30.503 42.737 1.00 65.28 ? 203 SER B CA 1 ATOM 1562 C C . SER A 1 208 ? 16.821 -30.740 43.996 1.00 64.76 ? 203 SER B C 1 ATOM 1563 O O . SER A 1 208 ? 15.624 -30.964 43.917 1.00 67.73 ? 203 SER B O 1 ATOM 1564 C CB . SER A 1 208 ? 16.850 -30.865 41.492 1.00 69.58 ? 203 SER B CB 1 ATOM 1565 O OG . SER A 1 208 ? 17.666 -30.715 40.351 1.00 70.40 ? 203 SER B OG 1 ATOM 1566 N N . THR A 1 209 ? 17.480 -30.676 45.151 1.00 61.72 ? 204 THR B N 1 ATOM 1567 C CA . THR A 1 209 ? 16.850 -30.936 46.439 1.00 61.12 ? 204 THR B CA 1 ATOM 1568 C C . THR A 1 209 ? 16.664 -29.639 47.209 1.00 60.16 ? 204 THR B C 1 ATOM 1569 O O . THR A 1 209 ? 17.602 -28.837 47.303 1.00 58.22 ? 204 THR B O 1 ATOM 1570 C CB . THR A 1 209 ? 17.732 -31.865 47.289 1.00 58.63 ? 204 THR B CB 1 ATOM 1571 O OG1 . THR A 1 209 ? 17.819 -33.133 46.630 1.00 60.22 ? 204 THR B OG1 1 ATOM 1572 C CG2 . THR A 1 209 ? 17.144 -32.070 48.687 1.00 57.99 ? 204 THR B CG2 1 ATOM 1573 N N . LYS A 1 210 ? 15.460 -29.459 47.761 1.00 61.71 ? 205 LYS B N 1 ATOM 1574 C CA . LYS A 1 210 ? 15.169 -28.403 48.735 1.00 60.80 ? 205 LYS B CA 1 ATOM 1575 C C . LYS A 1 210 ? 14.438 -29.090 49.880 1.00 60.48 ? 205 LYS B C 1 ATOM 1576 O O . LYS A 1 210 ? 13.399 -29.721 49.655 1.00 62.87 ? 205 LYS B O 1 ATOM 1577 C CB . LYS A 1 210 ? 14.288 -27.284 48.157 1.00 64.14 ? 205 LYS B CB 1 ATOM 1578 C CG . LYS A 1 210 ? 14.360 -27.077 46.645 1.00 66.93 ? 205 LYS B CG 1 ATOM 1579 C CD . LYS A 1 210 ? 15.618 -26.393 46.101 1.00 65.40 ? 205 LYS B CD 1 ATOM 1580 C CE . LYS A 1 210 ? 15.556 -24.885 46.291 1.00 66.31 ? 205 LYS B CE 1 ATOM 1581 N NZ . LYS A 1 210 ? 14.434 -24.252 45.537 1.00 71.02 ? 205 LYS B NZ 1 ATOM 1582 N N . VAL A 1 211 ? 14.983 -28.986 51.094 1.00 57.64 ? 206 VAL B N 1 ATOM 1583 C CA . VAL A 1 211 ? 14.335 -29.555 52.277 1.00 57.59 ? 206 VAL B CA 1 ATOM 1584 C C . VAL A 1 211 ? 14.254 -28.492 53.347 1.00 56.53 ? 206 VAL B C 1 ATOM 1585 O O . VAL A 1 211 ? 15.222 -27.768 53.584 1.00 54.23 ? 206 VAL B O 1 ATOM 1586 C CB . VAL A 1 211 ? 15.099 -30.779 52.834 1.00 55.83 ? 206 VAL B CB 1 ATOM 1587 C CG1 . VAL A 1 211 ? 14.537 -31.202 54.194 1.00 56.07 ? 206 VAL B CG1 1 ATOM 1588 C CG2 . VAL A 1 211 ? 15.017 -31.941 51.857 1.00 57.47 ? 206 VAL B CG2 1 ATOM 1589 N N . ASP A 1 212 ? 13.090 -28.405 53.984 1.00 58.40 ? 207 ASP B N 1 ATOM 1590 C CA . ASP A 1 212 ? 12.912 -27.597 55.170 1.00 57.68 ? 207 ASP B CA 1 ATOM 1591 C C . ASP A 1 212 ? 12.855 -28.572 56.342 1.00 56.90 ? 207 ASP B C 1 ATOM 1592 O O . ASP A 1 212 ? 12.216 -29.622 56.242 1.00 58.43 ? 207 ASP B O 1 ATOM 1593 C CB . ASP A 1 212 ? 11.624 -26.782 55.056 1.00 60.98 ? 207 ASP B CB 1 ATOM 1594 C CG . ASP A 1 212 ? 11.587 -25.917 53.803 1.00 62.62 ? 207 ASP B CG 1 ATOM 1595 O OD1 . ASP A 1 212 ? 12.638 -25.411 53.364 1.00 60.83 ? 207 ASP B OD1 1 ATOM 1596 O OD2 . ASP A 1 212 ? 10.493 -25.743 53.245 1.00 66.29 ? 207 ASP B OD2 1 ATOM 1597 N N . LYS A 1 213 ? 13.556 -28.255 57.428 1.00 54.71 ? 208 LYS B N 1 ATOM 1598 C CA . LYS A 1 213 ? 13.469 -29.072 58.631 1.00 54.53 ? 208 LYS B CA 1 ATOM 1599 C C . LYS A 1 213 ? 13.155 -28.185 59.815 1.00 54.63 ? 208 LYS B C 1 ATOM 1600 O O . LYS A 1 213 ? 13.953 -27.324 60.188 1.00 52.71 ? 208 LYS B O 1 ATOM 1601 C CB . LYS A 1 213 ? 14.763 -29.850 58.870 1.00 52.28 ? 208 LYS B CB 1 ATOM 1602 C CG . LYS A 1 213 ? 14.537 -31.144 59.626 1.00 53.24 ? 208 LYS B CG 1 ATOM 1603 C CD . LYS A 1 213 ? 14.030 -32.256 58.723 1.00 55.13 ? 208 LYS B CD 1 ATOM 1604 C CE . LYS A 1 213 ? 13.250 -33.298 59.498 1.00 57.51 ? 208 LYS B CE 1 ATOM 1605 N NZ . LYS A 1 213 ? 12.747 -34.335 58.555 1.00 60.00 ? 208 LYS B NZ 1 ATOM 1606 N N . LYS A 1 214 ? 11.976 -28.392 60.394 1.00 57.20 ? 209 LYS B N 1 ATOM 1607 C CA . LYS A 1 214 ? 11.547 -27.616 61.535 1.00 57.83 ? 209 LYS B CA 1 ATOM 1608 C C . LYS A 1 214 ? 12.264 -28.166 62.758 1.00 56.20 ? 209 LYS B C 1 ATOM 1609 O O . LYS A 1 214 ? 12.395 -29.381 62.907 1.00 56.14 ? 209 LYS B O 1 ATOM 1610 C CB . LYS A 1 214 ? 10.027 -27.670 61.665 1.00 61.53 ? 209 LYS B CB 1 ATOM 1611 C CG . LYS A 1 214 ? 9.483 -26.909 62.860 1.00 62.95 ? 209 LYS B CG 1 ATOM 1612 C CD . LYS A 1 214 ? 8.434 -25.867 62.446 1.00 65.96 ? 209 LYS B CD 1 ATOM 1613 C CE . LYS A 1 214 ? 6.979 -26.386 62.319 1.00 70.00 ? 209 LYS B CE 1 ATOM 1614 N NZ . LYS A 1 214 ? 6.492 -27.409 63.300 1.00 71.36 ? 209 LYS B NZ 1 ATOM 1615 N N . ILE A 1 215 ? 12.782 -27.266 63.594 1.00 55.11 ? 210 ILE B N 1 ATOM 1616 C CA . ILE A 1 215 ? 13.470 -27.674 64.812 1.00 54.17 ? 210 ILE B CA 1 ATOM 1617 C C . ILE A 1 215 ? 12.458 -27.668 65.942 1.00 56.25 ? 210 ILE B C 1 ATOM 1618 O O . ILE A 1 215 ? 12.018 -26.609 66.383 1.00 57.26 ? 210 ILE B O 1 ATOM 1619 C CB . ILE A 1 215 ? 14.672 -26.763 65.146 1.00 52.23 ? 210 ILE B CB 1 ATOM 1620 C CG1 . ILE A 1 215 ? 15.541 -26.528 63.904 1.00 50.49 ? 210 ILE B CG1 1 ATOM 1621 C CG2 . ILE A 1 215 ? 15.518 -27.372 66.264 1.00 51.67 ? 210 ILE B CG2 1 ATOM 1622 C CD1 . ILE A 1 215 ? 15.969 -27.787 63.168 1.00 49.80 ? 210 ILE B CD1 1 ATOM 1623 N N . VAL A 1 216 ? 12.101 -28.866 66.394 1.00 57.34 ? 211 VAL B N 1 ATOM 1624 C CA . VAL A 1 216 ? 11.054 -29.062 67.406 1.00 59.92 ? 211 VAL B CA 1 ATOM 1625 C C . VAL A 1 216 ? 11.673 -29.684 68.638 1.00 59.78 ? 211 VAL B C 1 ATOM 1626 O O . VAL A 1 216 ? 12.541 -30.532 68.513 1.00 58.69 ? 211 VAL B O 1 ATOM 1627 C CB . VAL A 1 216 ? 9.905 -29.987 66.929 1.00 62.74 ? 211 VAL B CB 1 ATOM 1628 C CG1 . VAL A 1 216 ? 9.365 -29.517 65.589 1.00 63.19 ? 211 VAL B CG1 1 ATOM 1629 C CG2 . VAL A 1 216 ? 10.329 -31.458 66.871 1.00 62.88 ? 211 VAL B CG2 1 ATOM 1630 N N . PRO A 1 217 ? 11.210 -29.302 69.834 1.00 61.48 ? 212 PRO B N 1 ATOM 1631 C CA . PRO A 1 217 ? 11.806 -29.867 71.051 1.00 61.98 ? 212 PRO B CA 1 ATOM 1632 C C . PRO A 1 217 ? 11.732 -31.388 71.088 1.00 63.46 ? 212 PRO B C 1 ATOM 1633 O O . PRO A 1 217 ? 10.861 -31.981 70.447 1.00 65.01 ? 212 PRO B O 1 ATOM 1634 C CB . PRO A 1 217 ? 10.946 -29.279 72.177 1.00 64.44 ? 212 PRO B CB 1 ATOM 1635 C CG . PRO A 1 217 ? 10.328 -28.057 71.595 1.00 64.27 ? 212 PRO B CG 1 ATOM 1636 C CD . PRO A 1 217 ? 10.141 -28.337 70.134 1.00 63.37 ? 212 PRO B CD 1 ATOM 1637 N N . ARG A 1 218 ? 12.642 -32.007 71.835 1.00 63.50 ? 213 ARG B N 1 ATOM 1638 C CA . ARG A 1 218 ? 12.616 -33.457 72.031 1.00 65.63 ? 213 ARG B CA 1 ATOM 1639 C C . ARG A 1 218 ? 11.520 -33.881 73.002 1.00 69.28 ? 213 ARG B C 1 ATOM 1640 O O . ARG A 1 218 ? 11.525 -33.477 74.164 1.00 70.42 ? 213 ARG B O 1 ATOM 1641 C CB . ARG A 1 218 ? 13.982 -33.923 72.537 1.00 65.03 ? 213 ARG B CB 1 ATOM 1642 C CG . ARG A 1 218 ? 15.071 -33.784 71.486 1.00 61.77 ? 213 ARG B CG 1 ATOM 1643 C CD . ARG A 1 218 ? 16.446 -33.964 72.125 1.00 61.49 ? 213 ARG B CD 1 ATOM 1644 N NE . ARG A 1 218 ? 17.535 -33.582 71.217 1.00 58.66 ? 213 ARG B NE 1 ATOM 1645 C CZ . ARG A 1 218 ? 18.135 -34.407 70.355 1.00 58.09 ? 213 ARG B CZ 1 ATOM 1646 N NH1 . ARG A 1 218 ? 17.772 -35.683 70.270 1.00 60.31 ? 213 ARG B NH1 1 ATOM 1647 N NH2 . ARG A 1 218 ? 19.109 -33.955 69.571 1.00 55.69 ? 213 ARG B NH2 1 ATOM 1648 N N . LEU B 1 4 ? -22.352 -20.847 25.782 1.00 91.81 ? 4 LEU E N 1 ATOM 1649 C CA . LEU B 1 4 ? -21.976 -20.054 26.998 1.00 91.05 ? 4 LEU E CA 1 ATOM 1650 C C . LEU B 1 4 ? -20.826 -19.053 26.745 1.00 90.02 ? 4 LEU E C 1 ATOM 1651 O O . LEU B 1 4 ? -19.774 -19.436 26.237 1.00 86.15 ? 4 LEU E O 1 ATOM 1652 C CB . LEU B 1 4 ? -21.600 -21.003 28.137 1.00 86.33 ? 4 LEU E CB 1 ATOM 1653 C CG . LEU B 1 4 ? -22.578 -20.953 29.331 1.00 89.07 ? 4 LEU E CG 1 ATOM 1654 C CD1 . LEU B 1 4 ? -22.785 -22.289 30.020 1.00 85.93 ? 4 LEU E CD1 1 ATOM 1655 C CD2 . LEU B 1 4 ? -21.903 -19.968 30.240 1.00 89.18 ? 4 LEU E CD2 1 ATOM 1656 N N . LYS B 1 5 ? -21.036 -17.780 27.094 1.00 93.82 ? 5 LYS E N 1 ATOM 1657 C CA . LYS B 1 5 ? -20.074 -16.721 26.791 1.00 93.82 ? 5 LYS E CA 1 ATOM 1658 C C . LYS B 1 5 ? -19.364 -16.185 28.033 1.00 92.02 ? 5 LYS E C 1 ATOM 1659 O O . LYS B 1 5 ? -20.010 -15.799 29.010 1.00 94.82 ? 5 LYS E O 1 ATOM 1660 C CB . LYS B 1 5 ? -20.790 -15.559 26.111 1.00 100.48 ? 5 LYS E CB 1 ATOM 1661 C CG . LYS B 1 5 ? -21.619 -15.922 24.890 1.00 104.13 ? 5 LYS E CG 1 ATOM 1662 C CD . LYS B 1 5 ? -22.763 -14.914 24.760 1.00 112.15 ? 5 LYS E CD 1 ATOM 1663 C CE . LYS B 1 5 ? -22.853 -14.274 23.387 1.00 116.94 ? 5 LYS E CE 1 ATOM 1664 N NZ . LYS B 1 5 ? -21.807 -13.225 23.229 1.00 116.21 ? 5 LYS E NZ 1 ATOM 1665 N N . GLU B 1 6 ? -18.033 -16.141 27.971 1.00 88.01 ? 6 GLU E N 1 ATOM 1666 C CA . GLU B 1 6 ? -17.216 -15.605 29.050 1.00 86.64 ? 6 GLU E CA 1 ATOM 1667 C C . GLU B 1 6 ? -16.604 -14.302 28.612 1.00 88.58 ? 6 GLU E C 1 ATOM 1668 O O . GLU B 1 6 ? -16.321 -14.118 27.430 1.00 88.80 ? 6 GLU E O 1 ATOM 1669 C CB . GLU B 1 6 ? -16.109 -16.578 29.417 1.00 81.23 ? 6 GLU E CB 1 ATOM 1670 C CG . GLU B 1 6 ? -16.632 -17.916 29.880 1.00 79.14 ? 6 GLU E CG 1 ATOM 1671 C CD . GLU B 1 6 ? -15.511 -18.838 30.309 1.00 74.61 ? 6 GLU E CD 1 ATOM 1672 O OE1 . GLU B 1 6 ? -14.550 -18.367 30.957 1.00 73.75 ? 6 GLU E OE1 1 ATOM 1673 O OE2 . GLU B 1 6 ? -15.592 -20.038 29.982 1.00 72.30 ? 6 GLU E OE2 1 ATOM 1674 N N . SER B 1 7 ? -16.417 -13.392 29.564 1.00 90.49 ? 7 SER E N 1 ATOM 1675 C CA . SER B 1 7 ? -15.675 -12.170 29.298 1.00 91.97 ? 7 SER E CA 1 ATOM 1676 C C . SER B 1 7 ? -14.767 -11.889 30.478 1.00 90.55 ? 7 SER E C 1 ATOM 1677 O O . SER B 1 7 ? -15.162 -12.056 31.630 1.00 91.54 ? 7 SER E O 1 ATOM 1678 C CB . SER B 1 7 ? -16.615 -10.985 29.062 1.00 98.35 ? 7 SER E CB 1 ATOM 1679 O OG . SER B 1 7 ? -17.329 -10.652 30.238 1.00 101.82 ? 7 SER E OG 1 ATOM 1680 N N . GLY B 1 8 ? -13.550 -11.460 30.187 1.00 88.83 ? 8 GLY E N 1 ATOM 1681 C CA . GLY B 1 8 ? -12.569 -11.208 31.237 1.00 87.85 ? 8 GLY E CA 1 ATOM 1682 C C . GLY B 1 8 ? -11.156 -11.033 30.722 1.00 85.31 ? 8 GLY E C 1 ATOM 1683 O O . GLY B 1 8 ? -10.886 -11.253 29.541 1.00 83.88 ? 8 GLY E O 1 ATOM 1684 N N . PRO B 1 9 ? -10.237 -10.655 31.621 1.00 85.41 ? 9 PRO E N 1 ATOM 1685 C CA . PRO B 1 9 ? -8.853 -10.316 31.271 1.00 84.02 ? 9 PRO E CA 1 ATOM 1686 C C . PRO B 1 9 ? -8.006 -11.514 30.862 1.00 80.04 ? 9 PRO E C 1 ATOM 1687 O O . PRO B 1 9 ? -8.057 -12.557 31.510 1.00 78.26 ? 9 PRO E O 1 ATOM 1688 C CB . PRO B 1 9 ? -8.293 -9.741 32.571 1.00 85.89 ? 9 PRO E CB 1 ATOM 1689 C CG . PRO B 1 9 ? -9.097 -10.380 33.646 1.00 86.59 ? 9 PRO E CG 1 ATOM 1690 C CD . PRO B 1 9 ? -10.470 -10.597 33.076 1.00 87.30 ? 9 PRO E CD 1 ATOM 1691 N N . GLY B 1 10 ? -7.209 -11.345 29.813 1.00 79.27 ? 10 GLY E N 1 ATOM 1692 C CA . GLY B 1 10 ? -6.217 -12.344 29.420 1.00 76.48 ? 10 GLY E CA 1 ATOM 1693 C C . GLY B 1 10 ? -5.003 -12.326 30.342 1.00 76.40 ? 10 GLY E C 1 ATOM 1694 O O . GLY B 1 10 ? -4.294 -13.329 30.472 1.00 74.63 ? 10 GLY E O 1 ATOM 1695 N N . LEU B 1 11 ? -4.780 -11.187 30.996 1.00 78.86 ? 11 LEU E N 1 ATOM 1696 C CA . LEU B 1 11 ? -3.564 -10.951 31.769 1.00 79.80 ? 11 LEU E CA 1 ATOM 1697 C C . LEU B 1 11 ? -3.831 -10.268 33.105 1.00 82.62 ? 11 LEU E C 1 ATOM 1698 O O . LEU B 1 11 ? -4.544 -9.272 33.162 1.00 84.92 ? 11 LEU E O 1 ATOM 1699 C CB . LEU B 1 11 ? -2.623 -10.090 30.936 1.00 80.75 ? 11 LEU E CB 1 ATOM 1700 C CG . LEU B 1 11 ? -1.260 -9.751 31.559 1.00 82.33 ? 11 LEU E CG 1 ATOM 1701 C CD1 . LEU B 1 11 ? -0.398 -10.992 31.565 1.00 80.89 ? 11 LEU E CD1 1 ATOM 1702 C CD2 . LEU B 1 11 ? -0.525 -8.603 30.868 1.00 84.07 ? 11 LEU E CD2 1 ATOM 1703 N N . VAL B 1 12 ? -3.237 -10.802 34.173 1.00 83.24 ? 12 VAL E N 1 ATOM 1704 C CA . VAL B 1 12 ? -3.413 -10.258 35.519 1.00 86.75 ? 12 VAL E CA 1 ATOM 1705 C C . VAL B 1 12 ? -2.072 -10.115 36.230 1.00 88.96 ? 12 VAL E C 1 ATOM 1706 O O . VAL B 1 12 ? -1.250 -11.028 36.196 1.00 87.58 ? 12 VAL E O 1 ATOM 1707 C CB . VAL B 1 12 ? -4.316 -11.168 36.376 1.00 86.57 ? 12 VAL E CB 1 ATOM 1708 C CG1 . VAL B 1 12 ? -4.485 -10.610 37.782 1.00 91.03 ? 12 VAL E CG1 1 ATOM 1709 C CG2 . VAL B 1 12 ? -5.672 -11.347 35.716 1.00 85.08 ? 12 VAL E CG2 1 ATOM 1710 N N . GLN B 1 13 ? -1.871 -8.969 36.882 1.00 93.07 ? 13 GLN E N 1 ATOM 1711 C CA . GLN B 1 13 ? -0.657 -8.712 37.656 1.00 96.28 ? 13 GLN E CA 1 ATOM 1712 C C . GLN B 1 13 ? -0.596 -9.648 38.873 1.00 98.04 ? 13 GLN E C 1 ATOM 1713 O O . GLN B 1 13 ? -1.629 -9.944 39.474 1.00 98.60 ? 13 GLN E O 1 ATOM 1714 C CB . GLN B 1 13 ? -0.626 -7.259 38.153 1.00 100.64 ? 13 GLN E CB 1 ATOM 1715 C CG . GLN B 1 13 ? -0.656 -6.182 37.076 1.00 100.08 ? 13 GLN E CG 1 ATOM 1716 C CD . GLN B 1 13 ? 0.590 -6.148 36.208 1.00 98.57 ? 13 GLN E CD 1 ATOM 1717 O OE1 . GLN B 1 13 ? 1.702 -5.945 36.693 1.00 100.87 ? 13 GLN E OE1 1 ATOM 1718 N NE2 . GLN B 1 13 ? 0.403 -6.334 34.911 1.00 95.31 ? 13 GLN E NE2 1 ATOM 1719 N N . PRO B 1 14 ? 0.611 -10.119 39.241 1.00 99.64 ? 14 PRO E N 1 ATOM 1720 C CA . PRO B 1 14 ? 0.793 -10.896 40.474 1.00 102.47 ? 14 PRO E CA 1 ATOM 1721 C C . PRO B 1 14 ? 0.231 -10.197 41.703 1.00 107.48 ? 14 PRO E C 1 ATOM 1722 O O . PRO B 1 14 ? 0.548 -9.036 41.945 1.00 111.15 ? 14 PRO E O 1 ATOM 1723 C CB . PRO B 1 14 ? 2.312 -11.003 40.594 1.00 104.89 ? 14 PRO E CB 1 ATOM 1724 C CG . PRO B 1 14 ? 2.782 -11.007 39.187 1.00 101.19 ? 14 PRO E CG 1 ATOM 1725 C CD . PRO B 1 14 ? 1.829 -10.134 38.414 1.00 98.76 ? 14 PRO E CD 1 ATOM 1726 N N . SER B 1 15 ? -0.580 -10.916 42.472 1.00 108.23 ? 15 SER E N 1 ATOM 1727 C CA . SER B 1 15 ? -1.262 -10.404 43.676 1.00 113.52 ? 15 SER E CA 1 ATOM 1728 C C . SER B 1 15 ? -2.561 -9.613 43.410 1.00 113.52 ? 15 SER E C 1 ATOM 1729 O O . SER B 1 15 ? -3.280 -9.302 44.363 1.00 118.04 ? 15 SER E O 1 ATOM 1730 C CB . SER B 1 15 ? -0.314 -9.634 44.615 1.00 119.97 ? 15 SER E CB 1 ATOM 1731 O OG . SER B 1 15 ? 1.036 -10.016 44.433 1.00 119.96 ? 15 SER E OG 1 ATOM 1732 N N . GLN B 1 16 ? -2.884 -9.323 42.143 1.00 109.25 ? 16 GLN E N 1 ATOM 1733 C CA . GLN B 1 16 ? -4.158 -8.655 41.811 1.00 109.55 ? 16 GLN E CA 1 ATOM 1734 C C . GLN B 1 16 ? -5.245 -9.685 41.548 1.00 106.34 ? 16 GLN E C 1 ATOM 1735 O O . GLN B 1 16 ? -4.979 -10.889 41.500 1.00 103.18 ? 16 GLN E O 1 ATOM 1736 C CB . GLN B 1 16 ? -4.021 -7.707 40.619 1.00 107.65 ? 16 GLN E CB 1 ATOM 1737 C CG . GLN B 1 16 ? -3.403 -6.377 40.983 1.00 112.19 ? 16 GLN E CG 1 ATOM 1738 C CD . GLN B 1 16 ? -2.015 -6.501 41.560 1.00 113.90 ? 16 GLN E CD 1 ATOM 1739 O OE1 . GLN B 1 16 ? -1.255 -7.374 41.163 1.00 110.49 ? 16 GLN E OE1 1 ATOM 1740 N NE2 . GLN B 1 16 ? -1.672 -5.621 42.493 1.00 119.82 ? 16 GLN E NE2 1 ATOM 1741 N N . SER B 1 17 ? -6.469 -9.196 41.377 1.00 107.76 ? 17 SER E N 1 ATOM 1742 C CA . SER B 1 17 ? -7.646 -10.059 41.291 1.00 106.11 ? 17 SER E CA 1 ATOM 1743 C C . SER B 1 17 ? -8.048 -10.383 39.860 1.00 101.09 ? 17 SER E C 1 ATOM 1744 O O . SER B 1 17 ? -7.737 -9.636 38.931 1.00 100.11 ? 17 SER E O 1 ATOM 1745 C CB . SER B 1 17 ? -8.841 -9.400 41.987 1.00 111.63 ? 17 SER E CB 1 ATOM 1746 O OG . SER B 1 17 ? -9.394 -8.364 41.198 1.00 112.78 ? 17 SER E OG 1 ATOM 1747 N N . LEU B 1 18 ? -8.774 -11.490 39.716 1.00 98.57 ? 18 LEU E N 1 ATOM 1748 C CA . LEU B 1 18 ? -9.298 -11.955 38.441 1.00 94.53 ? 18 LEU E CA 1 ATOM 1749 C C . LEU B 1 18 ? -10.813 -11.922 38.505 1.00 96.76 ? 18 LEU E C 1 ATOM 1750 O O . LEU B 1 18 ? -11.409 -12.486 39.425 1.00 98.62 ? 18 LEU E O 1 ATOM 1751 C CB . LEU B 1 18 ? -8.838 -13.388 38.167 1.00 89.87 ? 18 LEU E CB 1 ATOM 1752 C CG . LEU B 1 18 ? -9.589 -14.148 37.063 1.00 86.27 ? 18 LEU E CG 1 ATOM 1753 C CD1 . LEU B 1 18 ? -9.488 -13.413 35.738 1.00 85.44 ? 18 LEU E CD1 1 ATOM 1754 C CD2 . LEU B 1 18 ? -9.045 -15.559 36.910 1.00 82.29 ? 18 LEU E CD2 1 ATOM 1755 N N . SER B 1 19 ? -11.427 -11.258 37.529 1.00 97.23 ? 19 SER E N 1 ATOM 1756 C CA . SER B 1 19 ? -12.883 -11.169 37.441 1.00 99.90 ? 19 SER E CA 1 ATOM 1757 C C . SER B 1 19 ? -13.383 -11.605 36.070 1.00 96.72 ? 19 SER E C 1 ATOM 1758 O O . SER B 1 19 ? -13.089 -10.961 35.059 1.00 96.29 ? 19 SER E O 1 ATOM 1759 C CB . SER B 1 19 ? -13.350 -9.744 37.725 1.00 106.01 ? 19 SER E CB 1 ATOM 1760 O OG . SER B 1 19 ? -13.154 -9.418 39.089 1.00 110.11 ? 19 SER E OG 1 ATOM 1761 N N . ILE B 1 20 ? -14.148 -12.694 36.051 1.00 94.88 ? 20 ILE E N 1 ATOM 1762 C CA . ILE B 1 20 ? -14.742 -13.199 34.827 1.00 92.65 ? 20 ILE E CA 1 ATOM 1763 C C . ILE B 1 20 ? -16.255 -13.173 34.966 1.00 96.56 ? 20 ILE E C 1 ATOM 1764 O O . ILE B 1 20 ? -16.801 -13.478 36.029 1.00 98.78 ? 20 ILE E O 1 ATOM 1765 C CB . ILE B 1 20 ? -14.281 -14.637 34.508 1.00 87.18 ? 20 ILE E CB 1 ATOM 1766 C CG1 . ILE B 1 20 ? -12.751 -14.703 34.452 1.00 84.12 ? 20 ILE E CG1 1 ATOM 1767 C CG2 . ILE B 1 20 ? -14.883 -15.107 33.187 1.00 85.69 ? 20 ILE E CG2 1 ATOM 1768 C CD1 . ILE B 1 20 ? -12.200 -16.108 34.382 1.00 79.75 ? 20 ILE E CD1 1 ATOM 1769 N N . THR B 1 21 ? -16.916 -12.791 33.879 1.00 97.95 ? 21 THR E N 1 ATOM 1770 C CA . THR B 1 21 ? -18.364 -12.782 33.805 1.00 102.08 ? 21 THR E CA 1 ATOM 1771 C C . THR B 1 21 ? -18.855 -13.795 32.787 1.00 99.29 ? 21 THR E C 1 ATOM 1772 O O . THR B 1 21 ? -18.585 -13.674 31.597 1.00 98.09 ? 21 THR E O 1 ATOM 1773 C CB . THR B 1 21 ? -18.892 -11.395 33.410 1.00 108.12 ? 21 THR E CB 1 ATOM 1774 O OG1 . THR B 1 21 ? -18.578 -10.453 34.441 1.00 111.52 ? 21 THR E OG1 1 ATOM 1775 C CG2 . THR B 1 21 ? -20.398 -11.440 33.195 1.00 113.31 ? 21 THR E CG2 1 ATOM 1776 N N . CYS B 1 22 ? -19.620 -14.765 33.268 1.00 98.95 ? 22 CYS E N 1 ATOM 1777 C CA . CYS B 1 22 ? -20.155 -15.820 32.437 1.00 96.74 ? 22 CYS E CA 1 ATOM 1778 C C . CYS B 1 22 ? -21.592 -15.476 32.088 1.00 103.09 ? 22 CYS E C 1 ATOM 1779 O O . CYS B 1 22 ? -22.444 -15.409 32.974 1.00 107.17 ? 22 CYS E O 1 ATOM 1780 C CB . CYS B 1 22 ? -20.090 -17.146 33.195 1.00 92.67 ? 22 CYS E CB 1 ATOM 1781 S SG . CYS B 1 22 ? -20.863 -18.565 32.393 1.00 90.23 ? 22 CYS E SG 1 ATOM 1782 N N . THR B 1 23 ? -21.856 -15.248 30.802 1.00 104.86 ? 23 THR E N 1 ATOM 1783 C CA . THR B 1 23 ? -23.210 -14.983 30.325 1.00 111.49 ? 23 THR E CA 1 ATOM 1784 C C . THR B 1 23 ? -23.785 -16.266 29.756 1.00 109.88 ? 23 THR E C 1 ATOM 1785 O O . THR B 1 23 ? -23.159 -16.935 28.926 1.00 105.50 ? 23 THR E O 1 ATOM 1786 C CB . THR B 1 23 ? -23.233 -13.899 29.214 1.00 115.56 ? 23 THR E CB 1 ATOM 1787 O OG1 . THR B 1 23 ? -22.647 -12.687 29.710 1.00 117.22 ? 23 THR E OG1 1 ATOM 1788 C CG2 . THR B 1 23 ? -24.661 -13.614 28.714 1.00 123.26 ? 23 THR E CG2 1 ATOM 1789 N N . VAL B 1 24 ? -24.993 -16.587 30.201 1.00 114.20 ? 24 VAL E N 1 ATOM 1790 C CA . VAL B 1 24 ? -25.626 -17.861 29.897 1.00 112.89 ? 24 VAL E CA 1 ATOM 1791 C C . VAL B 1 24 ? -26.782 -17.702 28.907 1.00 119.41 ? 24 VAL E C 1 ATOM 1792 O O . VAL B 1 24 ? -27.527 -16.717 28.948 1.00 126.47 ? 24 VAL E O 1 ATOM 1793 C CB . VAL B 1 24 ? -26.101 -18.519 31.215 1.00 112.61 ? 24 VAL E CB 1 ATOM 1794 C CG1 . VAL B 1 24 ? -27.507 -19.091 31.106 1.00 117.10 ? 24 VAL E CG1 1 ATOM 1795 C CG2 . VAL B 1 24 ? -25.108 -19.580 31.664 1.00 104.78 ? 24 VAL E CG2 1 ATOM 1796 N N . SER B 1 25 ? -26.927 -18.698 28.034 1.00 117.51 ? 25 SER E N 1 ATOM 1797 C CA . SER B 1 25 ? -28.011 -18.720 27.043 1.00 124.00 ? 25 SER E CA 1 ATOM 1798 C C . SER B 1 25 ? -28.317 -20.167 26.610 1.00 121.47 ? 25 SER E C 1 ATOM 1799 O O . SER B 1 25 ? -27.407 -20.971 26.390 1.00 114.94 ? 25 SER E O 1 ATOM 1800 C CB . SER B 1 25 ? -27.692 -17.824 25.825 1.00 127.00 ? 25 SER E CB 1 ATOM 1801 O OG . SER B 1 25 ? -28.677 -17.964 24.815 1.00 133.18 ? 25 SER E OG 1 ATOM 1802 N N . GLY B 1 26 ? -29.607 -20.476 26.486 1.00 127.42 ? 26 GLY E N 1 ATOM 1803 C CA . GLY B 1 26 ? -30.076 -21.835 26.216 1.00 125.92 ? 26 GLY E CA 1 ATOM 1804 C C . GLY B 1 26 ? -30.791 -22.485 27.392 1.00 126.10 ? 26 GLY E C 1 ATOM 1805 O O . GLY B 1 26 ? -31.602 -23.397 27.199 1.00 127.82 ? 26 GLY E O 1 ATOM 1806 N N . PHE B 1 27 ? -30.507 -22.013 28.606 1.00 125.01 ? 27 PHE E N 1 ATOM 1807 C CA . PHE B 1 27 ? -31.182 -22.498 29.801 1.00 125.98 ? 27 PHE E CA 1 ATOM 1808 C C . PHE B 1 27 ? -31.377 -21.331 30.769 1.00 130.90 ? 27 PHE E C 1 ATOM 1809 O O . PHE B 1 27 ? -30.999 -20.194 30.468 1.00 133.24 ? 27 PHE E O 1 ATOM 1810 C CB . PHE B 1 27 ? -30.401 -23.678 30.401 1.00 117.46 ? 27 PHE E CB 1 ATOM 1811 C CG . PHE B 1 27 ? -29.066 -23.301 30.966 1.00 111.89 ? 27 PHE E CG 1 ATOM 1812 C CD1 . PHE B 1 27 ? -27.947 -23.257 30.148 1.00 107.13 ? 27 PHE E CD1 1 ATOM 1813 C CD2 . PHE B 1 27 ? -28.925 -22.994 32.319 1.00 112.02 ? 27 PHE E CD2 1 ATOM 1814 C CE1 . PHE B 1 27 ? -26.719 -22.912 30.663 1.00 102.61 ? 27 PHE E CE1 1 ATOM 1815 C CE2 . PHE B 1 27 ? -27.694 -22.646 32.842 1.00 107.56 ? 27 PHE E CE2 1 ATOM 1816 C CZ . PHE B 1 27 ? -26.592 -22.607 32.008 1.00 102.87 ? 27 PHE E CZ 1 ATOM 1817 N N . SER B 1 28 ? -32.017 -21.601 31.899 1.00 133.31 ? 28 SER E N 1 ATOM 1818 C CA . SER B 1 28 ? -32.294 -20.571 32.901 1.00 139.01 ? 28 SER E CA 1 ATOM 1819 C C . SER B 1 28 ? -31.470 -20.786 34.174 1.00 134.41 ? 28 SER E C 1 ATOM 1820 O O . SER B 1 28 ? -31.343 -21.917 34.645 1.00 130.16 ? 28 SER E O 1 ATOM 1821 C CB . SER B 1 28 ? -33.781 -20.584 33.248 1.00 147.66 ? 28 SER E CB 1 ATOM 1822 O OG . SER B 1 28 ? -34.125 -19.529 34.125 1.00 154.40 ? 28 SER E OG 1 ATOM 1823 N N . LEU B 1 29 ? -30.928 -19.698 34.731 1.00 136.10 ? 29 LEU E N 1 ATOM 1824 C CA . LEU B 1 29 ? -30.168 -19.749 35.991 1.00 132.98 ? 29 LEU E CA 1 ATOM 1825 C C . LEU B 1 29 ? -31.044 -20.034 37.217 1.00 138.10 ? 29 LEU E C 1 ATOM 1826 O O . LEU B 1 29 ? -30.519 -20.430 38.262 1.00 135.56 ? 29 LEU E O 1 ATOM 1827 C CB . LEU B 1 29 ? -29.395 -18.448 36.217 1.00 134.39 ? 29 LEU E CB 1 ATOM 1828 C CG . LEU B 1 29 ? -28.217 -18.180 35.281 1.00 128.35 ? 29 LEU E CG 1 ATOM 1829 C CD1 . LEU B 1 29 ? -27.786 -16.729 35.413 1.00 131.99 ? 29 LEU E CD1 1 ATOM 1830 C CD2 . LEU B 1 29 ? -27.045 -19.128 35.546 1.00 119.58 ? 29 LEU E CD2 1 ATOM 1831 N N . THR B 1 30 ? -32.361 -19.822 37.092 1.00 145.86 ? 30 THR E N 1 ATOM 1832 C CA . THR B 1 30 ? -33.330 -20.215 38.124 1.00 151.10 ? 30 THR E CA 1 ATOM 1833 C C . THR B 1 30 ? -33.448 -21.740 38.237 1.00 145.23 ? 30 THR E C 1 ATOM 1834 O O . THR B 1 30 ? -33.910 -22.255 39.254 1.00 147.70 ? 30 THR E O 1 ATOM 1835 C CB . THR B 1 30 ? -34.742 -19.661 37.826 1.00 161.75 ? 30 THR E CB 1 ATOM 1836 O OG1 . THR B 1 30 ? -35.176 -20.137 36.546 1.00 160.71 ? 30 THR E OG1 1 ATOM 1837 C CG2 . THR B 1 30 ? -34.758 -18.132 37.833 1.00 168.86 ? 30 THR E CG2 1 ATOM 1838 N N . THR B 1 31 ? -33.043 -22.448 37.186 1.00 138.02 ? 31 THR E N 1 ATOM 1839 C CA . THR B 1 31 ? -33.196 -23.896 37.100 1.00 132.78 ? 31 THR E CA 1 ATOM 1840 C C . THR B 1 31 ? -31.897 -24.648 37.364 1.00 123.19 ? 31 THR E C 1 ATOM 1841 O O . THR B 1 31 ? -31.937 -25.765 37.886 1.00 120.05 ? 31 THR E O 1 ATOM 1842 C CB . THR B 1 31 ? -33.714 -24.312 35.708 1.00 132.60 ? 31 THR E CB 1 ATOM 1843 O OG1 . THR B 1 31 ? -34.862 -23.527 35.365 1.00 141.99 ? 31 THR E OG1 1 ATOM 1844 C CG2 . THR B 1 31 ? -34.085 -25.787 35.685 1.00 129.14 ? 31 THR E CG2 1 ATOM 1845 N N . TYR B 1 32 ? -30.754 -24.055 36.998 1.00 118.82 ? 32 TYR E N 1 ATOM 1846 C CA . TYR B 1 32 ? -29.488 -24.783 37.015 1.00 110.03 ? 32 TYR E CA 1 ATOM 1847 C C . TYR B 1 32 ? -28.326 -24.025 37.657 1.00 107.77 ? 32 TYR E C 1 ATOM 1848 O O . TYR B 1 32 ? -28.215 -22.803 37.531 1.00 111.20 ? 32 TYR E O 1 ATOM 1849 C CB . TYR B 1 32 ? -29.105 -25.168 35.581 1.00 105.78 ? 32 TYR E CB 1 ATOM 1850 C CG . TYR B 1 32 ? -30.089 -26.115 34.901 1.00 106.81 ? 32 TYR E CG 1 ATOM 1851 C CD1 . TYR B 1 32 ? -30.140 -27.462 35.248 1.00 103.07 ? 32 TYR E CD1 1 ATOM 1852 C CD2 . TYR B 1 32 ? -30.960 -25.662 33.908 1.00 112.01 ? 32 TYR E CD2 1 ATOM 1853 C CE1 . TYR B 1 32 ? -31.027 -28.325 34.628 1.00 104.15 ? 32 TYR E CE1 1 ATOM 1854 C CE2 . TYR B 1 32 ? -31.853 -26.514 33.283 1.00 113.47 ? 32 TYR E CE2 1 ATOM 1855 C CZ . TYR B 1 32 ? -31.884 -27.843 33.645 1.00 109.44 ? 32 TYR E CZ 1 ATOM 1856 O OH . TYR B 1 32 ? -32.780 -28.677 33.021 1.00 111.31 ? 32 TYR E OH 1 ATOM 1857 N N . GLY B 1 33 ? -27.463 -24.782 38.332 1.00 102.11 ? 33 GLY E N 1 ATOM 1858 C CA . GLY B 1 33 ? -26.234 -24.261 38.929 1.00 99.55 ? 33 GLY E CA 1 ATOM 1859 C C . GLY B 1 33 ? -25.065 -24.227 37.956 1.00 93.31 ? 33 GLY E C 1 ATOM 1860 O O . GLY B 1 33 ? -24.980 -25.039 37.032 1.00 89.40 ? 33 GLY E O 1 ATOM 1861 N N . VAL B 1 34 ? -24.136 -23.309 38.188 1.00 92.55 ? 34 VAL E N 1 ATOM 1862 C CA . VAL B 1 34 ? -23.017 -23.111 37.275 1.00 87.56 ? 34 VAL E CA 1 ATOM 1863 C C . VAL B 1 34 ? -21.688 -23.294 37.999 1.00 83.78 ? 34 VAL E C 1 ATOM 1864 O O . VAL B 1 34 ? -21.412 -22.628 38.994 1.00 86.56 ? 34 VAL E O 1 ATOM 1865 C CB . VAL B 1 34 ? -23.063 -21.716 36.633 1.00 90.80 ? 34 VAL E CB 1 ATOM 1866 C CG1 . VAL B 1 34 ? -21.814 -21.485 35.800 1.00 86.39 ? 34 VAL E CG1 1 ATOM 1867 C CG2 . VAL B 1 34 ? -24.319 -21.570 35.777 1.00 94.56 ? 34 VAL E CG2 1 ATOM 1868 N N . HIS B 1 35 ? -20.867 -24.194 37.473 1.00 77.93 ? 35 HIS E N 1 ATOM 1869 C CA . HIS B 1 35 ? -19.597 -24.539 38.097 1.00 74.95 ? 35 HIS E CA 1 ATOM 1870 C C . HIS B 1 35 ? -18.469 -23.786 37.432 1.00 73.02 ? 35 HIS E C 1 ATOM 1871 O O . HIS B 1 35 ? -18.583 -23.372 36.278 1.00 72.37 ? 35 HIS E O 1 ATOM 1872 C CB . HIS B 1 35 ? -19.322 -26.035 37.982 1.00 70.72 ? 35 HIS E CB 1 ATOM 1873 C CG . HIS B 1 35 ? -20.427 -26.888 38.507 1.00 71.91 ? 35 HIS E CG 1 ATOM 1874 N ND1 . HIS B 1 35 ? -20.313 -27.632 39.660 1.00 72.22 ? 35 HIS E ND1 1 ATOM 1875 C CD2 . HIS B 1 35 ? -21.675 -27.112 38.037 1.00 73.38 ? 35 HIS E CD2 1 ATOM 1876 C CE1 . HIS B 1 35 ? -21.445 -28.273 39.879 1.00 73.56 ? 35 HIS E CE1 1 ATOM 1877 N NE2 . HIS B 1 35 ? -22.284 -27.980 38.905 1.00 74.27 ? 35 HIS E NE2 1 ATOM 1878 N N . TRP B 1 36 ? -17.377 -23.620 38.169 1.00 72.64 ? 36 TRP E N 1 ATOM 1879 C CA . TRP B 1 36 ? -16.173 -23.011 37.625 1.00 70.96 ? 36 TRP E CA 1 ATOM 1880 C C . TRP B 1 36 ? -15.019 -23.988 37.719 1.00 67.58 ? 36 TRP E C 1 ATOM 1881 O O . TRP B 1 36 ? -14.769 -24.586 38.762 1.00 68.09 ? 36 TRP E O 1 ATOM 1882 C CB . TRP B 1 36 ? -15.864 -21.689 38.320 1.00 74.73 ? 36 TRP E CB 1 ATOM 1883 C CG . TRP B 1 36 ? -16.858 -20.645 37.943 1.00 78.26 ? 36 TRP E CG 1 ATOM 1884 C CD1 . TRP B 1 36 ? -18.083 -20.450 38.502 1.00 82.47 ? 36 TRP E CD1 1 ATOM 1885 C CD2 . TRP B 1 36 ? -16.737 -19.677 36.896 1.00 78.58 ? 36 TRP E CD2 1 ATOM 1886 N NE1 . TRP B 1 36 ? -18.733 -19.410 37.881 1.00 85.61 ? 36 TRP E NE1 1 ATOM 1887 C CE2 . TRP B 1 36 ? -17.930 -18.916 36.891 1.00 83.26 ? 36 TRP E CE2 1 ATOM 1888 C CE3 . TRP B 1 36 ? -15.735 -19.366 35.974 1.00 75.95 ? 36 TRP E CE3 1 ATOM 1889 C CZ2 . TRP B 1 36 ? -18.147 -17.861 35.998 1.00 85.34 ? 36 TRP E CZ2 1 ATOM 1890 C CZ3 . TRP B 1 36 ? -15.952 -18.322 35.081 1.00 77.76 ? 36 TRP E CZ3 1 ATOM 1891 C CH2 . TRP B 1 36 ? -17.145 -17.580 35.102 1.00 82.40 ? 36 TRP E CH2 1 ATOM 1892 N N . VAL B 1 37 ? -14.342 -24.153 36.593 1.00 64.76 ? 37 VAL E N 1 ATOM 1893 C CA . VAL B 1 37 ? -13.280 -25.124 36.438 1.00 62.16 ? 37 VAL E CA 1 ATOM 1894 C C . VAL B 1 37 ? -12.112 -24.432 35.751 1.00 61.82 ? 37 VAL E C 1 ATOM 1895 O O . VAL B 1 37 ? -12.318 -23.548 34.914 1.00 62.24 ? 37 VAL E O 1 ATOM 1896 C CB . VAL B 1 37 ? -13.767 -26.315 35.580 1.00 59.58 ? 37 VAL E CB 1 ATOM 1897 C CG1 . VAL B 1 37 ? -12.624 -27.245 35.207 1.00 57.48 ? 37 VAL E CG1 1 ATOM 1898 C CG2 . VAL B 1 37 ? -14.827 -27.094 36.333 1.00 60.10 ? 37 VAL E CG2 1 ATOM 1899 N N . ARG B 1 38 ? -10.891 -24.828 36.102 1.00 61.58 ? 38 ARG E N 1 ATOM 1900 C CA . ARG B 1 38 ? -9.729 -24.324 35.405 1.00 61.56 ? 38 ARG E CA 1 ATOM 1901 C C . ARG B 1 38 ? -8.833 -25.445 34.963 1.00 60.51 ? 38 ARG E C 1 ATOM 1902 O O . ARG B 1 38 ? -8.916 -26.576 35.437 1.00 59.93 ? 38 ARG E O 1 ATOM 1903 C CB . ARG B 1 38 ? -8.944 -23.331 36.259 1.00 63.90 ? 38 ARG E CB 1 ATOM 1904 C CG . ARG B 1 38 ? -7.975 -23.957 37.243 1.00 64.99 ? 38 ARG E CG 1 ATOM 1905 C CD . ARG B 1 38 ? -7.303 -22.877 38.062 1.00 68.06 ? 38 ARG E CD 1 ATOM 1906 N NE . ARG B 1 38 ? -6.399 -23.448 39.041 1.00 70.10 ? 38 ARG E NE 1 ATOM 1907 C CZ . ARG B 1 38 ? -5.638 -22.740 39.866 1.00 73.54 ? 38 ARG E CZ 1 ATOM 1908 N NH1 . ARG B 1 38 ? -5.664 -21.410 39.841 1.00 74.99 ? 38 ARG E NH1 1 ATOM 1909 N NH2 . ARG B 1 38 ? -4.849 -23.371 40.721 1.00 76.01 ? 38 ARG E NH2 1 ATOM 1910 N N . GLN B 1 39 ? -7.943 -25.097 34.059 1.00 61.03 ? 39 GLN E N 1 ATOM 1911 C CA . GLN B 1 39 ? -7.142 -26.085 33.401 1.00 61.04 ? 39 GLN E CA 1 ATOM 1912 C C . GLN B 1 39 ? -5.757 -25.587 33.089 1.00 62.93 ? 39 GLN E C 1 ATOM 1913 O O . GLN B 1 39 ? -5.602 -24.572 32.426 1.00 63.27 ? 39 GLN E O 1 ATOM 1914 C CB . GLN B 1 39 ? -7.823 -26.474 32.120 1.00 59.79 ? 39 GLN E CB 1 ATOM 1915 C CG . GLN B 1 39 ? -6.880 -26.871 31.023 1.00 60.43 ? 39 GLN E CG 1 ATOM 1916 C CD . GLN B 1 39 ? -7.590 -27.747 30.064 1.00 59.80 ? 39 GLN E CD 1 ATOM 1917 O OE1 . GLN B 1 39 ? -8.472 -27.286 29.334 1.00 59.83 ? 39 GLN E OE1 1 ATOM 1918 N NE2 . GLN B 1 39 ? -7.263 -29.041 30.095 1.00 59.86 ? 39 GLN E NE2 1 ATOM 1919 N N . SER B 1 40 ? -4.761 -26.335 33.552 1.00 65.06 ? 40 SER E N 1 ATOM 1920 C CA . SER B 1 40 ? -3.375 -26.067 33.270 1.00 67.58 ? 40 SER E CA 1 ATOM 1921 C C . SER B 1 40 ? -2.743 -27.292 32.634 1.00 68.62 ? 40 SER E C 1 ATOM 1922 O O . SER B 1 40 ? -3.312 -28.388 32.664 1.00 67.80 ? 40 SER E O 1 ATOM 1923 C CB . SER B 1 40 ? -2.682 -25.778 34.574 1.00 70.34 ? 40 SER E CB 1 ATOM 1924 O OG . SER B 1 40 ? -3.525 -25.014 35.401 1.00 70.45 ? 40 SER E OG 1 ATOM 1925 N N . PRO B 1 41 ? -1.561 -27.114 32.041 1.00 71.49 ? 41 PRO E N 1 ATOM 1926 C CA . PRO B 1 41 ? -0.807 -28.297 31.607 1.00 73.70 ? 41 PRO E CA 1 ATOM 1927 C C . PRO B 1 41 ? -0.284 -29.142 32.780 1.00 76.37 ? 41 PRO E C 1 ATOM 1928 O O . PRO B 1 41 ? -0.222 -30.366 32.666 1.00 77.33 ? 41 PRO E O 1 ATOM 1929 C CB . PRO B 1 41 ? 0.362 -27.705 30.813 1.00 76.23 ? 41 PRO E CB 1 ATOM 1930 C CG . PRO B 1 41 ? 0.463 -26.286 31.257 1.00 76.04 ? 41 PRO E CG 1 ATOM 1931 C CD . PRO B 1 41 ? -0.927 -25.858 31.591 1.00 72.65 ? 41 PRO E CD 1 ATOM 1932 N N . GLY B 1 42 ? 0.071 -28.489 33.892 1.00 78.11 ? 42 GLY E N 1 ATOM 1933 C CA . GLY B 1 42 ? 0.577 -29.168 35.080 1.00 81.32 ? 42 GLY E CA 1 ATOM 1934 C C . GLY B 1 42 ? -0.477 -29.931 35.867 1.00 79.67 ? 42 GLY E C 1 ATOM 1935 O O . GLY B 1 42 ? -0.255 -31.083 36.240 1.00 81.88 ? 42 GLY E O 1 ATOM 1936 N N . LYS B 1 43 ? -1.628 -29.303 36.112 1.00 76.55 ? 43 LYS E N 1 ATOM 1937 C CA . LYS B 1 43 ? -2.661 -29.872 37.006 1.00 75.03 ? 43 LYS E CA 1 ATOM 1938 C C . LYS B 1 43 ? -3.818 -30.584 36.319 1.00 70.74 ? 43 LYS E C 1 ATOM 1939 O O . LYS B 1 43 ? -4.656 -31.176 37.000 1.00 70.28 ? 43 LYS E O 1 ATOM 1940 C CB . LYS B 1 43 ? -3.236 -28.775 37.917 1.00 75.69 ? 43 LYS E CB 1 ATOM 1941 C CG . LYS B 1 43 ? -2.362 -28.455 39.129 1.00 80.59 ? 43 LYS E CG 1 ATOM 1942 C CD . LYS B 1 43 ? -2.562 -29.495 40.233 1.00 82.76 ? 43 LYS E CD 1 ATOM 1943 C CE . LYS B 1 43 ? -1.348 -29.671 41.146 1.00 88.40 ? 43 LYS E CE 1 ATOM 1944 N NZ . LYS B 1 43 ? -1.506 -29.021 42.487 1.00 91.98 ? 43 LYS E NZ 1 ATOM 1945 N N . GLY B 1 44 ? -3.872 -30.555 34.989 1.00 68.09 ? 44 GLY E N 1 ATOM 1946 C CA . GLY B 1 44 ? -5.038 -31.067 34.273 1.00 64.18 ? 44 GLY E CA 1 ATOM 1947 C C . GLY B 1 44 ? -6.265 -30.206 34.523 1.00 61.61 ? 44 GLY E C 1 ATOM 1948 O O . GLY B 1 44 ? -6.190 -28.983 34.418 1.00 61.80 ? 44 GLY E O 1 ATOM 1949 N N . LEU B 1 45 ? -7.396 -30.837 34.826 1.00 59.24 ? 45 LEU E N 1 ATOM 1950 C CA . LEU B 1 45 ? -8.606 -30.101 35.161 1.00 57.96 ? 45 LEU E CA 1 ATOM 1951 C C . LEU B 1 45 ? -8.781 -30.018 36.655 1.00 59.25 ? 45 LEU E C 1 ATOM 1952 O O . LEU B 1 45 ? -8.464 -30.949 37.381 1.00 60.10 ? 45 LEU E O 1 ATOM 1953 C CB . LEU B 1 45 ? -9.832 -30.756 34.534 1.00 55.92 ? 45 LEU E CB 1 ATOM 1954 C CG . LEU B 1 45 ? -9.975 -30.568 33.024 1.00 54.97 ? 45 LEU E CG 1 ATOM 1955 C CD1 . LEU B 1 45 ? -11.041 -31.498 32.476 1.00 53.73 ? 45 LEU E CD1 1 ATOM 1956 C CD2 . LEU B 1 45 ? -10.334 -29.122 32.717 1.00 55.40 ? 45 LEU E CD2 1 ATOM 1957 N N . GLU B 1 46 ? -9.322 -28.893 37.095 1.00 59.87 ? 46 GLU E N 1 ATOM 1958 C CA . GLU B 1 46 ? -9.420 -28.580 38.504 1.00 62.22 ? 46 GLU E CA 1 ATOM 1959 C C . GLU B 1 46 ? -10.733 -27.866 38.834 1.00 62.58 ? 46 GLU E C 1 ATOM 1960 O O . GLU B 1 46 ? -10.973 -26.749 38.376 1.00 62.85 ? 46 GLU E O 1 ATOM 1961 C CB . GLU B 1 46 ? -8.240 -27.688 38.849 1.00 64.59 ? 46 GLU E CB 1 ATOM 1962 C CG . GLU B 1 46 ? -7.868 -27.641 40.305 1.00 68.29 ? 46 GLU E CG 1 ATOM 1963 C CD . GLU B 1 46 ? -6.434 -27.137 40.477 1.00 70.80 ? 46 GLU E CD 1 ATOM 1964 O OE1 . GLU B 1 46 ? -5.842 -26.613 39.493 1.00 69.43 ? 46 GLU E OE1 1 ATOM 1965 O OE2 . GLU B 1 46 ? -5.888 -27.284 41.588 1.00 74.41 ? 46 GLU E OE2 1 ATOM 1966 N N . TRP B 1 47 ? -11.575 -28.511 39.639 1.00 63.01 ? 47 TRP E N 1 ATOM 1967 C CA . TRP B 1 47 ? -12.858 -27.942 40.027 1.00 64.18 ? 47 TRP E CA 1 ATOM 1968 C C . TRP B 1 47 ? -12.632 -26.884 41.095 1.00 68.08 ? 47 TRP E C 1 ATOM 1969 O O . TRP B 1 47 ? -11.914 -27.131 42.058 1.00 70.12 ? 47 TRP E O 1 ATOM 1970 C CB . TRP B 1 47 ? -13.786 -29.038 40.546 1.00 64.05 ? 47 TRP E CB 1 ATOM 1971 C CG . TRP B 1 47 ? -15.145 -28.548 40.875 1.00 66.03 ? 47 TRP E CG 1 ATOM 1972 C CD1 . TRP B 1 47 ? -16.176 -28.377 40.012 1.00 65.04 ? 47 TRP E CD1 1 ATOM 1973 C CD2 . TRP B 1 47 ? -15.627 -28.155 42.161 1.00 70.34 ? 47 TRP E CD2 1 ATOM 1974 N NE1 . TRP B 1 47 ? -17.270 -27.899 40.671 1.00 68.47 ? 47 TRP E NE1 1 ATOM 1975 C CE2 . TRP B 1 47 ? -16.960 -27.754 41.996 1.00 71.79 ? 47 TRP E CE2 1 ATOM 1976 C CE3 . TRP B 1 47 ? -15.059 -28.104 43.440 1.00 73.83 ? 47 TRP E CE3 1 ATOM 1977 C CZ2 . TRP B 1 47 ? -17.739 -27.317 43.056 1.00 76.64 ? 47 TRP E CZ2 1 ATOM 1978 C CZ3 . TRP B 1 47 ? -15.838 -27.654 44.499 1.00 78.66 ? 47 TRP E CZ3 1 ATOM 1979 C CH2 . TRP B 1 47 ? -17.165 -27.265 44.298 1.00 80.01 ? 47 TRP E CH2 1 ATOM 1980 N N . LEU B 1 48 ? -13.256 -25.719 40.917 1.00 69.50 ? 48 LEU E N 1 ATOM 1981 C CA . LEU B 1 48 ? -13.015 -24.562 41.770 1.00 73.63 ? 48 LEU E CA 1 ATOM 1982 C C . LEU B 1 48 ? -14.210 -24.239 42.642 1.00 77.66 ? 48 LEU E C 1 ATOM 1983 O O . LEU B 1 48 ? -14.060 -24.049 43.851 1.00 81.84 ? 48 LEU E O 1 ATOM 1984 C CB . LEU B 1 48 ? -12.662 -23.343 40.925 1.00 73.21 ? 48 LEU E CB 1 ATOM 1985 C CG . LEU B 1 48 ? -11.356 -23.436 40.154 1.00 70.44 ? 48 LEU E CG 1 ATOM 1986 C CD1 . LEU B 1 48 ? -11.232 -22.224 39.246 1.00 70.23 ? 48 LEU E CD1 1 ATOM 1987 C CD2 . LEU B 1 48 ? -10.167 -23.537 41.095 1.00 72.67 ? 48 LEU E CD2 1 ATOM 1988 N N . GLY B 1 49 ? -15.391 -24.165 42.038 1.00 77.16 ? 49 GLY E N 1 ATOM 1989 C CA . GLY B 1 49 ? -16.601 -23.918 42.810 1.00 81.57 ? 49 GLY E CA 1 ATOM 1990 C C . GLY B 1 49 ? -17.891 -24.058 42.031 1.00 80.99 ? 49 GLY E C 1 ATOM 1991 O O . GLY B 1 49 ? -17.890 -24.469 40.870 1.00 76.93 ? 49 GLY E O 1 ATOM 1992 N N . VAL B 1 50 ? -18.992 -23.728 42.705 1.00 85.83 ? 50 VAL E N 1 ATOM 1993 C CA . VAL B 1 50 ? -20.332 -23.689 42.125 1.00 87.15 ? 50 VAL E CA 1 ATOM 1994 C C . VAL B 1 50 ? -21.137 -22.595 42.780 1.00 94.10 ? 50 VAL E C 1 ATOM 1995 O O . VAL B 1 50 ? -20.927 -22.247 43.944 1.00 98.20 ? 50 VAL E O 1 ATOM 1996 C CB . VAL B 1 50 ? -21.199 -24.921 42.464 1.00 86.95 ? 50 VAL E CB 1 ATOM 1997 C CG1 . VAL B 1 50 ? -22.261 -25.173 41.392 1.00 86.08 ? 50 VAL E CG1 1 ATOM 1998 C CG2 . VAL B 1 50 ? -20.354 -26.146 42.673 1.00 82.58 ? 50 VAL E CG2 1 ATOM 1999 N N . ILE B 1 51 ? -22.084 -22.086 42.015 1.00 96.01 ? 51 ILE E N 1 ATOM 2000 C CA . ILE B 1 51 ? -23.220 -21.377 42.570 1.00 103.41 ? 51 ILE E CA 1 ATOM 2001 C C . ILE B 1 51 ? -24.472 -22.130 42.139 1.00 103.96 ? 51 ILE E C 1 ATOM 2002 O O . ILE B 1 51 ? -24.708 -22.349 40.951 1.00 100.98 ? 51 ILE E O 1 ATOM 2003 C CB . ILE B 1 51 ? -23.254 -19.880 42.172 1.00 107.33 ? 51 ILE E CB 1 ATOM 2004 C CG1 . ILE B 1 51 ? -24.365 -19.150 42.936 1.00 116.25 ? 51 ILE E CG1 1 ATOM 2005 C CG2 . ILE B 1 51 ? -23.420 -19.680 40.667 1.00 104.46 ? 51 ILE E CG2 1 ATOM 2006 C CD1 . ILE B 1 51 ? -24.098 -17.672 43.123 1.00 121.28 ? 51 ILE E CD1 1 ATOM 2007 N N . TRP B 1 52 ? -25.251 -22.564 43.121 1.00 108.16 ? 52 TRP E N 1 ATOM 2008 C CA . TRP B 1 52 ? -26.466 -23.323 42.858 1.00 109.32 ? 52 TRP E CA 1 ATOM 2009 C C . TRP B 1 52 ? -27.608 -22.386 42.479 1.00 116.12 ? 52 TRP E C 1 ATOM 2010 O O . TRP B 1 52 ? -27.617 -21.215 42.872 1.00 121.54 ? 52 TRP E O 1 ATOM 2011 C CB . TRP B 1 52 ? -26.840 -24.130 44.094 1.00 111.72 ? 52 TRP E CB 1 ATOM 2012 C CG . TRP B 1 52 ? -25.718 -25.041 44.543 1.00 106.03 ? 52 TRP E CG 1 ATOM 2013 C CD1 . TRP B 1 52 ? -24.863 -24.857 45.607 1.00 107.41 ? 52 TRP E CD1 1 ATOM 2014 C CD2 . TRP B 1 52 ? -25.314 -26.252 43.908 1.00 98.80 ? 52 TRP E CD2 1 ATOM 2015 N NE1 . TRP B 1 52 ? -23.961 -25.901 45.671 1.00 101.64 ? 52 TRP E NE1 1 ATOM 2016 C CE2 . TRP B 1 52 ? -24.226 -26.772 44.643 1.00 96.32 ? 52 TRP E CE2 1 ATOM 2017 C CE3 . TRP B 1 52 ? -25.777 -26.960 42.790 1.00 94.88 ? 52 TRP E CE3 1 ATOM 2018 C CZ2 . TRP B 1 52 ? -23.595 -27.968 44.290 1.00 90.18 ? 52 TRP E CZ2 1 ATOM 2019 C CZ3 . TRP B 1 52 ? -25.156 -28.145 42.448 1.00 88.69 ? 52 TRP E CZ3 1 ATOM 2020 C CH2 . TRP B 1 52 ? -24.074 -28.638 43.190 1.00 86.37 ? 52 TRP E CH2 1 ATOM 2021 N N . SER B 1 53 ? -28.579 -22.916 41.735 1.00 116.43 ? 53 SER E N 1 ATOM 2022 C CA . SER B 1 53 ? -29.648 -22.100 41.173 1.00 123.03 ? 53 SER E CA 1 ATOM 2023 C C . SER B 1 53 ? -30.234 -21.179 42.244 1.00 132.32 ? 53 SER E C 1 ATOM 2024 O O . SER B 1 53 ? -30.452 -19.994 41.999 1.00 137.55 ? 53 SER E O 1 ATOM 2025 C CB . SER B 1 53 ? -30.732 -22.997 40.563 1.00 123.47 ? 53 SER E CB 1 ATOM 2026 O OG . SER B 1 53 ? -31.320 -23.823 41.554 1.00 125.53 ? 53 SER E OG 1 ATOM 2027 N N . GLY B 1 54 ? -30.440 -21.724 43.438 1.00 134.69 ? 54 GLY E N 1 ATOM 2028 C CA . GLY B 1 54 ? -30.952 -20.989 44.538 1.00 143.93 ? 54 GLY E CA 1 ATOM 2029 C C . GLY B 1 54 ? -30.420 -21.638 45.781 1.00 143.03 ? 54 GLY E C 1 ATOM 2030 O O . GLY B 1 54 ? -30.733 -22.796 46.040 1.00 140.86 ? 54 GLY E O 1 ATOM 2031 N N . GLY B 1 55 ? -29.573 -20.954 46.532 1.00 144.68 ? 55 GLY E N 1 ATOM 2032 C CA . GLY B 1 55 ? -28.801 -19.757 46.108 1.00 144.31 ? 55 GLY E CA 1 ATOM 2033 C C . GLY B 1 55 ? -27.381 -19.747 46.685 1.00 140.22 ? 55 GLY E C 1 ATOM 2034 O O . GLY B 1 55 ? -26.685 -18.736 46.625 1.00 140.94 ? 55 GLY E O 1 ATOM 2035 N N . SER B 1 56 ? -26.955 -20.889 47.225 1.00 136.22 ? 56 SER E N 1 ATOM 2036 C CA . SER B 1 56 ? -25.727 -21.035 47.999 1.00 134.16 ? 56 SER E CA 1 ATOM 2037 C C . SER B 1 56 ? -24.578 -21.388 47.064 1.00 124.79 ? 56 SER E C 1 ATOM 2038 O O . SER B 1 56 ? -24.784 -21.688 45.882 1.00 119.71 ? 56 SER E O 1 ATOM 2039 C CB . SER B 1 56 ? -25.914 -22.113 49.089 1.00 135.77 ? 56 SER E CB 1 ATOM 2040 O OG . SER B 1 56 ? -26.254 -23.363 48.515 1.00 129.84 ? 56 SER E OG 1 ATOM 2041 N N . THR B 1 57 ? -23.371 -21.335 47.613 1.00 123.34 ? 57 THR E N 1 ATOM 2042 C CA . THR B 1 57 ? -22.144 -21.597 46.891 1.00 115.68 ? 57 THR E CA 1 ATOM 2043 C C . THR B 1 57 ? -21.300 -22.638 47.603 1.00 113.18 ? 57 THR E C 1 ATOM 2044 O O . THR B 1 57 ? -21.346 -22.759 48.823 1.00 118.36 ? 57 THR E O 1 ATOM 2045 C CB . THR B 1 57 ? -21.268 -20.343 46.847 1.00 117.07 ? 57 THR E CB 1 ATOM 2046 O OG1 . THR B 1 57 ? -21.182 -19.782 48.162 1.00 124.48 ? 57 THR E OG1 1 ATOM 2047 C CG2 . THR B 1 57 ? -21.845 -19.316 45.892 1.00 118.32 ? 57 THR E CG2 1 ATOM 2048 N N . ASP B 1 58 ? -20.485 -23.351 46.837 1.00 105.99 ? 58 ASP E N 1 ATOM 2049 C CA . ASP B 1 58 ? -19.551 -24.315 47.409 1.00 103.74 ? 58 ASP E CA 1 ATOM 2050 C C . ASP B 1 58 ? -18.222 -24.214 46.706 1.00 98.63 ? 58 ASP E C 1 ATOM 2051 O O . ASP B 1 58 ? -18.176 -24.143 45.482 1.00 94.04 ? 58 ASP E O 1 ATOM 2052 C CB . ASP B 1 58 ? -20.089 -25.735 47.305 1.00 100.64 ? 58 ASP E CB 1 ATOM 2053 C CG . ASP B 1 58 ? -21.167 -26.008 48.331 1.00 106.54 ? 58 ASP E CG 1 ATOM 2054 O OD1 . ASP B 1 58 ? -22.271 -25.444 48.190 1.00 110.05 ? 58 ASP E OD1 1 ATOM 2055 O OD2 . ASP B 1 58 ? -20.904 -26.768 49.286 1.00 108.30 ? 58 ASP E OD2 1 ATOM 2056 N N . TYR B 1 59 ? -17.148 -24.243 47.486 1.00 100.14 ? 59 TYR E N 1 ATOM 2057 C CA . TYR B 1 59 ? -15.828 -23.902 46.993 1.00 97.17 ? 59 TYR E CA 1 ATOM 2058 C C . TYR B 1 59 ? -14.819 -24.994 47.303 1.00 95.10 ? 59 TYR E C 1 ATOM 2059 O O . TYR B 1 59 ? -14.891 -25.637 48.352 1.00 98.35 ? 59 TYR E O 1 ATOM 2060 C CB . TYR B 1 59 ? -15.351 -22.602 47.630 1.00 102.57 ? 59 TYR E CB 1 ATOM 2061 C CG . TYR B 1 59 ? -16.223 -21.400 47.348 1.00 105.60 ? 59 TYR E CG 1 ATOM 2062 C CD1 . TYR B 1 59 ? -16.369 -20.908 46.054 1.00 101.68 ? 59 TYR E CD1 1 ATOM 2063 C CD2 . TYR B 1 59 ? -16.882 -20.736 48.380 1.00 113.16 ? 59 TYR E CD2 1 ATOM 2064 C CE1 . TYR B 1 59 ? -17.154 -19.795 45.792 1.00 105.11 ? 59 TYR E CE1 1 ATOM 2065 C CE2 . TYR B 1 59 ? -17.669 -19.624 48.128 1.00 116.71 ? 59 TYR E CE2 1 ATOM 2066 C CZ . TYR B 1 59 ? -17.802 -19.155 46.838 1.00 112.64 ? 59 TYR E CZ 1 ATOM 2067 O OH . TYR B 1 59 ? -18.587 -18.053 46.596 1.00 116.80 ? 59 TYR E OH 1 ATOM 2068 N N . ASN B 1 60 ? -13.898 -25.210 46.361 1.00 90.19 ? 60 ASN E N 1 ATOM 2069 C CA . ASN B 1 60 ? -12.706 -26.018 46.590 1.00 89.15 ? 60 ASN E CA 1 ATOM 2070 C C . ASN B 1 60 ? -11.983 -25.474 47.827 1.00 95.35 ? 60 ASN E C 1 ATOM 2071 O O . ASN B 1 60 ? -11.659 -24.285 47.882 1.00 97.80 ? 60 ASN E O 1 ATOM 2072 C CB . ASN B 1 60 ? -11.805 -25.947 45.356 1.00 84.27 ? 60 ASN E CB 1 ATOM 2073 C CG . ASN B 1 60 ? -10.572 -26.834 45.465 1.00 83.61 ? 60 ASN E CG 1 ATOM 2074 O OD1 . ASN B 1 60 ? -10.020 -27.033 46.549 1.00 87.99 ? 60 ASN E OD1 1 ATOM 2075 N ND2 . ASN B 1 60 ? -10.128 -27.365 44.331 1.00 78.97 ? 60 ASN E ND2 1 ATOM 2076 N N . ALA B 1 61 ? -11.727 -26.347 48.803 1.00 98.34 ? 61 ALA E N 1 ATOM 2077 C CA . ALA B 1 61 ? -11.173 -25.947 50.112 1.00 105.54 ? 61 ALA E CA 1 ATOM 2078 C C . ALA B 1 61 ? -9.904 -25.102 49.997 1.00 106.87 ? 61 ALA E C 1 ATOM 2079 O O . ALA B 1 61 ? -9.648 -24.229 50.834 1.00 112.81 ? 61 ALA E O 1 ATOM 2080 C CB . ALA B 1 61 ? -10.887 -27.175 50.959 1.00 107.99 ? 61 ALA E CB 1 ATOM 2081 N N . ALA B 1 62 ? -9.109 -25.374 48.965 1.00 101.82 ? 62 ALA E N 1 ATOM 2082 C CA . ALA B 1 62 ? -7.871 -24.636 48.714 1.00 102.68 ? 62 ALA E CA 1 ATOM 2083 C C . ALA B 1 62 ? -8.082 -23.213 48.186 1.00 102.28 ? 62 ALA E C 1 ATOM 2084 O O . ALA B 1 62 ? -7.124 -22.462 48.063 1.00 103.66 ? 62 ALA E O 1 ATOM 2085 C CB . ALA B 1 62 ? -7.003 -25.407 47.739 1.00 97.87 ? 62 ALA E CB 1 ATOM 2086 N N . PHE B 1 63 ? -9.311 -22.855 47.832 1.00 100.85 ? 63 PHE E N 1 ATOM 2087 C CA . PHE B 1 63 ? -9.611 -21.517 47.328 1.00 101.10 ? 63 PHE E CA 1 ATOM 2088 C C . PHE B 1 63 ? -10.502 -20.700 48.239 1.00 107.17 ? 63 PHE E C 1 ATOM 2089 O O . PHE B 1 63 ? -10.687 -19.503 48.017 1.00 108.80 ? 63 PHE E O 1 ATOM 2090 C CB . PHE B 1 63 ? -10.188 -21.647 45.931 1.00 94.85 ? 63 PHE E CB 1 ATOM 2091 C CG . PHE B 1 63 ? -9.202 -22.199 44.958 1.00 90.03 ? 63 PHE E CG 1 ATOM 2092 C CD1 . PHE B 1 63 ? -8.931 -23.562 44.919 1.00 87.71 ? 63 PHE E CD1 1 ATOM 2093 C CD2 . PHE B 1 63 ? -8.496 -21.353 44.130 1.00 88.51 ? 63 PHE E CD2 1 ATOM 2094 C CE1 . PHE B 1 63 ? -7.996 -24.072 44.043 1.00 84.23 ? 63 PHE E CE1 1 ATOM 2095 C CE2 . PHE B 1 63 ? -7.564 -21.857 43.244 1.00 84.87 ? 63 PHE E CE2 1 ATOM 2096 C CZ . PHE B 1 63 ? -7.313 -23.219 43.201 1.00 82.91 ? 63 PHE E CZ 1 ATOM 2097 N N . ILE B 1 64 ? -11.027 -21.348 49.276 1.00 111.14 ? 64 ILE E N 1 ATOM 2098 C CA . ILE B 1 64 ? -11.516 -20.643 50.428 1.00 118.96 ? 64 ILE E CA 1 ATOM 2099 C C . ILE B 1 64 ? -10.229 -20.006 50.933 1.00 122.81 ? 64 ILE E C 1 ATOM 2100 O O . ILE B 1 64 ? -9.213 -20.698 50.976 1.00 121.45 ? 64 ILE E O 1 ATOM 2101 C CB . ILE B 1 64 ? -12.106 -21.613 51.479 1.00 122.77 ? 64 ILE E CB 1 ATOM 2102 C CG1 . ILE B 1 64 ? -13.536 -22.020 51.098 1.00 120.60 ? 64 ILE E CG1 1 ATOM 2103 C CG2 . ILE B 1 64 ? -12.093 -21.011 52.877 1.00 132.26 ? 64 ILE E CG2 1 ATOM 2104 C CD1 . ILE B 1 64 ? -14.070 -23.201 51.885 1.00 122.54 ? 64 ILE E CD1 1 ATOM 2105 N N . SER B 1 65 ? -10.197 -18.722 51.278 1.00 127.90 ? 65 SER E N 1 ATOM 2106 C CA . SER B 1 65 ? -11.234 -17.725 51.081 1.00 129.89 ? 65 SER E CA 1 ATOM 2107 C C . SER B 1 65 ? -10.620 -16.619 50.219 1.00 127.79 ? 65 SER E C 1 ATOM 2108 O O . SER B 1 65 ? -10.586 -15.457 50.636 1.00 133.13 ? 65 SER E O 1 ATOM 2109 C CB . SER B 1 65 ? -11.703 -17.113 52.435 1.00 139.76 ? 65 SER E CB 1 ATOM 2110 O OG . SER B 1 65 ? -11.988 -18.112 53.395 1.00 142.99 ? 65 SER E OG 1 ATOM 2111 N N . ARG B 1 66 ? -10.120 -16.973 49.033 1.00 120.48 ? 66 ARG E N 1 ATOM 2112 C CA . ARG B 1 66 ? -9.844 -15.949 48.029 1.00 118.07 ? 66 ARG E CA 1 ATOM 2113 C C . ARG B 1 66 ? -10.691 -16.110 46.767 1.00 112.32 ? 66 ARG E C 1 ATOM 2114 O O . ARG B 1 66 ? -10.331 -15.578 45.716 1.00 108.89 ? 66 ARG E O 1 ATOM 2115 C CB . ARG B 1 66 ? -8.370 -15.900 47.647 1.00 115.77 ? 66 ARG E CB 1 ATOM 2116 C CG . ARG B 1 66 ? -7.797 -17.213 47.153 1.00 110.32 ? 66 ARG E CG 1 ATOM 2117 C CD . ARG B 1 66 ? -6.497 -16.961 46.401 1.00 107.61 ? 66 ARG E CD 1 ATOM 2118 N NE . ARG B 1 66 ? -6.392 -17.758 45.188 1.00 100.83 ? 66 ARG E NE 1 ATOM 2119 C CZ . ARG B 1 66 ? -5.286 -18.280 44.673 1.00 98.47 ? 66 ARG E CZ 1 ATOM 2120 N NH1 . ARG B 1 66 ? -4.111 -18.163 45.264 1.00 102.22 ? 66 ARG E NH1 1 ATOM 2121 N NH2 . ARG B 1 66 ? -5.386 -18.968 43.550 1.00 93.13 ? 66 ARG E NH2 1 ATOM 2122 N N . LEU B 1 67 ? -11.803 -16.839 46.863 1.00 111.86 ? 67 LEU E N 1 ATOM 2123 C CA . LEU B 1 67 ? -12.677 -17.040 45.725 1.00 107.33 ? 67 LEU E CA 1 ATOM 2124 C C . LEU B 1 67 ? -14.134 -16.800 46.105 1.00 111.65 ? 67 LEU E C 1 ATOM 2125 O O . LEU B 1 67 ? -14.628 -17.371 47.077 1.00 115.11 ? 67 LEU E O 1 ATOM 2126 C CB . LEU B 1 67 ? -12.512 -18.465 45.191 1.00 101.26 ? 67 LEU E CB 1 ATOM 2127 C CG . LEU B 1 67 ? -12.993 -18.791 43.771 1.00 95.47 ? 67 LEU E CG 1 ATOM 2128 C CD1 . LEU B 1 67 ? -14.279 -19.587 43.741 1.00 94.90 ? 67 LEU E CD1 1 ATOM 2129 C CD2 . LEU B 1 67 ? -13.157 -17.556 42.909 1.00 95.75 ? 67 LEU E CD2 1 ATOM 2130 N N . SER B 1 68 ? -14.813 -15.947 45.342 1.00 112.15 ? 68 SER E N 1 ATOM 2131 C CA . SER B 1 68 ? -16.254 -15.784 45.470 1.00 116.10 ? 68 SER E CA 1 ATOM 2132 C C . SER B 1 68 ? -16.929 -15.829 44.106 1.00 112.24 ? 68 SER E C 1 ATOM 2133 O O . SER B 1 68 ? -16.489 -15.178 43.155 1.00 109.79 ? 68 SER E O 1 ATOM 2134 C CB . SER B 1 68 ? -16.602 -14.471 46.174 1.00 124.13 ? 68 SER E CB 1 ATOM 2135 O OG . SER B 1 68 ? -16.399 -13.360 45.320 1.00 123.80 ? 68 SER E OG 1 ATOM 2136 N N . ILE B 1 69 ? -18.003 -16.608 44.036 1.00 112.23 ? 69 ILE E N 1 ATOM 2137 C CA . ILE B 1 69 ? -18.838 -16.706 42.853 1.00 110.17 ? 69 ILE E CA 1 ATOM 2138 C C . ILE B 1 69 ? -20.192 -16.124 43.202 1.00 117.43 ? 69 ILE E C 1 ATOM 2139 O O . ILE B 1 69 ? -20.708 -16.400 44.283 1.00 121.98 ? 69 ILE E O 1 ATOM 2140 C CB . ILE B 1 69 ? -19.028 -18.175 42.440 1.00 104.72 ? 69 ILE E CB 1 ATOM 2141 C CG1 . ILE B 1 69 ? -17.675 -18.816 42.115 1.00 98.47 ? 69 ILE E CG1 1 ATOM 2142 C CG2 . ILE B 1 69 ? -19.959 -18.275 41.240 1.00 103.41 ? 69 ILE E CG2 1 ATOM 2143 C CD1 . ILE B 1 69 ? -17.659 -20.322 42.237 1.00 94.52 ? 69 ILE E CD1 1 ATOM 2144 N N . SER B 1 70 ? -20.855 -15.446 42.244 1.00 119.38 ? 70 SER E N 1 ATOM 2145 C CA . SER B 1 70 ? -22.148 -14.750 42.495 1.00 127.42 ? 70 SER E CA 1 ATOM 2146 C C . SER B 1 70 ? -23.204 -14.476 41.362 1.00 128.41 ? 70 SER E C 1 ATOM 2147 O O . SER B 1 70 ? -22.949 -14.636 40.167 1.00 122.58 ? 70 SER E O 1 ATOM 2148 C CB . SER B 1 70 ? -21.926 -13.489 43.336 1.00 134.38 ? 70 SER E CB 1 ATOM 2149 O OG . SER B 1 70 ? -22.179 -12.303 42.595 1.00 133.82 ? 70 SER E OG 1 ATOM 2150 N N . LYS B 1 71 ? -24.366 -13.987 41.813 1.00 136.93 ? 71 LYS E N 1 ATOM 2151 C CA . LYS B 1 71 ? -25.739 -14.066 41.252 1.00 140.66 ? 71 LYS E CA 1 ATOM 2152 C C . LYS B 1 71 ? -26.219 -13.317 39.985 1.00 141.71 ? 71 LYS E C 1 ATOM 2153 O O . LYS B 1 71 ? -25.656 -12.298 39.613 1.00 140.07 ? 71 LYS E O 1 ATOM 2154 C CB . LYS B 1 71 ? -26.703 -13.657 42.361 1.00 150.67 ? 71 LYS E CB 1 ATOM 2155 C CG . LYS B 1 71 ? -26.670 -12.175 42.679 1.00 158.31 ? 71 LYS E CG 1 ATOM 2156 C CD . LYS B 1 71 ? -28.050 -11.650 43.025 1.00 169.05 ? 71 LYS E CD 1 ATOM 2157 C CE . LYS B 1 71 ? -27.972 -10.212 43.520 1.00 177.00 ? 71 LYS E CE 1 ATOM 2158 N NZ . LYS B 1 71 ? -29.177 -9.769 44.275 1.00 188.73 ? 71 LYS E NZ 1 ATOM 2159 N N . ASP B 1 72 ? -27.297 -13.832 39.368 1.00 144.96 ? 72 ASP E N 1 ATOM 2160 C CA . ASP B 1 72 ? -27.903 -13.287 38.131 1.00 149.01 ? 72 ASP E CA 1 ATOM 2161 C C . ASP B 1 72 ? -28.915 -12.134 38.339 1.00 160.44 ? 72 ASP E C 1 ATOM 2162 O O . ASP B 1 72 ? -30.138 -12.308 38.351 1.00 165.36 ? 72 ASP E O 1 ATOM 2163 C CB . ASP B 1 72 ? -28.425 -14.427 37.206 1.00 145.84 ? 72 ASP E CB 1 ATOM 2164 C CG . ASP B 1 72 ? -29.898 -14.836 37.468 1.00 153.17 ? 72 ASP E CG 1 ATOM 2165 O OD1 . ASP B 1 72 ? -30.782 -14.448 36.660 1.00 154.22 ? 72 ASP E OD1 1 ATOM 2166 O OD2 . ASP B 1 72 ? -30.188 -15.522 38.479 1.00 158.27 ? 72 ASP E OD2 1 ATOM 2167 N N . ASN B 1 73 ? -28.390 -10.938 38.568 1.00 164.97 ? 73 ASN E N 1 ATOM 2168 C CA . ASN B 1 73 ? -29.262 -9.779 38.732 1.00 176.55 ? 73 ASN E CA 1 ATOM 2169 C C . ASN B 1 73 ? -30.015 -9.395 37.465 1.00 180.32 ? 73 ASN E C 1 ATOM 2170 O O . ASN B 1 73 ? -31.182 -9.043 37.510 1.00 186.83 ? 73 ASN E O 1 ATOM 2171 C CB . ASN B 1 73 ? -28.512 -8.601 39.335 1.00 180.36 ? 73 ASN E CB 1 ATOM 2172 C CG . ASN B 1 73 ? -28.282 -8.773 40.824 1.00 185.85 ? 73 ASN E CG 1 ATOM 2173 O OD1 . ASN B 1 73 ? -27.144 -8.805 41.295 1.00 182.58 ? 73 ASN E OD1 1 ATOM 2174 N ND2 . ASN B 1 73 ? -29.367 -8.905 41.572 1.00 194.80 ? 73 ASN E ND2 1 ATOM 2175 N N . SER B 1 74 ? -29.326 -9.473 36.337 1.00 176.42 ? 74 SER E N 1 ATOM 2176 C CA . SER B 1 74 ? -29.841 -9.020 35.056 1.00 180.00 ? 74 SER E CA 1 ATOM 2177 C C . SER B 1 74 ? -29.439 -9.988 33.957 1.00 170.15 ? 74 SER E C 1 ATOM 2178 O O . SER B 1 74 ? -28.566 -10.821 34.148 1.00 161.67 ? 74 SER E O 1 ATOM 2179 C CB . SER B 1 74 ? -29.334 -7.611 34.737 1.00 187.63 ? 74 SER E CB 1 ATOM 2180 O OG . SER B 1 74 ? -27.926 -7.590 34.555 1.00 181.50 ? 74 SER E OG 1 ATOM 2181 N N . LYS B 1 75 ? -30.136 -9.929 32.832 1.00 172.04 ? 75 LYS E N 1 ATOM 2182 C CA . LYS B 1 75 ? -29.719 -10.667 31.659 1.00 163.91 ? 75 LYS E CA 1 ATOM 2183 C C . LYS B 1 75 ? -29.551 -12.147 32.006 1.00 156.72 ? 75 LYS E C 1 ATOM 2184 O O . LYS B 1 75 ? -30.444 -12.735 32.600 1.00 160.53 ? 75 LYS E O 1 ATOM 2185 C CB . LYS B 1 75 ? -28.428 -10.071 31.114 1.00 158.64 ? 75 LYS E CB 1 ATOM 2186 C CG . LYS B 1 75 ? -28.596 -8.741 30.410 1.00 165.19 ? 75 LYS E CG 1 ATOM 2187 C CD . LYS B 1 75 ? -27.727 -8.700 29.168 1.00 159.12 ? 75 LYS E CD 1 ATOM 2188 C CE . LYS B 1 75 ? -28.528 -8.992 27.914 1.00 165.29 ? 75 LYS E CE 1 ATOM 2189 N NZ . LYS B 1 75 ? -27.820 -9.953 27.033 1.00 176.08 ? 75 LYS E NZ 1 ATOM 2190 N N . SER B 1 76 ? -28.419 -12.750 31.634 1.00 147.12 ? 76 SER E N 1 ATOM 2191 C CA . SER B 1 76 ? -28.153 -14.146 31.961 1.00 140.03 ? 76 SER E CA 1 ATOM 2192 C C . SER B 1 76 ? -26.747 -14.388 32.528 1.00 131.70 ? 76 SER E C 1 ATOM 2193 O O . SER B 1 76 ? -25.931 -15.048 31.881 1.00 124.64 ? 76 SER E O 1 ATOM 2194 C CB . SER B 1 76 ? -28.360 -14.965 30.700 1.00 138.59 ? 76 SER E CB 1 ATOM 2195 O OG . SER B 1 76 ? -28.901 -14.150 29.677 1.00 139.13 ? 76 SER E OG 1 ATOM 2196 N N . HIS B 1 77 ? -26.485 -13.896 33.746 1.00 133.29 ? 77 HIS E N 1 ATOM 2197 C CA . HIS B 1 77 ? -25.122 -13.678 34.252 1.00 127.55 ? 77 HIS E CA 1 ATOM 2198 C C . HIS B 1 77 ? -24.648 -14.370 35.526 1.00 124.08 ? 77 HIS E C 1 ATOM 2199 O O . HIS B 1 77 ? -25.293 -14.276 36.573 1.00 128.76 ? 77 HIS E O 1 ATOM 2200 C CB . HIS B 1 77 ? -24.904 -12.185 34.483 1.00 132.41 ? 77 HIS E CB 1 ATOM 2201 C CG . HIS B 1 77 ? -25.091 -11.352 33.261 1.00 134.94 ? 77 HIS E CG 1 ATOM 2202 N ND1 . HIS B 1 77 ? -25.211 -9.982 33.310 1.00 142.25 ? 77 HIS E ND1 1 ATOM 2203 C CD2 . HIS B 1 77 ? -25.180 -11.692 31.957 1.00 131.85 ? 77 HIS E CD2 1 ATOM 2204 C CE1 . HIS B 1 77 ? -25.375 -9.515 32.087 1.00 143.40 ? 77 HIS E CE1 1 ATOM 2205 N NE2 . HIS B 1 77 ? -25.360 -10.532 31.249 1.00 137.31 ? 77 HIS E NE2 1 ATOM 2206 N N . VAL B 1 78 ? -23.463 -14.977 35.451 1.00 116.47 ? 78 VAL E N 1 ATOM 2207 C CA . VAL B 1 78 ? -22.762 -15.477 36.638 1.00 113.37 ? 78 VAL E CA 1 ATOM 2208 C C . VAL B 1 78 ? -21.386 -14.844 36.768 1.00 110.61 ? 78 VAL E C 1 ATOM 2209 O O . VAL B 1 78 ? -20.707 -14.645 35.769 1.00 106.36 ? 78 VAL E O 1 ATOM 2210 C CB . VAL B 1 78 ? -22.567 -16.993 36.609 1.00 107.25 ? 78 VAL E CB 1 ATOM 2211 C CG1 . VAL B 1 78 ? -22.311 -17.511 38.007 1.00 105.25 ? 78 VAL E CG1 1 ATOM 2212 C CG2 . VAL B 1 78 ? -23.761 -17.667 35.976 1.00 109.81 ? 78 VAL E CG2 1 ATOM 2213 N N . PHE B 1 79 ? -20.981 -14.522 37.993 1.00 113.57 ? 79 PHE E N 1 ATOM 2214 C CA . PHE B 1 79 ? -19.751 -13.778 38.215 1.00 112.83 ? 79 PHE E CA 1 ATOM 2215 C C . PHE B 1 79 ? -18.698 -14.496 39.069 1.00 108.80 ? 79 PHE E C 1 ATOM 2216 O O . PHE B 1 79 ? -18.948 -14.790 40.235 1.00 111.60 ? 79 PHE E O 1 ATOM 2217 C CB . PHE B 1 79 ? -20.114 -12.449 38.874 1.00 120.46 ? 79 PHE E CB 1 ATOM 2218 C CG . PHE B 1 79 ? -20.891 -11.525 37.984 1.00 126.18 ? 79 PHE E CG 1 ATOM 2219 C CD1 . PHE B 1 79 ? -21.506 -11.995 36.838 1.00 124.11 ? 79 PHE E CD1 1 ATOM 2220 C CD2 . PHE B 1 79 ? -21.000 -10.179 38.284 1.00 134.63 ? 79 PHE E CD2 1 ATOM 2221 C CE1 . PHE B 1 79 ? -22.216 -11.154 36.004 1.00 130.33 ? 79 PHE E CE1 1 ATOM 2222 C CE2 . PHE B 1 79 ? -21.706 -9.330 37.448 1.00 140.86 ? 79 PHE E CE2 1 ATOM 2223 C CZ . PHE B 1 79 ? -22.311 -9.818 36.306 1.00 138.71 ? 79 PHE E CZ 1 ATOM 2224 N N . PHE B 1 80 ? -17.502 -14.694 38.497 1.00 103.03 ? 80 PHE E N 1 ATOM 2225 C CA . PHE B 1 80 ? -16.373 -15.380 39.128 1.00 99.44 ? 80 PHE E CA 1 ATOM 2226 C C . PHE B 1 80 ? -15.378 -14.315 39.542 1.00 101.55 ? 80 PHE E C 1 ATOM 2227 O O . PHE B 1 80 ? -15.122 -13.382 38.782 1.00 101.83 ? 80 PHE E O 1 ATOM 2228 C CB . PHE B 1 80 ? -15.741 -16.355 38.131 1.00 92.80 ? 80 PHE E CB 1 ATOM 2229 C CG . PHE B 1 80 ? -14.463 -16.999 38.603 1.00 89.49 ? 80 PHE E CG 1 ATOM 2230 C CD1 . PHE B 1 80 ? -13.257 -16.332 38.497 1.00 89.09 ? 80 PHE E CD1 1 ATOM 2231 C CD2 . PHE B 1 80 ? -14.463 -18.290 39.111 1.00 87.32 ? 80 PHE E CD2 1 ATOM 2232 C CE1 . PHE B 1 80 ? -12.080 -16.929 38.918 1.00 87.09 ? 80 PHE E CE1 1 ATOM 2233 C CE2 . PHE B 1 80 ? -13.290 -18.897 39.529 1.00 85.17 ? 80 PHE E CE2 1 ATOM 2234 C CZ . PHE B 1 80 ? -12.097 -18.216 39.431 1.00 85.27 ? 80 PHE E CZ 1 ATOM 2235 N N . LYS B 1 81 ? -14.818 -14.453 40.740 1.00 103.48 ? 81 LYS E N 1 ATOM 2236 C CA . LYS B 1 81 ? -13.886 -13.458 41.254 1.00 106.45 ? 81 LYS E CA 1 ATOM 2237 C C . LYS B 1 81 ? -12.881 -14.067 42.236 1.00 106.26 ? 81 LYS E C 1 ATOM 2238 O O . LYS B 1 81 ? -13.264 -14.567 43.292 1.00 109.16 ? 81 LYS E O 1 ATOM 2239 C CB . LYS B 1 81 ? -14.666 -12.309 41.906 1.00 113.89 ? 81 LYS E CB 1 ATOM 2240 C CG . LYS B 1 81 ? -13.878 -11.522 42.948 1.00 118.42 ? 81 LYS E CG 1 ATOM 2241 C CD . LYS B 1 81 ? -14.402 -10.094 43.171 1.00 125.27 ? 81 LYS E CD 1 ATOM 2242 C CE . LYS B 1 81 ? -13.649 -9.077 42.316 1.00 123.95 ? 81 LYS E CE 1 ATOM 2243 N NZ . LYS B 1 81 ? -13.867 -7.673 42.780 1.00 131.28 ? 81 LYS E NZ 1 ATOM 2244 N N . MET B 1 82 ? -11.599 -13.991 41.888 1.00 103.62 ? 82 MET E N 1 ATOM 2245 C CA . MET B 1 82 ? -10.530 -14.580 42.692 1.00 103.77 ? 82 MET E CA 1 ATOM 2246 C C . MET B 1 82 ? -9.484 -13.520 43.028 1.00 107.06 ? 82 MET E C 1 ATOM 2247 O O . MET B 1 82 ? -9.098 -12.733 42.164 1.00 105.77 ? 82 MET E O 1 ATOM 2248 C CB . MET B 1 82 ? -9.887 -15.733 41.928 1.00 97.81 ? 82 MET E CB 1 ATOM 2249 C CG . MET B 1 82 ? -8.978 -16.616 42.767 1.00 98.22 ? 82 MET E CG 1 ATOM 2250 S SD . MET B 1 82 ? -8.690 -18.223 41.989 1.00 92.50 ? 82 MET E SD 1 ATOM 2251 C CE . MET B 1 82 ? -7.298 -17.862 40.925 1.00 89.78 ? 82 MET E CE 1 ATOM 2252 N N . ASN B 1 83 A -9.035 -13.499 44.281 1.00 111.72 ? 82 ASN E N 1 ATOM 2253 C CA . ASN B 1 83 A -8.186 -12.378 44.775 1.00 116.40 ? 82 ASN E CA 1 ATOM 2254 C C . ASN B 1 83 A -6.652 -12.232 44.627 1.00 115.59 ? 82 ASN E C 1 ATOM 2255 O O . ASN B 1 83 A -6.201 -11.161 44.215 1.00 116.34 ? 82 ASN E O 1 ATOM 2256 C CB . ASN B 1 83 A -8.589 -12.056 46.220 1.00 123.97 ? 82 ASN E CB 1 ATOM 2257 C CG . ASN B 1 83 A -9.921 -11.332 46.294 1.00 127.72 ? 82 ASN E CG 1 ATOM 2258 O OD1 . ASN B 1 83 A -10.349 -10.695 45.329 1.00 125.89 ? 82 ASN E OD1 1 ATOM 2259 N ND2 . ASN B 1 83 A -10.583 -11.424 47.438 1.00 133.74 ? 82 ASN E ND2 1 ATOM 2260 N N . SER B 1 84 B -5.859 -13.234 44.983 1.00 114.80 ? 82 SER E N 1 ATOM 2261 C CA . SER B 1 84 B -4.404 -13.046 45.103 1.00 116.19 ? 82 SER E CA 1 ATOM 2262 C C . SER B 1 84 B -3.704 -13.928 44.086 1.00 110.57 ? 82 SER E C 1 ATOM 2263 O O . SER B 1 84 B -3.116 -14.949 44.453 1.00 110.48 ? 82 SER E O 1 ATOM 2264 C CB . SER B 1 84 B -3.931 -13.401 46.523 1.00 122.02 ? 82 SER E CB 1 ATOM 2265 O OG . SER B 1 84 B -4.836 -12.911 47.494 1.00 127.41 ? 82 SER E OG 1 ATOM 2266 N N . LEU B 1 85 C -3.768 -13.562 42.806 1.00 106.66 ? 82 LEU E N 1 ATOM 2267 C CA . LEU B 1 85 C -3.258 -14.470 41.788 1.00 101.77 ? 82 LEU E CA 1 ATOM 2268 C C . LEU B 1 85 C -1.731 -14.451 41.721 1.00 103.01 ? 82 LEU E C 1 ATOM 2269 O O . LEU B 1 85 C -1.105 -13.409 41.869 1.00 105.58 ? 82 LEU E O 1 ATOM 2270 C CB . LEU B 1 85 C -3.867 -14.183 40.420 1.00 97.43 ? 82 LEU E CB 1 ATOM 2271 C CG . LEU B 1 85 C -5.249 -14.800 40.207 1.00 95.15 ? 82 LEU E CG 1 ATOM 2272 C CD1 . LEU B 1 85 C -6.310 -13.992 40.933 1.00 99.01 ? 82 LEU E CD1 1 ATOM 2273 C CD2 . LEU B 1 85 C -5.587 -14.892 38.730 1.00 90.77 ? 82 LEU E CD2 1 ATOM 2274 N N . GLN B 1 86 ? -1.157 -15.631 41.507 1.00 101.61 ? 83 GLN E N 1 ATOM 2275 C CA . GLN B 1 86 ? 0.292 -15.816 41.450 1.00 103.50 ? 83 GLN E CA 1 ATOM 2276 C C . GLN B 1 86 ? 0.601 -16.750 40.294 1.00 99.25 ? 83 GLN E C 1 ATOM 2277 O O . GLN B 1 86 ? -0.295 -17.410 39.786 1.00 95.50 ? 83 GLN E O 1 ATOM 2278 C CB . GLN B 1 86 ? 0.805 -16.469 42.732 1.00 108.32 ? 83 GLN E CB 1 ATOM 2279 C CG . GLN B 1 86 ? 0.418 -15.757 44.017 1.00 113.57 ? 83 GLN E CG 1 ATOM 2280 C CD . GLN B 1 86 ? 1.053 -14.386 44.179 1.00 117.31 ? 83 GLN E CD 1 ATOM 2281 O OE1 . GLN B 1 86 ? 2.024 -14.050 43.505 1.00 116.90 ? 83 GLN E OE1 1 ATOM 2282 N NE2 . GLN B 1 86 ? 0.510 -13.593 45.095 1.00 121.50 ? 83 GLN E NE2 1 ATOM 2283 N N . ALA B 1 87 ? 1.874 -16.872 39.942 1.00 100.98 ? 84 ALA E N 1 ATOM 2284 C CA . ALA B 1 87 ? 2.297 -17.577 38.729 1.00 98.29 ? 84 ALA E CA 1 ATOM 2285 C C . ALA B 1 87 ? 1.492 -18.853 38.472 1.00 95.50 ? 84 ALA E C 1 ATOM 2286 O O . ALA B 1 87 ? 0.972 -19.051 37.380 1.00 91.21 ? 84 ALA E O 1 ATOM 2287 C CB . ALA B 1 87 ? 3.789 -17.888 38.793 1.00 102.04 ? 84 ALA E CB 1 ATOM 2288 N N . ASN B 1 88 ? 1.364 -19.696 39.492 1.00 98.47 ? 85 ASN E N 1 ATOM 2289 C CA . ASN B 1 88 ? 0.656 -20.968 39.356 1.00 96.58 ? 85 ASN E CA 1 ATOM 2290 C C . ASN B 1 88 ? -0.873 -20.860 39.301 1.00 90.31 ? 85 ASN E C 1 ATOM 2291 O O . ASN B 1 88 ? -1.545 -21.874 39.357 1.00 87.54 ? 85 ASN E O 1 ATOM 2292 C CB . ASN B 1 88 ? 1.089 -21.957 40.459 1.00 103.94 ? 85 ASN E CB 1 ATOM 2293 C CG . ASN B 1 88 ? 0.791 -21.468 41.871 1.00 113.24 ? 85 ASN E CG 1 ATOM 2294 O OD1 . ASN B 1 88 ? 0.152 -20.434 42.079 1.00 112.31 ? 85 ASN E OD1 1 ATOM 2295 N ND2 . ASN B 1 88 ? 1.269 -22.232 42.861 1.00 126.53 ? 85 ASN E ND2 1 ATOM 2296 N N . ASP B 1 89 ? -1.411 -19.642 39.226 1.00 87.78 ? 86 ASP E N 1 ATOM 2297 C CA . ASP B 1 89 ? -2.810 -19.436 38.885 1.00 83.55 ? 86 ASP E CA 1 ATOM 2298 C C . ASP B 1 89 ? -3.027 -19.231 37.391 1.00 79.06 ? 86 ASP E C 1 ATOM 2299 O O . ASP B 1 89 ? -4.159 -19.048 36.953 1.00 77.10 ? 86 ASP E O 1 ATOM 2300 C CB . ASP B 1 89 ? -3.395 -18.267 39.680 1.00 86.17 ? 86 ASP E CB 1 ATOM 2301 C CG . ASP B 1 89 ? -3.437 -18.557 41.164 1.00 89.96 ? 86 ASP E CG 1 ATOM 2302 O OD1 . ASP B 1 89 ? -3.792 -19.697 41.525 1.00 88.89 ? 86 ASP E OD1 1 ATOM 2303 O OD2 . ASP B 1 89 ? -3.101 -17.668 41.976 1.00 94.02 ? 86 ASP E OD2 1 ATOM 2304 N N . THR B 1 90 ? -1.951 -19.264 36.612 1.00 77.81 ? 87 THR E N 1 ATOM 2305 C CA . THR B 1 90 ? -2.053 -19.220 35.163 1.00 74.44 ? 87 THR E CA 1 ATOM 2306 C C . THR B 1 90 ? -2.794 -20.462 34.687 1.00 71.08 ? 87 THR E C 1 ATOM 2307 O O . THR B 1 90 ? -2.423 -21.582 35.032 1.00 71.15 ? 87 THR E O 1 ATOM 2308 C CB . THR B 1 90 ? -0.662 -19.154 34.499 1.00 75.60 ? 87 THR E CB 1 ATOM 2309 O OG1 . THR B 1 90 ? -0.049 -17.884 34.769 1.00 77.91 ? 87 THR E OG1 1 ATOM 2310 C CG2 . THR B 1 90 ? -0.751 -19.339 32.985 1.00 73.45 ? 87 THR E CG2 1 ATOM 2311 N N . ALA B 1 91 ? -3.853 -20.250 33.911 1.00 68.44 ? 88 ALA E N 1 ATOM 2312 C CA . ALA B 1 91 ? -4.715 -21.338 33.456 1.00 65.61 ? 88 ALA E CA 1 ATOM 2313 C C . ALA B 1 91 ? -5.790 -20.812 32.525 1.00 64.07 ? 88 ALA E C 1 ATOM 2314 O O . ALA B 1 91 ? -5.983 -19.596 32.401 1.00 65.11 ? 88 ALA E O 1 ATOM 2315 C CB . ALA B 1 91 ? -5.381 -22.011 34.651 1.00 65.71 ? 88 ALA E CB 1 ATOM 2316 N N . ILE B 1 92 ? -6.492 -21.748 31.887 1.00 61.90 ? 89 ILE E N 1 ATOM 2317 C CA . ILE B 1 92 ? -7.730 -21.449 31.196 1.00 61.20 ? 89 ILE E CA 1 ATOM 2318 C C . ILE B 1 92 ? -8.871 -21.680 32.174 1.00 60.99 ? 89 ILE E C 1 ATOM 2319 O O . ILE B 1 92 ? -8.973 -22.751 32.769 1.00 59.79 ? 89 ILE E O 1 ATOM 2320 C CB . ILE B 1 92 ? -7.948 -22.348 29.970 1.00 60.01 ? 89 ILE E CB 1 ATOM 2321 C CG1 . ILE B 1 92 ? -6.769 -22.217 28.999 1.00 60.72 ? 89 ILE E CG1 1 ATOM 2322 C CG2 . ILE B 1 92 ? -9.256 -21.976 29.285 1.00 60.43 ? 89 ILE E CG2 1 ATOM 2323 C CD1 . ILE B 1 92 ? -6.733 -23.277 27.917 1.00 60.41 ? 89 ILE E CD1 1 ATOM 2324 N N . TYR B 1 93 ? -9.718 -20.666 32.326 1.00 62.50 ? 90 TYR E N 1 ATOM 2325 C CA . TYR B 1 93 ? -10.840 -20.709 33.256 1.00 63.55 ? 90 TYR E CA 1 ATOM 2326 C C . TYR B 1 93 ? -12.160 -20.879 32.513 1.00 63.73 ? 90 TYR E C 1 ATOM 2327 O O . TYR B 1 93 ? -12.430 -20.182 31.539 1.00 64.65 ? 90 TYR E O 1 ATOM 2328 C CB . TYR B 1 93 ? -10.866 -19.432 34.106 1.00 66.49 ? 90 TYR E CB 1 ATOM 2329 C CG . TYR B 1 93 ? -9.746 -19.389 35.117 1.00 67.08 ? 90 TYR E CG 1 ATOM 2330 C CD1 . TYR B 1 93 ? -8.449 -19.121 34.728 1.00 66.57 ? 90 TYR E CD1 1 ATOM 2331 C CD2 . TYR B 1 93 ? -9.987 -19.647 36.462 1.00 68.77 ? 90 TYR E CD2 1 ATOM 2332 C CE1 . TYR B 1 93 ? -7.417 -19.092 35.651 1.00 67.94 ? 90 TYR E CE1 1 ATOM 2333 C CE2 . TYR B 1 93 ? -8.965 -19.630 37.391 1.00 70.15 ? 90 TYR E CE2 1 ATOM 2334 C CZ . TYR B 1 93 ? -7.684 -19.351 36.983 1.00 69.78 ? 90 TYR E CZ 1 ATOM 2335 O OH . TYR B 1 93 ? -6.679 -19.326 37.915 1.00 71.95 ? 90 TYR E OH 1 ATOM 2336 N N . TYR B 1 94 ? -12.980 -21.806 32.992 1.00 63.38 ? 91 TYR E N 1 ATOM 2337 C CA . TYR B 1 94 ? -14.265 -22.088 32.373 1.00 64.15 ? 91 TYR E CA 1 ATOM 2338 C C . TYR B 1 94 ? -15.394 -21.964 33.381 1.00 66.89 ? 91 TYR E C 1 ATOM 2339 O O . TYR B 1 94 ? -15.254 -22.426 34.508 1.00 66.81 ? 91 TYR E O 1 ATOM 2340 C CB . TYR B 1 94 ? -14.307 -23.517 31.856 1.00 61.42 ? 91 TYR E CB 1 ATOM 2341 C CG . TYR B 1 94 ? -13.316 -23.895 30.784 1.00 59.58 ? 91 TYR E CG 1 ATOM 2342 C CD1 . TYR B 1 94 ? -13.559 -23.575 29.451 1.00 60.52 ? 91 TYR E CD1 1 ATOM 2343 C CD2 . TYR B 1 94 ? -12.187 -24.648 31.081 1.00 57.69 ? 91 TYR E CD2 1 ATOM 2344 C CE1 . TYR B 1 94 ? -12.686 -23.955 28.448 1.00 59.67 ? 91 TYR E CE1 1 ATOM 2345 C CE2 . TYR B 1 94 ? -11.304 -25.036 30.080 1.00 56.89 ? 91 TYR E CE2 1 ATOM 2346 C CZ . TYR B 1 94 ? -11.561 -24.686 28.765 1.00 57.85 ? 91 TYR E CZ 1 ATOM 2347 O OH . TYR B 1 94 ? -10.712 -25.073 27.761 1.00 57.76 ? 91 TYR E OH 1 ATOM 2348 N N . CYS B 1 95 ? -16.513 -21.365 32.972 1.00 70.22 ? 92 CYS E N 1 ATOM 2349 C CA . CYS B 1 95 ? -17.795 -21.617 33.633 1.00 73.05 ? 92 CYS E CA 1 ATOM 2350 C C . CYS B 1 95 ? -18.424 -22.783 32.879 1.00 71.23 ? 92 CYS E C 1 ATOM 2351 O O . CYS B 1 95 ? -18.209 -22.919 31.672 1.00 70.02 ? 92 CYS E O 1 ATOM 2352 C CB . CYS B 1 95 ? -18.717 -20.393 33.619 1.00 78.52 ? 92 CYS E CB 1 ATOM 2353 S SG . CYS B 1 95 ? -19.287 -19.839 31.994 1.00 81.03 ? 92 CYS E SG 1 ATOM 2354 N N . ALA B 1 96 ? -19.190 -23.619 33.576 1.00 71.42 ? 93 ALA E N 1 ATOM 2355 C CA . ALA B 1 96 ? -19.723 -24.840 32.975 1.00 69.64 ? 93 ALA E CA 1 ATOM 2356 C C . ALA B 1 96 ? -20.917 -25.410 33.716 1.00 71.45 ? 93 ALA E C 1 ATOM 2357 O O . ALA B 1 96 ? -21.032 -25.272 34.933 1.00 72.80 ? 93 ALA E O 1 ATOM 2358 C CB . ALA B 1 96 ? -18.630 -25.900 32.889 1.00 65.22 ? 93 ALA E CB 1 ATOM 2359 N N . ARG B 1 97 ? -21.796 -26.051 32.951 1.00 71.93 ? 94 ARG E N 1 ATOM 2360 C CA . ARG B 1 97 ? -22.795 -26.948 33.489 1.00 72.71 ? 94 ARG E CA 1 ATOM 2361 C C . ARG B 1 97 ? -22.125 -28.287 33.735 1.00 67.62 ? 94 ARG E C 1 ATOM 2362 O O . ARG B 1 97 ? -21.436 -28.810 32.867 1.00 64.64 ? 94 ARG E O 1 ATOM 2363 C CB . ARG B 1 97 ? -23.965 -27.101 32.514 1.00 76.09 ? 94 ARG E CB 1 ATOM 2364 C CG . ARG B 1 97 ? -24.866 -25.867 32.473 1.00 82.48 ? 94 ARG E CG 1 ATOM 2365 C CD . ARG B 1 97 ? -26.328 -26.113 32.837 1.00 87.54 ? 94 ARG E CD 1 ATOM 2366 N NE . ARG B 1 97 ? -26.570 -27.344 33.589 1.00 85.84 ? 94 ARG E NE 1 ATOM 2367 C CZ . ARG B 1 97 ? -26.374 -27.584 34.888 1.00 85.53 ? 94 ARG E CZ 1 ATOM 2368 N NH1 . ARG B 1 97 ? -25.900 -26.652 35.701 1.00 87.15 ? 94 ARG E NH1 1 ATOM 2369 N NH2 . ARG B 1 97 ? -26.656 -28.797 35.376 1.00 83.82 ? 94 ARG E NH2 1 ATOM 2370 N N . MET B 1 98 ? -22.309 -28.817 34.937 1.00 67.13 ? 95 MET E N 1 ATOM 2371 C CA . MET B 1 98 ? -21.814 -30.135 35.307 1.00 63.35 ? 95 MET E CA 1 ATOM 2372 C C . MET B 1 98 ? -22.879 -30.833 36.148 1.00 64.74 ? 95 MET E C 1 ATOM 2373 O O . MET B 1 98 ? -23.926 -30.248 36.427 1.00 68.58 ? 95 MET E O 1 ATOM 2374 C CB . MET B 1 98 ? -20.503 -29.996 36.084 1.00 61.74 ? 95 MET E CB 1 ATOM 2375 C CG . MET B 1 98 ? -19.464 -29.110 35.401 1.00 60.88 ? 95 MET E CG 1 ATOM 2376 S SD . MET B 1 98 ? -17.861 -29.175 36.219 1.00 59.29 ? 95 MET E SD 1 ATOM 2377 C CE . MET B 1 98 ? -17.335 -30.804 35.679 1.00 55.73 ? 95 MET E CE 1 ATOM 2378 N N . ARG B 1 99 ? -22.601 -32.068 36.559 1.00 61.91 ? 96 ARG E N 1 ATOM 2379 C CA . ARG B 1 99 ? -23.580 -32.886 37.291 1.00 63.18 ? 96 ARG E CA 1 ATOM 2380 C C . ARG B 1 99 ? -24.836 -33.022 36.433 1.00 64.80 ? 96 ARG E C 1 ATOM 2381 O O . ARG B 1 99 ? -25.924 -32.592 36.817 1.00 68.79 ? 96 ARG E O 1 ATOM 2382 C CB . ARG B 1 99 ? -23.931 -32.285 38.664 1.00 66.97 ? 96 ARG E CB 1 ATOM 2383 C CG . ARG B 1 99 ? -22.741 -31.976 39.564 1.00 66.47 ? 96 ARG E CG 1 ATOM 2384 C CD . ARG B 1 99 ? -23.073 -32.185 41.035 1.00 69.71 ? 96 ARG E CD 1 ATOM 2385 N NE . ARG B 1 99 ? -24.449 -31.811 41.332 1.00 74.31 ? 96 ARG E NE 1 ATOM 2386 C CZ . ARG B 1 99 ? -25.134 -32.211 42.393 1.00 77.66 ? 96 ARG E CZ 1 ATOM 2387 N NH1 . ARG B 1 99 ? -24.594 -32.995 43.315 1.00 77.05 ? 96 ARG E NH1 1 ATOM 2388 N NH2 . ARG B 1 99 ? -26.379 -31.814 42.534 1.00 82.42 ? 96 ARG E NH2 1 ATOM 2389 N N . ILE B 1 100 ? -24.654 -33.621 35.263 1.00 62.16 ? 97 ILE E N 1 ATOM 2390 C CA . ILE B 1 100 ? -25.640 -33.591 34.183 1.00 64.12 ? 97 ILE E CA 1 ATOM 2391 C C . ILE B 1 100 ? -26.624 -34.759 34.280 1.00 64.57 ? 97 ILE E C 1 ATOM 2392 O O . ILE B 1 100 ? -26.257 -35.869 34.667 1.00 61.63 ? 97 ILE E O 1 ATOM 2393 C CB . ILE B 1 100 ? -24.941 -33.622 32.795 1.00 62.09 ? 97 ILE E CB 1 ATOM 2394 C CG1 . ILE B 1 100 ? -23.837 -32.508 32.673 1.00 61.24 ? 97 ILE E CG1 1 ATOM 2395 C CG2 . ILE B 1 100 ? -25.984 -33.519 31.686 1.00 65.33 ? 97 ILE E CG2 1 ATOM 2396 C CD1 . ILE B 1 100 ? -24.314 -31.095 32.953 1.00 65.06 ? 97 ILE E CD1 1 ATOM 2397 N N . THR B 1 101 ? -27.870 -34.481 33.895 1.00 68.69 ? 98 THR E N 1 ATOM 2398 C CA . THR B 1 101 ? -28.994 -35.407 34.038 1.00 70.48 ? 98 THR E CA 1 ATOM 2399 C C . THR B 1 101 ? -29.753 -35.671 32.742 1.00 72.67 ? 98 THR E C 1 ATOM 2400 O O . THR B 1 101 ? -30.690 -36.473 32.727 1.00 74.38 ? 98 THR E O 1 ATOM 2401 C CB . THR B 1 101 ? -30.046 -34.833 35.002 1.00 75.51 ? 98 THR E CB 1 ATOM 2402 O OG1 . THR B 1 101 ? -30.520 -33.574 34.516 1.00 80.01 ? 98 THR E OG1 1 ATOM 2403 C CG2 . THR B 1 101 ? -29.458 -34.640 36.368 1.00 74.60 ? 98 THR E CG2 1 ATOM 2404 N N . THR B 1 102 ? -29.405 -34.961 31.675 1.00 73.30 ? 99 THR E N 1 ATOM 2405 C CA . THR B 1 102 ? -30.067 -35.166 30.387 1.00 76.19 ? 99 THR E CA 1 ATOM 2406 C C . THR B 1 102 ? -29.085 -35.095 29.237 1.00 74.01 ? 99 THR E C 1 ATOM 2407 O O . THR B 1 102 ? -27.987 -34.589 29.382 1.00 71.12 ? 99 THR E O 1 ATOM 2408 C CB . THR B 1 102 ? -31.165 -34.120 30.094 1.00 82.91 ? 99 THR E CB 1 ATOM 2409 O OG1 . THR B 1 102 ? -30.562 -32.888 29.684 1.00 83.72 ? 99 THR E OG1 1 ATOM 2410 C CG2 . THR B 1 102 ? -32.041 -33.869 31.301 1.00 86.19 ? 99 THR E CG2 1 ATOM 2411 N N . ASP B 1 103 ? -29.529 -35.567 28.080 1.00 76.31 ? 100 ASP E N 1 ATOM 2412 C CA . ASP B 1 103 ? -28.722 -35.610 26.881 1.00 75.48 ? 100 ASP E CA 1 ATOM 2413 C C . ASP B 1 103 ? -28.375 -34.245 26.297 1.00 77.89 ? 100 ASP E C 1 ATOM 2414 O O . ASP B 1 103 ? -27.543 -34.191 25.403 1.00 77.13 ? 100 ASP E O 1 ATOM 2415 C CB . ASP B 1 103 ? -29.453 -36.392 25.779 1.00 78.85 ? 100 ASP E CB 1 ATOM 2416 C CG . ASP B 1 103 ? -29.531 -37.894 26.030 1.00 76.19 ? 100 ASP E CG 1 ATOM 2417 O OD1 . ASP B 1 103 ? -29.070 -38.392 27.075 1.00 71.85 ? 100 ASP E OD1 1 ATOM 2418 O OD2 . ASP B 1 103 ? -30.086 -38.586 25.147 1.00 79.05 ? 100 ASP E OD2 1 ATOM 2419 N N . TRP B 1 104 A -28.952 -33.142 26.775 1.00 81.29 ? 100 TRP E N 1 ATOM 2420 C CA . TRP B 1 104 A -28.882 -31.903 25.996 1.00 85.08 ? 100 TRP E CA 1 ATOM 2421 C C . TRP B 1 104 A -28.197 -30.699 26.636 1.00 84.04 ? 100 TRP E C 1 ATOM 2422 O O . TRP B 1 104 A -27.313 -30.104 26.030 1.00 83.05 ? 100 TRP E O 1 ATOM 2423 C CB . TRP B 1 104 A -30.276 -31.532 25.484 1.00 92.46 ? 100 TRP E CB 1 ATOM 2424 C CG . TRP B 1 104 A -30.709 -32.465 24.377 1.00 94.69 ? 100 TRP E CG 1 ATOM 2425 C CD1 . TRP B 1 104 A -30.384 -32.368 23.058 1.00 96.88 ? 100 TRP E CD1 1 ATOM 2426 C CD2 . TRP B 1 104 A -31.506 -33.654 24.505 1.00 95.24 ? 100 TRP E CD2 1 ATOM 2427 N NE1 . TRP B 1 104 A -30.935 -33.409 22.352 1.00 99.09 ? 100 TRP E NE1 1 ATOM 2428 C CE2 . TRP B 1 104 A -31.628 -34.214 23.217 1.00 97.96 ? 100 TRP E CE2 1 ATOM 2429 C CE3 . TRP B 1 104 A -32.136 -34.293 25.583 1.00 94.14 ? 100 TRP E CE3 1 ATOM 2430 C CZ2 . TRP B 1 104 A -32.359 -35.385 22.972 1.00 99.55 ? 100 TRP E CZ2 1 ATOM 2431 C CZ3 . TRP B 1 104 A -32.858 -35.463 25.343 1.00 95.41 ? 100 TRP E CZ3 1 ATOM 2432 C CH2 . TRP B 1 104 A -32.966 -35.994 24.044 1.00 98.04 ? 100 TRP E CH2 1 ATOM 2433 N N . PHE B 1 105 B -28.599 -30.330 27.842 1.00 84.81 ? 100 PHE E N 1 ATOM 2434 C CA . PHE B 1 105 B -28.299 -28.983 28.347 1.00 86.38 ? 100 PHE E CA 1 ATOM 2435 C C . PHE B 1 105 B -27.009 -28.883 29.150 1.00 81.11 ? 100 PHE E C 1 ATOM 2436 O O . PHE B 1 105 B -27.014 -28.363 30.268 1.00 81.64 ? 100 PHE E O 1 ATOM 2437 C CB . PHE B 1 105 B -29.477 -28.421 29.161 1.00 91.78 ? 100 PHE E CB 1 ATOM 2438 C CG . PHE B 1 105 B -30.691 -28.114 28.334 1.00 98.87 ? 100 PHE E CG 1 ATOM 2439 C CD1 . PHE B 1 105 B -30.661 -27.102 27.379 1.00 102.82 ? 100 PHE E CD1 1 ATOM 2440 C CD2 . PHE B 1 105 B -31.868 -28.815 28.522 1.00 102.21 ? 100 PHE E CD2 1 ATOM 2441 C CE1 . PHE B 1 105 B -31.784 -26.807 26.620 1.00 110.29 ? 100 PHE E CE1 1 ATOM 2442 C CE2 . PHE B 1 105 B -32.987 -28.525 27.766 1.00 109.61 ? 100 PHE E CE2 1 ATOM 2443 C CZ . PHE B 1 105 B -32.946 -27.522 26.813 1.00 113.84 ? 100 PHE E CZ 1 ATOM 2444 N N . ALA B 1 106 ? -25.904 -29.367 28.585 1.00 76.92 ? 101 ALA E N 1 ATOM 2445 C CA . ALA B 1 106 ? -24.619 -29.281 29.279 1.00 72.50 ? 101 ALA E CA 1 ATOM 2446 C C . ALA B 1 106 ? -23.513 -28.446 28.615 1.00 71.74 ? 101 ALA E C 1 ATOM 2447 O O . ALA B 1 106 ? -22.487 -28.965 28.148 1.00 68.35 ? 101 ALA E O 1 ATOM 2448 C CB . ALA B 1 106 ? -24.097 -30.670 29.576 1.00 68.05 ? 101 ALA E CB 1 ATOM 2449 N N . TYR B 1 107 ? -23.666 -27.134 28.713 1.00 75.01 ? 102 TYR E N 1 ATOM 2450 C CA . TYR B 1 107 ? -22.846 -26.211 27.953 1.00 75.38 ? 102 TYR E CA 1 ATOM 2451 C C . TYR B 1 107 ? -21.667 -25.761 28.804 1.00 72.22 ? 102 TYR E C 1 ATOM 2452 O O . TYR B 1 107 ? -21.842 -25.434 29.981 1.00 72.75 ? 102 TYR E O 1 ATOM 2453 C CB . TYR B 1 107 ? -23.668 -24.980 27.606 1.00 81.12 ? 102 TYR E CB 1 ATOM 2454 C CG . TYR B 1 107 ? -24.854 -25.179 26.706 1.00 85.83 ? 102 TYR E CG 1 ATOM 2455 C CD1 . TYR B 1 107 ? -25.994 -25.849 27.147 1.00 87.83 ? 102 TYR E CD1 1 ATOM 2456 C CD2 . TYR B 1 107 ? -24.865 -24.635 25.431 1.00 89.18 ? 102 TYR E CD2 1 ATOM 2457 C CE1 . TYR B 1 107 ? -27.090 -26.005 26.321 1.00 92.89 ? 102 TYR E CE1 1 ATOM 2458 C CE2 . TYR B 1 107 ? -25.961 -24.782 24.597 1.00 94.53 ? 102 TYR E CE2 1 ATOM 2459 C CZ . TYR B 1 107 ? -27.070 -25.471 25.049 1.00 96.38 ? 102 TYR E CZ 1 ATOM 2460 O OH . TYR B 1 107 ? -28.172 -25.627 24.236 1.00 102.46 ? 102 TYR E OH 1 ATOM 2461 N N . TRP B 1 108 ? -20.472 -25.740 28.218 1.00 69.67 ? 103 TRP E N 1 ATOM 2462 C CA . TRP B 1 108 ? -19.323 -25.095 28.837 1.00 67.68 ? 103 TRP E CA 1 ATOM 2463 C C . TRP B 1 108 ? -19.123 -23.730 28.197 1.00 70.31 ? 103 TRP E C 1 ATOM 2464 O O . TRP B 1 108 ? -19.476 -23.517 27.036 1.00 72.58 ? 103 TRP E O 1 ATOM 2465 C CB . TRP B 1 108 ? -18.060 -25.936 28.641 1.00 63.77 ? 103 TRP E CB 1 ATOM 2466 C CG . TRP B 1 108 ? -17.973 -27.111 29.549 1.00 61.15 ? 103 TRP E CG 1 ATOM 2467 C CD1 . TRP B 1 108 ? -18.929 -28.067 29.755 1.00 61.22 ? 103 TRP E CD1 1 ATOM 2468 C CD2 . TRP B 1 108 ? -16.866 -27.471 30.369 1.00 58.51 ? 103 TRP E CD2 1 ATOM 2469 N NE1 . TRP B 1 108 ? -18.487 -28.994 30.666 1.00 58.64 ? 103 TRP E NE1 1 ATOM 2470 C CE2 . TRP B 1 108 ? -17.220 -28.656 31.055 1.00 57.14 ? 103 TRP E CE2 1 ATOM 2471 C CE3 . TRP B 1 108 ? -15.610 -26.909 30.594 1.00 57.69 ? 103 TRP E CE3 1 ATOM 2472 C CZ2 . TRP B 1 108 ? -16.362 -29.287 31.942 1.00 55.25 ? 103 TRP E CZ2 1 ATOM 2473 C CZ3 . TRP B 1 108 ? -14.759 -27.533 31.474 1.00 55.94 ? 103 TRP E CZ3 1 ATOM 2474 C CH2 . TRP B 1 108 ? -15.140 -28.715 32.141 1.00 54.89 ? 103 TRP E CH2 1 ATOM 2475 N N . GLY B 1 109 ? -18.551 -22.808 28.961 1.00 70.38 ? 104 GLY E N 1 ATOM 2476 C CA . GLY B 1 109 ? -18.067 -21.559 28.404 1.00 72.26 ? 104 GLY E CA 1 ATOM 2477 C C . GLY B 1 109 ? -16.911 -21.821 27.452 1.00 69.96 ? 104 GLY E C 1 ATOM 2478 O O . GLY B 1 109 ? -16.307 -22.898 27.474 1.00 66.78 ? 104 GLY E O 1 ATOM 2479 N N . GLN B 1 110 ? -16.622 -20.851 26.590 1.00 72.14 ? 105 GLN E N 1 ATOM 2480 C CA . GLN B 1 110 ? -15.519 -20.995 25.624 1.00 70.86 ? 105 GLN E CA 1 ATOM 2481 C C . GLN B 1 110 ? -14.153 -21.083 26.293 1.00 67.48 ? 105 GLN E C 1 ATOM 2482 O O . GLN B 1 110 ? -13.241 -21.714 25.776 1.00 65.89 ? 105 GLN E O 1 ATOM 2483 C CB . GLN B 1 110 ? -15.501 -19.889 24.575 1.00 74.47 ? 105 GLN E CB 1 ATOM 2484 C CG . GLN B 1 110 ? -14.832 -18.558 24.985 1.00 75.24 ? 105 GLN E CG 1 ATOM 2485 C CD . GLN B 1 110 ? -15.845 -17.556 25.505 1.00 78.93 ? 105 GLN E CD 1 ATOM 2486 O OE1 . GLN B 1 110 ? -16.523 -17.824 26.499 1.00 78.92 ? 105 GLN E OE1 1 ATOM 2487 N NE2 . GLN B 1 110 ? -15.977 -16.405 24.826 1.00 82.80 ? 105 GLN E NE2 1 ATOM 2488 N N . GLY B 1 111 ? -14.005 -20.409 27.422 1.00 67.26 ? 106 GLY E N 1 ATOM 2489 C CA . GLY B 1 111 ? -12.771 -20.478 28.181 1.00 64.92 ? 106 GLY E CA 1 ATOM 2490 C C . GLY B 1 111 ? -12.028 -19.156 28.108 1.00 66.31 ? 106 GLY E C 1 ATOM 2491 O O . GLY B 1 111 ? -11.994 -18.497 27.070 1.00 68.00 ? 106 GLY E O 1 ATOM 2492 N N . THR B 1 112 ? -11.449 -18.761 29.229 1.00 65.92 ? 107 THR E N 1 ATOM 2493 C CA . THR B 1 112 ? -10.682 -17.536 29.309 1.00 67.39 ? 107 THR E CA 1 ATOM 2494 C C . THR B 1 112 ? -9.267 -17.926 29.725 1.00 65.71 ? 107 THR E C 1 ATOM 2495 O O . THR B 1 112 ? -9.059 -18.435 30.826 1.00 64.96 ? 107 THR E O 1 ATOM 2496 C CB . THR B 1 112 ? -11.308 -16.567 30.332 1.00 69.91 ? 107 THR E CB 1 ATOM 2497 O OG1 . THR B 1 112 ? -12.668 -16.323 29.987 1.00 72.28 ? 107 THR E OG1 1 ATOM 2498 C CG2 . THR B 1 112 ? -10.601 -15.236 30.353 1.00 71.79 ? 107 THR E CG2 1 ATOM 2499 N N . LEU B 1 113 ? -8.303 -17.733 28.831 1.00 65.71 ? 108 LEU E N 1 ATOM 2500 C CA . LEU B 1 113 ? -6.904 -17.952 29.164 1.00 65.19 ? 108 LEU E CA 1 ATOM 2501 C C . LEU B 1 113 ? -6.407 -16.787 30.013 1.00 66.91 ? 108 LEU E C 1 ATOM 2502 O O . LEU B 1 113 ? -6.419 -15.634 29.573 1.00 68.48 ? 108 LEU E O 1 ATOM 2503 C CB . LEU B 1 113 ? -6.041 -18.086 27.910 1.00 65.50 ? 108 LEU E CB 1 ATOM 2504 C CG . LEU B 1 113 ? -4.522 -18.150 28.141 1.00 66.01 ? 108 LEU E CG 1 ATOM 2505 C CD1 . LEU B 1 113 ? -4.136 -19.245 29.133 1.00 65.06 ? 108 LEU E CD1 1 ATOM 2506 C CD2 . LEU B 1 113 ? -3.785 -18.334 26.823 1.00 66.94 ? 108 LEU E CD2 1 ATOM 2507 N N . VAL B 1 114 ? -5.972 -17.095 31.230 1.00 67.00 ? 109 VAL E N 1 ATOM 2508 C CA . VAL B 1 114 ? -5.460 -16.072 32.109 1.00 69.33 ? 109 VAL E CA 1 ATOM 2509 C C . VAL B 1 114 ? -3.996 -16.349 32.396 1.00 69.74 ? 109 VAL E C 1 ATOM 2510 O O . VAL B 1 114 ? -3.632 -17.450 32.807 1.00 69.06 ? 109 VAL E O 1 ATOM 2511 C CB . VAL B 1 114 ? -6.273 -15.981 33.413 1.00 70.69 ? 109 VAL E CB 1 ATOM 2512 C CG1 . VAL B 1 114 ? -5.748 -14.852 34.295 1.00 73.71 ? 109 VAL E CG1 1 ATOM 2513 C CG2 . VAL B 1 114 ? -7.733 -15.743 33.080 1.00 71.07 ? 109 VAL E CG2 1 ATOM 2514 N N . THR B 1 115 ? -3.164 -15.350 32.134 1.00 71.40 ? 110 THR E N 1 ATOM 2515 C CA . THR B 1 115 ? -1.756 -15.404 32.475 1.00 72.82 ? 110 THR E CA 1 ATOM 2516 C C . THR B 1 115 ? -1.467 -14.398 33.584 1.00 75.74 ? 110 THR E C 1 ATOM 2517 O O . THR B 1 115 ? -1.876 -13.242 33.518 1.00 76.78 ? 110 THR E O 1 ATOM 2518 C CB . THR B 1 115 ? -0.892 -15.094 31.247 1.00 73.02 ? 110 THR E CB 1 ATOM 2519 O OG1 . THR B 1 115 ? -1.281 -15.955 30.174 1.00 71.03 ? 110 THR E OG1 1 ATOM 2520 C CG2 . THR B 1 115 ? 0.580 -15.302 31.566 1.00 74.98 ? 110 THR E CG2 1 ATOM 2521 N N . VAL B 1 116 ? -0.763 -14.856 34.608 1.00 77.64 ? 111 VAL E N 1 ATOM 2522 C CA . VAL B 1 116 ? -0.426 -14.015 35.736 1.00 81.33 ? 111 VAL E CA 1 ATOM 2523 C C . VAL B 1 116 ? 1.031 -13.635 35.579 1.00 83.51 ? 111 VAL E C 1 ATOM 2524 O O . VAL B 1 116 ? 1.913 -14.482 35.683 1.00 84.20 ? 111 VAL E O 1 ATOM 2525 C CB . VAL B 1 116 ? -0.662 -14.728 37.087 1.00 83.15 ? 111 VAL E CB 1 ATOM 2526 C CG1 . VAL B 1 116 ? -2.138 -14.714 37.420 1.00 82.40 ? 111 VAL E CG1 1 ATOM 2527 C CG2 . VAL B 1 116 ? -0.195 -16.176 37.047 1.00 82.12 ? 111 VAL E CG2 1 ATOM 2528 N N . SER B 1 117 ? 1.279 -12.365 35.283 1.00 67.80 ? 112 SER E N 1 ATOM 2529 C CA . SER B 1 117 ? 2.641 -11.881 35.070 1.00 64.83 ? 112 SER E CA 1 ATOM 2530 C C . SER B 1 117 ? 2.691 -10.358 35.125 1.00 65.99 ? 112 SER E C 1 ATOM 2531 O O . SER B 1 117 ? 1.680 -9.688 34.887 1.00 68.09 ? 112 SER E O 1 ATOM 2532 C CB . SER B 1 117 ? 3.181 -12.380 33.723 1.00 60.77 ? 112 SER E CB 1 ATOM 2533 O OG . SER B 1 117 ? 4.259 -11.584 33.268 1.00 58.36 ? 112 SER E OG 1 ATOM 2534 N N . ALA B 1 118 ? 3.868 -9.830 35.469 1.00 65.14 ? 113 ALA E N 1 ATOM 2535 C CA . ALA B 1 118 ? 4.108 -8.376 35.518 1.00 66.34 ? 113 ALA E CA 1 ATOM 2536 C C . ALA B 1 118 ? 4.822 -7.876 34.264 1.00 63.34 ? 113 ALA E C 1 ATOM 2537 O O . ALA B 1 118 ? 5.103 -6.688 34.132 1.00 64.33 ? 113 ALA E O 1 ATOM 2538 C CB . ALA B 1 118 ? 4.891 -8.023 36.772 1.00 68.46 ? 113 ALA E CB 1 ATOM 2539 N N . ALA B 1 119 ? 5.067 -8.782 33.327 1.00 60.14 ? 114 ALA E N 1 ATOM 2540 C CA . ALA B 1 119 ? 5.857 -8.477 32.153 1.00 57.60 ? 114 ALA E CA 1 ATOM 2541 C C . ALA B 1 119 ? 5.133 -7.507 31.241 1.00 58.72 ? 114 ALA E C 1 ATOM 2542 O O . ALA B 1 119 ? 3.910 -7.521 31.173 1.00 60.43 ? 114 ALA E O 1 ATOM 2543 C CB . ALA B 1 119 ? 6.178 -9.758 31.400 1.00 54.52 ? 114 ALA E CB 1 ATOM 2544 N N . LYS B 1 120 ? 5.900 -6.665 30.552 1.00 58.43 ? 115 LYS E N 1 ATOM 2545 C CA . LYS B 1 120 ? 5.361 -5.773 29.545 1.00 59.87 ? 115 LYS E CA 1 ATOM 2546 C C . LYS B 1 120 ? 5.516 -6.436 28.186 1.00 57.31 ? 115 LYS E C 1 ATOM 2547 O O . LYS B 1 120 ? 6.172 -7.471 28.075 1.00 54.62 ? 115 LYS E O 1 ATOM 2548 C CB . LYS B 1 120 ? 6.094 -4.430 29.581 1.00 61.87 ? 115 LYS E CB 1 ATOM 2549 C CG . LYS B 1 120 ? 6.228 -3.720 30.918 1.00 64.77 ? 115 LYS E CG 1 ATOM 2550 C CD . LYS B 1 120 ? 5.036 -3.938 31.838 1.00 67.09 ? 115 LYS E CD 1 ATOM 2551 C CE . LYS B 1 120 ? 5.369 -3.557 33.270 1.00 69.59 ? 115 LYS E CE 1 ATOM 2552 N NZ . LYS B 1 120 ? 4.212 -3.818 34.169 1.00 72.17 ? 115 LYS E NZ 1 ATOM 2553 N N . THR B 1 121 ? 4.877 -5.874 27.162 1.00 58.64 ? 116 THR E N 1 ATOM 2554 C CA . THR B 1 121 ? 5.110 -6.318 25.792 1.00 56.89 ? 116 THR E CA 1 ATOM 2555 C C . THR B 1 121 ? 6.594 -6.170 25.455 1.00 54.94 ? 116 THR E C 1 ATOM 2556 O O . THR B 1 121 ? 7.182 -5.106 25.636 1.00 56.52 ? 116 THR E O 1 ATOM 2557 C CB . THR B 1 121 ? 4.280 -5.522 24.771 1.00 59.76 ? 116 THR E CB 1 ATOM 2558 O OG1 . THR B 1 121 ? 2.884 -5.629 25.081 1.00 62.22 ? 116 THR E OG1 1 ATOM 2559 C CG2 . THR B 1 121 ? 4.506 -6.054 23.361 1.00 58.42 ? 116 THR E CG2 1 ATOM 2560 N N . THR B 1 122 ? 7.190 -7.250 24.970 1.00 52.02 ? 117 THR E N 1 ATOM 2561 C CA . THR B 1 122 ? 8.615 -7.285 24.709 1.00 50.48 ? 117 THR E CA 1 ATOM 2562 C C . THR B 1 122 ? 8.859 -8.093 23.445 1.00 48.63 ? 117 THR E C 1 ATOM 2563 O O . THR B 1 122 ? 8.356 -9.211 23.319 1.00 47.04 ? 117 THR E O 1 ATOM 2564 C CB . THR B 1 122 ? 9.386 -7.918 25.884 1.00 49.20 ? 117 THR E CB 1 ATOM 2565 O OG1 . THR B 1 122 ? 8.886 -7.389 27.119 1.00 51.30 ? 117 THR E OG1 1 ATOM 2566 C CG2 . THR B 1 122 ? 10.897 -7.642 25.766 1.00 48.80 ? 117 THR E CG2 1 ATOM 2567 N N . PRO B 1 123 ? 9.621 -7.521 22.494 1.00 49.29 ? 118 PRO E N 1 ATOM 2568 C CA . PRO B 1 123 ? 9.963 -8.305 21.313 1.00 47.89 ? 118 PRO E CA 1 ATOM 2569 C C . PRO B 1 123 ? 11.038 -9.344 21.638 1.00 45.45 ? 118 PRO E C 1 ATOM 2570 O O . PRO B 1 123 ? 11.775 -9.175 22.616 1.00 45.44 ? 118 PRO E O 1 ATOM 2571 C CB . PRO B 1 123 ? 10.494 -7.263 20.333 1.00 49.95 ? 118 PRO E CB 1 ATOM 2572 C CG . PRO B 1 123 ? 10.966 -6.128 21.181 1.00 51.74 ? 118 PRO E CG 1 ATOM 2573 C CD . PRO B 1 123 ? 10.147 -6.142 22.435 1.00 51.73 ? 118 PRO E CD 1 ATOM 2574 N N . PRO B 1 124 ? 11.125 -10.413 20.826 1.00 43.86 ? 119 PRO E N 1 ATOM 2575 C CA . PRO B 1 124 ? 12.114 -11.470 21.004 1.00 41.78 ? 119 PRO E CA 1 ATOM 2576 C C . PRO B 1 124 ? 13.476 -11.085 20.461 1.00 42.00 ? 119 PRO E C 1 ATOM 2577 O O . PRO B 1 124 ? 13.551 -10.316 19.517 1.00 43.54 ? 119 PRO E O 1 ATOM 2578 C CB . PRO B 1 124 ? 11.551 -12.607 20.155 1.00 40.92 ? 119 PRO E CB 1 ATOM 2579 C CG . PRO B 1 124 ? 10.831 -11.910 19.047 1.00 42.67 ? 119 PRO E CG 1 ATOM 2580 C CD . PRO B 1 124 ? 10.282 -10.643 19.633 1.00 44.51 ? 119 PRO E CD 1 ATOM 2581 N N . SER B 1 125 ? 14.540 -11.610 21.063 1.00 41.14 ? 120 SER E N 1 ATOM 2582 C CA . SER B 1 125 ? 15.840 -11.679 20.407 1.00 41.38 ? 120 SER E CA 1 ATOM 2583 C C . SER B 1 125 ? 15.870 -12.999 19.647 1.00 39.73 ? 120 SER E C 1 ATOM 2584 O O . SER B 1 125 ? 15.374 -14.024 20.141 1.00 38.24 ? 120 SER E O 1 ATOM 2585 C CB . SER B 1 125 ? 16.966 -11.645 21.426 1.00 42.06 ? 120 SER E CB 1 ATOM 2586 O OG . SER B 1 125 ? 16.964 -10.397 22.078 1.00 43.95 ? 120 SER E OG 1 ATOM 2587 N N . VAL B 1 126 ? 16.441 -12.977 18.451 1.00 40.37 ? 121 VAL E N 1 ATOM 2588 C CA . VAL B 1 126 ? 16.486 -14.171 17.613 1.00 39.55 ? 121 VAL E CA 1 ATOM 2589 C C . VAL B 1 126 ? 17.931 -14.540 17.278 1.00 40.41 ? 121 VAL E C 1 ATOM 2590 O O . VAL B 1 126 ? 18.685 -13.722 16.769 1.00 42.27 ? 121 VAL E O 1 ATOM 2591 C CB . VAL B 1 126 ? 15.679 -13.970 16.320 1.00 40.32 ? 121 VAL E CB 1 ATOM 2592 C CG1 . VAL B 1 126 ? 15.623 -15.260 15.518 1.00 39.70 ? 121 VAL E CG1 1 ATOM 2593 C CG2 . VAL B 1 126 ? 14.269 -13.499 16.655 1.00 40.30 ? 121 VAL E CG2 1 ATOM 2594 N N . TYR B 1 127 ? 18.312 -15.781 17.579 1.00 39.54 ? 122 TYR E N 1 ATOM 2595 C CA . TYR B 1 127 ? 19.677 -16.232 17.354 1.00 40.70 ? 122 TYR E CA 1 ATOM 2596 C C . TYR B 1 127 ? 19.693 -17.463 16.481 1.00 40.57 ? 122 TYR E C 1 ATOM 2597 O O . TYR B 1 127 ? 18.911 -18.376 16.699 1.00 39.22 ? 122 TYR E O 1 ATOM 2598 C CB . TYR B 1 127 ? 20.356 -16.552 18.674 1.00 40.70 ? 122 TYR E CB 1 ATOM 2599 C CG . TYR B 1 127 ? 20.305 -15.410 19.644 1.00 41.22 ? 122 TYR E CG 1 ATOM 2600 C CD1 . TYR B 1 127 ? 20.920 -14.200 19.348 1.00 43.24 ? 122 TYR E CD1 1 ATOM 2601 C CD2 . TYR B 1 127 ? 19.641 -15.530 20.855 1.00 40.25 ? 122 TYR E CD2 1 ATOM 2602 C CE1 . TYR B 1 127 ? 20.880 -13.142 20.233 1.00 44.23 ? 122 TYR E CE1 1 ATOM 2603 C CE2 . TYR B 1 127 ? 19.593 -14.476 21.748 1.00 41.23 ? 122 TYR E CE2 1 ATOM 2604 C CZ . TYR B 1 127 ? 20.220 -13.281 21.427 1.00 43.26 ? 122 TYR E CZ 1 ATOM 2605 O OH . TYR B 1 127 ? 20.201 -12.209 22.291 1.00 44.80 ? 122 TYR E OH 1 ATOM 2606 N N . PRO B 1 128 ? 20.602 -17.503 15.501 1.00 42.55 ? 123 PRO E N 1 ATOM 2607 C CA . PRO B 1 128 ? 20.730 -18.665 14.643 1.00 43.04 ? 123 PRO E CA 1 ATOM 2608 C C . PRO B 1 128 ? 21.418 -19.807 15.368 1.00 43.24 ? 123 PRO E C 1 ATOM 2609 O O . PRO B 1 128 ? 22.243 -19.569 16.231 1.00 44.36 ? 123 PRO E O 1 ATOM 2610 C CB . PRO B 1 128 ? 21.609 -18.160 13.510 1.00 45.51 ? 123 PRO E CB 1 ATOM 2611 C CG . PRO B 1 128 ? 22.493 -17.166 14.169 1.00 46.91 ? 123 PRO E CG 1 ATOM 2612 C CD . PRO B 1 128 ? 21.650 -16.513 15.226 1.00 45.07 ? 123 PRO E CD 1 ATOM 2613 N N . LEU B 1 129 ? 21.060 -21.034 15.022 1.00 42.92 ? 124 LEU E N 1 ATOM 2614 C CA . LEU B 1 129 ? 21.723 -22.221 15.543 1.00 43.74 ? 124 LEU E CA 1 ATOM 2615 C C . LEU B 1 129 ? 22.310 -23.007 14.380 1.00 45.36 ? 124 LEU E C 1 ATOM 2616 O O . LEU B 1 129 ? 21.612 -23.786 13.737 1.00 44.97 ? 124 LEU E O 1 ATOM 2617 C CB . LEU B 1 129 ? 20.721 -23.085 16.313 1.00 42.44 ? 124 LEU E CB 1 ATOM 2618 C CG . LEU B 1 129 ? 19.924 -22.315 17.374 1.00 41.12 ? 124 LEU E CG 1 ATOM 2619 C CD1 . LEU B 1 129 ? 18.769 -23.147 17.910 1.00 40.22 ? 124 LEU E CD1 1 ATOM 2620 C CD2 . LEU B 1 129 ? 20.836 -21.859 18.497 1.00 42.15 ? 124 LEU E CD2 1 ATOM 2621 N N . ALA B 1 130 ? 23.588 -22.777 14.104 1.00 47.71 ? 125 ALA E N 1 ATOM 2622 C CA . ALA B 1 130 ? 24.334 -23.527 13.093 1.00 50.14 ? 125 ALA E CA 1 ATOM 2623 C C . ALA B 1 130 ? 25.150 -24.611 13.786 1.00 51.78 ? 125 ALA E C 1 ATOM 2624 O O . ALA B 1 130 ? 25.592 -24.417 14.913 1.00 51.93 ? 125 ALA E O 1 ATOM 2625 C CB . ALA B 1 130 ? 25.247 -22.596 12.315 1.00 52.61 ? 125 ALA E CB 1 ATOM 2626 N N . PRO B 1 131 ? 25.355 -25.760 13.118 1.00 53.69 ? 126 PRO E N 1 ATOM 2627 C CA . PRO B 1 131 ? 26.131 -26.831 13.752 1.00 56.17 ? 126 PRO E CA 1 ATOM 2628 C C . PRO B 1 131 ? 27.534 -26.371 14.139 1.00 59.72 ? 126 PRO E C 1 ATOM 2629 O O . PRO B 1 131 ? 28.089 -25.483 13.496 1.00 61.02 ? 126 PRO E O 1 ATOM 2630 C CB . PRO B 1 131 ? 26.194 -27.930 12.673 1.00 57.80 ? 126 PRO E CB 1 ATOM 2631 C CG . PRO B 1 131 ? 25.781 -27.272 11.404 1.00 57.29 ? 126 PRO E CG 1 ATOM 2632 C CD . PRO B 1 131 ? 24.868 -26.155 11.785 1.00 54.11 ? 126 PRO E CD 1 ATOM 2633 N N . GLY B 1 132 ? 28.087 -26.959 15.196 1.00 62.00 ? 127 GLY E N 1 ATOM 2634 C CA . GLY B 1 132 ? 29.456 -26.667 15.596 1.00 66.28 ? 127 GLY E CA 1 ATOM 2635 C C . GLY B 1 132 ? 30.467 -26.981 14.505 1.00 70.69 ? 127 GLY E C 1 ATOM 2636 O O . GLY B 1 132 ? 30.229 -27.849 13.657 1.00 71.04 ? 127 GLY E O 1 ATOM 2637 N N . SER B 1 133 ? 31.603 -26.284 14.544 1.00 74.65 ? 128 SER E N 1 ATOM 2638 C CA . SER B 1 133 ? 32.650 -26.439 13.536 1.00 79.38 ? 128 SER E CA 1 ATOM 2639 C C . SER B 1 133 ? 33.056 -27.902 13.360 1.00 82.63 ? 128 SER E C 1 ATOM 2640 O O . SER B 1 133 ? 33.124 -28.406 12.233 1.00 84.05 ? 128 SER E O 1 ATOM 2641 C CB . SER B 1 133 ? 33.882 -25.613 13.917 1.00 83.55 ? 128 SER E CB 1 ATOM 2642 O OG . SER B 1 133 ? 33.534 -24.265 14.189 1.00 81.42 ? 128 SER E OG 1 ATOM 2643 N N . ALA B 1 134 ? 33.334 -28.572 14.478 1.00 84.54 ? 129 ALA E N 1 ATOM 2644 C CA . ALA B 1 134 ? 33.719 -29.993 14.464 1.00 88.04 ? 129 ALA E CA 1 ATOM 2645 C C . ALA B 1 134 ? 32.540 -30.990 14.545 1.00 85.28 ? 129 ALA E C 1 ATOM 2646 O O . ALA B 1 134 ? 32.707 -32.105 15.046 1.00 87.74 ? 129 ALA E O 1 ATOM 2647 C CB . ALA B 1 134 ? 34.726 -30.268 15.580 1.00 92.40 ? 129 ALA E CB 1 ATOM 2648 N N . ALA B 1 135 ? 31.361 -30.600 14.059 1.00 80.89 ? 130 ALA E N 1 ATOM 2649 C CA . ALA B 1 135 ? 30.238 -31.522 13.929 1.00 78.78 ? 130 ALA E CA 1 ATOM 2650 C C . ALA B 1 135 ? 30.444 -32.463 12.740 1.00 81.50 ? 130 ALA E C 1 ATOM 2651 O O . ALA B 1 135 ? 31.092 -32.108 11.749 1.00 83.58 ? 130 ALA E O 1 ATOM 2652 C CB . ALA B 1 135 ? 28.928 -30.760 13.782 1.00 73.84 ? 130 ALA E CB 1 ATOM 2653 N N . GLN B 1 136 ? 29.913 -33.675 12.871 1.00 81.95 ? 131 GLN E N 1 ATOM 2654 C CA . GLN B 1 136 ? 29.895 -34.649 11.787 1.00 84.01 ? 131 GLN E CA 1 ATOM 2655 C C . GLN B 1 136 ? 28.889 -34.205 10.751 1.00 80.58 ? 131 GLN E C 1 ATOM 2656 O O . GLN B 1 136 ? 27.820 -33.713 11.103 1.00 76.85 ? 131 GLN E O 1 ATOM 2657 C CB . GLN B 1 136 ? 29.462 -36.021 12.310 1.00 85.43 ? 131 GLN E CB 1 ATOM 2658 C CG . GLN B 1 136 ? 30.410 -36.659 13.305 1.00 89.59 ? 131 GLN E CG 1 ATOM 2659 C CD . GLN B 1 136 ? 31.807 -36.777 12.763 1.00 94.69 ? 131 GLN E CD 1 ATOM 2660 O OE1 . GLN B 1 136 ? 32.014 -37.040 11.578 1.00 96.45 ? 131 GLN E OE1 1 ATOM 2661 N NE2 . GLN B 1 136 ? 32.775 -36.601 13.630 1.00 97.66 ? 131 GLN E NE2 1 ATOM 2662 N N . THR B 1 137 ? 29.230 -34.364 9.479 1.00 82.56 ? 132 THR E N 1 ATOM 2663 C CA . THR B 1 137 ? 28.257 -34.121 8.389 1.00 80.31 ? 132 THR E CA 1 ATOM 2664 C C . THR B 1 137 ? 27.731 -35.433 7.727 1.00 81.86 ? 132 THR E C 1 ATOM 2665 O O . THR B 1 137 ? 28.493 -36.166 7.093 1.00 85.98 ? 132 THR E O 1 ATOM 2666 C CB . THR B 1 137 ? 28.821 -33.117 7.327 1.00 81.46 ? 132 THR E CB 1 ATOM 2667 O OG1 . THR B 1 137 ? 30.251 -33.107 7.384 1.00 85.47 ? 132 THR E OG1 1 ATOM 2668 C CG2 . THR B 1 137 ? 28.301 -31.686 7.579 1.00 77.53 ? 132 THR E CG2 1 ATOM 2669 N N . ASN B 1 138 ? 26.427 -35.704 7.899 1.00 78.73 ? 133 ASN E N 1 ATOM 2670 C CA . ASN B 1 138 ? 25.728 -36.850 7.307 1.00 79.97 ? 133 ASN E CA 1 ATOM 2671 C C . ASN B 1 138 ? 24.773 -36.350 6.235 1.00 77.98 ? 133 ASN E C 1 ATOM 2672 O O . ASN B 1 138 ? 24.741 -35.153 5.953 1.00 75.90 ? 133 ASN E O 1 ATOM 2673 C CB . ASN B 1 138 ? 24.988 -37.596 8.423 1.00 79.11 ? 133 ASN E CB 1 ATOM 2674 C CG . ASN B 1 138 ? 25.933 -38.180 9.448 1.00 81.60 ? 133 ASN E CG 1 ATOM 2675 O OD1 . ASN B 1 138 ? 27.131 -38.339 9.193 1.00 85.01 ? 133 ASN E OD1 1 ATOM 2676 N ND2 . ASN B 1 138 ? 25.396 -38.523 10.610 1.00 80.55 ? 133 ASN E ND2 1 ATOM 2677 N N . SER B 1 139 ? 24.017 -37.252 5.614 1.00 78.90 ? 134 SER E N 1 ATOM 2678 C CA . SER B 1 139 ? 23.132 -36.855 4.529 1.00 78.06 ? 134 SER E CA 1 ATOM 2679 C C . SER B 1 139 ? 22.139 -35.749 4.908 1.00 73.40 ? 134 SER E C 1 ATOM 2680 O O . SER B 1 139 ? 21.852 -34.888 4.073 1.00 73.09 ? 134 SER E O 1 ATOM 2681 C CB . SER B 1 139 ? 22.397 -38.057 3.956 1.00 80.84 ? 134 SER E CB 1 ATOM 2682 O OG . SER B 1 139 ? 21.625 -38.691 4.952 1.00 79.63 ? 134 SER E OG 1 ATOM 2683 N N . MET B 1 140 ? 21.616 -35.756 6.140 1.00 70.09 ? 135 MET E N 1 ATOM 2684 C CA . MET B 1 140 ? 20.748 -34.661 6.570 1.00 65.93 ? 135 MET E CA 1 ATOM 2685 C C . MET B 1 140 ? 21.467 -33.760 7.571 1.00 63.00 ? 135 MET E C 1 ATOM 2686 O O . MET B 1 140 ? 22.222 -34.240 8.411 1.00 63.45 ? 135 MET E O 1 ATOM 2687 C CB . MET B 1 140 ? 19.460 -35.199 7.204 1.00 64.92 ? 135 MET E CB 1 ATOM 2688 C CG . MET B 1 140 ? 18.496 -35.907 6.254 1.00 67.43 ? 135 MET E CG 1 ATOM 2689 S SD . MET B 1 140 ? 18.168 -35.023 4.712 1.00 68.49 ? 135 MET E SD 1 ATOM 2690 C CE . MET B 1 140 ? 16.570 -34.270 5.003 1.00 66.17 ? 135 MET E CE 1 ATOM 2691 N N . VAL B 1 141 ? 21.227 -32.456 7.471 1.00 60.35 ? 136 VAL E N 1 ATOM 2692 C CA . VAL B 1 141 ? 21.758 -31.490 8.440 1.00 57.83 ? 136 VAL E CA 1 ATOM 2693 C C . VAL B 1 141 ? 20.605 -30.750 9.136 1.00 54.26 ? 136 VAL E C 1 ATOM 2694 O O . VAL B 1 141 ? 19.648 -30.335 8.484 1.00 53.74 ? 136 VAL E O 1 ATOM 2695 C CB . VAL B 1 141 ? 22.757 -30.511 7.763 1.00 58.89 ? 136 VAL E CB 1 ATOM 2696 C CG1 . VAL B 1 141 ? 22.062 -29.550 6.802 1.00 58.51 ? 136 VAL E CG1 1 ATOM 2697 C CG2 . VAL B 1 141 ? 23.574 -29.750 8.801 1.00 57.71 ? 136 VAL E CG2 1 ATOM 2698 N N . THR B 1 142 ? 20.688 -30.614 10.460 1.00 52.23 ? 137 THR E N 1 ATOM 2699 C CA . THR B 1 142 ? 19.651 -29.947 11.243 1.00 49.30 ? 137 THR E CA 1 ATOM 2700 C C . THR B 1 142 ? 20.122 -28.569 11.679 1.00 47.81 ? 137 THR E C 1 ATOM 2701 O O . THR B 1 142 ? 21.204 -28.428 12.241 1.00 48.29 ? 137 THR E O 1 ATOM 2702 C CB . THR B 1 142 ? 19.256 -30.772 12.474 1.00 48.79 ? 137 THR E CB 1 ATOM 2703 O OG1 . THR B 1 142 ? 18.787 -32.051 12.054 1.00 50.64 ? 137 THR E OG1 1 ATOM 2704 C CG2 . THR B 1 142 ? 18.142 -30.097 13.247 1.00 46.45 ? 137 THR E CG2 1 ATOM 2705 N N . LEU B 1 143 ? 19.310 -27.556 11.396 1.00 46.60 ? 138 LEU E N 1 ATOM 2706 C CA . LEU B 1 143 ? 19.585 -26.179 11.798 1.00 45.53 ? 138 LEU E CA 1 ATOM 2707 C C . LEU B 1 143 ? 18.492 -25.717 12.725 1.00 43.49 ? 138 LEU E C 1 ATOM 2708 O O . LEU B 1 143 ? 17.519 -26.424 12.903 1.00 43.33 ? 138 LEU E O 1 ATOM 2709 C CB . LEU B 1 143 ? 19.638 -25.267 10.578 1.00 46.56 ? 138 LEU E CB 1 ATOM 2710 C CG . LEU B 1 143 ? 20.580 -25.707 9.460 1.00 49.40 ? 138 LEU E CG 1 ATOM 2711 C CD1 . LEU B 1 143 ? 20.361 -24.864 8.216 1.00 50.82 ? 138 LEU E CD1 1 ATOM 2712 C CD2 . LEU B 1 143 ? 22.014 -25.603 9.935 1.00 50.53 ? 138 LEU E CD2 1 ATOM 2713 N N . GLY B 1 144 ? 18.658 -24.539 13.316 1.00 42.60 ? 139 GLY E N 1 ATOM 2714 C CA . GLY B 1 144 ? 17.648 -24.003 14.197 1.00 41.26 ? 139 GLY E CA 1 ATOM 2715 C C . GLY B 1 144 ? 17.687 -22.502 14.384 1.00 41.08 ? 139 GLY E C 1 ATOM 2716 O O . GLY B 1 144 ? 18.560 -21.796 13.851 1.00 42.10 ? 139 GLY E O 1 ATOM 2717 N N . CYS B 1 145 ? 16.728 -22.041 15.182 1.00 40.35 ? 140 CYS E N 1 ATOM 2718 C CA . CYS B 1 145 ? 16.546 -20.639 15.504 1.00 40.34 ? 140 CYS E CA 1 ATOM 2719 C C . CYS B 1 145 ? 16.135 -20.576 16.973 1.00 38.62 ? 140 CYS E C 1 ATOM 2720 O O . CYS B 1 145 ? 15.276 -21.333 17.404 1.00 37.95 ? 140 CYS E O 1 ATOM 2721 C CB . CYS B 1 145 ? 15.539 -19.980 14.544 1.00 41.79 ? 140 CYS E CB 1 ATOM 2722 S SG . CYS B 1 145 ? 16.411 -18.818 13.467 1.00 45.45 ? 140 CYS E SG 1 ATOM 2723 N N . LEU B 1 146 ? 16.798 -19.726 17.748 1.00 38.22 ? 141 LEU E N 1 ATOM 2724 C CA . LEU B 1 146 ? 16.472 -19.534 19.149 1.00 37.41 ? 141 LEU E CA 1 ATOM 2725 C C . LEU B 1 146 ? 15.790 -18.193 19.289 1.00 37.24 ? 141 LEU E C 1 ATOM 2726 O O . LEU B 1 146 ? 16.358 -17.162 18.937 1.00 37.94 ? 141 LEU E O 1 ATOM 2727 C CB . LEU B 1 146 ? 17.725 -19.582 20.016 1.00 38.18 ? 141 LEU E CB 1 ATOM 2728 C CG . LEU B 1 146 ? 17.566 -19.260 21.516 1.00 38.39 ? 141 LEU E CG 1 ATOM 2729 C CD1 . LEU B 1 146 ? 16.629 -20.228 22.220 1.00 37.94 ? 141 LEU E CD1 1 ATOM 2730 C CD2 . LEU B 1 146 ? 18.924 -19.278 22.193 1.00 39.97 ? 141 LEU E CD2 1 ATOM 2731 N N . VAL B 1 147 ? 14.564 -18.221 19.804 1.00 36.87 ? 142 VAL E N 1 ATOM 2732 C CA . VAL B 1 147 ? 13.756 -17.032 19.983 1.00 37.22 ? 142 VAL E CA 1 ATOM 2733 C C . VAL B 1 147 ? 13.630 -16.824 21.475 1.00 37.30 ? 142 VAL E C 1 ATOM 2734 O O . VAL B 1 147 ? 13.000 -17.629 22.174 1.00 36.97 ? 142 VAL E O 1 ATOM 2735 C CB . VAL B 1 147 ? 12.374 -17.196 19.331 1.00 37.51 ? 142 VAL E CB 1 ATOM 2736 C CG1 . VAL B 1 147 ? 11.608 -15.877 19.366 1.00 38.64 ? 142 VAL E CG1 1 ATOM 2737 C CG2 . VAL B 1 147 ? 12.531 -17.676 17.888 1.00 37.74 ? 142 VAL E CG2 1 ATOM 2738 N N . LYS B 1 148 ? 14.215 -15.734 21.955 1.00 38.05 ? 143 LYS E N 1 ATOM 2739 C CA . LYS B 1 148 ? 14.409 -15.569 23.381 1.00 38.93 ? 143 LYS E CA 1 ATOM 2740 C C . LYS B 1 148 ? 13.864 -14.264 23.927 1.00 40.17 ? 143 LYS E C 1 ATOM 2741 O O . LYS B 1 148 ? 13.883 -13.232 23.252 1.00 40.83 ? 143 LYS E O 1 ATOM 2742 C CB . LYS B 1 148 ? 15.903 -15.654 23.661 1.00 39.90 ? 143 LYS E CB 1 ATOM 2743 C CG . LYS B 1 148 ? 16.267 -15.887 25.106 1.00 41.23 ? 143 LYS E CG 1 ATOM 2744 C CD . LYS B 1 148 ? 17.574 -16.658 25.195 1.00 42.26 ? 143 LYS E CD 1 ATOM 2745 C CE . LYS B 1 148 ? 17.885 -17.060 26.623 1.00 44.03 ? 143 LYS E CE 1 ATOM 2746 N NZ . LYS B 1 148 ? 18.016 -15.853 27.479 1.00 45.71 ? 143 LYS E NZ 1 ATOM 2747 N N . GLY B 1 149 ? 13.367 -14.323 25.161 1.00 41.04 ? 144 GLY E N 1 ATOM 2748 C CA . GLY B 1 149 ? 12.991 -13.126 25.915 1.00 42.50 ? 144 GLY E CA 1 ATOM 2749 C C . GLY B 1 149 ? 11.859 -12.271 25.364 1.00 43.08 ? 144 GLY E C 1 ATOM 2750 O O . GLY B 1 149 ? 11.972 -11.046 25.334 1.00 44.49 ? 144 GLY E O 1 ATOM 2751 N N . TYR B 1 150 ? 10.742 -12.895 24.981 1.00 42.55 ? 145 TYR E N 1 ATOM 2752 C CA . TYR B 1 150 ? 9.588 -12.137 24.469 1.00 43.68 ? 145 TYR E CA 1 ATOM 2753 C C . TYR B 1 150 ? 8.363 -12.297 25.347 1.00 45.33 ? 145 TYR E C 1 ATOM 2754 O O . TYR B 1 150 ? 8.225 -13.265 26.086 1.00 44.95 ? 145 TYR E O 1 ATOM 2755 C CB . TYR B 1 150 ? 9.217 -12.557 23.053 1.00 42.91 ? 145 TYR E CB 1 ATOM 2756 C CG . TYR B 1 150 ? 8.751 -13.985 22.931 1.00 41.79 ? 145 TYR E CG 1 ATOM 2757 C CD1 . TYR B 1 150 ? 9.666 -15.022 22.806 1.00 40.02 ? 145 TYR E CD1 1 ATOM 2758 C CD2 . TYR B 1 150 ? 7.392 -14.298 22.941 1.00 43.07 ? 145 TYR E CD2 1 ATOM 2759 C CE1 . TYR B 1 150 ? 9.252 -16.330 22.698 1.00 39.68 ? 145 TYR E CE1 1 ATOM 2760 C CE2 . TYR B 1 150 ? 6.965 -15.611 22.830 1.00 42.69 ? 145 TYR E CE2 1 ATOM 2761 C CZ . TYR B 1 150 ? 7.898 -16.620 22.707 1.00 40.92 ? 145 TYR E CZ 1 ATOM 2762 O OH . TYR B 1 150 ? 7.478 -17.909 22.597 1.00 40.86 ? 145 TYR E OH 1 ATOM 2763 N N . PHE B 1 151 ? 7.450 -11.345 25.211 1.00 47.69 ? 146 PHE E N 1 ATOM 2764 C CA . PHE B 1 151 ? 6.192 -11.375 25.929 1.00 49.75 ? 146 PHE E CA 1 ATOM 2765 C C . PHE B 1 151 ? 5.204 -10.422 25.274 1.00 52.17 ? 146 PHE E C 1 ATOM 2766 O O . PHE B 1 151 ? 5.581 -9.319 24.898 1.00 52.93 ? 146 PHE E O 1 ATOM 2767 C CB . PHE B 1 151 ? 6.409 -10.962 27.379 1.00 50.95 ? 146 PHE E CB 1 ATOM 2768 C CG . PHE B 1 151 ? 5.178 -11.071 28.220 1.00 53.50 ? 146 PHE E CG 1 ATOM 2769 C CD1 . PHE B 1 151 ? 4.240 -10.046 28.240 1.00 56.30 ? 146 PHE E CD1 1 ATOM 2770 C CD2 . PHE B 1 151 ? 4.952 -12.195 28.989 1.00 53.63 ? 146 PHE E CD2 1 ATOM 2771 C CE1 . PHE B 1 151 ? 3.103 -10.145 29.011 1.00 58.86 ? 146 PHE E CE1 1 ATOM 2772 C CE2 . PHE B 1 151 ? 3.826 -12.290 29.770 1.00 56.40 ? 146 PHE E CE2 1 ATOM 2773 C CZ . PHE B 1 151 ? 2.898 -11.266 29.779 1.00 58.97 ? 146 PHE E CZ 1 ATOM 2774 N N . PRO B 1 152 ? 3.927 -10.829 25.151 1.00 54.16 ? 147 PRO E N 1 ATOM 2775 C CA . PRO B 1 152 ? 3.340 -12.113 25.517 1.00 54.20 ? 147 PRO E CA 1 ATOM 2776 C C . PRO B 1 152 ? 3.483 -13.129 24.394 1.00 52.75 ? 147 PRO E C 1 ATOM 2777 O O . PRO B 1 152 ? 4.046 -12.827 23.342 1.00 52.01 ? 147 PRO E O 1 ATOM 2778 C CB . PRO B 1 152 ? 1.860 -11.758 25.704 1.00 57.76 ? 147 PRO E CB 1 ATOM 2779 C CG . PRO B 1 152 ? 1.623 -10.700 24.684 1.00 59.05 ? 147 PRO E CG 1 ATOM 2780 C CD . PRO B 1 152 ? 2.911 -9.924 24.578 1.00 57.16 ? 147 PRO E CD 1 ATOM 2781 N N . GLU B 1 153 ? 2.961 -14.324 24.613 1.00 53.21 ? 148 GLU E N 1 ATOM 2782 C CA . GLU B 1 153 ? 2.773 -15.265 23.522 1.00 52.91 ? 148 GLU E CA 1 ATOM 2783 C C . GLU B 1 153 ? 1.703 -14.749 22.562 1.00 55.53 ? 148 GLU E C 1 ATOM 2784 O O . GLU B 1 153 ? 0.875 -13.925 22.943 1.00 58.23 ? 148 GLU E O 1 ATOM 2785 C CB . GLU B 1 153 ? 2.349 -16.615 24.069 1.00 53.85 ? 148 GLU E CB 1 ATOM 2786 C CG . GLU B 1 153 ? 3.423 -17.329 24.856 1.00 52.08 ? 148 GLU E CG 1 ATOM 2787 C CD . GLU B 1 153 ? 3.208 -18.829 24.787 1.00 52.85 ? 148 GLU E CD 1 ATOM 2788 O OE1 . GLU B 1 153 ? 2.521 -19.385 25.670 1.00 55.68 ? 148 GLU E OE1 1 ATOM 2789 O OE2 . GLU B 1 153 ? 3.681 -19.442 23.809 1.00 51.64 ? 148 GLU E OE2 1 ATOM 2790 N N . PRO B 1 154 ? 1.701 -15.232 21.310 1.00 55.42 ? 149 PRO E N 1 ATOM 2791 C CA . PRO B 1 154 ? 2.627 -16.186 20.723 1.00 52.80 ? 149 PRO E CA 1 ATOM 2792 C C . PRO B 1 154 ? 3.654 -15.539 19.815 1.00 51.18 ? 149 PRO E C 1 ATOM 2793 O O . PRO B 1 154 ? 3.545 -14.358 19.502 1.00 52.37 ? 149 PRO E O 1 ATOM 2794 C CB . PRO B 1 154 ? 1.702 -17.051 19.867 1.00 55.24 ? 149 PRO E CB 1 ATOM 2795 C CG . PRO B 1 154 ? 0.653 -16.088 19.388 1.00 58.68 ? 149 PRO E CG 1 ATOM 2796 C CD . PRO B 1 154 ? 0.566 -14.971 20.403 1.00 58.97 ? 149 PRO E CD 1 ATOM 2797 N N . VAL B 1 155 ? 4.641 -16.329 19.402 1.00 48.98 ? 150 VAL E N 1 ATOM 2798 C CA . VAL B 1 155 ? 5.435 -16.033 18.214 1.00 48.62 ? 150 VAL E CA 1 ATOM 2799 C C . VAL B 1 155 ? 5.155 -17.126 17.192 1.00 49.56 ? 150 VAL E C 1 ATOM 2800 O O . VAL B 1 155 ? 4.816 -18.255 17.566 1.00 49.26 ? 150 VAL E O 1 ATOM 2801 C CB . VAL B 1 155 ? 6.957 -16.015 18.472 1.00 46.04 ? 150 VAL E CB 1 ATOM 2802 C CG1 . VAL B 1 155 ? 7.343 -14.867 19.393 1.00 45.70 ? 150 VAL E CG1 1 ATOM 2803 C CG2 . VAL B 1 155 ? 7.437 -17.345 19.040 1.00 44.40 ? 150 VAL E CG2 1 ATOM 2804 N N . THR B 1 156 ? 5.304 -16.790 15.909 1.00 50.93 ? 151 THR E N 1 ATOM 2805 C CA . THR B 1 156 ? 5.216 -17.781 14.846 1.00 51.75 ? 151 THR E CA 1 ATOM 2806 C C . THR B 1 156 ? 6.568 -17.842 14.158 1.00 49.86 ? 151 THR E C 1 ATOM 2807 O O . THR B 1 156 ? 7.220 -16.820 13.958 1.00 49.95 ? 151 THR E O 1 ATOM 2808 C CB . THR B 1 156 ? 4.193 -17.405 13.770 1.00 55.73 ? 151 THR E CB 1 ATOM 2809 O OG1 . THR B 1 156 ? 4.712 -16.288 13.037 1.00 56.77 ? 151 THR E OG1 1 ATOM 2810 C CG2 . THR B 1 156 ? 2.830 -17.061 14.381 1.00 58.34 ? 151 THR E CG2 1 ATOM 2811 N N . VAL B 1 157 ? 6.967 -19.041 13.772 1.00 48.85 ? 152 VAL E N 1 ATOM 2812 C CA . VAL B 1 157 ? 8.241 -19.249 13.111 1.00 47.51 ? 152 VAL E CA 1 ATOM 2813 C C . VAL B 1 157 ? 8.000 -19.938 11.787 1.00 49.36 ? 152 VAL E C 1 ATOM 2814 O O . VAL B 1 157 ? 7.324 -20.951 11.734 1.00 50.78 ? 152 VAL E O 1 ATOM 2815 C CB . VAL B 1 157 ? 9.183 -20.115 13.968 1.00 45.00 ? 152 VAL E CB 1 ATOM 2816 C CG1 . VAL B 1 157 ? 10.534 -20.273 13.291 1.00 44.44 ? 152 VAL E CG1 1 ATOM 2817 C CG2 . VAL B 1 157 ? 9.374 -19.484 15.336 1.00 43.50 ? 152 VAL E CG2 1 ATOM 2818 N N . THR B 1 158 ? 8.548 -19.390 10.714 1.00 50.07 ? 153 THR E N 1 ATOM 2819 C CA . THR B 1 158 ? 8.521 -20.073 9.430 1.00 51.84 ? 153 THR E CA 1 ATOM 2820 C C . THR B 1 158 ? 9.950 -20.129 8.931 1.00 50.48 ? 153 THR E C 1 ATOM 2821 O O . THR B 1 158 ? 10.824 -19.484 9.490 1.00 48.31 ? 153 THR E O 1 ATOM 2822 C CB . THR B 1 158 ? 7.606 -19.363 8.409 1.00 55.71 ? 153 THR E CB 1 ATOM 2823 O OG1 . THR B 1 158 ? 8.096 -18.048 8.147 1.00 56.16 ? 153 THR E OG1 1 ATOM 2824 C CG2 . THR B 1 158 ? 6.189 -19.255 8.937 1.00 57.08 ? 153 THR E CG2 1 ATOM 2825 N N . TRP B 1 159 ? 10.186 -20.927 7.903 1.00 51.90 ? 154 TRP E N 1 ATOM 2826 C CA . TRP B 1 159 ? 11.513 -21.059 7.330 1.00 51.67 ? 154 TRP E CA 1 ATOM 2827 C C . TRP B 1 159 ? 11.429 -20.786 5.842 1.00 55.38 ? 154 TRP E C 1 ATOM 2828 O O . TRP B 1 159 ? 10.571 -21.347 5.154 1.00 57.79 ? 154 TRP E O 1 ATOM 2829 C CB . TRP B 1 159 ? 12.054 -22.458 7.587 1.00 50.41 ? 154 TRP E CB 1 ATOM 2830 C CG . TRP B 1 159 ? 12.416 -22.717 9.012 1.00 47.17 ? 154 TRP E CG 1 ATOM 2831 C CD1 . TRP B 1 159 ? 11.626 -23.277 9.969 1.00 46.05 ? 154 TRP E CD1 1 ATOM 2832 C CD2 . TRP B 1 159 ? 13.671 -22.433 9.643 1.00 45.32 ? 154 TRP E CD2 1 ATOM 2833 N NE1 . TRP B 1 159 ? 12.314 -23.368 11.162 1.00 43.63 ? 154 TRP E NE1 1 ATOM 2834 C CE2 . TRP B 1 159 ? 13.572 -22.859 10.986 1.00 43.23 ? 154 TRP E CE2 1 ATOM 2835 C CE3 . TRP B 1 159 ? 14.870 -21.861 9.203 1.00 45.84 ? 154 TRP E CE3 1 ATOM 2836 C CZ2 . TRP B 1 159 ? 14.624 -22.727 11.895 1.00 41.64 ? 154 TRP E CZ2 1 ATOM 2837 C CZ3 . TRP B 1 159 ? 15.918 -21.738 10.102 1.00 44.29 ? 154 TRP E CZ3 1 ATOM 2838 C CH2 . TRP B 1 159 ? 15.787 -22.168 11.435 1.00 42.21 ? 154 TRP E CH2 1 ATOM 2839 N N . ASN B 1 160 ? 12.316 -19.918 5.358 1.00 56.30 ? 155 ASN E N 1 ATOM 2840 C CA . ASN B 1 160 ? 12.311 -19.482 3.962 1.00 60.54 ? 155 ASN E CA 1 ATOM 2841 C C . ASN B 1 160 ? 10.916 -19.046 3.523 1.00 63.53 ? 155 ASN E C 1 ATOM 2842 O O . ASN B 1 160 ? 10.394 -19.516 2.515 1.00 66.89 ? 155 ASN E O 1 ATOM 2843 C CB . ASN B 1 160 ? 12.860 -20.588 3.053 1.00 62.20 ? 155 ASN E CB 1 ATOM 2844 C CG . ASN B 1 160 ? 14.362 -20.775 3.199 1.00 60.84 ? 155 ASN E CG 1 ATOM 2845 O OD1 . ASN B 1 160 ? 15.051 -19.958 3.816 1.00 59.26 ? 155 ASN E OD1 1 ATOM 2846 N ND2 . ASN B 1 160 ? 14.881 -21.846 2.613 1.00 61.93 ? 155 ASN E ND2 1 ATOM 2847 N N . SER B 1 161 ? 10.319 -18.159 4.320 1.00 62.63 ? 156 SER E N 1 ATOM 2848 C CA . SER B 1 161 ? 8.957 -17.642 4.080 1.00 65.73 ? 156 SER E CA 1 ATOM 2849 C C . SER B 1 161 ? 7.841 -18.711 4.067 1.00 66.81 ? 156 SER E C 1 ATOM 2850 O O . SER B 1 161 ? 6.754 -18.446 3.558 1.00 70.60 ? 156 SER E O 1 ATOM 2851 C CB . SER B 1 161 ? 8.931 -16.871 2.759 1.00 70.83 ? 156 SER E CB 1 ATOM 2852 O OG . SER B 1 161 ? 10.024 -15.975 2.681 1.00 70.69 ? 156 SER E OG 1 ATOM 2853 N N . GLY B 1 162 ? 8.086 -19.891 4.643 1.00 64.20 ? 157 GLY E N 1 ATOM 2854 C CA . GLY B 1 162 ? 7.119 -20.980 4.601 1.00 65.72 ? 157 GLY E CA 1 ATOM 2855 C C . GLY B 1 162 ? 7.328 -21.965 3.463 1.00 68.72 ? 157 GLY E C 1 ATOM 2856 O O . GLY B 1 162 ? 6.571 -22.930 3.336 1.00 70.51 ? 157 GLY E O 1 ATOM 2857 N N . SER B 1 163 ? 8.341 -21.731 2.629 1.00 69.87 ? 158 SER E N 1 ATOM 2858 C CA . SER B 1 163 ? 8.689 -22.685 1.578 1.00 72.78 ? 158 SER E CA 1 ATOM 2859 C C . SER B 1 163 ? 9.246 -23.989 2.142 1.00 70.29 ? 158 SER E C 1 ATOM 2860 O O . SER B 1 163 ? 9.044 -25.053 1.565 1.00 72.39 ? 158 SER E O 1 ATOM 2861 C CB . SER B 1 163 ? 9.696 -22.064 0.626 1.00 74.61 ? 158 SER E CB 1 ATOM 2862 O OG . SER B 1 163 ? 9.151 -20.920 0.009 1.00 78.10 ? 158 SER E OG 1 ATOM 2863 N N . LEU B 1 164 ? 9.964 -23.892 3.259 1.00 66.56 ? 159 LEU E N 1 ATOM 2864 C CA . LEU B 1 164 ? 10.375 -25.070 4.025 1.00 64.51 ? 159 LEU E CA 1 ATOM 2865 C C . LEU B 1 164 ? 9.311 -25.421 5.052 1.00 63.51 ? 159 LEU E C 1 ATOM 2866 O O . LEU B 1 164 ? 9.293 -24.848 6.148 1.00 60.69 ? 159 LEU E O 1 ATOM 2867 C CB . LEU B 1 164 ? 11.703 -24.816 4.750 1.00 61.28 ? 159 LEU E CB 1 ATOM 2868 C CG . LEU B 1 164 ? 12.986 -25.184 4.008 1.00 62.55 ? 159 LEU E CG 1 ATOM 2869 C CD1 . LEU B 1 164 ? 14.176 -24.763 4.850 1.00 59.69 ? 159 LEU E CD1 1 ATOM 2870 C CD2 . LEU B 1 164 ? 13.041 -26.680 3.709 1.00 64.06 ? 159 LEU E CD2 1 ATOM 2871 N N . SER B 1 165 ? 8.441 -26.367 4.701 1.00 68.34 ? 160 SER E N 1 ATOM 2872 C CA . SER B 1 165 ? 7.373 -26.816 5.592 1.00 67.75 ? 160 SER E CA 1 ATOM 2873 C C . SER B 1 165 ? 7.784 -28.106 6.290 1.00 65.35 ? 160 SER E C 1 ATOM 2874 O O . SER B 1 165 ? 7.749 -28.190 7.515 1.00 61.82 ? 160 SER E O 1 ATOM 2875 C CB . SER B 1 165 ? 6.078 -27.057 4.806 1.00 73.76 ? 160 SER E CB 1 ATOM 2876 O OG . SER B 1 165 ? 5.793 -25.992 3.911 1.00 77.43 ? 160 SER E OG 1 ATOM 2877 N N . SER B 1 166 ? 8.178 -29.099 5.492 1.00 67.76 ? 161 SER E N 1 ATOM 2878 C CA . SER B 1 166 ? 8.507 -30.437 5.981 1.00 66.79 ? 161 SER E CA 1 ATOM 2879 C C . SER B 1 166 ? 9.801 -30.395 6.761 1.00 62.02 ? 161 SER E C 1 ATOM 2880 O O . SER B 1 166 ? 10.623 -29.503 6.540 1.00 60.62 ? 161 SER E O 1 ATOM 2881 C CB . SER B 1 166 ? 8.645 -31.432 4.819 1.00 71.49 ? 161 SER E CB 1 ATOM 2882 O OG . SER B 1 166 ? 7.377 -31.732 4.268 1.00 76.45 ? 161 SER E OG 1 ATOM 2883 N N . GLY B 1 167 ? 9.968 -31.359 7.667 1.00 60.23 ? 162 GLY E N 1 ATOM 2884 C CA . GLY B 1 167 ? 11.153 -31.462 8.515 1.00 56.44 ? 162 GLY E CA 1 ATOM 2885 C C . GLY B 1 167 ? 11.330 -30.322 9.510 1.00 52.37 ? 162 GLY E C 1 ATOM 2886 O O . GLY B 1 167 ? 12.452 -30.033 9.905 1.00 50.21 ? 162 GLY E O 1 ATOM 2887 N N . VAL B 1 168 ? 10.232 -29.676 9.907 1.00 51.70 ? 163 VAL E N 1 ATOM 2888 C CA . VAL B 1 168 ? 10.263 -28.583 10.884 1.00 48.07 ? 163 VAL E CA 1 ATOM 2889 C C . VAL B 1 168 ? 9.654 -29.044 12.199 1.00 46.79 ? 163 VAL E C 1 ATOM 2890 O O . VAL B 1 168 ? 8.687 -29.801 12.201 1.00 49.28 ? 163 VAL E O 1 ATOM 2891 C CB . VAL B 1 168 ? 9.487 -27.346 10.376 1.00 48.96 ? 163 VAL E CB 1 ATOM 2892 C CG1 . VAL B 1 168 ? 9.364 -26.288 11.464 1.00 46.13 ? 163 VAL E CG1 1 ATOM 2893 C CG2 . VAL B 1 168 ? 10.166 -26.767 9.148 1.00 50.41 ? 163 VAL E CG2 1 ATOM 2894 N N . HIS B 1 169 ? 10.240 -28.595 13.309 1.00 43.55 ? 164 HIS E N 1 ATOM 2895 C CA . HIS B 1 169 ? 9.649 -28.737 14.631 1.00 42.34 ? 164 HIS E CA 1 ATOM 2896 C C . HIS B 1 169 ? 9.801 -27.374 15.280 1.00 39.87 ? 164 HIS E C 1 ATOM 2897 O O . HIS B 1 169 ? 10.898 -26.850 15.355 1.00 38.28 ? 164 HIS E O 1 ATOM 2898 C CB . HIS B 1 169 ? 10.380 -29.788 15.467 1.00 41.84 ? 164 HIS E CB 1 ATOM 2899 C CG . HIS B 1 169 ? 10.465 -31.130 14.817 1.00 44.41 ? 164 HIS E CG 1 ATOM 2900 N ND1 . HIS B 1 169 ? 9.365 -31.932 14.625 1.00 47.33 ? 164 HIS E ND1 1 ATOM 2901 C CD2 . HIS B 1 169 ? 11.522 -31.824 14.335 1.00 45.16 ? 164 HIS E CD2 1 ATOM 2902 C CE1 . HIS B 1 169 ? 9.738 -33.063 14.050 1.00 49.62 ? 164 HIS E CE1 1 ATOM 2903 N NE2 . HIS B 1 169 ? 11.044 -33.025 13.867 1.00 48.19 ? 164 HIS E NE2 1 ATOM 2904 N N . THR B 1 170 ? 8.701 -26.777 15.697 1.00 40.03 ? 165 THR E N 1 ATOM 2905 C CA . THR B 1 170 ? 8.758 -25.599 16.546 1.00 38.14 ? 165 THR E CA 1 ATOM 2906 C C . THR B 1 170 ? 8.224 -26.020 17.891 1.00 37.88 ? 165 THR E C 1 ATOM 2907 O O . THR B 1 170 ? 7.140 -26.573 17.989 1.00 39.99 ? 165 THR E O 1 ATOM 2908 C CB . THR B 1 170 ? 7.951 -24.442 15.963 1.00 39.31 ? 165 THR E CB 1 ATOM 2909 O OG1 . THR B 1 170 ? 8.509 -24.116 14.688 1.00 40.38 ? 165 THR E OG1 1 ATOM 2910 C CG2 . THR B 1 170 ? 8.059 -23.205 16.822 1.00 37.91 ? 165 THR E CG2 1 ATOM 2911 N N . PHE B 1 171 ? 9.013 -25.796 18.928 1.00 36.06 ? 166 PHE E N 1 ATOM 2912 C CA . PHE B 1 171 ? 8.698 -26.306 20.257 1.00 36.25 ? 166 PHE E CA 1 ATOM 2913 C C . PHE B 1 171 ? 7.857 -25.309 21.058 1.00 36.13 ? 166 PHE E C 1 ATOM 2914 O O . PHE B 1 171 ? 7.911 -24.113 20.823 1.00 35.23 ? 166 PHE E O 1 ATOM 2915 C CB . PHE B 1 171 ? 10.001 -26.667 20.982 1.00 35.38 ? 166 PHE E CB 1 ATOM 2916 C CG . PHE B 1 171 ? 10.791 -27.722 20.276 1.00 35.83 ? 166 PHE E CG 1 ATOM 2917 C CD1 . PHE B 1 171 ? 11.707 -27.382 19.297 1.00 34.95 ? 166 PHE E CD1 1 ATOM 2918 C CD2 . PHE B 1 171 ? 10.591 -29.074 20.570 1.00 37.72 ? 166 PHE E CD2 1 ATOM 2919 C CE1 . PHE B 1 171 ? 12.415 -28.366 18.621 1.00 35.78 ? 166 PHE E CE1 1 ATOM 2920 C CE2 . PHE B 1 171 ? 11.298 -30.059 19.899 1.00 38.49 ? 166 PHE E CE2 1 ATOM 2921 C CZ . PHE B 1 171 ? 12.209 -29.705 18.926 1.00 37.50 ? 166 PHE E CZ 1 ATOM 2922 N N . PRO B 1 172 ? 7.048 -25.811 21.996 1.00 37.66 ? 167 PRO E N 1 ATOM 2923 C CA . PRO B 1 172 ? 6.275 -24.887 22.829 1.00 38.16 ? 167 PRO E CA 1 ATOM 2924 C C . PRO B 1 172 ? 7.141 -23.949 23.658 1.00 36.72 ? 167 PRO E C 1 ATOM 2925 O O . PRO B 1 172 ? 8.183 -24.338 24.154 1.00 36.04 ? 167 PRO E O 1 ATOM 2926 C CB . PRO B 1 172 ? 5.502 -25.824 23.770 1.00 40.39 ? 167 PRO E CB 1 ATOM 2927 C CG . PRO B 1 172 ? 5.400 -27.109 23.036 1.00 41.56 ? 167 PRO E CG 1 ATOM 2928 C CD . PRO B 1 172 ? 6.652 -27.219 22.215 1.00 39.55 ? 167 PRO E CD 1 ATOM 2929 N N . ALA B 1 173 ? 6.677 -22.729 23.843 1.00 37.04 ? 168 ALA E N 1 ATOM 2930 C CA . ALA B 1 173 ? 7.389 -21.758 24.654 1.00 36.72 ? 168 ALA E CA 1 ATOM 2931 C C . ALA B 1 173 ? 7.463 -22.215 26.112 1.00 38.16 ? 168 ALA E C 1 ATOM 2932 O O . ALA B 1 173 ? 6.673 -23.031 26.560 1.00 39.49 ? 168 ALA E O 1 ATOM 2933 C CB . ALA B 1 173 ? 6.708 -20.400 24.546 1.00 37.34 ? 168 ALA E CB 1 ATOM 2934 N N . VAL B 1 174 ? 8.454 -21.712 26.828 1.00 38.49 ? 169 VAL E N 1 ATOM 2935 C CA . VAL B 1 174 ? 8.504 -21.851 28.275 1.00 40.82 ? 169 VAL E CA 1 ATOM 2936 C C . VAL B 1 174 ? 8.856 -20.499 28.889 1.00 41.80 ? 169 VAL E C 1 ATOM 2937 O O . VAL B 1 174 ? 9.489 -19.657 28.234 1.00 40.49 ? 169 VAL E O 1 ATOM 2938 C CB . VAL B 1 174 ? 9.502 -22.941 28.726 1.00 41.42 ? 169 VAL E CB 1 ATOM 2939 C CG1 . VAL B 1 174 ? 9.146 -24.281 28.094 1.00 41.27 ? 169 VAL E CG1 1 ATOM 2940 C CG2 . VAL B 1 174 ? 10.932 -22.564 28.370 1.00 40.48 ? 169 VAL E CG2 1 ATOM 2941 N N . LEU B 1 175 ? 8.419 -20.287 30.131 1.00 44.75 ? 170 LEU E N 1 ATOM 2942 C CA . LEU B 1 175 ? 8.751 -19.069 30.840 1.00 46.51 ? 170 LEU E CA 1 ATOM 2943 C C . LEU B 1 175 ? 10.192 -19.124 31.284 1.00 47.73 ? 170 LEU E C 1 ATOM 2944 O O . LEU B 1 175 ? 10.703 -20.181 31.617 1.00 48.78 ? 170 LEU E O 1 ATOM 2945 C CB . LEU B 1 175 ? 7.831 -18.834 32.039 1.00 49.46 ? 170 LEU E CB 1 ATOM 2946 C CG . LEU B 1 175 ? 6.806 -17.706 32.038 1.00 50.47 ? 170 LEU E CG 1 ATOM 2947 C CD1 . LEU B 1 175 ? 7.182 -16.555 31.120 1.00 48.86 ? 170 LEU E CD1 1 ATOM 2948 C CD2 . LEU B 1 175 ? 5.430 -18.247 31.684 1.00 50.80 ? 170 LEU E CD2 1 ATOM 2949 N N . GLN B 1 176 ? 10.847 -17.974 31.268 1.00 48.69 ? 171 GLN E N 1 ATOM 2950 C CA . GLN B 1 176 ? 12.194 -17.856 31.778 1.00 50.99 ? 171 GLN E CA 1 ATOM 2951 C C . GLN B 1 176 ? 12.246 -16.505 32.503 1.00 53.55 ? 171 GLN E C 1 ATOM 2952 O O . GLN B 1 176 ? 12.377 -15.453 31.882 1.00 53.16 ? 171 GLN E O 1 ATOM 2953 C CB . GLN B 1 176 ? 13.206 -17.988 30.649 1.00 49.53 ? 171 GLN E CB 1 ATOM 2954 C CG . GLN B 1 176 ? 14.634 -17.860 31.103 1.00 52.47 ? 171 GLN E CG 1 ATOM 2955 C CD . GLN B 1 176 ? 15.577 -18.283 29.980 1.00 51.26 ? 171 GLN E CD 1 ATOM 2956 O OE1 . GLN B 1 176 ? 15.187 -18.229 28.811 1.00 48.71 ? 171 GLN E OE1 1 ATOM 2957 N NE2 . GLN B 1 176 ? 16.809 -18.702 30.313 1.00 53.70 ? 171 GLN E NE2 1 ATOM 2958 N N . SER B 1 177 ? 12.104 -16.560 33.825 1.00 56.69 ? 172 SER E N 1 ATOM 2959 C CA . SER B 1 177 ? 11.682 -15.417 34.636 1.00 59.32 ? 172 SER E CA 1 ATOM 2960 C C . SER B 1 177 ? 10.319 -14.949 34.121 1.00 57.16 ? 172 SER E C 1 ATOM 2961 O O . SER B 1 177 ? 9.404 -15.767 34.018 1.00 56.16 ? 172 SER E O 1 ATOM 2962 C CB . SER B 1 177 ? 12.760 -14.336 34.707 1.00 61.65 ? 172 SER E CB 1 ATOM 2963 O OG . SER B 1 177 ? 13.763 -14.656 35.666 1.00 65.61 ? 172 SER E OG 1 ATOM 2964 N N . ASP B 1 178 ? 10.166 -13.671 33.800 1.00 56.88 ? 173 ASP E N 1 ATOM 2965 C CA . ASP B 1 178 ? 8.915 -13.179 33.206 1.00 55.53 ? 173 ASP E CA 1 ATOM 2966 C C . ASP B 1 178 ? 8.788 -13.340 31.688 1.00 51.61 ? 173 ASP E C 1 ATOM 2967 O O . ASP B 1 178 ? 7.781 -12.936 31.121 1.00 51.21 ? 173 ASP E O 1 ATOM 2968 C CB . ASP B 1 178 ? 8.702 -11.688 33.521 1.00 58.52 ? 173 ASP E CB 1 ATOM 2969 C CG . ASP B 1 178 ? 8.503 -11.402 34.990 1.00 62.73 ? 173 ASP E CG 1 ATOM 2970 O OD1 . ASP B 1 178 ? 7.934 -12.254 35.709 1.00 63.52 ? 173 ASP E OD1 1 ATOM 2971 O OD2 . ASP B 1 178 ? 8.900 -10.289 35.405 1.00 65.56 ? 173 ASP E OD2 1 ATOM 2972 N N . LEU B 1 179 ? 9.780 -13.905 31.012 1.00 49.21 ? 174 LEU E N 1 ATOM 2973 C CA . LEU B 1 179 ? 9.766 -13.842 29.557 1.00 46.54 ? 174 LEU E CA 1 ATOM 2974 C C . LEU B 1 179 ? 9.831 -15.222 28.916 1.00 43.98 ? 174 LEU E C 1 ATOM 2975 O O . LEU B 1 179 ? 10.357 -16.171 29.484 1.00 43.95 ? 174 LEU E O 1 ATOM 2976 C CB . LEU B 1 179 ? 10.914 -12.980 29.027 1.00 46.73 ? 174 LEU E CB 1 ATOM 2977 C CG . LEU B 1 179 ? 11.082 -11.533 29.529 1.00 49.83 ? 174 LEU E CG 1 ATOM 2978 C CD1 . LEU B 1 179 ? 12.388 -10.933 29.011 1.00 50.31 ? 174 LEU E CD1 1 ATOM 2979 C CD2 . LEU B 1 179 ? 9.914 -10.640 29.128 1.00 50.72 ? 174 LEU E CD2 1 ATOM 2980 N N . TYR B 1 180 ? 9.290 -15.310 27.714 1.00 42.47 ? 175 TYR E N 1 ATOM 2981 C CA . TYR B 1 180 ? 9.152 -16.581 27.022 1.00 40.74 ? 175 TYR E CA 1 ATOM 2982 C C . TYR B 1 180 ? 10.314 -16.846 26.089 1.00 39.32 ? 175 TYR E C 1 ATOM 2983 O O . TYR B 1 180 ? 10.910 -15.926 25.544 1.00 39.20 ? 175 TYR E O 1 ATOM 2984 C CB . TYR B 1 180 ? 7.871 -16.623 26.206 1.00 40.68 ? 175 TYR E CB 1 ATOM 2985 C CG . TYR B 1 180 ? 6.619 -16.715 27.042 1.00 42.76 ? 175 TYR E CG 1 ATOM 2986 C CD1 . TYR B 1 180 ? 6.201 -17.935 27.574 1.00 43.01 ? 175 TYR E CD1 1 ATOM 2987 C CD2 . TYR B 1 180 ? 5.840 -15.580 27.300 1.00 44.93 ? 175 TYR E CD2 1 ATOM 2988 C CE1 . TYR B 1 180 ? 5.048 -18.023 28.337 1.00 45.32 ? 175 TYR E CE1 1 ATOM 2989 C CE2 . TYR B 1 180 ? 4.683 -15.655 28.067 1.00 47.13 ? 175 TYR E CE2 1 ATOM 2990 C CZ . TYR B 1 180 ? 4.291 -16.878 28.579 1.00 47.44 ? 175 TYR E CZ 1 ATOM 2991 O OH . TYR B 1 180 ? 3.144 -16.951 29.346 1.00 50.36 ? 175 TYR E OH 1 ATOM 2992 N N . THR B 1 181 ? 10.591 -18.128 25.893 1.00 38.59 ? 176 THR E N 1 ATOM 2993 C CA . THR B 1 181 ? 11.648 -18.585 25.012 1.00 37.78 ? 176 THR E CA 1 ATOM 2994 C C . THR B 1 181 ? 11.207 -19.833 24.294 1.00 36.72 ? 176 THR E C 1 ATOM 2995 O O . THR B 1 181 ? 10.720 -20.764 24.921 1.00 37.15 ? 176 THR E O 1 ATOM 2996 C CB . THR B 1 181 ? 12.912 -19.018 25.781 1.00 38.88 ? 176 THR E CB 1 ATOM 2997 O OG1 . THR B 1 181 ? 13.409 -17.943 26.573 1.00 41.24 ? 176 THR E OG1 1 ATOM 2998 C CG2 . THR B 1 181 ? 14.014 -19.456 24.806 1.00 38.19 ? 176 THR E CG2 1 ATOM 2999 N N . LEU B 1 182 ? 11.412 -19.872 22.987 1.00 36.04 ? 177 LEU E N 1 ATOM 3000 C CA . LEU B 1 182 ? 11.304 -21.127 22.279 1.00 35.65 ? 177 LEU E CA 1 ATOM 3001 C C . LEU B 1 182 ? 12.395 -21.276 21.231 1.00 35.23 ? 177 LEU E C 1 ATOM 3002 O O . LEU B 1 182 ? 13.223 -20.385 21.022 1.00 35.36 ? 177 LEU E O 1 ATOM 3003 C CB . LEU B 1 182 ? 9.911 -21.285 21.661 1.00 36.22 ? 177 LEU E CB 1 ATOM 3004 C CG . LEU B 1 182 ? 9.431 -20.345 20.558 1.00 36.70 ? 177 LEU E CG 1 ATOM 3005 C CD1 . LEU B 1 182 ? 10.153 -20.584 19.235 1.00 36.63 ? 177 LEU E CD1 1 ATOM 3006 C CD2 . LEU B 1 182 ? 7.940 -20.564 20.376 1.00 38.00 ? 177 LEU E CD2 1 ATOM 3007 N N . SER B 1 183 ? 12.408 -22.435 20.599 1.00 34.98 ? 178 SER E N 1 ATOM 3008 C CA . SER B 1 183 ? 13.274 -22.666 19.468 1.00 35.07 ? 178 SER E CA 1 ATOM 3009 C C . SER B 1 183 ? 12.534 -23.448 18.403 1.00 35.11 ? 178 SER E C 1 ATOM 3010 O O . SER B 1 183 ? 11.434 -23.972 18.627 1.00 36.02 ? 178 SER E O 1 ATOM 3011 C CB . SER B 1 183 ? 14.526 -23.404 19.924 1.00 35.87 ? 178 SER E CB 1 ATOM 3012 O OG . SER B 1 183 ? 14.109 -24.561 20.642 1.00 37.04 ? 178 SER E OG 1 ATOM 3013 N N . SER B 1 184 ? 13.117 -23.473 17.220 1.00 34.80 ? 179 SER E N 1 ATOM 3014 C CA . SER B 1 184 ? 12.552 -24.175 16.082 1.00 35.43 ? 179 SER E CA 1 ATOM 3015 C C . SER B 1 184 ? 13.689 -24.852 15.375 1.00 35.54 ? 179 SER E C 1 ATOM 3016 O O . SER B 1 184 ? 14.754 -24.254 15.227 1.00 34.94 ? 179 SER E O 1 ATOM 3017 C CB . SER B 1 184 ? 11.897 -23.191 15.121 1.00 36.52 ? 179 SER E CB 1 ATOM 3018 O OG . SER B 1 184 ? 11.348 -23.854 14.012 1.00 38.30 ? 179 SER E OG 1 ATOM 3019 N N . SER B 1 185 ? 13.469 -26.095 14.959 1.00 36.24 ? 180 SER E N 1 ATOM 3020 C CA . SER B 1 185 ? 14.484 -26.831 14.249 1.00 37.04 ? 180 SER E CA 1 ATOM 3021 C C . SER B 1 185 ? 13.988 -27.106 12.849 1.00 38.97 ? 180 SER E C 1 ATOM 3022 O O . SER B 1 185 ? 12.781 -27.171 12.601 1.00 40.00 ? 180 SER E O 1 ATOM 3023 C CB . SER B 1 185 ? 14.819 -28.130 14.974 1.00 37.41 ? 180 SER E CB 1 ATOM 3024 O OG . SER B 1 185 ? 13.865 -29.144 14.706 1.00 38.86 ? 180 SER E OG 1 ATOM 3025 N N . VAL B 1 186 ? 14.926 -27.220 11.923 1.00 39.96 ? 181 VAL E N 1 ATOM 3026 C CA . VAL B 1 186 ? 14.608 -27.619 10.566 1.00 42.45 ? 181 VAL E CA 1 ATOM 3027 C C . VAL B 1 186 ? 15.711 -28.528 10.066 1.00 43.70 ? 181 VAL E C 1 ATOM 3028 O O . VAL B 1 186 ? 16.868 -28.312 10.353 1.00 42.88 ? 181 VAL E O 1 ATOM 3029 C CB . VAL B 1 186 ? 14.386 -26.401 9.634 1.00 43.63 ? 181 VAL E CB 1 ATOM 3030 C CG1 . VAL B 1 186 ? 15.631 -25.534 9.539 1.00 43.12 ? 181 VAL E CG1 1 ATOM 3031 C CG2 . VAL B 1 186 ? 13.942 -26.860 8.251 1.00 47.18 ? 181 VAL E CG2 1 ATOM 3032 N N . THR B 1 187 ? 15.335 -29.568 9.345 1.00 46.35 ? 182 THR E N 1 ATOM 3033 C CA . THR B 1 187 ? 16.290 -30.537 8.858 1.00 48.36 ? 182 THR E CA 1 ATOM 3034 C C . THR B 1 187 ? 16.222 -30.544 7.348 1.00 51.85 ? 182 THR E C 1 ATOM 3035 O O . THR B 1 187 ? 15.152 -30.683 6.775 1.00 53.86 ? 182 THR E O 1 ATOM 3036 C CB . THR B 1 187 ? 15.989 -31.931 9.421 1.00 49.19 ? 182 THR E CB 1 ATOM 3037 O OG1 . THR B 1 187 ? 16.053 -31.873 10.849 1.00 46.71 ? 182 THR E OG1 1 ATOM 3038 C CG2 . THR B 1 187 ? 16.989 -32.961 8.899 1.00 51.73 ? 182 THR E CG2 1 ATOM 3039 N N . VAL B 1 188 ? 17.373 -30.374 6.713 1.00 53.31 ? 183 VAL E N 1 ATOM 3040 C CA . VAL B 1 188 ? 17.460 -30.361 5.266 1.00 57.23 ? 183 VAL E CA 1 ATOM 3041 C C . VAL B 1 188 ? 18.529 -31.337 4.807 1.00 59.80 ? 183 VAL E C 1 ATOM 3042 O O . VAL B 1 188 ? 19.278 -31.864 5.630 1.00 58.21 ? 183 VAL E O 1 ATOM 3043 C CB . VAL B 1 188 ? 17.758 -28.940 4.723 1.00 57.54 ? 183 VAL E CB 1 ATOM 3044 C CG1 . VAL B 1 188 ? 16.569 -28.021 4.955 1.00 56.38 ? 183 VAL E CG1 1 ATOM 3045 C CG2 . VAL B 1 188 ? 19.020 -28.350 5.351 1.00 55.55 ? 183 VAL E CG2 1 ATOM 3046 N N . PRO B 1 189 ? 18.583 -31.600 3.485 1.00 64.27 ? 184 PRO E N 1 ATOM 3047 C CA . PRO B 1 189 ? 19.695 -32.361 2.926 1.00 67.26 ? 184 PRO E CA 1 ATOM 3048 C C . PRO B 1 189 ? 21.016 -31.590 3.008 1.00 66.77 ? 184 PRO E C 1 ATOM 3049 O O . PRO B 1 189 ? 21.094 -30.425 2.594 1.00 66.91 ? 184 PRO E O 1 ATOM 3050 C CB . PRO B 1 189 ? 19.280 -32.586 1.464 1.00 72.27 ? 184 PRO E CB 1 ATOM 3051 C CG . PRO B 1 189 ? 17.798 -32.432 1.460 1.00 72.14 ? 184 PRO E CG 1 ATOM 3052 C CD . PRO B 1 189 ? 17.509 -31.393 2.498 1.00 67.26 ? 184 PRO E CD 1 ATOM 3053 N N . SER B 1 190 ? 22.039 -32.265 3.529 1.00 66.86 ? 185 SER E N 1 ATOM 3054 C CA . SER B 1 190 ? 23.379 -31.696 3.708 1.00 66.90 ? 185 SER E CA 1 ATOM 3055 C C . SER B 1 190 ? 23.943 -31.040 2.446 1.00 70.34 ? 185 SER E C 1 ATOM 3056 O O . SER B 1 190 ? 24.650 -30.033 2.515 1.00 70.07 ? 185 SER E O 1 ATOM 3057 C CB . SER B 1 190 ? 24.339 -32.790 4.163 1.00 68.29 ? 185 SER E CB 1 ATOM 3058 O OG . SER B 1 190 ? 25.403 -32.232 4.917 1.00 67.46 ? 185 SER E OG 1 ATOM 3059 N N . SER B 1 191 ? 23.645 -31.626 1.295 1.00 74.12 ? 186 SER E N 1 ATOM 3060 C CA . SER B 1 191 ? 24.108 -31.077 0.024 1.00 78.36 ? 186 SER E CA 1 ATOM 3061 C C . SER B 1 191 ? 23.607 -29.654 -0.235 1.00 77.63 ? 186 SER E C 1 ATOM 3062 O O . SER B 1 191 ? 24.242 -28.895 -0.976 1.00 80.51 ? 186 SER E O 1 ATOM 3063 C CB . SER B 1 191 ? 23.677 -31.978 -1.130 1.00 83.02 ? 186 SER E CB 1 ATOM 3064 O OG . SER B 1 191 ? 22.273 -32.147 -1.142 1.00 82.33 ? 186 SER E OG 1 ATOM 3065 N N . THR B 1 192 ? 22.467 -29.303 0.362 1.00 74.20 ? 187 THR E N 1 ATOM 3066 C CA . THR B 1 192 ? 21.809 -28.016 0.075 1.00 74.01 ? 187 THR E CA 1 ATOM 3067 C C . THR B 1 192 ? 22.168 -26.879 1.021 1.00 70.31 ? 187 THR E C 1 ATOM 3068 O O . THR B 1 192 ? 21.834 -25.729 0.755 1.00 70.76 ? 187 THR E O 1 ATOM 3069 C CB . THR B 1 192 ? 20.265 -28.163 0.090 1.00 73.34 ? 187 THR E CB 1 ATOM 3070 O OG1 . THR B 1 192 ? 19.821 -28.465 1.423 1.00 68.63 ? 187 THR E OG1 1 ATOM 3071 C CG2 . THR B 1 192 ? 19.848 -29.277 -0.846 1.00 77.51 ? 187 THR E CG2 1 ATOM 3072 N N . TRP B 1 193 ? 22.825 -27.192 2.131 1.00 67.10 ? 188 TRP E N 1 ATOM 3073 C CA . TRP B 1 193 ? 23.274 -26.150 3.042 1.00 64.31 ? 188 TRP E CA 1 ATOM 3074 C C . TRP B 1 193 ? 24.763 -26.318 3.309 1.00 65.46 ? 188 TRP E C 1 ATOM 3075 O O . TRP B 1 193 ? 25.221 -27.436 3.543 1.00 65.69 ? 188 TRP E O 1 ATOM 3076 C CB . TRP B 1 193 ? 22.495 -26.212 4.353 1.00 59.69 ? 188 TRP E CB 1 ATOM 3077 C CG . TRP B 1 193 ? 22.817 -25.077 5.277 1.00 57.27 ? 188 TRP E CG 1 ATOM 3078 C CD1 . TRP B 1 193 ? 22.260 -23.826 5.270 1.00 56.70 ? 188 TRP E CD1 1 ATOM 3079 C CD2 . TRP B 1 193 ? 23.802 -25.076 6.313 1.00 55.83 ? 188 TRP E CD2 1 ATOM 3080 N NE1 . TRP B 1 193 ? 22.839 -23.049 6.240 1.00 55.12 ? 188 TRP E NE1 1 ATOM 3081 C CE2 . TRP B 1 193 ? 23.785 -23.790 6.901 1.00 54.66 ? 188 TRP E CE2 1 ATOM 3082 C CE3 . TRP B 1 193 ? 24.695 -26.036 6.805 1.00 56.08 ? 188 TRP E CE3 1 ATOM 3083 C CZ2 . TRP B 1 193 ? 24.621 -23.442 7.969 1.00 53.83 ? 188 TRP E CZ2 1 ATOM 3084 C CZ3 . TRP B 1 193 ? 25.532 -25.691 7.861 1.00 55.42 ? 188 TRP E CZ3 1 ATOM 3085 C CH2 . TRP B 1 193 ? 25.486 -24.402 8.435 1.00 54.29 ? 188 TRP E CH2 1 ATOM 3086 N N . PRO B 1 194 ? 25.527 -25.210 3.296 1.00 66.76 ? 189 PRO E N 1 ATOM 3087 C CA . PRO B 1 194 ? 25.116 -23.803 3.140 1.00 66.98 ? 189 PRO E CA 1 ATOM 3088 C C . PRO B 1 194 ? 24.954 -23.289 1.694 1.00 71.52 ? 189 PRO E C 1 ATOM 3089 O O . PRO B 1 194 ? 24.716 -22.098 1.503 1.00 72.52 ? 189 PRO E O 1 ATOM 3090 C CB . PRO B 1 194 ? 26.245 -23.043 3.844 1.00 67.19 ? 189 PRO E CB 1 ATOM 3091 C CG . PRO B 1 194 ? 27.449 -23.901 3.630 1.00 69.73 ? 189 PRO E CG 1 ATOM 3092 C CD . PRO B 1 194 ? 26.971 -25.328 3.574 1.00 68.54 ? 189 PRO E CD 1 ATOM 3093 N N . SER B 1 195 ? 25.061 -24.158 0.694 1.00 74.73 ? 190 SER E N 1 ATOM 3094 C CA . SER B 1 195 ? 24.980 -23.711 -0.706 1.00 80.13 ? 190 SER E CA 1 ATOM 3095 C C . SER B 1 195 ? 23.653 -22.995 -1.013 1.00 80.29 ? 190 SER E C 1 ATOM 3096 O O . SER B 1 195 ? 23.645 -21.979 -1.697 1.00 83.75 ? 190 SER E O 1 ATOM 3097 C CB . SER B 1 195 ? 25.223 -24.872 -1.679 1.00 83.73 ? 190 SER E CB 1 ATOM 3098 O OG . SER B 1 195 ? 24.482 -26.020 -1.308 1.00 81.19 ? 190 SER E OG 1 ATOM 3099 N N . GLU B 1 196 ? 22.546 -23.522 -0.495 1.00 77.09 ? 191 GLU E N 1 ATOM 3100 C CA . GLU B 1 196 ? 21.245 -22.860 -0.596 1.00 77.05 ? 191 GLU E CA 1 ATOM 3101 C C . GLU B 1 196 ? 20.909 -22.204 0.743 1.00 71.90 ? 191 GLU E C 1 ATOM 3102 O O . GLU B 1 196 ? 21.084 -22.812 1.799 1.00 67.74 ? 191 GLU E O 1 ATOM 3103 C CB . GLU B 1 196 ? 20.139 -23.864 -0.952 1.00 77.72 ? 191 GLU E CB 1 ATOM 3104 C CG . GLU B 1 196 ? 20.364 -24.710 -2.190 1.00 82.93 ? 191 GLU E CG 1 ATOM 3105 C CD . GLU B 1 196 ? 20.393 -23.919 -3.480 1.00 89.27 ? 191 GLU E CD 1 ATOM 3106 O OE1 . GLU B 1 196 ? 21.403 -23.228 -3.731 1.00 91.38 ? 191 GLU E OE1 1 ATOM 3107 O OE2 . GLU B 1 196 ? 19.418 -24.011 -4.258 1.00 92.97 ? 191 GLU E OE2 1 ATOM 3108 N N . THR B 1 197 ? 20.399 -20.978 0.684 1.00 72.67 ? 192 THR E N 1 ATOM 3109 C CA . THR B 1 197 ? 20.041 -20.209 1.872 1.00 68.74 ? 192 THR E CA 1 ATOM 3110 C C . THR B 1 197 ? 18.961 -20.855 2.754 1.00 64.68 ? 192 THR E C 1 ATOM 3111 O O . THR B 1 197 ? 17.995 -21.433 2.250 1.00 65.97 ? 192 THR E O 1 ATOM 3112 C CB . THR B 1 197 ? 19.553 -18.803 1.443 1.00 71.70 ? 192 THR E CB 1 ATOM 3113 O OG1 . THR B 1 197 ? 20.667 -17.908 1.394 1.00 73.53 ? 192 THR E OG1 1 ATOM 3114 C CG2 . THR B 1 197 ? 18.490 -18.240 2.394 1.00 68.67 ? 192 THR E CG2 1 ATOM 3115 N N . VAL B 1 198 ? 19.130 -20.727 4.073 1.00 60.35 ? 193 VAL E N 1 ATOM 3116 C CA . VAL B 1 198 ? 18.125 -21.128 5.044 1.00 56.74 ? 193 VAL E CA 1 ATOM 3117 C C . VAL B 1 198 ? 17.957 -19.970 6.039 1.00 54.77 ? 193 VAL E C 1 ATOM 3118 O O . VAL B 1 198 ? 18.917 -19.537 6.685 1.00 53.78 ? 193 VAL E O 1 ATOM 3119 C CB . VAL B 1 198 ? 18.511 -22.441 5.755 1.00 53.94 ? 193 VAL E CB 1 ATOM 3120 C CG1 . VAL B 1 198 ? 17.606 -22.706 6.952 1.00 50.34 ? 193 VAL E CG1 1 ATOM 3121 C CG2 . VAL B 1 198 ? 18.456 -23.608 4.776 1.00 56.33 ? 193 VAL E CG2 1 ATOM 3122 N N . THR B 1 199 ? 16.731 -19.470 6.136 1.00 54.81 ? 194 THR E N 1 ATOM 3123 C CA . THR B 1 199 ? 16.437 -18.285 6.922 1.00 53.93 ? 194 THR E CA 1 ATOM 3124 C C . THR B 1 199 ? 15.182 -18.535 7.738 1.00 51.80 ? 194 THR E C 1 ATOM 3125 O O . THR B 1 199 ? 14.141 -18.885 7.189 1.00 53.23 ? 194 THR E O 1 ATOM 3126 C CB . THR B 1 199 ? 16.186 -17.075 5.996 1.00 58.21 ? 194 THR E CB 1 ATOM 3127 O OG1 . THR B 1 199 ? 17.272 -16.947 5.072 1.00 61.24 ? 194 THR E OG1 1 ATOM 3128 C CG2 . THR B 1 199 ? 16.056 -15.785 6.787 1.00 57.71 ? 194 THR E CG2 1 ATOM 3129 N N . CYS B 1 200 ? 15.262 -18.349 9.046 1.00 49.04 ? 195 CYS E N 1 ATOM 3130 C CA . CYS B 1 200 ? 14.067 -18.470 9.861 1.00 47.81 ? 195 CYS E CA 1 ATOM 3131 C C . CYS B 1 200 ? 13.385 -17.103 9.952 1.00 49.09 ? 195 CYS E C 1 ATOM 3132 O O . CYS B 1 200 ? 14.049 -16.077 10.135 1.00 49.55 ? 195 CYS E O 1 ATOM 3133 C CB . CYS B 1 200 ? 14.372 -19.058 11.234 1.00 44.93 ? 195 CYS E CB 1 ATOM 3134 S SG . CYS B 1 200 ? 14.957 -17.872 12.452 1.00 44.93 ? 195 CYS E SG 1 ATOM 3135 N N . ASN B 1 201 ? 12.061 -17.110 9.792 1.00 49.94 ? 196 ASN E N 1 ATOM 3136 C CA . ASN B 1 201 ? 11.259 -15.913 9.847 1.00 51.88 ? 196 ASN E CA 1 ATOM 3137 C C . ASN B 1 201 ? 10.504 -15.981 11.165 1.00 49.48 ? 196 ASN E C 1 ATOM 3138 O O . ASN B 1 201 ? 9.838 -16.974 11.459 1.00 48.58 ? 196 ASN E O 1 ATOM 3139 C CB . ASN B 1 201 ? 10.325 -15.859 8.641 1.00 56.02 ? 196 ASN E CB 1 ATOM 3140 C CG . ASN B 1 201 ? 10.979 -16.395 7.379 1.00 58.09 ? 196 ASN E CG 1 ATOM 3141 O OD1 . ASN B 1 201 ? 10.589 -17.438 6.856 1.00 58.74 ? 196 ASN E OD1 1 ATOM 3142 N ND2 . ASN B 1 201 ? 11.993 -15.695 6.898 1.00 59.51 ? 196 ASN E ND2 1 ATOM 3143 N N . VAL B 1 202 ? 10.663 -14.955 11.987 1.00 48.95 ? 197 VAL E N 1 ATOM 3144 C CA . VAL B 1 202 ? 9.999 -14.899 13.280 1.00 47.06 ? 197 VAL E CA 1 ATOM 3145 C C . VAL B 1 202 ? 9.048 -13.710 13.353 1.00 49.63 ? 197 VAL E C 1 ATOM 3146 O O . VAL B 1 202 ? 9.428 -12.571 13.087 1.00 51.61 ? 197 VAL E O 1 ATOM 3147 C CB . VAL B 1 202 ? 11.022 -14.826 14.425 1.00 44.62 ? 197 VAL E CB 1 ATOM 3148 C CG1 . VAL B 1 202 ? 10.325 -14.773 15.774 1.00 43.33 ? 197 VAL E CG1 1 ATOM 3149 C CG2 . VAL B 1 202 ? 11.954 -16.029 14.370 1.00 42.60 ? 197 VAL E CG2 1 ATOM 3150 N N . ALA B 1 203 ? 7.803 -13.984 13.719 1.00 49.88 ? 198 ALA E N 1 ATOM 3151 C CA . ALA B 1 203 ? 6.818 -12.931 13.864 1.00 52.75 ? 198 ALA E CA 1 ATOM 3152 C C . ALA B 1 203 ? 6.355 -12.902 15.310 1.00 50.76 ? 198 ALA E C 1 ATOM 3153 O O . ALA B 1 203 ? 6.200 -13.949 15.938 1.00 48.05 ? 198 ALA E O 1 ATOM 3154 C CB . ALA B 1 203 ? 5.651 -13.140 12.909 1.00 56.40 ? 198 ALA E CB 1 ATOM 3155 N N . HIS B 1 204 ? 6.199 -11.690 15.836 1.00 52.40 ? 199 HIS E N 1 ATOM 3156 C CA . HIS B 1 204 ? 5.629 -11.458 17.148 1.00 51.92 ? 199 HIS E CA 1 ATOM 3157 C C . HIS B 1 204 ? 4.619 -10.314 16.995 1.00 56.39 ? 199 HIS E C 1 ATOM 3158 O O . HIS B 1 204 ? 4.965 -9.137 17.157 1.00 58.23 ? 199 HIS E O 1 ATOM 3159 C CB . HIS B 1 204 ? 6.728 -11.128 18.149 1.00 49.70 ? 199 HIS E CB 1 ATOM 3160 C CG . HIS B 1 204 ? 6.251 -11.033 19.563 1.00 49.26 ? 199 HIS E CG 1 ATOM 3161 N ND1 . HIS B 1 204 ? 6.415 -9.896 20.325 1.00 50.89 ? 199 HIS E ND1 1 ATOM 3162 C CD2 . HIS B 1 204 ? 5.625 -11.931 20.357 1.00 47.85 ? 199 HIS E CD2 1 ATOM 3163 C CE1 . HIS B 1 204 ? 5.901 -10.097 21.525 1.00 50.50 ? 199 HIS E CE1 1 ATOM 3164 N NE2 . HIS B 1 204 ? 5.425 -11.327 21.574 1.00 48.64 ? 199 HIS E NE2 1 ATOM 3165 N N . PRO B 1 205 ? 3.369 -10.660 16.639 1.00 58.81 ? 200 PRO E N 1 ATOM 3166 C CA . PRO B 1 205 ? 2.318 -9.677 16.351 1.00 63.89 ? 200 PRO E CA 1 ATOM 3167 C C . PRO B 1 205 ? 2.048 -8.686 17.472 1.00 65.20 ? 200 PRO E C 1 ATOM 3168 O O . PRO B 1 205 ? 1.695 -7.543 17.197 1.00 69.35 ? 200 PRO E O 1 ATOM 3169 C CB . PRO B 1 205 ? 1.077 -10.542 16.134 1.00 65.48 ? 200 PRO E CB 1 ATOM 3170 C CG . PRO B 1 205 ? 1.603 -11.857 15.685 1.00 62.29 ? 200 PRO E CG 1 ATOM 3171 C CD . PRO B 1 205 ? 2.900 -12.039 16.409 1.00 57.52 ? 200 PRO E CD 1 ATOM 3172 N N . ALA B 1 206 ? 2.205 -9.123 18.720 1.00 62.40 ? 201 ALA E N 1 ATOM 3173 C CA . ALA B 1 206 ? 1.952 -8.263 19.870 1.00 63.97 ? 201 ALA E CA 1 ATOM 3174 C C . ALA B 1 206 ? 2.837 -7.025 19.842 1.00 65.55 ? 201 ALA E C 1 ATOM 3175 O O . ALA B 1 206 ? 2.346 -5.921 20.055 1.00 69.38 ? 201 ALA E O 1 ATOM 3176 C CB . ALA B 1 206 ? 2.131 -9.030 21.173 1.00 60.68 ? 201 ALA E CB 1 ATOM 3177 N N . SER B 1 207 ? 4.129 -7.207 19.556 1.00 63.34 ? 202 SER E N 1 ATOM 3178 C CA . SER B 1 207 ? 5.063 -6.074 19.456 1.00 65.15 ? 202 SER E CA 1 ATOM 3179 C C . SER B 1 207 ? 5.215 -5.541 18.022 1.00 68.34 ? 202 SER E C 1 ATOM 3180 O O . SER B 1 207 ? 5.965 -4.587 17.796 1.00 70.56 ? 202 SER E O 1 ATOM 3181 C CB . SER B 1 207 ? 6.429 -6.470 20.026 1.00 61.66 ? 202 SER E CB 1 ATOM 3182 O OG . SER B 1 207 ? 6.986 -7.545 19.282 1.00 58.78 ? 202 SER E OG 1 ATOM 3183 N N . SER B 1 208 ? 4.480 -6.137 17.078 1.00 69.25 ? 203 SER E N 1 ATOM 3184 C CA . SER B 1 208 ? 4.594 -5.843 15.645 1.00 72.43 ? 203 SER E CA 1 ATOM 3185 C C . SER B 1 208 ? 6.007 -6.079 15.106 1.00 70.34 ? 203 SER E C 1 ATOM 3186 O O . SER B 1 208 ? 6.533 -5.270 14.355 1.00 73.33 ? 203 SER E O 1 ATOM 3187 C CB . SER B 1 208 ? 4.129 -4.416 15.356 1.00 78.39 ? 203 SER E CB 1 ATOM 3188 O OG . SER B 1 208 ? 2.837 -4.197 15.898 1.00 80.68 ? 203 SER E OG 1 ATOM 3189 N N . THR B 1 209 ? 6.597 -7.207 15.494 1.00 65.68 ? 204 THR E N 1 ATOM 3190 C CA . THR B 1 209 ? 7.942 -7.567 15.109 1.00 63.75 ? 204 THR E CA 1 ATOM 3191 C C . THR B 1 209 ? 7.930 -8.642 14.028 1.00 62.85 ? 204 THR E C 1 ATOM 3192 O O . THR B 1 209 ? 7.147 -9.583 14.087 1.00 61.18 ? 204 THR E O 1 ATOM 3193 C CB . THR B 1 209 ? 8.718 -8.084 16.339 1.00 59.79 ? 204 THR E CB 1 ATOM 3194 O OG1 . THR B 1 209 ? 8.736 -7.075 17.356 1.00 61.38 ? 204 THR E OG1 1 ATOM 3195 C CG2 . THR B 1 209 ? 10.151 -8.521 15.960 1.00 58.00 ? 204 THR E CG2 1 ATOM 3196 N N . LYS B 1 210 ? 8.786 -8.459 13.024 1.00 64.59 ? 205 LYS E N 1 ATOM 3197 C CA . LYS B 1 210 ? 9.119 -9.501 12.053 1.00 63.93 ? 205 LYS E CA 1 ATOM 3198 C C . LYS B 1 210 ? 10.635 -9.493 11.862 1.00 62.85 ? 205 LYS E C 1 ATOM 3199 O O . LYS B 1 210 ? 11.203 -8.500 11.442 1.00 66.24 ? 205 LYS E O 1 ATOM 3200 C CB . LYS B 1 210 ? 8.451 -9.253 10.692 1.00 69.07 ? 205 LYS E CB 1 ATOM 3201 C CG . LYS B 1 210 ? 7.186 -8.385 10.707 1.00 73.66 ? 205 LYS E CG 1 ATOM 3202 C CD . LYS B 1 210 ? 6.233 -8.820 9.589 1.00 77.67 ? 205 LYS E CD 1 ATOM 3203 C CE . LYS B 1 210 ? 5.553 -10.160 9.848 1.00 75.02 ? 205 LYS E CE 1 ATOM 3204 N NZ . LYS B 1 210 ? 4.444 -10.335 8.877 1.00 80.22 ? 205 LYS E NZ 1 ATOM 3205 N N . VAL B 1 211 ? 11.293 -10.599 12.169 1.00 59.12 ? 206 VAL E N 1 ATOM 3206 C CA . VAL B 1 211 ? 12.750 -10.708 12.006 1.00 58.44 ? 206 VAL E CA 1 ATOM 3207 C C . VAL B 1 211 ? 13.102 -11.944 11.204 1.00 56.93 ? 206 VAL E C 1 ATOM 3208 O O . VAL B 1 211 ? 12.600 -13.040 11.485 1.00 54.42 ? 206 VAL E O 1 ATOM 3209 C CB . VAL B 1 211 ? 13.490 -10.805 13.359 1.00 55.61 ? 206 VAL E CB 1 ATOM 3210 C CG1 . VAL B 1 211 ? 14.962 -11.158 13.145 1.00 55.26 ? 206 VAL E CG1 1 ATOM 3211 C CG2 . VAL B 1 211 ? 13.365 -9.494 14.124 1.00 57.57 ? 206 VAL E CG2 1 ATOM 3212 N N . ASP B 1 212 ? 13.968 -11.758 10.215 1.00 58.99 ? 207 ASP E N 1 ATOM 3213 C CA . ASP B 1 212 ? 14.531 -12.859 9.474 1.00 58.22 ? 207 ASP E CA 1 ATOM 3214 C C . ASP B 1 212 ? 15.938 -13.075 10.024 1.00 56.35 ? 207 ASP E C 1 ATOM 3215 O O . ASP B 1 212 ? 16.646 -12.120 10.334 1.00 57.92 ? 207 ASP E O 1 ATOM 3216 C CB . ASP B 1 212 ? 14.525 -12.541 7.977 1.00 62.81 ? 207 ASP E CB 1 ATOM 3217 C CG . ASP B 1 212 ? 13.126 -12.316 7.442 1.00 65.48 ? 207 ASP E CG 1 ATOM 3218 O OD1 . ASP B 1 212 ? 12.192 -13.044 7.849 1.00 63.23 ? 207 ASP E OD1 1 ATOM 3219 O OD2 . ASP B 1 212 ? 12.958 -11.417 6.597 1.00 70.64 ? 207 ASP E OD2 1 ATOM 3220 N N . LYS B 1 213 ? 16.319 -14.330 10.218 1.00 53.42 ? 208 LYS E N 1 ATOM 3221 C CA . LYS B 1 213 ? 17.687 -14.644 10.625 1.00 52.33 ? 208 LYS E CA 1 ATOM 3222 C C . LYS B 1 213 ? 18.259 -15.730 9.736 1.00 52.33 ? 208 LYS E C 1 ATOM 3223 O O . LYS B 1 213 ? 17.773 -16.859 9.728 1.00 49.86 ? 208 LYS E O 1 ATOM 3224 C CB . LYS B 1 213 ? 17.742 -15.078 12.091 1.00 49.13 ? 208 LYS E CB 1 ATOM 3225 C CG . LYS B 1 213 ? 19.010 -14.642 12.816 1.00 49.79 ? 208 LYS E CG 1 ATOM 3226 C CD . LYS B 1 213 ? 18.743 -13.303 13.501 1.00 51.09 ? 208 LYS E CD 1 ATOM 3227 C CE . LYS B 1 213 ? 19.932 -12.370 13.525 1.00 54.34 ? 208 LYS E CE 1 ATOM 3228 N NZ . LYS B 1 213 ? 19.503 -11.049 14.070 1.00 56.15 ? 208 LYS E NZ 1 ATOM 3229 N N . LYS B 1 214 ? 19.281 -15.361 8.966 1.00 55.27 ? 209 LYS E N 1 ATOM 3230 C CA . LYS B 1 214 ? 19.922 -16.287 8.042 1.00 56.35 ? 209 LYS E CA 1 ATOM 3231 C C . LYS B 1 214 ? 20.869 -17.203 8.816 1.00 53.97 ? 209 LYS E C 1 ATOM 3232 O O . LYS B 1 214 ? 21.668 -16.740 9.628 1.00 53.76 ? 209 LYS E O 1 ATOM 3233 C CB . LYS B 1 214 ? 20.675 -15.527 6.943 1.00 60.97 ? 209 LYS E CB 1 ATOM 3234 C CG . LYS B 1 214 ? 21.417 -16.439 5.959 1.00 62.86 ? 209 LYS E CG 1 ATOM 3235 C CD . LYS B 1 214 ? 21.114 -16.200 4.476 1.00 67.32 ? 209 LYS E CD 1 ATOM 3236 C CE . LYS B 1 214 ? 22.327 -16.118 3.571 1.00 71.54 ? 209 LYS E CE 1 ATOM 3237 N NZ . LYS B 1 214 ? 23.180 -14.966 3.927 1.00 73.64 ? 209 LYS E NZ 1 ATOM 3238 N N . ILE B 1 215 ? 20.766 -18.504 8.568 1.00 52.67 ? 210 ILE E N 1 ATOM 3239 C CA . ILE B 1 215 ? 21.614 -19.465 9.255 1.00 51.15 ? 210 ILE E CA 1 ATOM 3240 C C . ILE B 1 215 ? 22.863 -19.641 8.401 1.00 54.54 ? 210 ILE E C 1 ATOM 3241 O O . ILE B 1 215 ? 22.812 -20.163 7.276 1.00 56.71 ? 210 ILE E O 1 ATOM 3242 C CB . ILE B 1 215 ? 20.899 -20.806 9.514 1.00 48.66 ? 210 ILE E CB 1 ATOM 3243 C CG1 . ILE B 1 215 ? 19.496 -20.576 10.092 1.00 46.47 ? 210 ILE E CG1 1 ATOM 3244 C CG2 . ILE B 1 215 ? 21.706 -21.674 10.468 1.00 47.38 ? 210 ILE E CG2 1 ATOM 3245 C CD1 . ILE B 1 215 ? 19.434 -19.656 11.295 1.00 45.08 ? 210 ILE E CD1 1 ATOM 3246 N N . VAL B 1 216 ? 23.979 -19.155 8.934 1.00 55.73 ? 211 VAL E N 1 ATOM 3247 C CA . VAL B 1 216 ? 25.269 -19.178 8.240 1.00 59.40 ? 211 VAL E CA 1 ATOM 3248 C C . VAL B 1 216 ? 26.208 -20.092 9.025 1.00 58.93 ? 211 VAL E C 1 ATOM 3249 O O . VAL B 1 216 ? 26.067 -20.231 10.236 1.00 56.64 ? 211 VAL E O 1 ATOM 3250 C CB . VAL B 1 216 ? 25.884 -17.753 8.051 1.00 62.71 ? 211 VAL E CB 1 ATOM 3251 C CG1 . VAL B 1 216 ? 24.861 -16.807 7.430 1.00 63.40 ? 211 VAL E CG1 1 ATOM 3252 C CG2 . VAL B 1 216 ? 26.437 -17.182 9.357 1.00 62.11 ? 211 VAL E CG2 1 ATOM 3253 N N . PRO B 1 217 ? 27.157 -20.733 8.342 1.00 61.84 ? 212 PRO E N 1 ATOM 3254 C CA . PRO B 1 217 ? 28.122 -21.577 9.059 1.00 62.40 ? 212 PRO E CA 1 ATOM 3255 C C . PRO B 1 217 ? 29.037 -20.815 10.004 1.00 64.13 ? 212 PRO E C 1 ATOM 3256 O O . PRO B 1 217 ? 29.354 -19.651 9.763 1.00 66.53 ? 212 PRO E O 1 ATOM 3257 C CB . PRO B 1 217 ? 28.983 -22.169 7.940 1.00 66.14 ? 212 PRO E CB 1 ATOM 3258 C CG . PRO B 1 217 ? 28.150 -22.077 6.715 1.00 66.44 ? 212 PRO E CG 1 ATOM 3259 C CD . PRO B 1 217 ? 27.293 -20.860 6.880 1.00 64.99 ? 212 PRO E CD 1 ATOM 3260 N N . ARG B 1 218 ? 29.502 -21.503 11.039 1.00 63.85 ? 213 ARG E N 1 ATOM 3261 C CA . ARG B 1 218 ? 30.384 -20.906 12.038 1.00 66.10 ? 213 ARG E CA 1 ATOM 3262 C C . ARG B 1 218 ? 31.799 -20.718 11.522 1.00 71.46 ? 213 ARG E C 1 ATOM 3263 O O . ARG B 1 218 ? 32.224 -21.420 10.606 1.00 73.38 ? 213 ARG E O 1 ATOM 3264 C CB . ARG B 1 218 ? 30.429 -21.793 13.278 1.00 64.81 ? 213 ARG E CB 1 ATOM 3265 C CG . ARG B 1 218 ? 29.067 -22.012 13.904 1.00 60.07 ? 213 ARG E CG 1 ATOM 3266 C CD . ARG B 1 218 ? 29.143 -22.888 15.135 1.00 59.64 ? 213 ARG E CD 1 ATOM 3267 N NE . ARG B 1 218 ? 28.224 -22.401 16.159 1.00 57.07 ? 213 ARG E NE 1 ATOM 3268 C CZ . ARG B 1 218 ? 28.502 -21.432 17.030 1.00 58.42 ? 213 ARG E CZ 1 ATOM 3269 N NH1 . ARG B 1 218 ? 27.587 -21.075 17.906 1.00 56.15 ? 213 ARG E NH1 1 ATOM 3270 N NH2 . ARG B 1 218 ? 29.687 -20.818 17.046 1.00 62.76 ? 213 ARG E NH2 1 ATOM 3271 N N . ASP B 1 219 ? 32.504 -19.759 12.125 1.00 74.46 ? 214 ASP E N 1 ATOM 3272 C CA . ASP B 1 219 ? 33.957 -19.533 11.952 1.00 80.38 ? 214 ASP E CA 1 ATOM 3273 C C . ASP B 1 219 ? 34.415 -19.205 10.520 1.00 83.98 ? 214 ASP E C 1 ATOM 3274 O O . ASP B 1 219 ? 33.937 -19.776 9.540 1.00 82.81 ? 214 ASP E O 1 ATOM 3275 C CB . ASP B 1 219 ? 34.784 -20.684 12.581 1.00 82.19 ? 214 ASP E CB 1 ATOM 3276 C CG . ASP B 1 219 ? 35.039 -21.853 11.622 1.00 82.86 ? 214 ASP E CG 1 ATOM 3277 O OD1 . ASP B 1 219 ? 35.879 -21.714 10.700 1.00 87.07 ? 214 ASP E OD1 1 ATOM 3278 O OD2 . ASP B 1 219 ? 34.429 -22.925 11.824 1.00 79.38 ? 214 ASP E OD2 1 HETATM 3279 N N . PCA C 1 1 ? 19.683 -8.585 5.865 1.00 54.03 ? 1 PCA H N 1 HETATM 3280 C CA . PCA C 1 1 ? 18.773 -8.695 4.721 1.00 52.40 ? 1 PCA H CA 1 HETATM 3281 C CB . PCA C 1 1 ? 18.319 -7.258 4.450 1.00 48.76 ? 1 PCA H CB 1 HETATM 3282 C CG . PCA C 1 1 ? 19.260 -6.356 5.250 1.00 47.99 ? 1 PCA H CG 1 HETATM 3283 C CD . PCA C 1 1 ? 20.012 -7.327 6.135 1.00 51.66 ? 1 PCA H CD 1 HETATM 3284 O OE . PCA C 1 1 ? 20.818 -6.983 6.976 1.00 52.75 ? 1 PCA H OE 1 HETATM 3285 C C . PCA C 1 1 ? 19.404 -9.238 3.463 1.00 50.85 ? 1 PCA H C 1 HETATM 3286 O O . PCA C 1 1 ? 20.627 -9.234 3.335 1.00 50.04 ? 1 PCA H O 1 ATOM 3287 N N . VAL C 1 2 ? 18.576 -9.690 2.525 1.00 50.65 ? 2 VAL H N 1 ATOM 3288 C CA . VAL C 1 2 ? 19.062 -10.166 1.230 1.00 49.38 ? 2 VAL H CA 1 ATOM 3289 C C . VAL C 1 2 ? 19.552 -8.998 0.395 1.00 44.69 ? 2 VAL H C 1 ATOM 3290 O O . VAL C 1 2 ? 18.826 -8.021 0.213 1.00 42.23 ? 2 VAL H O 1 ATOM 3291 C CB . VAL C 1 2 ? 17.968 -10.901 0.439 1.00 51.04 ? 2 VAL H CB 1 ATOM 3292 C CG1 . VAL C 1 2 ? 18.459 -11.259 -0.961 1.00 50.10 ? 2 VAL H CG1 1 ATOM 3293 C CG2 . VAL C 1 2 ? 17.540 -12.148 1.194 1.00 55.96 ? 2 VAL H CG2 1 ATOM 3294 N N . GLN C 1 3 ? 20.780 -9.125 -0.116 1.00 43.67 ? 3 GLN H N 1 ATOM 3295 C CA . GLN C 1 3 ? 21.412 -8.103 -0.935 1.00 39.86 ? 3 GLN H CA 1 ATOM 3296 C C . GLN C 1 3 ? 21.366 -8.449 -2.427 1.00 39.17 ? 3 GLN H C 1 ATOM 3297 O O . GLN C 1 3 ? 21.620 -9.582 -2.829 1.00 41.57 ? 3 GLN H O 1 ATOM 3298 C CB . GLN C 1 3 ? 22.855 -7.918 -0.488 1.00 39.55 ? 3 GLN H CB 1 ATOM 3299 C CG . GLN C 1 3 ? 23.025 -7.149 0.814 1.00 39.45 ? 3 GLN H CG 1 ATOM 3300 C CD . GLN C 1 3 ? 24.462 -7.204 1.326 1.00 40.09 ? 3 GLN H CD 1 ATOM 3301 O OE1 . GLN C 1 3 ? 25.071 -8.266 1.375 1.00 42.70 ? 3 GLN H OE1 1 ATOM 3302 N NE2 . GLN C 1 3 ? 25.008 -6.057 1.704 1.00 38.30 ? 3 GLN H NE2 1 ATOM 3303 N N . LEU C 1 4 ? 21.013 -7.449 -3.225 1.00 36.35 ? 4 LEU H N 1 ATOM 3304 C CA . LEU C 1 4 ? 21.145 -7.456 -4.689 1.00 35.40 ? 4 LEU H CA 1 ATOM 3305 C C . LEU C 1 4 ? 22.614 -7.563 -4.969 1.00 35.09 ? 4 LEU H C 1 ATOM 3306 O O . LEU C 1 4 ? 23.409 -6.975 -4.240 1.00 34.06 ? 4 LEU H O 1 ATOM 3307 C CB . LEU C 1 4 ? 20.590 -6.140 -5.253 1.00 32.78 ? 4 LEU H CB 1 ATOM 3308 C CG . LEU C 1 4 ? 19.213 -6.077 -5.886 1.00 33.26 ? 4 LEU H CG 1 ATOM 3309 C CD1 . LEU C 1 4 ? 18.185 -6.779 -5.045 1.00 35.49 ? 4 LEU H CD1 1 ATOM 3310 C CD2 . LEU C 1 4 ? 18.838 -4.612 -6.093 1.00 30.67 ? 4 LEU H CD2 1 ATOM 3311 N N . LYS C 1 5 ? 22.987 -8.340 -5.991 1.00 36.44 ? 5 LYS H N 1 ATOM 3312 C CA . LYS C 1 5 ? 24.392 -8.568 -6.293 1.00 36.60 ? 5 LYS H CA 1 ATOM 3313 C C . LYS C 1 5 ? 24.866 -7.505 -7.287 1.00 33.69 ? 5 LYS H C 1 ATOM 3314 O O . LYS C 1 5 ? 24.175 -7.182 -8.267 1.00 32.78 ? 5 LYS H O 1 ATOM 3315 C CB . LYS C 1 5 ? 24.610 -9.980 -6.839 1.00 40.31 ? 5 LYS H CB 1 ATOM 3316 C CG . LYS C 1 5 ? 24.179 -11.080 -5.872 1.00 43.88 ? 5 LYS H CG 1 ATOM 3317 C CD . LYS C 1 5 ? 24.011 -12.429 -6.563 1.00 48.01 ? 5 LYS H CD 1 ATOM 3318 C CE . LYS C 1 5 ? 24.061 -13.604 -5.597 1.00 52.12 ? 5 LYS H CE 1 ATOM 3319 N NZ . LYS C 1 5 ? 25.452 -14.097 -5.362 1.00 53.79 ? 5 LYS H NZ 1 ATOM 3320 N N . GLU C 1 6 ? 26.013 -6.914 -6.979 1.00 32.09 ? 6 GLU H N 1 ATOM 3321 C CA . GLU C 1 6 ? 26.674 -5.986 -7.877 1.00 30.02 ? 6 GLU H CA 1 ATOM 3322 C C . GLU C 1 6 ? 28.009 -6.531 -8.357 1.00 30.95 ? 6 GLU H C 1 ATOM 3323 O O . GLU C 1 6 ? 28.756 -7.125 -7.605 1.00 32.31 ? 6 GLU H O 1 ATOM 3324 C CB . GLU C 1 6 ? 26.907 -4.654 -7.187 1.00 27.70 ? 6 GLU H CB 1 ATOM 3325 C CG . GLU C 1 6 ? 25.623 -3.999 -6.718 1.00 26.79 ? 6 GLU H CG 1 ATOM 3326 C CD . GLU C 1 6 ? 25.835 -2.627 -6.153 1.00 25.00 ? 6 GLU H CD 1 ATOM 3327 O OE1 . GLU C 1 6 ? 26.844 -1.998 -6.491 1.00 24.70 ? 6 GLU H OE1 1 ATOM 3328 O OE2 . GLU C 1 6 ? 24.986 -2.164 -5.381 1.00 24.97 ? 6 GLU H OE2 1 ATOM 3329 N N . SER C 1 7 ? 28.295 -6.292 -9.623 1.00 30.48 ? 7 SER H N 1 ATOM 3330 C CA . SER C 1 7 ? 29.518 -6.729 -10.263 1.00 31.97 ? 7 SER H CA 1 ATOM 3331 C C . SER C 1 7 ? 30.194 -5.542 -10.929 1.00 29.98 ? 7 SER H C 1 ATOM 3332 O O . SER C 1 7 ? 29.542 -4.808 -11.676 1.00 28.53 ? 7 SER H O 1 ATOM 3333 C CB . SER C 1 7 ? 29.169 -7.790 -11.296 1.00 34.72 ? 7 SER H CB 1 ATOM 3334 O OG . SER C 1 7 ? 30.337 -8.391 -11.810 1.00 36.87 ? 7 SER H OG 1 ATOM 3335 N N . GLY C 1 8 ? 31.484 -5.331 -10.652 1.00 30.11 ? 8 GLY H N 1 ATOM 3336 C CA . GLY C 1 8 ? 32.172 -4.190 -11.220 1.00 28.84 ? 8 GLY H CA 1 ATOM 3337 C C . GLY C 1 8 ? 33.522 -3.888 -10.605 1.00 29.14 ? 8 GLY H C 1 ATOM 3338 O O . GLY C 1 8 ? 33.894 -4.487 -9.594 1.00 30.39 ? 8 GLY H O 1 ATOM 3339 N N . PRO C 1 9 ? 34.268 -2.955 -11.222 1.00 28.56 ? 9 PRO H N 1 ATOM 3340 C CA . PRO C 1 9 ? 35.660 -2.649 -10.862 1.00 29.27 ? 9 PRO H CA 1 ATOM 3341 C C . PRO C 1 9 ? 35.802 -1.945 -9.530 1.00 28.27 ? 9 PRO H C 1 ATOM 3342 O O . PRO C 1 9 ? 34.981 -1.088 -9.195 1.00 26.62 ? 9 PRO H O 1 ATOM 3343 C CB . PRO C 1 9 ? 36.120 -1.726 -11.995 1.00 28.94 ? 9 PRO H CB 1 ATOM 3344 C CG . PRO C 1 9 ? 34.872 -1.089 -12.498 1.00 27.23 ? 9 PRO H CG 1 ATOM 3345 C CD . PRO C 1 9 ? 33.780 -2.097 -12.318 1.00 27.50 ? 9 PRO H CD 1 ATOM 3346 N N . GLY C 1 10 ? 36.821 -2.327 -8.765 1.00 30.05 ? 10 GLY H N 1 ATOM 3347 C CA . GLY C 1 10 ? 37.181 -1.613 -7.557 1.00 29.81 ? 10 GLY H CA 1 ATOM 3348 C C . GLY C 1 10 ? 37.988 -0.361 -7.854 1.00 29.49 ? 10 GLY H C 1 ATOM 3349 O O . GLY C 1 10 ? 38.011 0.569 -7.049 1.00 29.37 ? 10 GLY H O 1 ATOM 3350 N N . LEU C 1 11 ? 38.611 -0.311 -9.028 1.00 29.94 ? 11 LEU H N 1 ATOM 3351 C CA . LEU C 1 11 ? 39.539 0.769 -9.355 1.00 30.09 ? 11 LEU H CA 1 ATOM 3352 C C . LEU C 1 11 ? 39.392 1.220 -10.826 1.00 29.63 ? 11 LEU H C 1 ATOM 3353 O O . LEU C 1 11 ? 39.358 0.410 -11.735 1.00 30.41 ? 11 LEU H O 1 ATOM 3354 C CB . LEU C 1 11 ? 40.966 0.303 -9.013 1.00 32.52 ? 11 LEU H CB 1 ATOM 3355 C CG . LEU C 1 11 ? 42.171 1.196 -8.771 1.00 33.73 ? 11 LEU H CG 1 ATOM 3356 C CD1 . LEU C 1 11 ? 43.507 0.455 -8.731 1.00 36.61 ? 11 LEU H CD1 1 ATOM 3357 C CD2 . LEU C 1 11 ? 42.192 2.274 -9.821 1.00 33.21 ? 11 LEU H CD2 1 ATOM 3358 N N . VAL C 1 12 ? 39.285 2.527 -11.034 1.00 28.61 ? 12 VAL H N 1 ATOM 3359 C CA . VAL C 1 12 ? 39.116 3.094 -12.369 1.00 28.73 ? 12 VAL H CA 1 ATOM 3360 C C . VAL C 1 12 ? 40.105 4.220 -12.595 1.00 29.78 ? 12 VAL H C 1 ATOM 3361 O O . VAL C 1 12 ? 40.230 5.096 -11.750 1.00 29.27 ? 12 VAL H O 1 ATOM 3362 C CB . VAL C 1 12 ? 37.702 3.683 -12.548 1.00 26.76 ? 12 VAL H CB 1 ATOM 3363 C CG1 . VAL C 1 12 ? 37.538 4.311 -13.916 1.00 27.19 ? 12 VAL H CG1 1 ATOM 3364 C CG2 . VAL C 1 12 ? 36.654 2.609 -12.339 1.00 26.00 ? 12 VAL H CG2 1 ATOM 3365 N N . GLN C 1 13 ? 40.758 4.212 -13.758 1.00 31.51 ? 13 GLN H N 1 ATOM 3366 C CA . GLN C 1 13 ? 41.722 5.250 -14.131 1.00 33.02 ? 13 GLN H CA 1 ATOM 3367 C C . GLN C 1 13 ? 41.019 6.582 -14.326 1.00 31.72 ? 13 GLN H C 1 ATOM 3368 O O . GLN C 1 13 ? 39.940 6.601 -14.874 1.00 30.63 ? 13 GLN H O 1 ATOM 3369 C CB . GLN C 1 13 ? 42.390 4.905 -15.467 1.00 35.48 ? 13 GLN H CB 1 ATOM 3370 C CG . GLN C 1 13 ? 43.169 3.603 -15.506 1.00 37.29 ? 13 GLN H CG 1 ATOM 3371 C CD . GLN C 1 13 ? 44.397 3.633 -14.640 1.00 38.67 ? 13 GLN H CD 1 ATOM 3372 O OE1 . GLN C 1 13 ? 45.275 4.462 -14.839 1.00 40.44 ? 13 GLN H OE1 1 ATOM 3373 N NE2 . GLN C 1 13 ? 44.477 2.722 -13.682 1.00 38.58 ? 13 GLN H NE2 1 ATOM 3374 N N . PRO C 1 14 ? 41.631 7.694 -13.902 1.00 32.48 ? 14 PRO H N 1 ATOM 3375 C CA . PRO C 1 14 ? 41.101 9.027 -14.181 1.00 32.66 ? 14 PRO H CA 1 ATOM 3376 C C . PRO C 1 14 ? 40.698 9.212 -15.646 1.00 33.57 ? 14 PRO H C 1 ATOM 3377 O O . PRO C 1 14 ? 41.410 8.802 -16.526 1.00 34.95 ? 14 PRO H O 1 ATOM 3378 C CB . PRO C 1 14 ? 42.251 9.953 -13.791 1.00 34.67 ? 14 PRO H CB 1 ATOM 3379 C CG . PRO C 1 14 ? 42.954 9.212 -12.702 1.00 34.80 ? 14 PRO H CG 1 ATOM 3380 C CD . PRO C 1 14 ? 42.808 7.743 -13.016 1.00 34.01 ? 14 PRO H CD 1 ATOM 3381 N N . SER C 1 15 ? 39.505 9.750 -15.872 1.00 33.10 ? 15 SER H N 1 ATOM 3382 C CA . SER C 1 15 ? 38.947 9.975 -17.212 1.00 34.55 ? 15 SER H CA 1 ATOM 3383 C C . SER C 1 15 ? 38.377 8.730 -17.898 1.00 34.31 ? 15 SER H C 1 ATOM 3384 O O . SER C 1 15 ? 37.734 8.864 -18.933 1.00 35.95 ? 15 SER H O 1 ATOM 3385 C CB . SER C 1 15 ? 39.966 10.637 -18.146 1.00 37.81 ? 15 SER H CB 1 ATOM 3386 O OG . SER C 1 15 ? 40.634 9.661 -18.933 1.00 39.45 ? 15 SER H OG 1 ATOM 3387 N N . GLN C 1 16 ? 38.575 7.538 -17.340 1.00 33.42 ? 16 GLN H N 1 ATOM 3388 C CA . GLN C 1 16 ? 37.983 6.327 -17.914 1.00 33.14 ? 16 GLN H CA 1 ATOM 3389 C C . GLN C 1 16 ? 36.589 6.100 -17.334 1.00 30.65 ? 16 GLN H C 1 ATOM 3390 O O . GLN C 1 16 ? 36.150 6.844 -16.467 1.00 29.58 ? 16 GLN H O 1 ATOM 3391 C CB . GLN C 1 16 ? 38.884 5.110 -17.703 1.00 34.05 ? 16 GLN H CB 1 ATOM 3392 C CG . GLN C 1 16 ? 40.242 5.135 -18.425 1.00 36.89 ? 16 GLN H CG 1 ATOM 3393 C CD . GLN C 1 16 ? 40.172 5.524 -19.897 1.00 39.34 ? 16 GLN H CD 1 ATOM 3394 O OE1 . GLN C 1 16 ? 39.178 5.277 -20.584 1.00 40.05 ? 16 GLN H OE1 1 ATOM 3395 N NE2 . GLN C 1 16 ? 41.230 6.143 -20.385 1.00 41.40 ? 16 GLN H NE2 1 ATOM 3396 N N . SER C 1 17 ? 35.881 5.102 -17.849 1.00 30.51 ? 17 SER H N 1 ATOM 3397 C CA . SER C 1 17 ? 34.488 4.862 -17.501 1.00 28.99 ? 17 SER H CA 1 ATOM 3398 C C . SER C 1 17 ? 34.295 3.791 -16.409 1.00 27.29 ? 17 SER H C 1 ATOM 3399 O O . SER C 1 17 ? 35.157 2.943 -16.176 1.00 27.96 ? 17 SER H O 1 ATOM 3400 C CB . SER C 1 17 ? 33.708 4.467 -18.761 1.00 30.44 ? 17 SER H CB 1 ATOM 3401 O OG . SER C 1 17 ? 34.109 3.163 -19.151 1.00 32.22 ? 17 SER H OG 1 ATOM 3402 N N . LEU C 1 18 ? 33.139 3.852 -15.769 1.00 25.34 ? 18 LEU H N 1 ATOM 3403 C CA . LEU C 1 18 ? 32.751 2.917 -14.720 1.00 24.38 ? 18 LEU H CA 1 ATOM 3404 C C . LEU C 1 18 ? 31.512 2.150 -15.155 1.00 24.22 ? 18 LEU H C 1 ATOM 3405 O O . LEU C 1 18 ? 30.487 2.754 -15.469 1.00 23.47 ? 18 LEU H O 1 ATOM 3406 C CB . LEU C 1 18 ? 32.424 3.669 -13.430 1.00 22.78 ? 18 LEU H CB 1 ATOM 3407 C CG . LEU C 1 18 ? 31.664 2.868 -12.366 1.00 22.13 ? 18 LEU H CG 1 ATOM 3408 C CD1 . LEU C 1 18 ? 32.448 1.642 -11.946 1.00 23.20 ? 18 LEU H CD1 1 ATOM 3409 C CD2 . LEU C 1 18 ? 31.383 3.730 -11.147 1.00 21.09 ? 18 LEU H CD2 1 ATOM 3410 N N . SER C 1 19 ? 31.603 0.826 -15.139 1.00 24.96 ? 19 SER H N 1 ATOM 3411 C CA . SER C 1 19 ? 30.490 -0.034 -15.520 1.00 25.52 ? 19 SER H CA 1 ATOM 3412 C C . SER C 1 19 ? 30.169 -1.021 -14.413 1.00 25.29 ? 19 SER H C 1 ATOM 3413 O O . SER C 1 19 ? 31.006 -1.869 -14.069 1.00 26.64 ? 19 SER H O 1 ATOM 3414 C CB . SER C 1 19 ? 30.826 -0.797 -16.814 1.00 28.19 ? 19 SER H CB 1 ATOM 3415 O OG . SER C 1 19 ? 30.934 0.064 -17.937 1.00 28.75 ? 19 SER H OG 1 ATOM 3416 N N . ILE C 1 20 ? 28.963 -0.920 -13.862 1.00 24.06 ? 20 ILE H N 1 ATOM 3417 C CA . ILE C 1 20 ? 28.496 -1.837 -12.845 1.00 24.27 ? 20 ILE H CA 1 ATOM 3418 C C . ILE C 1 20 ? 27.228 -2.539 -13.304 1.00 25.50 ? 20 ILE H C 1 ATOM 3419 O O . ILE C 1 20 ? 26.315 -1.918 -13.857 1.00 24.68 ? 20 ILE H O 1 ATOM 3420 C CB . ILE C 1 20 ? 28.183 -1.124 -11.522 1.00 22.43 ? 20 ILE H CB 1 ATOM 3421 C CG1 . ILE C 1 20 ? 29.405 -0.336 -11.041 1.00 21.70 ? 20 ILE H CG1 1 ATOM 3422 C CG2 . ILE C 1 20 ? 27.753 -2.135 -10.459 1.00 23.13 ? 20 ILE H CG2 1 ATOM 3423 C CD1 . ILE C 1 20 ? 29.114 0.589 -9.881 1.00 20.19 ? 20 ILE H CD1 1 ATOM 3424 N N . THR C 1 21 ? 27.176 -3.839 -13.037 1.00 27.57 ? 21 THR H N 1 ATOM 3425 C CA . THR C 1 21 ? 26.019 -4.654 -13.331 1.00 29.54 ? 21 THR H CA 1 ATOM 3426 C C . THR C 1 21 ? 25.375 -5.066 -12.029 1.00 30.12 ? 21 THR H C 1 ATOM 3427 O O . THR C 1 21 ? 26.027 -5.641 -11.164 1.00 30.90 ? 21 THR H O 1 ATOM 3428 C CB . THR C 1 21 ? 26.408 -5.880 -14.167 1.00 32.47 ? 21 THR H CB 1 ATOM 3429 O OG1 . THR C 1 21 ? 26.882 -5.423 -15.435 1.00 32.73 ? 21 THR H OG1 1 ATOM 3430 C CG2 . THR C 1 21 ? 25.223 -6.798 -14.377 1.00 34.55 ? 21 THR H CG2 1 ATOM 3431 N N . CYS C 1 22 ? 24.092 -4.743 -11.903 1.00 30.51 ? 22 CYS H N 1 ATOM 3432 C CA . CYS C 1 22 ? 23.291 -5.092 -10.747 1.00 31.99 ? 22 CYS H CA 1 ATOM 3433 C C . CYS C 1 22 ? 22.406 -6.270 -11.096 1.00 34.97 ? 22 CYS H C 1 ATOM 3434 O O . CYS C 1 22 ? 21.562 -6.167 -11.986 1.00 35.97 ? 22 CYS H O 1 ATOM 3435 C CB . CYS C 1 22 ? 22.439 -3.889 -10.330 1.00 30.61 ? 22 CYS H CB 1 ATOM 3436 S SG . CYS C 1 22 ? 21.239 -4.183 -9.005 1.00 32.62 ? 22 CYS H SG 1 ATOM 3437 N N . THR C 1 23 ? 22.616 -7.397 -10.429 1.00 37.29 ? 23 THR H N 1 ATOM 3438 C CA . THR C 1 23 ? 21.760 -8.551 -10.635 1.00 40.95 ? 23 THR H CA 1 ATOM 3439 C C . THR C 1 23 ? 20.698 -8.598 -9.551 1.00 41.52 ? 23 THR H C 1 ATOM 3440 O O . THR C 1 23 ? 20.989 -8.489 -8.361 1.00 40.82 ? 23 THR H O 1 ATOM 3441 C CB . THR C 1 23 ? 22.578 -9.868 -10.623 1.00 43.99 ? 23 THR H CB 1 ATOM 3442 O OG1 . THR C 1 23 ? 23.596 -9.784 -11.619 1.00 44.16 ? 23 THR H OG1 1 ATOM 3443 C CG2 . THR C 1 23 ? 21.704 -11.098 -10.866 1.00 47.82 ? 23 THR H CG2 1 ATOM 3444 N N . VAL C 1 24 ? 19.462 -8.787 -9.992 1.00 43.77 ? 24 VAL H N 1 ATOM 3445 C CA . VAL C 1 24 ? 18.278 -8.712 -9.133 1.00 44.39 ? 24 VAL H CA 1 ATOM 3446 C C . VAL C 1 24 ? 17.638 -10.076 -8.910 1.00 48.73 ? 24 VAL H C 1 ATOM 3447 O O . VAL C 1 24 ? 17.590 -10.899 -9.819 1.00 51.55 ? 24 VAL H O 1 ATOM 3448 C CB . VAL C 1 24 ? 17.276 -7.707 -9.734 1.00 42.94 ? 24 VAL H CB 1 ATOM 3449 C CG1 . VAL C 1 24 ? 15.853 -8.226 -9.704 1.00 45.48 ? 24 VAL H CG1 1 ATOM 3450 C CG2 . VAL C 1 24 ? 17.390 -6.380 -9.007 1.00 39.96 ? 24 VAL H CG2 1 ATOM 3451 N N . SER C 1 25 ? 17.161 -10.294 -7.684 1.00 50.00 ? 25 SER H N 1 ATOM 3452 C CA . SER C 1 25 ? 16.738 -11.615 -7.183 1.00 54.74 ? 25 SER H CA 1 ATOM 3453 C C . SER C 1 25 ? 15.243 -11.855 -6.895 1.00 56.65 ? 25 SER H C 1 ATOM 3454 O O . SER C 1 25 ? 14.626 -12.660 -7.594 1.00 60.18 ? 25 SER H O 1 ATOM 3455 C CB . SER C 1 25 ? 17.553 -11.967 -5.925 1.00 55.75 ? 25 SER H CB 1 ATOM 3456 O OG . SER C 1 25 ? 17.425 -10.935 -4.947 1.00 53.42 ? 25 SER H OG 1 ATOM 3457 N N . GLY C 1 26 ? 14.659 -11.210 -5.877 1.00 55.13 ? 26 GLY H N 1 ATOM 3458 C CA . GLY C 1 26 ? 13.345 -11.637 -5.352 1.00 57.43 ? 26 GLY H CA 1 ATOM 3459 C C . GLY C 1 26 ? 12.116 -11.105 -6.076 1.00 56.63 ? 26 GLY H C 1 ATOM 3460 O O . GLY C 1 26 ? 10.997 -11.534 -5.817 1.00 59.36 ? 26 GLY H O 1 ATOM 3461 N N . PHE C 1 27 ? 12.334 -10.188 -7.007 1.00 53.20 ? 27 PHE H N 1 ATOM 3462 C CA . PHE C 1 27 ? 11.269 -9.438 -7.667 1.00 51.95 ? 27 PHE H CA 1 ATOM 3463 C C . PHE C 1 27 ? 11.654 -9.254 -9.130 1.00 51.30 ? 27 PHE H C 1 ATOM 3464 O O . PHE C 1 27 ? 12.788 -9.527 -9.506 1.00 50.82 ? 27 PHE H O 1 ATOM 3465 C CB . PHE C 1 27 ? 11.086 -8.081 -7.000 1.00 48.28 ? 27 PHE H CB 1 ATOM 3466 C CG . PHE C 1 27 ? 12.257 -7.156 -7.193 1.00 44.61 ? 27 PHE H CG 1 ATOM 3467 C CD1 . PHE C 1 27 ? 13.345 -7.193 -6.333 1.00 43.35 ? 27 PHE H CD1 1 ATOM 3468 C CD2 . PHE C 1 27 ? 12.278 -6.257 -8.246 1.00 42.39 ? 27 PHE H CD2 1 ATOM 3469 C CE1 . PHE C 1 27 ? 14.427 -6.352 -6.514 1.00 40.28 ? 27 PHE H CE1 1 ATOM 3470 C CE2 . PHE C 1 27 ? 13.357 -5.419 -8.438 1.00 39.38 ? 27 PHE H CE2 1 ATOM 3471 C CZ . PHE C 1 27 ? 14.432 -5.464 -7.573 1.00 38.27 ? 27 PHE H CZ 1 ATOM 3472 N N . SER C 1 28 ? 10.716 -8.767 -9.939 1.00 51.84 ? 28 SER H N 1 ATOM 3473 C CA . SER C 1 28 ? 10.883 -8.671 -11.386 1.00 52.32 ? 28 SER H CA 1 ATOM 3474 C C . SER C 1 28 ? 11.117 -7.226 -11.832 1.00 48.91 ? 28 SER H C 1 ATOM 3475 O O . SER C 1 28 ? 10.475 -6.292 -11.330 1.00 47.32 ? 28 SER H O 1 ATOM 3476 C CB . SER C 1 28 ? 9.646 -9.222 -12.076 1.00 55.96 ? 28 SER H CB 1 ATOM 3477 O OG . SER C 1 28 ? 9.882 -9.272 -13.471 1.00 57.07 ? 28 SER H OG 1 ATOM 3478 N N . LEU C 1 29 ? 12.034 -7.043 -12.778 1.00 48.24 ? 29 LEU H N 1 ATOM 3479 C CA . LEU C 1 29 ? 12.336 -5.703 -13.295 1.00 45.50 ? 29 LEU H CA 1 ATOM 3480 C C . LEU C 1 29 ? 11.207 -5.124 -14.136 1.00 46.42 ? 29 LEU H C 1 ATOM 3481 O O . LEU C 1 29 ? 11.122 -3.905 -14.278 1.00 44.17 ? 29 LEU H O 1 ATOM 3482 C CB . LEU C 1 29 ? 13.639 -5.697 -14.096 1.00 44.81 ? 29 LEU H CB 1 ATOM 3483 C CG . LEU C 1 29 ? 14.917 -5.904 -13.281 1.00 43.45 ? 29 LEU H CG 1 ATOM 3484 C CD1 . LEU C 1 29 ? 16.077 -6.196 -14.225 1.00 44.01 ? 29 LEU H CD1 1 ATOM 3485 C CD2 . LEU C 1 29 ? 15.226 -4.708 -12.387 1.00 39.94 ? 29 LEU H CD2 1 ATOM 3486 N N . THR C 1 30 ? 10.326 -5.981 -14.655 1.00 49.96 ? 30 THR H N 1 ATOM 3487 C CA . THR C 1 30 ? 9.135 -5.509 -15.370 1.00 51.42 ? 30 THR H CA 1 ATOM 3488 C C . THR C 1 30 ? 8.131 -4.847 -14.412 1.00 50.67 ? 30 THR H C 1 ATOM 3489 O O . THR C 1 30 ? 7.241 -4.101 -14.845 1.00 50.95 ? 30 THR H O 1 ATOM 3490 C CB . THR C 1 30 ? 8.402 -6.658 -16.103 1.00 55.95 ? 30 THR H CB 1 ATOM 3491 O OG1 . THR C 1 30 ? 7.993 -7.658 -15.161 1.00 57.67 ? 30 THR H OG1 1 ATOM 3492 C CG2 . THR C 1 30 ? 9.282 -7.297 -17.166 1.00 57.57 ? 30 THR H CG2 1 ATOM 3493 N N . THR C 1 31 ? 8.260 -5.143 -13.118 1.00 50.08 ? 31 THR H N 1 ATOM 3494 C CA . THR C 1 31 ? 7.327 -4.646 -12.121 1.00 49.98 ? 31 THR H CA 1 ATOM 3495 C C . THR C 1 31 ? 7.870 -3.466 -11.320 1.00 46.32 ? 31 THR H C 1 ATOM 3496 O O . THR C 1 31 ? 7.101 -2.610 -10.904 1.00 46.60 ? 31 THR H O 1 ATOM 3497 C CB . THR C 1 31 ? 6.965 -5.759 -11.123 1.00 52.50 ? 31 THR H CB 1 ATOM 3498 O OG1 . THR C 1 31 ? 6.659 -6.966 -11.829 1.00 56.25 ? 31 THR H OG1 1 ATOM 3499 C CG2 . THR C 1 31 ? 5.780 -5.331 -10.249 1.00 53.45 ? 31 THR H CG2 1 ATOM 3500 N N . TYR C 1 32 ? 9.178 -3.425 -11.080 1.00 43.43 ? 32 TYR H N 1 ATOM 3501 C CA . TYR C 1 32 ? 9.765 -2.404 -10.202 1.00 40.15 ? 32 TYR H CA 1 ATOM 3502 C C . TYR C 1 32 ? 10.949 -1.703 -10.830 1.00 37.04 ? 32 TYR H C 1 ATOM 3503 O O . TYR C 1 32 ? 11.704 -2.299 -11.592 1.00 37.65 ? 32 TYR H O 1 ATOM 3504 C CB . TYR C 1 32 ? 10.198 -3.027 -8.882 1.00 40.43 ? 32 TYR H CB 1 ATOM 3505 C CG . TYR C 1 32 ? 9.017 -3.415 -8.053 1.00 43.43 ? 32 TYR H CG 1 ATOM 3506 C CD1 . TYR C 1 32 ? 8.240 -2.426 -7.439 1.00 43.41 ? 32 TYR H CD1 1 ATOM 3507 C CD2 . TYR C 1 32 ? 8.638 -4.745 -7.897 1.00 46.55 ? 32 TYR H CD2 1 ATOM 3508 C CE1 . TYR C 1 32 ? 7.142 -2.744 -6.674 1.00 45.53 ? 32 TYR H CE1 1 ATOM 3509 C CE2 . TYR C 1 32 ? 7.529 -5.071 -7.128 1.00 49.18 ? 32 TYR H CE2 1 ATOM 3510 C CZ . TYR C 1 32 ? 6.790 -4.057 -6.515 1.00 48.75 ? 32 TYR H CZ 1 ATOM 3511 O OH . TYR C 1 32 ? 5.669 -4.307 -5.738 1.00 51.87 ? 32 TYR H OH 1 ATOM 3512 N N . GLY C 1 33 ? 11.104 -0.428 -10.501 1.00 34.07 ? 33 GLY H N 1 ATOM 3513 C CA . GLY C 1 33 ? 12.254 0.336 -10.941 1.00 31.26 ? 33 GLY H CA 1 ATOM 3514 C C . GLY C 1 33 ? 13.445 0.109 -10.025 1.00 28.95 ? 33 GLY H C 1 ATOM 3515 O O . GLY C 1 33 ? 13.291 -0.394 -8.918 1.00 29.27 ? 33 GLY H O 1 ATOM 3516 N N . VAL C 1 34 ? 14.638 0.459 -10.507 1.00 26.82 ? 34 VAL H N 1 ATOM 3517 C CA . VAL C 1 34 ? 15.886 0.333 -9.733 1.00 24.79 ? 34 VAL H CA 1 ATOM 3518 C C . VAL C 1 34 ? 16.641 1.655 -9.766 1.00 22.44 ? 34 VAL H C 1 ATOM 3519 O O . VAL C 1 34 ? 16.856 2.240 -10.823 1.00 21.55 ? 34 VAL H O 1 ATOM 3520 C CB . VAL C 1 34 ? 16.767 -0.805 -10.273 1.00 25.37 ? 34 VAL H CB 1 ATOM 3521 C CG1 . VAL C 1 34 ? 18.097 -0.838 -9.554 1.00 24.32 ? 34 VAL H CG1 1 ATOM 3522 C CG2 . VAL C 1 34 ? 16.035 -2.129 -10.131 1.00 27.74 ? 34 VAL H CG2 1 ATOM 3523 N N . HIS C 1 35 ? 17.005 2.124 -8.575 1.00 21.45 ? 35 HIS H N 1 ATOM 3524 C CA . HIS C 1 35 ? 17.706 3.384 -8.424 1.00 20.02 ? 35 HIS H CA 1 ATOM 3525 C C . HIS C 1 35 ? 19.191 3.141 -8.215 1.00 19.65 ? 35 HIS H C 1 ATOM 3526 O O . HIS C 1 35 ? 19.615 2.046 -7.795 1.00 20.06 ? 35 HIS H O 1 ATOM 3527 C CB . HIS C 1 35 ? 17.151 4.174 -7.240 1.00 19.97 ? 35 HIS H CB 1 ATOM 3528 C CG . HIS C 1 35 ? 15.673 4.368 -7.281 1.00 20.78 ? 35 HIS H CG 1 ATOM 3529 N ND1 . HIS C 1 35 ? 15.087 5.594 -7.506 1.00 21.04 ? 35 HIS H ND1 1 ATOM 3530 C CD2 . HIS C 1 35 ? 14.653 3.492 -7.119 1.00 21.93 ? 35 HIS H CD2 1 ATOM 3531 C CE1 . HIS C 1 35 ? 13.771 5.470 -7.488 1.00 22.12 ? 35 HIS H CE1 1 ATOM 3532 N NE2 . HIS C 1 35 ? 13.482 4.203 -7.255 1.00 22.79 ? 35 HIS H NE2 1 ATOM 3533 N N . TRP C 1 36 ? 19.982 4.158 -8.546 1.00 18.95 ? 36 TRP H N 1 ATOM 3534 C CA . TRP C 1 36 ? 21.397 4.126 -8.291 1.00 18.57 ? 36 TRP H CA 1 ATOM 3535 C C . TRP C 1 36 ? 21.767 5.264 -7.373 1.00 18.42 ? 36 TRP H C 1 ATOM 3536 O O . TRP C 1 36 ? 21.359 6.412 -7.558 1.00 18.57 ? 36 TRP H O 1 ATOM 3537 C CB . TRP C 1 36 ? 22.199 4.131 -9.592 1.00 18.64 ? 36 TRP H CB 1 ATOM 3538 C CG . TRP C 1 36 ? 22.051 2.822 -10.316 1.00 19.39 ? 36 TRP H CG 1 ATOM 3539 C CD1 . TRP C 1 36 ? 21.041 2.479 -11.134 1.00 20.45 ? 36 TRP H CD1 1 ATOM 3540 C CD2 . TRP C 1 36 ? 22.917 1.691 -10.246 1.00 19.79 ? 36 TRP H CD2 1 ATOM 3541 N NE1 . TRP C 1 36 ? 21.225 1.205 -11.603 1.00 21.59 ? 36 TRP H NE1 1 ATOM 3542 C CE2 . TRP C 1 36 ? 22.369 0.697 -11.066 1.00 21.23 ? 36 TRP H CE2 1 ATOM 3543 C CE3 . TRP C 1 36 ? 24.109 1.422 -9.574 1.00 19.79 ? 36 TRP H CE3 1 ATOM 3544 C CZ2 . TRP C 1 36 ? 22.972 -0.558 -11.248 1.00 22.69 ? 36 TRP H CZ2 1 ATOM 3545 C CZ3 . TRP C 1 36 ? 24.707 0.185 -9.747 1.00 20.97 ? 36 TRP H CZ3 1 ATOM 3546 C CH2 . TRP C 1 36 ? 24.145 -0.787 -10.594 1.00 22.35 ? 36 TRP H CH2 1 ATOM 3547 N N . VAL C 1 37 ? 22.525 4.909 -6.346 1.00 18.78 ? 37 VAL H N 1 ATOM 3548 C CA . VAL C 1 37 ? 22.909 5.832 -5.298 1.00 19.09 ? 37 VAL H CA 1 ATOM 3549 C C . VAL C 1 37 ? 24.403 5.634 -5.042 1.00 19.33 ? 37 VAL H C 1 ATOM 3550 O O . VAL C 1 37 ? 24.936 4.527 -5.233 1.00 19.36 ? 37 VAL H O 1 ATOM 3551 C CB . VAL C 1 37 ? 22.094 5.558 -4.028 1.00 20.06 ? 37 VAL H CB 1 ATOM 3552 C CG1 . VAL C 1 37 ? 22.617 6.348 -2.843 1.00 21.02 ? 37 VAL H CG1 1 ATOM 3553 C CG2 . VAL C 1 37 ? 20.633 5.904 -4.256 1.00 20.33 ? 37 VAL H CG2 1 ATOM 3554 N N . ARG C 1 38 ? 25.091 6.715 -4.681 1.00 19.67 ? 38 ARG H N 1 ATOM 3555 C CA . ARG C 1 38 ? 26.472 6.610 -4.273 1.00 20.37 ? 38 ARG H CA 1 ATOM 3556 C C . ARG C 1 38 ? 26.720 7.330 -2.978 1.00 22.66 ? 38 ARG H C 1 ATOM 3557 O O . ARG C 1 38 ? 25.933 8.174 -2.524 1.00 23.64 ? 38 ARG H O 1 ATOM 3558 C CB . ARG C 1 38 ? 27.425 7.121 -5.342 1.00 19.54 ? 38 ARG H CB 1 ATOM 3559 C CG . ARG C 1 38 ? 27.645 8.620 -5.329 1.00 19.63 ? 38 ARG H CG 1 ATOM 3560 C CD . ARG C 1 38 ? 28.568 9.014 -6.461 1.00 19.41 ? 38 ARG H CD 1 ATOM 3561 N NE . ARG C 1 38 ? 28.758 10.441 -6.508 1.00 20.13 ? 38 ARG H NE 1 ATOM 3562 C CZ . ARG C 1 38 ? 29.549 11.067 -7.355 1.00 20.62 ? 38 ARG H CZ 1 ATOM 3563 N NH1 . ARG C 1 38 ? 30.271 10.393 -8.237 1.00 20.36 ? 38 ARG H NH1 1 ATOM 3564 N NH2 . ARG C 1 38 ? 29.645 12.389 -7.291 1.00 22.20 ? 38 ARG H NH2 1 ATOM 3565 N N . GLN C 1 39 ? 27.844 6.999 -2.386 1.00 24.66 ? 39 GLN H N 1 ATOM 3566 C CA . GLN C 1 39 ? 28.132 7.461 -1.063 1.00 27.73 ? 39 GLN H CA 1 ATOM 3567 C C . GLN C 1 39 ? 29.603 7.738 -0.897 1.00 29.70 ? 39 GLN H C 1 ATOM 3568 O O . GLN C 1 39 ? 30.445 6.875 -1.166 1.00 28.57 ? 39 GLN H O 1 ATOM 3569 C CB . GLN C 1 39 ? 27.682 6.404 -0.086 1.00 29.12 ? 39 GLN H CB 1 ATOM 3570 C CG . GLN C 1 39 ? 28.498 6.343 1.163 1.00 32.19 ? 39 GLN H CG 1 ATOM 3571 C CD . GLN C 1 39 ? 27.736 5.703 2.248 1.00 34.85 ? 39 GLN H CD 1 ATOM 3572 O OE1 . GLN C 1 39 ? 27.386 6.384 3.214 1.00 37.74 ? 39 GLN H OE1 1 ATOM 3573 N NE2 . GLN C 1 39 ? 27.428 4.387 2.103 1.00 34.96 ? 39 GLN H NE2 1 ATOM 3574 N N . SER C 1 40 ? 29.894 8.947 -0.422 1.00 33.20 ? 40 SER H N 1 ATOM 3575 C CA . SER C 1 40 ? 31.275 9.375 -0.154 1.00 35.98 ? 40 SER H CA 1 ATOM 3576 C C . SER C 1 40 ? 31.317 10.046 1.210 1.00 39.00 ? 40 SER H C 1 ATOM 3577 O O . SER C 1 40 ? 30.299 10.566 1.677 1.00 41.02 ? 40 SER H O 1 ATOM 3578 C CB . SER C 1 40 ? 31.759 10.323 -1.265 1.00 35.50 ? 40 SER H CB 1 ATOM 3579 O OG . SER C 1 40 ? 30.723 11.230 -1.610 1.00 35.50 ? 40 SER H OG 1 ATOM 3580 N N . PRO C 1 41 ? 32.482 10.020 1.879 1.00 42.64 ? 41 PRO H N 1 ATOM 3581 C CA . PRO C 1 41 ? 32.578 10.679 3.191 1.00 45.46 ? 41 PRO H CA 1 ATOM 3582 C C . PRO C 1 41 ? 32.222 12.175 3.144 1.00 47.03 ? 41 PRO H C 1 ATOM 3583 O O . PRO C 1 41 ? 31.666 12.705 4.090 1.00 49.23 ? 41 PRO H O 1 ATOM 3584 C CB . PRO C 1 41 ? 34.045 10.482 3.578 1.00 47.29 ? 41 PRO H CB 1 ATOM 3585 C CG . PRO C 1 41 ? 34.755 10.190 2.298 1.00 45.60 ? 41 PRO H CG 1 ATOM 3586 C CD . PRO C 1 41 ? 33.773 9.460 1.442 1.00 42.57 ? 41 PRO H CD 1 ATOM 3587 N N . GLY C 1 42 ? 32.541 12.840 2.041 1.00 47.15 ? 42 GLY H N 1 ATOM 3588 C CA . GLY C 1 42 ? 32.252 14.257 1.887 1.00 48.89 ? 42 GLY H CA 1 ATOM 3589 C C . GLY C 1 42 ? 30.783 14.565 1.652 1.00 48.57 ? 42 GLY H C 1 ATOM 3590 O O . GLY C 1 42 ? 30.236 15.464 2.285 1.00 51.36 ? 42 GLY H O 1 ATOM 3591 N N . LYS C 1 43 ? 30.142 13.829 0.743 1.00 45.97 ? 43 LYS H N 1 ATOM 3592 C CA . LYS C 1 43 ? 28.778 14.160 0.290 1.00 45.21 ? 43 LYS H CA 1 ATOM 3593 C C . LYS C 1 43 ? 27.655 13.385 0.977 1.00 43.15 ? 43 LYS H C 1 ATOM 3594 O O . LYS C 1 43 ? 26.486 13.656 0.710 1.00 43.82 ? 43 LYS H O 1 ATOM 3595 C CB . LYS C 1 43 ? 28.652 13.953 -1.228 1.00 44.39 ? 43 LYS H CB 1 ATOM 3596 C CG . LYS C 1 43 ? 29.192 15.109 -2.056 1.00 47.37 ? 43 LYS H CG 1 ATOM 3597 C CD . LYS C 1 43 ? 28.185 16.261 -2.112 1.00 50.05 ? 43 LYS H CD 1 ATOM 3598 C CE . LYS C 1 43 ? 28.835 17.640 -2.305 1.00 53.89 ? 43 LYS H CE 1 ATOM 3599 N NZ . LYS C 1 43 ? 28.694 18.178 -3.699 1.00 53.83 ? 43 LYS H NZ 1 ATOM 3600 N N . GLY C 1 44 ? 27.981 12.423 1.843 1.00 41.15 ? 44 GLY H N 1 ATOM 3601 C CA . GLY C 1 44 ? 26.946 11.536 2.374 1.00 38.42 ? 44 GLY H CA 1 ATOM 3602 C C . GLY C 1 44 ? 26.329 10.764 1.217 1.00 33.60 ? 44 GLY H C 1 ATOM 3603 O O . GLY C 1 44 ? 27.037 10.350 0.320 1.00 32.18 ? 44 GLY H O 1 ATOM 3604 N N . LEU C 1 45 ? 25.017 10.589 1.223 1.00 31.24 ? 45 LEU H N 1 ATOM 3605 C CA . LEU C 1 45 ? 24.352 9.815 0.185 1.00 27.86 ? 45 LEU H CA 1 ATOM 3606 C C . LEU C 1 45 ? 23.883 10.722 -0.919 1.00 26.31 ? 45 LEU H C 1 ATOM 3607 O O . LEU C 1 45 ? 23.458 11.845 -0.672 1.00 27.15 ? 45 LEU H O 1 ATOM 3608 C CB . LEU C 1 45 ? 23.172 9.038 0.751 1.00 28.15 ? 45 LEU H CB 1 ATOM 3609 C CG . LEU C 1 45 ? 23.521 7.820 1.606 1.00 28.95 ? 45 LEU H CG 1 ATOM 3610 C CD1 . LEU C 1 45 ? 22.297 7.311 2.338 1.00 29.74 ? 45 LEU H CD1 1 ATOM 3611 C CD2 . LEU C 1 45 ? 24.084 6.719 0.713 1.00 27.61 ? 45 LEU H CD2 1 ATOM 3612 N N . GLU C 1 46 ? 23.957 10.208 -2.141 1.00 24.04 ? 46 GLU H N 1 ATOM 3613 C CA . GLU C 1 46 ? 23.700 10.981 -3.327 1.00 23.51 ? 46 GLU H CA 1 ATOM 3614 C C . GLU C 1 46 ? 22.867 10.104 -4.271 1.00 21.11 ? 46 GLU H C 1 ATOM 3615 O O . GLU C 1 46 ? 23.236 8.971 -4.532 1.00 19.97 ? 46 GLU H O 1 ATOM 3616 C CB . GLU C 1 46 ? 25.050 11.395 -3.918 1.00 24.47 ? 46 GLU H CB 1 ATOM 3617 C CG . GLU C 1 46 ? 25.001 12.565 -4.876 1.00 26.11 ? 46 GLU H CG 1 ATOM 3618 C CD . GLU C 1 46 ? 26.360 13.170 -5.250 1.00 27.89 ? 46 GLU H CD 1 ATOM 3619 O OE1 . GLU C 1 46 ? 27.455 12.678 -4.818 1.00 28.07 ? 46 GLU H OE1 1 ATOM 3620 O OE2 . GLU C 1 46 ? 26.298 14.168 -6.027 1.00 29.54 ? 46 GLU H OE2 1 ATOM 3621 N N . TRP C 1 47 ? 21.705 10.604 -4.690 1.00 20.26 ? 47 TRP H N 1 ATOM 3622 C CA . TRP C 1 47 ? 20.884 9.948 -5.697 1.00 18.90 ? 47 TRP H CA 1 ATOM 3623 C C . TRP C 1 47 ? 21.341 10.280 -7.136 1.00 18.30 ? 47 TRP H C 1 ATOM 3624 O O . TRP C 1 47 ? 21.503 11.430 -7.527 1.00 18.73 ? 47 TRP H O 1 ATOM 3625 C CB . TRP C 1 47 ? 19.417 10.337 -5.512 1.00 19.56 ? 47 TRP H CB 1 ATOM 3626 C CG . TRP C 1 47 ? 18.490 9.613 -6.400 1.00 19.01 ? 47 TRP H CG 1 ATOM 3627 C CD1 . TRP C 1 47 ? 17.944 8.377 -6.185 1.00 18.72 ? 47 TRP H CD1 1 ATOM 3628 C CD2 . TRP C 1 47 ? 18.020 10.037 -7.677 1.00 19.11 ? 47 TRP H CD2 1 ATOM 3629 N NE1 . TRP C 1 47 ? 17.172 8.016 -7.242 1.00 18.62 ? 47 TRP H NE1 1 ATOM 3630 C CE2 . TRP C 1 47 ? 17.195 9.011 -8.176 1.00 18.99 ? 47 TRP H CE2 1 ATOM 3631 C CE3 . TRP C 1 47 ? 18.199 11.191 -8.438 1.00 19.74 ? 47 TRP H CE3 1 ATOM 3632 C CZ2 . TRP C 1 47 ? 16.541 9.110 -9.399 1.00 19.52 ? 47 TRP H CZ2 1 ATOM 3633 C CZ3 . TRP C 1 47 ? 17.556 11.290 -9.641 1.00 20.26 ? 47 TRP H CZ3 1 ATOM 3634 C CH2 . TRP C 1 47 ? 16.739 10.252 -10.117 1.00 20.16 ? 47 TRP H CH2 1 ATOM 3635 N N . LEU C 1 48 ? 21.536 9.243 -7.926 1.00 17.53 ? 48 LEU H N 1 ATOM 3636 C CA . LEU C 1 48 ? 22.156 9.395 -9.253 1.00 17.62 ? 48 LEU H CA 1 ATOM 3637 C C . LEU C 1 48 ? 21.203 9.196 -10.390 1.00 18.06 ? 48 LEU H C 1 ATOM 3638 O O . LEU C 1 48 ? 21.218 9.965 -11.359 1.00 18.91 ? 48 LEU H O 1 ATOM 3639 C CB . LEU C 1 48 ? 23.301 8.394 -9.421 1.00 16.78 ? 48 LEU H CB 1 ATOM 3640 C CG . LEU C 1 48 ? 24.490 8.597 -8.513 1.00 16.79 ? 48 LEU H CG 1 ATOM 3641 C CD1 . LEU C 1 48 ? 25.463 7.432 -8.696 1.00 16.56 ? 48 LEU H CD1 1 ATOM 3642 C CD2 . LEU C 1 48 ? 25.173 9.929 -8.790 1.00 17.37 ? 48 LEU H CD2 1 ATOM 3643 N N . GLY C 1 49 ? 20.385 8.146 -10.296 1.00 18.06 ? 49 GLY H N 1 ATOM 3644 C CA . GLY C 1 49 ? 19.358 7.932 -11.297 1.00 18.90 ? 49 GLY H CA 1 ATOM 3645 C C . GLY C 1 49 ? 18.440 6.774 -11.003 1.00 19.22 ? 49 GLY H C 1 ATOM 3646 O O . GLY C 1 49 ? 18.510 6.162 -9.933 1.00 18.63 ? 49 GLY H O 1 ATOM 3647 N N . VAL C 1 50 ? 17.550 6.509 -11.963 1.00 20.39 ? 50 VAL H N 1 ATOM 3648 C CA . VAL C 1 50 ? 16.604 5.419 -11.858 1.00 21.07 ? 50 VAL H CA 1 ATOM 3649 C C . VAL C 1 50 ? 16.254 4.926 -13.253 1.00 22.53 ? 50 VAL H C 1 ATOM 3650 O O . VAL C 1 50 ? 16.190 5.714 -14.224 1.00 23.39 ? 50 VAL H O 1 ATOM 3651 C CB . VAL C 1 50 ? 15.356 5.868 -11.082 1.00 21.75 ? 50 VAL H CB 1 ATOM 3652 C CG1 . VAL C 1 50 ? 14.682 7.050 -11.778 1.00 22.74 ? 50 VAL H CG1 1 ATOM 3653 C CG2 . VAL C 1 50 ? 14.373 4.724 -10.919 1.00 22.98 ? 50 VAL H CG2 1 ATOM 3654 N N . ILE C 1 51 ? 16.078 3.613 -13.371 1.00 23.26 ? 51 ILE H N 1 ATOM 3655 C CA . ILE C 1 51 ? 15.409 3.047 -14.525 1.00 25.21 ? 51 ILE H CA 1 ATOM 3656 C C . ILE C 1 51 ? 14.084 2.468 -14.029 1.00 26.47 ? 51 ILE H C 1 ATOM 3657 O O . ILE C 1 51 ? 14.055 1.636 -13.131 1.00 26.44 ? 51 ILE H O 1 ATOM 3658 C CB . ILE C 1 51 ? 16.263 2.032 -15.306 1.00 26.00 ? 51 ILE H CB 1 ATOM 3659 C CG1 . ILE C 1 51 ? 15.549 1.622 -16.600 1.00 28.58 ? 51 ILE H CG1 1 ATOM 3660 C CG2 . ILE C 1 51 ? 16.606 0.800 -14.477 1.00 26.08 ? 51 ILE H CG2 1 ATOM 3661 C CD1 . ILE C 1 51 ? 16.503 1.165 -17.686 1.00 29.73 ? 51 ILE H CD1 1 ATOM 3662 N N . TRP C 1 52 ? 12.987 2.976 -14.586 1.00 27.87 ? 52 TRP H N 1 ATOM 3663 C CA . TRP C 1 52 ? 11.653 2.555 -14.215 1.00 29.24 ? 52 TRP H CA 1 ATOM 3664 C C . TRP C 1 52 ? 11.295 1.224 -14.893 1.00 31.66 ? 52 TRP H C 1 ATOM 3665 O O . TRP C 1 52 ? 11.886 0.829 -15.894 1.00 32.60 ? 52 TRP H O 1 ATOM 3666 C CB . TRP C 1 52 ? 10.656 3.646 -14.591 1.00 30.10 ? 52 TRP H CB 1 ATOM 3667 C CG . TRP C 1 52 ? 10.965 4.968 -13.965 1.00 28.52 ? 52 TRP H CG 1 ATOM 3668 C CD1 . TRP C 1 52 ? 11.478 6.073 -14.577 1.00 28.20 ? 52 TRP H CD1 1 ATOM 3669 C CD2 . TRP C 1 52 ? 10.765 5.331 -12.593 1.00 27.66 ? 52 TRP H CD2 1 ATOM 3670 N NE1 . TRP C 1 52 ? 11.614 7.099 -13.670 1.00 27.13 ? 52 TRP H NE1 1 ATOM 3671 C CE2 . TRP C 1 52 ? 11.158 6.673 -12.450 1.00 26.87 ? 52 TRP H CE2 1 ATOM 3672 C CE3 . TRP C 1 52 ? 10.281 4.653 -11.477 1.00 27.94 ? 52 TRP H CE3 1 ATOM 3673 C CZ2 . TRP C 1 52 ? 11.100 7.344 -11.217 1.00 26.28 ? 52 TRP H CZ2 1 ATOM 3674 C CZ3 . TRP C 1 52 ? 10.224 5.318 -10.258 1.00 27.30 ? 52 TRP H CZ3 1 ATOM 3675 C CH2 . TRP C 1 52 ? 10.639 6.646 -10.133 1.00 26.36 ? 52 TRP H CH2 1 ATOM 3676 N N . SER C 1 53 ? 10.313 0.533 -14.338 1.00 32.99 ? 53 SER H N 1 ATOM 3677 C CA . SER C 1 53 ? 9.933 -0.775 -14.845 1.00 35.48 ? 53 SER H CA 1 ATOM 3678 C C . SER C 1 53 ? 9.608 -0.748 -16.349 1.00 37.82 ? 53 SER H C 1 ATOM 3679 O O . SER C 1 53 ? 9.971 -1.668 -17.095 1.00 39.43 ? 53 SER H O 1 ATOM 3680 C CB . SER C 1 53 ? 8.738 -1.307 -14.059 1.00 37.01 ? 53 SER H CB 1 ATOM 3681 O OG . SER C 1 53 ? 7.599 -0.494 -14.249 1.00 37.81 ? 53 SER H OG 1 ATOM 3682 N N . GLY C 1 54 ? 8.913 0.303 -16.786 1.00 38.23 ? 54 GLY H N 1 ATOM 3683 C CA . GLY C 1 54 ? 8.602 0.466 -18.220 1.00 40.57 ? 54 GLY H CA 1 ATOM 3684 C C . GLY C 1 54 ? 9.803 0.819 -19.085 1.00 39.78 ? 54 GLY H C 1 ATOM 3685 O O . GLY C 1 54 ? 9.701 0.866 -20.287 1.00 42.05 ? 54 GLY H O 1 ATOM 3686 N N . GLY C 1 55 ? 10.938 1.121 -18.476 1.00 37.03 ? 55 GLY H N 1 ATOM 3687 C CA . GLY C 1 55 ? 12.179 1.231 -19.193 1.00 36.60 ? 55 GLY H CA 1 ATOM 3688 C C . GLY C 1 55 ? 12.640 2.646 -19.430 1.00 35.40 ? 55 GLY H C 1 ATOM 3689 O O . GLY C 1 55 ? 13.718 2.845 -19.970 1.00 35.13 ? 55 GLY H O 1 ATOM 3690 N N . SER C 1 56 ? 11.868 3.641 -18.997 1.00 35.18 ? 56 SER H N 1 ATOM 3691 C CA . SER C 1 56 ? 12.347 5.027 -19.085 1.00 34.21 ? 56 SER H CA 1 ATOM 3692 C C . SER C 1 56 ? 13.283 5.297 -17.907 1.00 31.10 ? 56 SER H C 1 ATOM 3693 O O . SER C 1 56 ? 13.336 4.517 -16.934 1.00 29.78 ? 56 SER H O 1 ATOM 3694 C CB . SER C 1 56 ? 11.206 6.048 -19.140 1.00 35.57 ? 56 SER H CB 1 ATOM 3695 O OG . SER C 1 56 ? 10.430 6.052 -17.960 1.00 34.82 ? 56 SER H OG 1 ATOM 3696 N N . THR C 1 57 ? 14.049 6.375 -18.032 1.00 30.25 ? 57 THR H N 1 ATOM 3697 C CA . THR C 1 57 ? 15.068 6.717 -17.056 1.00 27.93 ? 57 THR H CA 1 ATOM 3698 C C . THR C 1 57 ? 14.951 8.155 -16.582 1.00 27.43 ? 57 THR H C 1 ATOM 3699 O O . THR C 1 57 ? 14.395 8.991 -17.267 1.00 29.04 ? 57 THR H O 1 ATOM 3700 C CB . THR C 1 57 ? 16.473 6.563 -17.653 1.00 27.81 ? 57 THR H CB 1 ATOM 3701 O OG1 . THR C 1 57 ? 16.541 7.273 -18.895 1.00 29.87 ? 57 THR H OG1 1 ATOM 3702 C CG2 . THR C 1 57 ? 16.820 5.081 -17.852 1.00 27.99 ? 57 THR H CG2 1 ATOM 3703 N N . ASP C 1 58 ? 15.485 8.420 -15.393 1.00 25.54 ? 58 ASP H N 1 ATOM 3704 C CA . ASP C 1 58 ? 15.627 9.770 -14.870 1.00 25.33 ? 58 ASP H CA 1 ATOM 3705 C C . ASP C 1 58 ? 16.979 9.881 -14.186 1.00 23.69 ? 58 ASP H C 1 ATOM 3706 O O . ASP C 1 58 ? 17.478 8.913 -13.581 1.00 22.73 ? 58 ASP H O 1 ATOM 3707 C CB . ASP C 1 58 ? 14.485 10.134 -13.914 1.00 25.68 ? 58 ASP H CB 1 ATOM 3708 C CG . ASP C 1 58 ? 13.220 10.522 -14.640 1.00 27.84 ? 58 ASP H CG 1 ATOM 3709 O OD1 . ASP C 1 58 ? 13.257 11.506 -15.425 1.00 29.39 ? 58 ASP H OD1 1 ATOM 3710 O OD2 . ASP C 1 58 ? 12.187 9.857 -14.397 1.00 28.31 ? 58 ASP H OD2 1 ATOM 3711 N N . TYR C 1 59 ? 17.597 11.049 -14.340 1.00 23.99 ? 59 TYR H N 1 ATOM 3712 C CA . TYR C 1 59 ? 18.954 11.263 -13.907 1.00 22.93 ? 59 TYR H CA 1 ATOM 3713 C C . TYR C 1 59 ? 19.112 12.544 -13.072 1.00 23.45 ? 59 TYR H C 1 ATOM 3714 O O . TYR C 1 59 ? 18.458 13.568 -13.298 1.00 25.81 ? 59 TYR H O 1 ATOM 3715 C CB . TYR C 1 59 ? 19.874 11.315 -15.132 1.00 23.59 ? 59 TYR H CB 1 ATOM 3716 C CG . TYR C 1 59 ? 19.870 10.065 -15.991 1.00 23.60 ? 59 TYR H CG 1 ATOM 3717 C CD1 . TYR C 1 59 ? 20.363 8.860 -15.503 1.00 22.32 ? 59 TYR H CD1 1 ATOM 3718 C CD2 . TYR C 1 59 ? 19.428 10.097 -17.303 1.00 25.44 ? 59 TYR H CD2 1 ATOM 3719 C CE1 . TYR C 1 59 ? 20.363 7.721 -16.285 1.00 22.80 ? 59 TYR H CE1 1 ATOM 3720 C CE2 . TYR C 1 59 ? 19.438 8.964 -18.097 1.00 26.00 ? 59 TYR H CE2 1 ATOM 3721 C CZ . TYR C 1 59 ? 19.897 7.779 -17.578 1.00 24.73 ? 59 TYR H CZ 1 ATOM 3722 O OH . TYR C 1 59 ? 19.909 6.640 -18.346 1.00 25.80 ? 59 TYR H OH 1 ATOM 3723 N N . ASN C 1 60 ? 19.992 12.466 -12.088 1.00 22.16 ? 60 ASN H N 1 ATOM 3724 C CA . ASN C 1 60 ? 20.490 13.641 -11.362 1.00 22.65 ? 60 ASN H CA 1 ATOM 3725 C C . ASN C 1 60 ? 20.999 14.643 -12.378 1.00 24.08 ? 60 ASN H C 1 ATOM 3726 O O . ASN C 1 60 ? 21.725 14.273 -13.283 1.00 23.91 ? 60 ASN H O 1 ATOM 3727 C CB . ASN C 1 60 ? 21.594 13.170 -10.410 1.00 21.30 ? 60 ASN H CB 1 ATOM 3728 C CG . ASN C 1 60 ? 22.297 14.286 -9.620 1.00 22.47 ? 60 ASN H CG 1 ATOM 3729 O OD1 . ASN C 1 60 ? 22.826 15.261 -10.173 1.00 24.03 ? 60 ASN H OD1 1 ATOM 3730 N ND2 . ASN C 1 60 ? 22.429 14.061 -8.330 1.00 21.81 ? 60 ASN H ND2 1 ATOM 3731 N N . ALA C 1 61 ? 20.589 15.895 -12.249 1.00 25.90 ? 61 ALA H N 1 ATOM 3732 C CA . ALA C 1 61 ? 20.884 16.912 -13.257 1.00 28.23 ? 61 ALA H CA 1 ATOM 3733 C C . ALA C 1 61 ? 22.376 17.033 -13.549 1.00 28.32 ? 61 ALA H C 1 ATOM 3734 O O . ALA C 1 61 ? 22.766 17.240 -14.703 1.00 29.83 ? 61 ALA H O 1 ATOM 3735 C CB . ALA C 1 61 ? 20.307 18.255 -12.845 1.00 30.61 ? 61 ALA H CB 1 ATOM 3736 N N . ALA C 1 62 ? 23.198 16.883 -12.517 1.00 27.17 ? 62 ALA H N 1 ATOM 3737 C CA . ALA C 1 62 ? 24.639 16.994 -12.656 1.00 27.48 ? 62 ALA H CA 1 ATOM 3738 C C . ALA C 1 62 ? 25.272 15.856 -13.482 1.00 26.05 ? 62 ALA H C 1 ATOM 3739 O O . ALA C 1 62 ? 26.376 16.003 -13.988 1.00 26.76 ? 62 ALA H O 1 ATOM 3740 C CB . ALA C 1 62 ? 25.278 17.093 -11.268 1.00 26.92 ? 62 ALA H CB 1 ATOM 3741 N N . PHE C 1 63 ? 24.571 14.743 -13.641 1.00 24.50 ? 63 PHE H N 1 ATOM 3742 C CA . PHE C 1 63 ? 25.144 13.577 -14.306 1.00 23.68 ? 63 PHE H CA 1 ATOM 3743 C C . PHE C 1 63 ? 24.486 13.270 -15.674 1.00 24.98 ? 63 PHE H C 1 ATOM 3744 O O . PHE C 1 63 ? 24.800 12.288 -16.338 1.00 24.41 ? 63 PHE H O 1 ATOM 3745 C CB . PHE C 1 63 ? 24.982 12.382 -13.407 1.00 21.65 ? 63 PHE H CB 1 ATOM 3746 C CG . PHE C 1 63 ? 25.748 12.491 -12.115 1.00 21.03 ? 63 PHE H CG 1 ATOM 3747 C CD1 . PHE C 1 63 ? 25.266 13.258 -11.078 1.00 21.39 ? 63 PHE H CD1 1 ATOM 3748 C CD2 . PHE C 1 63 ? 26.956 11.839 -11.942 1.00 20.50 ? 63 PHE H CD2 1 ATOM 3749 C CE1 . PHE C 1 63 ? 25.956 13.375 -9.888 1.00 21.28 ? 63 PHE H CE1 1 ATOM 3750 C CE2 . PHE C 1 63 ? 27.660 11.948 -10.743 1.00 20.25 ? 63 PHE H CE2 1 ATOM 3751 C CZ . PHE C 1 63 ? 27.160 12.724 -9.725 1.00 20.72 ? 63 PHE H CZ 1 ATOM 3752 N N . ILE C 1 64 ? 23.560 14.126 -16.075 1.00 26.97 ? 64 ILE H N 1 ATOM 3753 C CA . ILE C 1 64 ? 22.796 13.996 -17.332 1.00 29.09 ? 64 ILE H CA 1 ATOM 3754 C C . ILE C 1 64 ? 23.624 13.605 -18.538 1.00 30.33 ? 64 ILE H C 1 ATOM 3755 O O . ILE C 1 64 ? 23.192 12.801 -19.358 1.00 30.78 ? 64 ILE H O 1 ATOM 3756 C CB . ILE C 1 64 ? 22.056 15.317 -17.662 1.00 31.68 ? 64 ILE H CB 1 ATOM 3757 C CG1 . ILE C 1 64 ? 20.698 15.397 -16.954 1.00 31.39 ? 64 ILE H CG1 1 ATOM 3758 C CG2 . ILE C 1 64 ? 21.857 15.475 -19.157 1.00 34.37 ? 64 ILE H CG2 1 ATOM 3759 C CD1 . ILE C 1 64 ? 20.047 16.777 -17.006 1.00 34.17 ? 64 ILE H CD1 1 ATOM 3760 N N . SER C 1 65 ? 24.804 14.188 -18.657 1.00 31.49 ? 65 SER H N 1 ATOM 3761 C CA . SER C 1 65 ? 25.578 14.000 -19.867 1.00 33.23 ? 65 SER H CA 1 ATOM 3762 C C . SER C 1 65 ? 26.634 12.871 -19.820 1.00 31.54 ? 65 SER H C 1 ATOM 3763 O O . SER C 1 65 ? 27.199 12.503 -20.833 1.00 32.62 ? 65 SER H O 1 ATOM 3764 C CB . SER C 1 65 ? 26.256 15.301 -20.211 1.00 35.96 ? 65 SER H CB 1 ATOM 3765 O OG . SER C 1 65 ? 27.419 15.398 -19.426 1.00 35.84 ? 65 SER H OG 1 ATOM 3766 N N . ARG C 1 66 ? 26.908 12.313 -18.661 1.00 29.00 ? 66 ARG H N 1 ATOM 3767 C CA . ARG C 1 66 ? 27.893 11.238 -18.606 1.00 27.99 ? 66 ARG H CA 1 ATOM 3768 C C . ARG C 1 66 ? 27.422 9.967 -17.926 1.00 26.09 ? 66 ARG H C 1 ATOM 3769 O O . ARG C 1 66 ? 28.239 9.107 -17.635 1.00 25.56 ? 66 ARG H O 1 ATOM 3770 C CB . ARG C 1 66 ? 29.182 11.751 -17.973 1.00 27.77 ? 66 ARG H CB 1 ATOM 3771 C CG . ARG C 1 66 ? 29.020 12.392 -16.606 1.00 26.33 ? 66 ARG H CG 1 ATOM 3772 C CD . ARG C 1 66 ? 30.389 12.494 -15.930 1.00 25.94 ? 66 ARG H CD 1 ATOM 3773 N NE . ARG C 1 66 ? 30.217 12.616 -14.501 1.00 24.19 ? 66 ARG H NE 1 ATOM 3774 C CZ . ARG C 1 66 ? 31.067 12.216 -13.568 1.00 23.25 ? 66 ARG H CZ 1 ATOM 3775 N NH1 . ARG C 1 66 ? 32.195 11.587 -13.866 1.00 23.60 ? 66 ARG H NH1 1 ATOM 3776 N NH2 . ARG C 1 66 ? 30.762 12.439 -12.304 1.00 22.52 ? 66 ARG H NH2 1 ATOM 3777 N N . LEU C 1 67 ? 26.113 9.822 -17.734 1.00 25.67 ? 67 LEU H N 1 ATOM 3778 C CA . LEU C 1 67 ? 25.558 8.675 -17.054 1.00 24.43 ? 67 LEU H CA 1 ATOM 3779 C C . LEU C 1 67 ? 24.428 8.080 -17.879 1.00 25.45 ? 67 LEU H C 1 ATOM 3780 O O . LEU C 1 67 ? 23.546 8.812 -18.336 1.00 26.08 ? 67 LEU H O 1 ATOM 3781 C CB . LEU C 1 67 ? 25.027 9.087 -15.673 1.00 23.23 ? 67 LEU H CB 1 ATOM 3782 C CG . LEU C 1 67 ? 24.805 8.011 -14.600 1.00 22.18 ? 67 LEU H CG 1 ATOM 3783 C CD1 . LEU C 1 67 ? 23.360 7.701 -14.345 1.00 22.37 ? 67 LEU H CD1 1 ATOM 3784 C CD2 . LEU C 1 67 ? 25.537 6.715 -14.897 1.00 22.48 ? 67 LEU H CD2 1 ATOM 3785 N N . SER C 1 68 ? 24.467 6.762 -18.081 1.00 25.79 ? 68 SER H N 1 ATOM 3786 C CA . SER C 1 68 ? 23.324 6.036 -18.617 1.00 27.09 ? 68 SER H CA 1 ATOM 3787 C C . SER C 1 68 ? 23.090 4.749 -17.835 1.00 26.02 ? 68 SER H C 1 ATOM 3788 O O . SER C 1 68 ? 24.029 3.963 -17.572 1.00 25.42 ? 68 SER H O 1 ATOM 3789 C CB . SER C 1 68 ? 23.505 5.677 -20.090 1.00 30.03 ? 68 SER H CB 1 ATOM 3790 O OG . SER C 1 68 ? 24.249 4.467 -20.194 1.00 31.48 ? 68 SER H OG 1 ATOM 3791 N N . ILE C 1 69 ? 21.815 4.520 -17.528 1.00 25.86 ? 69 ILE H N 1 ATOM 3792 C CA . ILE C 1 69 ? 21.368 3.304 -16.888 1.00 25.65 ? 69 ILE H CA 1 ATOM 3793 C C . ILE C 1 69 ? 20.527 2.553 -17.908 1.00 27.50 ? 69 ILE H C 1 ATOM 3794 O O . ILE C 1 69 ? 19.794 3.176 -18.643 1.00 28.32 ? 69 ILE H O 1 ATOM 3795 C CB . ILE C 1 69 ? 20.530 3.627 -15.640 1.00 24.37 ? 69 ILE H CB 1 ATOM 3796 C CG1 . ILE C 1 69 ? 21.372 4.414 -14.636 1.00 22.86 ? 69 ILE H CG1 1 ATOM 3797 C CG2 . ILE C 1 69 ? 20.022 2.349 -14.986 1.00 24.67 ? 69 ILE H CG2 1 ATOM 3798 C CD1 . ILE C 1 69 ? 20.564 5.243 -13.665 1.00 22.18 ? 69 ILE H CD1 1 ATOM 3799 N N . SER C 1 70 ? 20.653 1.230 -17.961 1.00 28.54 ? 70 SER H N 1 ATOM 3800 C CA . SER C 1 70 ? 19.816 0.402 -18.843 1.00 31.19 ? 70 SER H CA 1 ATOM 3801 C C . SER C 1 70 ? 19.604 -0.958 -18.227 1.00 32.00 ? 70 SER H C 1 ATOM 3802 O O . SER C 1 70 ? 20.044 -1.185 -17.111 1.00 30.37 ? 70 SER H O 1 ATOM 3803 C CB . SER C 1 70 ? 20.440 0.278 -20.233 1.00 33.38 ? 70 SER H CB 1 ATOM 3804 O OG . SER C 1 70 ? 21.708 -0.346 -20.187 1.00 33.57 ? 70 SER H OG 1 ATOM 3805 N N . LYS C 1 71 ? 18.948 -1.874 -18.931 1.00 35.21 ? 71 LYS H N 1 ATOM 3806 C CA . LYS C 1 71 ? 18.676 -3.180 -18.320 1.00 36.79 ? 71 LYS H CA 1 ATOM 3807 C C . LYS C 1 71 ? 18.253 -4.283 -19.260 1.00 40.99 ? 71 LYS H C 1 ATOM 3808 O O . LYS C 1 71 ? 17.843 -4.011 -20.379 1.00 43.44 ? 71 LYS H O 1 ATOM 3809 C CB . LYS C 1 71 ? 17.577 -3.034 -17.278 1.00 35.63 ? 71 LYS H CB 1 ATOM 3810 C CG . LYS C 1 71 ? 16.252 -2.575 -17.862 1.00 36.72 ? 71 LYS H CG 1 ATOM 3811 C CD . LYS C 1 71 ? 15.143 -2.750 -16.845 1.00 36.49 ? 71 LYS H CD 1 ATOM 3812 C CE . LYS C 1 71 ? 13.837 -2.154 -17.332 1.00 37.60 ? 71 LYS H CE 1 ATOM 3813 N NZ . LYS C 1 71 ? 12.699 -2.524 -16.454 1.00 38.13 ? 71 LYS H NZ 1 ATOM 3814 N N . ASP C 1 72 ? 18.302 -5.522 -18.762 1.00 42.85 ? 72 ASP H N 1 ATOM 3815 C CA . ASP C 1 72 ? 17.837 -6.706 -19.487 1.00 47.41 ? 72 ASP H CA 1 ATOM 3816 C C . ASP C 1 72 ? 16.869 -7.433 -18.569 1.00 48.41 ? 72 ASP H C 1 ATOM 3817 O O . ASP C 1 72 ? 17.291 -8.149 -17.657 1.00 48.32 ? 72 ASP H O 1 ATOM 3818 C CB . ASP C 1 72 ? 19.012 -7.599 -19.878 1.00 49.52 ? 72 ASP H CB 1 ATOM 3819 C CG . ASP C 1 72 ? 18.579 -8.916 -20.531 1.00 54.66 ? 72 ASP H CG 1 ATOM 3820 O OD1 . ASP C 1 72 ? 17.373 -9.292 -20.506 1.00 56.51 ? 72 ASP H OD1 1 ATOM 3821 O OD2 . ASP C 1 72 ? 19.484 -9.582 -21.073 1.00 56.93 ? 72 ASP H OD2 1 ATOM 3822 N N . ASN C 1 73 ? 15.574 -7.239 -18.810 1.00 49.70 ? 73 ASN H N 1 ATOM 3823 C CA . ASN C 1 73 ? 14.542 -7.822 -17.967 1.00 50.77 ? 73 ASN H CA 1 ATOM 3824 C C . ASN C 1 73 ? 14.715 -9.323 -17.809 1.00 54.12 ? 73 ASN H C 1 ATOM 3825 O O . ASN C 1 73 ? 14.693 -9.819 -16.691 1.00 53.73 ? 73 ASN H O 1 ATOM 3826 C CB . ASN C 1 73 ? 13.160 -7.488 -18.534 1.00 52.54 ? 73 ASN H CB 1 ATOM 3827 C CG . ASN C 1 73 ? 12.704 -6.080 -18.185 1.00 49.55 ? 73 ASN H CG 1 ATOM 3828 O OD1 . ASN C 1 73 ? 13.094 -5.492 -17.170 1.00 46.24 ? 73 ASN H OD1 1 ATOM 3829 N ND2 . ASN C 1 73 ? 11.853 -5.537 -19.027 1.00 51.15 ? 73 ASN H ND2 1 ATOM 3830 N N . SER C 1 74 ? 14.919 -10.036 -18.912 1.00 57.82 ? 74 SER H N 1 ATOM 3831 C CA . SER C 1 74 ? 14.940 -11.504 -18.860 1.00 62.26 ? 74 SER H CA 1 ATOM 3832 C C . SER C 1 74 ? 16.079 -12.041 -17.991 1.00 61.27 ? 74 SER H C 1 ATOM 3833 O O . SER C 1 74 ? 15.898 -13.037 -17.285 1.00 63.88 ? 74 SER H O 1 ATOM 3834 C CB . SER C 1 74 ? 15.002 -12.112 -20.264 1.00 66.86 ? 74 SER H CB 1 ATOM 3835 O OG . SER C 1 74 ? 16.276 -11.915 -20.849 1.00 66.29 ? 74 SER H OG 1 ATOM 3836 N N . LYS C 1 75 ? 17.232 -11.376 -18.023 1.00 57.83 ? 75 LYS H N 1 ATOM 3837 C CA . LYS C 1 75 ? 18.373 -11.784 -17.183 1.00 56.63 ? 75 LYS H CA 1 ATOM 3838 C C . LYS C 1 75 ? 18.369 -11.172 -15.789 1.00 52.35 ? 75 LYS H C 1 ATOM 3839 O O . LYS C 1 75 ? 19.248 -11.462 -14.980 1.00 51.22 ? 75 LYS H O 1 ATOM 3840 C CB . LYS C 1 75 ? 19.721 -11.453 -17.838 1.00 55.87 ? 75 LYS H CB 1 ATOM 3841 C CG . LYS C 1 75 ? 20.238 -12.512 -18.815 1.00 60.70 ? 75 LYS H CG 1 ATOM 3842 C CD . LYS C 1 75 ? 21.721 -12.791 -18.590 1.00 60.57 ? 75 LYS H CD 1 ATOM 3843 C CE . LYS C 1 75 ? 22.330 -13.644 -19.689 1.00 65.22 ? 75 LYS H CE 1 ATOM 3844 N NZ . LYS C 1 75 ? 21.573 -14.906 -19.934 1.00 70.61 ? 75 LYS H NZ 1 ATOM 3845 N N . SER C 1 76 ? 17.377 -10.332 -15.518 1.00 50.13 ? 76 SER H N 1 ATOM 3846 C CA . SER C 1 76 ? 17.285 -9.589 -14.276 1.00 46.54 ? 76 SER H CA 1 ATOM 3847 C C . SER C 1 76 ? 18.527 -8.755 -13.990 1.00 42.71 ? 76 SER H C 1 ATOM 3848 O O . SER C 1 76 ? 19.033 -8.739 -12.872 1.00 41.12 ? 76 SER H O 1 ATOM 3849 C CB . SER C 1 76 ? 16.941 -10.491 -13.110 1.00 48.43 ? 76 SER H CB 1 ATOM 3850 O OG . SER C 1 76 ? 18.040 -11.302 -12.736 1.00 49.84 ? 76 SER H OG 1 ATOM 3851 N N . HIS C 1 77 ? 18.992 -8.069 -15.030 1.00 41.50 ? 77 HIS H N 1 ATOM 3852 C CA . HIS C 1 77 ? 20.222 -7.279 -14.996 1.00 38.76 ? 77 HIS H CA 1 ATOM 3853 C C . HIS C 1 77 ? 19.927 -5.805 -15.199 1.00 35.79 ? 77 HIS H C 1 ATOM 3854 O O . HIS C 1 77 ? 19.174 -5.446 -16.095 1.00 36.64 ? 77 HIS H O 1 ATOM 3855 C CB . HIS C 1 77 ? 21.194 -7.728 -16.094 1.00 40.69 ? 77 HIS H CB 1 ATOM 3856 C CG . HIS C 1 77 ? 21.950 -8.984 -15.766 1.00 43.09 ? 77 HIS H CG 1 ATOM 3857 N ND1 . HIS C 1 77 ? 22.609 -9.738 -16.716 1.00 46.22 ? 77 HIS H ND1 1 ATOM 3858 C CD2 . HIS C 1 77 ? 22.178 -9.598 -14.582 1.00 43.29 ? 77 HIS H CD2 1 ATOM 3859 C CE1 . HIS C 1 77 ? 23.210 -10.759 -16.130 1.00 48.19 ? 77 HIS H CE1 1 ATOM 3860 N NE2 . HIS C 1 77 ? 22.966 -10.695 -14.834 1.00 46.47 ? 77 HIS H NE2 1 ATOM 3861 N N . VAL C 1 78 ? 20.524 -4.962 -14.365 1.00 32.80 ? 78 VAL H N 1 ATOM 3862 C CA . VAL C 1 78 ? 20.504 -3.511 -14.570 1.00 30.39 ? 78 VAL H CA 1 ATOM 3863 C C . VAL C 1 78 ? 21.932 -2.971 -14.705 1.00 29.14 ? 78 VAL H C 1 ATOM 3864 O O . VAL C 1 78 ? 22.780 -3.197 -13.841 1.00 28.41 ? 78 VAL H O 1 ATOM 3865 C CB . VAL C 1 78 ? 19.838 -2.774 -13.406 1.00 28.34 ? 78 VAL H CB 1 ATOM 3866 C CG1 . VAL C 1 78 ? 19.750 -1.284 -13.703 1.00 26.27 ? 78 VAL H CG1 1 ATOM 3867 C CG2 . VAL C 1 78 ? 18.459 -3.368 -13.127 1.00 29.96 ? 78 VAL H CG2 1 ATOM 3868 N N . PHE C 1 79 ? 22.156 -2.208 -15.768 1.00 29.09 ? 79 PHE H N 1 ATOM 3869 C CA . PHE C 1 79 ? 23.475 -1.760 -16.152 1.00 28.51 ? 79 PHE H CA 1 ATOM 3870 C C . PHE C 1 79 ? 23.635 -0.278 -15.837 1.00 26.47 ? 79 PHE H C 1 ATOM 3871 O O . PHE C 1 79 ? 22.879 0.580 -16.330 1.00 26.54 ? 79 PHE H O 1 ATOM 3872 C CB . PHE C 1 79 ? 23.696 -2.018 -17.637 1.00 30.93 ? 79 PHE H CB 1 ATOM 3873 C CG . PHE C 1 79 ? 23.490 -3.444 -18.028 1.00 33.77 ? 79 PHE H CG 1 ATOM 3874 C CD1 . PHE C 1 79 ? 24.252 -4.437 -17.441 1.00 34.44 ? 79 PHE H CD1 1 ATOM 3875 C CD2 . PHE C 1 79 ? 22.544 -3.804 -18.978 1.00 36.17 ? 79 PHE H CD2 1 ATOM 3876 C CE1 . PHE C 1 79 ? 24.079 -5.764 -17.786 1.00 37.65 ? 79 PHE H CE1 1 ATOM 3877 C CE2 . PHE C 1 79 ? 22.372 -5.139 -19.331 1.00 39.37 ? 79 PHE H CE2 1 ATOM 3878 C CZ . PHE C 1 79 ? 23.141 -6.116 -18.730 1.00 40.09 ? 79 PHE H CZ 1 ATOM 3879 N N . PHE C 1 80 ? 24.593 0.004 -14.964 1.00 25.12 ? 80 PHE H N 1 ATOM 3880 C CA . PHE C 1 80 ? 25.014 1.359 -14.648 1.00 23.77 ? 80 PHE H CA 1 ATOM 3881 C C . PHE C 1 80 ? 26.316 1.664 -15.399 1.00 24.67 ? 80 PHE H C 1 ATOM 3882 O O . PHE C 1 80 ? 27.239 0.872 -15.427 1.00 25.39 ? 80 PHE H O 1 ATOM 3883 C CB . PHE C 1 80 ? 25.228 1.475 -13.143 1.00 22.45 ? 80 PHE H CB 1 ATOM 3884 C CG . PHE C 1 80 ? 25.812 2.777 -12.698 1.00 21.41 ? 80 PHE H CG 1 ATOM 3885 C CD1 . PHE C 1 80 ? 27.172 3.018 -12.792 1.00 21.66 ? 80 PHE H CD1 1 ATOM 3886 C CD2 . PHE C 1 80 ? 25.004 3.756 -12.147 1.00 20.80 ? 80 PHE H CD2 1 ATOM 3887 C CE1 . PHE C 1 80 ? 27.715 4.224 -12.351 1.00 21.11 ? 80 PHE H CE1 1 ATOM 3888 C CE2 . PHE C 1 80 ? 25.537 4.950 -11.698 1.00 20.31 ? 80 PHE H CE2 1 ATOM 3889 C CZ . PHE C 1 80 ? 26.899 5.181 -11.783 1.00 20.32 ? 80 PHE H CZ 1 ATOM 3890 N N . LYS C 1 81 ? 26.394 2.832 -16.002 1.00 25.04 ? 81 LYS H N 1 ATOM 3891 C CA . LYS C 1 81 ? 27.559 3.192 -16.796 1.00 26.48 ? 81 LYS H CA 1 ATOM 3892 C C . LYS C 1 81 ? 27.815 4.706 -16.780 1.00 25.80 ? 81 LYS H C 1 ATOM 3893 O O . LYS C 1 81 ? 26.984 5.481 -17.245 1.00 25.81 ? 81 LYS H O 1 ATOM 3894 C CB . LYS C 1 81 ? 27.403 2.673 -18.230 1.00 29.28 ? 81 LYS H CB 1 ATOM 3895 C CG . LYS C 1 81 ? 28.219 3.448 -19.261 1.00 31.43 ? 81 LYS H CG 1 ATOM 3896 C CD . LYS C 1 81 ? 28.539 2.647 -20.533 1.00 34.55 ? 81 LYS H CD 1 ATOM 3897 C CE . LYS C 1 81 ? 29.905 1.978 -20.455 1.00 35.75 ? 81 LYS H CE 1 ATOM 3898 N NZ . LYS C 1 81 ? 30.388 1.512 -21.800 1.00 39.83 ? 81 LYS H NZ 1 ATOM 3899 N N . MET C 1 82 ? 28.981 5.102 -16.266 1.00 25.26 ? 82 MET H N 1 ATOM 3900 C CA . MET C 1 82 ? 29.337 6.498 -16.139 1.00 24.98 ? 82 MET H CA 1 ATOM 3901 C C . MET C 1 82 ? 30.663 6.765 -16.837 1.00 26.51 ? 82 MET H C 1 ATOM 3902 O O . MET C 1 82 ? 31.592 5.983 -16.725 1.00 26.50 ? 82 MET H O 1 ATOM 3903 C CB . MET C 1 82 ? 29.419 6.860 -14.652 1.00 23.80 ? 82 MET H CB 1 ATOM 3904 C CG . MET C 1 82 ? 29.475 8.355 -14.370 1.00 24.03 ? 82 MET H CG 1 ATOM 3905 S SD . MET C 1 82 ? 29.021 8.735 -12.673 1.00 23.25 ? 82 MET H SD 1 ATOM 3906 C CE . MET C 1 82 ? 30.601 8.560 -11.835 1.00 23.00 ? 82 MET H CE 1 ATOM 3907 N N . ASN C 1 83 A 30.757 7.896 -17.531 1.00 28.07 ? 82 ASN H N 1 ATOM 3908 C CA . ASN C 1 83 A 31.965 8.288 -18.235 1.00 30.42 ? 82 ASN H CA 1 ATOM 3909 C C . ASN C 1 83 A 32.772 9.304 -17.423 1.00 30.36 ? 82 ASN H C 1 ATOM 3910 O O . ASN C 1 83 A 32.252 9.912 -16.489 1.00 29.46 ? 82 ASN H O 1 ATOM 3911 C CB . ASN C 1 83 A 31.632 8.917 -19.578 1.00 32.86 ? 82 ASN H CB 1 ATOM 3912 C CG . ASN C 1 83 A 31.025 7.926 -20.546 1.00 34.52 ? 82 ASN H CG 1 ATOM 3913 O OD1 . ASN C 1 83 A 31.213 6.713 -20.413 1.00 34.90 ? 82 ASN H OD1 1 ATOM 3914 N ND2 . ASN C 1 83 A 30.270 8.433 -21.516 1.00 36.44 ? 82 ASN H ND2 1 ATOM 3915 N N . SER C 1 84 B 34.035 9.459 -17.792 1.00 31.80 ? 82 SER H N 1 ATOM 3916 C CA . SER C 1 84 B 34.939 10.526 -17.314 1.00 32.89 ? 82 SER H CA 1 ATOM 3917 C C . SER C 1 84 B 35.063 10.687 -15.806 1.00 30.86 ? 82 SER H C 1 ATOM 3918 O O . SER C 1 84 B 34.873 11.778 -15.280 1.00 31.26 ? 82 SER H O 1 ATOM 3919 C CB . SER C 1 84 B 34.548 11.883 -17.928 1.00 34.91 ? 82 SER H CB 1 ATOM 3920 O OG . SER C 1 84 B 34.098 11.736 -19.256 1.00 37.08 ? 82 SER H OG 1 ATOM 3921 N N . LEU C 1 85 C 35.414 9.609 -15.122 1.00 29.23 ? 82 LEU H N 1 ATOM 3922 C CA . LEU C 1 85 C 35.509 9.642 -13.667 1.00 27.79 ? 82 LEU H CA 1 ATOM 3923 C C . LEU C 1 85 C 36.742 10.397 -13.256 1.00 29.26 ? 82 LEU H C 1 ATOM 3924 O O . LEU C 1 85 C 37.760 10.365 -13.949 1.00 31.10 ? 82 LEU H O 1 ATOM 3925 C CB . LEU C 1 85 C 35.503 8.238 -13.076 1.00 26.43 ? 82 LEU H CB 1 ATOM 3926 C CG . LEU C 1 85 C 34.092 7.665 -12.882 1.00 24.60 ? 82 LEU H CG 1 ATOM 3927 C CD1 . LEU C 1 85 C 33.506 7.216 -14.207 1.00 25.05 ? 82 LEU H CD1 1 ATOM 3928 C CD2 . LEU C 1 85 C 34.108 6.498 -11.918 1.00 23.87 ? 82 LEU H CD2 1 ATOM 3929 N N . GLN C 1 86 ? 36.640 11.113 -12.148 1.00 29.16 ? 83 GLN H N 1 ATOM 3930 C CA . GLN C 1 86 ? 37.779 11.836 -11.603 1.00 31.14 ? 83 GLN H CA 1 ATOM 3931 C C . GLN C 1 86 ? 37.882 11.493 -10.127 1.00 30.38 ? 83 GLN H C 1 ATOM 3932 O O . GLN C 1 86 ? 37.084 10.716 -9.616 1.00 28.33 ? 83 GLN H O 1 ATOM 3933 C CB . GLN C 1 86 ? 37.617 13.346 -11.850 1.00 32.94 ? 83 GLN H CB 1 ATOM 3934 C CG . GLN C 1 86 ? 37.385 13.719 -13.313 1.00 34.32 ? 83 GLN H CG 1 ATOM 3935 C CD . GLN C 1 86 ? 38.585 13.439 -14.216 1.00 36.54 ? 83 GLN H CD 1 ATOM 3936 O OE1 . GLN C 1 86 ? 39.708 13.208 -13.750 1.00 37.74 ? 83 GLN H OE1 1 ATOM 3937 N NE2 . GLN C 1 86 ? 38.350 13.461 -15.522 1.00 37.69 ? 83 GLN H NE2 1 ATOM 3938 N N . ALA C 1 87 ? 38.888 12.042 -9.466 1.00 32.45 ? 84 ALA H N 1 ATOM 3939 C CA . ALA C 1 87 ? 39.161 11.730 -8.068 1.00 33.45 ? 84 ALA H CA 1 ATOM 3940 C C . ALA C 1 87 ? 37.900 11.801 -7.198 1.00 32.74 ? 84 ALA H C 1 ATOM 3941 O O . ALA C 1 87 ? 37.606 10.861 -6.463 1.00 31.56 ? 84 ALA H O 1 ATOM 3942 C CB . ALA C 1 87 ? 40.253 12.640 -7.515 1.00 35.95 ? 84 ALA H CB 1 ATOM 3943 N N . ASN C 1 88 ? 37.148 12.893 -7.310 1.00 34.20 ? 85 ASN H N 1 ATOM 3944 C CA . ASN C 1 88 ? 35.959 13.072 -6.490 1.00 34.27 ? 85 ASN H CA 1 ATOM 3945 C C . ASN C 1 88 ? 34.732 12.204 -6.888 1.00 29.83 ? 85 ASN H C 1 ATOM 3946 O O . ASN C 1 88 ? 33.674 12.318 -6.277 1.00 28.66 ? 85 ASN H O 1 ATOM 3947 C CB . ASN C 1 88 ? 35.580 14.554 -6.387 1.00 38.95 ? 85 ASN H CB 1 ATOM 3948 C CG . ASN C 1 88 ? 35.021 15.109 -7.679 1.00 43.02 ? 85 ASN H CG 1 ATOM 3949 O OD1 . ASN C 1 88 ? 34.921 14.414 -8.695 1.00 41.50 ? 85 ASN H OD1 1 ATOM 3950 N ND2 . ASN C 1 88 ? 34.659 16.390 -7.644 1.00 51.52 ? 85 ASN H ND2 1 ATOM 3951 N N . ASP C 1 89 ? 34.882 11.341 -7.892 1.00 27.23 ? 86 ASP H N 1 ATOM 3952 C CA . ASP C 1 89 ? 33.889 10.279 -8.175 1.00 24.43 ? 86 ASP H CA 1 ATOM 3953 C C . ASP C 1 89 ? 34.173 9.004 -7.355 1.00 23.15 ? 86 ASP H C 1 ATOM 3954 O O . ASP C 1 89 ? 33.442 8.042 -7.402 1.00 21.59 ? 86 ASP H O 1 ATOM 3955 C CB . ASP C 1 89 ? 33.827 9.965 -9.675 1.00 24.04 ? 86 ASP H CB 1 ATOM 3956 C CG . ASP C 1 89 ? 33.124 11.075 -10.478 1.00 24.43 ? 86 ASP H CG 1 ATOM 3957 O OD1 . ASP C 1 89 ? 31.937 11.374 -10.190 1.00 24.09 ? 86 ASP H OD1 1 ATOM 3958 O OD2 . ASP C 1 89 ? 33.714 11.640 -11.407 1.00 25.49 ? 86 ASP H OD2 1 ATOM 3959 N N . THR C 1 90 ? 35.231 9.022 -6.566 1.00 24.04 ? 87 THR H N 1 ATOM 3960 C CA . THR C 1 90 ? 35.514 7.935 -5.649 1.00 23.86 ? 87 THR H CA 1 ATOM 3961 C C . THR C 1 90 ? 34.356 7.840 -4.680 1.00 23.34 ? 87 THR H C 1 ATOM 3962 O O . THR C 1 90 ? 33.972 8.850 -4.101 1.00 23.88 ? 87 THR H O 1 ATOM 3963 C CB . THR C 1 90 ? 36.842 8.161 -4.918 1.00 25.65 ? 87 THR H CB 1 ATOM 3964 O OG1 . THR C 1 90 ? 37.917 8.035 -5.866 1.00 26.03 ? 87 THR H OG1 1 ATOM 3965 C CG2 . THR C 1 90 ? 37.014 7.166 -3.733 1.00 26.29 ? 87 THR H CG2 1 ATOM 3966 N N . ALA C 1 91 ? 33.777 6.642 -4.561 1.00 22.71 ? 88 ALA H N 1 ATOM 3967 C CA . ALA C 1 91 ? 32.596 6.401 -3.754 1.00 22.49 ? 88 ALA H CA 1 ATOM 3968 C C . ALA C 1 91 ? 32.196 4.926 -3.758 1.00 22.46 ? 88 ALA H C 1 ATOM 3969 O O . ALA C 1 91 ? 32.672 4.124 -4.569 1.00 22.77 ? 88 ALA H O 1 ATOM 3970 C CB . ALA C 1 91 ? 31.422 7.214 -4.276 1.00 21.50 ? 88 ALA H CB 1 ATOM 3971 N N . ILE C 1 92 ? 31.297 4.584 -2.843 1.00 22.59 ? 89 ILE H N 1 ATOM 3972 C CA . ILE C 1 92 ? 30.614 3.314 -2.899 1.00 22.28 ? 89 ILE H CA 1 ATOM 3973 C C . ILE C 1 92 ? 29.347 3.521 -3.711 1.00 20.92 ? 89 ILE H C 1 ATOM 3974 O O . ILE C 1 92 ? 28.568 4.441 -3.434 1.00 20.46 ? 89 ILE H O 1 ATOM 3975 C CB . ILE C 1 92 ? 30.244 2.787 -1.506 1.00 23.57 ? 89 ILE H CB 1 ATOM 3976 C CG1 . ILE C 1 92 ? 31.498 2.655 -0.634 1.00 25.29 ? 89 ILE H CG1 1 ATOM 3977 C CG2 . ILE C 1 92 ? 29.536 1.444 -1.638 1.00 23.81 ? 89 ILE H CG2 1 ATOM 3978 C CD1 . ILE C 1 92 ? 31.211 2.445 0.834 1.00 27.20 ? 89 ILE H CD1 1 ATOM 3979 N N . TYR C 1 93 ? 29.153 2.665 -4.708 1.00 20.49 ? 90 TYR H N 1 ATOM 3980 C CA . TYR C 1 93 ? 28.004 2.751 -5.594 1.00 19.79 ? 90 TYR H CA 1 ATOM 3981 C C . TYR C 1 93 ? 27.022 1.627 -5.294 1.00 20.77 ? 90 TYR H C 1 ATOM 3982 O O . TYR C 1 93 ? 27.421 0.473 -5.125 1.00 22.01 ? 90 TYR H O 1 ATOM 3983 C CB . TYR C 1 93 ? 28.464 2.700 -7.068 1.00 19.32 ? 90 TYR H CB 1 ATOM 3984 C CG . TYR C 1 93 ? 29.167 3.957 -7.509 1.00 18.74 ? 90 TYR H CG 1 ATOM 3985 C CD1 . TYR C 1 93 ? 30.465 4.234 -7.093 1.00 19.39 ? 90 TYR H CD1 1 ATOM 3986 C CD2 . TYR C 1 93 ? 28.518 4.898 -8.295 1.00 18.21 ? 90 TYR H CD2 1 ATOM 3987 C CE1 . TYR C 1 93 ? 31.109 5.406 -7.472 1.00 19.41 ? 90 TYR H CE1 1 ATOM 3988 C CE2 . TYR C 1 93 ? 29.140 6.082 -8.671 1.00 18.28 ? 90 TYR H CE2 1 ATOM 3989 C CZ . TYR C 1 93 ? 30.437 6.341 -8.257 1.00 18.87 ? 90 TYR H CZ 1 ATOM 3990 O OH . TYR C 1 93 ? 31.055 7.506 -8.625 1.00 18.95 ? 90 TYR H OH 1 ATOM 3991 N N . TYR C 1 94 ? 25.739 1.978 -5.194 1.00 20.70 ? 91 TYR H N 1 ATOM 3992 C CA . TYR C 1 94 ? 24.682 1.016 -4.907 1.00 21.56 ? 91 TYR H CA 1 ATOM 3993 C C . TYR C 1 94 ? 23.564 1.075 -5.935 1.00 21.46 ? 91 TYR H C 1 ATOM 3994 O O . TYR C 1 94 ? 23.097 2.176 -6.297 1.00 20.30 ? 91 TYR H O 1 ATOM 3995 C CB . TYR C 1 94 ? 24.008 1.306 -3.563 1.00 22.25 ? 91 TYR H CB 1 ATOM 3996 C CG . TYR C 1 94 ? 24.876 1.391 -2.331 1.00 22.90 ? 91 TYR H CG 1 ATOM 3997 C CD1 . TYR C 1 94 ? 25.393 2.615 -1.928 1.00 22.62 ? 91 TYR H CD1 1 ATOM 3998 C CD2 . TYR C 1 94 ? 25.095 0.283 -1.516 1.00 24.55 ? 91 TYR H CD2 1 ATOM 3999 C CE1 . TYR C 1 94 ? 26.150 2.728 -0.771 1.00 23.95 ? 91 TYR H CE1 1 ATOM 4000 C CE2 . TYR C 1 94 ? 25.860 0.381 -0.358 1.00 25.79 ? 91 TYR H CE2 1 ATOM 4001 C CZ . TYR C 1 94 ? 26.386 1.606 0.002 1.00 25.48 ? 91 TYR H CZ 1 ATOM 4002 O OH . TYR C 1 94 ? 27.154 1.731 1.136 1.00 27.72 ? 91 TYR H OH 1 ATOM 4003 N N . CYS C 1 95 ? 23.108 -0.107 -6.373 1.00 22.75 ? 92 CYS H N 1 ATOM 4004 C CA . CYS C 1 95 ? 21.780 -0.209 -6.955 1.00 23.15 ? 92 CYS H CA 1 ATOM 4005 C C . CYS C 1 95 ? 20.841 -0.460 -5.785 1.00 23.41 ? 92 CYS H C 1 ATOM 4006 O O . CYS C 1 95 ? 21.262 -1.002 -4.764 1.00 24.18 ? 92 CYS H O 1 ATOM 4007 C CB . CYS C 1 95 ? 21.683 -1.302 -8.033 1.00 25.32 ? 92 CYS H CB 1 ATOM 4008 S SG . CYS C 1 95 ? 21.926 -2.998 -7.459 1.00 29.09 ? 92 CYS H SG 1 ATOM 4009 N N . ALA C 1 96 ? 19.594 -0.003 -5.901 1.00 22.74 ? 93 ALA H N 1 ATOM 4010 C CA . ALA C 1 96 ? 18.642 -0.111 -4.804 1.00 23.50 ? 93 ALA H CA 1 ATOM 4011 C C . ALA C 1 96 ? 17.179 0.071 -5.200 1.00 23.81 ? 93 ALA H C 1 ATOM 4012 O O . ALA C 1 96 ? 16.851 0.828 -6.106 1.00 22.62 ? 93 ALA H O 1 ATOM 4013 C CB . ALA C 1 96 ? 18.982 0.901 -3.714 1.00 23.07 ? 93 ALA H CB 1 ATOM 4014 N N . ARG C 1 97 ? 16.316 -0.649 -4.491 1.00 25.57 ? 94 ARG H N 1 ATOM 4015 C CA . ARG C 1 97 ? 14.894 -0.373 -4.480 1.00 26.44 ? 94 ARG H CA 1 ATOM 4016 C C . ARG C 1 97 ? 14.644 0.783 -3.520 1.00 26.00 ? 94 ARG H C 1 ATOM 4017 O O . ARG C 1 97 ? 15.110 0.769 -2.374 1.00 26.42 ? 94 ARG H O 1 ATOM 4018 C CB . ARG C 1 97 ? 14.116 -1.619 -4.044 1.00 29.30 ? 94 ARG H CB 1 ATOM 4019 C CG . ARG C 1 97 ? 14.046 -2.692 -5.135 1.00 30.68 ? 94 ARG H CG 1 ATOM 4020 C CD . ARG C 1 97 ? 12.646 -3.036 -5.609 1.00 32.93 ? 94 ARG H CD 1 ATOM 4021 N NE . ARG C 1 97 ? 11.729 -1.912 -5.470 1.00 32.77 ? 94 ARG H NE 1 ATOM 4022 C CZ . ARG C 1 97 ? 10.593 -1.897 -4.782 1.00 34.65 ? 94 ARG H CZ 1 ATOM 4023 N NH1 . ARG C 1 97 ? 9.897 -0.772 -4.757 1.00 34.68 ? 94 ARG H NH1 1 ATOM 4024 N NH2 . ARG C 1 97 ? 10.130 -2.968 -4.141 1.00 37.15 ? 94 ARG H NH2 1 ATOM 4025 N N . MET C 1 98 ? 13.943 1.796 -4.013 1.00 25.46 ? 95 MET H N 1 ATOM 4026 C CA . MET C 1 98 ? 13.560 2.954 -3.230 1.00 25.77 ? 95 MET H CA 1 ATOM 4027 C C . MET C 1 98 ? 12.122 3.321 -3.580 1.00 26.85 ? 95 MET H C 1 ATOM 4028 O O . MET C 1 98 ? 11.495 2.668 -4.419 1.00 27.11 ? 95 MET H O 1 ATOM 4029 C CB . MET C 1 98 ? 14.515 4.127 -3.522 1.00 24.28 ? 95 MET H CB 1 ATOM 4030 C CG . MET C 1 98 ? 16.000 3.771 -3.420 1.00 23.25 ? 95 MET H CG 1 ATOM 4031 S SD . MET C 1 98 ? 17.061 5.235 -3.529 1.00 22.25 ? 95 MET H SD 1 ATOM 4032 C CE . MET C 1 98 ? 16.772 5.912 -1.894 1.00 23.66 ? 95 MET H CE 1 ATOM 4033 N N . ARG C 1 99 ? 11.605 4.370 -2.934 1.00 27.73 ? 96 ARG H N 1 ATOM 4034 C CA . ARG C 1 99 ? 10.199 4.783 -3.107 1.00 29.20 ? 96 ARG H CA 1 ATOM 4035 C C . ARG C 1 99 ? 9.309 3.627 -2.751 1.00 30.96 ? 96 ARG H C 1 ATOM 4036 O O . ARG C 1 99 ? 8.502 3.187 -3.566 1.00 31.95 ? 96 ARG H O 1 ATOM 4037 C CB . ARG C 1 99 ? 9.891 5.257 -4.541 1.00 28.60 ? 96 ARG H CB 1 ATOM 4038 C CG . ARG C 1 99 ? 10.799 6.362 -5.051 1.00 27.33 ? 96 ARG H CG 1 ATOM 4039 C CD . ARG C 1 99 ? 10.052 7.324 -5.963 1.00 28.25 ? 96 ARG H CD 1 ATOM 4040 N NE . ARG C 1 99 ? 9.074 6.625 -6.776 1.00 29.58 ? 96 ARG H NE 1 ATOM 4041 C CZ . ARG C 1 99 ? 8.041 7.187 -7.382 1.00 31.02 ? 96 ARG H CZ 1 ATOM 4042 N NH1 . ARG C 1 99 ? 7.819 8.484 -7.310 1.00 32.11 ? 96 ARG H NH1 1 ATOM 4043 N NH2 . ARG C 1 99 ? 7.225 6.434 -8.075 1.00 32.48 ? 96 ARG H NH2 1 ATOM 4044 N N . ILE C 1 100 ? 9.434 3.127 -1.530 1.00 32.00 ? 97 ILE H N 1 ATOM 4045 C CA . ILE C 1 100 ? 8.847 1.834 -1.268 1.00 33.85 ? 97 ILE H CA 1 ATOM 4046 C C . ILE C 1 100 ? 7.458 1.951 -0.618 1.00 36.48 ? 97 ILE H C 1 ATOM 4047 O O . ILE C 1 100 ? 7.120 2.928 0.074 1.00 36.93 ? 97 ILE H O 1 ATOM 4048 C CB . ILE C 1 100 ? 9.812 0.874 -0.530 1.00 34.01 ? 97 ILE H CB 1 ATOM 4049 C CG1 . ILE C 1 100 ? 9.717 1.035 0.956 1.00 35.80 ? 97 ILE H CG1 1 ATOM 4050 C CG2 . ILE C 1 100 ? 11.254 1.028 -0.979 1.00 31.50 ? 97 ILE H CG2 1 ATOM 4051 C CD1 . ILE C 1 100 ? 8.828 -0.005 1.573 1.00 38.95 ? 97 ILE H CD1 1 ATOM 4052 N N . THR C 1 101 ? 6.662 0.926 -0.896 1.00 38.35 ? 98 THR H N 1 ATOM 4053 C CA . THR C 1 101 ? 5.244 0.911 -0.577 1.00 41.02 ? 98 THR H CA 1 ATOM 4054 C C . THR C 1 101 ? 4.875 -0.210 0.368 1.00 43.76 ? 98 THR H C 1 ATOM 4055 O O . THR C 1 101 ? 3.826 -0.146 0.998 1.00 46.55 ? 98 THR H O 1 ATOM 4056 C CB . THR C 1 101 ? 4.450 0.766 -1.876 1.00 41.39 ? 98 THR H CB 1 ATOM 4057 O OG1 . THR C 1 101 ? 4.913 -0.407 -2.554 1.00 41.48 ? 98 THR H OG1 1 ATOM 4058 C CG2 . THR C 1 101 ? 4.689 1.977 -2.793 1.00 39.13 ? 98 THR H CG2 1 ATOM 4059 N N . THR C 1 102 ? 5.739 -1.219 0.493 1.00 43.51 ? 99 THR H N 1 ATOM 4060 C CA . THR C 1 102 ? 5.464 -2.408 1.312 1.00 46.66 ? 99 THR H CA 1 ATOM 4061 C C . THR C 1 102 ? 6.743 -3.049 1.816 1.00 46.27 ? 99 THR H C 1 ATOM 4062 O O . THR C 1 102 ? 7.820 -2.746 1.351 1.00 43.54 ? 99 THR H O 1 ATOM 4063 C CB . THR C 1 102 ? 4.707 -3.496 0.518 1.00 48.67 ? 99 THR H CB 1 ATOM 4064 O OG1 . THR C 1 102 ? 5.601 -4.132 -0.398 1.00 47.05 ? 99 THR H OG1 1 ATOM 4065 C CG2 . THR C 1 102 ? 3.527 -2.923 -0.255 1.00 49.05 ? 99 THR H CG2 1 ATOM 4066 N N . ASP C 1 103 ? 6.597 -3.982 2.745 1.00 49.70 ? 100 ASP H N 1 ATOM 4067 C CA . ASP C 1 103 ? 7.723 -4.700 3.334 1.00 50.28 ? 100 ASP H CA 1 ATOM 4068 C C . ASP C 1 103 ? 8.482 -5.665 2.397 1.00 49.61 ? 100 ASP H C 1 ATOM 4069 O O . ASP C 1 103 ? 9.550 -6.165 2.774 1.00 49.88 ? 100 ASP H O 1 ATOM 4070 C CB . ASP C 1 103 ? 7.213 -5.497 4.534 1.00 54.70 ? 100 ASP H CB 1 ATOM 4071 C CG . ASP C 1 103 ? 6.745 -4.603 5.684 1.00 56.01 ? 100 ASP H CG 1 ATOM 4072 O OD1 . ASP C 1 103 ? 7.177 -3.432 5.771 1.00 53.48 ? 100 ASP H OD1 1 ATOM 4073 O OD2 . ASP C 1 103 ? 5.934 -5.084 6.505 1.00 60.01 ? 100 ASP H OD2 1 ATOM 4074 N N . TRP C 1 104 A 7.969 -5.911 1.187 1.00 49.18 ? 100 TRP H N 1 ATOM 4075 C CA . TRP C 1 104 A 8.499 -6.997 0.355 1.00 49.63 ? 100 TRP H CA 1 ATOM 4076 C C . TRP C 1 104 A 9.483 -6.559 -0.728 1.00 45.67 ? 100 TRP H C 1 ATOM 4077 O O . TRP C 1 104 A 9.280 -5.583 -1.426 1.00 43.29 ? 100 TRP H O 1 ATOM 4078 C CB . TRP C 1 104 A 7.353 -7.769 -0.296 1.00 52.63 ? 100 TRP H CB 1 ATOM 4079 C CG . TRP C 1 104 A 6.298 -8.163 0.624 1.00 56.56 ? 100 TRP H CG 1 ATOM 4080 C CD1 . TRP C 1 104 A 5.080 -7.596 0.732 1.00 57.52 ? 100 TRP H CD1 1 ATOM 4081 C CD2 . TRP C 1 104 A 6.347 -9.224 1.588 1.00 60.57 ? 100 TRP H CD2 1 ATOM 4082 N NE1 . TRP C 1 104 A 4.357 -8.230 1.699 1.00 61.76 ? 100 TRP H NE1 1 ATOM 4083 C CE2 . TRP C 1 104 A 5.111 -9.233 2.248 1.00 63.70 ? 100 TRP H CE2 1 ATOM 4084 C CE3 . TRP C 1 104 A 7.321 -10.167 1.959 1.00 62.16 ? 100 TRP H CE3 1 ATOM 4085 C CZ2 . TRP C 1 104 A 4.802 -10.153 3.264 1.00 68.38 ? 100 TRP H CZ2 1 ATOM 4086 C CZ3 . TRP C 1 104 A 7.014 -11.087 2.972 1.00 66.73 ? 100 TRP H CZ3 1 ATOM 4087 C CH2 . TRP C 1 104 A 5.765 -11.067 3.609 1.00 69.82 ? 100 TRP H CH2 1 ATOM 4088 N N . PHE C 1 105 B 10.526 -7.358 -0.871 1.00 45.56 ? 100 PHE H N 1 ATOM 4089 C CA . PHE C 1 105 B 11.623 -7.155 -1.783 1.00 42.58 ? 100 PHE H CA 1 ATOM 4090 C C . PHE C 1 105 B 12.171 -5.714 -1.919 1.00 38.68 ? 100 PHE H C 1 ATOM 4091 O O . PHE C 1 105 B 12.552 -5.284 -3.024 1.00 36.44 ? 100 PHE H O 1 ATOM 4092 C CB . PHE C 1 105 B 11.248 -7.802 -3.134 1.00 43.43 ? 100 PHE H CB 1 ATOM 4093 C CG . PHE C 1 105 B 10.624 -9.171 -2.995 1.00 47.72 ? 100 PHE H CG 1 ATOM 4094 C CD1 . PHE C 1 105 B 11.318 -10.197 -2.372 1.00 50.02 ? 100 PHE H CD1 1 ATOM 4095 C CD2 . PHE C 1 105 B 9.336 -9.432 -3.456 1.00 49.90 ? 100 PHE H CD2 1 ATOM 4096 C CE1 . PHE C 1 105 B 10.759 -11.458 -2.227 1.00 54.55 ? 100 PHE H CE1 1 ATOM 4097 C CE2 . PHE C 1 105 B 8.762 -10.695 -3.305 1.00 54.40 ? 100 PHE H CE2 1 ATOM 4098 C CZ . PHE C 1 105 B 9.475 -11.711 -2.691 1.00 56.77 ? 100 PHE H CZ 1 ATOM 4099 N N . ALA C 1 106 ? 12.310 -5.013 -0.787 1.00 38.05 ? 101 ALA H N 1 ATOM 4100 C CA . ALA C 1 106 ? 12.966 -3.698 -0.807 1.00 34.97 ? 101 ALA H CA 1 ATOM 4101 C C . ALA C 1 106 ? 14.459 -3.845 -0.454 1.00 34.12 ? 101 ALA H C 1 ATOM 4102 O O . ALA C 1 106 ? 14.901 -3.615 0.673 1.00 34.67 ? 101 ALA H O 1 ATOM 4103 C CB . ALA C 1 106 ? 12.283 -2.724 0.123 1.00 35.22 ? 101 ALA H CB 1 ATOM 4104 N N . TYR C 1 107 ? 15.230 -4.196 -1.471 1.00 33.03 ? 102 TYR H N 1 ATOM 4105 C CA . TYR C 1 107 ? 16.586 -4.665 -1.334 1.00 32.88 ? 102 TYR H CA 1 ATOM 4106 C C . TYR C 1 107 ? 17.537 -3.616 -1.881 1.00 29.96 ? 102 TYR H C 1 ATOM 4107 O O . TYR C 1 107 ? 17.220 -2.965 -2.891 1.00 28.42 ? 102 TYR H O 1 ATOM 4108 C CB . TYR C 1 107 ? 16.708 -5.948 -2.143 1.00 34.40 ? 102 TYR H CB 1 ATOM 4109 C CG . TYR C 1 107 ? 15.919 -7.147 -1.627 1.00 38.02 ? 102 TYR H CG 1 ATOM 4110 C CD1 . TYR C 1 107 ? 15.518 -7.254 -0.286 1.00 39.94 ? 102 TYR H CD1 1 ATOM 4111 C CD2 . TYR C 1 107 ? 15.615 -8.210 -2.478 1.00 39.96 ? 102 TYR H CD2 1 ATOM 4112 C CE1 . TYR C 1 107 ? 14.816 -8.362 0.168 1.00 43.62 ? 102 TYR H CE1 1 ATOM 4113 C CE2 . TYR C 1 107 ? 14.921 -9.320 -2.025 1.00 43.72 ? 102 TYR H CE2 1 ATOM 4114 C CZ . TYR C 1 107 ? 14.527 -9.391 -0.702 1.00 45.53 ? 102 TYR H CZ 1 ATOM 4115 O OH . TYR C 1 107 ? 13.831 -10.495 -0.241 1.00 49.74 ? 102 TYR H OH 1 ATOM 4116 N N . TRP C 1 108 ? 18.675 -3.432 -1.204 1.00 29.72 ? 103 TRP H N 1 ATOM 4117 C CA . TRP C 1 108 ? 19.804 -2.703 -1.756 1.00 27.47 ? 103 TRP H CA 1 ATOM 4118 C C . TRP C 1 108 ? 20.840 -3.713 -2.251 1.00 28.33 ? 103 TRP H C 1 ATOM 4119 O O . TRP C 1 108 ? 20.880 -4.864 -1.807 1.00 30.38 ? 103 TRP H O 1 ATOM 4120 C CB . TRP C 1 108 ? 20.419 -1.787 -0.699 1.00 26.98 ? 103 TRP H CB 1 ATOM 4121 C CG . TRP C 1 108 ? 19.647 -0.542 -0.476 1.00 26.07 ? 103 TRP H CG 1 ATOM 4122 C CD1 . TRP C 1 108 ? 18.316 -0.434 -0.204 1.00 26.95 ? 103 TRP H CD1 1 ATOM 4123 C CD2 . TRP C 1 108 ? 20.166 0.792 -0.499 1.00 24.54 ? 103 TRP H CD2 1 ATOM 4124 N NE1 . TRP C 1 108 ? 17.972 0.893 -0.062 1.00 26.11 ? 103 TRP H NE1 1 ATOM 4125 C CE2 . TRP C 1 108 ? 19.091 1.663 -0.233 1.00 24.64 ? 103 TRP H CE2 1 ATOM 4126 C CE3 . TRP C 1 108 ? 21.436 1.333 -0.713 1.00 23.42 ? 103 TRP H CE3 1 ATOM 4127 C CZ2 . TRP C 1 108 ? 19.240 3.042 -0.189 1.00 23.88 ? 103 TRP H CZ2 1 ATOM 4128 C CZ3 . TRP C 1 108 ? 21.585 2.719 -0.680 1.00 22.68 ? 103 TRP H CZ3 1 ATOM 4129 C CH2 . TRP C 1 108 ? 20.495 3.554 -0.421 1.00 22.97 ? 103 TRP H CH2 1 ATOM 4130 N N . GLY C 1 109 ? 21.647 -3.282 -3.210 1.00 26.83 ? 104 GLY H N 1 ATOM 4131 C CA . GLY C 1 109 ? 22.843 -4.004 -3.574 1.00 27.87 ? 104 GLY H CA 1 ATOM 4132 C C . GLY C 1 109 ? 23.891 -3.917 -2.479 1.00 28.78 ? 104 GLY H C 1 ATOM 4133 O O . GLY C 1 109 ? 23.853 -3.016 -1.644 1.00 27.98 ? 104 GLY H O 1 ATOM 4134 N N . GLN C 1 110 ? 24.816 -4.877 -2.472 1.00 31.06 ? 105 GLN H N 1 ATOM 4135 C CA . GLN C 1 110 ? 25.860 -4.950 -1.456 1.00 32.62 ? 105 GLN H CA 1 ATOM 4136 C C . GLN C 1 110 ? 26.754 -3.711 -1.485 1.00 30.67 ? 105 GLN H C 1 ATOM 4137 O O . GLN C 1 110 ? 27.212 -3.260 -0.451 1.00 32.05 ? 105 GLN H O 1 ATOM 4138 C CB . GLN C 1 110 ? 26.667 -6.229 -1.658 1.00 35.30 ? 105 GLN H CB 1 ATOM 4139 C CG . GLN C 1 110 ? 27.306 -6.346 -3.023 1.00 34.80 ? 105 GLN H CG 1 ATOM 4140 C CD . GLN C 1 110 ? 27.415 -7.766 -3.530 1.00 37.89 ? 105 GLN H CD 1 ATOM 4141 O OE1 . GLN C 1 110 ? 27.523 -8.003 -4.741 1.00 37.81 ? 105 GLN H OE1 1 ATOM 4142 N NE2 . GLN C 1 110 ? 27.385 -8.718 -2.615 1.00 40.95 ? 105 GLN H NE2 1 ATOM 4143 N N . GLY C 1 111 ? 26.983 -3.153 -2.659 1.00 28.55 ? 106 GLY H N 1 ATOM 4144 C CA . GLY C 1 111 ? 27.748 -1.925 -2.795 1.00 26.98 ? 106 GLY H CA 1 ATOM 4145 C C . GLY C 1 111 ? 29.077 -2.215 -3.451 1.00 27.26 ? 106 GLY H C 1 ATOM 4146 O O . GLY C 1 111 ? 29.706 -3.227 -3.151 1.00 29.94 ? 106 GLY H O 1 ATOM 4147 N N . THR C 1 112 ? 29.494 -1.338 -4.354 1.00 25.35 ? 107 THR H N 1 ATOM 4148 C CA . THR C 1 112 ? 30.747 -1.484 -5.056 1.00 25.51 ? 107 THR H CA 1 ATOM 4149 C C . THR C 1 112 ? 31.589 -0.248 -4.717 1.00 24.73 ? 107 THR H C 1 ATOM 4150 O O . THR C 1 112 ? 31.230 0.875 -5.084 1.00 23.21 ? 107 THR H O 1 ATOM 4151 C CB . THR C 1 112 ? 30.505 -1.576 -6.579 1.00 24.98 ? 107 THR H CB 1 ATOM 4152 O OG1 . THR C 1 112 ? 29.582 -2.640 -6.858 1.00 25.90 ? 107 THR H OG1 1 ATOM 4153 C CG2 . THR C 1 112 ? 31.795 -1.824 -7.332 1.00 25.86 ? 107 THR H CG2 1 ATOM 4154 N N . LEU C 1 113 ? 32.688 -0.457 -3.995 1.00 25.97 ? 108 LEU H N 1 ATOM 4155 C CA . LEU C 1 113 ? 33.632 0.611 -3.721 1.00 25.70 ? 108 LEU H CA 1 ATOM 4156 C C . LEU C 1 113 ? 34.417 0.894 -4.986 1.00 25.17 ? 108 LEU H C 1 ATOM 4157 O O . LEU C 1 113 ? 35.038 0.016 -5.564 1.00 26.79 ? 108 LEU H O 1 ATOM 4158 C CB . LEU C 1 113 ? 34.556 0.256 -2.562 1.00 27.69 ? 108 LEU H CB 1 ATOM 4159 C CG . LEU C 1 113 ? 35.701 1.248 -2.276 1.00 28.49 ? 108 LEU H CG 1 ATOM 4160 C CD1 . LEU C 1 113 ? 35.200 2.675 -2.082 1.00 27.39 ? 108 LEU H CD1 1 ATOM 4161 C CD2 . LEU C 1 113 ? 36.508 0.795 -1.062 1.00 30.98 ? 108 LEU H CD2 1 ATOM 4162 N N . VAL C 1 114 ? 34.362 2.125 -5.449 1.00 23.70 ? 109 VAL H N 1 ATOM 4163 C CA . VAL C 1 114 ? 35.127 2.494 -6.615 1.00 23.40 ? 109 VAL H CA 1 ATOM 4164 C C . VAL C 1 114 ? 36.092 3.624 -6.282 1.00 23.70 ? 109 VAL H C 1 ATOM 4165 O O . VAL C 1 114 ? 35.667 4.703 -5.875 1.00 22.99 ? 109 VAL H O 1 ATOM 4166 C CB . VAL C 1 114 ? 34.218 2.923 -7.767 1.00 21.91 ? 109 VAL H CB 1 ATOM 4167 C CG1 . VAL C 1 114 ? 35.048 3.268 -8.994 1.00 22.32 ? 109 VAL H CG1 1 ATOM 4168 C CG2 . VAL C 1 114 ? 33.240 1.818 -8.084 1.00 21.83 ? 109 VAL H CG2 1 ATOM 4169 N N . THR C 1 115 ? 37.381 3.361 -6.502 1.00 24.79 ? 110 THR H N 1 ATOM 4170 C CA . THR C 1 115 ? 38.436 4.356 -6.309 1.00 25.47 ? 110 THR H CA 1 ATOM 4171 C C . THR C 1 115 ? 38.978 4.783 -7.669 1.00 25.64 ? 110 THR H C 1 ATOM 4172 O O . THR C 1 115 ? 39.360 3.936 -8.485 1.00 26.40 ? 110 THR H O 1 ATOM 4173 C CB . THR C 1 115 ? 39.587 3.819 -5.456 1.00 27.17 ? 110 THR H CB 1 ATOM 4174 O OG1 . THR C 1 115 ? 39.087 3.360 -4.205 1.00 27.29 ? 110 THR H OG1 1 ATOM 4175 C CG2 . THR C 1 115 ? 40.587 4.890 -5.163 1.00 28.52 ? 110 THR H CG2 1 ATOM 4176 N N . VAL C 1 116 ? 39.033 6.096 -7.887 1.00 25.36 ? 111 VAL H N 1 ATOM 4177 C CA . VAL C 1 116 ? 39.492 6.634 -9.137 1.00 25.84 ? 111 VAL H CA 1 ATOM 4178 C C . VAL C 1 116 ? 40.927 7.128 -8.935 1.00 27.98 ? 111 VAL H C 1 ATOM 4179 O O . VAL C 1 116 ? 41.160 8.146 -8.277 1.00 28.88 ? 111 VAL H O 1 ATOM 4180 C CB . VAL C 1 116 ? 38.578 7.759 -9.660 1.00 24.94 ? 111 VAL H CB 1 ATOM 4181 C CG1 . VAL C 1 116 ? 38.966 8.166 -11.070 1.00 25.79 ? 111 VAL H CG1 1 ATOM 4182 C CG2 . VAL C 1 116 ? 37.125 7.306 -9.678 1.00 23.07 ? 111 VAL H CG2 1 ATOM 4183 N N . SER C 1 117 ? 41.880 6.397 -9.502 1.00 47.32 ? 112 SER H N 1 ATOM 4184 C CA . SER C 1 117 ? 43.293 6.703 -9.315 1.00 45.05 ? 112 SER H CA 1 ATOM 4185 C C . SER C 1 117 ? 44.162 6.015 -10.356 1.00 45.53 ? 112 SER H C 1 ATOM 4186 O O . SER C 1 117 ? 43.798 4.977 -10.878 1.00 46.43 ? 112 SER H O 1 ATOM 4187 C CB . SER C 1 117 ? 43.759 6.289 -7.914 1.00 41.52 ? 112 SER H CB 1 ATOM 4188 O OG . SER C 1 117 ? 45.167 6.200 -7.851 1.00 39.55 ? 112 SER H OG 1 ATOM 4189 N N . ALA C 1 118 ? 45.320 6.604 -10.632 1.00 45.41 ? 113 ALA H N 1 ATOM 4190 C CA . ALA C 1 118 ? 46.287 6.019 -11.552 1.00 46.29 ? 113 ALA H CA 1 ATOM 4191 C C . ALA C 1 118 ? 47.425 5.305 -10.830 1.00 43.87 ? 113 ALA H C 1 ATOM 4192 O O . ALA C 1 118 ? 48.349 4.807 -11.471 1.00 44.86 ? 113 ALA H O 1 ATOM 4193 C CB . ALA C 1 118 ? 46.831 7.093 -12.491 1.00 48.57 ? 113 ALA H CB 1 ATOM 4194 N N . ALA C 1 119 ? 47.370 5.234 -9.507 1.00 41.43 ? 114 ALA H N 1 ATOM 4195 C CA . ALA C 1 119 ? 48.445 4.593 -8.735 1.00 39.43 ? 114 ALA H CA 1 ATOM 4196 C C . ALA C 1 119 ? 48.550 3.083 -8.977 1.00 39.95 ? 114 ALA H C 1 ATOM 4197 O O . ALA C 1 119 ? 47.548 2.418 -9.220 1.00 41.21 ? 114 ALA H O 1 ATOM 4198 C CB . ALA C 1 119 ? 48.250 4.856 -7.251 1.00 36.96 ? 114 ALA H CB 1 ATOM 4199 N N . LYS C 1 120 ? 49.767 2.551 -8.910 1.00 39.74 ? 115 LYS H N 1 ATOM 4200 C CA . LYS C 1 120 ? 50.000 1.110 -8.972 1.00 40.64 ? 115 LYS H CA 1 ATOM 4201 C C . LYS C 1 120 ? 50.208 0.533 -7.580 1.00 38.32 ? 115 LYS H C 1 ATOM 4202 O O . LYS C 1 120 ? 50.489 1.267 -6.625 1.00 36.23 ? 115 LYS H O 1 ATOM 4203 C CB . LYS C 1 120 ? 51.218 0.827 -9.831 1.00 42.72 ? 115 LYS H CB 1 ATOM 4204 C CG . LYS C 1 120 ? 51.043 1.370 -11.248 1.00 45.85 ? 115 LYS H CG 1 ATOM 4205 C CD . LYS C 1 120 ? 52.044 0.763 -12.230 1.00 48.81 ? 115 LYS H CD 1 ATOM 4206 C CE . LYS C 1 120 ? 51.610 0.986 -13.670 1.00 52.17 ? 115 LYS H CE 1 ATOM 4207 N NZ . LYS C 1 120 ? 52.589 0.366 -14.613 1.00 55.34 ? 115 LYS H NZ 1 ATOM 4208 N N . THR C 1 121 ? 50.095 -0.785 -7.472 1.00 39.13 ? 116 THR H N 1 ATOM 4209 C CA . THR C 1 121 ? 50.283 -1.465 -6.199 1.00 37.51 ? 116 THR H CA 1 ATOM 4210 C C . THR C 1 121 ? 51.649 -1.142 -5.608 1.00 36.18 ? 116 THR H C 1 ATOM 4211 O O . THR C 1 121 ? 52.672 -1.357 -6.252 1.00 37.93 ? 116 THR H O 1 ATOM 4212 C CB . THR C 1 121 ? 50.209 -2.988 -6.343 1.00 39.65 ? 116 THR H CB 1 ATOM 4213 O OG1 . THR C 1 121 ? 48.969 -3.362 -6.957 1.00 41.68 ? 116 THR H OG1 1 ATOM 4214 C CG2 . THR C 1 121 ? 50.345 -3.657 -4.962 1.00 38.20 ? 116 THR H CG2 1 ATOM 4215 N N . THR C 1 122 ? 51.657 -0.644 -4.373 1.00 33.70 ? 117 THR H N 1 ATOM 4216 C CA . THR C 1 122 ? 52.873 -0.155 -3.735 1.00 32.48 ? 117 THR H CA 1 ATOM 4217 C C . THR C 1 122 ? 52.866 -0.578 -2.269 1.00 30.61 ? 117 THR H C 1 ATOM 4218 O O . THR C 1 122 ? 51.873 -0.410 -1.572 1.00 29.29 ? 117 THR H O 1 ATOM 4219 C CB . THR C 1 122 ? 52.984 1.379 -3.854 1.00 31.97 ? 117 THR H CB 1 ATOM 4220 O OG1 . THR C 1 122 ? 52.698 1.766 -5.204 1.00 34.05 ? 117 THR H OG1 1 ATOM 4221 C CG2 . THR C 1 122 ? 54.383 1.860 -3.505 1.00 31.92 ? 117 THR H CG2 1 ATOM 4222 N N . PRO C 1 123 ? 53.963 -1.179 -1.808 1.00 30.86 ? 118 PRO H N 1 ATOM 4223 C CA . PRO C 1 123 ? 54.016 -1.508 -0.389 1.00 29.54 ? 118 PRO H CA 1 ATOM 4224 C C . PRO C 1 123 ? 54.294 -0.275 0.446 1.00 27.96 ? 118 PRO H C 1 ATOM 4225 O O . PRO C 1 123 ? 54.860 0.693 -0.067 1.00 28.11 ? 118 PRO H O 1 ATOM 4226 C CB . PRO C 1 123 ? 55.177 -2.491 -0.289 1.00 31.07 ? 118 PRO H CB 1 ATOM 4227 C CG . PRO C 1 123 ? 56.036 -2.191 -1.474 1.00 32.80 ? 118 PRO H CG 1 ATOM 4228 C CD . PRO C 1 123 ? 55.140 -1.655 -2.549 1.00 32.88 ? 118 PRO H CD 1 ATOM 4229 N N . PRO C 1 124 ? 53.902 -0.312 1.728 1.00 26.81 ? 119 PRO H N 1 ATOM 4230 C CA . PRO C 1 124 ? 54.148 0.794 2.626 1.00 25.98 ? 119 PRO H CA 1 ATOM 4231 C C . PRO C 1 124 ? 55.598 0.796 3.095 1.00 26.82 ? 119 PRO H C 1 ATOM 4232 O O . PRO C 1 124 ? 56.251 -0.251 3.115 1.00 27.97 ? 119 PRO H O 1 ATOM 4233 C CB . PRO C 1 124 ? 53.223 0.482 3.809 1.00 25.02 ? 119 PRO H CB 1 ATOM 4234 C CG . PRO C 1 124 ? 53.171 -1.013 3.848 1.00 25.50 ? 119 PRO H CG 1 ATOM 4235 C CD . PRO C 1 124 ? 53.315 -1.468 2.423 1.00 26.93 ? 119 PRO H CD 1 ATOM 4236 N N . SER C 1 125 ? 56.108 1.978 3.410 1.00 26.97 ? 120 SER H N 1 ATOM 4237 C CA . SER C 1 125 ? 57.264 2.104 4.278 1.00 27.34 ? 120 SER H CA 1 ATOM 4238 C C . SER C 1 125 ? 56.728 2.223 5.701 1.00 26.13 ? 120 SER H C 1 ATOM 4239 O O . SER C 1 125 ? 55.764 2.920 5.928 1.00 25.28 ? 120 SER H O 1 ATOM 4240 C CB . SER C 1 125 ? 58.052 3.348 3.933 1.00 28.71 ? 120 SER H CB 1 ATOM 4241 O OG . SER C 1 125 ? 58.537 3.277 2.619 1.00 30.37 ? 120 SER H OG 1 ATOM 4242 N N . VAL C 1 126 ? 57.362 1.562 6.659 1.00 26.45 ? 121 VAL H N 1 ATOM 4243 C CA . VAL C 1 126 ? 56.888 1.587 8.045 1.00 25.77 ? 121 VAL H CA 1 ATOM 4244 C C . VAL C 1 126 ? 57.960 2.211 8.944 1.00 26.55 ? 121 VAL H C 1 ATOM 4245 O O . VAL C 1 126 ? 59.095 1.781 8.944 1.00 28.00 ? 121 VAL H O 1 ATOM 4246 C CB . VAL C 1 126 ? 56.533 0.173 8.545 1.00 25.55 ? 121 VAL H CB 1 ATOM 4247 C CG1 . VAL C 1 126 ? 55.937 0.235 9.948 1.00 25.13 ? 121 VAL H CG1 1 ATOM 4248 C CG2 . VAL C 1 126 ? 55.547 -0.464 7.587 1.00 25.32 ? 121 VAL H CG2 1 ATOM 4249 N N . TYR C 1 127 ? 57.593 3.237 9.692 1.00 26.17 ? 122 TYR H N 1 ATOM 4250 C CA . TYR C 1 127 ? 58.549 3.914 10.547 1.00 27.51 ? 122 TYR H CA 1 ATOM 4251 C C . TYR C 1 127 ? 58.045 3.852 11.967 1.00 26.85 ? 122 TYR H C 1 ATOM 4252 O O . TYR C 1 127 ? 56.846 3.962 12.204 1.00 25.49 ? 122 TYR H O 1 ATOM 4253 C CB . TYR C 1 127 ? 58.750 5.361 10.101 1.00 28.84 ? 122 TYR H CB 1 ATOM 4254 C CG . TYR C 1 127 ? 59.149 5.471 8.660 1.00 29.45 ? 122 TYR H CG 1 ATOM 4255 C CD1 . TYR C 1 127 ? 60.326 4.907 8.208 1.00 30.76 ? 122 TYR H CD1 1 ATOM 4256 C CD2 . TYR C 1 127 ? 58.345 6.125 7.743 1.00 29.12 ? 122 TYR H CD2 1 ATOM 4257 C CE1 . TYR C 1 127 ? 60.696 5.003 6.873 1.00 31.80 ? 122 TYR H CE1 1 ATOM 4258 C CE2 . TYR C 1 127 ? 58.703 6.214 6.418 1.00 29.96 ? 122 TYR H CE2 1 ATOM 4259 C CZ . TYR C 1 127 ? 59.866 5.648 5.991 1.00 31.27 ? 122 TYR H CZ 1 ATOM 4260 O OH . TYR C 1 127 ? 60.186 5.766 4.665 1.00 32.81 ? 122 TYR H OH 1 ATOM 4261 N N . PRO C 1 128 ? 58.954 3.648 12.912 1.00 27.93 ? 123 PRO H N 1 ATOM 4262 C CA . PRO C 1 128 ? 58.593 3.704 14.305 1.00 28.22 ? 123 PRO H CA 1 ATOM 4263 C C . PRO C 1 128 ? 58.458 5.145 14.766 1.00 29.81 ? 123 PRO H C 1 ATOM 4264 O O . PRO C 1 128 ? 59.104 6.046 14.217 1.00 31.34 ? 123 PRO H O 1 ATOM 4265 C CB . PRO C 1 128 ? 59.766 3.004 14.985 1.00 29.62 ? 123 PRO H CB 1 ATOM 4266 C CG . PRO C 1 128 ? 60.928 3.361 14.130 1.00 31.23 ? 123 PRO H CG 1 ATOM 4267 C CD . PRO C 1 128 ? 60.389 3.397 12.723 1.00 29.84 ? 123 PRO H CD 1 ATOM 4268 N N . LEU C 1 129 ? 57.582 5.357 15.739 1.00 30.09 ? 124 LEU H N 1 ATOM 4269 C CA . LEU C 1 129 ? 57.443 6.644 16.395 1.00 32.62 ? 124 LEU H CA 1 ATOM 4270 C C . LEU C 1 129 ? 57.757 6.411 17.867 1.00 34.54 ? 124 LEU H C 1 ATOM 4271 O O . LEU C 1 129 ? 56.932 5.878 18.613 1.00 33.62 ? 124 LEU H O 1 ATOM 4272 C CB . LEU C 1 129 ? 56.033 7.198 16.196 1.00 31.89 ? 124 LEU H CB 1 ATOM 4273 C CG . LEU C 1 129 ? 55.590 7.203 14.729 1.00 30.52 ? 124 LEU H CG 1 ATOM 4274 C CD1 . LEU C 1 129 ? 54.098 7.500 14.593 1.00 29.97 ? 124 LEU H CD1 1 ATOM 4275 C CD2 . LEU C 1 129 ? 56.419 8.203 13.929 1.00 32.28 ? 124 LEU H CD2 1 ATOM 4276 N N . ALA C 1 130 ? 58.989 6.736 18.244 1.00 37.53 ? 125 ALA H N 1 ATOM 4277 C CA . ALA C 1 130 ? 59.419 6.734 19.638 1.00 40.38 ? 125 ALA H CA 1 ATOM 4278 C C . ALA C 1 130 ? 59.515 8.166 20.145 1.00 44.68 ? 125 ALA H C 1 ATOM 4279 O O . ALA C 1 130 ? 59.928 9.061 19.406 1.00 46.36 ? 125 ALA H O 1 ATOM 4280 C CB . ALA C 1 130 ? 60.779 6.079 19.763 1.00 41.44 ? 125 ALA H CB 1 ATOM 4281 N N . PRO C 1 131 ? 59.184 8.392 21.421 1.00 47.89 ? 126 PRO H N 1 ATOM 4282 C CA . PRO C 1 131 ? 59.298 9.758 21.932 1.00 53.13 ? 126 PRO H CA 1 ATOM 4283 C C . PRO C 1 131 ? 60.700 10.359 21.732 1.00 58.25 ? 126 PRO H C 1 ATOM 4284 O O . PRO C 1 131 ? 61.705 9.634 21.769 1.00 58.21 ? 126 PRO H O 1 ATOM 4285 C CB . PRO C 1 131 ? 58.974 9.615 23.427 1.00 54.21 ? 126 PRO H CB 1 ATOM 4286 C CG . PRO C 1 131 ? 59.087 8.161 23.725 1.00 51.27 ? 126 PRO H CG 1 ATOM 4287 C CD . PRO C 1 131 ? 58.772 7.435 22.459 1.00 47.12 ? 126 PRO H CD 1 ATOM 4288 N N . GLY C 1 132 ? 60.761 11.669 21.548 1.00 63.78 ? 127 GLY H N 1 ATOM 4289 C CA . GLY C 1 132 ? 62.005 12.354 21.289 1.00 69.74 ? 127 GLY H CA 1 ATOM 4290 C C . GLY C 1 132 ? 62.884 12.296 22.518 1.00 75.35 ? 127 GLY H C 1 ATOM 4291 O O . GLY C 1 132 ? 62.411 12.050 23.613 1.00 75.61 ? 127 GLY H O 1 ATOM 4292 N N . SER C 1 133 ? 64.174 12.515 22.330 1.00 81.29 ? 128 SER H N 1 ATOM 4293 C CA . SER C 1 133 ? 65.118 12.318 23.406 1.00 87.65 ? 128 SER H CA 1 ATOM 4294 C C . SER C 1 133 ? 64.731 13.196 24.583 1.00 93.67 ? 128 SER H C 1 ATOM 4295 O O . SER C 1 133 ? 64.739 12.744 25.717 1.00 94.69 ? 128 SER H O 1 ATOM 4296 C CB . SER C 1 133 ? 66.525 12.701 22.949 1.00 92.18 ? 128 SER H CB 1 ATOM 4297 O OG . SER C 1 133 ? 67.187 11.652 22.271 1.00 89.28 ? 128 SER H OG 1 ATOM 4298 N N . ALA C 1 134 ? 64.311 14.422 24.327 1.00 99.02 ? 129 ALA H N 1 ATOM 4299 C CA . ALA C 1 134 ? 64.140 15.363 25.411 1.00 104.99 ? 129 ALA H CA 1 ATOM 4300 C C . ALA C 1 134 ? 62.845 15.027 26.101 1.00 102.61 ? 129 ALA H C 1 ATOM 4301 O O . ALA C 1 134 ? 61.885 15.778 26.083 1.00 103.57 ? 129 ALA H O 1 ATOM 4302 C CB . ALA C 1 134 ? 64.086 16.770 24.865 1.00 109.92 ? 129 ALA H CB 1 ATOM 4303 N N . ALA C 1 135 ? 62.886 13.877 26.759 1.00 99.95 ? 130 ALA H N 1 ATOM 4304 C CA . ALA C 1 135 ? 61.738 13.062 27.064 1.00 94.66 ? 130 ALA H CA 1 ATOM 4305 C C . ALA C 1 135 ? 60.609 13.574 27.973 1.00 96.06 ? 130 ALA H C 1 ATOM 4306 O O . ALA C 1 135 ? 59.449 13.537 27.569 1.00 93.56 ? 130 ALA H O 1 ATOM 4307 C CB . ALA C 1 135 ? 62.271 11.759 27.631 1.00 93.22 ? 130 ALA H CB 1 ATOM 4308 N N . GLN C 1 136 ? 60.921 14.105 29.147 1.00 99.06 ? 131 GLN H N 1 ATOM 4309 C CA . GLN C 1 136 ? 59.851 14.453 30.075 1.00 99.71 ? 131 GLN H CA 1 ATOM 4310 C C . GLN C 1 136 ? 58.822 13.298 30.292 1.00 93.73 ? 131 GLN H C 1 ATOM 4311 O O . GLN C 1 136 ? 57.653 13.430 29.940 1.00 90.66 ? 131 GLN H O 1 ATOM 4312 C CB . GLN C 1 136 ? 59.160 15.738 29.631 1.00 102.63 ? 131 GLN H CB 1 ATOM 4313 C CG . GLN C 1 136 ? 59.278 16.885 30.620 1.00 110.08 ? 131 GLN H CG 1 ATOM 4314 C CD . GLN C 1 136 ? 60.694 17.398 30.776 1.00 114.84 ? 131 GLN H CD 1 ATOM 4315 O OE1 . GLN C 1 136 ? 60.998 18.526 30.410 1.00 118.92 ? 131 GLN H OE1 1 ATOM 4316 N NE2 . GLN C 1 136 ? 61.563 16.573 31.324 1.00 115.23 ? 131 GLN H NE2 1 ATOM 4317 N N . THR C 1 137 ? 59.251 12.150 30.803 1.00 91.52 ? 132 THR H N 1 ATOM 4318 C CA . THR C 1 137 ? 58.352 10.999 30.948 1.00 84.93 ? 132 THR H CA 1 ATOM 4319 C C . THR C 1 137 ? 57.237 11.129 31.995 1.00 84.87 ? 132 THR H C 1 ATOM 4320 O O . THR C 1 137 ? 57.307 11.938 32.904 1.00 89.35 ? 132 THR H O 1 ATOM 4321 C CB . THR C 1 137 ? 59.115 9.693 31.202 1.00 82.97 ? 132 THR H CB 1 ATOM 4322 O OG1 . THR C 1 137 ? 60.355 9.978 31.848 1.00 87.63 ? 132 THR H OG1 1 ATOM 4323 C CG2 . THR C 1 137 ? 59.392 9.006 29.913 1.00 78.43 ? 132 THR H CG2 1 ATOM 4324 N N . ASN C 1 138 ? 56.199 10.316 31.819 1.00 79.08 ? 133 ASN H N 1 ATOM 4325 C CA . ASN C 1 138 ? 54.903 10.460 32.455 1.00 78.17 ? 133 ASN H CA 1 ATOM 4326 C C . ASN C 1 138 ? 54.340 9.093 32.842 1.00 74.07 ? 133 ASN H C 1 ATOM 4327 O O . ASN C 1 138 ? 54.931 8.079 32.521 1.00 71.56 ? 133 ASN H O 1 ATOM 4328 C CB . ASN C 1 138 ? 53.981 11.205 31.489 1.00 76.38 ? 133 ASN H CB 1 ATOM 4329 C CG . ASN C 1 138 ? 52.524 11.039 31.809 1.00 77.71 ? 133 ASN H CG 1 ATOM 4330 O OD1 . ASN C 1 138 ? 51.827 10.250 31.183 1.00 74.59 ? 133 ASN H OD1 1 ATOM 4331 N ND2 . ASN C 1 138 ? 52.044 11.808 32.768 1.00 82.93 ? 133 ASN H ND2 1 ATOM 4332 N N . SER C 1 139 ? 53.235 9.064 33.580 1.00 73.19 ? 134 SER H N 1 ATOM 4333 C CA . SER C 1 139 ? 52.608 7.793 34.000 1.00 69.80 ? 134 SER H CA 1 ATOM 4334 C C . SER C 1 139 ? 52.462 6.809 32.820 1.00 63.33 ? 134 SER H C 1 ATOM 4335 O O . SER C 1 139 ? 52.898 5.655 32.866 1.00 60.93 ? 134 SER H O 1 ATOM 4336 C CB . SER C 1 139 ? 51.229 8.085 34.619 1.00 72.09 ? 134 SER H CB 1 ATOM 4337 O OG . SER C 1 139 ? 50.544 6.899 34.968 1.00 70.69 ? 134 SER H OG 1 ATOM 4338 N N . MET C 1 140 ? 51.837 7.300 31.767 1.00 60.34 ? 135 MET H N 1 ATOM 4339 C CA . MET C 1 140 ? 51.622 6.545 30.535 1.00 55.22 ? 135 MET H CA 1 ATOM 4340 C C . MET C 1 140 ? 52.516 7.101 29.440 1.00 52.78 ? 135 MET H C 1 ATOM 4341 O O . MET C 1 140 ? 52.755 8.308 29.399 1.00 55.28 ? 135 MET H O 1 ATOM 4342 C CB . MET C 1 140 ? 50.155 6.655 30.094 1.00 54.75 ? 135 MET H CB 1 ATOM 4343 C CG . MET C 1 140 ? 49.153 5.904 30.965 1.00 56.20 ? 135 MET H CG 1 ATOM 4344 S SD . MET C 1 140 ? 49.626 4.202 31.375 1.00 55.04 ? 135 MET H SD 1 ATOM 4345 C CE . MET C 1 140 ? 48.648 3.234 30.226 1.00 51.54 ? 135 MET H CE 1 ATOM 4346 N N . VAL C 1 141 ? 53.010 6.235 28.558 1.00 48.40 ? 136 VAL H N 1 ATOM 4347 C CA . VAL C 1 141 ? 53.732 6.701 27.375 1.00 46.31 ? 136 VAL H CA 1 ATOM 4348 C C . VAL C 1 141 ? 53.004 6.243 26.146 1.00 42.31 ? 136 VAL H C 1 ATOM 4349 O O . VAL C 1 141 ? 52.437 5.153 26.115 1.00 40.40 ? 136 VAL H O 1 ATOM 4350 C CB . VAL C 1 141 ? 55.189 6.192 27.231 1.00 45.89 ? 136 VAL H CB 1 ATOM 4351 C CG1 . VAL C 1 141 ? 56.075 6.812 28.297 1.00 50.00 ? 136 VAL H CG1 1 ATOM 4352 C CG2 . VAL C 1 141 ? 55.264 4.667 27.240 1.00 43.76 ? 136 VAL H CG2 1 ATOM 4353 N N . THR C 1 142 ? 53.061 7.079 25.125 1.00 41.28 ? 137 THR H N 1 ATOM 4354 C CA . THR C 1 142 ? 52.435 6.780 23.853 1.00 38.15 ? 137 THR H CA 1 ATOM 4355 C C . THR C 1 142 ? 53.500 6.532 22.790 1.00 35.89 ? 137 THR H C 1 ATOM 4356 O O . THR C 1 142 ? 54.432 7.305 22.632 1.00 37.22 ? 137 THR H O 1 ATOM 4357 C CB . THR C 1 142 ? 51.496 7.928 23.430 1.00 39.45 ? 137 THR H CB 1 ATOM 4358 O OG1 . THR C 1 142 ? 50.518 8.140 24.454 1.00 41.69 ? 137 THR H OG1 1 ATOM 4359 C CG2 . THR C 1 142 ? 50.783 7.597 22.137 1.00 36.89 ? 137 THR H CG2 1 ATOM 4360 N N . LEU C 1 143 ? 53.355 5.430 22.078 1.00 32.92 ? 138 LEU H N 1 ATOM 4361 C CA . LEU C 1 143 ? 54.224 5.091 20.962 1.00 31.09 ? 138 LEU H CA 1 ATOM 4362 C C . LEU C 1 143 ? 53.374 4.905 19.712 1.00 29.05 ? 138 LEU H C 1 ATOM 4363 O O . LEU C 1 143 ? 52.161 4.764 19.780 1.00 28.65 ? 138 LEU H O 1 ATOM 4364 C CB . LEU C 1 143 ? 54.921 3.771 21.208 1.00 30.35 ? 138 LEU H CB 1 ATOM 4365 C CG . LEU C 1 143 ? 55.674 3.639 22.519 1.00 32.60 ? 138 LEU H CG 1 ATOM 4366 C CD1 . LEU C 1 143 ? 56.107 2.204 22.736 1.00 32.21 ? 138 LEU H CD1 1 ATOM 4367 C CD2 . LEU C 1 143 ? 56.875 4.570 22.528 1.00 34.53 ? 138 LEU H CD2 1 ATOM 4368 N N . GLY C 1 144 ? 54.022 4.856 18.561 1.00 27.99 ? 139 GLY H N 1 ATOM 4369 C CA . GLY C 1 144 ? 53.287 4.753 17.315 1.00 26.26 ? 139 GLY H CA 1 ATOM 4370 C C . GLY C 1 144 ? 54.065 4.140 16.196 1.00 25.03 ? 139 GLY H C 1 ATOM 4371 O O . GLY C 1 144 ? 55.248 3.860 16.323 1.00 25.33 ? 139 GLY H O 1 ATOM 4372 N N A CYS C 1 145 ? 53.378 4.035 15.066 0.56 24.06 ? 140 CYS H N 1 ATOM 4373 N N B CYS C 1 145 ? 53.390 3.792 15.114 0.44 23.91 ? 140 CYS H N 1 ATOM 4374 C CA A CYS C 1 145 ? 53.906 3.439 13.855 0.56 23.34 ? 140 CYS H CA 1 ATOM 4375 C CA B CYS C 1 145 ? 54.114 3.554 13.874 0.44 23.48 ? 140 CYS H CA 1 ATOM 4376 C C A CYS C 1 145 ? 53.362 4.252 12.686 0.56 23.08 ? 140 CYS H C 1 ATOM 4377 C C B CYS C 1 145 ? 53.414 4.236 12.712 0.44 23.10 ? 140 CYS H C 1 ATOM 4378 O O A CYS C 1 145 ? 52.172 4.512 12.639 0.56 22.89 ? 140 CYS H O 1 ATOM 4379 O O B CYS C 1 145 ? 52.200 4.374 12.687 0.44 22.82 ? 140 CYS H O 1 ATOM 4380 C CB A CYS C 1 145 ? 53.555 1.951 13.771 0.56 22.69 ? 140 CYS H CB 1 ATOM 4381 C CB B CYS C 1 145 ? 54.509 2.080 13.613 0.44 23.01 ? 140 CYS H CB 1 ATOM 4382 S SG A CYS C 1 145 ? 55.053 0.963 13.968 0.56 23.74 ? 140 CYS H SG 1 ATOM 4383 S SG B CYS C 1 145 ? 53.330 0.781 13.165 0.44 22.44 ? 140 CYS H SG 1 ATOM 4384 N N . LEU C 1 146 ? 54.246 4.708 11.799 1.00 23.50 ? 141 LEU H N 1 ATOM 4385 C CA . LEU C 1 146 ? 53.839 5.481 10.634 1.00 23.76 ? 141 LEU H CA 1 ATOM 4386 C C . LEU C 1 146 ? 53.948 4.568 9.445 1.00 22.91 ? 141 LEU H C 1 ATOM 4387 O O . LEU C 1 146 ? 55.004 3.977 9.195 1.00 23.00 ? 141 LEU H O 1 ATOM 4388 C CB . LEU C 1 146 ? 54.742 6.701 10.448 1.00 25.53 ? 141 LEU H CB 1 ATOM 4389 C CG . LEU C 1 146 ? 54.546 7.556 9.198 1.00 26.34 ? 141 LEU H CG 1 ATOM 4390 C CD1 . LEU C 1 146 ? 53.144 8.145 9.116 1.00 26.53 ? 141 LEU H CD1 1 ATOM 4391 C CD2 . LEU C 1 146 ? 55.570 8.683 9.182 1.00 28.84 ? 141 LEU H CD2 1 ATOM 4392 N N . VAL C 1 147 ? 52.827 4.411 8.754 1.00 22.54 ? 142 VAL H N 1 ATOM 4393 C CA . VAL C 1 147 ? 52.746 3.553 7.586 1.00 22.30 ? 142 VAL H CA 1 ATOM 4394 C C . VAL C 1 147 ? 52.494 4.400 6.362 1.00 22.97 ? 142 VAL H C 1 ATOM 4395 O O . VAL C 1 147 ? 51.376 4.881 6.153 1.00 23.12 ? 142 VAL H O 1 ATOM 4396 C CB . VAL C 1 147 ? 51.602 2.532 7.729 1.00 22.02 ? 142 VAL H CB 1 ATOM 4397 C CG1 . VAL C 1 147 ? 51.661 1.541 6.582 1.00 22.14 ? 142 VAL H CG1 1 ATOM 4398 C CG2 . VAL C 1 147 ? 51.712 1.808 9.073 1.00 22.03 ? 142 VAL H CG2 1 ATOM 4399 N N . LYS C 1 148 ? 53.516 4.549 5.534 1.00 23.68 ? 143 LYS H N 1 ATOM 4400 C CA . LYS C 1 148 ? 53.542 5.603 4.532 1.00 25.26 ? 143 LYS H CA 1 ATOM 4401 C C . LYS C 1 148 ? 53.688 5.102 3.103 1.00 25.82 ? 143 LYS H C 1 ATOM 4402 O O . LYS C 1 148 ? 54.385 4.118 2.854 1.00 25.53 ? 143 LYS H O 1 ATOM 4403 C CB . LYS C 1 148 ? 54.709 6.527 4.844 1.00 26.62 ? 143 LYS H CB 1 ATOM 4404 C CG . LYS C 1 148 ? 54.667 7.864 4.145 1.00 28.54 ? 143 LYS H CG 1 ATOM 4405 C CD . LYS C 1 148 ? 55.350 8.918 5.002 1.00 30.38 ? 143 LYS H CD 1 ATOM 4406 C CE . LYS C 1 148 ? 55.181 10.305 4.420 1.00 32.98 ? 143 LYS H CE 1 ATOM 4407 N NZ . LYS C 1 148 ? 55.773 10.363 3.062 1.00 34.18 ? 143 LYS H NZ 1 ATOM 4408 N N . GLY C 1 149 ? 53.026 5.806 2.182 1.00 27.08 ? 144 GLY H N 1 ATOM 4409 C CA . GLY C 1 149 ? 53.199 5.610 0.744 1.00 28.44 ? 144 GLY H CA 1 ATOM 4410 C C . GLY C 1 149 ? 52.788 4.244 0.222 1.00 28.07 ? 144 GLY H C 1 ATOM 4411 O O . GLY C 1 149 ? 53.544 3.607 -0.497 1.00 29.23 ? 144 GLY H O 1 ATOM 4412 N N . TYR C 1 150 ? 51.585 3.798 0.544 1.00 27.30 ? 145 TYR H N 1 ATOM 4413 C CA . TYR C 1 150 ? 51.130 2.516 0.019 1.00 27.59 ? 145 TYR H CA 1 ATOM 4414 C C . TYR C 1 150 ? 49.913 2.703 -0.849 1.00 28.54 ? 145 TYR H C 1 ATOM 4415 O O . TYR C 1 150 ? 49.267 3.730 -0.782 1.00 28.98 ? 145 TYR H O 1 ATOM 4416 C CB . TYR C 1 150 ? 50.822 1.527 1.131 1.00 26.49 ? 145 TYR H CB 1 ATOM 4417 C CG . TYR C 1 150 ? 49.697 1.945 2.036 1.00 25.88 ? 145 TYR H CG 1 ATOM 4418 C CD1 . TYR C 1 150 ? 49.931 2.787 3.109 1.00 24.90 ? 145 TYR H CD1 1 ATOM 4419 C CD2 . TYR C 1 150 ? 48.401 1.477 1.837 1.00 26.64 ? 145 TYR H CD2 1 ATOM 4420 C CE1 . TYR C 1 150 ? 48.915 3.161 3.958 1.00 24.78 ? 145 TYR H CE1 1 ATOM 4421 C CE2 . TYR C 1 150 ? 47.369 1.863 2.677 1.00 26.77 ? 145 TYR H CE2 1 ATOM 4422 C CZ . TYR C 1 150 ? 47.646 2.706 3.747 1.00 25.84 ? 145 TYR H CZ 1 ATOM 4423 O OH . TYR C 1 150 ? 46.644 3.093 4.599 1.00 26.19 ? 145 TYR H OH 1 ATOM 4424 N N . PHE C 1 151 ? 49.633 1.695 -1.669 1.00 29.42 ? 146 PHE H N 1 ATOM 4425 C CA . PHE C 1 151 ? 48.445 1.658 -2.502 1.00 30.68 ? 146 PHE H CA 1 ATOM 4426 C C . PHE C 1 151 ? 48.251 0.223 -2.986 1.00 31.74 ? 146 PHE H C 1 ATOM 4427 O O . PHE C 1 151 ? 49.233 -0.455 -3.267 1.00 31.78 ? 146 PHE H O 1 ATOM 4428 C CB . PHE C 1 151 ? 48.590 2.606 -3.699 1.00 31.93 ? 146 PHE H CB 1 ATOM 4429 C CG . PHE C 1 151 ? 47.360 2.690 -4.540 1.00 33.78 ? 146 PHE H CG 1 ATOM 4430 C CD1 . PHE C 1 151 ? 47.125 1.749 -5.528 1.00 35.61 ? 146 PHE H CD1 1 ATOM 4431 C CD2 . PHE C 1 151 ? 46.422 3.698 -4.339 1.00 34.13 ? 146 PHE H CD2 1 ATOM 4432 C CE1 . PHE C 1 151 ? 45.982 1.813 -6.306 1.00 37.74 ? 146 PHE H CE1 1 ATOM 4433 C CE2 . PHE C 1 151 ? 45.271 3.772 -5.121 1.00 36.38 ? 146 PHE H CE2 1 ATOM 4434 C CZ . PHE C 1 151 ? 45.055 2.824 -6.105 1.00 38.11 ? 146 PHE H CZ 1 ATOM 4435 N N . PRO C 1 152 ? 46.997 -0.260 -3.042 1.00 32.85 ? 147 PRO H N 1 ATOM 4436 C CA . PRO C 1 152 ? 45.760 0.373 -2.595 1.00 33.13 ? 147 PRO H CA 1 ATOM 4437 C C . PRO C 1 152 ? 45.533 0.129 -1.122 1.00 31.90 ? 147 PRO H C 1 ATOM 4438 O O . PRO C 1 152 ? 46.333 -0.557 -0.495 1.00 30.75 ? 147 PRO H O 1 ATOM 4439 C CB . PRO C 1 152 ? 44.694 -0.377 -3.391 1.00 35.75 ? 147 PRO H CB 1 ATOM 4440 C CG . PRO C 1 152 ? 45.249 -1.750 -3.509 1.00 36.46 ? 147 PRO H CG 1 ATOM 4441 C CD . PRO C 1 152 ? 46.738 -1.606 -3.583 1.00 34.97 ? 147 PRO H CD 1 ATOM 4442 N N . GLU C 1 153 ? 44.436 0.656 -0.590 1.00 32.84 ? 148 GLU H N 1 ATOM 4443 C CA . GLU C 1 153 ? 43.950 0.250 0.719 1.00 33.01 ? 148 GLU H CA 1 ATOM 4444 C C . GLU C 1 153 ? 43.485 -1.212 0.667 1.00 34.78 ? 148 GLU H C 1 ATOM 4445 O O . GLU C 1 153 ? 43.180 -1.730 -0.406 1.00 36.46 ? 148 GLU H O 1 ATOM 4446 C CB . GLU C 1 153 ? 42.786 1.138 1.157 1.00 34.45 ? 148 GLU H CB 1 ATOM 4447 C CG . GLU C 1 153 ? 43.181 2.578 1.433 1.00 33.96 ? 148 GLU H CG 1 ATOM 4448 C CD . GLU C 1 153 ? 42.206 3.269 2.368 1.00 35.49 ? 148 GLU H CD 1 ATOM 4449 O OE1 . GLU C 1 153 ? 41.433 4.142 1.889 1.00 38.08 ? 148 GLU H OE1 1 ATOM 4450 O OE2 . GLU C 1 153 ? 42.184 2.924 3.575 1.00 34.91 ? 148 GLU H OE2 1 ATOM 4451 N N . PRO C 1 154 ? 43.422 -1.882 1.826 1.00 34.74 ? 149 PRO H N 1 ATOM 4452 C CA . PRO C 1 154 ? 43.786 -1.407 3.151 1.00 32.86 ? 149 PRO H CA 1 ATOM 4453 C C . PRO C 1 154 ? 45.166 -1.904 3.587 1.00 31.50 ? 149 PRO H C 1 ATOM 4454 O O . PRO C 1 154 ? 45.798 -2.697 2.869 1.00 32.20 ? 149 PRO H O 1 ATOM 4455 C CB . PRO C 1 154 ? 42.708 -2.040 4.029 1.00 34.40 ? 149 PRO H CB 1 ATOM 4456 C CG . PRO C 1 154 ? 42.428 -3.353 3.363 1.00 36.85 ? 149 PRO H CG 1 ATOM 4457 C CD . PRO C 1 154 ? 42.770 -3.204 1.901 1.00 37.27 ? 149 PRO H CD 1 ATOM 4458 N N . VAL C 1 155 ? 45.622 -1.394 4.734 1.00 29.69 ? 150 VAL H N 1 ATOM 4459 C CA . VAL C 1 155 ? 46.634 -2.052 5.570 1.00 28.79 ? 150 VAL H CA 1 ATOM 4460 C C . VAL C 1 155 ? 45.969 -2.424 6.897 1.00 28.99 ? 150 VAL H C 1 ATOM 4461 O O . VAL C 1 155 ? 44.957 -1.852 7.269 1.00 29.67 ? 150 VAL H O 1 ATOM 4462 C CB . VAL C 1 155 ? 47.866 -1.157 5.858 1.00 27.15 ? 150 VAL H CB 1 ATOM 4463 C CG1 . VAL C 1 155 ? 48.646 -0.866 4.577 1.00 27.04 ? 150 VAL H CG1 1 ATOM 4464 C CG2 . VAL C 1 155 ? 47.457 0.148 6.533 1.00 26.60 ? 150 VAL H CG2 1 ATOM 4465 N N . THR C 1 156 ? 46.512 -3.410 7.588 1.00 28.70 ? 151 THR H N 1 ATOM 4466 C CA . THR C 1 156 ? 46.077 -3.715 8.937 1.00 28.93 ? 151 THR H CA 1 ATOM 4467 C C . THR C 1 156 ? 47.259 -3.449 9.851 1.00 27.05 ? 151 THR H C 1 ATOM 4468 O O . THR C 1 156 ? 48.405 -3.598 9.449 1.00 26.42 ? 151 THR H O 1 ATOM 4469 C CB . THR C 1 156 ? 45.554 -5.179 9.099 1.00 31.65 ? 151 THR H CB 1 ATOM 4470 O OG1 . THR C 1 156 ? 46.631 -6.116 9.028 1.00 32.38 ? 151 THR H OG1 1 ATOM 4471 C CG2 . THR C 1 156 ? 44.536 -5.528 8.029 1.00 33.78 ? 151 THR H CG2 1 ATOM 4472 N N . VAL C 1 157 ? 46.978 -3.008 11.067 1.00 26.39 ? 152 VAL H N 1 ATOM 4473 C CA . VAL C 1 157 ? 48.015 -2.797 12.060 1.00 25.11 ? 152 VAL H CA 1 ATOM 4474 C C . VAL C 1 157 ? 47.599 -3.527 13.333 1.00 26.08 ? 152 VAL H C 1 ATOM 4475 O O . VAL C 1 157 ? 46.454 -3.451 13.755 1.00 26.96 ? 152 VAL H O 1 ATOM 4476 C CB . VAL C 1 157 ? 48.221 -1.297 12.348 1.00 24.03 ? 152 VAL H CB 1 ATOM 4477 C CG1 . VAL C 1 157 ? 49.368 -1.076 13.326 1.00 23.58 ? 152 VAL H CG1 1 ATOM 4478 C CG2 . VAL C 1 157 ? 48.509 -0.544 11.055 1.00 23.39 ? 152 VAL H CG2 1 ATOM 4479 N N . THR C 1 158 ? 48.524 -4.271 13.913 1.00 26.04 ? 153 THR H N 1 ATOM 4480 C CA . THR C 1 158 ? 48.342 -4.804 15.248 1.00 27.32 ? 153 THR H CA 1 ATOM 4481 C C . THR C 1 158 ? 49.591 -4.464 16.052 1.00 26.51 ? 153 THR H C 1 ATOM 4482 O O . THR C 1 158 ? 50.577 -4.014 15.489 1.00 25.46 ? 153 THR H O 1 ATOM 4483 C CB . THR C 1 158 ? 48.071 -6.330 15.243 1.00 29.75 ? 153 THR H CB 1 ATOM 4484 O OG1 . THR C 1 158 ? 49.208 -7.036 14.738 1.00 30.03 ? 153 THR H OG1 1 ATOM 4485 C CG2 . THR C 1 158 ? 46.854 -6.660 14.389 1.00 30.97 ? 153 THR H CG2 1 ATOM 4486 N N . TRP C 1 159 ? 49.531 -4.665 17.360 1.00 27.60 ? 154 TRP H N 1 ATOM 4487 C CA . TRP C 1 159 ? 50.666 -4.416 18.239 1.00 27.58 ? 154 TRP H CA 1 ATOM 4488 C C . TRP C 1 159 ? 50.946 -5.644 19.064 1.00 29.79 ? 154 TRP H C 1 ATOM 4489 O O . TRP C 1 159 ? 50.043 -6.181 19.690 1.00 31.24 ? 154 TRP H O 1 ATOM 4490 C CB . TRP C 1 159 ? 50.364 -3.256 19.174 1.00 27.40 ? 154 TRP H CB 1 ATOM 4491 C CG . TRP C 1 159 ? 50.325 -1.948 18.478 1.00 25.81 ? 154 TRP H CG 1 ATOM 4492 C CD1 . TRP C 1 159 ? 49.235 -1.328 17.971 1.00 25.59 ? 154 TRP H CD1 1 ATOM 4493 C CD2 . TRP C 1 159 ? 51.438 -1.090 18.218 1.00 25.01 ? 154 TRP H CD2 1 ATOM 4494 N NE1 . TRP C 1 159 ? 49.590 -0.122 17.416 1.00 24.63 ? 154 TRP H NE1 1 ATOM 4495 C CE2 . TRP C 1 159 ? 50.941 0.046 17.556 1.00 24.19 ? 154 TRP H CE2 1 ATOM 4496 C CE3 . TRP C 1 159 ? 52.810 -1.168 18.497 1.00 25.32 ? 154 TRP H CE3 1 ATOM 4497 C CZ2 . TRP C 1 159 ? 51.759 1.094 17.152 1.00 23.81 ? 154 TRP H CZ2 1 ATOM 4498 C CZ3 . TRP C 1 159 ? 53.629 -0.117 18.096 1.00 25.00 ? 154 TRP H CZ3 1 ATOM 4499 C CH2 . TRP C 1 159 ? 53.100 0.992 17.415 1.00 24.15 ? 154 TRP H CH2 1 ATOM 4500 N N . ASN C 1 160 ? 52.204 -6.076 19.067 1.00 30.57 ? 155 ASN H N 1 ATOM 4501 C CA . ASN C 1 160 ? 52.607 -7.287 19.729 1.00 33.39 ? 155 ASN H CA 1 ATOM 4502 C C . ASN C 1 160 ? 51.669 -8.416 19.345 1.00 35.34 ? 155 ASN H C 1 ATOM 4503 O O . ASN C 1 160 ? 51.065 -9.051 20.214 1.00 37.32 ? 155 ASN H O 1 ATOM 4504 C CB . ASN C 1 160 ? 52.641 -7.092 21.252 1.00 34.77 ? 155 ASN H CB 1 ATOM 4505 C CG . ASN C 1 160 ? 53.741 -6.146 21.695 1.00 34.13 ? 155 ASN H CG 1 ATOM 4506 O OD1 . ASN C 1 160 ? 54.544 -5.690 20.890 1.00 33.23 ? 155 ASN H OD1 1 ATOM 4507 N ND2 . ASN C 1 160 ? 53.796 -5.863 22.982 1.00 35.37 ? 155 ASN H ND2 1 ATOM 4508 N N . SER C 1 161 ? 51.539 -8.640 18.032 1.00 35.05 ? 156 SER H N 1 ATOM 4509 C CA . SER C 1 161 ? 50.688 -9.716 17.498 1.00 37.40 ? 156 SER H CA 1 ATOM 4510 C C . SER C 1 161 ? 49.219 -9.654 17.947 1.00 38.27 ? 156 SER H C 1 ATOM 4511 O O . SER C 1 161 ? 48.540 -10.676 17.930 1.00 41.18 ? 156 SER H O 1 ATOM 4512 C CB . SER C 1 161 ? 51.277 -11.065 17.894 1.00 40.82 ? 156 SER H CB 1 ATOM 4513 O OG . SER C 1 161 ? 52.667 -11.047 17.657 1.00 40.43 ? 156 SER H OG 1 ATOM 4514 N N . GLY C 1 162 ? 48.732 -8.477 18.348 1.00 36.46 ? 157 GLY H N 1 ATOM 4515 C CA . GLY C 1 162 ? 47.358 -8.334 18.813 1.00 37.74 ? 157 GLY H CA 1 ATOM 4516 C C . GLY C 1 162 ? 47.198 -8.476 20.315 1.00 39.87 ? 157 GLY H C 1 ATOM 4517 O O . GLY C 1 162 ? 46.101 -8.289 20.825 1.00 41.01 ? 157 GLY H O 1 ATOM 4518 N N . SER C 1 163 ? 48.279 -8.800 21.031 1.00 40.81 ? 158 SER H N 1 ATOM 4519 C CA . SER C 1 163 ? 48.228 -8.894 22.497 1.00 43.06 ? 158 SER H CA 1 ATOM 4520 C C . SER C 1 163 ? 47.988 -7.544 23.159 1.00 41.92 ? 158 SER H C 1 ATOM 4521 O O . SER C 1 163 ? 47.362 -7.466 24.213 1.00 43.71 ? 158 SER H O 1 ATOM 4522 C CB . SER C 1 163 ? 49.512 -9.489 23.039 1.00 44.19 ? 158 SER H CB 1 ATOM 4523 O OG . SER C 1 163 ? 49.592 -10.843 22.658 1.00 47.00 ? 158 SER H OG 1 ATOM 4524 N N . LEU C 1 164 ? 48.495 -6.485 22.539 1.00 39.74 ? 159 LEU H N 1 ATOM 4525 C CA . LEU C 1 164 ? 48.146 -5.124 22.937 1.00 39.47 ? 159 LEU H CA 1 ATOM 4526 C C . LEU C 1 164 ? 46.904 -4.661 22.183 1.00 39.48 ? 159 LEU H C 1 ATOM 4527 O O . LEU C 1 164 ? 47.001 -4.205 21.052 1.00 37.99 ? 159 LEU H O 1 ATOM 4528 C CB . LEU C 1 164 ? 49.301 -4.161 22.648 1.00 37.76 ? 159 LEU H CB 1 ATOM 4529 C CG . LEU C 1 164 ? 50.308 -3.918 23.756 1.00 38.98 ? 159 LEU H CG 1 ATOM 4530 C CD1 . LEU C 1 164 ? 51.401 -3.012 23.227 1.00 37.51 ? 159 LEU H CD1 1 ATOM 4531 C CD2 . LEU C 1 164 ? 49.652 -3.304 24.992 1.00 40.86 ? 159 LEU H CD2 1 ATOM 4532 N N . SER C 1 165 ? 45.739 -4.793 22.808 1.00 43.88 ? 160 SER H N 1 ATOM 4533 C CA . SER C 1 165 ? 44.469 -4.412 22.189 1.00 45.00 ? 160 SER H CA 1 ATOM 4534 C C . SER C 1 165 ? 44.027 -3.048 22.676 1.00 44.51 ? 160 SER H C 1 ATOM 4535 O O . SER C 1 165 ? 43.669 -2.188 21.877 1.00 43.66 ? 160 SER H O 1 ATOM 4536 C CB . SER C 1 165 ? 43.371 -5.417 22.542 1.00 49.23 ? 160 SER H CB 1 ATOM 4537 O OG . SER C 1 165 ? 43.814 -6.740 22.359 1.00 51.10 ? 160 SER H OG 1 ATOM 4538 N N . SER C 1 166 ? 44.012 -2.884 23.999 1.00 45.75 ? 161 SER H N 1 ATOM 4539 C CA . SER C 1 166 ? 43.538 -1.655 24.618 1.00 45.92 ? 161 SER H CA 1 ATOM 4540 C C . SER C 1 166 ? 44.516 -0.538 24.341 1.00 42.28 ? 161 SER H C 1 ATOM 4541 O O . SER C 1 166 ? 45.657 -0.772 23.954 1.00 40.17 ? 161 SER H O 1 ATOM 4542 C CB . SER C 1 166 ? 43.333 -1.811 26.128 1.00 48.76 ? 161 SER H CB 1 ATOM 4543 O OG . SER C 1 166 ? 44.492 -1.404 26.837 1.00 47.61 ? 161 SER H OG 1 ATOM 4544 N N . GLY C 1 167 ? 44.041 0.684 24.518 1.00 42.33 ? 162 GLY H N 1 ATOM 4545 C CA . GLY C 1 167 ? 44.872 1.860 24.342 1.00 39.88 ? 162 GLY H CA 1 ATOM 4546 C C . GLY C 1 167 ? 45.442 2.015 22.944 1.00 36.78 ? 162 GLY H C 1 ATOM 4547 O O . GLY C 1 167 ? 46.467 2.649 22.790 1.00 35.38 ? 162 GLY H O 1 ATOM 4548 N N . VAL C 1 168 ? 44.787 1.432 21.936 1.00 35.95 ? 163 VAL H N 1 ATOM 4549 C CA . VAL C 1 168 ? 45.204 1.548 20.538 1.00 33.24 ? 163 VAL H CA 1 ATOM 4550 C C . VAL C 1 168 ? 44.248 2.452 19.740 1.00 33.60 ? 163 VAL H C 1 ATOM 4551 O O . VAL C 1 168 ? 43.030 2.443 19.924 1.00 35.48 ? 163 VAL H O 1 ATOM 4552 C CB . VAL C 1 168 ? 45.271 0.164 19.852 1.00 32.83 ? 163 VAL H CB 1 ATOM 4553 C CG1 . VAL C 1 168 ? 45.547 0.302 18.357 1.00 31.12 ? 163 VAL H CG1 1 ATOM 4554 C CG2 . VAL C 1 168 ? 46.341 -0.697 20.495 1.00 32.44 ? 163 VAL H CG2 1 ATOM 4555 N N . HIS C 1 169 ? 44.826 3.257 18.865 1.00 31.74 ? 164 HIS H N 1 ATOM 4556 C CA . HIS C 1 169 ? 44.060 4.002 17.882 1.00 32.36 ? 164 HIS H CA 1 ATOM 4557 C C . HIS C 1 169 ? 44.753 3.867 16.550 1.00 30.17 ? 164 HIS H C 1 ATOM 4558 O O . HIS C 1 169 ? 45.879 4.323 16.388 1.00 28.67 ? 164 HIS H O 1 ATOM 4559 C CB . HIS C 1 169 ? 43.994 5.493 18.227 1.00 33.73 ? 164 HIS H CB 1 ATOM 4560 C CG . HIS C 1 169 ? 43.476 5.786 19.595 1.00 36.10 ? 164 HIS H CG 1 ATOM 4561 N ND1 . HIS C 1 169 ? 42.161 5.579 19.950 1.00 38.83 ? 164 HIS H ND1 1 ATOM 4562 C CD2 . HIS C 1 169 ? 44.084 6.294 20.690 1.00 36.69 ? 164 HIS H CD2 1 ATOM 4563 C CE1 . HIS C 1 169 ? 41.980 5.944 21.207 1.00 40.88 ? 164 HIS H CE1 1 ATOM 4564 N NE2 . HIS C 1 169 ? 43.129 6.387 21.678 1.00 39.68 ? 164 HIS H NE2 1 ATOM 4565 N N . THR C 1 170 ? 44.089 3.254 15.583 1.00 30.45 ? 165 THR H N 1 ATOM 4566 C CA . THR C 1 170 ? 44.609 3.238 14.234 1.00 28.96 ? 165 THR H CA 1 ATOM 4567 C C . THR C 1 170 ? 43.751 4.159 13.418 1.00 30.28 ? 165 THR H C 1 ATOM 4568 O O . THR C 1 170 ? 42.555 3.949 13.337 1.00 32.29 ? 165 THR H O 1 ATOM 4569 C CB . THR C 1 170 ? 44.588 1.843 13.654 1.00 28.73 ? 165 THR H CB 1 ATOM 4570 O OG1 . THR C 1 170 ? 45.343 1.009 14.533 1.00 28.44 ? 165 THR H OG1 1 ATOM 4571 C CG2 . THR C 1 170 ? 45.216 1.842 12.235 1.00 27.49 ? 165 THR H CG2 1 ATOM 4572 N N . PHE C 1 171 ? 44.362 5.176 12.822 1.00 29.69 ? 166 PHE H N 1 ATOM 4573 C CA . PHE C 1 171 ? 43.613 6.263 12.202 1.00 31.77 ? 166 PHE H CA 1 ATOM 4574 C C . PHE C 1 171 ? 43.300 5.933 10.750 1.00 31.59 ? 166 PHE H C 1 ATOM 4575 O O . PHE C 1 171 ? 44.024 5.170 10.141 1.00 30.04 ? 166 PHE H O 1 ATOM 4576 C CB . PHE C 1 171 ? 44.399 7.568 12.312 1.00 32.08 ? 166 PHE H CB 1 ATOM 4577 C CG . PHE C 1 171 ? 44.630 7.989 13.717 1.00 32.83 ? 166 PHE H CG 1 ATOM 4578 C CD1 . PHE C 1 171 ? 45.729 7.525 14.414 1.00 31.03 ? 166 PHE H CD1 1 ATOM 4579 C CD2 . PHE C 1 171 ? 43.732 8.826 14.359 1.00 35.88 ? 166 PHE H CD2 1 ATOM 4580 C CE1 . PHE C 1 171 ? 45.934 7.896 15.729 1.00 32.10 ? 166 PHE H CE1 1 ATOM 4581 C CE2 . PHE C 1 171 ? 43.935 9.199 15.676 1.00 36.98 ? 166 PHE H CE2 1 ATOM 4582 C CZ . PHE C 1 171 ? 45.036 8.733 16.364 1.00 34.93 ? 166 PHE H CZ 1 ATOM 4583 N N . PRO C 1 172 ? 42.208 6.483 10.206 1.00 33.84 ? 167 PRO H N 1 ATOM 4584 C CA . PRO C 1 172 ? 41.918 6.232 8.801 1.00 34.01 ? 167 PRO H CA 1 ATOM 4585 C C . PRO C 1 172 ? 43.033 6.709 7.878 1.00 32.62 ? 167 PRO H C 1 ATOM 4586 O O . PRO C 1 172 ? 43.718 7.682 8.166 1.00 32.80 ? 167 PRO H O 1 ATOM 4587 C CB . PRO C 1 172 ? 40.629 7.031 8.557 1.00 37.32 ? 167 PRO H CB 1 ATOM 4588 C CG . PRO C 1 172 ? 39.980 7.139 9.891 1.00 39.01 ? 167 PRO H CG 1 ATOM 4589 C CD . PRO C 1 172 ? 41.107 7.195 10.885 1.00 37.01 ? 167 PRO H CD 1 ATOM 4590 N N . ALA C 1 173 ? 43.213 6.010 6.774 1.00 31.90 ? 168 ALA H N 1 ATOM 4591 C CA . ALA C 1 173 ? 44.176 6.428 5.780 1.00 31.20 ? 168 ALA H CA 1 ATOM 4592 C C . ALA C 1 173 ? 43.747 7.720 5.119 1.00 33.77 ? 168 ALA H C 1 ATOM 4593 O O . ALA C 1 173 ? 42.565 7.986 5.040 1.00 36.14 ? 168 ALA H O 1 ATOM 4594 C CB . ALA C 1 173 ? 44.336 5.360 4.732 1.00 30.25 ? 168 ALA H CB 1 ATOM 4595 N N . VAL C 1 174 ? 44.715 8.511 4.655 1.00 34.34 ? 169 VAL H N 1 ATOM 4596 C CA . VAL C 1 174 ? 44.449 9.681 3.814 1.00 37.50 ? 169 VAL H CA 1 ATOM 4597 C C . VAL C 1 174 ? 45.380 9.655 2.594 1.00 37.23 ? 169 VAL H C 1 ATOM 4598 O O . VAL C 1 174 ? 46.477 9.087 2.639 1.00 34.59 ? 169 VAL H O 1 ATOM 4599 C CB . VAL C 1 174 ? 44.614 11.009 4.585 1.00 40.05 ? 169 VAL H CB 1 ATOM 4600 C CG1 . VAL C 1 174 ? 43.699 11.037 5.800 1.00 41.21 ? 169 VAL H CG1 1 ATOM 4601 C CG2 . VAL C 1 174 ? 46.061 11.211 5.031 1.00 39.10 ? 169 VAL H CG2 1 ATOM 4602 N N . LEU C 1 175 ? 44.931 10.254 1.500 1.00 40.10 ? 170 LEU H N 1 ATOM 4603 C CA . LEU C 1 175 ? 45.754 10.379 0.301 1.00 41.09 ? 170 LEU H CA 1 ATOM 4604 C C . LEU C 1 175 ? 46.877 11.426 0.474 1.00 43.16 ? 170 LEU H C 1 ATOM 4605 O O . LEU C 1 175 ? 46.667 12.524 0.989 1.00 45.19 ? 170 LEU H O 1 ATOM 4606 C CB . LEU C 1 175 ? 44.904 10.769 -0.911 1.00 43.67 ? 170 LEU H CB 1 ATOM 4607 C CG . LEU C 1 175 ? 44.445 9.685 -1.942 1.00 43.14 ? 170 LEU H CG 1 ATOM 4608 C CD1 . LEU C 1 175 ? 44.052 10.195 -3.348 1.00 45.69 ? 170 LEU H CD1 1 ATOM 4609 C CD2 . LEU C 1 175 ? 45.447 8.544 -2.104 1.00 40.29 ? 170 LEU H CD2 1 ATOM 4610 N N . GLN C 1 176 ? 48.064 11.056 0.010 1.00 43.42 ? 171 GLN H N 1 ATOM 4611 C CA . GLN C 1 176 ? 49.287 11.824 0.161 1.00 46.08 ? 171 GLN H CA 1 ATOM 4612 C C . GLN C 1 176 ? 50.092 11.666 -1.110 1.00 46.07 ? 171 GLN H C 1 ATOM 4613 O O . GLN C 1 176 ? 50.770 10.655 -1.293 1.00 44.23 ? 171 GLN H O 1 ATOM 4614 C CB . GLN C 1 176 ? 50.023 11.242 1.380 1.00 45.56 ? 171 GLN H CB 1 ATOM 4615 C CG . GLN C 1 176 ? 51.583 11.220 1.443 1.00 47.33 ? 171 GLN H CG 1 ATOM 4616 C CD . GLN C 1 176 ? 52.217 9.887 1.035 1.00 46.78 ? 171 GLN H CD 1 ATOM 4617 O OE1 . GLN C 1 176 ? 53.270 9.833 0.383 1.00 49.94 ? 171 GLN H OE1 1 ATOM 4618 N NE2 . GLN C 1 176 ? 51.596 8.810 1.450 1.00 44.49 ? 171 GLN H NE2 1 ATOM 4619 N N . SER C 1 177 ? 50.007 12.662 -1.989 1.00 48.90 ? 172 SER H N 1 ATOM 4620 C CA . SER C 1 177 ? 50.647 12.586 -3.296 1.00 49.72 ? 172 SER H CA 1 ATOM 4621 C C . SER C 1 177 ? 50.265 11.268 -4.004 1.00 46.28 ? 172 SER H C 1 ATOM 4622 O O . SER C 1 177 ? 51.157 10.499 -4.377 1.00 44.93 ? 172 SER H O 1 ATOM 4623 C CB . SER C 1 177 ? 52.152 12.599 -3.087 1.00 50.48 ? 172 SER H CB 1 ATOM 4624 O OG . SER C 1 177 ? 52.517 13.570 -2.123 1.00 52.73 ? 172 SER H OG 1 ATOM 4625 N N . ASP C 1 178 ? 48.965 10.967 -4.100 1.00 44.85 ? 173 ASP H N 1 ATOM 4626 C CA . ASP C 1 178 ? 48.468 9.783 -4.818 1.00 43.01 ? 173 ASP H CA 1 ATOM 4627 C C . ASP C 1 178 ? 48.780 8.401 -4.190 1.00 38.73 ? 173 ASP H C 1 ATOM 4628 O O . ASP C 1 178 ? 48.546 7.369 -4.804 1.00 37.77 ? 173 ASP H O 1 ATOM 4629 C CB . ASP C 1 178 ? 48.974 9.825 -6.253 1.00 45.12 ? 173 ASP H CB 1 ATOM 4630 C CG . ASP C 1 178 ? 48.575 11.110 -6.948 1.00 49.31 ? 173 ASP H CG 1 ATOM 4631 O OD1 . ASP C 1 178 ? 47.355 11.415 -6.968 1.00 50.73 ? 173 ASP H OD1 1 ATOM 4632 O OD2 . ASP C 1 178 ? 49.475 11.823 -7.455 1.00 52.07 ? 173 ASP H OD2 1 ATOM 4633 N N . LEU C 1 179 ? 49.343 8.401 -2.994 1.00 36.28 ? 174 LEU H N 1 ATOM 4634 C CA . LEU C 1 179 ? 49.535 7.196 -2.176 1.00 33.18 ? 174 LEU H CA 1 ATOM 4635 C C . LEU C 1 179 ? 48.902 7.440 -0.820 1.00 31.75 ? 174 LEU H C 1 ATOM 4636 O O . LEU C 1 179 ? 48.643 8.580 -0.462 1.00 32.93 ? 174 LEU H O 1 ATOM 4637 C CB . LEU C 1 179 ? 51.029 6.878 -2.027 1.00 32.59 ? 174 LEU H CB 1 ATOM 4638 C CG . LEU C 1 179 ? 51.832 6.611 -3.314 1.00 33.94 ? 174 LEU H CG 1 ATOM 4639 C CD1 . LEU C 1 179 ? 53.321 6.514 -2.996 1.00 34.18 ? 174 LEU H CD1 1 ATOM 4640 C CD2 . LEU C 1 179 ? 51.371 5.349 -4.034 1.00 33.50 ? 174 LEU H CD2 1 ATOM 4641 N N . TYR C 1 180 ? 48.648 6.360 -0.083 1.00 29.58 ? 175 TYR H N 1 ATOM 4642 C CA . TYR C 1 180 ? 47.993 6.437 1.211 1.00 28.71 ? 175 TYR H CA 1 ATOM 4643 C C . TYR C 1 180 ? 48.999 6.475 2.336 1.00 27.29 ? 175 TYR H C 1 ATOM 4644 O O . TYR C 1 180 ? 50.124 6.043 2.183 1.00 26.81 ? 175 TYR H O 1 ATOM 4645 C CB . TYR C 1 180 ? 47.039 5.251 1.403 1.00 28.14 ? 175 TYR H CB 1 ATOM 4646 C CG . TYR C 1 180 ? 45.801 5.333 0.526 1.00 29.80 ? 175 TYR H CG 1 ATOM 4647 C CD1 . TYR C 1 180 ? 44.736 6.156 0.872 1.00 31.44 ? 175 TYR H CD1 1 ATOM 4648 C CD2 . TYR C 1 180 ? 45.698 4.588 -0.646 1.00 30.34 ? 175 TYR H CD2 1 ATOM 4649 C CE1 . TYR C 1 180 ? 43.599 6.243 0.061 1.00 33.50 ? 175 TYR H CE1 1 ATOM 4650 C CE2 . TYR C 1 180 ? 44.572 4.665 -1.460 1.00 32.29 ? 175 TYR H CE2 1 ATOM 4651 C CZ . TYR C 1 180 ? 43.530 5.491 -1.107 1.00 33.78 ? 175 TYR H CZ 1 ATOM 4652 O OH . TYR C 1 180 ? 42.436 5.554 -1.928 1.00 36.23 ? 175 TYR H OH 1 ATOM 4653 N N . THR C 1 181 ? 48.572 7.013 3.460 1.00 27.31 ? 176 THR H N 1 ATOM 4654 C CA . THR C 1 181 ? 49.359 7.045 4.668 1.00 26.66 ? 176 THR H CA 1 ATOM 4655 C C . THR C 1 181 ? 48.410 6.859 5.800 1.00 26.51 ? 176 THR H C 1 ATOM 4656 O O . THR C 1 181 ? 47.306 7.391 5.769 1.00 27.90 ? 176 THR H O 1 ATOM 4657 C CB . THR C 1 181 ? 50.044 8.415 4.876 1.00 28.45 ? 176 THR H CB 1 ATOM 4658 O OG1 . THR C 1 181 ? 50.906 8.685 3.774 1.00 29.59 ? 176 THR H OG1 1 ATOM 4659 C CG2 . THR C 1 181 ? 50.911 8.432 6.125 1.00 27.99 ? 176 THR H CG2 1 ATOM 4660 N N . LEU C 1 182 ? 48.817 6.107 6.805 1.00 25.34 ? 177 LEU H N 1 ATOM 4661 C CA . LEU C 1 182 ? 48.159 6.206 8.098 1.00 25.73 ? 177 LEU H CA 1 ATOM 4662 C C . LEU C 1 182 ? 49.157 6.015 9.196 1.00 25.01 ? 177 LEU H C 1 ATOM 4663 O O . LEU C 1 182 ? 50.315 5.713 8.938 1.00 24.47 ? 177 LEU H O 1 ATOM 4664 C CB . LEU C 1 182 ? 47.026 5.195 8.217 1.00 25.78 ? 177 LEU H CB 1 ATOM 4665 C CG . LEU C 1 182 ? 47.293 3.686 8.181 1.00 24.77 ? 177 LEU H CG 1 ATOM 4666 C CD1 . LEU C 1 182 ? 47.973 3.198 9.446 1.00 23.94 ? 177 LEU H CD1 1 ATOM 4667 C CD2 . LEU C 1 182 ? 45.960 2.976 8.002 1.00 25.82 ? 177 LEU H CD2 1 ATOM 4668 N N . SER C 1 183 ? 48.695 6.191 10.426 1.00 25.58 ? 178 SER H N 1 ATOM 4669 C CA . SER C 1 183 ? 49.492 5.913 11.600 1.00 24.96 ? 178 SER H CA 1 ATOM 4670 C C . SER C 1 183 ? 48.622 5.235 12.628 1.00 24.81 ? 178 SER H C 1 ATOM 4671 O O . SER C 1 183 ? 47.407 5.244 12.512 1.00 25.61 ? 178 SER H O 1 ATOM 4672 C CB . SER C 1 183 ? 50.089 7.205 12.167 1.00 26.57 ? 178 SER H CB 1 ATOM 4673 O OG . SER C 1 183 ? 49.071 8.179 12.385 1.00 28.84 ? 178 SER H OG 1 ATOM 4674 N N . SER C 1 184 ? 49.274 4.619 13.610 1.00 24.22 ? 179 SER H N 1 ATOM 4675 C CA . SER C 1 184 ? 48.613 3.906 14.689 1.00 24.53 ? 179 SER H CA 1 ATOM 4676 C C . SER C 1 184 ? 49.327 4.252 15.963 1.00 24.81 ? 179 SER H C 1 ATOM 4677 O O . SER C 1 184 ? 50.566 4.240 16.008 1.00 24.46 ? 179 SER H O 1 ATOM 4678 C CB . SER C 1 184 ? 48.724 2.396 14.478 1.00 24.00 ? 179 SER H CB 1 ATOM 4679 O OG . SER C 1 184 ? 48.054 1.699 15.520 1.00 25.17 ? 179 SER H OG 1 ATOM 4680 N N . SER C 1 185 ? 48.571 4.540 17.005 1.00 25.78 ? 180 SER H N 1 ATOM 4681 C CA . SER C 1 185 ? 49.166 4.893 18.272 1.00 26.42 ? 180 SER H CA 1 ATOM 4682 C C . SER C 1 185 ? 48.824 3.836 19.292 1.00 26.79 ? 180 SER H C 1 ATOM 4683 O O . SER C 1 185 ? 47.787 3.182 19.208 1.00 27.37 ? 180 SER H O 1 ATOM 4684 C CB . SER C 1 185 ? 48.709 6.283 18.733 1.00 28.45 ? 180 SER H CB 1 ATOM 4685 O OG . SER C 1 185 ? 47.454 6.282 19.375 1.00 29.89 ? 180 SER H OG 1 ATOM 4686 N N . VAL C 1 186 ? 49.712 3.657 20.251 1.00 26.95 ? 181 VAL H N 1 ATOM 4687 C CA . VAL C 1 186 ? 49.451 2.763 21.358 1.00 28.03 ? 181 VAL H CA 1 ATOM 4688 C C . VAL C 1 186 ? 50.021 3.381 22.619 1.00 29.33 ? 181 VAL H C 1 ATOM 4689 O O . VAL C 1 186 ? 51.108 3.965 22.590 1.00 29.25 ? 181 VAL H O 1 ATOM 4690 C CB . VAL C 1 186 ? 50.024 1.340 21.119 1.00 27.20 ? 181 VAL H CB 1 ATOM 4691 C CG1 . VAL C 1 186 ? 51.536 1.372 20.956 1.00 26.41 ? 181 VAL H CG1 1 ATOM 4692 C CG2 . VAL C 1 186 ? 49.631 0.419 22.250 1.00 28.67 ? 181 VAL H CG2 1 ATOM 4693 N N . THR C 1 187 ? 49.279 3.261 23.713 1.00 31.11 ? 182 THR H N 1 ATOM 4694 C CA . THR C 1 187 ? 49.671 3.841 24.975 1.00 32.97 ? 182 THR H CA 1 ATOM 4695 C C . THR C 1 187 ? 49.877 2.722 25.980 1.00 33.70 ? 182 THR H C 1 ATOM 4696 O O . THR C 1 187 ? 49.032 1.843 26.135 1.00 34.54 ? 182 THR H O 1 ATOM 4697 C CB . THR C 1 187 ? 48.613 4.840 25.457 1.00 35.38 ? 182 THR H CB 1 ATOM 4698 O OG1 . THR C 1 187 ? 48.503 5.878 24.484 1.00 35.68 ? 182 THR H OG1 1 ATOM 4699 C CG2 . THR C 1 187 ? 48.986 5.467 26.770 1.00 37.62 ? 182 THR H CG2 1 ATOM 4700 N N . VAL C 1 188 ? 51.026 2.752 26.636 1.00 34.01 ? 183 VAL H N 1 ATOM 4701 C CA . VAL C 1 188 ? 51.383 1.770 27.656 1.00 35.16 ? 183 VAL H CA 1 ATOM 4702 C C . VAL C 1 188 ? 51.971 2.458 28.894 1.00 36.92 ? 183 VAL H C 1 ATOM 4703 O O . VAL C 1 188 ? 52.394 3.617 28.831 1.00 36.99 ? 183 VAL H O 1 ATOM 4704 C CB . VAL C 1 188 ? 52.422 0.750 27.141 1.00 34.18 ? 183 VAL H CB 1 ATOM 4705 C CG1 . VAL C 1 188 ? 51.826 -0.108 26.042 1.00 33.21 ? 183 VAL H CG1 1 ATOM 4706 C CG2 . VAL C 1 188 ? 53.683 1.454 26.667 1.00 33.43 ? 183 VAL H CG2 1 ATOM 4707 N N . PRO C 1 189 ? 52.005 1.737 30.024 1.00 38.60 ? 184 PRO H N 1 ATOM 4708 C CA . PRO C 1 189 ? 52.635 2.294 31.219 1.00 40.66 ? 184 PRO H CA 1 ATOM 4709 C C . PRO C 1 189 ? 54.105 2.597 30.992 1.00 40.19 ? 184 PRO H C 1 ATOM 4710 O O . PRO C 1 189 ? 54.839 1.759 30.475 1.00 39.18 ? 184 PRO H O 1 ATOM 4711 C CB . PRO C 1 189 ? 52.456 1.191 32.270 1.00 42.40 ? 184 PRO H CB 1 ATOM 4712 C CG . PRO C 1 189 ? 51.307 0.376 31.774 1.00 42.13 ? 184 PRO H CG 1 ATOM 4713 C CD . PRO C 1 189 ? 51.412 0.416 30.281 1.00 39.36 ? 184 PRO H CD 1 ATOM 4714 N N . SER C 1 190 ? 54.513 3.802 31.369 1.00 41.73 ? 185 SER H N 1 ATOM 4715 C CA . SER C 1 190 ? 55.877 4.266 31.189 1.00 42.33 ? 185 SER H CA 1 ATOM 4716 C C . SER C 1 190 ? 56.910 3.297 31.767 1.00 42.93 ? 185 SER H C 1 ATOM 4717 O O . SER C 1 190 ? 57.948 3.060 31.159 1.00 42.44 ? 185 SER H O 1 ATOM 4718 C CB . SER C 1 190 ? 56.029 5.643 31.835 1.00 45.22 ? 185 SER H CB 1 ATOM 4719 O OG . SER C 1 190 ? 57.037 6.397 31.183 1.00 46.20 ? 185 SER H OG 1 ATOM 4720 N N . SER C 1 191 ? 56.607 2.716 32.921 1.00 44.47 ? 186 SER H N 1 ATOM 4721 C CA . SER C 1 191 ? 57.519 1.787 33.597 1.00 45.92 ? 186 SER H CA 1 ATOM 4722 C C . SER C 1 191 ? 57.852 0.540 32.778 1.00 44.47 ? 186 SER H C 1 ATOM 4723 O O . SER C 1 191 ? 58.828 -0.136 33.076 1.00 45.90 ? 186 SER H O 1 ATOM 4724 C CB . SER C 1 191 ? 56.907 1.311 34.909 1.00 47.94 ? 186 SER H CB 1 ATOM 4725 O OG . SER C 1 191 ? 55.639 0.726 34.686 1.00 47.24 ? 186 SER H OG 1 ATOM 4726 N N . THR C 1 192 ? 57.022 0.221 31.789 1.00 42.23 ? 187 THR H N 1 ATOM 4727 C CA . THR C 1 192 ? 57.173 -1.000 31.014 1.00 41.48 ? 187 THR H CA 1 ATOM 4728 C C . THR C 1 192 ? 57.853 -0.853 29.647 1.00 39.58 ? 187 THR H C 1 ATOM 4729 O O . THR C 1 192 ? 58.202 -1.844 29.010 1.00 39.30 ? 187 THR H O 1 ATOM 4730 C CB . THR C 1 192 ? 55.807 -1.697 30.925 1.00 41.42 ? 187 THR H CB 1 ATOM 4731 O OG1 . THR C 1 192 ? 56.027 -3.112 30.930 1.00 43.18 ? 187 THR H OG1 1 ATOM 4732 C CG2 . THR C 1 192 ? 54.964 -1.237 29.725 1.00 38.94 ? 187 THR H CG2 1 ATOM 4733 N N . TRP C 1 193 ? 58.072 0.379 29.205 1.00 38.59 ? 188 TRP H N 1 ATOM 4734 C CA . TRP C 1 193 ? 58.800 0.602 27.970 1.00 37.38 ? 188 TRP H CA 1 ATOM 4735 C C . TRP C 1 193 ? 59.969 1.528 28.275 1.00 38.96 ? 188 TRP H C 1 ATOM 4736 O O . TRP C 1 193 ? 59.794 2.514 28.987 1.00 40.10 ? 188 TRP H O 1 ATOM 4737 C CB . TRP C 1 193 ? 57.888 1.187 26.901 1.00 35.27 ? 188 TRP H CB 1 ATOM 4738 C CG . TRP C 1 193 ? 58.583 1.348 25.582 1.00 34.41 ? 188 TRP H CG 1 ATOM 4739 C CD1 . TRP C 1 193 ? 58.702 0.413 24.587 1.00 33.51 ? 188 TRP H CD1 1 ATOM 4740 C CD2 . TRP C 1 193 ? 59.275 2.509 25.130 1.00 34.93 ? 188 TRP H CD2 1 ATOM 4741 N NE1 . TRP C 1 193 ? 59.444 0.932 23.548 1.00 33.36 ? 188 TRP H NE1 1 ATOM 4742 C CE2 . TRP C 1 193 ? 59.794 2.220 23.856 1.00 34.12 ? 188 TRP H CE2 1 ATOM 4743 C CE3 . TRP C 1 193 ? 59.512 3.771 25.691 1.00 36.68 ? 188 TRP H CE3 1 ATOM 4744 C CZ2 . TRP C 1 193 ? 60.506 3.151 23.119 1.00 34.98 ? 188 TRP H CZ2 1 ATOM 4745 C CZ3 . TRP C 1 193 ? 60.224 4.689 24.972 1.00 37.57 ? 188 TRP H CZ3 1 ATOM 4746 C CH2 . TRP C 1 193 ? 60.715 4.381 23.694 1.00 36.82 ? 188 TRP H CH2 1 ATOM 4747 N N . PRO C 1 194 ? 61.165 1.226 27.737 1.00 39.42 ? 189 PRO H N 1 ATOM 4748 C CA . PRO C 1 194 ? 61.508 0.172 26.779 1.00 38.66 ? 189 PRO H CA 1 ATOM 4749 C C . PRO C 1 194 ? 61.843 -1.202 27.374 1.00 40.22 ? 189 PRO H C 1 ATOM 4750 O O . PRO C 1 194 ? 62.251 -2.095 26.630 1.00 40.39 ? 189 PRO H O 1 ATOM 4751 C CB . PRO C 1 194 ? 62.741 0.744 26.076 1.00 39.86 ? 189 PRO H CB 1 ATOM 4752 C CG . PRO C 1 194 ? 63.399 1.578 27.116 1.00 42.39 ? 189 PRO H CG 1 ATOM 4753 C CD . PRO C 1 194 ? 62.310 2.111 28.007 1.00 41.72 ? 189 PRO H CD 1 ATOM 4754 N N . SER C 1 195 ? 61.681 -1.392 28.679 1.00 41.62 ? 190 SER H N 1 ATOM 4755 C CA . SER C 1 195 ? 62.087 -2.677 29.258 1.00 44.10 ? 190 SER H CA 1 ATOM 4756 C C . SER C 1 195 ? 61.309 -3.853 28.629 1.00 43.47 ? 190 SER H C 1 ATOM 4757 O O . SER C 1 195 ? 61.903 -4.890 28.310 1.00 45.14 ? 190 SER H O 1 ATOM 4758 C CB . SER C 1 195 ? 61.989 -2.675 30.791 1.00 45.98 ? 190 SER H CB 1 ATOM 4759 O OG . SER C 1 195 ? 60.758 -2.149 31.230 1.00 44.75 ? 190 SER H OG 1 ATOM 4760 N N . GLU C 1 196 ? 59.998 -3.675 28.449 1.00 41.52 ? 191 GLU H N 1 ATOM 4761 C CA . GLU C 1 196 ? 59.154 -4.652 27.760 1.00 41.26 ? 191 GLU H CA 1 ATOM 4762 C C . GLU C 1 196 ? 58.906 -4.199 26.318 1.00 38.48 ? 191 GLU H C 1 ATOM 4763 O O . GLU C 1 196 ? 58.521 -3.034 26.075 1.00 36.21 ? 191 GLU H O 1 ATOM 4764 C CB . GLU C 1 196 ? 57.801 -4.801 28.455 1.00 41.64 ? 191 GLU H CB 1 ATOM 4765 C CG . GLU C 1 196 ? 57.824 -5.100 29.948 1.00 44.52 ? 191 GLU H CG 1 ATOM 4766 C CD . GLU C 1 196 ? 58.385 -6.453 30.295 1.00 48.13 ? 191 GLU H CD 1 ATOM 4767 O OE1 . GLU C 1 196 ? 59.376 -6.860 29.647 1.00 49.05 ? 191 GLU H OE1 1 ATOM 4768 O OE2 . GLU C 1 196 ? 57.826 -7.109 31.222 1.00 50.83 ? 191 GLU H OE2 1 ATOM 4769 N N . THR C 1 197 ? 59.100 -5.130 25.378 1.00 38.87 ? 192 THR H N 1 ATOM 4770 C CA . THR C 1 197 ? 59.123 -4.798 23.936 1.00 36.90 ? 192 THR H CA 1 ATOM 4771 C C . THR C 1 197 ? 57.751 -4.421 23.397 1.00 34.54 ? 192 THR H C 1 ATOM 4772 O O . THR C 1 197 ? 56.717 -4.935 23.826 1.00 34.80 ? 192 THR H O 1 ATOM 4773 C CB . THR C 1 197 ? 59.701 -5.900 23.033 1.00 38.68 ? 192 THR H CB 1 ATOM 4774 O OG1 . THR C 1 197 ? 58.877 -7.067 23.082 1.00 40.32 ? 192 THR H OG1 1 ATOM 4775 C CG2 . THR C 1 197 ? 61.135 -6.246 23.421 1.00 41.50 ? 192 THR H CG2 1 ATOM 4776 N N . VAL C 1 198 ? 57.766 -3.510 22.436 1.00 32.55 ? 193 VAL H N 1 ATOM 4777 C CA . VAL C 1 198 ? 56.560 -3.062 21.756 1.00 30.55 ? 193 VAL H CA 1 ATOM 4778 C C . VAL C 1 198 ? 56.829 -3.039 20.256 1.00 29.67 ? 193 VAL H C 1 ATOM 4779 O O . VAL C 1 198 ? 57.718 -2.339 19.788 1.00 29.42 ? 193 VAL H O 1 ATOM 4780 C CB . VAL C 1 198 ? 56.121 -1.672 22.266 1.00 29.41 ? 193 VAL H CB 1 ATOM 4781 C CG1 . VAL C 1 198 ? 55.035 -1.086 21.373 1.00 27.79 ? 193 VAL H CG1 1 ATOM 4782 C CG2 . VAL C 1 198 ? 55.627 -1.760 23.708 1.00 30.40 ? 193 VAL H CG2 1 ATOM 4783 N N . THR C 1 199 ? 56.052 -3.809 19.507 1.00 29.66 ? 194 THR H N 1 ATOM 4784 C CA . THR C 1 199 ? 56.290 -4.013 18.086 1.00 29.38 ? 194 THR H CA 1 ATOM 4785 C C . THR C 1 199 ? 54.984 -3.851 17.337 1.00 28.19 ? 194 THR H C 1 ATOM 4786 O O . THR C 1 199 ? 53.996 -4.494 17.681 1.00 29.43 ? 194 THR H O 1 ATOM 4787 C CB . THR C 1 199 ? 56.820 -5.436 17.838 1.00 31.86 ? 194 THR H CB 1 ATOM 4788 O OG1 . THR C 1 199 ? 57.912 -5.700 18.731 1.00 33.67 ? 194 THR H OG1 1 ATOM 4789 C CG2 . THR C 1 199 ? 57.261 -5.629 16.378 1.00 31.92 ? 194 THR H CG2 1 ATOM 4790 N N . CYS C 1 200 ? 54.960 -3.000 16.329 1.00 26.49 ? 195 CYS H N 1 ATOM 4791 C CA . CYS C 1 200 ? 53.787 -2.912 15.496 1.00 25.95 ? 195 CYS H CA 1 ATOM 4792 C C . CYS C 1 200 ? 53.895 -3.899 14.317 1.00 26.74 ? 195 CYS H C 1 ATOM 4793 O O . CYS C 1 200 ? 54.944 -4.097 13.729 1.00 27.13 ? 195 CYS H O 1 ATOM 4794 C CB . CYS C 1 200 ? 53.541 -1.475 15.038 1.00 24.53 ? 195 CYS H CB 1 ATOM 4795 S SG . CYS C 1 200 ? 54.450 -0.938 13.596 1.00 24.55 ? 195 CYS H SG 1 ATOM 4796 N N . ASN C 1 201 ? 52.786 -4.552 14.022 1.00 27.32 ? 196 ASN H N 1 ATOM 4797 C CA . ASN C 1 201 ? 52.729 -5.512 12.938 1.00 28.70 ? 196 ASN H CA 1 ATOM 4798 C C . ASN C 1 201 ? 51.873 -4.934 11.830 1.00 27.36 ? 196 ASN H C 1 ATOM 4799 O O . ASN C 1 201 ? 50.700 -4.667 12.053 1.00 27.25 ? 196 ASN H O 1 ATOM 4800 C CB . ASN C 1 201 ? 52.134 -6.836 13.439 1.00 31.52 ? 196 ASN H CB 1 ATOM 4801 C CG . ASN C 1 201 ? 52.553 -7.160 14.871 1.00 32.54 ? 196 ASN H CG 1 ATOM 4802 O OD1 . ASN C 1 201 ? 51.735 -7.165 15.801 1.00 32.79 ? 196 ASN H OD1 1 ATOM 4803 N ND2 . ASN C 1 201 ? 53.849 -7.404 15.056 1.00 33.26 ? 196 ASN H ND2 1 ATOM 4804 N N . VAL C 1 202 ? 52.459 -4.735 10.651 1.00 26.81 ? 197 VAL H N 1 ATOM 4805 C CA . VAL C 1 202 ? 51.755 -4.128 9.534 1.00 25.80 ? 197 VAL H CA 1 ATOM 4806 C C . VAL C 1 202 ? 51.631 -5.123 8.400 1.00 27.58 ? 197 VAL H C 1 ATOM 4807 O O . VAL C 1 202 ? 52.616 -5.715 8.001 1.00 28.61 ? 197 VAL H O 1 ATOM 4808 C CB . VAL C 1 202 ? 52.493 -2.862 9.025 1.00 24.04 ? 197 VAL H CB 1 ATOM 4809 C CG1 . VAL C 1 202 ? 51.740 -2.215 7.862 1.00 23.55 ? 197 VAL H CG1 1 ATOM 4810 C CG2 . VAL C 1 202 ? 52.629 -1.865 10.156 1.00 22.74 ? 197 VAL H CG2 1 ATOM 4811 N N . ALA C 1 203 ? 50.413 -5.277 7.886 1.00 28.35 ? 198 ALA H N 1 ATOM 4812 C CA . ALA C 1 203 ? 50.132 -6.141 6.739 1.00 30.67 ? 198 ALA H CA 1 ATOM 4813 C C . ALA C 1 203 ? 49.506 -5.329 5.606 1.00 29.70 ? 198 ALA H C 1 ATOM 4814 O O . ALA C 1 203 ? 48.617 -4.501 5.824 1.00 28.60 ? 198 ALA H O 1 ATOM 4815 C CB . ALA C 1 203 ? 49.206 -7.285 7.139 1.00 33.53 ? 198 ALA H CB 1 ATOM 4816 N N . HIS C 1 204 ? 49.983 -5.581 4.400 1.00 30.58 ? 199 HIS H N 1 ATOM 4817 C CA . HIS C 1 204 ? 49.422 -4.989 3.205 1.00 30.35 ? 199 HIS H CA 1 ATOM 4818 C C . HIS C 1 204 ? 49.211 -6.107 2.185 1.00 33.57 ? 199 HIS H C 1 ATOM 4819 O O . HIS C 1 204 ? 50.063 -6.326 1.324 1.00 34.43 ? 199 HIS H O 1 ATOM 4820 C CB . HIS C 1 204 ? 50.352 -3.922 2.656 1.00 28.50 ? 199 HIS H CB 1 ATOM 4821 C CG . HIS C 1 204 ? 49.778 -3.153 1.504 1.00 28.31 ? 199 HIS H CG 1 ATOM 4822 N ND1 . HIS C 1 204 ? 50.390 -3.087 0.272 1.00 29.11 ? 199 HIS H ND1 1 ATOM 4823 C CD2 . HIS C 1 204 ? 48.649 -2.414 1.400 1.00 27.80 ? 199 HIS H CD2 1 ATOM 4824 C CE1 . HIS C 1 204 ? 49.663 -2.341 -0.542 1.00 28.95 ? 199 HIS H CE1 1 ATOM 4825 N NE2 . HIS C 1 204 ? 48.601 -1.922 0.117 1.00 28.22 ? 199 HIS H NE2 1 ATOM 4826 N N . PRO C 1 205 ? 48.073 -6.822 2.291 1.00 35.87 ? 200 PRO H N 1 ATOM 4827 C CA . PRO C 1 205 ? 47.794 -8.013 1.482 1.00 39.89 ? 200 PRO H CA 1 ATOM 4828 C C . PRO C 1 205 ? 47.973 -7.800 -0.011 1.00 40.56 ? 200 PRO H C 1 ATOM 4829 O O . PRO C 1 205 ? 48.446 -8.703 -0.694 1.00 43.40 ? 200 PRO H O 1 ATOM 4830 C CB . PRO C 1 205 ? 46.327 -8.327 1.805 1.00 41.81 ? 200 PRO H CB 1 ATOM 4831 C CG . PRO C 1 205 ? 46.111 -7.745 3.164 1.00 39.46 ? 200 PRO H CG 1 ATOM 4832 C CD . PRO C 1 205 ? 46.973 -6.518 3.226 1.00 35.38 ? 200 PRO H CD 1 ATOM 4833 N N . ALA C 1 206 ? 47.620 -6.607 -0.496 1.00 38.40 ? 201 ALA H N 1 ATOM 4834 C CA . ALA C 1 206 ? 47.670 -6.301 -1.932 1.00 39.16 ? 201 ALA H CA 1 ATOM 4835 C C . ALA C 1 206 ? 49.059 -6.482 -2.502 1.00 39.53 ? 201 ALA H C 1 ATOM 4836 O O . ALA C 1 206 ? 49.191 -7.030 -3.600 1.00 42.28 ? 201 ALA H O 1 ATOM 4837 C CB . ALA C 1 206 ? 47.168 -4.892 -2.204 1.00 36.78 ? 201 ALA H CB 1 ATOM 4838 N N . SER C 1 207 ? 50.084 -6.043 -1.761 1.00 37.26 ? 202 SER H N 1 ATOM 4839 C CA . SER C 1 207 ? 51.494 -6.238 -2.167 1.00 38.16 ? 202 SER H CA 1 ATOM 4840 C C . SER C 1 207 ? 52.170 -7.441 -1.468 1.00 40.47 ? 202 SER H C 1 ATOM 4841 O O . SER C 1 207 ? 53.381 -7.638 -1.586 1.00 41.33 ? 202 SER H O 1 ATOM 4842 C CB . SER C 1 207 ? 52.312 -4.969 -1.886 1.00 35.29 ? 202 SER H CB 1 ATOM 4843 O OG . SER C 1 207 ? 52.374 -4.664 -0.498 1.00 33.09 ? 202 SER H OG 1 ATOM 4844 N N . SER C 1 208 ? 51.378 -8.224 -0.734 1.00 41.85 ? 203 SER H N 1 ATOM 4845 C CA . SER C 1 208 ? 51.869 -9.364 0.053 1.00 44.55 ? 203 SER H CA 1 ATOM 4846 C C . SER C 1 208 ? 52.998 -8.982 1.017 1.00 42.78 ? 203 SER H C 1 ATOM 4847 O O . SER C 1 208 ? 53.988 -9.698 1.165 1.00 45.17 ? 203 SER H O 1 ATOM 4848 C CB . SER C 1 208 ? 52.305 -10.501 -0.857 1.00 49.29 ? 203 SER H CB 1 ATOM 4849 O OG . SER C 1 208 ? 51.235 -10.852 -1.705 1.00 51.52 ? 203 SER H OG 1 ATOM 4850 N N . THR C 1 209 ? 52.809 -7.857 1.694 1.00 39.06 ? 204 THR H N 1 ATOM 4851 C CA . THR C 1 209 ? 53.812 -7.329 2.615 1.00 37.36 ? 204 THR H CA 1 ATOM 4852 C C . THR C 1 209 ? 53.370 -7.591 4.053 1.00 36.83 ? 204 THR H C 1 ATOM 4853 O O . THR C 1 209 ? 52.202 -7.373 4.399 1.00 35.62 ? 204 THR H O 1 ATOM 4854 C CB . THR C 1 209 ? 54.002 -5.807 2.417 1.00 34.27 ? 204 THR H CB 1 ATOM 4855 O OG1 . THR C 1 209 ? 54.563 -5.536 1.124 1.00 35.32 ? 204 THR H OG1 1 ATOM 4856 C CG2 . THR C 1 209 ? 54.951 -5.235 3.435 1.00 32.96 ? 204 THR H CG2 1 ATOM 4857 N N . LYS C 1 210 ? 54.298 -8.084 4.870 1.00 38.10 ? 205 LYS H N 1 ATOM 4858 C CA . LYS C 1 210 ? 54.138 -8.141 6.318 1.00 37.75 ? 205 LYS H CA 1 ATOM 4859 C C . LYS C 1 210 ? 55.418 -7.558 6.911 1.00 36.80 ? 205 LYS H C 1 ATOM 4860 O O . LYS C 1 210 ? 56.514 -7.998 6.591 1.00 38.92 ? 205 LYS H O 1 ATOM 4861 C CB . LYS C 1 210 ? 53.922 -9.570 6.838 1.00 41.79 ? 205 LYS H CB 1 ATOM 4862 C CG . LYS C 1 210 ? 53.322 -10.552 5.846 1.00 45.51 ? 205 LYS H CG 1 ATOM 4863 C CD . LYS C 1 210 ? 51.860 -10.242 5.565 1.00 44.66 ? 205 LYS H CD 1 ATOM 4864 C CE . LYS C 1 210 ? 51.475 -10.416 4.084 1.00 46.36 ? 205 LYS H CE 1 ATOM 4865 N NZ . LYS C 1 210 ? 51.780 -11.738 3.442 1.00 51.55 ? 205 LYS H NZ 1 ATOM 4866 N N . VAL C 1 211 ? 55.289 -6.543 7.742 1.00 34.18 ? 206 VAL H N 1 ATOM 4867 C CA . VAL C 1 211 ? 56.451 -5.974 8.412 1.00 33.83 ? 206 VAL H CA 1 ATOM 4868 C C . VAL C 1 211 ? 56.168 -5.843 9.907 1.00 32.87 ? 206 VAL H C 1 ATOM 4869 O O . VAL C 1 211 ? 55.079 -5.438 10.315 1.00 31.19 ? 206 VAL H O 1 ATOM 4870 C CB . VAL C 1 211 ? 56.836 -4.590 7.815 1.00 31.97 ? 206 VAL H CB 1 ATOM 4871 C CG1 . VAL C 1 211 ? 57.900 -3.910 8.667 1.00 31.84 ? 206 VAL H CG1 1 ATOM 4872 C CG2 . VAL C 1 211 ? 57.340 -4.744 6.384 1.00 33.41 ? 206 VAL H CG2 1 ATOM 4873 N N . ASP C 1 212 ? 57.156 -6.207 10.709 1.00 34.35 ? 207 ASP H N 1 ATOM 4874 C CA . ASP C 1 212 ? 57.140 -5.948 12.149 1.00 33.85 ? 207 ASP H CA 1 ATOM 4875 C C . ASP C 1 212 ? 58.175 -4.872 12.456 1.00 33.35 ? 207 ASP H C 1 ATOM 4876 O O . ASP C 1 212 ? 59.335 -5.011 12.069 1.00 34.99 ? 207 ASP H O 1 ATOM 4877 C CB . ASP C 1 212 ? 57.493 -7.207 12.932 1.00 36.70 ? 207 ASP H CB 1 ATOM 4878 C CG . ASP C 1 212 ? 56.530 -8.356 12.667 1.00 38.88 ? 207 ASP H CG 1 ATOM 4879 O OD1 . ASP C 1 212 ? 55.298 -8.138 12.726 1.00 37.44 ? 207 ASP H OD1 1 ATOM 4880 O OD2 . ASP C 1 212 ? 56.998 -9.485 12.391 1.00 42.67 ? 207 ASP H OD2 1 ATOM 4881 N N . LYS C 1 213 ? 57.770 -3.805 13.144 1.00 31.60 ? 208 LYS H N 1 ATOM 4882 C CA . LYS C 1 213 ? 58.689 -2.725 13.475 1.00 31.78 ? 208 LYS H CA 1 ATOM 4883 C C . LYS C 1 213 ? 58.744 -2.544 14.996 1.00 31.44 ? 208 LYS H C 1 ATOM 4884 O O . LYS C 1 213 ? 57.771 -2.126 15.632 1.00 29.52 ? 208 LYS H O 1 ATOM 4885 C CB . LYS C 1 213 ? 58.310 -1.418 12.781 1.00 30.74 ? 208 LYS H CB 1 ATOM 4886 C CG . LYS C 1 213 ? 59.500 -0.509 12.538 1.00 32.81 ? 208 LYS H CG 1 ATOM 4887 C CD . LYS C 1 213 ? 60.294 -0.924 11.301 1.00 35.18 ? 208 LYS H CD 1 ATOM 4888 C CE . LYS C 1 213 ? 61.737 -0.489 11.373 1.00 38.35 ? 208 LYS H CE 1 ATOM 4889 N NZ . LYS C 1 213 ? 62.450 -0.966 10.154 1.00 41.40 ? 208 LYS H NZ 1 ATOM 4890 N N . LYS C 1 214 ? 59.897 -2.864 15.568 1.00 33.41 ? 209 LYS H N 1 ATOM 4891 C CA . LYS C 1 214 ? 60.079 -2.747 16.995 1.00 34.24 ? 209 LYS H CA 1 ATOM 4892 C C . LYS C 1 214 ? 60.319 -1.288 17.350 1.00 33.24 ? 209 LYS H C 1 ATOM 4893 O O . LYS C 1 214 ? 61.138 -0.629 16.752 1.00 34.08 ? 209 LYS H O 1 ATOM 4894 C CB . LYS C 1 214 ? 61.237 -3.615 17.456 1.00 37.84 ? 209 LYS H CB 1 ATOM 4895 C CG . LYS C 1 214 ? 61.549 -3.456 18.937 1.00 39.52 ? 209 LYS H CG 1 ATOM 4896 C CD . LYS C 1 214 ? 61.561 -4.764 19.697 1.00 42.02 ? 209 LYS H CD 1 ATOM 4897 C CE . LYS C 1 214 ? 62.962 -5.252 19.878 1.00 45.83 ? 209 LYS H CE 1 ATOM 4898 N NZ . LYS C 1 214 ? 63.586 -5.506 18.566 1.00 47.38 ? 209 LYS H NZ 1 ATOM 4899 N N . ILE C 1 215 ? 59.601 -0.786 18.340 1.00 32.40 ? 210 ILE H N 1 ATOM 4900 C CA . ILE C 1 215 ? 59.722 0.606 18.727 1.00 32.38 ? 210 ILE H CA 1 ATOM 4901 C C . ILE C 1 215 ? 60.813 0.691 19.781 1.00 34.91 ? 210 ILE H C 1 ATOM 4902 O O . ILE C 1 215 ? 60.637 0.240 20.912 1.00 35.77 ? 210 ILE H O 1 ATOM 4903 C CB . ILE C 1 215 ? 58.399 1.195 19.251 1.00 30.93 ? 210 ILE H CB 1 ATOM 4904 C CG1 . ILE C 1 215 ? 57.241 0.856 18.306 1.00 29.26 ? 210 ILE H CG1 1 ATOM 4905 C CG2 . ILE C 1 215 ? 58.507 2.702 19.419 1.00 31.40 ? 210 ILE H CG2 1 ATOM 4906 C CD1 . ILE C 1 215 ? 57.485 1.200 16.851 1.00 28.64 ? 210 ILE H CD1 1 ATOM 4907 N N . VAL C 1 216 ? 61.935 1.271 19.375 1.00 36.72 ? 211 VAL H N 1 ATOM 4908 C CA . VAL C 1 216 ? 63.139 1.342 20.145 1.00 39.69 ? 211 VAL H CA 1 ATOM 4909 C C . VAL C 1 216 ? 63.469 2.816 20.446 1.00 41.16 ? 211 VAL H C 1 ATOM 4910 O O . VAL C 1 216 ? 63.249 3.679 19.606 1.00 40.72 ? 211 VAL H O 1 ATOM 4911 C CB . VAL C 1 216 ? 64.206 0.655 19.268 1.00 41.48 ? 211 VAL H CB 1 ATOM 4912 C CG1 . VAL C 1 216 ? 65.522 1.405 19.211 1.00 44.86 ? 211 VAL H CG1 1 ATOM 4913 C CG2 . VAL C 1 216 ? 64.377 -0.787 19.715 1.00 42.54 ? 211 VAL H CG2 1 ATOM 4914 N N . PRO C 1 217 ? 63.980 3.115 21.655 1.00 43.61 ? 212 PRO H N 1 ATOM 4915 C CA . PRO C 1 217 ? 64.287 4.515 21.981 1.00 45.85 ? 212 PRO H CA 1 ATOM 4916 C C . PRO C 1 217 ? 65.222 5.252 20.977 1.00 48.42 ? 212 PRO H C 1 ATOM 4917 O O . PRO C 1 217 ? 65.938 4.615 20.195 1.00 48.84 ? 212 PRO H O 1 ATOM 4918 C CB . PRO C 1 217 ? 64.918 4.416 23.383 1.00 48.16 ? 212 PRO H CB 1 ATOM 4919 C CG . PRO C 1 217 ? 64.434 3.114 23.943 1.00 46.59 ? 212 PRO H CG 1 ATOM 4920 C CD . PRO C 1 217 ? 64.252 2.194 22.779 1.00 44.63 ? 212 PRO H CD 1 ATOM 4921 N N . ARG C 1 218 ? 65.143 6.591 21.005 1.00 50.78 ? 213 ARG H N 1 ATOM 4922 C CA . ARG C 1 218 ? 66.064 7.590 20.337 1.00 54.62 ? 213 ARG H CA 1 ATOM 4923 C C . ARG C 1 218 ? 65.402 8.307 19.152 1.00 53.44 ? 213 ARG H C 1 ATOM 4924 O O . ARG C 1 218 ? 64.198 8.583 19.163 1.00 51.05 ? 213 ARG H O 1 ATOM 4925 C CB . ARG C 1 218 ? 67.456 7.040 19.939 1.00 57.55 ? 213 ARG H CB 1 ATOM 4926 C CG . ARG C 1 218 ? 67.644 6.683 18.454 1.00 57.26 ? 213 ARG H CG 1 ATOM 4927 C CD . ARG C 1 218 ? 69.074 6.329 18.065 1.00 61.17 ? 213 ARG H CD 1 ATOM 4928 N NE . ARG C 1 218 ? 70.073 6.999 18.892 1.00 66.22 ? 213 ARG H NE 1 ATOM 4929 C CZ . ARG C 1 218 ? 70.536 8.239 18.711 1.00 70.20 ? 213 ARG H CZ 1 ATOM 4930 N NH1 . ARG C 1 218 ? 71.448 8.730 19.542 1.00 74.71 ? 213 ARG H NH1 1 ATOM 4931 N NH2 . ARG C 1 218 ? 70.095 8.998 17.709 1.00 70.15 ? 213 ARG H NH2 1 ATOM 4932 N N . ASP D 2 1 ? 64.751 -29.758 47.247 1.00 55.38 ? 1 ASP C N 1 ATOM 4933 C CA . ASP D 2 1 ? 64.029 -28.463 47.034 1.00 51.90 ? 1 ASP C CA 1 ATOM 4934 C C . ASP D 2 1 ? 64.387 -27.445 48.107 1.00 51.35 ? 1 ASP C C 1 ATOM 4935 O O . ASP D 2 1 ? 64.670 -27.801 49.240 1.00 53.38 ? 1 ASP C O 1 ATOM 4936 C CB . ASP D 2 1 ? 62.511 -28.660 47.115 1.00 51.06 ? 1 ASP C CB 1 ATOM 4937 C CG . ASP D 2 1 ? 61.984 -29.729 46.146 1.00 51.88 ? 1 ASP C CG 1 ATOM 4938 O OD1 . ASP D 2 1 ? 62.771 -30.486 45.533 1.00 53.48 ? 1 ASP C OD1 1 ATOM 4939 O OD2 . ASP D 2 1 ? 60.754 -29.829 46.020 1.00 51.36 ? 1 ASP C OD2 1 ATOM 4940 N N . ILE D 2 2 ? 64.278 -26.174 47.759 1.00 48.74 ? 2 ILE C N 1 ATOM 4941 C CA . ILE D 2 2 ? 64.481 -25.086 48.705 1.00 48.29 ? 2 ILE C CA 1 ATOM 4942 C C . ILE D 2 2 ? 63.239 -24.855 49.559 1.00 47.65 ? 2 ILE C C 1 ATOM 4943 O O . ILE D 2 2 ? 62.161 -24.508 49.073 1.00 46.20 ? 2 ILE C O 1 ATOM 4944 C CB . ILE D 2 2 ? 64.867 -23.783 47.982 1.00 46.00 ? 2 ILE C CB 1 ATOM 4945 C CG1 . ILE D 2 2 ? 66.227 -23.971 47.332 1.00 47.08 ? 2 ILE C CG1 1 ATOM 4946 C CG2 . ILE D 2 2 ? 64.915 -22.588 48.925 1.00 45.44 ? 2 ILE C CG2 1 ATOM 4947 C CD1 . ILE D 2 2 ? 66.161 -24.636 45.977 1.00 46.81 ? 2 ILE C CD1 1 ATOM 4948 N N . LEU D 2 3 ? 63.416 -25.042 50.850 1.00 49.38 ? 3 LEU C N 1 ATOM 4949 C CA . LEU D 2 3 ? 62.352 -24.813 51.805 1.00 49.23 ? 3 LEU C CA 1 ATOM 4950 C C . LEU D 2 3 ? 62.313 -23.334 52.131 1.00 47.37 ? 3 LEU C C 1 ATOM 4951 O O . LEU D 2 3 ? 63.332 -22.722 52.421 1.00 48.20 ? 3 LEU C O 1 ATOM 4952 C CB . LEU D 2 3 ? 62.605 -25.634 53.075 1.00 52.46 ? 3 LEU C CB 1 ATOM 4953 C CG . LEU D 2 3 ? 61.644 -25.550 54.260 1.00 53.34 ? 3 LEU C CG 1 ATOM 4954 C CD1 . LEU D 2 3 ? 60.209 -25.802 53.824 1.00 51.98 ? 3 LEU C CD1 1 ATOM 4955 C CD2 . LEU D 2 3 ? 62.045 -26.500 55.392 1.00 57.06 ? 3 LEU C CD2 1 ATOM 4956 N N . MET D 2 4 ? 61.131 -22.760 52.049 1.00 45.48 ? 4 MET C N 1 ATOM 4957 C CA . MET D 2 4 ? 60.904 -21.384 52.441 1.00 44.10 ? 4 MET C CA 1 ATOM 4958 C C . MET D 2 4 ? 60.106 -21.384 53.739 1.00 45.16 ? 4 MET C C 1 ATOM 4959 O O . MET D 2 4 ? 58.961 -21.795 53.760 1.00 44.57 ? 4 MET C O 1 ATOM 4960 C CB . MET D 2 4 ? 60.103 -20.683 51.356 1.00 41.57 ? 4 MET C CB 1 ATOM 4961 C CG . MET D 2 4 ? 60.743 -20.749 49.987 1.00 40.77 ? 4 MET C CG 1 ATOM 4962 S SD . MET D 2 4 ? 62.215 -19.721 49.945 1.00 41.20 ? 4 MET C SD 1 ATOM 4963 C CE . MET D 2 4 ? 61.468 -18.118 49.682 1.00 39.07 ? 4 MET C CE 1 ATOM 4964 N N . ASN D 2 5 ? 60.724 -20.939 54.820 1.00 46.62 ? 5 ASN C N 1 ATOM 4965 C CA . ASN D 2 5 ? 60.092 -20.878 56.139 1.00 48.14 ? 5 ASN C CA 1 ATOM 4966 C C . ASN D 2 5 ? 59.605 -19.486 56.469 1.00 46.40 ? 5 ASN C C 1 ATOM 4967 O O . ASN D 2 5 ? 60.387 -18.546 56.597 1.00 46.56 ? 5 ASN C O 1 ATOM 4968 C CB . ASN D 2 5 ? 61.079 -21.361 57.196 1.00 51.62 ? 5 ASN C CB 1 ATOM 4969 C CG . ASN D 2 5 ? 61.763 -22.637 56.772 1.00 53.70 ? 5 ASN C CG 1 ATOM 4970 O OD1 . ASN D 2 5 ? 61.146 -23.698 56.815 1.00 55.16 ? 5 ASN C OD1 1 ATOM 4971 N ND2 . ASN D 2 5 ? 63.019 -22.534 56.278 1.00 54.45 ? 5 ASN C ND2 1 ATOM 4972 N N . GLN D 2 6 ? 58.297 -19.367 56.615 1.00 45.23 ? 6 GLN C N 1 ATOM 4973 C CA . GLN D 2 6 ? 57.680 -18.097 56.867 1.00 44.18 ? 6 GLN C CA 1 ATOM 4974 C C . GLN D 2 6 ? 57.330 -18.036 58.342 1.00 46.19 ? 6 GLN C C 1 ATOM 4975 O O . GLN D 2 6 ? 56.899 -19.024 58.912 1.00 47.95 ? 6 GLN C O 1 ATOM 4976 C CB . GLN D 2 6 ? 56.431 -17.995 56.002 1.00 42.40 ? 6 GLN C CB 1 ATOM 4977 C CG . GLN D 2 6 ? 56.318 -16.705 55.233 1.00 40.38 ? 6 GLN C CG 1 ATOM 4978 C CD . GLN D 2 6 ? 55.163 -16.743 54.262 1.00 38.88 ? 6 GLN C CD 1 ATOM 4979 O OE1 . GLN D 2 6 ? 55.115 -17.561 53.329 1.00 38.00 ? 6 GLN C OE1 1 ATOM 4980 N NE2 . GLN D 2 6 ? 54.199 -15.879 54.493 1.00 38.74 ? 6 GLN C NE2 1 ATOM 4981 N N . THR D 2 7 ? 57.564 -16.895 58.971 1.00 46.46 ? 7 THR C N 1 ATOM 4982 C CA . THR D 2 7 ? 57.155 -16.693 60.354 1.00 48.51 ? 7 THR C CA 1 ATOM 4983 C C . THR D 2 7 ? 56.722 -15.242 60.551 1.00 47.61 ? 7 THR C C 1 ATOM 4984 O O . THR D 2 7 ? 57.277 -14.335 59.914 1.00 46.08 ? 7 THR C O 1 ATOM 4985 C CB . THR D 2 7 ? 58.277 -16.992 61.368 1.00 51.48 ? 7 THR C CB 1 ATOM 4986 O OG1 . THR D 2 7 ? 59.423 -16.185 61.077 1.00 51.26 ? 7 THR C OG1 1 ATOM 4987 C CG2 . THR D 2 7 ? 58.646 -18.477 61.364 1.00 53.07 ? 7 THR C CG2 1 ATOM 4988 N N . PRO D 2 8 ? 55.724 -15.018 61.428 1.00 48.34 ? 8 PRO C N 1 ATOM 4989 C CA . PRO D 2 8 ? 54.969 -16.043 62.156 1.00 49.70 ? 8 PRO C CA 1 ATOM 4990 C C . PRO D 2 8 ? 53.937 -16.742 61.263 1.00 48.08 ? 8 PRO C C 1 ATOM 4991 O O . PRO D 2 8 ? 53.752 -16.347 60.108 1.00 45.53 ? 8 PRO C O 1 ATOM 4992 C CB . PRO D 2 8 ? 54.278 -15.243 63.257 1.00 50.94 ? 8 PRO C CB 1 ATOM 4993 C CG . PRO D 2 8 ? 54.072 -13.901 62.649 1.00 49.21 ? 8 PRO C CG 1 ATOM 4994 C CD . PRO D 2 8 ? 55.282 -13.659 61.787 1.00 48.11 ? 8 PRO C CD 1 ATOM 4995 N N . LEU D 2 9 ? 53.284 -17.773 61.801 1.00 49.57 ? 9 LEU C N 1 ATOM 4996 C CA . LEU D 2 9 ? 52.246 -18.515 61.080 1.00 48.99 ? 9 LEU C CA 1 ATOM 4997 C C . LEU D 2 9 ? 50.969 -17.669 61.005 1.00 47.62 ? 9 LEU C C 1 ATOM 4998 O O . LEU D 2 9 ? 50.299 -17.630 59.967 1.00 45.33 ? 9 LEU C O 1 ATOM 4999 C CB . LEU D 2 9 ? 51.970 -19.852 61.779 1.00 51.91 ? 9 LEU C CB 1 ATOM 5000 C CG . LEU D 2 9 ? 51.342 -21.016 60.957 1.00 52.31 ? 9 LEU C CG 1 ATOM 5001 C CD1 . LEU D 2 9 ? 51.643 -22.407 61.546 1.00 55.25 ? 9 LEU C CD1 1 ATOM 5002 C CD2 . LEU D 2 9 ? 49.830 -20.853 60.813 1.00 51.99 ? 9 LEU C CD2 1 ATOM 5003 N N . SER D 2 10 ? 50.644 -17.006 62.119 1.00 48.68 ? 10 SER C N 1 ATOM 5004 C CA . SER D 2 10 ? 49.582 -16.002 62.146 1.00 47.88 ? 10 SER C CA 1 ATOM 5005 C C . SER D 2 10 ? 50.057 -14.791 62.904 1.00 48.26 ? 10 SER C C 1 ATOM 5006 O O . SER D 2 10 ? 50.837 -14.919 63.842 1.00 50.47 ? 10 SER C O 1 ATOM 5007 C CB . SER D 2 10 ? 48.328 -16.554 62.797 1.00 49.43 ? 10 SER C CB 1 ATOM 5008 O OG . SER D 2 10 ? 48.652 -17.145 64.028 1.00 51.79 ? 10 SER C OG 1 ATOM 5009 N N . LEU D 2 11 ? 49.592 -13.623 62.476 1.00 46.75 ? 11 LEU C N 1 ATOM 5010 C CA . LEU D 2 11 ? 50.005 -12.360 63.064 1.00 47.19 ? 11 LEU C CA 1 ATOM 5011 C C . LEU D 2 11 ? 48.790 -11.492 63.386 1.00 47.57 ? 11 LEU C C 1 ATOM 5012 O O . LEU D 2 11 ? 48.280 -10.772 62.521 1.00 46.59 ? 11 LEU C O 1 ATOM 5013 C CB . LEU D 2 11 ? 50.942 -11.621 62.112 1.00 45.53 ? 11 LEU C CB 1 ATOM 5014 C CG . LEU D 2 11 ? 51.473 -10.265 62.590 1.00 46.34 ? 11 LEU C CG 1 ATOM 5015 C CD1 . LEU D 2 11 ? 52.121 -10.330 63.964 1.00 48.96 ? 11 LEU C CD1 1 ATOM 5016 C CD2 . LEU D 2 11 ? 52.457 -9.739 61.563 1.00 44.89 ? 11 LEU C CD2 1 ATOM 5017 N N . PRO D 2 12 ? 48.301 -11.576 64.620 1.00 49.36 ? 12 PRO C N 1 ATOM 5018 C CA . PRO D 2 12 ? 47.218 -10.700 65.052 1.00 50.05 ? 12 PRO C CA 1 ATOM 5019 C C . PRO D 2 12 ? 47.678 -9.246 65.066 1.00 49.73 ? 12 PRO C C 1 ATOM 5020 O O . PRO D 2 12 ? 48.727 -8.956 65.609 1.00 50.71 ? 12 PRO C O 1 ATOM 5021 C CB . PRO D 2 12 ? 46.896 -11.200 66.477 1.00 52.77 ? 12 PRO C CB 1 ATOM 5022 C CG . PRO D 2 12 ? 47.482 -12.568 66.560 1.00 53.16 ? 12 PRO C CG 1 ATOM 5023 C CD . PRO D 2 12 ? 48.657 -12.582 65.630 1.00 51.36 ? 12 PRO C CD 1 ATOM 5024 N N . VAL D 2 13 ? 46.919 -8.350 64.450 1.00 48.64 ? 13 VAL C N 1 ATOM 5025 C CA . VAL D 2 13 ? 47.221 -6.924 64.537 1.00 49.12 ? 13 VAL C CA 1 ATOM 5026 C C . VAL D 2 13 ? 45.973 -6.087 64.707 1.00 50.09 ? 13 VAL C C 1 ATOM 5027 O O . VAL D 2 13 ? 44.894 -6.481 64.275 1.00 49.54 ? 13 VAL C O 1 ATOM 5028 C CB . VAL D 2 13 ? 47.940 -6.397 63.282 1.00 47.20 ? 13 VAL C CB 1 ATOM 5029 C CG1 . VAL D 2 13 ? 49.361 -6.914 63.226 1.00 46.68 ? 13 VAL C CG1 1 ATOM 5030 C CG2 . VAL D 2 13 ? 47.183 -6.774 62.019 1.00 45.26 ? 13 VAL C CG2 1 ATOM 5031 N N . SER D 2 14 ? 46.131 -4.936 65.357 1.00 51.77 ? 14 SER C N 1 ATOM 5032 C CA . SER D 2 14 ? 45.094 -3.916 65.379 1.00 52.74 ? 14 SER C CA 1 ATOM 5033 C C . SER D 2 14 ? 45.316 -3.047 64.157 1.00 51.40 ? 14 SER C C 1 ATOM 5034 O O . SER D 2 14 ? 46.425 -3.004 63.622 1.00 50.15 ? 14 SER C O 1 ATOM 5035 C CB . SER D 2 14 ? 45.189 -3.071 66.647 1.00 55.51 ? 14 SER C CB 1 ATOM 5036 O OG . SER D 2 14 ? 45.126 -3.903 67.785 1.00 56.84 ? 14 SER C OG 1 ATOM 5037 N N . LEU D 2 15 ? 44.258 -2.377 63.704 1.00 51.78 ? 15 LEU C N 1 ATOM 5038 C CA . LEU D 2 15 ? 44.381 -1.407 62.620 1.00 51.19 ? 15 LEU C CA 1 ATOM 5039 C C . LEU D 2 15 ? 45.274 -0.255 63.069 1.00 52.95 ? 15 LEU C C 1 ATOM 5040 O O . LEU D 2 15 ? 45.207 0.190 64.210 1.00 55.34 ? 15 LEU C O 1 ATOM 5041 C CB . LEU D 2 15 ? 43.011 -0.885 62.194 1.00 51.92 ? 15 LEU C CB 1 ATOM 5042 C CG . LEU D 2 15 ? 42.021 -1.943 61.700 1.00 50.75 ? 15 LEU C CG 1 ATOM 5043 C CD1 . LEU D 2 15 ? 40.685 -1.312 61.331 1.00 52.11 ? 15 LEU C CD1 1 ATOM 5044 C CD2 . LEU D 2 15 ? 42.577 -2.710 60.516 1.00 48.12 ? 15 LEU C CD2 1 ATOM 5045 N N . GLY D 2 16 ? 46.129 0.206 62.169 1.00 52.15 ? 16 GLY C N 1 ATOM 5046 C CA . GLY D 2 16 ? 47.112 1.226 62.500 1.00 53.81 ? 16 GLY C CA 1 ATOM 5047 C C . GLY D 2 16 ? 48.484 0.666 62.849 1.00 53.43 ? 16 GLY C C 1 ATOM 5048 O O . GLY D 2 16 ? 49.475 1.386 62.753 1.00 54.03 ? 16 GLY C O 1 ATOM 5049 N N . ASP D 2 17 ? 48.546 -0.610 63.256 1.00 52.68 ? 17 ASP C N 1 ATOM 5050 C CA . ASP D 2 17 ? 49.811 -1.224 63.685 1.00 52.77 ? 17 ASP C CA 1 ATOM 5051 C C . ASP D 2 17 ? 50.773 -1.354 62.517 1.00 51.07 ? 17 ASP C C 1 ATOM 5052 O O . ASP D 2 17 ? 50.370 -1.361 61.367 1.00 49.31 ? 17 ASP C O 1 ATOM 5053 C CB . ASP D 2 17 ? 49.594 -2.620 64.327 1.00 52.25 ? 17 ASP C CB 1 ATOM 5054 C CG . ASP D 2 17 ? 49.171 -2.546 65.790 1.00 54.83 ? 17 ASP C CG 1 ATOM 5055 O OD1 . ASP D 2 17 ? 49.477 -1.538 66.462 1.00 57.05 ? 17 ASP C OD1 1 ATOM 5056 O OD2 . ASP D 2 17 ? 48.566 -3.523 66.280 1.00 54.81 ? 17 ASP C OD2 1 ATOM 5057 N N . GLN D 2 18 ? 52.054 -1.432 62.843 1.00 51.99 ? 18 GLN C N 1 ATOM 5058 C CA . GLN D 2 18 ? 53.048 -1.919 61.925 1.00 50.46 ? 18 GLN C CA 1 ATOM 5059 C C . GLN D 2 18 ? 52.943 -3.425 61.905 1.00 49.04 ? 18 GLN C C 1 ATOM 5060 O O . GLN D 2 18 ? 52.446 -4.012 62.852 1.00 50.04 ? 18 GLN C O 1 ATOM 5061 C CB . GLN D 2 18 ? 54.431 -1.533 62.420 1.00 52.32 ? 18 GLN C CB 1 ATOM 5062 C CG . GLN D 2 18 ? 54.552 -0.066 62.770 1.00 54.87 ? 18 GLN C CG 1 ATOM 5063 C CD . GLN D 2 18 ? 55.985 0.459 62.673 1.00 56.24 ? 18 GLN C CD 1 ATOM 5064 O OE1 . GLN D 2 18 ? 56.581 0.839 63.678 1.00 58.62 ? 18 GLN C OE1 1 ATOM 5065 N NE2 . GLN D 2 18 ? 56.556 0.443 61.465 1.00 54.87 ? 18 GLN C NE2 1 ATOM 5066 N N . ALA D 2 19 ? 53.411 -4.056 60.837 1.00 47.29 ? 19 ALA C N 1 ATOM 5067 C CA . ALA D 2 19 ? 53.469 -5.508 60.780 1.00 46.40 ? 19 ALA C CA 1 ATOM 5068 C C . ALA D 2 19 ? 54.718 -5.949 60.036 1.00 46.04 ? 19 ALA C C 1 ATOM 5069 O O . ALA D 2 19 ? 55.138 -5.308 59.064 1.00 45.25 ? 19 ALA C O 1 ATOM 5070 C CB . ALA D 2 19 ? 52.231 -6.052 60.102 1.00 44.75 ? 19 ALA C CB 1 ATOM 5071 N N . SER D 2 20 ? 55.310 -7.048 60.495 1.00 46.88 ? 20 SER C N 1 ATOM 5072 C CA . SER D 2 20 ? 56.542 -7.560 59.915 1.00 46.82 ? 20 SER C CA 1 ATOM 5073 C C . SER D 2 20 ? 56.472 -9.063 59.718 1.00 46.33 ? 20 SER C C 1 ATOM 5074 O O . SER D 2 20 ? 56.222 -9.806 60.652 1.00 47.99 ? 20 SER C O 1 ATOM 5075 C CB . SER D 2 20 ? 57.721 -7.205 60.803 1.00 49.04 ? 20 SER C CB 1 ATOM 5076 O OG . SER D 2 20 ? 58.874 -7.148 59.986 1.00 48.68 ? 20 SER C OG 1 ATOM 5077 N N . ILE D 2 21 ? 56.681 -9.502 58.491 1.00 45.08 ? 21 ILE C N 1 ATOM 5078 C CA . ILE D 2 21 ? 56.602 -10.908 58.156 1.00 44.85 ? 21 ILE C CA 1 ATOM 5079 C C . ILE D 2 21 ? 57.971 -11.304 57.668 1.00 45.11 ? 21 ILE C C 1 ATOM 5080 O O . ILE D 2 21 ? 58.589 -10.584 56.889 1.00 44.37 ? 21 ILE C O 1 ATOM 5081 C CB . ILE D 2 21 ? 55.561 -11.156 57.052 1.00 43.26 ? 21 ILE C CB 1 ATOM 5082 C CG1 . ILE D 2 21 ? 54.168 -10.794 57.568 1.00 43.52 ? 21 ILE C CG1 1 ATOM 5083 C CG2 . ILE D 2 21 ? 55.587 -12.616 56.598 1.00 43.07 ? 21 ILE C CG2 1 ATOM 5084 C CD1 . ILE D 2 21 ? 53.082 -10.862 56.520 1.00 41.92 ? 21 ILE C CD1 1 ATOM 5085 N N . SER D 2 22 ? 58.445 -12.449 58.133 1.00 46.53 ? 22 SER C N 1 ATOM 5086 C CA . SER D 2 22 ? 59.765 -12.923 57.768 1.00 47.34 ? 22 SER C CA 1 ATOM 5087 C C . SER D 2 22 ? 59.649 -14.129 56.829 1.00 46.52 ? 22 SER C C 1 ATOM 5088 O O . SER D 2 22 ? 58.660 -14.850 56.838 1.00 45.80 ? 22 SER C O 1 ATOM 5089 C CB . SER D 2 22 ? 60.562 -13.242 59.032 1.00 49.96 ? 22 SER C CB 1 ATOM 5090 O OG . SER D 2 22 ? 61.512 -14.243 58.769 1.00 51.04 ? 22 SER C OG 1 ATOM 5091 N N . CYS D 2 23 ? 60.654 -14.296 55.982 1.00 46.73 ? 23 CYS C N 1 ATOM 5092 C CA . CYS D 2 23 ? 60.771 -15.456 55.129 1.00 46.50 ? 23 CYS C CA 1 ATOM 5093 C C . CYS D 2 23 ? 62.238 -15.881 55.042 1.00 47.54 ? 23 CYS C C 1 ATOM 5094 O O . CYS D 2 23 ? 63.093 -15.085 54.658 1.00 46.95 ? 23 CYS C O 1 ATOM 5095 C CB . CYS D 2 23 ? 60.234 -15.120 53.746 1.00 44.63 ? 23 CYS C CB 1 ATOM 5096 S SG . CYS D 2 23 ? 60.424 -16.445 52.526 1.00 45.22 ? 23 CYS C SG 1 ATOM 5097 N N . ARG D 2 24 ? 62.506 -17.137 55.399 1.00 49.23 ? 24 ARG C N 1 ATOM 5098 C CA . ARG D 2 24 ? 63.843 -17.717 55.359 1.00 51.03 ? 24 ARG C CA 1 ATOM 5099 C C . ARG D 2 24 ? 63.961 -18.906 54.402 1.00 49.87 ? 24 ARG C C 1 ATOM 5100 O O . ARG D 2 24 ? 63.244 -19.898 54.542 1.00 50.05 ? 24 ARG C O 1 ATOM 5101 C CB . ARG D 2 24 ? 64.202 -18.243 56.737 1.00 54.91 ? 24 ARG C CB 1 ATOM 5102 C CG . ARG D 2 24 ? 64.781 -17.250 57.705 1.00 57.39 ? 24 ARG C CG 1 ATOM 5103 C CD . ARG D 2 24 ? 65.737 -18.062 58.578 1.00 61.88 ? 24 ARG C CD 1 ATOM 5104 N NE . ARG D 2 24 ? 65.020 -19.195 59.203 1.00 64.15 ? 24 ARG C NE 1 ATOM 5105 C CZ . ARG D 2 24 ? 65.354 -19.850 60.320 1.00 67.85 ? 24 ARG C CZ 1 ATOM 5106 N NH1 . ARG D 2 24 ? 64.578 -20.855 60.742 1.00 68.74 ? 24 ARG C NH1 1 ATOM 5107 N NH2 . ARG D 2 24 ? 66.434 -19.521 61.023 1.00 70.19 ? 24 ARG C NH2 1 ATOM 5108 N N . SER D 2 25 ? 64.917 -18.835 53.483 1.00 48.67 ? 25 SER C N 1 ATOM 5109 C CA . SER D 2 25 ? 65.177 -19.928 52.551 1.00 48.17 ? 25 SER C CA 1 ATOM 5110 C C . SER D 2 25 ? 66.285 -20.843 53.065 1.00 50.52 ? 25 SER C C 1 ATOM 5111 O O . SER D 2 25 ? 67.176 -20.398 53.754 1.00 51.88 ? 25 SER C O 1 ATOM 5112 C CB . SER D 2 25 ? 65.586 -19.357 51.197 1.00 46.36 ? 25 SER C CB 1 ATOM 5113 O OG . SER D 2 25 ? 66.701 -18.496 51.346 1.00 47.65 ? 25 SER C OG 1 ATOM 5114 N N . SER D 2 26 ? 66.235 -22.112 52.679 1.00 50.95 ? 26 SER C N 1 ATOM 5115 C CA . SER D 2 26 ? 67.212 -23.107 53.102 1.00 53.80 ? 26 SER C CA 1 ATOM 5116 C C . SER D 2 26 ? 68.517 -22.992 52.320 1.00 54.33 ? 26 SER C C 1 ATOM 5117 O O . SER D 2 26 ? 69.468 -23.715 52.608 1.00 57.26 ? 26 SER C O 1 ATOM 5118 C CB . SER D 2 26 ? 66.661 -24.515 52.895 1.00 54.68 ? 26 SER C CB 1 ATOM 5119 O OG . SER D 2 26 ? 66.294 -24.710 51.539 1.00 52.50 ? 26 SER C OG 1 ATOM 5120 N N . GLN D 2 27 ? 68.542 -22.128 51.308 1.00 51.61 ? 27 GLN C N 1 ATOM 5121 C CA . GLN D 2 27 ? 69.785 -21.778 50.604 1.00 52.06 ? 27 GLN C CA 1 ATOM 5122 C C . GLN D 2 27 ? 69.722 -20.403 49.942 1.00 49.09 ? 27 GLN C C 1 ATOM 5123 O O . GLN D 2 27 ? 68.648 -19.877 49.639 1.00 46.69 ? 27 GLN C O 1 ATOM 5124 C CB . GLN D 2 27 ? 70.184 -22.820 49.552 1.00 53.08 ? 27 GLN C CB 1 ATOM 5125 C CG . GLN D 2 27 ? 69.061 -23.428 48.752 1.00 51.79 ? 27 GLN C CG 1 ATOM 5126 C CD . GLN D 2 27 ? 69.604 -24.386 47.708 1.00 53.37 ? 27 GLN C CD 1 ATOM 5127 O OE1 . GLN D 2 27 ? 70.264 -23.965 46.745 1.00 53.31 ? 27 GLN C OE1 1 ATOM 5128 N NE2 . GLN D 2 27 ? 69.340 -25.682 47.890 1.00 55.33 ? 27 GLN C NE2 1 ATOM 5129 N N . TYR D 2 28 A 70.899 -19.857 49.692 1.00 49.31 ? 27 TYR C N 1 ATOM 5130 C CA . TYR D 2 28 A 71.052 -18.509 49.168 1.00 47.55 ? 27 TYR C CA 1 ATOM 5131 C C . TYR D 2 28 A 70.240 -18.351 47.880 1.00 44.92 ? 27 TYR C C 1 ATOM 5132 O O . TYR D 2 28 A 70.348 -19.164 46.959 1.00 44.77 ? 27 TYR C O 1 ATOM 5133 C CB . TYR D 2 28 A 72.548 -18.204 48.917 1.00 49.48 ? 27 TYR C CB 1 ATOM 5134 C CG . TYR D 2 28 A 72.890 -16.725 48.856 1.00 49.09 ? 27 TYR C CG 1 ATOM 5135 C CD1 . TYR D 2 28 A 72.565 -15.961 47.744 1.00 46.95 ? 27 TYR C CD1 1 ATOM 5136 C CD2 . TYR D 2 28 A 73.541 -16.091 49.908 1.00 51.47 ? 27 TYR C CD2 1 ATOM 5137 C CE1 . TYR D 2 28 A 72.867 -14.615 47.676 1.00 46.90 ? 27 TYR C CE1 1 ATOM 5138 C CE2 . TYR D 2 28 A 73.850 -14.734 49.844 1.00 51.52 ? 27 TYR C CE2 1 ATOM 5139 C CZ . TYR D 2 28 A 73.496 -14.006 48.714 1.00 49.18 ? 27 TYR C CZ 1 ATOM 5140 O OH . TYR D 2 28 A 73.763 -12.667 48.590 1.00 49.58 ? 27 TYR C OH 1 ATOM 5141 N N . ILE D 2 29 B 69.396 -17.321 47.840 1.00 42.95 ? 27 ILE C N 1 ATOM 5142 C CA . ILE D 2 29 B 68.623 -16.994 46.647 1.00 40.42 ? 27 ILE C CA 1 ATOM 5143 C C . ILE D 2 29 B 69.496 -16.212 45.657 1.00 40.39 ? 27 ILE C C 1 ATOM 5144 O O . ILE D 2 29 B 69.666 -14.998 45.775 1.00 40.53 ? 27 ILE C O 1 ATOM 5145 C CB . ILE D 2 29 B 67.347 -16.194 47.008 1.00 38.74 ? 27 ILE C CB 1 ATOM 5146 C CG1 . ILE D 2 29 B 66.464 -16.996 47.974 1.00 38.88 ? 27 ILE C CG1 1 ATOM 5147 C CG2 . ILE D 2 29 B 66.534 -15.854 45.766 1.00 36.71 ? 27 ILE C CG2 1 ATOM 5148 C CD1 . ILE D 2 29 B 66.072 -18.379 47.486 1.00 38.58 ? 27 ILE C CD1 1 ATOM 5149 N N . VAL D 2 30 C 70.041 -16.932 44.682 1.00 40.49 ? 27 VAL C N 1 ATOM 5150 C CA . VAL D 2 30 C 71.006 -16.370 43.744 1.00 40.72 ? 27 VAL C CA 1 ATOM 5151 C C . VAL D 2 30 C 70.301 -15.714 42.565 1.00 38.66 ? 27 VAL C C 1 ATOM 5152 O O . VAL D 2 30 C 69.138 -16.003 42.263 1.00 37.15 ? 27 VAL C O 1 ATOM 5153 C CB . VAL D 2 30 C 72.008 -17.430 43.231 1.00 42.31 ? 27 VAL C CB 1 ATOM 5154 C CG1 . VAL D 2 30 C 72.701 -18.117 44.394 1.00 44.87 ? 27 VAL C CG1 1 ATOM 5155 C CG2 . VAL D 2 30 C 71.347 -18.455 42.322 1.00 41.39 ? 27 VAL C CG2 1 ATOM 5156 N N . HIS D 2 31 D 71.011 -14.844 41.876 1.00 38.84 ? 27 HIS C N 1 ATOM 5157 C CA . HIS D 2 31 D 70.427 -14.164 40.733 1.00 37.24 ? 27 HIS C CA 1 ATOM 5158 C C . HIS D 2 31 D 70.302 -15.131 39.553 1.00 36.69 ? 27 HIS C C 1 ATOM 5159 O O . HIS D 2 31 D 70.981 -16.165 39.495 1.00 37.34 ? 27 HIS C O 1 ATOM 5160 C CB . HIS D 2 31 D 71.293 -12.974 40.317 1.00 38.06 ? 27 HIS C CB 1 ATOM 5161 C CG . HIS D 2 31 D 72.515 -13.374 39.545 1.00 39.52 ? 27 HIS C CG 1 ATOM 5162 N ND1 . HIS D 2 31 D 72.487 -13.644 38.192 1.00 38.97 ? 27 HIS C ND1 1 ATOM 5163 C CD2 . HIS D 2 31 D 73.785 -13.607 39.945 1.00 41.55 ? 27 HIS C CD2 1 ATOM 5164 C CE1 . HIS D 2 31 D 73.684 -14.021 37.793 1.00 40.62 ? 27 HIS C CE1 1 ATOM 5165 N NE2 . HIS D 2 31 D 74.494 -13.990 38.832 1.00 42.45 ? 27 HIS C NE2 1 ATOM 5166 N N . ARG D 2 32 E 69.411 -14.782 38.632 1.00 35.48 ? 27 ARG C N 1 ATOM 5167 C CA . ARG D 2 32 E 69.404 -15.351 37.296 1.00 35.48 ? 27 ARG C CA 1 ATOM 5168 C C . ARG D 2 32 E 69.306 -14.163 36.383 1.00 35.49 ? 27 ARG C C 1 ATOM 5169 O O . ARG D 2 32 E 68.394 -13.350 36.524 1.00 34.46 ? 27 ARG C O 1 ATOM 5170 C CB . ARG D 2 32 E 68.213 -16.267 37.062 1.00 34.38 ? 27 ARG C CB 1 ATOM 5171 C CG . ARG D 2 32 E 68.055 -17.380 38.066 1.00 34.77 ? 27 ARG C CG 1 ATOM 5172 C CD . ARG D 2 32 E 69.173 -18.404 37.936 1.00 36.57 ? 27 ARG C CD 1 ATOM 5173 N NE . ARG D 2 32 E 69.086 -19.421 38.981 1.00 37.54 ? 27 ARG C NE 1 ATOM 5174 C CZ . ARG D 2 32 E 70.118 -20.103 39.474 1.00 39.62 ? 27 ARG C CZ 1 ATOM 5175 N NH1 . ARG D 2 32 E 71.360 -19.876 39.064 1.00 40.79 ? 27 ARG C NH1 1 ATOM 5176 N NH2 . ARG D 2 32 E 69.907 -20.997 40.433 1.00 40.90 ? 27 ARG C NH2 1 ATOM 5177 N N . ASN D 2 33 ? 70.282 -14.049 35.484 1.00 37.07 ? 28 ASN C N 1 ATOM 5178 C CA . ASN D 2 33 ? 70.413 -12.922 34.572 1.00 37.54 ? 28 ASN C CA 1 ATOM 5179 C C . ASN D 2 33 ? 70.344 -11.582 35.262 1.00 37.50 ? 28 ASN C C 1 ATOM 5180 O O . ASN D 2 33 ? 69.879 -10.601 34.700 1.00 37.41 ? 28 ASN C O 1 ATOM 5181 C CB . ASN D 2 33 ? 69.391 -13.024 33.463 1.00 37.23 ? 28 ASN C CB 1 ATOM 5182 C CG . ASN D 2 33 ? 69.571 -14.288 32.648 1.00 38.04 ? 28 ASN C CG 1 ATOM 5183 O OD1 . ASN D 2 33 ? 70.626 -14.503 32.049 1.00 39.92 ? 28 ASN C OD1 1 ATOM 5184 N ND2 . ASN D 2 33 ? 68.552 -15.141 32.642 1.00 37.34 ? 28 ASN C ND2 1 ATOM 5185 N N . GLY D 2 34 ? 70.849 -11.545 36.482 1.00 37.90 ? 29 GLY C N 1 ATOM 5186 C CA . GLY D 2 34 ? 70.974 -10.314 37.217 1.00 38.66 ? 29 GLY C CA 1 ATOM 5187 C C . GLY D 2 34 ? 69.772 -9.963 38.042 1.00 37.33 ? 29 GLY C C 1 ATOM 5188 O O . GLY D 2 34 ? 69.754 -8.915 38.682 1.00 38.31 ? 29 GLY C O 1 ATOM 5189 N N . ASN D 2 35 ? 68.772 -10.841 38.049 1.00 35.83 ? 30 ASN C N 1 ATOM 5190 C CA . ASN D 2 35 ? 67.529 -10.599 38.778 1.00 34.55 ? 30 ASN C CA 1 ATOM 5191 C C . ASN D 2 35 ? 67.444 -11.559 39.928 1.00 34.54 ? 30 ASN C C 1 ATOM 5192 O O . ASN D 2 35 ? 67.693 -12.745 39.739 1.00 34.64 ? 30 ASN C O 1 ATOM 5193 C CB . ASN D 2 35 ? 66.321 -10.834 37.861 1.00 33.22 ? 30 ASN C CB 1 ATOM 5194 C CG . ASN D 2 35 ? 66.207 -9.808 36.746 1.00 33.50 ? 30 ASN C CG 1 ATOM 5195 O OD1 . ASN D 2 35 ? 66.324 -8.612 36.966 1.00 34.31 ? 30 ASN C OD1 1 ATOM 5196 N ND2 . ASN D 2 35 ? 65.899 -10.268 35.561 1.00 33.39 ? 30 ASN C ND2 1 ATOM 5197 N N . THR D 2 36 ? 67.096 -11.077 41.121 1.00 35.01 ? 31 THR C N 1 ATOM 5198 C CA . THR D 2 36 ? 66.877 -11.998 42.240 1.00 35.14 ? 31 THR C CA 1 ATOM 5199 C C . THR D 2 36 ? 65.370 -12.128 42.457 1.00 33.38 ? 31 THR C C 1 ATOM 5200 O O . THR D 2 36 ? 64.690 -11.213 42.902 1.00 33.05 ? 31 THR C O 1 ATOM 5201 C CB . THR D 2 36 ? 67.655 -11.685 43.544 1.00 37.15 ? 31 THR C CB 1 ATOM 5202 O OG1 . THR D 2 36 ? 66.751 -11.469 44.638 1.00 37.14 ? 31 THR C OG1 1 ATOM 5203 C CG2 . THR D 2 36 ? 68.593 -10.545 43.404 1.00 38.68 ? 31 THR C CG2 1 ATOM 5204 N N . TYR D 2 37 ? 64.858 -13.286 42.092 1.00 32.48 ? 32 TYR C N 1 ATOM 5205 C CA . TYR D 2 37 ? 63.431 -13.534 42.063 1.00 31.35 ? 32 TYR C CA 1 ATOM 5206 C C . TYR D 2 37 ? 62.899 -13.990 43.418 1.00 32.00 ? 32 TYR C C 1 ATOM 5207 O O . TYR D 2 37 ? 62.846 -15.193 43.728 1.00 32.41 ? 32 TYR C O 1 ATOM 5208 C CB . TYR D 2 37 ? 63.115 -14.578 41.000 1.00 30.63 ? 32 TYR C CB 1 ATOM 5209 C CG . TYR D 2 37 ? 63.395 -14.119 39.611 1.00 30.31 ? 32 TYR C CG 1 ATOM 5210 C CD1 . TYR D 2 37 ? 62.771 -12.988 39.093 1.00 29.98 ? 32 TYR C CD1 1 ATOM 5211 C CD2 . TYR D 2 37 ? 64.267 -14.819 38.794 1.00 30.84 ? 32 TYR C CD2 1 ATOM 5212 C CE1 . TYR D 2 37 ? 63.003 -12.573 37.791 1.00 30.22 ? 32 TYR C CE1 1 ATOM 5213 C CE2 . TYR D 2 37 ? 64.512 -14.415 37.499 1.00 30.99 ? 32 TYR C CE2 1 ATOM 5214 C CZ . TYR D 2 37 ? 63.884 -13.293 36.993 1.00 30.68 ? 32 TYR C CZ 1 ATOM 5215 O OH . TYR D 2 37 ? 64.164 -12.924 35.685 1.00 30.97 ? 32 TYR C OH 1 ATOM 5216 N N . LEU D 2 38 ? 62.513 -13.000 44.217 1.00 32.40 ? 33 LEU C N 1 ATOM 5217 C CA . LEU D 2 38 ? 61.876 -13.231 45.507 1.00 32.65 ? 33 LEU C CA 1 ATOM 5218 C C . LEU D 2 38 ? 60.644 -12.317 45.502 1.00 31.92 ? 33 LEU C C 1 ATOM 5219 O O . LEU D 2 38 ? 60.737 -11.089 45.322 1.00 31.77 ? 33 LEU C O 1 ATOM 5220 C CB . LEU D 2 38 ? 62.837 -12.929 46.663 1.00 34.14 ? 33 LEU C CB 1 ATOM 5221 C CG . LEU D 2 38 ? 62.591 -13.398 48.100 1.00 35.29 ? 33 LEU C CG 1 ATOM 5222 C CD1 . LEU D 2 38 ? 61.487 -12.622 48.818 1.00 35.11 ? 33 LEU C CD1 1 ATOM 5223 C CD2 . LEU D 2 38 ? 62.340 -14.901 48.184 1.00 35.52 ? 33 LEU C CD2 1 ATOM 5224 N N . GLU D 2 39 ? 59.486 -12.956 45.630 1.00 31.24 ? 34 GLU C N 1 ATOM 5225 C CA . GLU D 2 39 ? 58.188 -12.290 45.490 1.00 30.74 ? 34 GLU C CA 1 ATOM 5226 C C . GLU D 2 39 ? 57.327 -12.514 46.712 1.00 30.44 ? 34 GLU C C 1 ATOM 5227 O O . GLU D 2 39 ? 57.440 -13.541 47.375 1.00 30.57 ? 34 GLU C O 1 ATOM 5228 C CB . GLU D 2 39 ? 57.449 -12.830 44.250 1.00 30.22 ? 34 GLU C CB 1 ATOM 5229 C CG . GLU D 2 39 ? 58.126 -12.430 42.961 1.00 30.35 ? 34 GLU C CG 1 ATOM 5230 C CD . GLU D 2 39 ? 57.669 -13.180 41.714 1.00 30.82 ? 34 GLU C CD 1 ATOM 5231 O OE1 . GLU D 2 39 ? 56.795 -14.111 41.735 1.00 31.04 ? 34 GLU C OE1 1 ATOM 5232 O OE2 . GLU D 2 39 ? 58.200 -12.779 40.661 1.00 31.38 ? 34 GLU C OE2 1 ATOM 5233 N N . TRP D 2 40 ? 56.475 -11.536 46.999 1.00 30.20 ? 35 TRP C N 1 ATOM 5234 C CA . TRP D 2 40 ? 55.463 -11.654 48.049 1.00 30.48 ? 35 TRP C CA 1 ATOM 5235 C C . TRP D 2 40 ? 54.075 -11.513 47.454 1.00 29.99 ? 35 TRP C C 1 ATOM 5236 O O . TRP D 2 40 ? 53.818 -10.584 46.693 1.00 29.92 ? 35 TRP C O 1 ATOM 5237 C CB . TRP D 2 40 ? 55.632 -10.566 49.097 1.00 31.12 ? 35 TRP C CB 1 ATOM 5238 C CG . TRP D 2 40 ? 56.846 -10.683 49.887 1.00 31.83 ? 35 TRP C CG 1 ATOM 5239 C CD1 . TRP D 2 40 ? 58.048 -10.110 49.620 1.00 32.29 ? 35 TRP C CD1 1 ATOM 5240 C CD2 . TRP D 2 40 ? 57.009 -11.418 51.098 1.00 32.76 ? 35 TRP C CD2 1 ATOM 5241 N NE1 . TRP D 2 40 ? 58.959 -10.451 50.590 1.00 33.30 ? 35 TRP C NE1 1 ATOM 5242 C CE2 . TRP D 2 40 ? 58.338 -11.242 51.516 1.00 33.69 ? 35 TRP C CE2 1 ATOM 5243 C CE3 . TRP D 2 40 ? 56.156 -12.199 51.878 1.00 33.08 ? 35 TRP C CE3 1 ATOM 5244 C CZ2 . TRP D 2 40 ? 58.835 -11.833 52.664 1.00 35.13 ? 35 TRP C CZ2 1 ATOM 5245 C CZ3 . TRP D 2 40 ? 56.650 -12.777 53.016 1.00 34.45 ? 35 TRP C CZ3 1 ATOM 5246 C CH2 . TRP D 2 40 ? 57.976 -12.598 53.398 1.00 35.48 ? 35 TRP C CH2 1 ATOM 5247 N N . TYR D 2 41 ? 53.196 -12.434 47.832 1.00 30.27 ? 36 TYR C N 1 ATOM 5248 C CA . TYR D 2 41 ? 51.805 -12.446 47.423 1.00 30.21 ? 36 TYR C CA 1 ATOM 5249 C C . TYR D 2 41 ? 50.897 -12.298 48.627 1.00 30.75 ? 36 TYR C C 1 ATOM 5250 O O . TYR D 2 41 ? 51.242 -12.737 49.742 1.00 30.89 ? 36 TYR C O 1 ATOM 5251 C CB . TYR D 2 41 ? 51.475 -13.752 46.710 1.00 30.38 ? 36 TYR C CB 1 ATOM 5252 C CG . TYR D 2 41 ? 52.185 -13.885 45.406 1.00 30.16 ? 36 TYR C CG 1 ATOM 5253 C CD1 . TYR D 2 41 ? 53.443 -14.462 45.344 1.00 30.26 ? 36 TYR C CD1 1 ATOM 5254 C CD2 . TYR D 2 41 ? 51.629 -13.387 44.238 1.00 30.04 ? 36 TYR C CD2 1 ATOM 5255 C CE1 . TYR D 2 41 ? 54.120 -14.557 44.145 1.00 29.90 ? 36 TYR C CE1 1 ATOM 5256 C CE2 . TYR D 2 41 ? 52.301 -13.481 43.035 1.00 29.91 ? 36 TYR C CE2 1 ATOM 5257 C CZ . TYR D 2 41 ? 53.545 -14.073 43.002 1.00 29.67 ? 36 TYR C CZ 1 ATOM 5258 O OH . TYR D 2 41 ? 54.236 -14.183 41.825 1.00 30.17 ? 36 TYR C OH 1 ATOM 5259 N N . LEU D 2 42 ? 49.743 -11.672 48.381 1.00 30.85 ? 37 LEU C N 1 ATOM 5260 C CA . LEU D 2 42 ? 48.671 -11.571 49.355 1.00 31.82 ? 37 LEU C CA 1 ATOM 5261 C C . LEU D 2 42 ? 47.470 -12.280 48.784 1.00 32.24 ? 37 LEU C C 1 ATOM 5262 O O . LEU D 2 42 ? 47.054 -11.983 47.674 1.00 32.31 ? 37 LEU C O 1 ATOM 5263 C CB . LEU D 2 42 ? 48.327 -10.116 49.619 1.00 32.21 ? 37 LEU C CB 1 ATOM 5264 C CG . LEU D 2 42 ? 47.044 -9.846 50.401 1.00 33.42 ? 37 LEU C CG 1 ATOM 5265 C CD1 . LEU D 2 42 ? 47.071 -10.551 51.760 1.00 34.07 ? 37 LEU C CD1 1 ATOM 5266 C CD2 . LEU D 2 42 ? 46.870 -8.342 50.572 1.00 34.14 ? 37 LEU C CD2 1 ATOM 5267 N N . GLN D 2 43 ? 46.941 -13.245 49.515 1.00 33.27 ? 38 GLN C N 1 ATOM 5268 C CA . GLN D 2 43 ? 45.687 -13.865 49.138 1.00 34.39 ? 38 GLN C CA 1 ATOM 5269 C C . GLN D 2 43 ? 44.574 -13.512 50.108 1.00 36.26 ? 38 GLN C C 1 ATOM 5270 O O . GLN D 2 43 ? 44.707 -13.674 51.320 1.00 37.08 ? 38 GLN C O 1 ATOM 5271 C CB . GLN D 2 43 ? 45.807 -15.373 49.064 1.00 34.57 ? 38 GLN C CB 1 ATOM 5272 C CG . GLN D 2 43 ? 44.543 -16.024 48.535 1.00 35.45 ? 38 GLN C CG 1 ATOM 5273 C CD . GLN D 2 43 ? 44.764 -17.467 48.160 1.00 35.78 ? 38 GLN C CD 1 ATOM 5274 O OE1 . GLN D 2 43 ? 45.609 -18.148 48.721 1.00 35.83 ? 38 GLN C OE1 1 ATOM 5275 N NE2 . GLN D 2 43 ? 43.998 -17.936 47.207 1.00 36.63 ? 38 GLN C NE2 1 ATOM 5276 N N . LYS D 2 44 ? 43.473 -13.039 49.550 1.00 37.45 ? 39 LYS C N 1 ATOM 5277 C CA . LYS D 2 44 ? 42.294 -12.760 50.326 1.00 39.65 ? 39 LYS C CA 1 ATOM 5278 C C . LYS D 2 44 ? 41.281 -13.867 50.106 1.00 41.13 ? 39 LYS C C 1 ATOM 5279 O O . LYS D 2 44 ? 41.294 -14.541 49.075 1.00 40.88 ? 39 LYS C O 1 ATOM 5280 C CB . LYS D 2 44 ? 41.743 -11.386 49.965 1.00 40.45 ? 39 LYS C CB 1 ATOM 5281 C CG . LYS D 2 44 ? 42.756 -10.286 50.297 1.00 40.42 ? 39 LYS C CG 1 ATOM 5282 C CD . LYS D 2 44 ? 42.118 -8.938 50.569 1.00 42.04 ? 39 LYS C CD 1 ATOM 5283 C CE . LYS D 2 44 ? 42.535 -7.920 49.527 1.00 42.07 ? 39 LYS C CE 1 ATOM 5284 N NZ . LYS D 2 44 ? 41.792 -6.645 49.761 1.00 44.24 ? 39 LYS C NZ 1 ATOM 5285 N N . PRO D 2 45 ? 40.419 -14.092 51.093 1.00 43.01 ? 40 PRO C N 1 ATOM 5286 C CA . PRO D 2 45 ? 39.446 -15.178 51.014 1.00 45.11 ? 40 PRO C CA 1 ATOM 5287 C C . PRO D 2 45 ? 38.688 -15.211 49.676 1.00 45.76 ? 40 PRO C C 1 ATOM 5288 O O . PRO D 2 45 ? 38.126 -14.191 49.251 1.00 45.85 ? 40 PRO C O 1 ATOM 5289 C CB . PRO D 2 45 ? 38.483 -14.874 52.170 1.00 46.95 ? 40 PRO C CB 1 ATOM 5290 C CG . PRO D 2 45 ? 39.295 -14.096 53.149 1.00 46.06 ? 40 PRO C CG 1 ATOM 5291 C CD . PRO D 2 45 ? 40.339 -13.353 52.365 1.00 44.00 ? 40 PRO C CD 1 ATOM 5292 N N . GLY D 2 46 ? 38.729 -16.365 49.008 1.00 46.07 ? 41 GLY C N 1 ATOM 5293 C CA . GLY D 2 46 ? 37.977 -16.590 47.775 1.00 47.10 ? 41 GLY C CA 1 ATOM 5294 C C . GLY D 2 46 ? 38.547 -15.975 46.508 1.00 45.96 ? 41 GLY C C 1 ATOM 5295 O O . GLY D 2 46 ? 37.974 -16.135 45.435 1.00 47.19 ? 41 GLY C O 1 ATOM 5296 N N . GLN D 2 47 ? 39.666 -15.271 46.626 1.00 44.51 ? 42 GLN C N 1 ATOM 5297 C CA . GLN D 2 47 ? 40.339 -14.661 45.494 1.00 43.11 ? 42 GLN C CA 1 ATOM 5298 C C . GLN D 2 47 ? 41.660 -15.367 45.224 1.00 41.30 ? 42 GLN C C 1 ATOM 5299 O O . GLN D 2 47 ? 42.179 -16.118 46.058 1.00 40.26 ? 42 GLN C O 1 ATOM 5300 C CB . GLN D 2 47 ? 40.635 -13.188 45.785 1.00 43.62 ? 42 GLN C CB 1 ATOM 5301 C CG . GLN D 2 47 ? 39.423 -12.280 45.947 1.00 46.14 ? 42 GLN C CG 1 ATOM 5302 C CD . GLN D 2 47 ? 39.830 -10.821 46.188 1.00 46.62 ? 42 GLN C CD 1 ATOM 5303 O OE1 . GLN D 2 47 ? 40.990 -10.429 45.984 1.00 45.26 ? 42 GLN C OE1 1 ATOM 5304 N NE2 . GLN D 2 47 ? 38.877 -10.015 46.644 1.00 48.59 ? 42 GLN C NE2 1 ATOM 5305 N N . SER D 2 48 ? 42.217 -15.095 44.047 1.00 40.38 ? 43 SER C N 1 ATOM 5306 C CA . SER D 2 48 ? 43.539 -15.578 43.691 1.00 38.65 ? 43 SER C CA 1 ATOM 5307 C C . SER D 2 48 ? 44.588 -14.766 44.431 1.00 37.61 ? 43 SER C C 1 ATOM 5308 O O . SER D 2 48 ? 44.320 -13.641 44.845 1.00 38.77 ? 43 SER C O 1 ATOM 5309 C CB . SER D 2 48 ? 43.782 -15.432 42.204 1.00 38.16 ? 43 SER C CB 1 ATOM 5310 O OG . SER D 2 48 ? 42.877 -16.233 41.489 1.00 39.38 ? 43 SER C OG 1 ATOM 5311 N N . PRO D 2 49 ? 45.787 -15.326 44.602 1.00 36.27 ? 44 PRO C N 1 ATOM 5312 C CA . PRO D 2 49 ? 46.875 -14.534 45.158 1.00 35.31 ? 44 PRO C CA 1 ATOM 5313 C C . PRO D 2 49 ? 47.239 -13.373 44.234 1.00 34.68 ? 44 PRO C C 1 ATOM 5314 O O . PRO D 2 49 ? 47.271 -13.547 43.026 1.00 34.61 ? 44 PRO C O 1 ATOM 5315 C CB . PRO D 2 49 ? 48.030 -15.529 45.247 1.00 34.71 ? 44 PRO C CB 1 ATOM 5316 C CG . PRO D 2 49 ? 47.419 -16.880 45.177 1.00 35.76 ? 44 PRO C CG 1 ATOM 5317 C CD . PRO D 2 49 ? 46.164 -16.735 44.387 1.00 36.40 ? 44 PRO C CD 1 ATOM 5318 N N . LYS D 2 50 ? 47.501 -12.203 44.809 1.00 34.48 ? 45 LYS C N 1 ATOM 5319 C CA . LYS D 2 50 ? 47.902 -11.023 44.048 1.00 34.18 ? 45 LYS C CA 1 ATOM 5320 C C . LYS D 2 50 ? 49.305 -10.617 44.459 1.00 32.38 ? 45 LYS C C 1 ATOM 5321 O O . LYS D 2 50 ? 49.647 -10.704 45.621 1.00 31.94 ? 45 LYS C O 1 ATOM 5322 C CB . LYS D 2 50 ? 46.960 -9.860 44.309 1.00 36.05 ? 45 LYS C CB 1 ATOM 5323 C CG . LYS D 2 50 ? 45.539 -10.112 43.863 1.00 38.83 ? 45 LYS C CG 1 ATOM 5324 C CD . LYS D 2 50 ? 44.688 -8.881 44.111 1.00 41.34 ? 45 LYS C CD 1 ATOM 5325 C CE . LYS D 2 50 ? 43.206 -9.177 43.921 1.00 44.06 ? 45 LYS C CE 1 ATOM 5326 N NZ . LYS D 2 50 ? 42.875 -9.458 42.494 1.00 45.34 ? 45 LYS C NZ 1 ATOM 5327 N N . LEU D 2 51 ? 50.098 -10.178 43.487 1.00 31.32 ? 46 LEU C N 1 ATOM 5328 C CA . LEU D 2 51 ? 51.499 -9.825 43.692 1.00 30.33 ? 46 LEU C CA 1 ATOM 5329 C C . LEU D 2 51 ? 51.602 -8.496 44.390 1.00 30.58 ? 46 LEU C C 1 ATOM 5330 O O . LEU D 2 51 ? 50.990 -7.537 43.960 1.00 31.42 ? 46 LEU C O 1 ATOM 5331 C CB . LEU D 2 51 ? 52.201 -9.723 42.349 1.00 29.90 ? 46 LEU C CB 1 ATOM 5332 C CG . LEU D 2 51 ? 53.679 -9.361 42.395 1.00 29.95 ? 46 LEU C CG 1 ATOM 5333 C CD1 . LEU D 2 51 ? 54.514 -10.483 42.984 1.00 29.48 ? 46 LEU C CD1 1 ATOM 5334 C CD2 . LEU D 2 51 ? 54.142 -9.059 40.991 1.00 30.41 ? 46 LEU C CD2 1 ATOM 5335 N N . LEU D 2 52 ? 52.392 -8.429 45.451 1.00 30.28 ? 47 LEU C N 1 ATOM 5336 C CA . LEU D 2 52 ? 52.660 -7.157 46.124 1.00 31.13 ? 47 LEU C CA 1 ATOM 5337 C C . LEU D 2 52 ? 54.041 -6.646 45.754 1.00 30.87 ? 47 LEU C C 1 ATOM 5338 O O . LEU D 2 52 ? 54.215 -5.503 45.346 1.00 31.43 ? 47 LEU C O 1 ATOM 5339 C CB . LEU D 2 52 ? 52.548 -7.314 47.648 1.00 31.65 ? 47 LEU C CB 1 ATOM 5340 C CG . LEU D 2 52 ? 51.171 -7.706 48.181 1.00 32.18 ? 47 LEU C CG 1 ATOM 5341 C CD1 . LEU D 2 52 ? 51.214 -7.773 49.702 1.00 33.20 ? 47 LEU C CD1 1 ATOM 5342 C CD2 . LEU D 2 52 ? 50.086 -6.739 47.735 1.00 33.00 ? 47 LEU C CD2 1 ATOM 5343 N N . ILE D 2 53 ? 55.017 -7.523 45.918 1.00 30.33 ? 48 ILE C N 1 ATOM 5344 C CA . ILE D 2 53 ? 56.424 -7.165 45.807 1.00 30.71 ? 48 ILE C CA 1 ATOM 5345 C C . ILE D 2 53 ? 57.144 -8.152 44.911 1.00 29.64 ? 48 ILE C C 1 ATOM 5346 O O . ILE D 2 53 ? 57.027 -9.353 45.090 1.00 28.95 ? 48 ILE C O 1 ATOM 5347 C CB . ILE D 2 53 ? 57.117 -7.212 47.182 1.00 31.53 ? 48 ILE C CB 1 ATOM 5348 C CG1 . ILE D 2 53 ? 56.430 -6.278 48.184 1.00 32.73 ? 48 ILE C CG1 1 ATOM 5349 C CG2 . ILE D 2 53 ? 58.583 -6.830 47.049 1.00 32.46 ? 48 ILE C CG2 1 ATOM 5350 C CD1 . ILE D 2 53 ? 56.513 -4.802 47.833 1.00 33.95 ? 48 ILE C CD1 1 ATOM 5351 N N . TYR D 2 54 ? 57.850 -7.639 43.930 1.00 29.94 ? 49 TYR C N 1 ATOM 5352 C CA . TYR D 2 54 ? 58.652 -8.475 43.060 1.00 29.50 ? 49 TYR C CA 1 ATOM 5353 C C . TYR D 2 54 ? 60.113 -8.080 43.158 1.00 30.48 ? 49 TYR C C 1 ATOM 5354 O O . TYR D 2 54 ? 60.428 -6.972 43.498 1.00 31.53 ? 49 TYR C O 1 ATOM 5355 C CB . TYR D 2 54 ? 58.160 -8.422 41.607 1.00 29.00 ? 49 TYR C CB 1 ATOM 5356 C CG . TYR D 2 54 ? 58.353 -7.102 40.917 1.00 29.87 ? 49 TYR C CG 1 ATOM 5357 C CD1 . TYR D 2 54 ? 57.522 -6.048 41.177 1.00 30.57 ? 49 TYR C CD1 1 ATOM 5358 C CD2 . TYR D 2 54 ? 59.357 -6.922 40.009 1.00 30.43 ? 49 TYR C CD2 1 ATOM 5359 C CE1 . TYR D 2 54 ? 57.691 -4.844 40.570 1.00 31.71 ? 49 TYR C CE1 1 ATOM 5360 C CE2 . TYR D 2 54 ? 59.532 -5.720 39.378 1.00 31.43 ? 49 TYR C CE2 1 ATOM 5361 C CZ . TYR D 2 54 ? 58.691 -4.691 39.657 1.00 32.10 ? 49 TYR C CZ 1 ATOM 5362 O OH . TYR D 2 54 ? 58.861 -3.500 39.066 1.00 33.26 ? 49 TYR C OH 1 ATOM 5363 N N . LYS D 2 55 ? 60.985 -9.030 42.872 1.00 30.46 ? 50 LYS C N 1 ATOM 5364 C CA . LYS D 2 55 ? 62.413 -8.808 42.906 1.00 31.33 ? 50 LYS C CA 1 ATOM 5365 C C . LYS D 2 55 ? 62.893 -8.261 44.251 1.00 32.22 ? 50 LYS C C 1 ATOM 5366 O O . LYS D 2 55 ? 63.637 -7.323 44.293 1.00 33.20 ? 50 LYS C O 1 ATOM 5367 C CB . LYS D 2 55 ? 62.808 -7.871 41.779 1.00 32.09 ? 50 LYS C CB 1 ATOM 5368 C CG . LYS D 2 55 ? 63.513 -8.533 40.632 1.00 31.96 ? 50 LYS C CG 1 ATOM 5369 C CD . LYS D 2 55 ? 63.305 -7.727 39.377 1.00 32.59 ? 50 LYS C CD 1 ATOM 5370 C CE . LYS D 2 55 ? 64.603 -7.205 38.816 1.00 34.46 ? 50 LYS C CE 1 ATOM 5371 N NZ . LYS D 2 55 ? 64.497 -5.772 38.488 1.00 35.44 ? 50 LYS C NZ 1 ATOM 5372 N N . VAL D 2 56 ? 62.411 -8.837 45.340 1.00 32.06 ? 51 VAL C N 1 ATOM 5373 C CA . VAL D 2 56 ? 62.759 -8.435 46.707 1.00 33.19 ? 51 VAL C CA 1 ATOM 5374 C C . VAL D 2 56 ? 62.126 -7.169 47.253 1.00 33.92 ? 51 VAL C C 1 ATOM 5375 O O . VAL D 2 56 ? 61.570 -7.190 48.322 1.00 34.15 ? 51 VAL C O 1 ATOM 5376 C CB . VAL D 2 56 ? 64.287 -8.359 46.919 1.00 34.67 ? 51 VAL C CB 1 ATOM 5377 C CG1 . VAL D 2 56 ? 64.621 -8.202 48.392 1.00 36.20 ? 51 VAL C CG1 1 ATOM 5378 C CG2 . VAL D 2 56 ? 64.958 -9.589 46.369 1.00 34.32 ? 51 VAL C CG2 1 ATOM 5379 N N . SER D 2 57 ? 62.275 -6.053 46.569 1.00 34.63 ? 52 SER C N 1 ATOM 5380 C CA . SER D 2 57 ? 61.818 -4.790 47.103 1.00 36.04 ? 52 SER C CA 1 ATOM 5381 C C . SER D 2 57 ? 60.942 -3.975 46.221 1.00 36.16 ? 52 SER C C 1 ATOM 5382 O O . SER D 2 57 ? 60.569 -2.883 46.576 1.00 37.70 ? 52 SER C O 1 ATOM 5383 C CB . SER D 2 57 ? 63.003 -3.939 47.501 1.00 37.99 ? 52 SER C CB 1 ATOM 5384 O OG . SER D 2 57 ? 63.986 -3.975 46.511 1.00 38.41 ? 52 SER C OG 1 ATOM 5385 N N . ASN D 2 58 ? 60.621 -4.483 45.057 1.00 35.09 ? 53 ASN C N 1 ATOM 5386 C CA . ASN D 2 58 ? 59.922 -3.684 44.085 1.00 35.44 ? 53 ASN C CA 1 ATOM 5387 C C . ASN D 2 58 ? 58.423 -3.752 44.227 1.00 35.21 ? 53 ASN C C 1 ATOM 5388 O O . ASN D 2 58 ? 57.869 -4.816 44.241 1.00 33.71 ? 53 ASN C O 1 ATOM 5389 C CB . ASN D 2 58 ? 60.414 -4.089 42.717 1.00 34.72 ? 53 ASN C CB 1 ATOM 5390 C CG . ASN D 2 58 ? 61.869 -3.789 42.544 1.00 35.41 ? 53 ASN C CG 1 ATOM 5391 O OD1 . ASN D 2 58 ? 62.700 -4.674 42.541 1.00 34.57 ? 53 ASN C OD1 1 ATOM 5392 N ND2 . ASN D 2 58 ? 62.182 -2.519 42.438 1.00 37.04 ? 53 ASN C ND2 1 ATOM 5393 N N . ARG D 2 59 ? 57.783 -2.602 44.358 1.00 37.10 ? 54 ARG C N 1 ATOM 5394 C CA . ARG D 2 59 ? 56.362 -2.571 44.654 1.00 37.81 ? 54 ARG C CA 1 ATOM 5395 C C . ARG D 2 59 ? 55.542 -2.650 43.359 1.00 37.09 ? 54 ARG C C 1 ATOM 5396 O O . ARG D 2 59 ? 55.673 -1.786 42.475 1.00 38.74 ? 54 ARG C O 1 ATOM 5397 C CB . ARG D 2 59 ? 56.098 -1.331 45.546 1.00 41.00 ? 54 ARG C CB 1 ATOM 5398 C CG . ARG D 2 59 ? 54.717 -0.696 45.500 1.00 43.03 ? 54 ARG C CG 1 ATOM 5399 C CD . ARG D 2 59 ? 54.582 0.459 46.510 1.00 45.62 ? 54 ARG C CD 1 ATOM 5400 N NE . ARG D 2 59 ? 55.637 0.470 47.520 1.00 46.98 ? 54 ARG C NE 1 ATOM 5401 C CZ . ARG D 2 59 ? 56.626 1.371 47.596 1.00 49.51 ? 54 ARG C CZ 1 ATOM 5402 N NH1 . ARG D 2 59 ? 56.689 2.387 46.742 1.00 51.07 ? 54 ARG C NH1 1 ATOM 5403 N NH2 . ARG D 2 59 ? 57.539 1.274 48.568 1.00 49.88 ? 54 ARG C NH2 1 ATOM 5404 N N . PHE D 2 60 ? 54.735 -3.714 43.213 1.00 35.11 ? 55 PHE C N 1 ATOM 5405 C CA . PHE D 2 60 ? 53.963 -3.942 41.982 1.00 34.24 ? 55 PHE C CA 1 ATOM 5406 C C . PHE D 2 60 ? 52.987 -2.801 41.816 1.00 35.38 ? 55 PHE C C 1 ATOM 5407 O O . PHE D 2 60 ? 52.625 -2.152 42.781 1.00 35.81 ? 55 PHE C O 1 ATOM 5408 C CB . PHE D 2 60 ? 53.237 -5.294 42.047 1.00 33.02 ? 55 PHE C CB 1 ATOM 5409 C CG . PHE D 2 60 ? 52.573 -5.716 40.750 1.00 32.77 ? 55 PHE C CG 1 ATOM 5410 C CD1 . PHE D 2 60 ? 53.327 -6.059 39.644 1.00 32.36 ? 55 PHE C CD1 1 ATOM 5411 C CD2 . PHE D 2 60 ? 51.186 -5.816 40.668 1.00 33.33 ? 55 PHE C CD2 1 ATOM 5412 C CE1 . PHE D 2 60 ? 52.715 -6.467 38.463 1.00 32.79 ? 55 PHE C CE1 1 ATOM 5413 C CE2 . PHE D 2 60 ? 50.565 -6.219 39.494 1.00 33.74 ? 55 PHE C CE2 1 ATOM 5414 C CZ . PHE D 2 60 ? 51.332 -6.533 38.379 1.00 33.36 ? 55 PHE C CZ 1 ATOM 5415 N N . SER D 2 61 ? 52.584 -2.531 40.588 1.00 36.20 ? 56 SER C N 1 ATOM 5416 C CA . SER D 2 61 ? 51.737 -1.375 40.309 1.00 38.50 ? 56 SER C CA 1 ATOM 5417 C C . SER D 2 61 ? 50.420 -1.493 41.039 1.00 38.66 ? 56 SER C C 1 ATOM 5418 O O . SER D 2 61 ? 49.830 -2.567 41.066 1.00 37.65 ? 56 SER C O 1 ATOM 5419 C CB . SER D 2 61 ? 51.462 -1.227 38.813 1.00 39.73 ? 56 SER C CB 1 ATOM 5420 O OG . SER D 2 61 ? 50.623 -2.268 38.327 1.00 39.29 ? 56 SER C OG 1 ATOM 5421 N N . GLY D 2 62 ? 49.952 -0.387 41.607 1.00 40.43 ? 57 GLY C N 1 ATOM 5422 C CA . GLY D 2 62 ? 48.729 -0.379 42.403 1.00 41.11 ? 57 GLY C CA 1 ATOM 5423 C C . GLY D 2 62 ? 48.895 -0.691 43.888 1.00 40.57 ? 57 GLY C C 1 ATOM 5424 O O . GLY D 2 62 ? 47.961 -0.484 44.663 1.00 41.52 ? 57 GLY C O 1 ATOM 5425 N N . VAL D 2 63 ? 50.059 -1.208 44.283 1.00 39.24 ? 58 VAL C N 1 ATOM 5426 C CA . VAL D 2 63 ? 50.323 -1.526 45.677 1.00 38.96 ? 58 VAL C CA 1 ATOM 5427 C C . VAL D 2 63 ? 50.770 -0.224 46.331 1.00 41.32 ? 58 VAL C C 1 ATOM 5428 O O . VAL D 2 63 ? 51.628 0.486 45.788 1.00 42.43 ? 58 VAL C O 1 ATOM 5429 C CB . VAL D 2 63 ? 51.398 -2.621 45.814 1.00 36.93 ? 58 VAL C CB 1 ATOM 5430 C CG1 . VAL D 2 63 ? 51.632 -2.984 47.277 1.00 36.93 ? 58 VAL C CG1 1 ATOM 5431 C CG2 . VAL D 2 63 ? 50.988 -3.854 45.027 1.00 35.48 ? 58 VAL C CG2 1 ATOM 5432 N N . PRO D 2 64 ? 50.174 0.121 47.481 1.00 42.62 ? 59 PRO C N 1 ATOM 5433 C CA . PRO D 2 64 ? 50.555 1.382 48.125 1.00 44.91 ? 59 PRO C CA 1 ATOM 5434 C C . PRO D 2 64 ? 51.877 1.282 48.902 1.00 44.97 ? 59 PRO C C 1 ATOM 5435 O O . PRO D 2 64 ? 52.320 0.174 49.247 1.00 43.19 ? 59 PRO C O 1 ATOM 5436 C CB . PRO D 2 64 ? 49.369 1.677 49.054 1.00 46.11 ? 59 PRO C CB 1 ATOM 5437 C CG . PRO D 2 64 ? 48.777 0.337 49.355 1.00 44.30 ? 59 PRO C CG 1 ATOM 5438 C CD . PRO D 2 64 ? 49.067 -0.559 48.176 1.00 42.36 ? 59 PRO C CD 1 ATOM 5439 N N . ASP D 2 65 ? 52.478 2.440 49.190 1.00 47.37 ? 60 ASP C N 1 ATOM 5440 C CA . ASP D 2 65 ? 53.821 2.513 49.793 1.00 47.97 ? 60 ASP C CA 1 ATOM 5441 C C . ASP D 2 65 ? 53.908 2.093 51.262 1.00 47.54 ? 60 ASP C C 1 ATOM 5442 O O . ASP D 2 65 ? 54.996 2.034 51.807 1.00 47.87 ? 60 ASP C O 1 ATOM 5443 C CB . ASP D 2 65 ? 54.492 3.907 49.577 1.00 51.22 ? 60 ASP C CB 1 ATOM 5444 C CG . ASP D 2 65 ? 53.548 4.944 48.973 1.00 53.78 ? 60 ASP C CG 1 ATOM 5445 O OD1 . ASP D 2 65 ? 52.656 4.558 48.169 1.00 53.43 ? 60 ASP C OD1 1 ATOM 5446 O OD2 . ASP D 2 65 ? 53.734 6.151 49.260 1.00 57.00 ? 60 ASP C OD2 1 ATOM 5447 N N . ARG D 2 66 ? 52.798 1.745 51.898 1.00 46.91 ? 61 ARG C N 1 ATOM 5448 C CA . ARG D 2 66 ? 52.896 1.213 53.258 1.00 47.03 ? 61 ARG C CA 1 ATOM 5449 C C . ARG D 2 66 ? 53.500 -0.197 53.247 1.00 44.76 ? 61 ARG C C 1 ATOM 5450 O O . ARG D 2 66 ? 53.950 -0.682 54.285 1.00 44.89 ? 61 ARG C O 1 ATOM 5451 C CB . ARG D 2 66 ? 51.550 1.260 54.011 1.00 47.67 ? 61 ARG C CB 1 ATOM 5452 C CG . ARG D 2 66 ? 50.341 0.710 53.273 1.00 46.44 ? 61 ARG C CG 1 ATOM 5453 C CD . ARG D 2 66 ? 49.154 0.540 54.208 1.00 47.26 ? 61 ARG C CD 1 ATOM 5454 N NE . ARG D 2 66 ? 48.105 -0.311 53.650 1.00 45.83 ? 61 ARG C NE 1 ATOM 5455 C CZ . ARG D 2 66 ? 47.216 0.081 52.739 1.00 46.18 ? 61 ARG C CZ 1 ATOM 5456 N NH1 . ARG D 2 66 ? 47.238 1.321 52.256 1.00 47.72 ? 61 ARG C NH1 1 ATOM 5457 N NH2 . ARG D 2 66 ? 46.298 -0.777 52.296 1.00 45.25 ? 61 ARG C NH2 1 ATOM 5458 N N . PHE D 2 67 ? 53.502 -0.839 52.075 1.00 42.87 ? 62 PHE C N 1 ATOM 5459 C CA . PHE D 2 67 ? 54.183 -2.107 51.878 1.00 41.25 ? 62 PHE C CA 1 ATOM 5460 C C . PHE D 2 67 ? 55.622 -1.842 51.475 1.00 41.62 ? 62 PHE C C 1 ATOM 5461 O O . PHE D 2 67 ? 55.892 -0.897 50.727 1.00 42.52 ? 62 PHE C O 1 ATOM 5462 C CB . PHE D 2 67 ? 53.478 -2.933 50.793 1.00 39.43 ? 62 PHE C CB 1 ATOM 5463 C CG . PHE D 2 67 ? 52.107 -3.413 51.193 1.00 39.05 ? 62 PHE C CG 1 ATOM 5464 C CD1 . PHE D 2 67 ? 51.952 -4.559 51.954 1.00 38.45 ? 62 PHE C CD1 1 ATOM 5465 C CD2 . PHE D 2 67 ? 50.972 -2.727 50.791 1.00 39.70 ? 62 PHE C CD2 1 ATOM 5466 C CE1 . PHE D 2 67 ? 50.697 -5.011 52.314 1.00 38.41 ? 62 PHE C CE1 1 ATOM 5467 C CE2 . PHE D 2 67 ? 49.712 -3.180 51.132 1.00 39.61 ? 62 PHE C CE2 1 ATOM 5468 C CZ . PHE D 2 67 ? 49.575 -4.318 51.904 1.00 39.05 ? 62 PHE C CZ 1 ATOM 5469 N N . SER D 2 68 ? 56.539 -2.662 51.997 1.00 41.43 ? 63 SER C N 1 ATOM 5470 C CA . SER D 2 68 ? 57.932 -2.640 51.574 1.00 41.84 ? 63 SER C CA 1 ATOM 5471 C C . SER D 2 68 ? 58.538 -4.016 51.760 1.00 40.90 ? 63 SER C C 1 ATOM 5472 O O . SER D 2 68 ? 58.197 -4.731 52.703 1.00 40.88 ? 63 SER C O 1 ATOM 5473 C CB . SER D 2 68 ? 58.726 -1.589 52.344 1.00 44.32 ? 63 SER C CB 1 ATOM 5474 O OG . SER D 2 68 ? 58.795 -1.884 53.726 1.00 45.56 ? 63 SER C OG 1 ATOM 5475 N N . GLY D 2 69 ? 59.381 -4.406 50.807 1.00 40.21 ? 64 GLY C N 1 ATOM 5476 C CA . GLY D 2 69 ? 60.094 -5.666 50.870 1.00 39.76 ? 64 GLY C CA 1 ATOM 5477 C C . GLY D 2 69 ? 61.557 -5.365 51.056 1.00 40.97 ? 64 GLY C C 1 ATOM 5478 O O . GLY D 2 69 ? 62.041 -4.305 50.638 1.00 42.32 ? 64 GLY C O 1 ATOM 5479 N N . SER D 2 70 ? 62.265 -6.282 51.700 1.00 41.11 ? 65 SER C N 1 ATOM 5480 C CA . SER D 2 70 ? 63.701 -6.123 51.872 1.00 42.42 ? 65 SER C CA 1 ATOM 5481 C C . SER D 2 70 ? 64.323 -7.469 52.137 1.00 42.17 ? 65 SER C C 1 ATOM 5482 O O . SER D 2 70 ? 63.610 -8.474 52.263 1.00 40.62 ? 65 SER C O 1 ATOM 5483 C CB . SER D 2 70 ? 64.004 -5.173 53.030 1.00 45.00 ? 65 SER C CB 1 ATOM 5484 O OG . SER D 2 70 ? 63.726 -5.788 54.290 1.00 45.87 ? 65 SER C OG 1 ATOM 5485 N N . GLY D 2 71 ? 65.656 -7.478 52.208 1.00 43.64 ? 66 GLY C N 1 ATOM 5486 C CA . GLY D 2 71 ? 66.417 -8.674 52.539 1.00 44.38 ? 66 GLY C CA 1 ATOM 5487 C C . GLY D 2 71 ? 67.355 -9.099 51.436 1.00 44.23 ? 66 GLY C C 1 ATOM 5488 O O . GLY D 2 71 ? 67.384 -8.486 50.376 1.00 43.26 ? 66 GLY C O 1 ATOM 5489 N N . SER D 2 72 ? 68.149 -10.133 51.716 1.00 45.63 ? 67 SER C N 1 ATOM 5490 C CA . SER D 2 72 ? 69.026 -10.750 50.719 1.00 45.52 ? 67 SER C CA 1 ATOM 5491 C C . SER D 2 72 ? 69.500 -12.101 51.219 1.00 46.32 ? 67 SER C C 1 ATOM 5492 O O . SER D 2 72 ? 69.441 -12.389 52.415 1.00 47.17 ? 67 SER C O 1 ATOM 5493 C CB . SER D 2 72 ? 70.229 -9.865 50.365 1.00 47.18 ? 67 SER C CB 1 ATOM 5494 O OG . SER D 2 72 ? 71.093 -9.714 51.469 1.00 50.54 ? 67 SER C OG 1 ATOM 5495 N N . GLY D 2 73 ? 69.927 -12.930 50.274 1.00 45.74 ? 68 GLY C N 1 ATOM 5496 C CA . GLY D 2 73 ? 70.570 -14.200 50.582 1.00 47.19 ? 68 GLY C CA 1 ATOM 5497 C C . GLY D 2 73 ? 69.593 -15.261 51.029 1.00 46.56 ? 68 GLY C C 1 ATOM 5498 O O . GLY D 2 73 ? 68.983 -15.926 50.200 1.00 44.76 ? 68 GLY C O 1 ATOM 5499 N N . THR D 2 74 ? 69.477 -15.443 52.343 1.00 48.47 ? 69 THR C N 1 ATOM 5500 C CA . THR D 2 74 ? 68.524 -16.395 52.907 1.00 48.76 ? 69 THR C CA 1 ATOM 5501 C C . THR D 2 74 ? 67.484 -15.729 53.800 1.00 48.77 ? 69 THR C C 1 ATOM 5502 O O . THR D 2 74 ? 66.699 -16.415 54.431 1.00 49.57 ? 69 THR C O 1 ATOM 5503 C CB . THR D 2 74 ? 69.216 -17.485 53.760 1.00 51.62 ? 69 THR C CB 1 ATOM 5504 O OG1 . THR D 2 74 ? 69.771 -16.905 54.946 1.00 53.88 ? 69 THR C OG1 1 ATOM 5505 C CG2 . THR D 2 74 ? 70.296 -18.191 52.966 1.00 52.59 ? 69 THR C CG2 1 ATOM 5506 N N . ASP D 2 75 ? 67.463 -14.406 53.849 1.00 48.85 ? 70 ASP C N 1 ATOM 5507 C CA . ASP D 2 75 ? 66.670 -13.698 54.860 1.00 49.47 ? 70 ASP C CA 1 ATOM 5508 C C . ASP D 2 75 ? 65.901 -12.542 54.220 1.00 47.44 ? 70 ASP C C 1 ATOM 5509 O O . ASP D 2 75 ? 66.513 -11.600 53.707 1.00 48.13 ? 70 ASP C O 1 ATOM 5510 C CB . ASP D 2 75 ? 67.582 -13.240 56.010 1.00 52.53 ? 70 ASP C CB 1 ATOM 5511 C CG . ASP D 2 75 ? 67.553 -14.203 57.182 1.00 54.98 ? 70 ASP C CG 1 ATOM 5512 O OD1 . ASP D 2 75 ? 66.522 -14.885 57.381 1.00 54.10 ? 70 ASP C OD1 1 ATOM 5513 O OD2 . ASP D 2 75 ? 68.568 -14.288 57.902 1.00 58.02 ? 70 ASP C OD2 1 ATOM 5514 N N . PHE D 2 76 ? 64.569 -12.646 54.219 1.00 45.20 ? 71 PHE C N 1 ATOM 5515 C CA . PHE D 2 76 ? 63.707 -11.660 53.575 1.00 43.02 ? 71 PHE C CA 1 ATOM 5516 C C . PHE D 2 76 ? 62.537 -11.257 54.478 1.00 42.79 ? 71 PHE C C 1 ATOM 5517 O O . PHE D 2 76 ? 62.066 -12.051 55.281 1.00 42.73 ? 71 PHE C O 1 ATOM 5518 C CB . PHE D 2 76 ? 63.176 -12.215 52.256 1.00 40.97 ? 71 PHE C CB 1 ATOM 5519 C CG . PHE D 2 76 ? 64.254 -12.624 51.298 1.00 40.93 ? 71 PHE C CG 1 ATOM 5520 C CD1 . PHE D 2 76 ? 64.822 -11.699 50.443 1.00 40.72 ? 71 PHE C CD1 1 ATOM 5521 C CD2 . PHE D 2 76 ? 64.716 -13.935 51.273 1.00 41.65 ? 71 PHE C CD2 1 ATOM 5522 C CE1 . PHE D 2 76 ? 65.835 -12.066 49.568 1.00 41.18 ? 71 PHE C CE1 1 ATOM 5523 C CE2 . PHE D 2 76 ? 65.728 -14.316 50.408 1.00 42.05 ? 71 PHE C CE2 1 ATOM 5524 C CZ . PHE D 2 76 ? 66.291 -13.377 49.551 1.00 41.85 ? 71 PHE C CZ 1 ATOM 5525 N N . THR D 2 77 ? 62.085 -10.015 54.327 1.00 42.41 ? 72 THR C N 1 ATOM 5526 C CA . THR D 2 77 ? 61.059 -9.444 55.181 1.00 43.29 ? 72 THR C CA 1 ATOM 5527 C C . THR D 2 77 ? 60.056 -8.586 54.417 1.00 42.27 ? 72 THR C C 1 ATOM 5528 O O . THR D 2 77 ? 60.445 -7.736 53.621 1.00 42.60 ? 72 THR C O 1 ATOM 5529 C CB . THR D 2 77 ? 61.677 -8.517 56.240 1.00 45.58 ? 72 THR C CB 1 ATOM 5530 O OG1 . THR D 2 77 ? 62.627 -9.239 57.020 1.00 47.44 ? 72 THR C OG1 1 ATOM 5531 C CG2 . THR D 2 77 ? 60.620 -7.965 57.181 1.00 46.10 ? 72 THR C CG2 1 ATOM 5532 N N . LEU D 2 78 ? 58.774 -8.773 54.715 1.00 41.83 ? 73 LEU C N 1 ATOM 5533 C CA . LEU D 2 78 ? 57.737 -7.894 54.217 1.00 41.45 ? 73 LEU C CA 1 ATOM 5534 C C . LEU D 2 78 ? 57.236 -7.052 55.391 1.00 43.02 ? 73 LEU C C 1 ATOM 5535 O O . LEU D 2 78 ? 56.845 -7.591 56.424 1.00 42.87 ? 73 LEU C O 1 ATOM 5536 C CB . LEU D 2 78 ? 56.587 -8.704 53.627 1.00 40.21 ? 73 LEU C CB 1 ATOM 5537 C CG . LEU D 2 78 ? 55.411 -7.882 53.104 1.00 40.33 ? 73 LEU C CG 1 ATOM 5538 C CD1 . LEU D 2 78 ? 55.804 -7.047 51.886 1.00 40.30 ? 73 LEU C CD1 1 ATOM 5539 C CD2 . LEU D 2 78 ? 54.253 -8.789 52.735 1.00 39.45 ? 73 LEU C CD2 1 ATOM 5540 N N . LYS D 2 79 ? 57.239 -5.733 55.210 1.00 44.19 ? 74 LYS C N 1 ATOM 5541 C CA . LYS D 2 79 ? 56.732 -4.805 56.219 1.00 46.50 ? 74 LYS C CA 1 ATOM 5542 C C . LYS D 2 79 ? 55.533 -3.989 55.766 1.00 45.56 ? 74 LYS C C 1 ATOM 5543 O O . LYS D 2 79 ? 55.507 -3.465 54.649 1.00 44.46 ? 74 LYS C O 1 ATOM 5544 C CB . LYS D 2 79 ? 57.801 -3.793 56.615 1.00 49.69 ? 74 LYS C CB 1 ATOM 5545 C CG . LYS D 2 79 ? 58.945 -4.390 57.388 1.00 51.97 ? 74 LYS C CG 1 ATOM 5546 C CD . LYS D 2 79 ? 59.662 -3.321 58.187 1.00 55.87 ? 74 LYS C CD 1 ATOM 5547 C CE . LYS D 2 79 ? 60.935 -3.881 58.806 1.00 58.23 ? 74 LYS C CE 1 ATOM 5548 N NZ . LYS D 2 79 ? 61.978 -4.148 57.769 1.00 57.55 ? 74 LYS C NZ 1 ATOM 5549 N N . ILE D 2 80 ? 54.573 -3.837 56.675 1.00 45.80 ? 75 ILE C N 1 ATOM 5550 C CA . ILE D 2 80 ? 53.435 -2.964 56.460 1.00 45.73 ? 75 ILE C CA 1 ATOM 5551 C C . ILE D 2 80 ? 53.530 -1.897 57.524 1.00 47.61 ? 75 ILE C C 1 ATOM 5552 O O . ILE D 2 80 ? 53.483 -2.197 58.716 1.00 48.67 ? 75 ILE C O 1 ATOM 5553 C CB . ILE D 2 80 ? 52.097 -3.715 56.570 1.00 45.03 ? 75 ILE C CB 1 ATOM 5554 C CG1 . ILE D 2 80 ? 52.126 -4.971 55.694 1.00 42.97 ? 75 ILE C CG1 1 ATOM 5555 C CG2 . ILE D 2 80 ? 50.956 -2.815 56.118 1.00 45.63 ? 75 ILE C CG2 1 ATOM 5556 C CD1 . ILE D 2 80 ? 50.966 -5.907 55.923 1.00 42.41 ? 75 ILE C CD1 1 ATOM 5557 N N . SER D 2 81 ? 53.682 -0.653 57.099 1.00 48.20 ? 76 SER C N 1 ATOM 5558 C CA . SER D 2 81 ? 53.945 0.414 58.048 1.00 50.75 ? 76 SER C CA 1 ATOM 5559 C C . SER D 2 81 ? 52.739 0.700 58.941 1.00 52.00 ? 76 SER C C 1 ATOM 5560 O O . SER D 2 81 ? 52.905 0.977 60.123 1.00 54.07 ? 76 SER C O 1 ATOM 5561 C CB . SER D 2 81 ? 54.377 1.683 57.326 1.00 51.77 ? 76 SER C CB 1 ATOM 5562 O OG . SER D 2 81 ? 53.388 2.086 56.413 1.00 51.07 ? 76 SER C OG 1 ATOM 5563 N N . ARG D 2 82 ? 51.535 0.615 58.368 1.00 51.15 ? 77 ARG C N 1 ATOM 5564 C CA . ARG D 2 82 ? 50.278 0.957 59.067 1.00 52.25 ? 77 ARG C CA 1 ATOM 5565 C C . ARG D 2 82 ? 49.119 0.147 58.483 1.00 50.19 ? 77 ARG C C 1 ATOM 5566 O O . ARG D 2 82 ? 48.544 0.538 57.461 1.00 49.09 ? 77 ARG C O 1 ATOM 5567 C CB . ARG D 2 82 ? 49.963 2.454 58.879 1.00 54.72 ? 77 ARG C CB 1 ATOM 5568 C CG . ARG D 2 82 ? 50.762 3.430 59.723 1.00 57.79 ? 77 ARG C CG 1 ATOM 5569 C CD . ARG D 2 82 ? 51.039 4.695 58.914 1.00 59.62 ? 77 ARG C CD 1 ATOM 5570 N NE . ARG D 2 82 ? 51.679 4.386 57.620 1.00 58.00 ? 77 ARG C NE 1 ATOM 5571 C CZ . ARG D 2 82 ? 52.722 5.024 57.076 1.00 58.97 ? 77 ARG C CZ 1 ATOM 5572 N NH1 . ARG D 2 82 ? 53.305 6.070 57.672 1.00 62.14 ? 77 ARG C NH1 1 ATOM 5573 N NH2 . ARG D 2 82 ? 53.186 4.602 55.899 1.00 57.01 ? 77 ARG C NH2 1 ATOM 5574 N N . VAL D 2 83 ? 48.761 -0.949 59.155 1.00 49.57 ? 78 VAL C N 1 ATOM 5575 C CA . VAL D 2 83 ? 47.814 -1.920 58.617 1.00 48.00 ? 78 VAL C CA 1 ATOM 5576 C C . VAL D 2 83 ? 46.407 -1.335 58.462 1.00 48.96 ? 78 VAL C C 1 ATOM 5577 O O . VAL D 2 83 ? 45.908 -0.643 59.352 1.00 50.68 ? 78 VAL C O 1 ATOM 5578 C CB . VAL D 2 83 ? 47.761 -3.189 59.497 1.00 47.76 ? 78 VAL C CB 1 ATOM 5579 C CG1 . VAL D 2 83 ? 46.589 -4.083 59.111 1.00 46.94 ? 78 VAL C CG1 1 ATOM 5580 C CG2 . VAL D 2 83 ? 49.067 -3.958 59.386 1.00 46.49 ? 78 VAL C CG2 1 ATOM 5581 N N . GLU D 2 84 ? 45.806 -1.609 57.300 1.00 47.96 ? 79 GLU C N 1 ATOM 5582 C CA . GLU D 2 84 ? 44.393 -1.323 57.027 1.00 48.98 ? 79 GLU C CA 1 ATOM 5583 C C . GLU D 2 84 ? 43.619 -2.599 56.736 1.00 48.00 ? 79 GLU C C 1 ATOM 5584 O O . GLU D 2 84 ? 44.215 -3.641 56.443 1.00 46.26 ? 79 GLU C O 1 ATOM 5585 C CB . GLU D 2 84 ? 44.267 -0.406 55.834 1.00 49.23 ? 79 GLU C CB 1 ATOM 5586 C CG . GLU D 2 84 ? 45.200 0.769 55.912 1.00 50.59 ? 79 GLU C CG 1 ATOM 5587 C CD . GLU D 2 84 ? 44.601 1.977 55.246 1.00 52.78 ? 79 GLU C CD 1 ATOM 5588 O OE1 . GLU D 2 84 ? 45.069 2.361 54.143 1.00 52.53 ? 79 GLU C OE1 1 ATOM 5589 O OE2 . GLU D 2 84 ? 43.640 2.530 55.850 1.00 54.79 ? 79 GLU C OE2 1 ATOM 5590 N N . ALA D 2 85 ? 42.291 -2.498 56.786 1.00 49.48 ? 80 ALA C N 1 ATOM 5591 C CA . ALA D 2 85 ? 41.413 -3.662 56.709 1.00 49.30 ? 80 ALA C CA 1 ATOM 5592 C C . ALA D 2 85 ? 41.743 -4.500 55.495 1.00 47.74 ? 80 ALA C C 1 ATOM 5593 O O . ALA D 2 85 ? 41.900 -5.711 55.588 1.00 46.91 ? 80 ALA C O 1 ATOM 5594 C CB . ALA D 2 85 ? 39.955 -3.225 56.679 1.00 51.07 ? 80 ALA C CB 1 ATOM 5595 N N . GLU D 2 86 ? 41.894 -3.839 54.360 1.00 47.90 ? 81 GLU C N 1 ATOM 5596 C CA . GLU D 2 86 ? 42.092 -4.534 53.093 1.00 47.13 ? 81 GLU C CA 1 ATOM 5597 C C . GLU D 2 86 ? 43.391 -5.349 53.045 1.00 45.18 ? 81 GLU C C 1 ATOM 5598 O O . GLU D 2 86 ? 43.557 -6.175 52.163 1.00 43.95 ? 81 GLU C O 1 ATOM 5599 C CB . GLU D 2 86 ? 42.072 -3.530 51.946 1.00 48.11 ? 81 GLU C CB 1 ATOM 5600 C CG . GLU D 2 86 ? 43.240 -2.555 51.983 1.00 48.81 ? 81 GLU C CG 1 ATOM 5601 C CD . GLU D 2 86 ? 42.972 -1.293 51.194 1.00 51.03 ? 81 GLU C CD 1 ATOM 5602 O OE1 . GLU D 2 86 ? 43.843 -0.928 50.361 1.00 51.23 ? 81 GLU C OE1 1 ATOM 5603 O OE2 . GLU D 2 86 ? 41.896 -0.677 51.410 1.00 53.35 ? 81 GLU C OE2 1 ATOM 5604 N N . ASP D 2 87 ? 44.300 -5.112 53.989 1.00 45.15 ? 82 ASP C N 1 ATOM 5605 C CA . ASP D 2 87 ? 45.568 -5.844 54.047 1.00 43.61 ? 82 ASP C CA 1 ATOM 5606 C C . ASP D 2 87 ? 45.437 -7.233 54.666 1.00 42.90 ? 82 ASP C C 1 ATOM 5607 O O . ASP D 2 87 ? 46.363 -8.039 54.577 1.00 41.89 ? 82 ASP C O 1 ATOM 5608 C CB . ASP D 2 87 ? 46.607 -5.069 54.860 1.00 44.73 ? 82 ASP C CB 1 ATOM 5609 C CG . ASP D 2 87 ? 46.836 -3.663 54.348 1.00 45.81 ? 82 ASP C CG 1 ATOM 5610 O OD1 . ASP D 2 87 ? 46.619 -3.421 53.144 1.00 46.32 ? 82 ASP C OD1 1 ATOM 5611 O OD2 . ASP D 2 87 ? 47.251 -2.792 55.142 1.00 47.51 ? 82 ASP C OD2 1 ATOM 5612 N N . LEU D 2 88 ? 44.308 -7.514 55.305 1.00 43.36 ? 83 LEU C N 1 ATOM 5613 C CA . LEU D 2 88 ? 44.115 -8.787 55.973 1.00 43.03 ? 83 LEU C CA 1 ATOM 5614 C C . LEU D 2 88 ? 44.007 -9.883 54.931 1.00 41.34 ? 83 LEU C C 1 ATOM 5615 O O . LEU D 2 88 ? 43.463 -9.662 53.839 1.00 41.04 ? 83 LEU C O 1 ATOM 5616 C CB . LEU D 2 88 ? 42.864 -8.753 56.847 1.00 45.03 ? 83 LEU C CB 1 ATOM 5617 C CG . LEU D 2 88 ? 42.787 -7.647 57.905 1.00 46.66 ? 83 LEU C CG 1 ATOM 5618 C CD1 . LEU D 2 88 ? 41.410 -7.665 58.538 1.00 48.41 ? 83 LEU C CD1 1 ATOM 5619 C CD2 . LEU D 2 88 ? 43.886 -7.804 58.957 1.00 46.94 ? 83 LEU C CD2 1 ATOM 5620 N N . GLY D 2 89 ? 44.547 -11.053 55.267 1.00 40.46 ? 84 GLY C N 1 ATOM 5621 C CA . GLY D 2 89 ? 44.563 -12.195 54.358 1.00 39.23 ? 84 GLY C CA 1 ATOM 5622 C C . GLY D 2 89 ? 45.809 -12.990 54.642 1.00 38.35 ? 84 GLY C C 1 ATOM 5623 O O . GLY D 2 89 ? 46.410 -12.816 55.689 1.00 39.36 ? 84 GLY C O 1 ATOM 5624 N N . VAL D 2 90 ? 46.205 -13.850 53.711 1.00 36.99 ? 85 VAL C N 1 ATOM 5625 C CA . VAL D 2 90 ? 47.377 -14.694 53.894 1.00 36.41 ? 85 VAL C CA 1 ATOM 5626 C C . VAL D 2 90 ? 48.476 -14.266 52.950 1.00 34.85 ? 85 VAL C C 1 ATOM 5627 O O . VAL D 2 90 ? 48.285 -14.255 51.735 1.00 34.07 ? 85 VAL C O 1 ATOM 5628 C CB . VAL D 2 90 ? 47.068 -16.179 53.619 1.00 36.94 ? 85 VAL C CB 1 ATOM 5629 C CG1 . VAL D 2 90 ? 48.263 -17.052 53.959 1.00 37.23 ? 85 VAL C CG1 1 ATOM 5630 C CG2 . VAL D 2 90 ? 45.843 -16.619 54.397 1.00 38.56 ? 85 VAL C CG2 1 ATOM 5631 N N . TYR D 2 91 ? 49.640 -13.963 53.515 1.00 34.71 ? 86 TYR C N 1 ATOM 5632 C CA . TYR D 2 91 ? 50.795 -13.547 52.746 1.00 33.48 ? 86 TYR C CA 1 ATOM 5633 C C . TYR D 2 91 ? 51.699 -14.736 52.502 1.00 33.90 ? 86 TYR C C 1 ATOM 5634 O O . TYR D 2 91 ? 51.879 -15.548 53.414 1.00 34.91 ? 86 TYR C O 1 ATOM 5635 C CB . TYR D 2 91 ? 51.572 -12.486 53.509 1.00 33.58 ? 86 TYR C CB 1 ATOM 5636 C CG . TYR D 2 91 ? 50.837 -11.190 53.612 1.00 33.41 ? 86 TYR C CG 1 ATOM 5637 C CD1 . TYR D 2 91 ? 49.859 -11.007 54.570 1.00 34.34 ? 86 TYR C CD1 1 ATOM 5638 C CD2 . TYR D 2 91 ? 51.121 -10.141 52.755 1.00 32.50 ? 86 TYR C CD2 1 ATOM 5639 C CE1 . TYR D 2 91 ? 49.180 -9.812 54.669 1.00 34.72 ? 86 TYR C CE1 1 ATOM 5640 C CE2 . TYR D 2 91 ? 50.459 -8.944 52.857 1.00 32.99 ? 86 TYR C CE2 1 ATOM 5641 C CZ . TYR D 2 91 ? 49.495 -8.781 53.803 1.00 34.10 ? 86 TYR C CZ 1 ATOM 5642 O OH . TYR D 2 91 ? 48.855 -7.570 53.826 1.00 34.92 ? 86 TYR C OH 1 ATOM 5643 N N . TYR D 2 92 ? 52.276 -14.817 51.290 1.00 33.26 ? 87 TYR C N 1 ATOM 5644 C CA . TYR D 2 92 ? 53.208 -15.871 50.912 1.00 33.59 ? 87 TYR C CA 1 ATOM 5645 C C . TYR D 2 92 ? 54.453 -15.255 50.274 1.00 33.62 ? 87 TYR C C 1 ATOM 5646 O O . TYR D 2 92 ? 54.352 -14.326 49.454 1.00 32.38 ? 87 TYR C O 1 ATOM 5647 C CB . TYR D 2 92 ? 52.560 -16.811 49.892 1.00 33.00 ? 87 TYR C CB 1 ATOM 5648 C CG . TYR D 2 92 ? 51.379 -17.598 50.393 1.00 33.72 ? 87 TYR C CG 1 ATOM 5649 C CD1 . TYR D 2 92 ? 51.549 -18.805 51.054 1.00 35.06 ? 87 TYR C CD1 1 ATOM 5650 C CD2 . TYR D 2 92 ? 50.081 -17.157 50.162 1.00 33.52 ? 87 TYR C CD2 1 ATOM 5651 C CE1 . TYR D 2 92 ? 50.457 -19.539 51.487 1.00 36.25 ? 87 TYR C CE1 1 ATOM 5652 C CE2 . TYR D 2 92 ? 48.985 -17.875 50.607 1.00 34.44 ? 87 TYR C CE2 1 ATOM 5653 C CZ . TYR D 2 92 ? 49.182 -19.060 51.263 1.00 35.82 ? 87 TYR C CZ 1 ATOM 5654 O OH . TYR D 2 92 ? 48.118 -19.789 51.687 1.00 37.28 ? 87 TYR C OH 1 ATOM 5655 N N . CYS D 2 93 ? 55.630 -15.746 50.670 1.00 35.26 ? 88 CYS C N 1 ATOM 5656 C CA . CYS D 2 93 ? 56.843 -15.494 49.903 1.00 35.14 ? 88 CYS C CA 1 ATOM 5657 C C . CYS D 2 93 ? 56.978 -16.601 48.841 1.00 34.15 ? 88 CYS C C 1 ATOM 5658 O O . CYS D 2 93 ? 56.385 -17.674 48.944 1.00 34.02 ? 88 CYS C O 1 ATOM 5659 C CB . CYS D 2 93 ? 58.092 -15.364 50.804 1.00 37.54 ? 88 CYS C CB 1 ATOM 5660 S SG . CYS D 2 93 ? 58.494 -16.803 51.837 1.00 40.67 ? 88 CYS C SG 1 ATOM 5661 N N . PHE D 2 94 ? 57.730 -16.292 47.797 1.00 33.38 ? 89 PHE C N 1 ATOM 5662 C CA . PHE D 2 94 ? 57.992 -17.218 46.689 1.00 32.94 ? 89 PHE C CA 1 ATOM 5663 C C . PHE D 2 94 ? 59.373 -16.948 46.098 1.00 32.67 ? 89 PHE C C 1 ATOM 5664 O O . PHE D 2 94 ? 59.714 -15.794 45.803 1.00 31.98 ? 89 PHE C O 1 ATOM 5665 C CB . PHE D 2 94 ? 56.939 -17.023 45.605 1.00 32.15 ? 89 PHE C CB 1 ATOM 5666 C CG . PHE D 2 94 ? 57.263 -17.695 44.282 1.00 32.09 ? 89 PHE C CG 1 ATOM 5667 C CD1 . PHE D 2 94 ? 57.003 -19.040 44.091 1.00 32.82 ? 89 PHE C CD1 1 ATOM 5668 C CD2 . PHE D 2 94 ? 57.769 -16.965 43.228 1.00 31.53 ? 89 PHE C CD2 1 ATOM 5669 C CE1 . PHE D 2 94 ? 57.267 -19.649 42.889 1.00 33.00 ? 89 PHE C CE1 1 ATOM 5670 C CE2 . PHE D 2 94 ? 58.050 -17.562 42.013 1.00 31.90 ? 89 PHE C CE2 1 ATOM 5671 C CZ . PHE D 2 94 ? 57.793 -18.911 41.840 1.00 32.68 ? 89 PHE C CZ 1 ATOM 5672 N N . GLN D 2 95 ? 60.145 -18.013 45.890 1.00 33.05 ? 90 GLN C N 1 ATOM 5673 C CA . GLN D 2 95 ? 61.444 -17.911 45.245 1.00 33.05 ? 90 GLN C CA 1 ATOM 5674 C C . GLN D 2 95 ? 61.419 -18.531 43.849 1.00 32.68 ? 90 GLN C C 1 ATOM 5675 O O . GLN D 2 95 ? 60.984 -19.674 43.665 1.00 32.88 ? 90 GLN C O 1 ATOM 5676 C CB . GLN D 2 95 ? 62.533 -18.554 46.103 1.00 34.71 ? 90 GLN C CB 1 ATOM 5677 C CG . GLN D 2 95 ? 62.480 -20.076 46.226 1.00 35.75 ? 90 GLN C CG 1 ATOM 5678 C CD . GLN D 2 95 ? 63.235 -20.803 45.126 1.00 35.86 ? 90 GLN C CD 1 ATOM 5679 O OE1 . GLN D 2 95 ? 64.068 -20.213 44.429 1.00 35.02 ? 90 GLN C OE1 1 ATOM 5680 N NE2 . GLN D 2 95 ? 62.957 -22.096 44.978 1.00 36.65 ? 90 GLN C NE2 1 ATOM 5681 N N . GLY D 2 96 ? 61.886 -17.759 42.866 1.00 32.14 ? 91 GLY C N 1 ATOM 5682 C CA . GLY D 2 96 ? 62.002 -18.213 41.471 1.00 31.93 ? 91 GLY C CA 1 ATOM 5683 C C . GLY D 2 96 ? 63.453 -18.312 41.028 1.00 32.77 ? 91 GLY C C 1 ATOM 5684 O O . GLY D 2 96 ? 63.778 -18.118 39.845 1.00 32.64 ? 91 GLY C O 1 ATOM 5685 N N . SER D 2 97 ? 64.328 -18.628 41.978 1.00 33.79 ? 92 SER C N 1 ATOM 5686 C CA . SER D 2 97 ? 65.761 -18.761 41.701 1.00 34.92 ? 92 SER C CA 1 ATOM 5687 C C . SER D 2 97 ? 66.136 -20.195 41.386 1.00 35.88 ? 92 SER C C 1 ATOM 5688 O O . SER D 2 97 ? 66.874 -20.454 40.448 1.00 36.32 ? 92 SER C O 1 ATOM 5689 C CB . SER D 2 97 ? 66.572 -18.288 42.893 1.00 36.17 ? 92 SER C CB 1 ATOM 5690 O OG . SER D 2 97 ? 67.955 -18.596 42.725 1.00 38.19 ? 92 SER C OG 1 ATOM 5691 N N . HIS D 2 98 ? 65.626 -21.122 42.176 1.00 36.47 ? 93 HIS C N 1 ATOM 5692 C CA . HIS D 2 98 ? 66.025 -22.511 42.067 1.00 38.18 ? 93 HIS C CA 1 ATOM 5693 C C . HIS D 2 98 ? 64.844 -23.399 41.747 1.00 38.09 ? 93 HIS C C 1 ATOM 5694 O O . HIS D 2 98 ? 63.904 -23.475 42.528 1.00 38.04 ? 93 HIS C O 1 ATOM 5695 C CB . HIS D 2 98 ? 66.586 -22.984 43.394 1.00 40.11 ? 93 HIS C CB 1 ATOM 5696 C CG . HIS D 2 98 ? 67.745 -22.191 43.908 1.00 40.72 ? 93 HIS C CG 1 ATOM 5697 N ND1 . HIS D 2 98 ? 69.052 -22.490 43.590 1.00 42.37 ? 93 HIS C ND1 1 ATOM 5698 C CD2 . HIS D 2 98 ? 67.797 -21.150 44.774 1.00 40.40 ? 93 HIS C CD2 1 ATOM 5699 C CE1 . HIS D 2 98 ? 69.861 -21.648 44.213 1.00 42.95 ? 93 HIS C CE1 1 ATOM 5700 N NE2 . HIS D 2 98 ? 69.125 -20.827 44.943 1.00 41.87 ? 93 HIS C NE2 1 ATOM 5701 N N . VAL D 2 99 ? 64.897 -24.077 40.605 1.00 38.48 ? 94 VAL C N 1 ATOM 5702 C CA . VAL D 2 99 ? 63.889 -25.060 40.218 1.00 38.72 ? 94 VAL C CA 1 ATOM 5703 C C . VAL D 2 99 ? 64.027 -26.283 41.124 1.00 40.83 ? 94 VAL C C 1 ATOM 5704 O O . VAL D 2 99 ? 65.133 -26.766 41.310 1.00 42.49 ? 94 VAL C O 1 ATOM 5705 C CB . VAL D 2 99 ? 64.102 -25.515 38.755 1.00 39.15 ? 94 VAL C CB 1 ATOM 5706 C CG1 . VAL D 2 99 ? 63.114 -26.611 38.367 1.00 40.18 ? 94 VAL C CG1 1 ATOM 5707 C CG2 . VAL D 2 99 ? 63.980 -24.334 37.803 1.00 37.36 ? 94 VAL C CG2 1 ATOM 5708 N N . PRO D 2 100 ? 62.914 -26.805 41.678 1.00 41.01 ? 95 PRO C N 1 ATOM 5709 C CA . PRO D 2 100 ? 61.527 -26.351 41.578 1.00 39.37 ? 95 PRO C CA 1 ATOM 5710 C C . PRO D 2 100 ? 61.262 -25.144 42.454 1.00 37.63 ? 95 PRO C C 1 ATOM 5711 O O . PRO D 2 100 ? 61.737 -25.078 43.587 1.00 38.41 ? 95 PRO C O 1 ATOM 5712 C CB . PRO D 2 100 ? 60.722 -27.552 42.086 1.00 41.24 ? 95 PRO C CB 1 ATOM 5713 C CG . PRO D 2 100 ? 61.646 -28.264 43.004 1.00 43.44 ? 95 PRO C CG 1 ATOM 5714 C CD . PRO D 2 100 ? 63.031 -28.042 42.474 1.00 43.59 ? 95 PRO C CD 1 ATOM 5715 N N . TYR D 2 101 ? 60.501 -24.194 41.933 1.00 35.48 ? 96 TYR C N 1 ATOM 5716 C CA . TYR D 2 101 ? 60.239 -22.956 42.657 1.00 33.92 ? 96 TYR C CA 1 ATOM 5717 C C . TYR D 2 101 ? 59.265 -23.236 43.780 1.00 34.16 ? 96 TYR C C 1 ATOM 5718 O O . TYR D 2 101 ? 58.473 -24.160 43.693 1.00 35.01 ? 96 TYR C O 1 ATOM 5719 C CB . TYR D 2 101 ? 59.712 -21.878 41.705 1.00 32.16 ? 96 TYR C CB 1 ATOM 5720 C CG . TYR D 2 101 ? 60.632 -21.624 40.526 1.00 31.87 ? 96 TYR C CG 1 ATOM 5721 C CD1 . TYR D 2 101 ? 62.018 -21.515 40.696 1.00 32.42 ? 96 TYR C CD1 1 ATOM 5722 C CD2 . TYR D 2 101 ? 60.124 -21.488 39.232 1.00 31.30 ? 96 TYR C CD2 1 ATOM 5723 C CE1 . TYR D 2 101 ? 62.858 -21.278 39.619 1.00 32.23 ? 96 TYR C CE1 1 ATOM 5724 C CE2 . TYR D 2 101 ? 60.958 -21.254 38.152 1.00 31.15 ? 96 TYR C CE2 1 ATOM 5725 C CZ . TYR D 2 101 ? 62.311 -21.153 38.343 1.00 31.53 ? 96 TYR C CZ 1 ATOM 5726 O OH . TYR D 2 101 ? 63.082 -20.915 37.242 1.00 31.41 ? 96 TYR C OH 1 ATOM 5727 N N . THR D 2 102 ? 59.349 -22.454 44.851 1.00 33.77 ? 97 THR C N 1 ATOM 5728 C CA . THR D 2 102 ? 58.682 -22.797 46.100 1.00 34.71 ? 97 THR C CA 1 ATOM 5729 C C . THR D 2 102 ? 58.161 -21.586 46.844 1.00 33.75 ? 97 THR C C 1 ATOM 5730 O O . THR D 2 102 ? 58.696 -20.484 46.740 1.00 32.69 ? 97 THR C O 1 ATOM 5731 C CB . THR D 2 102 ? 59.606 -23.576 47.052 1.00 36.59 ? 97 THR C CB 1 ATOM 5732 O OG1 . THR D 2 102 ? 60.878 -22.933 47.098 1.00 36.45 ? 97 THR C OG1 1 ATOM 5733 C CG2 . THR D 2 102 ? 59.801 -25.008 46.579 1.00 38.26 ? 97 THR C CG2 1 ATOM 5734 N N . PHE D 2 103 ? 57.081 -21.838 47.574 1.00 34.41 ? 98 PHE C N 1 ATOM 5735 C CA . PHE D 2 103 ? 56.366 -20.849 48.346 1.00 33.87 ? 98 PHE C CA 1 ATOM 5736 C C . PHE D 2 103 ? 56.599 -21.100 49.819 1.00 35.49 ? 98 PHE C C 1 ATOM 5737 O O . PHE D 2 103 ? 56.771 -22.241 50.236 1.00 37.14 ? 98 PHE C O 1 ATOM 5738 C CB . PHE D 2 103 ? 54.868 -21.020 48.126 1.00 33.86 ? 98 PHE C CB 1 ATOM 5739 C CG . PHE D 2 103 ? 54.375 -20.569 46.787 1.00 32.49 ? 98 PHE C CG 1 ATOM 5740 C CD1 . PHE D 2 103 ? 54.289 -21.471 45.724 1.00 32.86 ? 98 PHE C CD1 1 ATOM 5741 C CD2 . PHE D 2 103 ? 53.938 -19.262 46.599 1.00 31.26 ? 98 PHE C CD2 1 ATOM 5742 C CE1 . PHE D 2 103 ? 53.805 -21.069 44.494 1.00 31.96 ? 98 PHE C CE1 1 ATOM 5743 C CE2 . PHE D 2 103 ? 53.453 -18.852 45.361 1.00 30.55 ? 98 PHE C CE2 1 ATOM 5744 C CZ . PHE D 2 103 ? 53.393 -19.755 44.308 1.00 30.80 ? 98 PHE C CZ 1 ATOM 5745 N N . GLY D 2 104 ? 56.563 -20.043 50.617 1.00 35.26 ? 99 GLY C N 1 ATOM 5746 C CA . GLY D 2 104 ? 56.477 -20.194 52.055 1.00 36.92 ? 99 GLY C CA 1 ATOM 5747 C C . GLY D 2 104 ? 55.123 -20.749 52.444 1.00 37.78 ? 99 GLY C C 1 ATOM 5748 O O . GLY D 2 104 ? 54.204 -20.834 51.606 1.00 37.64 ? 99 GLY C O 1 ATOM 5749 N N . GLY D 2 105 ? 55.003 -21.157 53.700 1.00 39.47 ? 100 GLY C N 1 ATOM 5750 C CA . GLY D 2 105 ? 53.794 -21.794 54.196 1.00 40.53 ? 100 GLY C CA 1 ATOM 5751 C C . GLY D 2 105 ? 52.631 -20.855 54.440 1.00 39.70 ? 100 GLY C C 1 ATOM 5752 O O . GLY D 2 105 ? 51.516 -21.311 54.659 1.00 40.26 ? 100 GLY C O 1 ATOM 5753 N N . GLY D 2 106 ? 52.889 -19.551 54.428 1.00 38.40 ? 101 GLY C N 1 ATOM 5754 C CA . GLY D 2 106 ? 51.844 -18.585 54.626 1.00 37.90 ? 101 GLY C CA 1 ATOM 5755 C C . GLY D 2 106 ? 51.834 -17.964 56.008 1.00 39.42 ? 101 GLY C C 1 ATOM 5756 O O . GLY D 2 106 ? 52.058 -18.639 57.016 1.00 40.96 ? 101 GLY C O 1 ATOM 5757 N N . THR D 2 107 ? 51.585 -16.656 56.033 1.00 39.16 ? 102 THR C N 1 ATOM 5758 C CA . THR D 2 107 ? 51.389 -15.911 57.259 1.00 40.64 ? 102 THR C CA 1 ATOM 5759 C C . THR D 2 107 ? 50.036 -15.236 57.165 1.00 40.95 ? 102 THR C C 1 ATOM 5760 O O . THR D 2 107 ? 49.793 -14.409 56.279 1.00 39.58 ? 102 THR C O 1 ATOM 5761 C CB . THR D 2 107 ? 52.464 -14.839 57.457 1.00 40.38 ? 102 THR C CB 1 ATOM 5762 O OG1 . THR D 2 107 ? 53.738 -15.479 57.559 1.00 41.00 ? 102 THR C OG1 1 ATOM 5763 C CG2 . THR D 2 107 ? 52.171 -13.986 58.719 1.00 41.84 ? 102 THR C CG2 1 ATOM 5764 N N . LYS D 2 108 ? 49.162 -15.594 58.097 1.00 42.97 ? 103 LYS C N 1 ATOM 5765 C CA . LYS D 2 108 ? 47.811 -15.087 58.126 1.00 43.44 ? 103 LYS C CA 1 ATOM 5766 C C . LYS D 2 108 ? 47.737 -13.830 58.971 1.00 43.82 ? 103 LYS C C 1 ATOM 5767 O O . LYS D 2 108 ? 47.935 -13.884 60.181 1.00 45.69 ? 103 LYS C O 1 ATOM 5768 C CB . LYS D 2 108 ? 46.898 -16.155 58.713 1.00 45.82 ? 103 LYS C CB 1 ATOM 5769 C CG . LYS D 2 108 ? 45.426 -15.859 58.497 1.00 46.77 ? 103 LYS C CG 1 ATOM 5770 C CD . LYS D 2 108 ? 44.590 -17.129 58.437 1.00 48.37 ? 103 LYS C CD 1 ATOM 5771 C CE . LYS D 2 108 ? 43.159 -16.791 58.058 1.00 49.14 ? 103 LYS C CE 1 ATOM 5772 N NZ . LYS D 2 108 ? 42.508 -15.962 59.117 1.00 51.13 ? 103 LYS C NZ 1 ATOM 5773 N N . LEU D 2 109 ? 47.450 -12.700 58.338 1.00 42.47 ? 104 LEU C N 1 ATOM 5774 C CA . LEU D 2 109 ? 47.351 -11.437 59.043 1.00 43.29 ? 104 LEU C CA 1 ATOM 5775 C C . LEU D 2 109 ? 45.906 -11.301 59.496 1.00 44.40 ? 104 LEU C C 1 ATOM 5776 O O . LEU D 2 109 ? 44.983 -11.344 58.687 1.00 44.03 ? 104 LEU C O 1 ATOM 5777 C CB . LEU D 2 109 ? 47.771 -10.277 58.142 1.00 42.13 ? 104 LEU C CB 1 ATOM 5778 C CG . LEU D 2 109 ? 48.004 -8.926 58.816 1.00 43.25 ? 104 LEU C CG 1 ATOM 5779 C CD1 . LEU D 2 109 ? 49.247 -8.966 59.688 1.00 44.43 ? 104 LEU C CD1 1 ATOM 5780 C CD2 . LEU D 2 109 ? 48.132 -7.814 57.791 1.00 42.42 ? 104 LEU C CD2 1 ATOM 5781 N N . GLU D 2 110 ? 45.715 -11.189 60.801 1.00 48.44 ? 105 GLU C N 1 ATOM 5782 C CA . GLU D 2 110 ? 44.389 -11.234 61.383 1.00 46.20 ? 105 GLU C CA 1 ATOM 5783 C C . GLU D 2 110 ? 44.146 -10.106 62.352 1.00 44.24 ? 105 GLU C C 1 ATOM 5784 O O . GLU D 2 110 ? 45.073 -9.488 62.854 1.00 45.47 ? 105 GLU C O 1 ATOM 5785 C CB . GLU D 2 110 ? 44.209 -12.543 62.133 1.00 48.82 ? 105 GLU C CB 1 ATOM 5786 C CG . GLU D 2 110 ? 44.195 -13.776 61.249 1.00 53.33 ? 105 GLU C CG 1 ATOM 5787 C CD . GLU D 2 110 ? 44.310 -15.091 61.997 1.00 58.86 ? 105 GLU C CD 1 ATOM 5788 O OE1 . GLU D 2 110 ? 43.720 -16.085 61.509 1.00 63.35 ? 105 GLU C OE1 1 ATOM 5789 O OE2 . GLU D 2 110 ? 44.981 -15.143 63.054 1.00 60.27 ? 105 GLU C OE2 1 ATOM 5790 N N . LEU D 2 111 ? 42.877 -9.869 62.629 1.00 43.14 ? 106 LEU C N 1 ATOM 5791 C CA . LEU D 2 111 ? 42.468 -8.804 63.539 1.00 43.18 ? 106 LEU C CA 1 ATOM 5792 C C . LEU D 2 111 ? 42.537 -9.215 64.982 1.00 43.46 ? 106 LEU C C 1 ATOM 5793 O O . LEU D 2 111 ? 42.122 -10.314 65.361 1.00 43.42 ? 106 LEU C O 1 ATOM 5794 C CB . LEU D 2 111 ? 41.032 -8.373 63.296 1.00 44.34 ? 106 LEU C CB 1 ATOM 5795 C CG . LEU D 2 111 ? 40.722 -6.963 62.774 1.00 47.10 ? 106 LEU C CG 1 ATOM 5796 C CD1 . LEU D 2 111 ? 41.926 -6.215 62.224 1.00 47.44 ? 106 LEU C CD1 1 ATOM 5797 C CD2 . LEU D 2 111 ? 39.591 -6.996 61.751 1.00 50.22 ? 106 LEU C CD2 1 ATOM 5798 N N . LYS D 2 112 ? 43.009 -8.284 65.795 1.00 45.04 ? 107 LYS C N 1 ATOM 5799 C CA . LYS D 2 112 ? 43.148 -8.530 67.199 1.00 46.29 ? 107 LYS C CA 1 ATOM 5800 C C . LYS D 2 112 ? 41.840 -8.078 67.846 1.00 46.23 ? 107 LYS C C 1 ATOM 5801 O O . LYS D 2 112 ? 41.254 -7.067 67.453 1.00 47.75 ? 107 LYS C O 1 ATOM 5802 C CB . LYS D 2 112 ? 44.351 -7.730 67.720 1.00 50.54 ? 107 LYS C CB 1 ATOM 5803 C CG . LYS D 2 112 ? 45.238 -8.377 68.769 1.00 53.90 ? 107 LYS C CG 1 ATOM 5804 C CD . LYS D 2 112 ? 46.503 -7.548 68.833 1.00 60.02 ? 107 LYS C CD 1 ATOM 5805 C CE . LYS D 2 112 ? 47.373 -7.947 70.001 1.00 66.40 ? 107 LYS C CE 1 ATOM 5806 N NZ . LYS D 2 112 ? 48.656 -7.197 69.971 1.00 74.94 ? 107 LYS C NZ 1 ATOM 5807 N N . ARG D 2 113 ? 41.379 -8.855 68.820 1.00 45.84 ? 108 ARG C N 1 ATOM 5808 C CA . ARG D 2 113 ? 40.192 -8.508 69.632 1.00 46.58 ? 108 ARG C CA 1 ATOM 5809 C C . ARG D 2 113 ? 40.363 -9.082 71.023 1.00 46.99 ? 108 ARG C C 1 ATOM 5810 O O . ARG D 2 113 ? 41.220 -9.945 71.239 1.00 47.42 ? 108 ARG C O 1 ATOM 5811 C CB . ARG D 2 113 ? 38.860 -9.002 69.034 1.00 46.55 ? 108 ARG C CB 1 ATOM 5812 C CG . ARG D 2 113 ? 38.755 -10.500 68.764 1.00 45.72 ? 108 ARG C CG 1 ATOM 5813 C CD . ARG D 2 113 ? 37.325 -11.045 68.851 1.00 48.35 ? 108 ARG C CD 1 ATOM 5814 N NE . ARG D 2 113 ? 36.773 -10.876 70.193 1.00 49.04 ? 108 ARG C NE 1 ATOM 5815 C CZ . ARG D 2 113 ? 35.595 -10.338 70.506 1.00 52.36 ? 108 ARG C CZ 1 ATOM 5816 N NH1 . ARG D 2 113 ? 34.751 -9.882 69.584 1.00 56.24 ? 108 ARG C NH1 1 ATOM 5817 N NH2 . ARG D 2 113 ? 35.251 -10.267 71.782 1.00 53.31 ? 108 ARG C NH2 1 ATOM 5818 N N . ALA D 2 114 ? 39.546 -8.604 71.961 1.00 48.33 ? 109 ALA C N 1 ATOM 5819 C CA . ALA D 2 114 ? 39.509 -9.159 73.306 1.00 48.56 ? 109 ALA C CA 1 ATOM 5820 C C . ALA D 2 114 ? 39.267 -10.649 73.250 1.00 46.93 ? 109 ALA C C 1 ATOM 5821 O O . ALA D 2 114 ? 38.455 -11.123 72.461 1.00 46.58 ? 109 ALA C O 1 ATOM 5822 C CB . ALA D 2 114 ? 38.408 -8.509 74.118 1.00 50.98 ? 109 ALA C CB 1 ATOM 5823 N N . ASP D 2 115 ? 39.962 -11.383 74.103 1.00 48.15 ? 110 ASP C N 1 ATOM 5824 C CA . ASP D 2 115 ? 39.735 -12.804 74.251 1.00 49.34 ? 110 ASP C CA 1 ATOM 5825 C C . ASP D 2 115 ? 38.261 -13.062 74.577 1.00 49.51 ? 110 ASP C C 1 ATOM 5826 O O . ASP D 2 115 ? 37.586 -12.219 75.170 1.00 49.32 ? 110 ASP C O 1 ATOM 5827 C CB . ASP D 2 115 ? 40.696 -13.389 75.296 1.00 53.00 ? 110 ASP C CB 1 ATOM 5828 C CG . ASP D 2 115 ? 42.112 -13.563 74.749 1.00 55.89 ? 110 ASP C CG 1 ATOM 5829 O OD1 . ASP D 2 115 ? 42.352 -13.218 73.567 1.00 53.96 ? 110 ASP C OD1 1 ATOM 5830 O OD2 . ASP D 2 115 ? 42.985 -14.060 75.494 1.00 61.41 ? 110 ASP C OD2 1 ATOM 5831 N N . ALA D 2 116 ? 37.750 -14.191 74.093 1.00 55.10 ? 111 ALA C N 1 ATOM 5832 C CA . ALA D 2 116 ? 36.361 -14.584 74.332 1.00 54.52 ? 111 ALA C CA 1 ATOM 5833 C C . ALA D 2 116 ? 36.261 -16.089 74.433 1.00 53.26 ? 111 ALA C C 1 ATOM 5834 O O . ALA D 2 116 ? 36.867 -16.812 73.636 1.00 51.49 ? 111 ALA C O 1 ATOM 5835 C CB . ALA D 2 116 ? 35.462 -14.094 73.211 1.00 52.76 ? 111 ALA C CB 1 ATOM 5836 N N . ALA D 2 117 ? 35.506 -16.554 75.422 1.00 54.55 ? 112 ALA C N 1 ATOM 5837 C CA . ALA D 2 117 ? 35.315 -17.970 75.630 1.00 53.79 ? 112 ALA C CA 1 ATOM 5838 C C . ALA D 2 117 ? 34.307 -18.522 74.617 1.00 51.04 ? 112 ALA C C 1 ATOM 5839 O O . ALA D 2 117 ? 33.385 -17.817 74.177 1.00 50.65 ? 112 ALA C O 1 ATOM 5840 C CB . ALA D 2 117 ? 34.857 -18.232 77.056 1.00 56.56 ? 112 ALA C CB 1 ATOM 5841 N N . PRO D 2 118 ? 34.497 -19.783 74.222 1.00 49.37 ? 113 PRO C N 1 ATOM 5842 C CA . PRO D 2 118 ? 33.536 -20.381 73.329 1.00 47.38 ? 113 PRO C CA 1 ATOM 5843 C C . PRO D 2 118 ? 32.238 -20.655 74.042 1.00 48.42 ? 113 PRO C C 1 ATOM 5844 O O . PRO D 2 118 ? 32.243 -21.031 75.205 1.00 50.47 ? 113 PRO C O 1 ATOM 5845 C CB . PRO D 2 118 ? 34.206 -21.689 72.898 1.00 46.37 ? 113 PRO C CB 1 ATOM 5846 C CG . PRO D 2 118 ? 35.197 -21.989 73.962 1.00 48.35 ? 113 PRO C CG 1 ATOM 5847 C CD . PRO D 2 118 ? 35.640 -20.667 74.496 1.00 49.86 ? 113 PRO C CD 1 ATOM 5848 N N . THR D 2 119 ? 31.137 -20.439 73.338 1.00 47.70 ? 114 THR C N 1 ATOM 5849 C CA . THR D 2 119 ? 29.831 -20.853 73.790 1.00 48.57 ? 114 THR C CA 1 ATOM 5850 C C . THR D 2 119 ? 29.649 -22.286 73.283 1.00 46.98 ? 114 THR C C 1 ATOM 5851 O O . THR D 2 119 ? 29.604 -22.516 72.061 1.00 45.32 ? 114 THR C O 1 ATOM 5852 C CB . THR D 2 119 ? 28.760 -19.937 73.196 1.00 48.88 ? 114 THR C CB 1 ATOM 5853 O OG1 . THR D 2 119 ? 29.089 -18.578 73.504 1.00 50.42 ? 114 THR C OG1 1 ATOM 5854 C CG2 . THR D 2 119 ? 27.389 -20.292 73.728 1.00 50.44 ? 114 THR C CG2 1 ATOM 5855 N N . VAL D 2 120 ? 29.606 -23.238 74.219 1.00 47.58 ? 115 VAL C N 1 ATOM 5856 C CA . VAL D 2 120 ? 29.554 -24.650 73.879 1.00 46.31 ? 115 VAL C CA 1 ATOM 5857 C C . VAL D 2 120 ? 28.135 -25.212 74.026 1.00 46.72 ? 115 VAL C C 1 ATOM 5858 O O . VAL D 2 120 ? 27.446 -24.985 75.031 1.00 49.15 ? 115 VAL C O 1 ATOM 5859 C CB . VAL D 2 120 ? 30.536 -25.484 74.741 1.00 47.52 ? 115 VAL C CB 1 ATOM 5860 C CG1 . VAL D 2 120 ? 30.666 -26.911 74.202 1.00 46.48 ? 115 VAL C CG1 1 ATOM 5861 C CG2 . VAL D 2 120 ? 31.907 -24.827 74.785 1.00 47.65 ? 115 VAL C CG2 1 ATOM 5862 N N . SER D 2 121 ? 27.723 -25.980 73.023 1.00 44.82 ? 116 SER C N 1 ATOM 5863 C CA . SER D 2 121 ? 26.426 -26.642 73.017 1.00 45.00 ? 116 SER C CA 1 ATOM 5864 C C . SER D 2 121 ? 26.562 -28.033 72.437 1.00 43.82 ? 116 SER C C 1 ATOM 5865 O O . SER D 2 121 ? 27.149 -28.216 71.349 1.00 42.43 ? 116 SER C O 1 ATOM 5866 C CB . SER D 2 121 ? 25.446 -25.883 72.139 1.00 44.94 ? 116 SER C CB 1 ATOM 5867 O OG . SER D 2 121 ? 25.355 -24.531 72.551 1.00 46.10 ? 116 SER C OG 1 ATOM 5868 N N . ILE D 2 122 ? 25.970 -29.000 73.123 1.00 44.52 ? 117 ILE C N 1 ATOM 5869 C CA . ILE D 2 122 ? 26.034 -30.391 72.723 1.00 43.86 ? 117 ILE C CA 1 ATOM 5870 C C . ILE D 2 122 ? 24.634 -30.837 72.286 1.00 44.09 ? 117 ILE C C 1 ATOM 5871 O O . ILE D 2 122 ? 23.627 -30.332 72.761 1.00 45.30 ? 117 ILE C O 1 ATOM 5872 C CB . ILE D 2 122 ? 26.632 -31.265 73.848 1.00 45.25 ? 117 ILE C CB 1 ATOM 5873 C CG1 . ILE D 2 122 ? 26.956 -32.665 73.331 1.00 44.94 ? 117 ILE C CG1 1 ATOM 5874 C CG2 . ILE D 2 122 ? 25.715 -31.324 75.070 1.00 47.55 ? 117 ILE C CG2 1 ATOM 5875 C CD1 . ILE D 2 122 ? 27.937 -33.406 74.215 1.00 46.44 ? 117 ILE C CD1 1 ATOM 5876 N N . PHE D 2 123 ? 24.576 -31.734 71.317 1.00 43.21 ? 118 PHE C N 1 ATOM 5877 C CA . PHE D 2 123 ? 23.294 -32.168 70.767 1.00 43.79 ? 118 PHE C CA 1 ATOM 5878 C C . PHE D 2 123 ? 23.309 -33.660 70.544 1.00 44.13 ? 118 PHE C C 1 ATOM 5879 O O . PHE D 2 123 ? 24.099 -34.144 69.735 1.00 43.37 ? 118 PHE C O 1 ATOM 5880 C CB . PHE D 2 123 ? 23.012 -31.468 69.441 1.00 42.95 ? 118 PHE C CB 1 ATOM 5881 C CG . PHE D 2 123 ? 22.883 -29.985 69.570 1.00 42.86 ? 118 PHE C CG 1 ATOM 5882 C CD1 . PHE D 2 123 ? 24.004 -29.174 69.501 1.00 41.70 ? 118 PHE C CD1 1 ATOM 5883 C CD2 . PHE D 2 123 ? 21.655 -29.402 69.777 1.00 44.33 ? 118 PHE C CD2 1 ATOM 5884 C CE1 . PHE D 2 123 ? 23.886 -27.798 69.639 1.00 41.98 ? 118 PHE C CE1 1 ATOM 5885 C CE2 . PHE D 2 123 ? 21.528 -28.032 69.899 1.00 44.77 ? 118 PHE C CE2 1 ATOM 5886 C CZ . PHE D 2 123 ? 22.641 -27.226 69.831 1.00 43.48 ? 118 PHE C CZ 1 ATOM 5887 N N . PRO D 2 124 ? 22.451 -34.396 71.262 1.00 45.65 ? 119 PRO C N 1 ATOM 5888 C CA . PRO D 2 124 ? 22.338 -35.824 71.025 1.00 46.36 ? 119 PRO C CA 1 ATOM 5889 C C . PRO D 2 124 ? 21.829 -36.079 69.619 1.00 46.13 ? 119 PRO C C 1 ATOM 5890 O O . PRO D 2 124 ? 21.323 -35.161 69.001 1.00 45.73 ? 119 PRO C O 1 ATOM 5891 C CB . PRO D 2 124 ? 21.299 -36.284 72.057 1.00 48.41 ? 119 PRO C CB 1 ATOM 5892 C CG . PRO D 2 124 ? 21.200 -35.176 73.056 1.00 49.04 ? 119 PRO C CG 1 ATOM 5893 C CD . PRO D 2 124 ? 21.527 -33.927 72.306 1.00 47.39 ? 119 PRO C CD 1 ATOM 5894 N N . PRO D 2 125 ? 21.951 -37.320 69.125 1.00 46.89 ? 120 PRO C N 1 ATOM 5895 C CA . PRO D 2 125 ? 21.410 -37.687 67.812 1.00 47.50 ? 120 PRO C CA 1 ATOM 5896 C C . PRO D 2 125 ? 19.901 -37.452 67.740 1.00 48.99 ? 120 PRO C C 1 ATOM 5897 O O . PRO D 2 125 ? 19.192 -37.664 68.733 1.00 49.98 ? 120 PRO C O 1 ATOM 5898 C CB . PRO D 2 125 ? 21.701 -39.191 67.707 1.00 48.60 ? 120 PRO C CB 1 ATOM 5899 C CG . PRO D 2 125 ? 22.788 -39.457 68.682 1.00 48.21 ? 120 PRO C CG 1 ATOM 5900 C CD . PRO D 2 125 ? 22.619 -38.454 69.788 1.00 47.65 ? 120 PRO C CD 1 ATOM 5901 N N . SER D 2 126 ? 19.423 -37.027 66.572 1.00 49.52 ? 121 SER C N 1 ATOM 5902 C CA . SER D 2 126 ? 17.990 -36.877 66.337 1.00 51.53 ? 121 SER C CA 1 ATOM 5903 C C . SER D 2 126 ? 17.381 -38.260 66.227 1.00 53.52 ? 121 SER C C 1 ATOM 5904 O O . SER D 2 126 ? 18.088 -39.231 65.951 1.00 53.17 ? 121 SER C O 1 ATOM 5905 C CB . SER D 2 126 ? 17.737 -36.085 65.054 1.00 52.02 ? 121 SER C CB 1 ATOM 5906 O OG . SER D 2 126 ? 17.891 -36.912 63.903 1.00 52.94 ? 121 SER C OG 1 ATOM 5907 N N . SER D 2 127 ? 16.076 -38.354 66.463 1.00 55.97 ? 122 SER C N 1 ATOM 5908 C CA . SER D 2 127 ? 15.362 -39.626 66.312 1.00 58.37 ? 122 SER C CA 1 ATOM 5909 C C . SER D 2 127 ? 15.285 -40.065 64.843 1.00 59.83 ? 122 SER C C 1 ATOM 5910 O O . SER D 2 127 ? 15.326 -41.266 64.559 1.00 60.94 ? 122 SER C O 1 ATOM 5911 C CB . SER D 2 127 ? 13.964 -39.547 66.921 1.00 60.76 ? 122 SER C CB 1 ATOM 5912 O OG . SER D 2 127 ? 13.229 -38.479 66.359 1.00 61.84 ? 122 SER C OG 1 ATOM 5913 N N . GLU D 2 128 ? 15.176 -39.096 63.924 1.00 60.31 ? 123 GLU C N 1 ATOM 5914 C CA . GLU D 2 128 ? 15.200 -39.403 62.481 1.00 62.19 ? 123 GLU C CA 1 ATOM 5915 C C . GLU D 2 128 ? 16.500 -40.096 62.098 1.00 61.14 ? 123 GLU C C 1 ATOM 5916 O O . GLU D 2 128 ? 16.502 -41.052 61.325 1.00 62.97 ? 123 GLU C O 1 ATOM 5917 C CB . GLU D 2 128 ? 15.038 -38.146 61.616 1.00 62.74 ? 123 GLU C CB 1 ATOM 5918 C CG . GLU D 2 128 ? 13.706 -37.419 61.777 1.00 65.03 ? 123 GLU C CG 1 ATOM 5919 C CD . GLU D 2 128 ? 13.783 -36.206 62.699 1.00 63.57 ? 123 GLU C CD 1 ATOM 5920 O OE1 . GLU D 2 128 ? 13.299 -35.117 62.291 1.00 64.90 ? 123 GLU C OE1 1 ATOM 5921 O OE2 . GLU D 2 128 ? 14.326 -36.344 63.830 1.00 61.66 ? 123 GLU C OE2 1 ATOM 5922 N N . GLN D 2 129 ? 17.611 -39.623 62.650 1.00 58.65 ? 124 GLN C N 1 ATOM 5923 C CA . GLN D 2 129 ? 18.894 -40.239 62.332 1.00 58.13 ? 124 GLN C CA 1 ATOM 5924 C C . GLN D 2 129 ? 18.997 -41.633 62.934 1.00 59.13 ? 124 GLN C C 1 ATOM 5925 O O . GLN D 2 129 ? 19.493 -42.555 62.285 1.00 60.41 ? 124 GLN C O 1 ATOM 5926 C CB . GLN D 2 129 ? 20.082 -39.402 62.802 1.00 55.37 ? 124 GLN C CB 1 ATOM 5927 C CG . GLN D 2 129 ? 21.381 -39.896 62.173 1.00 55.30 ? 124 GLN C CG 1 ATOM 5928 C CD . GLN D 2 129 ? 22.631 -39.237 62.720 1.00 53.01 ? 124 GLN C CD 1 ATOM 5929 O OE1 . GLN D 2 129 ? 22.624 -38.602 63.784 1.00 51.25 ? 124 GLN C OE1 1 ATOM 5930 N NE2 . GLN D 2 129 ? 23.728 -39.397 61.987 1.00 53.40 ? 124 GLN C NE2 1 ATOM 5931 N N . LEU D 2 130 ? 18.549 -41.764 64.183 1.00 58.89 ? 125 LEU C N 1 ATOM 5932 C CA . LEU D 2 130 ? 18.517 -43.052 64.867 1.00 60.13 ? 125 LEU C CA 1 ATOM 5933 C C . LEU D 2 130 ? 17.714 -44.093 64.087 1.00 63.33 ? 125 LEU C C 1 ATOM 5934 O O . LEU D 2 130 ? 18.135 -45.247 63.986 1.00 64.60 ? 125 LEU C O 1 ATOM 5935 C CB . LEU D 2 130 ? 17.985 -42.885 66.295 1.00 59.67 ? 125 LEU C CB 1 ATOM 5936 C CG . LEU D 2 130 ? 18.944 -42.133 67.233 1.00 57.39 ? 125 LEU C CG 1 ATOM 5937 C CD1 . LEU D 2 130 ? 18.246 -41.718 68.524 1.00 57.60 ? 125 LEU C CD1 1 ATOM 5938 C CD2 . LEU D 2 130 ? 20.177 -42.969 67.538 1.00 57.13 ? 125 LEU C CD2 1 ATOM 5939 N N . THR D 2 131 ? 16.586 -43.677 63.510 1.00 65.10 ? 126 THR C N 1 ATOM 5940 C CA . THR D 2 131 ? 15.765 -44.561 62.667 1.00 68.58 ? 126 THR C CA 1 ATOM 5941 C C . THR D 2 131 ? 16.593 -45.192 61.538 1.00 69.97 ? 126 THR C C 1 ATOM 5942 O O . THR D 2 131 ? 16.410 -46.363 61.199 1.00 72.46 ? 126 THR C O 1 ATOM 5943 C CB . THR D 2 131 ? 14.567 -43.793 62.060 1.00 70.31 ? 126 THR C CB 1 ATOM 5944 O OG1 . THR D 2 131 ? 13.742 -43.278 63.116 1.00 70.01 ? 126 THR C OG1 1 ATOM 5945 C CG2 . THR D 2 131 ? 13.732 -44.692 61.138 1.00 74.10 ? 126 THR C CG2 1 ATOM 5946 N N . SER D 2 132 ? 17.515 -44.413 60.978 1.00 68.77 ? 127 SER C N 1 ATOM 5947 C CA . SER D 2 132 ? 18.389 -44.880 59.895 1.00 70.40 ? 127 SER C CA 1 ATOM 5948 C C . SER D 2 132 ? 19.593 -45.701 60.378 1.00 69.91 ? 127 SER C C 1 ATOM 5949 O O . SER D 2 132 ? 20.417 -46.130 59.567 1.00 71.46 ? 127 SER C O 1 ATOM 5950 C CB . SER D 2 132 ? 18.916 -43.688 59.100 1.00 69.43 ? 127 SER C CB 1 ATOM 5951 O OG . SER D 2 132 ? 17.860 -42.934 58.541 1.00 70.68 ? 127 SER C OG 1 ATOM 5952 N N . GLY D 2 133 ? 19.725 -45.878 61.691 1.00 68.32 ? 128 GLY C N 1 ATOM 5953 C CA . GLY D 2 133 ? 20.769 -46.734 62.256 1.00 68.44 ? 128 GLY C CA 1 ATOM 5954 C C . GLY D 2 133 ? 22.098 -46.019 62.427 1.00 66.41 ? 128 GLY C C 1 ATOM 5955 O O . GLY D 2 133 ? 23.119 -46.659 62.697 1.00 66.97 ? 128 GLY C O 1 ATOM 5956 N N . GLY D 2 134 ? 22.090 -44.695 62.249 1.00 64.38 ? 129 GLY C N 1 ATOM 5957 C CA . GLY D 2 134 ? 23.265 -43.861 62.507 1.00 62.29 ? 129 GLY C CA 1 ATOM 5958 C C . GLY D 2 134 ? 23.074 -43.001 63.744 1.00 59.81 ? 129 GLY C C 1 ATOM 5959 O O . GLY D 2 134 ? 21.943 -42.699 64.120 1.00 59.72 ? 129 GLY C O 1 ATOM 5960 N N . ALA D 2 135 ? 24.178 -42.598 64.374 1.00 58.32 ? 130 ALA C N 1 ATOM 5961 C CA . ALA D 2 135 ? 24.123 -41.753 65.565 1.00 56.18 ? 130 ALA C CA 1 ATOM 5962 C C . ALA D 2 135 ? 25.243 -40.725 65.535 1.00 54.47 ? 130 ALA C C 1 ATOM 5963 O O . ALA D 2 135 ? 26.412 -41.075 65.692 1.00 55.07 ? 130 ALA C O 1 ATOM 5964 C CB . ALA D 2 135 ? 24.198 -42.608 66.824 1.00 56.97 ? 130 ALA C CB 1 ATOM 5965 N N . SER D 2 136 ? 24.884 -39.462 65.299 1.00 52.91 ? 131 SER C N 1 ATOM 5966 C CA . SER D 2 136 ? 25.839 -38.359 65.328 1.00 51.14 ? 131 SER C CA 1 ATOM 5967 C C . SER D 2 136 ? 25.581 -37.466 66.524 1.00 49.57 ? 131 SER C C 1 ATOM 5968 O O . SER D 2 136 ? 24.463 -37.003 66.738 1.00 49.53 ? 131 SER C O 1 ATOM 5969 C CB . SER D 2 136 ? 25.752 -37.519 64.059 1.00 50.89 ? 131 SER C CB 1 ATOM 5970 O OG . SER D 2 136 ? 26.288 -38.229 62.958 1.00 52.84 ? 131 SER C OG 1 ATOM 5971 N N . VAL D 2 137 ? 26.639 -37.219 67.286 1.00 48.73 ? 132 VAL C N 1 ATOM 5972 C CA . VAL D 2 137 ? 26.607 -36.284 68.395 1.00 47.57 ? 132 VAL C CA 1 ATOM 5973 C C . VAL D 2 137 ? 27.381 -35.057 67.956 1.00 46.14 ? 132 VAL C C 1 ATOM 5974 O O . VAL D 2 137 ? 28.530 -35.163 67.521 1.00 46.11 ? 132 VAL C O 1 ATOM 5975 C CB . VAL D 2 137 ? 27.250 -36.883 69.652 1.00 48.36 ? 132 VAL C CB 1 ATOM 5976 C CG1 . VAL D 2 137 ? 26.861 -36.065 70.869 1.00 48.36 ? 132 VAL C CG1 1 ATOM 5977 C CG2 . VAL D 2 137 ? 26.834 -38.338 69.815 1.00 49.89 ? 132 VAL C CG2 1 ATOM 5978 N N . VAL D 2 138 ? 26.737 -33.904 68.064 1.00 45.23 ? 133 VAL C N 1 ATOM 5979 C CA . VAL D 2 138 ? 27.257 -32.660 67.531 1.00 44.15 ? 133 VAL C CA 1 ATOM 5980 C C . VAL D 2 138 ? 27.530 -31.681 68.637 1.00 43.98 ? 133 VAL C C 1 ATOM 5981 O O . VAL D 2 138 ? 26.690 -31.467 69.498 1.00 44.34 ? 133 VAL C O 1 ATOM 5982 C CB . VAL D 2 138 ? 26.251 -32.015 66.575 1.00 43.91 ? 133 VAL C CB 1 ATOM 5983 C CG1 . VAL D 2 138 ? 26.697 -30.617 66.178 1.00 43.08 ? 133 VAL C CG1 1 ATOM 5984 C CG2 . VAL D 2 138 ? 26.072 -32.894 65.349 1.00 44.73 ? 133 VAL C CG2 1 ATOM 5985 N N . CYS D 2 139 ? 28.702 -31.064 68.574 1.00 43.93 ? 134 CYS C N 1 ATOM 5986 C CA . CYS D 2 139 ? 29.090 -30.043 69.509 1.00 44.61 ? 134 CYS C CA 1 ATOM 5987 C C . CYS D 2 139 ? 29.415 -28.755 68.736 1.00 43.05 ? 134 CYS C C 1 ATOM 5988 O O . CYS D 2 139 ? 30.138 -28.773 67.743 1.00 42.39 ? 134 CYS C O 1 ATOM 5989 C CB . CYS D 2 139 ? 30.294 -30.532 70.299 1.00 46.54 ? 134 CYS C CB 1 ATOM 5990 S SG . CYS D 2 139 ? 30.509 -29.664 71.847 1.00 49.47 ? 134 CYS C SG 1 ATOM 5991 N N . PHE D 2 140 ? 28.839 -27.644 69.170 1.00 42.49 ? 135 PHE C N 1 ATOM 5992 C CA . PHE D 2 140 ? 29.180 -26.339 68.616 1.00 41.51 ? 135 PHE C CA 1 ATOM 5993 C C . PHE D 2 140 ? 29.970 -25.570 69.651 1.00 41.77 ? 135 PHE C C 1 ATOM 5994 O O . PHE D 2 140 ? 29.588 -25.539 70.832 1.00 42.60 ? 135 PHE C O 1 ATOM 5995 C CB . PHE D 2 140 ? 27.941 -25.514 68.274 1.00 41.76 ? 135 PHE C CB 1 ATOM 5996 C CG . PHE D 2 140 ? 27.123 -26.055 67.133 1.00 41.86 ? 135 PHE C CG 1 ATOM 5997 C CD1 . PHE D 2 140 ? 27.726 -26.580 65.998 1.00 41.53 ? 135 PHE C CD1 1 ATOM 5998 C CD2 . PHE D 2 140 ? 25.745 -25.991 67.171 1.00 42.86 ? 135 PHE C CD2 1 ATOM 5999 C CE1 . PHE D 2 140 ? 26.969 -27.061 64.941 1.00 42.10 ? 135 PHE C CE1 1 ATOM 6000 C CE2 . PHE D 2 140 ? 24.979 -26.475 66.118 1.00 43.48 ? 135 PHE C CE2 1 ATOM 6001 C CZ . PHE D 2 140 ? 25.593 -27.010 65.001 1.00 43.08 ? 135 PHE C CZ 1 ATOM 6002 N N . LEU D 2 141 ? 31.054 -24.943 69.194 1.00 41.03 ? 136 LEU C N 1 ATOM 6003 C CA . LEU D 2 141 ? 31.864 -24.067 70.021 1.00 41.59 ? 136 LEU C CA 1 ATOM 6004 C C . LEU D 2 141 ? 31.937 -22.737 69.296 1.00 40.95 ? 136 LEU C C 1 ATOM 6005 O O . LEU D 2 141 ? 32.668 -22.592 68.339 1.00 40.40 ? 136 LEU C O 1 ATOM 6006 C CB . LEU D 2 141 ? 33.252 -24.668 70.219 1.00 42.03 ? 136 LEU C CB 1 ATOM 6007 C CG . LEU D 2 141 ? 33.241 -26.117 70.722 1.00 42.78 ? 136 LEU C CG 1 ATOM 6008 C CD1 . LEU D 2 141 ? 33.128 -27.122 69.581 1.00 42.05 ? 136 LEU C CD1 1 ATOM 6009 C CD2 . LEU D 2 141 ? 34.507 -26.397 71.508 1.00 44.45 ? 136 LEU C CD2 1 ATOM 6010 N N . ASN D 2 142 ? 31.155 -21.771 69.737 1.00 41.63 ? 137 ASN C N 1 ATOM 6011 C CA . ASN D 2 142 ? 30.915 -20.578 68.934 1.00 41.54 ? 137 ASN C CA 1 ATOM 6012 C C . ASN D 2 142 ? 31.443 -19.299 69.554 1.00 42.52 ? 137 ASN C C 1 ATOM 6013 O O . ASN D 2 142 ? 31.434 -19.145 70.774 1.00 43.55 ? 137 ASN C O 1 ATOM 6014 C CB . ASN D 2 142 ? 29.420 -20.450 68.640 1.00 42.01 ? 137 ASN C CB 1 ATOM 6015 C CG . ASN D 2 142 ? 28.924 -21.501 67.655 1.00 41.38 ? 137 ASN C CG 1 ATOM 6016 O OD1 . ASN D 2 142 ? 29.698 -22.069 66.884 1.00 40.64 ? 137 ASN C OD1 1 ATOM 6017 N ND2 . ASN D 2 142 ? 27.623 -21.742 67.655 1.00 42.10 ? 137 ASN C ND2 1 ATOM 6018 N N . ASN D 2 143 ? 31.932 -18.413 68.681 1.00 42.36 ? 138 ASN C N 1 ATOM 6019 C CA . ASN D 2 143 ? 32.338 -17.049 69.018 1.00 43.59 ? 138 ASN C CA 1 ATOM 6020 C C . ASN D 2 143 ? 33.433 -16.941 70.064 1.00 44.50 ? 138 ASN C C 1 ATOM 6021 O O . ASN D 2 143 ? 33.290 -16.233 71.049 1.00 46.12 ? 138 ASN C O 1 ATOM 6022 C CB . ASN D 2 143 ? 31.121 -16.227 69.437 1.00 45.11 ? 138 ASN C CB 1 ATOM 6023 C CG . ASN D 2 143 ? 30.032 -16.232 68.395 1.00 44.99 ? 138 ASN C CG 1 ATOM 6024 O OD1 . ASN D 2 143 ? 29.035 -16.925 68.545 1.00 45.23 ? 138 ASN C OD1 1 ATOM 6025 N ND2 . ASN D 2 143 ? 30.213 -15.456 67.335 1.00 45.11 ? 138 ASN C ND2 1 ATOM 6026 N N . PHE D 2 144 ? 34.541 -17.623 69.809 1.00 44.03 ? 139 PHE C N 1 ATOM 6027 C CA . PHE D 2 144 ? 35.697 -17.577 70.682 1.00 45.39 ? 139 PHE C CA 1 ATOM 6028 C C . PHE D 2 144 ? 36.859 -16.832 70.048 1.00 45.91 ? 139 PHE C C 1 ATOM 6029 O O . PHE D 2 144 ? 36.888 -16.610 68.827 1.00 44.90 ? 139 PHE C O 1 ATOM 6030 C CB . PHE D 2 144 ? 36.125 -18.989 71.101 1.00 45.27 ? 139 PHE C CB 1 ATOM 6031 C CG . PHE D 2 144 ? 36.450 -19.914 69.959 1.00 43.79 ? 139 PHE C CG 1 ATOM 6032 C CD1 . PHE D 2 144 ? 35.470 -20.708 69.379 1.00 42.56 ? 139 PHE C CD1 1 ATOM 6033 C CD2 . PHE D 2 144 ? 37.742 -20.032 69.507 1.00 44.33 ? 139 PHE C CD2 1 ATOM 6034 C CE1 . PHE D 2 144 ? 35.776 -21.581 68.346 1.00 41.85 ? 139 PHE C CE1 1 ATOM 6035 C CE2 . PHE D 2 144 ? 38.061 -20.898 68.464 1.00 43.76 ? 139 PHE C CE2 1 ATOM 6036 C CZ . PHE D 2 144 ? 37.074 -21.676 67.882 1.00 42.53 ? 139 PHE C CZ 1 ATOM 6037 N N . TYR D 2 145 ? 37.807 -16.448 70.908 1.00 47.95 ? 140 TYR C N 1 ATOM 6038 C CA . TYR D 2 145 ? 39.032 -15.769 70.501 1.00 48.96 ? 140 TYR C CA 1 ATOM 6039 C C . TYR D 2 145 ? 40.069 -15.895 71.623 1.00 51.45 ? 140 TYR C C 1 ATOM 6040 O O . TYR D 2 145 ? 39.733 -15.691 72.779 1.00 52.92 ? 140 TYR C O 1 ATOM 6041 C CB . TYR D 2 145 ? 38.782 -14.293 70.198 1.00 49.42 ? 140 TYR C CB 1 ATOM 6042 C CG . TYR D 2 145 ? 39.996 -13.646 69.591 1.00 50.18 ? 140 TYR C CG 1 ATOM 6043 C CD1 . TYR D 2 145 ? 41.027 -13.155 70.387 1.00 52.28 ? 140 TYR C CD1 1 ATOM 6044 C CD2 . TYR D 2 145 ? 40.140 -13.577 68.216 1.00 49.15 ? 140 TYR C CD2 1 ATOM 6045 C CE1 . TYR D 2 145 ? 42.158 -12.586 69.824 1.00 53.31 ? 140 TYR C CE1 1 ATOM 6046 C CE2 . TYR D 2 145 ? 41.260 -13.009 67.642 1.00 50.26 ? 140 TYR C CE2 1 ATOM 6047 C CZ . TYR D 2 145 ? 42.267 -12.518 68.442 1.00 52.28 ? 140 TYR C CZ 1 ATOM 6048 O OH . TYR D 2 145 ? 43.373 -11.962 67.835 1.00 53.58 ? 140 TYR C OH 1 ATOM 6049 N N . PRO D 2 146 ? 41.335 -16.211 71.290 1.00 52.67 ? 141 PRO C N 1 ATOM 6050 C CA . PRO D 2 146 ? 41.874 -16.408 69.953 1.00 51.85 ? 141 PRO C CA 1 ATOM 6051 C C . PRO D 2 146 ? 41.428 -17.720 69.327 1.00 50.71 ? 141 PRO C C 1 ATOM 6052 O O . PRO D 2 146 ? 40.657 -18.480 69.924 1.00 50.42 ? 141 PRO C O 1 ATOM 6053 C CB . PRO D 2 146 ? 43.392 -16.385 70.178 1.00 54.20 ? 141 PRO C CB 1 ATOM 6054 C CG . PRO D 2 146 ? 43.574 -16.869 71.566 1.00 55.93 ? 141 PRO C CG 1 ATOM 6055 C CD . PRO D 2 146 ? 42.358 -16.434 72.332 1.00 55.33 ? 141 PRO C CD 1 ATOM 6056 N N . LYS D 2 147 ? 41.907 -17.957 68.117 1.00 50.75 ? 142 LYS C N 1 ATOM 6057 C CA . LYS D 2 147 ? 41.474 -19.081 67.308 1.00 50.04 ? 142 LYS C CA 1 ATOM 6058 C C . LYS D 2 147 ? 41.961 -20.441 67.819 1.00 50.65 ? 142 LYS C C 1 ATOM 6059 O O . LYS D 2 147 ? 41.357 -21.453 67.531 1.00 49.48 ? 142 LYS C O 1 ATOM 6060 C CB . LYS D 2 147 ? 41.926 -18.825 65.860 1.00 51.07 ? 142 LYS C CB 1 ATOM 6061 C CG . LYS D 2 147 ? 42.550 -19.993 65.124 1.00 52.59 ? 142 LYS C CG 1 ATOM 6062 C CD . LYS D 2 147 ? 43.195 -19.533 63.818 1.00 54.24 ? 142 LYS C CD 1 ATOM 6063 C CE . LYS D 2 147 ? 44.459 -18.725 64.070 1.00 56.43 ? 142 LYS C CE 1 ATOM 6064 N NZ . LYS D 2 147 ? 45.332 -18.742 62.871 1.00 58.84 ? 142 LYS C NZ 1 ATOM 6065 N N . ASP D 2 148 ? 43.065 -20.473 68.551 1.00 53.02 ? 143 ASP C N 1 ATOM 6066 C CA . ASP D 2 148 ? 43.616 -21.748 69.036 1.00 54.77 ? 143 ASP C CA 1 ATOM 6067 C C . ASP D 2 148 ? 42.621 -22.399 69.971 1.00 53.91 ? 143 ASP C C 1 ATOM 6068 O O . ASP D 2 148 ? 42.268 -21.811 70.994 1.00 53.81 ? 143 ASP C O 1 ATOM 6069 C CB . ASP D 2 148 ? 44.929 -21.554 69.803 1.00 58.22 ? 143 ASP C CB 1 ATOM 6070 C CG . ASP D 2 148 ? 46.000 -20.853 68.983 1.00 60.08 ? 143 ASP C CG 1 ATOM 6071 O OD1 . ASP D 2 148 ? 46.218 -21.258 67.817 1.00 60.23 ? 143 ASP C OD1 1 ATOM 6072 O OD2 . ASP D 2 148 ? 46.640 -19.915 69.508 1.00 62.10 ? 143 ASP C OD2 1 ATOM 6073 N N . ILE D 2 149 ? 42.171 -23.603 69.623 1.00 53.36 ? 144 ILE C N 1 ATOM 6074 C CA . ILE D 2 149 ? 41.265 -24.329 70.486 1.00 53.08 ? 144 ILE C CA 1 ATOM 6075 C C . ILE D 2 149 ? 41.420 -25.843 70.358 1.00 54.06 ? 144 ILE C C 1 ATOM 6076 O O . ILE D 2 149 ? 41.765 -26.369 69.312 1.00 53.84 ? 144 ILE C O 1 ATOM 6077 C CB . ILE D 2 149 ? 39.794 -23.935 70.221 1.00 50.65 ? 144 ILE C CB 1 ATOM 6078 C CG1 . ILE D 2 149 ? 38.930 -24.279 71.433 1.00 50.81 ? 144 ILE C CG1 1 ATOM 6079 C CG2 . ILE D 2 149 ? 39.250 -24.619 68.972 1.00 49.28 ? 144 ILE C CG2 1 ATOM 6080 C CD1 . ILE D 2 149 ? 37.641 -23.498 71.486 1.00 49.32 ? 144 ILE C CD1 1 ATOM 6081 N N . ASN D 2 150 ? 41.146 -26.538 71.448 1.00 55.62 ? 145 ASN C N 1 ATOM 6082 C CA . ASN D 2 150 ? 41.164 -27.984 71.443 1.00 56.87 ? 145 ASN C CA 1 ATOM 6083 C C . ASN D 2 150 ? 39.851 -28.560 71.935 1.00 55.50 ? 145 ASN C C 1 ATOM 6084 O O . ASN D 2 150 ? 39.309 -28.116 72.950 1.00 55.60 ? 145 ASN C O 1 ATOM 6085 C CB . ASN D 2 150 ? 42.295 -28.496 72.315 1.00 60.72 ? 145 ASN C CB 1 ATOM 6086 C CG . ASN D 2 150 ? 42.658 -29.928 71.998 1.00 62.66 ? 145 ASN C CG 1 ATOM 6087 O OD1 . ASN D 2 150 ? 43.367 -30.200 71.027 1.00 63.57 ? 145 ASN C OD1 1 ATOM 6088 N ND2 . ASN D 2 150 ? 42.166 -30.856 72.810 1.00 63.72 ? 145 ASN C ND2 1 ATOM 6089 N N . VAL D 2 151 ? 39.347 -29.546 71.196 1.00 54.31 ? 146 VAL C N 1 ATOM 6090 C CA . VAL D 2 151 ? 38.153 -30.271 71.584 1.00 53.00 ? 146 VAL C CA 1 ATOM 6091 C C . VAL D 2 151 ? 38.484 -31.727 71.825 1.00 54.81 ? 146 VAL C C 1 ATOM 6092 O O . VAL D 2 151 ? 39.238 -32.335 71.068 1.00 55.37 ? 146 VAL C O 1 ATOM 6093 C CB . VAL D 2 151 ? 37.084 -30.218 70.504 1.00 50.60 ? 146 VAL C CB 1 ATOM 6094 C CG1 . VAL D 2 151 ? 35.824 -30.933 70.964 1.00 49.95 ? 146 VAL C CG1 1 ATOM 6095 C CG2 . VAL D 2 151 ? 36.775 -28.775 70.162 1.00 49.15 ? 146 VAL C CG2 1 ATOM 6096 N N . LYS D 2 152 ? 37.869 -32.280 72.867 1.00 55.49 ? 147 LYS C N 1 ATOM 6097 C CA . LYS D 2 152 ? 38.073 -33.656 73.255 1.00 57.53 ? 147 LYS C CA 1 ATOM 6098 C C . LYS D 2 152 ? 36.695 -34.248 73.532 1.00 56.17 ? 147 LYS C C 1 ATOM 6099 O O . LYS D 2 152 ? 35.855 -33.609 74.167 1.00 55.49 ? 147 LYS C O 1 ATOM 6100 C CB . LYS D 2 152 ? 38.973 -33.700 74.487 1.00 61.22 ? 147 LYS C CB 1 ATOM 6101 C CG . LYS D 2 152 ? 39.457 -35.083 74.884 1.00 64.63 ? 147 LYS C CG 1 ATOM 6102 C CD . LYS D 2 152 ? 40.705 -34.997 75.756 1.00 68.62 ? 147 LYS C CD 1 ATOM 6103 C CE . LYS D 2 152 ? 40.506 -34.068 76.947 1.00 69.51 ? 147 LYS C CE 1 ATOM 6104 N NZ . LYS D 2 152 ? 41.568 -34.252 77.980 1.00 74.24 ? 147 LYS C NZ 1 ATOM 6105 N N . TRP D 2 153 ? 36.449 -35.436 72.998 1.00 55.85 ? 148 TRP C N 1 ATOM 6106 C CA . TRP D 2 153 ? 35.249 -36.206 73.318 1.00 55.29 ? 148 TRP C CA 1 ATOM 6107 C C . TRP D 2 153 ? 35.514 -37.288 74.369 1.00 58.12 ? 148 TRP C C 1 ATOM 6108 O O . TRP D 2 153 ? 36.525 -37.998 74.308 1.00 60.33 ? 148 TRP C O 1 ATOM 6109 C CB . TRP D 2 153 ? 34.693 -36.879 72.069 1.00 53.96 ? 148 TRP C CB 1 ATOM 6110 C CG . TRP D 2 153 ? 34.012 -35.931 71.135 1.00 51.15 ? 148 TRP C CG 1 ATOM 6111 C CD1 . TRP D 2 153 ? 34.585 -35.242 70.110 1.00 50.08 ? 148 TRP C CD1 1 ATOM 6112 C CD2 . TRP D 2 153 ? 32.630 -35.568 71.138 1.00 49.38 ? 148 TRP C CD2 1 ATOM 6113 N NE1 . TRP D 2 153 ? 33.644 -34.470 69.474 1.00 47.89 ? 148 TRP C NE1 1 ATOM 6114 C CE2 . TRP D 2 153 ? 32.434 -34.652 70.087 1.00 47.49 ? 148 TRP C CE2 1 ATOM 6115 C CE3 . TRP D 2 153 ? 31.538 -35.924 71.932 1.00 49.61 ? 148 TRP C CE3 1 ATOM 6116 C CZ2 . TRP D 2 153 ? 31.188 -34.088 69.810 1.00 46.08 ? 148 TRP C CZ2 1 ATOM 6117 C CZ3 . TRP D 2 153 ? 30.302 -35.367 71.652 1.00 48.08 ? 148 TRP C CZ3 1 ATOM 6118 C CH2 . TRP D 2 153 ? 30.138 -34.457 70.601 1.00 46.34 ? 148 TRP C CH2 1 ATOM 6119 N N . LYS D 2 154 ? 34.590 -37.414 75.318 1.00 58.25 ? 149 LYS C N 1 ATOM 6120 C CA . LYS D 2 154 ? 34.626 -38.497 76.292 1.00 61.22 ? 149 LYS C CA 1 ATOM 6121 C C . LYS D 2 154 ? 33.319 -39.276 76.266 1.00 60.29 ? 149 LYS C C 1 ATOM 6122 O O . LYS D 2 154 ? 32.237 -38.714 76.093 1.00 57.87 ? 149 LYS C O 1 ATOM 6123 C CB . LYS D 2 154 ? 34.920 -37.974 77.700 1.00 63.79 ? 149 LYS C CB 1 ATOM 6124 C CG . LYS D 2 154 ? 36.333 -37.436 77.849 1.00 65.51 ? 149 LYS C CG 1 ATOM 6125 C CD . LYS D 2 154 ? 36.696 -37.173 79.304 1.00 69.19 ? 149 LYS C CD 1 ATOM 6126 C CE . LYS D 2 154 ? 38.037 -36.460 79.381 1.00 70.76 ? 149 LYS C CE 1 ATOM 6127 N NZ . LYS D 2 154 ? 38.361 -35.982 80.751 1.00 74.30 ? 149 LYS C NZ 1 ATOM 6128 N N . ILE D 2 155 ? 33.450 -40.586 76.423 1.00 62.24 ? 150 ILE C N 1 ATOM 6129 C CA . ILE D 2 155 ? 32.312 -41.490 76.436 1.00 62.05 ? 150 ILE C CA 1 ATOM 6130 C C . ILE D 2 155 ? 32.412 -42.382 77.656 1.00 65.62 ? 150 ILE C C 1 ATOM 6131 O O . ILE D 2 155 ? 33.291 -43.247 77.735 1.00 68.07 ? 150 ILE C O 1 ATOM 6132 C CB . ILE D 2 155 ? 32.279 -42.358 75.173 1.00 61.34 ? 150 ILE C CB 1 ATOM 6133 C CG1 . ILE D 2 155 ? 31.997 -41.477 73.961 1.00 58.02 ? 150 ILE C CG1 1 ATOM 6134 C CG2 . ILE D 2 155 ? 31.208 -43.432 75.292 1.00 62.28 ? 150 ILE C CG2 1 ATOM 6135 C CD1 . ILE D 2 155 ? 32.154 -42.200 72.646 1.00 57.97 ? 150 ILE C CD1 1 ATOM 6136 N N . ASP D 2 156 ? 31.488 -42.178 78.590 1.00 66.15 ? 151 ASP C N 1 ATOM 6137 C CA . ASP D 2 156 ? 31.551 -42.800 79.906 1.00 70.04 ? 151 ASP C CA 1 ATOM 6138 C C . ASP D 2 156 ? 32.948 -42.644 80.502 1.00 72.80 ? 151 ASP C C 1 ATOM 6139 O O . ASP D 2 156 ? 33.554 -43.609 80.985 1.00 76.39 ? 151 ASP C O 1 ATOM 6140 C CB . ASP D 2 156 ? 31.147 -44.273 79.823 1.00 71.80 ? 151 ASP C CB 1 ATOM 6141 C CG . ASP D 2 156 ? 29.663 -44.461 79.573 1.00 70.17 ? 151 ASP C CG 1 ATOM 6142 O OD1 . ASP D 2 156 ? 28.848 -43.617 80.006 1.00 69.16 ? 151 ASP C OD1 1 ATOM 6143 O OD2 . ASP D 2 156 ? 29.308 -45.475 78.947 1.00 70.24 ? 151 ASP C OD2 1 ATOM 6144 N N . GLY D 2 157 ? 33.462 -41.419 80.443 1.00 71.35 ? 152 GLY C N 1 ATOM 6145 C CA . GLY D 2 157 ? 34.767 -41.100 81.029 1.00 74.22 ? 152 GLY C CA 1 ATOM 6146 C C . GLY D 2 157 ? 36.011 -41.389 80.196 1.00 74.45 ? 152 GLY C C 1 ATOM 6147 O O . GLY D 2 157 ? 37.104 -40.947 80.549 1.00 76.38 ? 152 GLY C O 1 ATOM 6148 N N . SER D 2 158 ? 35.866 -42.145 79.109 1.00 73.02 ? 153 SER C N 1 ATOM 6149 C CA . SER D 2 158 ? 37.010 -42.493 78.262 1.00 73.91 ? 153 SER C CA 1 ATOM 6150 C C . SER D 2 158 ? 37.091 -41.568 77.060 1.00 70.19 ? 153 SER C C 1 ATOM 6151 O O . SER D 2 158 ? 36.086 -41.312 76.395 1.00 66.81 ? 153 SER C O 1 ATOM 6152 C CB . SER D 2 158 ? 36.924 -43.941 77.774 1.00 75.51 ? 153 SER C CB 1 ATOM 6153 O OG . SER D 2 158 ? 37.076 -44.855 78.849 1.00 79.93 ? 153 SER C OG 1 ATOM 6154 N N . GLU D 2 159 ? 38.296 -41.083 76.779 1.00 71.26 ? 154 GLU C N 1 ATOM 6155 C CA . GLU D 2 159 ? 38.538 -40.267 75.605 1.00 68.46 ? 154 GLU C CA 1 ATOM 6156 C C . GLU D 2 159 ? 38.210 -41.065 74.350 1.00 67.48 ? 154 GLU C C 1 ATOM 6157 O O . GLU D 2 159 ? 38.405 -42.279 74.305 1.00 69.93 ? 154 GLU C O 1 ATOM 6158 C CB . GLU D 2 159 ? 39.993 -39.794 75.555 1.00 70.67 ? 154 GLU C CB 1 ATOM 6159 C CG . GLU D 2 159 ? 40.165 -38.536 74.718 1.00 67.66 ? 154 GLU C CG 1 ATOM 6160 C CD . GLU D 2 159 ? 41.578 -38.302 74.231 1.00 69.78 ? 154 GLU C CD 1 ATOM 6161 O OE1 . GLU D 2 159 ? 42.548 -38.588 74.974 1.00 73.91 ? 154 GLU C OE1 1 ATOM 6162 O OE2 . GLU D 2 159 ? 41.699 -37.823 73.085 1.00 67.71 ? 154 GLU C OE2 1 ATOM 6163 N N . ARG D 2 160 ? 37.714 -40.371 73.333 1.00 64.27 ? 155 ARG C N 1 ATOM 6164 C CA . ARG D 2 160 ? 37.309 -41.009 72.096 1.00 63.74 ? 155 ARG C CA 1 ATOM 6165 C C . ARG D 2 160 ? 37.689 -40.175 70.874 1.00 62.17 ? 155 ARG C C 1 ATOM 6166 O O . ARG D 2 160 ? 37.201 -39.052 70.708 1.00 59.18 ? 155 ARG C O 1 ATOM 6167 C CB . ARG D 2 160 ? 35.803 -41.185 72.120 1.00 61.75 ? 155 ARG C CB 1 ATOM 6168 C CG . ARG D 2 160 ? 35.211 -41.680 70.819 1.00 60.92 ? 155 ARG C CG 1 ATOM 6169 C CD . ARG D 2 160 ? 35.611 -43.113 70.531 1.00 64.24 ? 155 ARG C CD 1 ATOM 6170 N NE . ARG D 2 160 ? 34.922 -43.565 69.326 1.00 63.70 ? 155 ARG C NE 1 ATOM 6171 C CZ . ARG D 2 160 ? 34.034 -44.557 69.259 1.00 64.39 ? 155 ARG C CZ 1 ATOM 6172 N NH1 . ARG D 2 160 ? 33.479 -44.839 68.086 1.00 63.99 ? 155 ARG C NH1 1 ATOM 6173 N NH2 . ARG D 2 160 ? 33.708 -45.274 70.336 1.00 65.86 ? 155 ARG C NH2 1 ATOM 6174 N N . GLN D 2 161 ? 38.509 -40.753 69.995 1.00 64.54 ? 156 GLN C N 1 ATOM 6175 C CA . GLN D 2 161 ? 39.068 -40.031 68.853 1.00 63.99 ? 156 GLN C CA 1 ATOM 6176 C C . GLN D 2 161 ? 38.494 -40.457 67.512 1.00 63.66 ? 156 GLN C C 1 ATOM 6177 O O . GLN D 2 161 ? 38.182 -39.599 66.681 1.00 61.71 ? 156 GLN C O 1 ATOM 6178 C CB . GLN D 2 161 ? 40.589 -40.173 68.836 1.00 67.55 ? 156 GLN C CB 1 ATOM 6179 C CG . GLN D 2 161 ? 41.309 -39.061 69.587 1.00 67.45 ? 156 GLN C CG 1 ATOM 6180 C CD . GLN D 2 161 ? 42.574 -39.545 70.300 1.00 71.98 ? 156 GLN C CD 1 ATOM 6181 O OE1 . GLN D 2 161 ? 42.577 -39.713 71.519 1.00 73.58 ? 156 GLN C OE1 1 ATOM 6182 N NE2 . GLN D 2 161 ? 43.640 -39.799 69.541 1.00 74.82 ? 156 GLN C NE2 1 ATOM 6183 N N . ASN D 2 162 ? 38.365 -41.763 67.283 1.00 66.04 ? 157 ASN C N 1 ATOM 6184 C CA . ASN D 2 162 ? 37.872 -42.240 65.994 1.00 66.35 ? 157 ASN C CA 1 ATOM 6185 C C . ASN D 2 162 ? 36.375 -41.939 65.816 1.00 62.85 ? 157 ASN C C 1 ATOM 6186 O O . ASN D 2 162 ? 35.579 -42.090 66.740 1.00 61.50 ? 157 ASN C O 1 ATOM 6187 C CB . ASN D 2 162 ? 38.200 -43.719 65.787 1.00 70.58 ? 157 ASN C CB 1 ATOM 6188 C CG . ASN D 2 162 ? 37.280 -44.633 66.557 1.00 70.89 ? 157 ASN C CG 1 ATOM 6189 O OD1 . ASN D 2 162 ? 37.291 -44.652 67.794 1.00 70.98 ? 157 ASN C OD1 1 ATOM 6190 N ND2 . ASN D 2 162 ? 36.468 -45.400 65.834 1.00 71.53 ? 157 ASN C ND2 1 ATOM 6191 N N . GLY D 2 163 ? 36.019 -41.470 64.627 1.00 61.76 ? 158 GLY C N 1 ATOM 6192 C CA . GLY D 2 163 ? 34.653 -41.059 64.322 1.00 59.12 ? 158 GLY C CA 1 ATOM 6193 C C . GLY D 2 163 ? 34.400 -39.581 64.572 1.00 55.88 ? 158 GLY C C 1 ATOM 6194 O O . GLY D 2 163 ? 33.262 -39.128 64.454 1.00 53.96 ? 158 GLY C O 1 ATOM 6195 N N . VAL D 2 164 ? 35.456 -38.832 64.905 1.00 55.66 ? 159 VAL C N 1 ATOM 6196 C CA . VAL D 2 164 ? 35.358 -37.394 65.168 1.00 53.02 ? 159 VAL C CA 1 ATOM 6197 C C . VAL D 2 164 ? 35.711 -36.604 63.907 1.00 52.99 ? 159 VAL C C 1 ATOM 6198 O O . VAL D 2 164 ? 36.684 -36.918 63.197 1.00 55.41 ? 159 VAL C O 1 ATOM 6199 C CB . VAL D 2 164 ? 36.297 -36.954 66.314 1.00 53.30 ? 159 VAL C CB 1 ATOM 6200 C CG1 . VAL D 2 164 ? 36.172 -35.453 66.568 1.00 50.95 ? 159 VAL C CG1 1 ATOM 6201 C CG2 . VAL D 2 164 ? 35.991 -37.731 67.594 1.00 53.92 ? 159 VAL C CG2 1 ATOM 6202 N N . LEU D 2 165 ? 34.913 -35.583 63.620 1.00 50.70 ? 160 LEU C N 1 ATOM 6203 C CA . LEU D 2 165 ? 35.185 -34.684 62.499 1.00 50.40 ? 160 LEU C CA 1 ATOM 6204 C C . LEU D 2 165 ? 34.922 -33.246 62.920 1.00 47.76 ? 160 LEU C C 1 ATOM 6205 O O . LEU D 2 165 ? 33.847 -32.923 63.435 1.00 46.39 ? 160 LEU C O 1 ATOM 6206 C CB . LEU D 2 165 ? 34.329 -35.056 61.291 1.00 51.26 ? 160 LEU C CB 1 ATOM 6207 C CG . LEU D 2 165 ? 34.713 -36.374 60.591 1.00 54.48 ? 160 LEU C CG 1 ATOM 6208 C CD1 . LEU D 2 165 ? 33.668 -36.736 59.546 1.00 55.51 ? 160 LEU C CD1 1 ATOM 6209 C CD2 . LEU D 2 165 ? 36.098 -36.324 59.951 1.00 56.89 ? 160 LEU C CD2 1 ATOM 6210 N N . ASN D 2 166 ? 35.920 -32.399 62.709 1.00 47.62 ? 161 ASN C N 1 ATOM 6211 C CA . ASN D 2 166 ? 35.862 -30.993 63.074 1.00 45.56 ? 161 ASN C CA 1 ATOM 6212 C C . ASN D 2 166 ? 35.813 -30.095 61.845 1.00 45.53 ? 161 ASN C C 1 ATOM 6213 O O . ASN D 2 166 ? 36.222 -30.477 60.746 1.00 47.13 ? 161 ASN C O 1 ATOM 6214 C CB . ASN D 2 166 ? 37.063 -30.634 63.955 1.00 45.98 ? 161 ASN C CB 1 ATOM 6215 C CG . ASN D 2 166 ? 37.046 -31.359 65.284 1.00 46.12 ? 161 ASN C CG 1 ATOM 6216 O OD1 . ASN D 2 166 ? 35.996 -31.741 65.768 1.00 45.14 ? 161 ASN C OD1 1 ATOM 6217 N ND2 . ASN D 2 166 ? 38.214 -31.538 65.887 1.00 47.69 ? 161 ASN C ND2 1 ATOM 6218 N N . SER D 2 167 ? 35.290 -28.897 62.050 1.00 43.78 ? 162 SER C N 1 ATOM 6219 C CA . SER D 2 167 ? 35.219 -27.900 61.013 1.00 44.07 ? 162 SER C CA 1 ATOM 6220 C C . SER D 2 167 ? 35.315 -26.540 61.657 1.00 42.83 ? 162 SER C C 1 ATOM 6221 O O . SER D 2 167 ? 34.639 -26.257 62.633 1.00 41.50 ? 162 SER C O 1 ATOM 6222 C CB . SER D 2 167 ? 33.912 -28.020 60.237 1.00 44.14 ? 162 SER C CB 1 ATOM 6223 O OG . SER D 2 167 ? 33.901 -27.110 59.150 1.00 45.00 ? 162 SER C OG 1 ATOM 6224 N N . TRP D 2 168 ? 36.181 -25.709 61.113 1.00 43.83 ? 163 TRP C N 1 ATOM 6225 C CA . TRP D 2 168 ? 36.428 -24.409 61.678 1.00 43.24 ? 163 TRP C CA 1 ATOM 6226 C C . TRP D 2 168 ? 35.989 -23.336 60.717 1.00 43.97 ? 163 TRP C C 1 ATOM 6227 O O . TRP D 2 168 ? 36.149 -23.445 59.505 1.00 45.36 ? 163 TRP C O 1 ATOM 6228 C CB . TRP D 2 168 ? 37.919 -24.229 61.984 1.00 44.19 ? 163 TRP C CB 1 ATOM 6229 C CG . TRP D 2 168 ? 38.503 -25.264 62.890 1.00 44.41 ? 163 TRP C CG 1 ATOM 6230 C CD1 . TRP D 2 168 ? 38.712 -25.147 64.228 1.00 43.96 ? 163 TRP C CD1 1 ATOM 6231 C CD2 . TRP D 2 168 ? 38.977 -26.571 62.517 1.00 45.94 ? 163 TRP C CD2 1 ATOM 6232 N NE1 . TRP D 2 168 ? 39.306 -26.293 64.715 1.00 45.09 ? 163 TRP C NE1 1 ATOM 6233 C CE2 . TRP D 2 168 ? 39.468 -27.187 63.686 1.00 46.28 ? 163 TRP C CE2 1 ATOM 6234 C CE3 . TRP D 2 168 ? 39.050 -27.273 61.304 1.00 47.63 ? 163 TRP C CE3 1 ATOM 6235 C CZ2 . TRP D 2 168 ? 40.021 -28.481 63.681 1.00 48.04 ? 163 TRP C CZ2 1 ATOM 6236 C CZ3 . TRP D 2 168 ? 39.598 -28.565 61.300 1.00 49.40 ? 163 TRP C CZ3 1 ATOM 6237 C CH2 . TRP D 2 168 ? 40.075 -29.153 62.485 1.00 49.48 ? 163 TRP C CH2 1 ATOM 6238 N N . THR D 2 169 ? 35.459 -22.272 61.290 1.00 43.59 ? 164 THR C N 1 ATOM 6239 C CA . THR D 2 169 ? 35.019 -21.132 60.538 1.00 44.48 ? 164 THR C CA 1 ATOM 6240 C C . THR D 2 169 ? 36.212 -20.160 60.367 1.00 45.66 ? 164 THR C C 1 ATOM 6241 O O . THR D 2 169 ? 37.189 -20.221 61.124 1.00 45.00 ? 164 THR C O 1 ATOM 6242 C CB . THR D 2 169 ? 33.797 -20.532 61.271 1.00 43.81 ? 164 THR C CB 1 ATOM 6243 O OG1 . THR D 2 169 ? 32.740 -20.321 60.330 1.00 45.13 ? 164 THR C OG1 1 ATOM 6244 C CG2 . THR D 2 169 ? 34.110 -19.245 62.000 1.00 43.68 ? 164 THR C CG2 1 ATOM 6245 N N . ASP D 2 170 ? 36.154 -19.313 59.337 1.00 47.38 ? 165 ASP C N 1 ATOM 6246 C CA . ASP D 2 170 ? 37.085 -18.188 59.192 1.00 48.70 ? 165 ASP C CA 1 ATOM 6247 C C . ASP D 2 170 ? 36.773 -17.143 60.244 1.00 47.53 ? 165 ASP C C 1 ATOM 6248 O O . ASP D 2 170 ? 35.727 -17.185 60.873 1.00 46.62 ? 165 ASP C O 1 ATOM 6249 C CB . ASP D 2 170 ? 36.977 -17.548 57.797 1.00 51.36 ? 165 ASP C CB 1 ATOM 6250 C CG . ASP D 2 170 ? 37.860 -18.233 56.779 1.00 54.13 ? 165 ASP C CG 1 ATOM 6251 O OD1 . ASP D 2 170 ? 38.928 -18.740 57.217 1.00 55.02 ? 165 ASP C OD1 1 ATOM 6252 O OD2 . ASP D 2 170 ? 37.509 -18.254 55.563 1.00 56.35 ? 165 ASP C OD2 1 ATOM 6253 N N . GLN D 2 171 ? 37.672 -16.192 60.429 1.00 47.96 ? 166 GLN C N 1 ATOM 6254 C CA . GLN D 2 171 ? 37.399 -15.079 61.318 1.00 47.85 ? 166 GLN C CA 1 ATOM 6255 C C . GLN D 2 171 ? 36.151 -14.345 60.847 1.00 48.64 ? 166 GLN C C 1 ATOM 6256 O O . GLN D 2 171 ? 36.000 -14.105 59.665 1.00 50.23 ? 166 GLN C O 1 ATOM 6257 C CB . GLN D 2 171 ? 38.600 -14.123 61.377 1.00 48.82 ? 166 GLN C CB 1 ATOM 6258 C CG . GLN D 2 171 ? 38.515 -13.099 62.499 1.00 48.62 ? 166 GLN C CG 1 ATOM 6259 C CD . GLN D 2 171 ? 39.832 -12.403 62.772 1.00 49.59 ? 166 GLN C CD 1 ATOM 6260 O OE1 . GLN D 2 171 ? 40.605 -12.138 61.853 1.00 50.75 ? 166 GLN C OE1 1 ATOM 6261 N NE2 . GLN D 2 171 ? 40.088 -12.088 64.039 1.00 49.53 ? 166 GLN C NE2 1 ATOM 6262 N N . ASP D 2 172 ? 35.254 -14.018 61.773 1.00 48.78 ? 167 ASP C N 1 ATOM 6263 C CA . ASP D 2 172 ? 34.046 -13.262 61.463 1.00 50.38 ? 167 ASP C CA 1 ATOM 6264 C C . ASP D 2 172 ? 34.428 -11.820 61.095 1.00 52.21 ? 167 ASP C C 1 ATOM 6265 O O . ASP D 2 172 ? 35.240 -11.189 61.764 1.00 52.17 ? 167 ASP C O 1 ATOM 6266 C CB . ASP D 2 172 ? 33.072 -13.320 62.658 1.00 50.31 ? 167 ASP C CB 1 ATOM 6267 C CG . ASP D 2 172 ? 31.722 -12.668 62.366 1.00 52.07 ? 167 ASP C CG 1 ATOM 6268 O OD1 . ASP D 2 172 ? 31.659 -11.422 62.243 1.00 53.76 ? 167 ASP C OD1 1 ATOM 6269 O OD2 . ASP D 2 172 ? 30.715 -13.414 62.296 1.00 52.32 ? 167 ASP C OD2 1 ATOM 6270 N N . SER D 2 173 ? 33.862 -11.314 60.005 1.00 54.13 ? 168 SER C N 1 ATOM 6271 C CA . SER D 2 173 ? 34.167 -9.947 59.543 1.00 56.22 ? 168 SER C CA 1 ATOM 6272 C C . SER D 2 173 ? 33.651 -8.852 60.477 1.00 56.96 ? 168 SER C C 1 ATOM 6273 O O . SER D 2 173 ? 34.136 -7.726 60.392 1.00 58.86 ? 168 SER C O 1 ATOM 6274 C CB . SER D 2 173 ? 33.617 -9.677 58.115 1.00 58.77 ? 168 SER C CB 1 ATOM 6275 O OG . SER D 2 173 ? 33.192 -10.883 57.494 1.00 58.74 ? 168 SER C OG 1 ATOM 6276 N N . LYS D 2 174 ? 32.681 -9.161 61.349 1.00 56.15 ? 169 LYS C N 1 ATOM 6277 C CA . LYS D 2 174 ? 32.094 -8.150 62.231 1.00 57.40 ? 169 LYS C CA 1 ATOM 6278 C C . LYS D 2 174 ? 32.611 -8.161 63.660 1.00 56.04 ? 169 LYS C C 1 ATOM 6279 O O . LYS D 2 174 ? 33.062 -7.124 64.141 1.00 57.45 ? 169 LYS C O 1 ATOM 6280 C CB . LYS D 2 174 ? 30.572 -8.273 62.252 1.00 58.75 ? 169 LYS C CB 1 ATOM 6281 C CG . LYS D 2 174 ? 29.951 -8.007 60.897 1.00 60.79 ? 169 LYS C CG 1 ATOM 6282 C CD . LYS D 2 174 ? 28.647 -7.260 60.992 1.00 63.74 ? 169 LYS C CD 1 ATOM 6283 C CE . LYS D 2 174 ? 28.497 -6.337 59.803 1.00 66.66 ? 169 LYS C CE 1 ATOM 6284 N NZ . LYS D 2 174 ? 27.143 -5.741 59.781 1.00 70.09 ? 169 LYS C NZ 1 ATOM 6285 N N . ASP D 2 175 ? 32.521 -9.308 64.342 1.00 53.62 ? 170 ASP C N 1 ATOM 6286 C CA . ASP D 2 175 ? 32.995 -9.406 65.727 1.00 52.94 ? 170 ASP C CA 1 ATOM 6287 C C . ASP D 2 175 ? 34.392 -10.037 65.856 1.00 51.03 ? 170 ASP C C 1 ATOM 6288 O O . ASP D 2 175 ? 34.922 -10.132 66.957 1.00 51.18 ? 170 ASP C O 1 ATOM 6289 C CB . ASP D 2 175 ? 31.984 -10.143 66.618 1.00 52.78 ? 170 ASP C CB 1 ATOM 6290 C CG . ASP D 2 175 ? 31.869 -11.639 66.291 1.00 50.95 ? 170 ASP C CG 1 ATOM 6291 O OD1 . ASP D 2 175 ? 32.722 -12.165 65.544 1.00 49.72 ? 170 ASP C OD1 1 ATOM 6292 O OD2 . ASP D 2 175 ? 30.911 -12.294 66.780 1.00 51.01 ? 170 ASP C OD2 1 ATOM 6293 N N . SER D 2 176 ? 34.974 -10.477 64.741 1.00 49.64 ? 171 SER C N 1 ATOM 6294 C CA . SER D 2 176 ? 36.369 -10.939 64.701 1.00 48.66 ? 171 SER C CA 1 ATOM 6295 C C . SER D 2 176 ? 36.610 -12.227 65.492 1.00 47.37 ? 171 SER C C 1 ATOM 6296 O O . SER D 2 176 ? 37.754 -12.545 65.831 1.00 47.25 ? 171 SER C O 1 ATOM 6297 C CB . SER D 2 176 ? 37.314 -9.826 65.180 1.00 49.91 ? 171 SER C CB 1 ATOM 6298 O OG . SER D 2 176 ? 37.137 -8.661 64.413 1.00 51.06 ? 171 SER C OG 1 ATOM 6299 N N . THR D 2 177 ? 35.543 -12.979 65.761 1.00 46.53 ? 172 THR C N 1 ATOM 6300 C CA . THR D 2 177 ? 35.667 -14.234 66.495 1.00 45.64 ? 172 THR C CA 1 ATOM 6301 C C . THR D 2 177 ? 35.757 -15.411 65.540 1.00 44.59 ? 172 THR C C 1 ATOM 6302 O O . THR D 2 177 ? 35.584 -15.279 64.319 1.00 44.68 ? 172 THR C O 1 ATOM 6303 C CB . THR D 2 177 ? 34.476 -14.493 67.439 1.00 45.76 ? 172 THR C CB 1 ATOM 6304 O OG1 . THR D 2 177 ? 33.263 -14.454 66.681 1.00 45.65 ? 172 THR C OG1 1 ATOM 6305 C CG2 . THR D 2 177 ? 34.419 -13.448 68.569 1.00 47.57 ? 172 THR C CG2 1 ATOM 6306 N N . TYR D 2 178 ? 36.049 -16.563 66.126 1.00 44.12 ? 173 TYR C N 1 ATOM 6307 C CA . TYR D 2 178 ? 36.065 -17.831 65.440 1.00 43.48 ? 173 TYR C CA 1 ATOM 6308 C C . TYR D 2 178 ? 35.002 -18.746 66.032 1.00 42.86 ? 173 TYR C C 1 ATOM 6309 O O . TYR D 2 178 ? 34.566 -18.557 67.164 1.00 43.03 ? 173 TYR C O 1 ATOM 6310 C CB . TYR D 2 178 ? 37.467 -18.452 65.570 1.00 44.01 ? 173 TYR C CB 1 ATOM 6311 C CG . TYR D 2 178 ? 38.560 -17.613 64.934 1.00 44.90 ? 173 TYR C CG 1 ATOM 6312 C CD1 . TYR D 2 178 ? 39.225 -16.614 65.657 1.00 45.87 ? 173 TYR C CD1 1 ATOM 6313 C CD2 . TYR D 2 178 ? 38.932 -17.820 63.620 1.00 45.39 ? 173 TYR C CD2 1 ATOM 6314 C CE1 . TYR D 2 178 ? 40.222 -15.845 65.083 1.00 46.99 ? 173 TYR C CE1 1 ATOM 6315 C CE2 . TYR D 2 178 ? 39.925 -17.058 63.038 1.00 46.61 ? 173 TYR C CE2 1 ATOM 6316 C CZ . TYR D 2 178 ? 40.565 -16.072 63.771 1.00 47.34 ? 173 TYR C CZ 1 ATOM 6317 O OH . TYR D 2 178 ? 41.566 -15.302 63.223 1.00 48.96 ? 173 TYR C OH 1 ATOM 6318 N N . SER D 2 179 ? 34.594 -19.736 65.249 1.00 42.60 ? 174 SER C N 1 ATOM 6319 C CA . SER D 2 179 ? 33.625 -20.753 65.662 1.00 42.30 ? 174 SER C CA 1 ATOM 6320 C C . SER D 2 179 ? 34.031 -22.115 65.104 1.00 42.29 ? 174 SER C C 1 ATOM 6321 O O . SER D 2 179 ? 34.723 -22.181 64.089 1.00 42.83 ? 174 SER C O 1 ATOM 6322 C CB . SER D 2 179 ? 32.236 -20.420 65.135 1.00 42.37 ? 174 SER C CB 1 ATOM 6323 O OG . SER D 2 179 ? 31.719 -19.232 65.708 1.00 43.32 ? 174 SER C OG 1 ATOM 6324 N N . MET D 2 180 ? 33.569 -23.190 65.740 1.00 42.12 ? 175 MET C N 1 ATOM 6325 C CA . MET D 2 180 ? 33.949 -24.531 65.338 1.00 42.32 ? 175 MET C CA 1 ATOM 6326 C C . MET D 2 180 ? 32.813 -25.519 65.615 1.00 41.72 ? 175 MET C C 1 ATOM 6327 O O . MET D 2 180 ? 32.055 -25.342 66.556 1.00 41.25 ? 175 MET C O 1 ATOM 6328 C CB . MET D 2 180 ? 35.197 -24.929 66.120 1.00 43.31 ? 175 MET C CB 1 ATOM 6329 C CG . MET D 2 180 ? 35.615 -26.380 65.970 1.00 44.39 ? 175 MET C CG 1 ATOM 6330 S SD . MET D 2 180 ? 36.751 -26.796 67.308 1.00 46.13 ? 175 MET C SD 1 ATOM 6331 C CE . MET D 2 180 ? 37.389 -28.353 66.680 1.00 47.53 ? 175 MET C CE 1 ATOM 6332 N N . SER D 2 181 ? 32.702 -26.543 64.774 1.00 41.71 ? 176 SER C N 1 ATOM 6333 C CA . SER D 2 181 ? 31.830 -27.689 65.028 1.00 41.62 ? 176 SER C CA 1 ATOM 6334 C C . SER D 2 181 ? 32.650 -28.955 65.187 1.00 42.28 ? 176 SER C C 1 ATOM 6335 O O . SER D 2 181 ? 33.653 -29.140 64.505 1.00 43.26 ? 176 SER C O 1 ATOM 6336 C CB . SER D 2 181 ? 30.838 -27.900 63.896 1.00 41.92 ? 176 SER C CB 1 ATOM 6337 O OG . SER D 2 181 ? 31.501 -28.432 62.772 1.00 43.31 ? 176 SER C OG 1 ATOM 6338 N N . SER D 2 182 ? 32.216 -29.822 66.093 1.00 42.35 ? 177 SER C N 1 ATOM 6339 C CA . SER D 2 182 ? 32.849 -31.113 66.295 1.00 43.40 ? 177 SER C CA 1 ATOM 6340 C C . SER D 2 182 ? 31.745 -32.155 66.322 1.00 43.62 ? 177 SER C C 1 ATOM 6341 O O . SER D 2 182 ? 30.759 -32.004 67.030 1.00 43.25 ? 177 SER C O 1 ATOM 6342 C CB . SER D 2 182 ? 33.664 -31.135 67.593 1.00 43.91 ? 177 SER C CB 1 ATOM 6343 O OG . SER D 2 182 ? 34.381 -32.354 67.726 1.00 45.40 ? 177 SER C OG 1 ATOM 6344 N N . THR D 2 183 ? 31.918 -33.209 65.540 1.00 44.77 ? 178 THR C N 1 ATOM 6345 C CA . THR D 2 183 ? 30.871 -34.188 65.344 1.00 45.25 ? 178 THR C CA 1 ATOM 6346 C C . THR D 2 183 ? 31.401 -35.597 65.502 1.00 46.98 ? 178 THR C C 1 ATOM 6347 O O . THR D 2 183 ? 32.304 -36.025 64.770 1.00 48.27 ? 178 THR C O 1 ATOM 6348 C CB . THR D 2 183 ? 30.274 -34.033 63.952 1.00 45.60 ? 178 THR C CB 1 ATOM 6349 O OG1 . THR D 2 183 ? 29.729 -32.717 63.834 1.00 44.38 ? 178 THR C OG1 1 ATOM 6350 C CG2 . THR D 2 183 ? 29.185 -35.066 63.707 1.00 46.58 ? 178 THR C CG2 1 ATOM 6351 N N . LEU D 2 184 ? 30.803 -36.318 66.440 1.00 47.29 ? 179 LEU C N 1 ATOM 6352 C CA . LEU D 2 184 ? 31.175 -37.686 66.718 1.00 49.24 ? 179 LEU C CA 1 ATOM 6353 C C . LEU D 2 184 ? 30.131 -38.607 66.114 1.00 49.94 ? 179 LEU C C 1 ATOM 6354 O O . LEU D 2 184 ? 28.999 -38.636 66.576 1.00 49.38 ? 179 LEU C O 1 ATOM 6355 C CB . LEU D 2 184 ? 31.253 -37.902 68.222 1.00 49.69 ? 179 LEU C CB 1 ATOM 6356 C CG . LEU D 2 184 ? 31.405 -39.344 68.690 1.00 51.96 ? 179 LEU C CG 1 ATOM 6357 C CD1 . LEU D 2 184 ? 32.638 -39.996 68.072 1.00 54.00 ? 179 LEU C CD1 1 ATOM 6358 C CD2 . LEU D 2 184 ? 31.482 -39.350 70.203 1.00 52.65 ? 179 LEU C CD2 1 ATOM 6359 N N . THR D 2 185 ? 30.516 -39.366 65.093 1.00 51.63 ? 180 THR C N 1 ATOM 6360 C CA . THR D 2 185 ? 29.576 -40.240 64.411 1.00 52.92 ? 180 THR C CA 1 ATOM 6361 C C . THR D 2 185 ? 29.774 -41.679 64.882 1.00 55.04 ? 180 THR C C 1 ATOM 6362 O O . THR D 2 185 ? 30.898 -42.148 65.013 1.00 56.48 ? 180 THR C O 1 ATOM 6363 C CB . THR D 2 185 ? 29.707 -40.095 62.882 1.00 53.99 ? 180 THR C CB 1 ATOM 6364 O OG1 . THR D 2 185 ? 29.325 -38.760 62.510 1.00 52.23 ? 180 THR C OG1 1 ATOM 6365 C CG2 . THR D 2 185 ? 28.822 -41.099 62.158 1.00 55.98 ? 180 THR C CG2 1 ATOM 6366 N N . LEU D 2 186 ? 28.659 -42.346 65.174 1.00 55.59 ? 181 LEU C N 1 ATOM 6367 C CA . LEU D 2 186 ? 28.643 -43.731 65.650 1.00 57.80 ? 181 LEU C CA 1 ATOM 6368 C C . LEU D 2 186 ? 27.507 -44.497 64.999 1.00 59.00 ? 181 LEU C C 1 ATOM 6369 O O . LEU D 2 186 ? 26.606 -43.908 64.390 1.00 58.11 ? 181 LEU C O 1 ATOM 6370 C CB . LEU D 2 186 ? 28.404 -43.768 67.159 1.00 57.25 ? 181 LEU C CB 1 ATOM 6371 C CG . LEU D 2 186 ? 29.305 -42.908 68.039 1.00 56.20 ? 181 LEU C CG 1 ATOM 6372 C CD1 . LEU D 2 186 ? 28.618 -42.607 69.356 1.00 55.41 ? 181 LEU C CD1 1 ATOM 6373 C CD2 . LEU D 2 186 ? 30.629 -43.615 68.264 1.00 58.52 ? 181 LEU C CD2 1 ATOM 6374 N N . THR D 2 187 ? 27.535 -45.814 65.145 1.00 61.36 ? 182 THR C N 1 ATOM 6375 C CA . THR D 2 187 ? 26.357 -46.606 64.835 1.00 62.76 ? 182 THR C CA 1 ATOM 6376 C C . THR D 2 187 ? 25.378 -46.435 65.983 1.00 61.62 ? 182 THR C C 1 ATOM 6377 O O . THR D 2 187 ? 25.782 -46.161 67.113 1.00 60.84 ? 182 THR C O 1 ATOM 6378 C CB . THR D 2 187 ? 26.659 -48.112 64.652 1.00 66.15 ? 182 THR C CB 1 ATOM 6379 O OG1 . THR D 2 187 ? 27.094 -48.694 65.886 1.00 66.71 ? 182 THR C OG1 1 ATOM 6380 C CG2 . THR D 2 187 ? 27.720 -48.332 63.571 1.00 68.14 ? 182 THR C CG2 1 ATOM 6381 N N . LYS D 2 188 ? 24.091 -46.575 65.683 1.00 62.08 ? 183 LYS C N 1 ATOM 6382 C CA . LYS D 2 188 ? 23.055 -46.634 66.706 1.00 61.79 ? 183 LYS C CA 1 ATOM 6383 C C . LYS D 2 188 ? 23.466 -47.651 67.776 1.00 63.47 ? 183 LYS C C 1 ATOM 6384 O O . LYS D 2 188 ? 23.520 -47.337 68.966 1.00 62.85 ? 183 LYS C O 1 ATOM 6385 C CB . LYS D 2 188 ? 21.732 -47.036 66.046 1.00 63.20 ? 183 LYS C CB 1 ATOM 6386 C CG . LYS D 2 188 ? 20.477 -46.980 66.907 1.00 63.30 ? 183 LYS C CG 1 ATOM 6387 C CD . LYS D 2 188 ? 19.324 -47.631 66.137 1.00 65.56 ? 183 LYS C CD 1 ATOM 6388 C CE . LYS D 2 188 ? 17.937 -47.223 66.621 1.00 65.82 ? 183 LYS C CE 1 ATOM 6389 N NZ . LYS D 2 188 ? 17.437 -48.076 67.732 1.00 67.37 ? 183 LYS C NZ 1 ATOM 6390 N N . ASP D 2 189 ? 23.800 -48.858 67.341 1.00 66.02 ? 184 ASP C N 1 ATOM 6391 C CA . ASP D 2 189 ? 24.150 -49.934 68.270 1.00 68.32 ? 184 ASP C CA 1 ATOM 6392 C C . ASP D 2 189 ? 25.262 -49.562 69.242 1.00 67.75 ? 184 ASP C C 1 ATOM 6393 O O . ASP D 2 189 ? 25.175 -49.904 70.418 1.00 68.70 ? 184 ASP C O 1 ATOM 6394 C CB . ASP D 2 189 ? 24.549 -51.207 67.518 1.00 71.56 ? 184 ASP C CB 1 ATOM 6395 C CG . ASP D 2 189 ? 23.345 -51.953 66.948 1.00 73.38 ? 184 ASP C CG 1 ATOM 6396 O OD1 . ASP D 2 189 ? 22.263 -51.336 66.796 1.00 72.03 ? 184 ASP C OD1 1 ATOM 6397 O OD2 . ASP D 2 189 ? 23.477 -53.163 66.663 1.00 76.52 ? 184 ASP C OD2 1 ATOM 6398 N N . GLU D 2 190 ? 26.301 -48.886 68.753 1.00 66.55 ? 185 GLU C N 1 ATOM 6399 C CA . GLU D 2 190 ? 27.383 -48.426 69.623 1.00 66.28 ? 185 GLU C CA 1 ATOM 6400 C C . GLU D 2 190 ? 26.948 -47.252 70.494 1.00 63.61 ? 185 GLU C C 1 ATOM 6401 O O . GLU D 2 190 ? 27.328 -47.166 71.663 1.00 64.33 ? 185 GLU C O 1 ATOM 6402 C CB . GLU D 2 190 ? 28.632 -48.043 68.814 1.00 66.39 ? 185 GLU C CB 1 ATOM 6403 C CG . GLU D 2 190 ? 29.848 -47.762 69.690 1.00 67.08 ? 185 GLU C CG 1 ATOM 6404 C CD . GLU D 2 190 ? 31.113 -47.514 68.887 1.00 67.95 ? 185 GLU C CD 1 ATOM 6405 O OE1 . GLU D 2 190 ? 31.019 -46.995 67.742 1.00 66.69 ? 185 GLU C OE1 1 ATOM 6406 O OE2 . GLU D 2 190 ? 32.209 -47.837 69.410 1.00 70.29 ? 185 GLU C OE2 1 ATOM 6407 N N . TYR D 2 191 ? 26.161 -46.347 69.928 1.00 61.07 ? 186 TYR C N 1 ATOM 6408 C CA . TYR D 2 191 ? 25.664 -45.213 70.686 1.00 58.99 ? 186 TYR C CA 1 ATOM 6409 C C . TYR D 2 191 ? 24.917 -45.700 71.923 1.00 60.65 ? 186 TYR C C 1 ATOM 6410 O O . TYR D 2 191 ? 25.089 -45.142 73.000 1.00 60.42 ? 186 TYR C O 1 ATOM 6411 C CB . TYR D 2 191 ? 24.772 -44.321 69.819 1.00 56.83 ? 186 TYR C CB 1 ATOM 6412 C CG . TYR D 2 191 ? 24.055 -43.224 70.582 1.00 55.30 ? 186 TYR C CG 1 ATOM 6413 C CD1 . TYR D 2 191 ? 24.762 -42.211 71.217 1.00 53.96 ? 186 TYR C CD1 1 ATOM 6414 C CD2 . TYR D 2 191 ? 22.667 -43.189 70.652 1.00 55.66 ? 186 TYR C CD2 1 ATOM 6415 C CE1 . TYR D 2 191 ? 24.111 -41.207 71.912 1.00 53.16 ? 186 TYR C CE1 1 ATOM 6416 C CE2 . TYR D 2 191 ? 22.003 -42.180 71.340 1.00 54.94 ? 186 TYR C CE2 1 ATOM 6417 C CZ . TYR D 2 191 ? 22.742 -41.189 71.966 1.00 53.69 ? 186 TYR C CZ 1 ATOM 6418 O OH . TYR D 2 191 ? 22.143 -40.175 72.666 1.00 53.57 ? 186 TYR C OH 1 ATOM 6419 N N . GLU D 2 192 ? 24.125 -46.759 71.764 1.00 62.74 ? 187 GLU C N 1 ATOM 6420 C CA . GLU D 2 192 ? 23.338 -47.326 72.865 1.00 65.07 ? 187 GLU C CA 1 ATOM 6421 C C . GLU D 2 192 ? 24.123 -48.209 73.835 1.00 67.72 ? 187 GLU C C 1 ATOM 6422 O O . GLU D 2 192 ? 23.554 -48.678 74.815 1.00 69.64 ? 187 GLU C O 1 ATOM 6423 C CB . GLU D 2 192 ? 22.143 -48.123 72.318 1.00 66.51 ? 187 GLU C CB 1 ATOM 6424 C CG . GLU D 2 192 ? 21.170 -47.239 71.550 1.00 64.97 ? 187 GLU C CG 1 ATOM 6425 C CD . GLU D 2 192 ? 19.962 -47.947 70.989 1.00 66.77 ? 187 GLU C CD 1 ATOM 6426 O OE1 . GLU D 2 192 ? 19.766 -49.149 71.283 1.00 69.42 ? 187 GLU C OE1 1 ATOM 6427 O OE2 . GLU D 2 192 ? 19.195 -47.269 70.264 1.00 65.94 ? 187 GLU C OE2 1 ATOM 6428 N N . ARG D 2 193 ? 25.408 -48.449 73.578 1.00 68.41 ? 188 ARG C N 1 ATOM 6429 C CA . ARG D 2 193 ? 26.213 -49.191 74.535 1.00 71.33 ? 188 ARG C CA 1 ATOM 6430 C C . ARG D 2 193 ? 26.747 -48.279 75.631 1.00 71.22 ? 188 ARG C C 1 ATOM 6431 O O . ARG D 2 193 ? 27.284 -48.765 76.614 1.00 73.88 ? 188 ARG C O 1 ATOM 6432 C CB . ARG D 2 193 ? 27.323 -49.971 73.808 1.00 73.00 ? 188 ARG C CB 1 ATOM 6433 C CG . ARG D 2 193 ? 26.780 -50.827 72.651 1.00 73.66 ? 188 ARG C CG 1 ATOM 6434 C CD . ARG D 2 193 ? 27.349 -52.225 72.581 1.00 77.42 ? 188 ARG C CD 1 ATOM 6435 N NE . ARG D 2 193 ? 26.670 -53.138 73.498 1.00 79.98 ? 188 ARG C NE 1 ATOM 6436 C CZ . ARG D 2 193 ? 25.645 -53.943 73.189 1.00 81.15 ? 188 ARG C CZ 1 ATOM 6437 N NH1 . ARG D 2 193 ? 25.141 -53.998 71.957 1.00 80.17 ? 188 ARG C NH1 1 ATOM 6438 N NH2 . ARG D 2 193 ? 25.111 -54.719 74.127 1.00 83.66 ? 188 ARG C NH2 1 ATOM 6439 N N . HIS D 2 194 ? 26.548 -46.967 75.488 1.00 68.74 ? 189 HIS C N 1 ATOM 6440 C CA . HIS D 2 194 ? 27.121 -45.986 76.408 1.00 68.86 ? 189 HIS C CA 1 ATOM 6441 C C . HIS D 2 194 ? 26.085 -44.974 76.855 1.00 67.48 ? 189 HIS C C 1 ATOM 6442 O O . HIS D 2 194 ? 25.132 -44.686 76.133 1.00 65.48 ? 189 HIS C O 1 ATOM 6443 C CB . HIS D 2 194 ? 28.303 -45.265 75.757 1.00 67.45 ? 189 HIS C CB 1 ATOM 6444 C CG . HIS D 2 194 ? 29.419 -46.185 75.376 1.00 69.69 ? 189 HIS C CG 1 ATOM 6445 N ND1 . HIS D 2 194 ? 30.227 -46.797 76.312 1.00 73.12 ? 189 HIS C ND1 1 ATOM 6446 C CD2 . HIS D 2 194 ? 29.853 -46.612 74.166 1.00 69.49 ? 189 HIS C CD2 1 ATOM 6447 C CE1 . HIS D 2 194 ? 31.111 -47.561 75.694 1.00 74.81 ? 189 HIS C CE1 1 ATOM 6448 N NE2 . HIS D 2 194 ? 30.909 -47.463 74.392 1.00 72.66 ? 189 HIS C NE2 1 ATOM 6449 N N . ASN D 2 195 ? 26.288 -44.441 78.057 1.00 68.99 ? 190 ASN C N 1 ATOM 6450 C CA . ASN D 2 195 ? 25.341 -43.513 78.677 1.00 68.77 ? 190 ASN C CA 1 ATOM 6451 C C . ASN D 2 195 ? 25.793 -42.064 78.632 1.00 66.40 ? 190 ASN C C 1 ATOM 6452 O O . ASN D 2 195 ? 25.012 -41.185 78.284 1.00 64.67 ? 190 ASN C O 1 ATOM 6453 C CB . ASN D 2 195 ? 25.045 -43.923 80.117 1.00 72.63 ? 190 ASN C CB 1 ATOM 6454 C CG . ASN D 2 195 ? 24.151 -45.138 80.182 1.00 74.94 ? 190 ASN C CG 1 ATOM 6455 O OD1 . ASN D 2 195 ? 23.074 -45.171 79.559 1.00 73.59 ? 190 ASN C OD1 1 ATOM 6456 N ND2 . ASN D 2 195 ? 24.584 -46.155 80.935 1.00 78.70 ? 190 ASN C ND2 1 ATOM 6457 N N . SER D 2 196 ? 27.048 -41.817 78.979 1.00 66.59 ? 191 SER C N 1 ATOM 6458 C CA . SER D 2 196 ? 27.525 -40.447 79.147 1.00 65.26 ? 191 SER C CA 1 ATOM 6459 C C . SER D 2 196 ? 28.345 -39.959 77.943 1.00 62.17 ? 191 SER C C 1 ATOM 6460 O O . SER D 2 196 ? 29.307 -40.605 77.534 1.00 62.40 ? 191 SER C O 1 ATOM 6461 C CB . SER D 2 196 ? 28.339 -40.347 80.434 1.00 68.52 ? 191 SER C CB 1 ATOM 6462 O OG . SER D 2 196 ? 28.709 -39.013 80.700 1.00 68.04 ? 191 SER C OG 1 ATOM 6463 N N . TYR D 2 197 ? 27.947 -38.815 77.386 1.00 59.63 ? 192 TYR C N 1 ATOM 6464 C CA . TYR D 2 197 ? 28.613 -38.228 76.229 1.00 57.07 ? 192 TYR C CA 1 ATOM 6465 C C . TYR D 2 197 ? 29.033 -36.812 76.561 1.00 56.63 ? 192 TYR C C 1 ATOM 6466 O O . TYR D 2 197 ? 28.205 -35.970 76.883 1.00 56.27 ? 192 TYR C O 1 ATOM 6467 C CB . TYR D 2 197 ? 27.690 -38.250 75.012 1.00 54.73 ? 192 TYR C CB 1 ATOM 6468 C CG . TYR D 2 197 ? 27.465 -39.654 74.500 1.00 55.40 ? 192 TYR C CG 1 ATOM 6469 C CD1 . TYR D 2 197 ? 26.499 -40.485 75.082 1.00 57.11 ? 192 TYR C CD1 1 ATOM 6470 C CD2 . TYR D 2 197 ? 28.238 -40.170 73.468 1.00 54.74 ? 192 TYR C CD2 1 ATOM 6471 C CE1 . TYR D 2 197 ? 26.299 -41.779 74.627 1.00 58.00 ? 192 TYR C CE1 1 ATOM 6472 C CE2 . TYR D 2 197 ? 28.046 -41.465 73.006 1.00 55.86 ? 192 TYR C CE2 1 ATOM 6473 C CZ . TYR D 2 197 ? 27.076 -42.269 73.588 1.00 57.48 ? 192 TYR C CZ 1 ATOM 6474 O OH . TYR D 2 197 ? 26.865 -43.557 73.144 1.00 58.72 ? 192 TYR C OH 1 ATOM 6475 N N . THR D 2 198 ? 30.331 -36.558 76.482 1.00 57.19 ? 193 THR C N 1 ATOM 6476 C CA . THR D 2 198 ? 30.888 -35.287 76.908 1.00 57.54 ? 193 THR C CA 1 ATOM 6477 C C . THR D 2 198 ? 31.741 -34.665 75.796 1.00 55.71 ? 193 THR C C 1 ATOM 6478 O O . THR D 2 198 ? 32.472 -35.354 75.082 1.00 54.96 ? 193 THR C O 1 ATOM 6479 C CB . THR D 2 198 ? 31.725 -35.458 78.192 1.00 60.90 ? 193 THR C CB 1 ATOM 6480 O OG1 . THR D 2 198 ? 30.921 -36.009 79.256 1.00 63.84 ? 193 THR C OG1 1 ATOM 6481 C CG2 . THR D 2 198 ? 32.297 -34.139 78.641 1.00 61.21 ? 193 THR C CG2 1 ATOM 6482 N N . CYS D 2 199 ? 31.621 -33.346 75.682 1.00 55.24 ? 194 CYS C N 1 ATOM 6483 C CA . CYS D 2 199 ? 32.370 -32.522 74.743 1.00 54.32 ? 194 CYS C CA 1 ATOM 6484 C C . CYS D 2 199 ? 33.203 -31.501 75.537 1.00 55.50 ? 194 CYS C C 1 ATOM 6485 O O . CYS D 2 199 ? 32.657 -30.596 76.171 1.00 55.81 ? 194 CYS C O 1 ATOM 6486 C CB . CYS D 2 199 ? 31.369 -31.806 73.834 1.00 52.48 ? 194 CYS C CB 1 ATOM 6487 S SG . CYS D 2 199 ? 32.104 -30.604 72.730 1.00 52.24 ? 194 CYS C SG 1 ATOM 6488 N N . GLU D 2 200 ? 34.525 -31.655 75.497 1.00 56.81 ? 195 GLU C N 1 ATOM 6489 C CA . GLU D 2 200 ? 35.446 -30.833 76.296 1.00 58.71 ? 195 GLU C CA 1 ATOM 6490 C C . GLU D 2 200 ? 36.273 -29.877 75.437 1.00 56.73 ? 195 GLU C C 1 ATOM 6491 O O . GLU D 2 200 ? 37.065 -30.302 74.597 1.00 56.14 ? 195 GLU C O 1 ATOM 6492 C CB . GLU D 2 200 ? 36.412 -31.703 77.098 1.00 62.61 ? 195 GLU C CB 1 ATOM 6493 C CG . GLU D 2 200 ? 35.835 -32.345 78.344 1.00 65.99 ? 195 GLU C CG 1 ATOM 6494 C CD . GLU D 2 200 ? 36.932 -32.802 79.288 1.00 70.84 ? 195 GLU C CD 1 ATOM 6495 O OE1 . GLU D 2 200 ? 36.671 -33.671 80.148 1.00 74.28 ? 195 GLU C OE1 1 ATOM 6496 O OE2 . GLU D 2 200 ? 38.067 -32.279 79.175 1.00 72.61 ? 195 GLU C OE2 1 ATOM 6497 N N . ALA D 2 201 ? 36.111 -28.587 75.697 1.00 55.86 ? 196 ALA C N 1 ATOM 6498 C CA . ALA D 2 201 ? 36.824 -27.550 74.989 1.00 54.64 ? 196 ALA C CA 1 ATOM 6499 C C . ALA D 2 201 ? 37.924 -26.941 75.858 1.00 57.07 ? 196 ALA C C 1 ATOM 6500 O O . ALA D 2 201 ? 37.637 -26.348 76.889 1.00 58.67 ? 196 ALA C O 1 ATOM 6501 C CB . ALA D 2 201 ? 35.843 -26.472 74.554 1.00 52.70 ? 196 ALA C CB 1 ATOM 6502 N N . THR D 2 202 ? 39.177 -27.072 75.424 1.00 57.77 ? 197 THR C N 1 ATOM 6503 C CA . THR D 2 202 ? 40.303 -26.384 76.067 1.00 60.36 ? 197 THR C CA 1 ATOM 6504 C C . THR D 2 202 ? 40.663 -25.137 75.261 1.00 58.58 ? 197 THR C C 1 ATOM 6505 O O . THR D 2 202 ? 40.893 -25.210 74.046 1.00 56.94 ? 197 THR C O 1 ATOM 6506 C CB . THR D 2 202 ? 41.557 -27.281 76.202 1.00 63.27 ? 197 THR C CB 1 ATOM 6507 O OG1 . THR D 2 202 ? 41.267 -28.425 77.012 1.00 65.31 ? 197 THR C OG1 1 ATOM 6508 C CG2 . THR D 2 202 ? 42.736 -26.502 76.802 1.00 66.37 ? 197 THR C CG2 1 ATOM 6509 N N . HIS D 2 203 ? 40.701 -24.001 75.947 1.00 59.39 ? 198 HIS C N 1 ATOM 6510 C CA . HIS D 2 203 ? 40.902 -22.712 75.320 1.00 58.27 ? 198 HIS C CA 1 ATOM 6511 C C . HIS D 2 203 ? 41.680 -21.853 76.305 1.00 61.57 ? 198 HIS C C 1 ATOM 6512 O O . HIS D 2 203 ? 41.641 -22.107 77.509 1.00 64.44 ? 198 HIS C O 1 ATOM 6513 C CB . HIS D 2 203 ? 39.539 -22.094 74.994 1.00 55.76 ? 198 HIS C CB 1 ATOM 6514 C CG . HIS D 2 203 ? 39.619 -20.834 74.193 1.00 54.44 ? 198 HIS C CG 1 ATOM 6515 N ND1 . HIS D 2 203 ? 39.331 -19.597 74.725 1.00 55.34 ? 198 HIS C ND1 1 ATOM 6516 C CD2 . HIS D 2 203 ? 39.956 -20.621 72.899 1.00 52.62 ? 198 HIS C CD2 1 ATOM 6517 C CE1 . HIS D 2 203 ? 39.484 -18.673 73.793 1.00 54.09 ? 198 HIS C CE1 1 ATOM 6518 N NE2 . HIS D 2 203 ? 39.877 -19.266 72.680 1.00 52.48 ? 198 HIS C NE2 1 ATOM 6519 N N . LYS D 2 204 ? 42.399 -20.847 75.816 1.00 61.98 ? 199 LYS C N 1 ATOM 6520 C CA . LYS D 2 204 ? 43.272 -20.081 76.714 1.00 65.56 ? 199 LYS C CA 1 ATOM 6521 C C . LYS D 2 204 ? 42.499 -19.266 77.770 1.00 67.10 ? 199 LYS C C 1 ATOM 6522 O O . LYS D 2 204 ? 43.009 -19.054 78.867 1.00 70.84 ? 199 LYS C O 1 ATOM 6523 C CB . LYS D 2 204 ? 44.266 -19.216 75.934 1.00 65.89 ? 199 LYS C CB 1 ATOM 6524 C CG . LYS D 2 204 ? 43.776 -17.828 75.553 1.00 64.73 ? 199 LYS C CG 1 ATOM 6525 C CD . LYS D 2 204 ? 44.762 -17.124 74.629 1.00 64.87 ? 199 LYS C CD 1 ATOM 6526 C CE . LYS D 2 204 ? 46.024 -16.661 75.349 1.00 68.89 ? 199 LYS C CE 1 ATOM 6527 N NZ . LYS D 2 204 ? 45.797 -15.370 76.047 1.00 70.60 ? 199 LYS C NZ 1 ATOM 6528 N N . THR D 2 205 ? 41.261 -18.871 77.461 1.00 64.76 ? 200 THR C N 1 ATOM 6529 C CA . THR D 2 205 ? 40.425 -18.108 78.393 1.00 66.44 ? 200 THR C CA 1 ATOM 6530 C C . THR D 2 205 ? 40.131 -18.850 79.703 1.00 69.76 ? 200 THR C C 1 ATOM 6531 O O . THR D 2 205 ? 39.525 -18.283 80.608 1.00 72.27 ? 200 THR C O 1 ATOM 6532 C CB . THR D 2 205 ? 39.078 -17.703 77.760 1.00 63.58 ? 200 THR C CB 1 ATOM 6533 O OG1 . THR D 2 205 ? 38.459 -18.855 77.180 1.00 60.92 ? 200 THR C OG1 1 ATOM 6534 C CG2 . THR D 2 205 ? 39.269 -16.632 76.696 1.00 61.81 ? 200 THR C CG2 1 ATOM 6535 N N . SER D 2 206 ? 40.547 -20.110 79.813 1.00 70.34 ? 201 SER C N 1 ATOM 6536 C CA . SER D 2 206 ? 40.491 -20.812 81.091 1.00 74.07 ? 201 SER C CA 1 ATOM 6537 C C . SER D 2 206 ? 41.522 -21.934 81.174 1.00 75.80 ? 201 SER C C 1 ATOM 6538 O O . SER D 2 206 ? 41.872 -22.539 80.159 1.00 73.63 ? 201 SER C O 1 ATOM 6539 C CB . SER D 2 206 ? 39.103 -21.396 81.332 1.00 72.90 ? 201 SER C CB 1 ATOM 6540 O OG . SER D 2 206 ? 39.097 -22.197 82.498 1.00 76.42 ? 201 SER C OG 1 ATOM 6541 N N . THR D 2 207 ? 41.991 -22.203 82.390 1.00 80.48 ? 202 THR C N 1 ATOM 6542 C CA . THR D 2 207 ? 42.854 -23.352 82.667 1.00 82.80 ? 202 THR C CA 1 ATOM 6543 C C . THR D 2 207 ? 42.038 -24.639 82.833 1.00 82.19 ? 202 THR C C 1 ATOM 6544 O O . THR D 2 207 ? 42.580 -25.736 82.714 1.00 83.07 ? 202 THR C O 1 ATOM 6545 C CB . THR D 2 207 ? 43.655 -23.131 83.949 1.00 88.71 ? 202 THR C CB 1 ATOM 6546 O OG1 . THR D 2 207 ? 42.744 -22.892 85.021 1.00 91.18 ? 202 THR C OG1 1 ATOM 6547 C CG2 . THR D 2 207 ? 44.565 -21.931 83.807 1.00 89.85 ? 202 THR C CG2 1 ATOM 6548 N N . SER D 2 208 ? 40.746 -24.491 83.137 1.00 81.21 ? 203 SER C N 1 ATOM 6549 C CA . SER D 2 208 ? 39.782 -25.597 83.168 1.00 80.06 ? 203 SER C CA 1 ATOM 6550 C C . SER D 2 208 ? 39.101 -25.667 81.802 1.00 74.50 ? 203 SER C C 1 ATOM 6551 O O . SER D 2 208 ? 38.783 -24.628 81.228 1.00 71.85 ? 203 SER C O 1 ATOM 6552 C CB . SER D 2 208 ? 38.751 -25.444 84.317 1.00 82.69 ? 203 SER C CB 1 ATOM 6553 O OG . SER D 2 208 ? 39.231 -26.059 85.499 1.00 88.01 ? 203 SER C OG 1 ATOM 6554 N N . PRO D 2 209 ? 38.911 -26.887 81.263 1.00 73.13 ? 204 PRO C N 1 ATOM 6555 C CA . PRO D 2 209 ? 38.121 -27.040 80.039 1.00 68.92 ? 204 PRO C CA 1 ATOM 6556 C C . PRO D 2 209 ? 36.644 -26.696 80.246 1.00 68.10 ? 204 PRO C C 1 ATOM 6557 O O . PRO D 2 209 ? 36.137 -26.828 81.368 1.00 70.77 ? 204 PRO C O 1 ATOM 6558 C CB . PRO D 2 209 ? 38.279 -28.530 79.693 1.00 68.61 ? 204 PRO C CB 1 ATOM 6559 C CG . PRO D 2 209 ? 38.677 -29.191 80.960 1.00 72.90 ? 204 PRO C CG 1 ATOM 6560 C CD . PRO D 2 209 ? 39.467 -28.174 81.728 1.00 75.88 ? 204 PRO C CD 1 ATOM 6561 N N . ILE D 2 210 ? 35.977 -26.235 79.182 1.00 64.68 ? 205 ILE C N 1 ATOM 6562 C CA . ILE D 2 210 ? 34.526 -26.110 79.195 1.00 64.13 ? 205 ILE C CA 1 ATOM 6563 C C . ILE D 2 210 ? 33.957 -27.474 78.827 1.00 62.69 ? 205 ILE C C 1 ATOM 6564 O O . ILE D 2 210 ? 34.333 -28.070 77.816 1.00 60.48 ? 205 ILE C O 1 ATOM 6565 C CB . ILE D 2 210 ? 34.011 -24.985 78.274 1.00 61.71 ? 205 ILE C CB 1 ATOM 6566 C CG1 . ILE D 2 210 ? 34.554 -23.651 78.781 1.00 63.83 ? 205 ILE C CG1 1 ATOM 6567 C CG2 . ILE D 2 210 ? 32.482 -24.941 78.265 1.00 61.17 ? 205 ILE C CG2 1 ATOM 6568 C CD1 . ILE D 2 210 ? 34.348 -22.509 77.818 1.00 61.78 ? 205 ILE C CD1 1 ATOM 6569 N N . VAL D 2 211 ? 33.091 -27.970 79.702 1.00 64.39 ? 206 VAL C N 1 ATOM 6570 C CA . VAL D 2 211 ? 32.522 -29.287 79.579 1.00 64.11 ? 206 VAL C CA 1 ATOM 6571 C C . VAL D 2 211 ? 31.035 -29.131 79.276 1.00 62.83 ? 206 VAL C C 1 ATOM 6572 O O . VAL D 2 211 ? 30.350 -28.326 79.912 1.00 64.39 ? 206 VAL C O 1 ATOM 6573 C CB . VAL D 2 211 ? 32.728 -30.079 80.896 1.00 67.80 ? 206 VAL C CB 1 ATOM 6574 C CG1 . VAL D 2 211 ? 32.234 -31.510 80.760 1.00 67.51 ? 206 VAL C CG1 1 ATOM 6575 C CG2 . VAL D 2 211 ? 34.203 -30.059 81.297 1.00 69.85 ? 206 VAL C CG2 1 ATOM 6576 N N . LYS D 2 212 ? 30.557 -29.874 78.281 1.00 60.28 ? 207 LYS C N 1 ATOM 6577 C CA . LYS D 2 212 ? 29.129 -30.019 78.047 1.00 59.69 ? 207 LYS C CA 1 ATOM 6578 C C . LYS D 2 212 ? 28.852 -31.481 77.793 1.00 59.46 ? 207 LYS C C 1 ATOM 6579 O O . LYS D 2 212 ? 29.564 -32.128 77.019 1.00 57.75 ? 207 LYS C O 1 ATOM 6580 C CB . LYS D 2 212 ? 28.669 -29.173 76.858 1.00 57.29 ? 207 LYS C CB 1 ATOM 6581 C CG . LYS D 2 212 ? 28.417 -27.714 77.202 1.00 58.14 ? 207 LYS C CG 1 ATOM 6582 C CD . LYS D 2 212 ? 27.309 -27.564 78.228 1.00 60.64 ? 207 LYS C CD 1 ATOM 6583 C CE . LYS D 2 212 ? 26.755 -26.150 78.267 1.00 61.38 ? 207 LYS C CE 1 ATOM 6584 N NZ . LYS D 2 212 ? 27.758 -25.194 78.804 1.00 62.48 ? 207 LYS C NZ 1 ATOM 6585 N N . SER D 2 213 ? 27.827 -32.005 78.458 1.00 61.26 ? 208 SER C N 1 ATOM 6586 C CA . SER D 2 213 ? 27.500 -33.408 78.324 1.00 61.86 ? 208 SER C CA 1 ATOM 6587 C C . SER D 2 213 ? 26.028 -33.675 78.506 1.00 63.01 ? 208 SER C C 1 ATOM 6588 O O . SER D 2 213 ? 25.268 -32.798 78.910 1.00 64.27 ? 208 SER C O 1 ATOM 6589 C CB . SER D 2 213 ? 28.283 -34.228 79.349 1.00 64.53 ? 208 SER C CB 1 ATOM 6590 O OG . SER D 2 213 ? 27.845 -33.938 80.656 1.00 67.52 ? 208 SER C OG 1 ATOM 6591 N N . PHE D 2 214 ? 25.643 -34.907 78.206 1.00 63.47 ? 209 PHE C N 1 ATOM 6592 C CA . PHE D 2 214 ? 24.305 -35.385 78.486 1.00 65.51 ? 209 PHE C CA 1 ATOM 6593 C C . PHE D 2 214 ? 24.394 -36.874 78.754 1.00 67.46 ? 209 PHE C C 1 ATOM 6594 O O . PHE D 2 214 ? 25.324 -37.533 78.286 1.00 66.81 ? 209 PHE C O 1 ATOM 6595 C CB . PHE D 2 214 ? 23.377 -35.117 77.301 1.00 63.22 ? 209 PHE C CB 1 ATOM 6596 C CG . PHE D 2 214 ? 23.726 -35.902 76.072 1.00 60.90 ? 209 PHE C CG 1 ATOM 6597 C CD1 . PHE D 2 214 ? 24.637 -35.414 75.161 1.00 58.49 ? 209 PHE C CD1 1 ATOM 6598 C CD2 . PHE D 2 214 ? 23.141 -37.136 75.831 1.00 61.59 ? 209 PHE C CD2 1 ATOM 6599 C CE1 . PHE D 2 214 ? 24.966 -36.139 74.032 1.00 57.17 ? 209 PHE C CE1 1 ATOM 6600 C CE2 . PHE D 2 214 ? 23.459 -37.867 74.701 1.00 59.99 ? 209 PHE C CE2 1 ATOM 6601 C CZ . PHE D 2 214 ? 24.376 -37.373 73.803 1.00 57.94 ? 209 PHE C CZ 1 ATOM 6602 N N . ASN D 2 215 ? 23.418 -37.393 79.491 1.00 70.68 ? 210 ASN C N 1 ATOM 6603 C CA . ASN D 2 215 ? 23.292 -38.838 79.716 1.00 72.75 ? 210 ASN C CA 1 ATOM 6604 C C . ASN D 2 215 ? 22.174 -39.373 78.829 1.00 72.23 ? 210 ASN C C 1 ATOM 6605 O O . ASN D 2 215 ? 21.037 -38.910 78.940 1.00 73.29 ? 210 ASN C O 1 ATOM 6606 C CB . ASN D 2 215 ? 22.985 -39.194 81.173 1.00 76.89 ? 210 ASN C CB 1 ATOM 6607 C CG . ASN D 2 215 ? 24.210 -39.618 81.963 1.00 78.94 ? 210 ASN C CG 1 ATOM 6608 O OD1 . ASN D 2 215 ? 25.290 -39.082 81.782 1.00 78.11 ? 210 ASN C OD1 1 ATOM 6609 N ND2 . ASN D 2 215 ? 24.024 -40.556 82.890 1.00 82.73 ? 210 ASN C ND2 1 ATOM 6610 N N . ARG D 2 216 ? 22.499 -40.346 77.971 1.00 71.56 ? 211 ARG C N 1 ATOM 6611 C CA . ARG D 2 216 ? 21.544 -40.928 77.022 1.00 71.03 ? 211 ARG C CA 1 ATOM 6612 C C . ARG D 2 216 ? 20.240 -41.348 77.744 1.00 74.43 ? 211 ARG C C 1 ATOM 6613 O O . ARG D 2 216 ? 19.127 -41.079 77.281 1.00 74.88 ? 211 ARG C O 1 ATOM 6614 C CB . ARG D 2 216 ? 22.208 -42.120 76.306 1.00 70.13 ? 211 ARG C CB 1 ATOM 6615 C CG . ARG D 2 216 ? 21.491 -42.597 75.058 1.00 68.79 ? 211 ARG C CG 1 ATOM 6616 C CD . ARG D 2 216 ? 22.138 -43.832 74.456 1.00 69.07 ? 211 ARG C CD 1 ATOM 6617 N NE . ARG D 2 216 ? 21.395 -45.041 74.814 1.00 71.55 ? 211 ARG C NE 1 ATOM 6618 C CZ . ARG D 2 216 ? 21.673 -45.849 75.833 1.00 74.09 ? 211 ARG C CZ 1 ATOM 6619 N NH1 . ARG D 2 216 ? 22.700 -45.624 76.643 1.00 74.66 ? 211 ARG C NH1 1 ATOM 6620 N NH2 . ARG D 2 216 ? 20.910 -46.910 76.041 1.00 76.95 ? 211 ARG C NH2 1 ATOM 6621 N N . ASN D 2 217 ? 20.408 -41.979 78.899 1.00 77.77 ? 212 ASN C N 1 ATOM 6622 C CA . ASN D 2 217 ? 19.313 -42.455 79.758 1.00 81.51 ? 212 ASN C CA 1 ATOM 6623 C C . ASN D 2 217 ? 18.419 -41.408 80.455 1.00 83.45 ? 212 ASN C C 1 ATOM 6624 O O . ASN D 2 217 ? 17.503 -41.791 81.199 1.00 86.90 ? 212 ASN C O 1 ATOM 6625 C CB . ASN D 2 217 ? 19.882 -43.384 80.848 1.00 84.98 ? 212 ASN C CB 1 ATOM 6626 C CG . ASN D 2 217 ? 21.024 -42.742 81.623 1.00 85.61 ? 212 ASN C CG 1 ATOM 6627 O OD1 . ASN D 2 217 ? 22.132 -42.576 81.094 1.00 84.27 ? 212 ASN C OD1 1 ATOM 6628 N ND2 . ASN D 2 217 ? 20.760 -42.357 82.867 1.00 88.80 ? 212 ASN C ND2 1 ATOM 6629 N N . GLU D 2 218 ? 18.678 -40.116 80.262 1.00 81.34 ? 213 GLU C N 1 ATOM 6630 C CA . GLU D 2 218 ? 17.785 -39.080 80.788 1.00 82.99 ? 213 GLU C CA 1 ATOM 6631 C C . GLU D 2 218 ? 17.126 -38.266 79.667 1.00 80.91 ? 213 GLU C C 1 ATOM 6632 O O . GLU D 2 218 ? 16.372 -37.334 79.944 1.00 82.08 ? 213 GLU C O 1 ATOM 6633 C CB . GLU D 2 218 ? 18.534 -38.155 81.748 1.00 83.99 ? 213 GLU C CB 1 ATOM 6634 C CG . GLU D 2 218 ? 19.617 -38.848 82.562 1.00 85.41 ? 213 GLU C CG 1 ATOM 6635 C CD . GLU D 2 218 ? 20.246 -37.936 83.615 1.00 87.69 ? 213 GLU C CD 1 ATOM 6636 O OE1 . GLU D 2 218 ? 20.518 -38.420 84.744 1.00 91.40 ? 213 GLU C OE1 1 ATOM 6637 O OE2 . GLU D 2 218 ? 20.486 -36.734 83.313 1.00 86.29 ? 213 GLU C OE2 1 ATOM 6638 N N . CYS D 2 219 ? 17.411 -38.628 78.412 1.00 78.38 ? 214 CYS C N 1 ATOM 6639 C CA . CYS D 2 219 ? 16.854 -37.961 77.237 1.00 76.62 ? 214 CYS C CA 1 ATOM 6640 C C . CYS D 2 219 ? 15.616 -38.732 76.789 1.00 77.96 ? 214 CYS C C 1 ATOM 6641 O O . CYS D 2 219 ? 15.010 -39.456 77.584 1.00 80.74 ? 214 CYS C O 1 ATOM 6642 C CB . CYS D 2 219 ? 17.892 -37.883 76.105 1.00 73.04 ? 214 CYS C CB 1 ATOM 6643 S SG . CYS D 2 219 ? 19.241 -36.714 76.390 1.00 71.42 ? 214 CYS C SG 1 ATOM 6644 N N . ASP E 2 1 ? -10.739 -34.548 50.624 1.00 83.60 ? 1 ASP F N 1 ATOM 6645 C CA . ASP E 2 1 ? -11.324 -34.622 49.259 1.00 78.07 ? 1 ASP F CA 1 ATOM 6646 C C . ASP E 2 1 ? -11.335 -36.061 48.777 1.00 75.05 ? 1 ASP F C 1 ATOM 6647 O O . ASP E 2 1 ? -10.603 -36.899 49.293 1.00 77.02 ? 1 ASP F O 1 ATOM 6648 C CB . ASP E 2 1 ? -10.522 -33.780 48.254 1.00 77.17 ? 1 ASP F CB 1 ATOM 6649 C CG . ASP E 2 1 ? -10.408 -32.313 48.644 1.00 80.51 ? 1 ASP F CG 1 ATOM 6650 O OD1 . ASP E 2 1 ? -10.430 -31.997 49.855 1.00 84.27 ? 1 ASP F OD1 1 ATOM 6651 O OD2 . ASP E 2 1 ? -10.251 -31.479 47.717 1.00 79.36 ? 1 ASP F OD2 1 ATOM 6652 N N . ILE E 2 2 ? -12.186 -36.338 47.794 1.00 70.86 ? 2 ILE F N 1 ATOM 6653 C CA . ILE E 2 2 ? -12.191 -37.626 47.093 1.00 67.70 ? 2 ILE F CA 1 ATOM 6654 C C . ILE E 2 2 ? -11.223 -37.639 45.934 1.00 64.61 ? 2 ILE F C 1 ATOM 6655 O O . ILE E 2 2 ? -11.375 -36.895 44.968 1.00 61.19 ? 2 ILE F O 1 ATOM 6656 C CB . ILE E 2 2 ? -13.586 -37.968 46.562 1.00 65.34 ? 2 ILE F CB 1 ATOM 6657 C CG1 . ILE E 2 2 ? -14.516 -38.180 47.738 1.00 68.15 ? 2 ILE F CG1 1 ATOM 6658 C CG2 . ILE E 2 2 ? -13.574 -39.212 45.679 1.00 62.77 ? 2 ILE F CG2 1 ATOM 6659 C CD1 . ILE E 2 2 ? -15.094 -36.897 48.284 1.00 70.30 ? 2 ILE F CD1 1 ATOM 6660 N N . LEU E 2 3 ? -10.223 -38.502 46.060 1.00 65.79 ? 3 LEU F N 1 ATOM 6661 C CA . LEU E 2 3 ? -9.200 -38.652 45.046 1.00 64.03 ? 3 LEU F CA 1 ATOM 6662 C C . LEU E 2 3 ? -9.665 -39.588 43.970 1.00 59.86 ? 3 LEU F C 1 ATOM 6663 O O . LEU E 2 3 ? -9.977 -40.740 44.240 1.00 59.73 ? 3 LEU F O 1 ATOM 6664 C CB . LEU E 2 3 ? -7.930 -39.237 45.666 1.00 68.16 ? 3 LEU F CB 1 ATOM 6665 C CG . LEU E 2 3 ? -6.705 -39.531 44.794 1.00 68.01 ? 3 LEU F CG 1 ATOM 6666 C CD1 . LEU E 2 3 ? -6.299 -38.308 43.979 1.00 66.70 ? 3 LEU F CD1 1 ATOM 6667 C CD2 . LEU E 2 3 ? -5.533 -40.052 45.612 1.00 72.13 ? 3 LEU F CD2 1 ATOM 6668 N N . MET E 2 4 ? -9.645 -39.101 42.736 1.00 57.02 ? 4 MET F N 1 ATOM 6669 C CA . MET E 2 4 ? -10.031 -39.895 41.586 1.00 53.30 ? 4 MET F CA 1 ATOM 6670 C C . MET E 2 4 ? -8.757 -40.278 40.898 1.00 53.22 ? 4 MET F C 1 ATOM 6671 O O . MET E 2 4 ? -8.067 -39.396 40.372 1.00 53.29 ? 4 MET F O 1 ATOM 6672 C CB . MET E 2 4 ? -10.865 -39.051 40.642 1.00 50.59 ? 4 MET F CB 1 ATOM 6673 C CG . MET E 2 4 ? -12.093 -38.463 41.293 1.00 51.13 ? 4 MET F CG 1 ATOM 6674 S SD . MET E 2 4 ? -13.287 -39.761 41.666 1.00 50.92 ? 4 MET F SD 1 ATOM 6675 C CE . MET E 2 4 ? -14.033 -39.941 40.057 1.00 47.42 ? 4 MET F CE 1 ATOM 6676 N N . ASN E 2 5 ? -8.393 -41.558 40.889 1.00 53.65 ? 5 ASN F N 1 ATOM 6677 C CA . ASN E 2 5 ? -7.209 -41.824 40.105 1.00 53.50 ? 5 ASN F CA 1 ATOM 6678 C C . ASN E 2 5 ? -7.500 -42.662 38.894 1.00 49.96 ? 5 ASN F C 1 ATOM 6679 O O . ASN E 2 5 ? -8.119 -43.722 38.930 1.00 49.49 ? 5 ASN F O 1 ATOM 6680 C CB . ASN E 2 5 ? -5.960 -42.295 40.854 1.00 57.96 ? 5 ASN F CB 1 ATOM 6681 C CG . ASN E 2 5 ? -6.244 -43.387 41.800 1.00 61.25 ? 5 ASN F CG 1 ATOM 6682 O OD1 . ASN E 2 5 ? -6.199 -44.557 41.422 1.00 62.92 ? 5 ASN F OD1 1 ATOM 6683 N ND2 . ASN E 2 5 ? -6.549 -43.029 43.039 1.00 63.63 ? 5 ASN F ND2 1 ATOM 6684 N N . GLN E 2 6 ? -6.976 -42.143 37.818 1.00 47.64 ? 6 GLN F N 1 ATOM 6685 C CA . GLN E 2 6 ? -7.238 -42.600 36.490 1.00 44.88 ? 6 GLN F CA 1 ATOM 6686 C C . GLN E 2 6 ? -6.043 -43.399 36.007 1.00 45.63 ? 6 GLN F C 1 ATOM 6687 O O . GLN E 2 6 ? -4.917 -43.001 36.202 1.00 47.46 ? 6 GLN F O 1 ATOM 6688 C CB . GLN E 2 6 ? -7.429 -41.381 35.604 1.00 42.82 ? 6 GLN F CB 1 ATOM 6689 C CG . GLN E 2 6 ? -8.644 -41.453 34.732 1.00 40.39 ? 6 GLN F CG 1 ATOM 6690 C CD . GLN E 2 6 ? -8.887 -40.145 34.039 1.00 39.18 ? 6 GLN F CD 1 ATOM 6691 O OE1 . GLN E 2 6 ? -9.124 -39.123 34.689 1.00 39.48 ? 6 GLN F OE1 1 ATOM 6692 N NE2 . GLN E 2 6 ? -8.814 -40.157 32.709 1.00 38.10 ? 6 GLN F NE2 1 ATOM 6693 N N . THR E 2 7 ? -6.285 -44.525 35.361 1.00 44.91 ? 7 THR F N 1 ATOM 6694 C CA . THR E 2 7 ? -5.205 -45.302 34.778 1.00 45.70 ? 7 THR F CA 1 ATOM 6695 C C . THR E 2 7 ? -5.682 -45.867 33.447 1.00 43.68 ? 7 THR F C 1 ATOM 6696 O O . THR E 2 7 ? -6.874 -46.129 33.283 1.00 42.37 ? 7 THR F O 1 ATOM 6697 C CB . THR E 2 7 ? -4.728 -46.453 35.692 1.00 49.02 ? 7 THR F CB 1 ATOM 6698 O OG1 . THR E 2 7 ? -5.824 -47.299 36.065 1.00 49.00 ? 7 THR F OG1 1 ATOM 6699 C CG2 . THR E 2 7 ? -4.064 -45.913 36.947 1.00 51.70 ? 7 THR F CG2 1 ATOM 6700 N N . PRO E 2 8 ? -4.766 -46.011 32.472 1.00 43.69 ? 8 PRO F N 1 ATOM 6701 C CA . PRO E 2 8 ? -3.374 -45.558 32.531 1.00 45.03 ? 8 PRO F CA 1 ATOM 6702 C C . PRO E 2 8 ? -3.258 -44.040 32.350 1.00 43.83 ? 8 PRO F C 1 ATOM 6703 O O . PRO E 2 8 ? -4.262 -43.368 32.115 1.00 41.87 ? 8 PRO F O 1 ATOM 6704 C CB . PRO E 2 8 ? -2.725 -46.295 31.364 1.00 45.23 ? 8 PRO F CB 1 ATOM 6705 C CG . PRO E 2 8 ? -3.832 -46.450 30.377 1.00 43.02 ? 8 PRO F CG 1 ATOM 6706 C CD . PRO E 2 8 ? -5.071 -46.675 31.192 1.00 42.45 ? 8 PRO F CD 1 ATOM 6707 N N . LEU E 2 9 ? -2.046 -43.511 32.487 1.00 45.50 ? 9 LEU F N 1 ATOM 6708 C CA . LEU E 2 9 ? -1.787 -42.080 32.284 1.00 45.10 ? 9 LEU F CA 1 ATOM 6709 C C . LEU E 2 9 ? -1.758 -41.753 30.786 1.00 42.84 ? 9 LEU F C 1 ATOM 6710 O O . LEU E 2 9 ? -2.219 -40.695 30.361 1.00 41.22 ? 9 LEU F O 1 ATOM 6711 C CB . LEU E 2 9 ? -0.457 -41.688 32.930 1.00 48.31 ? 9 LEU F CB 1 ATOM 6712 C CG . LEU E 2 9 ? -0.224 -40.201 33.315 1.00 49.64 ? 9 LEU F CG 1 ATOM 6713 C CD1 . LEU E 2 9 ? 0.837 -40.016 34.414 1.00 53.22 ? 9 LEU F CD1 1 ATOM 6714 C CD2 . LEU E 2 9 ? 0.173 -39.359 32.100 1.00 48.93 ? 9 LEU F CD2 1 ATOM 6715 N N . SER E 2 10 ? -1.175 -42.658 30.004 1.00 42.91 ? 10 SER F N 1 ATOM 6716 C CA . SER E 2 10 ? -1.281 -42.617 28.556 1.00 41.42 ? 10 SER F CA 1 ATOM 6717 C C . SER E 2 10 ? -1.605 -43.999 28.013 1.00 40.91 ? 10 SER F C 1 ATOM 6718 O O . SER E 2 10 ? -1.233 -45.030 28.584 1.00 42.23 ? 10 SER F O 1 ATOM 6719 C CB . SER E 2 10 ? -0.013 -42.074 27.908 1.00 42.86 ? 10 SER F CB 1 ATOM 6720 O OG . SER E 2 10 ? 1.124 -42.821 28.278 1.00 45.49 ? 10 SER F OG 1 ATOM 6721 N N . LEU E 2 11 ? -2.353 -44.002 26.922 1.00 38.93 ? 11 LEU F N 1 ATOM 6722 C CA . LEU E 2 11 ? -2.772 -45.234 26.313 1.00 38.89 ? 11 LEU F CA 1 ATOM 6723 C C . LEU E 2 11 ? -2.515 -45.184 24.813 1.00 38.77 ? 11 LEU F C 1 ATOM 6724 O O . LEU E 2 11 ? -3.333 -44.648 24.057 1.00 37.77 ? 11 LEU F O 1 ATOM 6725 C CB . LEU E 2 11 ? -4.249 -45.485 26.604 1.00 37.44 ? 11 LEU F CB 1 ATOM 6726 C CG . LEU E 2 11 ? -4.848 -46.780 26.039 1.00 37.81 ? 11 LEU F CG 1 ATOM 6727 C CD1 . LEU E 2 11 ? -4.051 -48.027 26.420 1.00 40.21 ? 11 LEU F CD1 1 ATOM 6728 C CD2 . LEU E 2 11 ? -6.277 -46.895 26.512 1.00 36.64 ? 11 LEU F CD2 1 ATOM 6729 N N . PRO E 2 12 ? -1.372 -45.734 24.379 1.00 40.33 ? 12 PRO F N 1 ATOM 6730 C CA . PRO E 2 12 ? -1.097 -45.881 22.953 1.00 40.64 ? 12 PRO F CA 1 ATOM 6731 C C . PRO E 2 12 ? -2.051 -46.885 22.303 1.00 40.48 ? 12 PRO F C 1 ATOM 6732 O O . PRO E 2 12 ? -2.208 -47.993 22.807 1.00 41.71 ? 12 PRO F O 1 ATOM 6733 C CB . PRO E 2 12 ? 0.338 -46.423 22.924 1.00 43.07 ? 12 PRO F CB 1 ATOM 6734 C CG . PRO E 2 12 ? 0.916 -46.103 24.255 1.00 43.68 ? 12 PRO F CG 1 ATOM 6735 C CD . PRO E 2 12 ? -0.221 -46.113 25.218 1.00 42.31 ? 12 PRO F CD 1 ATOM 6736 N N . VAL E 2 13 ? -2.711 -46.486 21.224 1.00 39.33 ? 13 VAL F N 1 ATOM 6737 C CA . VAL E 2 13 ? -3.554 -47.411 20.470 1.00 39.50 ? 13 VAL F CA 1 ATOM 6738 C C . VAL E 2 13 ? -3.361 -47.251 18.974 1.00 40.14 ? 13 VAL F C 1 ATOM 6739 O O . VAL E 2 13 ? -2.957 -46.180 18.501 1.00 39.63 ? 13 VAL F O 1 ATOM 6740 C CB . VAL E 2 13 ? -5.047 -47.224 20.783 1.00 38.03 ? 13 VAL F CB 1 ATOM 6741 C CG1 . VAL E 2 13 ? -5.369 -47.715 22.182 1.00 37.73 ? 13 VAL F CG1 1 ATOM 6742 C CG2 . VAL E 2 13 ? -5.466 -45.773 20.622 1.00 36.53 ? 13 VAL F CG2 1 ATOM 6743 N N . SER E 2 14 ? -3.617 -48.336 18.244 1.00 41.48 ? 14 SER F N 1 ATOM 6744 C CA . SER E 2 14 ? -3.727 -48.289 16.789 1.00 42.40 ? 14 SER F CA 1 ATOM 6745 C C . SER E 2 14 ? -5.183 -48.025 16.479 1.00 41.44 ? 14 SER F C 1 ATOM 6746 O O . SER E 2 14 ? -6.066 -48.340 17.287 1.00 40.27 ? 14 SER F O 1 ATOM 6747 C CB . SER E 2 14 ? -3.312 -49.621 16.163 1.00 45.11 ? 14 SER F CB 1 ATOM 6748 O OG . SER E 2 14 ? -1.978 -49.960 16.493 1.00 46.57 ? 14 SER F OG 1 ATOM 6749 N N . LEU E 2 15 ? -5.452 -47.471 15.307 1.00 42.10 ? 15 LEU F N 1 ATOM 6750 C CA . LEU E 2 15 ? -6.829 -47.298 14.869 1.00 41.99 ? 15 LEU F CA 1 ATOM 6751 C C . LEU E 2 15 ? -7.473 -48.668 14.707 1.00 43.57 ? 15 LEU F C 1 ATOM 6752 O O . LEU E 2 15 ? -6.828 -49.600 14.226 1.00 45.60 ? 15 LEU F O 1 ATOM 6753 C CB . LEU E 2 15 ? -6.897 -46.527 13.560 1.00 43.22 ? 15 LEU F CB 1 ATOM 6754 C CG . LEU E 2 15 ? -6.298 -45.119 13.598 1.00 42.36 ? 15 LEU F CG 1 ATOM 6755 C CD1 . LEU E 2 15 ? -6.392 -44.452 12.236 1.00 44.44 ? 15 LEU F CD1 1 ATOM 6756 C CD2 . LEU E 2 15 ? -6.982 -44.265 14.647 1.00 40.07 ? 15 LEU F CD2 1 ATOM 6757 N N . GLY E 2 16 ? -8.727 -48.787 15.144 1.00 42.90 ? 16 GLY F N 1 ATOM 6758 C CA . GLY E 2 16 ? -9.407 -50.070 15.158 1.00 44.64 ? 16 GLY F CA 1 ATOM 6759 C C . GLY E 2 16 ? -9.343 -50.794 16.493 1.00 44.26 ? 16 GLY F C 1 ATOM 6760 O O . GLY E 2 16 ? -10.126 -51.690 16.731 1.00 45.28 ? 16 GLY F O 1 ATOM 6761 N N . ASP E 2 17 ? -8.413 -50.424 17.367 1.00 43.30 ? 17 ASP F N 1 ATOM 6762 C CA . ASP E 2 17 ? -8.252 -51.107 18.657 1.00 43.61 ? 17 ASP F CA 1 ATOM 6763 C C . ASP E 2 17 ? -9.376 -50.768 19.632 1.00 41.98 ? 17 ASP F C 1 ATOM 6764 O O . ASP E 2 17 ? -9.934 -49.674 19.604 1.00 39.64 ? 17 ASP F O 1 ATOM 6765 C CB . ASP E 2 17 ? -6.940 -50.698 19.358 1.00 43.26 ? 17 ASP F CB 1 ATOM 6766 C CG . ASP E 2 17 ? -5.679 -51.219 18.673 1.00 45.74 ? 17 ASP F CG 1 ATOM 6767 O OD1 . ASP E 2 17 ? -5.774 -51.989 17.703 1.00 48.14 ? 17 ASP F OD1 1 ATOM 6768 O OD2 . ASP E 2 17 ? -4.568 -50.826 19.114 1.00 45.91 ? 17 ASP F OD2 1 ATOM 6769 N N . GLN E 2 18 ? -9.664 -51.703 20.532 1.00 43.55 ? 18 GLN F N 1 ATOM 6770 C CA . GLN E 2 18 ? -10.486 -51.416 21.700 1.00 42.64 ? 18 GLN F CA 1 ATOM 6771 C C . GLN E 2 18 ? -9.629 -50.539 22.609 1.00 41.00 ? 18 GLN F C 1 ATOM 6772 O O . GLN E 2 18 ? -8.405 -50.520 22.495 1.00 41.73 ? 18 GLN F O 1 ATOM 6773 C CB . GLN E 2 18 ? -10.918 -52.713 22.430 1.00 45.35 ? 18 GLN F CB 1 ATOM 6774 C CG . GLN E 2 18 ? -11.990 -52.519 23.540 1.00 45.12 ? 18 GLN F CG 1 ATOM 6775 C CD . GLN E 2 18 ? -11.529 -52.713 24.986 1.00 46.09 ? 18 GLN F CD 1 ATOM 6776 O OE1 . GLN E 2 18 ? -12.302 -53.186 25.814 1.00 47.97 ? 18 GLN F OE1 1 ATOM 6777 N NE2 . GLN E 2 18 ? -10.318 -52.282 25.311 1.00 46.08 ? 18 GLN F NE2 1 ATOM 6778 N N . ALA E 2 19 ? -10.270 -49.776 23.478 1.00 38.84 ? 19 ALA F N 1 ATOM 6779 C CA . ALA E 2 19 ? -9.541 -49.035 24.495 1.00 37.58 ? 19 ALA F CA 1 ATOM 6780 C C . ALA E 2 19 ? -10.338 -49.012 25.782 1.00 37.08 ? 19 ALA F C 1 ATOM 6781 O O . ALA E 2 19 ? -11.567 -48.897 25.758 1.00 36.42 ? 19 ALA F O 1 ATOM 6782 C CB . ALA E 2 19 ? -9.268 -47.629 24.026 1.00 35.95 ? 19 ALA F CB 1 ATOM 6783 N N . SER E 2 20 ? -9.637 -49.133 26.905 1.00 37.69 ? 20 SER F N 1 ATOM 6784 C CA . SER E 2 20 ? -10.275 -49.213 28.213 1.00 37.73 ? 20 SER F CA 1 ATOM 6785 C C . SER E 2 20 ? -9.570 -48.292 29.209 1.00 37.10 ? 20 SER F C 1 ATOM 6786 O O . SER E 2 20 ? -8.366 -48.405 29.439 1.00 38.31 ? 20 SER F O 1 ATOM 6787 C CB . SER E 2 20 ? -10.261 -50.667 28.685 1.00 40.39 ? 20 SER F CB 1 ATOM 6788 O OG . SER E 2 20 ? -11.399 -50.969 29.454 1.00 40.99 ? 20 SER F OG 1 ATOM 6789 N N . ILE E 2 21 ? -10.323 -47.361 29.776 1.00 35.70 ? 21 ILE F N 1 ATOM 6790 C CA . ILE E 2 21 ? -9.775 -46.383 30.700 1.00 35.73 ? 21 ILE F CA 1 ATOM 6791 C C . ILE E 2 21 ? -10.462 -46.584 32.022 1.00 36.94 ? 21 ILE F C 1 ATOM 6792 O O . ILE E 2 21 ? -11.684 -46.640 32.074 1.00 36.15 ? 21 ILE F O 1 ATOM 6793 C CB . ILE E 2 21 ? -10.046 -44.948 30.228 1.00 33.79 ? 21 ILE F CB 1 ATOM 6794 C CG1 . ILE E 2 21 ? -9.318 -44.691 28.908 1.00 33.49 ? 21 ILE F CG1 1 ATOM 6795 C CG2 . ILE E 2 21 ? -9.606 -43.943 31.277 1.00 34.43 ? 21 ILE F CG2 1 ATOM 6796 C CD1 . ILE E 2 21 ? -9.628 -43.353 28.268 1.00 32.19 ? 21 ILE F CD1 1 ATOM 6797 N N . SER E 2 22 ? -9.685 -46.649 33.089 1.00 39.43 ? 22 SER F N 1 ATOM 6798 C CA . SER E 2 22 ? -10.214 -46.935 34.416 1.00 41.62 ? 22 SER F CA 1 ATOM 6799 C C . SER E 2 22 ? -10.131 -45.715 35.350 1.00 42.75 ? 22 SER F C 1 ATOM 6800 O O . SER E 2 22 ? -9.148 -44.953 35.339 1.00 43.05 ? 22 SER F O 1 ATOM 6801 C CB . SER E 2 22 ? -9.447 -48.091 35.039 1.00 44.49 ? 22 SER F CB 1 ATOM 6802 O OG . SER E 2 22 ? -9.485 -47.994 36.449 1.00 46.85 ? 22 SER F OG 1 ATOM 6803 N N . CYS E 2 23 ? -11.146 -45.573 36.193 1.00 43.94 ? 23 CYS F N 1 ATOM 6804 C CA . CYS E 2 23 ? -11.196 -44.486 37.150 1.00 45.36 ? 23 CYS F CA 1 ATOM 6805 C C . CYS E 2 23 ? -11.622 -45.004 38.512 1.00 47.35 ? 23 CYS F C 1 ATOM 6806 O O . CYS E 2 23 ? -12.719 -45.533 38.655 1.00 47.04 ? 23 CYS F O 1 ATOM 6807 C CB . CYS E 2 23 ? -12.184 -43.429 36.677 1.00 44.23 ? 23 CYS F CB 1 ATOM 6808 S SG . CYS E 2 23 ? -12.418 -42.073 37.854 1.00 47.29 ? 23 CYS F SG 1 ATOM 6809 N N . ARG E 2 24 ? -10.770 -44.813 39.512 1.00 49.53 ? 24 ARG F N 1 ATOM 6810 C CA . ARG E 2 24 ? -11.042 -45.268 40.861 1.00 52.31 ? 24 ARG F CA 1 ATOM 6811 C C . ARG E 2 24 ? -11.188 -44.076 41.811 1.00 52.74 ? 24 ARG F C 1 ATOM 6812 O O . ARG E 2 24 ? -10.361 -43.166 41.801 1.00 52.51 ? 24 ARG F O 1 ATOM 6813 C CB . ARG E 2 24 ? -9.905 -46.179 41.327 1.00 56.48 ? 24 ARG F CB 1 ATOM 6814 C CG . ARG E 2 24 ? -10.052 -47.639 40.901 1.00 57.78 ? 24 ARG F CG 1 ATOM 6815 C CD . ARG E 2 24 ? -9.716 -48.637 42.001 1.00 63.02 ? 24 ARG F CD 1 ATOM 6816 N NE . ARG E 2 24 ? -10.138 -49.986 41.633 1.00 64.32 ? 24 ARG F NE 1 ATOM 6817 C CZ . ARG E 2 24 ? -9.926 -51.058 42.400 1.00 68.56 ? 24 ARG F CZ 1 ATOM 6818 N NH1 . ARG E 2 24 ? -9.290 -50.932 43.562 1.00 72.22 ? 24 ARG F NH1 1 ATOM 6819 N NH2 . ARG E 2 24 ? -10.335 -52.262 42.009 1.00 69.69 ? 24 ARG F NH2 1 ATOM 6820 N N . SER E 2 25 ? -12.249 -44.086 42.619 1.00 53.26 ? 25 SER F N 1 ATOM 6821 C CA . SER E 2 25 ? -12.461 -43.089 43.672 1.00 54.65 ? 25 SER F CA 1 ATOM 6822 C C . SER E 2 25 ? -12.051 -43.623 45.044 1.00 58.47 ? 25 SER F C 1 ATOM 6823 O O . SER E 2 25 ? -12.095 -44.822 45.300 1.00 59.80 ? 25 SER F O 1 ATOM 6824 C CB . SER E 2 25 ? -13.926 -42.669 43.702 1.00 53.12 ? 25 SER F CB 1 ATOM 6825 O OG . SER E 2 25 ? -14.770 -43.791 43.830 1.00 53.70 ? 25 SER F OG 1 ATOM 6826 N N . SER E 2 26 ? -11.647 -42.712 45.922 1.00 60.57 ? 26 SER F N 1 ATOM 6827 C CA . SER E 2 26 ? -11.191 -43.064 47.251 1.00 65.07 ? 26 SER F CA 1 ATOM 6828 C C . SER E 2 26 ? -12.355 -43.393 48.179 1.00 66.05 ? 26 SER F C 1 ATOM 6829 O O . SER E 2 26 ? -12.148 -43.978 49.239 1.00 69.76 ? 26 SER F O 1 ATOM 6830 C CB . SER E 2 26 ? -10.350 -41.920 47.820 1.00 67.65 ? 26 SER F CB 1 ATOM 6831 O OG . SER E 2 26 ? -11.059 -40.703 47.648 1.00 66.14 ? 26 SER F OG 1 ATOM 6832 N N . GLN E 2 27 ? -13.569 -43.034 47.769 1.00 62.72 ? 27 GLN F N 1 ATOM 6833 C CA . GLN E 2 27 ? -14.787 -43.400 48.520 1.00 63.57 ? 27 GLN F CA 1 ATOM 6834 C C . GLN E 2 27 ? -15.951 -43.617 47.583 1.00 59.01 ? 27 GLN F C 1 ATOM 6835 O O . GLN E 2 27 ? -15.928 -43.154 46.440 1.00 55.40 ? 27 GLN F O 1 ATOM 6836 C CB . GLN E 2 27 ? -15.178 -42.382 49.601 1.00 66.46 ? 27 GLN F CB 1 ATOM 6837 C CG . GLN E 2 27 ? -14.945 -40.927 49.270 1.00 65.44 ? 27 GLN F CG 1 ATOM 6838 C CD . GLN E 2 27 ? -15.271 -40.005 50.443 1.00 68.94 ? 27 GLN F CD 1 ATOM 6839 O OE1 . GLN E 2 27 ? -14.373 -39.354 51.009 1.00 71.85 ? 27 GLN F OE1 1 ATOM 6840 N NE2 . GLN E 2 27 ? -16.546 -39.956 50.829 1.00 68.95 ? 27 GLN F NE2 1 ATOM 6841 N N . TYR E 2 28 A -16.954 -44.335 48.084 1.00 59.37 ? 27 TYR F N 1 ATOM 6842 C CA . TYR E 2 28 A -18.137 -44.704 47.314 1.00 55.84 ? 27 TYR F CA 1 ATOM 6843 C C . TYR E 2 28 A -18.804 -43.452 46.741 1.00 52.61 ? 27 TYR F C 1 ATOM 6844 O O . TYR E 2 28 A -19.044 -42.471 47.453 1.00 53.60 ? 27 TYR F O 1 ATOM 6845 C CB . TYR E 2 28 A -19.116 -45.505 48.208 1.00 58.20 ? 27 TYR F CB 1 ATOM 6846 C CG . TYR E 2 28 A -20.086 -46.384 47.442 1.00 56.08 ? 27 TYR F CG 1 ATOM 6847 C CD1 . TYR E 2 28 A -21.176 -45.831 46.771 1.00 53.19 ? 27 TYR F CD1 1 ATOM 6848 C CD2 . TYR E 2 28 A -19.913 -47.770 47.386 1.00 57.55 ? 27 TYR F CD2 1 ATOM 6849 C CE1 . TYR E 2 28 A -22.074 -46.624 46.062 1.00 51.71 ? 27 TYR F CE1 1 ATOM 6850 C CE2 . TYR E 2 28 A -20.805 -48.574 46.696 1.00 56.35 ? 27 TYR F CE2 1 ATOM 6851 C CZ . TYR E 2 28 A -21.878 -48.002 46.031 1.00 53.31 ? 27 TYR F CZ 1 ATOM 6852 O OH . TYR E 2 28 A -22.718 -48.824 45.345 1.00 52.24 ? 27 TYR F OH 1 ATOM 6853 N N . ILE E 2 29 B -19.075 -43.485 45.443 1.00 48.90 ? 27 ILE F N 1 ATOM 6854 C CA . ILE E 2 29 B -19.820 -42.417 44.784 1.00 46.42 ? 27 ILE F CA 1 ATOM 6855 C C . ILE E 2 29 B -21.311 -42.675 45.032 1.00 46.52 ? 27 ILE F C 1 ATOM 6856 O O . ILE E 2 29 B -21.897 -43.584 44.435 1.00 45.78 ? 27 ILE F O 1 ATOM 6857 C CB . ILE E 2 29 B -19.476 -42.341 43.275 1.00 43.19 ? 27 ILE F CB 1 ATOM 6858 C CG1 . ILE E 2 29 B -17.962 -42.120 43.079 1.00 43.42 ? 27 ILE F CG1 1 ATOM 6859 C CG2 . ILE E 2 29 B -20.231 -41.213 42.578 1.00 41.11 ? 27 ILE F CG2 1 ATOM 6860 C CD1 . ILE E 2 29 B -17.401 -40.898 43.781 1.00 45.11 ? 27 ILE F CD1 1 ATOM 6861 N N . VAL E 2 30 C -21.899 -41.903 45.946 1.00 48.17 ? 27 VAL F N 1 ATOM 6862 C CA . VAL E 2 30 C -23.296 -42.056 46.365 1.00 48.86 ? 27 VAL F CA 1 ATOM 6863 C C . VAL E 2 30 C -24.237 -41.144 45.581 1.00 46.95 ? 27 VAL F C 1 ATOM 6864 O O . VAL E 2 30 C -23.811 -40.159 44.990 1.00 45.66 ? 27 VAL F O 1 ATOM 6865 C CB . VAL E 2 30 C -23.481 -41.763 47.876 1.00 52.50 ? 27 VAL F CB 1 ATOM 6866 C CG1 . VAL E 2 30 C -22.545 -42.620 48.709 1.00 55.20 ? 27 VAL F CG1 1 ATOM 6867 C CG2 . VAL E 2 30 C -23.288 -40.283 48.199 1.00 53.24 ? 27 VAL F CG2 1 ATOM 6868 N N . HIS E 2 31 D -25.527 -41.466 45.585 1.00 47.35 ? 27 HIS F N 1 ATOM 6869 C CA . HIS E 2 31 D -26.489 -40.695 44.804 1.00 46.00 ? 27 HIS F CA 1 ATOM 6870 C C . HIS E 2 31 D -26.764 -39.345 45.447 1.00 47.67 ? 27 HIS F C 1 ATOM 6871 O O . HIS E 2 31 D -26.594 -39.173 46.670 1.00 50.32 ? 27 HIS F O 1 ATOM 6872 C CB . HIS E 2 31 D -27.818 -41.450 44.669 1.00 46.45 ? 27 HIS F CB 1 ATOM 6873 C CG . HIS E 2 31 D -28.686 -41.362 45.892 1.00 49.41 ? 27 HIS F CG 1 ATOM 6874 N ND1 . HIS E 2 31 D -29.491 -40.275 46.155 1.00 50.42 ? 27 HIS F ND1 1 ATOM 6875 C CD2 . HIS E 2 31 D -28.833 -42.199 46.945 1.00 51.87 ? 27 HIS F CD2 1 ATOM 6876 C CE1 . HIS E 2 31 D -30.106 -40.449 47.309 1.00 53.12 ? 27 HIS F CE1 1 ATOM 6877 N NE2 . HIS E 2 31 D -29.731 -41.614 47.805 1.00 54.08 ? 27 HIS F NE2 1 ATOM 6878 N N . ARG E 2 32 E -27.225 -38.406 44.626 1.00 46.53 ? 27 ARG F N 1 ATOM 6879 C CA . ARG E 2 32 E -27.867 -37.188 45.117 1.00 48.61 ? 27 ARG F CA 1 ATOM 6880 C C . ARG E 2 32 E -29.126 -36.960 44.324 1.00 47.69 ? 27 ARG F C 1 ATOM 6881 O O . ARG E 2 32 E -29.060 -36.690 43.125 1.00 46.28 ? 27 ARG F O 1 ATOM 6882 C CB . ARG E 2 32 E -26.997 -35.961 44.917 1.00 48.99 ? 27 ARG F CB 1 ATOM 6883 C CG . ARG E 2 32 E -25.513 -36.095 45.120 1.00 48.98 ? 27 ARG F CG 1 ATOM 6884 C CD . ARG E 2 32 E -24.881 -36.671 46.368 1.00 51.19 ? 27 ARG F CD 1 ATOM 6885 N NE . ARG E 2 32 E -25.372 -36.104 47.606 1.00 54.52 ? 27 ARG F NE 1 ATOM 6886 C CZ . ARG E 2 32 E -24.659 -35.983 48.720 1.00 57.52 ? 27 ARG F CZ 1 ATOM 6887 N NH1 . ARG E 2 32 E -23.374 -36.326 48.766 1.00 57.72 ? 27 ARG F NH1 1 ATOM 6888 N NH2 . ARG E 2 32 E -25.229 -35.468 49.796 1.00 60.71 ? 27 ARG F NH2 1 ATOM 6889 N N . ASN E 2 33 ? -30.258 -37.026 45.006 1.00 49.44 ? 28 ASN F N 1 ATOM 6890 C CA . ASN E 2 33 ? -31.588 -37.011 44.405 1.00 49.13 ? 28 ASN F CA 1 ATOM 6891 C C . ASN E 2 33 ? -31.778 -38.117 43.401 1.00 46.56 ? 28 ASN F C 1 ATOM 6892 O O . ASN E 2 33 ? -32.444 -37.929 42.399 1.00 45.84 ? 28 ASN F O 1 ATOM 6893 C CB . ASN E 2 33 ? -31.894 -35.660 43.759 1.00 49.75 ? 28 ASN F CB 1 ATOM 6894 C CG . ASN E 2 33 ? -31.831 -34.519 44.740 1.00 52.76 ? 28 ASN F CG 1 ATOM 6895 O OD1 . ASN E 2 33 ? -32.628 -34.443 45.662 1.00 55.50 ? 28 ASN F OD1 1 ATOM 6896 N ND2 . ASN E 2 33 ? -30.887 -33.621 44.544 1.00 53.08 ? 28 ASN F ND2 1 ATOM 6897 N N . GLY E 2 34 ? -31.175 -39.266 43.674 1.00 45.69 ? 29 GLY F N 1 ATOM 6898 C CA . GLY E 2 34 ? -31.402 -40.461 42.885 1.00 44.00 ? 29 GLY F CA 1 ATOM 6899 C C . GLY E 2 34 ? -30.466 -40.604 41.725 1.00 41.40 ? 29 GLY F C 1 ATOM 6900 O O . GLY E 2 34 ? -30.538 -41.596 41.023 1.00 40.22 ? 29 GLY F O 1 ATOM 6901 N N . ASN E 2 35 ? -29.557 -39.637 41.563 1.00 40.88 ? 30 ASN F N 1 ATOM 6902 C CA . ASN E 2 35 ? -28.595 -39.609 40.455 1.00 38.81 ? 30 ASN F CA 1 ATOM 6903 C C . ASN E 2 35 ? -27.191 -39.859 40.957 1.00 38.88 ? 30 ASN F C 1 ATOM 6904 O O . ASN E 2 35 ? -26.791 -39.273 41.959 1.00 40.03 ? 30 ASN F O 1 ATOM 6905 C CB . ASN E 2 35 ? -28.628 -38.247 39.775 1.00 38.47 ? 30 ASN F CB 1 ATOM 6906 C CG . ASN E 2 35 ? -29.929 -37.994 39.056 1.00 38.55 ? 30 ASN F CG 1 ATOM 6907 O OD1 . ASN E 2 35 ? -30.479 -38.895 38.450 1.00 37.73 ? 30 ASN F OD1 1 ATOM 6908 N ND2 . ASN E 2 35 ? -30.437 -36.772 39.144 1.00 39.90 ? 30 ASN F ND2 1 ATOM 6909 N N . THR E 2 36 ? -26.456 -40.740 40.277 1.00 37.81 ? 31 THR F N 1 ATOM 6910 C CA . THR E 2 36 ? -25.062 -40.926 40.612 1.00 38.28 ? 31 THR F CA 1 ATOM 6911 C C . THR E 2 36 ? -24.220 -40.166 39.570 1.00 36.62 ? 31 THR F C 1 ATOM 6912 O O . THR E 2 36 ? -24.115 -40.554 38.395 1.00 34.99 ? 31 THR F O 1 ATOM 6913 C CB . THR E 2 36 ? -24.603 -42.398 40.890 1.00 39.09 ? 31 THR F CB 1 ATOM 6914 O OG1 . THR E 2 36 ? -23.481 -42.783 40.075 1.00 38.68 ? 31 THR F OG1 1 ATOM 6915 C CG2 . THR E 2 36 ? -25.670 -43.350 40.789 1.00 39.50 ? 31 THR F CG2 1 ATOM 6916 N N . TYR E 2 37 ? -23.643 -39.062 40.028 1.00 37.51 ? 32 TYR F N 1 ATOM 6917 C CA . TYR E 2 37 ? -22.924 -38.146 39.164 1.00 36.87 ? 32 TYR F CA 1 ATOM 6918 C C . TYR E 2 37 ? -21.493 -38.610 38.990 1.00 36.40 ? 32 TYR F C 1 ATOM 6919 O O . TYR E 2 37 ? -20.634 -38.336 39.817 1.00 38.09 ? 32 TYR F O 1 ATOM 6920 C CB . TYR E 2 37 ? -22.967 -36.725 39.721 1.00 38.57 ? 32 TYR F CB 1 ATOM 6921 C CG . TYR E 2 37 ? -24.354 -36.158 39.718 1.00 39.38 ? 32 TYR F CG 1 ATOM 6922 C CD1 . TYR E 2 37 ? -25.074 -36.055 38.539 1.00 38.38 ? 32 TYR F CD1 1 ATOM 6923 C CD2 . TYR E 2 37 ? -24.959 -35.754 40.894 1.00 41.56 ? 32 TYR F CD2 1 ATOM 6924 C CE1 . TYR E 2 37 ? -26.359 -35.549 38.529 1.00 39.60 ? 32 TYR F CE1 1 ATOM 6925 C CE2 . TYR E 2 37 ? -26.247 -35.241 40.897 1.00 42.63 ? 32 TYR F CE2 1 ATOM 6926 C CZ . TYR E 2 37 ? -26.951 -35.149 39.709 1.00 41.53 ? 32 TYR F CZ 1 ATOM 6927 O OH . TYR E 2 37 ? -28.229 -34.644 39.670 1.00 42.49 ? 32 TYR F OH 1 ATOM 6928 N N . LEU E 2 38 ? -21.269 -39.376 37.940 1.00 34.81 ? 33 LEU F N 1 ATOM 6929 C CA . LEU E 2 38 ? -19.931 -39.760 37.507 1.00 34.56 ? 33 LEU F CA 1 ATOM 6930 C C . LEU E 2 38 ? -19.923 -39.539 36.016 1.00 33.28 ? 33 LEU F C 1 ATOM 6931 O O . LEU E 2 38 ? -20.722 -40.150 35.293 1.00 32.67 ? 33 LEU F O 1 ATOM 6932 C CB . LEU E 2 38 ? -19.632 -41.223 37.852 1.00 34.86 ? 33 LEU F CB 1 ATOM 6933 C CG . LEU E 2 38 ? -18.218 -41.822 37.844 1.00 35.24 ? 33 LEU F CG 1 ATOM 6934 C CD1 . LEU E 2 38 ? -17.672 -42.066 36.446 1.00 33.77 ? 33 LEU F CD1 1 ATOM 6935 C CD2 . LEU E 2 38 ? -17.245 -40.999 38.670 1.00 36.71 ? 33 LEU F CD2 1 ATOM 6936 N N . GLU E 2 39 ? -19.048 -38.637 35.572 1.00 33.55 ? 34 GLU F N 1 ATOM 6937 C CA . GLU E 2 39 ? -19.011 -38.154 34.192 1.00 32.61 ? 34 GLU F CA 1 ATOM 6938 C C . GLU E 2 39 ? -17.643 -38.359 33.571 1.00 31.88 ? 34 GLU F C 1 ATOM 6939 O O . GLU E 2 39 ? -16.648 -38.317 34.264 1.00 32.45 ? 34 GLU F O 1 ATOM 6940 C CB . GLU E 2 39 ? -19.328 -36.657 34.163 1.00 34.07 ? 34 GLU F CB 1 ATOM 6941 C CG . GLU E 2 39 ? -20.771 -36.359 34.521 1.00 35.00 ? 34 GLU F CG 1 ATOM 6942 C CD . GLU E 2 39 ? -21.053 -34.901 34.885 1.00 37.15 ? 34 GLU F CD 1 ATOM 6943 O OE1 . GLU E 2 39 ? -20.135 -34.037 34.882 1.00 38.43 ? 34 GLU F OE1 1 ATOM 6944 O OE2 . GLU E 2 39 ? -22.228 -34.618 35.183 1.00 38.41 ? 34 GLU F OE2 1 ATOM 6945 N N . TRP E 2 40 ? -17.613 -38.563 32.259 1.00 30.87 ? 35 TRP F N 1 ATOM 6946 C CA . TRP E 2 40 ? -16.380 -38.629 31.492 1.00 30.53 ? 35 TRP F CA 1 ATOM 6947 C C . TRP E 2 40 ? -16.352 -37.523 30.446 1.00 31.02 ? 35 TRP F C 1 ATOM 6948 O O . TRP E 2 40 ? -17.325 -37.316 29.716 1.00 30.81 ? 35 TRP F O 1 ATOM 6949 C CB . TRP E 2 40 ? -16.267 -39.963 30.773 1.00 29.57 ? 35 TRP F CB 1 ATOM 6950 C CG . TRP E 2 40 ? -16.106 -41.112 31.665 1.00 29.74 ? 35 TRP F CG 1 ATOM 6951 C CD1 . TRP E 2 40 ? -17.087 -41.881 32.186 1.00 30.05 ? 35 TRP F CD1 1 ATOM 6952 C CD2 . TRP E 2 40 ? -14.875 -41.653 32.137 1.00 30.50 ? 35 TRP F CD2 1 ATOM 6953 N NE1 . TRP E 2 40 ? -16.551 -42.879 32.954 1.00 30.85 ? 35 TRP F NE1 1 ATOM 6954 C CE2 . TRP E 2 40 ? -15.190 -42.754 32.948 1.00 31.11 ? 35 TRP F CE2 1 ATOM 6955 C CE3 . TRP E 2 40 ? -13.531 -41.305 31.961 1.00 30.71 ? 35 TRP F CE3 1 ATOM 6956 C CZ2 . TRP E 2 40 ? -14.214 -43.529 33.565 1.00 32.25 ? 35 TRP F CZ2 1 ATOM 6957 C CZ3 . TRP E 2 40 ? -12.573 -42.072 32.568 1.00 31.65 ? 35 TRP F CZ3 1 ATOM 6958 C CH2 . TRP E 2 40 ? -12.915 -43.174 33.354 1.00 32.56 ? 35 TRP F CH2 1 ATOM 6959 N N . TYR E 2 41 ? -15.215 -36.841 30.373 1.00 31.87 ? 36 TYR F N 1 ATOM 6960 C CA . TYR E 2 41 ? -14.967 -35.785 29.403 1.00 32.89 ? 36 TYR F CA 1 ATOM 6961 C C . TYR E 2 41 ? -13.821 -36.175 28.495 1.00 32.71 ? 36 TYR F C 1 ATOM 6962 O O . TYR E 2 41 ? -12.942 -36.942 28.880 1.00 32.20 ? 36 TYR F O 1 ATOM 6963 C CB . TYR E 2 41 ? -14.634 -34.463 30.113 1.00 34.74 ? 36 TYR F CB 1 ATOM 6964 C CG . TYR E 2 41 ? -15.801 -33.936 30.876 1.00 35.67 ? 36 TYR F CG 1 ATOM 6965 C CD1 . TYR E 2 41 ? -16.028 -34.327 32.196 1.00 35.83 ? 36 TYR F CD1 1 ATOM 6966 C CD2 . TYR E 2 41 ? -16.713 -33.090 30.274 1.00 36.89 ? 36 TYR F CD2 1 ATOM 6967 C CE1 . TYR E 2 41 ? -17.121 -33.862 32.898 1.00 37.02 ? 36 TYR F CE1 1 ATOM 6968 C CE2 . TYR E 2 41 ? -17.827 -32.632 30.966 1.00 38.22 ? 36 TYR F CE2 1 ATOM 6969 C CZ . TYR E 2 41 ? -18.025 -33.017 32.273 1.00 38.13 ? 36 TYR F CZ 1 ATOM 6970 O OH . TYR E 2 41 ? -19.132 -32.555 32.953 1.00 40.09 ? 36 TYR F OH 1 ATOM 6971 N N . LEU E 2 42 ? -13.869 -35.670 27.270 1.00 33.63 ? 37 LEU F N 1 ATOM 6972 C CA . LEU E 2 42 ? -12.786 -35.793 26.325 1.00 34.27 ? 37 LEU F CA 1 ATOM 6973 C C . LEU E 2 42 ? -12.347 -34.389 25.976 1.00 36.85 ? 37 LEU F C 1 ATOM 6974 O O . LEU E 2 42 ? -13.165 -33.574 25.566 1.00 38.08 ? 37 LEU F O 1 ATOM 6975 C CB . LEU E 2 42 ? -13.243 -36.513 25.064 1.00 33.64 ? 37 LEU F CB 1 ATOM 6976 C CG . LEU E 2 42 ? -12.300 -36.465 23.847 1.00 34.13 ? 37 LEU F CG 1 ATOM 6977 C CD1 . LEU E 2 42 ? -10.934 -37.022 24.195 1.00 33.72 ? 37 LEU F CD1 1 ATOM 6978 C CD2 . LEU E 2 42 ? -12.919 -37.244 22.705 1.00 34.30 ? 37 LEU F CD2 1 ATOM 6979 N N . GLN E 2 43 ? -11.066 -34.105 26.147 1.00 38.35 ? 38 GLN F N 1 ATOM 6980 C CA . GLN E 2 43 ? -10.512 -32.856 25.659 1.00 41.80 ? 38 GLN F CA 1 ATOM 6981 C C . GLN E 2 43 ? -9.546 -33.063 24.510 1.00 42.97 ? 38 GLN F C 1 ATOM 6982 O O . GLN E 2 43 ? -8.588 -33.832 24.622 1.00 41.79 ? 38 GLN F O 1 ATOM 6983 C CB . GLN E 2 43 ? -9.801 -32.096 26.746 1.00 43.17 ? 38 GLN F CB 1 ATOM 6984 C CG . GLN E 2 43 ? -9.365 -30.731 26.247 1.00 46.45 ? 38 GLN F CG 1 ATOM 6985 C CD . GLN E 2 43 ? -8.951 -29.825 27.370 1.00 48.68 ? 38 GLN F CD 1 ATOM 6986 O OE1 . GLN E 2 43 ? -8.518 -30.283 28.420 1.00 48.32 ? 38 GLN F OE1 1 ATOM 6987 N NE2 . GLN E 2 43 ? -9.113 -28.536 27.170 1.00 51.54 ? 38 GLN F NE2 1 ATOM 6988 N N . LYS E 2 44 ? -9.811 -32.354 23.414 1.00 46.05 ? 39 LYS F N 1 ATOM 6989 C CA . LYS E 2 44 ? -8.960 -32.380 22.250 1.00 48.14 ? 39 LYS F CA 1 ATOM 6990 C C . LYS E 2 44 ? -8.161 -31.109 22.199 1.00 50.91 ? 39 LYS F C 1 ATOM 6991 O O . LYS E 2 44 ? -8.607 -30.092 22.735 1.00 51.52 ? 39 LYS F O 1 ATOM 6992 C CB . LYS E 2 44 ? -9.799 -32.540 20.989 1.00 49.89 ? 39 LYS F CB 1 ATOM 6993 C CG . LYS E 2 44 ? -10.522 -33.873 20.973 1.00 48.60 ? 39 LYS F CG 1 ATOM 6994 C CD . LYS E 2 44 ? -10.827 -34.369 19.574 1.00 50.44 ? 39 LYS F CD 1 ATOM 6995 C CE . LYS E 2 44 ? -12.322 -34.454 19.331 1.00 51.59 ? 39 LYS F CE 1 ATOM 6996 N NZ . LYS E 2 44 ? -12.571 -34.802 17.899 1.00 53.86 ? 39 LYS F NZ 1 ATOM 6997 N N . PRO E 2 45 ? -6.974 -31.162 21.550 1.00 53.03 ? 40 PRO F N 1 ATOM 6998 C CA . PRO E 2 45 ? -6.075 -30.000 21.464 1.00 56.04 ? 40 PRO F CA 1 ATOM 6999 C C . PRO E 2 45 ? -6.761 -28.703 21.031 1.00 58.93 ? 40 PRO F C 1 ATOM 7000 O O . PRO E 2 45 ? -7.351 -28.643 19.951 1.00 59.43 ? 40 PRO F O 1 ATOM 7001 C CB . PRO E 2 45 ? -5.058 -30.420 20.403 1.00 56.60 ? 40 PRO F CB 1 ATOM 7002 C CG . PRO E 2 45 ? -5.053 -31.913 20.445 1.00 53.73 ? 40 PRO F CG 1 ATOM 7003 C CD . PRO E 2 45 ? -6.417 -32.350 20.868 1.00 51.64 ? 40 PRO F CD 1 ATOM 7004 N N . GLY E 2 46 ? -6.679 -27.685 21.886 1.00 61.09 ? 41 GLY F N 1 ATOM 7005 C CA . GLY E 2 46 ? -7.228 -26.358 21.594 1.00 64.67 ? 41 GLY F CA 1 ATOM 7006 C C . GLY E 2 46 ? -8.711 -26.168 21.873 1.00 64.25 ? 41 GLY F C 1 ATOM 7007 O O . GLY E 2 46 ? -9.215 -25.046 21.796 1.00 67.63 ? 41 GLY F O 1 ATOM 7008 N N . GLN E 2 47 ? -9.403 -27.242 22.235 1.00 60.45 ? 42 GLN F N 1 ATOM 7009 C CA . GLN E 2 47 ? -10.842 -27.185 22.473 1.00 59.99 ? 42 GLN F CA 1 ATOM 7010 C C . GLN E 2 47 ? -11.148 -27.334 23.951 1.00 56.66 ? 42 GLN F C 1 ATOM 7011 O O . GLN E 2 47 ? -10.311 -27.764 24.742 1.00 55.07 ? 42 GLN F O 1 ATOM 7012 C CB . GLN E 2 47 ? -11.559 -28.306 21.715 1.00 59.03 ? 42 GLN F CB 1 ATOM 7013 C CG . GLN E 2 47 ? -11.488 -28.220 20.193 1.00 62.13 ? 42 GLN F CG 1 ATOM 7014 C CD . GLN E 2 47 ? -12.316 -29.299 19.505 1.00 61.74 ? 42 GLN F CD 1 ATOM 7015 O OE1 . GLN E 2 47 ? -13.248 -29.862 20.091 1.00 61.17 ? 42 GLN F OE1 1 ATOM 7016 N NE2 . GLN E 2 47 ? -11.989 -29.583 18.247 1.00 63.76 ? 42 GLN F NE2 1 ATOM 7017 N N . SER E 2 48 ? -12.370 -26.987 24.310 1.00 55.67 ? 43 SER F N 1 ATOM 7018 C CA . SER E 2 48 ? -12.854 -27.231 25.644 1.00 53.36 ? 43 SER F CA 1 ATOM 7019 C C . SER E 2 48 ? -13.064 -28.728 25.841 1.00 48.91 ? 43 SER F C 1 ATOM 7020 O O . SER E 2 48 ? -13.125 -29.501 24.871 1.00 47.19 ? 43 SER F O 1 ATOM 7021 C CB . SER E 2 48 ? -14.157 -26.476 25.877 1.00 55.25 ? 43 SER F CB 1 ATOM 7022 O OG . SER E 2 48 ? -13.957 -25.089 25.663 1.00 59.32 ? 43 SER F OG 1 ATOM 7023 N N . PRO E 2 49 ? -13.142 -29.156 27.106 1.00 46.85 ? 44 PRO F N 1 ATOM 7024 C CA . PRO E 2 49 ? -13.582 -30.521 27.360 1.00 43.52 ? 44 PRO F CA 1 ATOM 7025 C C . PRO E 2 49 ? -15.044 -30.684 26.967 1.00 42.97 ? 44 PRO F C 1 ATOM 7026 O O . PRO E 2 49 ? -15.842 -29.790 27.214 1.00 44.48 ? 44 PRO F O 1 ATOM 7027 C CB . PRO E 2 49 ? -13.417 -30.681 28.878 1.00 43.15 ? 44 PRO F CB 1 ATOM 7028 C CG . PRO E 2 49 ? -12.489 -29.595 29.297 1.00 45.72 ? 44 PRO F CG 1 ATOM 7029 C CD . PRO E 2 49 ? -12.685 -28.471 28.326 1.00 48.11 ? 44 PRO F CD 1 ATOM 7030 N N . LYS E 2 50 ? -15.372 -31.809 26.346 1.00 41.11 ? 45 LYS F N 1 ATOM 7031 C CA . LYS E 2 50 ? -16.742 -32.121 25.977 1.00 41.22 ? 45 LYS F CA 1 ATOM 7032 C C . LYS E 2 50 ? -17.200 -33.352 26.724 1.00 38.81 ? 45 LYS F C 1 ATOM 7033 O O . LYS E 2 50 ? -16.441 -34.296 26.935 1.00 36.99 ? 45 LYS F O 1 ATOM 7034 C CB . LYS E 2 50 ? -16.856 -32.385 24.483 1.00 42.19 ? 45 LYS F CB 1 ATOM 7035 C CG . LYS E 2 50 ? -16.537 -31.184 23.619 1.00 45.38 ? 45 LYS F CG 1 ATOM 7036 C CD . LYS E 2 50 ? -16.737 -31.535 22.157 1.00 46.58 ? 45 LYS F CD 1 ATOM 7037 C CE . LYS E 2 50 ? -16.211 -30.435 21.242 1.00 50.04 ? 45 LYS F CE 1 ATOM 7038 N NZ . LYS E 2 50 ? -17.026 -29.191 21.343 1.00 53.30 ? 45 LYS F NZ 1 ATOM 7039 N N . LEU E 2 51 ? -18.464 -33.338 27.107 1.00 38.92 ? 46 LEU F N 1 ATOM 7040 C CA . LEU E 2 51 ? -19.046 -34.438 27.852 1.00 37.22 ? 46 LEU F CA 1 ATOM 7041 C C . LEU E 2 51 ? -19.251 -35.614 26.920 1.00 35.57 ? 46 LEU F C 1 ATOM 7042 O O . LEU E 2 51 ? -19.747 -35.438 25.831 1.00 36.86 ? 46 LEU F O 1 ATOM 7043 C CB . LEU E 2 51 ? -20.373 -33.994 28.438 1.00 38.25 ? 46 LEU F CB 1 ATOM 7044 C CG . LEU E 2 51 ? -21.111 -35.038 29.259 1.00 37.38 ? 46 LEU F CG 1 ATOM 7045 C CD1 . LEU E 2 51 ? -20.387 -35.330 30.552 1.00 36.70 ? 46 LEU F CD1 1 ATOM 7046 C CD2 . LEU E 2 51 ? -22.508 -34.519 29.541 1.00 38.94 ? 46 LEU F CD2 1 ATOM 7047 N N . LEU E 2 52 ? -18.844 -36.799 27.341 1.00 33.81 ? 47 LEU F N 1 ATOM 7048 C CA . LEU E 2 52 ? -19.134 -38.020 26.603 1.00 33.29 ? 47 LEU F CA 1 ATOM 7049 C C . LEU E 2 52 ? -20.218 -38.808 27.295 1.00 32.42 ? 47 LEU F C 1 ATOM 7050 O O . LEU E 2 52 ? -21.195 -39.215 26.639 1.00 33.20 ? 47 LEU F O 1 ATOM 7051 C CB . LEU E 2 52 ? -17.895 -38.910 26.468 1.00 32.79 ? 47 LEU F CB 1 ATOM 7052 C CG . LEU E 2 52 ? -16.743 -38.315 25.663 1.00 33.62 ? 47 LEU F CG 1 ATOM 7053 C CD1 . LEU E 2 52 ? -15.609 -39.322 25.585 1.00 33.21 ? 47 LEU F CD1 1 ATOM 7054 C CD2 . LEU E 2 52 ? -17.175 -37.901 24.266 1.00 34.77 ? 47 LEU F CD2 1 ATOM 7055 N N . ILE E 2 53 ? -20.026 -39.032 28.593 1.00 30.97 ? 48 ILE F N 1 ATOM 7056 C CA . ILE E 2 53 ? -20.862 -39.926 29.377 1.00 30.64 ? 48 ILE F CA 1 ATOM 7057 C C . ILE E 2 53 ? -21.269 -39.192 30.638 1.00 30.92 ? 48 ILE F C 1 ATOM 7058 O O . ILE E 2 53 ? -20.435 -38.527 31.261 1.00 30.44 ? 48 ILE F O 1 ATOM 7059 C CB . ILE E 2 53 ? -20.106 -41.213 29.785 1.00 30.03 ? 48 ILE F CB 1 ATOM 7060 C CG1 . ILE E 2 53 ? -19.590 -41.962 28.550 1.00 29.84 ? 48 ILE F CG1 1 ATOM 7061 C CG2 . ILE E 2 53 ? -20.999 -42.122 30.608 1.00 30.14 ? 48 ILE F CG2 1 ATOM 7062 C CD1 . ILE E 2 53 ? -20.679 -42.491 27.651 1.00 30.52 ? 48 ILE F CD1 1 ATOM 7063 N N . TYR E 2 54 ? -22.529 -39.341 31.002 1.00 31.24 ? 49 TYR F N 1 ATOM 7064 C CA . TYR E 2 54 ? -23.062 -38.780 32.212 1.00 32.01 ? 49 TYR F CA 1 ATOM 7065 C C . TYR E 2 54 ? -23.809 -39.832 33.016 1.00 32.22 ? 49 TYR F C 1 ATOM 7066 O O . TYR E 2 54 ? -24.191 -40.843 32.499 1.00 32.28 ? 49 TYR F O 1 ATOM 7067 C CB . TYR E 2 54 ? -23.893 -37.556 31.910 1.00 33.10 ? 49 TYR F CB 1 ATOM 7068 C CG . TYR E 2 54 ? -25.221 -37.813 31.264 1.00 33.44 ? 49 TYR F CG 1 ATOM 7069 C CD1 . TYR E 2 54 ? -25.340 -37.978 29.892 1.00 33.48 ? 49 TYR F CD1 1 ATOM 7070 C CD2 . TYR E 2 54 ? -26.363 -37.849 32.021 1.00 34.29 ? 49 TYR F CD2 1 ATOM 7071 C CE1 . TYR E 2 54 ? -26.568 -38.193 29.309 1.00 34.44 ? 49 TYR F CE1 1 ATOM 7072 C CE2 . TYR E 2 54 ? -27.592 -38.056 31.455 1.00 35.13 ? 49 TYR F CE2 1 ATOM 7073 C CZ . TYR E 2 54 ? -27.697 -38.228 30.103 1.00 35.21 ? 49 TYR F CZ 1 ATOM 7074 O OH . TYR E 2 54 ? -28.924 -38.430 29.565 1.00 36.26 ? 49 TYR F OH 1 ATOM 7075 N N . LYS E 2 55 ? -23.904 -39.612 34.313 1.00 32.93 ? 50 LYS F N 1 ATOM 7076 C CA . LYS E 2 55 ? -24.582 -40.511 35.211 1.00 33.54 ? 50 LYS F CA 1 ATOM 7077 C C . LYS E 2 55 ? -24.100 -41.904 35.025 1.00 33.05 ? 50 LYS F C 1 ATOM 7078 O O . LYS E 2 55 ? -24.870 -42.813 34.830 1.00 33.14 ? 50 LYS F O 1 ATOM 7079 C CB . LYS E 2 55 ? -26.082 -40.411 35.079 1.00 34.46 ? 50 LYS F CB 1 ATOM 7080 C CG . LYS E 2 55 ? -26.664 -39.167 35.708 1.00 35.64 ? 50 LYS F CG 1 ATOM 7081 C CD . LYS E 2 55 ? -28.154 -39.117 35.519 1.00 36.30 ? 50 LYS F CD 1 ATOM 7082 C CE . LYS E 2 55 ? -28.796 -40.415 35.960 1.00 36.48 ? 50 LYS F CE 1 ATOM 7083 N NZ . LYS E 2 55 ? -30.170 -40.446 35.477 1.00 37.49 ? 50 LYS F NZ 1 ATOM 7084 N N . VAL E 2 56 ? -22.788 -42.029 35.021 1.00 32.68 ? 51 VAL F N 1 ATOM 7085 C CA . VAL E 2 56 ? -22.099 -43.290 34.904 1.00 32.87 ? 51 VAL F CA 1 ATOM 7086 C C . VAL E 2 56 ? -22.135 -43.885 33.523 1.00 32.45 ? 51 VAL F C 1 ATOM 7087 O O . VAL E 2 56 ? -21.127 -44.320 33.038 1.00 31.95 ? 51 VAL F O 1 ATOM 7088 C CB . VAL E 2 56 ? -22.589 -44.356 35.904 1.00 34.27 ? 51 VAL F CB 1 ATOM 7089 C CG1 . VAL E 2 56 ? -21.765 -45.617 35.795 1.00 34.96 ? 51 VAL F CG1 1 ATOM 7090 C CG2 . VAL E 2 56 ? -22.564 -43.838 37.318 1.00 35.43 ? 51 VAL F CG2 1 ATOM 7091 N N . SER E 2 57 ? -23.332 -44.010 32.962 1.00 32.85 ? 52 SER F N 1 ATOM 7092 C CA . SER E 2 57 ? -23.578 -44.873 31.829 1.00 32.97 ? 52 SER F CA 1 ATOM 7093 C C . SER E 2 57 ? -24.242 -44.288 30.604 1.00 32.24 ? 52 SER F C 1 ATOM 7094 O O . SER E 2 57 ? -24.385 -44.960 29.617 1.00 32.19 ? 52 SER F O 1 ATOM 7095 C CB . SER E 2 57 ? -24.411 -46.039 32.312 1.00 34.93 ? 52 SER F CB 1 ATOM 7096 O OG . SER E 2 57 ? -23.620 -47.175 32.429 1.00 36.74 ? 52 SER F OG 1 ATOM 7097 N N . ASN E 2 58 ? -24.664 -43.049 30.681 1.00 31.74 ? 53 ASN F N 1 ATOM 7098 C CA . ASN E 2 58 ? -25.509 -42.500 29.672 1.00 32.05 ? 53 ASN F CA 1 ATOM 7099 C C . ASN E 2 58 ? -24.760 -41.668 28.688 1.00 31.57 ? 53 ASN F C 1 ATOM 7100 O O . ASN E 2 58 ? -24.041 -40.775 29.038 1.00 31.02 ? 53 ASN F O 1 ATOM 7101 C CB . ASN E 2 58 ? -26.630 -41.700 30.300 1.00 32.65 ? 53 ASN F CB 1 ATOM 7102 C CG . ASN E 2 58 ? -27.334 -42.462 31.375 1.00 33.23 ? 53 ASN F CG 1 ATOM 7103 O OD1 . ASN E 2 58 ? -27.294 -42.085 32.520 1.00 33.73 ? 53 ASN F OD1 1 ATOM 7104 N ND2 . ASN E 2 58 ? -27.950 -43.554 31.016 1.00 33.90 ? 53 ASN F ND2 1 ATOM 7105 N N . ARG E 2 59 ? -24.958 -41.985 27.430 1.00 32.18 ? 54 ARG F N 1 ATOM 7106 C CA . ARG E 2 59 ? -24.213 -41.327 26.358 1.00 32.44 ? 54 ARG F CA 1 ATOM 7107 C C . ARG E 2 59 ? -24.809 -39.975 26.083 1.00 33.18 ? 54 ARG F C 1 ATOM 7108 O O . ARG E 2 59 ? -25.990 -39.858 25.844 1.00 34.29 ? 54 ARG F O 1 ATOM 7109 C CB . ARG E 2 59 ? -24.203 -42.140 25.048 1.00 33.48 ? 54 ARG F CB 1 ATOM 7110 C CG . ARG E 2 59 ? -22.873 -42.816 24.823 1.00 33.14 ? 54 ARG F CG 1 ATOM 7111 C CD . ARG E 2 59 ? -22.760 -43.436 23.458 1.00 34.83 ? 54 ARG F CD 1 ATOM 7112 N NE . ARG E 2 59 ? -23.925 -44.251 23.154 1.00 36.71 ? 54 ARG F NE 1 ATOM 7113 C CZ . ARG E 2 59 ? -24.178 -45.479 23.629 1.00 37.56 ? 54 ARG F CZ 1 ATOM 7114 N NH1 . ARG E 2 59 ? -25.307 -46.094 23.256 1.00 39.13 ? 54 ARG F NH1 1 ATOM 7115 N NH2 . ARG E 2 59 ? -23.355 -46.094 24.498 1.00 36.53 ? 54 ARG F NH2 1 ATOM 7116 N N . PHE E 2 60 ? -23.986 -38.948 26.115 1.00 32.92 ? 55 PHE F N 1 ATOM 7117 C CA . PHE E 2 60 ? -24.466 -37.597 25.827 1.00 34.48 ? 55 PHE F CA 1 ATOM 7118 C C . PHE E 2 60 ? -24.838 -37.544 24.357 1.00 36.37 ? 55 PHE F C 1 ATOM 7119 O O . PHE E 2 60 ? -24.392 -38.380 23.575 1.00 36.08 ? 55 PHE F O 1 ATOM 7120 C CB . PHE E 2 60 ? -23.405 -36.566 26.198 1.00 34.11 ? 55 PHE F CB 1 ATOM 7121 C CG . PHE E 2 60 ? -23.871 -35.138 26.145 1.00 35.98 ? 55 PHE F CG 1 ATOM 7122 C CD1 . PHE E 2 60 ? -24.810 -34.653 27.049 1.00 36.77 ? 55 PHE F CD1 1 ATOM 7123 C CD2 . PHE E 2 60 ? -23.322 -34.251 25.220 1.00 37.34 ? 55 PHE F CD2 1 ATOM 7124 C CE1 . PHE E 2 60 ? -25.216 -33.324 27.014 1.00 39.09 ? 55 PHE F CE1 1 ATOM 7125 C CE2 . PHE E 2 60 ? -23.726 -32.924 25.183 1.00 39.78 ? 55 PHE F CE2 1 ATOM 7126 C CZ . PHE E 2 60 ? -24.673 -32.458 26.077 1.00 40.65 ? 55 PHE F CZ 1 ATOM 7127 N N . SER E 2 61 ? -25.709 -36.608 23.996 1.00 39.05 ? 56 SER F N 1 ATOM 7128 C CA . SER E 2 61 ? -26.159 -36.491 22.613 1.00 41.71 ? 56 SER F CA 1 ATOM 7129 C C . SER E 2 61 ? -24.962 -36.296 21.687 1.00 41.76 ? 56 SER F C 1 ATOM 7130 O O . SER E 2 61 ? -23.972 -35.674 22.052 1.00 41.09 ? 56 SER F O 1 ATOM 7131 C CB . SER E 2 61 ? -27.153 -35.337 22.436 1.00 44.84 ? 56 SER F CB 1 ATOM 7132 O OG . SER E 2 61 ? -26.472 -34.096 22.511 1.00 46.05 ? 56 SER F OG 1 ATOM 7133 N N . GLY E 2 62 ? -25.050 -36.875 20.500 1.00 43.15 ? 57 GLY F N 1 ATOM 7134 C CA . GLY E 2 62 ? -23.984 -36.777 19.513 1.00 43.73 ? 57 GLY F CA 1 ATOM 7135 C C . GLY E 2 62 ? -22.846 -37.769 19.709 1.00 41.52 ? 57 GLY F C 1 ATOM 7136 O O . GLY E 2 62 ? -22.072 -38.007 18.798 1.00 42.02 ? 57 GLY F O 1 ATOM 7137 N N . VAL E 2 63 ? -22.727 -38.358 20.889 1.00 39.51 ? 58 VAL F N 1 ATOM 7138 C CA . VAL E 2 63 ? -21.631 -39.277 21.154 1.00 37.76 ? 58 VAL F CA 1 ATOM 7139 C C . VAL E 2 63 ? -22.018 -40.651 20.618 1.00 38.31 ? 58 VAL F C 1 ATOM 7140 O O . VAL E 2 63 ? -23.066 -41.173 20.990 1.00 38.58 ? 58 VAL F O 1 ATOM 7141 C CB . VAL E 2 63 ? -21.356 -39.392 22.654 1.00 35.91 ? 58 VAL F CB 1 ATOM 7142 C CG1 . VAL E 2 63 ? -20.171 -40.317 22.916 1.00 34.63 ? 58 VAL F CG1 1 ATOM 7143 C CG2 . VAL E 2 63 ? -21.099 -38.018 23.260 1.00 36.09 ? 58 VAL F CG2 1 ATOM 7144 N N . PRO E 2 64 ? -21.171 -41.247 19.756 1.00 38.80 ? 59 PRO F N 1 ATOM 7145 C CA . PRO E 2 64 ? -21.533 -42.512 19.096 1.00 39.94 ? 59 PRO F CA 1 ATOM 7146 C C . PRO E 2 64 ? -21.437 -43.729 20.012 1.00 38.89 ? 59 PRO F C 1 ATOM 7147 O O . PRO E 2 64 ? -20.798 -43.653 21.051 1.00 37.28 ? 59 PRO F O 1 ATOM 7148 C CB . PRO E 2 64 ? -20.540 -42.600 17.938 1.00 40.84 ? 59 PRO F CB 1 ATOM 7149 C CG . PRO E 2 64 ? -19.361 -41.801 18.373 1.00 39.35 ? 59 PRO F CG 1 ATOM 7150 C CD . PRO E 2 64 ? -19.858 -40.741 19.316 1.00 38.48 ? 59 PRO F CD 1 ATOM 7151 N N . ASP E 2 65 ? -22.059 -44.842 19.618 1.00 40.67 ? 60 ASP F N 1 ATOM 7152 C CA . ASP E 2 65 ? -22.168 -46.007 20.513 1.00 40.59 ? 60 ASP F CA 1 ATOM 7153 C C . ASP E 2 65 ? -20.902 -46.852 20.670 1.00 39.92 ? 60 ASP F C 1 ATOM 7154 O O . ASP E 2 65 ? -20.918 -47.899 21.317 1.00 39.86 ? 60 ASP F O 1 ATOM 7155 C CB . ASP E 2 65 ? -23.359 -46.936 20.204 1.00 43.16 ? 60 ASP F CB 1 ATOM 7156 C CG . ASP E 2 65 ? -23.499 -47.284 18.751 1.00 46.38 ? 60 ASP F CG 1 ATOM 7157 O OD1 . ASP E 2 65 ? -22.792 -46.686 17.906 1.00 47.20 ? 60 ASP F OD1 1 ATOM 7158 O OD2 . ASP E 2 65 ? -24.333 -48.187 18.463 1.00 49.29 ? 60 ASP F OD2 1 ATOM 7159 N N . ARG E 2 66 ? -19.798 -46.422 20.092 1.00 39.78 ? 61 ARG F N 1 ATOM 7160 C CA . ARG E 2 66 ? -18.548 -47.103 20.385 1.00 39.37 ? 61 ARG F CA 1 ATOM 7161 C C . ARG E 2 66 ? -18.052 -46.722 21.786 1.00 36.80 ? 61 ARG F C 1 ATOM 7162 O O . ARG E 2 66 ? -17.265 -47.451 22.376 1.00 36.70 ? 61 ARG F O 1 ATOM 7163 C CB . ARG E 2 66 ? -17.503 -46.895 19.280 1.00 40.75 ? 61 ARG F CB 1 ATOM 7164 C CG . ARG E 2 66 ? -17.280 -45.460 18.833 1.00 41.27 ? 61 ARG F CG 1 ATOM 7165 C CD . ARG E 2 66 ? -16.019 -45.340 17.966 1.00 42.43 ? 61 ARG F CD 1 ATOM 7166 N NE . ARG E 2 66 ? -15.547 -43.956 17.843 1.00 41.61 ? 61 ARG F NE 1 ATOM 7167 C CZ . ARG E 2 66 ? -16.095 -43.048 17.039 1.00 43.19 ? 61 ARG F CZ 1 ATOM 7168 N NH1 . ARG E 2 66 ? -17.137 -43.362 16.267 1.00 45.20 ? 61 ARG F NH1 1 ATOM 7169 N NH2 . ARG E 2 66 ? -15.590 -41.822 16.988 1.00 43.31 ? 61 ARG F NH2 1 ATOM 7170 N N . PHE E 2 67 ? -18.554 -45.614 22.329 1.00 35.01 ? 62 PHE F N 1 ATOM 7171 C CA . PHE E 2 67 ? -18.279 -45.219 23.710 1.00 33.30 ? 62 PHE F CA 1 ATOM 7172 C C . PHE E 2 67 ? -19.299 -45.827 24.687 1.00 33.18 ? 62 PHE F C 1 ATOM 7173 O O . PHE E 2 67 ? -20.513 -45.824 24.442 1.00 33.98 ? 62 PHE F O 1 ATOM 7174 C CB . PHE E 2 67 ? -18.340 -43.701 23.857 1.00 32.59 ? 62 PHE F CB 1 ATOM 7175 C CG . PHE E 2 67 ? -17.250 -42.973 23.126 1.00 32.72 ? 62 PHE F CG 1 ATOM 7176 C CD1 . PHE E 2 67 ? -15.993 -42.817 23.700 1.00 32.07 ? 62 PHE F CD1 1 ATOM 7177 C CD2 . PHE E 2 67 ? -17.480 -42.417 21.881 1.00 33.91 ? 62 PHE F CD2 1 ATOM 7178 C CE1 . PHE E 2 67 ? -14.990 -42.132 23.040 1.00 32.31 ? 62 PHE F CE1 1 ATOM 7179 C CE2 . PHE E 2 67 ? -16.470 -41.725 21.210 1.00 34.31 ? 62 PHE F CE2 1 ATOM 7180 C CZ . PHE E 2 67 ? -15.225 -41.582 21.788 1.00 33.30 ? 62 PHE F CZ 1 ATOM 7181 N N . SER E 2 68 ? -18.807 -46.336 25.804 1.00 32.32 ? 63 SER F N 1 ATOM 7182 C CA . SER E 2 68 ? -19.671 -46.825 26.864 1.00 32.19 ? 63 SER F CA 1 ATOM 7183 C C . SER E 2 68 ? -19.035 -46.664 28.240 1.00 31.62 ? 63 SER F C 1 ATOM 7184 O O . SER E 2 68 ? -17.846 -46.933 28.453 1.00 32.10 ? 63 SER F O 1 ATOM 7185 C CB . SER E 2 68 ? -20.021 -48.289 26.625 1.00 33.85 ? 63 SER F CB 1 ATOM 7186 O OG . SER E 2 68 ? -18.840 -49.054 26.693 1.00 34.58 ? 63 SER F OG 1 ATOM 7187 N N . GLY E 2 69 ? -19.849 -46.239 29.187 1.00 31.16 ? 64 GLY F N 1 ATOM 7188 C CA . GLY E 2 69 ? -19.402 -46.040 30.540 1.00 30.82 ? 64 GLY F CA 1 ATOM 7189 C C . GLY E 2 69 ? -20.007 -47.131 31.370 1.00 32.12 ? 64 GLY F C 1 ATOM 7190 O O . GLY E 2 69 ? -21.068 -47.647 31.029 1.00 32.56 ? 64 GLY F O 1 ATOM 7191 N N . SER E 2 70 ? -19.328 -47.517 32.443 1.00 32.74 ? 65 SER F N 1 ATOM 7192 C CA . SER E 2 70 ? -19.875 -48.516 33.344 1.00 34.45 ? 65 SER F CA 1 ATOM 7193 C C . SER E 2 70 ? -19.215 -48.400 34.693 1.00 35.38 ? 65 SER F C 1 ATOM 7194 O O . SER E 2 70 ? -18.301 -47.610 34.884 1.00 34.97 ? 65 SER F O 1 ATOM 7195 C CB . SER E 2 70 ? -19.681 -49.924 32.773 1.00 36.01 ? 65 SER F CB 1 ATOM 7196 O OG . SER E 2 70 ? -18.321 -50.318 32.821 1.00 37.02 ? 65 SER F OG 1 ATOM 7197 N N . GLY E 2 71 ? -19.681 -49.196 35.634 1.00 37.30 ? 66 GLY F N 1 ATOM 7198 C CA . GLY E 2 71 ? -19.079 -49.268 36.952 1.00 39.06 ? 66 GLY F CA 1 ATOM 7199 C C . GLY E 2 71 ? -20.012 -48.819 38.041 1.00 39.80 ? 66 GLY F C 1 ATOM 7200 O O . GLY E 2 71 ? -21.104 -48.339 37.771 1.00 38.69 ? 66 GLY F O 1 ATOM 7201 N N . SER E 2 72 ? -19.574 -48.961 39.286 1.00 42.17 ? 67 SER F N 1 ATOM 7202 C CA . SER E 2 72 ? -20.343 -48.479 40.433 1.00 43.29 ? 67 SER F CA 1 ATOM 7203 C C . SER E 2 72 ? -19.474 -48.418 41.661 1.00 45.84 ? 67 SER F C 1 ATOM 7204 O O . SER E 2 72 ? -18.445 -49.087 41.749 1.00 47.64 ? 67 SER F O 1 ATOM 7205 C CB . SER E 2 72 ? -21.594 -49.338 40.712 1.00 44.84 ? 67 SER F CB 1 ATOM 7206 O OG . SER E 2 72 ? -21.289 -50.648 41.147 1.00 47.86 ? 67 SER F OG 1 ATOM 7207 N N . GLY E 2 73 ? -19.889 -47.592 42.608 1.00 46.64 ? 68 GLY F N 1 ATOM 7208 C CA . GLY E 2 73 ? -19.232 -47.517 43.905 1.00 49.55 ? 68 GLY F CA 1 ATOM 7209 C C . GLY E 2 73 ? -17.931 -46.752 43.794 1.00 49.10 ? 68 GLY F C 1 ATOM 7210 O O . GLY E 2 73 ? -17.943 -45.523 43.712 1.00 47.54 ? 68 GLY F O 1 ATOM 7211 N N . THR E 2 74 ? -16.815 -47.478 43.768 1.00 50.67 ? 69 THR F N 1 ATOM 7212 C CA . THR E 2 74 ? -15.484 -46.855 43.666 1.00 50.81 ? 69 THR F CA 1 ATOM 7213 C C . THR E 2 74 ? -14.762 -47.164 42.363 1.00 48.92 ? 69 THR F C 1 ATOM 7214 O O . THR E 2 74 ? -13.635 -46.759 42.179 1.00 49.39 ? 69 THR F O 1 ATOM 7215 C CB . THR E 2 74 ? -14.551 -47.285 44.836 1.00 55.04 ? 69 THR F CB 1 ATOM 7216 O OG1 . THR E 2 74 ? -14.219 -48.677 44.722 1.00 56.96 ? 69 THR F OG1 1 ATOM 7217 C CG2 . THR E 2 74 ? -15.208 -47.017 46.186 1.00 57.61 ? 69 THR F CG2 1 ATOM 7218 N N . ASP E 2 75 ? -15.419 -47.865 41.457 1.00 47.73 ? 70 ASP F N 1 ATOM 7219 C CA . ASP E 2 75 ? -14.766 -48.438 40.297 1.00 46.88 ? 70 ASP F CA 1 ATOM 7220 C C . ASP E 2 75 ? -15.534 -48.155 39.008 1.00 43.30 ? 70 ASP F C 1 ATOM 7221 O O . ASP E 2 75 ? -16.644 -48.633 38.818 1.00 42.90 ? 70 ASP F O 1 ATOM 7222 C CB . ASP E 2 75 ? -14.719 -49.944 40.520 1.00 50.16 ? 70 ASP F CB 1 ATOM 7223 C CG . ASP E 2 75 ? -13.526 -50.592 39.910 1.00 51.54 ? 70 ASP F CG 1 ATOM 7224 O OD1 . ASP E 2 75 ? -13.346 -50.444 38.682 1.00 49.03 ? 70 ASP F OD1 1 ATOM 7225 O OD2 . ASP E 2 75 ? -12.789 -51.269 40.675 1.00 55.59 ? 70 ASP F OD2 1 ATOM 7226 N N . PHE E 2 76 ? -14.933 -47.392 38.115 1.00 41.17 ? 71 PHE F N 1 ATOM 7227 C CA . PHE E 2 76 ? -15.598 -46.980 36.889 1.00 38.36 ? 71 PHE F CA 1 ATOM 7228 C C . PHE E 2 76 ? -14.681 -47.166 35.694 1.00 37.46 ? 71 PHE F C 1 ATOM 7229 O O . PHE E 2 76 ? -13.466 -47.140 35.843 1.00 38.34 ? 71 PHE F O 1 ATOM 7230 C CB . PHE E 2 76 ? -16.044 -45.527 37.025 1.00 36.90 ? 71 PHE F CB 1 ATOM 7231 C CG . PHE E 2 76 ? -16.968 -45.295 38.194 1.00 38.02 ? 71 PHE F CG 1 ATOM 7232 C CD1 . PHE E 2 76 ? -18.338 -45.507 38.070 1.00 37.58 ? 71 PHE F CD1 1 ATOM 7233 C CD2 . PHE E 2 76 ? -16.471 -44.893 39.419 1.00 40.01 ? 71 PHE F CD2 1 ATOM 7234 C CE1 . PHE E 2 76 ? -19.196 -45.304 39.145 1.00 38.70 ? 71 PHE F CE1 1 ATOM 7235 C CE2 . PHE E 2 76 ? -17.315 -44.675 40.498 1.00 41.24 ? 71 PHE F CE2 1 ATOM 7236 C CZ . PHE E 2 76 ? -18.684 -44.883 40.363 1.00 40.77 ? 71 PHE F CZ 1 ATOM 7237 N N . THR E 2 77 ? -15.278 -47.370 34.519 1.00 36.19 ? 72 THR F N 1 ATOM 7238 C CA . THR E 2 77 ? -14.556 -47.619 33.303 1.00 35.97 ? 72 THR F CA 1 ATOM 7239 C C . THR E 2 77 ? -15.178 -46.878 32.127 1.00 34.22 ? 72 THR F C 1 ATOM 7240 O O . THR E 2 77 ? -16.380 -46.763 32.050 1.00 34.20 ? 72 THR F O 1 ATOM 7241 C CB . THR E 2 77 ? -14.575 -49.120 32.990 1.00 37.70 ? 72 THR F CB 1 ATOM 7242 O OG1 . THR E 2 77 ? -14.116 -49.828 34.129 1.00 40.39 ? 72 THR F OG1 1 ATOM 7243 C CG2 . THR E 2 77 ? -13.705 -49.452 31.760 1.00 37.77 ? 72 THR F CG2 1 ATOM 7244 N N . LEU E 2 78 ? -14.343 -46.371 31.229 1.00 33.63 ? 73 LEU F N 1 ATOM 7245 C CA . LEU E 2 78 ? -14.784 -45.893 29.937 1.00 32.86 ? 73 LEU F CA 1 ATOM 7246 C C . LEU E 2 78 ? -14.181 -46.809 28.876 1.00 33.63 ? 73 LEU F C 1 ATOM 7247 O O . LEU E 2 78 ? -12.979 -47.053 28.891 1.00 34.07 ? 73 LEU F O 1 ATOM 7248 C CB . LEU E 2 78 ? -14.326 -44.456 29.706 1.00 32.14 ? 73 LEU F CB 1 ATOM 7249 C CG . LEU E 2 78 ? -14.694 -43.866 28.343 1.00 31.58 ? 73 LEU F CG 1 ATOM 7250 C CD1 . LEU E 2 78 ? -16.193 -43.694 28.205 1.00 31.62 ? 73 LEU F CD1 1 ATOM 7251 C CD2 . LEU E 2 78 ? -14.023 -42.524 28.158 1.00 31.48 ? 73 LEU F CD2 1 ATOM 7252 N N . LYS E 2 79 ? -15.027 -47.356 28.006 1.00 34.08 ? 74 LYS F N 1 ATOM 7253 C CA . LYS E 2 79 ? -14.570 -48.190 26.898 1.00 35.64 ? 74 LYS F CA 1 ATOM 7254 C C . LYS E 2 79 ? -14.844 -47.554 25.544 1.00 34.61 ? 74 LYS F C 1 ATOM 7255 O O . LYS E 2 79 ? -15.850 -46.893 25.342 1.00 33.74 ? 74 LYS F O 1 ATOM 7256 C CB . LYS E 2 79 ? -15.239 -49.563 26.930 1.00 37.91 ? 74 LYS F CB 1 ATOM 7257 C CG . LYS E 2 79 ? -14.778 -50.430 28.075 1.00 40.21 ? 74 LYS F CG 1 ATOM 7258 C CD . LYS E 2 79 ? -15.007 -51.900 27.772 1.00 43.28 ? 74 LYS F CD 1 ATOM 7259 C CE . LYS E 2 79 ? -14.733 -52.742 29.012 1.00 45.90 ? 74 LYS F CE 1 ATOM 7260 N NZ . LYS E 2 79 ? -15.777 -52.540 30.062 1.00 45.83 ? 74 LYS F NZ 1 ATOM 7261 N N . ILE E 2 80 ? -13.917 -47.754 24.627 1.00 34.95 ? 75 ILE F N 1 ATOM 7262 C CA . ILE E 2 80 ? -14.123 -47.418 23.226 1.00 34.78 ? 75 ILE F CA 1 ATOM 7263 C C . ILE E 2 80 ? -13.964 -48.732 22.487 1.00 36.49 ? 75 ILE F C 1 ATOM 7264 O O . ILE E 2 80 ? -12.927 -49.376 22.572 1.00 37.27 ? 75 ILE F O 1 ATOM 7265 C CB . ILE E 2 80 ? -13.113 -46.379 22.733 1.00 33.93 ? 75 ILE F CB 1 ATOM 7266 C CG1 . ILE E 2 80 ? -13.088 -45.188 23.683 1.00 32.63 ? 75 ILE F CG1 1 ATOM 7267 C CG2 . ILE E 2 80 ? -13.484 -45.908 21.338 1.00 34.42 ? 75 ILE F CG2 1 ATOM 7268 C CD1 . ILE E 2 80 ? -11.948 -44.220 23.435 1.00 32.52 ? 75 ILE F CD1 1 ATOM 7269 N N . SER E 2 81 ? -15.009 -49.158 21.799 1.00 37.39 ? 76 SER F N 1 ATOM 7270 C CA . SER E 2 81 ? -15.006 -50.479 21.170 1.00 39.69 ? 76 SER F CA 1 ATOM 7271 C C . SER E 2 81 ? -14.037 -50.557 19.994 1.00 40.49 ? 76 SER F C 1 ATOM 7272 O O . SER E 2 81 ? -13.402 -51.579 19.774 1.00 42.00 ? 76 SER F O 1 ATOM 7273 C CB . SER E 2 81 ? -16.419 -50.887 20.739 1.00 41.10 ? 76 SER F CB 1 ATOM 7274 O OG . SER E 2 81 ? -17.060 -49.979 19.853 1.00 41.35 ? 76 SER F OG 1 ATOM 7275 N N . ARG E 2 82 ? -13.913 -49.461 19.259 1.00 39.70 ? 77 ARG F N 1 ATOM 7276 C CA . ARG E 2 82 ? -13.048 -49.410 18.114 1.00 40.98 ? 77 ARG F CA 1 ATOM 7277 C C . ARG E 2 82 ? -12.655 -47.941 17.973 1.00 39.28 ? 77 ARG F C 1 ATOM 7278 O O . ARG E 2 82 ? -13.498 -47.072 17.772 1.00 38.97 ? 77 ARG F O 1 ATOM 7279 C CB . ARG E 2 82 ? -13.761 -49.963 16.913 1.00 43.45 ? 77 ARG F CB 1 ATOM 7280 C CG . ARG E 2 82 ? -12.816 -50.462 15.838 1.00 46.11 ? 77 ARG F CG 1 ATOM 7281 C CD . ARG E 2 82 ? -13.495 -50.810 14.523 1.00 49.20 ? 77 ARG F CD 1 ATOM 7282 N NE . ARG E 2 82 ? -14.309 -49.673 14.114 1.00 48.80 ? 77 ARG F NE 1 ATOM 7283 C CZ . ARG E 2 82 ? -15.633 -49.675 14.045 1.00 49.60 ? 77 ARG F CZ 1 ATOM 7284 N NH1 . ARG E 2 82 ? -16.343 -50.788 14.247 1.00 51.62 ? 77 ARG F NH1 1 ATOM 7285 N NH2 . ARG E 2 82 ? -16.254 -48.551 13.711 1.00 49.55 ? 77 ARG F NH2 1 ATOM 7286 N N . VAL E 2 83 ? -11.377 -47.661 18.175 1.00 38.64 ? 78 VAL F N 1 ATOM 7287 C CA . VAL E 2 83 ? -10.884 -46.289 18.177 1.00 37.27 ? 78 VAL F CA 1 ATOM 7288 C C . VAL E 2 83 ? -10.775 -45.711 16.775 1.00 38.64 ? 78 VAL F C 1 ATOM 7289 O O . VAL E 2 83 ? -10.283 -46.376 15.860 1.00 40.02 ? 78 VAL F O 1 ATOM 7290 C CB . VAL E 2 83 ? -9.521 -46.202 18.894 1.00 36.70 ? 78 VAL F CB 1 ATOM 7291 C CG1 . VAL E 2 83 ? -8.855 -44.845 18.670 1.00 36.31 ? 78 VAL F CG1 1 ATOM 7292 C CG2 . VAL E 2 83 ? -9.694 -46.458 20.382 1.00 35.52 ? 78 VAL F CG2 1 ATOM 7293 N N . GLU E 2 84 ? -11.244 -44.470 16.634 1.00 38.40 ? 79 GLU F N 1 ATOM 7294 C CA . GLU E 2 84 ? -11.048 -43.666 15.425 1.00 40.26 ? 79 GLU F CA 1 ATOM 7295 C C . GLU E 2 84 ? -10.249 -42.419 15.752 1.00 39.49 ? 79 GLU F C 1 ATOM 7296 O O . GLU E 2 84 ? -10.122 -42.074 16.928 1.00 37.93 ? 79 GLU F O 1 ATOM 7297 C CB . GLU E 2 84 ? -12.393 -43.244 14.854 1.00 41.54 ? 79 GLU F CB 1 ATOM 7298 C CG . GLU E 2 84 ? -13.381 -44.378 14.777 1.00 42.51 ? 79 GLU F CG 1 ATOM 7299 C CD . GLU E 2 84 ? -14.583 -44.065 13.916 1.00 45.04 ? 79 GLU F CD 1 ATOM 7300 O OE1 . GLU E 2 84 ? -14.623 -42.948 13.356 1.00 46.94 ? 79 GLU F OE1 1 ATOM 7301 O OE2 . GLU E 2 84 ? -15.499 -44.915 13.833 1.00 45.82 ? 79 GLU F OE2 1 ATOM 7302 N N . ALA E 2 85 ? -9.749 -41.745 14.710 1.00 41.09 ? 80 ALA F N 1 ATOM 7303 C CA . ALA E 2 85 ? -8.820 -40.615 14.846 1.00 41.10 ? 80 ALA F CA 1 ATOM 7304 C C . ALA E 2 85 ? -9.372 -39.531 15.734 1.00 40.11 ? 80 ALA F C 1 ATOM 7305 O O . ALA E 2 85 ? -8.667 -39.008 16.584 1.00 39.32 ? 80 ALA F O 1 ATOM 7306 C CB . ALA E 2 85 ? -8.500 -40.028 13.479 1.00 43.66 ? 80 ALA F CB 1 ATOM 7307 N N . GLU E 2 86 ? -10.647 -39.225 15.554 1.00 40.79 ? 81 GLU F N 1 ATOM 7308 C CA . GLU E 2 86 ? -11.303 -38.155 16.287 1.00 40.80 ? 81 GLU F CA 1 ATOM 7309 C C . GLU E 2 86 ? -11.424 -38.428 17.789 1.00 38.06 ? 81 GLU F C 1 ATOM 7310 O O . GLU E 2 86 ? -11.753 -37.534 18.533 1.00 37.65 ? 81 GLU F O 1 ATOM 7311 C CB . GLU E 2 86 ? -12.700 -37.906 15.703 1.00 42.92 ? 81 GLU F CB 1 ATOM 7312 C CG . GLU E 2 86 ? -13.670 -39.068 15.936 1.00 42.68 ? 81 GLU F CG 1 ATOM 7313 C CD . GLU E 2 86 ? -14.914 -39.054 15.064 1.00 45.34 ? 81 GLU F CD 1 ATOM 7314 O OE1 . GLU E 2 86 ? -14.823 -39.015 13.799 1.00 48.88 ? 81 GLU F OE1 1 ATOM 7315 O OE2 . GLU E 2 86 ? -15.998 -39.120 15.671 1.00 44.91 ? 81 GLU F OE2 1 ATOM 7316 N N . ASP E 2 87 ? -11.176 -39.660 18.219 1.00 36.79 ? 82 ASP F N 1 ATOM 7317 C CA . ASP E 2 87 ? -11.233 -40.031 19.642 1.00 35.17 ? 82 ASP F CA 1 ATOM 7318 C C . ASP E 2 87 ? -9.942 -39.712 20.419 1.00 34.74 ? 82 ASP F C 1 ATOM 7319 O O . ASP E 2 87 ? -9.901 -39.867 21.643 1.00 33.63 ? 82 ASP F O 1 ATOM 7320 C CB . ASP E 2 87 ? -11.445 -41.524 19.805 1.00 34.90 ? 82 ASP F CB 1 ATOM 7321 C CG . ASP E 2 87 ? -12.633 -42.041 19.073 1.00 36.03 ? 82 ASP F CG 1 ATOM 7322 O OD1 . ASP E 2 87 ? -13.503 -41.245 18.621 1.00 37.01 ? 82 ASP F OD1 1 ATOM 7323 O OD2 . ASP E 2 87 ? -12.686 -43.290 18.971 1.00 36.78 ? 82 ASP F OD2 1 ATOM 7324 N N . LEU E 2 88 ? -8.886 -39.323 19.705 1.00 35.59 ? 83 LEU F N 1 ATOM 7325 C CA . LEU E 2 88 ? -7.612 -39.019 20.338 1.00 35.30 ? 83 LEU F CA 1 ATOM 7326 C C . LEU E 2 88 ? -7.703 -37.698 21.091 1.00 35.34 ? 83 LEU F C 1 ATOM 7327 O O . LEU E 2 88 ? -8.346 -36.752 20.622 1.00 36.22 ? 83 LEU F O 1 ATOM 7328 C CB . LEU E 2 88 ? -6.496 -38.955 19.308 1.00 36.55 ? 83 LEU F CB 1 ATOM 7329 C CG . LEU E 2 88 ? -6.288 -40.172 18.405 1.00 37.04 ? 83 LEU F CG 1 ATOM 7330 C CD1 . LEU E 2 88 ? -5.254 -39.836 17.335 1.00 38.72 ? 83 LEU F CD1 1 ATOM 7331 C CD2 . LEU E 2 88 ? -5.863 -41.392 19.205 1.00 36.40 ? 83 LEU F CD2 1 ATOM 7332 N N . GLY E 2 89 ? -7.066 -37.664 22.263 1.00 34.62 ? 84 GLY F N 1 ATOM 7333 C CA . GLY E 2 89 ? -7.121 -36.514 23.159 1.00 34.98 ? 84 GLY F CA 1 ATOM 7334 C C . GLY E 2 89 ? -6.997 -37.010 24.583 1.00 34.26 ? 84 GLY F C 1 ATOM 7335 O O . GLY E 2 89 ? -6.657 -38.169 24.801 1.00 34.07 ? 84 GLY F O 1 ATOM 7336 N N . VAL E 2 90 ? -7.343 -36.168 25.548 1.00 34.38 ? 85 VAL F N 1 ATOM 7337 C CA . VAL E 2 90 ? -7.221 -36.522 26.954 1.00 34.10 ? 85 VAL F CA 1 ATOM 7338 C C . VAL E 2 90 ? -8.608 -36.746 27.537 1.00 33.21 ? 85 VAL F C 1 ATOM 7339 O O . VAL E 2 90 ? -9.504 -35.911 27.397 1.00 33.51 ? 85 VAL F O 1 ATOM 7340 C CB . VAL E 2 90 ? -6.485 -35.433 27.756 1.00 35.76 ? 85 VAL F CB 1 ATOM 7341 C CG1 . VAL E 2 90 ? -6.222 -35.898 29.179 1.00 36.19 ? 85 VAL F CG1 1 ATOM 7342 C CG2 . VAL E 2 90 ? -5.171 -35.065 27.071 1.00 37.23 ? 85 VAL F CG2 1 ATOM 7343 N N . TYR E 2 91 ? -8.781 -37.895 28.179 1.00 32.47 ? 86 TYR F N 1 ATOM 7344 C CA . TYR E 2 91 ? -10.033 -38.242 28.842 1.00 31.66 ? 86 TYR F CA 1 ATOM 7345 C C . TYR E 2 91 ? -9.941 -37.995 30.351 1.00 32.71 ? 86 TYR F C 1 ATOM 7346 O O . TYR E 2 91 ? -8.916 -38.269 30.947 1.00 33.74 ? 86 TYR F O 1 ATOM 7347 C CB . TYR E 2 91 ? -10.349 -39.710 28.596 1.00 30.67 ? 86 TYR F CB 1 ATOM 7348 C CG . TYR E 2 91 ? -10.690 -40.009 27.162 1.00 29.90 ? 86 TYR F CG 1 ATOM 7349 C CD1 . TYR E 2 91 ? -9.700 -40.162 26.220 1.00 30.16 ? 86 TYR F CD1 1 ATOM 7350 C CD2 . TYR E 2 91 ? -12.011 -40.137 26.757 1.00 29.14 ? 86 TYR F CD2 1 ATOM 7351 C CE1 . TYR E 2 91 ? -10.009 -40.429 24.899 1.00 30.07 ? 86 TYR F CE1 1 ATOM 7352 C CE2 . TYR E 2 91 ? -12.332 -40.394 25.439 1.00 29.08 ? 86 TYR F CE2 1 ATOM 7353 C CZ . TYR E 2 91 ? -11.325 -40.552 24.511 1.00 29.67 ? 86 TYR F CZ 1 ATOM 7354 O OH . TYR E 2 91 ? -11.619 -40.816 23.188 1.00 29.93 ? 86 TYR F OH 1 ATOM 7355 N N . TYR E 2 92 ? -11.003 -37.469 30.947 1.00 32.92 ? 87 TYR F N 1 ATOM 7356 C CA . TYR E 2 92 ? -11.058 -37.198 32.385 1.00 34.52 ? 87 TYR F CA 1 ATOM 7357 C C . TYR E 2 92 ? -12.345 -37.713 32.993 1.00 34.62 ? 87 TYR F C 1 ATOM 7358 O O . TYR E 2 92 ? -13.412 -37.414 32.458 1.00 33.84 ? 87 TYR F O 1 ATOM 7359 C CB . TYR E 2 92 ? -11.039 -35.700 32.644 1.00 35.79 ? 87 TYR F CB 1 ATOM 7360 C CG . TYR E 2 92 ? -9.774 -34.990 32.230 1.00 36.88 ? 87 TYR F CG 1 ATOM 7361 C CD1 . TYR E 2 92 ? -8.678 -34.925 33.091 1.00 38.46 ? 87 TYR F CD1 1 ATOM 7362 C CD2 . TYR E 2 92 ? -9.690 -34.335 31.005 1.00 36.63 ? 87 TYR F CD2 1 ATOM 7363 C CE1 . TYR E 2 92 ? -7.523 -34.238 32.732 1.00 39.89 ? 87 TYR F CE1 1 ATOM 7364 C CE2 . TYR E 2 92 ? -8.547 -33.655 30.634 1.00 37.98 ? 87 TYR F CE2 1 ATOM 7365 C CZ . TYR E 2 92 ? -7.469 -33.611 31.486 1.00 39.53 ? 87 TYR F CZ 1 ATOM 7366 O OH . TYR E 2 92 ? -6.365 -32.923 31.051 1.00 41.11 ? 87 TYR F OH 1 ATOM 7367 N N . CYS E 2 93 ? -12.258 -38.468 34.099 1.00 36.08 ? 88 CYS F N 1 ATOM 7368 C CA . CYS E 2 93 ? -13.449 -38.799 34.892 1.00 36.67 ? 88 CYS F CA 1 ATOM 7369 C C . CYS E 2 93 ? -13.660 -37.671 35.887 1.00 37.34 ? 88 CYS F C 1 ATOM 7370 O O . CYS E 2 93 ? -12.707 -36.990 36.262 1.00 38.44 ? 88 CYS F O 1 ATOM 7371 C CB . CYS E 2 93 ? -13.346 -40.162 35.611 1.00 38.45 ? 88 CYS F CB 1 ATOM 7372 S SG . CYS E 2 93 ? -11.953 -40.372 36.758 1.00 43.64 ? 88 CYS F SG 1 ATOM 7373 N N . PHE E 2 94 ? -14.911 -37.486 36.304 1.00 36.52 ? 89 PHE F N 1 ATOM 7374 C CA . PHE E 2 94 ? -15.309 -36.424 37.234 1.00 37.69 ? 89 PHE F CA 1 ATOM 7375 C C . PHE E 2 94 ? -16.420 -36.959 38.115 1.00 37.83 ? 89 PHE F C 1 ATOM 7376 O O . PHE E 2 94 ? -17.335 -37.598 37.601 1.00 36.43 ? 89 PHE F O 1 ATOM 7377 C CB . PHE E 2 94 ? -15.800 -35.197 36.453 1.00 37.32 ? 89 PHE F CB 1 ATOM 7378 C CG . PHE E 2 94 ? -16.506 -34.164 37.287 1.00 38.88 ? 89 PHE F CG 1 ATOM 7379 C CD1 . PHE E 2 94 ? -15.800 -33.251 38.046 1.00 41.33 ? 89 PHE F CD1 1 ATOM 7380 C CD2 . PHE E 2 94 ? -17.882 -34.087 37.292 1.00 38.76 ? 89 PHE F CD2 1 ATOM 7381 C CE1 . PHE E 2 94 ? -16.452 -32.293 38.817 1.00 43.50 ? 89 PHE F CE1 1 ATOM 7382 C CE2 . PHE E 2 94 ? -18.543 -33.130 38.060 1.00 40.82 ? 89 PHE F CE2 1 ATOM 7383 C CZ . PHE E 2 94 ? -17.822 -32.226 38.821 1.00 43.23 ? 89 PHE F CZ 1 ATOM 7384 N N . GLN E 2 95 ? -16.329 -36.700 39.423 1.00 39.73 ? 90 GLN F N 1 ATOM 7385 C CA . GLN E 2 95 ? -17.379 -37.027 40.361 1.00 40.69 ? 90 GLN F CA 1 ATOM 7386 C C . GLN E 2 95 ? -18.031 -35.745 40.875 1.00 42.41 ? 90 GLN F C 1 ATOM 7387 O O . GLN E 2 95 ? -17.356 -34.803 41.247 1.00 43.76 ? 90 GLN F O 1 ATOM 7388 C CB . GLN E 2 95 ? -16.857 -37.907 41.513 1.00 42.45 ? 90 GLN F CB 1 ATOM 7389 C CG . GLN E 2 95 ? -15.925 -37.239 42.508 1.00 45.27 ? 90 GLN F CG 1 ATOM 7390 C CD . GLN E 2 95 ? -16.622 -36.555 43.671 1.00 47.68 ? 90 GLN F CD 1 ATOM 7391 O OE1 . GLN E 2 95 ? -17.773 -36.810 43.959 1.00 47.64 ? 90 GLN F OE1 1 ATOM 7392 N NE2 . GLN E 2 95 ? -15.901 -35.683 44.357 1.00 50.39 ? 90 GLN F NE2 1 ATOM 7393 N N . GLY E 2 96 ? -19.365 -35.728 40.846 1.00 42.33 ? 91 GLY F N 1 ATOM 7394 C CA . GLY E 2 96 ? -20.167 -34.635 41.393 1.00 44.40 ? 91 GLY F CA 1 ATOM 7395 C C . GLY E 2 96 ? -21.042 -35.099 42.537 1.00 45.88 ? 91 GLY F C 1 ATOM 7396 O O . GLY E 2 96 ? -22.127 -34.574 42.735 1.00 46.74 ? 91 GLY F O 1 ATOM 7397 N N . SER E 2 97 ? -20.556 -36.078 43.291 1.00 46.65 ? 92 SER F N 1 ATOM 7398 C CA . SER E 2 97 ? -21.280 -36.623 44.429 1.00 48.51 ? 92 SER F CA 1 ATOM 7399 C C . SER E 2 97 ? -20.886 -35.910 45.705 1.00 52.25 ? 92 SER F C 1 ATOM 7400 O O . SER E 2 97 ? -21.744 -35.490 46.469 1.00 54.76 ? 92 SER F O 1 ATOM 7401 C CB . SER E 2 97 ? -21.006 -38.123 44.551 1.00 47.84 ? 92 SER F CB 1 ATOM 7402 O OG . SER E 2 97 ? -21.587 -38.667 45.709 1.00 49.69 ? 92 SER F OG 1 ATOM 7403 N N . HIS E 2 98 ? -19.584 -35.747 45.917 1.00 53.57 ? 93 HIS F N 1 ATOM 7404 C CA . HIS E 2 98 ? -19.062 -35.227 47.166 1.00 57.31 ? 93 HIS F CA 1 ATOM 7405 C C . HIS E 2 98 ? -18.326 -33.908 46.939 1.00 58.68 ? 93 HIS F C 1 ATOM 7406 O O . HIS E 2 98 ? -17.341 -33.860 46.199 1.00 57.57 ? 93 HIS F O 1 ATOM 7407 C CB . HIS E 2 98 ? -18.062 -36.206 47.747 1.00 58.53 ? 93 HIS F CB 1 ATOM 7408 C CG . HIS E 2 98 ? -18.598 -37.581 47.982 1.00 57.78 ? 93 HIS F CG 1 ATOM 7409 N ND1 . HIS E 2 98 ? -19.190 -37.958 49.169 1.00 60.50 ? 93 HIS F ND1 1 ATOM 7410 C CD2 . HIS E 2 98 ? -18.572 -38.689 47.204 1.00 55.13 ? 93 HIS F CD2 1 ATOM 7411 C CE1 . HIS E 2 98 ? -19.531 -39.233 49.102 1.00 59.85 ? 93 HIS F CE1 1 ATOM 7412 N NE2 . HIS E 2 98 ? -19.179 -39.696 47.913 1.00 56.69 ? 93 HIS F NE2 1 ATOM 7413 N N . VAL E 2 99 ? -18.793 -32.854 47.596 1.00 61.75 ? 94 VAL F N 1 ATOM 7414 C CA . VAL E 2 99 ? -18.114 -31.559 47.609 1.00 64.21 ? 94 VAL F CA 1 ATOM 7415 C C . VAL E 2 99 ? -16.837 -31.682 48.445 1.00 67.13 ? 94 VAL F C 1 ATOM 7416 O O . VAL E 2 99 ? -16.880 -32.258 49.523 1.00 69.46 ? 94 VAL F O 1 ATOM 7417 C CB . VAL E 2 99 ? -19.015 -30.468 48.237 1.00 67.49 ? 94 VAL F CB 1 ATOM 7418 C CG1 . VAL E 2 99 ? -18.288 -29.130 48.327 1.00 70.66 ? 94 VAL F CG1 1 ATOM 7419 C CG2 . VAL E 2 99 ? -20.309 -30.319 47.444 1.00 65.21 ? 94 VAL F CG2 1 ATOM 7420 N N . PRO E 2 100 ? -15.693 -31.165 47.950 1.00 67.36 ? 95 PRO F N 1 ATOM 7421 C CA . PRO E 2 100 ? -15.453 -30.537 46.650 1.00 65.08 ? 95 PRO F CA 1 ATOM 7422 C C . PRO E 2 100 ? -15.386 -31.582 45.559 1.00 60.51 ? 95 PRO F C 1 ATOM 7423 O O . PRO E 2 100 ? -14.840 -32.665 45.783 1.00 59.93 ? 95 PRO F O 1 ATOM 7424 C CB . PRO E 2 100 ? -14.092 -29.863 46.825 1.00 67.99 ? 95 PRO F CB 1 ATOM 7425 C CG . PRO E 2 100 ? -13.397 -30.667 47.873 1.00 70.18 ? 95 PRO F CG 1 ATOM 7426 C CD . PRO E 2 100 ? -14.479 -31.189 48.783 1.00 70.90 ? 95 PRO F CD 1 ATOM 7427 N N . TYR E 2 101 ? -15.949 -31.258 44.396 1.00 57.82 ? 96 TYR F N 1 ATOM 7428 C CA . TYR E 2 101 ? -15.993 -32.184 43.269 1.00 53.54 ? 96 TYR F CA 1 ATOM 7429 C C . TYR E 2 101 ? -14.609 -32.287 42.642 1.00 52.75 ? 96 TYR F C 1 ATOM 7430 O O . TYR E 2 101 ? -13.788 -31.377 42.775 1.00 54.93 ? 96 TYR F O 1 ATOM 7431 C CB . TYR E 2 101 ? -17.058 -31.746 42.270 1.00 51.69 ? 96 TYR F CB 1 ATOM 7432 C CG . TYR E 2 101 ? -18.435 -31.578 42.905 1.00 52.71 ? 96 TYR F CG 1 ATOM 7433 C CD1 . TYR E 2 101 ? -18.942 -32.530 43.792 1.00 52.84 ? 96 TYR F CD1 1 ATOM 7434 C CD2 . TYR E 2 101 ? -19.235 -30.476 42.611 1.00 53.91 ? 96 TYR F CD2 1 ATOM 7435 C CE1 . TYR E 2 101 ? -20.203 -32.395 44.357 1.00 53.83 ? 96 TYR F CE1 1 ATOM 7436 C CE2 . TYR E 2 101 ? -20.494 -30.327 43.180 1.00 55.00 ? 96 TYR F CE2 1 ATOM 7437 C CZ . TYR E 2 101 ? -20.971 -31.296 44.055 1.00 54.87 ? 96 TYR F CZ 1 ATOM 7438 O OH . TYR E 2 101 ? -22.215 -31.190 44.638 1.00 56.13 ? 96 TYR F OH 1 ATOM 7439 N N . THR E 2 102 ? -14.326 -33.419 42.010 1.00 49.67 ? 97 THR F N 1 ATOM 7440 C CA . THR E 2 102 ? -12.952 -33.722 41.627 1.00 49.37 ? 97 THR F CA 1 ATOM 7441 C C . THR E 2 102 ? -12.837 -34.562 40.379 1.00 45.86 ? 97 THR F C 1 ATOM 7442 O O . THR E 2 102 ? -13.629 -35.496 40.165 1.00 43.83 ? 97 THR F O 1 ATOM 7443 C CB . THR E 2 102 ? -12.207 -34.515 42.712 1.00 51.48 ? 97 THR F CB 1 ATOM 7444 O OG1 . THR E 2 102 ? -13.022 -35.614 43.157 1.00 51.05 ? 97 THR F OG1 1 ATOM 7445 C CG2 . THR E 2 102 ? -11.843 -33.618 43.891 1.00 55.58 ? 97 THR F CG2 1 ATOM 7446 N N . PHE E 2 103 ? -11.770 -34.259 39.634 1.00 45.23 ? 98 PHE F N 1 ATOM 7447 C CA . PHE E 2 103 ? -11.448 -34.868 38.364 1.00 42.31 ? 98 PHE F CA 1 ATOM 7448 C C . PHE E 2 103 ? -10.376 -35.900 38.591 1.00 42.65 ? 98 PHE F C 1 ATOM 7449 O O . PHE E 2 103 ? -9.588 -35.772 39.513 1.00 45.83 ? 98 PHE F O 1 ATOM 7450 C CB . PHE E 2 103 ? -10.864 -33.816 37.422 1.00 42.18 ? 98 PHE F CB 1 ATOM 7451 C CG . PHE E 2 103 ? -11.866 -32.852 36.881 1.00 41.71 ? 98 PHE F CG 1 ATOM 7452 C CD1 . PHE E 2 103 ? -12.610 -33.174 35.771 1.00 39.30 ? 98 PHE F CD1 1 ATOM 7453 C CD2 . PHE E 2 103 ? -12.056 -31.614 37.478 1.00 44.27 ? 98 PHE F CD2 1 ATOM 7454 C CE1 . PHE E 2 103 ? -13.533 -32.284 35.256 1.00 39.57 ? 98 PHE F CE1 1 ATOM 7455 C CE2 . PHE E 2 103 ? -12.972 -30.714 36.969 1.00 44.52 ? 98 PHE F CE2 1 ATOM 7456 C CZ . PHE E 2 103 ? -13.708 -31.047 35.848 1.00 42.18 ? 98 PHE F CZ 1 ATOM 7457 N N . GLY E 2 104 ? -10.321 -36.899 37.729 1.00 40.44 ? 99 GLY F N 1 ATOM 7458 C CA . GLY E 2 104 ? -9.146 -37.731 37.606 1.00 40.88 ? 99 GLY F CA 1 ATOM 7459 C C . GLY E 2 104 ? -8.047 -36.956 36.903 1.00 41.38 ? 99 GLY F C 1 ATOM 7460 O O . GLY E 2 104 ? -8.287 -35.883 36.344 1.00 40.99 ? 99 GLY F O 1 ATOM 7461 N N . GLY E 2 105 ? -6.833 -37.499 36.943 1.00 42.60 ? 100 GLY F N 1 ATOM 7462 C CA . GLY E 2 105 ? -5.650 -36.815 36.431 1.00 43.53 ? 100 GLY F CA 1 ATOM 7463 C C . GLY E 2 105 ? -5.534 -36.786 34.917 1.00 41.51 ? 100 GLY F C 1 ATOM 7464 O O . GLY E 2 105 ? -4.727 -36.045 34.361 1.00 42.01 ? 100 GLY F O 1 ATOM 7465 N N . GLY E 2 106 ? -6.335 -37.584 34.233 1.00 39.36 ? 101 GLY F N 1 ATOM 7466 C CA . GLY E 2 106 ? -6.304 -37.603 32.785 1.00 37.85 ? 101 GLY F CA 1 ATOM 7467 C C . GLY E 2 106 ? -5.645 -38.837 32.218 1.00 37.54 ? 101 GLY F C 1 ATOM 7468 O O . GLY E 2 106 ? -4.660 -39.336 32.749 1.00 38.84 ? 101 GLY F O 1 ATOM 7469 N N . THR E 2 107 ? -6.229 -39.331 31.134 1.00 36.29 ? 102 THR F N 1 ATOM 7470 C CA . THR E 2 107 ? -5.661 -40.409 30.345 1.00 36.33 ? 102 THR F CA 1 ATOM 7471 C C . THR E 2 107 ? -5.560 -39.932 28.899 1.00 35.85 ? 102 THR F C 1 ATOM 7472 O O . THR E 2 107 ? -6.572 -39.639 28.263 1.00 34.27 ? 102 THR F O 1 ATOM 7473 C CB . THR E 2 107 ? -6.516 -41.689 30.392 1.00 35.46 ? 102 THR F CB 1 ATOM 7474 O OG1 . THR E 2 107 ? -6.510 -42.210 31.721 1.00 36.89 ? 102 THR F OG1 1 ATOM 7475 C CG2 . THR E 2 107 ? -5.948 -42.758 29.457 1.00 35.59 ? 102 THR F CG2 1 ATOM 7476 N N . LYS E 2 108 ? -4.330 -39.869 28.405 1.00 37.24 ? 103 LYS F N 1 ATOM 7477 C CA . LYS E 2 108 ? -4.042 -39.395 27.064 1.00 37.67 ? 103 LYS F CA 1 ATOM 7478 C C . LYS E 2 108 ? -4.102 -40.574 26.095 1.00 36.44 ? 103 LYS F C 1 ATOM 7479 O O . LYS E 2 108 ? -3.358 -41.545 26.223 1.00 36.82 ? 103 LYS F O 1 ATOM 7480 C CB . LYS E 2 108 ? -2.662 -38.749 27.045 1.00 40.20 ? 103 LYS F CB 1 ATOM 7481 C CG . LYS E 2 108 ? -2.395 -37.943 25.791 1.00 41.87 ? 103 LYS F CG 1 ATOM 7482 C CD . LYS E 2 108 ? -1.399 -36.813 26.050 1.00 44.94 ? 103 LYS F CD 1 ATOM 7483 C CE . LYS E 2 108 ? -1.266 -35.935 24.820 1.00 46.20 ? 103 LYS F CE 1 ATOM 7484 N NZ . LYS E 2 108 ? -0.662 -36.696 23.687 1.00 46.98 ? 103 LYS F NZ 1 ATOM 7485 N N . LEU E 2 109 ? -5.042 -40.510 25.166 1.00 35.10 ? 104 LEU F N 1 ATOM 7486 C CA . LEU E 2 109 ? -5.181 -41.552 24.164 1.00 34.61 ? 104 LEU F CA 1 ATOM 7487 C C . LEU E 2 109 ? -4.377 -41.141 22.952 1.00 34.80 ? 104 LEU F C 1 ATOM 7488 O O . LEU E 2 109 ? -4.680 -40.131 22.338 1.00 34.76 ? 104 LEU F O 1 ATOM 7489 C CB . LEU E 2 109 ? -6.645 -41.747 23.803 1.00 33.61 ? 104 LEU F CB 1 ATOM 7490 C CG . LEU E 2 109 ? -6.971 -43.005 22.999 1.00 34.15 ? 104 LEU F CG 1 ATOM 7491 C CD1 . LEU E 2 109 ? -6.807 -44.254 23.845 1.00 34.69 ? 104 LEU F CD1 1 ATOM 7492 C CD2 . LEU E 2 109 ? -8.396 -42.946 22.449 1.00 33.60 ? 104 LEU F CD2 1 ATOM 7493 N N . GLU E 2 110 ? -3.362 -41.938 22.615 1.00 64.64 ? 105 GLU F N 1 ATOM 7494 C CA . GLU E 2 110 ? -2.389 -41.569 21.606 1.00 58.19 ? 105 GLU F CA 1 ATOM 7495 C C . GLU E 2 110 ? -2.222 -42.661 20.588 1.00 51.67 ? 105 GLU F C 1 ATOM 7496 O O . GLU E 2 110 ? -2.596 -43.800 20.844 1.00 51.51 ? 105 GLU F O 1 ATOM 7497 C CB . GLU E 2 110 ? -1.035 -41.339 22.264 1.00 55.81 ? 105 GLU F CB 1 ATOM 7498 C CG . GLU E 2 110 ? -0.979 -40.143 23.195 1.00 63.77 ? 105 GLU F CG 1 ATOM 7499 C CD . GLU E 2 110 ? 0.262 -40.131 24.092 1.00 62.46 ? 105 GLU F CD 1 ATOM 7500 O OE1 . GLU E 2 110 ? 0.930 -41.189 24.236 1.00 56.29 ? 105 GLU F OE1 1 ATOM 7501 O OE2 . GLU E 2 110 ? 0.560 -39.054 24.659 1.00 69.31 ? 105 GLU F OE2 1 ATOM 7502 N N . LEU E 2 111 ? -1.617 -42.304 19.455 1.00 48.50 ? 106 LEU F N 1 ATOM 7503 C CA . LEU E 2 111 ? -1.369 -43.235 18.365 1.00 45.21 ? 106 LEU F CA 1 ATOM 7504 C C . LEU E 2 111 ? -0.130 -44.057 18.630 1.00 41.16 ? 106 LEU F C 1 ATOM 7505 O O . LEU E 2 111 ? 0.840 -43.560 19.205 1.00 39.58 ? 106 LEU F O 1 ATOM 7506 C CB . LEU E 2 111 ? -1.201 -42.504 17.026 1.00 46.78 ? 106 LEU F CB 1 ATOM 7507 C CG . LEU E 2 111 ? -2.242 -42.650 15.918 1.00 50.52 ? 106 LEU F CG 1 ATOM 7508 C CD1 . LEU E 2 111 ? -3.547 -43.307 16.357 1.00 52.51 ? 106 LEU F CD1 1 ATOM 7509 C CD2 . LEU E 2 111 ? -2.515 -41.318 15.222 1.00 56.27 ? 106 LEU F CD2 1 ATOM 7510 N N . LYS E 2 112 ? -0.182 -45.311 18.185 1.00 41.35 ? 107 LYS F N 1 ATOM 7511 C CA . LYS E 2 112 ? 0.913 -46.250 18.301 1.00 40.57 ? 107 LYS F CA 1 ATOM 7512 C C . LYS E 2 112 ? 1.693 -46.260 16.975 1.00 41.35 ? 107 LYS F C 1 ATOM 7513 O O . LYS E 2 112 ? 1.120 -46.116 15.896 1.00 43.66 ? 107 LYS F O 1 ATOM 7514 C CB . LYS E 2 112 ? 0.356 -47.643 18.615 1.00 45.05 ? 107 LYS F CB 1 ATOM 7515 C CG . LYS E 2 112 ? 1.092 -48.530 19.604 1.00 47.27 ? 107 LYS F CG 1 ATOM 7516 C CD . LYS E 2 112 ? 0.156 -49.669 19.953 1.00 54.55 ? 107 LYS F CD 1 ATOM 7517 C CE . LYS E 2 112 ? 0.849 -50.761 20.742 1.00 60.71 ? 107 LYS F CE 1 ATOM 7518 N NZ . LYS E 2 112 ? -0.127 -51.816 21.140 1.00 70.45 ? 107 LYS F NZ 1 ATOM 7519 N N . ARG E 2 113 ? 3.015 -46.371 17.111 1.00 40.69 ? 108 ARG F N 1 ATOM 7520 C CA . ARG E 2 113 ? 4.014 -46.533 16.074 1.00 43.73 ? 108 ARG F CA 1 ATOM 7521 C C . ARG E 2 113 ? 5.027 -47.593 16.410 1.00 46.85 ? 108 ARG F C 1 ATOM 7522 O O . ARG E 2 113 ? 5.179 -47.976 17.578 1.00 45.55 ? 108 ARG F O 1 ATOM 7523 C CB . ARG E 2 113 ? 4.990 -45.409 16.182 1.00 41.71 ? 108 ARG F CB 1 ATOM 7524 C CG . ARG E 2 113 ? 4.549 -44.029 15.892 1.00 41.35 ? 108 ARG F CG 1 ATOM 7525 C CD . ARG E 2 113 ? 5.823 -43.285 15.526 1.00 43.54 ? 108 ARG F CD 1 ATOM 7526 N NE . ARG E 2 113 ? 6.949 -44.065 14.940 1.00 47.19 ? 108 ARG F NE 1 ATOM 7527 C CZ . ARG E 2 113 ? 7.400 -43.949 13.687 1.00 54.02 ? 108 ARG F CZ 1 ATOM 7528 N NH1 . ARG E 2 113 ? 6.855 -43.099 12.814 1.00 57.94 ? 108 ARG F NH1 1 ATOM 7529 N NH2 . ARG E 2 113 ? 8.429 -44.690 13.303 1.00 59.13 ? 108 ARG F NH2 1 ATOM 7530 N N . ALA E 2 114 ? 5.852 -47.907 15.412 1.00 52.37 ? 109 ALA F N 1 ATOM 7531 C CA . ALA E 2 114 ? 7.149 -48.504 15.666 1.00 56.36 ? 109 ALA F CA 1 ATOM 7532 C C . ALA E 2 114 ? 8.020 -47.559 16.507 1.00 50.56 ? 109 ALA F C 1 ATOM 7533 O O . ALA E 2 114 ? 8.046 -46.338 16.312 1.00 46.75 ? 109 ALA F O 1 ATOM 7534 C CB . ALA E 2 114 ? 7.859 -48.822 14.363 1.00 65.58 ? 109 ALA F CB 1 ATOM 7535 N N . ASP E 2 115 ? 8.750 -48.159 17.430 1.00 51.82 ? 110 ASP F N 1 ATOM 7536 C CA . ASP E 2 115 ? 9.744 -47.445 18.191 1.00 48.71 ? 110 ASP F CA 1 ATOM 7537 C C . ASP E 2 115 ? 10.801 -46.819 17.278 1.00 51.95 ? 110 ASP F C 1 ATOM 7538 O O . ASP E 2 115 ? 11.215 -47.435 16.299 1.00 59.67 ? 110 ASP F O 1 ATOM 7539 C CB . ASP E 2 115 ? 10.421 -48.392 19.184 1.00 52.39 ? 110 ASP F CB 1 ATOM 7540 C CG . ASP E 2 115 ? 9.543 -48.728 20.367 1.00 50.28 ? 110 ASP F CG 1 ATOM 7541 O OD1 . ASP E 2 115 ? 8.455 -48.126 20.516 1.00 45.41 ? 110 ASP F OD1 1 ATOM 7542 O OD2 . ASP E 2 115 ? 9.961 -49.580 21.170 1.00 55.35 ? 110 ASP F OD2 1 ATOM 7543 N N . ALA E 2 116 ? 11.219 -45.597 17.617 1.00 35.21 ? 111 ALA F N 1 ATOM 7544 C CA . ALA E 2 116 ? 12.192 -44.834 16.829 1.00 35.55 ? 111 ALA F CA 1 ATOM 7545 C C . ALA E 2 116 ? 13.140 -44.088 17.752 1.00 33.91 ? 111 ALA F C 1 ATOM 7546 O O . ALA E 2 116 ? 12.714 -43.498 18.743 1.00 31.72 ? 111 ALA F O 1 ATOM 7547 C CB . ALA E 2 116 ? 11.489 -43.846 15.915 1.00 34.85 ? 111 ALA F CB 1 ATOM 7548 N N . ALA E 2 117 ? 14.423 -44.131 17.427 1.00 35.46 ? 112 ALA F N 1 ATOM 7549 C CA . ALA E 2 117 ? 15.435 -43.450 18.204 1.00 34.45 ? 112 ALA F CA 1 ATOM 7550 C C . ALA E 2 117 ? 15.449 -41.962 17.863 1.00 32.60 ? 112 ALA F C 1 ATOM 7551 O O . ALA E 2 117 ? 15.180 -41.584 16.719 1.00 33.27 ? 112 ALA F O 1 ATOM 7552 C CB . ALA E 2 117 ? 16.804 -44.057 17.941 1.00 37.39 ? 112 ALA F CB 1 ATOM 7553 N N . PRO E 2 118 ? 15.753 -41.112 18.860 1.00 30.70 ? 113 PRO F N 1 ATOM 7554 C CA . PRO E 2 118 ? 15.826 -39.678 18.610 1.00 29.46 ? 113 PRO F CA 1 ATOM 7555 C C . PRO E 2 118 ? 17.029 -39.330 17.777 1.00 31.14 ? 113 PRO F C 1 ATOM 7556 O O . PRO E 2 118 ? 18.075 -39.953 17.905 1.00 33.08 ? 113 PRO F O 1 ATOM 7557 C CB . PRO E 2 118 ? 15.942 -39.066 20.016 1.00 27.46 ? 113 PRO F CB 1 ATOM 7558 C CG . PRO E 2 118 ? 16.483 -40.159 20.866 1.00 28.48 ? 113 PRO F CG 1 ATOM 7559 C CD . PRO E 2 118 ? 15.957 -41.446 20.278 1.00 30.22 ? 113 PRO F CD 1 ATOM 7560 N N . THR E 2 119 ? 16.849 -38.376 16.884 1.00 31.44 ? 114 THR F N 1 ATOM 7561 C CA . THR E 2 119 ? 17.946 -37.770 16.163 1.00 33.05 ? 114 THR F CA 1 ATOM 7562 C C . THR E 2 119 ? 18.385 -36.619 17.051 1.00 30.99 ? 114 THR F C 1 ATOM 7563 O O . THR E 2 119 ? 17.608 -35.715 17.315 1.00 29.50 ? 114 THR F O 1 ATOM 7564 C CB . THR E 2 119 ? 17.469 -37.282 14.787 1.00 34.89 ? 114 THR F CB 1 ATOM 7565 O OG1 . THR E 2 119 ? 16.934 -38.397 14.081 1.00 36.86 ? 114 THR F OG1 1 ATOM 7566 C CG2 . THR E 2 119 ? 18.587 -36.701 13.973 1.00 37.17 ? 114 THR F CG2 1 ATOM 7567 N N . VAL E 2 120 ? 19.620 -36.681 17.540 1.00 31.44 ? 115 VAL F N 1 ATOM 7568 C CA . VAL E 2 120 ? 20.142 -35.687 18.480 1.00 29.60 ? 115 VAL F CA 1 ATOM 7569 C C . VAL E 2 120 ? 21.114 -34.726 17.797 1.00 30.66 ? 115 VAL F C 1 ATOM 7570 O O . VAL E 2 120 ? 21.988 -35.137 17.057 1.00 33.15 ? 115 VAL F O 1 ATOM 7571 C CB . VAL E 2 120 ? 20.835 -36.357 19.687 1.00 29.36 ? 115 VAL F CB 1 ATOM 7572 C CG1 . VAL E 2 120 ? 21.146 -35.336 20.773 1.00 27.64 ? 115 VAL F CG1 1 ATOM 7573 C CG2 . VAL E 2 120 ? 19.954 -37.458 20.259 1.00 29.11 ? 115 VAL F CG2 1 ATOM 7574 N N . SER E 2 121 ? 20.942 -33.438 18.072 1.00 29.38 ? 116 SER F N 1 ATOM 7575 C CA . SER E 2 121 ? 21.806 -32.383 17.553 1.00 30.38 ? 116 SER F CA 1 ATOM 7576 C C . SER E 2 121 ? 22.071 -31.379 18.666 1.00 28.32 ? 116 SER F C 1 ATOM 7577 O O . SER E 2 121 ? 21.163 -30.992 19.410 1.00 26.54 ? 116 SER F O 1 ATOM 7578 C CB . SER E 2 121 ? 21.125 -31.658 16.406 1.00 32.08 ? 116 SER F CB 1 ATOM 7579 O OG . SER E 2 121 ? 20.632 -32.571 15.444 1.00 34.11 ? 116 SER F OG 1 ATOM 7580 N N . ILE E 2 122 ? 23.325 -30.973 18.780 1.00 28.63 ? 117 ILE F N 1 ATOM 7581 C CA . ILE E 2 122 ? 23.745 -30.024 19.794 1.00 27.17 ? 117 ILE F CA 1 ATOM 7582 C C . ILE E 2 122 ? 24.277 -28.757 19.135 1.00 28.40 ? 117 ILE F C 1 ATOM 7583 O O . ILE E 2 122 ? 24.930 -28.822 18.128 1.00 30.36 ? 117 ILE F O 1 ATOM 7584 C CB . ILE E 2 122 ? 24.805 -30.641 20.724 1.00 26.99 ? 117 ILE F CB 1 ATOM 7585 C CG1 . ILE E 2 122 ? 25.029 -29.747 21.942 1.00 25.70 ? 117 ILE F CG1 1 ATOM 7586 C CG2 . ILE E 2 122 ? 26.116 -30.913 19.986 1.00 29.39 ? 117 ILE F CG2 1 ATOM 7587 C CD1 . ILE E 2 122 ? 25.686 -30.480 23.084 1.00 25.55 ? 117 ILE F CD1 1 ATOM 7588 N N . PHE E 2 123 ? 23.980 -27.605 19.722 1.00 27.65 ? 118 PHE F N 1 ATOM 7589 C CA . PHE E 2 123 ? 24.302 -26.308 19.112 1.00 29.36 ? 118 PHE F CA 1 ATOM 7590 C C . PHE E 2 123 ? 24.941 -25.412 20.146 1.00 28.76 ? 118 PHE F C 1 ATOM 7591 O O . PHE E 2 123 ? 24.307 -25.072 21.145 1.00 27.26 ? 118 PHE F O 1 ATOM 7592 C CB . PHE E 2 123 ? 23.053 -25.635 18.546 1.00 30.17 ? 118 PHE F CB 1 ATOM 7593 C CG . PHE E 2 123 ? 22.417 -26.413 17.449 1.00 31.30 ? 118 PHE F CG 1 ATOM 7594 C CD1 . PHE E 2 123 ? 21.523 -27.431 17.740 1.00 29.66 ? 118 PHE F CD1 1 ATOM 7595 C CD2 . PHE E 2 123 ? 22.758 -26.179 16.128 1.00 34.37 ? 118 PHE F CD2 1 ATOM 7596 C CE1 . PHE E 2 123 ? 20.955 -28.182 16.724 1.00 30.95 ? 118 PHE F CE1 1 ATOM 7597 C CE2 . PHE E 2 123 ? 22.196 -26.919 15.109 1.00 35.96 ? 118 PHE F CE2 1 ATOM 7598 C CZ . PHE E 2 123 ? 21.288 -27.921 15.405 1.00 34.13 ? 118 PHE F CZ 1 ATOM 7599 N N . PRO E 2 124 ? 26.210 -25.036 19.918 1.00 30.28 ? 119 PRO F N 1 ATOM 7600 C CA . PRO E 2 124 ? 26.852 -24.067 20.797 1.00 30.15 ? 119 PRO F CA 1 ATOM 7601 C C . PRO E 2 124 ? 26.186 -22.720 20.671 1.00 31.35 ? 119 PRO F C 1 ATOM 7602 O O . PRO E 2 124 ? 25.519 -22.465 19.679 1.00 32.75 ? 119 PRO F O 1 ATOM 7603 C CB . PRO E 2 124 ? 28.271 -23.955 20.245 1.00 32.11 ? 119 PRO F CB 1 ATOM 7604 C CG . PRO E 2 124 ? 28.452 -25.128 19.355 1.00 33.09 ? 119 PRO F CG 1 ATOM 7605 C CD . PRO E 2 124 ? 27.099 -25.469 18.830 1.00 32.55 ? 119 PRO F CD 1 ATOM 7606 N N . PRO E 2 125 ? 26.384 -21.849 21.661 1.00 31.38 ? 120 PRO F N 1 ATOM 7607 C CA . PRO E 2 125 ? 25.813 -20.509 21.605 1.00 33.25 ? 120 PRO F CA 1 ATOM 7608 C C . PRO E 2 125 ? 26.221 -19.778 20.359 1.00 36.30 ? 120 PRO F C 1 ATOM 7609 O O . PRO E 2 125 ? 27.362 -19.908 19.947 1.00 37.19 ? 120 PRO F O 1 ATOM 7610 C CB . PRO E 2 125 ? 26.430 -19.809 22.811 1.00 33.05 ? 120 PRO F CB 1 ATOM 7611 C CG . PRO E 2 125 ? 26.852 -20.889 23.727 1.00 30.79 ? 120 PRO F CG 1 ATOM 7612 C CD . PRO E 2 125 ? 27.205 -22.055 22.862 1.00 30.24 ? 120 PRO F CD 1 ATOM 7613 N N . SER E 2 126 ? 25.309 -19.015 19.763 1.00 38.70 ? 121 SER F N 1 ATOM 7614 C CA . SER E 2 126 ? 25.653 -18.190 18.611 1.00 42.62 ? 121 SER F CA 1 ATOM 7615 C C . SER E 2 126 ? 26.558 -17.029 19.035 1.00 44.26 ? 121 SER F C 1 ATOM 7616 O O . SER E 2 126 ? 26.512 -16.563 20.171 1.00 43.09 ? 121 SER F O 1 ATOM 7617 C CB . SER E 2 126 ? 24.392 -17.630 17.952 1.00 45.29 ? 121 SER F CB 1 ATOM 7618 O OG . SER E 2 126 ? 23.894 -16.504 18.653 1.00 46.72 ? 121 SER F OG 1 ATOM 7619 N N . SER E 2 127 ? 27.371 -16.559 18.106 1.00 47.50 ? 122 SER F N 1 ATOM 7620 C CA . SER E 2 127 ? 28.264 -15.433 18.383 1.00 49.69 ? 122 SER F CA 1 ATOM 7621 C C . SER E 2 127 ? 27.483 -14.144 18.662 1.00 52.18 ? 122 SER F C 1 ATOM 7622 O O . SER E 2 127 ? 27.927 -13.321 19.452 1.00 52.62 ? 122 SER F O 1 ATOM 7623 C CB . SER E 2 127 ? 29.234 -15.234 17.227 1.00 53.17 ? 122 SER F CB 1 ATOM 7624 O OG . SER E 2 127 ? 28.518 -15.196 16.010 1.00 56.51 ? 122 SER F OG 1 ATOM 7625 N N . GLU E 2 128 ? 26.319 -13.979 18.037 1.00 54.29 ? 123 GLU F N 1 ATOM 7626 C CA . GLU E 2 128 ? 25.451 -12.841 18.348 1.00 57.24 ? 123 GLU F CA 1 ATOM 7627 C C . GLU E 2 128 ? 25.025 -12.885 19.815 1.00 54.24 ? 123 GLU F C 1 ATOM 7628 O O . GLU E 2 128 ? 25.036 -11.858 20.492 1.00 56.34 ? 123 GLU F O 1 ATOM 7629 C CB . GLU E 2 128 ? 24.191 -12.802 17.467 1.00 60.17 ? 123 GLU F CB 1 ATOM 7630 C CG . GLU E 2 128 ? 24.421 -12.597 15.974 1.00 64.58 ? 123 GLU F CG 1 ATOM 7631 C CD . GLU E 2 128 ? 24.102 -13.832 15.136 1.00 63.46 ? 123 GLU F CD 1 ATOM 7632 O OE1 . GLU E 2 128 ? 24.495 -14.972 15.523 1.00 59.12 ? 123 GLU F OE1 1 ATOM 7633 O OE2 . GLU E 2 128 ? 23.428 -13.654 14.088 1.00 67.45 ? 123 GLU F OE2 1 ATOM 7634 N N . GLN E 2 129 ? 24.664 -14.068 20.307 1.00 49.85 ? 124 GLN F N 1 ATOM 7635 C CA . GLN E 2 129 ? 24.223 -14.187 21.696 1.00 47.64 ? 124 GLN F CA 1 ATOM 7636 C C . GLN E 2 129 ? 25.385 -13.879 22.632 1.00 46.74 ? 124 GLN F C 1 ATOM 7637 O O . GLN E 2 129 ? 25.237 -13.110 23.591 1.00 47.89 ? 124 GLN F O 1 ATOM 7638 C CB . GLN E 2 129 ? 23.616 -15.565 22.005 1.00 43.62 ? 124 GLN F CB 1 ATOM 7639 C CG . GLN E 2 129 ? 22.868 -15.581 23.332 1.00 42.65 ? 124 GLN F CG 1 ATOM 7640 C CD . GLN E 2 129 ? 22.390 -16.955 23.786 1.00 39.04 ? 124 GLN F CD 1 ATOM 7641 O OE1 . GLN E 2 129 ? 22.817 -18.002 23.284 1.00 36.57 ? 124 GLN F OE1 1 ATOM 7642 N NE2 . GLN E 2 129 ? 21.499 -16.949 24.763 1.00 39.19 ? 124 GLN F NE2 1 ATOM 7643 N N . LEU E 2 130 ? 26.540 -14.466 22.327 1.00 45.28 ? 125 LEU F N 1 ATOM 7644 C CA . LEU E 2 130 ? 27.763 -14.240 23.102 1.00 44.83 ? 125 LEU F CA 1 ATOM 7645 C C . LEU E 2 130 ? 28.122 -12.775 23.213 1.00 48.47 ? 125 LEU F C 1 ATOM 7646 O O . LEU E 2 130 ? 28.562 -12.354 24.267 1.00 48.48 ? 125 LEU F O 1 ATOM 7647 C CB . LEU E 2 130 ? 28.937 -15.025 22.517 1.00 43.54 ? 125 LEU F CB 1 ATOM 7648 C CG . LEU E 2 130 ? 28.805 -16.540 22.700 1.00 40.22 ? 125 LEU F CG 1 ATOM 7649 C CD1 . LEU E 2 130 ? 29.822 -17.267 21.831 1.00 40.34 ? 125 LEU F CD1 1 ATOM 7650 C CD2 . LEU E 2 130 ? 28.957 -16.937 24.162 1.00 37.92 ? 125 LEU F CD2 1 ATOM 7651 N N . THR E 2 131 ? 27.904 -12.004 22.146 1.00 52.26 ? 126 THR F N 1 ATOM 7652 C CA . THR E 2 131 ? 28.100 -10.551 22.164 1.00 56.81 ? 126 THR F CA 1 ATOM 7653 C C . THR E 2 131 ? 27.267 -9.887 23.258 1.00 58.26 ? 126 THR F C 1 ATOM 7654 O O . THR E 2 131 ? 27.714 -8.949 23.890 1.00 60.55 ? 126 THR F O 1 ATOM 7655 C CB . THR E 2 131 ? 27.752 -9.911 20.802 1.00 61.21 ? 126 THR F CB 1 ATOM 7656 O OG1 . THR E 2 131 ? 28.624 -10.419 19.786 1.00 61.07 ? 126 THR F OG1 1 ATOM 7657 C CG2 . THR E 2 131 ? 27.909 -8.391 20.839 1.00 66.34 ? 126 THR F CG2 1 ATOM 7658 N N . SER E 2 132 ? 26.065 -10.386 23.490 1.00 57.67 ? 127 SER F N 1 ATOM 7659 C CA . SER E 2 132 ? 25.196 -9.841 24.531 1.00 59.78 ? 127 SER F CA 1 ATOM 7660 C C . SER E 2 132 ? 25.543 -10.293 25.942 1.00 57.35 ? 127 SER F C 1 ATOM 7661 O O . SER E 2 132 ? 25.001 -9.768 26.905 1.00 59.49 ? 127 SER F O 1 ATOM 7662 C CB . SER E 2 132 ? 23.751 -10.187 24.210 1.00 60.44 ? 127 SER F CB 1 ATOM 7663 O OG . SER E 2 132 ? 23.424 -9.552 22.990 1.00 64.53 ? 127 SER F OG 1 ATOM 7664 N N . GLY E 2 133 ? 26.441 -11.259 26.070 1.00 53.77 ? 128 GLY F N 1 ATOM 7665 C CA . GLY E 2 133 ? 26.851 -11.746 27.380 1.00 52.04 ? 128 GLY F CA 1 ATOM 7666 C C . GLY E 2 133 ? 26.076 -12.957 27.847 1.00 49.42 ? 128 GLY F C 1 ATOM 7667 O O . GLY E 2 133 ? 26.244 -13.382 28.983 1.00 49.24 ? 128 GLY F O 1 ATOM 7668 N N . GLY E 2 134 ? 25.223 -13.511 26.992 1.00 48.24 ? 129 GLY F N 1 ATOM 7669 C CA . GLY E 2 134 ? 24.473 -14.730 27.324 1.00 45.50 ? 129 GLY F CA 1 ATOM 7670 C C . GLY E 2 134 ? 24.977 -15.944 26.565 1.00 42.08 ? 129 GLY F C 1 ATOM 7671 O O . GLY E 2 134 ? 25.564 -15.821 25.487 1.00 42.49 ? 129 GLY F O 1 ATOM 7672 N N . ALA E 2 135 ? 24.753 -17.132 27.116 1.00 39.29 ? 130 ALA F N 1 ATOM 7673 C CA . ALA E 2 135 ? 25.216 -18.348 26.453 1.00 36.37 ? 130 ALA F CA 1 ATOM 7674 C C . ALA E 2 135 ? 24.210 -19.489 26.598 1.00 34.52 ? 130 ALA F C 1 ATOM 7675 O O . ALA E 2 135 ? 24.101 -20.101 27.655 1.00 34.09 ? 130 ALA F O 1 ATOM 7676 C CB . ALA E 2 135 ? 26.576 -18.762 26.990 1.00 35.20 ? 130 ALA F CB 1 ATOM 7677 N N . SER E 2 136 ? 23.476 -19.768 25.527 1.00 34.00 ? 131 SER F N 1 ATOM 7678 C CA . SER E 2 136 ? 22.516 -20.854 25.517 1.00 32.29 ? 131 SER F CA 1 ATOM 7679 C C . SER E 2 136 ? 23.042 -21.997 24.657 1.00 30.38 ? 131 SER F C 1 ATOM 7680 O O . SER E 2 136 ? 23.420 -21.798 23.511 1.00 30.95 ? 131 SER F O 1 ATOM 7681 C CB . SER E 2 136 ? 21.167 -20.383 24.969 1.00 33.85 ? 131 SER F CB 1 ATOM 7682 O OG . SER E 2 136 ? 20.528 -19.438 25.809 1.00 36.20 ? 131 SER F OG 1 ATOM 7683 N N . VAL E 2 137 ? 23.057 -23.192 25.225 1.00 28.67 ? 132 VAL F N 1 ATOM 7684 C CA . VAL E 2 137 ? 23.394 -24.393 24.499 1.00 27.77 ? 132 VAL F CA 1 ATOM 7685 C C . VAL E 2 137 ? 22.105 -25.179 24.291 1.00 27.58 ? 132 VAL F C 1 ATOM 7686 O O . VAL E 2 137 ? 21.372 -25.494 25.246 1.00 26.95 ? 132 VAL F O 1 ATOM 7687 C CB . VAL E 2 137 ? 24.392 -25.260 25.261 1.00 26.90 ? 132 VAL F CB 1 ATOM 7688 C CG1 . VAL E 2 137 ? 25.025 -26.286 24.329 1.00 26.75 ? 132 VAL F CG1 1 ATOM 7689 C CG2 . VAL E 2 137 ? 25.462 -24.383 25.904 1.00 27.78 ? 132 VAL F CG2 1 ATOM 7690 N N . VAL E 2 138 ? 21.841 -25.493 23.032 1.00 28.31 ? 133 VAL F N 1 ATOM 7691 C CA . VAL E 2 138 ? 20.577 -26.070 22.631 1.00 28.38 ? 133 VAL F CA 1 ATOM 7692 C C . VAL E 2 138 ? 20.802 -27.466 22.107 1.00 28.37 ? 133 VAL F C 1 ATOM 7693 O O . VAL E 2 138 ? 21.730 -27.712 21.328 1.00 28.81 ? 133 VAL F O 1 ATOM 7694 C CB . VAL E 2 138 ? 19.926 -25.227 21.530 1.00 30.03 ? 133 VAL F CB 1 ATOM 7695 C CG1 . VAL E 2 138 ? 18.711 -25.934 20.954 1.00 30.07 ? 133 VAL F CG1 1 ATOM 7696 C CG2 . VAL E 2 138 ? 19.546 -23.865 22.079 1.00 31.47 ? 133 VAL F CG2 1 ATOM 7697 N N . CYS E 2 139 ? 19.944 -28.375 22.549 1.00 28.63 ? 134 CYS F N 1 ATOM 7698 C CA . CYS E 2 139 ? 19.960 -29.747 22.083 1.00 29.52 ? 134 CYS F CA 1 ATOM 7699 C C . CYS E 2 139 ? 18.581 -30.131 21.561 1.00 28.96 ? 134 CYS F C 1 ATOM 7700 O O . CYS E 2 139 ? 17.575 -29.952 22.255 1.00 28.57 ? 134 CYS F O 1 ATOM 7701 C CB . CYS E 2 139 ? 20.321 -30.657 23.230 1.00 30.56 ? 134 CYS F CB 1 ATOM 7702 S SG . CYS E 2 139 ? 20.906 -32.255 22.682 1.00 34.26 ? 134 CYS F SG 1 ATOM 7703 N N . PHE E 2 140 ? 18.526 -30.620 20.329 1.00 29.07 ? 135 PHE F N 1 ATOM 7704 C CA . PHE E 2 140 ? 17.292 -31.117 19.767 1.00 28.70 ? 135 PHE F CA 1 ATOM 7705 C C . PHE E 2 140 ? 17.354 -32.629 19.797 1.00 27.92 ? 135 PHE F C 1 ATOM 7706 O O . PHE E 2 140 ? 18.374 -33.235 19.488 1.00 27.99 ? 135 PHE F O 1 ATOM 7707 C CB . PHE E 2 140 ? 17.093 -30.648 18.318 1.00 30.83 ? 135 PHE F CB 1 ATOM 7708 C CG . PHE E 2 140 ? 16.850 -29.175 18.166 1.00 32.26 ? 135 PHE F CG 1 ATOM 7709 C CD1 . PHE E 2 140 ? 16.040 -28.479 19.049 1.00 32.05 ? 135 PHE F CD1 1 ATOM 7710 C CD2 . PHE E 2 140 ? 17.403 -28.484 17.103 1.00 34.95 ? 135 PHE F CD2 1 ATOM 7711 C CE1 . PHE E 2 140 ? 15.809 -27.120 18.887 1.00 33.96 ? 135 PHE F CE1 1 ATOM 7712 C CE2 . PHE E 2 140 ? 17.181 -27.119 16.936 1.00 36.99 ? 135 PHE F CE2 1 ATOM 7713 C CZ . PHE E 2 140 ? 16.374 -26.439 17.830 1.00 36.41 ? 135 PHE F CZ 1 ATOM 7714 N N . LEU E 2 141 ? 16.232 -33.226 20.164 1.00 27.13 ? 136 LEU F N 1 ATOM 7715 C CA . LEU E 2 141 ? 16.054 -34.661 20.108 1.00 27.27 ? 136 LEU F CA 1 ATOM 7716 C C . LEU E 2 141 ? 14.775 -34.903 19.325 1.00 27.52 ? 136 LEU F C 1 ATOM 7717 O O . LEU E 2 141 ? 13.680 -34.719 19.844 1.00 27.15 ? 136 LEU F O 1 ATOM 7718 C CB . LEU E 2 141 ? 15.954 -35.226 21.520 1.00 26.79 ? 136 LEU F CB 1 ATOM 7719 C CG . LEU E 2 141 ? 17.106 -34.794 22.439 1.00 26.62 ? 136 LEU F CG 1 ATOM 7720 C CD1 . LEU E 2 141 ? 16.839 -33.458 23.116 1.00 25.93 ? 136 LEU F CD1 1 ATOM 7721 C CD2 . LEU E 2 141 ? 17.311 -35.863 23.501 1.00 27.34 ? 136 LEU F CD2 1 ATOM 7722 N N . ASN E 2 142 ? 14.912 -35.279 18.066 1.00 28.55 ? 137 ASN F N 1 ATOM 7723 C CA . ASN E 2 142 ? 13.789 -35.235 17.157 1.00 29.46 ? 137 ASN F CA 1 ATOM 7724 C C . ASN E 2 142 ? 13.320 -36.583 16.644 1.00 30.09 ? 137 ASN F C 1 ATOM 7725 O O . ASN E 2 142 ? 14.115 -37.490 16.396 1.00 30.94 ? 137 ASN F O 1 ATOM 7726 C CB . ASN E 2 142 ? 14.124 -34.303 15.990 1.00 31.39 ? 137 ASN F CB 1 ATOM 7727 C CG . ASN E 2 142 ? 14.230 -32.864 16.434 1.00 31.07 ? 137 ASN F CG 1 ATOM 7728 O OD1 . ASN E 2 142 ? 13.788 -32.523 17.534 1.00 29.63 ? 137 ASN F OD1 1 ATOM 7729 N ND2 . ASN E 2 142 ? 14.797 -32.006 15.589 1.00 32.96 ? 137 ASN F ND2 1 ATOM 7730 N N . ASN E 2 143 ? 12.002 -36.683 16.492 1.00 29.85 ? 138 ASN F N 1 ATOM 7731 C CA . ASN E 2 143 ? 11.355 -37.826 15.864 1.00 30.69 ? 138 ASN F CA 1 ATOM 7732 C C . ASN E 2 143 ? 11.642 -39.159 16.526 1.00 29.98 ? 138 ASN F C 1 ATOM 7733 O O . ASN E 2 143 ? 12.116 -40.094 15.894 1.00 31.66 ? 138 ASN F O 1 ATOM 7734 C CB . ASN E 2 143 ? 11.698 -37.849 14.382 1.00 33.37 ? 138 ASN F CB 1 ATOM 7735 C CG . ASN E 2 143 ? 11.372 -36.530 13.728 1.00 34.54 ? 138 ASN F CG 1 ATOM 7736 O OD1 . ASN E 2 143 ? 12.207 -35.651 13.649 1.00 34.73 ? 138 ASN F OD1 1 ATOM 7737 N ND2 . ASN E 2 143 ? 10.117 -36.351 13.351 1.00 35.58 ? 138 ASN F ND2 1 ATOM 7738 N N . PHE E 2 144 ? 11.325 -39.229 17.813 1.00 27.99 ? 139 PHE F N 1 ATOM 7739 C CA . PHE E 2 144 ? 11.455 -40.461 18.571 1.00 27.86 ? 139 PHE F CA 1 ATOM 7740 C C . PHE E 2 144 ? 10.101 -41.030 18.983 1.00 27.70 ? 139 PHE F C 1 ATOM 7741 O O . PHE E 2 144 ? 9.081 -40.356 18.946 1.00 27.05 ? 139 PHE F O 1 ATOM 7742 C CB . PHE E 2 144 ? 12.360 -40.251 19.790 1.00 26.86 ? 139 PHE F CB 1 ATOM 7743 C CG . PHE E 2 144 ? 11.892 -39.177 20.744 1.00 25.40 ? 139 PHE F CG 1 ATOM 7744 C CD1 . PHE E 2 144 ? 11.077 -39.497 21.807 1.00 25.40 ? 139 PHE F CD1 1 ATOM 7745 C CD2 . PHE E 2 144 ? 12.314 -37.849 20.600 1.00 24.63 ? 139 PHE F CD2 1 ATOM 7746 C CE1 . PHE E 2 144 ? 10.669 -38.510 22.704 1.00 25.07 ? 139 PHE F CE1 1 ATOM 7747 C CE2 . PHE E 2 144 ? 11.904 -36.870 21.476 1.00 23.84 ? 139 PHE F CE2 1 ATOM 7748 C CZ . PHE E 2 144 ? 11.087 -37.191 22.535 1.00 24.16 ? 139 PHE F CZ 1 ATOM 7749 N N . TYR E 2 145 ? 10.125 -42.294 19.375 1.00 28.62 ? 140 TYR F N 1 ATOM 7750 C CA . TYR E 2 145 ? 8.958 -42.992 19.863 1.00 29.19 ? 140 TYR F CA 1 ATOM 7751 C C . TYR E 2 145 ? 9.373 -44.248 20.640 1.00 30.75 ? 140 TYR F C 1 ATOM 7752 O O . TYR E 2 145 ? 10.182 -45.041 20.154 1.00 32.18 ? 140 TYR F O 1 ATOM 7753 C CB . TYR E 2 145 ? 8.024 -43.389 18.707 1.00 30.17 ? 140 TYR F CB 1 ATOM 7754 C CG . TYR E 2 145 ? 6.719 -43.897 19.238 1.00 30.56 ? 140 TYR F CG 1 ATOM 7755 C CD1 . TYR E 2 145 ? 6.578 -45.225 19.635 1.00 32.18 ? 140 TYR F CD1 1 ATOM 7756 C CD2 . TYR E 2 145 ? 5.641 -43.037 19.424 1.00 29.92 ? 140 TYR F CD2 1 ATOM 7757 C CE1 . TYR E 2 145 ? 5.378 -45.695 20.166 1.00 32.80 ? 140 TYR F CE1 1 ATOM 7758 C CE2 . TYR E 2 145 ? 4.437 -43.486 19.952 1.00 30.77 ? 140 TYR F CE2 1 ATOM 7759 C CZ . TYR E 2 145 ? 4.313 -44.822 20.323 1.00 32.05 ? 140 TYR F CZ 1 ATOM 7760 O OH . TYR E 2 145 ? 3.147 -45.299 20.852 1.00 33.13 ? 140 TYR F OH 1 ATOM 7761 N N . PRO E 2 146 ? 8.782 -44.474 21.827 1.00 31.34 ? 141 PRO F N 1 ATOM 7762 C CA . PRO E 2 146 ? 7.704 -43.731 22.461 1.00 30.99 ? 141 PRO F CA 1 ATOM 7763 C C . PRO E 2 146 ? 8.147 -42.398 23.067 1.00 30.13 ? 141 PRO F C 1 ATOM 7764 O O . PRO E 2 146 ? 9.311 -42.040 23.012 1.00 29.42 ? 141 PRO F O 1 ATOM 7765 C CB . PRO E 2 146 ? 7.210 -44.688 23.558 1.00 32.59 ? 141 PRO F CB 1 ATOM 7766 C CG . PRO E 2 146 ? 8.391 -45.487 23.912 1.00 33.70 ? 141 PRO F CG 1 ATOM 7767 C CD . PRO E 2 146 ? 9.219 -45.606 22.663 1.00 33.34 ? 141 PRO F CD 1 ATOM 7768 N N . LYS E 2 147 ? 7.186 -41.692 23.637 1.00 31.07 ? 142 LYS F N 1 ATOM 7769 C CA . LYS E 2 147 ? 7.376 -40.337 24.109 1.00 31.50 ? 142 LYS F CA 1 ATOM 7770 C C . LYS E 2 147 ? 8.259 -40.212 25.369 1.00 32.38 ? 142 LYS F C 1 ATOM 7771 O O . LYS E 2 147 ? 8.771 -39.139 25.639 1.00 31.25 ? 142 LYS F O 1 ATOM 7772 C CB . LYS E 2 147 ? 6.005 -39.711 24.366 1.00 33.08 ? 142 LYS F CB 1 ATOM 7773 C CG . LYS E 2 147 ? 5.873 -38.909 25.644 1.00 34.84 ? 142 LYS F CG 1 ATOM 7774 C CD . LYS E 2 147 ? 4.415 -38.582 25.941 1.00 37.29 ? 142 LYS F CD 1 ATOM 7775 C CE . LYS E 2 147 ? 3.637 -39.823 26.357 1.00 39.07 ? 142 LYS F CE 1 ATOM 7776 N NZ . LYS E 2 147 ? 2.447 -39.426 27.147 1.00 42.23 ? 142 LYS F NZ 1 ATOM 7777 N N . ASP E 2 148 ? 8.391 -41.291 26.146 1.00 34.62 ? 143 ASP F N 1 ATOM 7778 C CA . ASP E 2 148 ? 9.220 -41.273 27.349 1.00 36.07 ? 143 ASP F CA 1 ATOM 7779 C C . ASP E 2 148 ? 10.671 -41.087 26.940 1.00 34.57 ? 143 ASP F C 1 ATOM 7780 O O . ASP E 2 148 ? 11.194 -41.840 26.124 1.00 34.55 ? 143 ASP F O 1 ATOM 7781 C CB . ASP E 2 148 ? 9.080 -42.576 28.135 1.00 39.42 ? 143 ASP F CB 1 ATOM 7782 C CG . ASP E 2 148 ? 7.645 -42.977 28.326 1.00 41.74 ? 143 ASP F CG 1 ATOM 7783 O OD1 . ASP E 2 148 ? 7.022 -42.454 29.285 1.00 43.89 ? 143 ASP F OD1 1 ATOM 7784 O OD2 . ASP E 2 148 ? 7.150 -43.815 27.511 1.00 42.13 ? 143 ASP F OD2 1 ATOM 7785 N N . ILE E 2 149 ? 11.311 -40.069 27.487 1.00 33.57 ? 144 ILE F N 1 ATOM 7786 C CA . ILE E 2 149 ? 12.719 -39.831 27.207 1.00 32.66 ? 144 ILE F CA 1 ATOM 7787 C C . ILE E 2 149 ? 13.401 -39.076 28.332 1.00 33.22 ? 144 ILE F C 1 ATOM 7788 O O . ILE E 2 149 ? 12.781 -38.311 29.044 1.00 33.16 ? 144 ILE F O 1 ATOM 7789 C CB . ILE E 2 149 ? 12.914 -39.072 25.872 1.00 30.52 ? 144 ILE F CB 1 ATOM 7790 C CG1 . ILE E 2 149 ? 14.337 -39.268 25.355 1.00 30.09 ? 144 ILE F CG1 1 ATOM 7791 C CG2 . ILE E 2 149 ? 12.593 -37.590 26.019 1.00 29.46 ? 144 ILE F CG2 1 ATOM 7792 C CD1 . ILE E 2 149 ? 14.483 -39.018 23.879 1.00 29.08 ? 144 ILE F CD1 1 ATOM 7793 N N . ASN E 2 150 ? 14.690 -39.319 28.492 1.00 34.60 ? 145 ASN F N 1 ATOM 7794 C CA . ASN E 2 150 ? 15.466 -38.602 29.460 1.00 36.00 ? 145 ASN F CA 1 ATOM 7795 C C . ASN E 2 150 ? 16.669 -37.923 28.863 1.00 34.49 ? 145 ASN F C 1 ATOM 7796 O O . ASN E 2 150 ? 17.431 -38.542 28.122 1.00 34.70 ? 145 ASN F O 1 ATOM 7797 C CB . ASN E 2 150 ? 15.937 -39.536 30.539 1.00 39.84 ? 145 ASN F CB 1 ATOM 7798 C CG . ASN E 2 150 ? 16.324 -38.780 31.765 1.00 42.35 ? 145 ASN F CG 1 ATOM 7799 O OD1 . ASN E 2 150 ? 15.447 -38.305 32.489 1.00 45.17 ? 145 ASN F OD1 1 ATOM 7800 N ND2 . ASN E 2 150 ? 17.624 -38.603 31.987 1.00 43.21 ? 145 ASN F ND2 1 ATOM 7801 N N . VAL E 2 151 ? 16.840 -36.651 29.203 1.00 33.58 ? 146 VAL F N 1 ATOM 7802 C CA . VAL E 2 151 ? 17.987 -35.887 28.767 1.00 32.49 ? 146 VAL F CA 1 ATOM 7803 C C . VAL E 2 151 ? 18.831 -35.486 29.955 1.00 33.81 ? 146 VAL F C 1 ATOM 7804 O O . VAL E 2 151 ? 18.307 -35.106 31.005 1.00 34.81 ? 146 VAL F O 1 ATOM 7805 C CB . VAL E 2 151 ? 17.573 -34.611 28.047 1.00 31.37 ? 146 VAL F CB 1 ATOM 7806 C CG1 . VAL E 2 151 ? 18.799 -33.872 27.539 1.00 30.87 ? 146 VAL F CG1 1 ATOM 7807 C CG2 . VAL E 2 151 ? 16.667 -34.957 26.884 1.00 31.27 ? 146 VAL F CG2 1 ATOM 7808 N N . LYS E 2 152 ? 20.146 -35.558 29.764 1.00 33.83 ? 147 LYS F N 1 ATOM 7809 C CA . LYS E 2 152 ? 21.106 -35.232 30.807 1.00 35.32 ? 147 LYS F CA 1 ATOM 7810 C C . LYS E 2 152 ? 22.243 -34.407 30.227 1.00 33.00 ? 147 LYS F C 1 ATOM 7811 O O . LYS E 2 152 ? 22.877 -34.813 29.263 1.00 32.10 ? 147 LYS F O 1 ATOM 7812 C CB . LYS E 2 152 ? 21.663 -36.516 31.395 1.00 38.74 ? 147 LYS F CB 1 ATOM 7813 C CG . LYS E 2 152 ? 22.499 -36.317 32.640 1.00 42.23 ? 147 LYS F CG 1 ATOM 7814 C CD . LYS E 2 152 ? 22.608 -37.619 33.426 1.00 46.84 ? 147 LYS F CD 1 ATOM 7815 C CE . LYS E 2 152 ? 23.068 -38.773 32.547 1.00 48.06 ? 147 LYS F CE 1 ATOM 7816 N NZ . LYS E 2 152 ? 23.511 -39.943 33.351 1.00 53.20 ? 147 LYS F NZ 1 ATOM 7817 N N . TRP E 2 153 ? 22.495 -33.252 30.820 1.00 32.14 ? 148 TRP F N 1 ATOM 7818 C CA . TRP E 2 153 ? 23.611 -32.411 30.404 1.00 31.02 ? 148 TRP F CA 1 ATOM 7819 C C . TRP E 2 153 ? 24.852 -32.766 31.210 1.00 32.92 ? 148 TRP F C 1 ATOM 7820 O O . TRP E 2 153 ? 24.760 -33.074 32.395 1.00 35.26 ? 148 TRP F O 1 ATOM 7821 C CB . TRP E 2 153 ? 23.262 -30.930 30.569 1.00 29.97 ? 148 TRP F CB 1 ATOM 7822 C CG . TRP E 2 153 ? 22.331 -30.437 29.518 1.00 28.01 ? 148 TRP F CG 1 ATOM 7823 C CD1 . TRP E 2 153 ? 20.976 -30.421 29.573 1.00 27.67 ? 148 TRP F CD1 1 ATOM 7824 C CD2 . TRP E 2 153 ? 22.691 -29.870 28.250 1.00 26.77 ? 148 TRP F CD2 1 ATOM 7825 N NE1 . TRP E 2 153 ? 20.457 -29.880 28.414 1.00 26.50 ? 148 TRP F NE1 1 ATOM 7826 C CE2 . TRP E 2 153 ? 21.489 -29.534 27.584 1.00 26.13 ? 148 TRP F CE2 1 ATOM 7827 C CE3 . TRP E 2 153 ? 23.906 -29.600 27.620 1.00 26.68 ? 148 TRP F CE3 1 ATOM 7828 C CZ2 . TRP E 2 153 ? 21.471 -28.958 26.310 1.00 25.53 ? 148 TRP F CZ2 1 ATOM 7829 C CZ3 . TRP E 2 153 ? 23.888 -29.029 26.362 1.00 26.18 ? 148 TRP F CZ3 1 ATOM 7830 C CH2 . TRP E 2 153 ? 22.677 -28.710 25.719 1.00 25.73 ? 148 TRP F CH2 1 ATOM 7831 N N . LYS E 2 154 ? 26.007 -32.753 30.552 1.00 32.75 ? 149 LYS F N 1 ATOM 7832 C CA . LYS E 2 154 ? 27.293 -32.861 31.231 1.00 34.84 ? 149 LYS F CA 1 ATOM 7833 C C . LYS E 2 154 ? 28.235 -31.756 30.790 1.00 33.92 ? 149 LYS F C 1 ATOM 7834 O O . LYS E 2 154 ? 28.324 -31.434 29.606 1.00 32.56 ? 149 LYS F O 1 ATOM 7835 C CB . LYS E 2 154 ? 27.946 -34.216 30.984 1.00 37.09 ? 149 LYS F CB 1 ATOM 7836 C CG . LYS E 2 154 ? 27.200 -35.361 31.642 1.00 38.99 ? 149 LYS F CG 1 ATOM 7837 C CD . LYS E 2 154 ? 27.997 -36.648 31.604 1.00 42.40 ? 149 LYS F CD 1 ATOM 7838 C CE . LYS E 2 154 ? 27.141 -37.797 32.103 1.00 44.49 ? 149 LYS F CE 1 ATOM 7839 N NZ . LYS E 2 154 ? 27.775 -39.133 31.886 1.00 48.15 ? 149 LYS F NZ 1 ATOM 7840 N N . ILE E 2 155 ? 28.952 -31.202 31.760 1.00 34.95 ? 150 ILE F N 1 ATOM 7841 C CA . ILE E 2 155 ? 29.884 -30.125 31.522 1.00 34.63 ? 150 ILE F CA 1 ATOM 7842 C C . ILE E 2 155 ? 31.221 -30.582 32.085 1.00 37.20 ? 150 ILE F C 1 ATOM 7843 O O . ILE E 2 155 ? 31.344 -30.829 33.290 1.00 38.95 ? 150 ILE F O 1 ATOM 7844 C CB . ILE E 2 155 ? 29.418 -28.823 32.184 1.00 34.16 ? 150 ILE F CB 1 ATOM 7845 C CG1 . ILE E 2 155 ? 28.157 -28.324 31.483 1.00 32.18 ? 150 ILE F CG1 1 ATOM 7846 C CG2 . ILE E 2 155 ? 30.502 -27.764 32.105 1.00 34.53 ? 150 ILE F CG2 1 ATOM 7847 C CD1 . ILE E 2 155 ? 27.500 -27.156 32.186 1.00 32.67 ? 150 ILE F CD1 1 ATOM 7848 N N . ASP E 2 156 ? 32.196 -30.730 31.190 1.00 37.71 ? 151 ASP F N 1 ATOM 7849 C CA . ASP E 2 156 ? 33.486 -31.296 31.530 1.00 40.97 ? 151 ASP F CA 1 ATOM 7850 C C . ASP E 2 156 ? 33.283 -32.509 32.413 1.00 43.51 ? 151 ASP F C 1 ATOM 7851 O O . ASP E 2 156 ? 33.877 -32.602 33.476 1.00 46.16 ? 151 ASP F O 1 ATOM 7852 C CB . ASP E 2 156 ? 34.360 -30.248 32.219 1.00 41.89 ? 151 ASP F CB 1 ATOM 7853 C CG . ASP E 2 156 ? 34.790 -29.154 31.277 1.00 40.65 ? 151 ASP F CG 1 ATOM 7854 O OD1 . ASP E 2 156 ? 35.029 -29.470 30.094 1.00 40.67 ? 151 ASP F OD1 1 ATOM 7855 O OD2 . ASP E 2 156 ? 34.910 -27.975 31.700 1.00 40.67 ? 151 ASP F OD2 1 ATOM 7856 N N . GLY E 2 157 ? 32.405 -33.413 31.981 1.00 43.12 ? 152 GLY F N 1 ATOM 7857 C CA . GLY E 2 157 ? 32.183 -34.670 32.687 1.00 46.24 ? 152 GLY F CA 1 ATOM 7858 C C . GLY E 2 157 ? 31.220 -34.652 33.858 1.00 46.85 ? 152 GLY F C 1 ATOM 7859 O O . GLY E 2 157 ? 30.803 -35.709 34.300 1.00 49.22 ? 152 GLY F O 1 ATOM 7860 N N . SER E 2 158 ? 30.849 -33.476 34.356 1.00 45.75 ? 153 SER F N 1 ATOM 7861 C CA . SER E 2 158 ? 29.933 -33.370 35.498 1.00 47.21 ? 153 SER F CA 1 ATOM 7862 C C . SER E 2 158 ? 28.512 -33.076 35.066 1.00 44.74 ? 153 SER F C 1 ATOM 7863 O O . SER E 2 158 ? 28.272 -32.162 34.290 1.00 41.39 ? 153 SER F O 1 ATOM 7864 C CB . SER E 2 158 ? 30.360 -32.262 36.446 1.00 48.26 ? 153 SER F CB 1 ATOM 7865 O OG . SER E 2 158 ? 31.554 -32.630 37.085 1.00 52.00 ? 153 SER F OG 1 ATOM 7866 N N . GLU E 2 159 ? 27.570 -33.827 35.624 1.00 47.18 ? 154 GLU F N 1 ATOM 7867 C CA . GLU E 2 159 ? 26.158 -33.611 35.356 1.00 45.83 ? 154 GLU F CA 1 ATOM 7868 C C . GLU E 2 159 ? 25.796 -32.187 35.768 1.00 45.64 ? 154 GLU F C 1 ATOM 7869 O O . GLU E 2 159 ? 26.364 -31.642 36.706 1.00 47.26 ? 154 GLU F O 1 ATOM 7870 C CB . GLU E 2 159 ? 25.300 -34.619 36.117 1.00 48.64 ? 154 GLU F CB 1 ATOM 7871 C CG . GLU E 2 159 ? 23.931 -34.833 35.503 1.00 47.01 ? 154 GLU F CG 1 ATOM 7872 C CD . GLU E 2 159 ? 23.001 -35.655 36.399 1.00 50.64 ? 154 GLU F CD 1 ATOM 7873 O OE1 . GLU E 2 159 ? 21.882 -36.008 35.943 1.00 49.85 ? 154 GLU F OE1 1 ATOM 7874 O OE2 . GLU E 2 159 ? 23.390 -35.980 37.551 1.00 54.81 ? 154 GLU F OE2 1 ATOM 7875 N N . ARG E 2 160 ? 24.863 -31.593 35.040 1.00 44.17 ? 155 ARG F N 1 ATOM 7876 C CA . ARG E 2 160 ? 24.450 -30.228 35.283 1.00 45.12 ? 155 ARG F CA 1 ATOM 7877 C C . ARG E 2 160 ? 22.933 -30.165 35.155 1.00 45.45 ? 155 ARG F C 1 ATOM 7878 O O . ARG E 2 160 ? 22.382 -30.625 34.145 1.00 43.43 ? 155 ARG F O 1 ATOM 7879 C CB . ARG E 2 160 ? 25.128 -29.322 34.265 1.00 43.63 ? 155 ARG F CB 1 ATOM 7880 C CG . ARG E 2 160 ? 24.663 -27.879 34.263 1.00 44.16 ? 155 ARG F CG 1 ATOM 7881 C CD . ARG E 2 160 ? 25.061 -27.145 35.517 1.00 47.56 ? 155 ARG F CD 1 ATOM 7882 N NE . ARG E 2 160 ? 24.663 -25.743 35.405 1.00 48.75 ? 155 ARG F NE 1 ATOM 7883 C CZ . ARG E 2 160 ? 25.484 -24.694 35.417 1.00 50.11 ? 155 ARG F CZ 1 ATOM 7884 N NH1 . ARG E 2 160 ? 24.974 -23.472 35.296 1.00 50.78 ? 155 ARG F NH1 1 ATOM 7885 N NH2 . ARG E 2 160 ? 26.804 -24.846 35.557 1.00 51.30 ? 155 ARG F NH2 1 ATOM 7886 N N . GLN E 2 161 ? 22.269 -29.614 36.179 1.00 48.71 ? 156 GLN F N 1 ATOM 7887 C CA . GLN E 2 161 ? 20.809 -29.509 36.222 1.00 49.82 ? 156 GLN F CA 1 ATOM 7888 C C . GLN E 2 161 ? 20.284 -28.077 36.186 1.00 49.63 ? 156 GLN F C 1 ATOM 7889 O O . GLN E 2 161 ? 19.355 -27.777 35.448 1.00 49.53 ? 156 GLN F O 1 ATOM 7890 C CB . GLN E 2 161 ? 20.277 -30.234 37.451 1.00 54.31 ? 156 GLN F CB 1 ATOM 7891 C CG . GLN E 2 161 ? 19.927 -31.682 37.176 1.00 54.84 ? 156 GLN F CG 1 ATOM 7892 C CD . GLN E 2 161 ? 20.221 -32.555 38.374 1.00 60.57 ? 156 GLN F CD 1 ATOM 7893 O OE1 . GLN E 2 161 ? 19.470 -32.601 39.367 1.00 64.14 ? 156 GLN F OE1 1 ATOM 7894 N NE2 . GLN E 2 161 ? 21.338 -33.252 38.294 1.00 61.52 ? 156 GLN F NE2 1 ATOM 7895 N N . ASN E 2 162 ? 20.863 -27.191 36.973 1.00 51.24 ? 157 ASN F N 1 ATOM 7896 C CA . ASN E 2 162 ? 20.403 -25.817 37.000 1.00 52.03 ? 157 ASN F CA 1 ATOM 7897 C C . ASN E 2 162 ? 20.646 -25.071 35.669 1.00 48.23 ? 157 ASN F C 1 ATOM 7898 O O . ASN E 2 162 ? 21.723 -25.161 35.068 1.00 45.38 ? 157 ASN F O 1 ATOM 7899 C CB . ASN E 2 162 ? 21.055 -25.116 38.198 1.00 56.10 ? 157 ASN F CB 1 ATOM 7900 C CG . ASN E 2 162 ? 20.827 -23.618 38.219 1.00 58.35 ? 157 ASN F CG 1 ATOM 7901 O OD1 . ASN E 2 162 ? 21.448 -22.866 37.458 1.00 56.40 ? 157 ASN F OD1 1 ATOM 7902 N ND2 . ASN E 2 162 ? 19.970 -23.169 39.136 1.00 62.82 ? 157 ASN F ND2 1 ATOM 7903 N N . GLY E 2 163 ? 19.626 -24.344 35.215 1.00 47.81 ? 158 GLY F N 1 ATOM 7904 C CA . GLY E 2 163 ? 19.688 -23.609 33.953 1.00 45.25 ? 158 GLY F CA 1 ATOM 7905 C C . GLY E 2 163 ? 19.207 -24.430 32.769 1.00 41.78 ? 158 GLY F C 1 ATOM 7906 O O . GLY E 2 163 ? 19.341 -24.006 31.614 1.00 39.55 ? 158 GLY F O 1 ATOM 7907 N N . VAL E 2 164 ? 18.646 -25.606 33.054 1.00 40.92 ? 159 VAL F N 1 ATOM 7908 C CA . VAL E 2 164 ? 18.129 -26.476 31.997 1.00 38.29 ? 159 VAL F CA 1 ATOM 7909 C C . VAL E 2 164 ? 16.631 -26.248 31.842 1.00 39.34 ? 159 VAL F C 1 ATOM 7910 O O . VAL E 2 164 ? 15.900 -26.187 32.834 1.00 42.64 ? 159 VAL F O 1 ATOM 7911 C CB . VAL E 2 164 ? 18.375 -27.970 32.299 1.00 37.42 ? 159 VAL F CB 1 ATOM 7912 C CG1 . VAL E 2 164 ? 17.814 -28.844 31.183 1.00 35.46 ? 159 VAL F CG1 1 ATOM 7913 C CG2 . VAL E 2 164 ? 19.858 -28.243 32.482 1.00 37.01 ? 159 VAL F CG2 1 ATOM 7914 N N . LEU E 2 165 ? 16.174 -26.128 30.601 1.00 37.26 ? 160 LEU F N 1 ATOM 7915 C CA . LEU E 2 165 ? 14.751 -25.999 30.312 1.00 37.88 ? 160 LEU F CA 1 ATOM 7916 C C . LEU E 2 165 ? 14.406 -26.892 29.135 1.00 35.15 ? 160 LEU F C 1 ATOM 7917 O O . LEU E 2 165 ? 15.043 -26.839 28.084 1.00 33.07 ? 160 LEU F O 1 ATOM 7918 C CB . LEU E 2 165 ? 14.379 -24.539 30.017 1.00 39.88 ? 160 LEU F CB 1 ATOM 7919 C CG . LEU E 2 165 ? 14.407 -23.595 31.227 1.00 43.20 ? 160 LEU F CG 1 ATOM 7920 C CD1 . LEU E 2 165 ? 14.232 -22.150 30.781 1.00 45.65 ? 160 LEU F CD1 1 ATOM 7921 C CD2 . LEU E 2 165 ? 13.356 -23.947 32.274 1.00 45.96 ? 160 LEU F CD2 1 ATOM 7922 N N . ASN E 2 166 ? 13.393 -27.722 29.333 1.00 35.33 ? 161 ASN F N 1 ATOM 7923 C CA . ASN E 2 166 ? 12.947 -28.653 28.323 1.00 33.46 ? 161 ASN F CA 1 ATOM 7924 C C . ASN E 2 166 ? 11.573 -28.276 27.788 1.00 34.55 ? 161 ASN F C 1 ATOM 7925 O O . ASN E 2 166 ? 10.773 -27.619 28.461 1.00 36.77 ? 161 ASN F O 1 ATOM 7926 C CB . ASN E 2 166 ? 12.920 -30.067 28.886 1.00 33.16 ? 161 ASN F CB 1 ATOM 7927 C CG . ASN E 2 166 ? 14.304 -30.581 29.246 1.00 32.43 ? 161 ASN F CG 1 ATOM 7928 O OD1 . ASN E 2 166 ? 15.297 -30.144 28.694 1.00 31.42 ? 161 ASN F OD1 1 ATOM 7929 N ND2 . ASN E 2 166 ? 14.365 -31.524 30.166 1.00 33.44 ? 161 ASN F ND2 1 ATOM 7930 N N . SER E 2 167 ? 11.321 -28.689 26.554 1.00 32.85 ? 162 SER F N 1 ATOM 7931 C CA . SER E 2 167 ? 10.058 -28.424 25.908 1.00 34.24 ? 162 SER F CA 1 ATOM 7932 C C . SER E 2 167 ? 9.750 -29.585 24.984 1.00 32.49 ? 162 SER F C 1 ATOM 7933 O O . SER E 2 167 ? 10.562 -29.967 24.156 1.00 30.77 ? 162 SER F O 1 ATOM 7934 C CB . SER E 2 167 ? 10.123 -27.107 25.133 1.00 35.44 ? 162 SER F CB 1 ATOM 7935 O OG . SER E 2 167 ? 8.830 -26.731 24.683 1.00 38.27 ? 162 SER F OG 1 ATOM 7936 N N . TRP E 2 168 ? 8.570 -30.150 25.131 1.00 33.81 ? 163 TRP F N 1 ATOM 7937 C CA . TRP E 2 168 ? 8.183 -31.319 24.363 1.00 32.96 ? 163 TRP F CA 1 ATOM 7938 C C . TRP E 2 168 ? 7.112 -30.931 23.347 1.00 34.08 ? 163 TRP F C 1 ATOM 7939 O O . TRP E 2 168 ? 6.208 -30.137 23.586 1.00 36.38 ? 163 TRP F O 1 ATOM 7940 C CB . TRP E 2 168 ? 7.668 -32.430 25.291 1.00 33.69 ? 163 TRP F CB 1 ATOM 7941 C CG . TRP E 2 168 ? 8.635 -32.837 26.367 1.00 33.57 ? 163 TRP F CG 1 ATOM 7942 C CD1 . TRP E 2 168 ? 9.476 -33.911 26.342 1.00 32.77 ? 163 TRP F CD1 1 ATOM 7943 C CD2 . TRP E 2 168 ? 8.854 -32.183 27.628 1.00 35.57 ? 163 TRP F CD2 1 ATOM 7944 N NE1 . TRP E 2 168 ? 10.219 -33.966 27.511 1.00 33.74 ? 163 TRP F NE1 1 ATOM 7945 C CE2 . TRP E 2 168 ? 9.856 -32.917 28.315 1.00 34.92 ? 163 TRP F CE2 1 ATOM 7946 C CE3 . TRP E 2 168 ? 8.293 -31.049 28.253 1.00 38.18 ? 163 TRP F CE3 1 ATOM 7947 C CZ2 . TRP E 2 168 ? 10.333 -32.546 29.588 1.00 36.59 ? 163 TRP F CZ2 1 ATOM 7948 C CZ3 . TRP E 2 168 ? 8.766 -30.683 29.540 1.00 39.73 ? 163 TRP F CZ3 1 ATOM 7949 C CH2 . TRP E 2 168 ? 9.775 -31.431 30.186 1.00 38.80 ? 163 TRP F CH2 1 ATOM 7950 N N . THR E 2 169 ? 7.222 -31.535 22.204 1.00 33.21 ? 164 THR F N 1 ATOM 7951 C CA . THR E 2 169 ? 6.290 -31.318 21.132 1.00 35.03 ? 164 THR F CA 1 ATOM 7952 C C . THR E 2 169 ? 5.144 -32.318 21.308 1.00 35.56 ? 164 THR F C 1 ATOM 7953 O O . THR E 2 169 ? 5.345 -33.355 21.938 1.00 34.05 ? 164 THR F O 1 ATOM 7954 C CB . THR E 2 169 ? 7.036 -31.497 19.803 1.00 34.55 ? 164 THR F CB 1 ATOM 7955 O OG1 . THR E 2 169 ? 6.759 -30.389 18.950 1.00 37.47 ? 164 THR F OG1 1 ATOM 7956 C CG2 . THR E 2 169 ? 6.714 -32.798 19.117 1.00 34.22 ? 164 THR F CG2 1 ATOM 7957 N N . ASP E 2 170 ? 3.942 -31.980 20.812 1.00 38.18 ? 165 ASP F N 1 ATOM 7958 C CA . ASP E 2 170 ? 2.809 -32.919 20.791 1.00 38.82 ? 165 ASP F CA 1 ATOM 7959 C C . ASP E 2 170 ? 3.103 -33.972 19.751 1.00 37.26 ? 165 ASP F C 1 ATOM 7960 O O . ASP E 2 170 ? 3.917 -33.753 18.863 1.00 36.61 ? 165 ASP F O 1 ATOM 7961 C CB . ASP E 2 170 ? 1.500 -32.230 20.376 1.00 42.42 ? 165 ASP F CB 1 ATOM 7962 C CG . ASP E 2 170 ? 0.801 -31.509 21.523 1.00 45.10 ? 165 ASP F CG 1 ATOM 7963 O OD1 . ASP E 2 170 ? 1.290 -31.486 22.673 1.00 44.49 ? 165 ASP F OD1 1 ATOM 7964 O OD2 . ASP E 2 170 ? -0.273 -30.939 21.255 1.00 48.97 ? 165 ASP F OD2 1 ATOM 7965 N N . GLN E 2 171 ? 2.406 -35.096 19.820 1.00 37.13 ? 166 GLN F N 1 ATOM 7966 C CA . GLN E 2 171 ? 2.585 -36.123 18.817 1.00 36.60 ? 166 GLN F CA 1 ATOM 7967 C C . GLN E 2 171 ? 2.429 -35.520 17.412 1.00 38.73 ? 166 GLN F C 1 ATOM 7968 O O . GLN E 2 171 ? 1.511 -34.752 17.162 1.00 41.16 ? 166 GLN F O 1 ATOM 7969 C CB . GLN E 2 171 ? 1.599 -37.263 19.040 1.00 37.00 ? 166 GLN F CB 1 ATOM 7970 C CG . GLN E 2 171 ? 1.921 -38.503 18.219 1.00 36.45 ? 166 GLN F CG 1 ATOM 7971 C CD . GLN E 2 171 ? 1.186 -39.724 18.717 1.00 36.55 ? 166 GLN F CD 1 ATOM 7972 O OE1 . GLN E 2 171 ? 0.054 -39.622 19.176 1.00 37.80 ? 166 GLN F OE1 1 ATOM 7973 N NE2 . GLN E 2 171 ? 1.837 -40.882 18.658 1.00 35.77 ? 166 GLN F NE2 1 ATOM 7974 N N . ASP E 2 172 ? 3.348 -35.854 16.508 1.00 38.80 ? 167 ASP F N 1 ATOM 7975 C CA . ASP E 2 172 ? 3.320 -35.339 15.126 1.00 41.74 ? 167 ASP F CA 1 ATOM 7976 C C . ASP E 2 172 ? 2.174 -35.952 14.338 1.00 44.05 ? 167 ASP F C 1 ATOM 7977 O O . ASP E 2 172 ? 2.087 -37.179 14.227 1.00 43.18 ? 167 ASP F O 1 ATOM 7978 C CB . ASP E 2 172 ? 4.629 -35.673 14.401 1.00 41.59 ? 167 ASP F CB 1 ATOM 7979 C CG . ASP E 2 172 ? 4.681 -35.095 12.969 1.00 45.17 ? 167 ASP F CG 1 ATOM 7980 O OD1 . ASP E 2 172 ? 4.917 -33.873 12.819 1.00 46.26 ? 167 ASP F OD1 1 ATOM 7981 O OD2 . ASP E 2 172 ? 4.495 -35.865 11.990 1.00 47.34 ? 167 ASP F OD2 1 ATOM 7982 N N . SER E 2 173 ? 1.328 -35.104 13.755 1.00 47.66 ? 168 SER F N 1 ATOM 7983 C CA . SER E 2 173 ? 0.129 -35.570 13.054 1.00 50.79 ? 168 SER F CA 1 ATOM 7984 C C . SER E 2 173 ? 0.413 -36.574 11.931 1.00 52.16 ? 168 SER F C 1 ATOM 7985 O O . SER E 2 173 ? -0.448 -37.392 11.597 1.00 53.31 ? 168 SER F O 1 ATOM 7986 C CB . SER E 2 173 ? -0.628 -34.384 12.478 1.00 54.68 ? 168 SER F CB 1 ATOM 7987 O OG . SER E 2 173 ? 0.191 -33.658 11.584 1.00 56.57 ? 168 SER F OG 1 ATOM 7988 N N . LYS E 2 174 ? 1.619 -36.512 11.363 1.00 52.40 ? 169 LYS F N 1 ATOM 7989 C CA . LYS E 2 174 ? 1.958 -37.275 10.156 1.00 54.93 ? 169 LYS F CA 1 ATOM 7990 C C . LYS E 2 174 ? 2.699 -38.589 10.430 1.00 52.61 ? 169 LYS F C 1 ATOM 7991 O O . LYS E 2 174 ? 2.256 -39.658 9.975 1.00 54.17 ? 169 LYS F O 1 ATOM 7992 C CB . LYS E 2 174 ? 2.773 -36.407 9.193 1.00 57.98 ? 169 LYS F CB 1 ATOM 7993 C CG . LYS E 2 174 ? 2.013 -35.196 8.662 1.00 61.93 ? 169 LYS F CG 1 ATOM 7994 C CD . LYS E 2 174 ? 2.428 -34.908 7.196 1.00 66.87 ? 169 LYS F CD 1 ATOM 7995 C CE . LYS E 2 174 ? 3.825 -34.308 7.122 1.00 66.68 ? 169 LYS F CE 1 ATOM 7996 N NZ . LYS E 2 174 ? 4.350 -34.288 5.725 1.00 71.81 ? 169 LYS F NZ 1 ATOM 7997 N N . ASP E 2 175 ? 3.820 -38.515 11.148 1.00 49.04 ? 170 ASP F N 1 ATOM 7998 C CA . ASP E 2 175 ? 4.602 -39.717 11.460 1.00 46.88 ? 170 ASP F CA 1 ATOM 7999 C C . ASP E 2 175 ? 4.403 -40.238 12.880 1.00 42.60 ? 170 ASP F C 1 ATOM 8000 O O . ASP E 2 175 ? 4.974 -41.265 13.217 1.00 41.46 ? 170 ASP F O 1 ATOM 8001 C CB . ASP E 2 175 ? 6.092 -39.492 11.173 1.00 47.39 ? 170 ASP F CB 1 ATOM 8002 C CG . ASP E 2 175 ? 6.752 -38.590 12.177 1.00 45.37 ? 170 ASP F CG 1 ATOM 8003 O OD1 . ASP E 2 175 ? 6.201 -38.439 13.294 1.00 43.88 ? 170 ASP F OD1 1 ATOM 8004 O OD2 . ASP E 2 175 ? 7.836 -38.042 11.857 1.00 46.02 ? 170 ASP F OD2 1 ATOM 8005 N N . SER E 2 176 ? 3.616 -39.536 13.702 1.00 40.52 ? 171 SER F N 1 ATOM 8006 C CA . SER E 2 176 ? 3.238 -40.010 15.049 1.00 37.88 ? 171 SER F CA 1 ATOM 8007 C C . SER E 2 176 ? 4.421 -40.080 16.014 1.00 35.41 ? 171 SER F C 1 ATOM 8008 O O . SER E 2 176 ? 4.397 -40.844 16.980 1.00 34.15 ? 171 SER F O 1 ATOM 8009 C CB . SER E 2 176 ? 2.544 -41.396 14.987 1.00 38.50 ? 171 SER F CB 1 ATOM 8010 O OG . SER E 2 176 ? 1.344 -41.368 14.231 1.00 40.35 ? 171 SER F OG 1 ATOM 8011 N N . THR E 2 177 ? 5.467 -39.306 15.740 1.00 34.86 ? 172 THR F N 1 ATOM 8012 C CA . THR E 2 177 ? 6.617 -39.251 16.619 1.00 33.17 ? 172 THR F CA 1 ATOM 8013 C C . THR E 2 177 ? 6.550 -38.026 17.511 1.00 31.69 ? 172 THR F C 1 ATOM 8014 O O . THR E 2 177 ? 5.747 -37.126 17.290 1.00 32.56 ? 172 THR F O 1 ATOM 8015 C CB . THR E 2 177 ? 7.950 -39.155 15.832 1.00 33.82 ? 172 THR F CB 1 ATOM 8016 O OG1 . THR E 2 177 ? 7.893 -38.018 14.956 1.00 35.12 ? 172 THR F OG1 1 ATOM 8017 C CG2 . THR E 2 177 ? 8.218 -40.434 15.023 1.00 35.54 ? 172 THR F CG2 1 ATOM 8018 N N . TYR E 2 178 ? 7.438 -38.019 18.502 1.00 29.98 ? 173 TYR F N 1 ATOM 8019 C CA . TYR E 2 178 ? 7.621 -36.917 19.419 1.00 28.90 ? 173 TYR F CA 1 ATOM 8020 C C . TYR E 2 178 ? 9.003 -36.328 19.220 1.00 28.59 ? 173 TYR F C 1 ATOM 8021 O O . TYR E 2 178 ? 9.935 -37.012 18.751 1.00 28.53 ? 173 TYR F O 1 ATOM 8022 C CB . TYR E 2 178 ? 7.467 -37.403 20.856 1.00 28.00 ? 173 TYR F CB 1 ATOM 8023 C CG . TYR E 2 178 ? 6.090 -37.938 21.158 1.00 28.86 ? 173 TYR F CG 1 ATOM 8024 C CD1 . TYR E 2 178 ? 5.786 -39.286 20.934 1.00 29.23 ? 173 TYR F CD1 1 ATOM 8025 C CD2 . TYR E 2 178 ? 5.072 -37.105 21.647 1.00 29.72 ? 173 TYR F CD2 1 ATOM 8026 C CE1 . TYR E 2 178 ? 4.520 -39.784 21.198 1.00 30.28 ? 173 TYR F CE1 1 ATOM 8027 C CE2 . TYR E 2 178 ? 3.802 -37.601 21.907 1.00 30.99 ? 173 TYR F CE2 1 ATOM 8028 C CZ . TYR E 2 178 ? 3.530 -38.939 21.690 1.00 31.11 ? 173 TYR F CZ 1 ATOM 8029 O OH . TYR E 2 178 ? 2.267 -39.446 21.943 1.00 32.56 ? 173 TYR F OH 1 ATOM 8030 N N . SER E 2 179 ? 9.128 -35.055 19.591 1.00 28.87 ? 174 SER F N 1 ATOM 8031 C CA . SER E 2 179 ? 10.386 -34.337 19.543 1.00 28.60 ? 174 SER F CA 1 ATOM 8032 C C . SER E 2 179 ? 10.541 -33.581 20.850 1.00 28.61 ? 174 SER F C 1 ATOM 8033 O O . SER E 2 179 ? 9.591 -33.446 21.614 1.00 28.97 ? 174 SER F O 1 ATOM 8034 C CB . SER E 2 179 ? 10.421 -33.396 18.338 1.00 29.97 ? 174 SER F CB 1 ATOM 8035 O OG . SER E 2 179 ? 10.470 -34.138 17.134 1.00 30.89 ? 174 SER F OG 1 ATOM 8036 N N . MET E 2 180 ? 11.756 -33.128 21.135 1.00 28.90 ? 175 MET F N 1 ATOM 8037 C CA . MET E 2 180 ? 12.010 -32.393 22.363 1.00 29.38 ? 175 MET F CA 1 ATOM 8038 C C . MET E 2 180 ? 13.215 -31.477 22.232 1.00 28.56 ? 175 MET F C 1 ATOM 8039 O O . MET E 2 180 ? 14.203 -31.838 21.604 1.00 28.12 ? 175 MET F O 1 ATOM 8040 C CB . MET E 2 180 ? 12.270 -33.378 23.476 1.00 30.21 ? 175 MET F CB 1 ATOM 8041 C CG . MET E 2 180 ? 12.743 -32.749 24.775 1.00 31.87 ? 175 MET F CG 1 ATOM 8042 S SD . MET E 2 180 ? 13.490 -34.019 25.781 1.00 34.47 ? 175 MET F SD 1 ATOM 8043 C CE . MET E 2 180 ? 13.586 -33.190 27.352 1.00 35.93 ? 175 MET F CE 1 ATOM 8044 N N . SER E 2 181 ? 13.129 -30.298 22.840 1.00 28.41 ? 176 SER F N 1 ATOM 8045 C CA . SER E 2 181 ? 14.279 -29.422 22.935 1.00 27.86 ? 176 SER F CA 1 ATOM 8046 C C . SER E 2 181 ? 14.742 -29.420 24.374 1.00 27.38 ? 176 SER F C 1 ATOM 8047 O O . SER E 2 181 ? 13.944 -29.592 25.289 1.00 28.24 ? 176 SER F O 1 ATOM 8048 C CB . SER E 2 181 ? 13.962 -28.001 22.445 1.00 29.54 ? 176 SER F CB 1 ATOM 8049 O OG . SER E 2 181 ? 13.179 -27.241 23.360 1.00 30.87 ? 176 SER F OG 1 ATOM 8050 N N . SER E 2 182 ? 16.044 -29.267 24.563 1.00 26.75 ? 177 SER F N 1 ATOM 8051 C CA . SER E 2 182 ? 16.623 -29.087 25.883 1.00 26.83 ? 177 SER F CA 1 ATOM 8052 C C . SER E 2 182 ? 17.685 -28.008 25.790 1.00 27.21 ? 177 SER F C 1 ATOM 8053 O O . SER E 2 182 ? 18.613 -28.119 24.981 1.00 26.65 ? 177 SER F O 1 ATOM 8054 C CB . SER E 2 182 ? 17.275 -30.366 26.372 1.00 26.09 ? 177 SER F CB 1 ATOM 8055 O OG . SER E 2 182 ? 17.790 -30.149 27.666 1.00 26.79 ? 177 SER F OG 1 ATOM 8056 N N . THR E 2 183 ? 17.556 -26.996 26.638 1.00 28.44 ? 178 THR F N 1 ATOM 8057 C CA . THR E 2 183 ? 18.329 -25.799 26.511 1.00 29.08 ? 178 THR F CA 1 ATOM 8058 C C . THR E 2 183 ? 18.989 -25.544 27.836 1.00 29.76 ? 178 THR F C 1 ATOM 8059 O O . THR E 2 183 ? 18.346 -25.563 28.872 1.00 31.23 ? 178 THR F O 1 ATOM 8060 C CB . THR E 2 183 ? 17.427 -24.625 26.103 1.00 31.06 ? 178 THR F CB 1 ATOM 8061 O OG1 . THR E 2 183 ? 16.809 -24.939 24.850 1.00 31.01 ? 178 THR F OG1 1 ATOM 8062 C CG2 . THR E 2 183 ? 18.226 -23.339 25.976 1.00 32.32 ? 178 THR F CG2 1 ATOM 8063 N N . LEU E 2 184 ? 20.299 -25.353 27.788 1.00 29.45 ? 179 LEU F N 1 ATOM 8064 C CA . LEU E 2 184 ? 21.080 -25.026 28.957 1.00 30.22 ? 179 LEU F CA 1 ATOM 8065 C C . LEU E 2 184 ? 21.537 -23.569 28.853 1.00 31.21 ? 179 LEU F C 1 ATOM 8066 O O . LEU E 2 184 ? 22.347 -23.226 28.004 1.00 30.98 ? 179 LEU F O 1 ATOM 8067 C CB . LEU E 2 184 ? 22.274 -25.963 29.028 1.00 29.23 ? 179 LEU F CB 1 ATOM 8068 C CG . LEU E 2 184 ? 23.326 -25.610 30.055 1.00 30.37 ? 179 LEU F CG 1 ATOM 8069 C CD1 . LEU E 2 184 ? 22.725 -25.535 31.455 1.00 32.47 ? 179 LEU F CD1 1 ATOM 8070 C CD2 . LEU E 2 184 ? 24.426 -26.653 29.989 1.00 29.88 ? 179 LEU F CD2 1 ATOM 8071 N N . THR E 2 185 ? 21.017 -22.716 29.711 1.00 33.08 ? 180 THR F N 1 ATOM 8072 C CA . THR E 2 185 ? 21.325 -21.295 29.632 1.00 35.00 ? 180 THR F CA 1 ATOM 8073 C C . THR E 2 185 ? 22.363 -20.913 30.697 1.00 36.12 ? 180 THR F C 1 ATOM 8074 O O . THR E 2 185 ? 22.232 -21.272 31.871 1.00 37.47 ? 180 THR F O 1 ATOM 8075 C CB . THR E 2 185 ? 20.054 -20.434 29.777 1.00 37.44 ? 180 THR F CB 1 ATOM 8076 O OG1 . THR E 2 185 ? 19.176 -20.684 28.671 1.00 36.73 ? 180 THR F OG1 1 ATOM 8077 C CG2 . THR E 2 185 ? 20.404 -18.959 29.814 1.00 40.03 ? 180 THR F CG2 1 ATOM 8078 N N . LEU E 2 186 ? 23.399 -20.196 30.264 1.00 35.92 ? 181 LEU F N 1 ATOM 8079 C CA . LEU E 2 186 ? 24.493 -19.790 31.134 1.00 36.87 ? 181 LEU F CA 1 ATOM 8080 C C . LEU E 2 186 ? 24.848 -18.349 30.834 1.00 38.66 ? 181 LEU F C 1 ATOM 8081 O O . LEU E 2 186 ? 24.399 -17.795 29.830 1.00 38.64 ? 181 LEU F O 1 ATOM 8082 C CB . LEU E 2 186 ? 25.729 -20.649 30.868 1.00 34.95 ? 181 LEU F CB 1 ATOM 8083 C CG . LEU E 2 186 ? 25.561 -22.166 30.910 1.00 33.31 ? 181 LEU F CG 1 ATOM 8084 C CD1 . LEU E 2 186 ? 26.659 -22.825 30.101 1.00 31.89 ? 181 LEU F CD1 1 ATOM 8085 C CD2 . LEU E 2 186 ? 25.580 -22.656 32.349 1.00 34.70 ? 181 LEU F CD2 1 ATOM 8086 N N . THR E 2 187 ? 25.660 -17.750 31.701 1.00 40.47 ? 182 THR F N 1 ATOM 8087 C CA . THR E 2 187 ? 26.318 -16.500 31.347 1.00 42.65 ? 182 THR F CA 1 ATOM 8088 C C . THR E 2 187 ? 27.460 -16.847 30.396 1.00 40.69 ? 182 THR F C 1 ATOM 8089 O O . THR E 2 187 ? 27.929 -17.988 30.370 1.00 38.31 ? 182 THR F O 1 ATOM 8090 C CB . THR E 2 187 ? 26.877 -15.750 32.578 1.00 45.45 ? 182 THR F CB 1 ATOM 8091 O OG1 . THR E 2 187 ? 27.923 -16.529 33.167 1.00 44.41 ? 182 THR F OG1 1 ATOM 8092 C CG2 . THR E 2 187 ? 25.760 -15.466 33.608 1.00 48.32 ? 182 THR F CG2 1 ATOM 8093 N N . LYS E 2 188 ? 27.876 -15.868 29.600 1.00 42.29 ? 183 LYS F N 1 ATOM 8094 C CA . LYS E 2 188 ? 29.092 -15.975 28.801 1.00 41.98 ? 183 LYS F CA 1 ATOM 8095 C C . LYS E 2 188 ? 30.249 -16.375 29.702 1.00 41.65 ? 183 LYS F C 1 ATOM 8096 O O . LYS E 2 188 ? 30.937 -17.334 29.409 1.00 40.32 ? 183 LYS F O 1 ATOM 8097 C CB . LYS E 2 188 ? 29.380 -14.639 28.122 1.00 44.99 ? 183 LYS F CB 1 ATOM 8098 C CG . LYS E 2 188 ? 30.507 -14.606 27.099 1.00 45.37 ? 183 LYS F CG 1 ATOM 8099 C CD . LYS E 2 188 ? 30.776 -13.148 26.717 1.00 49.35 ? 183 LYS F CD 1 ATOM 8100 C CE . LYS E 2 188 ? 31.496 -12.963 25.380 1.00 50.71 ? 183 LYS F CE 1 ATOM 8101 N NZ . LYS E 2 188 ? 32.981 -13.006 25.518 1.00 50.88 ? 183 LYS F NZ 1 ATOM 8102 N N . ASP E 2 189 ? 30.435 -15.650 30.807 1.00 44.04 ? 184 ASP F N 1 ATOM 8103 C CA . ASP E 2 189 ? 31.546 -15.901 31.733 1.00 44.50 ? 184 ASP F CA 1 ATOM 8104 C C . ASP E 2 189 ? 31.593 -17.354 32.185 1.00 42.51 ? 184 ASP F C 1 ATOM 8105 O O . ASP E 2 189 ? 32.633 -17.980 32.102 1.00 41.36 ? 184 ASP F O 1 ATOM 8106 C CB . ASP E 2 189 ? 31.484 -14.954 32.944 1.00 47.84 ? 184 ASP F CB 1 ATOM 8107 C CG . ASP E 2 189 ? 31.945 -13.542 32.609 1.00 50.77 ? 184 ASP F CG 1 ATOM 8108 O OD1 . ASP E 2 189 ? 32.108 -13.216 31.407 1.00 50.94 ? 184 ASP F OD1 1 ATOM 8109 O OD2 . ASP E 2 189 ? 32.158 -12.749 33.554 1.00 54.10 ? 184 ASP F OD2 1 ATOM 8110 N N . GLU E 2 190 ? 30.457 -17.900 32.617 1.00 42.09 ? 185 GLU F N 1 ATOM 8111 C CA . GLU E 2 190 ? 30.412 -19.292 33.066 1.00 41.11 ? 185 GLU F CA 1 ATOM 8112 C C . GLU E 2 190 ? 30.589 -20.271 31.904 1.00 37.63 ? 185 GLU F C 1 ATOM 8113 O O . GLU E 2 190 ? 31.175 -21.340 32.069 1.00 37.33 ? 185 GLU F O 1 ATOM 8114 C CB . GLU E 2 190 ? 29.096 -19.627 33.800 1.00 42.96 ? 185 GLU F CB 1 ATOM 8115 C CG . GLU E 2 190 ? 29.136 -21.030 34.435 1.00 43.80 ? 185 GLU F CG 1 ATOM 8116 C CD . GLU E 2 190 ? 27.955 -21.404 35.322 1.00 46.53 ? 185 GLU F CD 1 ATOM 8117 O OE1 . GLU E 2 190 ? 26.834 -20.855 35.154 1.00 48.65 ? 185 GLU F OE1 1 ATOM 8118 O OE2 . GLU E 2 190 ? 28.150 -22.285 36.203 1.00 48.40 ? 185 GLU F OE2 1 ATOM 8119 N N . TYR E 2 191 ? 30.050 -19.933 30.745 1.00 35.65 ? 186 TYR F N 1 ATOM 8120 C CA . TYR E 2 191 ? 30.219 -20.765 29.570 1.00 33.58 ? 186 TYR F CA 1 ATOM 8121 C C . TYR E 2 191 ? 31.707 -20.938 29.271 1.00 33.81 ? 186 TYR F C 1 ATOM 8122 O O . TYR E 2 191 ? 32.137 -22.035 28.970 1.00 32.89 ? 186 TYR F O 1 ATOM 8123 C CB . TYR E 2 191 ? 29.472 -20.172 28.367 1.00 33.27 ? 186 TYR F CB 1 ATOM 8124 C CG . TYR E 2 191 ? 29.755 -20.862 27.044 1.00 32.45 ? 186 TYR F CG 1 ATOM 8125 C CD1 . TYR E 2 191 ? 29.407 -22.188 26.842 1.00 31.14 ? 186 TYR F CD1 1 ATOM 8126 C CD2 . TYR E 2 191 ? 30.365 -20.182 25.997 1.00 33.67 ? 186 TYR F CD2 1 ATOM 8127 C CE1 . TYR E 2 191 ? 29.661 -22.823 25.642 1.00 31.02 ? 186 TYR F CE1 1 ATOM 8128 C CE2 . TYR E 2 191 ? 30.619 -20.810 24.792 1.00 33.76 ? 186 TYR F CE2 1 ATOM 8129 C CZ . TYR E 2 191 ? 30.259 -22.132 24.618 1.00 32.49 ? 186 TYR F CZ 1 ATOM 8130 O OH . TYR E 2 191 ? 30.518 -22.759 23.415 1.00 33.25 ? 186 TYR F OH 1 ATOM 8131 N N . GLU E 2 192 ? 32.480 -19.856 29.405 1.00 35.22 ? 187 GLU F N 1 ATOM 8132 C CA . GLU E 2 192 ? 33.933 -19.870 29.148 1.00 36.21 ? 187 GLU F CA 1 ATOM 8133 C C . GLU E 2 192 ? 34.775 -20.478 30.272 1.00 36.63 ? 187 GLU F C 1 ATOM 8134 O O . GLU E 2 192 ? 35.978 -20.575 30.148 1.00 37.91 ? 187 GLU F O 1 ATOM 8135 C CB . GLU E 2 192 ? 34.443 -18.454 28.858 1.00 38.04 ? 187 GLU F CB 1 ATOM 8136 C CG . GLU E 2 192 ? 33.813 -17.826 27.625 1.00 38.70 ? 187 GLU F CG 1 ATOM 8137 C CD . GLU E 2 192 ? 34.139 -16.327 27.448 1.00 41.35 ? 187 GLU F CD 1 ATOM 8138 O OE1 . GLU E 2 192 ? 34.807 -15.663 28.313 1.00 42.71 ? 187 GLU F OE1 1 ATOM 8139 O OE2 . GLU E 2 192 ? 33.673 -15.786 26.427 1.00 42.63 ? 187 GLU F OE2 1 ATOM 8140 N N . ARG E 2 193 ? 34.169 -20.874 31.378 1.00 36.22 ? 188 ARG F N 1 ATOM 8141 C CA . ARG E 2 193 ? 34.924 -21.565 32.411 1.00 37.38 ? 188 ARG F CA 1 ATOM 8142 C C . ARG E 2 193 ? 34.935 -23.068 32.181 1.00 36.31 ? 188 ARG F C 1 ATOM 8143 O O . ARG E 2 193 ? 35.457 -23.802 32.999 1.00 37.62 ? 188 ARG F O 1 ATOM 8144 C CB . ARG E 2 193 ? 34.360 -21.245 33.790 1.00 38.95 ? 188 ARG F CB 1 ATOM 8145 C CG . ARG E 2 193 ? 34.217 -19.748 34.043 1.00 40.26 ? 188 ARG F CG 1 ATOM 8146 C CD . ARG E 2 193 ? 34.980 -19.310 35.287 1.00 43.34 ? 188 ARG F CD 1 ATOM 8147 N NE . ARG E 2 193 ? 35.406 -20.420 36.146 1.00 44.89 ? 188 ARG F NE 1 ATOM 8148 C CZ . ARG E 2 193 ? 36.570 -20.472 36.806 1.00 47.24 ? 188 ARG F CZ 1 ATOM 8149 N NH1 . ARG E 2 193 ? 36.868 -21.522 37.564 1.00 48.92 ? 188 ARG F NH1 1 ATOM 8150 N NH2 . ARG E 2 193 ? 37.456 -19.494 36.699 1.00 48.38 ? 188 ARG F NH2 1 ATOM 8151 N N . HIS E 2 194 ? 34.365 -23.518 31.069 1.00 34.40 ? 189 HIS F N 1 ATOM 8152 C CA . HIS E 2 194 ? 34.328 -24.942 30.740 1.00 34.21 ? 189 HIS F CA 1 ATOM 8153 C C . HIS E 2 194 ? 34.556 -25.199 29.259 1.00 33.61 ? 189 HIS F C 1 ATOM 8154 O O . HIS E 2 194 ? 34.206 -24.390 28.406 1.00 32.58 ? 189 HIS F O 1 ATOM 8155 C CB . HIS E 2 194 ? 32.981 -25.550 31.175 1.00 33.13 ? 189 HIS F CB 1 ATOM 8156 C CG . HIS E 2 194 ? 32.731 -25.437 32.646 1.00 34.57 ? 189 HIS F CG 1 ATOM 8157 N ND1 . HIS E 2 194 ? 33.437 -26.164 33.579 1.00 36.86 ? 189 HIS F ND1 1 ATOM 8158 C CD2 . HIS E 2 194 ? 31.892 -24.634 33.346 1.00 34.64 ? 189 HIS F CD2 1 ATOM 8159 C CE1 . HIS E 2 194 ? 33.044 -25.816 34.791 1.00 38.31 ? 189 HIS F CE1 1 ATOM 8160 N NE2 . HIS E 2 194 ? 32.099 -24.899 34.675 1.00 37.02 ? 189 HIS F NE2 1 ATOM 8161 N N . ASN E 2 195 ? 35.079 -26.378 28.964 1.00 34.72 ? 190 ASN F N 1 ATOM 8162 C CA . ASN E 2 195 ? 35.453 -26.742 27.606 1.00 35.42 ? 190 ASN F CA 1 ATOM 8163 C C . ASN E 2 195 ? 34.474 -27.703 26.933 1.00 34.67 ? 190 ASN F C 1 ATOM 8164 O O . ASN E 2 195 ? 34.098 -27.502 25.782 1.00 34.03 ? 190 ASN F O 1 ATOM 8165 C CB . ASN E 2 195 ? 36.844 -27.372 27.625 1.00 38.27 ? 190 ASN F CB 1 ATOM 8166 C CG . ASN E 2 195 ? 37.908 -26.422 28.170 1.00 39.42 ? 190 ASN F CG 1 ATOM 8167 O OD1 . ASN E 2 195 ? 37.937 -25.261 27.801 1.00 38.73 ? 190 ASN F OD1 1 ATOM 8168 N ND2 . ASN E 2 195 ? 38.770 -26.912 29.052 1.00 41.56 ? 190 ASN F ND2 1 ATOM 8169 N N . SER E 2 196 ? 34.084 -28.750 27.649 1.00 35.11 ? 191 SER F N 1 ATOM 8170 C CA . SER E 2 196 ? 33.273 -29.815 27.065 1.00 35.09 ? 191 SER F CA 1 ATOM 8171 C C . SER E 2 196 ? 31.782 -29.700 27.439 1.00 32.75 ? 191 SER F C 1 ATOM 8172 O O . SER E 2 196 ? 31.424 -29.570 28.605 1.00 32.58 ? 191 SER F O 1 ATOM 8173 C CB . SER E 2 196 ? 33.820 -31.179 27.473 1.00 37.62 ? 191 SER F CB 1 ATOM 8174 O OG . SER E 2 196 ? 33.051 -32.186 26.835 1.00 37.70 ? 191 SER F OG 1 ATOM 8175 N N . TYR E 2 197 ? 30.926 -29.740 26.431 1.00 31.71 ? 192 TYR F N 1 ATOM 8176 C CA . TYR E 2 197 ? 29.498 -29.656 26.632 1.00 29.97 ? 192 TYR F CA 1 ATOM 8177 C C . TYR E 2 197 ? 28.867 -30.859 25.971 1.00 30.46 ? 192 TYR F C 1 ATOM 8178 O O . TYR E 2 197 ? 29.056 -31.077 24.787 1.00 30.97 ? 192 TYR F O 1 ATOM 8179 C CB . TYR E 2 197 ? 28.962 -28.340 26.061 1.00 28.65 ? 192 TYR F CB 1 ATOM 8180 C CG . TYR E 2 197 ? 29.407 -27.152 26.877 1.00 28.79 ? 192 TYR F CG 1 ATOM 8181 C CD1 . TYR E 2 197 ? 30.653 -26.568 26.679 1.00 29.82 ? 192 TYR F CD1 1 ATOM 8182 C CD2 . TYR E 2 197 ? 28.591 -26.625 27.876 1.00 28.25 ? 192 TYR F CD2 1 ATOM 8183 C CE1 . TYR E 2 197 ? 31.072 -25.492 27.437 1.00 30.18 ? 192 TYR F CE1 1 ATOM 8184 C CE2 . TYR E 2 197 ? 28.996 -25.533 28.625 1.00 28.80 ? 192 TYR F CE2 1 ATOM 8185 C CZ . TYR E 2 197 ? 30.231 -24.975 28.406 1.00 29.75 ? 192 TYR F CZ 1 ATOM 8186 O OH . TYR E 2 197 ? 30.613 -23.901 29.189 1.00 30.77 ? 192 TYR F OH 1 ATOM 8187 N N . THR E 2 198 ? 28.114 -31.628 26.751 1.00 30.92 ? 193 THR F N 1 ATOM 8188 C CA . THR E 2 198 ? 27.525 -32.862 26.283 1.00 32.01 ? 193 THR F CA 1 ATOM 8189 C C . THR E 2 198 ? 26.022 -32.940 26.608 1.00 31.41 ? 193 THR F C 1 ATOM 8190 O O . THR E 2 198 ? 25.552 -32.549 27.688 1.00 31.15 ? 193 THR F O 1 ATOM 8191 C CB . THR E 2 198 ? 28.261 -34.074 26.889 1.00 34.52 ? 193 THR F CB 1 ATOM 8192 O OG1 . THR E 2 198 ? 29.646 -34.012 26.534 1.00 36.53 ? 193 THR F OG1 1 ATOM 8193 C CG2 . THR E 2 198 ? 27.669 -35.386 26.399 1.00 35.40 ? 193 THR F CG2 1 ATOM 8194 N N . CYS E 2 199 ? 25.287 -33.471 25.639 1.00 31.82 ? 194 CYS F N 1 ATOM 8195 C CA . CYS E 2 199 ? 23.860 -33.676 25.729 1.00 31.52 ? 194 CYS F CA 1 ATOM 8196 C C . CYS E 2 199 ? 23.651 -35.187 25.603 1.00 32.13 ? 194 CYS F C 1 ATOM 8197 O O . CYS E 2 199 ? 24.054 -35.780 24.602 1.00 33.11 ? 194 CYS F O 1 ATOM 8198 C CB . CYS E 2 199 ? 23.192 -32.909 24.592 1.00 32.01 ? 194 CYS F CB 1 ATOM 8199 S SG . CYS E 2 199 ? 21.428 -33.201 24.424 1.00 34.29 ? 194 CYS F SG 1 ATOM 8200 N N . GLU E 2 200 ? 23.097 -35.810 26.646 1.00 32.27 ? 195 GLU F N 1 ATOM 8201 C CA . GLU E 2 200 ? 22.904 -37.277 26.704 1.00 33.85 ? 195 GLU F CA 1 ATOM 8202 C C . GLU E 2 200 ? 21.431 -37.685 26.808 1.00 32.73 ? 195 GLU F C 1 ATOM 8203 O O . GLU E 2 200 ? 20.787 -37.429 27.838 1.00 32.15 ? 195 GLU F O 1 ATOM 8204 C CB . GLU E 2 200 ? 23.581 -37.877 27.930 1.00 36.41 ? 195 GLU F CB 1 ATOM 8205 C CG . GLU E 2 200 ? 25.075 -38.052 27.833 1.00 38.87 ? 195 GLU F CG 1 ATOM 8206 C CD . GLU E 2 200 ? 25.598 -39.070 28.843 1.00 42.60 ? 195 GLU F CD 1 ATOM 8207 O OE1 . GLU E 2 200 ? 24.824 -39.964 29.289 1.00 43.78 ? 195 GLU F OE1 1 ATOM 8208 O OE2 . GLU E 2 200 ? 26.797 -38.984 29.177 1.00 44.91 ? 195 GLU F OE2 1 ATOM 8209 N N . ALA E 2 201 ? 20.954 -38.393 25.777 1.00 32.38 ? 196 ALA F N 1 ATOM 8210 C CA . ALA E 2 201 ? 19.574 -38.838 25.669 1.00 31.30 ? 196 ALA F CA 1 ATOM 8211 C C . ALA E 2 201 ? 19.465 -40.332 25.995 1.00 33.56 ? 196 ALA F C 1 ATOM 8212 O O . ALA E 2 201 ? 20.076 -41.158 25.336 1.00 35.17 ? 196 ALA F O 1 ATOM 8213 C CB . ALA E 2 201 ? 19.066 -38.570 24.262 1.00 30.03 ? 196 ALA F CB 1 ATOM 8214 N N . THR E 2 202 ? 18.696 -40.667 27.023 1.00 34.02 ? 197 THR F N 1 ATOM 8215 C CA . THR E 2 202 ? 18.363 -42.062 27.319 1.00 36.51 ? 197 THR F CA 1 ATOM 8216 C C . THR E 2 202 ? 16.932 -42.345 26.882 1.00 35.23 ? 197 THR F C 1 ATOM 8217 O O . THR E 2 202 ? 16.003 -41.643 27.278 1.00 33.95 ? 197 THR F O 1 ATOM 8218 C CB . THR E 2 202 ? 18.491 -42.389 28.825 1.00 39.17 ? 197 THR F CB 1 ATOM 8219 O OG1 . THR E 2 202 ? 19.861 -42.299 29.205 1.00 41.10 ? 197 THR F OG1 1 ATOM 8220 C CG2 . THR E 2 202 ? 18.044 -43.808 29.136 1.00 42.44 ? 197 THR F CG2 1 ATOM 8221 N N . HIS E 2 203 ? 16.763 -43.406 26.104 1.00 36.03 ? 198 HIS F N 1 ATOM 8222 C CA . HIS E 2 203 ? 15.486 -43.729 25.474 1.00 34.95 ? 198 HIS F CA 1 ATOM 8223 C C . HIS E 2 203 ? 15.367 -45.245 25.396 1.00 37.56 ? 198 HIS F C 1 ATOM 8224 O O . HIS E 2 203 ? 16.372 -45.933 25.382 1.00 40.15 ? 198 HIS F O 1 ATOM 8225 C CB . HIS E 2 203 ? 15.464 -43.103 24.084 1.00 32.99 ? 198 HIS F CB 1 ATOM 8226 C CG . HIS E 2 203 ? 14.158 -43.239 23.378 1.00 32.30 ? 198 HIS F CG 1 ATOM 8227 N ND1 . HIS E 2 203 ? 13.982 -44.090 22.309 1.00 33.51 ? 198 HIS F ND1 1 ATOM 8228 C CD2 . HIS E 2 203 ? 12.961 -42.643 23.592 1.00 30.83 ? 198 HIS F CD2 1 ATOM 8229 C CE1 . HIS E 2 203 ? 12.733 -44.005 21.888 1.00 32.63 ? 198 HIS F CE1 1 ATOM 8230 N NE2 . HIS E 2 203 ? 12.091 -43.138 22.651 1.00 31.06 ? 198 HIS F NE2 1 ATOM 8231 N N . LYS E 2 204 ? 14.161 -45.780 25.352 1.00 37.54 ? 199 LYS F N 1 ATOM 8232 C CA . LYS E 2 204 ? 14.001 -47.244 25.443 1.00 40.84 ? 199 LYS F CA 1 ATOM 8233 C C . LYS E 2 204 ? 14.568 -48.014 24.234 1.00 42.23 ? 199 LYS F C 1 ATOM 8234 O O . LYS E 2 204 ? 14.867 -49.182 24.360 1.00 45.48 ? 199 LYS F O 1 ATOM 8235 C CB . LYS E 2 204 ? 12.543 -47.645 25.681 1.00 41.10 ? 199 LYS F CB 1 ATOM 8236 C CG . LYS E 2 204 ? 11.712 -47.843 24.416 1.00 40.24 ? 199 LYS F CG 1 ATOM 8237 C CD . LYS E 2 204 ? 10.244 -48.076 24.739 1.00 40.36 ? 199 LYS F CD 1 ATOM 8238 C CE . LYS E 2 204 ? 9.981 -49.456 25.317 1.00 44.07 ? 199 LYS F CE 1 ATOM 8239 N NZ . LYS E 2 204 ? 9.878 -50.474 24.242 1.00 45.77 ? 199 LYS F NZ 1 ATOM 8240 N N . THR E 2 205 ? 14.725 -47.343 23.089 1.00 40.23 ? 200 THR F N 1 ATOM 8241 C CA . THR E 2 205 ? 15.331 -47.941 21.899 1.00 42.42 ? 200 THR F CA 1 ATOM 8242 C C . THR E 2 205 ? 16.804 -48.312 22.067 1.00 45.33 ? 200 THR F C 1 ATOM 8243 O O . THR E 2 205 ? 17.393 -48.852 21.138 1.00 48.29 ? 200 THR F O 1 ATOM 8244 C CB . THR E 2 205 ? 15.230 -47.017 20.667 1.00 40.29 ? 200 THR F CB 1 ATOM 8245 O OG1 . THR E 2 205 ? 15.710 -45.710 20.997 1.00 37.79 ? 200 THR F OG1 1 ATOM 8246 C CG2 . THR E 2 205 ? 13.791 -46.927 20.172 1.00 38.74 ? 200 THR F CG2 1 ATOM 8247 N N . SER E 2 206 ? 17.403 -48.003 23.218 1.00 45.07 ? 201 SER F N 1 ATOM 8248 C CA . SER E 2 206 ? 18.749 -48.484 23.536 1.00 48.43 ? 201 SER F CA 1 ATOM 8249 C C . SER E 2 206 ? 19.118 -48.312 25.005 1.00 48.91 ? 201 SER F C 1 ATOM 8250 O O . SER E 2 206 ? 18.699 -47.364 25.663 1.00 46.06 ? 201 SER F O 1 ATOM 8251 C CB . SER E 2 206 ? 19.780 -47.740 22.695 1.00 47.85 ? 201 SER F CB 1 ATOM 8252 O OG . SER E 2 206 ? 21.094 -48.113 23.067 1.00 51.30 ? 201 SER F OG 1 ATOM 8253 N N . THR E 2 207 ? 19.944 -49.215 25.508 1.00 53.38 ? 202 THR F N 1 ATOM 8254 C CA . THR E 2 207 ? 20.484 -49.086 26.867 1.00 54.76 ? 202 THR F CA 1 ATOM 8255 C C . THR E 2 207 ? 21.616 -48.043 26.908 1.00 53.18 ? 202 THR F C 1 ATOM 8256 O O . THR E 2 207 ? 21.920 -47.473 27.964 1.00 52.66 ? 202 THR F O 1 ATOM 8257 C CB . THR E 2 207 ? 21.030 -50.425 27.380 1.00 60.88 ? 202 THR F CB 1 ATOM 8258 O OG1 . THR E 2 207 ? 22.080 -50.872 26.517 1.00 63.86 ? 202 THR F OG1 1 ATOM 8259 C CG2 . THR E 2 207 ? 19.925 -51.453 27.427 1.00 62.75 ? 202 THR F CG2 1 ATOM 8260 N N . SER E 2 208 ? 22.254 -47.828 25.759 1.00 52.92 ? 203 SER F N 1 ATOM 8261 C CA . SER E 2 208 ? 23.313 -46.825 25.645 1.00 51.75 ? 203 SER F CA 1 ATOM 8262 C C . SER E 2 208 ? 22.739 -45.453 25.338 1.00 46.47 ? 203 SER F C 1 ATOM 8263 O O . SER E 2 208 ? 22.017 -45.282 24.347 1.00 44.62 ? 203 SER F O 1 ATOM 8264 C CB . SER E 2 208 ? 24.281 -47.187 24.519 1.00 54.59 ? 203 SER F CB 1 ATOM 8265 O OG . SER E 2 208 ? 24.965 -48.414 24.761 1.00 60.41 ? 203 SER F OG 1 ATOM 8266 N N . PRO E 2 209 ? 23.068 -44.453 26.164 1.00 44.67 ? 204 PRO F N 1 ATOM 8267 C CA . PRO E 2 209 ? 22.561 -43.133 25.808 1.00 40.39 ? 204 PRO F CA 1 ATOM 8268 C C . PRO E 2 209 ? 23.120 -42.655 24.480 1.00 39.94 ? 204 PRO F C 1 ATOM 8269 O O . PRO E 2 209 ? 24.202 -43.061 24.096 1.00 42.72 ? 204 PRO F O 1 ATOM 8270 C CB . PRO E 2 209 ? 23.047 -42.233 26.955 1.00 39.45 ? 204 PRO F CB 1 ATOM 8271 C CG . PRO E 2 209 ? 24.189 -42.965 27.557 1.00 43.50 ? 204 PRO F CG 1 ATOM 8272 C CD . PRO E 2 209 ? 23.910 -44.425 27.371 1.00 46.81 ? 204 PRO F CD 1 ATOM 8273 N N . ILE E 2 210 ? 22.365 -41.825 23.777 1.00 37.35 ? 205 ILE F N 1 ATOM 8274 C CA . ILE E 2 210 ? 22.890 -41.126 22.616 1.00 37.55 ? 205 ILE F CA 1 ATOM 8275 C C . ILE E 2 210 ? 23.562 -39.817 23.070 1.00 36.20 ? 205 ILE F C 1 ATOM 8276 O O . ILE E 2 210 ? 22.937 -38.923 23.678 1.00 33.63 ? 205 ILE F O 1 ATOM 8277 C CB . ILE E 2 210 ? 21.797 -40.840 21.575 1.00 36.17 ? 205 ILE F CB 1 ATOM 8278 C CG1 . ILE E 2 210 ? 21.231 -42.157 21.053 1.00 38.46 ? 205 ILE F CG1 1 ATOM 8279 C CG2 . ILE E 2 210 ? 22.369 -40.034 20.410 1.00 36.44 ? 205 ILE F CG2 1 ATOM 8280 C CD1 . ILE E 2 210 ? 19.968 -41.998 20.240 1.00 37.28 ? 205 ILE F CD1 1 ATOM 8281 N N . VAL E 2 211 ? 24.839 -39.711 22.748 1.00 38.44 ? 206 VAL F N 1 ATOM 8282 C CA . VAL E 2 211 ? 25.676 -38.637 23.231 1.00 37.91 ? 206 VAL F CA 1 ATOM 8283 C C . VAL E 2 211 ? 25.944 -37.698 22.066 1.00 37.77 ? 206 VAL F C 1 ATOM 8284 O O . VAL E 2 211 ? 26.229 -38.135 20.956 1.00 40.18 ? 206 VAL F O 1 ATOM 8285 C CB . VAL E 2 211 ? 26.995 -39.205 23.800 1.00 41.09 ? 206 VAL F CB 1 ATOM 8286 C CG1 . VAL E 2 211 ? 27.858 -38.114 24.413 1.00 40.23 ? 206 VAL F CG1 1 ATOM 8287 C CG2 . VAL E 2 211 ? 26.696 -40.284 24.835 1.00 42.77 ? 206 VAL F CG2 1 ATOM 8288 N N . LYS E 2 212 ? 25.809 -36.404 22.309 1.00 35.62 ? 207 LYS F N 1 ATOM 8289 C CA . LYS E 2 212 ? 26.289 -35.400 21.364 1.00 35.71 ? 207 LYS F CA 1 ATOM 8290 C C . LYS E 2 212 ? 26.993 -34.315 22.146 1.00 34.50 ? 207 LYS F C 1 ATOM 8291 O O . LYS E 2 212 ? 26.505 -33.856 23.162 1.00 32.30 ? 207 LYS F O 1 ATOM 8292 C CB . LYS E 2 212 ? 25.128 -34.817 20.564 1.00 34.54 ? 207 LYS F CB 1 ATOM 8293 C CG . LYS E 2 212 ? 24.708 -35.672 19.381 1.00 36.69 ? 207 LYS F CG 1 ATOM 8294 C CD . LYS E 2 212 ? 25.826 -35.818 18.371 1.00 40.26 ? 207 LYS F CD 1 ATOM 8295 C CE . LYS E 2 212 ? 25.320 -36.281 17.016 1.00 42.82 ? 207 LYS F CE 1 ATOM 8296 N NZ . LYS E 2 212 ? 24.817 -37.681 17.080 1.00 44.05 ? 207 LYS F NZ 1 ATOM 8297 N N . SER E 2 213 ? 28.170 -33.930 21.690 1.00 36.56 ? 208 SER F N 1 ATOM 8298 C CA . SER E 2 213 ? 28.944 -32.925 22.389 1.00 36.01 ? 208 SER F CA 1 ATOM 8299 C C . SER E 2 213 ? 29.775 -32.063 21.458 1.00 37.42 ? 208 SER F C 1 ATOM 8300 O O . SER E 2 213 ? 29.825 -32.255 20.249 1.00 39.15 ? 208 SER F O 1 ATOM 8301 C CB . SER E 2 213 ? 29.829 -33.593 23.445 1.00 37.59 ? 208 SER F CB 1 ATOM 8302 O OG . SER E 2 213 ? 30.849 -34.338 22.847 1.00 41.17 ? 208 SER F OG 1 ATOM 8303 N N . PHE E 2 214 ? 30.393 -31.065 22.051 1.00 37.35 ? 209 PHE F N 1 ATOM 8304 C CA . PHE E 2 214 ? 31.393 -30.282 21.373 1.00 39.57 ? 209 PHE F CA 1 ATOM 8305 C C . PHE E 2 214 ? 32.351 -29.779 22.433 1.00 40.66 ? 209 PHE F C 1 ATOM 8306 O O . PHE E 2 214 ? 32.011 -29.766 23.625 1.00 38.50 ? 209 PHE F O 1 ATOM 8307 C CB . PHE E 2 214 ? 30.735 -29.122 20.609 1.00 38.27 ? 209 PHE F CB 1 ATOM 8308 C CG . PHE E 2 214 ? 30.090 -28.102 21.496 1.00 35.23 ? 209 PHE F CG 1 ATOM 8309 C CD1 . PHE E 2 214 ? 28.788 -28.246 21.906 1.00 33.01 ? 209 PHE F CD1 1 ATOM 8310 C CD2 . PHE E 2 214 ? 30.797 -26.982 21.915 1.00 35.32 ? 209 PHE F CD2 1 ATOM 8311 C CE1 . PHE E 2 214 ? 28.196 -27.304 22.732 1.00 31.39 ? 209 PHE F CE1 1 ATOM 8312 C CE2 . PHE E 2 214 ? 30.214 -26.033 22.734 1.00 33.41 ? 209 PHE F CE2 1 ATOM 8313 C CZ . PHE E 2 214 ? 28.911 -26.194 23.143 1.00 31.74 ? 209 PHE F CZ 1 ATOM 8314 N N . ASN E 2 215 ? 33.545 -29.391 21.989 1.00 44.77 ? 210 ASN F N 1 ATOM 8315 C CA . ASN E 2 215 ? 34.528 -28.727 22.826 1.00 46.70 ? 210 ASN F CA 1 ATOM 8316 C C . ASN E 2 215 ? 34.526 -27.238 22.438 1.00 47.10 ? 210 ASN F C 1 ATOM 8317 O O . ASN E 2 215 ? 34.631 -26.896 21.256 1.00 48.92 ? 210 ASN F O 1 ATOM 8318 C CB . ASN E 2 215 ? 35.931 -29.323 22.587 1.00 51.70 ? 210 ASN F CB 1 ATOM 8319 C CG . ASN E 2 215 ? 35.917 -30.556 21.684 1.00 55.23 ? 210 ASN F CG 1 ATOM 8320 O OD1 . ASN E 2 215 ? 35.007 -30.731 20.865 1.00 56.21 ? 210 ASN F OD1 1 ATOM 8321 N ND2 . ASN E 2 215 ? 36.947 -31.401 21.803 1.00 59.29 ? 210 ASN F ND2 1 ATOM 8322 N N . ARG E 2 216 ? 34.369 -26.364 23.426 1.00 46.38 ? 211 ARG F N 1 ATOM 8323 C CA . ARG E 2 216 ? 34.330 -24.909 23.220 1.00 47.55 ? 211 ARG F CA 1 ATOM 8324 C C . ARG E 2 216 ? 35.577 -24.351 22.531 1.00 52.49 ? 211 ARG F C 1 ATOM 8325 O O . ARG E 2 216 ? 35.493 -23.443 21.713 1.00 53.38 ? 211 ARG F O 1 ATOM 8326 C CB . ARG E 2 216 ? 34.186 -24.204 24.570 1.00 45.66 ? 211 ARG F CB 1 ATOM 8327 C CG . ARG E 2 216 ? 33.815 -22.739 24.452 1.00 44.89 ? 211 ARG F CG 1 ATOM 8328 C CD . ARG E 2 216 ? 33.765 -22.056 25.803 1.00 43.48 ? 211 ARG F CD 1 ATOM 8329 N NE . ARG E 2 216 ? 34.963 -21.266 26.038 1.00 45.57 ? 211 ARG F NE 1 ATOM 8330 C CZ . ARG E 2 216 ? 36.041 -21.672 26.698 1.00 46.26 ? 211 ARG F CZ 1 ATOM 8331 N NH1 . ARG E 2 216 ? 36.110 -22.880 27.244 1.00 46.30 ? 211 ARG F NH1 1 ATOM 8332 N NH2 . ARG E 2 216 ? 37.062 -20.850 26.824 1.00 48.22 ? 211 ARG F NH2 1 ATOM 8333 N N . ASN E 2 217 ? 36.729 -24.900 22.904 1.00 56.87 ? 212 ASN F N 1 ATOM 8334 C CA . ASN E 2 217 ? 38.034 -24.523 22.354 1.00 62.68 ? 212 ASN F CA 1 ATOM 8335 C C . ASN E 2 217 ? 38.207 -24.634 20.826 1.00 67.22 ? 212 ASN F C 1 ATOM 8336 O O . ASN E 2 217 ? 39.274 -24.279 20.308 1.00 69.75 ? 212 ASN F O 1 ATOM 8337 C CB . ASN E 2 217 ? 39.128 -25.368 23.036 1.00 65.62 ? 212 ASN F CB 1 ATOM 8338 C CG . ASN E 2 217 ? 38.788 -26.862 23.054 1.00 66.95 ? 212 ASN F CG 1 ATOM 8339 O OD1 . ASN E 2 217 ? 37.867 -27.302 23.775 1.00 65.02 ? 212 ASN F OD1 1 ATOM 8340 N ND2 . ASN E 2 217 ? 39.506 -27.644 22.253 1.00 69.74 ? 212 ASN F ND2 1 ATOM 8341 N N . GLU E 2 218 ? 37.189 -25.124 20.114 1.00 67.58 ? 213 GLU F N 1 ATOM 8342 C CA . GLU E 2 218 ? 37.260 -25.277 18.654 1.00 72.17 ? 213 GLU F CA 1 ATOM 8343 C C . GLU E 2 218 ? 36.225 -24.431 17.910 1.00 73.59 ? 213 GLU F C 1 ATOM 8344 O O . GLU E 2 218 ? 36.106 -24.531 16.684 1.00 77.60 ? 213 GLU F O 1 ATOM 8345 C CB . GLU E 2 218 ? 37.092 -26.748 18.288 1.00 72.46 ? 213 GLU F CB 1 ATOM 8346 C CG . GLU E 2 218 ? 37.751 -27.674 19.293 1.00 71.99 ? 213 GLU F CG 1 ATOM 8347 C CD . GLU E 2 218 ? 37.911 -29.078 18.769 1.00 75.48 ? 213 GLU F CD 1 ATOM 8348 O OE1 . GLU E 2 218 ? 36.891 -29.721 18.443 1.00 72.94 ? 213 GLU F OE1 1 ATOM 8349 O OE2 . GLU E 2 218 ? 39.076 -29.531 18.679 1.00 79.83 ? 213 GLU F OE2 1 ATOM 8350 N N . CYS E 2 219 ? 35.492 -23.601 18.658 1.00 72.75 ? 214 CYS F N 1 ATOM 8351 C CA . CYS E 2 219 ? 34.435 -22.730 18.104 1.00 73.04 ? 214 CYS F CA 1 ATOM 8352 C C . CYS E 2 219 ? 34.856 -21.254 18.046 1.00 74.06 ? 214 CYS F C 1 ATOM 8353 O O . CYS E 2 219 ? 36.041 -20.929 18.142 1.00 75.18 ? 214 CYS F O 1 ATOM 8354 C CB . CYS E 2 219 ? 33.146 -22.874 18.936 1.00 69.42 ? 214 CYS F CB 1 ATOM 8355 S SG . CYS E 2 219 ? 32.330 -24.476 18.764 1.00 66.94 ? 214 CYS F SG 1 ATOM 8356 N N . ASP F 2 1 ? 16.200 21.684 -8.114 1.00 41.31 ? 1 ASP L N 1 ATOM 8357 C CA . ASP F 2 1 ? 16.009 20.451 -7.294 1.00 37.88 ? 1 ASP L CA 1 ATOM 8358 C C . ASP F 2 1 ? 15.357 20.782 -5.968 1.00 35.49 ? 1 ASP L C 1 ATOM 8359 O O . ASP F 2 1 ? 15.444 21.902 -5.474 1.00 36.69 ? 1 ASP L O 1 ATOM 8360 C CB . ASP F 2 1 ? 17.346 19.759 -7.001 1.00 38.42 ? 1 ASP L CB 1 ATOM 8361 C CG . ASP F 2 1 ? 18.007 19.192 -8.232 1.00 40.31 ? 1 ASP L CG 1 ATOM 8362 O OD1 . ASP F 2 1 ? 17.550 19.462 -9.375 1.00 41.43 ? 1 ASP L OD1 1 ATOM 8363 O OD2 . ASP F 2 1 ? 18.979 18.419 -8.019 1.00 41.17 ? 1 ASP L OD2 1 ATOM 8364 N N . ILE F 2 2 ? 14.730 19.784 -5.369 1.00 32.41 ? 2 ILE L N 1 ATOM 8365 C CA . ILE F 2 2 ? 14.172 20.000 -4.045 1.00 30.88 ? 2 ILE L CA 1 ATOM 8366 C C . ILE F 2 2 ? 15.275 19.685 -2.996 1.00 29.75 ? 2 ILE L C 1 ATOM 8367 O O . ILE F 2 2 ? 15.764 18.577 -2.910 1.00 28.37 ? 2 ILE L O 1 ATOM 8368 C CB . ILE F 2 2 ? 12.763 19.341 -3.898 1.00 29.14 ? 2 ILE L CB 1 ATOM 8369 C CG1 . ILE F 2 2 ? 12.807 18.170 -2.956 1.00 27.23 ? 2 ILE L CG1 1 ATOM 8370 C CG2 . ILE F 2 2 ? 12.152 18.912 -5.241 1.00 29.03 ? 2 ILE L CG2 1 ATOM 8371 C CD1 . ILE F 2 2 ? 12.718 18.591 -1.515 1.00 27.34 ? 2 ILE L CD1 1 ATOM 8372 N N . LEU F 2 3 ? 15.726 20.718 -2.280 1.00 31.07 ? 3 LEU L N 1 ATOM 8373 C CA . LEU F 2 3 ? 16.770 20.619 -1.275 1.00 30.93 ? 3 LEU L CA 1 ATOM 8374 C C . LEU F 2 3 ? 16.146 20.078 0.013 1.00 28.27 ? 3 LEU L C 1 ATOM 8375 O O . LEU F 2 3 ? 15.093 20.533 0.447 1.00 28.02 ? 3 LEU L O 1 ATOM 8376 C CB . LEU F 2 3 ? 17.476 21.980 -1.087 1.00 34.22 ? 3 LEU L CB 1 ATOM 8377 C CG . LEU F 2 3 ? 18.575 22.303 -2.175 1.00 37.55 ? 3 LEU L CG 1 ATOM 8378 C CD1 . LEU F 2 3 ? 19.117 21.136 -3.049 1.00 36.64 ? 3 LEU L CD1 1 ATOM 8379 C CD2 . LEU F 2 3 ? 18.077 23.416 -3.095 1.00 39.96 ? 3 LEU L CD2 1 ATOM 8380 N N . MET F 2 4 ? 16.778 19.074 0.583 1.00 26.40 ? 4 MET L N 1 ATOM 8381 C CA . MET F 2 4 ? 16.361 18.499 1.848 1.00 25.13 ? 4 MET L CA 1 ATOM 8382 C C . MET F 2 4 ? 17.359 18.942 2.888 1.00 25.88 ? 4 MET L C 1 ATOM 8383 O O . MET F 2 4 ? 18.516 18.602 2.801 1.00 26.53 ? 4 MET L O 1 ATOM 8384 C CB . MET F 2 4 ? 16.353 16.984 1.743 1.00 23.88 ? 4 MET L CB 1 ATOM 8385 C CG . MET F 2 4 ? 15.505 16.459 0.598 1.00 23.41 ? 4 MET L CG 1 ATOM 8386 S SD . MET F 2 4 ? 13.764 16.729 0.948 1.00 24.21 ? 4 MET L SD 1 ATOM 8387 C CE . MET F 2 4 ? 13.449 15.313 1.999 1.00 23.31 ? 4 MET L CE 1 ATOM 8388 N N . ASN F 2 5 ? 16.918 19.732 3.853 1.00 26.66 ? 5 ASN L N 1 ATOM 8389 C CA . ASN F 2 5 ? 17.762 20.220 4.938 1.00 28.33 ? 5 ASN L CA 1 ATOM 8390 C C . ASN F 2 5 ? 17.534 19.451 6.224 1.00 26.68 ? 5 ASN L C 1 ATOM 8391 O O . ASN F 2 5 ? 16.492 19.579 6.835 1.00 26.24 ? 5 ASN L O 1 ATOM 8392 C CB . ASN F 2 5 ? 17.488 21.708 5.179 1.00 31.36 ? 5 ASN L CB 1 ATOM 8393 C CG . ASN F 2 5 ? 17.433 22.502 3.896 1.00 33.29 ? 5 ASN L CG 1 ATOM 8394 O OD1 . ASN F 2 5 ? 18.467 22.878 3.371 1.00 36.67 ? 5 ASN L OD1 1 ATOM 8395 N ND2 . ASN F 2 5 ? 16.232 22.757 3.368 1.00 33.63 ? 5 ASN L ND2 1 ATOM 8396 N N . GLN F 2 6 ? 18.542 18.704 6.652 1.00 26.05 ? 6 GLN L N 1 ATOM 8397 C CA . GLN F 2 6 ? 18.439 17.882 7.824 1.00 25.54 ? 6 GLN L CA 1 ATOM 8398 C C . GLN F 2 6 ? 19.086 18.658 8.953 1.00 27.66 ? 6 GLN L C 1 ATOM 8399 O O . GLN F 2 6 ? 20.091 19.339 8.741 1.00 29.16 ? 6 GLN L O 1 ATOM 8400 C CB . GLN F 2 6 ? 19.169 16.571 7.571 1.00 24.67 ? 6 GLN L CB 1 ATOM 8401 C CG . GLN F 2 6 ? 18.365 15.361 7.949 1.00 23.49 ? 6 GLN L CG 1 ATOM 8402 C CD . GLN F 2 6 ? 18.992 14.094 7.484 1.00 22.70 ? 6 GLN L CD 1 ATOM 8403 O OE1 . GLN F 2 6 ? 19.066 13.864 6.292 1.00 22.58 ? 6 GLN L OE1 1 ATOM 8404 N NE2 . GLN F 2 6 ? 19.441 13.256 8.414 1.00 23.16 ? 6 GLN L NE2 1 ATOM 8405 N N . THR F 2 7 ? 18.500 18.597 10.140 1.00 28.01 ? 7 THR L N 1 ATOM 8406 C CA . THR F 2 7 ? 19.133 19.157 11.316 1.00 30.40 ? 7 THR L CA 1 ATOM 8407 C C . THR F 2 7 ? 18.772 18.279 12.492 1.00 30.25 ? 7 THR L C 1 ATOM 8408 O O . THR F 2 7 ? 17.714 17.668 12.480 1.00 28.80 ? 7 THR L O 1 ATOM 8409 C CB . THR F 2 7 ? 18.661 20.605 11.592 1.00 33.04 ? 7 THR L CB 1 ATOM 8410 O OG1 . THR F 2 7 ? 17.231 20.638 11.592 1.00 32.40 ? 7 THR L OG1 1 ATOM 8411 C CG2 . THR F 2 7 ? 19.177 21.568 10.523 1.00 33.93 ? 7 THR L CG2 1 ATOM 8412 N N . PRO F 2 8 ? 19.654 18.196 13.507 1.00 31.95 ? 8 PRO L N 1 ATOM 8413 C CA . PRO F 2 8 ? 21.007 18.757 13.495 1.00 33.52 ? 8 PRO L CA 1 ATOM 8414 C C . PRO F 2 8 ? 21.962 17.918 12.623 1.00 32.12 ? 8 PRO L C 1 ATOM 8415 O O . PRO F 2 8 ? 21.571 16.863 12.098 1.00 29.90 ? 8 PRO L O 1 ATOM 8416 C CB . PRO F 2 8 ? 21.417 18.696 14.966 1.00 35.82 ? 8 PRO L CB 1 ATOM 8417 C CG . PRO F 2 8 ? 20.680 17.516 15.488 1.00 34.68 ? 8 PRO L CG 1 ATOM 8418 C CD . PRO F 2 8 ? 19.361 17.504 14.773 1.00 32.74 ? 8 PRO L CD 1 ATOM 8419 N N . LEU F 2 9 ? 23.187 18.405 12.465 1.00 33.80 ? 9 LEU L N 1 ATOM 8420 C CA . LEU F 2 9 ? 24.224 17.713 11.715 1.00 33.47 ? 9 LEU L CA 1 ATOM 8421 C C . LEU F 2 9 ? 24.818 16.549 12.534 1.00 33.51 ? 9 LEU L C 1 ATOM 8422 O O . LEU F 2 9 ? 25.186 15.492 12.002 1.00 32.42 ? 9 LEU L O 1 ATOM 8423 C CB . LEU F 2 9 ? 25.335 18.709 11.373 1.00 36.13 ? 9 LEU L CB 1 ATOM 8424 C CG . LEU F 2 9 ? 26.268 18.462 10.213 1.00 36.50 ? 9 LEU L CG 1 ATOM 8425 C CD1 . LEU F 2 9 ? 25.523 17.853 9.050 1.00 33.91 ? 9 LEU L CD1 1 ATOM 8426 C CD2 . LEU F 2 9 ? 26.984 19.746 9.789 1.00 39.55 ? 9 LEU L CD2 1 ATOM 8427 N N . SER F 2 10 ? 24.968 16.787 13.829 1.00 35.25 ? 10 SER L N 1 ATOM 8428 C CA . SER F 2 10 ? 25.267 15.725 14.774 1.00 35.54 ? 10 SER L CA 1 ATOM 8429 C C . SER F 2 10 ? 24.439 15.887 16.032 1.00 36.66 ? 10 SER L C 1 ATOM 8430 O O . SER F 2 10 ? 24.191 17.002 16.493 1.00 38.15 ? 10 SER L O 1 ATOM 8431 C CB . SER F 2 10 ? 26.738 15.718 15.162 1.00 37.67 ? 10 SER L CB 1 ATOM 8432 O OG . SER F 2 10 ? 27.143 17.006 15.558 1.00 40.24 ? 10 SER L OG 1 ATOM 8433 N N . LEU F 2 11 ? 24.032 14.755 16.591 1.00 36.21 ? 11 LEU L N 1 ATOM 8434 C CA . LEU F 2 11 ? 23.173 14.734 17.749 1.00 37.86 ? 11 LEU L CA 1 ATOM 8435 C C . LEU F 2 11 ? 23.811 13.846 18.816 1.00 39.44 ? 11 LEU L C 1 ATOM 8436 O O . LEU F 2 11 ? 23.731 12.628 18.756 1.00 38.57 ? 11 LEU L O 1 ATOM 8437 C CB . LEU F 2 11 ? 21.768 14.261 17.362 1.00 36.05 ? 11 LEU L CB 1 ATOM 8438 C CG . LEU F 2 11 ? 20.736 14.203 18.487 1.00 38.17 ? 11 LEU L CG 1 ATOM 8439 C CD1 . LEU F 2 11 ? 20.597 15.513 19.255 1.00 40.98 ? 11 LEU L CD1 1 ATOM 8440 C CD2 . LEU F 2 11 ? 19.405 13.808 17.895 1.00 36.62 ? 11 LEU L CD2 1 ATOM 8441 N N . PRO F 2 12 ? 24.486 14.470 19.778 1.00 42.15 ? 12 PRO L N 1 ATOM 8442 C CA . PRO F 2 12 ? 24.966 13.750 20.961 1.00 44.55 ? 12 PRO L CA 1 ATOM 8443 C C . PRO F 2 12 ? 23.851 13.331 21.914 1.00 45.76 ? 12 PRO L C 1 ATOM 8444 O O . PRO F 2 12 ? 23.147 14.201 22.431 1.00 47.18 ? 12 PRO L O 1 ATOM 8445 C CB . PRO F 2 12 ? 25.840 14.786 21.676 1.00 47.58 ? 12 PRO L CB 1 ATOM 8446 C CG . PRO F 2 12 ? 26.163 15.823 20.658 1.00 46.51 ? 12 PRO L CG 1 ATOM 8447 C CD . PRO F 2 12 ? 25.009 15.848 19.707 1.00 43.52 ? 12 PRO L CD 1 ATOM 8448 N N . VAL F 2 13 ? 23.731 12.029 22.181 1.00 45.76 ? 13 VAL L N 1 ATOM 8449 C CA . VAL F 2 13 ? 22.743 11.501 23.130 1.00 47.69 ? 13 VAL L CA 1 ATOM 8450 C C . VAL F 2 13 ? 23.355 10.539 24.131 1.00 50.58 ? 13 VAL L C 1 ATOM 8451 O O . VAL F 2 13 ? 24.396 9.940 23.881 1.00 50.68 ? 13 VAL L O 1 ATOM 8452 C CB . VAL F 2 13 ? 21.583 10.778 22.425 1.00 45.34 ? 13 VAL L CB 1 ATOM 8453 C CG1 . VAL F 2 13 ? 20.710 11.783 21.702 1.00 43.38 ? 13 VAL L CG1 1 ATOM 8454 C CG2 . VAL F 2 13 ? 22.093 9.721 21.450 1.00 43.15 ? 13 VAL L CG2 1 ATOM 8455 N N . SER F 2 14 ? 22.718 10.421 25.288 1.00 53.61 ? 14 SER L N 1 ATOM 8456 C CA . SER F 2 14 ? 23.011 9.351 26.237 1.00 56.53 ? 14 SER L CA 1 ATOM 8457 C C . SER F 2 14 ? 22.080 8.209 25.911 1.00 55.64 ? 14 SER L C 1 ATOM 8458 O O . SER F 2 14 ? 21.011 8.433 25.373 1.00 53.77 ? 14 SER L O 1 ATOM 8459 C CB . SER F 2 14 ? 22.767 9.798 27.681 1.00 60.92 ? 14 SER L CB 1 ATOM 8460 O OG . SER F 2 14 ? 23.526 10.941 28.000 1.00 62.05 ? 14 SER L OG 1 ATOM 8461 N N . LEU F 2 15 ? 22.474 6.988 26.251 1.00 57.54 ? 15 LEU L N 1 ATOM 8462 C CA . LEU F 2 15 ? 21.588 5.843 26.090 1.00 57.81 ? 15 LEU L CA 1 ATOM 8463 C C . LEU F 2 15 ? 20.364 6.066 26.962 1.00 60.68 ? 15 LEU L C 1 ATOM 8464 O O . LEU F 2 15 ? 20.478 6.597 28.068 1.00 64.02 ? 15 LEU L O 1 ATOM 8465 C CB . LEU F 2 15 ? 22.289 4.542 26.479 1.00 60.28 ? 15 LEU L CB 1 ATOM 8466 C CG . LEU F 2 15 ? 23.540 4.197 25.668 1.00 58.41 ? 15 LEU L CG 1 ATOM 8467 C CD1 . LEU F 2 15 ? 24.154 2.898 26.159 1.00 61.59 ? 15 LEU L CD1 1 ATOM 8468 C CD2 . LEU F 2 15 ? 23.229 4.108 24.187 1.00 54.09 ? 15 LEU L CD2 1 ATOM 8469 N N . GLY F 2 16 ? 19.196 5.687 26.449 1.00 59.63 ? 16 GLY L N 1 ATOM 8470 C CA . GLY F 2 16 ? 17.933 5.926 27.129 1.00 62.23 ? 16 GLY L CA 1 ATOM 8471 C C . GLY F 2 16 ? 17.227 7.187 26.654 1.00 60.29 ? 16 GLY L C 1 ATOM 8472 O O . GLY F 2 16 ? 16.011 7.276 26.770 1.00 61.12 ? 16 GLY L O 1 ATOM 8473 N N . ASP F 2 17 ? 17.972 8.154 26.109 1.00 58.33 ? 17 ASP L N 1 ATOM 8474 C CA . ASP F 2 17 ? 17.404 9.453 25.717 1.00 57.34 ? 17 ASP L CA 1 ATOM 8475 C C . ASP F 2 17 ? 16.451 9.320 24.528 1.00 54.30 ? 17 ASP L C 1 ATOM 8476 O O . ASP F 2 17 ? 16.597 8.432 23.678 1.00 51.52 ? 17 ASP L O 1 ATOM 8477 C CB . ASP F 2 17 ? 18.492 10.461 25.293 1.00 55.85 ? 17 ASP L CB 1 ATOM 8478 C CG . ASP F 2 17 ? 19.279 11.070 26.474 1.00 59.67 ? 17 ASP L CG 1 ATOM 8479 O OD1 . ASP F 2 17 ? 18.962 10.822 27.664 1.00 63.90 ? 17 ASP L OD1 1 ATOM 8480 O OD2 . ASP F 2 17 ? 20.240 11.823 26.188 1.00 58.79 ? 17 ASP L OD2 1 ATOM 8481 N N . GLN F 2 18 ? 15.489 10.231 24.468 1.00 55.15 ? 18 GLN L N 1 ATOM 8482 C CA . GLN F 2 18 ? 14.677 10.394 23.272 1.00 52.46 ? 18 GLN L CA 1 ATOM 8483 C C . GLN F 2 18 ? 15.495 11.228 22.290 1.00 49.59 ? 18 GLN L C 1 ATOM 8484 O O . GLN F 2 18 ? 16.261 12.084 22.713 1.00 51.31 ? 18 GLN L O 1 ATOM 8485 C CB . GLN F 2 18 ? 13.356 11.087 23.588 1.00 54.77 ? 18 GLN L CB 1 ATOM 8486 C CG . GLN F 2 18 ? 12.280 10.897 22.534 1.00 52.82 ? 18 GLN L CG 1 ATOM 8487 C CD . GLN F 2 18 ? 11.279 12.038 22.518 1.00 54.09 ? 18 GLN L CD 1 ATOM 8488 O OE1 . GLN F 2 18 ? 10.859 12.497 21.461 1.00 52.33 ? 18 GLN L OE1 1 ATOM 8489 N NE2 . GLN F 2 18 ? 10.905 12.511 23.701 1.00 58.50 ? 18 GLN L NE2 1 ATOM 8490 N N . ALA F 2 19 ? 15.341 10.987 20.993 1.00 46.04 ? 19 ALA L N 1 ATOM 8491 C CA . ALA F 2 19 ? 16.088 11.722 19.982 1.00 43.40 ? 19 ALA L CA 1 ATOM 8492 C C . ALA F 2 19 ? 15.133 12.166 18.885 1.00 40.74 ? 19 ALA L C 1 ATOM 8493 O O . ALA F 2 19 ? 14.212 11.449 18.528 1.00 39.53 ? 19 ALA L O 1 ATOM 8494 C CB . ALA F 2 19 ? 17.193 10.858 19.402 1.00 41.84 ? 19 ALA L CB 1 ATOM 8495 N N . SER F 2 20 ? 15.374 13.355 18.355 1.00 39.90 ? 20 SER L N 1 ATOM 8496 C CA . SER F 2 20 ? 14.511 13.915 17.340 1.00 37.90 ? 20 SER L CA 1 ATOM 8497 C C . SER F 2 20 ? 15.343 14.508 16.198 1.00 35.53 ? 20 SER L C 1 ATOM 8498 O O . SER F 2 20 ? 16.204 15.361 16.410 1.00 36.44 ? 20 SER L O 1 ATOM 8499 C CB . SER F 2 20 ? 13.612 14.973 17.964 1.00 40.70 ? 20 SER L CB 1 ATOM 8500 O OG . SER F 2 20 ? 12.374 15.043 17.283 1.00 40.27 ? 20 SER L OG 1 ATOM 8501 N N . ILE F 2 21 ? 15.096 14.028 14.990 1.00 32.60 ? 21 ILE L N 1 ATOM 8502 C CA . ILE F 2 21 ? 15.834 14.466 13.813 1.00 30.78 ? 21 ILE L CA 1 ATOM 8503 C C . ILE F 2 21 ? 14.871 15.071 12.828 1.00 29.38 ? 21 ILE L C 1 ATOM 8504 O O . ILE F 2 21 ? 13.886 14.450 12.459 1.00 28.05 ? 21 ILE L O 1 ATOM 8505 C CB . ILE F 2 21 ? 16.505 13.289 13.106 1.00 29.38 ? 21 ILE L CB 1 ATOM 8506 C CG1 . ILE F 2 21 ? 17.555 12.668 14.015 1.00 31.02 ? 21 ILE L CG1 1 ATOM 8507 C CG2 . ILE F 2 21 ? 17.139 13.745 11.794 1.00 28.41 ? 21 ILE L CG2 1 ATOM 8508 C CD1 . ILE F 2 21 ? 18.186 11.401 13.469 1.00 30.08 ? 21 ILE L CD1 1 ATOM 8509 N N . SER F 2 22 ? 15.182 16.271 12.372 1.00 29.77 ? 22 SER L N 1 ATOM 8510 C CA . SER F 2 22 ? 14.265 17.023 11.542 1.00 29.52 ? 22 SER L CA 1 ATOM 8511 C C . SER F 2 22 ? 14.730 17.005 10.088 1.00 27.91 ? 22 SER L C 1 ATOM 8512 O O . SER F 2 22 ? 15.909 16.971 9.801 1.00 27.97 ? 22 SER L O 1 ATOM 8513 C CB . SER F 2 22 ? 14.140 18.462 12.073 1.00 32.02 ? 22 SER L CB 1 ATOM 8514 O OG . SER F 2 22 ? 13.796 19.382 11.044 1.00 32.19 ? 22 SER L OG 1 ATOM 8515 N N . CYS F 2 23 ? 13.781 17.035 9.174 1.00 27.33 ? 23 CYS L N 1 ATOM 8516 C CA . CYS F 2 23 ? 14.072 17.130 7.769 1.00 27.06 ? 23 CYS L CA 1 ATOM 8517 C C . CYS F 2 23 ? 13.115 18.131 7.116 1.00 26.59 ? 23 CYS L C 1 ATOM 8518 O O . CYS F 2 23 ? 11.902 18.009 7.197 1.00 26.31 ? 23 CYS L O 1 ATOM 8519 C CB . CYS F 2 23 ? 13.952 15.750 7.142 1.00 26.81 ? 23 CYS L CB 1 ATOM 8520 S SG . CYS F 2 23 ? 14.170 15.735 5.359 1.00 30.06 ? 23 CYS L SG 1 ATOM 8521 N N . ARG F 2 24 ? 13.669 19.133 6.471 1.00 27.01 ? 24 ARG L N 1 ATOM 8522 C CA . ARG F 2 24 ? 12.878 20.151 5.804 1.00 27.67 ? 24 ARG L CA 1 ATOM 8523 C C . ARG F 2 24 ? 13.129 20.202 4.290 1.00 26.05 ? 24 ARG L C 1 ATOM 8524 O O . ARG F 2 24 ? 14.256 20.385 3.849 1.00 26.85 ? 24 ARG L O 1 ATOM 8525 C CB . ARG F 2 24 ? 13.204 21.521 6.396 1.00 31.16 ? 24 ARG L CB 1 ATOM 8526 C CG . ARG F 2 24 ? 12.441 21.875 7.660 1.00 33.59 ? 24 ARG L CG 1 ATOM 8527 C CD . ARG F 2 24 ? 11.872 23.299 7.570 1.00 37.67 ? 24 ARG L CD 1 ATOM 8528 N NE . ARG F 2 24 ? 12.661 24.373 8.166 1.00 41.72 ? 24 ARG L NE 1 ATOM 8529 C CZ . ARG F 2 24 ? 12.324 25.662 8.099 1.00 45.60 ? 24 ARG L CZ 1 ATOM 8530 N NH1 . ARG F 2 24 ? 11.230 26.036 7.439 1.00 46.22 ? 24 ARG L NH1 1 ATOM 8531 N NH2 . ARG F 2 24 ? 13.079 26.590 8.692 1.00 49.02 ? 24 ARG L NH2 1 ATOM 8532 N N . SER F 2 25 ? 12.068 20.110 3.505 1.00 24.41 ? 25 SER L N 1 ATOM 8533 C CA . SER F 2 25 ? 12.168 20.218 2.059 1.00 23.72 ? 25 SER L CA 1 ATOM 8534 C C . SER F 2 25 ? 11.902 21.636 1.571 1.00 25.46 ? 25 SER L C 1 ATOM 8535 O O . SER F 2 25 ? 11.110 22.363 2.147 1.00 26.85 ? 25 SER L O 1 ATOM 8536 C CB . SER F 2 25 ? 11.177 19.258 1.400 1.00 22.09 ? 25 SER L CB 1 ATOM 8537 O OG . SER F 2 25 ? 9.848 19.514 1.833 1.00 22.48 ? 25 SER L OG 1 ATOM 8538 N N . SER F 2 26 ? 12.541 22.018 0.478 1.00 25.89 ? 26 SER L N 1 ATOM 8539 C CA . SER F 2 26 ? 12.390 23.367 -0.080 1.00 28.31 ? 26 SER L CA 1 ATOM 8540 C C . SER F 2 26 ? 11.022 23.551 -0.733 1.00 28.15 ? 26 SER L C 1 ATOM 8541 O O . SER F 2 26 ? 10.624 24.666 -1.057 1.00 30.34 ? 26 SER L O 1 ATOM 8542 C CB . SER F 2 26 ? 13.489 23.639 -1.123 1.00 29.78 ? 26 SER L CB 1 ATOM 8543 O OG . SER F 2 26 ? 13.488 22.676 -2.189 1.00 28.23 ? 26 SER L OG 1 ATOM 8544 N N . GLN F 2 27 ? 10.320 22.437 -0.932 1.00 25.79 ? 27 GLN L N 1 ATOM 8545 C CA . GLN F 2 27 ? 9.025 22.374 -1.580 1.00 25.54 ? 27 GLN L CA 1 ATOM 8546 C C . GLN F 2 27 ? 8.127 21.249 -1.052 1.00 22.86 ? 27 GLN L C 1 ATOM 8547 O O . GLN F 2 27 ? 8.622 20.210 -0.594 1.00 20.72 ? 27 GLN L O 1 ATOM 8548 C CB . GLN F 2 27 ? 9.345 22.022 -3.013 1.00 25.95 ? 27 GLN L CB 1 ATOM 8549 C CG . GLN F 2 27 ? 8.527 22.614 -4.112 1.00 27.99 ? 27 GLN L CG 1 ATOM 8550 C CD . GLN F 2 27 ? 9.110 22.139 -5.442 1.00 28.54 ? 27 GLN L CD 1 ATOM 8551 O OE1 . GLN F 2 27 ? 10.279 22.386 -5.735 1.00 30.19 ? 27 GLN L OE1 1 ATOM 8552 N NE2 . GLN F 2 27 ? 8.324 21.401 -6.209 1.00 27.66 ? 27 GLN L NE2 1 ATOM 8553 N N . TYR F 2 28 A 6.817 21.440 -1.195 1.00 22.67 ? 27 TYR L N 1 ATOM 8554 C CA . TYR F 2 28 A 5.825 20.497 -0.692 1.00 21.14 ? 27 TYR L CA 1 ATOM 8555 C C . TYR F 2 28 A 6.037 19.103 -1.304 1.00 18.92 ? 27 TYR L C 1 ATOM 8556 O O . TYR F 2 28 A 6.105 18.956 -2.525 1.00 18.62 ? 27 TYR L O 1 ATOM 8557 C CB . TYR F 2 28 A 4.397 21.012 -1.001 1.00 22.31 ? 27 TYR L CB 1 ATOM 8558 C CG . TYR F 2 28 A 3.312 20.436 -0.112 1.00 21.96 ? 27 TYR L CG 1 ATOM 8559 C CD1 . TYR F 2 28 A 2.858 19.121 -0.292 1.00 20.30 ? 27 TYR L CD1 1 ATOM 8560 C CD2 . TYR F 2 28 A 2.737 21.192 0.904 1.00 23.61 ? 27 TYR L CD2 1 ATOM 8561 C CE1 . TYR F 2 28 A 1.880 18.589 0.514 1.00 20.27 ? 27 TYR L CE1 1 ATOM 8562 C CE2 . TYR F 2 28 A 1.747 20.666 1.714 1.00 23.79 ? 27 TYR L CE2 1 ATOM 8563 C CZ . TYR F 2 28 A 1.324 19.364 1.514 1.00 22.14 ? 27 TYR L CZ 1 ATOM 8564 O OH . TYR F 2 28 A 0.379 18.823 2.353 1.00 22.50 ? 27 TYR L OH 1 ATOM 8565 N N . ILE F 2 29 B 6.153 18.093 -0.441 1.00 17.73 ? 27 ILE L N 1 ATOM 8566 C CA . ILE F 2 29 B 6.273 16.700 -0.877 1.00 16.39 ? 27 ILE L CA 1 ATOM 8567 C C . ILE F 2 29 B 4.881 16.151 -1.215 1.00 16.12 ? 27 ILE L C 1 ATOM 8568 O O . ILE F 2 29 B 4.116 15.769 -0.337 1.00 16.27 ? 27 ILE L O 1 ATOM 8569 C CB . ILE F 2 29 B 6.975 15.828 0.193 1.00 15.71 ? 27 ILE L CB 1 ATOM 8570 C CG1 . ILE F 2 29 B 8.362 16.388 0.514 1.00 16.03 ? 27 ILE L CG1 1 ATOM 8571 C CG2 . ILE F 2 29 B 7.126 14.380 -0.276 1.00 14.73 ? 27 ILE L CG2 1 ATOM 8572 C CD1 . ILE F 2 29 B 9.283 16.548 -0.677 1.00 16.19 ? 27 ILE L CD1 1 ATOM 8573 N N . VAL F 2 30 C 4.568 16.138 -2.513 1.00 16.18 ? 27 VAL L N 1 ATOM 8574 C CA . VAL F 2 30 C 3.266 15.766 -2.997 1.00 16.12 ? 27 VAL L CA 1 ATOM 8575 C C . VAL F 2 30 C 3.188 14.263 -3.246 1.00 15.48 ? 27 VAL L C 1 ATOM 8576 O O . VAL F 2 30 C 4.213 13.613 -3.387 1.00 14.53 ? 27 VAL L O 1 ATOM 8577 C CB . VAL F 2 30 C 2.889 16.518 -4.301 1.00 17.15 ? 27 VAL L CB 1 ATOM 8578 C CG1 . VAL F 2 30 C 2.996 18.012 -4.107 1.00 18.44 ? 27 VAL L CG1 1 ATOM 8579 C CG2 . VAL F 2 30 C 3.714 16.061 -5.492 1.00 17.03 ? 27 VAL L CG2 1 ATOM 8580 N N . HIS F 2 31 D 1.963 13.723 -3.320 1.00 16.00 ? 27 HIS L N 1 ATOM 8581 C CA . HIS F 2 31 D 1.777 12.293 -3.531 1.00 16.10 ? 27 HIS L CA 1 ATOM 8582 C C . HIS F 2 31 D 2.090 11.914 -4.971 1.00 16.68 ? 27 HIS L C 1 ATOM 8583 O O . HIS F 2 31 D 2.037 12.743 -5.881 1.00 17.32 ? 27 HIS L O 1 ATOM 8584 C CB . HIS F 2 31 D 0.326 11.877 -3.221 1.00 16.81 ? 27 HIS L CB 1 ATOM 8585 C CG . HIS F 2 31 D -0.645 12.216 -4.320 1.00 17.52 ? 27 HIS L CG 1 ATOM 8586 N ND1 . HIS F 2 31 D -0.818 11.421 -5.429 1.00 17.77 ? 27 HIS L ND1 1 ATOM 8587 C CD2 . HIS F 2 31 D -1.450 13.289 -4.503 1.00 18.36 ? 27 HIS L CD2 1 ATOM 8588 C CE1 . HIS F 2 31 D -1.679 11.989 -6.250 1.00 18.83 ? 27 HIS L CE1 1 ATOM 8589 N NE2 . HIS F 2 31 D -2.095 13.115 -5.702 1.00 19.14 ? 27 HIS L NE2 1 ATOM 8590 N N . ARG F 2 32 E 2.383 10.640 -5.173 1.00 17.36 ? 27 ARG L N 1 ATOM 8591 C CA . ARG F 2 32 E 2.360 10.027 -6.505 1.00 18.47 ? 27 ARG L CA 1 ATOM 8592 C C . ARG F 2 32 E 1.632 8.722 -6.339 1.00 19.80 ? 27 ARG L C 1 ATOM 8593 O O . ARG F 2 32 E 2.064 7.858 -5.545 1.00 19.88 ? 27 ARG L O 1 ATOM 8594 C CB . ARG F 2 32 E 3.739 9.730 -7.029 1.00 18.28 ? 27 ARG L CB 1 ATOM 8595 C CG . ARG F 2 32 E 4.701 10.894 -7.035 1.00 18.17 ? 27 ARG L CG 1 ATOM 8596 C CD . ARG F 2 32 E 4.304 11.938 -8.062 1.00 19.14 ? 27 ARG L CD 1 ATOM 8597 N NE . ARG F 2 32 E 5.184 13.101 -8.006 1.00 19.47 ? 27 ARG L NE 1 ATOM 8598 C CZ . ARG F 2 32 E 4.835 14.341 -8.351 1.00 20.27 ? 27 ARG L CZ 1 ATOM 8599 N NH1 . ARG F 2 32 E 3.614 14.625 -8.753 1.00 20.78 ? 27 ARG L NH1 1 ATOM 8600 N NH2 . ARG F 2 32 E 5.722 15.320 -8.239 1.00 21.26 ? 27 ARG L NH2 1 ATOM 8601 N N . ASN F 2 33 ? 0.518 8.605 -7.063 1.00 21.39 ? 28 ASN L N 1 ATOM 8602 C CA . ASN F 2 33 ? -0.396 7.482 -6.945 1.00 23.00 ? 28 ASN L CA 1 ATOM 8603 C C . ASN F 2 33 ? -0.854 7.238 -5.535 1.00 22.28 ? 28 ASN L C 1 ATOM 8604 O O . ASN F 2 33 ? -1.076 6.101 -5.138 1.00 23.57 ? 28 ASN L O 1 ATOM 8605 C CB . ASN F 2 33 ? 0.216 6.231 -7.546 1.00 24.73 ? 28 ASN L CB 1 ATOM 8606 C CG . ASN F 2 33 ? 0.591 6.451 -8.987 1.00 26.71 ? 28 ASN L CG 1 ATOM 8607 O OD1 . ASN F 2 33 ? -0.268 6.816 -9.808 1.00 29.19 ? 28 ASN L OD1 1 ATOM 8608 N ND2 . ASN F 2 33 ? 1.859 6.289 -9.307 1.00 27.43 ? 28 ASN L ND2 1 ATOM 8609 N N . GLY F 2 34 ? -1.037 8.325 -4.803 1.00 20.79 ? 29 GLY L N 1 ATOM 8610 C CA . GLY F 2 34 ? -1.627 8.268 -3.487 1.00 20.96 ? 29 GLY L CA 1 ATOM 8611 C C . GLY F 2 34 ? -0.636 7.968 -2.400 1.00 20.10 ? 29 GLY L C 1 ATOM 8612 O O . GLY F 2 34 ? -1.027 7.796 -1.256 1.00 20.90 ? 29 GLY L O 1 ATOM 8613 N N . ASN F 2 35 ? 0.646 7.906 -2.767 1.00 19.01 ? 30 ASN L N 1 ATOM 8614 C CA . ASN F 2 35 ? 1.723 7.643 -1.835 1.00 18.14 ? 30 ASN L CA 1 ATOM 8615 C C . ASN F 2 35 ? 2.599 8.868 -1.662 1.00 17.01 ? 30 ASN L C 1 ATOM 8616 O O . ASN F 2 35 ? 2.971 9.538 -2.633 1.00 16.59 ? 30 ASN L O 1 ATOM 8617 C CB . ASN F 2 35 ? 2.567 6.478 -2.336 1.00 18.40 ? 30 ASN L CB 1 ATOM 8618 C CG . ASN F 2 35 ? 1.797 5.142 -2.356 1.00 20.08 ? 30 ASN L CG 1 ATOM 8619 O OD1 . ASN F 2 35 ? 1.046 4.831 -1.461 1.00 21.06 ? 30 ASN L OD1 1 ATOM 8620 N ND2 . ASN F 2 35 ? 2.017 4.359 -3.369 1.00 20.92 ? 30 ASN L ND2 1 ATOM 8621 N N . THR F 2 36 ? 2.914 9.194 -0.417 1.00 16.80 ? 31 THR L N 1 ATOM 8622 C CA . THR F 2 36 ? 3.846 10.269 -0.169 1.00 15.99 ? 31 THR L CA 1 ATOM 8623 C C . THR F 2 36 ? 5.178 9.605 0.150 1.00 15.67 ? 31 THR L C 1 ATOM 8624 O O . THR F 2 36 ? 5.342 9.004 1.230 1.00 16.14 ? 31 THR L O 1 ATOM 8625 C CB . THR F 2 36 ? 3.349 11.142 1.017 1.00 16.40 ? 31 THR L CB 1 ATOM 8626 O OG1 . THR F 2 36 ? 2.043 11.641 0.729 1.00 16.97 ? 31 THR L OG1 1 ATOM 8627 C CG2 . THR F 2 36 ? 4.258 12.286 1.348 1.00 16.03 ? 31 THR L CG2 1 ATOM 8628 N N . TYR F 2 37 ? 6.117 9.711 -0.788 1.00 15.44 ? 32 TYR L N 1 ATOM 8629 C CA . TYR F 2 37 ? 7.414 9.033 -0.680 1.00 15.70 ? 32 TYR L CA 1 ATOM 8630 C C . TYR F 2 37 ? 8.425 9.877 0.062 1.00 15.86 ? 32 TYR L C 1 ATOM 8631 O O . TYR F 2 37 ? 9.161 10.666 -0.542 1.00 15.95 ? 32 TYR L O 1 ATOM 8632 C CB . TYR F 2 37 ? 7.960 8.690 -2.055 1.00 15.54 ? 32 TYR L CB 1 ATOM 8633 C CG . TYR F 2 37 ? 7.125 7.689 -2.758 1.00 15.93 ? 32 TYR L CG 1 ATOM 8634 C CD1 . TYR F 2 37 ? 6.908 6.440 -2.208 1.00 16.54 ? 32 TYR L CD1 1 ATOM 8635 C CD2 . TYR F 2 37 ? 6.559 7.975 -3.986 1.00 16.15 ? 32 TYR L CD2 1 ATOM 8636 C CE1 . TYR F 2 37 ? 6.138 5.499 -2.872 1.00 17.51 ? 32 TYR L CE1 1 ATOM 8637 C CE2 . TYR F 2 37 ? 5.791 7.036 -4.656 1.00 16.99 ? 32 TYR L CE2 1 ATOM 8638 C CZ . TYR F 2 37 ? 5.575 5.808 -4.086 1.00 17.59 ? 32 TYR L CZ 1 ATOM 8639 O OH . TYR F 2 37 ? 4.800 4.895 -4.744 1.00 18.73 ? 32 TYR L OH 1 ATOM 8640 N N . LEU F 2 38 ? 8.446 9.696 1.377 1.00 16.94 ? 33 LEU L N 1 ATOM 8641 C CA . LEU F 2 38 ? 9.445 10.293 2.229 1.00 17.49 ? 33 LEU L CA 1 ATOM 8642 C C . LEU F 2 38 ? 9.947 9.192 3.120 1.00 17.44 ? 33 LEU L C 1 ATOM 8643 O O . LEU F 2 38 ? 9.161 8.647 3.889 1.00 17.75 ? 33 LEU L O 1 ATOM 8644 C CB . LEU F 2 38 ? 8.846 11.402 3.065 1.00 18.32 ? 33 LEU L CB 1 ATOM 8645 C CG . LEU F 2 38 ? 10.059 12.042 3.717 1.00 19.49 ? 33 LEU L CG 1 ATOM 8646 C CD1 . LEU F 2 38 ? 10.161 13.469 3.275 1.00 20.26 ? 33 LEU L CD1 1 ATOM 8647 C CD2 . LEU F 2 38 ? 9.957 11.893 5.220 1.00 20.83 ? 33 LEU L CD2 1 ATOM 8648 N N . GLU F 2 39 ? 11.244 8.903 3.010 1.00 16.97 ? 34 GLU L N 1 ATOM 8649 C CA . GLU F 2 39 ? 11.876 7.745 3.641 1.00 17.59 ? 34 GLU L CA 1 ATOM 8650 C C . GLU F 2 39 ? 13.012 8.201 4.542 1.00 17.51 ? 34 GLU L C 1 ATOM 8651 O O . GLU F 2 39 ? 13.630 9.235 4.273 1.00 16.80 ? 34 GLU L O 1 ATOM 8652 C CB . GLU F 2 39 ? 12.438 6.800 2.553 1.00 17.80 ? 34 GLU L CB 1 ATOM 8653 C CG . GLU F 2 39 ? 11.333 6.124 1.777 1.00 18.17 ? 34 GLU L CG 1 ATOM 8654 C CD . GLU F 2 39 ? 11.732 5.489 0.464 1.00 18.23 ? 34 GLU L CD 1 ATOM 8655 O OE1 . GLU F 2 39 ? 12.918 5.544 0.075 1.00 18.51 ? 34 GLU L OE1 1 ATOM 8656 O OE2 . GLU F 2 39 ? 10.819 4.904 -0.173 1.00 18.50 ? 34 GLU L OE2 1 ATOM 8657 N N . TRP F 2 40 ? 13.291 7.396 5.569 1.00 18.08 ? 35 TRP L N 1 ATOM 8658 C CA . TRP F 2 40 ? 14.450 7.563 6.433 1.00 18.77 ? 35 TRP L CA 1 ATOM 8659 C C . TRP F 2 40 ? 15.334 6.318 6.404 1.00 19.66 ? 35 TRP L C 1 ATOM 8660 O O . TRP F 2 40 ? 14.842 5.178 6.531 1.00 20.81 ? 35 TRP L O 1 ATOM 8661 C CB . TRP F 2 40 ? 14.014 7.804 7.872 1.00 19.70 ? 35 TRP L CB 1 ATOM 8662 C CG . TRP F 2 40 ? 13.298 9.074 8.068 1.00 19.44 ? 35 TRP L CG 1 ATOM 8663 C CD1 . TRP F 2 40 ? 11.952 9.276 8.002 1.00 19.43 ? 35 TRP L CD1 1 ATOM 8664 C CD2 . TRP F 2 40 ? 13.880 10.332 8.408 1.00 19.57 ? 35 TRP L CD2 1 ATOM 8665 N NE1 . TRP F 2 40 ? 11.660 10.587 8.283 1.00 19.74 ? 35 TRP L NE1 1 ATOM 8666 C CE2 . TRP F 2 40 ? 12.827 11.259 8.530 1.00 19.64 ? 35 TRP L CE2 1 ATOM 8667 C CE3 . TRP F 2 40 ? 15.196 10.766 8.625 1.00 19.85 ? 35 TRP L CE3 1 ATOM 8668 C CZ2 . TRP F 2 40 ? 13.045 12.591 8.848 1.00 20.05 ? 35 TRP L CZ2 1 ATOM 8669 C CZ3 . TRP F 2 40 ? 15.407 12.078 8.944 1.00 20.37 ? 35 TRP L CZ3 1 ATOM 8670 C CH2 . TRP F 2 40 ? 14.341 12.979 9.057 1.00 20.58 ? 35 TRP L CH2 1 ATOM 8671 N N . TYR F 2 41 ? 16.633 6.553 6.255 1.00 19.50 ? 36 TYR L N 1 ATOM 8672 C CA . TYR F 2 41 ? 17.648 5.508 6.259 1.00 20.56 ? 36 TYR L CA 1 ATOM 8673 C C . TYR F 2 41 ? 18.628 5.724 7.398 1.00 22.03 ? 36 TYR L C 1 ATOM 8674 O O . TYR F 2 41 ? 18.914 6.858 7.775 1.00 21.53 ? 36 TYR L O 1 ATOM 8675 C CB . TYR F 2 41 ? 18.432 5.505 4.939 1.00 20.04 ? 36 TYR L CB 1 ATOM 8676 C CG . TYR F 2 41 ? 17.561 5.124 3.783 1.00 19.34 ? 36 TYR L CG 1 ATOM 8677 C CD1 . TYR F 2 41 ? 16.832 6.085 3.093 1.00 17.96 ? 36 TYR L CD1 1 ATOM 8678 C CD2 . TYR F 2 41 ? 17.423 3.794 3.410 1.00 20.48 ? 36 TYR L CD2 1 ATOM 8679 C CE1 . TYR F 2 41 ? 16.008 5.736 2.035 1.00 17.91 ? 36 TYR L CE1 1 ATOM 8680 C CE2 . TYR F 2 41 ? 16.596 3.427 2.361 1.00 20.38 ? 36 TYR L CE2 1 ATOM 8681 C CZ . TYR F 2 41 ? 15.886 4.398 1.678 1.00 18.96 ? 36 TYR L CZ 1 ATOM 8682 O OH . TYR F 2 41 ? 15.065 4.032 0.653 1.00 18.80 ? 36 TYR L OH 1 ATOM 8683 N N . LEU F 2 42 ? 19.146 4.615 7.918 1.00 24.02 ? 37 LEU L N 1 ATOM 8684 C CA . LEU F 2 42 ? 20.200 4.618 8.913 1.00 25.73 ? 37 LEU L CA 1 ATOM 8685 C C . LEU F 2 42 ? 21.380 3.894 8.322 1.00 27.71 ? 37 LEU L C 1 ATOM 8686 O O . LEU F 2 42 ? 21.259 2.733 7.886 1.00 28.81 ? 37 LEU L O 1 ATOM 8687 C CB . LEU F 2 42 ? 19.764 3.878 10.165 1.00 27.19 ? 37 LEU L CB 1 ATOM 8688 C CG . LEU F 2 42 ? 20.834 3.536 11.207 1.00 29.12 ? 37 LEU L CG 1 ATOM 8689 C CD1 . LEU F 2 42 ? 21.566 4.790 11.672 1.00 28.85 ? 37 LEU L CD1 1 ATOM 8690 C CD2 . LEU F 2 42 ? 20.203 2.805 12.381 1.00 30.93 ? 37 LEU L CD2 1 ATOM 8691 N N . GLN F 2 43 ? 22.523 4.568 8.300 1.00 28.98 ? 38 GLN L N 1 ATOM 8692 C CA . GLN F 2 43 ? 23.733 3.909 7.931 1.00 31.44 ? 38 GLN L CA 1 ATOM 8693 C C . GLN F 2 43 ? 24.655 3.741 9.127 1.00 33.90 ? 38 GLN L C 1 ATOM 8694 O O . GLN F 2 43 ? 24.925 4.676 9.859 1.00 33.36 ? 38 GLN L O 1 ATOM 8695 C CB . GLN F 2 43 ? 24.454 4.652 6.827 1.00 31.51 ? 38 GLN L CB 1 ATOM 8696 C CG . GLN F 2 43 ? 25.667 3.855 6.361 1.00 33.70 ? 38 GLN L CG 1 ATOM 8697 C CD . GLN F 2 43 ? 26.196 4.387 5.088 1.00 34.19 ? 38 GLN L CD 1 ATOM 8698 O OE1 . GLN F 2 43 ? 26.554 3.607 4.192 1.00 35.67 ? 38 GLN L OE1 1 ATOM 8699 N NE2 . GLN F 2 43 ? 26.209 5.728 4.956 1.00 33.15 ? 38 GLN L NE2 1 ATOM 8700 N N . LYS F 2 44 ? 25.138 2.522 9.301 1.00 37.58 ? 39 LYS L N 1 ATOM 8701 C CA . LYS F 2 44 ? 26.122 2.230 10.310 1.00 40.85 ? 39 LYS L CA 1 ATOM 8702 C C . LYS F 2 44 ? 27.467 2.057 9.636 1.00 42.45 ? 39 LYS L C 1 ATOM 8703 O O . LYS F 2 44 ? 27.533 1.790 8.432 1.00 42.63 ? 39 LYS L O 1 ATOM 8704 C CB . LYS F 2 44 ? 25.701 1.000 11.103 1.00 43.58 ? 39 LYS L CB 1 ATOM 8705 C CG . LYS F 2 44 ? 24.401 1.263 11.856 1.00 43.68 ? 39 LYS L CG 1 ATOM 8706 C CD . LYS F 2 44 ? 24.245 0.402 13.098 1.00 47.36 ? 39 LYS L CD 1 ATOM 8707 C CE . LYS F 2 44 ? 23.054 -0.535 12.975 1.00 48.65 ? 39 LYS L CE 1 ATOM 8708 N NZ . LYS F 2 44 ? 23.052 -1.462 14.150 1.00 52.69 ? 39 LYS L NZ 1 ATOM 8709 N N . PRO F 2 45 ? 28.549 2.263 10.398 1.00 44.16 ? 40 PRO L N 1 ATOM 8710 C CA . PRO F 2 45 ? 29.888 2.119 9.852 1.00 45.56 ? 40 PRO L CA 1 ATOM 8711 C C . PRO F 2 45 ? 30.057 0.797 9.104 1.00 46.84 ? 40 PRO L C 1 ATOM 8712 O O . PRO F 2 45 ? 29.728 -0.271 9.641 1.00 47.99 ? 40 PRO L O 1 ATOM 8713 C CB . PRO F 2 45 ? 30.786 2.159 11.102 1.00 47.95 ? 40 PRO L CB 1 ATOM 8714 C CG . PRO F 2 45 ? 30.005 2.935 12.108 1.00 46.77 ? 40 PRO L CG 1 ATOM 8715 C CD . PRO F 2 45 ? 28.555 2.693 11.815 1.00 44.98 ? 40 PRO L CD 1 ATOM 8716 N N . GLY F 2 46 ? 30.528 0.882 7.858 1.00 46.55 ? 41 GLY L N 1 ATOM 8717 C CA . GLY F 2 46 ? 30.890 -0.309 7.077 1.00 47.88 ? 41 GLY L CA 1 ATOM 8718 C C . GLY F 2 46 ? 29.731 -1.168 6.614 1.00 46.83 ? 41 GLY L C 1 ATOM 8719 O O . GLY F 2 46 ? 29.944 -2.282 6.155 1.00 48.70 ? 41 GLY L O 1 ATOM 8720 N N . GLN F 2 47 ? 28.506 -0.666 6.772 1.00 43.80 ? 42 GLN L N 1 ATOM 8721 C CA . GLN F 2 47 ? 27.312 -1.312 6.241 1.00 42.76 ? 42 GLN L CA 1 ATOM 8722 C C . GLN F 2 47 ? 26.583 -0.396 5.276 1.00 39.62 ? 42 GLN L C 1 ATOM 8723 O O . GLN F 2 47 ? 26.783 0.822 5.287 1.00 37.99 ? 42 GLN L O 1 ATOM 8724 C CB . GLN F 2 47 ? 26.340 -1.625 7.371 1.00 42.55 ? 42 GLN L CB 1 ATOM 8725 C CG . GLN F 2 47 ? 26.821 -2.628 8.404 1.00 45.56 ? 42 GLN L CG 1 ATOM 8726 C CD . GLN F 2 47 ? 25.763 -2.902 9.477 1.00 45.72 ? 42 GLN L CD 1 ATOM 8727 O OE1 . GLN F 2 47 ? 24.576 -2.567 9.321 1.00 44.14 ? 42 GLN L OE1 1 ATOM 8728 N NE2 . GLN F 2 47 ? 26.183 -3.511 10.564 1.00 48.21 ? 42 GLN L NE2 1 ATOM 8729 N N . SER F 2 48 ? 25.694 -0.986 4.480 1.00 38.98 ? 43 SER L N 1 ATOM 8730 C CA . SER F 2 48 ? 24.837 -0.237 3.586 1.00 36.27 ? 43 SER L CA 1 ATOM 8731 C C . SER F 2 48 ? 23.817 0.548 4.400 1.00 33.51 ? 43 SER L C 1 ATOM 8732 O O . SER F 2 48 ? 23.592 0.233 5.579 1.00 33.74 ? 43 SER L O 1 ATOM 8733 C CB . SER F 2 48 ? 24.104 -1.179 2.645 1.00 37.15 ? 43 SER L CB 1 ATOM 8734 O OG . SER F 2 48 ? 25.015 -2.011 1.957 1.00 40.57 ? 43 SER L OG 1 ATOM 8735 N N . PRO F 2 49 ? 23.228 1.597 3.785 1.00 30.58 ? 44 PRO L N 1 ATOM 8736 C CA . PRO F 2 49 ? 22.078 2.220 4.416 1.00 28.42 ? 44 PRO L CA 1 ATOM 8737 C C . PRO F 2 49 ? 20.922 1.222 4.464 1.00 28.37 ? 44 PRO L C 1 ATOM 8738 O O . PRO F 2 49 ? 20.740 0.441 3.514 1.00 29.05 ? 44 PRO L O 1 ATOM 8739 C CB . PRO F 2 49 ? 21.749 3.410 3.501 1.00 26.51 ? 44 PRO L CB 1 ATOM 8740 C CG . PRO F 2 49 ? 22.971 3.635 2.687 1.00 27.61 ? 44 PRO L CG 1 ATOM 8741 C CD . PRO F 2 49 ? 23.643 2.302 2.565 1.00 30.04 ? 44 PRO L CD 1 ATOM 8742 N N . LYS F 2 50 ? 20.201 1.221 5.588 1.00 27.73 ? 45 LYS L N 1 ATOM 8743 C CA . LYS F 2 50 ? 19.010 0.385 5.752 1.00 28.08 ? 45 LYS L CA 1 ATOM 8744 C C . LYS F 2 50 ? 17.788 1.270 5.960 1.00 25.40 ? 45 LYS L C 1 ATOM 8745 O O . LYS F 2 50 ? 17.838 2.313 6.646 1.00 23.69 ? 45 LYS L O 1 ATOM 8746 C CB . LYS F 2 50 ? 19.153 -0.541 6.946 1.00 30.71 ? 45 LYS L CB 1 ATOM 8747 C CG . LYS F 2 50 ? 20.293 -1.536 6.822 1.00 33.65 ? 45 LYS L CG 1 ATOM 8748 C CD . LYS F 2 50 ? 20.326 -2.423 8.051 1.00 36.64 ? 45 LYS L CD 1 ATOM 8749 C CE . LYS F 2 50 ? 21.573 -3.295 8.080 1.00 39.78 ? 45 LYS L CE 1 ATOM 8750 N NZ . LYS F 2 50 ? 21.550 -4.325 7.000 1.00 41.60 ? 45 LYS L NZ 1 ATOM 8751 N N . LEU F 2 51 ? 16.691 0.830 5.368 1.00 24.78 ? 46 LEU L N 1 ATOM 8752 C CA . LEU F 2 51 ? 15.440 1.547 5.461 1.00 22.85 ? 46 LEU L CA 1 ATOM 8753 C C . LEU F 2 51 ? 14.853 1.385 6.858 1.00 23.62 ? 46 LEU L C 1 ATOM 8754 O O . LEU F 2 51 ? 14.777 0.267 7.387 1.00 25.45 ? 46 LEU L O 1 ATOM 8755 C CB . LEU F 2 51 ? 14.467 1.008 4.436 1.00 22.83 ? 46 LEU L CB 1 ATOM 8756 C CG . LEU F 2 51 ? 13.111 1.686 4.406 1.00 21.59 ? 46 LEU L CG 1 ATOM 8757 C CD1 . LEU F 2 51 ? 13.204 3.111 3.881 1.00 19.36 ? 46 LEU L CD1 1 ATOM 8758 C CD2 . LEU F 2 51 ? 12.189 0.865 3.532 1.00 22.54 ? 46 LEU L CD2 1 ATOM 8759 N N . LEU F 2 52 ? 14.476 2.510 7.460 1.00 22.32 ? 47 LEU L N 1 ATOM 8760 C CA . LEU F 2 52 ? 13.778 2.468 8.746 1.00 23.68 ? 47 LEU L CA 1 ATOM 8761 C C . LEU F 2 52 ? 12.293 2.761 8.577 1.00 23.30 ? 47 LEU L C 1 ATOM 8762 O O . LEU F 2 52 ? 11.432 2.055 9.094 1.00 24.78 ? 47 LEU L O 1 ATOM 8763 C CB . LEU F 2 52 ? 14.358 3.488 9.719 1.00 23.42 ? 47 LEU L CB 1 ATOM 8764 C CG . LEU F 2 52 ? 15.817 3.278 10.134 1.00 24.38 ? 47 LEU L CG 1 ATOM 8765 C CD1 . LEU F 2 52 ? 16.210 4.344 11.144 1.00 24.50 ? 47 LEU L CD1 1 ATOM 8766 C CD2 . LEU F 2 52 ? 16.063 1.885 10.700 1.00 26.85 ? 47 LEU L CD2 1 ATOM 8767 N N . ILE F 2 53 ? 12.023 3.838 7.848 1.00 21.40 ? 48 ILE L N 1 ATOM 8768 C CA . ILE F 2 53 ? 10.682 4.367 7.720 1.00 21.00 ? 48 ILE L CA 1 ATOM 8769 C C . ILE F 2 53 ? 10.401 4.649 6.260 1.00 19.11 ? 48 ILE L C 1 ATOM 8770 O O . ILE F 2 53 ? 11.241 5.210 5.586 1.00 17.93 ? 48 ILE L O 1 ATOM 8771 C CB . ILE F 2 53 ? 10.513 5.682 8.498 1.00 20.72 ? 48 ILE L CB 1 ATOM 8772 C CG1 . ILE F 2 53 ? 10.837 5.491 9.982 1.00 22.67 ? 48 ILE L CG1 1 ATOM 8773 C CG2 . ILE F 2 53 ? 9.090 6.209 8.350 1.00 20.65 ? 48 ILE L CG2 1 ATOM 8774 C CD1 . ILE F 2 53 ? 9.911 4.556 10.704 1.00 25.11 ? 48 ILE L CD1 1 ATOM 8775 N N . TYR F 2 54 ? 9.233 4.223 5.787 1.00 19.32 ? 49 TYR L N 1 ATOM 8776 C CA . TYR F 2 54 ? 8.784 4.563 4.454 1.00 18.30 ? 49 TYR L CA 1 ATOM 8777 C C . TYR F 2 54 ? 7.402 5.204 4.482 1.00 18.09 ? 49 TYR L C 1 ATOM 8778 O O . TYR F 2 54 ? 6.621 5.064 5.449 1.00 19.60 ? 49 TYR L O 1 ATOM 8779 C CB . TYR F 2 54 ? 8.795 3.336 3.525 1.00 19.34 ? 49 TYR L CB 1 ATOM 8780 C CG . TYR F 2 54 ? 7.781 2.285 3.859 1.00 21.46 ? 49 TYR L CG 1 ATOM 8781 C CD1 . TYR F 2 54 ? 8.013 1.373 4.888 1.00 23.73 ? 49 TYR L CD1 1 ATOM 8782 C CD2 . TYR F 2 54 ? 6.612 2.167 3.128 1.00 21.92 ? 49 TYR L CD2 1 ATOM 8783 C CE1 . TYR F 2 54 ? 7.092 0.387 5.194 1.00 26.33 ? 49 TYR L CE1 1 ATOM 8784 C CE2 . TYR F 2 54 ? 5.674 1.192 3.428 1.00 24.29 ? 49 TYR L CE2 1 ATOM 8785 C CZ . TYR F 2 54 ? 5.924 0.310 4.462 1.00 26.61 ? 49 TYR L CZ 1 ATOM 8786 O OH . TYR F 2 54 ? 5.021 -0.657 4.777 1.00 29.75 ? 49 TYR L OH 1 ATOM 8787 N N . LYS F 2 55 ? 7.108 5.929 3.430 1.00 16.62 ? 50 LYS L N 1 ATOM 8788 C CA . LYS F 2 55 ? 5.861 6.624 3.340 1.00 16.48 ? 50 LYS L CA 1 ATOM 8789 C C . LYS F 2 55 ? 5.558 7.492 4.568 1.00 16.73 ? 50 LYS L C 1 ATOM 8790 O O . LYS F 2 55 ? 4.517 7.422 5.140 1.00 17.88 ? 50 LYS L O 1 ATOM 8791 C CB . LYS F 2 55 ? 4.743 5.681 2.943 1.00 17.66 ? 50 LYS L CB 1 ATOM 8792 C CG . LYS F 2 55 ? 4.642 5.511 1.459 1.00 17.25 ? 50 LYS L CG 1 ATOM 8793 C CD . LYS F 2 55 ? 3.782 4.339 1.089 1.00 19.06 ? 50 LYS L CD 1 ATOM 8794 C CE . LYS F 2 55 ? 2.331 4.614 1.374 1.00 19.76 ? 50 LYS L CE 1 ATOM 8795 N NZ . LYS F 2 55 ? 1.569 3.369 1.284 1.00 21.96 ? 50 LYS L NZ 1 ATOM 8796 N N . VAL F 2 56 ? 6.533 8.284 4.956 1.00 15.91 ? 51 VAL L N 1 ATOM 8797 C CA . VAL F 2 56 ? 6.445 9.194 6.085 1.00 16.44 ? 51 VAL L CA 1 ATOM 8798 C C . VAL F 2 56 ? 6.506 8.560 7.461 1.00 18.35 ? 51 VAL L C 1 ATOM 8799 O O . VAL F 2 56 ? 7.264 8.981 8.289 1.00 18.82 ? 51 VAL L O 1 ATOM 8800 C CB . VAL F 2 56 ? 5.220 10.132 6.003 1.00 16.86 ? 51 VAL L CB 1 ATOM 8801 C CG1 . VAL F 2 56 ? 5.324 11.246 7.020 1.00 17.96 ? 51 VAL L CG1 1 ATOM 8802 C CG2 . VAL F 2 56 ? 5.033 10.662 4.611 1.00 15.51 ? 51 VAL L CG2 1 ATOM 8803 N N . SER F 2 57 ? 5.622 7.616 7.703 1.00 19.91 ? 52 SER L N 1 ATOM 8804 C CA . SER F 2 57 ? 5.455 7.037 9.008 1.00 22.45 ? 52 SER L CA 1 ATOM 8805 C C . SER F 2 57 ? 5.362 5.524 9.116 1.00 24.06 ? 52 SER L C 1 ATOM 8806 O O . SER F 2 57 ? 5.036 5.025 10.161 1.00 26.23 ? 52 SER L O 1 ATOM 8807 C CB . SER F 2 57 ? 4.277 7.684 9.712 1.00 24.10 ? 52 SER L CB 1 ATOM 8808 O OG . SER F 2 57 ? 3.097 7.508 8.997 1.00 24.86 ? 52 SER L OG 1 ATOM 8809 N N . ASN F 2 58 ? 5.664 4.796 8.064 1.00 23.27 ? 53 ASN L N 1 ATOM 8810 C CA . ASN F 2 58 ? 5.496 3.348 8.095 1.00 25.61 ? 53 ASN L CA 1 ATOM 8811 C C . ASN F 2 58 ? 6.787 2.624 8.418 1.00 26.31 ? 53 ASN L C 1 ATOM 8812 O O . ASN F 2 58 ? 7.750 2.744 7.718 1.00 24.69 ? 53 ASN L O 1 ATOM 8813 C CB . ASN F 2 58 ? 4.925 2.806 6.777 1.00 25.25 ? 53 ASN L CB 1 ATOM 8814 C CG . ASN F 2 58 ? 3.591 3.411 6.399 1.00 24.93 ? 53 ASN L CG 1 ATOM 8815 O OD1 . ASN F 2 58 ? 2.585 2.758 6.462 1.00 27.18 ? 53 ASN L OD1 1 ATOM 8816 N ND2 . ASN F 2 58 ? 3.597 4.637 5.960 1.00 22.88 ? 53 ASN L ND2 1 ATOM 8817 N N . ARG F 2 59 ? 6.780 1.845 9.486 1.00 29.37 ? 54 ARG L N 1 ATOM 8818 C CA . ARG F 2 59 ? 7.995 1.235 9.970 1.00 30.72 ? 54 ARG L CA 1 ATOM 8819 C C . ARG F 2 59 ? 8.294 0.029 9.114 1.00 31.00 ? 54 ARG L C 1 ATOM 8820 O O . ARG F 2 59 ? 7.426 -0.784 8.889 1.00 32.70 ? 54 ARG L O 1 ATOM 8821 C CB . ARG F 2 59 ? 7.764 0.924 11.427 1.00 34.54 ? 54 ARG L CB 1 ATOM 8822 C CG . ARG F 2 59 ? 8.774 0.075 12.153 1.00 37.75 ? 54 ARG L CG 1 ATOM 8823 C CD . ARG F 2 59 ? 8.393 -0.074 13.627 1.00 41.84 ? 54 ARG L CD 1 ATOM 8824 N NE . ARG F 2 59 ? 7.775 1.141 14.153 1.00 42.16 ? 54 ARG L NE 1 ATOM 8825 C CZ . ARG F 2 59 ? 6.520 1.251 14.593 1.00 45.20 ? 54 ARG L CZ 1 ATOM 8826 N NH1 . ARG F 2 59 ? 5.701 0.198 14.623 1.00 48.25 ? 54 ARG L NH1 1 ATOM 8827 N NH2 . ARG F 2 59 ? 6.075 2.432 15.034 1.00 45.55 ? 54 ARG L NH2 1 ATOM 8828 N N . PHE F 2 60 ? 9.511 -0.046 8.585 1.00 29.72 ? 55 PHE L N 1 ATOM 8829 C CA . PHE F 2 60 ? 9.925 -1.180 7.751 1.00 30.70 ? 55 PHE L CA 1 ATOM 8830 C C . PHE F 2 60 ? 10.078 -2.413 8.634 1.00 34.63 ? 55 PHE L C 1 ATOM 8831 O O . PHE F 2 60 ? 10.366 -2.319 9.835 1.00 35.59 ? 55 PHE L O 1 ATOM 8832 C CB . PHE F 2 60 ? 11.235 -0.861 7.014 1.00 28.75 ? 55 PHE L CB 1 ATOM 8833 C CG . PHE F 2 60 ? 11.643 -1.882 5.968 1.00 29.59 ? 55 PHE L CG 1 ATOM 8834 C CD1 . PHE F 2 60 ? 10.907 -2.045 4.812 1.00 29.18 ? 55 PHE L CD1 1 ATOM 8835 C CD2 . PHE F 2 60 ? 12.794 -2.644 6.125 1.00 31.11 ? 55 PHE L CD2 1 ATOM 8836 C CE1 . PHE F 2 60 ? 11.291 -2.962 3.842 1.00 30.45 ? 55 PHE L CE1 1 ATOM 8837 C CE2 . PHE F 2 60 ? 13.182 -3.559 5.161 1.00 32.49 ? 55 PHE L CE2 1 ATOM 8838 C CZ . PHE F 2 60 ? 12.423 -3.723 4.016 1.00 32.19 ? 55 PHE L CZ 1 ATOM 8839 N N . SER F 2 61 ? 9.878 -3.574 8.027 1.00 37.29 ? 56 SER L N 1 ATOM 8840 C CA . SER F 2 61 ? 9.877 -4.835 8.741 1.00 41.71 ? 56 SER L CA 1 ATOM 8841 C C . SER F 2 61 ? 11.220 -5.004 9.454 1.00 42.76 ? 56 SER L C 1 ATOM 8842 O O . SER F 2 61 ? 12.247 -4.630 8.901 1.00 41.16 ? 56 SER L O 1 ATOM 8843 C CB . SER F 2 61 ? 9.580 -5.946 7.732 1.00 43.81 ? 56 SER L CB 1 ATOM 8844 O OG . SER F 2 61 ? 9.485 -7.219 8.330 1.00 48.64 ? 56 SER L OG 1 ATOM 8845 N N . GLY F 2 62 ? 11.204 -5.484 10.697 1.00 45.94 ? 57 GLY L N 1 ATOM 8846 C CA . GLY F 2 62 ? 12.427 -5.634 11.478 1.00 47.38 ? 57 GLY L CA 1 ATOM 8847 C C . GLY F 2 62 ? 12.863 -4.417 12.281 1.00 45.63 ? 57 GLY L C 1 ATOM 8848 O O . GLY F 2 62 ? 13.708 -4.541 13.175 1.00 47.80 ? 57 GLY L O 1 ATOM 8849 N N . VAL F 2 63 ? 12.298 -3.247 11.987 1.00 42.53 ? 58 VAL L N 1 ATOM 8850 C CA . VAL F 2 63 ? 12.629 -2.015 12.706 1.00 40.75 ? 58 VAL L CA 1 ATOM 8851 C C . VAL F 2 63 ? 11.735 -1.917 13.920 1.00 43.38 ? 58 VAL L C 1 ATOM 8852 O O . VAL F 2 63 ? 10.517 -1.963 13.772 1.00 44.18 ? 58 VAL L O 1 ATOM 8853 C CB . VAL F 2 63 ? 12.361 -0.778 11.836 1.00 36.92 ? 58 VAL L CB 1 ATOM 8854 C CG1 . VAL F 2 63 ? 12.741 0.502 12.570 1.00 35.57 ? 58 VAL L CG1 1 ATOM 8855 C CG2 . VAL F 2 63 ? 13.117 -0.889 10.528 1.00 34.97 ? 58 VAL L CG2 1 ATOM 8856 N N . PRO F 2 64 ? 12.313 -1.764 15.122 1.00 45.49 ? 59 PRO L N 1 ATOM 8857 C CA . PRO F 2 64 ? 11.495 -1.784 16.350 1.00 48.68 ? 59 PRO L CA 1 ATOM 8858 C C . PRO F 2 64 ? 10.735 -0.488 16.592 1.00 47.29 ? 59 PRO L C 1 ATOM 8859 O O . PRO F 2 64 ? 11.150 0.570 16.124 1.00 44.11 ? 59 PRO L O 1 ATOM 8860 C CB . PRO F 2 64 ? 12.522 -1.980 17.457 1.00 51.06 ? 59 PRO L CB 1 ATOM 8861 C CG . PRO F 2 64 ? 13.788 -1.411 16.903 1.00 48.00 ? 59 PRO L CG 1 ATOM 8862 C CD . PRO F 2 64 ? 13.742 -1.567 15.408 1.00 45.16 ? 59 PRO L CD 1 ATOM 8863 N N . ASP F 2 65 ? 9.659 -0.562 17.368 1.00 50.48 ? 60 ASP L N 1 ATOM 8864 C CA . ASP F 2 65 ? 8.706 0.553 17.448 1.00 49.69 ? 60 ASP L CA 1 ATOM 8865 C C . ASP F 2 65 ? 9.182 1.778 18.245 1.00 49.21 ? 60 ASP L C 1 ATOM 8866 O O . ASP F 2 65 ? 8.410 2.727 18.425 1.00 48.87 ? 60 ASP L O 1 ATOM 8867 C CB . ASP F 2 65 ? 7.309 0.121 17.925 1.00 53.09 ? 60 ASP L CB 1 ATOM 8868 C CG . ASP F 2 65 ? 7.351 -0.850 19.075 1.00 58.06 ? 60 ASP L CG 1 ATOM 8869 O OD1 . ASP F 2 65 ? 8.432 -1.021 19.685 1.00 58.83 ? 60 ASP L OD1 1 ATOM 8870 O OD2 . ASP F 2 65 ? 6.292 -1.447 19.359 1.00 61.61 ? 60 ASP L OD2 1 ATOM 8871 N N . ARG F 2 66 ? 10.433 1.777 18.711 1.00 49.34 ? 61 ARG L N 1 ATOM 8872 C CA . ARG F 2 66 ? 10.994 3.003 19.291 1.00 48.65 ? 61 ARG L CA 1 ATOM 8873 C C . ARG F 2 66 ? 11.267 4.050 18.203 1.00 44.05 ? 61 ARG L C 1 ATOM 8874 O O . ARG F 2 66 ? 11.410 5.235 18.492 1.00 43.39 ? 61 ARG L O 1 ATOM 8875 C CB . ARG F 2 66 ? 12.235 2.734 20.166 1.00 50.78 ? 61 ARG L CB 1 ATOM 8876 C CG . ARG F 2 66 ? 13.317 1.857 19.558 1.00 50.02 ? 61 ARG L CG 1 ATOM 8877 C CD . ARG F 2 66 ? 14.601 1.912 20.386 1.00 51.42 ? 61 ARG L CD 1 ATOM 8878 N NE . ARG F 2 66 ? 15.759 1.396 19.664 1.00 49.67 ? 61 ARG L NE 1 ATOM 8879 C CZ . ARG F 2 66 ? 16.024 0.103 19.485 1.00 51.46 ? 61 ARG L CZ 1 ATOM 8880 N NH1 . ARG F 2 66 ? 15.213 -0.836 19.970 1.00 54.65 ? 61 ARG L NH1 1 ATOM 8881 N NH2 . ARG F 2 66 ? 17.114 -0.259 18.809 1.00 50.38 ? 61 ARG L NH2 1 ATOM 8882 N N . PHE F 2 67 ? 11.318 3.601 16.954 1.00 41.33 ? 62 PHE L N 1 ATOM 8883 C CA . PHE F 2 67 ? 11.410 4.490 15.801 1.00 37.47 ? 62 PHE L CA 1 ATOM 8884 C C . PHE F 2 67 ? 10.052 4.890 15.246 1.00 36.55 ? 62 PHE L C 1 ATOM 8885 O O . PHE F 2 67 ? 9.227 4.027 14.964 1.00 37.74 ? 62 PHE L O 1 ATOM 8886 C CB . PHE F 2 67 ? 12.138 3.803 14.661 1.00 35.64 ? 62 PHE L CB 1 ATOM 8887 C CG . PHE F 2 67 ? 13.589 3.553 14.924 1.00 35.94 ? 62 PHE L CG 1 ATOM 8888 C CD1 . PHE F 2 67 ? 14.522 4.561 14.719 1.00 34.21 ? 62 PHE L CD1 1 ATOM 8889 C CD2 . PHE F 2 67 ? 14.030 2.311 15.353 1.00 38.07 ? 62 PHE L CD2 1 ATOM 8890 C CE1 . PHE F 2 67 ? 15.867 4.334 14.962 1.00 34.79 ? 62 PHE L CE1 1 ATOM 8891 C CE2 . PHE F 2 67 ? 15.369 2.080 15.590 1.00 38.54 ? 62 PHE L CE2 1 ATOM 8892 C CZ . PHE F 2 67 ? 16.289 3.091 15.396 1.00 36.87 ? 62 PHE L CZ 1 ATOM 8893 N N . SER F 2 68 ? 9.841 6.187 15.040 1.00 34.79 ? 63 SER L N 1 ATOM 8894 C CA . SER F 2 68 ? 8.595 6.670 14.461 1.00 33.95 ? 63 SER L CA 1 ATOM 8895 C C . SER F 2 68 ? 8.890 7.836 13.546 1.00 30.85 ? 63 SER L C 1 ATOM 8896 O O . SER F 2 68 ? 9.767 8.654 13.827 1.00 31.12 ? 63 SER L O 1 ATOM 8897 C CB . SER F 2 68 ? 7.587 7.077 15.527 1.00 37.05 ? 63 SER L CB 1 ATOM 8898 O OG . SER F 2 68 ? 7.995 8.255 16.191 1.00 38.36 ? 63 SER L OG 1 ATOM 8899 N N . GLY F 2 69 ? 8.174 7.888 12.434 1.00 28.44 ? 64 GLY L N 1 ATOM 8900 C CA . GLY F 2 69 ? 8.292 8.970 11.477 1.00 25.63 ? 64 GLY L CA 1 ATOM 8901 C C . GLY F 2 69 ? 7.000 9.739 11.480 1.00 25.70 ? 64 GLY L C 1 ATOM 8902 O O . GLY F 2 69 ? 5.957 9.169 11.723 1.00 26.64 ? 64 GLY L O 1 ATOM 8903 N N . SER F 2 70 ? 7.077 11.036 11.210 1.00 24.69 ? 65 SER L N 1 ATOM 8904 C CA . SER F 2 70 ? 5.884 11.852 11.127 1.00 25.20 ? 65 SER L CA 1 ATOM 8905 C C . SER F 2 70 ? 6.161 13.070 10.286 1.00 23.52 ? 65 SER L C 1 ATOM 8906 O O . SER F 2 70 ? 7.295 13.287 9.863 1.00 22.26 ? 65 SER L O 1 ATOM 8907 C CB . SER F 2 70 ? 5.417 12.271 12.514 1.00 28.15 ? 65 SER L CB 1 ATOM 8908 O OG . SER F 2 70 ? 6.268 13.274 13.014 1.00 29.11 ? 65 SER L OG 1 ATOM 8909 N N . GLY F 2 71 ? 5.119 13.859 10.056 1.00 23.91 ? 66 GLY L N 1 ATOM 8910 C CA . GLY F 2 71 ? 5.241 15.095 9.318 1.00 23.49 ? 66 GLY L CA 1 ATOM 8911 C C . GLY F 2 71 ? 4.423 15.147 8.032 1.00 22.31 ? 66 GLY L C 1 ATOM 8912 O O . GLY F 2 71 ? 3.763 14.179 7.637 1.00 21.60 ? 66 GLY L O 1 ATOM 8913 N N . SER F 2 72 ? 4.433 16.316 7.404 1.00 22.46 ? 67 SER L N 1 ATOM 8914 C CA . SER F 2 72 ? 3.690 16.524 6.179 1.00 21.80 ? 67 SER L CA 1 ATOM 8915 C C . SER F 2 72 ? 4.175 17.779 5.465 1.00 21.85 ? 67 SER L C 1 ATOM 8916 O O . SER F 2 72 ? 4.646 18.728 6.109 1.00 23.17 ? 67 SER L O 1 ATOM 8917 C CB . SER F 2 72 ? 2.208 16.646 6.562 1.00 23.57 ? 67 SER L CB 1 ATOM 8918 O OG . SER F 2 72 ? 1.331 16.614 5.454 1.00 23.17 ? 67 SER L OG 1 ATOM 8919 N N . GLY F 2 73 ? 4.063 17.783 4.138 1.00 20.72 ? 68 GLY L N 1 ATOM 8920 C CA . GLY F 2 73 ? 4.300 19.000 3.343 1.00 21.39 ? 68 GLY L CA 1 ATOM 8921 C C . GLY F 2 73 ? 5.767 19.295 3.156 1.00 20.88 ? 68 GLY L C 1 ATOM 8922 O O . GLY F 2 73 ? 6.423 18.718 2.285 1.00 19.22 ? 68 GLY L O 1 ATOM 8923 N N . THR F 2 74 ? 6.292 20.195 3.977 1.00 22.60 ? 69 THR L N 1 ATOM 8924 C CA . THR F 2 74 ? 7.726 20.508 3.926 1.00 22.78 ? 69 THR L CA 1 ATOM 8925 C C . THR F 2 74 ? 8.478 20.134 5.189 1.00 23.23 ? 69 THR L C 1 ATOM 8926 O O . THR F 2 74 ? 9.661 20.402 5.276 1.00 24.02 ? 69 THR L O 1 ATOM 8927 C CB . THR F 2 74 ? 7.972 22.006 3.642 1.00 24.81 ? 69 THR L CB 1 ATOM 8928 O OG1 . THR F 2 74 ? 7.506 22.784 4.748 1.00 27.07 ? 69 THR L OG1 1 ATOM 8929 C CG2 . THR F 2 74 ? 7.258 22.447 2.360 1.00 24.94 ? 69 THR L CG2 1 ATOM 8930 N N . ASP F 2 75 ? 7.806 19.520 6.153 1.00 23.68 ? 70 ASP L N 1 ATOM 8931 C CA . ASP F 2 75 ? 8.332 19.352 7.503 1.00 25.01 ? 70 ASP L CA 1 ATOM 8932 C C . ASP F 2 75 ? 8.160 17.916 8.024 1.00 23.79 ? 70 ASP L C 1 ATOM 8933 O O . ASP F 2 75 ? 7.039 17.442 8.199 1.00 23.93 ? 70 ASP L O 1 ATOM 8934 C CB . ASP F 2 75 ? 7.568 20.284 8.402 1.00 28.11 ? 70 ASP L CB 1 ATOM 8935 C CG . ASP F 2 75 ? 8.391 20.775 9.549 1.00 30.87 ? 70 ASP L CG 1 ATOM 8936 O OD1 . ASP F 2 75 ? 9.338 20.053 9.953 1.00 30.80 ? 70 ASP L OD1 1 ATOM 8937 O OD2 . ASP F 2 75 ? 8.092 21.884 10.051 1.00 34.29 ? 70 ASP L OD2 1 ATOM 8938 N N . PHE F 2 76 ? 9.268 17.233 8.249 1.00 22.96 ? 71 PHE L N 1 ATOM 8939 C CA . PHE F 2 76 ? 9.272 15.817 8.638 1.00 22.29 ? 71 PHE L CA 1 ATOM 8940 C C . PHE F 2 76 ? 10.248 15.534 9.766 1.00 23.08 ? 71 PHE L C 1 ATOM 8941 O O . PHE F 2 76 ? 11.295 16.144 9.849 1.00 23.22 ? 71 PHE L O 1 ATOM 8942 C CB . PHE F 2 76 ? 9.638 14.949 7.433 1.00 20.38 ? 71 PHE L CB 1 ATOM 8943 C CG . PHE F 2 76 ? 8.720 15.141 6.264 1.00 19.89 ? 71 PHE L CG 1 ATOM 8944 C CD1 . PHE F 2 76 ? 7.553 14.410 6.157 1.00 20.14 ? 71 PHE L CD1 1 ATOM 8945 C CD2 . PHE F 2 76 ? 9.015 16.060 5.278 1.00 20.16 ? 71 PHE L CD2 1 ATOM 8946 C CE1 . PHE F 2 76 ? 6.696 14.585 5.073 1.00 19.76 ? 71 PHE L CE1 1 ATOM 8947 C CE2 . PHE F 2 76 ? 8.169 16.243 4.190 1.00 19.76 ? 71 PHE L CE2 1 ATOM 8948 C CZ . PHE F 2 76 ? 7.013 15.507 4.088 1.00 19.32 ? 71 PHE L CZ 1 ATOM 8949 N N . THR F 2 77 ? 9.915 14.560 10.593 1.00 23.75 ? 72 THR L N 1 ATOM 8950 C CA . THR F 2 77 ? 10.679 14.257 11.784 1.00 25.49 ? 72 THR L CA 1 ATOM 8951 C C . THR F 2 77 ? 10.837 12.767 11.973 1.00 25.94 ? 72 THR L C 1 ATOM 8952 O O . THR F 2 77 ? 9.902 12.006 11.713 1.00 26.29 ? 72 THR L O 1 ATOM 8953 C CB . THR F 2 77 ? 9.980 14.827 12.999 1.00 27.85 ? 72 THR L CB 1 ATOM 8954 O OG1 . THR F 2 77 ? 9.866 16.230 12.792 1.00 28.60 ? 72 THR L OG1 1 ATOM 8955 C CG2 . THR F 2 77 ? 10.774 14.581 14.276 1.00 29.72 ? 72 THR L CG2 1 ATOM 8956 N N . LEU F 2 78 ? 12.025 12.350 12.390 1.00 26.80 ? 73 LEU L N 1 ATOM 8957 C CA . LEU F 2 78 ? 12.250 10.994 12.845 1.00 28.22 ? 73 LEU L CA 1 ATOM 8958 C C . LEU F 2 78 ? 12.504 11.034 14.330 1.00 31.82 ? 73 LEU L C 1 ATOM 8959 O O . LEU F 2 78 ? 13.403 11.744 14.779 1.00 32.31 ? 73 LEU L O 1 ATOM 8960 C CB . LEU F 2 78 ? 13.452 10.378 12.129 1.00 26.80 ? 73 LEU L CB 1 ATOM 8961 C CG . LEU F 2 78 ? 13.818 8.964 12.570 1.00 28.02 ? 73 LEU L CG 1 ATOM 8962 C CD1 . LEU F 2 78 ? 12.734 7.964 12.192 1.00 28.12 ? 73 LEU L CD1 1 ATOM 8963 C CD2 . LEU F 2 78 ? 15.127 8.531 11.945 1.00 27.57 ? 73 LEU L CD2 1 ATOM 8964 N N . LYS F 2 79 ? 11.724 10.271 15.092 1.00 35.32 ? 74 LYS L N 1 ATOM 8965 C CA . LYS F 2 79 ? 11.915 10.175 16.539 1.00 39.84 ? 74 LYS L CA 1 ATOM 8966 C C . LYS F 2 79 ? 12.377 8.787 16.935 1.00 40.52 ? 74 LYS L C 1 ATOM 8967 O O . LYS F 2 79 ? 11.968 7.790 16.340 1.00 38.78 ? 74 LYS L O 1 ATOM 8968 C CB . LYS F 2 79 ? 10.629 10.497 17.283 1.00 43.80 ? 74 LYS L CB 1 ATOM 8969 C CG . LYS F 2 79 ? 10.242 11.953 17.191 1.00 46.14 ? 74 LYS L CG 1 ATOM 8970 C CD . LYS F 2 79 ? 9.318 12.346 18.333 1.00 51.79 ? 74 LYS L CD 1 ATOM 8971 C CE . LYS F 2 79 ? 8.778 13.760 18.133 1.00 53.81 ? 74 LYS L CE 1 ATOM 8972 N NZ . LYS F 2 79 ? 7.803 13.818 17.002 1.00 52.82 ? 74 LYS L NZ 1 ATOM 8973 N N . ILE F 2 80 ? 13.257 8.750 17.930 1.00 42.91 ? 75 ILE L N 1 ATOM 8974 C CA . ILE F 2 80 ? 13.648 7.518 18.600 1.00 44.98 ? 75 ILE L CA 1 ATOM 8975 C C . ILE F 2 80 ? 13.283 7.730 20.037 1.00 48.87 ? 75 ILE L C 1 ATOM 8976 O O . ILE F 2 80 ? 13.807 8.645 20.653 1.00 49.99 ? 75 ILE L O 1 ATOM 8977 C CB . ILE F 2 80 ? 15.149 7.245 18.489 1.00 44.17 ? 75 ILE L CB 1 ATOM 8978 C CG1 . ILE F 2 80 ? 15.572 7.329 17.034 1.00 40.60 ? 75 ILE L CG1 1 ATOM 8979 C CG2 . ILE F 2 80 ? 15.461 5.862 19.039 1.00 46.91 ? 75 ILE L CG2 1 ATOM 8980 C CD1 . ILE F 2 80 ? 17.064 7.315 16.834 1.00 40.30 ? 75 ILE L CD1 1 ATOM 8981 N N . SER F 2 81 ? 12.363 6.917 20.553 1.00 52.06 ? 76 SER L N 1 ATOM 8982 C CA . SER F 2 81 ? 11.810 7.167 21.865 1.00 56.35 ? 76 SER L CA 1 ATOM 8983 C C . SER F 2 81 ? 12.862 6.956 22.956 1.00 59.56 ? 76 SER L C 1 ATOM 8984 O O . SER F 2 81 ? 12.907 7.721 23.926 1.00 62.45 ? 76 SER L O 1 ATOM 8985 C CB . SER F 2 81 ? 10.607 6.273 22.081 1.00 58.77 ? 76 SER L CB 1 ATOM 8986 O OG . SER F 2 81 ? 11.015 4.950 21.794 1.00 59.14 ? 76 SER L OG 1 ATOM 8987 N N . ARG F 2 82 ? 13.709 5.938 22.784 1.00 59.40 ? 77 ARG L N 1 ATOM 8988 C CA . ARG F 2 82 ? 14.683 5.543 23.813 1.00 62.31 ? 77 ARG L CA 1 ATOM 8989 C C . ARG F 2 82 ? 15.947 4.899 23.178 1.00 59.90 ? 77 ARG L C 1 ATOM 8990 O O . ARG F 2 82 ? 16.004 3.687 22.946 1.00 60.99 ? 77 ARG L O 1 ATOM 8991 C CB . ARG F 2 82 ? 13.978 4.626 24.854 1.00 67.57 ? 77 ARG L CB 1 ATOM 8992 C CG . ARG F 2 82 ? 14.250 3.126 24.748 1.00 69.63 ? 77 ARG L CG 1 ATOM 8993 C CD . ARG F 2 82 ? 13.132 2.278 25.341 1.00 74.18 ? 77 ARG L CD 1 ATOM 8994 N NE . ARG F 2 82 ? 11.860 2.572 24.675 1.00 73.08 ? 77 ARG L NE 1 ATOM 8995 C CZ . ARG F 2 82 ? 10.824 3.186 25.242 1.00 75.51 ? 77 ARG L CZ 1 ATOM 8996 N NH1 . ARG F 2 82 ? 10.861 3.547 26.526 1.00 79.69 ? 77 ARG L NH1 1 ATOM 8997 N NH2 . ARG F 2 82 ? 9.734 3.423 24.519 1.00 73.61 ? 77 ARG L NH2 1 ATOM 8998 N N . VAL F 2 83 ? 16.973 5.721 22.944 1.00 56.73 ? 78 VAL L N 1 ATOM 8999 C CA . VAL F 2 83 ? 18.126 5.337 22.132 1.00 53.67 ? 78 VAL L CA 1 ATOM 9000 C C . VAL F 2 83 ? 18.961 4.200 22.716 1.00 56.15 ? 78 VAL L C 1 ATOM 9001 O O . VAL F 2 83 ? 19.400 4.264 23.869 1.00 59.71 ? 78 VAL L O 1 ATOM 9002 C CB . VAL F 2 83 ? 19.070 6.534 21.910 1.00 51.62 ? 78 VAL L CB 1 ATOM 9003 C CG1 . VAL F 2 83 ? 20.393 6.082 21.312 1.00 50.42 ? 78 VAL L CG1 1 ATOM 9004 C CG2 . VAL F 2 83 ? 18.417 7.567 21.018 1.00 48.47 ? 78 VAL L CG2 1 ATOM 9005 N N . GLU F 2 84 ? 19.233 3.199 21.881 1.00 54.72 ? 79 GLU L N 1 ATOM 9006 C CA . GLU F 2 84 ? 20.148 2.101 22.214 1.00 56.82 ? 79 GLU L CA 1 ATOM 9007 C C . GLU F 2 84 ? 21.411 2.140 21.344 1.00 53.51 ? 79 GLU L C 1 ATOM 9008 O O . GLU F 2 84 ? 21.481 2.829 20.326 1.00 49.50 ? 79 GLU L O 1 ATOM 9009 C CB . GLU F 2 84 ? 19.448 0.763 22.032 1.00 59.13 ? 79 GLU L CB 1 ATOM 9010 C CG . GLU F 2 84 ? 18.059 0.733 22.645 1.00 61.84 ? 79 GLU L CG 1 ATOM 9011 C CD . GLU F 2 84 ? 17.606 -0.671 22.995 1.00 66.08 ? 79 GLU L CD 1 ATOM 9012 O OE1 . GLU F 2 84 ? 16.804 -0.799 23.950 1.00 69.70 ? 79 GLU L OE1 1 ATOM 9013 O OE2 . GLU F 2 84 ? 18.064 -1.637 22.326 1.00 66.25 ? 79 GLU L OE2 1 ATOM 9014 N N . ALA F 2 85 ? 22.408 1.375 21.753 1.00 54.91 ? 80 ALA L N 1 ATOM 9015 C CA . ALA F 2 85 ? 23.735 1.414 21.122 1.00 52.97 ? 80 ALA L CA 1 ATOM 9016 C C . ALA F 2 85 ? 23.698 1.149 19.632 1.00 49.47 ? 80 ALA L C 1 ATOM 9017 O O . ALA F 2 85 ? 24.455 1.734 18.869 1.00 46.91 ? 80 ALA L O 1 ATOM 9018 C CB . ALA F 2 85 ? 24.648 0.391 21.764 1.00 56.48 ? 80 ALA L CB 1 ATOM 9019 N N . GLU F 2 86 ? 22.845 0.215 19.241 1.00 49.43 ? 81 GLU L N 1 ATOM 9020 C CA . GLU F 2 86 ? 22.722 -0.179 17.851 1.00 46.92 ? 81 GLU L CA 1 ATOM 9021 C C . GLU F 2 86 ? 22.114 0.900 16.961 1.00 42.50 ? 81 GLU L C 1 ATOM 9022 O O . GLU F 2 86 ? 22.212 0.803 15.743 1.00 40.58 ? 81 GLU L O 1 ATOM 9023 C CB . GLU F 2 86 ? 21.899 -1.460 17.759 1.00 49.41 ? 81 GLU L CB 1 ATOM 9024 C CG . GLU F 2 86 ? 20.442 -1.284 18.148 1.00 49.94 ? 81 GLU L CG 1 ATOM 9025 C CD . GLU F 2 86 ? 19.789 -2.610 18.494 1.00 53.88 ? 81 GLU L CD 1 ATOM 9026 O OE1 . GLU F 2 86 ? 18.944 -3.065 17.688 1.00 53.49 ? 81 GLU L OE1 1 ATOM 9027 O OE2 . GLU F 2 86 ? 20.130 -3.199 19.560 1.00 57.94 ? 81 GLU L OE2 1 ATOM 9028 N N . ASP F 2 87 ? 21.493 1.920 17.557 1.00 41.25 ? 82 ASP L N 1 ATOM 9029 C CA . ASP F 2 87 ? 20.892 3.035 16.805 1.00 37.54 ? 82 ASP L CA 1 ATOM 9030 C C . ASP F 2 87 ? 21.903 4.068 16.318 1.00 35.38 ? 82 ASP L C 1 ATOM 9031 O O . ASP F 2 87 ? 21.580 4.899 15.473 1.00 32.92 ? 82 ASP L O 1 ATOM 9032 C CB . ASP F 2 87 ? 19.855 3.759 17.659 1.00 38.09 ? 82 ASP L CB 1 ATOM 9033 C CG . ASP F 2 87 ? 18.820 2.824 18.226 1.00 40.45 ? 82 ASP L CG 1 ATOM 9034 O OD1 . ASP F 2 87 ? 18.544 1.771 17.613 1.00 40.49 ? 82 ASP L OD1 1 ATOM 9035 O OD2 . ASP F 2 87 ? 18.268 3.147 19.298 1.00 42.84 ? 82 ASP L OD2 1 ATOM 9036 N N . LEU F 2 88 ? 23.120 4.018 16.845 1.00 36.62 ? 83 LEU L N 1 ATOM 9037 C CA . LEU F 2 88 ? 24.143 5.003 16.501 1.00 35.45 ? 83 LEU L CA 1 ATOM 9038 C C . LEU F 2 88 ? 24.614 4.821 15.067 1.00 33.47 ? 83 LEU L C 1 ATOM 9039 O O . LEU F 2 88 ? 24.817 3.705 14.605 1.00 34.29 ? 83 LEU L O 1 ATOM 9040 C CB . LEU F 2 88 ? 25.329 4.893 17.445 1.00 37.87 ? 83 LEU L CB 1 ATOM 9041 C CG . LEU F 2 88 ? 25.050 4.994 18.946 1.00 40.44 ? 83 LEU L CG 1 ATOM 9042 C CD1 . LEU F 2 88 ? 26.331 4.660 19.713 1.00 43.27 ? 83 LEU L CD1 1 ATOM 9043 C CD2 . LEU F 2 88 ? 24.520 6.362 19.335 1.00 39.79 ? 83 LEU L CD2 1 ATOM 9044 N N . GLY F 2 89 ? 24.809 5.929 14.380 1.00 31.54 ? 84 GLY L N 1 ATOM 9045 C CA . GLY F 2 89 ? 25.152 5.919 12.959 1.00 29.88 ? 84 GLY L CA 1 ATOM 9046 C C . GLY F 2 89 ? 24.688 7.213 12.341 1.00 27.84 ? 84 GLY L C 1 ATOM 9047 O O . GLY F 2 89 ? 24.429 8.177 13.050 1.00 28.00 ? 84 GLY L O 1 ATOM 9048 N N . VAL F 2 90 ? 24.569 7.240 11.022 1.00 26.38 ? 85 VAL L N 1 ATOM 9049 C CA . VAL F 2 90 ? 24.132 8.443 10.320 1.00 24.92 ? 85 VAL L CA 1 ATOM 9050 C C . VAL F 2 90 ? 22.778 8.228 9.686 1.00 23.32 ? 85 VAL L C 1 ATOM 9051 O O . VAL F 2 90 ? 22.612 7.331 8.872 1.00 22.75 ? 85 VAL L O 1 ATOM 9052 C CB . VAL F 2 90 ? 25.116 8.831 9.204 1.00 24.95 ? 85 VAL L CB 1 ATOM 9053 C CG1 . VAL F 2 90 ? 24.710 10.161 8.581 1.00 24.04 ? 85 VAL L CG1 1 ATOM 9054 C CG2 . VAL F 2 90 ? 26.534 8.904 9.749 1.00 26.91 ? 85 VAL L CG2 1 ATOM 9055 N N . TYR F 2 91 ? 21.832 9.096 10.020 1.00 23.14 ? 86 TYR L N 1 ATOM 9056 C CA . TYR F 2 91 ? 20.464 9.041 9.487 1.00 22.11 ? 86 TYR L CA 1 ATOM 9057 C C . TYR F 2 91 ? 20.281 9.990 8.294 1.00 21.08 ? 86 TYR L C 1 ATOM 9058 O O . TYR F 2 91 ? 20.767 11.114 8.321 1.00 22.01 ? 86 TYR L O 1 ATOM 9059 C CB . TYR F 2 91 ? 19.474 9.418 10.573 1.00 22.44 ? 86 TYR L CB 1 ATOM 9060 C CG . TYR F 2 91 ? 19.403 8.411 11.677 1.00 24.06 ? 86 TYR L CG 1 ATOM 9061 C CD1 . TYR F 2 91 ? 20.355 8.395 12.686 1.00 25.88 ? 86 TYR L CD1 1 ATOM 9062 C CD2 . TYR F 2 91 ? 18.380 7.484 11.734 1.00 24.05 ? 86 TYR L CD2 1 ATOM 9063 C CE1 . TYR F 2 91 ? 20.299 7.468 13.709 1.00 27.75 ? 86 TYR L CE1 1 ATOM 9064 C CE2 . TYR F 2 91 ? 18.320 6.553 12.764 1.00 26.03 ? 86 TYR L CE2 1 ATOM 9065 C CZ . TYR F 2 91 ? 19.289 6.556 13.747 1.00 27.79 ? 86 TYR L CZ 1 ATOM 9066 O OH . TYR F 2 91 ? 19.298 5.653 14.785 1.00 30.18 ? 86 TYR L OH 1 ATOM 9067 N N . TYR F 2 92 ? 19.570 9.537 7.273 1.00 19.91 ? 87 TYR L N 1 ATOM 9068 C CA . TYR F 2 92 ? 19.299 10.346 6.090 1.00 19.32 ? 87 TYR L CA 1 ATOM 9069 C C . TYR F 2 92 ? 17.817 10.304 5.758 1.00 18.84 ? 87 TYR L C 1 ATOM 9070 O O . TYR F 2 92 ? 17.248 9.215 5.706 1.00 18.28 ? 87 TYR L O 1 ATOM 9071 C CB . TYR F 2 92 ? 20.049 9.783 4.866 1.00 19.43 ? 87 TYR L CB 1 ATOM 9072 C CG . TYR F 2 92 ? 21.556 9.835 4.950 1.00 20.36 ? 87 TYR L CG 1 ATOM 9073 C CD1 . TYR F 2 92 ? 22.250 10.994 4.594 1.00 21.07 ? 87 TYR L CD1 1 ATOM 9074 C CD2 . TYR F 2 92 ? 22.295 8.725 5.396 1.00 21.28 ? 87 TYR L CD2 1 ATOM 9075 C CE1 . TYR F 2 92 ? 23.631 11.050 4.681 1.00 22.61 ? 87 TYR L CE1 1 ATOM 9076 C CE2 . TYR F 2 92 ? 23.685 8.768 5.481 1.00 22.66 ? 87 TYR L CE2 1 ATOM 9077 C CZ . TYR F 2 92 ? 24.336 9.939 5.128 1.00 23.34 ? 87 TYR L CZ 1 ATOM 9078 O OH . TYR F 2 92 ? 25.686 10.037 5.191 1.00 25.31 ? 87 TYR L OH 1 ATOM 9079 N N . CYS F 2 93 ? 17.202 11.478 5.502 1.00 19.43 ? 88 CYS L N 1 ATOM 9080 C CA . CYS F 2 93 ? 15.874 11.526 4.894 1.00 19.12 ? 88 CYS L CA 1 ATOM 9081 C C . CYS F 2 93 ? 16.066 11.483 3.380 1.00 17.60 ? 88 CYS L C 1 ATOM 9082 O O . CYS F 2 93 ? 17.126 11.831 2.862 1.00 18.16 ? 88 CYS L O 1 ATOM 9083 C CB . CYS F 2 93 ? 15.030 12.745 5.351 1.00 21.12 ? 88 CYS L CB 1 ATOM 9084 S SG . CYS F 2 93 ? 15.738 14.379 5.032 1.00 25.15 ? 88 CYS L SG 1 ATOM 9085 N N . PHE F 2 94 ? 15.028 11.044 2.676 1.00 15.96 ? 89 PHE L N 1 ATOM 9086 C CA . PHE F 2 94 ? 15.024 10.949 1.219 1.00 14.94 ? 89 PHE L CA 1 ATOM 9087 C C . PHE F 2 94 ? 13.603 11.244 0.731 1.00 13.82 ? 89 PHE L C 1 ATOM 9088 O O . PHE F 2 94 ? 12.647 10.802 1.340 1.00 13.66 ? 89 PHE L O 1 ATOM 9089 C CB . PHE F 2 94 ? 15.484 9.540 0.790 1.00 14.97 ? 89 PHE L CB 1 ATOM 9090 C CG . PHE F 2 94 ? 15.230 9.215 -0.667 1.00 14.89 ? 89 PHE L CG 1 ATOM 9091 C CD1 . PHE F 2 94 ? 16.070 9.653 -1.648 1.00 15.48 ? 89 PHE L CD1 1 ATOM 9092 C CD2 . PHE F 2 94 ? 14.140 8.442 -1.037 1.00 14.80 ? 89 PHE L CD2 1 ATOM 9093 C CE1 . PHE F 2 94 ? 15.850 9.339 -2.975 1.00 16.04 ? 89 PHE L CE1 1 ATOM 9094 C CE2 . PHE F 2 94 ? 13.899 8.137 -2.373 1.00 15.08 ? 89 PHE L CE2 1 ATOM 9095 C CZ . PHE F 2 94 ? 14.761 8.590 -3.343 1.00 15.70 ? 89 PHE L CZ 1 ATOM 9096 N N . GLN F 2 95 ? 13.478 12.027 -0.335 1.00 13.49 ? 90 GLN L N 1 ATOM 9097 C CA . GLN F 2 95 ? 12.208 12.270 -0.985 1.00 12.80 ? 90 GLN L CA 1 ATOM 9098 C C . GLN F 2 95 ? 12.195 11.644 -2.386 1.00 13.29 ? 90 GLN L C 1 ATOM 9099 O O . GLN F 2 95 ? 13.089 11.861 -3.181 1.00 13.88 ? 90 GLN L O 1 ATOM 9100 C CB . GLN F 2 95 ? 11.883 13.776 -1.031 1.00 12.99 ? 90 GLN L CB 1 ATOM 9101 C CG . GLN F 2 95 ? 12.746 14.624 -1.961 1.00 13.94 ? 90 GLN L CG 1 ATOM 9102 C CD . GLN F 2 95 ? 12.250 14.673 -3.390 1.00 14.19 ? 90 GLN L CD 1 ATOM 9103 O OE1 . GLN F 2 95 ? 11.118 14.293 -3.682 1.00 13.71 ? 90 GLN L OE1 1 ATOM 9104 N NE2 . GLN F 2 95 ? 13.087 15.120 -4.283 1.00 15.39 ? 90 GLN L NE2 1 ATOM 9105 N N . GLY F 2 96 ? 11.144 10.883 -2.673 1.00 13.32 ? 91 GLY L N 1 ATOM 9106 C CA . GLY F 2 96 ? 10.919 10.289 -3.995 1.00 14.09 ? 91 GLY L CA 1 ATOM 9107 C C . GLY F 2 96 ? 9.685 10.862 -4.674 1.00 14.53 ? 91 GLY L C 1 ATOM 9108 O O . GLY F 2 96 ? 9.024 10.200 -5.467 1.00 15.39 ? 91 GLY L O 1 ATOM 9109 N N . SER F 2 97 ? 9.377 12.106 -4.369 1.00 14.44 ? 92 SER L N 1 ATOM 9110 C CA . SER F 2 97 ? 8.230 12.757 -4.936 1.00 14.97 ? 92 SER L CA 1 ATOM 9111 C C . SER F 2 97 ? 8.566 13.519 -6.188 1.00 16.43 ? 92 SER L C 1 ATOM 9112 O O . SER F 2 97 ? 7.776 13.507 -7.135 1.00 17.40 ? 92 SER L O 1 ATOM 9113 C CB . SER F 2 97 ? 7.637 13.738 -3.938 1.00 14.65 ? 92 SER L CB 1 ATOM 9114 O OG . SER F 2 97 ? 6.593 14.447 -4.536 1.00 15.25 ? 92 SER L OG 1 ATOM 9115 N N . HIS F 2 98 ? 9.689 14.233 -6.173 1.00 17.20 ? 93 HIS L N 1 ATOM 9116 C CA . HIS F 2 98 ? 10.073 15.086 -7.272 1.00 18.96 ? 93 HIS L CA 1 ATOM 9117 C C . HIS F 2 98 ? 11.391 14.675 -7.865 1.00 19.86 ? 93 HIS L C 1 ATOM 9118 O O . HIS F 2 98 ? 12.405 14.719 -7.182 1.00 20.25 ? 93 HIS L O 1 ATOM 9119 C CB . HIS F 2 98 ? 10.222 16.511 -6.783 1.00 19.87 ? 93 HIS L CB 1 ATOM 9120 C CG . HIS F 2 98 ? 8.996 17.067 -6.137 1.00 19.46 ? 93 HIS L CG 1 ATOM 9121 N ND1 . HIS F 2 98 ? 8.015 17.729 -6.844 1.00 20.58 ? 93 HIS L ND1 1 ATOM 9122 C CD2 . HIS F 2 98 ? 8.628 17.116 -4.837 1.00 18.48 ? 93 HIS L CD2 1 ATOM 9123 C CE1 . HIS F 2 98 ? 7.081 18.138 -6.010 1.00 20.34 ? 93 HIS L CE1 1 ATOM 9124 N NE2 . HIS F 2 98 ? 7.437 17.799 -4.781 1.00 19.22 ? 93 HIS L NE2 1 ATOM 9125 N N . VAL F 2 99 ? 11.380 14.343 -9.151 1.00 20.80 ? 94 VAL L N 1 ATOM 9126 C CA . VAL F 2 99 ? 12.588 14.090 -9.889 1.00 22.25 ? 94 VAL L CA 1 ATOM 9127 C C . VAL F 2 99 ? 13.352 15.403 -10.111 1.00 24.20 ? 94 VAL L C 1 ATOM 9128 O O . VAL F 2 99 ? 12.789 16.356 -10.625 1.00 25.34 ? 94 VAL L O 1 ATOM 9129 C CB . VAL F 2 99 ? 12.277 13.488 -11.283 1.00 23.75 ? 94 VAL L CB 1 ATOM 9130 C CG1 . VAL F 2 99 ? 13.550 13.286 -12.092 1.00 26.05 ? 94 VAL L CG1 1 ATOM 9131 C CG2 . VAL F 2 99 ? 11.531 12.169 -11.149 1.00 22.57 ? 94 VAL L CG2 1 ATOM 9132 N N . PRO F 2 100 ? 14.664 15.438 -9.798 1.00 24.89 ? 95 PRO L N 1 ATOM 9133 C CA . PRO F 2 100 ? 15.539 14.382 -9.287 1.00 24.06 ? 95 PRO L CA 1 ATOM 9134 C C . PRO F 2 100 ? 15.373 14.170 -7.807 1.00 21.59 ? 95 PRO L C 1 ATOM 9135 O O . PRO F 2 100 ? 15.287 15.133 -7.059 1.00 21.48 ? 95 PRO L O 1 ATOM 9136 C CB . PRO F 2 100 ? 16.936 14.924 -9.551 1.00 26.72 ? 95 PRO L CB 1 ATOM 9137 C CG . PRO F 2 100 ? 16.780 16.410 -9.548 1.00 28.05 ? 95 PRO L CG 1 ATOM 9138 C CD . PRO F 2 100 ? 15.394 16.692 -10.060 1.00 27.38 ? 95 PRO L CD 1 ATOM 9139 N N . TYR F 2 101 ? 15.349 12.911 -7.383 1.00 20.10 ? 96 TYR L N 1 ATOM 9140 C CA . TYR F 2 101 ? 15.117 12.588 -5.978 1.00 17.88 ? 96 TYR L CA 1 ATOM 9141 C C . TYR F 2 101 ? 16.369 12.975 -5.180 1.00 18.09 ? 96 TYR L C 1 ATOM 9142 O O . TYR F 2 101 ? 17.477 13.053 -5.718 1.00 19.30 ? 96 TYR L O 1 ATOM 9143 C CB . TYR F 2 101 ? 14.735 11.110 -5.814 1.00 17.05 ? 96 TYR L CB 1 ATOM 9144 C CG . TYR F 2 101 ? 13.532 10.701 -6.671 1.00 17.00 ? 96 TYR L CG 1 ATOM 9145 C CD1 . TYR F 2 101 ? 12.401 11.514 -6.754 1.00 16.49 ? 96 TYR L CD1 1 ATOM 9146 C CD2 . TYR F 2 101 ? 13.532 9.517 -7.398 1.00 17.82 ? 96 TYR L CD2 1 ATOM 9147 C CE1 . TYR F 2 101 ? 11.320 11.167 -7.550 1.00 16.67 ? 96 TYR L CE1 1 ATOM 9148 C CE2 . TYR F 2 101 ? 12.456 9.164 -8.196 1.00 18.17 ? 96 TYR L CE2 1 ATOM 9149 C CZ . TYR F 2 101 ? 11.355 10.012 -8.280 1.00 17.53 ? 96 TYR L CZ 1 ATOM 9150 O OH . TYR F 2 101 ? 10.251 9.697 -9.037 1.00 17.87 ? 96 TYR L OH 1 ATOM 9151 N N . THR F 2 102 ? 16.176 13.246 -3.901 1.00 16.84 ? 97 THR L N 1 ATOM 9152 C CA . THR F 2 102 ? 17.236 13.852 -3.110 1.00 17.47 ? 97 THR L CA 1 ATOM 9153 C C . THR F 2 102 ? 17.227 13.345 -1.689 1.00 16.15 ? 97 THR L C 1 ATOM 9154 O O . THR F 2 102 ? 16.192 12.920 -1.164 1.00 14.59 ? 97 THR L O 1 ATOM 9155 C CB . THR F 2 102 ? 17.123 15.393 -3.096 1.00 18.47 ? 97 THR L CB 1 ATOM 9156 O OG1 . THR F 2 102 ? 15.770 15.756 -2.851 1.00 17.45 ? 97 THR L OG1 1 ATOM 9157 C CG2 . THR F 2 102 ? 17.545 15.990 -4.433 1.00 20.65 ? 97 THR L CG2 1 ATOM 9158 N N . PHE F 2 103 ? 18.419 13.397 -1.108 1.00 17.02 ? 98 PHE L N 1 ATOM 9159 C CA . PHE F 2 103 ? 18.690 13.016 0.256 1.00 16.53 ? 98 PHE L CA 1 ATOM 9160 C C . PHE F 2 103 ? 18.986 14.261 1.069 1.00 17.42 ? 98 PHE L C 1 ATOM 9161 O O . PHE F 2 103 ? 19.500 15.235 0.547 1.00 18.59 ? 98 PHE L O 1 ATOM 9162 C CB . PHE F 2 103 ? 19.939 12.168 0.308 1.00 17.26 ? 98 PHE L CB 1 ATOM 9163 C CG . PHE F 2 103 ? 19.762 10.785 -0.220 1.00 16.98 ? 98 PHE L CG 1 ATOM 9164 C CD1 . PHE F 2 103 ? 19.294 9.771 0.613 1.00 16.24 ? 98 PHE L CD1 1 ATOM 9165 C CD2 . PHE F 2 103 ? 20.131 10.467 -1.514 1.00 17.98 ? 98 PHE L CD2 1 ATOM 9166 C CE1 . PHE F 2 103 ? 19.145 8.476 0.151 1.00 16.41 ? 98 PHE L CE1 1 ATOM 9167 C CE2 . PHE F 2 103 ? 20.009 9.164 -1.979 1.00 18.25 ? 98 PHE L CE2 1 ATOM 9168 C CZ . PHE F 2 103 ? 19.510 8.169 -1.145 1.00 17.47 ? 98 PHE L CZ 1 ATOM 9169 N N . GLY F 2 104 ? 18.676 14.206 2.361 1.00 17.16 ? 99 GLY L N 1 ATOM 9170 C CA . GLY F 2 104 ? 19.214 15.173 3.297 1.00 18.41 ? 99 GLY L CA 1 ATOM 9171 C C . GLY F 2 104 ? 20.684 14.897 3.522 1.00 19.56 ? 99 GLY L C 1 ATOM 9172 O O . GLY F 2 104 ? 21.177 13.818 3.206 1.00 19.19 ? 99 GLY L O 1 ATOM 9173 N N . GLY F 2 105 ? 21.372 15.864 4.119 1.00 21.33 ? 100 GLY L N 1 ATOM 9174 C CA . GLY F 2 105 ? 22.815 15.820 4.289 1.00 22.98 ? 100 GLY L CA 1 ATOM 9175 C C . GLY F 2 105 ? 23.325 14.866 5.354 1.00 23.08 ? 100 GLY L C 1 ATOM 9176 O O . GLY F 2 105 ? 24.513 14.589 5.411 1.00 24.56 ? 100 GLY L O 1 ATOM 9177 N N . GLY F 2 106 ? 22.436 14.345 6.181 1.00 22.13 ? 101 GLY L N 1 ATOM 9178 C CA . GLY F 2 106 ? 22.823 13.402 7.204 1.00 22.59 ? 101 GLY L CA 1 ATOM 9179 C C . GLY F 2 106 ? 22.810 13.997 8.597 1.00 23.91 ? 101 GLY L C 1 ATOM 9180 O O . GLY F 2 106 ? 23.176 15.160 8.799 1.00 25.37 ? 101 GLY L O 1 ATOM 9181 N N . THR F 2 107 ? 22.367 13.187 9.552 1.00 23.97 ? 102 THR L N 1 ATOM 9182 C CA . THR F 2 107 ? 22.456 13.504 10.969 1.00 25.84 ? 102 THR L CA 1 ATOM 9183 C C . THR F 2 107 ? 23.155 12.343 11.653 1.00 26.99 ? 102 THR L C 1 ATOM 9184 O O . THR F 2 107 ? 22.645 11.222 11.640 1.00 26.41 ? 102 THR L O 1 ATOM 9185 C CB . THR F 2 107 ? 21.074 13.709 11.615 1.00 25.51 ? 102 THR L CB 1 ATOM 9186 O OG1 . THR F 2 107 ? 20.440 14.875 11.066 1.00 25.53 ? 102 THR L OG1 1 ATOM 9187 C CG2 . THR F 2 107 ? 21.192 13.913 13.117 1.00 27.60 ? 102 THR L CG2 1 ATOM 9188 N N . LYS F 2 108 ? 24.299 12.639 12.272 1.00 29.16 ? 103 LYS L N 1 ATOM 9189 C CA . LYS F 2 108 ? 25.114 11.658 12.960 1.00 30.77 ? 103 LYS L CA 1 ATOM 9190 C C . LYS F 2 108 ? 24.701 11.546 14.420 1.00 31.82 ? 103 LYS L C 1 ATOM 9191 O O . LYS F 2 108 ? 24.875 12.475 15.188 1.00 33.55 ? 103 LYS L O 1 ATOM 9192 C CB . LYS F 2 108 ? 26.592 12.071 12.874 1.00 33.12 ? 103 LYS L CB 1 ATOM 9193 C CG . LYS F 2 108 ? 27.549 10.964 13.280 1.00 35.32 ? 103 LYS L CG 1 ATOM 9194 C CD . LYS F 2 108 ? 28.907 11.113 12.616 1.00 37.14 ? 103 LYS L CD 1 ATOM 9195 C CE . LYS F 2 108 ? 29.764 9.888 12.892 1.00 39.01 ? 103 LYS L CE 1 ATOM 9196 N NZ . LYS F 2 108 ? 30.093 9.782 14.347 1.00 41.78 ? 103 LYS L NZ 1 ATOM 9197 N N . LEU F 2 109 ? 24.171 10.395 14.800 1.00 31.25 ? 104 LEU L N 1 ATOM 9198 C CA . LEU F 2 109 ? 23.751 10.164 16.162 1.00 32.78 ? 104 LEU L CA 1 ATOM 9199 C C . LEU F 2 109 ? 24.905 9.581 16.942 1.00 34.63 ? 104 LEU L C 1 ATOM 9200 O O . LEU F 2 109 ? 25.346 8.486 16.628 1.00 34.60 ? 104 LEU L O 1 ATOM 9201 C CB . LEU F 2 109 ? 22.555 9.213 16.195 1.00 32.37 ? 104 LEU L CB 1 ATOM 9202 C CG . LEU F 2 109 ? 21.809 9.117 17.529 1.00 34.63 ? 104 LEU L CG 1 ATOM 9203 C CD1 . LEU F 2 109 ? 21.051 10.401 17.834 1.00 34.92 ? 104 LEU L CD1 1 ATOM 9204 C CD2 . LEU F 2 109 ? 20.848 7.942 17.520 1.00 34.51 ? 104 LEU L CD2 1 ATOM 9205 N N . GLU F 2 110 ? 25.369 10.311 17.961 1.00 49.85 ? 105 GLU L N 1 ATOM 9206 C CA . GLU F 2 110 ? 26.583 9.968 18.713 1.00 47.62 ? 105 GLU L CA 1 ATOM 9207 C C . GLU F 2 110 ? 26.289 9.882 20.191 1.00 42.41 ? 105 GLU L C 1 ATOM 9208 O O . GLU F 2 110 ? 25.248 10.343 20.661 1.00 41.25 ? 105 GLU L O 1 ATOM 9209 C CB . GLU F 2 110 ? 27.721 10.999 18.513 1.00 51.42 ? 105 GLU L CB 1 ATOM 9210 C CG . GLU F 2 110 ? 27.365 12.148 17.601 1.00 57.98 ? 105 GLU L CG 1 ATOM 9211 C CD . GLU F 2 110 ? 28.547 13.057 17.316 1.00 63.84 ? 105 GLU L CD 1 ATOM 9212 O OE1 . GLU F 2 110 ? 28.868 13.255 16.120 1.00 72.34 ? 105 GLU L OE1 1 ATOM 9213 O OE2 . GLU F 2 110 ? 29.155 13.557 18.292 1.00 61.22 ? 105 GLU L OE2 1 ATOM 9214 N N . LEU F 2 111 ? 27.244 9.294 20.904 1.00 41.15 ? 106 LEU L N 1 ATOM 9215 C CA . LEU F 2 111 ? 27.218 9.197 22.348 1.00 38.84 ? 106 LEU L CA 1 ATOM 9216 C C . LEU F 2 111 ? 27.781 10.433 23.063 1.00 38.97 ? 106 LEU L C 1 ATOM 9217 O O . LEU F 2 111 ? 28.742 11.065 22.632 1.00 40.31 ? 106 LEU L O 1 ATOM 9218 C CB . LEU F 2 111 ? 27.950 7.940 22.800 1.00 40.03 ? 106 LEU L CB 1 ATOM 9219 C CG . LEU F 2 111 ? 27.186 6.634 22.900 1.00 41.54 ? 106 LEU L CG 1 ATOM 9220 C CD1 . LEU F 2 111 ? 27.883 5.652 23.837 1.00 45.31 ? 106 LEU L CD1 1 ATOM 9221 C CD2 . LEU F 2 111 ? 25.758 6.892 23.324 1.00 39.78 ? 106 LEU L CD2 1 ATOM 9222 N N . LYS F 2 112 ? 27.126 10.775 24.159 1.00 39.16 ? 107 LYS L N 1 ATOM 9223 C CA . LYS F 2 112 ? 27.461 11.914 24.962 1.00 41.15 ? 107 LYS L CA 1 ATOM 9224 C C . LYS F 2 112 ? 28.329 11.460 26.112 1.00 41.15 ? 107 LYS L C 1 ATOM 9225 O O . LYS F 2 112 ? 28.115 10.369 26.655 1.00 41.41 ? 107 LYS L O 1 ATOM 9226 C CB . LYS F 2 112 ? 26.193 12.550 25.522 1.00 44.66 ? 107 LYS L CB 1 ATOM 9227 C CG . LYS F 2 112 ? 26.405 14.049 25.633 1.00 49.40 ? 107 LYS L CG 1 ATOM 9228 C CD . LYS F 2 112 ? 25.527 14.786 26.626 1.00 56.28 ? 107 LYS L CD 1 ATOM 9229 C CE . LYS F 2 112 ? 26.107 16.153 26.953 1.00 62.49 ? 107 LYS L CE 1 ATOM 9230 N NZ . LYS F 2 112 ? 25.184 16.919 27.840 1.00 72.45 ? 107 LYS L NZ 1 ATOM 9231 N N . ARG F 2 113 ? 29.303 12.296 26.475 1.00 42.26 ? 108 ARG L N 1 ATOM 9232 C CA . ARG F 2 113 ? 30.171 12.027 27.640 1.00 43.37 ? 108 ARG L CA 1 ATOM 9233 C C . ARG F 2 113 ? 30.761 13.314 28.178 1.00 45.83 ? 108 ARG L C 1 ATOM 9234 O O . ARG F 2 113 ? 30.709 14.359 27.534 1.00 46.83 ? 108 ARG L O 1 ATOM 9235 C CB . ARG F 2 113 ? 31.301 11.023 27.307 1.00 42.03 ? 108 ARG L CB 1 ATOM 9236 C CG . ARG F 2 113 ? 32.223 11.420 26.162 1.00 41.13 ? 108 ARG L CG 1 ATOM 9237 C CD . ARG F 2 113 ? 33.634 10.848 26.283 1.00 42.54 ? 108 ARG L CD 1 ATOM 9238 N NE . ARG F 2 113 ? 34.293 11.340 27.488 1.00 43.42 ? 108 ARG L NE 1 ATOM 9239 C CZ . ARG F 2 113 ? 34.924 10.599 28.401 1.00 45.92 ? 108 ARG L CZ 1 ATOM 9240 N NH1 . ARG F 2 113 ? 35.026 9.276 28.297 1.00 48.82 ? 108 ARG L NH1 1 ATOM 9241 N NH2 . ARG F 2 113 ? 35.471 11.201 29.436 1.00 47.40 ? 108 ARG L NH2 1 ATOM 9242 N N . ALA F 2 114 ? 31.317 13.224 29.379 1.00 48.46 ? 109 ALA L N 1 ATOM 9243 C CA . ALA F 2 114 ? 32.053 14.329 29.962 1.00 51.53 ? 109 ALA L CA 1 ATOM 9244 C C . ALA F 2 114 ? 33.137 14.788 29.002 1.00 48.99 ? 109 ALA L C 1 ATOM 9245 O O . ALA F 2 114 ? 33.795 13.973 28.341 1.00 45.94 ? 109 ALA L O 1 ATOM 9246 C CB . ALA F 2 114 ? 32.689 13.920 31.280 1.00 54.73 ? 109 ALA L CB 1 ATOM 9247 N N . ASP F 2 115 ? 33.315 16.101 28.942 1.00 52.57 ? 110 ASP L N 1 ATOM 9248 C CA . ASP F 2 115 ? 34.400 16.686 28.195 1.00 52.69 ? 110 ASP L CA 1 ATOM 9249 C C . ASP F 2 115 ? 35.746 16.156 28.691 1.00 50.82 ? 110 ASP L C 1 ATOM 9250 O O . ASP F 2 115 ? 35.921 15.930 29.877 1.00 51.91 ? 110 ASP L O 1 ATOM 9251 C CB . ASP F 2 115 ? 34.326 18.213 28.298 1.00 59.46 ? 110 ASP L CB 1 ATOM 9252 C CG . ASP F 2 115 ? 33.144 18.797 27.494 1.00 63.79 ? 110 ASP L CG 1 ATOM 9253 O OD1 . ASP F 2 115 ? 32.105 18.107 27.368 1.00 61.47 ? 110 ASP L OD1 1 ATOM 9254 O OD2 . ASP F 2 115 ? 33.248 19.936 26.984 1.00 70.69 ? 110 ASP L OD2 1 ATOM 9255 N N . ALA F 2 116 ? 36.676 15.935 27.764 1.00 40.91 ? 111 ALA L N 1 ATOM 9256 C CA . ALA F 2 116 ? 38.015 15.420 28.072 1.00 40.43 ? 111 ALA L CA 1 ATOM 9257 C C . ALA F 2 116 ? 39.064 16.105 27.194 1.00 39.36 ? 111 ALA L C 1 ATOM 9258 O O . ALA F 2 116 ? 38.875 16.303 25.995 1.00 37.94 ? 111 ALA L O 1 ATOM 9259 C CB . ALA F 2 116 ? 38.069 13.914 27.862 1.00 39.14 ? 111 ALA L CB 1 ATOM 9260 N N . ALA F 2 117 ? 40.177 16.460 27.806 1.00 40.43 ? 112 ALA L N 1 ATOM 9261 C CA . ALA F 2 117 ? 41.267 17.072 27.081 1.00 39.77 ? 112 ALA L CA 1 ATOM 9262 C C . ALA F 2 117 ? 42.059 16.006 26.299 1.00 37.55 ? 112 ALA L C 1 ATOM 9263 O O . ALA F 2 117 ? 42.173 14.845 26.719 1.00 37.28 ? 112 ALA L O 1 ATOM 9264 C CB . ALA F 2 117 ? 42.173 17.825 28.043 1.00 42.17 ? 112 ALA L CB 1 ATOM 9265 N N . PRO F 2 118 ? 42.608 16.397 25.151 1.00 36.34 ? 113 PRO L N 1 ATOM 9266 C CA . PRO F 2 118 ? 43.417 15.467 24.380 1.00 34.60 ? 113 PRO L CA 1 ATOM 9267 C C . PRO F 2 118 ? 44.766 15.241 25.022 1.00 35.55 ? 113 PRO L C 1 ATOM 9268 O O . PRO F 2 118 ? 45.379 16.187 25.538 1.00 37.36 ? 113 PRO L O 1 ATOM 9269 C CB . PRO F 2 118 ? 43.605 16.177 23.038 1.00 33.58 ? 113 PRO L CB 1 ATOM 9270 C CG . PRO F 2 118 ? 43.400 17.625 23.335 1.00 35.45 ? 113 PRO L CG 1 ATOM 9271 C CD . PRO F 2 118 ? 42.411 17.678 24.454 1.00 37.01 ? 113 PRO L CD 1 ATOM 9272 N N . THR F 2 119 ? 45.216 13.993 24.980 1.00 34.91 ? 114 THR L N 1 ATOM 9273 C CA . THR F 2 119 ? 46.557 13.630 25.361 1.00 35.44 ? 114 THR L CA 1 ATOM 9274 C C . THR F 2 119 ? 47.417 13.786 24.118 1.00 33.76 ? 114 THR L C 1 ATOM 9275 O O . THR F 2 119 ? 47.245 13.045 23.152 1.00 32.84 ? 114 THR L O 1 ATOM 9276 C CB . THR F 2 119 ? 46.579 12.185 25.851 1.00 36.29 ? 114 THR L CB 1 ATOM 9277 O OG1 . THR F 2 119 ? 45.646 12.050 26.936 1.00 38.02 ? 114 THR L OG1 1 ATOM 9278 C CG2 . THR F 2 119 ? 47.971 11.779 26.328 1.00 37.76 ? 114 THR L CG2 1 ATOM 9279 N N . VAL F 2 120 ? 48.323 14.760 24.135 1.00 34.17 ? 115 VAL L N 1 ATOM 9280 C CA . VAL F 2 120 ? 49.124 15.124 22.966 1.00 32.84 ? 115 VAL L CA 1 ATOM 9281 C C . VAL F 2 120 ? 50.532 14.553 23.048 1.00 33.01 ? 115 VAL L C 1 ATOM 9282 O O . VAL F 2 120 ? 51.186 14.637 24.080 1.00 35.20 ? 115 VAL L O 1 ATOM 9283 C CB . VAL F 2 120 ? 49.212 16.653 22.788 1.00 33.87 ? 115 VAL L CB 1 ATOM 9284 C CG1 . VAL F 2 120 ? 49.816 17.004 21.434 1.00 32.84 ? 115 VAL L CG1 1 ATOM 9285 C CG2 . VAL F 2 120 ? 47.825 17.265 22.887 1.00 34.42 ? 115 VAL L CG2 1 ATOM 9286 N N . SER F 2 121 ? 50.986 13.969 21.945 1.00 31.40 ? 116 SER L N 1 ATOM 9287 C CA . SER F 2 121 ? 52.325 13.435 21.828 1.00 31.55 ? 116 SER L CA 1 ATOM 9288 C C . SER F 2 121 ? 52.849 13.876 20.478 1.00 29.92 ? 116 SER L C 1 ATOM 9289 O O . SER F 2 121 ? 52.083 13.939 19.513 1.00 28.40 ? 116 SER L O 1 ATOM 9290 C CB . SER F 2 121 ? 52.290 11.915 21.916 1.00 31.80 ? 116 SER L CB 1 ATOM 9291 O OG . SER F 2 121 ? 51.549 11.508 23.045 1.00 33.38 ? 116 SER L OG 1 ATOM 9292 N N . ILE F 2 122 ? 54.138 14.211 20.432 1.00 30.29 ? 117 ILE L N 1 ATOM 9293 C CA . ILE F 2 122 ? 54.821 14.589 19.201 1.00 29.02 ? 117 ILE L CA 1 ATOM 9294 C C . ILE F 2 122 ? 55.982 13.629 18.962 1.00 29.12 ? 117 ILE L C 1 ATOM 9295 O O . ILE F 2 122 ? 56.580 13.126 19.907 1.00 30.51 ? 117 ILE L O 1 ATOM 9296 C CB . ILE F 2 122 ? 55.286 16.062 19.263 1.00 30.05 ? 117 ILE L CB 1 ATOM 9297 C CG1 . ILE F 2 122 ? 55.735 16.536 17.885 1.00 29.22 ? 117 ILE L CG1 1 ATOM 9298 C CG2 . ILE F 2 122 ? 56.374 16.272 20.317 1.00 32.32 ? 117 ILE L CG2 1 ATOM 9299 C CD1 . ILE F 2 122 ? 55.751 18.037 17.769 1.00 30.50 ? 117 ILE L CD1 1 ATOM 9300 N N . PHE F 2 123 ? 56.253 13.334 17.693 1.00 27.79 ? 118 PHE L N 1 ATOM 9301 C CA . PHE F 2 123 ? 57.268 12.358 17.331 1.00 28.08 ? 118 PHE L CA 1 ATOM 9302 C C . PHE F 2 123 ? 58.089 12.928 16.183 1.00 27.81 ? 118 PHE L C 1 ATOM 9303 O O . PHE F 2 123 ? 57.527 13.279 15.140 1.00 26.52 ? 118 PHE L O 1 ATOM 9304 C CB . PHE F 2 123 ? 56.621 11.032 16.940 1.00 27.52 ? 118 PHE L CB 1 ATOM 9305 C CG . PHE F 2 123 ? 55.852 10.403 18.052 1.00 28.09 ? 118 PHE L CG 1 ATOM 9306 C CD1 . PHE F 2 123 ? 54.533 10.739 18.272 1.00 27.14 ? 118 PHE L CD1 1 ATOM 9307 C CD2 . PHE F 2 123 ? 56.460 9.498 18.906 1.00 29.97 ? 118 PHE L CD2 1 ATOM 9308 C CE1 . PHE F 2 123 ? 53.827 10.169 19.321 1.00 27.97 ? 118 PHE L CE1 1 ATOM 9309 C CE2 . PHE F 2 123 ? 55.765 8.931 19.947 1.00 30.94 ? 118 PHE L CE2 1 ATOM 9310 C CZ . PHE F 2 123 ? 54.445 9.257 20.150 1.00 29.85 ? 118 PHE L CZ 1 ATOM 9311 N N . PRO F 2 124 ? 59.412 13.063 16.387 1.00 29.17 ? 119 PRO L N 1 ATOM 9312 C CA . PRO F 2 124 ? 60.297 13.452 15.304 1.00 29.26 ? 119 PRO L CA 1 ATOM 9313 C C . PRO F 2 124 ? 60.426 12.345 14.270 1.00 28.96 ? 119 PRO L C 1 ATOM 9314 O O . PRO F 2 124 ? 60.112 11.198 14.556 1.00 29.25 ? 119 PRO L O 1 ATOM 9315 C CB . PRO F 2 124 ? 61.651 13.652 15.991 1.00 31.41 ? 119 PRO L CB 1 ATOM 9316 C CG . PRO F 2 124 ? 61.357 13.746 17.448 1.00 32.63 ? 119 PRO L CG 1 ATOM 9317 C CD . PRO F 2 124 ? 60.123 12.940 17.669 1.00 31.29 ? 119 PRO L CD 1 ATOM 9318 N N . PRO F 2 125 ? 60.928 12.679 13.075 1.00 28.97 ? 120 PRO L N 1 ATOM 9319 C CA . PRO F 2 125 ? 61.146 11.655 12.057 1.00 29.19 ? 120 PRO L CA 1 ATOM 9320 C C . PRO F 2 125 ? 62.066 10.568 12.559 1.00 31.08 ? 120 PRO L C 1 ATOM 9321 O O . PRO F 2 125 ? 63.008 10.853 13.289 1.00 32.51 ? 120 PRO L O 1 ATOM 9322 C CB . PRO F 2 125 ? 61.823 12.412 10.921 1.00 29.31 ? 120 PRO L CB 1 ATOM 9323 C CG . PRO F 2 125 ? 61.479 13.848 11.147 1.00 28.97 ? 120 PRO L CG 1 ATOM 9324 C CD . PRO F 2 125 ? 61.336 14.019 12.625 1.00 29.13 ? 120 PRO L CD 1 ATOM 9325 N N . SER F 2 126 ? 61.800 9.328 12.171 1.00 31.73 ? 121 SER L N 1 ATOM 9326 C CA . SER F 2 126 ? 62.697 8.236 12.487 1.00 33.92 ? 121 SER L CA 1 ATOM 9327 C C . SER F 2 126 ? 63.941 8.321 11.614 1.00 35.04 ? 121 SER L C 1 ATOM 9328 O O . SER F 2 126 ? 63.890 8.837 10.495 1.00 34.06 ? 121 SER L O 1 ATOM 9329 C CB . SER F 2 126 ? 62.004 6.911 12.233 1.00 34.89 ? 121 SER L CB 1 ATOM 9330 O OG . SER F 2 126 ? 61.929 6.671 10.844 1.00 35.11 ? 121 SER L OG 1 ATOM 9331 N N . SER F 2 127 ? 65.052 7.780 12.111 1.00 37.54 ? 122 SER L N 1 ATOM 9332 C CA . SER F 2 127 ? 66.310 7.774 11.363 1.00 38.98 ? 122 SER L CA 1 ATOM 9333 C C . SER F 2 127 ? 66.212 6.933 10.083 1.00 39.65 ? 122 SER L C 1 ATOM 9334 O O . SER F 2 127 ? 66.857 7.255 9.076 1.00 39.72 ? 122 SER L O 1 ATOM 9335 C CB . SER F 2 127 ? 67.460 7.262 12.242 1.00 42.00 ? 122 SER L CB 1 ATOM 9336 O OG . SER F 2 127 ? 67.159 5.992 12.778 1.00 43.95 ? 122 SER L OG 1 ATOM 9337 N N . GLU F 2 128 ? 65.414 5.862 10.119 1.00 40.36 ? 123 GLU L N 1 ATOM 9338 C CA . GLU F 2 128 ? 65.156 5.078 8.908 1.00 41.45 ? 123 GLU L CA 1 ATOM 9339 C C . GLU F 2 128 ? 64.514 5.947 7.836 1.00 39.17 ? 123 GLU L C 1 ATOM 9340 O O . GLU F 2 128 ? 64.867 5.847 6.669 1.00 39.95 ? 123 GLU L O 1 ATOM 9341 C CB . GLU F 2 128 ? 64.252 3.867 9.166 1.00 42.96 ? 123 GLU L CB 1 ATOM 9342 C CG . GLU F 2 128 ? 64.810 2.822 10.118 1.00 46.27 ? 123 GLU L CG 1 ATOM 9343 C CD . GLU F 2 128 ? 64.224 2.943 11.518 1.00 45.86 ? 123 GLU L CD 1 ATOM 9344 O OE1 . GLU F 2 128 ? 63.908 1.879 12.118 1.00 48.34 ? 123 GLU L OE1 1 ATOM 9345 O OE2 . GLU F 2 128 ? 64.081 4.112 12.005 1.00 43.51 ? 123 GLU L OE2 1 ATOM 9346 N N . GLN F 2 129 ? 63.563 6.787 8.225 1.00 36.86 ? 124 GLN L N 1 ATOM 9347 C CA . GLN F 2 129 ? 62.896 7.646 7.242 1.00 35.70 ? 124 GLN L CA 1 ATOM 9348 C C . GLN F 2 129 ? 63.872 8.669 6.695 1.00 35.77 ? 124 GLN L C 1 ATOM 9349 O O . GLN F 2 129 ? 63.947 8.864 5.488 1.00 36.30 ? 124 GLN L O 1 ATOM 9350 C CB . GLN F 2 129 ? 61.647 8.347 7.806 1.00 33.50 ? 124 GLN L CB 1 ATOM 9351 C CG . GLN F 2 129 ? 60.802 8.967 6.693 1.00 32.85 ? 124 GLN L CG 1 ATOM 9352 C CD . GLN F 2 129 ? 59.664 9.860 7.153 1.00 31.04 ? 124 GLN L CD 1 ATOM 9353 O OE1 . GLN F 2 129 ? 59.655 10.375 8.259 1.00 30.00 ? 124 GLN L OE1 1 ATOM 9354 N NE2 . GLN F 2 129 ? 58.711 10.071 6.275 1.00 31.06 ? 124 GLN L NE2 1 ATOM 9355 N N . LEU F 2 130 ? 64.635 9.288 7.594 1.00 35.91 ? 125 LEU L N 1 ATOM 9356 C CA . LEU F 2 130 ? 65.659 10.265 7.217 1.00 36.60 ? 125 LEU L CA 1 ATOM 9357 C C . LEU F 2 130 ? 66.685 9.713 6.220 1.00 39.09 ? 125 LEU L C 1 ATOM 9358 O O . LEU F 2 130 ? 67.150 10.433 5.334 1.00 39.37 ? 125 LEU L O 1 ATOM 9359 C CB . LEU F 2 130 ? 66.373 10.795 8.457 1.00 36.72 ? 125 LEU L CB 1 ATOM 9360 C CG . LEU F 2 130 ? 65.497 11.678 9.354 1.00 35.16 ? 125 LEU L CG 1 ATOM 9361 C CD1 . LEU F 2 130 ? 66.152 11.911 10.703 1.00 36.01 ? 125 LEU L CD1 1 ATOM 9362 C CD2 . LEU F 2 130 ? 65.178 13.005 8.673 1.00 34.38 ? 125 LEU L CD2 1 ATOM 9363 N N . THR F 2 131 ? 67.034 8.439 6.370 1.00 41.54 ? 126 THR L N 1 ATOM 9364 C CA . THR F 2 131 ? 67.919 7.756 5.420 1.00 44.59 ? 126 THR L CA 1 ATOM 9365 C C . THR F 2 131 ? 67.362 7.767 3.988 1.00 44.98 ? 126 THR L C 1 ATOM 9366 O O . THR F 2 131 ? 68.125 7.822 3.013 1.00 46.28 ? 126 THR L O 1 ATOM 9367 C CB . THR F 2 131 ? 68.142 6.282 5.836 1.00 47.51 ? 126 THR L CB 1 ATOM 9368 O OG1 . THR F 2 131 ? 68.747 6.234 7.136 1.00 48.68 ? 126 THR L OG1 1 ATOM 9369 C CG2 . THR F 2 131 ? 69.028 5.548 4.822 1.00 50.46 ? 126 THR L CG2 1 ATOM 9370 N N . SER F 2 132 ? 66.037 7.691 3.871 1.00 43.90 ? 127 SER L N 1 ATOM 9371 C CA . SER F 2 132 ? 65.367 7.728 2.574 1.00 44.60 ? 127 SER L CA 1 ATOM 9372 C C . SER F 2 132 ? 65.169 9.137 2.017 1.00 43.61 ? 127 SER L C 1 ATOM 9373 O O . SER F 2 132 ? 64.708 9.275 0.883 1.00 45.17 ? 127 SER L O 1 ATOM 9374 C CB . SER F 2 132 ? 64.012 7.040 2.674 1.00 44.41 ? 127 SER L CB 1 ATOM 9375 O OG . SER F 2 132 ? 64.196 5.696 3.065 1.00 46.44 ? 127 SER L OG 1 ATOM 9376 N N . GLY F 2 133 ? 65.502 10.167 2.802 1.00 41.71 ? 128 GLY L N 1 ATOM 9377 C CA . GLY F 2 133 ? 65.412 11.556 2.350 1.00 40.78 ? 128 GLY L CA 1 ATOM 9378 C C . GLY F 2 133 ? 64.122 12.245 2.737 1.00 38.95 ? 128 GLY L C 1 ATOM 9379 O O . GLY F 2 133 ? 63.972 13.454 2.494 1.00 38.58 ? 128 GLY L O 1 ATOM 9380 N N . GLY F 2 134 ? 63.213 11.504 3.384 1.00 37.63 ? 129 GLY L N 1 ATOM 9381 C CA . GLY F 2 134 ? 61.924 12.060 3.801 1.00 36.19 ? 129 GLY L CA 1 ATOM 9382 C C . GLY F 2 134 ? 61.944 12.439 5.272 1.00 34.53 ? 129 GLY L C 1 ATOM 9383 O O . GLY F 2 134 ? 62.795 11.955 6.030 1.00 34.59 ? 129 GLY L O 1 ATOM 9384 N N . ALA F 2 135 ? 61.015 13.299 5.687 1.00 33.35 ? 130 ALA L N 1 ATOM 9385 C CA . ALA F 2 135 ? 60.909 13.678 7.111 1.00 32.33 ? 130 ALA L CA 1 ATOM 9386 C C . ALA F 2 135 ? 59.478 13.957 7.560 1.00 31.10 ? 130 ALA L C 1 ATOM 9387 O O . ALA F 2 135 ? 58.953 15.042 7.317 1.00 31.45 ? 130 ALA L O 1 ATOM 9388 C CB . ALA F 2 135 ? 61.774 14.898 7.389 1.00 32.88 ? 130 ALA L CB 1 ATOM 9389 N N . SER F 2 136 ? 58.874 12.990 8.245 1.00 30.20 ? 131 SER L N 1 ATOM 9390 C CA . SER F 2 136 ? 57.511 13.137 8.748 1.00 29.28 ? 131 SER L CA 1 ATOM 9391 C C . SER F 2 136 ? 57.559 13.378 10.239 1.00 28.72 ? 131 SER L C 1 ATOM 9392 O O . SER F 2 136 ? 58.277 12.692 10.954 1.00 28.64 ? 131 SER L O 1 ATOM 9393 C CB . SER F 2 136 ? 56.687 11.902 8.440 1.00 29.43 ? 131 SER L CB 1 ATOM 9394 O OG . SER F 2 136 ? 56.487 11.825 7.035 1.00 30.54 ? 131 SER L OG 1 ATOM 9395 N N . VAL F 2 137 ? 56.837 14.402 10.676 1.00 28.51 ? 132 VAL L N 1 ATOM 9396 C CA . VAL F 2 137 ? 56.637 14.697 12.078 1.00 28.28 ? 132 VAL L CA 1 ATOM 9397 C C . VAL F 2 137 ? 55.182 14.427 12.419 1.00 27.68 ? 132 VAL L C 1 ATOM 9398 O O . VAL F 2 137 ? 54.276 14.997 11.809 1.00 27.66 ? 132 VAL L O 1 ATOM 9399 C CB . VAL F 2 137 ? 56.926 16.161 12.392 1.00 29.34 ? 132 VAL L CB 1 ATOM 9400 C CG1 . VAL F 2 137 ? 57.100 16.345 13.896 1.00 29.78 ? 132 VAL L CG1 1 ATOM 9401 C CG2 . VAL F 2 137 ? 58.162 16.625 11.640 1.00 30.30 ? 132 VAL L CG2 1 ATOM 9402 N N . VAL F 2 138 ? 54.977 13.559 13.404 1.00 27.64 ? 133 VAL L N 1 ATOM 9403 C CA . VAL F 2 138 ? 53.671 13.024 13.727 1.00 27.23 ? 133 VAL L CA 1 ATOM 9404 C C . VAL F 2 138 ? 53.252 13.541 15.090 1.00 27.73 ? 133 VAL L C 1 ATOM 9405 O O . VAL F 2 138 ? 54.063 13.571 16.031 1.00 27.99 ? 133 VAL L O 1 ATOM 9406 C CB . VAL F 2 138 ? 53.699 11.478 13.744 1.00 27.23 ? 133 VAL L CB 1 ATOM 9407 C CG1 . VAL F 2 138 ? 52.399 10.914 14.289 1.00 26.93 ? 133 VAL L CG1 1 ATOM 9408 C CG2 . VAL F 2 138 ? 53.986 10.956 12.349 1.00 27.49 ? 133 VAL L CG2 1 ATOM 9409 N N . CYS F 2 139 ? 51.984 13.932 15.175 1.00 28.07 ? 134 CYS L N 1 ATOM 9410 C CA . CYS F 2 139 ? 51.377 14.365 16.419 1.00 29.30 ? 134 CYS L CA 1 ATOM 9411 C C . CYS F 2 139 ? 50.089 13.607 16.670 1.00 28.80 ? 134 CYS L C 1 ATOM 9412 O O . CYS F 2 139 ? 49.207 13.591 15.807 1.00 28.61 ? 134 CYS L O 1 ATOM 9413 C CB . CYS F 2 139 ? 51.058 15.841 16.341 1.00 31.24 ? 134 CYS L CB 1 ATOM 9414 S SG . CYS F 2 139 ? 50.857 16.586 17.957 1.00 34.75 ? 134 CYS L SG 1 ATOM 9415 N N . PHE F 2 140 ? 49.986 12.955 17.828 1.00 28.82 ? 135 PHE L N 1 ATOM 9416 C CA . PHE F 2 140 ? 48.776 12.264 18.214 1.00 28.48 ? 135 PHE L CA 1 ATOM 9417 C C . PHE F 2 140 ? 48.063 13.122 19.238 1.00 29.21 ? 135 PHE L C 1 ATOM 9418 O O . PHE F 2 140 ? 48.686 13.668 20.157 1.00 30.44 ? 135 PHE L O 1 ATOM 9419 C CB . PHE F 2 140 ? 49.073 10.897 18.839 1.00 28.99 ? 135 PHE L CB 1 ATOM 9420 C CG . PHE F 2 140 ? 49.625 9.885 17.882 1.00 28.91 ? 135 PHE L CG 1 ATOM 9421 C CD1 . PHE F 2 140 ? 49.145 9.769 16.586 1.00 28.49 ? 135 PHE L CD1 1 ATOM 9422 C CD2 . PHE F 2 140 ? 50.593 8.995 18.294 1.00 30.02 ? 135 PHE L CD2 1 ATOM 9423 C CE1 . PHE F 2 140 ? 49.639 8.794 15.723 1.00 28.92 ? 135 PHE L CE1 1 ATOM 9424 C CE2 . PHE F 2 140 ? 51.100 8.021 17.429 1.00 30.47 ? 135 PHE L CE2 1 ATOM 9425 C CZ . PHE F 2 140 ? 50.621 7.923 16.141 1.00 29.85 ? 135 PHE L CZ 1 ATOM 9426 N N . LEU F 2 141 ? 46.747 13.214 19.085 1.00 28.96 ? 136 LEU L N 1 ATOM 9427 C CA . LEU F 2 141 ? 45.882 13.883 20.035 1.00 29.74 ? 136 LEU L CA 1 ATOM 9428 C C . LEU F 2 141 ? 44.783 12.890 20.398 1.00 29.70 ? 136 LEU L C 1 ATOM 9429 O O . LEU F 2 141 ? 43.844 12.680 19.639 1.00 29.31 ? 136 LEU L O 1 ATOM 9430 C CB . LEU F 2 141 ? 45.302 15.150 19.424 1.00 30.00 ? 136 LEU L CB 1 ATOM 9431 C CG . LEU F 2 141 ? 46.356 16.078 18.826 1.00 30.23 ? 136 LEU L CG 1 ATOM 9432 C CD1 . LEU F 2 141 ? 46.687 15.707 17.385 1.00 29.54 ? 136 LEU L CD1 1 ATOM 9433 C CD2 . LEU F 2 141 ? 45.846 17.504 18.865 1.00 31.93 ? 136 LEU L CD2 1 ATOM 9434 N N . ASN F 2 142 ? 44.914 12.269 21.559 1.00 30.36 ? 137 ASN L N 1 ATOM 9435 C CA . ASN F 2 142 ? 44.125 11.095 21.844 1.00 31.01 ? 137 ASN L CA 1 ATOM 9436 C C . ASN F 2 142 ? 43.134 11.239 22.983 1.00 32.31 ? 137 ASN L C 1 ATOM 9437 O O . ASN F 2 142 ? 43.399 11.900 23.998 1.00 33.01 ? 137 ASN L O 1 ATOM 9438 C CB . ASN F 2 142 ? 45.059 9.915 22.103 1.00 31.56 ? 137 ASN L CB 1 ATOM 9439 C CG . ASN F 2 142 ? 45.864 9.554 20.873 1.00 30.69 ? 137 ASN L CG 1 ATOM 9440 O OD1 . ASN F 2 142 ? 45.610 10.077 19.783 1.00 29.73 ? 137 ASN L OD1 1 ATOM 9441 N ND2 . ASN F 2 142 ? 46.852 8.688 21.038 1.00 31.45 ? 137 ASN L ND2 1 ATOM 9442 N N . ASN F 2 143 ? 41.984 10.596 22.784 1.00 32.53 ? 138 ASN L N 1 ATOM 9443 C CA . ASN F 2 143 ? 40.958 10.483 23.806 1.00 33.86 ? 138 ASN L CA 1 ATOM 9444 C C . ASN F 2 143 ? 40.473 11.844 24.327 1.00 34.13 ? 138 ASN L C 1 ATOM 9445 O O . ASN F 2 143 ? 40.576 12.165 25.519 1.00 35.30 ? 138 ASN L O 1 ATOM 9446 C CB . ASN F 2 143 ? 41.455 9.594 24.929 1.00 35.65 ? 138 ASN L CB 1 ATOM 9447 C CG . ASN F 2 143 ? 41.917 8.250 24.422 1.00 36.12 ? 138 ASN L CG 1 ATOM 9448 O OD1 . ASN F 2 143 ? 43.106 8.033 24.224 1.00 36.95 ? 138 ASN L OD1 1 ATOM 9449 N ND2 . ASN F 2 143 ? 40.986 7.350 24.188 1.00 36.81 ? 138 ASN L ND2 1 ATOM 9450 N N . PHE F 2 144 ? 39.957 12.642 23.401 1.00 33.19 ? 139 PHE L N 1 ATOM 9451 C CA . PHE F 2 144 ? 39.341 13.904 23.751 1.00 34.08 ? 139 PHE L CA 1 ATOM 9452 C C . PHE F 2 144 ? 37.837 13.869 23.485 1.00 34.74 ? 139 PHE L C 1 ATOM 9453 O O . PHE F 2 144 ? 37.319 12.938 22.861 1.00 34.03 ? 139 PHE L O 1 ATOM 9454 C CB . PHE F 2 144 ? 40.021 15.059 23.015 1.00 33.76 ? 139 PHE L CB 1 ATOM 9455 C CG . PHE F 2 144 ? 40.024 14.928 21.514 1.00 32.54 ? 139 PHE L CG 1 ATOM 9456 C CD1 . PHE F 2 144 ? 41.012 14.210 20.838 1.00 31.06 ? 139 PHE L CD1 1 ATOM 9457 C CD2 . PHE F 2 144 ? 39.060 15.560 20.785 1.00 33.30 ? 139 PHE L CD2 1 ATOM 9458 C CE1 . PHE F 2 144 ? 40.997 14.117 19.456 1.00 30.42 ? 139 PHE L CE1 1 ATOM 9459 C CE2 . PHE F 2 144 ? 39.037 15.470 19.415 1.00 32.97 ? 139 PHE L CE2 1 ATOM 9460 C CZ . PHE F 2 144 ? 40.009 14.747 18.746 1.00 31.46 ? 139 PHE L CZ 1 ATOM 9461 N N . TYR F 2 145 ? 37.147 14.868 24.032 1.00 36.23 ? 140 TYR L N 1 ATOM 9462 C CA . TYR F 2 145 ? 35.721 15.055 23.820 1.00 37.30 ? 140 TYR L CA 1 ATOM 9463 C C . TYR F 2 145 ? 35.359 16.475 24.228 1.00 39.29 ? 140 TYR L C 1 ATOM 9464 O O . TYR F 2 145 ? 35.811 16.924 25.275 1.00 40.29 ? 140 TYR L O 1 ATOM 9465 C CB . TYR F 2 145 ? 34.907 14.065 24.657 1.00 37.97 ? 140 TYR L CB 1 ATOM 9466 C CG . TYR F 2 145 ? 33.449 14.119 24.299 1.00 39.05 ? 140 TYR L CG 1 ATOM 9467 C CD1 . TYR F 2 145 ? 32.601 15.063 24.874 1.00 41.02 ? 140 TYR L CD1 1 ATOM 9468 C CD2 . TYR F 2 145 ? 32.930 13.269 23.347 1.00 38.64 ? 140 TYR L CD2 1 ATOM 9469 C CE1 . TYR F 2 145 ? 31.262 15.137 24.515 1.00 42.53 ? 140 TYR L CE1 1 ATOM 9470 C CE2 . TYR F 2 145 ? 31.595 13.332 22.972 1.00 40.20 ? 140 TYR L CE2 1 ATOM 9471 C CZ . TYR F 2 145 ? 30.761 14.262 23.561 1.00 42.03 ? 140 TYR L CZ 1 ATOM 9472 O OH . TYR F 2 145 ? 29.440 14.319 23.192 1.00 43.99 ? 140 TYR L OH 1 ATOM 9473 N N . PRO F 2 146 ? 34.528 17.181 23.430 1.00 40.51 ? 141 PRO L N 1 ATOM 9474 C CA . PRO F 2 146 ? 33.848 16.724 22.218 1.00 40.36 ? 141 PRO L CA 1 ATOM 9475 C C . PRO F 2 146 ? 34.769 16.561 21.013 1.00 39.07 ? 141 PRO L C 1 ATOM 9476 O O . PRO F 2 146 ? 35.979 16.752 21.104 1.00 37.98 ? 141 PRO L O 1 ATOM 9477 C CB . PRO F 2 146 ? 32.792 17.813 21.980 1.00 42.99 ? 141 PRO L CB 1 ATOM 9478 C CG . PRO F 2 146 ? 33.372 19.036 22.566 1.00 44.19 ? 141 PRO L CG 1 ATOM 9479 C CD . PRO F 2 146 ? 34.209 18.590 23.733 1.00 43.06 ? 141 PRO L CD 1 ATOM 9480 N N . LYS F 2 147 ? 34.180 16.188 19.897 1.00 39.87 ? 142 LYS L N 1 ATOM 9481 C CA . LYS F 2 147 ? 34.912 15.866 18.696 1.00 39.48 ? 142 LYS L CA 1 ATOM 9482 C C . LYS F 2 147 ? 35.590 17.075 18.055 1.00 40.82 ? 142 LYS L C 1 ATOM 9483 O O . LYS F 2 147 ? 36.669 16.934 17.504 1.00 39.16 ? 142 LYS L O 1 ATOM 9484 C CB . LYS F 2 147 ? 33.983 15.106 17.747 1.00 40.92 ? 142 LYS L CB 1 ATOM 9485 C CG . LYS F 2 147 ? 33.948 15.534 16.295 1.00 42.53 ? 142 LYS L CG 1 ATOM 9486 C CD . LYS F 2 147 ? 32.801 14.845 15.547 1.00 44.71 ? 142 LYS L CD 1 ATOM 9487 C CE . LYS F 2 147 ? 31.433 15.372 15.945 1.00 47.26 ? 142 LYS L CE 1 ATOM 9488 N NZ . LYS F 2 147 ? 30.429 15.115 14.870 1.00 50.15 ? 142 LYS L NZ 1 ATOM 9489 N N . ASP F 2 148 ? 35.007 18.267 18.197 1.00 44.52 ? 143 ASP L N 1 ATOM 9490 C CA . ASP F 2 148 ? 35.549 19.477 17.588 1.00 46.66 ? 143 ASP L CA 1 ATOM 9491 C C . ASP F 2 148 ? 36.924 19.808 18.185 1.00 45.48 ? 143 ASP L C 1 ATOM 9492 O O . ASP F 2 148 ? 37.050 19.963 19.396 1.00 45.58 ? 143 ASP L O 1 ATOM 9493 C CB . ASP F 2 148 ? 34.610 20.667 17.818 1.00 50.93 ? 143 ASP L CB 1 ATOM 9494 C CG . ASP F 2 148 ? 33.125 20.323 17.580 1.00 53.68 ? 143 ASP L CG 1 ATOM 9495 O OD1 . ASP F 2 148 ? 32.458 19.936 18.574 1.00 54.21 ? 143 ASP L OD1 1 ATOM 9496 O OD2 . ASP F 2 148 ? 32.613 20.464 16.435 1.00 56.22 ? 143 ASP L OD2 1 ATOM 9497 N N . ILE F 2 149 ? 37.944 19.901 17.331 1.00 44.74 ? 144 ILE L N 1 ATOM 9498 C CA . ILE F 2 149 ? 39.319 20.216 17.747 1.00 43.80 ? 144 ILE L CA 1 ATOM 9499 C C . ILE F 2 149 ? 40.116 20.873 16.627 1.00 44.46 ? 144 ILE L C 1 ATOM 9500 O O . ILE F 2 149 ? 39.908 20.583 15.455 1.00 44.14 ? 144 ILE L O 1 ATOM 9501 C CB . ILE F 2 149 ? 40.083 18.953 18.214 1.00 40.88 ? 144 ILE L CB 1 ATOM 9502 C CG1 . ILE F 2 149 ? 41.293 19.344 19.059 1.00 40.69 ? 144 ILE L CG1 1 ATOM 9503 C CG2 . ILE F 2 149 ? 40.521 18.095 17.033 1.00 39.38 ? 144 ILE L CG2 1 ATOM 9504 C CD1 . ILE F 2 149 ? 41.786 18.235 19.948 1.00 39.12 ? 144 ILE L CD1 1 ATOM 9505 N N . ASN F 2 150 ? 41.058 21.730 16.992 1.00 45.70 ? 145 ASN L N 1 ATOM 9506 C CA . ASN F 2 150 ? 41.894 22.364 15.984 1.00 46.92 ? 145 ASN L CA 1 ATOM 9507 C C . ASN F 2 150 ? 43.378 22.184 16.326 1.00 44.69 ? 145 ASN L C 1 ATOM 9508 O O . ASN F 2 150 ? 43.807 22.398 17.462 1.00 44.55 ? 145 ASN L O 1 ATOM 9509 C CB . ASN F 2 150 ? 41.522 23.835 15.829 1.00 51.54 ? 145 ASN L CB 1 ATOM 9510 C CG . ASN F 2 150 ? 41.759 24.355 14.426 1.00 54.42 ? 145 ASN L CG 1 ATOM 9511 O OD1 . ASN F 2 150 ? 40.931 24.143 13.522 1.00 56.02 ? 145 ASN L OD1 1 ATOM 9512 N ND2 . ASN F 2 150 ? 42.877 25.076 14.238 1.00 55.88 ? 145 ASN L ND2 1 ATOM 9513 N N . VAL F 2 151 ? 44.139 21.754 15.325 1.00 42.74 ? 146 VAL L N 1 ATOM 9514 C CA . VAL F 2 151 ? 45.563 21.548 15.450 1.00 40.76 ? 146 VAL L CA 1 ATOM 9515 C C . VAL F 2 151 ? 46.253 22.626 14.649 1.00 41.78 ? 146 VAL L C 1 ATOM 9516 O O . VAL F 2 151 ? 45.729 23.112 13.641 1.00 43.34 ? 146 VAL L O 1 ATOM 9517 C CB . VAL F 2 151 ? 45.981 20.147 14.965 1.00 38.34 ? 146 VAL L CB 1 ATOM 9518 C CG1 . VAL F 2 151 ? 47.476 19.933 15.151 1.00 37.24 ? 146 VAL L CG1 1 ATOM 9519 C CG2 . VAL F 2 151 ? 45.216 19.099 15.755 1.00 37.40 ? 146 VAL L CG2 1 ATOM 9520 N N . LYS F 2 152 ? 47.415 23.024 15.135 1.00 40.99 ? 147 LYS L N 1 ATOM 9521 C CA . LYS F 2 152 ? 48.212 24.000 14.442 1.00 42.50 ? 147 LYS L CA 1 ATOM 9522 C C . LYS F 2 152 ? 49.677 23.617 14.593 1.00 40.47 ? 147 LYS L C 1 ATOM 9523 O O . LYS F 2 152 ? 50.146 23.378 15.711 1.00 39.70 ? 147 LYS L O 1 ATOM 9524 C CB . LYS F 2 152 ? 47.948 25.369 15.044 1.00 46.20 ? 147 LYS L CB 1 ATOM 9525 C CG . LYS F 2 152 ? 48.549 26.513 14.268 1.00 49.38 ? 147 LYS L CG 1 ATOM 9526 C CD . LYS F 2 152 ? 47.861 27.824 14.625 1.00 54.02 ? 147 LYS L CD 1 ATOM 9527 C CE . LYS F 2 152 ? 47.824 28.051 16.133 1.00 55.01 ? 147 LYS L CE 1 ATOM 9528 N NZ . LYS F 2 152 ? 47.486 29.460 16.477 1.00 60.22 ? 147 LYS L NZ 1 ATOM 9529 N N . TRP F 2 153 ? 50.383 23.544 13.460 1.00 39.43 ? 148 TRP L N 1 ATOM 9530 C CA . TRP F 2 153 ? 51.819 23.296 13.471 1.00 38.00 ? 148 TRP L CA 1 ATOM 9531 C C . TRP F 2 153 ? 52.565 24.620 13.468 1.00 40.78 ? 148 TRP L C 1 ATOM 9532 O O . TRP F 2 153 ? 52.142 25.572 12.820 1.00 43.10 ? 148 TRP L O 1 ATOM 9533 C CB . TRP F 2 153 ? 52.234 22.453 12.275 1.00 36.10 ? 148 TRP L CB 1 ATOM 9534 C CG . TRP F 2 153 ? 51.871 21.023 12.419 1.00 33.26 ? 148 TRP L CG 1 ATOM 9535 C CD1 . TRP F 2 153 ? 50.718 20.432 12.016 1.00 32.58 ? 148 TRP L CD1 1 ATOM 9536 C CD2 . TRP F 2 153 ? 52.665 19.995 13.002 1.00 31.34 ? 148 TRP L CD2 1 ATOM 9537 N NE1 . TRP F 2 153 ? 50.747 19.095 12.297 1.00 30.39 ? 148 TRP L NE1 1 ATOM 9538 C CE2 . TRP F 2 153 ? 51.932 18.800 12.907 1.00 29.73 ? 148 TRP L CE2 1 ATOM 9539 C CE3 . TRP F 2 153 ? 53.929 19.964 13.596 1.00 31.34 ? 148 TRP L CE3 1 ATOM 9540 C CZ2 . TRP F 2 153 ? 52.413 17.584 13.393 1.00 28.33 ? 148 TRP L CZ2 1 ATOM 9541 C CZ3 . TRP F 2 153 ? 54.408 18.759 14.065 1.00 29.82 ? 148 TRP L CZ3 1 ATOM 9542 C CH2 . TRP F 2 153 ? 53.651 17.582 13.960 1.00 28.31 ? 148 TRP L CH2 1 ATOM 9543 N N . LYS F 2 154 ? 53.646 24.681 14.240 1.00 40.75 ? 149 LYS L N 1 ATOM 9544 C CA . LYS F 2 154 ? 54.564 25.795 14.172 1.00 43.62 ? 149 LYS L CA 1 ATOM 9545 C C . LYS F 2 154 ? 55.963 25.261 13.913 1.00 42.32 ? 149 LYS L C 1 ATOM 9546 O O . LYS F 2 154 ? 56.320 24.154 14.330 1.00 39.95 ? 149 LYS L O 1 ATOM 9547 C CB . LYS F 2 154 ? 54.495 26.651 15.436 1.00 46.49 ? 149 LYS L CB 1 ATOM 9548 C CG . LYS F 2 154 ? 53.184 27.409 15.551 1.00 48.67 ? 149 LYS L CG 1 ATOM 9549 C CD . LYS F 2 154 ? 53.220 28.450 16.654 1.00 52.56 ? 149 LYS L CD 1 ATOM 9550 C CE . LYS F 2 154 ? 51.844 29.050 16.849 1.00 54.66 ? 149 LYS L CE 1 ATOM 9551 N NZ . LYS F 2 154 ? 51.756 29.927 18.052 1.00 58.74 ? 149 LYS L NZ 1 ATOM 9552 N N . ILE F 2 155 ? 56.725 26.024 13.148 1.00 44.19 ? 150 ILE L N 1 ATOM 9553 C CA . ILE F 2 155 ? 58.097 25.695 12.841 1.00 43.58 ? 150 ILE L CA 1 ATOM 9554 C C . ILE F 2 155 ? 58.901 26.942 13.111 1.00 47.30 ? 150 ILE L C 1 ATOM 9555 O O . ILE F 2 155 ? 58.668 27.965 12.481 1.00 50.05 ? 150 ILE L O 1 ATOM 9556 C CB . ILE F 2 155 ? 58.238 25.239 11.380 1.00 42.24 ? 150 ILE L CB 1 ATOM 9557 C CG1 . ILE F 2 155 ? 57.527 23.901 11.191 1.00 38.72 ? 150 ILE L CG1 1 ATOM 9558 C CG2 . ILE F 2 155 ? 59.699 25.095 10.997 1.00 42.49 ? 150 ILE L CG2 1 ATOM 9559 C CD1 . ILE F 2 155 ? 57.435 23.483 9.744 1.00 38.08 ? 150 ILE L CD1 1 ATOM 9560 N N . ASP F 2 156 ? 59.819 26.845 14.070 1.00 47.92 ? 151 ASP L N 1 ATOM 9561 C CA . ASP F 2 156 ? 60.580 27.980 14.547 1.00 52.16 ? 151 ASP L CA 1 ATOM 9562 C C . ASP F 2 156 ? 59.647 29.178 14.734 1.00 55.60 ? 151 ASP L C 1 ATOM 9563 O O . ASP F 2 156 ? 59.920 30.273 14.250 1.00 59.26 ? 151 ASP L O 1 ATOM 9564 C CB . ASP F 2 156 ? 61.722 28.309 13.574 1.00 53.47 ? 151 ASP L CB 1 ATOM 9565 C CG . ASP F 2 156 ? 62.818 27.250 13.554 1.00 51.16 ? 151 ASP L CG 1 ATOM 9566 O OD1 . ASP F 2 156 ? 63.121 26.677 14.620 1.00 50.61 ? 151 ASP L OD1 1 ATOM 9567 O OD2 . ASP F 2 156 ? 63.400 27.009 12.468 1.00 50.28 ? 151 ASP L OD2 1 ATOM 9568 N N . GLY F 2 157 ? 58.520 28.944 15.401 1.00 54.71 ? 152 GLY L N 1 ATOM 9569 C CA . GLY F 2 157 ? 57.555 29.997 15.705 1.00 58.31 ? 152 GLY L CA 1 ATOM 9570 C C . GLY F 2 157 ? 56.494 30.274 14.648 1.00 58.48 ? 152 GLY L C 1 ATOM 9571 O O . GLY F 2 157 ? 55.436 30.798 14.972 1.00 60.20 ? 152 GLY L O 1 ATOM 9572 N N . SER F 2 158 ? 56.765 29.924 13.393 1.00 57.29 ? 153 SER L N 1 ATOM 9573 C CA . SER F 2 158 ? 55.876 30.255 12.285 1.00 58.60 ? 153 SER L CA 1 ATOM 9574 C C . SER F 2 158 ? 54.865 29.142 12.058 1.00 54.97 ? 153 SER L C 1 ATOM 9575 O O . SER F 2 158 ? 55.208 27.964 12.042 1.00 50.79 ? 153 SER L O 1 ATOM 9576 C CB . SER F 2 158 ? 56.680 30.489 10.997 1.00 59.65 ? 153 SER L CB 1 ATOM 9577 O OG . SER F 2 158 ? 57.691 31.459 11.182 1.00 63.63 ? 153 SER L OG 1 ATOM 9578 N N . GLU F 2 159 ? 53.614 29.536 11.862 1.00 57.19 ? 154 GLU L N 1 ATOM 9579 C CA . GLU F 2 159 ? 52.569 28.595 11.530 1.00 54.74 ? 154 GLU L CA 1 ATOM 9580 C C . GLU F 2 159 ? 52.888 27.925 10.198 1.00 53.39 ? 154 GLU L C 1 ATOM 9581 O O . GLU F 2 159 ? 53.467 28.532 9.314 1.00 55.76 ? 154 GLU L O 1 ATOM 9582 C CB . GLU F 2 159 ? 51.212 29.292 11.446 1.00 57.89 ? 154 GLU L CB 1 ATOM 9583 C CG . GLU F 2 159 ? 50.049 28.343 11.662 1.00 55.43 ? 154 GLU L CG 1 ATOM 9584 C CD . GLU F 2 159 ? 48.717 28.895 11.186 1.00 58.71 ? 154 GLU L CD 1 ATOM 9585 O OE1 . GLU F 2 159 ? 48.544 30.145 11.113 1.00 63.68 ? 154 GLU L OE1 1 ATOM 9586 O OE2 . GLU F 2 159 ? 47.846 28.052 10.866 1.00 56.91 ? 154 GLU L OE2 1 ATOM 9587 N N . ARG F 2 160 ? 52.496 26.670 10.067 1.00 50.11 ? 155 ARG L N 1 ATOM 9588 C CA . ARG F 2 160 ? 52.763 25.913 8.877 1.00 49.19 ? 155 ARG L CA 1 ATOM 9589 C C . ARG F 2 160 ? 51.530 25.084 8.537 1.00 48.02 ? 155 ARG L C 1 ATOM 9590 O O . ARG F 2 160 ? 51.010 24.368 9.386 1.00 45.71 ? 155 ARG L O 1 ATOM 9591 C CB . ARG F 2 160 ? 53.983 25.033 9.137 1.00 46.78 ? 155 ARG L CB 1 ATOM 9592 C CG . ARG F 2 160 ? 54.320 24.042 8.043 1.00 45.29 ? 155 ARG L CG 1 ATOM 9593 C CD . ARG F 2 160 ? 54.806 24.726 6.788 1.00 48.12 ? 155 ARG L CD 1 ATOM 9594 N NE . ARG F 2 160 ? 55.204 23.713 5.814 1.00 47.11 ? 155 ARG L NE 1 ATOM 9595 C CZ . ARG F 2 160 ? 56.435 23.531 5.333 1.00 47.23 ? 155 ARG L CZ 1 ATOM 9596 N NH1 . ARG F 2 160 ? 56.643 22.554 4.449 1.00 46.38 ? 155 ARG L NH1 1 ATOM 9597 N NH2 . ARG F 2 160 ? 57.445 24.323 5.690 1.00 48.54 ? 155 ARG L NH2 1 ATOM 9598 N N . GLN F 2 161 ? 51.062 25.195 7.297 1.00 50.47 ? 156 GLN L N 1 ATOM 9599 C CA . GLN F 2 161 ? 49.888 24.448 6.844 1.00 50.35 ? 156 GLN L CA 1 ATOM 9600 C C . GLN F 2 161 ? 50.177 23.423 5.742 1.00 49.77 ? 156 GLN L C 1 ATOM 9601 O O . GLN F 2 161 ? 49.687 22.304 5.784 1.00 48.11 ? 156 GLN L O 1 ATOM 9602 C CB . GLN F 2 161 ? 48.790 25.400 6.394 1.00 54.45 ? 156 GLN L CB 1 ATOM 9603 C CG . GLN F 2 161 ? 47.817 25.727 7.507 1.00 54.94 ? 156 GLN L CG 1 ATOM 9604 C CD . GLN F 2 161 ? 47.280 27.117 7.419 1.00 60.05 ? 156 GLN L CD 1 ATOM 9605 O OE1 . GLN F 2 161 ? 46.329 27.393 6.679 1.00 63.28 ? 156 GLN L OE1 1 ATOM 9606 N NE2 . GLN F 2 161 ? 47.884 28.017 8.186 1.00 61.53 ? 156 GLN L NE2 1 ATOM 9607 N N . ASN F 2 162 ? 50.948 23.801 4.738 1.00 52.42 ? 157 ASN L N 1 ATOM 9608 C CA . ASN F 2 162 ? 51.181 22.875 3.627 1.00 52.67 ? 157 ASN L CA 1 ATOM 9609 C C . ASN F 2 162 ? 52.050 21.694 4.059 1.00 48.64 ? 157 ASN L C 1 ATOM 9610 O O . ASN F 2 162 ? 53.036 21.870 4.773 1.00 47.80 ? 157 ASN L O 1 ATOM 9611 C CB . ASN F 2 162 ? 51.768 23.593 2.418 1.00 56.65 ? 157 ASN L CB 1 ATOM 9612 C CG . ASN F 2 162 ? 53.223 23.917 2.583 1.00 56.88 ? 157 ASN L CG 1 ATOM 9613 O OD1 . ASN F 2 162 ? 53.593 24.739 3.434 1.00 57.58 ? 157 ASN L OD1 1 ATOM 9614 N ND2 . ASN F 2 162 ? 54.070 23.285 1.760 1.00 57.07 ? 157 ASN L ND2 1 ATOM 9615 N N . GLY F 2 163 ? 51.665 20.495 3.630 1.00 47.05 ? 158 GLY L N 1 ATOM 9616 C CA . GLY F 2 163 ? 52.331 19.255 4.029 1.00 43.84 ? 158 GLY L CA 1 ATOM 9617 C C . GLY F 2 163 ? 51.742 18.670 5.305 1.00 41.39 ? 158 GLY L C 1 ATOM 9618 O O . GLY F 2 163 ? 52.329 17.780 5.907 1.00 38.60 ? 158 GLY L O 1 ATOM 9619 N N . VAL F 2 164 ? 50.591 19.184 5.731 1.00 42.13 ? 159 VAL L N 1 ATOM 9620 C CA . VAL F 2 164 ? 49.896 18.667 6.904 1.00 40.38 ? 159 VAL L CA 1 ATOM 9621 C C . VAL F 2 164 ? 48.787 17.740 6.439 1.00 40.74 ? 159 VAL L C 1 ATOM 9622 O O . VAL F 2 164 ? 48.109 18.024 5.456 1.00 43.82 ? 159 VAL L O 1 ATOM 9623 C CB . VAL F 2 164 ? 49.301 19.801 7.766 1.00 41.32 ? 159 VAL L CB 1 ATOM 9624 C CG1 . VAL F 2 164 ? 48.574 19.234 8.982 1.00 39.67 ? 159 VAL L CG1 1 ATOM 9625 C CG2 . VAL F 2 164 ? 50.393 20.758 8.222 1.00 41.58 ? 159 VAL L CG2 1 ATOM 9626 N N . LEU F 2 165 ? 48.637 16.610 7.112 1.00 38.79 ? 160 LEU L N 1 ATOM 9627 C CA . LEU F 2 165 ? 47.528 15.712 6.836 1.00 39.50 ? 160 LEU L CA 1 ATOM 9628 C C . LEU F 2 165 ? 46.966 15.258 8.160 1.00 37.70 ? 160 LEU L C 1 ATOM 9629 O O . LEU F 2 165 ? 47.724 14.844 9.048 1.00 35.41 ? 160 LEU L O 1 ATOM 9630 C CB . LEU F 2 165 ? 47.978 14.525 5.992 1.00 40.24 ? 160 LEU L CB 1 ATOM 9631 C CG . LEU F 2 165 ? 48.300 14.863 4.526 1.00 43.54 ? 160 LEU L CG 1 ATOM 9632 C CD1 . LEU F 2 165 ? 48.931 13.660 3.835 1.00 44.35 ? 160 LEU L CD1 1 ATOM 9633 C CD2 . LEU F 2 165 ? 47.084 15.334 3.730 1.00 46.23 ? 160 LEU L CD2 1 ATOM 9634 N N . ASN F 2 166 ? 45.648 15.394 8.303 1.00 38.37 ? 161 ASN L N 1 ATOM 9635 C CA . ASN F 2 166 ? 44.957 15.010 9.517 1.00 37.27 ? 161 ASN L CA 1 ATOM 9636 C C . ASN F 2 166 ? 44.010 13.870 9.282 1.00 37.30 ? 161 ASN L C 1 ATOM 9637 O O . ASN F 2 166 ? 43.451 13.730 8.204 1.00 39.42 ? 161 ASN L O 1 ATOM 9638 C CB . ASN F 2 166 ? 44.158 16.180 10.056 1.00 38.80 ? 161 ASN L CB 1 ATOM 9639 C CG . ASN F 2 166 ? 45.043 17.322 10.511 1.00 39.31 ? 161 ASN L CG 1 ATOM 9640 O OD1 . ASN F 2 166 ? 46.217 17.119 10.865 1.00 38.24 ? 161 ASN L OD1 1 ATOM 9641 N ND2 . ASN F 2 166 ? 44.476 18.529 10.543 1.00 41.16 ? 161 ASN L ND2 1 ATOM 9642 N N . SER F 2 167 ? 43.805 13.076 10.316 1.00 35.49 ? 162 SER L N 1 ATOM 9643 C CA . SER F 2 167 ? 42.940 11.937 10.225 1.00 36.05 ? 162 SER L CA 1 ATOM 9644 C C . SER F 2 167 ? 42.245 11.810 11.556 1.00 35.40 ? 162 SER L C 1 ATOM 9645 O O . SER F 2 167 ? 42.882 11.843 12.605 1.00 34.09 ? 162 SER L O 1 ATOM 9646 C CB . SER F 2 167 ? 43.743 10.684 9.909 1.00 36.00 ? 162 SER L CB 1 ATOM 9647 O OG . SER F 2 167 ? 42.864 9.617 9.615 1.00 37.92 ? 162 SER L OG 1 ATOM 9648 N N . TRP F 2 168 ? 40.934 11.686 11.520 1.00 36.83 ? 163 TRP L N 1 ATOM 9649 C CA . TRP F 2 168 ? 40.151 11.617 12.730 1.00 36.66 ? 163 TRP L CA 1 ATOM 9650 C C . TRP F 2 168 ? 39.572 10.228 12.851 1.00 37.28 ? 163 TRP L C 1 ATOM 9651 O O . TRP F 2 168 ? 39.177 9.605 11.864 1.00 38.89 ? 163 TRP L O 1 ATOM 9652 C CB . TRP F 2 168 ? 39.027 12.640 12.701 1.00 38.38 ? 163 TRP L CB 1 ATOM 9653 C CG . TRP F 2 168 ? 39.497 14.039 12.504 1.00 38.74 ? 163 TRP L CG 1 ATOM 9654 C CD1 . TRP F 2 168 ? 39.698 14.973 13.479 1.00 38.28 ? 163 TRP L CD1 1 ATOM 9655 C CD2 . TRP F 2 168 ? 39.824 14.680 11.254 1.00 40.17 ? 163 TRP L CD2 1 ATOM 9656 N NE1 . TRP F 2 168 ? 40.128 16.159 12.913 1.00 39.56 ? 163 TRP L NE1 1 ATOM 9657 C CE2 . TRP F 2 168 ? 40.216 16.007 11.553 1.00 40.31 ? 163 TRP L CE2 1 ATOM 9658 C CE3 . TRP F 2 168 ? 39.817 14.265 9.914 1.00 42.01 ? 163 TRP L CE3 1 ATOM 9659 C CZ2 . TRP F 2 168 ? 40.601 16.925 10.562 1.00 42.00 ? 163 TRP L CZ2 1 ATOM 9660 C CZ3 . TRP F 2 168 ? 40.199 15.187 8.915 1.00 43.53 ? 163 TRP L CZ3 1 ATOM 9661 C CH2 . TRP F 2 168 ? 40.583 16.500 9.251 1.00 43.55 ? 163 TRP L CH2 1 ATOM 9662 N N . THR F 2 169 ? 39.532 9.755 14.084 1.00 36.37 ? 164 THR L N 1 ATOM 9663 C CA . THR F 2 169 ? 39.024 8.443 14.408 1.00 37.18 ? 164 THR L CA 1 ATOM 9664 C C . THR F 2 169 ? 37.503 8.584 14.602 1.00 38.51 ? 164 THR L C 1 ATOM 9665 O O . THR F 2 169 ? 37.010 9.686 14.836 1.00 38.06 ? 164 THR L O 1 ATOM 9666 C CB . THR F 2 169 ? 39.801 7.928 15.654 1.00 36.24 ? 164 THR L CB 1 ATOM 9667 O OG1 . THR F 2 169 ? 40.307 6.604 15.424 1.00 37.33 ? 164 THR L OG1 1 ATOM 9668 C CG2 . THR F 2 169 ? 38.986 8.000 16.928 1.00 36.41 ? 164 THR L CG2 1 ATOM 9669 N N . ASP F 2 170 ? 36.761 7.485 14.448 1.00 40.42 ? 165 ASP L N 1 ATOM 9670 C CA . ASP F 2 170 ? 35.340 7.428 14.823 1.00 41.79 ? 165 ASP L CA 1 ATOM 9671 C C . ASP F 2 170 ? 35.261 7.432 16.346 1.00 40.36 ? 165 ASP L C 1 ATOM 9672 O O . ASP F 2 170 ? 36.226 7.133 17.011 1.00 38.80 ? 165 ASP L O 1 ATOM 9673 C CB . ASP F 2 170 ? 34.659 6.135 14.333 1.00 44.78 ? 165 ASP L CB 1 ATOM 9674 C CG . ASP F 2 170 ? 34.167 6.197 12.872 1.00 47.56 ? 165 ASP L CG 1 ATOM 9675 O OD1 . ASP F 2 170 ? 34.229 7.267 12.220 1.00 47.74 ? 165 ASP L OD1 1 ATOM 9676 O OD2 . ASP F 2 170 ? 33.696 5.146 12.372 1.00 50.22 ? 165 ASP L OD2 1 ATOM 9677 N N . GLN F 2 171 ? 34.095 7.736 16.897 1.00 41.04 ? 166 GLN L N 1 ATOM 9678 C CA . GLN F 2 171 ? 33.910 7.661 18.335 1.00 40.44 ? 166 GLN L CA 1 ATOM 9679 C C . GLN F 2 171 ? 34.321 6.277 18.872 1.00 41.38 ? 166 GLN L C 1 ATOM 9680 O O . GLN F 2 171 ? 33.961 5.252 18.306 1.00 43.25 ? 166 GLN L O 1 ATOM 9681 C CB . GLN F 2 171 ? 32.454 7.980 18.699 1.00 41.72 ? 166 GLN L CB 1 ATOM 9682 C CG . GLN F 2 171 ? 32.256 8.228 20.184 1.00 41.13 ? 166 GLN L CG 1 ATOM 9683 C CD . GLN F 2 171 ? 30.925 8.853 20.531 1.00 42.38 ? 166 GLN L CD 1 ATOM 9684 O OE1 . GLN F 2 171 ? 29.882 8.484 19.985 1.00 43.82 ? 166 GLN L OE1 1 ATOM 9685 N NE2 . GLN F 2 171 ? 30.949 9.789 21.484 1.00 41.91 ? 166 GLN L NE2 1 ATOM 9686 N N . ASP F 2 172 ? 35.089 6.260 19.961 1.00 41.09 ? 167 ASP L N 1 ATOM 9687 C CA . ASP F 2 172 ? 35.557 5.006 20.587 1.00 42.71 ? 167 ASP L CA 1 ATOM 9688 C C . ASP F 2 172 ? 34.403 4.257 21.242 1.00 45.20 ? 167 ASP L C 1 ATOM 9689 O O . ASP F 2 172 ? 33.704 4.813 22.076 1.00 45.50 ? 167 ASP L O 1 ATOM 9690 C CB . ASP F 2 172 ? 36.637 5.316 21.643 1.00 41.86 ? 167 ASP L CB 1 ATOM 9691 C CG . ASP F 2 172 ? 37.206 4.054 22.338 1.00 43.98 ? 167 ASP L CG 1 ATOM 9692 O OD1 . ASP F 2 172 ? 36.575 3.528 23.302 1.00 46.18 ? 167 ASP L OD1 1 ATOM 9693 O OD2 . ASP F 2 172 ? 38.308 3.613 21.950 1.00 43.92 ? 167 ASP L OD2 1 ATOM 9694 N N . SER F 2 173 ? 34.240 2.985 20.893 1.00 47.63 ? 168 SER L N 1 ATOM 9695 C CA . SER F 2 173 ? 33.156 2.159 21.424 1.00 50.79 ? 168 SER L CA 1 ATOM 9696 C C . SER F 2 173 ? 33.143 2.017 22.952 1.00 51.47 ? 168 SER L C 1 ATOM 9697 O O . SER F 2 173 ? 32.094 1.734 23.538 1.00 53.53 ? 168 SER L O 1 ATOM 9698 C CB . SER F 2 173 ? 33.230 0.761 20.826 1.00 53.68 ? 168 SER L CB 1 ATOM 9699 O OG . SER F 2 173 ? 34.473 0.160 21.141 1.00 53.84 ? 168 SER L OG 1 ATOM 9700 N N . LYS F 2 174 ? 34.300 2.205 23.581 1.00 50.18 ? 169 LYS L N 1 ATOM 9701 C CA . LYS F 2 174 ? 34.464 1.941 25.013 1.00 51.56 ? 169 LYS L CA 1 ATOM 9702 C C . LYS F 2 174 ? 34.354 3.185 25.889 1.00 49.37 ? 169 LYS L C 1 ATOM 9703 O O . LYS F 2 174 ? 33.527 3.222 26.790 1.00 50.73 ? 169 LYS L O 1 ATOM 9704 C CB . LYS F 2 174 ? 35.795 1.231 25.270 1.00 52.91 ? 169 LYS L CB 1 ATOM 9705 C CG . LYS F 2 174 ? 35.867 -0.128 24.594 1.00 55.90 ? 169 LYS L CG 1 ATOM 9706 C CD . LYS F 2 174 ? 36.586 -1.159 25.420 1.00 59.24 ? 169 LYS L CD 1 ATOM 9707 C CE . LYS F 2 174 ? 35.965 -2.525 25.195 1.00 63.33 ? 169 LYS L CE 1 ATOM 9708 N NZ . LYS F 2 174 ? 36.778 -3.574 25.857 1.00 67.06 ? 169 LYS L NZ 1 ATOM 9709 N N . ASP F 2 175 ? 35.172 4.198 25.620 1.00 46.11 ? 170 ASP L N 1 ATOM 9710 C CA . ASP F 2 175 ? 35.144 5.441 26.411 1.00 44.64 ? 170 ASP L CA 1 ATOM 9711 C C . ASP F 2 175 ? 34.488 6.637 25.693 1.00 42.64 ? 170 ASP L C 1 ATOM 9712 O O . ASP F 2 175 ? 34.487 7.745 26.235 1.00 41.90 ? 170 ASP L O 1 ATOM 9713 C CB . ASP F 2 175 ? 36.559 5.825 26.865 1.00 43.78 ? 170 ASP L CB 1 ATOM 9714 C CG . ASP F 2 175 ? 37.422 6.358 25.735 1.00 41.38 ? 170 ASP L CG 1 ATOM 9715 O OD1 . ASP F 2 175 ? 36.911 6.565 24.618 1.00 39.82 ? 170 ASP L OD1 1 ATOM 9716 O OD2 . ASP F 2 175 ? 38.625 6.577 25.976 1.00 41.15 ? 170 ASP L OD2 1 ATOM 9717 N N . SER F 2 176 ? 33.978 6.427 24.472 1.00 41.80 ? 171 SER L N 1 ATOM 9718 C CA . SER F 2 176 ? 33.185 7.453 23.754 1.00 40.89 ? 171 SER L CA 1 ATOM 9719 C C . SER F 2 176 ? 33.980 8.725 23.441 1.00 38.67 ? 171 SER L C 1 ATOM 9720 O O . SER F 2 176 ? 33.425 9.810 23.293 1.00 38.44 ? 171 SER L O 1 ATOM 9721 C CB . SER F 2 176 ? 31.923 7.833 24.552 1.00 42.48 ? 171 SER L CB 1 ATOM 9722 O OG . SER F 2 176 ? 31.119 6.701 24.840 1.00 44.71 ? 171 SER L OG 1 ATOM 9723 N N . THR F 2 177 ? 35.291 8.591 23.361 1.00 37.40 ? 172 THR L N 1 ATOM 9724 C CA . THR F 2 177 ? 36.134 9.705 22.996 1.00 35.79 ? 172 THR L CA 1 ATOM 9725 C C . THR F 2 177 ? 36.498 9.643 21.513 1.00 34.77 ? 172 THR L C 1 ATOM 9726 O O . THR F 2 177 ? 36.229 8.656 20.801 1.00 34.84 ? 172 THR L O 1 ATOM 9727 C CB . THR F 2 177 ? 37.434 9.735 23.821 1.00 35.48 ? 172 THR L CB 1 ATOM 9728 O OG1 . THR F 2 177 ? 38.133 8.510 23.650 1.00 35.69 ? 172 THR L OG1 1 ATOM 9729 C CG2 . THR F 2 177 ? 37.166 9.973 25.329 1.00 36.92 ? 172 THR L CG2 1 ATOM 9730 N N . TYR F 2 178 ? 37.109 10.738 21.072 1.00 33.80 ? 173 TYR L N 1 ATOM 9731 C CA . TYR F 2 178 ? 37.656 10.864 19.743 1.00 32.98 ? 173 TYR L CA 1 ATOM 9732 C C . TYR F 2 178 ? 39.174 11.049 19.838 1.00 32.12 ? 173 TYR L C 1 ATOM 9733 O O . TYR F 2 178 ? 39.718 11.534 20.859 1.00 32.14 ? 173 TYR L O 1 ATOM 9734 C CB . TYR F 2 178 ? 37.023 12.065 19.030 1.00 33.40 ? 173 TYR L CB 1 ATOM 9735 C CG . TYR F 2 178 ? 35.525 11.934 18.823 1.00 34.82 ? 173 TYR L CG 1 ATOM 9736 C CD1 . TYR F 2 178 ? 34.639 12.369 19.801 1.00 35.79 ? 173 TYR L CD1 1 ATOM 9737 C CD2 . TYR F 2 178 ? 34.993 11.361 17.661 1.00 35.66 ? 173 TYR L CD2 1 ATOM 9738 C CE1 . TYR F 2 178 ? 33.272 12.246 19.636 1.00 37.40 ? 173 TYR L CE1 1 ATOM 9739 C CE2 . TYR F 2 178 ? 33.612 11.231 17.478 1.00 37.45 ? 173 TYR L CE2 1 ATOM 9740 C CZ . TYR F 2 178 ? 32.761 11.679 18.475 1.00 38.30 ? 173 TYR L CZ 1 ATOM 9741 O OH . TYR F 2 178 ? 31.398 11.575 18.353 1.00 40.35 ? 173 TYR L OH 1 ATOM 9742 N N . SER F 2 179 ? 39.849 10.650 18.766 1.00 31.72 ? 174 SER L N 1 ATOM 9743 C CA . SER F 2 179 ? 41.298 10.774 18.658 1.00 30.68 ? 174 SER L CA 1 ATOM 9744 C C . SER F 2 179 ? 41.633 11.292 17.278 1.00 30.35 ? 174 SER L C 1 ATOM 9745 O O . SER F 2 179 ? 40.860 11.135 16.334 1.00 31.07 ? 174 SER L O 1 ATOM 9746 C CB . SER F 2 179 ? 41.980 9.425 18.865 1.00 31.01 ? 174 SER L CB 1 ATOM 9747 O OG . SER F 2 179 ? 41.905 9.039 20.214 1.00 31.99 ? 174 SER L OG 1 ATOM 9748 N N . MET F 2 180 ? 42.814 11.860 17.137 1.00 29.62 ? 175 MET L N 1 ATOM 9749 C CA . MET F 2 180 ? 43.199 12.444 15.859 1.00 29.63 ? 175 MET L CA 1 ATOM 9750 C C . MET F 2 180 ? 44.692 12.384 15.676 1.00 28.59 ? 175 MET L C 1 ATOM 9751 O O . MET F 2 180 ? 45.435 12.560 16.660 1.00 27.89 ? 175 MET L O 1 ATOM 9752 C CB . MET F 2 180 ? 42.769 13.888 15.842 1.00 30.56 ? 175 MET L CB 1 ATOM 9753 C CG . MET F 2 180 ? 43.298 14.664 14.665 1.00 31.25 ? 175 MET L CG 1 ATOM 9754 S SD . MET F 2 180 ? 43.138 16.393 15.040 1.00 33.03 ? 175 MET L SD 1 ATOM 9755 C CE . MET F 2 180 ? 43.403 17.102 13.415 1.00 34.60 ? 175 MET L CE 1 ATOM 9756 N N . SER F 2 181 ? 45.134 12.128 14.440 1.00 28.46 ? 176 SER L N 1 ATOM 9757 C CA . SER F 2 181 ? 46.550 12.216 14.112 1.00 28.07 ? 176 SER L CA 1 ATOM 9758 C C . SER F 2 181 ? 46.763 13.409 13.213 1.00 28.57 ? 176 SER L C 1 ATOM 9759 O O . SER F 2 181 ? 45.923 13.740 12.407 1.00 29.87 ? 176 SER L O 1 ATOM 9760 C CB . SER F 2 181 ? 47.035 10.963 13.425 1.00 28.29 ? 176 SER L CB 1 ATOM 9761 O OG . SER F 2 181 ? 46.430 10.897 12.135 1.00 30.01 ? 176 SER L OG 1 ATOM 9762 N N . SER F 2 182 ? 47.898 14.068 13.359 1.00 28.66 ? 177 SER L N 1 ATOM 9763 C CA . SER F 2 182 ? 48.277 15.156 12.474 1.00 29.44 ? 177 SER L CA 1 ATOM 9764 C C . SER F 2 182 ? 49.731 14.909 12.090 1.00 29.20 ? 177 SER L C 1 ATOM 9765 O O . SER F 2 182 ? 50.581 14.675 12.957 1.00 29.09 ? 177 SER L O 1 ATOM 9766 C CB . SER F 2 182 ? 48.117 16.509 13.168 1.00 30.28 ? 177 SER L CB 1 ATOM 9767 O OG . SER F 2 182 ? 48.477 17.570 12.285 1.00 31.54 ? 177 SER L OG 1 ATOM 9768 N N . THR F 2 183 ? 50.001 14.934 10.794 1.00 29.70 ? 178 THR L N 1 ATOM 9769 C CA . THR F 2 183 ? 51.285 14.545 10.267 1.00 29.68 ? 178 THR L CA 1 ATOM 9770 C C . THR F 2 183 ? 51.808 15.600 9.317 1.00 30.96 ? 178 THR L C 1 ATOM 9771 O O . THR F 2 183 ? 51.170 15.928 8.322 1.00 32.38 ? 178 THR L O 1 ATOM 9772 C CB . THR F 2 183 ? 51.202 13.201 9.541 1.00 29.81 ? 178 THR L CB 1 ATOM 9773 O OG1 . THR F 2 183 ? 50.840 12.196 10.491 1.00 29.82 ? 178 THR L OG1 1 ATOM 9774 C CG2 . THR F 2 183 ? 52.528 12.808 8.952 1.00 29.87 ? 178 THR L CG2 1 ATOM 9775 N N . LEU F 2 184 ? 52.988 16.109 9.627 1.00 31.10 ? 179 LEU L N 1 ATOM 9776 C CA . LEU F 2 184 ? 53.632 17.119 8.811 1.00 32.79 ? 179 LEU L CA 1 ATOM 9777 C C . LEU F 2 184 ? 54.765 16.483 8.032 1.00 32.91 ? 179 LEU L C 1 ATOM 9778 O O . LEU F 2 184 ? 55.763 16.065 8.615 1.00 32.31 ? 179 LEU L O 1 ATOM 9779 C CB . LEU F 2 184 ? 54.161 18.223 9.708 1.00 33.49 ? 179 LEU L CB 1 ATOM 9780 C CG . LEU F 2 184 ? 55.056 19.244 9.037 1.00 35.58 ? 179 LEU L CG 1 ATOM 9781 C CD1 . LEU F 2 184 ? 54.358 19.912 7.860 1.00 37.50 ? 179 LEU L CD1 1 ATOM 9782 C CD2 . LEU F 2 184 ? 55.465 20.266 10.086 1.00 36.64 ? 179 LEU L CD2 1 ATOM 9783 N N . THR F 2 185 ? 54.608 16.383 6.718 1.00 34.14 ? 180 THR L N 1 ATOM 9784 C CA . THR F 2 185 ? 55.604 15.708 5.894 1.00 34.73 ? 180 THR L CA 1 ATOM 9785 C C . THR F 2 185 ? 56.485 16.726 5.174 1.00 36.25 ? 180 THR L C 1 ATOM 9786 O O . THR F 2 185 ? 55.994 17.663 4.546 1.00 38.03 ? 180 THR L O 1 ATOM 9787 C CB . THR F 2 185 ? 54.941 14.741 4.889 1.00 35.74 ? 180 THR L CB 1 ATOM 9788 O OG1 . THR F 2 185 ? 54.310 13.663 5.606 1.00 34.85 ? 180 THR L OG1 1 ATOM 9789 C CG2 . THR F 2 185 ? 55.971 14.153 3.939 1.00 36.65 ? 180 THR L CG2 1 ATOM 9790 N N . LEU F 2 186 ? 57.795 16.521 5.266 1.00 36.12 ? 181 LEU L N 1 ATOM 9791 C CA . LEU F 2 186 ? 58.775 17.419 4.669 1.00 37.42 ? 181 LEU L CA 1 ATOM 9792 C C . LEU F 2 186 ? 59.842 16.596 3.983 1.00 37.66 ? 181 LEU L C 1 ATOM 9793 O O . LEU F 2 186 ? 59.912 15.381 4.167 1.00 36.98 ? 181 LEU L O 1 ATOM 9794 C CB . LEU F 2 186 ? 59.440 18.256 5.757 1.00 37.62 ? 181 LEU L CB 1 ATOM 9795 C CG . LEU F 2 186 ? 58.537 19.028 6.717 1.00 37.72 ? 181 LEU L CG 1 ATOM 9796 C CD1 . LEU F 2 186 ? 59.272 19.306 8.017 1.00 37.77 ? 181 LEU L CD1 1 ATOM 9797 C CD2 . LEU F 2 186 ? 58.063 20.320 6.074 1.00 39.94 ? 181 LEU L CD2 1 ATOM 9798 N N . THR F 2 187 ? 60.689 17.264 3.204 1.00 39.34 ? 182 THR L N 1 ATOM 9799 C CA . THR F 2 187 ? 61.942 16.669 2.770 1.00 39.61 ? 182 THR L CA 1 ATOM 9800 C C . THR F 2 187 ? 62.941 16.748 3.928 1.00 38.74 ? 182 THR L C 1 ATOM 9801 O O . THR F 2 187 ? 62.858 17.631 4.796 1.00 37.98 ? 182 THR L O 1 ATOM 9802 C CB . THR F 2 187 ? 62.548 17.390 1.552 1.00 42.30 ? 182 THR L CB 1 ATOM 9803 O OG1 . THR F 2 187 ? 62.899 18.732 1.917 1.00 43.47 ? 182 THR L OG1 1 ATOM 9804 C CG2 . THR F 2 187 ? 61.561 17.421 0.361 1.00 43.88 ? 182 THR L CG2 1 ATOM 9805 N N . LYS F 2 188 ? 63.873 15.801 3.947 1.00 38.67 ? 183 LYS L N 1 ATOM 9806 C CA . LYS F 2 188 ? 64.994 15.846 4.878 1.00 38.54 ? 183 LYS L CA 1 ATOM 9807 C C . LYS F 2 188 ? 65.651 17.225 4.826 1.00 39.44 ? 183 LYS L C 1 ATOM 9808 O O . LYS F 2 188 ? 65.875 17.853 5.853 1.00 39.21 ? 183 LYS L O 1 ATOM 9809 C CB . LYS F 2 188 ? 66.010 14.762 4.501 1.00 39.44 ? 183 LYS L CB 1 ATOM 9810 C CG . LYS F 2 188 ? 67.169 14.528 5.461 1.00 39.90 ? 183 LYS L CG 1 ATOM 9811 C CD . LYS F 2 188 ? 68.182 13.597 4.793 1.00 41.45 ? 183 LYS L CD 1 ATOM 9812 C CE . LYS F 2 188 ? 69.112 12.876 5.763 1.00 42.46 ? 183 LYS L CE 1 ATOM 9813 N NZ . LYS F 2 188 ? 70.329 13.659 6.090 1.00 43.90 ? 183 LYS L NZ 1 ATOM 9814 N N . ASP F 2 189 ? 65.950 17.690 3.623 1.00 41.05 ? 184 ASP L N 1 ATOM 9815 C CA . ASP F 2 189 ? 66.608 18.994 3.439 1.00 43.20 ? 184 ASP L CA 1 ATOM 9816 C C . ASP F 2 189 ? 65.866 20.155 4.085 1.00 42.82 ? 184 ASP L C 1 ATOM 9817 O O . ASP F 2 189 ? 66.487 20.985 4.734 1.00 43.57 ? 184 ASP L O 1 ATOM 9818 C CB . ASP F 2 189 ? 66.828 19.284 1.951 1.00 45.80 ? 184 ASP L CB 1 ATOM 9819 C CG . ASP F 2 189 ? 67.912 18.387 1.336 1.00 47.28 ? 184 ASP L CG 1 ATOM 9820 O OD1 . ASP F 2 189 ? 68.571 17.612 2.083 1.00 47.14 ? 184 ASP L OD1 1 ATOM 9821 O OD2 . ASP F 2 189 ? 68.096 18.440 0.102 1.00 49.91 ? 184 ASP L OD2 1 ATOM 9822 N N . GLU F 2 190 ? 64.545 20.191 3.927 1.00 41.73 ? 185 GLU L N 1 ATOM 9823 C CA . GLU F 2 190 ? 63.732 21.219 4.564 1.00 41.90 ? 185 GLU L CA 1 ATOM 9824 C C . GLU F 2 190 ? 63.643 21.015 6.072 1.00 39.85 ? 185 GLU L C 1 ATOM 9825 O O . GLU F 2 190 ? 63.719 21.984 6.835 1.00 41.14 ? 185 GLU L O 1 ATOM 9826 C CB . GLU F 2 190 ? 62.333 21.294 3.958 1.00 42.31 ? 185 GLU L CB 1 ATOM 9827 C CG . GLU F 2 190 ? 61.531 22.489 4.459 1.00 44.14 ? 185 GLU L CG 1 ATOM 9828 C CD . GLU F 2 190 ? 60.164 22.589 3.810 1.00 45.21 ? 185 GLU L CD 1 ATOM 9829 O OE1 . GLU F 2 190 ? 59.479 21.544 3.640 1.00 43.92 ? 185 GLU L OE1 1 ATOM 9830 O OE2 . GLU F 2 190 ? 59.764 23.723 3.479 1.00 48.28 ? 185 GLU L OE2 1 ATOM 9831 N N . TYR F 2 191 ? 63.505 19.764 6.501 1.00 37.00 ? 186 TYR L N 1 ATOM 9832 C CA . TYR F 2 191 ? 63.441 19.453 7.929 1.00 35.52 ? 186 TYR L CA 1 ATOM 9833 C C . TYR F 2 191 ? 64.689 19.961 8.659 1.00 36.84 ? 186 TYR L C 1 ATOM 9834 O O . TYR F 2 191 ? 64.616 20.408 9.797 1.00 37.12 ? 186 TYR L O 1 ATOM 9835 C CB . TYR F 2 191 ? 63.293 17.943 8.150 1.00 33.64 ? 186 TYR L CB 1 ATOM 9836 C CG . TYR F 2 191 ? 63.411 17.503 9.595 1.00 32.93 ? 186 TYR L CG 1 ATOM 9837 C CD1 . TYR F 2 191 ? 62.474 17.896 10.543 1.00 32.46 ? 186 TYR L CD1 1 ATOM 9838 C CD2 . TYR F 2 191 ? 64.445 16.689 10.003 1.00 33.34 ? 186 TYR L CD2 1 ATOM 9839 C CE1 . TYR F 2 191 ? 62.574 17.502 11.870 1.00 32.49 ? 186 TYR L CE1 1 ATOM 9840 C CE2 . TYR F 2 191 ? 64.554 16.279 11.322 1.00 33.65 ? 186 TYR L CE2 1 ATOM 9841 C CZ . TYR F 2 191 ? 63.625 16.683 12.255 1.00 33.26 ? 186 TYR L CZ 1 ATOM 9842 O OH . TYR F 2 191 ? 63.794 16.241 13.561 1.00 33.94 ? 186 TYR L OH 1 ATOM 9843 N N . GLU F 2 192 ? 65.833 19.885 7.993 1.00 37.69 ? 187 GLU L N 1 ATOM 9844 C CA . GLU F 2 192 ? 67.088 20.391 8.563 1.00 39.61 ? 187 GLU L CA 1 ATOM 9845 C C . GLU F 2 192 ? 67.282 21.906 8.473 1.00 41.58 ? 187 GLU L C 1 ATOM 9846 O O . GLU F 2 192 ? 68.211 22.443 9.062 1.00 43.77 ? 187 GLU L O 1 ATOM 9847 C CB . GLU F 2 192 ? 68.284 19.656 7.945 1.00 40.37 ? 187 GLU L CB 1 ATOM 9848 C CG . GLU F 2 192 ? 68.265 18.152 8.225 1.00 39.18 ? 187 GLU L CG 1 ATOM 9849 C CD . GLU F 2 192 ? 69.455 17.423 7.624 1.00 40.54 ? 187 GLU L CD 1 ATOM 9850 O OE1 . GLU F 2 192 ? 70.191 18.022 6.805 1.00 42.21 ? 187 GLU L OE1 1 ATOM 9851 O OE2 . GLU F 2 192 ? 69.657 16.245 7.979 1.00 40.51 ? 187 GLU L OE2 1 ATOM 9852 N N . ARG F 2 193 ? 66.402 22.613 7.782 1.00 41.48 ? 188 ARG L N 1 ATOM 9853 C CA . ARG F 2 193 ? 66.496 24.083 7.746 1.00 44.24 ? 188 ARG L CA 1 ATOM 9854 C C . ARG F 2 193 ? 65.796 24.701 8.953 1.00 44.84 ? 188 ARG L C 1 ATOM 9855 O O . ARG F 2 193 ? 65.691 25.926 9.050 1.00 47.55 ? 188 ARG L O 1 ATOM 9856 C CB . ARG F 2 193 ? 65.875 24.701 6.497 1.00 45.22 ? 188 ARG L CB 1 ATOM 9857 C CG . ARG F 2 193 ? 66.566 24.469 5.180 1.00 45.78 ? 188 ARG L CG 1 ATOM 9858 C CD . ARG F 2 193 ? 65.787 25.135 4.051 1.00 47.52 ? 188 ARG L CD 1 ATOM 9859 N NE . ARG F 2 193 ? 66.602 25.716 2.972 1.00 50.45 ? 188 ARG L NE 1 ATOM 9860 C CZ . ARG F 2 193 ? 67.078 26.967 2.928 1.00 54.10 ? 188 ARG L CZ 1 ATOM 9861 N NH1 . ARG F 2 193 ? 66.892 27.837 3.920 1.00 55.58 ? 188 ARG L NH1 1 ATOM 9862 N NH2 . ARG F 2 193 ? 67.771 27.356 1.869 1.00 56.79 ? 188 ARG L NH2 1 ATOM 9863 N N . HIS F 2 194 ? 65.269 23.867 9.847 1.00 42.53 ? 189 HIS L N 1 ATOM 9864 C CA . HIS F 2 194 ? 64.565 24.375 11.016 1.00 43.30 ? 189 HIS L CA 1 ATOM 9865 C C . HIS F 2 194 ? 64.902 23.585 12.265 1.00 42.82 ? 189 HIS L C 1 ATOM 9866 O O . HIS F 2 194 ? 65.275 22.413 12.196 1.00 40.97 ? 189 HIS L O 1 ATOM 9867 C CB . HIS F 2 194 ? 63.060 24.374 10.764 1.00 41.69 ? 189 HIS L CB 1 ATOM 9868 C CG . HIS F 2 194 ? 62.646 25.229 9.606 1.00 43.20 ? 189 HIS L CG 1 ATOM 9869 N ND1 . HIS F 2 194 ? 62.708 26.610 9.638 1.00 46.82 ? 189 HIS L ND1 1 ATOM 9870 C CD2 . HIS F 2 194 ? 62.189 24.901 8.373 1.00 42.14 ? 189 HIS L CD2 1 ATOM 9871 C CE1 . HIS F 2 194 ? 62.285 27.090 8.481 1.00 48.04 ? 189 HIS L CE1 1 ATOM 9872 N NE2 . HIS F 2 194 ? 61.976 26.074 7.693 1.00 45.24 ? 189 HIS L NE2 1 ATOM 9873 N N . ASN F 2 195 ? 64.778 24.242 13.411 1.00 45.28 ? 190 ASN L N 1 ATOM 9874 C CA . ASN F 2 195 ? 65.147 23.645 14.693 1.00 45.78 ? 190 ASN L CA 1 ATOM 9875 C C . ASN F 2 195 ? 63.949 23.226 15.511 1.00 44.26 ? 190 ASN L C 1 ATOM 9876 O O . ASN F 2 195 ? 63.877 22.082 15.950 1.00 42.48 ? 190 ASN L O 1 ATOM 9877 C CB . ASN F 2 195 ? 66.013 24.638 15.469 1.00 50.22 ? 190 ASN L CB 1 ATOM 9878 C CG . ASN F 2 195 ? 67.276 25.018 14.702 1.00 52.17 ? 190 ASN L CG 1 ATOM 9879 O OD1 . ASN F 2 195 ? 67.920 24.150 14.106 1.00 50.81 ? 190 ASN L OD1 1 ATOM 9880 N ND2 . ASN F 2 195 ? 67.619 26.307 14.678 1.00 55.90 ? 190 ASN L ND2 1 ATOM 9881 N N . SER F 2 196 ? 62.994 24.135 15.675 1.00 45.36 ? 191 SER L N 1 ATOM 9882 C CA . SER F 2 196 ? 61.870 23.934 16.592 1.00 44.77 ? 191 SER L CA 1 ATOM 9883 C C . SER F 2 196 ? 60.604 23.456 15.869 1.00 41.79 ? 191 SER L C 1 ATOM 9884 O O . SER F 2 196 ? 60.165 24.049 14.890 1.00 41.78 ? 191 SER L O 1 ATOM 9885 C CB . SER F 2 196 ? 61.584 25.232 17.347 1.00 48.44 ? 191 SER L CB 1 ATOM 9886 O OG . SER F 2 196 ? 60.484 25.094 18.211 1.00 48.12 ? 191 SER L OG 1 ATOM 9887 N N . TYR F 2 197 ? 60.024 22.374 16.370 1.00 39.83 ? 192 TYR L N 1 ATOM 9888 C CA . TYR F 2 197 ? 58.809 21.795 15.789 1.00 37.51 ? 192 TYR L CA 1 ATOM 9889 C C . TYR F 2 197 ? 57.733 21.622 16.839 1.00 37.79 ? 192 TYR L C 1 ATOM 9890 O O . TYR F 2 197 ? 57.878 20.831 17.768 1.00 37.71 ? 192 TYR L O 1 ATOM 9891 C CB . TYR F 2 197 ? 59.126 20.446 15.152 1.00 34.78 ? 192 TYR L CB 1 ATOM 9892 C CG . TYR F 2 197 ? 59.967 20.580 13.905 1.00 34.76 ? 192 TYR L CG 1 ATOM 9893 C CD1 . TYR F 2 197 ? 61.350 20.697 13.980 1.00 36.01 ? 192 TYR L CD1 1 ATOM 9894 C CD2 . TYR F 2 197 ? 59.374 20.627 12.641 1.00 33.87 ? 192 TYR L CD2 1 ATOM 9895 C CE1 . TYR F 2 197 ? 62.120 20.838 12.832 1.00 36.18 ? 192 TYR L CE1 1 ATOM 9896 C CE2 . TYR F 2 197 ? 60.140 20.772 11.493 1.00 34.24 ? 192 TYR L CE2 1 ATOM 9897 C CZ . TYR F 2 197 ? 61.505 20.879 11.599 1.00 35.15 ? 192 TYR L CZ 1 ATOM 9898 O OH . TYR F 2 197 ? 62.245 21.013 10.464 1.00 35.51 ? 192 TYR L OH 1 ATOM 9899 N N . THR F 2 198 ? 56.636 22.342 16.666 1.00 38.85 ? 193 THR L N 1 ATOM 9900 C CA . THR F 2 198 ? 55.604 22.425 17.685 1.00 39.64 ? 193 THR L CA 1 ATOM 9901 C C . THR F 2 198 ? 54.255 22.029 17.123 1.00 38.37 ? 193 THR L C 1 ATOM 9902 O O . THR F 2 198 ? 53.920 22.359 15.986 1.00 38.27 ? 193 THR L O 1 ATOM 9903 C CB . THR F 2 198 ? 55.542 23.845 18.272 1.00 43.14 ? 193 THR L CB 1 ATOM 9904 O OG1 . THR F 2 198 ? 56.810 24.139 18.870 1.00 44.94 ? 193 THR L OG1 1 ATOM 9905 C CG2 . THR F 2 198 ? 54.453 23.960 19.330 1.00 43.91 ? 193 THR L CG2 1 ATOM 9906 N N . CYS F 2 199 ? 53.505 21.302 17.942 1.00 38.23 ? 194 CYS L N 1 ATOM 9907 C CA . CYS F 2 199 ? 52.173 20.834 17.631 1.00 37.81 ? 194 CYS L CA 1 ATOM 9908 C C . CYS F 2 199 ? 51.258 21.484 18.675 1.00 39.40 ? 194 CYS L C 1 ATOM 9909 O O . CYS F 2 199 ? 51.455 21.291 19.878 1.00 40.08 ? 194 CYS L O 1 ATOM 9910 C CB . CYS F 2 199 ? 52.171 19.309 17.722 1.00 36.48 ? 194 CYS L CB 1 ATOM 9911 S SG . CYS F 2 199 ? 50.553 18.561 17.557 1.00 37.52 ? 194 CYS L SG 1 ATOM 9912 N N . GLU F 2 200 ? 50.308 22.304 18.223 1.00 40.56 ? 195 GLU L N 1 ATOM 9913 C CA . GLU F 2 200 ? 49.397 23.056 19.116 1.00 42.56 ? 195 GLU L CA 1 ATOM 9914 C C . GLU F 2 200 ? 47.940 22.620 18.910 1.00 41.44 ? 195 GLU L C 1 ATOM 9915 O O . GLU F 2 200 ? 47.398 22.746 17.806 1.00 41.05 ? 195 GLU L O 1 ATOM 9916 C CB . GLU F 2 200 ? 49.481 24.560 18.861 1.00 46.03 ? 195 GLU L CB 1 ATOM 9917 C CG . GLU F 2 200 ? 50.704 25.244 19.447 1.00 48.63 ? 195 GLU L CG 1 ATOM 9918 C CD . GLU F 2 200 ? 50.609 26.775 19.500 1.00 53.59 ? 195 GLU L CD 1 ATOM 9919 O OE1 . GLU F 2 200 ? 49.490 27.328 19.371 1.00 55.66 ? 195 GLU L OE1 1 ATOM 9920 O OE2 . GLU F 2 200 ? 51.662 27.444 19.675 1.00 55.78 ? 195 GLU L OE2 1 ATOM 9921 N N . ALA F 2 201 ? 47.323 22.127 19.984 1.00 40.86 ? 196 ALA L N 1 ATOM 9922 C CA . ALA F 2 201 ? 45.943 21.662 19.976 1.00 39.82 ? 196 ALA L CA 1 ATOM 9923 C C . ALA F 2 201 ? 45.057 22.649 20.723 1.00 42.58 ? 196 ALA L C 1 ATOM 9924 O O . ALA F 2 201 ? 45.299 22.922 21.903 1.00 43.93 ? 196 ALA L O 1 ATOM 9925 C CB . ALA F 2 201 ? 45.866 20.304 20.637 1.00 37.71 ? 196 ALA L CB 1 ATOM 9926 N N . THR F 2 202 ? 44.067 23.222 20.030 1.00 43.61 ? 197 THR L N 1 ATOM 9927 C CA . THR F 2 202 ? 43.075 24.058 20.695 1.00 46.38 ? 197 THR L CA 1 ATOM 9928 C C . THR F 2 202 ? 41.763 23.259 20.786 1.00 44.88 ? 197 THR L C 1 ATOM 9929 O O . THR F 2 202 ? 41.308 22.647 19.814 1.00 43.10 ? 197 THR L O 1 ATOM 9930 C CB . THR F 2 202 ? 42.941 25.445 20.024 1.00 49.86 ? 197 THR L CB 1 ATOM 9931 O OG1 . THR F 2 202 ? 41.986 26.238 20.733 1.00 53.04 ? 197 THR L OG1 1 ATOM 9932 C CG2 . THR F 2 202 ? 42.519 25.318 18.576 1.00 49.34 ? 197 THR L CG2 1 ATOM 9933 N N . HIS F 2 203 ? 41.193 23.237 21.979 1.00 45.68 ? 198 HIS L N 1 ATOM 9934 C CA . HIS F 2 203 ? 40.054 22.392 22.279 1.00 44.70 ? 198 HIS L CA 1 ATOM 9935 C C . HIS F 2 203 ? 39.227 23.087 23.338 1.00 47.94 ? 198 HIS L C 1 ATOM 9936 O O . HIS F 2 203 ? 39.782 23.848 24.121 1.00 50.30 ? 198 HIS L O 1 ATOM 9937 C CB . HIS F 2 203 ? 40.560 21.057 22.807 1.00 41.79 ? 198 HIS L CB 1 ATOM 9938 C CG . HIS F 2 203 ? 39.484 20.044 23.027 1.00 40.61 ? 198 HIS L CG 1 ATOM 9939 N ND1 . HIS F 2 203 ? 39.078 19.658 24.285 1.00 41.23 ? 198 HIS L ND1 1 ATOM 9940 C CD2 . HIS F 2 203 ? 38.731 19.337 22.154 1.00 39.17 ? 198 HIS L CD2 1 ATOM 9941 C CE1 . HIS F 2 203 ? 38.123 18.755 24.176 1.00 40.31 ? 198 HIS L CE1 1 ATOM 9942 N NE2 . HIS F 2 203 ? 37.896 18.539 22.893 1.00 39.10 ? 198 HIS L NE2 1 ATOM 9943 N N . LYS F 2 204 ? 37.921 22.821 23.391 1.00 48.58 ? 199 LYS L N 1 ATOM 9944 C CA . LYS F 2 204 ? 37.037 23.602 24.268 1.00 52.34 ? 199 LYS L CA 1 ATOM 9945 C C . LYS F 2 204 ? 37.335 23.429 25.770 1.00 53.43 ? 199 LYS L C 1 ATOM 9946 O O . LYS F 2 204 ? 37.020 24.310 26.572 1.00 56.97 ? 199 LYS L O 1 ATOM 9947 C CB . LYS F 2 204 ? 35.558 23.330 23.965 1.00 52.90 ? 199 LYS L CB 1 ATOM 9948 C CG . LYS F 2 204 ? 34.939 22.171 24.726 1.00 51.45 ? 199 LYS L CG 1 ATOM 9949 C CD . LYS F 2 204 ? 33.525 21.876 24.239 1.00 52.14 ? 199 LYS L CD 1 ATOM 9950 C CE . LYS F 2 204 ? 32.512 22.918 24.687 1.00 56.29 ? 199 LYS L CE 1 ATOM 9951 N NZ . LYS F 2 204 ? 32.062 22.662 26.083 1.00 57.46 ? 199 LYS L NZ 1 ATOM 9952 N N . THR F 2 205 ? 37.957 22.311 26.139 1.00 50.88 ? 200 THR L N 1 ATOM 9953 C CA . THR F 2 205 ? 38.351 22.051 27.522 1.00 51.98 ? 200 THR L CA 1 ATOM 9954 C C . THR F 2 205 ? 39.414 23.001 28.048 1.00 54.75 ? 200 THR L C 1 ATOM 9955 O O . THR F 2 205 ? 39.787 22.900 29.206 1.00 56.87 ? 200 THR L O 1 ATOM 9956 C CB . THR F 2 205 ? 38.904 20.619 27.722 1.00 48.94 ? 200 THR L CB 1 ATOM 9957 O OG1 . THR F 2 205 ? 39.917 20.333 26.749 1.00 46.43 ? 200 THR L OG1 1 ATOM 9958 C CG2 . THR F 2 205 ? 37.812 19.606 27.607 1.00 47.40 ? 200 THR L CG2 1 ATOM 9959 N N . SER F 2 206 ? 39.919 23.909 27.222 1.00 55.62 ? 201 SER L N 1 ATOM 9960 C CA . SER F 2 206 ? 40.802 24.953 27.720 1.00 58.98 ? 201 SER L CA 1 ATOM 9961 C C . SER F 2 206 ? 40.862 26.126 26.760 1.00 60.83 ? 201 SER L C 1 ATOM 9962 O O . SER F 2 206 ? 40.626 25.981 25.567 1.00 58.80 ? 201 SER L O 1 ATOM 9963 C CB . SER F 2 206 ? 42.201 24.385 27.944 1.00 57.56 ? 201 SER L CB 1 ATOM 9964 O OG . SER F 2 206 ? 43.104 25.413 28.287 1.00 61.09 ? 201 SER L OG 1 ATOM 9965 N N . THR F 2 207 ? 41.159 27.301 27.293 1.00 65.50 ? 202 THR L N 1 ATOM 9966 C CA . THR F 2 207 ? 41.441 28.449 26.449 1.00 68.02 ? 202 THR L CA 1 ATOM 9967 C C . THR F 2 207 ? 42.881 28.359 25.945 1.00 66.52 ? 202 THR L C 1 ATOM 9968 O O . THR F 2 207 ? 43.175 28.753 24.815 1.00 66.37 ? 202 THR L O 1 ATOM 9969 C CB . THR F 2 207 ? 41.193 29.756 27.205 1.00 74.04 ? 202 THR L CB 1 ATOM 9970 O OG1 . THR F 2 207 ? 42.015 29.782 28.372 1.00 75.96 ? 202 THR L OG1 1 ATOM 9971 C CG2 . THR F 2 207 ? 39.734 29.846 27.618 1.00 75.72 ? 202 THR L CG2 1 ATOM 9972 N N . SER F 2 208 ? 43.765 27.788 26.763 1.00 65.75 ? 203 SER L N 1 ATOM 9973 C CA . SER F 2 208 ? 45.182 27.675 26.415 1.00 64.51 ? 203 SER L CA 1 ATOM 9974 C C . SER F 2 208 ? 45.429 26.444 25.559 1.00 59.02 ? 203 SER L C 1 ATOM 9975 O O . SER F 2 208 ? 45.109 25.319 25.977 1.00 56.15 ? 203 SER L O 1 ATOM 9976 C CB . SER F 2 208 ? 46.036 27.529 27.668 1.00 66.43 ? 203 SER L CB 1 ATOM 9977 O OG . SER F 2 208 ? 45.940 28.665 28.491 1.00 72.03 ? 203 SER L OG 1 ATOM 9978 N N . PRO F 2 209 ? 46.040 26.639 24.378 1.00 57.66 ? 204 PRO L N 1 ATOM 9979 C CA . PRO F 2 209 ? 46.323 25.444 23.597 1.00 52.89 ? 204 PRO L CA 1 ATOM 9980 C C . PRO F 2 209 ? 47.263 24.503 24.349 1.00 51.15 ? 204 PRO L C 1 ATOM 9981 O O . PRO F 2 209 ? 48.056 24.950 25.182 1.00 53.48 ? 204 PRO L O 1 ATOM 9982 C CB . PRO F 2 209 ? 46.995 25.990 22.328 1.00 52.92 ? 204 PRO L CB 1 ATOM 9983 C CG . PRO F 2 209 ? 47.511 27.334 22.709 1.00 57.59 ? 204 PRO L CG 1 ATOM 9984 C CD . PRO F 2 209 ? 46.573 27.864 23.753 1.00 60.72 ? 204 PRO L CD 1 ATOM 9985 N N . ILE F 2 210 ? 47.142 23.209 24.068 1.00 47.36 ? 205 ILE L N 1 ATOM 9986 C CA . ILE F 2 210 ? 48.114 22.235 24.547 1.00 45.94 ? 205 ILE L CA 1 ATOM 9987 C C . ILE F 2 210 ? 49.260 22.121 23.541 1.00 44.35 ? 205 ILE L C 1 ATOM 9988 O O . ILE F 2 210 ? 49.059 21.734 22.389 1.00 41.65 ? 205 ILE L O 1 ATOM 9989 C CB . ILE F 2 210 ? 47.483 20.860 24.768 1.00 43.70 ? 205 ILE L CB 1 ATOM 9990 C CG1 . ILE F 2 210 ? 46.426 20.954 25.864 1.00 45.61 ? 205 ILE L CG1 1 ATOM 9991 C CG2 . ILE F 2 210 ? 48.548 19.846 25.173 1.00 42.94 ? 205 ILE L CG2 1 ATOM 9992 C CD1 . ILE F 2 210 ? 45.553 19.726 25.965 1.00 43.78 ? 205 ILE L CD1 1 ATOM 9993 N N . VAL F 2 211 ? 50.465 22.434 24.011 1.00 46.13 ? 206 VAL L N 1 ATOM 9994 C CA . VAL F 2 211 ? 51.647 22.588 23.172 1.00 45.42 ? 206 VAL L CA 1 ATOM 9995 C C . VAL F 2 211 ? 52.618 21.447 23.416 1.00 43.78 ? 206 VAL L C 1 ATOM 9996 O O . VAL F 2 211 ? 53.010 21.188 24.549 1.00 45.40 ? 206 VAL L O 1 ATOM 9997 C CB . VAL F 2 211 ? 52.378 23.905 23.520 1.00 49.46 ? 206 VAL L CB 1 ATOM 9998 C CG1 . VAL F 2 211 ? 53.566 24.128 22.595 1.00 49.15 ? 206 VAL L CG1 1 ATOM 9999 C CG2 . VAL F 2 211 ? 51.414 25.079 23.455 1.00 51.81 ? 206 VAL L CG2 1 ATOM 10000 N N . LYS F 2 212 ? 53.025 20.783 22.348 1.00 41.10 ? 207 LYS L N 1 ATOM 10001 C CA . LYS F 2 212 ? 54.068 19.775 22.440 1.00 40.32 ? 207 LYS L CA 1 ATOM 10002 C C . LYS F 2 212 ? 55.079 20.023 21.345 1.00 39.70 ? 207 LYS L C 1 ATOM 10003 O O . LYS F 2 212 ? 54.712 20.162 20.171 1.00 37.81 ? 207 LYS L O 1 ATOM 10004 C CB . LYS F 2 212 ? 53.493 18.372 22.288 1.00 37.85 ? 207 LYS L CB 1 ATOM 10005 C CG . LYS F 2 212 ? 52.885 17.810 23.561 1.00 39.15 ? 207 LYS L CG 1 ATOM 10006 C CD . LYS F 2 212 ? 53.925 17.675 24.656 1.00 42.18 ? 207 LYS L CD 1 ATOM 10007 C CE . LYS F 2 212 ? 53.475 16.732 25.758 1.00 43.46 ? 207 LYS L CE 1 ATOM 10008 N NZ . LYS F 2 212 ? 52.340 17.315 26.524 1.00 44.85 ? 207 LYS L NZ 1 ATOM 10009 N N . SER F 2 213 ? 56.353 20.059 21.726 1.00 41.33 ? 208 SER L N 1 ATOM 10010 C CA . SER F 2 213 ? 57.409 20.373 20.782 1.00 41.21 ? 208 SER L CA 1 ATOM 10011 C C . SER F 2 213 ? 58.705 19.648 21.087 1.00 42.01 ? 208 SER L C 1 ATOM 10012 O O . SER F 2 213 ? 58.849 18.983 22.112 1.00 42.83 ? 208 SER L O 1 ATOM 10013 C CB . SER F 2 213 ? 57.658 21.879 20.747 1.00 43.83 ? 208 SER L CB 1 ATOM 10014 O OG . SER F 2 213 ? 58.256 22.317 21.940 1.00 47.17 ? 208 SER L OG 1 ATOM 10015 N N . PHE F 2 214 ? 59.624 19.757 20.141 1.00 42.00 ? 209 PHE L N 1 ATOM 10016 C CA . PHE F 2 214 ? 60.985 19.293 20.319 1.00 43.66 ? 209 PHE L CA 1 ATOM 10017 C C . PHE F 2 214 ? 61.908 20.170 19.474 1.00 45.13 ? 209 PHE L C 1 ATOM 10018 O O . PHE F 2 214 ? 61.481 20.797 18.501 1.00 44.03 ? 209 PHE L O 1 ATOM 10019 C CB . PHE F 2 214 ? 61.114 17.822 19.898 1.00 41.35 ? 209 PHE L CB 1 ATOM 10020 C CG . PHE F 2 214 ? 60.939 17.597 18.426 1.00 38.68 ? 209 PHE L CG 1 ATOM 10021 C CD1 . PHE F 2 214 ? 59.684 17.390 17.898 1.00 36.53 ? 209 PHE L CD1 1 ATOM 10022 C CD2 . PHE F 2 214 ? 62.040 17.611 17.566 1.00 38.90 ? 209 PHE L CD2 1 ATOM 10023 C CE1 . PHE F 2 214 ? 59.521 17.187 16.532 1.00 34.81 ? 209 PHE L CE1 1 ATOM 10024 C CE2 . PHE F 2 214 ? 61.887 17.411 16.210 1.00 36.97 ? 209 PHE L CE2 1 ATOM 10025 C CZ . PHE F 2 214 ? 60.623 17.199 15.689 1.00 35.01 ? 209 PHE L CZ 1 ATOM 10026 N N . ASN F 2 215 ? 63.173 20.203 19.853 1.00 48.26 ? 210 ASN L N 1 ATOM 10027 C CA . ASN F 2 215 ? 64.199 20.848 19.061 1.00 50.18 ? 210 ASN L CA 1 ATOM 10028 C C . ASN F 2 215 ? 65.041 19.822 18.323 1.00 49.58 ? 210 ASN L C 1 ATOM 10029 O O . ASN F 2 215 ? 65.589 18.913 18.918 1.00 50.84 ? 210 ASN L O 1 ATOM 10030 C CB . ASN F 2 215 ? 65.060 21.684 19.963 1.00 54.57 ? 210 ASN L CB 1 ATOM 10031 C CG . ASN F 2 215 ? 64.308 22.887 20.503 1.00 56.68 ? 210 ASN L CG 1 ATOM 10032 O OD1 . ASN F 2 215 ? 63.078 22.891 20.578 1.00 55.25 ? 210 ASN L OD1 1 ATOM 10033 N ND2 . ASN F 2 215 ? 65.032 23.925 20.825 1.00 60.79 ? 210 ASN L ND2 1 ATOM 10034 N N . ARG F 2 216 ? 65.136 19.980 17.017 1.00 49.02 ? 211 ARG L N 1 ATOM 10035 C CA . ARG F 2 216 ? 65.861 19.045 16.164 1.00 48.85 ? 211 ARG L CA 1 ATOM 10036 C C . ARG F 2 216 ? 67.305 18.829 16.591 1.00 53.46 ? 211 ARG L C 1 ATOM 10037 O O . ARG F 2 216 ? 67.810 17.708 16.514 1.00 52.98 ? 211 ARG L O 1 ATOM 10038 C CB . ARG F 2 216 ? 65.877 19.558 14.728 1.00 47.48 ? 211 ARG L CB 1 ATOM 10039 C CG . ARG F 2 216 ? 66.325 18.526 13.716 1.00 45.91 ? 211 ARG L CG 1 ATOM 10040 C CD . ARG F 2 216 ? 66.395 19.095 12.309 1.00 45.45 ? 211 ARG L CD 1 ATOM 10041 N NE . ARG F 2 216 ? 67.770 19.396 11.932 1.00 47.37 ? 211 ARG L NE 1 ATOM 10042 C CZ . ARG F 2 216 ? 68.363 20.581 12.046 1.00 49.77 ? 211 ARG L CZ 1 ATOM 10043 N NH1 . ARG F 2 216 ? 67.720 21.640 12.510 1.00 50.76 ? 211 ARG L NH1 1 ATOM 10044 N NH2 . ARG F 2 216 ? 69.626 20.706 11.676 1.00 51.73 ? 211 ARG L NH2 1 ATOM 10045 N N . ASN F 2 217 ? 67.964 19.920 16.998 1.00 59.16 ? 212 ASN L N 1 ATOM 10046 C CA . ASN F 2 217 ? 69.362 19.892 17.471 1.00 65.02 ? 212 ASN L CA 1 ATOM 10047 C C . ASN F 2 217 ? 69.680 18.966 18.667 1.00 69.25 ? 212 ASN L C 1 ATOM 10048 O O . ASN F 2 217 ? 70.848 18.821 19.035 1.00 71.98 ? 212 ASN L O 1 ATOM 10049 C CB . ASN F 2 217 ? 69.830 21.327 17.793 1.00 68.60 ? 212 ASN L CB 1 ATOM 10050 C CG . ASN F 2 217 ? 68.838 22.101 18.651 1.00 69.80 ? 212 ASN L CG 1 ATOM 10051 O OD1 . ASN F 2 217 ? 67.795 22.552 18.148 1.00 67.94 ? 212 ASN L OD1 1 ATOM 10052 N ND2 . ASN F 2 217 ? 69.170 22.294 19.935 1.00 73.50 ? 212 ASN L ND2 1 ATOM 10053 N N . GLU F 2 218 ? 68.655 18.346 19.257 1.00 71.00 ? 213 GLU L N 1 ATOM 10054 C CA . GLU F 2 218 ? 68.815 17.481 20.434 1.00 75.92 ? 213 GLU L CA 1 ATOM 10055 C C . GLU F 2 218 ? 68.448 16.026 20.137 1.00 76.25 ? 213 GLU L C 1 ATOM 10056 O O . GLU F 2 218 ? 68.425 15.187 21.044 1.00 78.65 ? 213 GLU L O 1 ATOM 10057 C CB . GLU F 2 218 ? 67.950 18.017 21.582 1.00 77.47 ? 213 GLU L CB 1 ATOM 10058 C CG . GLU F 2 218 ? 67.919 19.540 21.634 1.00 79.19 ? 213 GLU L CG 1 ATOM 10059 C CD . GLU F 2 218 ? 67.259 20.098 22.871 1.00 81.23 ? 213 GLU L CD 1 ATOM 10060 O OE1 . GLU F 2 218 ? 66.284 19.489 23.366 1.00 78.74 ? 213 GLU L OE1 1 ATOM 10061 O OE2 . GLU F 2 218 ? 67.708 21.171 23.325 1.00 84.79 ? 213 GLU L OE2 1 ATOM 10062 N N . CYS F 2 219 ? 68.173 15.731 18.867 1.00 76.32 ? 214 CYS L N 1 ATOM 10063 C CA . CYS F 2 219 ? 67.702 14.405 18.441 1.00 75.66 ? 214 CYS L CA 1 ATOM 10064 C C . CYS F 2 219 ? 68.789 13.644 17.686 1.00 76.40 ? 214 CYS L C 1 ATOM 10065 O O . CYS F 2 219 ? 69.854 13.358 18.234 1.00 79.01 ? 214 CYS L O 1 ATOM 10066 C CB . CYS F 2 219 ? 66.462 14.550 17.551 1.00 72.47 ? 214 CYS L CB 1 ATOM 10067 S SG . CYS F 2 219 ? 65.000 15.190 18.416 1.00 72.52 ? 214 CYS L SG 1 HETATM 10068 C C1 . NAG G 3 . ? 49.042 -39.145 47.227 1.00 56.62 ? 401 NAG B C1 1 HETATM 10069 C C2 . NAG G 3 . ? 50.464 -39.443 47.676 1.00 65.46 ? 401 NAG B C2 1 HETATM 10070 C C3 . NAG G 3 . ? 51.116 -40.403 46.695 1.00 70.97 ? 401 NAG B C3 1 HETATM 10071 C C4 . NAG G 3 . ? 50.245 -41.628 46.488 1.00 74.24 ? 401 NAG B C4 1 HETATM 10072 C C5 . NAG G 3 . ? 48.925 -41.112 45.955 1.00 71.82 ? 401 NAG B C5 1 HETATM 10073 C C6 . NAG G 3 . ? 47.977 -42.220 45.658 1.00 74.82 ? 401 NAG B C6 1 HETATM 10074 C C7 . NAG G 3 . ? 51.366 -37.592 48.869 1.00 66.33 ? 401 NAG B C7 1 HETATM 10075 C C8 . NAG G 3 . ? 51.961 -36.234 48.760 1.00 66.11 ? 401 NAG B C8 1 HETATM 10076 N N2 . NAG G 3 . ? 51.222 -38.231 47.733 1.00 65.49 ? 401 NAG B N2 1 HETATM 10077 O O3 . NAG G 3 . ? 52.393 -40.801 47.173 1.00 73.38 ? 401 NAG B O3 1 HETATM 10078 O O4 . NAG G 3 . ? 50.879 -42.566 45.614 1.00 80.45 ? 401 NAG B O4 1 HETATM 10079 O O5 . NAG G 3 . ? 48.369 -40.378 47.030 1.00 61.98 ? 401 NAG B O5 1 HETATM 10080 O O6 . NAG G 3 . ? 47.856 -42.815 46.932 1.00 84.41 ? 401 NAG B O6 1 HETATM 10081 O O7 . NAG G 3 . ? 51.044 -38.073 49.932 1.00 69.68 ? 401 NAG B O7 1 HETATM 10082 C C1 . FUC H 4 . ? 46.558 -43.426 47.035 1.00 92.51 ? 402 FUC B C1 1 HETATM 10083 C C2 . FUC H 4 . ? 46.606 -44.825 46.431 1.00 92.94 ? 402 FUC B C2 1 HETATM 10084 C C3 . FUC H 4 . ? 47.477 -45.752 47.271 1.00 93.37 ? 402 FUC B C3 1 HETATM 10085 C C4 . FUC H 4 . ? 47.098 -45.672 48.745 1.00 95.37 ? 402 FUC B C4 1 HETATM 10086 C C5 . FUC H 4 . ? 47.020 -44.222 49.210 1.00 96.06 ? 402 FUC B C5 1 HETATM 10087 C C6 . FUC H 4 . ? 46.567 -44.139 50.663 1.00 94.09 ? 402 FUC B C6 1 HETATM 10088 O O2 . FUC H 4 . ? 47.130 -44.752 45.101 1.00 90.84 ? 402 FUC B O2 1 HETATM 10089 O O3 . FUC H 4 . ? 47.321 -47.099 46.811 1.00 92.20 ? 402 FUC B O3 1 HETATM 10090 O O4 . FUC H 4 . ? 45.831 -46.307 48.947 1.00 97.88 ? 402 FUC B O4 1 HETATM 10091 O O5 . FUC H 4 . ? 46.103 -43.507 48.384 1.00 96.70 ? 402 FUC B O5 1 HETATM 10092 C C1 . NAG I 3 . ? 51.271 -43.917 46.270 1.00 89.07 ? 403 NAG B C1 1 HETATM 10093 C C2 . NAG I 3 . ? 51.268 -45.069 45.246 1.00 94.17 ? 403 NAG B C2 1 HETATM 10094 C C3 . NAG I 3 . ? 51.739 -46.396 45.869 1.00 97.59 ? 403 NAG B C3 1 HETATM 10095 C C4 . NAG I 3 . ? 52.513 -46.314 47.203 1.00 98.54 ? 403 NAG B C4 1 HETATM 10096 C C5 . NAG I 3 . ? 52.224 -45.105 48.113 1.00 94.56 ? 403 NAG B C5 1 HETATM 10097 C C6 . NAG I 3 . ? 53.360 -44.966 49.128 1.00 91.97 ? 403 NAG B C6 1 HETATM 10098 C C7 . NAG I 3 . ? 49.559 -44.692 43.515 1.00 90.39 ? 403 NAG B C7 1 HETATM 10099 C C8 . NAG I 3 . ? 48.169 -45.013 43.035 1.00 85.93 ? 403 NAG B C8 1 HETATM 10100 N N2 . NAG I 3 . ? 49.949 -45.274 44.653 1.00 95.30 ? 403 NAG B N2 1 HETATM 10101 O O3 . NAG I 3 . ? 52.521 -47.102 44.919 1.00 92.37 ? 403 NAG B O3 1 HETATM 10102 O O4 . NAG I 3 . ? 52.251 -47.479 47.975 1.00 101.89 ? 403 NAG B O4 1 HETATM 10103 O O5 . NAG I 3 . ? 52.093 -43.862 47.441 1.00 90.25 ? 403 NAG B O5 1 HETATM 10104 O O6 . NAG I 3 . ? 52.899 -44.314 50.287 1.00 89.03 ? 403 NAG B O6 1 HETATM 10105 O O7 . NAG I 3 . ? 50.277 -43.921 42.875 1.00 86.14 ? 403 NAG B O7 1 HETATM 10106 C C1 . BMA J 5 . ? 52.860 -48.666 47.426 1.00 99.33 ? 404 BMA B C1 1 HETATM 10107 C C2 . BMA J 5 . ? 53.161 -49.638 48.557 1.00 97.25 ? 404 BMA B C2 1 HETATM 10108 C C3 . BMA J 5 . ? 53.888 -50.867 48.024 1.00 98.28 ? 404 BMA B C3 1 HETATM 10109 C C4 . BMA J 5 . ? 53.240 -51.429 46.752 1.00 102.40 ? 404 BMA B C4 1 HETATM 10110 C C5 . BMA J 5 . ? 52.769 -50.348 45.767 1.00 104.29 ? 404 BMA B C5 1 HETATM 10111 C C6 . BMA J 5 . ? 51.904 -50.925 44.640 1.00 108.38 ? 404 BMA B C6 1 HETATM 10112 O O2 . BMA J 5 . ? 51.940 -50.031 49.189 1.00 92.68 ? 404 BMA B O2 1 HETATM 10113 O O3 . BMA J 5 . ? 53.915 -51.862 49.057 1.00 94.41 ? 404 BMA B O3 1 HETATM 10114 O O4 . BMA J 5 . ? 54.195 -52.270 46.089 1.00 101.80 ? 404 BMA B O4 1 HETATM 10115 O O5 . BMA J 5 . ? 52.041 -49.335 46.466 1.00 100.34 ? 404 BMA B O5 1 HETATM 10116 O O6 . BMA J 5 . ? 52.485 -50.575 43.366 1.00 115.25 ? 404 BMA B O6 1 HETATM 10117 C C1 . MAN K 6 . ? 51.860 -51.278 42.252 1.00 120.74 ? 405 MAN B C1 1 HETATM 10118 C C2 . MAN K 6 . ? 51.400 -50.253 41.217 1.00 121.76 ? 405 MAN B C2 1 HETATM 10119 C C3 . MAN K 6 . ? 50.164 -49.542 41.744 1.00 120.93 ? 405 MAN B C3 1 HETATM 10120 C C4 . MAN K 6 . ? 49.024 -50.543 41.840 1.00 121.27 ? 405 MAN B C4 1 HETATM 10121 C C5 . MAN K 6 . ? 49.424 -51.873 42.507 1.00 119.15 ? 405 MAN B C5 1 HETATM 10122 C C6 . MAN K 6 . ? 48.774 -53.060 41.793 1.00 114.20 ? 405 MAN B C6 1 HETATM 10123 O O2 . MAN K 6 . ? 51.126 -50.883 39.980 1.00 117.96 ? 405 MAN B O2 1 HETATM 10124 O O3 . MAN K 6 . ? 49.802 -48.475 40.896 1.00 116.22 ? 405 MAN B O3 1 HETATM 10125 O O4 . MAN K 6 . ? 48.000 -49.945 42.600 1.00 120.50 ? 405 MAN B O4 1 HETATM 10126 O O5 . MAN K 6 . ? 50.816 -52.171 42.638 1.00 122.35 ? 405 MAN B O5 1 HETATM 10127 O O6 . MAN K 6 . ? 47.470 -53.269 42.283 1.00 108.65 ? 405 MAN B O6 1 HETATM 10128 C C1 . PEG L 7 . ? 64.511 -19.484 31.049 1.00 45.17 ? 406 PEG B C1 1 HETATM 10129 O O1 . PEG L 7 . ? 64.840 -20.613 30.229 1.00 44.78 ? 406 PEG B O1 1 HETATM 10130 C C2 . PEG L 7 . ? 64.724 -19.795 32.533 1.00 46.77 ? 406 PEG B C2 1 HETATM 10131 O O2 . PEG L 7 . ? 65.323 -21.081 32.736 1.00 48.94 ? 406 PEG B O2 1 HETATM 10132 C C3 . PEG L 7 . ? 65.592 -21.401 34.109 1.00 48.05 ? 406 PEG B C3 1 HETATM 10133 C C4 . PEG L 7 . ? 65.198 -22.858 34.367 1.00 48.19 ? 406 PEG B C4 1 HETATM 10134 O O4 . PEG L 7 . ? 66.343 -23.722 34.340 1.00 46.58 ? 406 PEG B O4 1 HETATM 10135 C C1 . NAG M 3 . ? 1.085 -21.874 44.258 1.00 59.88 ? 401 NAG E C1 1 HETATM 10136 C C2 . NAG M 3 . ? 0.951 -22.766 45.485 1.00 71.19 ? 401 NAG E C2 1 HETATM 10137 C C3 . NAG M 3 . ? 0.575 -21.941 46.730 1.00 81.06 ? 401 NAG E C3 1 HETATM 10138 C C4 . NAG M 3 . ? 1.539 -20.759 46.963 1.00 87.68 ? 401 NAG E C4 1 HETATM 10139 C C5 . NAG M 3 . ? 1.627 -19.979 45.649 1.00 86.10 ? 401 NAG E C5 1 HETATM 10140 C C6 . NAG M 3 . ? 2.590 -18.781 45.613 1.00 93.20 ? 401 NAG E C6 1 HETATM 10141 C C7 . NAG M 3 . ? 0.460 -25.122 44.881 1.00 65.02 ? 401 NAG E C7 1 HETATM 10142 C C8 . NAG M 3 . ? -0.581 -26.172 44.610 1.00 61.46 ? 401 NAG E C8 1 HETATM 10143 N N2 . NAG M 3 . ? 0.040 -23.879 45.201 1.00 69.11 ? 401 NAG E N2 1 HETATM 10144 O O3 . NAG M 3 . ? 0.546 -22.793 47.854 1.00 80.41 ? 401 NAG E O3 1 HETATM 10145 O O4 . NAG M 3 . ? 1.067 -19.865 47.969 1.00 101.87 ? 401 NAG E O4 1 HETATM 10146 O O5 . NAG M 3 . ? 2.019 -20.869 44.618 1.00 71.66 ? 401 NAG E O5 1 HETATM 10147 O O6 . NAG M 3 . ? 3.207 -18.391 46.835 1.00 105.20 ? 401 NAG E O6 1 HETATM 10148 O O7 . NAG M 3 . ? 1.641 -25.455 44.798 1.00 62.47 ? 401 NAG E O7 1 HETATM 10149 C C1 . FUC N 4 . ? 4.496 -17.732 46.745 1.00 107.66 ? 402 FUC E C1 1 HETATM 10150 C C2 . FUC N 4 . ? 5.595 -18.591 47.359 1.00 104.59 ? 402 FUC E C2 1 HETATM 10151 C C3 . FUC N 4 . ? 6.038 -19.687 46.408 1.00 102.42 ? 402 FUC E C3 1 HETATM 10152 C C4 . FUC N 4 . ? 6.396 -19.087 45.068 1.00 103.76 ? 402 FUC E C4 1 HETATM 10153 C C5 . FUC N 4 . ? 5.202 -18.314 44.544 1.00 107.40 ? 402 FUC E C5 1 HETATM 10154 C C6 . FUC N 4 . ? 5.502 -17.734 43.172 1.00 105.27 ? 402 FUC E C6 1 HETATM 10155 O O2 . FUC N 4 . ? 5.069 -19.226 48.527 1.00 104.14 ? 402 FUC E O2 1 HETATM 10156 O O3 . FUC N 4 . ? 7.140 -20.426 46.940 1.00 95.30 ? 402 FUC E O3 1 HETATM 10157 O O4 . FUC N 4 . ? 7.486 -18.194 45.215 1.00 103.48 ? 402 FUC E O4 1 HETATM 10158 O O5 . FUC N 4 . ? 4.877 -17.266 45.456 1.00 109.83 ? 402 FUC E O5 1 HETATM 10159 C C1 . NAG O 3 . ? 1.703 -20.095 49.261 1.00 107.94 ? 403 NAG E C1 1 HETATM 10160 C C2 . NAG O 3 . ? 1.582 -18.831 50.112 1.00 110.60 ? 403 NAG E C2 1 HETATM 10161 C C3 . NAG O 3 . ? 2.310 -19.029 51.435 1.00 112.60 ? 403 NAG E C3 1 HETATM 10162 C C4 . NAG O 3 . ? 1.729 -20.201 52.224 1.00 114.12 ? 403 NAG E C4 1 HETATM 10163 C C5 . NAG O 3 . ? 1.288 -21.396 51.353 1.00 112.22 ? 403 NAG E C5 1 HETATM 10164 C C6 . NAG O 3 . ? -0.033 -21.957 51.893 1.00 112.53 ? 403 NAG E C6 1 HETATM 10165 C C7 . NAG O 3 . ? 1.752 -16.393 49.699 1.00 108.28 ? 403 NAG E C7 1 HETATM 10166 C C8 . NAG O 3 . ? 2.359 -15.300 48.864 1.00 104.53 ? 403 NAG E C8 1 HETATM 10167 N N2 . NAG O 3 . ? 2.090 -17.658 49.397 1.00 110.45 ? 403 NAG E N2 1 HETATM 10168 O O3 . NAG O 3 . ? 2.196 -17.857 52.215 1.00 110.29 ? 403 NAG E O3 1 HETATM 10169 O O4 . NAG O 3 . ? 2.691 -20.661 53.173 1.00 112.79 ? 403 NAG E O4 1 HETATM 10170 O O5 . NAG O 3 . ? 1.148 -21.206 49.940 1.00 106.73 ? 403 NAG E O5 1 HETATM 10171 O O6 . NAG O 3 . ? -0.866 -22.407 50.848 1.00 115.67 ? 403 NAG E O6 1 HETATM 10172 O O7 . NAG O 3 . ? 0.988 -16.086 50.617 1.00 104.14 ? 403 NAG E O7 1 HETATM 10173 C C1 . BMA P 5 . ? 2.150 -20.629 54.499 1.00 109.77 ? 404 BMA E C1 1 HETATM 10174 C C2 . BMA P 5 . ? 2.832 -21.810 55.190 1.00 108.35 ? 404 BMA E C2 1 HETATM 10175 C C3 . BMA P 5 . ? 3.159 -21.645 56.666 1.00 107.24 ? 404 BMA E C3 1 HETATM 10176 C C4 . BMA P 5 . ? 3.428 -20.204 57.057 1.00 105.11 ? 404 BMA E C4 1 HETATM 10177 C C5 . BMA P 5 . ? 2.315 -19.331 56.513 1.00 104.90 ? 404 BMA E C5 1 HETATM 10178 C C6 . BMA P 5 . ? 2.449 -17.897 57.012 1.00 102.15 ? 404 BMA E C6 1 HETATM 10179 O O2 . BMA P 5 . ? 4.054 -22.079 54.489 1.00 109.74 ? 404 BMA E O2 1 HETATM 10180 O O3 . BMA P 5 . ? 4.348 -22.403 56.885 1.00 105.81 ? 404 BMA E O3 1 HETATM 10181 O O4 . BMA P 5 . ? 3.474 -20.093 58.483 1.00 100.88 ? 404 BMA E O4 1 HETATM 10182 O O5 . BMA P 5 . ? 2.398 -19.352 55.094 1.00 108.05 ? 404 BMA E O5 1 HETATM 10183 O O6 . BMA P 5 . ? 1.393 -17.101 56.462 1.00 97.47 ? 404 BMA E O6 1 HETATM 10184 C C1 . MAN Q 6 . ? 4.024 -23.497 57.751 1.00 99.95 ? 405 MAN E C1 1 HETATM 10185 C C2 . MAN Q 6 . ? 4.572 -23.146 59.122 1.00 99.95 ? 405 MAN E C2 1 HETATM 10186 C C3 . MAN Q 6 . ? 6.061 -23.409 59.236 1.00 97.64 ? 405 MAN E C3 1 HETATM 10187 C C4 . MAN Q 6 . ? 6.443 -24.740 58.621 1.00 93.73 ? 405 MAN E C4 1 HETATM 10188 C C5 . MAN Q 6 . ? 5.918 -24.787 57.195 1.00 90.05 ? 405 MAN E C5 1 HETATM 10189 C C6 . MAN Q 6 . ? 6.228 -26.091 56.492 1.00 85.95 ? 405 MAN E C6 1 HETATM 10190 O O2 . MAN Q 6 . ? 3.883 -23.898 60.126 1.00 101.01 ? 405 MAN E O2 1 HETATM 10191 O O3 . MAN Q 6 . ? 6.404 -23.420 60.617 1.00 97.95 ? 405 MAN E O3 1 HETATM 10192 O O4 . MAN Q 6 . ? 7.863 -24.888 58.662 1.00 86.39 ? 405 MAN E O4 1 HETATM 10193 O O5 . MAN Q 6 . ? 4.522 -24.731 57.266 1.00 92.36 ? 405 MAN E O5 1 HETATM 10194 O O6 . MAN Q 6 . ? 5.271 -27.045 56.931 1.00 77.42 ? 405 MAN E O6 1 HETATM 10195 C C1 . NAG R 3 . ? 33.906 16.664 -8.715 1.00 41.66 ? 401 NAG H C1 1 HETATM 10196 C C2 . NAG R 3 . ? 32.738 17.353 -8.020 1.00 48.68 ? 401 NAG H C2 1 HETATM 10197 C C3 . NAG R 3 . ? 31.900 18.145 -9.016 1.00 52.96 ? 401 NAG H C3 1 HETATM 10198 C C4 . NAG R 3 . ? 32.780 19.034 -9.886 1.00 56.57 ? 401 NAG H C4 1 HETATM 10199 C C5 . NAG R 3 . ? 33.946 18.245 -10.470 1.00 56.18 ? 401 NAG H C5 1 HETATM 10200 C C6 . NAG R 3 . ? 34.868 19.150 -11.277 1.00 62.09 ? 401 NAG H C6 1 HETATM 10201 C C7 . NAG R 3 . ? 31.964 16.203 -6.028 1.00 50.26 ? 401 NAG H C7 1 HETATM 10202 C C8 . NAG R 3 . ? 31.339 14.943 -5.508 1.00 50.91 ? 401 NAG H C8 1 HETATM 10203 N N2 . NAG R 3 . ? 31.912 16.370 -7.347 1.00 49.03 ? 401 NAG H N2 1 HETATM 10204 O O3 . NAG R 3 . ? 30.956 18.956 -8.307 1.00 50.76 ? 401 NAG H O3 1 HETATM 10205 O O4 . NAG R 3 . ? 31.997 19.586 -10.950 1.00 60.75 ? 401 NAG H O4 1 HETATM 10206 O O5 . NAG R 3 . ? 34.684 17.635 -9.413 1.00 47.40 ? 401 NAG H O5 1 HETATM 10207 O O6 . NAG R 3 . ? 35.342 20.214 -10.444 1.00 74.19 ? 401 NAG H O6 1 HETATM 10208 O O7 . NAG R 3 . ? 32.487 17.022 -5.290 1.00 55.20 ? 401 NAG H O7 1 HETATM 10209 C C1 . FUC S 4 . ? 35.721 21.322 -11.280 1.00 82.90 ? 402 FUC H C1 1 HETATM 10210 C C2 . FUC S 4 . ? 36.289 22.442 -10.414 1.00 82.85 ? 402 FUC H C2 1 HETATM 10211 C C3 . FUC S 4 . ? 37.522 21.915 -9.734 1.00 85.52 ? 402 FUC H C3 1 HETATM 10212 C C4 . FUC S 4 . ? 38.529 21.610 -10.825 1.00 90.30 ? 402 FUC H C4 1 HETATM 10213 C C5 . FUC S 4 . ? 37.953 20.564 -11.776 1.00 91.82 ? 402 FUC H C5 1 HETATM 10214 C C6 . FUC S 4 . ? 38.879 20.325 -12.957 1.00 89.68 ? 402 FUC H C6 1 HETATM 10215 O O2 . FUC S 4 . ? 35.401 22.904 -9.408 1.00 79.23 ? 402 FUC H O2 1 HETATM 10216 O O3 . FUC S 4 . ? 37.997 22.925 -8.857 1.00 83.98 ? 402 FUC H O3 1 HETATM 10217 O O4 . FUC S 4 . ? 38.817 22.820 -11.535 1.00 91.76 ? 402 FUC H O4 1 HETATM 10218 O O5 . FUC S 4 . ? 36.672 20.946 -12.280 1.00 89.57 ? 402 FUC H O5 1 HETATM 10219 C C1 . NAG T 3 . ? 31.817 20.545 -11.293 1.00 63.83 ? 403 NAG H C1 1 HETATM 10220 C C2 . NAG T 3 . ? 31.092 20.938 -12.586 1.00 65.62 ? 403 NAG H C2 1 HETATM 10221 C C3 . NAG T 3 . ? 31.218 22.460 -12.841 1.00 68.26 ? 403 NAG H C3 1 HETATM 10222 C C4 . NAG T 3 . ? 30.434 23.013 -11.657 1.00 70.91 ? 403 NAG H C4 1 HETATM 10223 C C5 . NAG T 3 . ? 31.233 22.739 -10.384 1.00 67.84 ? 403 NAG H C5 1 HETATM 10224 C C6 . NAG T 3 . ? 30.537 23.291 -9.160 1.00 66.42 ? 403 NAG H C6 1 HETATM 10225 C C7 . NAG T 3 . ? 32.435 20.060 -14.409 1.00 61.20 ? 403 NAG H C7 1 HETATM 10226 C C8 . NAG T 3 . ? 32.927 18.769 -14.952 1.00 60.92 ? 403 NAG H C8 1 HETATM 10227 N N2 . NAG T 3 . ? 31.367 20.000 -13.664 1.00 60.68 ? 403 NAG H N2 1 HETATM 10228 O O3 . NAG T 3 . ? 30.611 22.861 -14.058 1.00 70.59 ? 403 NAG H O3 1 HETATM 10229 O O4 . NAG T 3 . ? 30.132 24.296 -11.729 1.00 80.93 ? 403 NAG H O4 1 HETATM 10230 O O5 . NAG T 3 . ? 31.312 21.331 -10.212 1.00 60.94 ? 403 NAG H O5 1 HETATM 10231 O O6 . NAG T 3 . ? 30.902 22.482 -8.051 1.00 64.98 ? 403 NAG H O6 1 HETATM 10232 O O7 . NAG T 3 . ? 32.980 21.104 -14.645 1.00 62.35 ? 403 NAG H O7 1 HETATM 10233 C C1 . BMA U 5 . ? 30.002 25.472 -12.444 1.00 89.77 ? 404 BMA H C1 1 HETATM 10234 C C2 . BMA U 5 . ? 29.005 25.487 -13.603 1.00 91.64 ? 404 BMA H C2 1 HETATM 10235 C C3 . BMA U 5 . ? 29.060 26.805 -14.349 1.00 94.21 ? 404 BMA H C3 1 HETATM 10236 C C4 . BMA U 5 . ? 28.562 27.849 -13.346 1.00 93.94 ? 404 BMA H C4 1 HETATM 10237 C C5 . BMA U 5 . ? 29.415 27.877 -12.094 1.00 96.25 ? 404 BMA H C5 1 HETATM 10238 C C6 . BMA U 5 . ? 28.699 28.713 -11.031 1.00 98.06 ? 404 BMA H C6 1 HETATM 10239 O O2 . BMA U 5 . ? 27.693 25.306 -13.072 1.00 84.27 ? 404 BMA H O2 1 HETATM 10240 O O3 . BMA U 5 . ? 28.261 26.799 -15.554 1.00 98.82 ? 404 BMA H O3 1 HETATM 10241 O O4 . BMA U 5 . ? 28.563 29.166 -13.881 1.00 91.23 ? 404 BMA H O4 1 HETATM 10242 O O5 . BMA U 5 . ? 29.665 26.566 -11.576 1.00 94.28 ? 404 BMA H O5 1 HETATM 10243 O O6 . BMA U 5 . ? 29.582 29.549 -10.257 1.00 100.36 ? 404 BMA H O6 1 HETATM 10244 C C1 . MAN V 6 . ? 28.370 25.613 -16.362 1.00 102.55 ? 405 MAN H C1 1 HETATM 10245 C C2 . MAN V 6 . ? 29.829 25.565 -16.829 1.00 105.74 ? 405 MAN H C2 1 HETATM 10246 C C3 . MAN V 6 . ? 30.131 26.788 -17.692 1.00 106.21 ? 405 MAN H C3 1 HETATM 10247 C C4 . MAN V 6 . ? 29.201 26.793 -18.909 1.00 104.80 ? 405 MAN H C4 1 HETATM 10248 C C5 . MAN V 6 . ? 27.731 26.622 -18.495 1.00 107.56 ? 405 MAN H C5 1 HETATM 10249 C C6 . MAN V 6 . ? 26.867 26.263 -19.705 1.00 107.34 ? 405 MAN H C6 1 HETATM 10250 O O2 . MAN V 6 . ? 29.970 24.392 -17.605 1.00 108.90 ? 405 MAN H O2 1 HETATM 10251 O O3 . MAN V 6 . ? 31.489 26.813 -18.095 1.00 103.59 ? 405 MAN H O3 1 HETATM 10252 O O4 . MAN V 6 . ? 29.355 28.000 -19.627 1.00 97.88 ? 405 MAN H O4 1 HETATM 10253 O O5 . MAN V 6 . ? 27.526 25.615 -17.507 1.00 105.01 ? 405 MAN H O5 1 HETATM 10254 O O6 . MAN V 6 . ? 26.681 27.388 -20.533 1.00 111.46 ? 405 MAN H O6 1 HETATM 10255 C C1 . NAG W 3 . ? 31.216 23.691 -17.419 1.00 107.15 ? 406 NAG H C1 1 HETATM 10256 C C2 . NAG W 3 . ? 31.378 22.725 -18.586 1.00 107.12 ? 406 NAG H C2 1 HETATM 10257 C C3 . NAG W 3 . ? 32.666 21.924 -18.450 1.00 106.73 ? 406 NAG H C3 1 HETATM 10258 C C4 . NAG W 3 . ? 33.874 22.818 -18.159 1.00 109.14 ? 406 NAG H C4 1 HETATM 10259 C C5 . NAG W 3 . ? 33.548 23.849 -17.075 1.00 109.23 ? 406 NAG H C5 1 HETATM 10260 C C6 . NAG W 3 . ? 34.669 24.872 -16.929 1.00 109.25 ? 406 NAG H C6 1 HETATM 10261 C C7 . NAG W 3 . ? 29.149 22.132 -19.440 1.00 108.47 ? 406 NAG H C7 1 HETATM 10262 C C8 . NAG W 3 . ? 28.053 21.107 -19.489 1.00 107.82 ? 406 NAG H C8 1 HETATM 10263 N N2 . NAG W 3 . ? 30.236 21.826 -18.719 1.00 108.09 ? 406 NAG H N2 1 HETATM 10264 O O3 . NAG W 3 . ? 32.858 21.219 -19.653 1.00 104.81 ? 406 NAG H O3 1 HETATM 10265 O O4 . NAG W 3 . ? 34.945 22.023 -17.682 1.00 107.53 ? 406 NAG H O4 1 HETATM 10266 O O5 . NAG W 3 . ? 32.348 24.536 -17.367 1.00 106.70 ? 406 NAG H O5 1 HETATM 10267 O O6 . NAG W 3 . ? 35.546 24.538 -15.877 1.00 113.16 ? 406 NAG H O6 1 HETATM 10268 O O7 . NAG W 3 . ? 29.004 23.196 -20.049 1.00 107.60 ? 406 NAG H O7 1 HETATM 10269 C C1 . GAL X 8 . ? 35.962 21.956 -18.660 1.00 103.71 ? 407 GAL H C1 1 HETATM 10270 C C2 . GAL X 8 . ? 36.878 20.988 -17.990 1.00 102.60 ? 407 GAL H C2 1 HETATM 10271 C C3 . GAL X 8 . ? 38.022 20.751 -18.922 1.00 100.67 ? 407 GAL H C3 1 HETATM 10272 C C4 . GAL X 8 . ? 37.449 19.977 -20.081 1.00 102.27 ? 407 GAL H C4 1 HETATM 10273 C C5 . GAL X 8 . ? 36.327 20.745 -20.777 1.00 100.93 ? 407 GAL H C5 1 HETATM 10274 C C6 . GAL X 8 . ? 35.463 19.815 -21.626 1.00 96.51 ? 407 GAL H C6 1 HETATM 10275 O O2 . GAL X 8 . ? 37.310 21.526 -16.743 1.00 103.55 ? 407 GAL H O2 1 HETATM 10276 O O3 . GAL X 8 . ? 38.866 19.934 -18.145 1.00 95.47 ? 407 GAL H O3 1 HETATM 10277 O O4 . GAL X 8 . ? 36.971 18.742 -19.545 1.00 100.45 ? 407 GAL H O4 1 HETATM 10278 O O5 . GAL X 8 . ? 35.443 21.398 -19.863 1.00 105.61 ? 407 GAL H O5 1 HETATM 10279 O O6 . GAL X 8 . ? 34.337 20.522 -22.161 1.00 89.10 ? 407 GAL H O6 1 HETATM 10280 C C1 . GLA Y 9 . ? 40.213 19.993 -18.593 1.00 93.69 ? 408 GLA H C1 1 HETATM 10281 C C2 . GLA Y 9 . ? 40.666 18.621 -18.190 1.00 92.95 ? 408 GLA H C2 1 HETATM 10282 C C3 . GLA Y 9 . ? 40.603 18.464 -16.686 1.00 92.80 ? 408 GLA H C3 1 HETATM 10283 C C4 . GLA Y 9 . ? 41.319 19.600 -15.988 1.00 93.02 ? 408 GLA H C4 1 HETATM 10284 C C5 . GLA Y 9 . ? 40.843 20.938 -16.531 1.00 93.44 ? 408 GLA H C5 1 HETATM 10285 C C6 . GLA Y 9 . ? 41.586 22.090 -15.868 1.00 94.34 ? 408 GLA H C6 1 HETATM 10286 O O2 . GLA Y 9 . ? 39.673 17.752 -18.733 1.00 89.07 ? 408 GLA H O2 1 HETATM 10287 O O3 . GLA Y 9 . ? 41.207 17.230 -16.322 1.00 88.58 ? 408 GLA H O3 1 HETATM 10288 O O4 . GLA Y 9 . ? 42.735 19.467 -16.133 1.00 86.03 ? 408 GLA H O4 1 HETATM 10289 O O5 . GLA Y 9 . ? 41.009 20.973 -17.943 1.00 91.54 ? 408 GLA H O5 1 HETATM 10290 O O6 . GLA Y 9 . ? 41.737 21.796 -14.473 1.00 93.37 ? 408 GLA H O6 1 HETATM 10291 C C1 . MAN Z 6 . ? 28.678 30.402 -9.680 1.00 99.14 ? 409 MAN H C1 1 HETATM 10292 C C2 . MAN Z 6 . ? 28.711 31.632 -10.579 1.00 99.05 ? 409 MAN H C2 1 HETATM 10293 C C3 . MAN Z 6 . ? 30.010 32.408 -10.395 1.00 99.58 ? 409 MAN H C3 1 HETATM 10294 C C4 . MAN Z 6 . ? 30.296 32.650 -8.918 1.00 98.46 ? 409 MAN H C4 1 HETATM 10295 C C5 . MAN Z 6 . ? 30.167 31.360 -8.117 1.00 95.83 ? 409 MAN H C5 1 HETATM 10296 C C6 . MAN Z 6 . ? 30.377 31.617 -6.630 1.00 92.91 ? 409 MAN H C6 1 HETATM 10297 O O2 . MAN Z 6 . ? 27.601 32.481 -10.268 1.00 100.16 ? 409 MAN H O2 1 HETATM 10298 O O3 . MAN Z 6 . ? 29.917 33.664 -11.076 1.00 99.98 ? 409 MAN H O3 1 HETATM 10299 O O4 . MAN Z 6 . ? 31.620 33.175 -8.768 1.00 97.44 ? 409 MAN H O4 1 HETATM 10300 O O5 . MAN Z 6 . ? 28.873 30.799 -8.324 1.00 95.43 ? 409 MAN H O5 1 HETATM 10301 O O6 . MAN Z 6 . ? 31.044 30.495 -6.041 1.00 94.65 ? 409 MAN H O6 1 HETATM 10302 C C1 . PEG AA 7 . ? 5.799 4.848 -12.004 1.00 55.78 ? 410 PEG H C1 1 HETATM 10303 O O1 . PEG AA 7 . ? 4.745 5.450 -12.767 1.00 54.83 ? 410 PEG H O1 1 HETATM 10304 C C2 . PEG AA 7 . ? 7.153 5.164 -12.626 1.00 56.93 ? 410 PEG H C2 1 HETATM 10305 O O2 . PEG AA 7 . ? 7.019 5.610 -13.977 1.00 57.84 ? 410 PEG H O2 1 HETATM 10306 C C3 . PEG AA 7 . ? 7.132 7.028 -14.104 1.00 59.00 ? 410 PEG H C3 1 HETATM 10307 C C4 . PEG AA 7 . ? 6.925 7.415 -15.564 1.00 59.21 ? 410 PEG H C4 1 HETATM 10308 O O4 . PEG AA 7 . ? 8.089 8.113 -16.017 1.00 61.70 ? 410 PEG H O4 1 HETATM 10309 K K . K BA 10 . ? 0.501 15.911 2.097 1.00 39.13 ? 301 K L K 1 HETATM 10310 O O . HOH CA 11 . ? 52.569 -12.535 39.944 0.58 4.16 ? 501 HOH B O 1 HETATM 10311 O O . HOH CA 11 . ? 42.005 -14.058 28.732 0.95 27.49 ? 502 HOH B O 1 HETATM 10312 O O . HOH CA 11 . ? 42.359 -28.124 28.668 1.00 30.54 ? 503 HOH B O 1 HETATM 10313 O O . HOH CA 11 . ? 54.685 -6.944 27.082 0.99 29.49 ? 504 HOH B O 1 HETATM 10314 O O . HOH CA 11 . ? 58.138 -10.435 33.920 1.00 24.08 ? 505 HOH B O 1 HETATM 10315 O O . HOH CA 11 . ? 54.770 -19.495 27.223 0.58 9.07 ? 506 HOH B O 1 HETATM 10316 O O . HOH CA 11 . ? 55.569 -15.384 34.013 0.95 18.94 ? 507 HOH B O 1 HETATM 10317 O O . HOH CA 11 . ? 58.230 -16.556 34.181 0.99 24.49 ? 508 HOH B O 1 HETATM 10318 O O . HOH CA 11 . ? 21.165 -25.692 72.627 1.00 46.16 ? 509 HOH B O 1 HETATM 10319 O O . HOH CA 11 . ? 19.243 -17.742 56.967 1.00 37.84 ? 510 HOH B O 1 HETATM 10320 O O . HOH CA 11 . ? 40.267 -25.062 25.871 0.99 37.35 ? 511 HOH B O 1 HETATM 10321 O O . HOH CA 11 . ? 11.557 -21.727 56.507 1.00 42.68 ? 512 HOH B O 1 HETATM 10322 O O . HOH CA 11 . ? 54.944 -8.960 23.162 0.73 21.90 ? 513 HOH B O 1 HETATM 10323 O O . HOH CA 11 . ? 28.895 -27.537 50.510 1.00 29.03 ? 514 HOH B O 1 HETATM 10324 O O . HOH CA 11 . ? 15.556 -31.797 38.166 0.94 33.36 ? 515 HOH B O 1 HETATM 10325 O O . HOH CA 11 . ? 65.640 -19.917 37.749 0.81 22.44 ? 516 HOH B O 1 HETATM 10326 O O . HOH CA 11 . ? 36.843 -32.181 48.925 0.54 5.36 ? 517 HOH B O 1 HETATM 10327 O O . HOH CA 11 . ? 60.864 -30.057 30.191 1.00 31.39 ? 518 HOH B O 1 HETATM 10328 O O . HOH CA 11 . ? 62.602 -19.994 26.672 0.91 26.34 ? 519 HOH B O 1 HETATM 10329 O O . HOH CA 11 . ? 24.956 -20.019 66.304 0.55 10.48 ? 520 HOH B O 1 HETATM 10330 O O . HOH CA 11 . ? 32.007 -26.400 52.388 0.93 30.00 ? 521 HOH B O 1 HETATM 10331 O O . HOH CA 11 . ? 44.507 -29.139 28.663 0.97 25.96 ? 522 HOH B O 1 HETATM 10332 O O . HOH CA 11 . ? 60.138 -16.881 29.423 0.88 16.36 ? 523 HOH B O 1 HETATM 10333 O O . HOH CA 11 . ? 56.295 -37.614 38.723 1.00 41.53 ? 524 HOH B O 1 HETATM 10334 O O . HOH CA 11 . ? 36.419 -23.865 40.222 1.00 33.96 ? 525 HOH B O 1 HETATM 10335 O O . HOH CA 11 . ? 59.105 -15.395 31.367 1.00 19.90 ? 526 HOH B O 1 HETATM 10336 O O . HOH CA 11 . ? 56.429 -25.782 45.040 0.83 20.50 ? 527 HOH B O 1 HETATM 10337 O O . HOH CA 11 . ? 62.517 -17.784 28.844 0.86 23.43 ? 528 HOH B O 1 HETATM 10338 O O . HOH CA 11 . ? 53.710 -26.531 23.345 0.97 28.96 ? 529 HOH B O 1 HETATM 10339 O O . HOH CA 11 . ? 51.754 -28.646 55.665 1.00 47.66 ? 530 HOH B O 1 HETATM 10340 O O . HOH CA 11 . ? 61.053 -37.298 40.344 1.00 44.80 ? 531 HOH B O 1 HETATM 10341 O O . HOH CA 11 . ? 28.397 -18.412 58.646 1.00 32.96 ? 532 HOH B O 1 HETATM 10342 O O . HOH CA 11 . ? 45.672 -15.073 20.715 1.00 32.36 ? 533 HOH B O 1 HETATM 10343 O O . HOH CA 11 . ? 65.676 -23.548 31.321 1.00 49.55 ? 534 HOH B O 1 HETATM 10344 O O . HOH CA 11 . ? 43.253 -13.779 39.431 1.00 41.81 ? 535 HOH B O 1 HETATM 10345 O O . HOH CA 11 . ? 47.479 -7.062 36.985 1.00 27.03 ? 536 HOH B O 1 HETATM 10346 O O . HOH CA 11 . ? 40.144 -21.170 29.308 1.00 22.76 ? 537 HOH B O 1 HETATM 10347 O O . HOH CA 11 . ? 18.462 -22.909 51.668 1.00 35.94 ? 538 HOH B O 1 HETATM 10348 O O . HOH DA 11 . ? 12.494 -24.449 22.714 0.54 7.72 ? 501 HOH E O 1 HETATM 10349 O O . HOH DA 11 . ? 13.408 -15.537 27.819 1.00 39.08 ? 502 HOH E O 1 HETATM 10350 O O . HOH DA 11 . ? 13.722 -30.464 12.308 1.00 36.10 ? 503 HOH E O 1 HETATM 10351 O O . HOH DA 11 . ? 32.603 -27.103 18.036 1.00 34.63 ? 504 HOH E O 1 HETATM 10352 O O . HOH DA 11 . ? 8.142 -32.443 11.087 1.00 37.08 ? 505 HOH E O 1 HETATM 10353 O O . HOH DA 11 . ? 10.928 -23.665 24.517 0.89 20.42 ? 506 HOH E O 1 HETATM 10354 O O . HOH DA 11 . ? 3.725 -6.039 12.318 1.00 37.24 ? 507 HOH E O 1 HETATM 10355 O O . HOH DA 11 . ? 3.781 -15.536 41.775 0.97 47.19 ? 508 HOH E O 1 HETATM 10356 O O . HOH DA 11 . ? -1.521 -26.076 37.428 1.00 39.66 ? 509 HOH E O 1 HETATM 10357 O O . HOH DA 11 . ? 17.341 -10.212 17.559 0.89 32.67 ? 510 HOH E O 1 HETATM 10358 O O . HOH DA 11 . ? -0.714 -18.377 29.329 0.89 40.12 ? 511 HOH E O 1 HETATM 10359 O O . HOH DA 11 . ? 13.019 -16.245 4.095 0.94 29.08 ? 512 HOH E O 1 HETATM 10360 O O . HOH DA 11 . ? 2.072 -12.188 20.199 1.00 34.88 ? 513 HOH E O 1 HETATM 10361 O O . HOH DA 11 . ? 3.745 -14.975 32.100 1.00 37.87 ? 514 HOH E O 1 HETATM 10362 O O . HOH DA 11 . ? 4.244 -19.649 20.306 1.00 34.84 ? 515 HOH E O 1 HETATM 10363 O O . HOH DA 11 . ? 20.559 -12.143 9.559 1.00 36.69 ? 516 HOH E O 1 HETATM 10364 O O . HOH EA 11 . ? 23.267 14.469 -1.352 1.00 24.72 ? 501 HOH H O 1 HETATM 10365 O O . HOH EA 11 . ? 33.303 0.917 -18.044 0.77 18.21 ? 502 HOH H O 1 HETATM 10366 O O . HOH EA 11 . ? 45.472 2.710 -10.818 0.95 24.79 ? 503 HOH H O 1 HETATM 10367 O O . HOH EA 11 . ? 40.044 2.479 -16.136 0.93 19.06 ? 504 HOH H O 1 HETATM 10368 O O . HOH EA 11 . ? 34.945 7.791 -19.716 0.69 19.64 ? 505 HOH H O 1 HETATM 10369 O O . HOH EA 11 . ? 28.440 -3.775 -16.048 0.78 21.86 ? 506 HOH H O 1 HETATM 10370 O O . HOH EA 11 . ? 9.036 1.300 -9.028 1.00 22.28 ? 507 HOH H O 1 HETATM 10371 O O . HOH EA 11 . ? 10.765 3.313 -7.594 0.95 15.69 ? 508 HOH H O 1 HETATM 10372 O O . HOH EA 11 . ? 33.658 14.201 -10.865 0.80 17.99 ? 509 HOH H O 1 HETATM 10373 O O . HOH EA 11 . ? 13.679 8.080 -20.493 0.89 29.75 ? 510 HOH H O 1 HETATM 10374 O O . HOH EA 11 . ? 7.186 3.057 -16.080 1.00 41.77 ? 511 HOH H O 1 HETATM 10375 O O . HOH EA 11 . ? 23.007 17.541 -8.453 1.00 34.08 ? 512 HOH H O 1 HETATM 10376 O O . HOH EA 11 . ? 23.550 1.412 -19.393 0.98 23.43 ? 513 HOH H O 1 HETATM 10377 O O . HOH EA 11 . ? 7.752 -1.322 -2.537 1.00 34.77 ? 514 HOH H O 1 HETATM 10378 O O . HOH EA 11 . ? 55.389 9.469 23.552 0.97 24.44 ? 515 HOH H O 1 HETATM 10379 O O . HOH EA 11 . ? 53.581 9.813 25.620 1.00 28.71 ? 516 HOH H O 1 HETATM 10380 O O . HOH EA 11 . ? 44.199 1.517 4.269 0.98 23.83 ? 517 HOH H O 1 HETATM 10381 O O . HOH EA 11 . ? 46.027 -4.215 0.502 0.59 6.81 ? 518 HOH H O 1 HETATM 10382 O O . HOH EA 11 . ? 46.711 -5.097 18.580 0.71 11.49 ? 519 HOH H O 1 HETATM 10383 O O . HOH EA 11 . ? 59.019 5.549 29.093 0.79 29.98 ? 520 HOH H O 1 HETATM 10384 O O . HOH EA 11 . ? 51.011 -9.250 -3.677 0.96 28.92 ? 521 HOH H O 1 HETATM 10385 O O . HOH EA 11 . ? 33.997 -0.012 -15.822 0.74 17.24 ? 522 HOH H O 1 HETATM 10386 O O . HOH EA 11 . ? 38.313 15.123 -8.991 1.00 33.36 ? 523 HOH H O 1 HETATM 10387 O O . HOH EA 11 . ? 8.118 1.670 -11.885 1.00 29.85 ? 524 HOH H O 1 HETATM 10388 O O . HOH EA 11 . ? 24.584 17.209 -16.375 0.93 31.65 ? 525 HOH H O 1 HETATM 10389 O O . HOH EA 11 . ? 57.112 -6.508 21.132 0.91 14.86 ? 526 HOH H O 1 HETATM 10390 O O . HOH EA 11 . ? 41.556 4.155 5.831 1.00 38.67 ? 527 HOH H O 1 HETATM 10391 O O . HOH EA 11 . ? 15.723 9.680 -19.587 0.95 28.11 ? 528 HOH H O 1 HETATM 10392 O O . HOH EA 11 . ? 56.007 4.548 -1.038 0.97 26.26 ? 529 HOH H O 1 HETATM 10393 O O . HOH EA 11 . ? 33.250 -2.807 -3.302 0.82 17.24 ? 530 HOH H O 1 HETATM 10394 O O . HOH EA 11 . ? 47.669 13.290 -3.167 1.00 33.71 ? 531 HOH H O 1 HETATM 10395 O O . HOH EA 11 . ? 21.082 13.686 -3.879 0.98 24.55 ? 532 HOH H O 1 HETATM 10396 O O . HOH EA 11 . ? 45.869 7.521 -5.653 0.88 24.07 ? 533 HOH H O 1 HETATM 10397 O O . HOH EA 11 . ? 22.109 -11.596 -0.129 0.99 33.95 ? 534 HOH H O 1 HETATM 10398 O O . HOH EA 11 . ? 27.012 -1.531 -16.811 0.96 25.40 ? 535 HOH H O 1 HETATM 10399 O O . HOH EA 11 . ? 40.617 7.077 2.061 1.00 39.73 ? 536 HOH H O 1 HETATM 10400 O O . HOH EA 11 . ? 13.178 -1.502 -13.758 0.99 26.81 ? 537 HOH H O 1 HETATM 10401 O O . HOH EA 11 . ? 15.058 -1.086 1.608 0.98 31.82 ? 538 HOH H O 1 HETATM 10402 O O . HOH EA 11 . ? 42.414 2.344 -2.212 0.78 17.77 ? 539 HOH H O 1 HETATM 10403 O O . HOH EA 11 . ? 31.909 12.644 -19.828 0.77 18.11 ? 540 HOH H O 1 HETATM 10404 O O . HOH EA 11 . ? 42.850 2.970 9.525 0.92 33.86 ? 541 HOH H O 1 HETATM 10405 O O . HOH EA 11 . ? 46.411 9.141 -8.922 0.96 33.52 ? 542 HOH H O 1 HETATM 10406 O O . HOH EA 11 . ? 14.591 -11.330 -11.293 0.95 47.46 ? 543 HOH H O 1 HETATM 10407 O O . HOH EA 11 . ? 15.191 -5.955 -21.149 1.00 36.33 ? 544 HOH H O 1 HETATM 10408 O O . HOH EA 11 . ? 60.332 -9.251 22.327 0.92 29.39 ? 545 HOH H O 1 HETATM 10409 O O . HOH EA 11 . ? 14.939 1.139 0.153 0.69 6.68 ? 546 HOH H O 1 HETATM 10410 O O . HOH EA 11 . ? 12.679 10.777 -18.011 1.00 20.90 ? 547 HOH H O 1 HETATM 10411 O O . HOH EA 11 . ? 26.144 9.305 -21.437 1.00 36.18 ? 548 HOH H O 1 HETATM 10412 O O . HOH EA 11 . ? 59.709 6.327 32.634 1.00 45.80 ? 549 HOH H O 1 HETATM 10413 O O . HOH EA 11 . ? 28.302 -0.816 2.042 0.81 20.62 ? 550 HOH H O 1 HETATM 10414 O O . HOH EA 11 . ? 50.545 7.052 -7.129 0.98 38.09 ? 551 HOH H O 1 HETATM 10415 O O . HOH EA 11 . ? 54.750 -8.679 17.911 1.00 32.94 ? 552 HOH H O 1 HETATM 10416 O O . HOH EA 11 . ? 43.560 7.047 -4.603 1.00 27.63 ? 553 HOH H O 1 HETATM 10417 O O . HOH EA 11 . ? 28.152 10.648 -2.093 1.00 36.92 ? 554 HOH H O 1 HETATM 10418 O O . HOH EA 11 . ? 62.340 -2.291 24.000 1.00 34.77 ? 555 HOH H O 1 HETATM 10419 O O . HOH EA 11 . ? 59.993 -1.697 22.221 1.00 28.34 ? 556 HOH H O 1 HETATM 10420 O O . HOH EA 11 . ? 24.095 20.060 -12.892 1.00 39.00 ? 557 HOH H O 1 HETATM 10421 O O . HOH EA 11 . ? 26.569 15.152 -16.869 1.00 29.21 ? 558 HOH H O 1 HETATM 10422 O O . HOH EA 11 . ? 3.339 2.849 -12.100 1.00 56.30 ? 559 HOH H O 1 HETATM 10423 O O . HOH EA 11 . ? 59.147 -7.906 26.248 1.00 26.71 ? 560 HOH H O 1 HETATM 10424 O O . HOH EA 11 . ? 49.336 8.588 -9.343 1.00 34.59 ? 561 HOH H O 1 HETATM 10425 O O . HOH EA 11 . ? 8.935 3.809 -17.955 1.00 31.62 ? 562 HOH H O 1 HETATM 10426 O O . HOH FA 11 . ? 63.621 -25.661 44.953 0.92 18.68 ? 301 HOH C O 1 HETATM 10427 O O . HOH FA 11 . ? 66.819 -15.487 41.121 0.47 5.56 ? 302 HOH C O 1 HETATM 10428 O O . HOH FA 11 . ? 43.558 -11.833 46.881 0.74 17.06 ? 303 HOH C O 1 HETATM 10429 O O . HOH FA 11 . ? 48.322 -9.452 40.890 0.59 11.66 ? 304 HOH C O 1 HETATM 10430 O O . HOH FA 11 . ? 61.541 -9.073 50.340 0.98 24.38 ? 305 HOH C O 1 HETATM 10431 O O . HOH FA 11 . ? 48.252 -3.983 42.934 0.90 31.20 ? 306 HOH C O 1 HETATM 10432 O O . HOH FA 11 . ? 60.966 -4.952 54.186 0.79 39.99 ? 307 HOH C O 1 HETATM 10433 O O . HOH FA 11 . ? 71.376 -7.692 49.385 0.99 35.26 ? 308 HOH C O 1 HETATM 10434 O O . HOH FA 11 . ? 53.986 -20.389 57.371 0.93 23.84 ? 309 HOH C O 1 HETATM 10435 O O . HOH FA 11 . ? 31.958 -39.348 79.082 1.00 29.07 ? 310 HOH C O 1 HETATM 10436 O O . HOH FA 11 . ? 31.765 -31.483 62.450 0.77 19.45 ? 311 HOH C O 1 HETATM 10437 O O . HOH FA 11 . ? 69.353 -24.292 42.062 0.71 16.00 ? 312 HOH C O 1 HETATM 10438 O O . HOH FA 11 . ? 43.584 -13.854 64.915 1.00 37.23 ? 313 HOH C O 1 HETATM 10439 O O . HOH FA 11 . ? 52.365 -13.936 66.222 1.00 42.46 ? 314 HOH C O 1 HETATM 10440 O O . HOH FA 11 . ? 66.692 -17.219 33.909 1.00 22.41 ? 315 HOH C O 1 HETATM 10441 O O . HOH FA 11 . ? 52.342 -22.450 50.884 1.00 37.78 ? 316 HOH C O 1 HETATM 10442 O O . HOH FA 11 . ? 46.989 0.464 66.265 0.84 35.63 ? 317 HOH C O 1 HETATM 10443 O O . HOH FA 11 . ? 53.507 -0.962 65.707 0.83 32.37 ? 318 HOH C O 1 HETATM 10444 O O . HOH FA 11 . ? 37.526 -27.119 58.528 1.00 35.05 ? 319 HOH C O 1 HETATM 10445 O O . HOH FA 11 . ? 42.866 -12.517 57.878 1.00 29.96 ? 320 HOH C O 1 HETATM 10446 O O . HOH FA 11 . ? 40.532 -24.613 78.731 0.93 38.11 ? 321 HOH C O 1 HETATM 10447 O O . HOH FA 11 . ? 41.204 -6.266 71.817 0.96 54.11 ? 322 HOH C O 1 HETATM 10448 O O . HOH FA 11 . ? 73.232 -6.780 51.443 0.86 30.48 ? 323 HOH C O 1 HETATM 10449 O O . HOH FA 11 . ? 55.366 -8.250 63.371 1.00 33.25 ? 324 HOH C O 1 HETATM 10450 O O . HOH FA 11 . ? 72.265 -11.274 46.674 0.64 8.42 ? 325 HOH C O 1 HETATM 10451 O O . HOH FA 11 . ? 36.685 -15.809 54.696 0.96 34.76 ? 326 HOH C O 1 HETATM 10452 O O . HOH FA 11 . ? 58.654 0.343 44.180 0.78 22.02 ? 327 HOH C O 1 HETATM 10453 O O . HOH FA 11 . ? 35.893 -13.023 54.207 1.00 44.50 ? 328 HOH C O 1 HETATM 10454 O O . HOH FA 11 . ? 33.747 -19.449 57.695 0.95 41.44 ? 329 HOH C O 1 HETATM 10455 O O . HOH FA 11 . ? 22.947 -31.982 77.622 1.00 32.24 ? 330 HOH C O 1 HETATM 10456 O O . HOH FA 11 . ? 41.869 -2.900 65.445 0.94 33.22 ? 331 HOH C O 1 HETATM 10457 O O . HOH FA 11 . ? 58.845 -12.245 61.754 0.95 38.44 ? 332 HOH C O 1 HETATM 10458 O O . HOH FA 11 . ? 35.491 -17.832 45.201 0.94 36.45 ? 333 HOH C O 1 HETATM 10459 O O . HOH FA 11 . ? 21.395 -35.843 80.099 1.00 50.09 ? 334 HOH C O 1 HETATM 10460 O O . HOH GA 11 . ? 31.027 -32.913 28.932 1.00 18.76 ? 301 HOH F O 1 HETATM 10461 O O . HOH GA 11 . ? -11.856 -53.018 18.235 0.98 24.35 ? 302 HOH F O 1 HETATM 10462 O O . HOH GA 11 . ? -21.880 -50.761 43.438 0.98 32.94 ? 303 HOH F O 1 HETATM 10463 O O . HOH GA 11 . ? -18.400 -44.785 34.150 0.72 8.85 ? 304 HOH F O 1 HETATM 10464 O O . HOH GA 11 . ? -10.380 -42.968 12.015 0.83 21.20 ? 305 HOH F O 1 HETATM 10465 O O . HOH GA 11 . ? -6.353 -31.653 28.696 0.58 16.83 ? 306 HOH F O 1 HETATM 10466 O O . HOH GA 11 . ? -23.617 -37.146 35.431 1.00 33.23 ? 307 HOH F O 1 HETATM 10467 O O . HOH GA 11 . ? 18.508 -33.591 15.863 0.72 19.45 ? 308 HOH F O 1 HETATM 10468 O O . HOH GA 11 . ? 22.433 -21.852 20.981 0.94 30.91 ? 309 HOH F O 1 HETATM 10469 O O . HOH GA 11 . ? 20.538 -39.822 29.128 1.00 29.98 ? 310 HOH F O 1 HETATM 10470 O O . HOH GA 11 . ? 17.843 -22.901 29.397 0.88 20.61 ? 311 HOH F O 1 HETATM 10471 O O . HOH GA 11 . ? 19.090 -44.875 24.791 0.62 14.99 ? 312 HOH F O 1 HETATM 10472 O O . HOH GA 11 . ? 39.350 -29.434 29.711 0.93 23.27 ? 313 HOH F O 1 HETATM 10473 O O . HOH GA 11 . ? 6.625 -28.232 26.781 0.85 30.77 ? 314 HOH F O 1 HETATM 10474 O O . HOH GA 11 . ? -24.816 -45.029 43.488 0.89 20.46 ? 315 HOH F O 1 HETATM 10475 O O . HOH GA 11 . ? 11.704 -44.511 26.151 0.67 20.76 ? 316 HOH F O 1 HETATM 10476 O O . HOH GA 11 . ? -17.017 -34.574 50.573 0.84 38.68 ? 317 HOH F O 1 HETATM 10477 O O . HOH GA 11 . ? 8.146 -34.992 16.075 1.00 38.23 ? 318 HOH F O 1 HETATM 10478 O O . HOH GA 11 . ? -12.029 -39.198 50.637 0.98 34.53 ? 319 HOH F O 1 HETATM 10479 O O . HOH GA 11 . ? -6.827 -34.523 39.636 0.96 34.37 ? 320 HOH F O 1 HETATM 10480 O O . HOH GA 11 . ? 21.284 -33.115 33.559 0.83 33.34 ? 321 HOH F O 1 HETATM 10481 O O . HOH GA 11 . ? -26.428 -44.104 26.707 0.72 17.03 ? 322 HOH F O 1 HETATM 10482 O O . HOH GA 11 . ? -19.690 -50.411 22.638 0.87 41.44 ? 323 HOH F O 1 HETATM 10483 O O . HOH GA 11 . ? -24.375 -47.713 43.395 0.93 15.27 ? 324 HOH F O 1 HETATM 10484 O O . HOH GA 11 . ? 14.776 -39.921 14.827 0.61 7.70 ? 325 HOH F O 1 HETATM 10485 O O . HOH GA 11 . ? -17.714 -49.227 24.215 0.67 22.85 ? 326 HOH F O 1 HETATM 10486 O O . HOH GA 11 . ? 3.866 -34.526 23.911 1.00 41.91 ? 327 HOH F O 1 HETATM 10487 O O . HOH GA 11 . ? -3.775 -37.671 21.643 0.98 29.09 ? 328 HOH F O 1 HETATM 10488 O O . HOH GA 11 . ? -16.409 -46.044 50.406 1.00 42.15 ? 329 HOH F O 1 HETATM 10489 O O . HOH GA 11 . ? -11.467 -47.194 13.388 0.89 21.48 ? 330 HOH F O 1 HETATM 10490 O O . HOH GA 11 . ? -16.861 -52.855 32.549 0.82 34.92 ? 331 HOH F O 1 HETATM 10491 O O . HOH GA 11 . ? 17.007 -47.027 28.010 0.99 41.87 ? 332 HOH F O 1 HETATM 10492 O O . HOH GA 11 . ? -12.261 -31.551 23.302 0.87 32.73 ? 333 HOH F O 1 HETATM 10493 O O . HOH GA 11 . ? 37.750 -17.507 27.112 0.75 35.79 ? 334 HOH F O 1 HETATM 10494 O O . HOH GA 11 . ? -17.239 -49.704 30.482 0.97 35.49 ? 335 HOH F O 1 HETATM 10495 O O . HOH GA 11 . ? 16.639 -51.344 20.037 1.00 34.01 ? 336 HOH F O 1 HETATM 10496 O O . HOH GA 11 . ? 0.640 -44.985 31.549 0.81 24.58 ? 337 HOH F O 1 HETATM 10497 O O . HOH GA 11 . ? 21.338 -38.497 16.324 1.00 32.88 ? 338 HOH F O 1 HETATM 10498 O O . HOH GA 11 . ? 33.194 -33.091 23.277 1.00 51.94 ? 339 HOH F O 1 HETATM 10499 O O . HOH GA 11 . ? -25.064 -33.153 51.357 0.98 45.18 ? 340 HOH F O 1 HETATM 10500 O O . HOH GA 11 . ? 23.630 -27.989 38.484 1.00 38.61 ? 341 HOH F O 1 HETATM 10501 O O . HOH GA 11 . ? -17.107 -52.633 17.647 1.00 18.38 ? 342 HOH F O 1 HETATM 10502 O O . HOH GA 11 . ? 36.603 -20.904 15.480 1.00 43.54 ? 343 HOH F O 1 HETATM 10503 O O . HOH GA 11 . ? 14.636 -26.313 25.467 1.00 28.41 ? 344 HOH F O 1 HETATM 10504 O O . HOH GA 11 . ? 1.966 -42.319 21.784 1.00 29.07 ? 345 HOH F O 1 HETATM 10505 O O . HOH GA 11 . ? 22.753 -18.943 20.779 1.00 28.99 ? 346 HOH F O 1 HETATM 10506 O O . HOH GA 11 . ? 29.035 -35.161 18.929 1.00 28.28 ? 347 HOH F O 1 HETATM 10507 O O . HOH HA 11 . ? 14.198 17.711 -7.083 0.73 8.20 ? 401 HOH L O 1 HETATM 10508 O O . HOH HA 11 . ? 15.888 20.641 9.193 0.51 5.01 ? 402 HOH L O 1 HETATM 10509 O O . HOH HA 11 . ? 20.861 18.422 4.804 0.53 7.26 ? 403 HOH L O 1 HETATM 10510 O O . HOH HA 11 . ? 22.590 17.348 7.150 1.00 27.31 ? 404 HOH L O 1 HETATM 10511 O O . HOH HA 11 . ? 5.228 10.989 -3.282 0.65 4.66 ? 405 HOH L O 1 HETATM 10512 O O . HOH HA 11 . ? 8.416 5.573 0.777 1.00 20.05 ? 406 HOH L O 1 HETATM 10513 O O . HOH HA 11 . ? 4.037 5.566 -7.431 0.94 25.96 ? 407 HOH L O 1 HETATM 10514 O O . HOH HA 11 . ? 8.688 11.579 8.249 0.49 9.29 ? 408 HOH L O 1 HETATM 10515 O O . HOH HA 11 . ? 6.182 5.964 12.540 0.74 12.16 ? 409 HOH L O 1 HETATM 10516 O O . HOH HA 11 . ? 8.030 17.838 -9.740 0.87 19.30 ? 410 HOH L O 1 HETATM 10517 O O . HOH HA 11 . ? 8.794 15.168 -10.536 0.96 24.42 ? 411 HOH L O 1 HETATM 10518 O O . HOH HA 11 . ? 7.985 11.062 -8.500 0.56 2.31 ? 412 HOH L O 1 HETATM 10519 O O . HOH HA 11 . ? 23.490 13.010 1.878 0.68 6.28 ? 413 HOH L O 1 HETATM 10520 O O . HOH HA 11 . ? 31.621 8.140 15.483 1.00 33.28 ? 414 HOH L O 1 HETATM 10521 O O . HOH HA 11 . ? 43.167 12.301 26.838 1.00 19.01 ? 415 HOH L O 1 HETATM 10522 O O . HOH HA 11 . ? 59.449 8.588 10.526 1.00 25.68 ? 416 HOH L O 1 HETATM 10523 O O . HOH HA 11 . ? 40.452 19.073 12.828 0.98 32.61 ? 417 HOH L O 1 HETATM 10524 O O . HOH HA 11 . ? 39.100 21.755 11.688 1.00 50.10 ? 418 HOH L O 1 HETATM 10525 O O . HOH HA 11 . ? 55.219 14.470 23.521 0.81 15.85 ? 419 HOH L O 1 HETATM 10526 O O . HOH HA 11 . ? 52.770 27.005 4.957 1.00 42.29 ? 420 HOH L O 1 HETATM 10527 O O . HOH HA 11 . ? 65.148 25.195 18.485 1.00 56.30 ? 421 HOH L O 1 HETATM 10528 O O . HOH HA 11 . ? 26.178 14.967 3.433 0.88 33.08 ? 422 HOH L O 1 HETATM 10529 O O . HOH HA 11 . ? 19.929 16.574 -9.653 0.84 27.32 ? 423 HOH L O 1 HETATM 10530 O O . HOH HA 11 . ? 58.302 25.937 16.892 1.00 28.08 ? 424 HOH L O 1 HETATM 10531 O O . HOH HA 11 . ? 1.334 9.996 9.047 0.71 29.01 ? 425 HOH L O 1 HETATM 10532 O O . HOH HA 11 . ? 1.566 16.981 -8.352 0.90 16.46 ? 426 HOH L O 1 HETATM 10533 O O . HOH HA 11 . ? 20.238 17.929 -2.800 0.83 22.71 ? 427 HOH L O 1 HETATM 10534 O O . HOH HA 11 . ? 59.397 9.698 3.354 1.00 35.82 ? 428 HOH L O 1 HETATM 10535 O O . HOH HA 11 . ? 25.573 -3.829 4.711 0.97 32.53 ? 429 HOH L O 1 HETATM 10536 O O . HOH HA 11 . ? 57.803 10.599 12.641 0.69 13.97 ? 430 HOH L O 1 HETATM 10537 O O . HOH HA 11 . ? 12.624 18.703 -8.960 0.86 26.88 ? 431 HOH L O 1 HETATM 10538 O O . HOH HA 11 . ? 56.093 12.051 22.415 0.86 24.34 ? 432 HOH L O 1 HETATM 10539 O O . HOH HA 11 . ? 20.021 18.170 -5.403 1.00 41.56 ? 433 HOH L O 1 HETATM 10540 O O . HOH HA 11 . ? 4.354 1.606 10.912 0.74 22.48 ? 434 HOH L O 1 HETATM 10541 O O . HOH HA 11 . ? 1.350 19.341 -7.104 0.87 20.99 ? 435 HOH L O 1 HETATM 10542 O O . HOH HA 11 . ? 0.568 15.078 -6.542 0.64 9.15 ? 436 HOH L O 1 HETATM 10543 O O . HOH HA 11 . ? 0.607 19.395 4.889 0.65 5.79 ? 437 HOH L O 1 HETATM 10544 O O . HOH HA 11 . ? 57.222 16.621 24.307 0.73 23.40 ? 438 HOH L O 1 HETATM 10545 O O . HOH HA 11 . ? 0.000 10.155 0.000 0.45 14.42 ? 439 HOH L O 1 HETATM 10546 O O . HOH HA 11 . ? 27.775 7.507 15.179 0.86 26.50 ? 440 HOH L O 1 HETATM 10547 O O . HOH HA 11 . ? 4.760 22.597 5.533 1.00 30.12 ? 441 HOH L O 1 HETATM 10548 O O . HOH HA 11 . ? 56.933 19.091 24.638 0.66 21.65 ? 442 HOH L O 1 HETATM 10549 O O . HOH HA 11 . ? 3.382 15.514 2.359 1.00 13.25 ? 443 HOH L O 1 HETATM 10550 O O . HOH HA 11 . ? 1.780 14.104 0.176 1.00 31.63 ? 444 HOH L O 1 HETATM 10551 O O . HOH HA 11 . ? 5.723 23.943 -2.019 1.00 40.75 ? 445 HOH L O 1 HETATM 10552 O O . HOH HA 11 . ? 49.071 11.435 22.657 1.00 29.62 ? 446 HOH L 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 . PCA A 1 ? 0.9261 0.6318 1.1295 0.0083 0.0004 0.1699 1 PCA B N 2 C CA . PCA A 1 ? 0.8911 0.5927 1.0517 -0.0069 0.0224 0.1213 1 PCA B CA 3 C CB . PCA A 1 ? 0.9135 0.6040 1.1193 0.0159 0.0514 0.0970 1 PCA B CB 4 C CG . PCA A 1 ? 0.9323 0.6376 1.2127 0.0471 0.0413 0.1348 1 PCA B CG 5 C CD . PCA A 1 ? 0.9479 0.6578 1.2195 0.0384 0.0076 0.1808 1 PCA B CD 6 O OE . PCA A 1 ? 0.9779 0.6976 1.3012 0.0563 -0.0100 0.2239 1 PCA B OE 7 C C . PCA A 1 ? 0.8056 0.5617 0.9209 -0.0230 0.0075 0.1113 1 PCA B C 8 O O . PCA A 1 ? 0.7717 0.5699 0.8898 -0.0210 -0.0165 0.1354 1 PCA B O 9 N N . VAL A 2 ? 0.7634 0.5184 0.8376 -0.0402 0.0215 0.0765 2 VAL B N 10 C CA . VAL A 2 ? 0.6972 0.4997 0.7380 -0.0511 0.0122 0.0651 2 VAL B CA 11 C C . VAL A 2 ? 0.6663 0.4983 0.7350 -0.0344 0.0174 0.0568 2 VAL B C 12 O O . VAL A 2 ? 0.6877 0.5037 0.7784 -0.0243 0.0403 0.0377 2 VAL B O 13 C CB . VAL A 2 ? 0.6854 0.4836 0.6814 -0.0743 0.0229 0.0371 2 VAL B CB 14 C CG1 . VAL A 2 ? 0.6332 0.4787 0.6065 -0.0805 0.0147 0.0289 2 VAL B CG1 15 C CG2 . VAL A 2 ? 0.7125 0.4905 0.6833 -0.0939 0.0167 0.0470 2 VAL B CG2 16 N N . GLN A 3 ? 0.6165 0.4909 0.6825 -0.0340 -0.0017 0.0695 3 GLN B N 17 C CA . GLN A 3 ? 0.5771 0.4825 0.6667 -0.0231 0.0014 0.0631 3 GLN B CA 18 C C . GLN A 3 ? 0.5196 0.4600 0.5782 -0.0358 -0.0125 0.0602 3 GLN B C 19 O O . GLN A 3 ? 0.5088 0.4582 0.5432 -0.0465 -0.0295 0.0723 3 GLN B O 20 C CB . GLN A 3 ? 0.5960 0.5154 0.7427 -0.0028 -0.0074 0.0893 3 GLN B CB 21 C CG . GLN A 3 ? 0.6103 0.5287 0.8053 0.0166 0.0167 0.0769 3 GLN B CG 22 C CD . GLN A 3 ? 0.6245 0.5646 0.8883 0.0389 0.0073 0.1073 3 GLN B CD 23 O OE1 . GLN A 3 ? 0.6507 0.5747 0.9414 0.0483 -0.0036 0.1354 3 GLN B OE1 24 N NE2 . GLN A 3 ? 0.6014 0.5804 0.8983 0.0470 0.0116 0.1047 3 GLN B NE2 25 N N . LEU A 4 ? 0.4823 0.4397 0.5414 -0.0353 -0.0024 0.0433 4 LEU B N 26 C CA . LEU A 4 ? 0.4431 0.4284 0.4832 -0.0442 -0.0123 0.0407 4 LEU B CA 27 C C . LEU A 4 ? 0.4177 0.4292 0.4891 -0.0365 -0.0119 0.0426 4 LEU B C 28 O O . LEU A 4 ? 0.4135 0.4291 0.4913 -0.0349 0.0044 0.0289 4 LEU B O 29 C CB . LEU A 4 ? 0.4345 0.4163 0.4412 -0.0558 -0.0027 0.0225 4 LEU B CB 30 C CG . LEU A 4 ? 0.4494 0.4184 0.4259 -0.0674 -0.0070 0.0230 4 LEU B CG 31 C CD1 . LEU A 4 ? 0.4805 0.4195 0.4525 -0.0712 0.0057 0.0149 4 LEU B CD1 32 C CD2 . LEU A 4 ? 0.4297 0.4148 0.3816 -0.0779 -0.0087 0.0163 4 LEU B CD2 33 N N . LYS A 5 ? 0.4061 0.4384 0.4950 -0.0355 -0.0305 0.0608 5 LYS B N 34 C CA . LYS A 5 ? 0.3914 0.4546 0.5130 -0.0323 -0.0339 0.0660 5 LYS B CA 35 C C . LYS A 5 ? 0.3618 0.4364 0.4550 -0.0476 -0.0401 0.0571 5 LYS B C 36 O O . LYS A 5 ? 0.3685 0.4382 0.4302 -0.0588 -0.0517 0.0573 5 LYS B O 37 C CB . LYS A 5 ? 0.4077 0.4923 0.5637 -0.0276 -0.0545 0.0929 5 LYS B CB 38 C CG . LYS A 5 ? 0.4399 0.5098 0.6346 -0.0088 -0.0489 0.1076 5 LYS B CG 39 C CD . LYS A 5 ? 0.4689 0.5593 0.6892 -0.0075 -0.0766 0.1429 5 LYS B CD 40 C CE . LYS A 5 ? 0.4974 0.5806 0.7809 0.0174 -0.0703 0.1639 5 LYS B CE 41 N NZ . LYS A 5 ? 0.4957 0.6177 0.8474 0.0331 -0.0661 0.1734 5 LYS B NZ 42 N N . GLU A 6 ? 0.3406 0.4281 0.4458 -0.0484 -0.0295 0.0488 6 GLU B N 43 C CA . GLU A 6 ? 0.3246 0.4179 0.4104 -0.0619 -0.0338 0.0428 6 GLU B CA 44 C C . GLU A 6 ? 0.3114 0.4332 0.4264 -0.0679 -0.0436 0.0517 6 GLU B C 45 O O . GLU A 6 ? 0.3063 0.4494 0.4622 -0.0591 -0.0383 0.0591 6 GLU B O 46 C CB . GLU A 6 ? 0.3218 0.4088 0.3960 -0.0633 -0.0162 0.0310 6 GLU B CB 47 C CG . GLU A 6 ? 0.3308 0.3963 0.3762 -0.0622 -0.0083 0.0226 6 GLU B CG 48 C CD . GLU A 6 ? 0.3324 0.3980 0.3618 -0.0684 0.0041 0.0155 6 GLU B CD 49 O OE1 . GLU A 6 ? 0.3302 0.4083 0.3667 -0.0738 0.0056 0.0186 6 GLU B OE1 50 O OE2 . GLU A 6 ? 0.3356 0.3903 0.3447 -0.0704 0.0110 0.0088 6 GLU B OE2 51 N N . SER A 7 ? 0.3067 0.4290 0.4028 -0.0838 -0.0559 0.0497 7 SER B N 52 C CA . SER A 7 ? 0.3069 0.4549 0.4260 -0.0961 -0.0655 0.0559 7 SER B CA 53 C C . SER A 7 ? 0.3118 0.4434 0.4082 -0.1112 -0.0620 0.0440 7 SER B C 54 O O . SER A 7 ? 0.3168 0.4216 0.3793 -0.1155 -0.0613 0.0336 7 SER B O 55 C CB . SER A 7 ? 0.3203 0.4872 0.4421 -0.1067 -0.0899 0.0686 7 SER B CB 56 O OG . SER A 7 ? 0.3348 0.4785 0.4093 -0.1200 -0.0965 0.0582 7 SER B OG 57 N N . GLY A 8 ? 0.3135 0.4611 0.4330 -0.1189 -0.0582 0.0468 8 GLY B N 58 C CA . GLY A 8 ? 0.3273 0.4544 0.4311 -0.1327 -0.0534 0.0391 8 GLY B CA 59 C C . GLY A 8 ? 0.3255 0.4717 0.4571 -0.1398 -0.0450 0.0460 8 GLY B C 60 O O . GLY A 8 ? 0.3132 0.4903 0.4760 -0.1314 -0.0382 0.0536 8 GLY B O 61 N N . PRO A 9 ? 0.3457 0.4715 0.4676 -0.1551 -0.0428 0.0432 9 PRO B N 62 C CA . PRO A 9 ? 0.3522 0.4939 0.4972 -0.1685 -0.0363 0.0518 9 PRO B CA 63 C C . PRO A 9 ? 0.3429 0.4949 0.4931 -0.1578 -0.0174 0.0587 9 PRO B C 64 O O . PRO A 9 ? 0.3376 0.4692 0.4638 -0.1460 -0.0103 0.0563 9 PRO B O 65 C CB . PRO A 9 ? 0.3795 0.4814 0.5062 -0.1856 -0.0380 0.0466 9 PRO B CB 66 C CG . PRO A 9 ? 0.3833 0.4487 0.4800 -0.1719 -0.0359 0.0368 9 PRO B CG 67 C CD . PRO A 9 ? 0.3641 0.4466 0.4545 -0.1590 -0.0430 0.0323 9 PRO B CD 68 N N . GLY A 10 ? 0.3455 0.5339 0.5267 -0.1642 -0.0089 0.0667 10 GLY B N 69 C CA . GLY A 10 ? 0.3514 0.5517 0.5322 -0.1629 0.0117 0.0719 10 GLY B CA 70 C C . GLY A 10 ? 0.3791 0.5600 0.5457 -0.1812 0.0143 0.0825 10 GLY B C 71 O O . GLY A 10 ? 0.3916 0.5734 0.5422 -0.1827 0.0279 0.0897 10 GLY B O 72 N N . LEU A 11 ? 0.3989 0.5609 0.5697 -0.1975 0.0014 0.0842 11 LEU B N 73 C CA . LEU A 11 ? 0.4295 0.5682 0.5955 -0.2169 0.0036 0.0967 11 LEU B CA 74 C C . LEU A 11 ? 0.4526 0.5392 0.6046 -0.2226 -0.0076 0.0902 11 LEU B C 75 O O . LEU A 11 ? 0.4583 0.5401 0.6127 -0.2294 -0.0192 0.0762 11 LEU B O 76 C CB . LEU A 11 ? 0.4424 0.6166 0.6405 -0.2397 0.0067 0.1052 11 LEU B CB 77 C CG . LEU A 11 ? 0.4812 0.6340 0.6792 -0.2651 0.0099 0.1215 11 LEU B CG 78 C CD1 . LEU A 11 ? 0.4887 0.6466 0.6704 -0.2628 0.0253 0.1388 11 LEU B CD1 79 C CD2 . LEU A 11 ? 0.4946 0.6795 0.7263 -0.2932 0.0083 0.1270 11 LEU B CD2 80 N N . VAL A 12 ? 0.4729 0.5221 0.6117 -0.2215 -0.0034 0.1014 12 VAL B N 81 C CA . VAL A 12 ? 0.5047 0.4985 0.6366 -0.2237 -0.0076 0.0947 12 VAL B CA 82 C C . VAL A 12 ? 0.5436 0.5058 0.6848 -0.2395 -0.0027 0.1154 12 VAL B C 83 O O . VAL A 12 ? 0.5459 0.5204 0.6867 -0.2384 0.0025 0.1399 12 VAL B O 84 C CB . VAL A 12 ? 0.4964 0.4686 0.6116 -0.1978 -0.0068 0.0895 12 VAL B CB 85 C CG1 . VAL A 12 ? 0.5324 0.4473 0.6470 -0.1969 -0.0052 0.0799 12 VAL B CG1 86 C CG2 . VAL A 12 ? 0.4661 0.4649 0.5708 -0.1842 -0.0115 0.0716 12 VAL B CG2 87 N N . GLN A 13 ? 0.5799 0.4993 0.7268 -0.2566 -0.0045 0.1056 13 GLN B N 88 C CA . GLN A 13 ? 0.6318 0.5073 0.7905 -0.2713 0.0006 0.1248 13 GLN B CA 89 C C . GLN A 13 ? 0.6420 0.4794 0.8014 -0.2469 0.0052 0.1408 13 GLN B C 90 O O . GLN A 13 ? 0.6251 0.4500 0.7771 -0.2243 0.0058 0.1248 13 GLN B O 91 C CB . GLN A 13 ? 0.6832 0.5123 0.8455 -0.2963 -0.0002 0.1035 13 GLN B CB 92 C CG . GLN A 13 ? 0.6801 0.5487 0.8467 -0.3261 -0.0089 0.0910 13 GLN B CG 93 C CD . GLN A 13 ? 0.6866 0.5910 0.8732 -0.3477 -0.0069 0.1177 13 GLN B CD 94 O OE1 . GLN A 13 ? 0.7336 0.6011 0.9294 -0.3652 -0.0013 0.1358 13 GLN B OE1 95 N NE2 . GLN A 13 ? 0.6460 0.6222 0.8425 -0.3470 -0.0096 0.1210 13 GLN B NE2 96 N N . PRO A 14 ? 0.6705 0.4935 0.8419 -0.2523 0.0079 0.1760 14 PRO B N 97 C CA . PRO A 14 ? 0.6931 0.4782 0.8764 -0.2306 0.0098 0.1981 14 PRO B CA 98 C C . PRO A 14 ? 0.7298 0.4479 0.9268 -0.2204 0.0173 0.1745 14 PRO B C 99 O O . PRO A 14 ? 0.7703 0.4456 0.9730 -0.2419 0.0225 0.1584 14 PRO B O 100 C CB . PRO A 14 ? 0.7341 0.5080 0.9306 -0.2485 0.0098 0.2403 14 PRO B CB 101 C CG . PRO A 14 ? 0.7093 0.5436 0.8902 -0.2712 0.0088 0.2440 14 PRO B CG 102 C CD . PRO A 14 ? 0.6792 0.5333 0.8539 -0.2769 0.0086 0.2021 14 PRO B CD 103 N N . SER A 15 ? 0.7173 0.4291 0.9191 -0.1897 0.0197 0.1710 15 SER B N 104 C CA . SER A 15 ? 0.7517 0.4059 0.9675 -0.1747 0.0324 0.1451 15 SER B CA 105 C C . SER A 15 ? 0.7377 0.3929 0.9261 -0.1816 0.0359 0.0952 15 SER B C 106 O O . SER A 15 ? 0.7738 0.3820 0.9662 -0.1743 0.0499 0.0677 15 SER B O 107 C CB . SER A 15 ? 0.8258 0.4061 1.0681 -0.1868 0.0434 0.1510 15 SER B CB 108 O OG . SER A 15 ? 0.8540 0.4098 1.0773 -0.2169 0.0477 0.1129 15 SER B OG 109 N N . GLN A 16 ? 0.6953 0.4024 0.8579 -0.1973 0.0246 0.0841 16 GLN B N 110 C CA . GLN A 16 ? 0.6794 0.3984 0.8155 -0.2026 0.0230 0.0453 16 GLN B CA 111 C C . GLN A 16 ? 0.6205 0.3836 0.7444 -0.1774 0.0187 0.0446 16 GLN B C 112 O O . GLN A 16 ? 0.5936 0.3841 0.7264 -0.1602 0.0155 0.0718 16 GLN B O 113 C CB . GLN A 16 ? 0.6730 0.4237 0.7961 -0.2345 0.0115 0.0361 16 GLN B CB 114 C CG . GLN A 16 ? 0.7321 0.4418 0.8624 -0.2680 0.0141 0.0302 16 GLN B CG 115 C CD . GLN A 16 ? 0.7988 0.4348 0.9233 -0.2738 0.0289 -0.0003 16 GLN B CD 116 O OE1 . GLN A 16 ? 0.8017 0.4296 0.9062 -0.2637 0.0345 -0.0289 16 GLN B OE1 117 N NE2 . GLN A 16 ? 0.8613 0.4410 1.0022 -0.2926 0.0376 0.0036 16 GLN B NE2 118 N N . SER A 17 ? 0.6085 0.3789 0.7088 -0.1794 0.0179 0.0141 17 SER B N 119 C CA . SER A 17 ? 0.5658 0.3667 0.6541 -0.1574 0.0164 0.0101 17 SER B CA 120 C C . SER A 17 ? 0.5117 0.3699 0.5862 -0.1605 0.0021 0.0150 17 SER B C 121 O O . SER A 17 ? 0.5132 0.3908 0.5855 -0.1805 -0.0066 0.0132 17 SER B O 122 C CB . SER A 17 ? 0.5938 0.3685 0.6628 -0.1574 0.0263 -0.0241 17 SER B CB 123 O OG . SER A 17 ? 0.6007 0.3905 0.6413 -0.1827 0.0161 -0.0450 17 SER B OG 124 N N . LEU A 18 ? 0.4721 0.3569 0.5417 -0.1404 0.0008 0.0215 18 LEU B N 125 C CA . LEU A 18 ? 0.4278 0.3591 0.4878 -0.1389 -0.0085 0.0252 18 LEU B CA 126 C C . LEU A 18 ? 0.4164 0.3536 0.4565 -0.1322 -0.0105 0.0074 18 LEU B C 127 O O . LEU A 18 ? 0.4157 0.3421 0.4529 -0.1172 -0.0033 0.0046 18 LEU B O 128 C CB . LEU A 18 ? 0.3999 0.3549 0.4659 -0.1256 -0.0075 0.0474 18 LEU B CB 129 C CG . LEU A 18 ? 0.3658 0.3576 0.4206 -0.1190 -0.0113 0.0459 18 LEU B CG 130 C CD1 . LEU A 18 ? 0.3573 0.3737 0.4178 -0.1305 -0.0159 0.0425 18 LEU B CD1 131 C CD2 . LEU A 18 ? 0.3565 0.3669 0.4096 -0.1124 -0.0084 0.0635 18 LEU B CD2 132 N N . SER A 19 ? 0.4061 0.3650 0.4360 -0.1436 -0.0208 -0.0003 19 SER B N 133 C CA . SER A 19 ? 0.4036 0.3711 0.4123 -0.1412 -0.0254 -0.0121 19 SER B CA 134 C C . SER A 19 ? 0.3723 0.3778 0.3862 -0.1353 -0.0350 -0.0005 19 SER B C 135 O O . SER A 19 ? 0.3699 0.3988 0.3988 -0.1444 -0.0435 0.0064 19 SER B O 136 C CB . SER A 19 ? 0.4391 0.3938 0.4280 -0.1640 -0.0306 -0.0312 19 SER B CB 137 O OG . SER A 19 ? 0.4783 0.3898 0.4614 -0.1663 -0.0154 -0.0475 19 SER B OG 138 N N . ILE A 20 ? 0.3555 0.3667 0.3614 -0.1199 -0.0321 0.0017 20 ILE B N 139 C CA . ILE A 20 ? 0.3321 0.3690 0.3429 -0.1128 -0.0379 0.0100 20 ILE B CA 140 C C . ILE A 20 ? 0.3350 0.3705 0.3246 -0.1117 -0.0429 0.0050 20 ILE B C 141 O O . ILE A 20 ? 0.3365 0.3560 0.3093 -0.1086 -0.0357 -0.0031 20 ILE B O 142 C CB . ILE A 20 ? 0.3160 0.3594 0.3342 -0.0997 -0.0286 0.0180 20 ILE B CB 143 C CG1 . ILE A 20 ? 0.3197 0.3664 0.3532 -0.1040 -0.0228 0.0257 20 ILE B CG1 144 C CG2 . ILE A 20 ? 0.3036 0.3650 0.3294 -0.0924 -0.0300 0.0223 20 ILE B CG2 145 C CD1 . ILE A 20 ? 0.3138 0.3668 0.3443 -0.0975 -0.0139 0.0332 20 ILE B CD1 146 N N . THR A 21 ? 0.3347 0.3897 0.3293 -0.1141 -0.0549 0.0129 21 THR B N 147 C CA . THR A 21 ? 0.3448 0.4011 0.3199 -0.1151 -0.0621 0.0147 21 THR B CA 148 C C . THR A 21 ? 0.3316 0.3950 0.3218 -0.0995 -0.0602 0.0263 21 THR B C 149 O O . THR A 21 ? 0.3234 0.4021 0.3434 -0.0925 -0.0615 0.0360 21 THR B O 150 C CB . THR A 21 ? 0.3668 0.4388 0.3340 -0.1334 -0.0806 0.0191 21 THR B CB 151 O OG1 . THR A 21 ? 0.3902 0.4470 0.3347 -0.1518 -0.0782 0.0013 21 THR B OG1 152 C CG2 . THR A 21 ? 0.3792 0.4559 0.3247 -0.1363 -0.0901 0.0275 21 THR B CG2 153 N N . CYS A 22 ? 0.3358 0.3866 0.3073 -0.0947 -0.0541 0.0234 22 CYS B N 154 C CA . CYS A 22 ? 0.3392 0.3879 0.3191 -0.0841 -0.0508 0.0310 22 CYS B CA 155 C C . CYS A 22 ? 0.3525 0.4027 0.3212 -0.0891 -0.0634 0.0425 22 CYS B C 156 O O . CYS A 22 ? 0.3663 0.4117 0.3055 -0.0992 -0.0651 0.0385 22 CYS B O 157 C CB . CYS A 22 ? 0.3379 0.3746 0.3049 -0.0802 -0.0375 0.0226 22 CYS B CB 158 S SG . CYS A 22 ? 0.3522 0.3780 0.3189 -0.0746 -0.0312 0.0257 22 CYS B SG 159 N N . THR A 23 ? 0.3541 0.4128 0.3490 -0.0823 -0.0717 0.0588 23 THR B N 160 C CA . THR A 23 ? 0.3776 0.4376 0.3650 -0.0869 -0.0860 0.0772 23 THR B CA 161 C C . THR A 23 ? 0.3824 0.4215 0.3804 -0.0748 -0.0775 0.0841 23 THR B C 162 O O . THR A 23 ? 0.3802 0.4136 0.4126 -0.0597 -0.0682 0.0854 23 THR B O 163 C CB . THR A 23 ? 0.3942 0.4821 0.3971 -0.0949 -0.1088 0.0971 23 THR B CB 164 O OG1 . THR A 23 ? 0.4115 0.5038 0.4425 -0.0855 -0.1200 0.1250 23 THR B OG1 165 C CG2 . THR A 23 ? 0.3812 0.4886 0.4132 -0.0935 -0.1089 0.0925 23 THR B CG2 166 N N . VAL A 24 ? 0.3926 0.4190 0.3597 -0.0840 -0.0785 0.0865 24 VAL B N 167 C CA . VAL A 24 ? 0.4020 0.4031 0.3684 -0.0795 -0.0683 0.0878 24 VAL B CA 168 C C . VAL A 24 ? 0.4282 0.4212 0.4061 -0.0786 -0.0814 0.1163 24 VAL B C 169 O O . VAL A 24 ? 0.4394 0.4491 0.4028 -0.0902 -0.0997 0.1343 24 VAL B O 170 C CB . VAL A 24 ? 0.4003 0.3962 0.3290 -0.0921 -0.0594 0.0735 24 VAL B CB 171 C CG1 . VAL A 24 ? 0.4296 0.4106 0.3414 -0.1014 -0.0615 0.0868 24 VAL B CG1 172 C CG2 . VAL A 24 ? 0.3794 0.3699 0.3115 -0.0873 -0.0430 0.0534 24 VAL B CG2 173 N N . SER A 25 ? 0.4424 0.4074 0.4433 -0.0672 -0.0712 0.1202 25 SER B N 174 C CA . SER A 25 ? 0.4772 0.4252 0.4941 -0.0645 -0.0812 0.1499 25 SER B CA 175 C C . SER A 25 ? 0.4966 0.4016 0.5154 -0.0621 -0.0629 0.1414 25 SER B C 176 O O . SER A 25 ? 0.4870 0.3777 0.5112 -0.0565 -0.0427 0.1148 25 SER B O 177 C CB . SER A 25 ? 0.4864 0.4463 0.5584 -0.0456 -0.0904 0.1721 25 SER B CB 178 O OG . SER A 25 ? 0.4858 0.4260 0.5960 -0.0259 -0.0677 0.1554 25 SER B OG 179 N N . GLY A 26 ? 0.5321 0.4163 0.5436 -0.0699 -0.0706 0.1650 26 GLY B N 180 C CA . GLY A 26 ? 0.5619 0.3995 0.5713 -0.0737 -0.0547 0.1590 26 GLY B CA 181 C C . GLY A 26 ? 0.5622 0.4001 0.5216 -0.0994 -0.0513 0.1478 26 GLY B C 182 O O . GLY A 26 ? 0.5943 0.3979 0.5459 -0.1103 -0.0439 0.1505 26 GLY B O 183 N N . PHE A 27 ? 0.5283 0.4042 0.4584 -0.1089 -0.0545 0.1342 27 PHE B N 184 C CA . PHE A 27 ? 0.5259 0.4129 0.4175 -0.1302 -0.0502 0.1254 27 PHE B CA 185 C C . PHE A 27 ? 0.5020 0.4297 0.3689 -0.1374 -0.0577 0.1231 27 PHE B C 186 O O . PHE A 27 ? 0.4819 0.4279 0.3586 -0.1275 -0.0651 0.1213 27 PHE B O 187 C CB . PHE A 27 ? 0.5115 0.3948 0.3995 -0.1334 -0.0332 0.0959 27 PHE B CB 188 C CG . PHE A 27 ? 0.4760 0.3862 0.3694 -0.1229 -0.0298 0.0758 27 PHE B CG 189 C CD1 . PHE A 27 ? 0.4706 0.3723 0.3895 -0.1066 -0.0248 0.0671 27 PHE B CD1 190 C CD2 . PHE A 27 ? 0.4552 0.3983 0.3308 -0.1294 -0.0293 0.0665 27 PHE B CD2 191 C CE1 . PHE A 27 ? 0.4406 0.3666 0.3625 -0.0999 -0.0221 0.0520 27 PHE B CE1 192 C CE2 . PHE A 27 ? 0.4242 0.3869 0.3073 -0.1200 -0.0265 0.0520 27 PHE B CE2 193 C CZ . PHE A 27 ? 0.4175 0.3720 0.3217 -0.1067 -0.0242 0.0460 27 PHE B CZ 194 N N . SER A 28 ? 0.5057 0.4469 0.3418 -0.1560 -0.0529 0.1203 28 SER B N 195 C CA . SER A 28 ? 0.5003 0.4735 0.3087 -0.1663 -0.0553 0.1169 28 SER B CA 196 C C . SER A 28 ? 0.4683 0.4625 0.2752 -0.1634 -0.0399 0.0881 28 SER B C 197 O O . SER A 28 ? 0.4567 0.4521 0.2691 -0.1661 -0.0282 0.0781 28 SER B O 198 C CB . SER A 28 ? 0.5348 0.5123 0.3111 -0.1896 -0.0564 0.1341 28 SER B CB 199 O OG . SER A 28 ? 0.5424 0.5491 0.2874 -0.2017 -0.0551 0.1270 28 SER B OG 200 N N . LEU A 29 ? 0.4567 0.4685 0.2577 -0.1599 -0.0407 0.0768 29 LEU B N 201 C CA . LEU A 29 ? 0.4352 0.4631 0.2414 -0.1543 -0.0258 0.0530 29 LEU B CA 202 C C . LEU A 29 ? 0.4508 0.4975 0.2396 -0.1674 -0.0100 0.0455 29 LEU B C 203 O O . LEU A 29 ? 0.4345 0.4961 0.2388 -0.1604 0.0042 0.0301 29 LEU B O 204 C CB . LEU A 29 ? 0.4306 0.4646 0.2360 -0.1489 -0.0289 0.0420 29 LEU B CB 205 C CG . LEU A 29 ? 0.4119 0.4368 0.2437 -0.1342 -0.0395 0.0448 29 LEU B CG 206 C CD1 . LEU A 29 ? 0.4188 0.4514 0.2433 -0.1374 -0.0458 0.0379 29 LEU B CD1 207 C CD2 . LEU A 29 ? 0.3822 0.4045 0.2398 -0.1204 -0.0301 0.0343 29 LEU B CD2 208 N N . THR A 30 ? 0.4868 0.5360 0.2468 -0.1862 -0.0117 0.0586 30 THR B N 209 C CA . THR A 30 ? 0.5022 0.5722 0.2481 -0.2007 0.0062 0.0532 30 THR B CA 210 C C . THR A 30 ? 0.4887 0.5603 0.2556 -0.2024 0.0110 0.0585 30 THR B C 211 O O . THR A 30 ? 0.4925 0.5891 0.2626 -0.2104 0.0272 0.0525 30 THR B O 212 C CB . THR A 30 ? 0.5511 0.6254 0.2545 -0.2259 0.0032 0.0690 30 THR B CB 213 O OG1 . THR A 30 ? 0.5683 0.6199 0.2718 -0.2317 -0.0146 0.0980 30 THR B OG1 214 C CG2 . THR A 30 ? 0.5730 0.6520 0.2452 -0.2334 -0.0021 0.0627 30 THR B CG2 215 N N . THR A 31 ? 0.4821 0.5280 0.2636 -0.1970 -0.0015 0.0688 31 THR B N 216 C CA . THR A 31 ? 0.4803 0.5218 0.2749 -0.2049 0.0015 0.0719 31 THR B CA 217 C C . THR A 31 ? 0.4497 0.4965 0.2720 -0.1915 0.0031 0.0576 31 THR B C 218 O O . THR A 31 ? 0.4448 0.5084 0.2783 -0.2005 0.0084 0.0549 31 THR B O 219 C CB . THR A 31 ? 0.5100 0.5119 0.2994 -0.2123 -0.0098 0.0908 31 THR B CB 220 O OG1 . THR A 31 ? 0.5447 0.5426 0.3080 -0.2254 -0.0158 0.1115 31 THR B OG1 221 C CG2 . THR A 31 ? 0.5248 0.5187 0.3198 -0.2286 -0.0045 0.0916 31 THR B CG2 222 N N . TYR A 32 ? 0.4314 0.4678 0.2640 -0.1731 -0.0026 0.0508 32 TYR B N 223 C CA . TYR A 32 ? 0.4091 0.4482 0.2618 -0.1640 -0.0026 0.0409 32 TYR B CA 224 C C . TYR A 32 ? 0.3850 0.4407 0.2515 -0.1467 -0.0006 0.0315 32 TYR B C 225 O O . TYR A 32 ? 0.3854 0.4358 0.2457 -0.1394 -0.0024 0.0299 32 TYR B O 226 C CB . TYR A 32 ? 0.4179 0.4211 0.2723 -0.1607 -0.0088 0.0420 32 TYR B CB 227 C CG . TYR A 32 ? 0.4520 0.4271 0.2976 -0.1763 -0.0089 0.0499 32 TYR B CG 228 C CD1 . TYR A 32 ? 0.4815 0.4331 0.3190 -0.1782 -0.0144 0.0666 32 TYR B CD1 229 C CD2 . TYR A 32 ? 0.4629 0.4325 0.3078 -0.1912 -0.0047 0.0423 32 TYR B CD2 230 C CE1 . TYR A 32 ? 0.5180 0.4367 0.3511 -0.1918 -0.0140 0.0770 32 TYR B CE1 231 C CE2 . TYR A 32 ? 0.5024 0.4378 0.3390 -0.2078 -0.0030 0.0475 32 TYR B CE2 232 C CZ . TYR A 32 ? 0.5304 0.4377 0.3633 -0.2064 -0.0068 0.0654 32 TYR B CZ 233 O OH . TYR A 32 ? 0.5784 0.4456 0.4066 -0.2224 -0.0047 0.0737 32 TYR B OH 234 N N . GLY A 33 ? 0.3701 0.4459 0.2552 -0.1429 0.0017 0.0273 33 GLY B N 235 C CA . GLY A 33 ? 0.3517 0.4384 0.2544 -0.1267 0.0030 0.0223 33 GLY B CA 236 C C . GLY A 33 ? 0.3465 0.4138 0.2501 -0.1195 -0.0041 0.0204 33 GLY B C 237 O O . GLY A 33 ? 0.3567 0.4068 0.2520 -0.1265 -0.0072 0.0203 33 GLY B O 238 N N . VAL A 34 ? 0.3301 0.3981 0.2444 -0.1067 -0.0039 0.0174 34 VAL B N 239 C CA . VAL A 34 ? 0.3222 0.3778 0.2401 -0.1007 -0.0084 0.0162 34 VAL B CA 240 C C . VAL A 34 ? 0.3093 0.3807 0.2448 -0.0939 -0.0077 0.0189 34 VAL B C 241 O O . VAL A 34 ? 0.3037 0.3813 0.2527 -0.0858 -0.0035 0.0188 34 VAL B O 242 C CB . VAL A 34 ? 0.3288 0.3685 0.2432 -0.0953 -0.0120 0.0144 34 VAL B CB 243 C CG1 . VAL A 34 ? 0.3205 0.3549 0.2461 -0.0888 -0.0142 0.0138 34 VAL B CG1 244 C CG2 . VAL A 34 ? 0.3445 0.3701 0.2454 -0.1015 -0.0163 0.0194 34 VAL B CG2 245 N N . HIS A 35 ? 0.3036 0.3791 0.2378 -0.0987 -0.0104 0.0215 35 HIS B N 246 C CA . HIS A 35 ? 0.2981 0.3912 0.2460 -0.0960 -0.0127 0.0304 35 HIS B CA 247 C C . HIS A 35 ? 0.2963 0.3767 0.2463 -0.0904 -0.0124 0.0291 35 HIS B C 248 O O . HIS A 35 ? 0.2909 0.3544 0.2334 -0.0899 -0.0105 0.0210 35 HIS B O 249 C CB . HIS A 35 ? 0.3061 0.4187 0.2444 -0.1115 -0.0172 0.0358 35 HIS B CB 250 C CG . HIS A 35 ? 0.3082 0.4371 0.2456 -0.1218 -0.0186 0.0377 35 HIS B CG 251 N ND1 . HIS A 35 ? 0.3039 0.4702 0.2611 -0.1249 -0.0243 0.0529 35 HIS B ND1 252 C CD2 . HIS A 35 ? 0.3177 0.4332 0.2406 -0.1309 -0.0156 0.0293 35 HIS B CD2 253 C CE1 . HIS A 35 ? 0.3102 0.4886 0.2646 -0.1369 -0.0241 0.0518 35 HIS B CE1 254 N NE2 . HIS A 35 ? 0.3194 0.4648 0.2506 -0.1418 -0.0185 0.0372 35 HIS B NE2 255 N N . TRP A 36 ? 0.3005 0.3909 0.2661 -0.0857 -0.0141 0.0400 36 TRP B N 256 C CA . TRP A 36 ? 0.3066 0.3894 0.2749 -0.0845 -0.0137 0.0420 36 TRP B CA 257 C C . TRP A 36 ? 0.3150 0.4176 0.2804 -0.0935 -0.0175 0.0565 36 TRP B C 258 O O . TRP A 36 ? 0.3192 0.4413 0.2969 -0.0935 -0.0236 0.0729 36 TRP B O 259 C CB . TRP A 36 ? 0.3062 0.3749 0.2926 -0.0743 -0.0119 0.0421 36 TRP B CB 260 C CG . TRP A 36 ? 0.3069 0.3597 0.2859 -0.0726 -0.0101 0.0275 36 TRP B CG 261 C CD1 . TRP A 36 ? 0.3140 0.3641 0.2879 -0.0711 -0.0075 0.0203 36 TRP B CD1 262 C CD2 . TRP A 36 ? 0.3099 0.3529 0.2854 -0.0750 -0.0120 0.0211 36 TRP B CD2 263 N NE1 . TRP A 36 ? 0.3187 0.3567 0.2806 -0.0743 -0.0096 0.0111 36 TRP B NE1 264 C CE2 . TRP A 36 ? 0.3137 0.3489 0.2798 -0.0759 -0.0138 0.0127 36 TRP B CE2 265 C CE3 . TRP A 36 ? 0.3074 0.3526 0.2891 -0.0776 -0.0123 0.0236 36 TRP B CE3 266 C CZ2 . TRP A 36 ? 0.3208 0.3524 0.2852 -0.0794 -0.0198 0.0100 36 TRP B CZ2 267 C CZ3 . TRP A 36 ? 0.3099 0.3524 0.2958 -0.0788 -0.0156 0.0191 36 TRP B CZ3 268 C CH2 . TRP A 36 ? 0.3150 0.3517 0.2932 -0.0798 -0.0212 0.0139 36 TRP B CH2 269 N N . VAL A 37 ? 0.3252 0.4262 0.2750 -0.1024 -0.0136 0.0516 37 VAL B N 270 C CA . VAL A 37 ? 0.3430 0.4640 0.2773 -0.1178 -0.0155 0.0624 37 VAL B CA 271 C C . VAL A 37 ? 0.3499 0.4663 0.2857 -0.1192 -0.0091 0.0639 37 VAL B C 272 O O . VAL A 37 ? 0.3446 0.4454 0.2882 -0.1119 -0.0015 0.0504 37 VAL B O 273 C CB . VAL A 37 ? 0.3611 0.4856 0.2647 -0.1345 -0.0107 0.0475 37 VAL B CB 274 C CG1 . VAL A 37 ? 0.3917 0.5362 0.2682 -0.1565 -0.0096 0.0529 37 VAL B CG1 275 C CG2 . VAL A 37 ? 0.3610 0.4958 0.2642 -0.1383 -0.0188 0.0500 37 VAL B CG2 276 N N . ARG A 38 ? 0.3630 0.4971 0.2941 -0.1298 -0.0135 0.0837 38 ARG B N 277 C CA . ARG A 38 ? 0.3719 0.5065 0.3003 -0.1365 -0.0057 0.0863 38 ARG B CA 278 C C . ARG A 38 ? 0.4040 0.5629 0.2993 -0.1604 -0.0034 0.0937 38 ARG B C 279 O O . ARG A 38 ? 0.4118 0.5906 0.2897 -0.1730 -0.0140 0.1055 38 ARG B O 280 C CB . ARG A 38 ? 0.3685 0.4945 0.3251 -0.1282 -0.0116 0.1065 38 ARG B CB 281 C CG . ARG A 38 ? 0.3858 0.5288 0.3452 -0.1358 -0.0234 0.1400 38 ARG B CG 282 C CD . ARG A 38 ? 0.3873 0.5099 0.3798 -0.1254 -0.0259 0.1573 38 ARG B CD 283 N NE . ARG A 38 ? 0.4106 0.5472 0.4141 -0.1297 -0.0382 0.1955 38 ARG B NE 284 C CZ . ARG A 38 ? 0.4242 0.5412 0.4585 -0.1226 -0.0409 0.2183 38 ARG B CZ 285 N NH1 . ARG A 38 ? 0.4213 0.5029 0.4737 -0.1141 -0.0316 0.2023 38 ARG B NH1 286 N NH2 . ARG A 38 ? 0.4461 0.5784 0.4942 -0.1255 -0.0539 0.2587 38 ARG B NH2 287 N N . GLN A 39 ? 0.4239 0.5854 0.3109 -0.1691 0.0101 0.0881 39 GLN B N 288 C CA . GLN A 39 ? 0.4702 0.6534 0.3177 -0.1953 0.0192 0.0866 39 GLN B CA 289 C C . GLN A 39 ? 0.4955 0.6898 0.3442 -0.2053 0.0257 0.1023 39 GLN B C 290 O O . GLN A 39 ? 0.4857 0.6692 0.3607 -0.1943 0.0363 0.0944 39 GLN B O 291 C CB . GLN A 39 ? 0.4780 0.6510 0.3077 -0.1982 0.0404 0.0499 39 GLN B CB 292 C CG . GLN A 39 ? 0.5160 0.7021 0.3157 -0.2193 0.0637 0.0359 39 GLN B CG 293 C CD . GLN A 39 ? 0.5409 0.7146 0.3132 -0.2280 0.0821 0.0010 39 GLN B CD 294 O OE1 . GLN A 39 ? 0.5276 0.6762 0.3244 -0.2082 0.0932 -0.0205 39 GLN B OE1 295 N NE2 . GLN A 39 ? 0.5837 0.7733 0.3047 -0.2594 0.0836 -0.0027 39 GLN B NE2 296 N N . SER A 40 ? 0.5372 0.7565 0.3580 -0.2288 0.0175 0.1277 40 SER B N 297 C CA . SER A 40 ? 0.5752 0.8087 0.3890 -0.2451 0.0239 0.1469 40 SER B CA 298 C C . SER A 40 ? 0.6337 0.8988 0.3889 -0.2813 0.0306 0.1484 40 SER B C 299 O O . SER A 40 ? 0.6534 0.9322 0.3783 -0.2952 0.0191 0.1495 40 SER B O 300 C CB . SER A 40 ? 0.5761 0.8053 0.4204 -0.2382 0.0024 0.1898 40 SER B CB 301 O OG . SER A 40 ? 0.5841 0.8266 0.4256 -0.2400 -0.0210 0.2168 40 SER B OG 302 N N . PRO A 41 ? 0.6701 0.9501 0.4064 -0.3007 0.0498 0.1479 41 PRO B N 303 C CA . PRO A 41 ? 0.7379 1.0495 0.4094 -0.3405 0.0584 0.1476 41 PRO B CA 304 C C . PRO A 41 ? 0.7741 1.1119 0.4214 -0.3612 0.0250 0.1932 41 PRO B C 305 O O . PRO A 41 ? 0.8164 1.1783 0.4102 -0.3911 0.0213 0.1886 41 PRO B O 306 C CB . PRO A 41 ? 0.7565 1.0818 0.4230 -0.3553 0.0823 0.1497 41 PRO B CB 307 C CG . PRO A 41 ? 0.7112 1.0160 0.4406 -0.3278 0.0732 0.1690 41 PRO B CG 308 C CD . PRO A 41 ? 0.6573 0.9307 0.4275 -0.2920 0.0634 0.1503 41 PRO B CD 309 N N . GLY A 42 ? 0.7703 1.1032 0.4599 -0.3456 0.0009 0.2371 42 GLY B N 310 C CA . GLY A 42 ? 0.8088 1.1684 0.4916 -0.3598 -0.0319 0.2893 42 GLY B CA 311 C C . GLY A 42 ? 0.8042 1.1696 0.4995 -0.3484 -0.0547 0.2926 42 GLY B C 312 O O . GLY A 42 ? 0.8567 1.2604 0.5178 -0.3758 -0.0747 0.3160 42 GLY B O 313 N N . LYS A 43 ? 0.7612 1.0935 0.5042 -0.3114 -0.0522 0.2704 43 LYS B N 314 C CA . LYS A 43 ? 0.7432 1.0812 0.5103 -0.2966 -0.0727 0.2773 43 LYS B CA 315 C C . LYS A 43 ? 0.7147 1.0512 0.4524 -0.3033 -0.0627 0.2328 43 LYS B C 316 O O . LYS A 43 ? 0.7004 1.0476 0.4536 -0.2970 -0.0790 0.2383 43 LYS B O 317 C CB . LYS A 43 ? 0.7164 1.0196 0.5533 -0.2539 -0.0761 0.2831 43 LYS B CB 318 C CG . LYS A 43 ? 0.7481 1.0533 0.6268 -0.2442 -0.0945 0.3363 43 LYS B CG 319 C CD . LYS A 43 ? 0.7754 1.1180 0.6725 -0.2452 -0.1227 0.3755 43 LYS B CD 320 C CE . LYS A 43 ? 0.8339 1.1983 0.7477 -0.2544 -0.1443 0.4387 43 LYS B CE 321 N NZ . LYS A 43 ? 0.8293 1.1559 0.8168 -0.2175 -0.1451 0.4619 43 LYS B NZ 322 N N . GLY A 44 ? 0.7051 1.0280 0.4052 -0.3159 -0.0348 0.1901 44 GLY B N 323 C CA . GLY A 44 ? 0.6826 0.9899 0.3620 -0.3182 -0.0202 0.1447 44 GLY B CA 324 C C . GLY A 44 ? 0.6098 0.8842 0.3432 -0.2785 -0.0207 0.1324 44 GLY B C 325 O O . GLY A 44 ? 0.5754 0.8293 0.3512 -0.2515 -0.0181 0.1393 44 GLY B O 326 N N . LEU A 45 ? 0.5825 0.8530 0.3118 -0.2784 -0.0250 0.1155 45 LEU B N 327 C CA . LEU A 45 ? 0.5196 0.7614 0.2930 -0.2452 -0.0246 0.1038 45 LEU B CA 328 C C . LEU A 45 ? 0.4853 0.7439 0.2987 -0.2299 -0.0487 0.1382 45 LEU B C 329 O O . LEU A 45 ? 0.5086 0.8035 0.3144 -0.2470 -0.0681 0.1633 45 LEU B O 330 C CB . LEU A 45 ? 0.5263 0.7515 0.2796 -0.2519 -0.0148 0.0694 45 LEU B CB 331 C CG . LEU A 45 ? 0.5431 0.7373 0.2774 -0.2534 0.0148 0.0299 45 LEU B CG 332 C CD1 . LEU A 45 ? 0.5684 0.7449 0.2769 -0.2676 0.0236 -0.0003 45 LEU B CD1 333 C CD2 . LEU A 45 ? 0.5026 0.6686 0.2823 -0.2185 0.0240 0.0239 45 LEU B CD2 334 N N . GLU A 46 ? 0.4379 0.6715 0.2956 -0.1983 -0.0463 0.1379 46 GLU B N 335 C CA . GLU A 46 ? 0.4143 0.6570 0.3177 -0.1790 -0.0617 0.1676 46 GLU B CA 336 C C . GLU A 46 ? 0.3750 0.5926 0.3083 -0.1535 -0.0552 0.1485 46 GLU B C 337 O O . GLU A 46 ? 0.3554 0.5407 0.2973 -0.1386 -0.0427 0.1294 46 GLU B O 338 C CB . GLU A 46 ? 0.4194 0.6529 0.3453 -0.1696 -0.0624 0.1911 46 GLU B CB 339 C CG . GLU A 46 ? 0.4220 0.6689 0.3936 -0.1553 -0.0786 0.2312 46 GLU B CG 340 C CD . GLU A 46 ? 0.4446 0.6876 0.4268 -0.1578 -0.0825 0.2624 46 GLU B CD 341 O OE1 . GLU A 46 ? 0.4576 0.6889 0.4121 -0.1707 -0.0715 0.2512 46 GLU B OE1 342 O OE2 . GLU A 46 ? 0.4554 0.7081 0.4779 -0.1466 -0.0959 0.3006 46 GLU B OE2 343 N N . TRP A 47 ? 0.3645 0.6021 0.3128 -0.1515 -0.0644 0.1555 47 TRP B N 344 C CA . TRP A 47 ? 0.3364 0.5561 0.3086 -0.1316 -0.0572 0.1391 47 TRP B CA 345 C C . TRP A 47 ? 0.3240 0.5311 0.3435 -0.1049 -0.0550 0.1527 47 TRP B C 346 O O . TRP A 47 ? 0.3320 0.5610 0.3837 -0.0988 -0.0649 0.1841 47 TRP B O 347 C CB . TRP A 47 ? 0.3368 0.5870 0.3108 -0.1417 -0.0657 0.1428 47 TRP B CB 348 C CG . TRP A 47 ? 0.3168 0.5519 0.3087 -0.1262 -0.0564 0.1260 47 TRP B CG 349 C CD1 . TRP A 47 ? 0.3113 0.5205 0.2789 -0.1301 -0.0463 0.0977 47 TRP B CD1 350 C CD2 . TRP A 47 ? 0.3038 0.5495 0.3424 -0.1051 -0.0545 0.1375 47 TRP B CD2 351 N NE1 . TRP A 47 ? 0.2974 0.5030 0.2873 -0.1164 -0.0403 0.0925 47 TRP B NE1 352 C CE2 . TRP A 47 ? 0.2931 0.5207 0.3259 -0.1008 -0.0429 0.1135 47 TRP B CE2 353 C CE3 . TRP A 47 ? 0.3061 0.5737 0.3939 -0.0888 -0.0596 0.1664 47 TRP B CE3 354 C CZ2 . TRP A 47 ? 0.2864 0.5191 0.3542 -0.0835 -0.0339 0.1135 47 TRP B CZ2 355 C CZ3 . TRP A 47 ? 0.2991 0.5689 0.4293 -0.0676 -0.0486 0.1649 47 TRP B CZ3 356 C CH2 . TRP A 47 ? 0.2885 0.5423 0.4054 -0.0665 -0.0349 0.1369 47 TRP B CH2 357 N N . LEU A 48 ? 0.3099 0.4815 0.3342 -0.0903 -0.0417 0.1293 48 LEU B N 358 C CA . LEU A 48 ? 0.3107 0.4591 0.3699 -0.0697 -0.0349 0.1328 48 LEU B CA 359 C C . LEU A 48 ? 0.3034 0.4474 0.3852 -0.0546 -0.0258 0.1209 48 LEU B C 360 O O . LEU A 48 ? 0.3130 0.4574 0.4358 -0.0379 -0.0212 0.1331 48 LEU B O 361 C CB . LEU A 48 ? 0.3094 0.4232 0.3538 -0.0699 -0.0268 0.1147 48 LEU B CB 362 C CG . LEU A 48 ? 0.3206 0.4376 0.3493 -0.0832 -0.0305 0.1259 48 LEU B CG 363 C CD1 . LEU A 48 ? 0.3185 0.4087 0.3383 -0.0838 -0.0219 0.1058 48 LEU B CD1 364 C CD2 . LEU A 48 ? 0.3406 0.4636 0.3962 -0.0800 -0.0376 0.1592 48 LEU B CD2 365 N N . GLY A 49 ? 0.2921 0.4302 0.3490 -0.0602 -0.0208 0.0974 49 GLY B N 366 C CA . GLY A 49 ? 0.2925 0.4308 0.3643 -0.0505 -0.0108 0.0863 49 GLY B CA 367 C C . GLY A 49 ? 0.2849 0.4189 0.3249 -0.0612 -0.0084 0.0665 49 GLY B C 368 O O . GLY A 49 ? 0.2843 0.4121 0.2948 -0.0737 -0.0138 0.0605 49 GLY B O 369 N N . VAL A 50 ? 0.2877 0.4237 0.3360 -0.0559 0.0019 0.0570 50 VAL B N 370 C CA . VAL A 50 ? 0.2860 0.4182 0.3061 -0.0670 0.0040 0.0431 50 VAL B CA 371 C C . VAL A 50 ? 0.2967 0.4180 0.3180 -0.0609 0.0191 0.0281 50 VAL B C 372 O O . VAL A 50 ? 0.3047 0.4346 0.3573 -0.0483 0.0314 0.0289 50 VAL B O 373 C CB . VAL A 50 ? 0.2843 0.4492 0.3058 -0.0794 -0.0019 0.0531 50 VAL B CB 374 C CG1 . VAL A 50 ? 0.2856 0.4862 0.3504 -0.0696 0.0030 0.0669 50 VAL B CG1 375 C CG2 . VAL A 50 ? 0.2883 0.4435 0.2811 -0.0927 0.0004 0.0412 50 VAL B CG2 376 N N . ILE A 51 ? 0.3046 0.4070 0.2927 -0.0703 0.0193 0.0151 51 ILE B N 377 C CA . ILE A 51 ? 0.3228 0.4223 0.2995 -0.0732 0.0325 0.0020 51 ILE B CA 378 C C . ILE A 51 ? 0.3288 0.4409 0.2864 -0.0878 0.0296 0.0059 51 ILE B C 379 O O . ILE A 51 ? 0.3312 0.4292 0.2649 -0.0975 0.0183 0.0087 51 ILE B O 380 C CB . ILE A 51 ? 0.3378 0.4088 0.2894 -0.0768 0.0338 -0.0127 51 ILE B CB 381 C CG1 . ILE A 51 ? 0.3666 0.4381 0.3015 -0.0836 0.0507 -0.0283 51 ILE B CG1 382 C CG2 . ILE A 51 ? 0.3306 0.3893 0.2563 -0.0866 0.0172 -0.0082 51 ILE B CG2 383 C CD1 . ILE A 51 ? 0.3941 0.4407 0.3115 -0.0875 0.0575 -0.0471 51 ILE B CD1 384 N N . TRP A 52 ? 0.3359 0.4743 0.3091 -0.0887 0.0417 0.0069 52 TRP B N 385 C CA . TRP A 52 ? 0.3420 0.4956 0.3017 -0.1051 0.0407 0.0124 52 TRP B CA 386 C C . TRP A 52 ? 0.3692 0.5054 0.2910 -0.1173 0.0454 0.0041 52 TRP B C 387 O O . TRP A 52 ? 0.3865 0.5083 0.2956 -0.1139 0.0527 -0.0083 52 TRP B O 388 C CB . TRP A 52 ? 0.3397 0.5355 0.3356 -0.1028 0.0530 0.0182 52 TRP B CB 389 C CG . TRP A 52 ? 0.3209 0.5414 0.3569 -0.0924 0.0444 0.0331 52 TRP B CG 390 C CD1 . TRP A 52 ? 0.3181 0.5525 0.3980 -0.0716 0.0526 0.0376 52 TRP B CD1 391 C CD2 . TRP A 52 ? 0.3083 0.5418 0.3423 -0.1048 0.0253 0.0470 52 TRP B CD2 392 N NE1 . TRP A 52 ? 0.3030 0.5634 0.4095 -0.0703 0.0366 0.0588 52 TRP B NE1 393 C CE2 . TRP A 52 ? 0.2978 0.5596 0.3728 -0.0926 0.0199 0.0629 52 TRP B CE2 394 C CE3 . TRP A 52 ? 0.3115 0.5333 0.3127 -0.1264 0.0136 0.0471 52 TRP B CE3 395 C CZ2 . TRP A 52 ? 0.2933 0.5778 0.3704 -0.1053 0.0011 0.0791 52 TRP B CZ2 396 C CZ3 . TRP A 52 ? 0.3098 0.5486 0.3132 -0.1386 -0.0010 0.0574 52 TRP B CZ3 397 C CH2 . TRP A 52 ? 0.3005 0.5729 0.3380 -0.1298 -0.0082 0.0733 52 TRP B CH2 398 N N . SER A 53 ? 0.3799 0.5163 0.2816 -0.1344 0.0399 0.0124 53 SER B N 399 C CA . SER A 53 ? 0.4092 0.5309 0.2734 -0.1488 0.0401 0.0124 53 SER B CA 400 C C . SER A 53 ? 0.4349 0.5723 0.2891 -0.1530 0.0611 -0.0002 53 SER B C 401 O O . SER A 53 ? 0.4640 0.5876 0.2838 -0.1621 0.0611 -0.0056 53 SER B O 402 C CB . SER A 53 ? 0.4187 0.5388 0.2701 -0.1671 0.0336 0.0266 53 SER B CB 403 O OG . SER A 53 ? 0.4206 0.5747 0.2916 -0.1740 0.0452 0.0282 53 SER B OG 404 N N . GLY A 54 ? 0.4327 0.6020 0.3171 -0.1481 0.0798 -0.0047 54 GLY B N 405 C CA . GLY A 54 ? 0.4603 0.6449 0.3415 -0.1494 0.1076 -0.0220 54 GLY B CA 406 C C . GLY A 54 ? 0.4696 0.6359 0.3578 -0.1332 0.1192 -0.0428 54 GLY B C 407 O O . GLY A 54 ? 0.5032 0.6736 0.3847 -0.1350 0.1459 -0.0633 54 GLY B O 408 N N . GLY A 55 ? 0.4443 0.5896 0.3468 -0.1191 0.1024 -0.0391 55 GLY B N 409 C CA . GLY A 55 ? 0.4567 0.5759 0.3576 -0.1098 0.1086 -0.0568 55 GLY B CA 410 C C . GLY A 55 ? 0.4501 0.5743 0.4058 -0.0852 0.1240 -0.0611 55 GLY B C 411 O O . GLY A 55 ? 0.4673 0.5650 0.4264 -0.0774 0.1330 -0.0770 55 GLY B O 412 N N . SER A 56 ? 0.4306 0.5884 0.4314 -0.0743 0.1255 -0.0446 56 SER B N 413 C CA . SER A 56 ? 0.4222 0.5884 0.4831 -0.0491 0.1329 -0.0381 56 SER B CA 414 C C . SER A 56 ? 0.3960 0.5526 0.4633 -0.0445 0.1043 -0.0183 56 SER B C 415 O O . SER A 56 ? 0.3791 0.5308 0.4131 -0.0592 0.0828 -0.0104 56 SER B O 416 C CB . SER A 56 ? 0.4143 0.6304 0.5280 -0.0399 0.1459 -0.0251 56 SER B CB 417 O OG . SER A 56 ? 0.3876 0.6345 0.4955 -0.0550 0.1249 -0.0041 56 SER B OG 418 N N . THR A 57 ? 0.3976 0.5497 0.5087 -0.0244 0.1066 -0.0105 57 THR B N 419 C CA . THR A 57 ? 0.3799 0.5215 0.4945 -0.0215 0.0834 0.0069 57 THR B CA 420 C C . THR A 57 ? 0.3694 0.5478 0.5395 -0.0079 0.0761 0.0361 57 THR B C 421 O O . THR A 57 ? 0.3715 0.5804 0.5878 0.0045 0.0912 0.0420 57 THR B O 422 C CB . THR A 57 ? 0.4001 0.4968 0.5085 -0.0154 0.0886 -0.0067 57 THR B CB 423 O OG1 . THR A 57 ? 0.4304 0.5161 0.5724 0.0002 0.1171 -0.0211 57 THR B OG1 424 C CG2 . THR A 57 ? 0.4100 0.4788 0.4604 -0.0345 0.0844 -0.0274 57 THR B CG2 425 N N . ASP A 58 ? 0.3535 0.5347 0.5182 -0.0128 0.0523 0.0558 58 ASP B N 426 C CA . ASP A 58 ? 0.3471 0.5607 0.5592 -0.0029 0.0405 0.0882 58 ASP B CA 427 C C . ASP A 58 ? 0.3426 0.5325 0.5389 -0.0058 0.0244 0.0987 58 ASP B C 428 O O . ASP A 58 ? 0.3322 0.5019 0.4802 -0.0215 0.0158 0.0868 58 ASP B O 429 C CB . ASP A 58 ? 0.3332 0.5988 0.5477 -0.0183 0.0247 0.1066 58 ASP B CB 430 C CG . ASP A 58 ? 0.3389 0.6422 0.5879 -0.0137 0.0408 0.1052 58 ASP B CG 431 O OD1 . ASP A 58 ? 0.3507 0.6761 0.6631 0.0088 0.0542 0.1174 58 ASP B OD1 432 O OD2 . ASP A 58 ? 0.3348 0.6469 0.5514 -0.0327 0.0414 0.0934 58 ASP B OD2 433 N N . TYR A 59 ? 0.3542 0.5483 0.5955 0.0096 0.0217 0.1233 59 TYR B N 434 C CA . TYR A 59 ? 0.3615 0.5307 0.5923 0.0072 0.0104 0.1348 59 TYR B CA 435 C C . TYR A 59 ? 0.3624 0.5700 0.6227 0.0067 -0.0100 0.1774 59 TYR B C 436 O O . TYR A 59 ? 0.3669 0.6084 0.6828 0.0215 -0.0102 0.2018 59 TYR B O 437 C CB . TYR A 59 ? 0.3890 0.5107 0.6431 0.0247 0.0291 0.1234 59 TYR B CB 438 C CG . TYR A 59 ? 0.3979 0.4819 0.6176 0.0202 0.0476 0.0820 59 TYR B CG 439 C CD1 . TYR A 59 ? 0.3853 0.4520 0.5495 0.0009 0.0390 0.0644 59 TYR B CD1 440 C CD2 . TYR A 59 ? 0.4238 0.4921 0.6676 0.0343 0.0744 0.0613 59 TYR B CD2 441 C CE1 . TYR A 59 ? 0.3956 0.4345 0.5281 -0.0062 0.0513 0.0321 59 TYR B CE1 442 C CE2 . TYR A 59 ? 0.4366 0.4739 0.6402 0.0243 0.0898 0.0239 59 TYR B CE2 443 C CZ . TYR A 59 ? 0.4234 0.4479 0.5709 0.0031 0.0755 0.0120 59 TYR B CZ 444 O OH . TYR A 59 ? 0.4431 0.4435 0.5508 -0.0097 0.0858 -0.0192 59 TYR B OH 445 N N . ASN A 60 ? 0.3604 0.5653 0.5849 -0.0108 -0.0267 0.1874 60 ASN B N 446 C CA . ASN A 60 ? 0.3735 0.6081 0.6159 -0.0156 -0.0466 0.2288 60 ASN B CA 447 C C . ASN A 60 ? 0.4011 0.6206 0.7088 0.0115 -0.0396 0.2534 60 ASN B C 448 O O . ASN A 60 ? 0.4177 0.5853 0.7278 0.0218 -0.0239 0.2364 60 ASN B O 449 C CB . ASN A 60 ? 0.3745 0.5945 0.5649 -0.0375 -0.0561 0.2272 60 ASN B CB 450 C CG . ASN A 60 ? 0.3873 0.6458 0.5802 -0.0517 -0.0787 0.2700 60 ASN B CG 451 O OD1 . ASN A 60 ? 0.3970 0.6829 0.6418 -0.0391 -0.0881 0.3069 60 ASN B OD1 452 N ND2 . ASN A 60 ? 0.3924 0.6565 0.5306 -0.0788 -0.0868 0.2664 60 ASN B ND2 453 N N . ALA A 61 ? 0.4159 0.6806 0.7788 0.0219 -0.0515 0.2942 61 ALA B N 454 C CA . ALA A 61 ? 0.4473 0.6993 0.8874 0.0533 -0.0422 0.3205 61 ALA B CA 455 C C . ALA A 61 ? 0.4787 0.6786 0.9160 0.0556 -0.0407 0.3298 61 ALA B C 456 O O . ALA A 61 ? 0.5080 0.6603 0.9867 0.0792 -0.0195 0.3226 61 ALA B O 457 C CB . ALA A 61 ? 0.4550 0.7748 0.9548 0.0597 -0.0638 0.3748 61 ALA B CB 458 N N . ALA A 62 ? 0.4812 0.6882 0.8672 0.0286 -0.0606 0.3427 62 ALA B N 459 C CA . ALA A 62 ? 0.5104 0.6760 0.8900 0.0249 -0.0615 0.3559 62 ALA B CA 460 C C . ALA A 62 ? 0.5146 0.6145 0.8663 0.0253 -0.0379 0.3083 62 ALA B C 461 O O . ALA A 62 ? 0.5411 0.6003 0.8967 0.0239 -0.0346 0.3161 62 ALA B O 462 C CB . ALA A 62 ? 0.5120 0.7098 0.8386 -0.0078 -0.0856 0.3785 62 ALA B CB 463 N N . PHE A 63 ? 0.4919 0.5838 0.8152 0.0243 -0.0235 0.2621 63 PHE B N 464 C CA . PHE A 63 ? 0.4916 0.5310 0.7852 0.0204 -0.0054 0.2189 63 PHE B CA 465 C C . PHE A 63 ? 0.5101 0.5176 0.8306 0.0401 0.0204 0.1879 63 PHE B C 466 O O . PHE A 63 ? 0.5276 0.4892 0.8270 0.0351 0.0352 0.1545 63 PHE B O 467 C CB . PHE A 63 ? 0.4582 0.5126 0.6877 -0.0025 -0.0116 0.1923 63 PHE B CB 468 C CG . PHE A 63 ? 0.4526 0.5270 0.6501 -0.0241 -0.0287 0.2126 63 PHE B CG 469 C CD1 . PHE A 63 ? 0.4485 0.5720 0.6411 -0.0340 -0.0467 0.2422 63 PHE B CD1 470 C CD2 . PHE A 63 ? 0.4603 0.5073 0.6328 -0.0372 -0.0259 0.2022 63 PHE B CD2 471 C CE1 . PHE A 63 ? 0.4534 0.5951 0.6096 -0.0576 -0.0589 0.2574 63 PHE B CE1 472 C CE2 . PHE A 63 ? 0.4594 0.5270 0.6028 -0.0578 -0.0369 0.2190 63 PHE B CE2 473 C CZ . PHE A 63 ? 0.4574 0.5707 0.5895 -0.0684 -0.0521 0.2450 63 PHE B CZ 474 N N . ILE A 64 ? 0.5140 0.5484 0.8812 0.0601 0.0269 0.1988 64 ILE B N 475 C CA . ILE A 64 ? 0.5307 0.5423 0.9179 0.0765 0.0564 0.1640 64 ILE B CA 476 C C . ILE A 64 ? 0.5721 0.5129 0.9695 0.0833 0.0802 0.1397 64 ILE B C 477 O O . ILE A 64 ? 0.5875 0.4996 0.9576 0.0784 0.1012 0.0955 64 ILE B O 478 C CB . ILE A 64 ? 0.5338 0.5896 0.9861 0.1006 0.0633 0.1843 64 ILE B CB 479 C CG1 . ILE A 64 ? 0.5088 0.5908 0.9325 0.0935 0.0738 0.1521 64 ILE B CG1 480 C CG2 . ILE A 64 ? 0.5811 0.6025 1.1091 0.1328 0.0909 0.1878 64 ILE B CG2 481 C CD1 . ILE A 64 ? 0.4980 0.6407 0.9758 0.1081 0.0744 0.1744 64 ILE B CD1 482 N N . SER A 65 ? 0.5965 0.5082 1.0251 0.0891 0.0756 0.1677 65 SER B N 483 C CA . SER A 65 ? 0.6475 0.4862 1.0925 0.0946 0.0998 0.1461 65 SER B CA 484 C C . SER A 65 ? 0.6477 0.4496 1.0256 0.0647 0.0995 0.1096 65 SER B C 485 O O . SER A 65 ? 0.6951 0.4366 1.0732 0.0616 0.1207 0.0808 65 SER B O 486 C CB . SER A 65 ? 0.6812 0.4997 1.1832 0.1085 0.0930 0.1934 65 SER B CB 487 O OG . SER A 65 ? 0.6671 0.4922 1.1310 0.0838 0.0666 0.2167 65 SER B OG 488 N N . ARG A 66 ? 0.5989 0.4366 0.9231 0.0420 0.0762 0.1112 66 ARG B N 489 C CA . ARG A 66 ? 0.5986 0.4108 0.8712 0.0150 0.0726 0.0855 66 ARG B CA 490 C C . ARG A 66 ? 0.5494 0.3971 0.7653 -0.0033 0.0607 0.0650 66 ARG B C 491 O O . ARG A 66 ? 0.5456 0.3853 0.7256 -0.0246 0.0534 0.0515 66 ARG B O 492 C CB . ARG A 66 ? 0.6119 0.4134 0.8913 0.0046 0.0578 0.1179 66 ARG B CB 493 C CG . ARG A 66 ? 0.5838 0.4385 0.8663 0.0042 0.0341 0.1621 66 ARG B CG 494 C CD . ARG A 66 ? 0.5964 0.4436 0.8663 -0.0153 0.0217 0.1850 66 ARG B CD 495 N NE . ARG A 66 ? 0.5644 0.4677 0.8102 -0.0265 0.0012 0.2113 66 ARG B NE 496 C CZ . ARG A 66 ? 0.5541 0.4719 0.7664 -0.0496 -0.0080 0.2174 66 ARG B CZ 497 N NH1 . ARG A 66 ? 0.5705 0.4570 0.7711 -0.0648 -0.0018 0.2012 66 ARG B NH1 498 N NH2 . ARG A 66 ? 0.5346 0.5016 0.7240 -0.0596 -0.0221 0.2373 66 ARG B NH2 499 N N . LEU A 67 ? 0.5164 0.4018 0.7292 0.0050 0.0602 0.0629 67 LEU B N 500 C CA . LEU A 67 ? 0.4778 0.3947 0.6438 -0.0099 0.0487 0.0495 67 LEU B CA 501 C C . LEU A 67 ? 0.4765 0.3959 0.6285 -0.0076 0.0634 0.0203 67 LEU B C 502 O O . LEU A 67 ? 0.4781 0.4111 0.6608 0.0091 0.0750 0.0243 67 LEU B O 503 C CB . LEU A 67 ? 0.4446 0.4109 0.6110 -0.0093 0.0303 0.0789 67 LEU B CB 504 C CG . LEU A 67 ? 0.4111 0.4050 0.5334 -0.0237 0.0200 0.0670 67 LEU B CG 505 C CD1 . LEU A 67 ? 0.4145 0.3886 0.5036 -0.0394 0.0182 0.0461 67 LEU B CD1 506 C CD2 . LEU A 67 ? 0.3937 0.4259 0.5063 -0.0310 0.0035 0.0902 67 LEU B CD2 507 N N . SER A 68 ? 0.4730 0.3850 0.5804 -0.0257 0.0619 -0.0056 68 SER B N 508 C CA . SER A 68 ? 0.4778 0.3983 0.5613 -0.0293 0.0721 -0.0292 68 SER B CA 509 C C . SER A 68 ? 0.4462 0.3894 0.4871 -0.0462 0.0541 -0.0311 68 SER B C 510 O O . SER A 68 ? 0.4462 0.3835 0.4695 -0.0591 0.0412 -0.0306 68 SER B O 511 C CB . SER A 68 ? 0.5296 0.4090 0.6036 -0.0353 0.0949 -0.0628 68 SER B CB 512 O OG . SER A 68 ? 0.5487 0.4041 0.5939 -0.0565 0.0861 -0.0749 68 SER B OG 513 N N . ILE A 69 ? 0.4270 0.3975 0.4580 -0.0450 0.0538 -0.0300 69 ILE B N 514 C CA . ILE A 69 ? 0.4082 0.3954 0.4037 -0.0587 0.0397 -0.0306 69 ILE B CA 515 C C . ILE A 69 ? 0.4296 0.4151 0.3975 -0.0681 0.0511 -0.0512 69 ILE B C 516 O O . ILE A 69 ? 0.4443 0.4337 0.4254 -0.0603 0.0700 -0.0591 69 ILE B O 517 C CB . ILE A 69 ? 0.3815 0.3994 0.3848 -0.0540 0.0298 -0.0105 69 ILE B CB 518 C CG1 . ILE A 69 ? 0.3688 0.3920 0.3916 -0.0493 0.0195 0.0094 69 ILE B CG1 519 C CG2 . ILE A 69 ? 0.3712 0.3977 0.3429 -0.0663 0.0185 -0.0114 69 ILE B CG2 520 C CD1 . ILE A 69 ? 0.3565 0.4100 0.3923 -0.0460 0.0136 0.0283 69 ILE B CD1 521 N N . SER A 70 ? 0.4345 0.4179 0.3658 -0.0857 0.0402 -0.0579 70 SER B N 522 C CA . SER A 70 ? 0.4615 0.4470 0.3578 -0.1002 0.0480 -0.0736 70 SER B CA 523 C C . SER A 70 ? 0.4553 0.4541 0.3229 -0.1144 0.0264 -0.0616 70 SER B C 524 O O . SER A 70 ? 0.4287 0.4337 0.3097 -0.1092 0.0101 -0.0445 70 SER B O 525 C CB . SER A 70 ? 0.5072 0.4661 0.3853 -0.1125 0.0628 -0.1010 70 SER B CB 526 O OG . SER A 70 ? 0.5137 0.4608 0.3820 -0.1251 0.0463 -0.1008 70 SER B OG 527 N N . LYS A 71 ? 0.4870 0.4908 0.3169 -0.1322 0.0274 -0.0691 71 LYS B N 528 C CA . LYS A 71 ? 0.4843 0.5014 0.2935 -0.1438 0.0052 -0.0505 71 LYS B CA 529 C C . LYS A 71 ? 0.5319 0.5547 0.2928 -0.1700 0.0018 -0.0560 71 LYS B C 530 O O . LYS A 71 ? 0.5645 0.5822 0.3005 -0.1814 0.0216 -0.0788 71 LYS B O 531 C CB . LYS A 71 ? 0.4556 0.4849 0.2788 -0.1333 0.0033 -0.0327 71 LYS B CB 532 C CG . LYS A 71 ? 0.4704 0.5092 0.2845 -0.1360 0.0224 -0.0400 71 LYS B CG 533 C CD . LYS A 71 ? 0.4534 0.5037 0.2729 -0.1347 0.0162 -0.0209 71 LYS B CD 534 C CE . LYS A 71 ? 0.4600 0.5268 0.2788 -0.1379 0.0358 -0.0261 71 LYS B CE 535 N NZ . LYS A 71 ? 0.4509 0.5259 0.2667 -0.1446 0.0283 -0.0077 71 LYS B NZ 536 N N . ASP A 72 ? 0.5351 0.5697 0.2849 -0.1795 -0.0228 -0.0332 72 ASP B N 537 C CA . ASP A 72 ? 0.5792 0.6261 0.2827 -0.2067 -0.0338 -0.0267 72 ASP B CA 538 C C . ASP A 72 ? 0.5646 0.6215 0.2723 -0.2034 -0.0477 0.0043 72 ASP B C 539 O O . ASP A 72 ? 0.5473 0.6084 0.2770 -0.1968 -0.0697 0.0290 72 ASP B O 540 C CB . ASP A 72 ? 0.6059 0.6594 0.2954 -0.2255 -0.0556 -0.0240 72 ASP B CB 541 C CG . ASP A 72 ? 0.6618 0.7355 0.3022 -0.2572 -0.0740 -0.0093 72 ASP B CG 542 O OD1 . ASP A 72 ? 0.6753 0.7572 0.3014 -0.2602 -0.0759 0.0092 72 ASP B OD1 543 O OD2 . ASP A 72 ? 0.7030 0.7860 0.3165 -0.2828 -0.0878 -0.0146 72 ASP B OD2 544 N N . ASN A 73 ? 0.5723 0.6320 0.2627 -0.2080 -0.0326 0.0030 73 ASN B N 545 C CA . ASN A 73 ? 0.5656 0.6279 0.2605 -0.2066 -0.0418 0.0306 73 ASN B CA 546 C C . ASN A 73 ? 0.5908 0.6604 0.2725 -0.2199 -0.0709 0.0623 73 ASN B C 547 O O . ASN A 73 ? 0.5750 0.6372 0.2884 -0.2058 -0.0846 0.0869 73 ASN B O 548 C CB . ASN A 73 ? 0.5862 0.6563 0.2555 -0.2189 -0.0212 0.0240 73 ASN B CB 549 C CG . ASN A 73 ? 0.5543 0.6236 0.2567 -0.2001 0.0016 0.0083 73 ASN B CG 550 O OD1 . ASN A 73 ? 0.5201 0.5813 0.2612 -0.1796 -0.0020 0.0115 73 ASN B OD1 551 N ND2 . ASN A 73 ? 0.5744 0.6562 0.2620 -0.2086 0.0258 -0.0074 73 ASN B ND2 552 N N . SER A 74 ? 0.6343 0.7186 0.2714 -0.2473 -0.0800 0.0622 74 SER B N 553 C CA . SER A 74 ? 0.6668 0.7660 0.2901 -0.2636 -0.1114 0.1000 74 SER B CA 554 C C . SER A 74 ? 0.6420 0.7454 0.3120 -0.2472 -0.1359 0.1197 74 SER B C 555 O O . SER A 74 ? 0.6531 0.7635 0.3430 -0.2443 -0.1593 0.1582 74 SER B O 556 C CB . SER A 74 ? 0.7284 0.8483 0.2864 -0.3030 -0.1175 0.0948 74 SER B CB 557 O OG . SER A 74 ? 0.7362 0.8607 0.2884 -0.3112 -0.1212 0.0721 74 SER B OG 558 N N . LYS A 75 ? 0.6156 0.7159 0.3067 -0.2367 -0.1293 0.0951 75 LYS B N 559 C CA . LYS A 75 ? 0.5898 0.6983 0.3292 -0.2213 -0.1475 0.1103 75 LYS B CA 560 C C . LYS A 75 ? 0.5369 0.6259 0.3305 -0.1867 -0.1344 0.1084 75 LYS B C 561 O O . LYS A 75 ? 0.5179 0.6130 0.3547 -0.1715 -0.1424 0.1166 75 LYS B O 562 C CB . LYS A 75 ? 0.6023 0.7201 0.3307 -0.2356 -0.1491 0.0868 75 LYS B CB 563 C CG . LYS A 75 ? 0.6653 0.8068 0.3393 -0.2755 -0.1679 0.0917 75 LYS B CG 564 C CD . LYS A 75 ? 0.6767 0.8409 0.3629 -0.2895 -0.1894 0.0939 75 LYS B CD 565 C CE . LYS A 75 ? 0.7464 0.9325 0.3678 -0.3365 -0.2051 0.0890 75 LYS B CE 566 N NZ . LYS A 75 ? 0.7903 0.9997 0.3788 -0.3558 -0.2266 0.1253 75 LYS B NZ 567 N N . SER A 76 ? 0.5203 0.5894 0.3097 -0.1774 -0.1138 0.0975 76 SER B N 568 C CA . SER A 76 ? 0.4809 0.5318 0.3096 -0.1518 -0.1003 0.0924 76 SER B CA 569 C C . SER A 76 ? 0.4486 0.4994 0.3030 -0.1387 -0.0920 0.0724 76 SER B C 570 O O . SER A 76 ? 0.4214 0.4668 0.3130 -0.1206 -0.0893 0.0754 76 SER B O 571 C CB . SER A 76 ? 0.4831 0.5246 0.3459 -0.1379 -0.1103 0.1208 76 SER B CB 572 O OG . SER A 76 ? 0.5134 0.5508 0.3544 -0.1506 -0.1184 0.1436 76 SER B OG 573 N N . HIS A 77 ? 0.4548 0.5085 0.2873 -0.1494 -0.0845 0.0504 77 HIS B N 574 C CA . HIS A 77 ? 0.4357 0.4874 0.2886 -0.1418 -0.0783 0.0343 77 HIS B CA 575 C C . HIS A 77 ? 0.4181 0.4563 0.2700 -0.1338 -0.0557 0.0129 77 HIS B C 576 O O . HIS A 77 ? 0.4371 0.4721 0.2636 -0.1423 -0.0439 0.0000 77 HIS B O 577 C CB . HIS A 77 ? 0.4650 0.5266 0.2997 -0.1621 -0.0885 0.0267 77 HIS B CB 578 C CG . HIS A 77 ? 0.4769 0.5622 0.3263 -0.1696 -0.1145 0.0507 77 HIS B CG 579 N ND1 . HIS A 77 ? 0.4548 0.5490 0.3513 -0.1504 -0.1219 0.0709 77 HIS B ND1 580 C CD2 . HIS A 77 ? 0.5136 0.6192 0.3398 -0.1952 -0.1345 0.0580 77 HIS B CD2 581 C CE1 . HIS A 77 ? 0.4705 0.5921 0.3804 -0.1602 -0.1457 0.0930 77 HIS B CE1 582 N NE2 . HIS A 77 ? 0.5063 0.6373 0.3722 -0.1891 -0.1564 0.0871 77 HIS B NE2 583 N N . VAL A 78 ? 0.3863 0.4199 0.2680 -0.1181 -0.0492 0.0106 78 VAL B N 584 C CA . VAL A 78 ? 0.3737 0.3994 0.2617 -0.1105 -0.0323 -0.0035 78 VAL B CA 585 C C . VAL A 78 ? 0.3696 0.3905 0.2734 -0.1096 -0.0322 -0.0097 78 VAL B C 586 O O . VAL A 78 ? 0.3617 0.3895 0.2830 -0.1077 -0.0416 -0.0006 78 VAL B O 587 C CB . VAL A 78 ? 0.3515 0.3785 0.2555 -0.0982 -0.0260 0.0027 78 VAL B CB 588 C CG1 . VAL A 78 ? 0.3459 0.3729 0.2608 -0.0912 -0.0125 -0.0050 78 VAL B CG1 589 C CG2 . VAL A 78 ? 0.3585 0.3870 0.2479 -0.1028 -0.0275 0.0104 78 VAL B CG2 590 N N . PHE A 79 ? 0.3829 0.3912 0.2832 -0.1114 -0.0197 -0.0251 79 PHE B N 591 C CA . PHE A 79 ? 0.3908 0.3873 0.3037 -0.1142 -0.0185 -0.0317 79 PHE B CA 592 C C . PHE A 79 ? 0.3806 0.3689 0.3190 -0.0989 -0.0064 -0.0292 79 PHE B C 593 O O . PHE A 79 ? 0.3863 0.3687 0.3277 -0.0916 0.0072 -0.0356 79 PHE B O 594 C CB . PHE A 79 ? 0.4320 0.4129 0.3195 -0.1318 -0.0129 -0.0526 79 PHE B CB 595 C CG . PHE A 79 ? 0.4519 0.4470 0.3077 -0.1523 -0.0282 -0.0514 79 PHE B CG 596 C CD1 . PHE A 79 ? 0.4425 0.4565 0.3078 -0.1590 -0.0498 -0.0351 79 PHE B CD1 597 C CD2 . PHE A 79 ? 0.4830 0.4768 0.3020 -0.1656 -0.0212 -0.0640 79 PHE B CD2 598 C CE1 . PHE A 79 ? 0.4616 0.4944 0.3034 -0.1778 -0.0681 -0.0268 79 PHE B CE1 599 C CE2 . PHE A 79 ? 0.5071 0.5178 0.2933 -0.1882 -0.0388 -0.0577 79 PHE B CE2 600 C CZ . PHE A 79 ? 0.4958 0.5267 0.2951 -0.1936 -0.0643 -0.0366 79 PHE B CZ 601 N N . PHE A 80 ? 0.3673 0.3598 0.3263 -0.0947 -0.0116 -0.0174 80 PHE B N 602 C CA . PHE A 80 ? 0.3643 0.3512 0.3462 -0.0845 -0.0044 -0.0091 80 PHE B CA 603 C C . PHE A 80 ? 0.3992 0.3641 0.3906 -0.0917 -0.0015 -0.0143 80 PHE B C 604 O O . PHE A 80 ? 0.4046 0.3714 0.3921 -0.1047 -0.0100 -0.0162 80 PHE B O 605 C CB . PHE A 80 ? 0.3358 0.3418 0.3265 -0.0808 -0.0105 0.0068 80 PHE B CB 606 C CG . PHE A 80 ? 0.3340 0.3400 0.3429 -0.0761 -0.0072 0.0207 80 PHE B CG 607 C CD1 . PHE A 80 ? 0.3445 0.3412 0.3651 -0.0821 -0.0076 0.0258 80 PHE B CD1 608 C CD2 . PHE A 80 ? 0.3250 0.3439 0.3393 -0.0687 -0.0057 0.0321 80 PHE B CD2 609 C CE1 . PHE A 80 ? 0.3485 0.3461 0.3841 -0.0799 -0.0062 0.0441 80 PHE B CE1 610 C CE2 . PHE A 80 ? 0.3299 0.3544 0.3595 -0.0670 -0.0066 0.0511 80 PHE B CE2 611 C CZ . PHE A 80 ? 0.3408 0.3532 0.3804 -0.0720 -0.0066 0.0581 80 PHE B CZ 612 N N . LYS A 81 ? 0.4307 0.3753 0.4396 -0.0834 0.0103 -0.0145 81 LYS B N 613 C CA . LYS A 81 ? 0.4749 0.3887 0.4942 -0.0908 0.0160 -0.0206 81 LYS B CA 614 C C . LYS A 81 ? 0.4880 0.3874 0.5411 -0.0759 0.0244 -0.0036 81 LYS B C 615 O O . LYS A 81 ? 0.4964 0.3926 0.5659 -0.0601 0.0353 -0.0025 81 LYS B O 616 C CB . LYS A 81 ? 0.5246 0.4130 0.5234 -0.1018 0.0264 -0.0496 81 LYS B CB 617 C CG . LYS A 81 ? 0.5821 0.4259 0.5964 -0.1041 0.0420 -0.0615 81 LYS B CG 618 C CD . LYS A 81 ? 0.6365 0.4556 0.6190 -0.1251 0.0507 -0.0952 81 LYS B CD 619 C CE . LYS A 81 ? 0.6982 0.4636 0.6983 -0.1224 0.0756 -0.1138 81 LYS B CE 620 N NZ . LYS A 81 ? 0.7019 0.4466 0.7389 -0.1167 0.0733 -0.0918 81 LYS B NZ 621 N N . MET A 82 ? 0.4987 0.3926 0.5653 -0.0816 0.0190 0.0128 82 MET B N 622 C CA . MET A 82 ? 0.5210 0.4037 0.6200 -0.0701 0.0227 0.0374 82 MET B CA 623 C C . MET A 82 ? 0.5552 0.3976 0.6679 -0.0809 0.0277 0.0373 82 MET B C 624 O O . MET A 82 ? 0.5498 0.3953 0.6490 -0.1004 0.0203 0.0343 82 MET B O 625 C CB . MET A 82 ? 0.5040 0.4243 0.6026 -0.0703 0.0099 0.0657 82 MET B CB 626 C CG . MET A 82 ? 0.5290 0.4511 0.6574 -0.0592 0.0087 0.0985 82 MET B CG 627 S SD . MET A 82 ? 0.5241 0.4994 0.6377 -0.0635 -0.0056 0.1254 82 MET B SD 628 C CE . MET A 82 ? 0.5254 0.5034 0.6266 -0.0846 -0.0095 0.1373 82 MET B CE 629 N N . ASN A 83 A 0.5875 0.3936 0.7321 -0.0680 0.0407 0.0432 82 ASN B N 630 C CA . ASN A 83 A 0.6347 0.3909 0.7949 -0.0783 0.0487 0.0414 82 ASN B CA 631 C C . ASN A 83 A 0.6324 0.3943 0.8167 -0.0777 0.0391 0.0837 82 ASN B C 632 O O . ASN A 83 A 0.5981 0.4010 0.7872 -0.0677 0.0283 0.1120 82 ASN B O 633 C CB . ASN A 83 A 0.6884 0.3936 0.8749 -0.0633 0.0725 0.0238 82 ASN B CB 634 C CG . ASN A 83 A 0.7082 0.4010 0.8623 -0.0724 0.0854 -0.0220 82 ASN B CG 635 O OD1 . ASN A 83 A 0.7122 0.4186 0.8262 -0.0968 0.0748 -0.0403 82 ASN B OD1 636 N ND2 . ASN A 83 A 0.7354 0.4052 0.9081 -0.0539 0.1087 -0.0394 82 ASN B ND2 637 N N . SER A 84 B 0.6718 0.3928 0.8670 -0.0927 0.0430 0.0873 82 SER B N 638 C CA . SER A 84 B 0.6931 0.4036 0.9162 -0.0937 0.0378 0.1295 82 SER B CA 639 C C . SER A 84 B 0.6537 0.4221 0.8637 -0.0997 0.0201 0.1636 82 SER B C 640 O O . SER A 84 B 0.6552 0.4388 0.8855 -0.0881 0.0132 0.2025 82 SER B O 641 C CB . SER A 84 B 0.7292 0.4046 1.0017 -0.0666 0.0487 0.1504 82 SER B CB 642 O OG . SER A 84 B 0.7671 0.3928 1.0498 -0.0579 0.0710 0.1123 82 SER B OG 643 N N . LEU A 85 C 0.6230 0.4246 0.8003 -0.1193 0.0134 0.1497 82 LEU B N 644 C CA . LEU A 85 C 0.5944 0.4492 0.7546 -0.1269 0.0026 0.1731 82 LEU B CA 645 C C . LEU A 85 C 0.6298 0.4784 0.8002 -0.1437 -0.0001 0.2080 82 LEU B C 646 O O . LEU A 85 C 0.6657 0.4768 0.8475 -0.1586 0.0049 0.2047 82 LEU B O 647 C CB . LEU A 85 C 0.5571 0.4481 0.6886 -0.1389 0.0004 0.1474 82 LEU B CB 648 C CG . LEU A 85 C 0.5172 0.4332 0.6324 -0.1233 -0.0011 0.1277 82 LEU B CG 649 C CD1 . LEU A 85 C 0.5298 0.4133 0.6473 -0.1149 0.0049 0.0983 82 LEU B CD1 650 C CD2 . LEU A 85 C 0.4832 0.4399 0.5770 -0.1325 -0.0038 0.1152 82 LEU B CD2 651 N N . GLN A 86 ? 0.6297 0.5156 0.7928 -0.1449 -0.0083 0.2417 83 GLN B N 652 C CA . GLN A 86 ? 0.6685 0.5572 0.8343 -0.1642 -0.0118 0.2800 83 GLN B CA 653 C C . GLN A 86 ? 0.6518 0.6004 0.7813 -0.1808 -0.0144 0.2855 83 GLN B C 654 O O . GLN A 86 ? 0.6122 0.5920 0.7204 -0.1743 -0.0132 0.2598 83 GLN B O 655 C CB . GLN A 86 ? 0.7077 0.5772 0.9039 -0.1510 -0.0191 0.3245 83 GLN B CB 656 C CG . GLN A 86 ? 0.7374 0.5444 0.9764 -0.1289 -0.0106 0.3155 83 GLN B CG 657 C CD . GLN A 86 ? 0.7749 0.5240 1.0255 -0.1448 0.0008 0.2993 83 GLN B CD 658 O OE1 . GLN A 86 ? 0.7765 0.5342 1.0100 -0.1727 0.0000 0.3036 83 GLN B OE1 659 N NE2 . GLN A 86 ? 0.8062 0.4965 1.0857 -0.1289 0.0136 0.2783 83 GLN B NE2 660 N N . ALA A 87 ? 0.6921 0.6544 0.8141 -0.2035 -0.0155 0.3176 84 ALA B N 661 C CA . ALA A 87 ? 0.6910 0.7083 0.7761 -0.2236 -0.0117 0.3191 84 ALA B CA 662 C C . ALA A 87 ? 0.6759 0.7316 0.7333 -0.2138 -0.0161 0.3114 84 ALA B C 663 O O . ALA A 87 ? 0.6398 0.7243 0.6743 -0.2164 -0.0069 0.2805 84 ALA B O 664 C CB . ALA A 87 ? 0.7366 0.7642 0.8139 -0.2497 -0.0138 0.3643 84 ALA B CB 665 N N . ASN A 88 ? 0.7107 0.7657 0.7753 -0.2025 -0.0301 0.3399 85 ASN B N 666 C CA . ASN A 88 ? 0.7100 0.8029 0.7492 -0.1979 -0.0374 0.3367 85 ASN B CA 667 C C . ASN A 88 ? 0.6411 0.7279 0.6841 -0.1756 -0.0334 0.2945 85 ASN B C 668 O O . ASN A 88 ? 0.6281 0.7420 0.6524 -0.1729 -0.0389 0.2894 85 ASN B O 669 C CB . ASN A 88 ? 0.7873 0.8910 0.8392 -0.1951 -0.0571 0.3865 85 ASN B CB 670 C CG . ASN A 88 ? 0.8590 0.9192 0.9683 -0.1655 -0.0622 0.3992 85 ASN B CG 671 O OD1 . ASN A 88 ? 0.8364 0.8580 0.9677 -0.1482 -0.0505 0.3649 85 ASN B OD1 672 N ND2 . ASN A 88 ? 0.9972 1.0659 1.1321 -0.1607 -0.0793 0.4507 85 ASN B ND2 673 N N . ASP A 89 ? 0.5974 0.6500 0.6616 -0.1637 -0.0247 0.2654 86 ASP B N 674 C CA . ASP A 89 ? 0.5412 0.5918 0.6017 -0.1485 -0.0199 0.2255 86 ASP B CA 675 C C . ASP A 89 ? 0.5070 0.5794 0.5443 -0.1593 -0.0090 0.1967 86 ASP B C 676 O O . ASP A 89 ? 0.4748 0.5470 0.5092 -0.1486 -0.0058 0.1673 86 ASP B O 677 C CB . ASP A 89 ? 0.5365 0.5425 0.6272 -0.1324 -0.0168 0.2087 86 ASP B CB 678 C CG . ASP A 89 ? 0.5526 0.5369 0.6737 -0.1142 -0.0218 0.2289 86 ASP B CG 679 O OD1 . ASP A 89 ? 0.5371 0.5448 0.6571 -0.1031 -0.0280 0.2348 86 ASP B OD1 680 O OD2 . ASP A 89 ? 0.5811 0.5242 0.7312 -0.1107 -0.0182 0.2383 86 ASP B OD2 681 N N . THR A 90 ? 0.5128 0.6050 0.5376 -0.1801 -0.0023 0.2074 87 THR B N 682 C CA . THR A 90 ? 0.4899 0.6086 0.4998 -0.1889 0.0120 0.1830 87 THR B CA 683 C C . THR A 90 ? 0.4718 0.6134 0.4516 -0.1867 0.0152 0.1686 87 THR B C 684 O O . THR A 90 ? 0.4943 0.6535 0.4483 -0.1980 0.0103 0.1869 87 THR B O 685 C CB . THR A 90 ? 0.5158 0.6559 0.5181 -0.2139 0.0224 0.1996 87 THR B CB 686 O OG1 . THR A 90 ? 0.5185 0.6358 0.5508 -0.2187 0.0210 0.2074 87 THR B OG1 687 C CG2 . THR A 90 ? 0.5069 0.6808 0.4963 -0.2210 0.0427 0.1740 87 THR B CG2 688 N N . ALA A 91 ? 0.4346 0.5758 0.4179 -0.1745 0.0222 0.1375 88 ALA B N 689 C CA . ALA A 91 ? 0.4214 0.5734 0.3798 -0.1714 0.0260 0.1198 88 ALA B CA 690 C C . ALA A 91 ? 0.3932 0.5395 0.3658 -0.1572 0.0346 0.0903 88 ALA B C 691 O O . ALA A 91 ? 0.3772 0.5136 0.3783 -0.1490 0.0323 0.0861 88 ALA B O 692 C CB . ALA A 91 ? 0.4140 0.5567 0.3685 -0.1624 0.0095 0.1301 88 ALA B CB 693 N N . ILE A 92 ? 0.3899 0.5415 0.3424 -0.1562 0.0432 0.0716 89 ILE B N 694 C CA . ILE A 92 ? 0.3691 0.5098 0.3365 -0.1400 0.0477 0.0491 89 ILE B CA 695 C C . ILE A 92 ? 0.3549 0.4776 0.3185 -0.1293 0.0317 0.0495 89 ILE B C 696 O O . ILE A 92 ? 0.3630 0.4891 0.3021 -0.1363 0.0273 0.0531 89 ILE B O 697 C CB . ILE A 92 ? 0.3873 0.5346 0.3377 -0.1442 0.0687 0.0269 89 ILE B CB 698 C CG1 . ILE A 92 ? 0.4074 0.5771 0.3611 -0.1559 0.0907 0.0236 89 ILE B CG1 699 C CG2 . ILE A 92 ? 0.3724 0.5039 0.3457 -0.1249 0.0714 0.0097 89 ILE B CG2 700 C CD1 . ILE A 92 ? 0.4394 0.6139 0.3684 -0.1651 0.1176 -0.0009 89 ILE B CD1 701 N N . TYR A 93 ? 0.3350 0.4432 0.3214 -0.1152 0.0238 0.0451 90 TYR B N 702 C CA . TYR A 93 ? 0.3236 0.4164 0.3078 -0.1059 0.0119 0.0442 90 TYR B CA 703 C C . TYR A 93 ? 0.3174 0.4027 0.3002 -0.0978 0.0149 0.0281 90 TYR B C 704 O O . TYR A 93 ? 0.3114 0.3977 0.3123 -0.0920 0.0196 0.0214 90 TYR B O 705 C CB . TYR A 93 ? 0.3176 0.3967 0.3207 -0.1005 0.0025 0.0496 90 TYR B CB 706 C CG . TYR A 93 ? 0.3293 0.4054 0.3369 -0.1059 -0.0008 0.0678 90 TYR B CG 707 C CD1 . TYR A 93 ? 0.3407 0.4255 0.3536 -0.1170 0.0036 0.0784 90 TYR B CD1 708 C CD2 . TYR A 93 ? 0.3318 0.3971 0.3430 -0.0994 -0.0073 0.0770 90 TYR B CD2 709 C CE1 . TYR A 93 ? 0.3569 0.4352 0.3758 -0.1227 -0.0003 0.1000 90 TYR B CE1 710 C CE2 . TYR A 93 ? 0.3478 0.4074 0.3715 -0.1014 -0.0103 0.0981 90 TYR B CE2 711 C CZ . TYR A 93 ? 0.3617 0.4257 0.3877 -0.1136 -0.0078 0.1107 90 TYR B CZ 712 O OH . TYR A 93 ? 0.3859 0.4409 0.4254 -0.1166 -0.0116 0.1361 90 TYR B OH 713 N N . TYR A 94 ? 0.3205 0.4004 0.2862 -0.0980 0.0114 0.0252 91 TYR B N 714 C CA . TYR A 94 ? 0.3196 0.3874 0.2819 -0.0928 0.0139 0.0130 91 TYR B CA 715 C C . TYR A 94 ? 0.3130 0.3728 0.2729 -0.0882 0.0028 0.0161 91 TYR B C 716 O O . TYR A 94 ? 0.3069 0.3735 0.2627 -0.0907 -0.0026 0.0243 91 TYR B O 717 C CB . TYR A 94 ? 0.3381 0.4055 0.2762 -0.1039 0.0240 0.0029 91 TYR B CB 718 C CG . TYR A 94 ? 0.3553 0.4313 0.2845 -0.1136 0.0408 -0.0054 91 TYR B CG 719 C CD1 . TYR A 94 ? 0.3655 0.4605 0.2744 -0.1295 0.0405 0.0033 91 TYR B CD1 720 C CD2 . TYR A 94 ? 0.3713 0.4370 0.3125 -0.1077 0.0588 -0.0215 91 TYR B CD2 721 C CE1 . TYR A 94 ? 0.3939 0.4989 0.2868 -0.1429 0.0583 -0.0059 91 TYR B CE1 722 C CE2 . TYR A 94 ? 0.3935 0.4676 0.3260 -0.1173 0.0803 -0.0337 91 TYR B CE2 723 C CZ . TYR A 94 ? 0.4067 0.5010 0.3105 -0.1369 0.0803 -0.0270 91 TYR B CZ 724 O OH . TYR A 94 ? 0.4364 0.5422 0.3235 -0.1513 0.1027 -0.0392 91 TYR B OH 725 N N . CYS A 95 ? 0.3176 0.3659 0.2832 -0.0815 0.0000 0.0118 92 CYS B N 726 C CA . CYS A 95 ? 0.3210 0.3624 0.2762 -0.0817 -0.0052 0.0117 92 CYS B CA 727 C C . CYS A 95 ? 0.3341 0.3664 0.2767 -0.0874 0.0013 0.0047 92 CYS B C 728 O O . CYS A 95 ? 0.3447 0.3696 0.2918 -0.0864 0.0108 -0.0022 92 CYS B O 729 C CB . CYS A 95 ? 0.3226 0.3572 0.2833 -0.0770 -0.0128 0.0134 92 CYS B CB 730 S SG . CYS A 95 ? 0.3420 0.3696 0.3184 -0.0710 -0.0144 0.0161 92 CYS B SG 731 N N . ALA A 96 ? 0.3376 0.3701 0.2665 -0.0945 -0.0013 0.0051 93 ALA B N 732 C CA . ALA A 96 ? 0.3608 0.3817 0.2743 -0.1054 0.0048 -0.0030 93 ALA B CA 733 C C . ALA A 96 ? 0.3632 0.3850 0.2668 -0.1138 0.0000 0.0000 93 ALA B C 734 O O . ALA A 96 ? 0.3479 0.3896 0.2552 -0.1136 -0.0059 0.0078 93 ALA B O 735 C CB . ALA A 96 ? 0.3754 0.4081 0.2738 -0.1187 0.0105 -0.0087 93 ALA B CB 736 N N . ARG A 97 ? 0.3921 0.3910 0.2865 -0.1215 0.0050 -0.0065 94 ARG B N 737 C CA . ARG A 97 ? 0.4101 0.4100 0.2914 -0.1370 0.0027 -0.0054 94 ARG B CA 738 C C . ARG A 97 ? 0.4301 0.4451 0.2941 -0.1576 0.0040 -0.0124 94 ARG B C 739 O O . ARG A 97 ? 0.4500 0.4490 0.3001 -0.1666 0.0134 -0.0267 94 ARG B O 740 C CB . ARG A 97 ? 0.4395 0.4031 0.3184 -0.1393 0.0072 -0.0073 94 ARG B CB 741 C CG . ARG A 97 ? 0.4392 0.3963 0.3298 -0.1261 0.0004 0.0065 94 ARG B CG 742 C CD . ARG A 97 ? 0.4566 0.4095 0.3366 -0.1381 -0.0032 0.0160 94 ARG B CD 743 N NE . ARG A 97 ? 0.4620 0.4372 0.3311 -0.1557 -0.0023 0.0123 94 ARG B NE 744 C CZ . ARG A 97 ? 0.4875 0.4514 0.3447 -0.1761 0.0002 0.0101 94 ARG B CZ 745 N NH1 . ARG A 97 ? 0.4812 0.4773 0.3345 -0.1921 -0.0017 0.0095 94 ARG B NH1 746 N NH2 . ARG A 97 ? 0.5294 0.4509 0.3827 -0.1812 0.0044 0.0107 94 ARG B NH2 747 N N . MET A 98 ? 0.4229 0.4720 0.2886 -0.1663 -0.0048 -0.0022 95 MET B N 748 C CA . MET A 98 ? 0.4418 0.5177 0.2934 -0.1892 -0.0097 -0.0019 95 MET B CA 749 C C . MET A 98 ? 0.4400 0.5412 0.2970 -0.2032 -0.0169 0.0074 95 MET B C 750 O O . MET A 98 ? 0.4328 0.5331 0.3047 -0.1922 -0.0157 0.0135 95 MET B O 751 C CB . MET A 98 ? 0.4263 0.5366 0.2890 -0.1826 -0.0173 0.0113 95 MET B CB 752 C CG . MET A 98 ? 0.4261 0.5202 0.2911 -0.1671 -0.0108 0.0070 95 MET B CG 753 S SD . MET A 98 ? 0.4239 0.5550 0.2968 -0.1666 -0.0201 0.0262 95 MET B SD 754 C CE . MET A 98 ? 0.4667 0.6126 0.2987 -0.2028 -0.0215 0.0188 95 MET B CE 755 N N . ARG A 99 ? 0.4536 0.5837 0.2989 -0.2292 -0.0246 0.0099 96 ARG B N 756 C CA . ARG A 99 ? 0.4628 0.6224 0.3144 -0.2490 -0.0316 0.0184 96 ARG B CA 757 C C . ARG A 99 ? 0.4782 0.5954 0.3159 -0.2580 -0.0222 0.0058 96 ARG B C 758 O O . ARG A 99 ? 0.4705 0.5910 0.3243 -0.2499 -0.0203 0.0142 96 ARG B O 759 C CB . ARG A 99 ? 0.4359 0.6380 0.3281 -0.2307 -0.0361 0.0393 96 ARG B CB 760 C CG . ARG A 99 ? 0.4183 0.6545 0.3366 -0.2129 -0.0435 0.0564 96 ARG B CG 761 C CD . ARG A 99 ? 0.4092 0.7016 0.3715 -0.2077 -0.0496 0.0789 96 ARG B CD 762 N NE . ARG A 99 ? 0.4128 0.7047 0.3869 -0.2056 -0.0393 0.0750 96 ARG B NE 763 C CZ . ARG A 99 ? 0.4074 0.7486 0.4170 -0.2089 -0.0399 0.0897 96 ARG B CZ 764 N NH1 . ARG A 99 ? 0.4016 0.7997 0.4462 -0.2110 -0.0527 0.1126 96 ARG B NH1 765 N NH2 . ARG A 99 ? 0.4112 0.7476 0.4238 -0.2097 -0.0272 0.0836 96 ARG B NH2 766 N N . ILE A 100 ? 0.5132 0.5878 0.3212 -0.2748 -0.0143 -0.0141 97 ILE B N 767 C CA . ILE A 100 ? 0.5381 0.5602 0.3396 -0.2755 -0.0037 -0.0231 97 ILE B CA 768 C C . ILE A 100 ? 0.5779 0.5965 0.3643 -0.3114 -0.0050 -0.0267 97 ILE B C 769 O O . ILE A 100 ? 0.5984 0.6453 0.3693 -0.3419 -0.0122 -0.0309 97 ILE B O 770 C CB . ILE A 100 ? 0.5592 0.5261 0.3514 -0.2624 0.0108 -0.0413 97 ILE B CB 771 C CG1 . ILE A 100 ? 0.6150 0.5531 0.3757 -0.2917 0.0213 -0.0664 97 ILE B CG1 772 C CG2 . ILE A 100 ? 0.5228 0.5045 0.3284 -0.2352 0.0106 -0.0379 97 ILE B CG2 773 C CD1 . ILE A 100 ? 0.6645 0.5438 0.4187 -0.3036 0.0330 -0.0772 97 ILE B CD1 774 N N . THR A 101 ? 0.5916 0.5765 0.3824 -0.3097 0.0005 -0.0226 98 THR B N 775 C CA . THR A 101 ? 0.6223 0.6043 0.4055 -0.3413 -0.0005 -0.0197 98 THR B CA 776 C C . THR A 101 ? 0.6801 0.5847 0.4462 -0.3533 0.0125 -0.0337 98 THR B C 777 O O . THR A 101 ? 0.7188 0.6071 0.4711 -0.3870 0.0139 -0.0382 98 THR B O 778 C CB . THR A 101 ? 0.5890 0.6089 0.3964 -0.3298 -0.0050 0.0039 98 THR B CB 779 O OG1 . THR A 101 ? 0.5659 0.6568 0.3891 -0.3417 -0.0149 0.0138 98 THR B OG1 780 C CG2 . THR A 101 ? 0.6255 0.6132 0.4272 -0.3462 0.0000 0.0116 98 THR B CG2 781 N N . THR A 102 ? 0.6887 0.5465 0.4604 -0.3255 0.0225 -0.0397 99 THR B N 782 C CA . THR A 102 ? 0.7398 0.5242 0.5127 -0.3229 0.0351 -0.0433 99 THR B CA 783 C C . THR A 102 ? 0.7704 0.5056 0.5375 -0.3160 0.0527 -0.0705 99 THR B C 784 O O . THR A 102 ? 0.7378 0.4975 0.5050 -0.3017 0.0540 -0.0798 99 THR B O 785 C CB . THR A 102 ? 0.7168 0.4954 0.5145 -0.2897 0.0305 -0.0172 99 THR B CB 786 O OG1 . THR A 102 ? 0.7715 0.4804 0.5799 -0.2805 0.0411 -0.0154 99 THR B OG1 787 C CG2 . THR A 102 ? 0.6612 0.4739 0.4738 -0.2568 0.0258 -0.0140 99 THR B CG2 788 N N . ASP A 103 ? 0.8334 0.4971 0.5991 -0.3246 0.0686 -0.0822 100 ASP B N 789 C CA . ASP A 103 ? 0.8762 0.4844 0.6456 -0.3126 0.0924 -0.1093 100 ASP B CA 790 C C . ASP A 103 ? 0.8399 0.4537 0.6433 -0.2672 0.0956 -0.1000 100 ASP B C 791 O O . ASP A 103 ? 0.8514 0.4446 0.6580 -0.2571 0.1152 -0.1242 100 ASP B O 792 C CB . ASP A 103 ? 0.9523 0.4749 0.7302 -0.3197 0.1104 -0.1158 100 ASP B CB 793 C CG . ASP A 103 ? 1.0252 0.5095 0.7660 -0.3625 0.1267 -0.1526 100 ASP B CG 794 O OD1 . ASP A 103 ? 1.0218 0.5454 0.7301 -0.3834 0.1261 -0.1756 100 ASP B OD1 795 O OD2 . ASP A 103 ? 1.0972 0.5108 0.8404 -0.3771 0.1400 -0.1582 100 ASP B OD2 796 N N . TRP A 104 A 0.7980 0.4402 0.6256 -0.2433 0.0778 -0.0661 100 TRP B N 797 C CA . TRP A 104 A 0.7952 0.4198 0.6632 -0.2047 0.0799 -0.0492 100 TRP B CA 798 C C . TRP A 104 A 0.7269 0.4084 0.6101 -0.1790 0.0644 -0.0319 100 TRP B C 799 O O . TRP A 104 A 0.7127 0.3961 0.6186 -0.1556 0.0723 -0.0376 100 TRP B O 800 C CB . TRP A 104 A 0.8295 0.4172 0.7161 -0.2010 0.0733 -0.0194 100 TRP B CB 801 C CG . TRP A 104 A 0.8445 0.4083 0.7777 -0.1643 0.0763 -0.0012 100 TRP B CG 802 C CD1 . TRP A 104 A 0.8050 0.4036 0.7621 -0.1401 0.0568 0.0316 100 TRP B CD1 803 C CD2 . TRP A 104 A 0.9035 0.4067 0.8692 -0.1481 0.1012 -0.0156 100 TRP B CD2 804 N NE1 . TRP A 104 A 0.8337 0.4025 0.8400 -0.1100 0.0645 0.0432 100 TRP B NE1 805 C CE2 . TRP A 104 A 0.8912 0.4006 0.9078 -0.1114 0.0935 0.0148 100 TRP B CE2 806 C CE3 . TRP A 104 A 0.9697 0.4139 0.9273 -0.1623 0.1309 -0.0526 100 TRP B CE3 807 C CZ2 . TRP A 104 A 0.9378 0.3996 1.0069 -0.0840 0.1150 0.0126 100 TRP B CZ2 808 C CZ3 . TRP A 104 A 1.0219 0.4111 1.0263 -0.1357 0.1565 -0.0602 100 TRP B CZ3 809 C CH2 . TRP A 104 A 1.0047 0.4048 1.0690 -0.0945 0.1485 -0.0260 100 TRP B CH2 810 N N . PHE A 105 B 0.6935 0.4193 0.5658 -0.1848 0.0447 -0.0120 100 PHE B N 811 C CA . PHE A 105 B 0.6513 0.4177 0.5388 -0.1623 0.0296 0.0085 100 PHE B CA 812 C C . PHE A 105 B 0.6138 0.4273 0.4953 -0.1573 0.0274 -0.0038 100 PHE B C 813 O O . PHE A 105 B 0.5832 0.4389 0.4588 -0.1570 0.0151 0.0062 100 PHE B O 814 C CB . PHE A 105 B 0.6433 0.4308 0.5199 -0.1719 0.0142 0.0331 100 PHE B CB 815 C CG . PHE A 105 B 0.6871 0.4339 0.5730 -0.1731 0.0113 0.0568 100 PHE B CG 816 C CD1 . PHE A 105 B 0.6972 0.4279 0.6125 -0.1492 0.0057 0.0776 100 PHE B CD1 817 C CD2 . PHE A 105 B 0.7194 0.4483 0.5873 -0.1995 0.0122 0.0628 100 PHE B CD2 818 C CE1 . PHE A 105 B 0.7425 0.4375 0.6697 -0.1502 0.0002 0.1065 100 PHE B CE1 819 C CE2 . PHE A 105 B 0.7627 0.4522 0.6388 -0.2023 0.0087 0.0893 100 PHE B CE2 820 C CZ . PHE A 105 B 0.7765 0.4479 0.6824 -0.1768 0.0020 0.1127 100 PHE B CZ 821 N N . ALA A 106 ? 0.6224 0.4264 0.5061 -0.1537 0.0415 -0.0253 101 ALA B N 822 C CA . ALA A 106 ? 0.5972 0.4400 0.4685 -0.1572 0.0411 -0.0373 101 ALA B CA 823 C C . ALA A 106 ? 0.5967 0.4364 0.4877 -0.1375 0.0526 -0.0462 101 ALA B C 824 O O . ALA A 106 ? 0.6418 0.4499 0.5328 -0.1400 0.0727 -0.0666 101 ALA B O 825 C CB . ALA A 106 ? 0.6278 0.4694 0.4668 -0.1882 0.0476 -0.0572 101 ALA B CB 826 N N . TYR A 107 ? 0.5519 0.4228 0.4602 -0.1195 0.0423 -0.0327 102 TYR B N 827 C CA . TYR A 107 ? 0.5482 0.4272 0.4737 -0.1059 0.0530 -0.0410 102 TYR B CA 828 C C . TYR A 107 ? 0.5044 0.4258 0.4271 -0.1037 0.0427 -0.0347 102 TYR B C 829 O O . TYR A 107 ? 0.4695 0.4145 0.3819 -0.1086 0.0276 -0.0237 102 TYR B O 830 C CB . TYR A 107 ? 0.5611 0.4237 0.5297 -0.0809 0.0568 -0.0303 102 TYR B CB 831 C CG . TYR A 107 ? 0.6041 0.4442 0.5911 -0.0732 0.0836 -0.0505 102 TYR B CG 832 C CD1 . TYR A 107 ? 0.6596 0.4598 0.6280 -0.0876 0.1043 -0.0743 102 TYR B CD1 833 C CD2 . TYR A 107 ? 0.6013 0.4602 0.6251 -0.0536 0.0910 -0.0480 102 TYR B CD2 834 C CE1 . TYR A 107 ? 0.7075 0.4826 0.6911 -0.0814 0.1350 -0.0985 102 TYR B CE1 835 C CE2 . TYR A 107 ? 0.6398 0.4802 0.6845 -0.0457 0.1212 -0.0690 102 TYR B CE2 836 C CZ . TYR A 107 ? 0.6955 0.4922 0.7191 -0.0589 0.1449 -0.0958 102 TYR B CZ 837 O OH . TYR A 107 ? 0.7402 0.5148 0.7832 -0.0515 0.1804 -0.1217 102 TYR B OH 838 N N . TRP A 108 ? 0.4990 0.4277 0.4346 -0.0959 0.0543 -0.0426 103 TRP B N 839 C CA . TRP A 108 ? 0.4709 0.4339 0.4101 -0.0927 0.0473 -0.0355 103 TRP B CA 840 C C . TRP A 108 ? 0.4510 0.4217 0.4283 -0.0729 0.0463 -0.0259 103 TRP B C 841 O O . TRP A 108 ? 0.4676 0.4219 0.4714 -0.0612 0.0592 -0.0300 103 TRP B O 842 C CB . TRP A 108 ? 0.4905 0.4637 0.4095 -0.1064 0.0617 -0.0507 103 TRP B CB 843 C CG . TRP A 108 ? 0.5046 0.4880 0.3873 -0.1292 0.0557 -0.0533 103 TRP B CG 844 C CD1 . TRP A 108 ? 0.5262 0.4941 0.3887 -0.1442 0.0539 -0.0594 103 TRP B CD1 845 C CD2 . TRP A 108 ? 0.5024 0.5179 0.3668 -0.1423 0.0489 -0.0464 103 TRP B CD2 846 N NE1 . TRP A 108 ? 0.5288 0.5231 0.3638 -0.1660 0.0449 -0.0566 103 TRP B NE1 847 C CE2 . TRP A 108 ? 0.5133 0.5369 0.3496 -0.1643 0.0411 -0.0469 103 TRP B CE2 848 C CE3 . TRP A 108 ? 0.4927 0.5319 0.3640 -0.1391 0.0475 -0.0366 103 TRP B CE3 849 C CZ2 . TRP A 108 ? 0.5176 0.5756 0.3356 -0.1810 0.0302 -0.0351 103 TRP B CZ2 850 C CZ3 . TRP A 108 ? 0.4978 0.5650 0.3487 -0.1554 0.0379 -0.0250 103 TRP B CZ3 851 C CH2 . TRP A 108 ? 0.5134 0.5916 0.3390 -0.1755 0.0285 -0.0229 103 TRP B CH2 852 N N . GLY A 109 ? 0.4183 0.4142 0.4011 -0.0703 0.0323 -0.0136 104 GLY B N 853 C CA . GLY A 109 ? 0.4082 0.4197 0.4243 -0.0582 0.0294 -0.0048 104 GLY B CA 854 C C . GLY A 109 ? 0.4258 0.4460 0.4557 -0.0568 0.0498 -0.0157 104 GLY B C 855 O O . GLY A 109 ? 0.4331 0.4513 0.4363 -0.0694 0.0634 -0.0296 104 GLY B O 856 N N . GLN A 110 ? 0.4314 0.4660 0.5027 -0.0440 0.0521 -0.0086 105 GLN B N 857 C CA . GLN A 110 ? 0.4511 0.4991 0.5435 -0.0412 0.0755 -0.0189 105 GLN B CA 858 C C . GLN A 110 ? 0.4343 0.5025 0.5017 -0.0573 0.0775 -0.0210 105 GLN B C 859 O O . GLN A 110 ? 0.4677 0.5409 0.5242 -0.0654 0.0999 -0.0351 105 GLN B O 860 C CB . GLN A 110 ? 0.4664 0.5372 0.6174 -0.0246 0.0751 -0.0059 105 GLN B CB 861 C CG . GLN A 110 ? 0.4901 0.5552 0.6709 -0.0106 0.0563 0.0131 105 GLN B CG 862 C CD . GLN A 110 ? 0.4824 0.5724 0.6658 -0.0168 0.0260 0.0334 105 GLN B CD 863 O OE1 . GLN A 110 ? 0.4885 0.5807 0.6361 -0.0319 0.0163 0.0304 105 GLN B OE1 864 N NE2 . GLN A 110 ? 0.4881 0.5969 0.7150 -0.0065 0.0115 0.0545 105 GLN B NE2 865 N N . GLY A 111 ? 0.3948 0.4735 0.4533 -0.0631 0.0560 -0.0070 106 GLY B N 866 C CA . GLY A 111 ? 0.3850 0.4784 0.4242 -0.0775 0.0559 -0.0034 106 GLY B CA 867 C C . GLY A 111 ? 0.3661 0.4818 0.4344 -0.0780 0.0511 0.0079 106 GLY B C 868 O O . GLY A 111 ? 0.3678 0.5003 0.4726 -0.0706 0.0607 0.0075 106 GLY B O 869 N N . THR A 112 ? 0.3472 0.4632 0.4036 -0.0870 0.0372 0.0183 107 THR B N 870 C CA . THR A 112 ? 0.3352 0.4660 0.4148 -0.0924 0.0305 0.0284 107 THR B CA 871 C C . THR A 112 ? 0.3374 0.4755 0.4034 -0.1073 0.0376 0.0357 107 THR B C 872 O O . THR A 112 ? 0.3346 0.4588 0.3781 -0.1128 0.0295 0.0431 107 THR B O 873 C CB . THR A 112 ? 0.3272 0.4436 0.4041 -0.0931 0.0094 0.0333 107 THR B CB 874 O OG1 . THR A 112 ? 0.3218 0.4321 0.4021 -0.0831 0.0013 0.0300 107 THR B OG1 875 C CG2 . THR A 112 ? 0.3291 0.4577 0.4280 -0.1035 0.0020 0.0404 107 THR B CG2 876 N N . LEU A 113 ? 0.3428 0.5052 0.4262 -0.1135 0.0532 0.0362 108 LEU B N 877 C CA . LEU A 113 ? 0.3556 0.5282 0.4256 -0.1312 0.0600 0.0472 108 LEU B CA 878 C C . LEU A 113 ? 0.3471 0.5131 0.4307 -0.1395 0.0444 0.0620 108 LEU B C 879 O O . LEU A 113 ? 0.3370 0.5154 0.4518 -0.1406 0.0407 0.0624 108 LEU B O 880 C CB . LEU A 113 ? 0.3721 0.5756 0.4571 -0.1376 0.0851 0.0419 108 LEU B CB 881 C CG . LEU A 113 ? 0.3973 0.6168 0.4696 -0.1600 0.0928 0.0566 108 LEU B CG 882 C CD1 . LEU A 113 ? 0.4150 0.6206 0.4396 -0.1721 0.0867 0.0672 108 LEU B CD1 883 C CD2 . LEU A 113 ? 0.4159 0.6696 0.5020 -0.1665 0.1233 0.0470 108 LEU B CD2 884 N N . VAL A 114 ? 0.3532 0.4992 0.4156 -0.1462 0.0354 0.0746 109 VAL B N 885 C CA . VAL A 114 ? 0.3604 0.4890 0.4348 -0.1544 0.0241 0.0865 109 VAL B CA 886 C C . VAL A 114 ? 0.3830 0.5143 0.4514 -0.1720 0.0286 0.1082 109 VAL B C 887 O O . VAL A 114 ? 0.3940 0.5208 0.4401 -0.1743 0.0274 0.1219 109 VAL B O 888 C CB . VAL A 114 ? 0.3570 0.4515 0.4229 -0.1442 0.0104 0.0847 109 VAL B CB 889 C CG1 . VAL A 114 ? 0.3771 0.4454 0.4564 -0.1536 0.0034 0.0913 109 VAL B CG1 890 C CG2 . VAL A 114 ? 0.3370 0.4302 0.4043 -0.1310 0.0054 0.0664 109 VAL B CG2 891 N N . THR A 115 ? 0.3941 0.5348 0.4839 -0.1866 0.0314 0.1146 110 THR B N 892 C CA . THR A 115 ? 0.4230 0.5641 0.5095 -0.2065 0.0352 0.1385 110 THR B CA 893 C C . THR A 115 ? 0.4414 0.5429 0.5418 -0.2125 0.0228 0.1483 110 THR B C 894 O O . THR A 115 ? 0.4385 0.5306 0.5576 -0.2144 0.0170 0.1345 110 THR B O 895 C CB . THR A 115 ? 0.4280 0.6091 0.5302 -0.2228 0.0513 0.1396 110 THR B CB 896 O OG1 . THR A 115 ? 0.4144 0.6259 0.5084 -0.2137 0.0674 0.1231 110 THR B OG1 897 C CG2 . THR A 115 ? 0.4647 0.6491 0.5560 -0.2469 0.0566 0.1676 110 THR B CG2 898 N N . VAL A 116 ? 0.4685 0.5460 0.5600 -0.2167 0.0188 0.1727 111 VAL B N 899 C CA . VAL A 116 ? 0.4975 0.5280 0.6055 -0.2206 0.0112 0.1818 111 VAL B CA 900 C C . VAL A 116 ? 0.5323 0.5629 0.6489 -0.2464 0.0155 0.2075 111 VAL B C 901 O O . VAL A 116 ? 0.5542 0.5924 0.6586 -0.2535 0.0165 0.2369 111 VAL B O 902 C CB . VAL A 116 ? 0.5085 0.5062 0.6133 -0.2026 0.0040 0.1946 111 VAL B CB 903 C CG1 . VAL A 116 ? 0.5420 0.4832 0.6694 -0.2025 0.0017 0.1959 111 VAL B CG1 904 C CG2 . VAL A 116 ? 0.4740 0.4797 0.5677 -0.1803 0.0014 0.1717 111 VAL B CG2 905 N N . SER A 117 ? 0.5346 0.7791 0.4339 -0.1303 0.0318 0.0101 112 SER B N 906 C CA . SER A 117 ? 0.5595 0.7593 0.4421 -0.1290 0.0358 0.0117 112 SER B CA 907 C C . SER A 117 ? 0.5984 0.7507 0.4530 -0.1469 0.0443 -0.0010 112 SER B C 908 O O . SER A 117 ? 0.5900 0.7549 0.4431 -0.1638 0.0386 -0.0096 112 SER B O 909 C CB . SER A 117 ? 0.5241 0.7383 0.4258 -0.1432 0.0219 0.0166 112 SER B CB 910 O OG . SER A 117 ? 0.5475 0.7199 0.4330 -0.1548 0.0264 0.0134 112 SER B OG 911 N N . ALA A 118 ? 0.6493 0.7469 0.4779 -0.1439 0.0604 -0.0034 113 ALA B N 912 C CA . ALA A 118 ? 0.6972 0.7476 0.4970 -0.1691 0.0733 -0.0220 113 ALA B CA 913 C C . ALA A 118 ? 0.6950 0.7399 0.4998 -0.1981 0.0685 -0.0286 113 ALA B C 914 O O . ALA A 118 ? 0.7402 0.7498 0.5225 -0.2249 0.0822 -0.0478 113 ALA B O 915 C CB . ALA A 118 ? 0.7727 0.7506 0.5308 -0.1509 0.1043 -0.0243 113 ALA B CB 916 N N . ALA A 119 ? 0.6505 0.7317 0.4839 -0.1952 0.0518 -0.0155 114 ALA B N 917 C CA . ALA A 119 ? 0.6468 0.7295 0.4876 -0.2198 0.0481 -0.0210 114 ALA B CA 918 C C . ALA A 119 ? 0.6362 0.7570 0.4850 -0.2494 0.0352 -0.0390 114 ALA B C 919 O O . ALA A 119 ? 0.6103 0.7699 0.4686 -0.2442 0.0207 -0.0373 114 ALA B O 920 C CB . ALA A 119 ? 0.5989 0.7159 0.4678 -0.2078 0.0328 -0.0038 114 ALA B CB 921 N N . LYS A 120 ? 0.6638 0.7781 0.5070 -0.2795 0.0421 -0.0564 115 LYS B N 922 C CA . LYS A 120 ? 0.6567 0.8267 0.5094 -0.3055 0.0280 -0.0757 115 LYS B CA 923 C C . LYS A 120 ? 0.6038 0.8307 0.4889 -0.2999 0.0064 -0.0635 115 LYS B C 924 O O . LYS A 120 ? 0.5886 0.8016 0.4852 -0.2895 0.0076 -0.0483 115 LYS B O 925 C CB . LYS A 120 ? 0.7125 0.8664 0.5485 -0.3473 0.0464 -0.1067 115 LYS B CB 926 C CG . LYS A 120 ? 0.7250 0.9334 0.5570 -0.3713 0.0370 -0.1340 115 LYS B CG 927 C CD . LYS A 120 ? 0.7558 0.9976 0.5907 -0.4181 0.0442 -0.1676 115 LYS B CD 928 C CE . LYS A 120 ? 0.7496 1.0845 0.5907 -0.4332 0.0238 -0.1912 115 LYS B CE 929 N NZ . LYS A 120 ? 0.7763 1.1643 0.6259 -0.4820 0.0300 -0.2288 115 LYS B NZ 930 N N . THR A 121 ? 0.5843 0.8755 0.4799 -0.3046 -0.0117 -0.0705 116 THR B N 931 C CA . THR A 121 ? 0.5489 0.8926 0.4700 -0.2978 -0.0282 -0.0612 116 THR B CA 932 C C . THR A 121 ? 0.5575 0.8952 0.4881 -0.3210 -0.0178 -0.0716 116 THR B C 933 O O . THR A 121 ? 0.5997 0.9292 0.5191 -0.3542 -0.0031 -0.0973 116 THR B O 934 C CB . THR A 121 ? 0.5458 0.9647 0.4694 -0.2968 -0.0458 -0.0698 116 THR B CB 935 O OG1 . THR A 121 ? 0.5461 0.9599 0.4537 -0.2751 -0.0509 -0.0581 116 THR B OG1 936 C CG2 . THR A 121 ? 0.5161 0.9861 0.4623 -0.2801 -0.0603 -0.0566 116 THR B CG2 937 N N . THR A 122 ? 0.5255 0.8618 0.4734 -0.3063 -0.0217 -0.0534 117 THR B N 938 C CA . THR A 122 ? 0.5351 0.8602 0.4897 -0.3252 -0.0096 -0.0593 117 THR B CA 939 C C . THR A 122 ? 0.4955 0.8633 0.4761 -0.3099 -0.0234 -0.0456 117 THR B C 940 O O . THR A 122 ? 0.4734 0.8292 0.4588 -0.2825 -0.0308 -0.0240 117 THR B O 941 C CB . THR A 122 ? 0.5625 0.8071 0.4969 -0.3192 0.0113 -0.0483 117 THR B CB 942 O OG1 . THR A 122 ? 0.6021 0.8001 0.5088 -0.3211 0.0249 -0.0555 117 THR B OG1 943 C CG2 . THR A 122 ? 0.5948 0.8137 0.5235 -0.3444 0.0320 -0.0574 117 THR B CG2 944 N N . PRO A 123 ? 0.4925 0.9115 0.4895 -0.3296 -0.0244 -0.0606 118 PRO B N 945 C CA . PRO A 123 ? 0.4587 0.9147 0.4781 -0.3116 -0.0347 -0.0472 118 PRO B CA 946 C C . PRO A 123 ? 0.4562 0.8592 0.4736 -0.3082 -0.0223 -0.0335 118 PRO B C 947 O O . PRO A 123 ? 0.4878 0.8345 0.4867 -0.3233 -0.0034 -0.0369 118 PRO B O 948 C CB . PRO A 123 ? 0.4675 1.0016 0.5055 -0.3358 -0.0366 -0.0710 118 PRO B CB 949 C CG . PRO A 123 ? 0.5097 1.0230 0.5331 -0.3794 -0.0178 -0.0994 118 PRO B CG 950 C CD . PRO A 123 ? 0.5253 0.9741 0.5212 -0.3709 -0.0138 -0.0931 118 PRO B CD 951 N N . PRO A 124 ? 0.4253 0.8433 0.4566 -0.2856 -0.0308 -0.0175 119 PRO B N 952 C CA . PRO A 124 ? 0.4228 0.8033 0.4518 -0.2811 -0.0213 -0.0060 119 PRO B CA 953 C C . PRO A 124 ? 0.4339 0.8302 0.4711 -0.3041 -0.0090 -0.0168 119 PRO B C 954 O O . PRO A 124 ? 0.4289 0.8875 0.4851 -0.3156 -0.0138 -0.0308 119 PRO B O 955 C CB . PRO A 124 ? 0.3943 0.7913 0.4339 -0.2527 -0.0337 0.0093 119 PRO B CB 956 C CG . PRO A 124 ? 0.3857 0.8415 0.4373 -0.2449 -0.0454 0.0046 119 PRO B CG 957 C CD . PRO A 124 ? 0.4021 0.8712 0.4464 -0.2610 -0.0471 -0.0097 119 PRO B CD 958 N N . SER A 125 ? 0.4533 0.7985 0.4747 -0.3091 0.0079 -0.0104 120 SER B N 959 C CA . SER A 125 ? 0.4620 0.8179 0.4899 -0.3250 0.0211 -0.0148 120 SER B CA 960 C C . SER A 125 ? 0.4287 0.8010 0.4686 -0.2971 0.0094 0.0013 120 SER B C 961 O O . SER A 125 ? 0.4212 0.7647 0.4508 -0.2740 0.0030 0.0161 120 SER B O 962 C CB . SER A 125 ? 0.5115 0.7947 0.5068 -0.3386 0.0490 -0.0116 120 SER B CB 963 O OG . SER A 125 ? 0.5551 0.8078 0.5320 -0.3686 0.0677 -0.0292 120 SER B OG 964 N N . VAL A 126 ? 0.4152 0.8371 0.4766 -0.3006 0.0084 -0.0040 121 VAL B N 965 C CA . VAL A 126 ? 0.3923 0.8266 0.4621 -0.2751 0.0007 0.0083 121 VAL B CA 966 C C . VAL A 126 ? 0.4079 0.8376 0.4759 -0.2855 0.0167 0.0085 121 VAL B C 967 O O . VAL A 126 ? 0.4167 0.8814 0.4977 -0.3084 0.0271 -0.0051 121 VAL B O 968 C CB . VAL A 126 ? 0.3677 0.8637 0.4599 -0.2574 -0.0137 0.0060 121 VAL B CB 969 C CG1 . VAL A 126 ? 0.3565 0.8467 0.4489 -0.2306 -0.0160 0.0181 121 VAL B CG1 970 C CG2 . VAL A 126 ? 0.3614 0.8598 0.4492 -0.2472 -0.0265 0.0070 121 VAL B CG2 971 N N . TYR A 127 ? 0.4144 0.8070 0.4657 -0.2698 0.0193 0.0222 122 TYR B N 972 C CA . TYR A 127 ? 0.4369 0.8194 0.4791 -0.2763 0.0356 0.0251 122 TYR B CA 973 C C . TYR A 127 ? 0.4182 0.8188 0.4672 -0.2543 0.0279 0.0308 122 TYR B C 974 O O . TYR A 127 ? 0.4022 0.7904 0.4456 -0.2351 0.0162 0.0369 122 TYR B O 975 C CB . TYR A 127 ? 0.4752 0.7938 0.4801 -0.2759 0.0504 0.0366 122 TYR B CB 976 C CG . TYR A 127 ? 0.5095 0.7919 0.4985 -0.2951 0.0633 0.0313 122 TYR B CG 977 C CD1 . TYR A 127 ? 0.5379 0.8278 0.5318 -0.3309 0.0820 0.0144 122 TYR B CD1 978 C CD2 . TYR A 127 ? 0.5200 0.7634 0.4884 -0.2798 0.0592 0.0399 122 TYR B CD2 979 C CE1 . TYR A 127 ? 0.5808 0.8300 0.5553 -0.3538 0.0984 0.0051 122 TYR B CE1 980 C CE2 . TYR A 127 ? 0.5584 0.7609 0.5076 -0.2960 0.0743 0.0340 122 TYR B CE2 981 C CZ . TYR A 127 ? 0.5930 0.7934 0.5432 -0.3343 0.0949 0.0160 122 TYR B CZ 982 O OH . TYR A 127 ? 0.6421 0.7948 0.5685 -0.3554 0.1144 0.0058 122 TYR B OH 983 N N . PRO A 128 ? 0.4250 0.8544 0.4846 -0.2599 0.0377 0.0263 123 PRO B N 984 C CA . PRO A 128 ? 0.4170 0.8575 0.4783 -0.2403 0.0351 0.0298 123 PRO B CA 985 C C . PRO A 128 ? 0.4361 0.8374 0.4676 -0.2343 0.0416 0.0393 123 PRO B C 986 O O . PRO A 128 ? 0.4661 0.8381 0.4756 -0.2452 0.0557 0.0451 123 PRO B O 987 C CB . PRO A 128 ? 0.4218 0.9098 0.5032 -0.2503 0.0465 0.0209 123 PRO B CB 988 C CG . PRO A 128 ? 0.4490 0.9258 0.5238 -0.2826 0.0638 0.0155 123 PRO B CG 989 C CD . PRO A 128 ? 0.4499 0.8990 0.5168 -0.2889 0.0562 0.0156 123 PRO B CD 990 N N . LEU A 129 ? 0.4263 0.8268 0.4528 -0.2166 0.0339 0.0399 124 LEU B N 991 C CA . LEU A 129 ? 0.4433 0.8261 0.4431 -0.2091 0.0374 0.0450 124 LEU B CA 992 C C . LEU A 129 ? 0.4483 0.8499 0.4505 -0.2042 0.0445 0.0391 124 LEU B C 993 O O . LEU A 129 ? 0.4424 0.8497 0.4501 -0.1947 0.0396 0.0313 124 LEU B O 994 C CB . LEU A 129 ? 0.4337 0.8076 0.4244 -0.1987 0.0237 0.0442 124 LEU B CB 995 C CG . LEU A 129 ? 0.4260 0.7854 0.4182 -0.2007 0.0165 0.0487 124 LEU B CG 996 C CD1 . LEU A 129 ? 0.4154 0.7778 0.4065 -0.1936 0.0042 0.0439 124 LEU B CD1 997 C CD2 . LEU A 129 ? 0.4549 0.7884 0.4223 -0.2009 0.0266 0.0607 124 LEU B CD2 998 N N . ALA A 130 ? 0.4684 0.8738 0.4633 -0.2120 0.0601 0.0422 125 ALA B N 999 C CA . ALA A 130 ? 0.4783 0.9002 0.4701 -0.2069 0.0698 0.0374 125 ALA B CA 1000 C C . ALA A 130 ? 0.5065 0.9109 0.4608 -0.2003 0.0741 0.0441 125 ALA B C 1001 O O . ALA A 130 ? 0.5260 0.9062 0.4558 -0.1997 0.0769 0.0566 125 ALA B O 1002 C CB . ALA A 130 ? 0.4859 0.9333 0.4946 -0.2205 0.0862 0.0348 125 ALA B CB 1003 N N . PRO A 131 ? 0.5136 0.9299 0.4587 -0.1919 0.0756 0.0357 126 PRO B N 1004 C CA . PRO A 131 ? 0.5433 0.9558 0.4503 -0.1840 0.0788 0.0408 126 PRO B CA 1005 C C . PRO A 131 ? 0.5794 0.9754 0.4629 -0.1875 0.0985 0.0571 126 PRO B C 1006 O O . PRO A 131 ? 0.5777 0.9765 0.4784 -0.2018 0.1137 0.0565 126 PRO B O 1007 C CB . PRO A 131 ? 0.5494 0.9795 0.4535 -0.1802 0.0820 0.0244 126 PRO B CB 1008 C CG . PRO A 131 ? 0.5317 0.9682 0.4693 -0.1825 0.0871 0.0161 126 PRO B CG 1009 C CD . PRO A 131 ? 0.5044 0.9356 0.4669 -0.1866 0.0769 0.0215 126 PRO B CD 1010 N N . GLY A 132 ? 0.6180 0.9990 0.4597 -0.1735 0.1004 0.0712 127 GLY B N 1011 C CA . GLY A 132 ? 0.6728 1.0230 0.4767 -0.1722 0.1251 0.0903 127 GLY B CA 1012 C C . GLY A 132 ? 0.6933 1.0556 0.4921 -0.1796 0.1441 0.0861 127 GLY B C 1013 O O . GLY A 132 ? 0.6717 1.0677 0.4848 -0.1774 0.1362 0.0697 127 GLY B O 1014 N N . SER A 133 ? 0.7427 1.0724 0.5187 -0.1906 0.1732 0.0996 128 SER B N 1015 C CA . SER A 133 ? 0.7712 1.1112 0.5407 -0.2008 0.1968 0.0969 128 SER B CA 1016 C C . SER A 133 ? 0.7929 1.1518 0.5278 -0.1777 0.1927 0.0977 128 SER B C 1017 O O . SER A 133 ? 0.7799 1.1714 0.5303 -0.1816 0.1954 0.0825 128 SER B O 1018 C CB . SER A 133 ? 0.8377 1.1266 0.5729 -0.2169 0.2343 0.1138 128 SER B CB 1019 O OG . SER A 133 ? 0.8321 1.1024 0.5935 -0.2437 0.2417 0.1091 128 SER B OG 1020 N N . ALA A 134 ? 0.8312 1.1741 0.5170 -0.1515 0.1871 0.1146 129 ALA B N 1021 C CA . ALA A 134 ? 0.8561 1.2298 0.5057 -0.1285 0.1799 0.1129 129 ALA B CA 1022 C C . ALA A 134 ? 0.8128 1.2365 0.4824 -0.1205 0.1464 0.0899 129 ALA B C 1023 O O . ALA A 134 ? 0.8331 1.2895 0.4683 -0.1008 0.1363 0.0872 129 ALA B O 1024 C CB . ALA A 134 ? 0.9296 1.2716 0.5075 -0.0990 0.1945 0.1438 129 ALA B CB 1025 N N . ALA A 135 ? 0.7594 1.1917 0.4815 -0.1374 0.1318 0.0714 130 ALA B N 1026 C CA . ALA A 135 ? 0.7307 1.1990 0.4701 -0.1378 0.1087 0.0463 130 ALA B CA 1027 C C . ALA A 135 ? 0.7416 1.2314 0.4803 -0.1442 0.1158 0.0239 130 ALA B C 1028 O O . ALA A 135 ? 0.7479 1.2273 0.4948 -0.1511 0.1351 0.0250 130 ALA B O 1029 C CB . ALA A 135 ? 0.6823 1.1414 0.4697 -0.1517 0.0967 0.0367 130 ALA B CB 1030 N N . GLN A 136 ? 0.7493 1.2723 0.4763 -0.1433 0.1023 0.0012 131 GLN B N 1031 C CA . GLN A 136 ? 0.7615 1.2970 0.4870 -0.1528 0.1103 -0.0264 131 GLN B CA 1032 C C . GLN A 136 ? 0.7307 1.2405 0.4986 -0.1664 0.1139 -0.0413 131 GLN B C 1033 O O . GLN A 136 ? 0.6995 1.1990 0.4916 -0.1717 0.1017 -0.0423 131 GLN B O 1034 C CB . GLN A 136 ? 0.7820 1.3624 0.4822 -0.1551 0.0967 -0.0526 131 GLN B CB 1035 C CG . GLN A 136 ? 0.8213 1.4431 0.4726 -0.1336 0.0908 -0.0395 131 GLN B CG 1036 C CD . GLN A 136 ? 0.8621 1.4720 0.4814 -0.1223 0.1121 -0.0236 131 GLN B CD 1037 O OE1 . GLN A 136 ? 0.8767 1.4527 0.4888 -0.1114 0.1247 0.0088 131 GLN B OE1 1038 N NE2 . GLN A 136 ? 0.8889 1.5234 0.4871 -0.1283 0.1196 -0.0486 131 GLN B NE2 1039 N N . THR A 137 ? 0.7448 1.2446 0.5182 -0.1679 0.1324 -0.0514 132 THR B N 1040 C CA . THR A 137 ? 0.7371 1.2125 0.5376 -0.1720 0.1393 -0.0677 132 THR B CA 1041 C C . THR A 137 ? 0.7625 1.2358 0.5413 -0.1839 0.1393 -0.1008 132 THR B C 1042 O O . THR A 137 ? 0.7975 1.2906 0.5443 -0.1871 0.1455 -0.1170 132 THR B O 1043 C CB . THR A 137 ? 0.7484 1.2192 0.5599 -0.1632 0.1614 -0.0660 132 THR B CB 1044 O OG1 . THR A 137 ? 0.7363 1.2221 0.5566 -0.1608 0.1660 -0.0415 132 THR B OG1 1045 C CG2 . THR A 137 ? 0.7373 1.1849 0.5796 -0.1555 0.1675 -0.0705 132 THR B CG2 1046 N N . ASN A 138 ? 0.7503 1.2008 0.5436 -0.1936 0.1343 -0.1126 133 ASN B N 1047 C CA . ASN A 138 ? 0.7841 1.2200 0.5581 -0.2129 0.1426 -0.1492 133 ASN B CA 1048 C C . ASN A 138 ? 0.7962 1.1697 0.5817 -0.2106 0.1618 -0.1560 133 ASN B C 1049 O O . ASN A 138 ? 0.7716 1.1301 0.5849 -0.1938 0.1589 -0.1314 133 ASN B O 1050 C CB . ASN A 138 ? 0.7738 1.2452 0.5430 -0.2308 0.1224 -0.1616 133 ASN B CB 1051 C CG . ASN A 138 ? 0.7899 1.3258 0.5293 -0.2314 0.1112 -0.1694 133 ASN B CG 1052 O OD1 . ASN A 138 ? 0.7688 1.3403 0.5065 -0.2149 0.0937 -0.1434 133 ASN B OD1 1053 N ND2 . ASN A 138 ? 0.8335 1.3811 0.5439 -0.2471 0.1242 -0.2040 133 ASN B ND2 1054 N N . SER A 139 ? 0.8436 1.1800 0.6033 -0.2263 0.1837 -0.1894 134 SER B N 1055 C CA . SER A 139 ? 0.8789 1.1423 0.6335 -0.2138 0.2126 -0.1935 134 SER B CA 1056 C C . SER A 139 ? 0.8528 1.0823 0.6310 -0.2021 0.2085 -0.1728 134 SER B C 1057 O O . SER A 139 ? 0.8669 1.0593 0.6505 -0.1730 0.2240 -0.1575 134 SER B O 1058 C CB . SER A 139 ? 0.9542 1.1709 0.6679 -0.2394 0.2415 -0.2364 134 SER B CB 1059 O OG . SER A 139 ? 0.9616 1.1899 0.6692 -0.2765 0.2332 -0.2610 134 SER B OG 1060 N N . MET A 140 ? 0.8171 1.0650 0.6072 -0.2216 0.1883 -0.1725 135 MET B N 1061 C CA . MET A 140 ? 0.7792 1.0135 0.5953 -0.2099 0.1770 -0.1481 135 MET B CA 1062 C C . MET A 140 ? 0.7081 1.0048 0.5544 -0.2021 0.1459 -0.1210 135 MET B C 1063 O O . MET A 140 ? 0.6965 1.0403 0.5375 -0.2124 0.1318 -0.1244 135 MET B O 1064 C CB . MET A 140 ? 0.7963 1.0033 0.6030 -0.2384 0.1800 -0.1674 135 MET B CB 1065 C CG . MET A 140 ? 0.8777 0.9991 0.6493 -0.2478 0.2189 -0.1914 135 MET B CG 1066 S SD . MET A 140 ? 0.9170 0.9665 0.6796 -0.1978 0.2458 -0.1654 135 MET B SD 1067 C CE . MET A 140 ? 0.9221 0.9208 0.6868 -0.1915 0.2490 -0.1481 135 MET B CE 1068 N N . VAL A 141 ? 0.6704 0.9657 0.5433 -0.1823 0.1381 -0.0945 136 VAL B N 1069 C CA . VAL A 141 ? 0.6152 0.9550 0.5125 -0.1802 0.1142 -0.0717 136 VAL B CA 1070 C C . VAL A 141 ? 0.5877 0.9168 0.5020 -0.1823 0.1013 -0.0613 136 VAL B C 1071 O O . VAL A 141 ? 0.5959 0.8911 0.5138 -0.1705 0.1105 -0.0576 136 VAL B O 1072 C CB . VAL A 141 ? 0.6006 0.9643 0.5162 -0.1613 0.1173 -0.0531 136 VAL B CB 1073 C CG1 . VAL A 141 ? 0.6004 0.9510 0.5348 -0.1387 0.1246 -0.0427 136 VAL B CG1 1074 C CG2 . VAL A 141 ? 0.5649 0.9644 0.4932 -0.1672 0.1012 -0.0351 136 VAL B CG2 1075 N N . THR A 142 ? 0.5582 0.9151 0.4783 -0.1932 0.0819 -0.0556 137 THR B N 1076 C CA . THR A 142 ? 0.5361 0.8865 0.4706 -0.1962 0.0697 -0.0471 137 THR B CA 1077 C C . THR A 142 ? 0.5054 0.8752 0.4612 -0.1862 0.0578 -0.0230 137 THR B C 1078 O O . THR A 142 ? 0.4961 0.8890 0.4486 -0.1862 0.0536 -0.0143 137 THR B O 1079 C CB . THR A 142 ? 0.5324 0.9029 0.4580 -0.2144 0.0587 -0.0604 137 THR B CB 1080 O OG1 . THR A 142 ? 0.5699 0.9274 0.4755 -0.2323 0.0732 -0.0898 137 THR B OG1 1081 C CG2 . THR A 142 ? 0.5109 0.8738 0.4514 -0.2173 0.0485 -0.0526 137 THR B CG2 1082 N N . LEU A 143 ? 0.4981 0.8557 0.4711 -0.1784 0.0558 -0.0133 138 LEU B N 1083 C CA . LEU A 143 ? 0.4751 0.8520 0.4684 -0.1756 0.0459 0.0032 138 LEU B CA 1084 C C . LEU A 143 ? 0.4630 0.8297 0.4618 -0.1801 0.0342 0.0072 138 LEU B C 1085 O O . LEU A 143 ? 0.4728 0.8185 0.4623 -0.1845 0.0356 -0.0019 138 LEU B O 1086 C CB . LEU A 143 ? 0.4769 0.8670 0.4877 -0.1602 0.0529 0.0087 138 LEU B CB 1087 C CG . LEU A 143 ? 0.4984 0.9004 0.5058 -0.1514 0.0677 0.0038 138 LEU B CG 1088 C CD1 . LEU A 143 ? 0.5034 0.9278 0.5288 -0.1287 0.0742 0.0084 138 LEU B CD1 1089 C CD2 . LEU A 143 ? 0.4945 0.9202 0.5012 -0.1643 0.0685 0.0072 138 LEU B CD2 1090 N N . GLY A 144 ? 0.4488 0.8286 0.4612 -0.1822 0.0260 0.0186 139 GLY B N 1091 C CA . GLY A 144 ? 0.4389 0.8099 0.4556 -0.1855 0.0157 0.0223 139 GLY B CA 1092 C C . GLY A 144 ? 0.4295 0.8137 0.4623 -0.1873 0.0108 0.0306 139 GLY B C 1093 O O . GLY A 144 ? 0.4289 0.8357 0.4735 -0.1889 0.0156 0.0319 139 GLY B O 1094 N N . CYS A 145 ? 0.4258 0.8001 0.4594 -0.1900 0.0025 0.0330 140 CYS B N 1095 C CA . CYS A 145 ? 0.4232 0.8087 0.4687 -0.1946 -0.0022 0.0367 140 CYS B CA 1096 C C . CYS A 145 ? 0.4140 0.7801 0.4498 -0.2008 -0.0080 0.0396 140 CYS B C 1097 O O . CYS A 145 ? 0.4066 0.7611 0.4362 -0.1972 -0.0122 0.0379 140 CYS B O 1098 C CB . CYS A 145 ? 0.4315 0.8254 0.4849 -0.1803 -0.0046 0.0369 140 CYS B CB 1099 S SG . CYS A 145 ? 0.4410 0.8658 0.5084 -0.1779 -0.0131 0.0382 140 CYS B SG 1100 N N . LEU A 146 ? 0.4144 0.7747 0.4459 -0.2106 -0.0045 0.0427 141 LEU B N 1101 C CA . LEU A 146 ? 0.4173 0.7554 0.4354 -0.2107 -0.0066 0.0468 141 LEU B CA 1102 C C . LEU A 146 ? 0.4102 0.7491 0.4365 -0.2199 -0.0090 0.0433 141 LEU B C 1103 O O . LEU A 146 ? 0.4204 0.7670 0.4517 -0.2348 -0.0019 0.0383 141 LEU B O 1104 C CB . LEU A 146 ? 0.4480 0.7630 0.4431 -0.2108 0.0051 0.0546 141 LEU B CB 1105 C CG . LEU A 146 ? 0.4707 0.7560 0.4447 -0.2040 0.0084 0.0618 141 LEU B CG 1106 C CD1 . LEU A 146 ? 0.4555 0.7554 0.4292 -0.1878 -0.0041 0.0625 141 LEU B CD1 1107 C CD2 . LEU A 146 ? 0.5152 0.7669 0.4565 -0.1979 0.0265 0.0735 141 LEU B CD2 1108 N N . VAL A 147 ? 0.3993 0.7340 0.4259 -0.2140 -0.0175 0.0433 142 VAL B N 1109 C CA . VAL A 147 ? 0.3982 0.7368 0.4294 -0.2203 -0.0213 0.0393 142 VAL B CA 1110 C C . VAL A 147 ? 0.4092 0.7189 0.4242 -0.2208 -0.0182 0.0417 142 VAL B C 1111 O O . VAL A 147 ? 0.4027 0.7072 0.4132 -0.2099 -0.0228 0.0450 142 VAL B O 1112 C CB . VAL A 147 ? 0.3889 0.7401 0.4271 -0.2095 -0.0300 0.0396 142 VAL B CB 1113 C CG1 . VAL A 147 ? 0.3917 0.7570 0.4323 -0.2137 -0.0349 0.0355 142 VAL B CG1 1114 C CG2 . VAL A 147 ? 0.3875 0.7566 0.4339 -0.1999 -0.0289 0.0403 142 VAL B CG2 1115 N N . LYS A 148 ? 0.4295 0.7207 0.4343 -0.2346 -0.0074 0.0380 143 LYS B N 1116 C CA . LYS A 148 ? 0.4619 0.7114 0.4416 -0.2299 0.0031 0.0430 143 LYS B CA 1117 C C . LYS A 148 ? 0.4781 0.7115 0.4506 -0.2434 0.0080 0.0334 143 LYS B C 1118 O O . LYS A 148 ? 0.4819 0.7350 0.4649 -0.2654 0.0088 0.0198 143 LYS B O 1119 C CB . LYS A 148 ? 0.5059 0.7225 0.4634 -0.2322 0.0220 0.0491 143 LYS B CB 1120 C CG . LYS A 148 ? 0.5525 0.7218 0.4747 -0.2119 0.0354 0.0620 143 LYS B CG 1121 C CD . LYS A 148 ? 0.5853 0.7364 0.4845 -0.1985 0.0478 0.0754 143 LYS B CD 1122 C CE . LYS A 148 ? 0.6348 0.7488 0.4946 -0.1649 0.0592 0.0930 143 LYS B CE 1123 N NZ . LYS A 148 ? 0.6951 0.7426 0.5236 -0.1707 0.0836 0.0927 143 LYS B NZ 1124 N N . GLY A 149 ? 0.4899 0.6953 0.4446 -0.2295 0.0113 0.0387 144 GLY B N 1125 C CA . GLY A 149 ? 0.5192 0.6959 0.4581 -0.2410 0.0216 0.0293 144 GLY B CA 1126 C C . GLY A 149 ? 0.4929 0.7074 0.4505 -0.2561 0.0083 0.0153 144 GLY B C 1127 O O . GLY A 149 ? 0.5134 0.7311 0.4691 -0.2820 0.0155 -0.0012 144 GLY B O 1128 N N . TYR A 150 ? 0.4526 0.6981 0.4255 -0.2411 -0.0090 0.0206 145 TYR B N 1129 C CA . TYR A 150 ? 0.4378 0.7141 0.4191 -0.2470 -0.0199 0.0121 145 TYR B CA 1130 C C . TYR A 150 ? 0.4359 0.7014 0.4084 -0.2344 -0.0224 0.0157 145 TYR B C 1131 O O . TYR A 150 ? 0.4322 0.6826 0.4009 -0.2190 -0.0198 0.0247 145 TYR B O 1132 C CB . TYR A 150 ? 0.4078 0.7271 0.4088 -0.2398 -0.0333 0.0161 145 TYR B CB 1133 C CG . TYR A 150 ? 0.3887 0.7034 0.3939 -0.2215 -0.0373 0.0289 145 TYR B CG 1134 C CD1 . TYR A 150 ? 0.3840 0.6925 0.3934 -0.2175 -0.0341 0.0342 145 TYR B CD1 1135 C CD2 . TYR A 150 ? 0.3855 0.7020 0.3876 -0.2114 -0.0414 0.0332 145 TYR B CD2 1136 C CE1 . TYR A 150 ? 0.3734 0.6829 0.3861 -0.2072 -0.0359 0.0396 145 TYR B CE1 1137 C CE2 . TYR A 150 ? 0.3799 0.6898 0.3841 -0.2031 -0.0397 0.0394 145 TYR B CE2 1138 C CZ . TYR A 150 ? 0.3714 0.6807 0.3821 -0.2027 -0.0374 0.0406 145 TYR B CZ 1139 O OH . TYR A 150 ? 0.3637 0.6719 0.3761 -0.2007 -0.0342 0.0407 145 TYR B OH 1140 N N . PHE A 151 ? 0.4387 0.7207 0.4080 -0.2410 -0.0272 0.0070 146 PHE B N 1141 C CA . PHE A 151 ? 0.4397 0.7150 0.3998 -0.2308 -0.0285 0.0095 146 PHE B CA 1142 C C . PHE A 151 ? 0.4415 0.7483 0.3982 -0.2350 -0.0372 0.0024 146 PHE B C 1143 O O . PHE A 151 ? 0.4516 0.7787 0.4066 -0.2521 -0.0380 -0.0124 146 PHE B O 1144 C CB . PHE A 151 ? 0.4704 0.7053 0.4107 -0.2315 -0.0141 0.0046 146 PHE B CB 1145 C CG . PHE A 151 ? 0.4714 0.7036 0.4041 -0.2194 -0.0136 0.0069 146 PHE B CG 1146 C CD1 . PHE A 151 ? 0.4833 0.7239 0.4049 -0.2273 -0.0154 -0.0030 146 PHE B CD1 1147 C CD2 . PHE A 151 ? 0.4595 0.6904 0.3967 -0.2009 -0.0115 0.0173 146 PHE B CD2 1148 C CE1 . PHE A 151 ? 0.4869 0.7252 0.4006 -0.2166 -0.0130 -0.0006 146 PHE B CE1 1149 C CE2 . PHE A 151 ? 0.4621 0.6987 0.3955 -0.1921 -0.0092 0.0175 146 PHE B CE2 1150 C CZ . PHE A 151 ? 0.4756 0.7114 0.3966 -0.2000 -0.0090 0.0096 146 PHE B CZ 1151 N N . PRO A 152 ? 0.4358 0.7496 0.3886 -0.2205 -0.0417 0.0119 147 PRO B N 1152 C CA . PRO A 152 ? 0.4257 0.7236 0.3813 -0.2083 -0.0378 0.0238 147 PRO B CA 1153 C C . PRO A 152 ? 0.4150 0.7199 0.3813 -0.2013 -0.0402 0.0336 147 PRO B C 1154 O O . PRO A 152 ? 0.4098 0.7330 0.3822 -0.2009 -0.0459 0.0336 147 PRO B O 1155 C CB . PRO A 152 ? 0.4370 0.7366 0.3768 -0.2026 -0.0366 0.0259 147 PRO B CB 1156 C CG . PRO A 152 ? 0.4465 0.7749 0.3779 -0.2012 -0.0456 0.0232 147 PRO B CG 1157 C CD . PRO A 152 ? 0.4456 0.7886 0.3868 -0.2172 -0.0490 0.0090 147 PRO B CD 1158 N N . GLU A 153 ? 0.4158 0.7091 0.3842 -0.1976 -0.0338 0.0390 148 GLU B N 1159 C CA . GLU A 153 ? 0.4238 0.7120 0.3931 -0.1931 -0.0300 0.0459 148 GLU B CA 1160 C C . GLU A 153 ? 0.4487 0.7319 0.3979 -0.1809 -0.0276 0.0550 148 GLU B C 1161 O O . GLU A 153 ? 0.4612 0.7469 0.3965 -0.1782 -0.0282 0.0553 148 GLU B O 1162 C CB . GLU A 153 ? 0.4281 0.7076 0.4018 -0.2000 -0.0196 0.0432 148 GLU B CB 1163 C CG . GLU A 153 ? 0.4145 0.7093 0.4046 -0.2037 -0.0227 0.0369 148 GLU B CG 1164 C CD . GLU A 153 ? 0.4225 0.7264 0.4202 -0.2124 -0.0148 0.0303 148 GLU B CD 1165 O OE1 . GLU A 153 ? 0.4293 0.7524 0.4322 -0.2172 -0.0102 0.0229 148 GLU B OE1 1166 O OE2 . GLU A 153 ? 0.4304 0.7271 0.4290 -0.2156 -0.0121 0.0299 148 GLU B OE2 1167 N N . PRO A 154 ? 0.4655 0.7396 0.4082 -0.1694 -0.0230 0.0635 149 PRO B N 1168 C CA . PRO A 154 ? 0.4594 0.7293 0.4150 -0.1716 -0.0206 0.0623 149 PRO B CA 1169 C C . PRO A 154 ? 0.4527 0.7534 0.4190 -0.1624 -0.0318 0.0630 149 PRO B C 1170 O O . PRO A 154 ? 0.4508 0.7819 0.4141 -0.1541 -0.0412 0.0636 149 PRO B O 1171 C CB . PRO A 154 ? 0.4949 0.7248 0.4270 -0.1628 -0.0015 0.0710 149 PRO B CB 1172 C CG . PRO A 154 ? 0.5258 0.7520 0.4310 -0.1413 -0.0001 0.0842 149 PRO B CG 1173 C CD . PRO A 154 ? 0.5021 0.7605 0.4155 -0.1488 -0.0148 0.0774 149 PRO B CD 1174 N N . VAL A 155 ? 0.4479 0.7476 0.4271 -0.1660 -0.0301 0.0605 150 VAL B N 1175 C CA . VAL A 155 ? 0.4501 0.7742 0.4364 -0.1539 -0.0342 0.0630 150 VAL B CA 1176 C C . VAL A 155 ? 0.4824 0.7735 0.4535 -0.1390 -0.0192 0.0710 150 VAL B C 1177 O O . VAL A 155 ? 0.4941 0.7467 0.4561 -0.1497 -0.0060 0.0682 150 VAL B O 1178 C CB . VAL A 155 ? 0.4269 0.7715 0.4355 -0.1694 -0.0399 0.0537 150 VAL B CB 1179 C CG1 . VAL A 155 ? 0.4183 0.7817 0.4337 -0.1852 -0.0474 0.0448 150 VAL B CG1 1180 C CG2 . VAL A 155 ? 0.4212 0.7409 0.4326 -0.1802 -0.0333 0.0504 150 VAL B CG2 1181 N N . THR A 156 ? 0.5050 0.8134 0.4720 -0.1147 -0.0189 0.0788 151 THR B N 1182 C CA . THR A 156 ? 0.5416 0.8118 0.4910 -0.0980 -0.0008 0.0856 151 THR B CA 1183 C C . THR A 156 ? 0.5217 0.8261 0.4934 -0.0971 -0.0065 0.0801 151 THR B C 1184 O O . THR A 156 ? 0.4984 0.8608 0.4913 -0.0970 -0.0216 0.0765 151 THR B O 1185 C CB . THR A 156 ? 0.5971 0.8485 0.5118 -0.0582 0.0108 0.1044 151 THR B CB 1186 O OG1 . THR A 156 ? 0.5931 0.9122 0.5190 -0.0315 -0.0039 0.1095 151 THR B OG1 1187 C CG2 . THR A 156 ? 0.6187 0.8457 0.5094 -0.0571 0.0150 0.1116 151 THR B CG2 1188 N N . VAL A 157 ? 0.5358 0.8053 0.5015 -0.1004 0.0079 0.0765 152 VAL B N 1189 C CA . VAL A 157 ? 0.5189 0.8145 0.5011 -0.0981 0.0064 0.0718 152 VAL B CA 1190 C C . VAL A 157 ? 0.5702 0.8273 0.5264 -0.0696 0.0278 0.0797 152 VAL B C 1191 O O . VAL A 157 ? 0.6106 0.8015 0.5380 -0.0724 0.0490 0.0793 152 VAL B O 1192 C CB . VAL A 157 ? 0.4916 0.7832 0.4883 -0.1296 0.0044 0.0579 152 VAL B CB 1193 C CG1 . VAL A 157 ? 0.4804 0.7991 0.4914 -0.1276 0.0042 0.0539 152 VAL B CG1 1194 C CG2 . VAL A 157 ? 0.4585 0.7729 0.4709 -0.1507 -0.0107 0.0534 152 VAL B CG2 1195 N N . THR A 158 ? 0.5748 0.8730 0.5391 -0.0425 0.0254 0.0853 153 THR B N 1196 C CA . THR A 158 ? 0.6247 0.8875 0.5648 -0.0120 0.0476 0.0920 153 THR B CA 1197 C C . THR A 158 ? 0.5955 0.9081 0.5632 -0.0140 0.0420 0.0836 153 THR B C 1198 O O . THR A 158 ? 0.5473 0.9212 0.5490 -0.0354 0.0228 0.0753 153 THR B O 1199 C CB . THR A 158 ? 0.6781 0.9415 0.5901 0.0406 0.0556 0.1134 153 THR B CB 1200 O OG1 . THR A 158 ? 0.6483 1.0122 0.5904 0.0568 0.0319 0.1154 153 THR B OG1 1201 C CG2 . THR A 158 ? 0.7094 0.9211 0.5894 0.0426 0.0632 0.1236 153 THR B CG2 1202 N N . TRP A 159 ? 0.6331 0.9126 0.5823 0.0061 0.0628 0.0847 154 TRP B N 1203 C CA . TRP A 159 ? 0.6129 0.9365 0.5848 0.0063 0.0612 0.0769 154 TRP B CA 1204 C C . TRP A 159 ? 0.6577 0.9988 0.6164 0.0604 0.0742 0.0901 154 TRP B C 1205 O O . TRP A 159 ? 0.7241 0.9944 0.6396 0.0924 0.0992 0.1013 154 TRP B O 1206 C CB . TRP A 159 ? 0.6204 0.8930 0.5825 -0.0221 0.0749 0.0617 154 TRP B CB 1207 C CG . TRP A 159 ? 0.5738 0.8525 0.5526 -0.0678 0.0597 0.0492 154 TRP B CG 1208 C CD1 . TRP A 159 ? 0.5781 0.8145 0.5435 -0.0913 0.0616 0.0434 154 TRP B CD1 1209 C CD2 . TRP A 159 ? 0.5257 0.8559 0.5339 -0.0915 0.0437 0.0421 154 TRP B CD2 1210 N NE1 . TRP A 159 ? 0.5339 0.7987 0.5194 -0.1225 0.0453 0.0343 154 TRP B NE1 1211 C CE2 . TRP A 159 ? 0.5045 0.8190 0.5124 -0.1221 0.0356 0.0350 154 TRP B CE2 1212 C CE3 . TRP A 159 ? 0.5050 0.8917 0.5367 -0.0895 0.0387 0.0411 154 TRP B CE3 1213 C CZ2 . TRP A 159 ? 0.4717 0.8160 0.4955 -0.1441 0.0239 0.0308 154 TRP B CZ2 1214 C CZ3 . TRP A 159 ? 0.4718 0.8822 0.5193 -0.1187 0.0294 0.0350 154 TRP B CZ3 1215 C CH2 . TRP A 159 ? 0.4595 0.8441 0.4998 -0.1424 0.0227 0.0318 154 TRP B CH2 1216 N N . ASN A 160 ? 0.6268 1.0619 0.6203 0.0709 0.0603 0.0882 155 ASN B N 1217 C CA . ASN A 160 ? 0.6647 1.1459 0.6533 0.1276 0.0684 0.1003 155 ASN B CA 1218 C C . ASN A 160 ? 0.7200 1.1776 0.6715 0.1772 0.0748 0.1227 155 ASN B C 1219 O O . ASN A 160 ? 0.7905 1.2025 0.7018 0.2298 0.0994 0.1390 155 ASN B O 1220 C CB . ASN A 160 ? 0.7056 1.1414 0.6756 0.1445 0.0944 0.0979 155 ASN B CB 1221 C CG . ASN A 160 ? 0.6583 1.1436 0.6657 0.1088 0.0876 0.0794 155 ASN B CG 1222 O OD1 . ASN A 160 ? 0.6006 1.1594 0.6477 0.0766 0.0663 0.0699 155 ASN B OD1 1223 N ND2 . ASN A 160 ? 0.6917 1.1311 0.6811 0.1144 0.1098 0.0738 155 ASN B ND2 1224 N N . SER A 161 ? 0.6926 1.1781 0.6533 0.1614 0.0545 0.1239 156 SER B N 1225 C CA . SER A 161 ? 0.7421 1.1905 0.6627 0.1962 0.0601 0.1443 156 SER B CA 1226 C C . SER A 161 ? 0.8018 1.1100 0.6724 0.1886 0.0910 0.1495 156 SER B C 1227 O O . SER A 161 ? 0.7752 1.0403 0.6549 0.1344 0.0894 0.1335 156 SER B O 1228 C CB . SER A 161 ? 0.7845 1.3024 0.6922 0.2687 0.0604 0.1640 156 SER B CB 1229 O OG . SER A 161 ? 0.7237 1.3838 0.6857 0.2582 0.0307 0.1495 156 SER B OG 1230 N N . GLY A 162 ? 0.8913 1.1298 0.7071 0.2420 0.1215 0.1704 157 GLY B N 1231 C CA . GLY A 162 ? 0.9617 1.0576 0.7238 0.2305 0.1601 0.1711 157 GLY B CA 1232 C C . GLY A 162 ? 0.9956 1.0356 0.7442 0.2284 0.1875 0.1596 157 GLY B C 1233 O O . GLY A 162 ? 1.0635 0.9871 0.7663 0.2148 0.2237 0.1545 157 GLY B O 1234 N N . SER A 163 ? 0.9528 1.0772 0.7406 0.2375 0.1724 0.1525 158 SER B N 1235 C CA . SER A 163 ? 0.9982 1.0837 0.7683 0.2560 0.1998 0.1473 158 SER B CA 1236 C C . SER A 163 ? 0.9930 1.0047 0.7584 0.1943 0.2141 0.1201 158 SER B C 1237 O O . SER A 163 ? 1.0769 0.9886 0.7945 0.2014 0.2534 0.1155 158 SER B O 1238 C CB . SER A 163 ? 0.9436 1.1531 0.7648 0.2725 0.1774 0.1429 158 SER B CB 1239 O OG . SER A 163 ? 1.0140 1.1929 0.8070 0.3192 0.2074 0.1485 158 SER B OG 1240 N N . LEU A 164 ? 0.9003 0.9645 0.7123 0.1357 0.1836 0.1014 159 LEU B N 1241 C CA . LEU A 164 ? 0.8829 0.9043 0.6963 0.0771 0.1895 0.0747 159 LEU B CA 1242 C C . LEU A 164 ? 0.8901 0.8520 0.6843 0.0425 0.1950 0.0694 159 LEU B C 1243 O O . LEU A 164 ? 0.8253 0.8374 0.6506 0.0186 0.1662 0.0694 159 LEU B O 1244 C CB . LEU A 164 ? 0.7902 0.9036 0.6596 0.0403 0.1559 0.0602 159 LEU B CB 1245 C CG . LEU A 164 ? 0.7865 0.9321 0.6687 0.0464 0.1605 0.0512 159 LEU B CG 1246 C CD1 . LEU A 164 ? 0.7033 0.9330 0.6342 0.0114 0.1297 0.0420 159 LEU B CD1 1247 C CD2 . LEU A 164 ? 0.8444 0.9074 0.6893 0.0297 0.1918 0.0322 159 LEU B CD2 1248 N N . SER A 165 ? 0.9158 0.7301 0.6129 0.0024 0.1295 0.0419 160 SER B N 1249 C CA . SER A 165 ? 0.9377 0.7047 0.5840 -0.0284 0.1419 0.0344 160 SER B CA 1250 C C . SER A 165 ? 0.9111 0.6953 0.5579 -0.0699 0.1642 0.0077 160 SER B C 1251 O O . SER A 165 ? 0.8697 0.6861 0.5183 -0.0995 0.1565 -0.0014 160 SER B O 1252 C CB . SER A 165 ? 1.0363 0.7024 0.6197 -0.0119 0.1659 0.0420 160 SER B CB 1253 O OG . SER A 165 ? 1.0673 0.7235 0.6520 0.0366 0.1455 0.0676 160 SER B OG 1254 N N . SER A 166 ? 0.9382 0.7050 0.5841 -0.0700 0.1916 -0.0057 161 SER B N 1255 C CA . SER A 166 ? 0.9269 0.7112 0.5679 -0.1087 0.2146 -0.0345 161 SER B CA 1256 C C . SER A 166 ? 0.8442 0.7215 0.5297 -0.1225 0.1926 -0.0379 161 SER B C 1257 O O . SER A 166 ? 0.7996 0.7221 0.5255 -0.1013 0.1689 -0.0208 161 SER B O 1258 C CB . SER A 166 ? 0.9786 0.7242 0.6099 -0.1024 0.2490 -0.0485 161 SER B CB 1259 O OG . SER A 166 ? 1.0679 0.7143 0.6504 -0.0894 0.2757 -0.0454 161 SER B OG 1260 N N . GLY A 167 ? 0.8299 0.7352 0.5057 -0.1582 0.2019 -0.0606 162 GLY B N 1261 C CA . GLY A 167 ? 0.7697 0.7563 0.4765 -0.1691 0.1840 -0.0626 162 GLY B CA 1262 C C . GLY A 167 ? 0.7180 0.7430 0.4493 -0.1608 0.1508 -0.0423 162 GLY B C 1263 O O . GLY A 167 ? 0.6765 0.7568 0.4370 -0.1574 0.1354 -0.0341 162 GLY B O 1264 N N . VAL A 168 ? 0.7295 0.7206 0.4448 -0.1589 0.1427 -0.0349 163 VAL B N 1265 C CA . VAL A 168 ? 0.6879 0.7092 0.4229 -0.1538 0.1144 -0.0195 163 VAL B CA 1266 C C . VAL A 168 ? 0.6812 0.7177 0.4017 -0.1798 0.1143 -0.0340 163 VAL B C 1267 O O . VAL A 168 ? 0.7214 0.7228 0.4089 -0.1994 0.1346 -0.0519 163 VAL B O 1268 C CB . VAL A 168 ? 0.7046 0.6867 0.4336 -0.1312 0.1015 -0.0006 163 VAL B CB 1269 C CG1 . VAL A 168 ? 0.6676 0.6766 0.4110 -0.1326 0.0764 0.0089 163 VAL B CG1 1270 C CG2 . VAL A 168 ? 0.7069 0.6928 0.4616 -0.1016 0.0964 0.0126 163 VAL B CG2 1271 N N . HIS A 169 ? 0.6379 0.7259 0.3842 -0.1796 0.0942 -0.0274 164 HIS B N 1272 C CA . HIS A 169 ? 0.6273 0.7361 0.3690 -0.1962 0.0893 -0.0378 164 HIS B CA 1273 C C . HIS A 169 ? 0.5989 0.7197 0.3623 -0.1822 0.0661 -0.0189 164 HIS B C 1274 O O . HIS A 169 ? 0.5722 0.7247 0.3636 -0.1694 0.0536 -0.0051 164 HIS B O 1275 C CB . HIS A 169 ? 0.6079 0.7784 0.3594 -0.2086 0.0906 -0.0530 164 HIS B CB 1276 C CG . HIS A 169 ? 0.6370 0.8076 0.3700 -0.2257 0.1131 -0.0759 164 HIS B CG 1277 N ND1 . HIS A 169 ? 0.6789 0.8175 0.3828 -0.2512 0.1365 -0.1015 164 HIS B ND1 1278 C CD2 . HIS A 169 ? 0.6386 0.8362 0.3755 -0.2243 0.1188 -0.0797 164 HIS B CD2 1279 C CE1 . HIS A 169 ? 0.7040 0.8495 0.3965 -0.2655 0.1559 -0.1219 164 HIS B CE1 1280 N NE2 . HIS A 169 ? 0.6797 0.8631 0.3915 -0.2488 0.1444 -0.1090 164 HIS B NE2 1281 N N . THR A 170 ? 0.6137 0.7046 0.3609 -0.1867 0.0634 -0.0192 165 THR B N 1282 C CA . THR A 170 ? 0.5904 0.6941 0.3551 -0.1794 0.0446 -0.0080 165 THR B CA 1283 C C . THR A 170 ? 0.5807 0.7075 0.3431 -0.1955 0.0476 -0.0238 165 THR B C 1284 O O . THR A 170 ? 0.6091 0.7130 0.3447 -0.2132 0.0618 -0.0398 165 THR B O 1285 C CB . THR A 170 ? 0.6155 0.6746 0.3627 -0.1710 0.0373 0.0025 165 THR B CB 1286 O OG1 . THR A 170 ? 0.6281 0.6723 0.3796 -0.1526 0.0348 0.0147 165 THR B OG1 1287 C CG2 . THR A 170 ? 0.5935 0.6700 0.3607 -0.1669 0.0189 0.0101 165 THR B CG2 1288 N N . PHE A 171 ? 0.5466 0.7174 0.3370 -0.1884 0.0365 -0.0195 166 PHE B N 1289 C CA . PHE A 171 ? 0.5360 0.7429 0.3320 -0.1977 0.0385 -0.0355 166 PHE B CA 1290 C C . PHE A 171 ? 0.5357 0.7252 0.3303 -0.2003 0.0344 -0.0366 166 PHE B C 1291 O O . PHE A 171 ? 0.5397 0.7035 0.3374 -0.1909 0.0246 -0.0215 166 PHE B O 1292 C CB . PHE A 171 ? 0.5116 0.7719 0.3331 -0.1825 0.0297 -0.0283 166 PHE B CB 1293 C CG . PHE A 171 ? 0.5142 0.7973 0.3314 -0.1831 0.0351 -0.0309 166 PHE B CG 1294 C CD1 . PHE A 171 ? 0.5264 0.8453 0.3344 -0.1993 0.0447 -0.0559 166 PHE B CD1 1295 C CD2 . PHE A 171 ? 0.5127 0.7834 0.3348 -0.1709 0.0329 -0.0125 166 PHE B CD2 1296 C CE1 . PHE A 171 ? 0.5320 0.8724 0.3326 -0.2026 0.0508 -0.0617 166 PHE B CE1 1297 C CE2 . PHE A 171 ? 0.5191 0.8088 0.3342 -0.1728 0.0403 -0.0166 166 PHE B CE2 1298 C CZ . PHE A 171 ? 0.5299 0.8529 0.3323 -0.1886 0.0489 -0.0411 166 PHE B CZ 1299 N N . PRO A 172 ? 0.5387 0.7464 0.3296 -0.2152 0.0431 -0.0578 167 PRO B N 1300 C CA . PRO A 172 ? 0.5410 0.7356 0.3314 -0.2183 0.0417 -0.0613 167 PRO B CA 1301 C C . PRO A 172 ? 0.5180 0.7310 0.3386 -0.1974 0.0277 -0.0468 167 PRO B C 1302 O O . PRO A 172 ? 0.4998 0.7526 0.3437 -0.1814 0.0222 -0.0404 167 PRO B O 1303 C CB . PRO A 172 ? 0.5477 0.7768 0.3390 -0.2372 0.0559 -0.0903 167 PRO B CB 1304 C CG . PRO A 172 ? 0.5645 0.7987 0.3404 -0.2537 0.0695 -0.1045 167 PRO B CG 1305 C CD . PRO A 172 ? 0.5488 0.7882 0.3338 -0.2347 0.0581 -0.0841 167 PRO B CD 1306 N N . ALA A 173 ? 0.5249 0.7058 0.3403 -0.1979 0.0239 -0.0424 168 ALA B N 1307 C CA . ALA A 173 ? 0.5153 0.7010 0.3552 -0.1829 0.0163 -0.0325 168 ALA B CA 1308 C C . ALA A 173 ? 0.5112 0.7369 0.3732 -0.1743 0.0209 -0.0432 168 ALA B C 1309 O O . ALA A 173 ? 0.5186 0.7696 0.3776 -0.1856 0.0294 -0.0637 168 ALA B O 1310 C CB . ALA A 173 ? 0.5323 0.6785 0.3577 -0.1914 0.0136 -0.0330 168 ALA B CB 1311 N N . VAL A 174 ? 0.5126 0.7446 0.3973 -0.1533 0.0169 -0.0298 169 VAL B N 1312 C CA . VAL A 174 ? 0.5225 0.7849 0.4285 -0.1373 0.0210 -0.0370 169 VAL B CA 1313 C C . VAL A 174 ? 0.5417 0.7688 0.4576 -0.1267 0.0239 -0.0279 169 VAL B C 1314 O O . VAL A 174 ? 0.5485 0.7429 0.4625 -0.1258 0.0212 -0.0114 169 VAL B O 1315 C CB . VAL A 174 ? 0.5174 0.8305 0.4387 -0.1128 0.0159 -0.0281 169 VAL B CB 1316 C CG1 . VAL A 174 ? 0.5083 0.8602 0.4203 -0.1278 0.0151 -0.0425 169 VAL B CG1 1317 C CG2 . VAL A 174 ? 0.5237 0.8147 0.4454 -0.0944 0.0116 0.0010 169 VAL B CG2 1318 N N . LEU A 175 ? 0.5584 0.7935 0.4869 -0.1200 0.0320 -0.0414 170 LEU B N 1319 C CA . LEU A 175 ? 0.5871 0.7837 0.5241 -0.1109 0.0397 -0.0365 170 LEU B CA 1320 C C . LEU A 175 ? 0.6065 0.7996 0.5567 -0.0793 0.0405 -0.0117 170 LEU B C 1321 O O . LEU A 175 ? 0.6047 0.8405 0.5631 -0.0555 0.0355 -0.0034 170 LEU B O 1322 C CB . LEU A 175 ? 0.6039 0.8075 0.5515 -0.1096 0.0518 -0.0586 170 LEU B CB 1323 C CG . LEU A 175 ? 0.6278 0.7810 0.5652 -0.1280 0.0617 -0.0703 170 LEU B CG 1324 C CD1 . LEU A 175 ? 0.6231 0.7461 0.5325 -0.1574 0.0530 -0.0696 170 LEU B CD1 1325 C CD2 . LEU A 175 ? 0.6382 0.8066 0.5800 -0.1347 0.0746 -0.0981 170 LEU B CD2 1326 N N . GLN A 176 ? 0.6340 0.7754 0.5830 -0.0806 0.0482 -0.0010 171 GLN B N 1327 C CA . GLN A 176 ? 0.6684 0.7875 0.6224 -0.0531 0.0560 0.0239 171 GLN B CA 1328 C C . GLN A 176 ? 0.7060 0.7675 0.6638 -0.0546 0.0749 0.0203 171 GLN B C 1329 O O . GLN A 176 ? 0.7128 0.7354 0.6656 -0.0790 0.0801 0.0183 171 GLN B O 1330 C CB . GLN A 176 ? 0.6667 0.7777 0.6113 -0.0595 0.0504 0.0436 171 GLN B CB 1331 C CG . GLN A 176 ? 0.7097 0.7898 0.6513 -0.0342 0.0627 0.0710 171 GLN B CG 1332 C CD . GLN A 176 ? 0.7069 0.7918 0.6386 -0.0394 0.0580 0.0889 171 GLN B CD 1333 O OE1 . GLN A 176 ? 0.6826 0.7772 0.6149 -0.0664 0.0493 0.0791 171 GLN B OE1 1334 N NE2 . GLN A 176 ? 0.7401 0.8170 0.6602 -0.0115 0.0648 0.1158 171 GLN B NE2 1335 N N . SER A 177 ? 0.7313 0.7913 0.6998 -0.0284 0.0862 0.0167 172 SER B N 1336 C CA . SER A 177 ? 0.7678 0.7767 0.7400 -0.0346 0.1068 0.0027 172 SER B CA 1337 C C . SER A 177 ? 0.7332 0.7571 0.6994 -0.0740 0.0989 -0.0270 172 SER B C 1338 O O . SER A 177 ? 0.6991 0.7724 0.6636 -0.0797 0.0846 -0.0355 172 SER B O 1339 C CB . SER A 177 ? 0.8134 0.7517 0.7779 -0.0418 0.1252 0.0165 172 SER B CB 1340 O OG . SER A 177 ? 0.8748 0.7623 0.8430 -0.0183 0.1513 0.0187 172 SER B OG 1341 N N . ASP A 178 ? 0.7481 0.7295 0.7068 -0.1024 0.1086 -0.0428 173 ASP B N 1342 C CA . ASP A 178 ? 0.7259 0.7174 0.6700 -0.1365 0.1010 -0.0685 173 ASP B CA 1343 C C . ASP A 178 ? 0.6881 0.6946 0.6158 -0.1604 0.0799 -0.0638 173 ASP B C 1344 O O . ASP A 178 ? 0.6834 0.6892 0.5916 -0.1868 0.0731 -0.0808 173 ASP B O 1345 C CB . ASP A 178 ? 0.7702 0.7154 0.7097 -0.1566 0.1193 -0.0906 173 ASP B CB 1346 C CG . ASP A 178 ? 0.7935 0.7005 0.7313 -0.1757 0.1237 -0.0864 173 ASP B CG 1347 O OD1 . ASP A 178 ? 0.8009 0.6933 0.7484 -0.1594 0.1285 -0.0628 173 ASP B OD1 1348 O OD2 . ASP A 178 ? 0.8081 0.7025 0.7337 -0.2086 0.1234 -0.1085 173 ASP B OD2 1349 N N . LEU A 179 ? 0.6631 0.6819 0.5957 -0.1497 0.0703 -0.0408 174 LEU B N 1350 C CA . LEU A 179 ? 0.6361 0.6660 0.5575 -0.1688 0.0530 -0.0368 174 LEU B CA 1351 C C . LEU A 179 ? 0.6008 0.6672 0.5194 -0.1569 0.0403 -0.0231 174 LEU B C 1352 O O . LEU A 179 ? 0.5978 0.6820 0.5268 -0.1330 0.0437 -0.0112 174 LEU B O 1353 C CB . LEU A 179 ? 0.6494 0.6558 0.5807 -0.1768 0.0570 -0.0280 174 LEU B CB 1354 C CG . LEU A 179 ? 0.6901 0.6579 0.6257 -0.1949 0.0730 -0.0445 174 LEU B CG 1355 C CD1 . LEU A 179 ? 0.7063 0.6552 0.6557 -0.2034 0.0818 -0.0355 174 LEU B CD1 1356 C CD2 . LEU A 179 ? 0.6934 0.6670 0.6125 -0.2230 0.0628 -0.0698 174 LEU B CD2 1357 N N . TYR A 180 ? 0.5804 0.6573 0.4830 -0.1723 0.0262 -0.0250 175 TYR B N 1358 C CA . TYR A 180 ? 0.5550 0.6597 0.4503 -0.1666 0.0177 -0.0173 175 TYR B CA 1359 C C . TYR A 180 ? 0.5432 0.6538 0.4486 -0.1586 0.0130 0.0019 175 TYR B C 1360 O O . TYR A 180 ? 0.5563 0.6510 0.4716 -0.1640 0.0135 0.0072 175 TYR B O 1361 C CB . TYR A 180 ? 0.5543 0.6562 0.4209 -0.1845 0.0099 -0.0281 175 TYR B CB 1362 C CG . TYR A 180 ? 0.5686 0.6688 0.4197 -0.1942 0.0185 -0.0477 175 TYR B CG 1363 C CD1 . TYR A 180 ? 0.5599 0.6874 0.4131 -0.1904 0.0258 -0.0556 175 TYR B CD1 1364 C CD2 . TYR A 180 ? 0.5909 0.6673 0.4258 -0.2094 0.0207 -0.0614 175 TYR B CD2 1365 C CE1 . TYR A 180 ? 0.5741 0.7044 0.4169 -0.2022 0.0371 -0.0767 175 TYR B CE1 1366 C CE2 . TYR A 180 ? 0.6086 0.6826 0.4278 -0.2200 0.0319 -0.0805 175 TYR B CE2 1367 C CZ . TYR A 180 ? 0.5991 0.6997 0.4238 -0.2167 0.0411 -0.0882 175 TYR B CZ 1368 O OH . TYR A 180 ? 0.6185 0.7211 0.4311 -0.2300 0.0557 -0.1105 175 TYR B OH 1369 N N . THR A 181 ? 0.5262 0.6630 0.4297 -0.1484 0.0105 0.0092 176 THR B N 1370 C CA . THR A 181 ? 0.5165 0.6621 0.4251 -0.1419 0.0076 0.0255 176 THR B CA 1371 C C . THR A 181 ? 0.4993 0.6676 0.3938 -0.1442 0.0031 0.0218 176 THR B C 1372 O O . THR A 181 ? 0.4937 0.6834 0.3825 -0.1430 0.0055 0.0114 176 THR B O 1373 C CB . THR A 181 ? 0.5257 0.6783 0.4451 -0.1204 0.0154 0.0421 176 THR B CB 1374 O OG1 . THR A 181 ? 0.5534 0.6740 0.4825 -0.1174 0.0258 0.0452 176 THR B OG1 1375 C CG2 . THR A 181 ? 0.5223 0.6816 0.4426 -0.1169 0.0153 0.0580 176 THR B CG2 1376 N N . LEU A 182 ? 0.4915 0.6566 0.3824 -0.1484 -0.0011 0.0275 177 LEU B N 1377 C CA . LEU A 182 ? 0.4833 0.6654 0.3622 -0.1484 -0.0003 0.0258 177 LEU B CA 1378 C C . LEU A 182 ? 0.4775 0.6631 0.3648 -0.1431 -0.0002 0.0387 177 LEU B C 1379 O O . LEU A 182 ? 0.4733 0.6495 0.3769 -0.1420 -0.0011 0.0474 177 LEU B O 1380 C CB . LEU A 182 ? 0.4937 0.6587 0.3477 -0.1619 -0.0006 0.0128 177 LEU B CB 1381 C CG . LEU A 182 ? 0.5058 0.6428 0.3491 -0.1655 -0.0080 0.0159 177 LEU B CG 1382 C CD1 . LEU A 182 ? 0.5046 0.6449 0.3546 -0.1576 -0.0096 0.0258 177 LEU B CD1 1383 C CD2 . LEU A 182 ? 0.5305 0.6422 0.3381 -0.1765 -0.0043 0.0047 177 LEU B CD2 1384 N N . SER A 183 ? 0.4753 0.6756 0.3520 -0.1430 0.0034 0.0363 178 SER B N 1385 C CA . SER A 183 ? 0.4752 0.6791 0.3576 -0.1392 0.0062 0.0449 178 SER B CA 1386 C C . SER A 183 ? 0.4804 0.6773 0.3441 -0.1452 0.0105 0.0347 178 SER B C 1387 O O . SER A 183 ? 0.4906 0.6841 0.3350 -0.1542 0.0144 0.0210 178 SER B O 1388 C CB . SER A 183 ? 0.4775 0.7061 0.3638 -0.1294 0.0118 0.0554 178 SER B CB 1389 O OG . SER A 183 ? 0.4871 0.7428 0.3604 -0.1283 0.0121 0.0461 178 SER B OG 1390 N N . SER A 184 ? 0.4820 0.6751 0.3520 -0.1407 0.0133 0.0400 179 SER B N 1391 C CA . SER A 184 ? 0.4986 0.6756 0.3509 -0.1425 0.0211 0.0321 179 SER B CA 1392 C C . SER A 184 ? 0.4984 0.6939 0.3596 -0.1381 0.0304 0.0352 179 SER B C 1393 O O . SER A 184 ? 0.4880 0.6976 0.3724 -0.1318 0.0289 0.0465 179 SER B O 1394 C CB . SER A 184 ? 0.5131 0.6627 0.3647 -0.1353 0.0139 0.0359 179 SER B CB 1395 O OG . SER A 184 ? 0.5428 0.6662 0.3726 -0.1323 0.0244 0.0308 179 SER B OG 1396 N N . SER A 185 ? 0.5147 0.7089 0.3560 -0.1445 0.0433 0.0230 180 SER B N 1397 C CA . SER A 185 ? 0.5203 0.7310 0.3652 -0.1423 0.0547 0.0227 180 SER B CA 1398 C C . SER A 185 ? 0.5501 0.7300 0.3857 -0.1396 0.0670 0.0150 180 SER B C 1399 O O . SER A 185 ? 0.5735 0.7180 0.3871 -0.1433 0.0710 0.0070 180 SER B O 1400 C CB . SER A 185 ? 0.5220 0.7658 0.3507 -0.1520 0.0607 0.0124 180 SER B CB 1401 O OG . SER A 185 ? 0.5437 0.7773 0.3481 -0.1668 0.0737 -0.0098 180 SER B OG 1402 N N . VAL A 186 ? 0.5581 0.7472 0.4085 -0.1317 0.0757 0.0181 181 VAL B N 1403 C CA . VAL A 186 ? 0.5916 0.7524 0.4348 -0.1250 0.0912 0.0101 181 VAL B CA 1404 C C . VAL A 186 ? 0.5974 0.7808 0.4432 -0.1286 0.1084 0.0031 181 VAL B C 1405 O O . VAL A 186 ? 0.5758 0.7927 0.4402 -0.1276 0.1058 0.0124 181 VAL B O 1406 C CB . VAL A 186 ? 0.5990 0.7451 0.4651 -0.1032 0.0818 0.0214 181 VAL B CB 1407 C CG1 . VAL A 186 ? 0.5736 0.7603 0.4819 -0.0966 0.0743 0.0315 181 VAL B CG1 1408 C CG2 . VAL A 186 ? 0.6413 0.7514 0.4961 -0.0893 0.0988 0.0148 181 VAL B CG2 1409 N N . THR A 187 ? 0.6326 0.7927 0.4551 -0.1351 0.1293 -0.0143 182 THR B N 1410 C CA . THR A 187 ? 0.6458 0.8256 0.4637 -0.1422 0.1485 -0.0259 182 THR B CA 1411 C C . THR A 187 ? 0.6822 0.8293 0.5062 -0.1282 0.1683 -0.0322 182 THR B C 1412 O O . THR A 187 ? 0.7209 0.8178 0.5238 -0.1258 0.1799 -0.0411 182 THR B O 1413 C CB . THR A 187 ? 0.6610 0.8510 0.4441 -0.1672 0.1595 -0.0485 182 THR B CB 1414 O OG1 . THR A 187 ? 0.6286 0.8578 0.4106 -0.1739 0.1395 -0.0417 182 THR B OG1 1415 C CG2 . THR A 187 ? 0.6816 0.8936 0.4547 -0.1761 0.1800 -0.0632 182 THR B CG2 1416 N N . VAL A 188 ? 0.6766 0.8495 0.5278 -0.1184 0.1748 -0.0277 183 VAL B N 1417 C CA . VAL A 188 ? 0.7084 0.8608 0.5752 -0.1000 0.1935 -0.0336 183 VAL B CA 1418 C C . VAL A 188 ? 0.7252 0.8997 0.5878 -0.1113 0.2184 -0.0485 183 VAL B C 1419 O O . VAL A 188 ? 0.7080 0.9182 0.5571 -0.1302 0.2163 -0.0488 183 VAL B O 1420 C CB . VAL A 188 ? 0.6880 0.8590 0.6030 -0.0741 0.1780 -0.0167 183 VAL B CB 1421 C CG1 . VAL A 188 ? 0.6843 0.8299 0.5972 -0.0603 0.1551 -0.0044 183 VAL B CG1 1422 C CG2 . VAL A 188 ? 0.6493 0.8731 0.5924 -0.0831 0.1687 -0.0064 183 VAL B CG2 1423 N N . PRO A 189 ? 0.7643 0.9162 0.6352 -0.0977 0.2429 -0.0605 184 PRO B N 1424 C CA . PRO A 189 ? 0.7821 0.9562 0.6530 -0.1069 0.2690 -0.0756 184 PRO B CA 1425 C C . PRO A 189 ? 0.7513 0.9782 0.6587 -0.1040 0.2622 -0.0616 184 PRO B C 1426 O O . PRO A 189 ? 0.7285 0.9686 0.6795 -0.0841 0.2494 -0.0484 184 PRO B O 1427 C CB . PRO A 189 ? 0.8298 0.9615 0.7089 -0.0854 0.2954 -0.0891 184 PRO B CB 1428 C CG . PRO A 189 ? 0.8530 0.9266 0.7117 -0.0742 0.2884 -0.0851 184 PRO B CG 1429 C CD . PRO A 189 ? 0.8030 0.8997 0.6734 -0.0730 0.2510 -0.0620 184 PRO B CD 1430 N N . SER A 190 ? 0.7567 1.0139 0.6427 -0.1254 0.2716 -0.0655 185 SER B N 1431 C CA . SER A 190 ? 0.7424 1.0403 0.6502 -0.1283 0.2723 -0.0521 185 SER B CA 1432 C C . SER A 190 ? 0.7475 1.0582 0.7065 -0.1115 0.2890 -0.0565 185 SER B C 1433 O O . SER A 190 ? 0.7221 1.0612 0.7195 -0.1079 0.2818 -0.0437 185 SER B O 1434 C CB . SER A 190 ? 0.7683 1.0873 0.6322 -0.1508 0.2876 -0.0586 185 SER B CB 1435 O OG . SER A 190 ? 0.7602 1.1068 0.6254 -0.1563 0.2828 -0.0378 185 SER B OG 1436 N N . SER A 191 ? 0.7836 1.0741 0.7449 -0.1017 0.3133 -0.0771 186 SER B N 1437 C CA . SER A 191 ? 0.7948 1.1026 0.8086 -0.0810 0.3308 -0.0847 186 SER B CA 1438 C C . SER A 191 ? 0.7646 1.0884 0.8323 -0.0555 0.3048 -0.0700 186 SER B C 1439 O O . SER A 191 ? 0.7544 1.1215 0.8748 -0.0475 0.3086 -0.0706 186 SER B O 1440 C CB . SER A 191 ? 0.8444 1.1151 0.8481 -0.0684 0.3600 -0.1083 186 SER B CB 1441 O OG . SER A 191 ? 0.8583 1.0766 0.8418 -0.0544 0.3481 -0.1063 186 SER B OG 1442 N N . THR A 192 ? 0.7554 1.0493 0.8081 -0.0463 0.2785 -0.0588 187 THR B N 1443 C CA . THR A 192 ? 0.7415 1.0439 0.8350 -0.0179 0.2536 -0.0478 187 THR B CA 1444 C C . THR A 192 ? 0.6970 1.0323 0.8091 -0.0295 0.2242 -0.0309 187 THR B C 1445 O O . THR A 192 ? 0.6852 1.0334 0.8274 -0.0103 0.2004 -0.0233 187 THR B O 1446 C CB . THR A 192 ? 0.7715 1.0130 0.8322 0.0016 0.2462 -0.0456 187 THR B CB 1447 O OG1 . THR A 192 ? 0.7885 1.0345 0.8878 0.0424 0.2360 -0.0410 187 THR B OG1 1448 C CG2 . THR A 192 ? 0.7478 0.9668 0.7710 -0.0150 0.2207 -0.0323 187 THR B CG2 1449 N N . TRP A 193 ? 0.6799 1.0253 0.7695 -0.0593 0.2262 -0.0250 188 TRP B N 1450 C CA . TRP A 193 ? 0.6453 1.0179 0.7544 -0.0721 0.2084 -0.0113 188 TRP B CA 1451 C C . TRP A 193 ? 0.6527 1.0505 0.7629 -0.0952 0.2314 -0.0111 188 TRP B C 1452 O O . TRP A 193 ? 0.6781 1.0625 0.7454 -0.1083 0.2489 -0.0134 188 TRP B O 1453 C CB . TRP A 193 ? 0.6266 0.9703 0.6948 -0.0817 0.1855 0.0020 188 TRP B CB 1454 C CG . TRP A 193 ? 0.5960 0.9579 0.6828 -0.0923 0.1687 0.0149 188 TRP B CG 1455 C CD1 . TRP A 193 ? 0.5761 0.9509 0.6961 -0.0832 0.1464 0.0176 188 TRP B CD1 1456 C CD2 . TRP A 193 ? 0.5916 0.9576 0.6617 -0.1138 0.1754 0.0259 188 TRP B CD2 1457 N NE1 . TRP A 193 ? 0.5601 0.9456 0.6880 -0.1015 0.1413 0.0262 188 TRP B NE1 1458 C CE2 . TRP A 193 ? 0.5721 0.9475 0.6685 -0.1186 0.1598 0.0334 188 TRP B CE2 1459 C CE3 . TRP A 193 ? 0.6104 0.9713 0.6416 -0.1279 0.1938 0.0308 188 TRP B CE3 1460 C CZ2 . TRP A 193 ? 0.5754 0.9456 0.6606 -0.1366 0.1655 0.0461 188 TRP B CZ2 1461 C CZ3 . TRP A 193 ? 0.6144 0.9728 0.6315 -0.1416 0.1963 0.0471 188 TRP B CZ3 1462 C CH2 . TRP A 193 ? 0.5996 0.9581 0.6437 -0.1456 0.1840 0.0550 188 TRP B CH2 1463 N N . PRO A 194 ? 0.6396 1.0733 0.7947 -0.1026 0.2327 -0.0093 189 PRO B N 1464 C CA . PRO A 194 ? 0.6162 1.0781 0.8232 -0.0931 0.2109 -0.0099 189 PRO B CA 1465 C C . PRO A 194 ? 0.6173 1.1196 0.8839 -0.0673 0.2118 -0.0266 189 PRO B C 1466 O O . PRO A 194 ? 0.5991 1.1365 0.9101 -0.0584 0.1914 -0.0294 189 PRO B O 1467 C CB . PRO A 194 ? 0.6113 1.0929 0.8337 -0.1210 0.2213 -0.0049 189 PRO B CB 1468 C CG . PRO A 194 ? 0.6398 1.1206 0.8423 -0.1363 0.2566 -0.0075 189 PRO B CG 1469 C CD . PRO A 194 ? 0.6546 1.1018 0.8035 -0.1270 0.2594 -0.0069 189 PRO B CD 1470 N N . SER A 195 ? 0.6425 1.1416 0.9093 -0.0531 0.2339 -0.0385 190 SER B N 1471 C CA . SER A 195 ? 0.6534 1.1947 0.9806 -0.0232 0.2379 -0.0545 190 SER B CA 1472 C C . SER A 195 ? 0.6504 1.1906 0.9920 0.0117 0.2035 -0.0488 190 SER B C 1473 O O . SER A 195 ? 0.6453 1.2441 1.0483 0.0317 0.1913 -0.0575 190 SER B O 1474 C CB . SER A 195 ? 0.6883 1.2124 1.0041 -0.0117 0.2701 -0.0681 190 SER B CB 1475 O OG . SER A 195 ? 0.7090 1.1658 0.9559 -0.0131 0.2718 -0.0618 190 SER B OG 1476 N N . GLU A 196 ? 0.6591 1.1368 0.9433 0.0185 0.1887 -0.0353 191 GLU B N 1477 C CA . GLU A 196 ? 0.6642 1.1288 0.9459 0.0484 0.1568 -0.0256 191 GLU B CA 1478 C C . GLU A 196 ? 0.6345 1.0917 0.8945 0.0241 0.1314 -0.0129 191 GLU B C 1479 O O . GLU A 196 ? 0.6255 1.0526 0.8452 -0.0057 0.1388 -0.0068 191 GLU B O 1480 C CB . GLU A 196 ? 0.7079 1.0996 0.9379 0.0728 0.1633 -0.0209 191 GLU B CB 1481 C CG . GLU A 196 ? 0.7538 1.1387 1.0020 0.1078 0.1874 -0.0324 191 GLU B CG 1482 C CD . GLU A 196 ? 0.7518 1.1799 1.0379 0.0949 0.2198 -0.0513 191 GLU B CD 1483 O OE1 . GLU A 196 ? 0.7764 1.1659 1.0271 0.0804 0.2506 -0.0604 191 GLU B OE1 1484 O OE2 . GLU A 196 ? 0.7299 1.2330 1.0815 0.0980 0.2164 -0.0599 191 GLU B OE2 1485 N N . THR A 197 ? 0.6243 1.1134 0.9121 0.0384 0.1016 -0.0101 192 THR B N 1486 C CA . THR A 197 ? 0.5981 1.0850 0.8720 0.0168 0.0780 -0.0017 192 THR B CA 1487 C C . THR A 197 ? 0.6031 1.0180 0.8076 0.0123 0.0697 0.0127 192 THR B C 1488 O O . THR A 197 ? 0.6347 1.0043 0.8054 0.0356 0.0701 0.0175 192 THR B O 1489 C CB . THR A 197 ? 0.5962 1.1391 0.9141 0.0361 0.0470 -0.0061 192 THR B CB 1490 O OG1 . THR A 197 ? 0.5750 1.1895 0.9541 0.0136 0.0522 -0.0223 192 THR B OG1 1491 C CG2 . THR A 197 ? 0.5945 1.1094 0.8755 0.0314 0.0186 0.0052 192 THR B CG2 1492 N N . VAL A 198 ? 0.5756 0.9793 0.7601 -0.0180 0.0651 0.0183 193 VAL B N 1493 C CA . VAL A 198 ? 0.5748 0.9246 0.7034 -0.0250 0.0548 0.0287 193 VAL B CA 1494 C C . VAL A 198 ? 0.5511 0.9144 0.6860 -0.0406 0.0333 0.0322 193 VAL B C 1495 O O . VAL A 198 ? 0.5264 0.9093 0.6787 -0.0649 0.0398 0.0307 193 VAL B O 1496 C CB . VAL A 198 ? 0.5758 0.8925 0.6642 -0.0456 0.0759 0.0303 193 VAL B CB 1497 C CG1 . VAL A 198 ? 0.5715 0.8495 0.6139 -0.0572 0.0645 0.0374 193 VAL B CG1 1498 C CG2 . VAL A 198 ? 0.6041 0.8985 0.6768 -0.0328 0.0978 0.0231 193 VAL B CG2 1499 N N . THR A 199 ? 0.5617 0.9084 0.6776 -0.0266 0.0106 0.0367 194 THR B N 1500 C CA . THR A 199 ? 0.5491 0.9122 0.6723 -0.0384 -0.0107 0.0362 194 THR B CA 1501 C C . THR A 199 ? 0.5605 0.8709 0.6286 -0.0401 -0.0210 0.0447 194 THR B C 1502 O O . THR A 199 ? 0.5914 0.8685 0.6273 -0.0186 -0.0258 0.0503 194 THR B O 1503 C CB . THR A 199 ? 0.5571 0.9723 0.7196 -0.0175 -0.0328 0.0293 194 THR B CB 1504 O OG1 . THR A 199 ? 0.5528 1.0217 0.7704 -0.0125 -0.0208 0.0183 194 THR B OG1 1505 C CG2 . THR A 199 ? 0.5445 0.9866 0.7198 -0.0365 -0.0523 0.0225 194 THR B CG2 1506 N N . CYS A 200 ? 0.5439 0.8434 0.5998 -0.0649 -0.0214 0.0454 195 CYS B N 1507 C CA . CYS A 200 ? 0.5584 0.8156 0.5677 -0.0689 -0.0301 0.0499 195 CYS B CA 1508 C C . CYS A 200 ? 0.5583 0.8315 0.5722 -0.0668 -0.0543 0.0469 195 CYS B C 1509 O O . CYS A 200 ? 0.5420 0.8545 0.5929 -0.0796 -0.0603 0.0386 195 CYS B O 1510 C CB . CYS A 200 ? 0.5492 0.7876 0.5410 -0.0916 -0.0182 0.0513 195 CYS B CB 1511 S SG . CYS A 200 ? 0.5438 0.8012 0.5602 -0.1132 -0.0225 0.0482 195 CYS B SG 1512 N N . ASN A 201 ? 0.5831 0.8237 0.5558 -0.0525 -0.0657 0.0524 196 ASN B N 1513 C CA . ASN A 201 ? 0.5948 0.8475 0.5589 -0.0477 -0.0901 0.0506 196 ASN B CA 1514 C C . ASN A 201 ? 0.5941 0.8077 0.5177 -0.0679 -0.0889 0.0501 196 ASN B C 1515 O O . ASN A 201 ? 0.6125 0.7766 0.4919 -0.0677 -0.0779 0.0558 196 ASN B O 1516 C CB . ASN A 201 ? 0.6397 0.8789 0.5780 -0.0123 -0.1027 0.0603 196 ASN B CB 1517 C CG . ASN A 201 ? 0.6450 0.9008 0.6120 0.0115 -0.0932 0.0627 196 ASN B CG 1518 O OD1 . ASN A 201 ? 0.6705 0.8776 0.6068 0.0246 -0.0761 0.0705 196 ASN B OD1 1519 N ND2 . ASN A 201 ? 0.6225 0.9472 0.6504 0.0137 -0.1002 0.0526 196 ASN B ND2 1520 N N . VAL A 202 ? 0.5748 0.8113 0.5155 -0.0876 -0.0970 0.0404 197 VAL B N 1521 C CA . VAL A 202 ? 0.5747 0.7792 0.4839 -0.1067 -0.0938 0.0372 197 VAL B CA 1522 C C . VAL A 202 ? 0.5988 0.8095 0.4874 -0.1072 -0.1151 0.0313 197 VAL B C 1523 O O . VAL A 202 ? 0.5986 0.8558 0.5182 -0.1097 -0.1303 0.0212 197 VAL B O 1524 C CB . VAL A 202 ? 0.5430 0.7568 0.4817 -0.1299 -0.0797 0.0305 197 VAL B CB 1525 C CG1 . VAL A 202 ? 0.5468 0.7301 0.4571 -0.1453 -0.0753 0.0259 197 VAL B CG1 1526 C CG2 . VAL A 202 ? 0.5254 0.7352 0.4760 -0.1275 -0.0605 0.0379 197 VAL B CG2 1527 N N . ALA A 203 ? 0.6251 0.7913 0.4595 -0.1070 -0.1148 0.0355 198 ALA B N 1528 C CA . ALA A 203 ? 0.6589 0.8247 0.4617 -0.1090 -0.1330 0.0305 198 ALA B CA 1529 C C . ALA A 203 ? 0.6568 0.7934 0.4368 -0.1348 -0.1211 0.0209 198 ALA B C 1530 O O . ALA A 203 ? 0.6530 0.7524 0.4131 -0.1411 -0.1016 0.0239 198 ALA B O 1531 C CB . ALA A 203 ? 0.7115 0.8452 0.4596 -0.0820 -0.1426 0.0458 198 ALA B CB 1532 N N . HIS A 204 ? 0.6611 0.8193 0.4466 -0.1503 -0.1319 0.0062 199 HIS B N 1533 C CA . HIS A 204 ? 0.6680 0.8005 0.4314 -0.1730 -0.1212 -0.0056 199 HIS B CA 1534 C C . HIS A 204 ? 0.7125 0.8493 0.4367 -0.1764 -0.1401 -0.0139 199 HIS B C 1535 O O . HIS A 204 ? 0.7118 0.8832 0.4580 -0.1917 -0.1498 -0.0319 199 HIS B O 1536 C CB . HIS A 204 ? 0.6335 0.7825 0.4456 -0.1929 -0.1080 -0.0188 199 HIS B CB 1537 C CG . HIS A 204 ? 0.6402 0.7610 0.4360 -0.2113 -0.0928 -0.0307 199 HIS B CG 1538 N ND1 . HIS A 204 ? 0.6493 0.7782 0.4575 -0.2315 -0.0910 -0.0502 199 HIS B ND1 1539 C CD2 . HIS A 204 ? 0.6418 0.7293 0.4124 -0.2131 -0.0767 -0.0286 199 HIS B CD2 1540 C CE1 . HIS A 204 ? 0.6574 0.7561 0.4487 -0.2415 -0.0743 -0.0578 199 HIS B CE1 1541 N NE2 . HIS A 204 ? 0.6512 0.7290 0.4216 -0.2305 -0.0664 -0.0454 199 HIS B NE2 1542 N N . PRO A 205 ? 0.7590 0.8582 0.4205 -0.1633 -0.1436 -0.0015 200 PRO B N 1543 C CA . PRO A 205 ? 0.8167 0.9170 0.4271 -0.1598 -0.1639 -0.0035 200 PRO B CA 1544 C C . PRO A 205 ? 0.8250 0.9344 0.4312 -0.1898 -0.1625 -0.0280 200 PRO B C 1545 O O . PRO A 205 ? 0.8558 0.9982 0.4482 -0.1918 -0.1849 -0.0385 200 PRO B O 1546 C CB . PRO A 205 ? 0.8661 0.9001 0.4038 -0.1486 -0.1523 0.0143 200 PRO B CB 1547 C CG . PRO A 205 ? 0.8401 0.8547 0.3988 -0.1362 -0.1357 0.0278 200 PRO B CG 1548 C CD . PRO A 205 ? 0.7694 0.8192 0.4001 -0.1526 -0.1256 0.0147 200 PRO B CD 1549 N N . ALA A 206 ? 0.8019 0.8858 0.4207 -0.2115 -0.1365 -0.0386 201 ALA B N 1550 C CA . ALA A 206 ? 0.8147 0.8982 0.4296 -0.2390 -0.1289 -0.0632 201 ALA B CA 1551 C C . ALA A 206 ? 0.8047 0.9389 0.4665 -0.2528 -0.1408 -0.0835 201 ALA B C 1552 O O . ALA A 206 ? 0.8430 0.9903 0.4848 -0.2707 -0.1487 -0.1043 201 ALA B O 1553 C CB . ALA A 206 ? 0.7875 0.8414 0.4195 -0.2526 -0.0982 -0.0697 201 ALA B CB 1554 N N . SER A 207 ? 0.7613 0.9230 0.4831 -0.2481 -0.1393 -0.0803 202 SER B N 1555 C CA . SER A 207 ? 0.7557 0.9663 0.5258 -0.2647 -0.1463 -0.1014 202 SER B CA 1556 C C . SER A 207 ? 0.7663 1.0367 0.5496 -0.2481 -0.1772 -0.0986 202 SER B C 1557 O O . SER A 207 ? 0.7576 1.0798 0.5865 -0.2630 -0.1836 -0.1188 202 SER B O 1558 C CB . SER A 207 ? 0.7146 0.9182 0.5416 -0.2734 -0.1214 -0.1024 202 SER B CB 1559 O OG . SER A 207 ? 0.6816 0.8878 0.5287 -0.2506 -0.1206 -0.0788 202 SER B OG 1560 N N . SER A 208 ? 0.7910 1.0534 0.5346 -0.2171 -0.1939 -0.0750 203 SER B N 1561 C CA . SER A 208 ? 0.8034 1.1193 0.5576 -0.1898 -0.2232 -0.0668 203 SER B CA 1562 C C . SER A 208 ? 0.7590 1.1148 0.5867 -0.1869 -0.2177 -0.0677 203 SER B C 1563 O O . SER A 208 ? 0.7600 1.1862 0.6273 -0.1857 -0.2366 -0.0817 203 SER B O 1564 C CB . SER A 208 ? 0.8432 1.2162 0.5840 -0.1972 -0.2522 -0.0882 203 SER B CB 1565 O OG . SER A 208 ? 0.8918 1.2230 0.5598 -0.2032 -0.2533 -0.0881 203 SER B OG 1566 N N . THR A 209 ? 0.7287 1.0433 0.5729 -0.1863 -0.1915 -0.0542 204 THR B N 1567 C CA . THR A 209 ? 0.6916 1.0329 0.5977 -0.1861 -0.1802 -0.0534 204 THR B CA 1568 C C . THR A 209 ? 0.6844 1.0160 0.5854 -0.1519 -0.1822 -0.0281 204 THR B C 1569 O O . THR A 209 ? 0.6932 0.9687 0.5499 -0.1399 -0.1728 -0.0103 204 THR B O 1570 C CB . THR A 209 ? 0.6669 0.9684 0.5920 -0.2084 -0.1477 -0.0555 204 THR B CB 1571 O OG1 . THR A 209 ? 0.6830 0.9882 0.6166 -0.2399 -0.1411 -0.0806 204 THR B OG1 1572 C CG2 . THR A 209 ? 0.6352 0.9552 0.6129 -0.2071 -0.1331 -0.0506 204 THR B CG2 1573 N N . LYS A 210 ? 0.6697 1.0568 0.6182 -0.1390 -0.1914 -0.0302 205 LYS B N 1574 C CA . LYS A 210 ? 0.6571 1.0383 0.6148 -0.1097 -0.1867 -0.0106 205 LYS B CA 1575 C C . LYS A 210 ? 0.6166 1.0387 0.6425 -0.1236 -0.1717 -0.0213 205 LYS B C 1576 O O . LYS A 210 ? 0.6099 1.0977 0.6811 -0.1350 -0.1821 -0.0420 205 LYS B O 1577 C CB . LYS A 210 ? 0.6943 1.1053 0.6372 -0.0704 -0.2143 -0.0007 205 LYS B CB 1578 C CG . LYS A 210 ? 0.7478 1.1584 0.6368 -0.0616 -0.2403 -0.0007 205 LYS B CG 1579 C CD . LYS A 210 ? 0.7839 1.1082 0.5926 -0.0570 -0.2309 0.0177 205 LYS B CD 1580 C CE . LYS A 210 ? 0.8223 1.1051 0.5920 -0.0155 -0.2307 0.0451 205 LYS B CE 1581 N NZ . LYS A 210 ? 0.8711 1.1976 0.6296 0.0247 -0.2637 0.0532 205 LYS B NZ 1582 N N . VAL A 211 ? 0.5911 0.9766 0.6222 -0.1252 -0.1463 -0.0094 206 VAL B N 1583 C CA . VAL A 211 ? 0.5625 0.9772 0.6484 -0.1371 -0.1280 -0.0157 206 VAL B CA 1584 C C . VAL A 211 ? 0.5529 0.9554 0.6394 -0.1126 -0.1180 0.0009 206 VAL B C 1585 O O . VAL A 211 ? 0.5558 0.9050 0.5996 -0.1021 -0.1102 0.0165 206 VAL B O 1586 C CB . VAL A 211 ? 0.5501 0.9306 0.6404 -0.1678 -0.1017 -0.0191 206 VAL B CB 1587 C CG1 . VAL A 211 ? 0.5343 0.9295 0.6664 -0.1766 -0.0782 -0.0189 206 VAL B CG1 1588 C CG2 . VAL A 211 ? 0.5645 0.9572 0.6619 -0.1957 -0.1057 -0.0406 206 VAL B CG2 1589 N N . ASP A 212 ? 0.5426 0.9972 0.6789 -0.1063 -0.1159 -0.0059 207 ASP B N 1590 C CA . ASP A 212 ? 0.5333 0.9801 0.6782 -0.0889 -0.1001 0.0050 207 ASP B CA 1591 C C . ASP A 212 ? 0.5121 0.9618 0.6879 -0.1163 -0.0720 0.0001 207 ASP B C 1592 O O . ASP A 212 ? 0.5064 0.9928 0.7206 -0.1404 -0.0679 -0.0166 207 ASP B O 1593 C CB . ASP A 212 ? 0.5446 1.0488 0.7235 -0.0590 -0.1155 0.0005 207 ASP B CB 1594 C CG . ASP A 212 ? 0.5784 1.0794 0.7213 -0.0277 -0.1450 0.0083 207 ASP B CG 1595 O OD1 . ASP A 212 ? 0.5980 1.0332 0.6798 -0.0220 -0.1453 0.0232 207 ASP B OD1 1596 O OD2 . ASP A 212 ? 0.5925 1.1593 0.7669 -0.0082 -0.1676 -0.0009 207 ASP B OD2 1597 N N . LYS A 213 ? 0.5051 0.9139 0.6595 -0.1144 -0.0512 0.0138 208 LYS B N 1598 C CA . LYS A 213 ? 0.4963 0.9044 0.6708 -0.1348 -0.0240 0.0136 208 LYS B CA 1599 C C . LYS A 213 ? 0.4947 0.9064 0.6744 -0.1197 -0.0089 0.0198 208 LYS B C 1600 O O . LYS A 213 ? 0.4953 0.8703 0.6371 -0.1061 -0.0058 0.0311 208 LYS B O 1601 C CB . LYS A 213 ? 0.4972 0.8533 0.6357 -0.1502 -0.0117 0.0239 208 LYS B CB 1602 C CG . LYS A 213 ? 0.5039 0.8572 0.6616 -0.1745 0.0128 0.0223 208 LYS B CG 1603 C CD . LYS A 213 ? 0.5138 0.8834 0.6974 -0.1980 0.0103 0.0050 208 LYS B CD 1604 C CE . LYS A 213 ? 0.5302 0.9089 0.7458 -0.2235 0.0392 -0.0024 208 LYS B CE 1605 N NZ . LYS A 213 ? 0.5478 0.9427 0.7891 -0.2511 0.0391 -0.0250 208 LYS B NZ 1606 N N . LYS A 214 ? 0.4956 0.9540 0.7235 -0.1248 0.0026 0.0087 209 LYS B N 1607 C CA . LYS A 214 ? 0.4977 0.9643 0.7352 -0.1125 0.0202 0.0109 209 LYS B CA 1608 C C . LYS A 214 ? 0.4985 0.9277 0.7092 -0.1302 0.0472 0.0220 209 LYS B C 1609 O O . LYS A 214 ? 0.5002 0.9200 0.7129 -0.1542 0.0591 0.0228 209 LYS B O 1610 C CB . LYS A 214 ? 0.4996 1.0364 0.8017 -0.1121 0.0240 -0.0075 209 LYS B CB 1611 C CG . LYS A 214 ? 0.5085 1.0577 0.8256 -0.1002 0.0460 -0.0086 209 LYS B CG 1612 C CD . LYS A 214 ? 0.5163 1.1172 0.8726 -0.0665 0.0313 -0.0191 209 LYS B CD 1613 C CE . LYS A 214 ? 0.5124 1.2019 0.9454 -0.0744 0.0318 -0.0438 209 LYS B CE 1614 N NZ . LYS A 214 ? 0.5126 1.2218 0.9766 -0.1127 0.0656 -0.0559 209 LYS B NZ 1615 N N . ILE A 215 ? 0.5029 0.9074 0.6833 -0.1174 0.0570 0.0306 210 ILE B N 1616 C CA . ILE A 215 ? 0.5104 0.8873 0.6602 -0.1299 0.0795 0.0412 210 ILE B CA 1617 C C . ILE A 215 ? 0.5183 0.9231 0.6958 -0.1359 0.1052 0.0350 210 ILE B C 1618 O O . ILE A 215 ? 0.5240 0.9422 0.7094 -0.1207 0.1110 0.0286 210 ILE B O 1619 C CB . ILE A 215 ? 0.5145 0.8560 0.6140 -0.1186 0.0773 0.0492 210 ILE B CB 1620 C CG1 . ILE A 215 ? 0.5080 0.8259 0.5844 -0.1120 0.0536 0.0512 210 ILE B CG1 1621 C CG2 . ILE A 215 ? 0.5254 0.8474 0.5902 -0.1302 0.0936 0.0607 210 ILE B CG2 1622 C CD1 . ILE A 215 ? 0.5019 0.8119 0.5784 -0.1258 0.0445 0.0550 210 ILE B CD1 1623 N N . VAL A 216 ? 0.5268 0.9350 0.7166 -0.1588 0.1241 0.0362 211 VAL B N 1624 C CA . VAL A 216 ? 0.5411 0.9763 0.7592 -0.1712 0.1534 0.0283 211 VAL B CA 1625 C C . VAL A 216 ? 0.5676 0.9646 0.7391 -0.1836 0.1789 0.0457 211 VAL B C 1626 O O . VAL A 216 ? 0.5775 0.9369 0.7153 -0.1895 0.1765 0.0610 211 VAL B O 1627 C CB . VAL A 216 ? 0.5450 1.0192 0.8193 -0.1930 0.1610 0.0113 211 VAL B CB 1628 C CG1 . VAL A 216 ? 0.5220 1.0407 0.8382 -0.1791 0.1298 -0.0049 211 VAL B CG1 1629 C CG2 . VAL A 216 ? 0.5663 1.0020 0.8209 -0.2193 0.1741 0.0205 211 VAL B CG2 1630 N N . PRO A 217 ? 0.5870 0.9941 0.7548 -0.1859 0.2042 0.0436 212 PRO B N 1631 C CA . PRO A 217 ? 0.6230 0.9947 0.7372 -0.1950 0.2274 0.0625 212 PRO B CA 1632 C C . PRO A 217 ? 0.6538 0.9970 0.7603 -0.2164 0.2453 0.0743 212 PRO B C 1633 O O . PRO A 217 ? 0.6514 1.0131 0.8054 -0.2335 0.2510 0.0601 212 PRO B O 1634 C CB . PRO A 217 ? 0.6424 1.0390 0.7670 -0.1991 0.2556 0.0518 212 PRO B CB 1635 C CG . PRO A 217 ? 0.6117 1.0478 0.7824 -0.1816 0.2409 0.0306 212 PRO B CG 1636 C CD . PRO A 217 ? 0.5822 1.0334 0.7918 -0.1779 0.2134 0.0243 212 PRO B CD 1637 N N . ARG A 218 ? 0.6893 0.9882 0.7352 -0.2147 0.2550 0.0991 213 ARG B N 1638 C CA . ARG A 218 ? 0.7372 0.9930 0.7634 -0.2315 0.2789 0.1151 213 ARG B CA 1639 C C . ARG A 218 ? 0.7810 1.0374 0.8136 -0.2554 0.3218 0.1116 213 ARG B C 1640 O O . ARG A 218 ? 0.8070 1.0633 0.8053 -0.2519 0.3386 0.1193 213 ARG B O 1641 C CB . ARG A 218 ? 0.7686 0.9780 0.7239 -0.2135 0.2736 0.1458 213 ARG B CB 1642 C CG . ARG A 218 ? 0.7295 0.9350 0.6824 -0.1953 0.2371 0.1475 213 ARG B CG 1643 C CD . ARG A 218 ? 0.7553 0.9366 0.6442 -0.1725 0.2284 0.1731 213 ARG B CD 1644 N NE . ARG A 218 ? 0.7164 0.9062 0.6060 -0.1558 0.1943 0.1695 213 ARG B NE 1645 C CZ . ARG A 218 ? 0.7181 0.8807 0.6081 -0.1508 0.1848 0.1764 213 ARG B CZ 1646 N NH1 . ARG A 218 ? 0.7614 0.8806 0.6493 -0.1608 0.2073 0.1877 213 ARG B NH1 1647 N NH2 . ARG A 218 ? 0.6831 0.8583 0.5744 -0.1376 0.1563 0.1701 213 ARG B NH2 1648 N N . LEU B 4 ? 0.6113 1.1735 1.7033 -0.2367 -0.2477 0.1083 4 LEU E N 1649 C CA . LEU B 4 ? 0.5864 1.1451 1.7277 -0.1959 -0.1750 0.0531 4 LEU E CA 1650 C C . LEU B 4 ? 0.6120 1.1208 1.6872 -0.2022 -0.1695 0.0371 4 LEU E C 1651 O O . LEU B 4 ? 0.6173 1.1030 1.5527 -0.2300 -0.1797 0.0246 4 LEU E O 1652 C CB . LEU B 4 ? 0.5428 1.1238 1.6136 -0.1841 -0.1157 -0.0084 4 LEU E CB 1653 C CG . LEU B 4 ? 0.5273 1.1362 1.7207 -0.1512 -0.0605 -0.0314 4 LEU E CG 1654 C CD1 . LEU B 4 ? 0.4940 1.1362 1.6345 -0.1536 -0.0360 -0.0592 4 LEU E CD1 1655 C CD2 . LEU B 4 ? 0.5437 1.1153 1.7293 -0.1348 -0.0005 -0.0814 4 LEU E CD2 1656 N N . LYS B 5 ? 0.6305 1.1206 1.8136 -0.1772 -0.1486 0.0370 5 LYS E N 1657 C CA . LYS B 5 ? 0.6626 1.1035 1.7984 -0.1842 -0.1489 0.0291 5 LYS E CA 1658 C C . LYS B 5 ? 0.6529 1.0757 1.7676 -0.1620 -0.0741 -0.0378 5 LYS E C 1659 O O . LYS B 5 ? 0.6540 1.0801 1.8684 -0.1337 -0.0219 -0.0612 5 LYS E O 1660 C CB . LYS B 5 ? 0.7093 1.1295 1.9790 -0.1797 -0.1907 0.0876 5 LYS E CB 1661 C CG . LYS B 5 ? 0.7401 1.1705 2.0455 -0.2100 -0.2777 0.1667 5 LYS E CG 1662 C CD . LYS B 5 ? 0.7693 1.2035 2.2881 -0.1877 -0.3040 0.2234 5 LYS E CD 1663 C CE . LYS B 5 ? 0.8415 1.2367 2.3649 -0.2271 -0.3974 0.3023 5 LYS E CE 1664 N NZ . LYS B 5 ? 0.8744 1.2123 2.3286 -0.2314 -0.3830 0.2811 5 LYS E NZ 1665 N N . GLU B 6 ? 0.6539 1.0512 1.6390 -0.1805 -0.0677 -0.0670 6 GLU E N 1666 C CA . GLU B 6 ? 0.6577 1.0306 1.6034 -0.1719 -0.0107 -0.1235 6 GLU E CA 1667 C C . GLU B 6 ? 0.6981 1.0229 1.6446 -0.1771 -0.0185 -0.1163 6 GLU E C 1668 O O . GLU B 6 ? 0.7157 1.0258 1.6321 -0.1979 -0.0688 -0.0777 6 GLU E O 1669 C CB . GLU B 6 ? 0.6288 1.0145 1.4428 -0.1904 -0.0003 -0.1588 6 GLU E CB 1670 C CG . GLU B 6 ? 0.5915 1.0209 1.3945 -0.1875 0.0068 -0.1669 6 GLU E CG 1671 C CD . GLU B 6 ? 0.5675 1.0075 1.2596 -0.2044 0.0159 -0.1977 6 GLU E CD 1672 O OE1 . GLU B 6 ? 0.5796 0.9965 1.2259 -0.2114 0.0379 -0.2287 6 GLU E OE1 1673 O OE2 . GLU B 6 ? 0.5401 1.0100 1.1970 -0.2128 -0.0014 -0.1874 6 GLU E OE2 1674 N N . SER B 7 ? 0.7250 1.0167 1.6965 -0.1637 0.0334 -0.1543 7 SER E N 1675 C CA . SER B 7 ? 0.7657 1.0075 1.7211 -0.1708 0.0329 -0.1564 7 SER E CA 1676 C C . SER B 7 ? 0.7830 0.9964 1.6610 -0.1788 0.0860 -0.2160 7 SER E C 1677 O O . SER B 7 ? 0.7932 1.0023 1.6825 -0.1713 0.1372 -0.2530 7 SER E O 1678 C CB . SER B 7 ? 0.8076 1.0205 1.9085 -0.1485 0.0347 -0.1263 7 SER E CB 1679 O OG . SER B 7 ? 0.8274 1.0274 2.0139 -0.1240 0.1043 -0.1617 7 SER E OG 1680 N N . GLY B 8 ? 0.7969 0.9861 1.5919 -0.2003 0.0728 -0.2236 8 GLY E N 1681 C CA . GLY B 8 ? 0.8206 0.9825 1.5345 -0.2175 0.1092 -0.2720 8 GLY E CA 1682 C C . GLY B 8 ? 0.8191 0.9730 1.4493 -0.2438 0.0828 -0.2706 8 GLY E C 1683 O O . GLY B 8 ? 0.7998 0.9680 1.4193 -0.2511 0.0431 -0.2376 8 GLY E O 1684 N N . PRO B 9 ? 0.8508 0.9769 1.4175 -0.2642 0.1063 -0.3064 9 PRO E N 1685 C CA . PRO B 9 ? 0.8572 0.9726 1.3624 -0.2902 0.0871 -0.3067 9 PRO E CA 1686 C C . PRO B 9 ? 0.8040 0.9706 1.2662 -0.3048 0.0597 -0.2965 9 PRO E C 1687 O O . PRO B 9 ? 0.7756 0.9766 1.2210 -0.3061 0.0624 -0.3068 9 PRO E O 1688 C CB . PRO B 9 ? 0.9122 0.9854 1.3658 -0.3126 0.1185 -0.3465 9 PRO E CB 1689 C CG . PRO B 9 ? 0.9205 0.9982 1.3712 -0.3083 0.1485 -0.3696 9 PRO E CG 1690 C CD . PRO B 9 ? 0.8916 0.9907 1.4344 -0.2713 0.1529 -0.3482 9 PRO E CD 1691 N N . GLY B 10 ? 0.7998 0.9653 1.2465 -0.3181 0.0384 -0.2776 10 GLY E N 1692 C CA . GLY B 10 ? 0.7619 0.9650 1.1790 -0.3352 0.0263 -0.2726 10 GLY E CA 1693 C C . GLY B 10 ? 0.7673 0.9757 1.1595 -0.3574 0.0304 -0.2929 10 GLY E C 1694 O O . GLY B 10 ? 0.7320 0.9801 1.1235 -0.3674 0.0235 -0.2910 10 GLY E O 1695 N N . LEU B 11 ? 0.8181 0.9832 1.1949 -0.3680 0.0399 -0.3095 11 LEU E N 1696 C CA . LEU B 11 ? 0.8415 1.0011 1.1893 -0.3994 0.0344 -0.3220 11 LEU E CA 1697 C C . LEU B 11 ? 0.9067 1.0189 1.2136 -0.4147 0.0504 -0.3493 11 LEU E C 1698 O O . LEU B 11 ? 0.9522 1.0134 1.2607 -0.4043 0.0747 -0.3614 11 LEU E O 1699 C CB . LEU B 11 ? 0.8597 0.9988 1.2096 -0.4146 0.0292 -0.3129 11 LEU E CB 1700 C CG . LEU B 11 ? 0.8857 1.0219 1.2203 -0.4506 0.0178 -0.3184 11 LEU E CG 1701 C CD1 . LEU B 11 ? 0.8353 1.0332 1.2048 -0.4603 0.0015 -0.3041 11 LEU E CD1 1702 C CD2 . LEU B 11 ? 0.9203 1.0215 1.2523 -0.4659 0.0196 -0.3147 11 LEU E CD2 1703 N N . VAL B 12 ? 0.9235 1.0457 1.1935 -0.4444 0.0377 -0.3572 12 VAL E N 1704 C CA . VAL B 12 ? 1.0102 1.0735 1.2122 -0.4751 0.0537 -0.3851 12 VAL E CA 1705 C C . VAL B 12 ? 1.0565 1.1103 1.2131 -0.5277 0.0214 -0.3810 12 VAL E C 1706 O O . VAL B 12 ? 1.0108 1.1211 1.1958 -0.5390 -0.0156 -0.3568 12 VAL E O 1707 C CB . VAL B 12 ? 1.0138 1.0836 1.1920 -0.4724 0.0669 -0.3978 12 VAL E CB 1708 C CG1 . VAL B 12 ? 1.1269 1.1185 1.2130 -0.5162 0.0920 -0.4311 12 VAL E CG1 1709 C CG2 . VAL B 12 ? 0.9704 1.0548 1.2074 -0.4229 0.0947 -0.3972 12 VAL E CG2 1710 N N . GLN B 13 ? 1.1547 1.1340 1.2475 -0.5620 0.0357 -0.4025 13 GLN E N 1711 C CA . GLN B 13 ? 1.2207 1.1788 1.2585 -0.6226 0.0000 -0.3965 13 GLN E CA 1712 C C . GLN B 13 ? 1.2630 1.2218 1.2401 -0.6640 -0.0263 -0.3940 13 GLN E C 1713 O O . GLN B 13 ? 1.2956 1.2241 1.2267 -0.6601 0.0056 -0.4175 13 GLN E O 1714 C CB . GLN B 13 ? 1.3334 1.1945 1.2957 -0.6560 0.0279 -0.4252 13 GLN E CB 1715 C CG . GLN B 13 ? 1.3153 1.1604 1.3268 -0.6238 0.0505 -0.4265 13 GLN E CG 1716 C CD . GLN B 13 ? 1.2602 1.1575 1.3274 -0.6278 0.0108 -0.3951 13 GLN E CD 1717 O OE1 . GLN B 13 ? 1.3004 1.1921 1.3400 -0.6770 -0.0229 -0.3849 13 GLN E OE1 1718 N NE2 . GLN B 13 ? 1.1777 1.1209 1.3225 -0.5814 0.0159 -0.3786 13 GLN E NE2 1719 N N . PRO B 14 ? 1.2701 1.2619 1.2535 -0.7066 -0.0860 -0.3623 14 PRO E N 1720 C CA . PRO B 14 ? 1.3325 1.3130 1.2477 -0.7606 -0.1249 -0.3517 14 PRO E CA 1721 C C . PRO B 14 ? 1.4849 1.3517 1.2469 -0.8169 -0.0957 -0.3903 14 PRO E C 1722 O O . PRO B 14 ? 1.5764 1.3715 1.2750 -0.8524 -0.0827 -0.4080 14 PRO E O 1723 C CB . PRO B 14 ? 1.3371 1.3535 1.2945 -0.8051 -0.1955 -0.3078 14 PRO E CB 1724 C CG . PRO B 14 ? 1.2211 1.3103 1.3131 -0.7496 -0.1872 -0.2910 14 PRO E CG 1725 C CD . PRO B 14 ? 1.2072 1.2598 1.2852 -0.7021 -0.1217 -0.3280 14 PRO E CD 1726 N N . SER B 15 ? 1.5228 1.3676 1.2217 -0.8290 -0.0813 -0.4047 15 SER E N 1727 C CA . SER B 15 ? 1.6812 1.4072 1.2247 -0.8861 -0.0371 -0.4484 15 SER E CA 1728 C C . SER B 15 ? 1.6990 1.3698 1.2441 -0.8405 0.0601 -0.5002 15 SER E C 1729 O O . SER B 15 ? 1.8264 1.3988 1.2595 -0.8804 0.1154 -0.5423 15 SER E O 1730 C CB . SER B 15 ? 1.8346 1.4730 1.2504 -0.9825 -0.0722 -0.4467 15 SER E CB 1731 O OG . SER B 15 ? 1.7907 1.4983 1.2689 -1.0060 -0.1630 -0.3899 15 SER E OG 1732 N N . GLN B 16 ? 1.5826 1.3115 1.2566 -0.7619 0.0822 -0.4953 16 GLN E N 1733 C CA . GLN B 16 ? 1.5874 1.2767 1.2981 -0.7133 0.1642 -0.5320 16 GLN E CA 1734 C C . GLN B 16 ? 1.5047 1.2522 1.2834 -0.6614 0.1836 -0.5299 16 GLN E C 1735 O O . GLN B 16 ? 1.4342 1.2543 1.2318 -0.6579 0.1351 -0.5011 16 GLN E O 1736 C CB . GLN B 16 ? 1.5260 1.2330 1.3312 -0.6651 0.1726 -0.5233 16 GLN E CB 1737 C CG . GLN B 16 ? 1.6377 1.2548 1.3699 -0.7115 0.1867 -0.5429 16 GLN E CG 1738 C CD . GLN B 16 ? 1.6872 1.3013 1.3390 -0.7823 0.1196 -0.5216 16 GLN E CD 1739 O OE1 . GLN B 16 ? 1.5950 1.2998 1.3033 -0.7757 0.0548 -0.4799 16 GLN E OE1 1740 N NE2 . GLN B 16 ? 1.8403 1.3464 1.3659 -0.8536 0.1356 -0.5481 16 GLN E NE2 1741 N N . SER B 17 ? 1.5180 1.2326 1.3437 -0.6218 0.2549 -0.5581 17 SER E N 1742 C CA . SER B 17 ? 1.4638 1.2188 1.3491 -0.5803 0.2827 -0.5609 17 SER E CA 1743 C C . SER B 17 ? 1.3205 1.1695 1.3508 -0.5053 0.2612 -0.5259 17 SER E C 1744 O O . SER B 17 ? 1.2847 1.1441 1.3747 -0.4801 0.2491 -0.5098 17 SER E O 1745 C CB . SER B 17 ? 1.5687 1.2325 1.4399 -0.5835 0.3782 -0.6099 17 SER E CB 1746 O OG . SER B 17 ? 1.5511 1.2018 1.5323 -0.5341 0.4175 -0.6125 17 SER E OG 1747 N N . LEU B 18 ? 1.2542 1.1621 1.3288 -0.4767 0.2573 -0.5146 18 LEU E N 1748 C CA . LEU B 18 ? 1.1367 1.1249 1.3299 -0.4161 0.2367 -0.4813 18 LEU E CA 1749 C C . LEU B 18 ? 1.1440 1.1219 1.4103 -0.3820 0.2926 -0.4954 18 LEU E C 1750 O O . LEU B 18 ? 1.1867 1.1461 1.4141 -0.3983 0.3262 -0.5192 18 LEU E O 1751 C CB . LEU B 18 ? 1.0516 1.1207 1.2422 -0.4141 0.1817 -0.4520 18 LEU E CB 1752 C CG . LEU B 18 ? 0.9507 1.0914 1.2357 -0.3634 0.1679 -0.4234 18 LEU E CG 1753 C CD1 . LEU B 18 ? 0.9133 1.0655 1.2676 -0.3346 0.1530 -0.3990 18 LEU E CD1 1754 C CD2 . LEU B 18 ? 0.8829 1.0890 1.1546 -0.3679 0.1231 -0.4006 18 LEU E CD2 1755 N N . SER B 19 ? 1.1096 1.0976 1.4868 -0.3380 0.3006 -0.4773 19 SER E N 1756 C CA . SER B 19 ? 1.1073 1.0951 1.5933 -0.3008 0.3465 -0.4793 19 SER E CA 1757 C C . SER B 19 ? 1.0053 1.0692 1.6001 -0.2567 0.2981 -0.4283 19 SER E C 1758 O O . SER B 19 ? 0.9840 1.0526 1.6218 -0.2428 0.2657 -0.3992 19 SER E O 1759 C CB . SER B 19 ? 1.1955 1.1014 1.7310 -0.2961 0.4112 -0.5046 19 SER E CB 1760 O OG . SER B 19 ? 1.3126 1.1324 1.7386 -0.3439 0.4713 -0.5580 19 SER E OG 1761 N N . ILE B 20 ? 0.9535 1.0693 1.5821 -0.2414 0.2927 -0.4171 20 ILE E N 1762 C CA . ILE B 20 ? 0.8738 1.0536 1.5928 -0.2093 0.2469 -0.3685 20 ILE E CA 1763 C C . ILE B 20 ? 0.8792 1.0651 1.7244 -0.1801 0.2853 -0.3638 20 ILE E C 1764 O O . ILE B 20 ? 0.9164 1.0840 1.7528 -0.1868 0.3409 -0.3993 20 ILE E O 1765 C CB . ILE B 20 ? 0.8045 1.0470 1.4607 -0.2185 0.1984 -0.3515 20 ILE E CB 1766 C CG1 . ILE B 20 ? 0.8002 1.0394 1.3562 -0.2471 0.1673 -0.3555 20 ILE E CG1 1767 C CG2 . ILE B 20 ? 0.7446 1.0377 1.4735 -0.1961 0.1520 -0.3019 20 ILE E CG2 1768 C CD1 . ILE B 20 ? 0.7455 1.0365 1.2479 -0.2585 0.1334 -0.3458 20 ILE E CD1 1769 N N . THR B 21 ? 0.8495 1.0576 1.8144 -0.1523 0.2539 -0.3171 21 THR E N 1770 C CA . THR B 21 ? 0.8442 1.0709 1.9633 -0.1225 0.2753 -0.2968 21 THR E CA 1771 C C . THR B 21 ? 0.7731 1.0707 1.9286 -0.1145 0.2072 -0.2435 21 THR E C 1772 O O . THR B 21 ? 0.7528 1.0641 1.9099 -0.1179 0.1417 -0.1974 21 THR E O 1773 C CB . THR B 21 ? 0.8868 1.0747 2.1464 -0.0996 0.2908 -0.2761 21 THR E CB 1774 O OG1 . THR B 21 ? 0.9657 1.0766 2.1949 -0.1091 0.3683 -0.3314 21 THR E OG1 1775 C CG2 . THR B 21 ? 0.8779 1.0967 2.3305 -0.0675 0.3010 -0.2412 21 THR E CG2 1776 N N . CYS B 22 ? 0.7487 1.0825 1.9282 -0.1093 0.2258 -0.2506 22 CYS E N 1777 C CA . CYS B 22 ? 0.6915 1.0878 1.8963 -0.1069 0.1672 -0.2046 22 CYS E CA 1778 C C . CYS B 22 ? 0.7005 1.1175 2.0989 -0.0802 0.1663 -0.1627 22 CYS E C 1779 O O . CYS B 22 ? 0.7225 1.1356 2.2136 -0.0641 0.2325 -0.1878 22 CYS E O 1780 C CB . CYS B 22 ? 0.6608 1.0854 1.7745 -0.1196 0.1848 -0.2355 22 CYS E CB 1781 S SG . CYS B 22 ? 0.5981 1.0934 1.7366 -0.1196 0.1275 -0.1886 22 CYS E SG 1782 N N . THR B 23 ? 0.6959 1.1301 2.1579 -0.0803 0.0917 -0.0968 23 THR E N 1783 C CA . THR B 23 ? 0.7048 1.1658 2.3654 -0.0602 0.0691 -0.0399 23 THR E CA 1784 C C . THR B 23 ? 0.6681 1.1872 2.3195 -0.0738 0.0124 -0.0005 23 THR E C 1785 O O . THR B 23 ? 0.6546 1.1808 2.1731 -0.1036 -0.0492 0.0194 23 THR E O 1786 C CB . THR B 23 ? 0.7373 1.1746 2.4789 -0.0612 0.0074 0.0213 23 THR E CB 1787 O OG1 . THR B 23 ? 0.7774 1.1559 2.5204 -0.0501 0.0600 -0.0159 23 THR E OG1 1788 C CG2 . THR B 23 ? 0.7476 1.2156 2.7198 -0.0429 -0.0277 0.0925 23 THR E CG2 1789 N N . VAL B 24 ? 0.6623 1.2176 2.4591 -0.0542 0.0394 0.0090 24 VAL E N 1790 C CA . VAL B 24 ? 0.6289 1.2393 2.4210 -0.0667 -0.0006 0.0374 24 VAL E CA 1791 C C . VAL B 24 ? 0.6406 1.2851 2.6110 -0.0668 -0.0750 0.1262 24 VAL E C 1792 O O . VAL B 24 ? 0.6644 1.3054 2.8353 -0.0411 -0.0616 0.1551 24 VAL E O 1793 C CB . VAL B 24 ? 0.6145 1.2424 2.4216 -0.0522 0.0848 -0.0195 24 VAL E CB 1794 C CG1 . VAL B 24 ? 0.5977 1.2821 2.5693 -0.0425 0.0717 0.0232 24 VAL E CG1 1795 C CG2 . VAL B 24 ? 0.5890 1.2139 2.1782 -0.0753 0.0949 -0.0697 24 VAL E CG2 1796 N N . SER B 25 ? 0.6309 1.3044 2.5293 -0.0995 -0.1533 0.1710 25 SER E N 1797 C CA . SER B 25 ? 0.6547 1.3594 2.6972 -0.1142 -0.2409 0.2635 25 SER E CA 1798 C C . SER B 25 ? 0.6417 1.3821 2.5913 -0.1486 -0.2903 0.2852 25 SER E C 1799 O O . SER B 25 ? 0.6362 1.3578 2.3732 -0.1772 -0.2975 0.2542 25 SER E O 1800 C CB . SER B 25 ? 0.7077 1.3721 2.7455 -0.1405 -0.3257 0.3274 25 SER E CB 1801 O OG . SER B 25 ? 0.7412 1.4294 2.8894 -0.1692 -0.4264 0.4244 25 SER E OG 1802 N N . GLY B 26 ? 0.6431 1.4333 2.7647 -0.1464 -0.3220 0.3400 26 GLY E N 1803 C CA . GLY B 26 ? 0.6326 1.4597 2.6920 -0.1766 -0.3608 0.3595 26 GLY E CA 1804 C C . GLY B 26 ? 0.5886 1.4646 2.7379 -0.1443 -0.2816 0.3162 26 GLY E C 1805 O O . GLY B 26 ? 0.5831 1.5021 2.7712 -0.1617 -0.3166 0.3504 26 GLY E O 1806 N N . PHE B 27 ? 0.5708 1.4334 2.7455 -0.1037 -0.1748 0.2415 27 PHE E N 1807 C CA . PHE B 27 ? 0.5455 1.4396 2.8013 -0.0781 -0.0872 0.1948 27 PHE E CA 1808 C C . PHE B 27 ? 0.5669 1.4360 2.9707 -0.0364 0.0120 0.1529 27 PHE E C 1809 O O . PHE B 27 ? 0.5946 1.4273 3.0406 -0.0259 0.0052 0.1643 27 PHE E O 1810 C CB . PHE B 27 ? 0.5168 1.4026 2.5436 -0.0942 -0.0521 0.1278 27 PHE E CB 1811 C CG . PHE B 27 ? 0.5202 1.3510 2.3801 -0.0909 -0.0017 0.0588 27 PHE E CG 1812 C CD1 . PHE B 27 ? 0.5238 1.3228 2.2239 -0.1146 -0.0569 0.0671 27 PHE E CD1 1813 C CD2 . PHE B 27 ? 0.5306 1.3358 2.3898 -0.0706 0.1021 -0.0136 27 PHE E CD2 1814 C CE1 . PHE B 27 ? 0.5268 1.2809 2.0908 -0.1129 -0.0148 0.0090 27 PHE E CE1 1815 C CE2 . PHE B 27 ? 0.5431 1.2961 2.2474 -0.0752 0.1387 -0.0705 27 PHE E CE2 1816 C CZ . PHE B 27 ? 0.5361 1.2694 2.1030 -0.0938 0.0772 -0.0567 27 PHE E CZ 1817 N N . SER B 28 ? 0.5659 1.4484 3.0509 -0.0169 0.1066 0.1059 28 SER E N 1818 C CA . SER B 28 ? 0.6046 1.4510 3.2259 0.0157 0.2196 0.0578 28 SER E CA 1819 C C . SER B 28 ? 0.6297 1.4207 3.0564 0.0082 0.3195 -0.0437 28 SER E C 1820 O O . SER B 28 ? 0.6169 1.4212 2.9071 -0.0110 0.3308 -0.0758 28 SER E O 1821 C CB . SER B 28 ? 0.6084 1.5008 3.5011 0.0384 0.2653 0.0832 28 SER E CB 1822 O OG . SER B 28 ? 0.6562 1.5057 3.7044 0.0687 0.3826 0.0397 28 SER E OG 1823 N N . LEU B 29 ? 0.6777 1.4021 3.0913 0.0187 0.3878 -0.0905 29 LEU E N 1824 C CA . LEU B 29 ? 0.7207 1.3791 2.9528 0.0023 0.4813 -0.1831 29 LEU E CA 1825 C C . LEU B 29 ? 0.7668 1.4103 3.0699 0.0027 0.5985 -0.2361 29 LEU E C 1826 O O . LEU B 29 ? 0.8113 1.4045 2.9348 -0.0248 0.6620 -0.3063 29 LEU E O 1827 C CB . LEU B 29 ? 0.7743 1.3578 2.9739 0.0066 0.5209 -0.2155 29 LEU E CB 1828 C CG . LEU B 29 ? 0.7449 1.3219 2.8099 -0.0038 0.4266 -0.1874 29 LEU E CG 1829 C CD1 . LEU B 29 ? 0.8003 1.3103 2.9042 0.0073 0.4679 -0.2064 29 LEU E CD1 1830 C CD2 . LEU B 29 ? 0.7243 1.2931 2.5258 -0.0371 0.4002 -0.2238 29 LEU E CD2 1831 N N . THR B 30 ? 0.7645 1.4474 3.3299 0.0293 0.6264 -0.2002 30 THR E N 1832 C CA . THR B 30 ? 0.8016 1.4804 3.4588 0.0286 0.7364 -0.2428 30 THR E CA 1833 C C . THR B 30 ? 0.7529 1.4809 3.2841 0.0041 0.6989 -0.2426 30 THR E C 1834 O O . THR B 30 ? 0.7979 1.5060 3.3081 -0.0107 0.7898 -0.2949 30 THR E O 1835 C CB . THR B 30 ? 0.8053 1.5281 3.8122 0.0660 0.7654 -0.1916 30 THR E CB 1836 O OG1 . THR B 30 ? 0.7266 1.5418 3.8376 0.0740 0.6290 -0.0927 30 THR E OG1 1837 C CG2 . THR B 30 ? 0.8611 1.5288 4.0259 0.0932 0.8208 -0.1949 30 THR E CG2 1838 N N . THR B 31 ? 0.6715 1.4558 3.1165 -0.0035 0.5700 -0.1851 31 THR E N 1839 C CA . THR B 31 ? 0.6223 1.4566 2.9661 -0.0249 0.5228 -0.1737 31 THR E CA 1840 C C . THR B 31 ? 0.6106 1.4126 2.6575 -0.0565 0.4951 -0.2146 31 THR E C 1841 O O . THR B 31 ? 0.6045 1.4161 2.5406 -0.0781 0.5064 -0.2391 31 THR E O 1842 C CB . THR B 31 ? 0.5582 1.4720 3.0080 -0.0205 0.3985 -0.0782 31 THR E CB 1843 O OG1 . THR B 31 ? 0.5666 1.5139 3.3144 0.0079 0.4063 -0.0255 31 THR E OG1 1844 C CG2 . THR B 31 ? 0.5226 1.4851 2.8988 -0.0425 0.3644 -0.0677 31 THR E CG2 1845 N N . TYR B 32 ? 0.6064 1.3717 2.5362 -0.0598 0.4574 -0.2184 32 TYR E N 1846 C CA . TYR B 32 ? 0.5836 1.3310 2.2659 -0.0871 0.4128 -0.2402 32 TYR E CA 1847 C C . TYR B 32 ? 0.6258 1.2983 2.1705 -0.0992 0.4519 -0.2933 32 TYR E C 1848 O O . TYR B 32 ? 0.6548 1.2941 2.2760 -0.0838 0.4734 -0.2941 32 TYR E O 1849 C CB . TYR B 32 ? 0.5256 1.3168 2.1765 -0.0892 0.2951 -0.1749 32 TYR E CB 1850 C CG . TYR B 32 ? 0.4881 1.3464 2.2236 -0.0917 0.2403 -0.1203 32 TYR E CG 1851 C CD1 . TYR B 32 ? 0.4696 1.3482 2.0985 -0.1114 0.2378 -0.1357 32 TYR E CD1 1852 C CD2 . TYR B 32 ? 0.4788 1.3770 2.3999 -0.0791 0.1854 -0.0489 32 TYR E CD2 1853 C CE1 . TYR B 32 ? 0.4413 1.3766 2.1390 -0.1181 0.1873 -0.0863 32 TYR E CE1 1854 C CE2 . TYR B 32 ? 0.4541 1.4098 2.4473 -0.0895 0.1279 0.0057 32 TYR E CE2 1855 C CZ . TYR B 32 ? 0.4356 1.4091 2.3132 -0.1089 0.1315 -0.0154 32 TYR E CZ 1856 O OH . TYR B 32 ? 0.4191 1.4460 2.3642 -0.1230 0.0742 0.0390 32 TYR E OH 1857 N N . GLY B 33 ? 0.6298 1.2754 1.9746 -0.1298 0.4554 -0.3329 33 GLY E N 1858 C CA . GLY B 33 ? 0.6709 1.2494 1.8619 -0.1516 0.4737 -0.3758 33 GLY E CA 1859 C C . GLY B 33 ? 0.6150 1.2075 1.7225 -0.1512 0.3864 -0.3446 33 GLY E C 1860 O O . GLY B 33 ? 0.5527 1.1968 1.6471 -0.1481 0.3140 -0.3026 33 GLY E O 1861 N N . VAL B 34 ? 0.6451 1.1842 1.6872 -0.1596 0.3987 -0.3681 34 VAL E N 1862 C CA . VAL B 34 ? 0.6005 1.1471 1.5791 -0.1595 0.3274 -0.3415 34 VAL E CA 1863 C C . VAL B 34 ? 0.6240 1.1292 1.4299 -0.1924 0.3261 -0.3764 34 VAL E C 1864 O O . VAL B 34 ? 0.6977 1.1397 1.4512 -0.2126 0.3805 -0.4192 34 VAL E O 1865 C CB . VAL B 34 ? 0.6129 1.1407 1.6961 -0.1377 0.3265 -0.3232 34 VAL E CB 1866 C CG1 . VAL B 34 ? 0.5866 1.1111 1.5847 -0.1448 0.2630 -0.3037 34 VAL E CG1 1867 C CG2 . VAL B 34 ? 0.5835 1.1579 1.8514 -0.1088 0.3064 -0.2724 34 VAL E CG2 1868 N N . HIS B 35 ? 0.5670 1.1039 1.2901 -0.2013 0.2634 -0.3552 35 HIS E N 1869 C CA . HIS B 35 ? 0.5847 1.0947 1.1682 -0.2323 0.2494 -0.3760 35 HIS E CA 1870 C C . HIS B 35 ? 0.5712 1.0693 1.1338 -0.2312 0.2148 -0.3638 35 HIS E C 1871 O O . HIS B 35 ? 0.5326 1.0524 1.1645 -0.2091 0.1864 -0.3326 35 HIS E O 1872 C CB . HIS B 35 ? 0.5380 1.0881 1.0610 -0.2421 0.2085 -0.3602 35 HIS E CB 1873 C CG . HIS B 35 ? 0.5408 1.1086 1.0827 -0.2436 0.2353 -0.3673 35 HIS E CG 1874 N ND1 . HIS B 35 ? 0.5835 1.1282 1.0321 -0.2751 0.2540 -0.3931 35 HIS E ND1 1875 C CD2 . HIS B 35 ? 0.5124 1.1174 1.1583 -0.2213 0.2438 -0.3489 35 HIS E CD2 1876 C CE1 . HIS B 35 ? 0.5796 1.1455 1.0698 -0.2704 0.2795 -0.3948 35 HIS E CE1 1877 N NE2 . HIS B 35 ? 0.5333 1.1393 1.1493 -0.2367 0.2735 -0.3676 35 HIS E NE2 1878 N N . TRP B 36 ? 0.6121 1.0723 1.0756 -0.2610 0.2141 -0.3858 36 TRP E N 1879 C CA . TRP B 36 ? 0.6020 1.0530 1.0410 -0.2647 0.1809 -0.3750 36 TRP E CA 1880 C C . TRP B 36 ? 0.5778 1.0477 0.9420 -0.2860 0.1372 -0.3644 36 TRP E C 1881 O O . TRP B 36 ? 0.6134 1.0674 0.9063 -0.3156 0.1390 -0.3788 36 TRP E O 1882 C CB . TRP B 36 ? 0.6799 1.0653 1.0938 -0.2814 0.2178 -0.4051 36 TRP E CB 1883 C CG . TRP B 36 ? 0.6946 1.0651 1.2137 -0.2528 0.2563 -0.4067 36 TRP E CG 1884 C CD1 . TRP B 36 ? 0.7334 1.0860 1.3138 -0.2443 0.3155 -0.4265 36 TRP E CD1 1885 C CD2 . TRP B 36 ? 0.6742 1.0466 1.2649 -0.2295 0.2382 -0.3834 36 TRP E CD2 1886 N NE1 . TRP B 36 ? 0.7345 1.0811 1.4371 -0.2137 0.3340 -0.4141 36 TRP E NE1 1887 C CE2 . TRP B 36 ? 0.7006 1.0577 1.4051 -0.2056 0.2831 -0.3861 36 TRP E CE2 1888 C CE3 . TRP B 36 ? 0.6433 1.0251 1.2171 -0.2289 0.1913 -0.3601 36 TRP E CE3 1889 C CZ2 . TRP B 36 ? 0.6966 1.0479 1.4980 -0.1815 0.2731 -0.3610 36 TRP E CZ2 1890 C CZ3 . TRP B 36 ? 0.6437 1.0155 1.2949 -0.2087 0.1845 -0.3394 36 TRP E CZ3 1891 C CH2 . TRP B 36 ? 0.6702 1.0270 1.4335 -0.1855 0.2206 -0.3375 36 TRP E CH2 1892 N N . VAL B 37 ? 0.5246 1.0246 0.9113 -0.2734 0.0995 -0.3369 37 VAL E N 1893 C CA . VAL B 37 ? 0.4951 1.0191 0.8476 -0.2859 0.0637 -0.3217 37 VAL E CA 1894 C C . VAL B 37 ? 0.4906 1.0073 0.8509 -0.2882 0.0454 -0.3116 37 VAL E C 1895 O O . VAL B 37 ? 0.4871 0.9946 0.8829 -0.2732 0.0505 -0.3058 37 VAL E O 1896 C CB . VAL B 37 ? 0.4392 1.0064 0.8181 -0.2695 0.0490 -0.2996 37 VAL E CB 1897 C CG1 . VAL B 37 ? 0.4106 0.9973 0.7759 -0.2781 0.0224 -0.2837 37 VAL E CG1 1898 C CG2 . VAL B 37 ? 0.4455 1.0227 0.8151 -0.2705 0.0651 -0.3089 37 VAL E CG2 1899 N N . ARG B 38 ? 0.4948 1.0150 0.8299 -0.3091 0.0222 -0.3060 38 ARG E N 1900 C CA . ARG B 38 ? 0.4879 1.0074 0.8435 -0.3119 0.0078 -0.2946 38 ARG E CA 1901 C C . ARG B 38 ? 0.4553 1.0075 0.8362 -0.3143 -0.0115 -0.2743 38 ARG E C 1902 O O . ARG B 38 ? 0.4428 1.0148 0.8192 -0.3186 -0.0214 -0.2680 38 ARG E O 1903 C CB . ARG B 38 ? 0.5402 1.0237 0.8639 -0.3389 0.0029 -0.3066 38 ARG E CB 1904 C CG . ARG B 38 ? 0.5616 1.0483 0.8593 -0.3726 -0.0284 -0.2974 38 ARG E CG 1905 C CD . ARG B 38 ? 0.6308 1.0721 0.8830 -0.4080 -0.0367 -0.3076 38 ARG E CD 1906 N NE . ARG B 38 ? 0.6659 1.1060 0.8913 -0.4498 -0.0791 -0.2903 38 ARG E NE 1907 C CZ . ARG B 38 ? 0.7390 1.1392 0.9157 -0.4950 -0.1020 -0.2898 38 ARG E CZ 1908 N NH1 . ARG B 38 ? 0.7826 1.1381 0.9284 -0.5016 -0.0784 -0.3119 38 ARG E NH1 1909 N NH2 . ARG B 38 ? 0.7757 1.1773 0.9348 -0.5378 -0.1527 -0.2637 38 ARG E NH2 1910 N N . GLN B 39 ? 0.4512 1.0041 0.8635 -0.3130 -0.0123 -0.2648 39 GLN E N 1911 C CA . GLN B 39 ? 0.4299 1.0063 0.8828 -0.3124 -0.0139 -0.2488 39 GLN E CA 1912 C C . GLN B 39 ? 0.4409 1.0146 0.9354 -0.3241 -0.0166 -0.2413 39 GLN E C 1913 O O . GLN B 39 ? 0.4543 1.0061 0.9433 -0.3238 -0.0055 -0.2465 39 GLN E O 1914 C CB . GLN B 39 ? 0.4161 0.9907 0.8648 -0.2984 0.0058 -0.2457 39 GLN E CB 1915 C CG . GLN B 39 ? 0.4155 0.9861 0.8942 -0.3041 0.0237 -0.2378 39 GLN E CG 1916 C CD . GLN B 39 ? 0.4181 0.9818 0.8721 -0.3021 0.0404 -0.2343 39 GLN E CD 1917 O OE1 . GLN B 39 ? 0.4386 0.9815 0.8532 -0.3027 0.0402 -0.2322 39 GLN E OE1 1918 N NE2 . GLN B 39 ? 0.4057 0.9841 0.8842 -0.3027 0.0512 -0.2303 39 GLN E NE2 1919 N N . SER B 40 ? 0.4430 1.0396 0.9890 -0.3352 -0.0327 -0.2255 40 SER E N 1920 C CA . SER B 40 ? 0.4497 1.0530 1.0647 -0.3463 -0.0344 -0.2129 40 SER E CA 1921 C C . SER B 40 ? 0.4285 1.0543 1.1242 -0.3393 -0.0143 -0.1989 40 SER E C 1922 O O . SER B 40 ? 0.4161 1.0527 1.1071 -0.3296 -0.0093 -0.1968 40 SER E O 1923 C CB . SER B 40 ? 0.4798 1.0882 1.1046 -0.3727 -0.0786 -0.1991 40 SER E CB 1924 O OG . SER B 40 ? 0.5219 1.1002 1.0545 -0.3831 -0.0890 -0.2171 40 SER E OG 1925 N N . PRO B 41 ? 0.4372 1.0664 1.2124 -0.3450 0.0037 -0.1910 41 PRO E N 1926 C CA . PRO B 41 ? 0.4246 1.0726 1.3030 -0.3404 0.0299 -0.1772 41 PRO E CA 1927 C C . PRO B 41 ? 0.4189 1.1045 1.3781 -0.3465 -0.0158 -0.1459 41 PRO E C 1928 O O . PRO B 41 ? 0.4065 1.1059 1.4257 -0.3368 -0.0012 -0.1355 41 PRO E O 1929 C CB . PRO B 41 ? 0.4345 1.0745 1.3873 -0.3488 0.0630 -0.1772 41 PRO E CB 1930 C CG . PRO B 41 ? 0.4509 1.0816 1.3566 -0.3615 0.0305 -0.1800 41 PRO E CG 1931 C CD . PRO B 41 ? 0.4572 1.0677 1.2355 -0.3551 0.0126 -0.1971 41 PRO E CD 1932 N N . GLY B 42 ? 0.4398 1.1343 1.3933 -0.3677 -0.0724 -0.1294 42 GLY E N 1933 C CA . GLY B 42 ? 0.4514 1.1727 1.4654 -0.3864 -0.1312 -0.0920 42 GLY E CA 1934 C C . GLY B 42 ? 0.4597 1.1767 1.3905 -0.3877 -0.1554 -0.0934 42 GLY E C 1935 O O . GLY B 42 ? 0.4577 1.1965 1.4566 -0.3879 -0.1751 -0.0664 42 GLY E O 1936 N N . LYS B 43 ? 0.4756 1.1633 1.2694 -0.3885 -0.1506 -0.1238 43 LYS E N 1937 C CA . LYS B 43 ? 0.4888 1.1669 1.1948 -0.3964 -0.1713 -0.1282 43 LYS E CA 1938 C C . LYS B 43 ? 0.4471 1.1256 1.1149 -0.3662 -0.1289 -0.1502 43 LYS E C 1939 O O . LYS B 43 ? 0.4624 1.1369 1.0709 -0.3713 -0.1414 -0.1530 43 LYS E O 1940 C CB . LYS B 43 ? 0.5502 1.1896 1.1359 -0.4233 -0.1887 -0.1478 43 LYS E CB 1941 C CG . LYS B 43 ? 0.6194 1.2454 1.1970 -0.4737 -0.2506 -0.1201 43 LYS E CG 1942 C CD . LYS B 43 ? 0.6584 1.2814 1.2047 -0.5031 -0.2959 -0.0961 43 LYS E CD 1943 C CE . LYS B 43 ? 0.7117 1.3383 1.3087 -0.5529 -0.3730 -0.0444 43 LYS E CE 1944 N NZ . LYS B 43 ? 0.8246 1.3908 1.2791 -0.6189 -0.4163 -0.0456 43 LYS E NZ 1945 N N . GLY B 44 ? 0.4050 1.0829 1.0991 -0.3414 -0.0806 -0.1644 44 GLY E N 1946 C CA . GLY B 44 ? 0.3756 1.0458 1.0170 -0.3215 -0.0464 -0.1832 44 GLY E CA 1947 C C . GLY B 44 ? 0.3818 1.0326 0.9265 -0.3198 -0.0460 -0.2057 44 GLY E C 1948 O O . GLY B 44 ? 0.3971 1.0303 0.9206 -0.3232 -0.0436 -0.2162 44 GLY E O 1949 N N . LEU B 45 ? 0.3668 1.0201 0.8639 -0.3140 -0.0446 -0.2123 45 LEU E N 1950 C CA . LEU B 45 ? 0.3781 1.0156 0.8085 -0.3114 -0.0386 -0.2319 45 LEU E CA 1951 C C . LEU B 45 ? 0.4135 1.0397 0.7979 -0.3346 -0.0608 -0.2362 45 LEU E C 1952 O O . LEU B 45 ? 0.4204 1.0560 0.8068 -0.3500 -0.0852 -0.2212 45 LEU E O 1953 C CB . LEU B 45 ? 0.3566 1.0009 0.7672 -0.2950 -0.0197 -0.2363 45 LEU E CB 1954 C CG . LEU B 45 ? 0.3444 0.9801 0.7640 -0.2843 0.0011 -0.2344 45 LEU E CG 1955 C CD1 . LEU B 45 ? 0.3339 0.9754 0.7318 -0.2786 0.0095 -0.2310 45 LEU E CD1 1956 C CD2 . LEU B 45 ? 0.3603 0.9766 0.7681 -0.2807 0.0045 -0.2422 45 LEU E CD2 1957 N N . GLU B 46 ? 0.4458 1.0439 0.7850 -0.3409 -0.0495 -0.2567 46 GLU E N 1958 C CA . GLU B 46 ? 0.5080 1.0741 0.7817 -0.3746 -0.0604 -0.2676 46 GLU E CA 1959 C C . GLU B 46 ? 0.5370 1.0738 0.7666 -0.3702 -0.0214 -0.2981 46 GLU E C 1960 O O . GLU B 46 ? 0.5409 1.0617 0.7853 -0.3564 0.0013 -0.3112 46 GLU E O 1961 C CB . GLU B 46 ? 0.5457 1.0907 0.8174 -0.4005 -0.0831 -0.2615 46 GLU E CB 1962 C CG . GLU B 46 ? 0.6296 1.1370 0.8281 -0.4530 -0.1137 -0.2591 46 GLU E CG 1963 C CD . GLU B 46 ? 0.6542 1.1573 0.8784 -0.4808 -0.1545 -0.2361 46 GLU E CD 1964 O OE1 . GLU B 46 ? 0.6068 1.1307 0.9002 -0.4561 -0.1460 -0.2316 46 GLU E OE1 1965 O OE2 . GLU B 46 ? 0.7252 1.2020 0.8998 -0.5321 -0.1980 -0.2195 46 GLU E OE2 1966 N N . TRP B 47 ? 0.5604 1.0884 0.7452 -0.3827 -0.0112 -0.3084 47 TRP E N 1967 C CA . TRP B 47 ? 0.5923 1.0925 0.7534 -0.3794 0.0354 -0.3383 47 TRP E CA 1968 C C . TRP B 47 ? 0.6878 1.1218 0.7769 -0.4190 0.0525 -0.3637 47 TRP E C 1969 O O . TRP B 47 ? 0.7482 1.1519 0.7640 -0.4658 0.0240 -0.3593 47 TRP E O 1970 C CB . TRP B 47 ? 0.5958 1.1054 0.7320 -0.3844 0.0459 -0.3422 47 TRP E CB 1971 C CG . TRP B 47 ? 0.6279 1.1153 0.7656 -0.3780 0.1013 -0.3714 47 TRP E CG 1972 C CD1 . TRP B 47 ? 0.5780 1.0958 0.7973 -0.3385 0.1259 -0.3697 47 TRP E CD1 1973 C CD2 . TRP B 47 ? 0.7287 1.1535 0.7901 -0.4167 0.1423 -0.4052 47 TRP E CD2 1974 N NE1 . TRP B 47 ? 0.6304 1.1174 0.8537 -0.3430 0.1811 -0.3984 47 TRP E NE1 1975 C CE2 . TRP B 47 ? 0.7272 1.1523 0.8481 -0.3914 0.1995 -0.4252 47 TRP E CE2 1976 C CE3 . TRP B 47 ? 0.8328 1.1943 0.7779 -0.4768 0.1363 -0.4189 47 TRP E CE3 1977 C CZ2 . TRP B 47 ? 0.8239 1.1878 0.8999 -0.4198 0.2639 -0.4645 47 TRP E CZ2 1978 C CZ3 . TRP B 47 ? 0.9417 1.2324 0.8145 -0.5130 0.1974 -0.4595 47 TRP E CZ3 1979 C CH2 . TRP B 47 ? 0.9352 1.2271 0.8776 -0.4822 0.2671 -0.4851 47 TRP E CH2 1980 N N . LEU B 48 ? 0.7080 1.1145 0.8181 -0.4044 0.0975 -0.3877 48 LEU E N 1981 C CA . LEU B 48 ? 0.8065 1.1403 0.8508 -0.4409 0.1235 -0.4157 48 LEU E CA 1982 C C . LEU B 48 ? 0.8884 1.1673 0.8949 -0.4567 0.1918 -0.4554 48 LEU E C 1983 O O . LEU B 48 ? 1.0029 1.2091 0.8974 -0.5138 0.2096 -0.4801 48 LEU E O 1984 C CB . LEU B 48 ? 0.7827 1.1144 0.8845 -0.4156 0.1293 -0.4146 48 LEU E CB 1985 C CG . LEU B 48 ? 0.7252 1.0947 0.8565 -0.4095 0.0743 -0.3825 48 LEU E CG 1986 C CD1 . LEU B 48 ? 0.7061 1.0699 0.8923 -0.3834 0.0873 -0.3834 48 LEU E CD1 1987 C CD2 . LEU B 48 ? 0.7887 1.1290 0.8433 -0.4635 0.0345 -0.3750 48 LEU E CD2 1988 N N . GLY B 49 ? 0.8414 1.1490 0.9411 -0.4119 0.2314 -0.4605 49 GLY E N 1989 C CA . GLY B 49 ? 0.9144 1.1760 1.0087 -0.4219 0.3064 -0.4976 49 GLY E CA 1990 C C . GLY B 49 ? 0.8451 1.1586 1.0734 -0.3692 0.3345 -0.4889 49 GLY E C 1991 O O . GLY B 49 ? 0.7441 1.1275 1.0512 -0.3299 0.2890 -0.4516 49 GLY E O 1992 N N . VAL B 50 ? 0.9124 1.1847 1.1638 -0.3750 0.4118 -0.5229 50 VAL E N 1993 C CA . VAL B 50 ? 0.8652 1.1793 1.2665 -0.3294 0.4474 -0.5147 50 VAL E CA 1994 C C . VAL B 50 ? 0.9599 1.2049 1.4104 -0.3342 0.5442 -0.5568 50 VAL E C 1995 O O . VAL B 50 ? 1.0798 1.2359 1.4153 -0.3846 0.5991 -0.6025 50 VAL E O 1996 C CB . VAL B 50 ? 0.8514 1.1972 1.2549 -0.3331 0.4587 -0.5143 50 VAL E CB 1997 C CG1 . VAL B 50 ? 0.7598 1.1829 1.3279 -0.2812 0.4472 -0.4787 50 VAL E CG1 1998 C CG2 . VAL B 50 ? 0.8290 1.1948 1.1137 -0.3605 0.3947 -0.4984 50 VAL E CG2 1999 N N . ILE B 51 ? 0.9136 1.1954 1.5386 -0.2854 0.5652 -0.5386 51 ILE E N 2000 C CA . ILE B 51 ? 0.9885 1.2246 1.7158 -0.2793 0.6670 -0.5723 51 ILE E CA 2001 C C . ILE B 51 ? 0.9230 1.2325 1.7945 -0.2458 0.6699 -0.5452 51 ILE E C 2002 O O . ILE B 51 ? 0.8217 1.2111 1.8038 -0.2060 0.6021 -0.4905 51 ILE E O 2003 C CB . ILE B 51 ? 1.0137 1.2156 1.8488 -0.2539 0.6989 -0.5740 51 ILE E CB 2004 C CG1 . ILE B 51 ? 1.1136 1.2511 2.0521 -0.2538 0.8233 -0.6181 51 ILE E CG1 2005 C CG2 . ILE B 51 ? 0.8988 1.1840 1.8861 -0.1998 0.6235 -0.5094 51 ILE E CG2 2006 C CD1 . ILE B 51 ? 1.1969 1.2522 2.1588 -0.2562 0.8808 -0.6462 51 ILE E CD1 2007 N N . TRP B 52 ? 0.9920 1.2688 1.8488 -0.2697 0.7469 -0.5831 52 TRP E N 2008 C CA . TRP B 52 ? 0.9400 1.2829 1.9305 -0.2443 0.7567 -0.5611 52 TRP E CA 2009 C C . TRP B 52 ? 0.9419 1.2968 2.1730 -0.2013 0.8156 -0.5504 52 TRP E C 2010 O O . TRP B 52 ? 1.0210 1.3053 2.2917 -0.2027 0.8887 -0.5833 52 TRP E O 2011 C CB . TRP B 52 ? 1.0225 1.3196 1.9026 -0.2910 0.8220 -0.6076 52 TRP E CB 2012 C CG . TRP B 52 ? 1.0314 1.3117 1.6855 -0.3374 0.7598 -0.6122 52 TRP E CG 2013 C CD1 . TRP B 52 ? 1.1459 1.3308 1.6045 -0.3989 0.7829 -0.6547 52 TRP E CD1 2014 C CD2 . TRP B 52 ? 0.9281 1.2859 1.5397 -0.3282 0.6608 -0.5676 52 TRP E CD2 2015 N NE1 . TRP B 52 ? 1.1132 1.3202 1.4284 -0.4253 0.6977 -0.6331 52 TRP E NE1 2016 C CE2 . TRP B 52 ? 0.9795 1.2910 1.3890 -0.3801 0.6286 -0.5830 52 TRP E CE2 2017 C CE3 . TRP B 52 ? 0.8083 1.2643 1.5322 -0.2860 0.5968 -0.5148 52 TRP E CE3 2018 C CZ2 . TRP B 52 ? 0.9080 1.2721 1.2461 -0.3833 0.5411 -0.5481 52 TRP E CZ2 2019 C CZ3 . TRP B 52 ? 0.7465 1.2456 1.3773 -0.2939 0.5165 -0.4867 52 TRP E CZ3 2020 C CH2 . TRP B 52 ? 0.7921 1.2475 1.2419 -0.3383 0.4921 -0.5038 52 TRP E CH2 2021 N N . SER B 53 ? 0.8619 1.3032 2.2585 -0.1663 0.7834 -0.5021 53 SER E N 2022 C CA . SER B 53 ? 0.8483 1.3197 2.5065 -0.1220 0.8124 -0.4710 53 SER E CA 2023 C C . SER B 53 ? 0.9703 1.3543 2.7029 -0.1303 0.9570 -0.5332 53 SER E C 2024 O O . SER B 53 ? 0.9958 1.3549 2.8755 -0.1037 0.9932 -0.5282 53 SER E O 2025 C CB . SER B 53 ? 0.7726 1.3384 2.5802 -0.0997 0.7720 -0.4186 53 SER E CB 2026 O OG . SER B 53 ? 0.8174 1.3691 2.5828 -0.1253 0.8437 -0.4602 53 SER E OG 2027 N N . GLY B 54 ? 1.0571 1.3848 2.6757 -0.1725 1.0419 -0.5933 54 GLY E N 2028 C CA . GLY B 54 ? 1.1971 1.4243 2.8470 -0.1944 1.1909 -0.6619 54 GLY E CA 2029 C C . GLY B 54 ? 1.3040 1.4457 2.6846 -0.2659 1.2364 -0.7264 54 GLY E C 2030 O O . GLY B 54 ? 1.2847 1.4606 2.6065 -0.2840 1.2210 -0.7240 54 GLY E O 2031 N N . GLY B 55 ? 1.4214 1.4507 2.6249 -0.3125 1.2810 -0.7789 55 GLY E N 2032 C CA . GLY B 55 ? 1.4263 1.4224 2.6342 -0.2976 1.2591 -0.7732 55 GLY E CA 2033 C C . GLY B 55 ? 1.4957 1.4151 2.4168 -0.3595 1.2196 -0.8016 55 GLY E C 2034 O O . GLY B 55 ? 1.5357 1.4006 2.4186 -0.3649 1.2214 -0.8126 55 GLY E O 2035 N N . SER B 56 ? 1.5095 1.4274 2.2389 -0.4071 1.1780 -0.8080 56 SER E N 2036 C CA . SER B 56 ? 1.6011 1.4383 2.0581 -0.4798 1.1460 -0.8340 56 SER E CA 2037 C C . SER B 56 ? 1.4688 1.3904 1.8819 -0.4561 0.9985 -0.7740 56 SER E C 2038 O O . SER B 56 ? 1.3168 1.3518 1.8796 -0.3923 0.9257 -0.7176 56 SER E O 2039 C CB . SER B 56 ? 1.6947 1.4830 1.9809 -0.5472 1.1760 -0.8662 56 SER E CB 2040 O OG . SER B 56 ? 1.5609 1.4640 1.9081 -0.5133 1.1010 -0.8188 56 SER E OG 2041 N N . THR B 57 ? 1.5403 1.3989 1.7468 -0.5141 0.9582 -0.7863 57 THR E N 2042 C CA . THR B 57 ? 1.4401 1.3606 1.5945 -0.5023 0.8325 -0.7372 57 THR E CA 2043 C C . THR B 57 ? 1.4820 1.3830 1.4350 -0.5654 0.7704 -0.7325 57 THR E C 2044 O O . THR B 57 ? 1.6330 1.4340 1.4300 -0.6390 0.8237 -0.7750 57 THR E O 2045 C CB . THR B 57 ? 1.4917 1.3520 1.6043 -0.5149 0.8317 -0.7484 57 THR E CB 2046 O OG1 . THR B 57 ? 1.6854 1.4041 1.6401 -0.5928 0.9182 -0.8104 57 THR E OG1 2047 C CG2 . THR B 57 ? 1.4262 1.3214 1.7480 -0.4455 0.8601 -0.7350 57 THR E CG2 2048 N N . ASP B 58 ? 1.3611 1.3497 1.3162 -0.5414 0.6581 -0.6793 58 ASP E N 2049 C CA . ASP B 58 ? 1.3898 1.3687 1.1830 -0.5956 0.5857 -0.6631 58 ASP E CA 2050 C C . ASP B 58 ? 1.3113 1.3359 1.1003 -0.5822 0.4881 -0.6206 58 ASP E C 2051 O O . ASP B 58 ? 1.1802 1.2898 1.1028 -0.5172 0.4502 -0.5869 58 ASP E O 2052 C CB . ASP B 58 ? 1.3213 1.3672 1.1353 -0.5820 0.5574 -0.6406 58 ASP E CB 2053 C CG . ASP B 58 ? 1.4350 1.4155 1.1975 -0.6217 0.6490 -0.6857 58 ASP E CG 2054 O OD1 . ASP B 58 ? 1.4395 1.4166 1.3250 -0.5893 0.7360 -0.7116 58 ASP E OD1 2055 O OD2 . ASP B 58 ? 1.5273 1.4561 1.1314 -0.6881 0.6353 -0.6937 58 ASP E OD2 2056 N N . TYR B 59 ? 1.4018 1.3668 1.0363 -0.6495 0.4462 -0.6198 59 TYR E N 2057 C CA . TYR B 59 ? 1.3572 1.3467 0.9880 -0.6473 0.3682 -0.5863 59 TYR E CA 2058 C C . TYR B 59 ? 1.3496 1.3627 0.9007 -0.6850 0.2746 -0.5458 59 TYR E C 2059 O O . TYR B 59 ? 1.4507 1.4094 0.8766 -0.7482 0.2720 -0.5536 59 TYR E O 2060 C CB . TYR B 59 ? 1.4908 1.3770 1.0293 -0.6977 0.4038 -0.6193 59 TYR E CB 2061 C CG . TYR B 59 ? 1.5103 1.3634 1.1382 -0.6619 0.4981 -0.6580 59 TYR E CG 2062 C CD1 . TYR B 59 ? 1.3786 1.3097 1.1750 -0.5827 0.4872 -0.6349 59 TYR E CD1 2063 C CD2 . TYR B 59 ? 1.6735 1.4086 1.2173 -0.7123 0.6002 -0.7167 59 TYR E CD2 2064 C CE1 . TYR B 59 ? 1.3991 1.3001 1.2945 -0.5500 0.5663 -0.6624 59 TYR E CE1 2065 C CE2 . TYR B 59 ? 1.6943 1.3970 1.3430 -0.6770 0.6919 -0.7504 59 TYR E CE2 2066 C CZ . TYR B 59 ? 1.5527 1.3422 1.3847 -0.5939 0.6702 -0.7200 59 TYR E CZ 2067 O OH . TYR B 59 ? 1.5761 1.3335 1.5280 -0.5592 0.7550 -0.7463 59 TYR E OH 2068 N N . ASN B 60 ? 1.2341 1.3260 0.8664 -0.6468 0.2005 -0.5009 60 ASN E N 2069 C CA . ASN B 60 ? 1.2288 1.3416 0.8168 -0.6806 0.1096 -0.4571 60 ASN E CA 2070 C C . ASN B 60 ? 1.3944 1.4044 0.8240 -0.7729 0.0930 -0.4667 60 ASN E C 2071 O O . ASN B 60 ? 1.4504 1.4106 0.8546 -0.7881 0.1155 -0.4865 60 ASN E O 2072 C CB . ASN B 60 ? 1.0987 1.2937 0.8092 -0.6272 0.0574 -0.4187 60 ASN E CB 2073 C CG . ASN B 60 ? 1.0790 1.3079 0.7898 -0.6514 -0.0311 -0.3688 60 ASN E CG 2074 O OD1 . ASN B 60 ? 1.1881 1.3627 0.7924 -0.7228 -0.0708 -0.3573 60 ASN E OD1 2075 N ND2 . ASN B 60 ? 0.9510 1.2644 0.7852 -0.5962 -0.0618 -0.3366 60 ASN E ND2 2076 N N . ALA B 61 ? 1.4814 1.4549 0.7998 -0.8391 0.0496 -0.4497 61 ALA E N 2077 C CA . ALA B 61 ? 1.6721 1.5300 0.8076 -0.9461 0.0299 -0.4566 61 ALA E CA 2078 C C . ALA B 61 ? 1.6932 1.5400 0.8274 -0.9699 -0.0252 -0.4325 61 ALA E C 2079 O O . ALA B 61 ? 1.8505 1.5902 0.8454 -1.0461 -0.0103 -0.4560 61 ALA E O 2080 C CB . ALA B 61 ? 1.7396 1.5805 0.7827 -1.0092 -0.0387 -0.4204 61 ALA E CB 2081 N N . ALA B 62 ? 1.5437 1.4954 0.8294 -0.9092 -0.0847 -0.3871 62 ALA E N 2082 C CA . ALA B 62 ? 1.5427 1.5006 0.8579 -0.9226 -0.1375 -0.3599 62 ALA E CA 2083 C C . ALA B 62 ? 1.5376 1.4709 0.8777 -0.8915 -0.0710 -0.4012 62 ALA E C 2084 O O . ALA B 62 ? 1.5561 1.4802 0.9021 -0.9098 -0.1053 -0.3860 62 ALA E O 2085 C CB . ALA B 62 ? 1.3880 1.4619 0.8687 -0.8664 -0.2065 -0.3030 62 ALA E CB 2086 N N . PHE B 63 ? 1.5112 1.4388 0.8819 -0.8426 0.0200 -0.4482 63 PHE E N 2087 C CA . PHE B 63 ? 1.5099 1.4121 0.9191 -0.8103 0.0847 -0.4843 63 PHE E CA 2088 C C . PHE B 63 ? 1.6655 1.4487 0.9577 -0.8558 0.1778 -0.5457 63 PHE E C 2089 O O . PHE B 63 ? 1.6944 1.4354 1.0039 -0.8423 0.2342 -0.5772 63 PHE E O 2090 C CB . PHE B 63 ? 1.3399 1.3416 0.9221 -0.7092 0.1070 -0.4777 63 PHE E CB 2091 C CG . PHE B 63 ? 1.2111 1.3091 0.9001 -0.6708 0.0325 -0.4262 63 PHE E CG 2092 C CD1 . PHE B 63 ? 1.1525 1.3100 0.8701 -0.6669 -0.0211 -0.3893 63 PHE E CD1 2093 C CD2 . PHE B 63 ? 1.1614 1.2820 0.9194 -0.6443 0.0202 -0.4159 63 PHE E CD2 2094 C CE1 . PHE B 63 ? 1.0465 1.2833 0.8702 -0.6343 -0.0770 -0.3457 63 PHE E CE1 2095 C CE2 . PHE B 63 ? 1.0560 1.2564 0.9121 -0.6142 -0.0364 -0.3729 63 PHE E CE2 2096 C CZ . PHE B 63 ? 1.0000 1.2573 0.8927 -0.6087 -0.0812 -0.3390 63 PHE E CZ 2097 N N . ILE B 64 ? 1.7763 1.4983 0.9479 -0.9134 0.1976 -0.5631 64 ILE E N 2098 C CA . ILE B 64 ? 1.9775 1.5565 0.9859 -0.9918 0.2755 -0.6189 64 ILE E CA 2099 C C . ILE B 64 ? 2.0862 1.6005 0.9792 -1.0690 0.2128 -0.6008 64 ILE E C 2100 O O . ILE B 64 ? 2.0556 1.6165 0.9423 -1.0941 0.1054 -0.5436 64 ILE E O 2101 C CB . ILE B 64 ? 2.0880 1.6103 0.9661 -1.0548 0.2908 -0.6318 64 ILE E CB 2102 C CG1 . ILE B 64 ? 2.0104 1.5761 0.9957 -0.9864 0.3754 -0.6616 64 ILE E CG1 2103 C CG2 . ILE B 64 ? 2.3432 1.6932 0.9889 -1.1761 0.3378 -0.6761 64 ILE E CG2 2104 C CD1 . ILE B 64 ? 2.0734 1.6166 0.9656 -1.0310 0.3758 -0.6629 64 ILE E CD1 2105 N N . SER B 65 ? 2.2106 1.6227 1.0262 -1.1068 0.2723 -0.6430 65 SER E N 2106 C CA . SER B 65 ? 2.2365 1.5992 1.0995 -1.0681 0.3972 -0.7046 65 SER E CA 2107 C C . SER B 65 ? 2.1678 1.5597 1.1279 -1.0231 0.3858 -0.6959 65 SER E C 2108 O O . SER B 65 ? 2.2981 1.5818 1.1783 -1.0647 0.4455 -0.7368 65 SER E O 2109 C CB . SER B 65 ? 2.4916 1.6727 1.1458 -1.1725 0.4918 -0.7702 65 SER E CB 2110 O OG . SER B 65 ? 2.5956 1.7274 1.1100 -1.2430 0.4845 -0.7727 65 SER E OG 2111 N N . ARG B 66 ? 1.9755 1.5039 1.0981 -0.9440 0.3133 -0.6447 66 ARG E N 2112 C CA . ARG B 66 ? 1.8938 1.4576 1.1347 -0.8849 0.3212 -0.6415 66 ARG E CA 2113 C C . ARG B 66 ? 1.7199 1.3886 1.1589 -0.7755 0.3477 -0.6327 66 ARG E C 2114 O O . ARG B 66 ? 1.6201 1.3461 1.1711 -0.7213 0.3257 -0.6116 66 ARG E O 2115 C CB . ARG B 66 ? 1.8451 1.4574 1.0961 -0.8986 0.2184 -0.5909 66 ARG E CB 2116 C CG . ARG B 66 ? 1.7103 1.4404 1.0407 -0.8705 0.1261 -0.5319 66 ARG E CG 2117 C CD . ARG B 66 ? 1.6287 1.4227 1.0372 -0.8554 0.0505 -0.4869 66 ARG E CD 2118 N NE . ARG B 66 ? 1.4466 1.3674 1.0170 -0.7749 0.0166 -0.4495 66 ARG E NE 2119 C CZ . ARG B 66 ? 1.3661 1.3623 1.0129 -0.7662 -0.0590 -0.3997 66 ARG E CZ 2120 N NH1 . ARG B 66 ? 1.4384 1.4118 1.0336 -0.8310 -0.1247 -0.3706 66 ARG E NH1 2121 N NH2 . ARG B 66 ? 1.2215 1.3144 1.0023 -0.6947 -0.0667 -0.3775 66 ARG E NH2 2122 N N . LEU B 67 ? 1.6947 1.3843 1.1712 -0.7494 0.3913 -0.6461 67 LEU E N 2123 C CA . LEU B 67 ? 1.5460 1.3291 1.2027 -0.6563 0.4102 -0.6329 67 LEU E CA 2124 C C . LEU B 67 ? 1.6045 1.3395 1.2982 -0.6426 0.5170 -0.6782 67 LEU E C 2125 O O . LEU B 67 ? 1.6968 1.3805 1.2964 -0.6885 0.5547 -0.7046 67 LEU E O 2126 C CB . LEU B 67 ? 1.4154 1.3077 1.1241 -0.6257 0.3361 -0.5867 67 LEU E CB 2127 C CG . LEU B 67 ? 1.2488 1.2496 1.1287 -0.5385 0.3194 -0.5554 67 LEU E CG 2128 C CD1 . LEU B 67 ? 1.2104 1.2449 1.1503 -0.5078 0.3568 -0.5615 67 LEU E CD1 2129 C CD2 . LEU B 67 ? 1.2200 1.2187 1.1994 -0.4949 0.3466 -0.5582 67 LEU E CD2 2130 N N . SER B 68 ? 1.5583 1.3073 1.3956 -0.5822 0.5658 -0.6848 68 SER E N 2131 C CA . SER B 68 ? 1.5824 1.3119 1.5168 -0.5523 0.6615 -0.7153 68 SER E CA 2132 C C . SER B 68 ? 1.4282 1.2644 1.5718 -0.4631 0.6402 -0.6749 68 SER E C 2133 O O . SER B 68 ? 1.3606 1.2306 1.5802 -0.4274 0.6007 -0.6467 68 SER E O 2134 C CB . SER B 68 ? 1.7367 1.3389 1.6406 -0.5833 0.7681 -0.7719 68 SER E CB 2135 O OG . SER B 68 ? 1.6931 1.3050 1.7056 -0.5394 0.7646 -0.7584 68 SER E OG 2136 N N . ILE B 69 ? 1.3845 1.2675 1.6120 -0.4347 0.6644 -0.6705 69 ILE E N 2137 C CA . ILE B 69 ? 1.2628 1.2371 1.6860 -0.3610 0.6471 -0.6307 69 ILE E CA 2138 C C . ILE B 69 ? 1.3266 1.2594 1.8756 -0.3419 0.7536 -0.6614 69 ILE E C 2139 O O . ILE B 69 ? 1.4264 1.2979 1.9102 -0.3799 0.8296 -0.7065 69 ILE E O 2140 C CB . ILE B 69 ? 1.1586 1.2274 1.5928 -0.3444 0.5842 -0.5946 69 ILE E CB 2141 C CG1 . ILE B 69 ? 1.1017 1.2096 1.4301 -0.3624 0.4879 -0.5647 69 ILE E CG1 2142 C CG2 . ILE B 69 ? 1.0504 1.2035 1.6749 -0.2795 0.5637 -0.5510 69 ILE E CG2 2143 C CD1 . ILE B 69 ? 1.0497 1.2124 1.3292 -0.3714 0.4436 -0.5468 69 ILE E CD1 2144 N N . SER B 70 ? 1.2801 1.2416 2.0139 -0.2869 0.7619 -0.6358 70 SER E N 2145 C CA . SER B 70 ? 1.3429 1.2664 2.2318 -0.2652 0.8676 -0.6609 70 SER E CA 2146 C C . SER B 70 ? 1.2435 1.2520 2.3835 -0.1949 0.8399 -0.6029 70 SER E C 2147 O O . SER B 70 ? 1.1290 1.2233 2.3052 -0.1672 0.7364 -0.5433 70 SER E O 2148 C CB . SER B 70 ? 1.4930 1.2863 2.3262 -0.2998 0.9644 -0.7195 70 SER E CB 2149 O OG . SER B 70 ? 1.4674 1.2583 2.3588 -0.2744 0.9287 -0.6949 70 SER E OG 2150 N N . LYS B 71 ? 1.3071 1.2794 2.6162 -0.1733 0.9376 -0.6217 71 LYS E N 2151 C CA . LYS B 71 ? 1.2487 1.2928 2.8028 -0.1225 0.9458 -0.5803 71 LYS E CA 2152 C C . LYS B 71 ? 1.1732 1.2773 2.9338 -0.0688 0.8783 -0.5078 71 LYS E C 2153 O O . LYS B 71 ? 1.1710 1.2550 2.8957 -0.0662 0.8332 -0.4921 71 LYS E O 2154 C CB . LYS B 71 ? 1.3676 1.3339 3.0231 -0.1290 1.0989 -0.6387 71 LYS E CB 2155 C CG . LYS B 71 ? 1.4819 1.3413 3.1918 -0.1306 1.1945 -0.6786 71 LYS E CG 2156 C CD . LYS B 71 ? 1.6011 1.3851 3.4368 -0.1347 1.3557 -0.7350 71 LYS E CD 2157 C CE . LYS B 71 ? 1.7499 1.3976 3.5777 -0.1542 1.4709 -0.7940 71 LYS E CE 2158 N NZ . LYS B 71 ? 1.8695 1.4423 3.8590 -0.1526 1.6400 -0.8467 71 LYS E NZ 2159 N N . ASP B 72 ? 1.1190 1.2956 3.0929 -0.0313 0.8675 -0.4606 72 ASP E N 2160 C CA . ASP B 72 ? 1.0732 1.2966 3.2918 0.0157 0.8190 -0.3876 72 ASP E CA 2161 C C . ASP B 72 ? 1.1516 1.3305 3.6137 0.0429 0.9389 -0.4059 72 ASP E C 2162 O O . ASP B 72 ? 1.1475 1.3625 3.7726 0.0589 0.9861 -0.3991 72 ASP E O 2163 C CB . ASP B 72 ? 0.9645 1.3013 3.2752 0.0341 0.7090 -0.3075 72 ASP E CB 2164 C CG . ASP B 72 ? 0.9434 1.3243 3.5520 0.0761 0.6780 -0.2309 72 ASP E CG 2165 O OD1 . ASP B 72 ? 0.9441 1.3111 3.6044 0.0882 0.6264 -0.1911 72 ASP E OD1 2166 O OD2 . ASP B 72 ? 0.9294 1.3589 3.7252 0.0945 0.7016 -0.2068 72 ASP E OD2 2167 N N . ASN B 73 ? 1.2275 1.3241 3.7166 0.0465 0.9943 -0.4314 73 ASN E N 2168 C CA . ASN B 73 ? 1.2993 1.3516 4.0569 0.0796 1.1010 -0.4371 73 ASN E CA 2169 C C . ASN B 73 ? 1.2168 1.3644 4.2700 0.1300 1.0152 -0.3334 73 ASN E C 2170 O O . ASN B 73 ? 1.2076 1.3997 4.4910 0.1554 1.0540 -0.3097 73 ASN E O 2171 C CB . ASN B 73 ? 1.3980 1.3391 4.1156 0.0720 1.1657 -0.4795 73 ASN E CB 2172 C CG . ASN B 73 ? 1.5476 1.3611 4.1527 0.0322 1.3320 -0.5871 73 ASN E CG 2173 O OD1 . ASN B 73 ? 1.6168 1.3471 3.9732 -0.0141 1.3496 -0.6425 73 ASN E OD1 2174 N ND2 . ASN B 73 ? 1.6088 1.4008 4.3917 0.0438 1.4559 -0.6169 73 ASN E ND2 2175 N N . SER B 74 ? 1.1642 1.3391 4.1997 0.1378 0.8942 -0.2699 74 SER E N 2176 C CA . SER B 74 ? 1.1055 1.3530 4.3805 0.1720 0.7891 -0.1626 74 SER E CA 2177 C C . SER B 74 ? 1.0186 1.3284 4.1176 0.1500 0.6274 -0.1034 74 SER E C 2178 O O . SER B 74 ? 1.0118 1.2947 3.8362 0.1175 0.6096 -0.1481 74 SER E O 2179 C CB . SER B 74 ? 1.1685 1.3528 4.6076 0.1974 0.8205 -0.1471 74 SER E CB 2180 O OG . SER B 74 ? 1.1853 1.3131 4.3976 0.1730 0.7861 -0.1719 74 SER E OG 2181 N N . LYS B 75 ? 0.9643 1.3501 4.2221 0.1625 0.5123 -0.0023 75 LYS E N 2182 C CA . LYS B 75 ? 0.8970 1.3374 3.9932 0.1337 0.3672 0.0545 75 LYS E CA 2183 C C . LYS B 75 ? 0.8477 1.3329 3.7740 0.1106 0.3680 0.0190 75 LYS E C 2184 O O . LYS B 75 ? 0.8343 1.3647 3.9003 0.1229 0.3998 0.0272 75 LYS E O 2185 C CB . LYS B 75 ? 0.9106 1.3002 3.8165 0.1128 0.3150 0.0498 75 LYS E CB 2186 C CG . LYS B 75 ? 0.9425 1.3131 4.0208 0.1276 0.2550 0.1245 75 LYS E CG 2187 C CD . LYS B 75 ? 0.9262 1.2952 3.8244 0.0924 0.1305 0.1707 75 LYS E CD 2188 C CE . LYS B 75 ? 0.9749 1.3050 4.0001 0.0998 0.0801 0.2322 75 LYS E CE 2189 N NZ . LYS B 75 ? 0.9919 1.3559 4.3423 0.1271 0.0466 0.3198 75 LYS E NZ 2190 N N . SER B 76 ? 0.8244 1.2970 3.4685 0.0782 0.3364 -0.0180 76 SER E N 2191 C CA . SER B 76 ? 0.7763 1.2908 3.2534 0.0543 0.3201 -0.0414 76 SER E CA 2192 C C . SER B 76 ? 0.7789 1.2491 2.9758 0.0254 0.3272 -0.1029 76 SER E C 2193 O O . SER B 76 ? 0.7343 1.2310 2.7703 0.0008 0.2491 -0.0855 76 SER E O 2194 C CB . SER B 76 ? 0.7238 1.3096 3.2321 0.0418 0.1934 0.0467 76 SER E CB 2195 O OG . SER B 76 ? 0.7339 1.3069 3.2453 0.0321 0.1009 0.1090 76 SER E OG 2196 N N . HIS B 77 ? 0.8402 1.2386 2.9854 0.0247 0.4258 -0.1752 77 HIS E N 2197 C CA . HIS B 77 ? 0.8592 1.2061 2.7810 -0.0023 0.4268 -0.2218 77 HIS E CA 2198 C C . HIS B 77 ? 0.8835 1.2028 2.6278 -0.0305 0.4910 -0.2964 77 HIS E C 2199 O O . HIS B 77 ? 0.9393 1.2233 2.7296 -0.0305 0.5895 -0.3441 77 HIS E O 2200 C CB . HIS B 77 ? 0.9287 1.2002 2.9020 0.0068 0.4764 -0.2417 77 HIS E CB 2201 C CG . HIS B 77 ? 0.9150 1.1998 3.0122 0.0245 0.3986 -0.1684 77 HIS E CG 2202 N ND1 . HIS B 77 ? 0.9730 1.2071 3.2244 0.0469 0.4398 -0.1617 77 HIS E ND1 2203 C CD2 . HIS B 77 ? 0.8629 1.1977 2.9488 0.0174 0.2824 -0.0968 77 HIS E CD2 2204 C CE1 . HIS B 77 ? 0.9528 1.2094 3.2862 0.0539 0.3444 -0.0844 77 HIS E CE1 2205 N NE2 . HIS B 77 ? 0.8921 1.2062 3.1188 0.0327 0.2484 -0.0450 77 HIS E NE2 2206 N N . VAL B 78 ? 0.8507 1.1798 2.3946 -0.0585 0.4366 -0.3050 78 VAL E N 2207 C CA . VAL B 78 ? 0.8844 1.1787 2.2444 -0.0931 0.4810 -0.3683 78 VAL E CA 2208 C C . VAL B 78 ? 0.9169 1.1593 2.1265 -0.1186 0.4677 -0.3925 78 VAL E C 2209 O O . VAL B 78 ? 0.8683 1.1376 2.0350 -0.1188 0.3902 -0.3564 78 VAL E O 2210 C CB . VAL B 78 ? 0.8183 1.1743 2.0823 -0.1069 0.4288 -0.3558 78 VAL E CB 2211 C CG1 . VAL B 78 ? 0.8646 1.1797 1.9544 -0.1458 0.4718 -0.4149 78 VAL E CG1 2212 C CG2 . VAL B 78 ? 0.7814 1.1962 2.1947 -0.0839 0.4275 -0.3229 78 VAL E CG2 2213 N N . PHE B 79 ? 1.0099 1.1733 2.1319 -0.1466 0.5450 -0.4540 79 PHE E N 2214 C CA . PHE B 79 ? 1.0619 1.1638 2.0610 -0.1743 0.5433 -0.4788 79 PHE E CA 2215 C C . PHE B 79 ? 1.0839 1.1699 1.8800 -0.2234 0.5283 -0.5099 79 PHE E C 2216 O O . PHE B 79 ? 1.1615 1.1990 1.8798 -0.2563 0.5893 -0.5554 79 PHE E O 2217 C CB . PHE B 79 ? 1.1751 1.1809 2.2207 -0.1790 0.6416 -0.5234 79 PHE E CB 2218 C CG . PHE B 79 ? 1.1688 1.1823 2.4432 -0.1299 0.6650 -0.4918 79 PHE E CG 2219 C CD1 . PHE B 79 ? 1.0744 1.1665 2.4744 -0.0928 0.5790 -0.4194 79 PHE E CD1 2220 C CD2 . PHE B 79 ? 1.2726 1.2046 2.6378 -0.1263 0.7753 -0.5333 79 PHE E CD2 2221 C CE1 . PHE B 79 ? 1.0791 1.1753 2.6974 -0.0533 0.5912 -0.3821 79 PHE E CE1 2222 C CE2 . PHE B 79 ? 1.2707 1.2093 2.8719 -0.0797 0.7980 -0.4999 79 PHE E CE2 2223 C CZ . PHE B 79 ? 1.1708 1.1958 2.9036 -0.0428 0.6987 -0.4197 79 PHE E CZ 2224 N N . PHE B 80 ? 1.0253 1.1477 1.7417 -0.2318 0.4476 -0.4826 80 PHE E N 2225 C CA . PHE B 80 ? 1.0378 1.1524 1.5880 -0.2766 0.4178 -0.4987 80 PHE E CA 2226 C C . PHE B 80 ? 1.1170 1.1589 1.5825 -0.3094 0.4292 -0.5230 80 PHE E C 2227 O O . PHE B 80 ? 1.1033 1.1393 1.6263 -0.2896 0.4154 -0.5062 80 PHE E O 2228 C CB . PHE B 80 ? 0.9296 1.1267 1.4694 -0.2647 0.3311 -0.4533 80 PHE E CB 2229 C CG . PHE B 80 ? 0.9317 1.1298 1.3385 -0.3047 0.2913 -0.4581 80 PHE E CG 2230 C CD1 . PHE B 80 ? 0.9532 1.1262 1.3056 -0.3255 0.2653 -0.4570 80 PHE E CD1 2231 C CD2 . PHE B 80 ? 0.9132 1.1409 1.2635 -0.3213 0.2750 -0.4579 80 PHE E CD2 2232 C CE1 . PHE B 80 ? 0.9574 1.1372 1.2144 -0.3624 0.2233 -0.4533 80 PHE E CE1 2233 C CE2 . PHE B 80 ? 0.9175 1.1490 1.1695 -0.3575 0.2316 -0.4533 80 PHE E CE2 2234 C CZ . PHE B 80 ? 0.9391 1.1488 1.1517 -0.3778 0.2046 -0.4493 80 PHE E CZ 2235 N N . LYS B 81 ? 1.2088 1.1910 1.5317 -0.3650 0.4500 -0.5594 81 LYS E N 2236 C CA . LYS B 81 ? 1.3048 1.2084 1.5315 -0.4075 0.4605 -0.5834 81 LYS E CA 2237 C C . LYS B 81 ? 1.3678 1.2428 1.4267 -0.4746 0.4278 -0.5942 81 LYS E C 2238 O O . LYS B 81 ? 1.4480 1.2782 1.4212 -0.5147 0.4634 -0.6228 81 LYS E O 2239 C CB . LYS B 81 ? 1.4245 1.2292 1.6734 -0.4152 0.5610 -0.6301 81 LYS E CB 2240 C CG . LYS B 81 ? 1.5711 1.2634 1.6648 -0.4846 0.5932 -0.6722 81 LYS E CG 2241 C CD . LYS B 81 ? 1.6746 1.2699 1.8151 -0.4818 0.6854 -0.7106 81 LYS E CD 2242 C CE . LYS B 81 ? 1.6425 1.2419 1.8248 -0.4623 0.6462 -0.6872 81 LYS E CE 2243 N NZ . LYS B 81 ? 1.7751 1.2572 1.9557 -0.4793 0.7340 -0.7307 81 LYS E NZ 2244 N N . MET B 82 ? 1.3412 1.2380 1.3580 -0.4909 0.3594 -0.5688 82 MET E N 2245 C CA . MET B 82 ? 1.3915 1.2739 1.2773 -0.5536 0.3092 -0.5634 82 MET E CA 2246 C C . MET B 82 ? 1.4823 1.2973 1.2880 -0.6010 0.2981 -0.5725 82 MET E C 2247 O O . MET B 82 ? 1.4378 1.2696 1.3110 -0.5711 0.2867 -0.5593 82 MET E O 2248 C CB . MET B 82 ? 1.2644 1.2523 1.1993 -0.5291 0.2285 -0.5145 82 MET E CB 2249 C CG . MET B 82 ? 1.3029 1.2908 1.1381 -0.5869 0.1722 -0.4991 82 MET E CG 2250 S SD . MET B 82 ? 1.1639 1.2697 1.0807 -0.5490 0.1064 -0.4504 82 MET E SD 2251 C CE . MET B 82 ? 1.0892 1.2455 1.0763 -0.5333 0.0510 -0.4138 82 MET E CE 2252 N N . ASN B 83 A 1.6191 1.3524 1.2731 -0.6809 0.2990 -0.5933 82 ASN E N 2253 C CA . ASN B 83 A 1.7403 1.3856 1.2968 -0.7392 0.2995 -0.6091 82 ASN E CA 2254 C C . ASN B 83 A 1.7327 1.4005 1.2587 -0.7742 0.2131 -0.5716 82 ASN E C 2255 O O . ASN B 83 A 1.7442 1.3874 1.2887 -0.7699 0.2194 -0.5754 82 ASN E O 2256 C CB . ASN B 83 A 1.9365 1.4462 1.3275 -0.8204 0.3636 -0.6600 82 ASN E CB 2257 C CG . ASN B 83 A 1.9899 1.4354 1.4272 -0.7899 0.4808 -0.7117 82 ASN E CG 2258 O OD1 . ASN B 83 A 1.9061 1.3891 1.4878 -0.7190 0.5073 -0.7079 82 ASN E OD1 2259 N ND2 . ASN B 83 A 2.1387 1.4833 1.4592 -0.8466 0.5527 -0.7582 82 ASN E ND2 2260 N N . SER B 84 B 1.7214 1.4310 1.2093 -0.8106 0.1353 -0.5347 82 SER E N 2261 C CA . SER B 84 B 1.7480 1.4630 1.2035 -0.8600 0.0564 -0.4992 82 SER E CA 2262 C C . SER B 84 B 1.5864 1.4312 1.1832 -0.8082 -0.0119 -0.4453 82 SER E C 2263 O O . SER B 84 B 1.5729 1.4583 1.1666 -0.8360 -0.0770 -0.4081 82 SER E O 2264 C CB . SER B 84 B 1.9028 1.5409 1.1923 -0.9646 0.0160 -0.4946 82 SER E CB 2265 O OG . SER B 84 B 2.0594 1.5729 1.2085 -1.0127 0.0963 -0.5515 82 SER E OG 2266 N N . LEU B 85 C 1.4759 1.3797 1.1967 -0.7367 0.0045 -0.4398 82 LEU E N 2267 C CA . LEU B 85 C 1.3348 1.3496 1.1822 -0.6882 -0.0411 -0.3971 82 LEU E CA 2268 C C . LEU B 85 C 1.3304 1.3758 1.2076 -0.7221 -0.1099 -0.3570 82 LEU E C 2269 O O . LEU B 85 C 1.3910 1.3897 1.2307 -0.7557 -0.1151 -0.3621 82 LEU E O 2270 C CB . LEU B 85 C 1.2294 1.2884 1.1838 -0.6111 -0.0027 -0.4018 82 LEU E CB 2271 C CG . LEU B 85 C 1.1842 1.2625 1.1683 -0.5654 0.0388 -0.4166 82 LEU E CG 2272 C CD1 . LEU B 85 C 1.2832 1.2752 1.2033 -0.5771 0.1058 -0.4617 82 LEU E CD1 2273 C CD2 . LEU B 85 C 1.0706 1.2113 1.1669 -0.4993 0.0460 -0.4005 82 LEU E CD2 2274 N N . GLN B 86 ? 1.2609 1.3843 1.2152 -0.7131 -0.1603 -0.3162 83 GLN E N 2275 C CA . GLN B 86 ? 1.2490 1.4146 1.2687 -0.7418 -0.2268 -0.2704 83 GLN E CA 2276 C C . GLN B 86 ? 1.1124 1.3755 1.2829 -0.6822 -0.2314 -0.2427 83 GLN E C 2277 O O . GLN B 86 ? 1.0473 1.3384 1.2427 -0.6338 -0.1974 -0.2550 83 GLN E O 2278 C CB . GLN B 86 ? 1.3380 1.4837 1.2938 -0.8148 -0.2938 -0.2400 83 GLN E CB 2279 C CG . GLN B 86 ? 1.5035 1.5348 1.2767 -0.8899 -0.2862 -0.2698 83 GLN E CG 2280 C CD . GLN B 86 ? 1.5913 1.5591 1.3068 -0.9334 -0.2873 -0.2806 83 GLN E CD 2281 O OE1 . GLN B 86 ? 1.5370 1.5528 1.3516 -0.9211 -0.3155 -0.2535 83 GLN E OE1 2282 N NE2 . GLN B 86 ? 1.7372 1.5902 1.2889 -0.9888 -0.2513 -0.3222 83 GLN E NE2 2283 N N . ALA B 87 ? 1.0850 1.3957 1.3559 -0.6919 -0.2725 -0.2044 84 ALA E N 2284 C CA . ALA B 87 ? 0.9764 1.3652 1.3930 -0.6401 -0.2601 -0.1846 84 ALA E CA 2285 C C . ALA B 87 ? 0.9193 1.3457 1.3632 -0.6001 -0.2421 -0.1855 84 ALA E C 2286 O O . ALA B 87 ? 0.8448 1.2932 1.3275 -0.5493 -0.1956 -0.2009 84 ALA E O 2287 C CB . ALA B 87 ? 0.9688 1.4047 1.5033 -0.6682 -0.3143 -0.1353 84 ALA E CB 2288 N N . ASN B 88 ? 0.9679 1.3940 1.3794 -0.6293 -0.2816 -0.1680 85 ASN E N 2289 C CA . ASN B 88 ? 0.9244 1.3849 1.3602 -0.5969 -0.2700 -0.1657 85 ASN E CA 2290 C C . ASN B 88 ? 0.8871 1.3145 1.2297 -0.5690 -0.2177 -0.2092 85 ASN E C 2291 O O . ASN B 88 ? 0.8445 1.2927 1.1887 -0.5503 -0.2113 -0.2087 85 ASN E O 2292 C CB . ASN B 88 ? 1.0124 1.4837 1.4529 -0.6407 -0.3360 -0.1259 85 ASN E CB 2293 C CG . ASN B 88 ? 1.2073 1.6031 1.4921 -0.7086 -0.3673 -0.1343 85 ASN E CG 2294 O OD1 . ASN B 88 ? 1.2537 1.5862 1.4273 -0.7188 -0.3286 -0.1764 85 ASN E OD1 2295 N ND2 . ASN B 88 ? 1.3787 1.7739 1.6549 -0.7606 -0.4372 -0.0923 85 ASN E ND2 2296 N N . ASP B 89 ? 0.8956 1.2714 1.1680 -0.5676 -0.1813 -0.2440 86 ASP E N 2297 C CA . ASP B 89 ? 0.8624 1.2177 1.0943 -0.5306 -0.1266 -0.2794 86 ASP E CA 2298 C C . ASP B 89 ? 0.7710 1.1568 1.0760 -0.4778 -0.0931 -0.2824 86 ASP E C 2299 O O . ASP B 89 ? 0.7540 1.1291 1.0463 -0.4464 -0.0563 -0.3021 86 ASP E O 2300 C CB . ASP B 89 ? 0.9576 1.2323 1.0839 -0.5590 -0.0993 -0.3147 86 ASP E CB 2301 C CG . ASP B 89 ? 1.0571 1.2829 1.0780 -0.6198 -0.1219 -0.3182 86 ASP E CG 2302 O OD1 . ASP B 89 ? 1.0364 1.2869 1.0541 -0.6201 -0.1360 -0.3073 86 ASP E OD1 2303 O OD2 . ASP B 89 ? 1.1615 1.3175 1.0932 -0.6735 -0.1269 -0.3310 86 ASP E OD2 2304 N N . THR B 90 ? 0.7180 1.1376 1.1005 -0.4732 -0.1062 -0.2605 87 THR E N 2305 C CA . THR B 90 ? 0.6506 1.0902 1.0872 -0.4354 -0.0754 -0.2610 87 THR E CA 2306 C C . THR B 90 ? 0.5897 1.0627 1.0483 -0.4061 -0.0620 -0.2572 87 THR E C 2307 O O . THR B 90 ? 0.5670 1.0739 1.0623 -0.4111 -0.0810 -0.2395 87 THR E O 2308 C CB . THR B 90 ? 0.6300 1.0948 1.1474 -0.4437 -0.0836 -0.2404 87 THR E CB 2309 O OG1 . THR B 90 ? 0.6784 1.1093 1.1724 -0.4696 -0.0934 -0.2449 87 THR E OG1 2310 C CG2 . THR B 90 ? 0.5861 1.0616 1.1429 -0.4148 -0.0462 -0.2419 87 THR E CG2 2311 N N . ALA B 91 ? 0.5667 1.0277 1.0059 -0.3785 -0.0332 -0.2701 88 ALA E N 2312 C CA . ALA B 91 ? 0.5204 1.0055 0.9667 -0.3554 -0.0218 -0.2670 88 ALA E CA 2313 C C . ALA B 91 ? 0.5129 0.9783 0.9431 -0.3336 -0.0007 -0.2732 88 ALA E C 2314 O O . ALA B 91 ? 0.5419 0.9738 0.9580 -0.3335 0.0056 -0.2812 88 ALA E O 2315 C CB . ALA B 91 ? 0.5313 1.0217 0.9437 -0.3612 -0.0329 -0.2725 88 ALA E CB 2316 N N . ILE B 92 ? 0.4776 0.9613 0.9128 -0.3186 0.0061 -0.2659 89 ILE E N 2317 C CA . ILE B 92 ? 0.4771 0.9469 0.9011 -0.3027 0.0133 -0.2633 89 ILE E CA 2318 C C . ILE B 92 ? 0.4747 0.9514 0.8911 -0.2918 0.0157 -0.2734 89 ILE E C 2319 O O . ILE B 92 ? 0.4532 0.9548 0.8634 -0.2931 0.0121 -0.2745 89 ILE E O 2320 C CB . ILE B 92 ? 0.4604 0.9379 0.8818 -0.3019 0.0173 -0.2480 89 ILE E CB 2321 C CG1 . ILE B 92 ? 0.4741 0.9352 0.8978 -0.3191 0.0290 -0.2435 89 ILE E CG1 2322 C CG2 . ILE B 92 ? 0.4736 0.9355 0.8869 -0.2932 0.0106 -0.2357 89 ILE E CG2 2323 C CD1 . ILE B 92 ? 0.4773 0.9331 0.8850 -0.3296 0.0456 -0.2355 89 ILE E CD1 2324 N N . TYR B 93 ? 0.4999 0.9511 0.9236 -0.2820 0.0256 -0.2803 90 TYR E N 2325 C CA . TYR B 93 ? 0.5127 0.9613 0.9405 -0.2729 0.0421 -0.2946 90 TYR E CA 2326 C C . TYR B 93 ? 0.4960 0.9575 0.9678 -0.2516 0.0420 -0.2771 90 TYR E C 2327 O O . TYR B 93 ? 0.5020 0.9503 1.0038 -0.2449 0.0322 -0.2581 90 TYR E O 2328 C CB . TYR B 93 ? 0.5682 0.9711 0.9870 -0.2800 0.0646 -0.3181 90 TYR E CB 2329 C CG . TYR B 93 ? 0.6000 0.9860 0.9624 -0.3116 0.0589 -0.3338 90 TYR E CG 2330 C CD1 . TYR B 93 ? 0.5948 0.9821 0.9522 -0.3261 0.0374 -0.3237 90 TYR E CD1 2331 C CD2 . TYR B 93 ? 0.6449 1.0101 0.9576 -0.3332 0.0728 -0.3555 90 TYR E CD2 2332 C CE1 . TYR B 93 ? 0.6294 1.0046 0.9474 -0.3596 0.0218 -0.3293 90 TYR E CE1 2333 C CE2 . TYR B 93 ? 0.6897 1.0336 0.9421 -0.3729 0.0554 -0.3619 90 TYR E CE2 2334 C CZ . TYR B 93 ? 0.6790 1.0314 0.9408 -0.3850 0.0260 -0.3459 90 TYR E CZ 2335 O OH . TYR B 93 ? 0.7289 1.0625 0.9422 -0.4287 -0.0003 -0.3444 90 TYR E OH 2336 N N . TYR B 94 ? 0.4818 0.9677 0.9585 -0.2454 0.0483 -0.2797 91 TYR E N 2337 C CA . TYR B 94 ? 0.4687 0.9730 0.9956 -0.2289 0.0432 -0.2589 91 TYR E CA 2338 C C . TYR B 94 ? 0.4907 0.9936 1.0571 -0.2175 0.0755 -0.2763 91 TYR E C 2339 O O . TYR B 94 ? 0.5052 1.0045 1.0287 -0.2288 0.0960 -0.3026 91 TYR E O 2340 C CB . TYR B 94 ? 0.4315 0.9687 0.9332 -0.2342 0.0242 -0.2432 91 TYR E CB 2341 C CG . TYR B 94 ? 0.4220 0.9555 0.8863 -0.2491 0.0058 -0.2287 91 TYR E CG 2342 C CD1 . TYR B 94 ? 0.4387 0.9556 0.9049 -0.2566 -0.0135 -0.2015 91 TYR E CD1 2343 C CD2 . TYR B 94 ? 0.4065 0.9485 0.8366 -0.2603 0.0092 -0.2396 91 TYR E CD2 2344 C CE1 . TYR B 94 ? 0.4494 0.9493 0.8682 -0.2781 -0.0182 -0.1934 91 TYR E CE1 2345 C CE2 . TYR B 94 ? 0.4059 0.9398 0.8156 -0.2743 0.0067 -0.2298 91 TYR E CE2 2346 C CZ . TYR B 94 ? 0.4311 0.9398 0.8270 -0.2847 -0.0017 -0.2106 91 TYR E CZ 2347 O OH . TYR B 94 ? 0.4486 0.9352 0.8106 -0.3063 0.0073 -0.2062 91 TYR E OH 2348 N N . CYS B 95 ? 0.5044 1.0070 1.1567 -0.1991 0.0803 -0.2593 92 CYS E N 2349 C CA . CYS B 95 ? 0.5148 1.0305 1.2300 -0.1860 0.1107 -0.2666 92 CYS E CA 2350 C C . CYS B 95 ? 0.4718 1.0331 1.2014 -0.1843 0.0760 -0.2341 92 CYS E C 2351 O O . CYS B 95 ? 0.4570 1.0256 1.1776 -0.1906 0.0326 -0.2003 92 CYS E O 2352 C CB . CYS B 95 ? 0.5526 1.0473 1.3834 -0.1657 0.1370 -0.2609 92 CYS E CB 2353 S SG . CYS B 95 ? 0.5466 1.0556 1.4764 -0.1533 0.0805 -0.1978 92 CYS E SG 2354 N N . ALA B 96 ? 0.4629 1.0468 1.2038 -0.1821 0.0968 -0.2451 93 ALA E N 2355 C CA . ALA B 96 ? 0.4277 1.0516 1.1667 -0.1853 0.0654 -0.2181 93 ALA E CA 2356 C C . ALA B 96 ? 0.4247 1.0724 1.2177 -0.1777 0.0945 -0.2260 93 ALA E C 2357 O O . ALA B 96 ? 0.4515 1.0803 1.2341 -0.1791 0.1450 -0.2644 93 ALA E O 2358 C CB . ALA B 96 ? 0.4066 1.0353 1.0362 -0.2037 0.0468 -0.2255 93 ALA E CB 2359 N N . ARG B 97 ? 0.4022 1.0853 1.2453 -0.1760 0.0624 -0.1887 94 ARG E N 2360 C CA . ARG B 97 ? 0.3908 1.1047 1.2670 -0.1743 0.0800 -0.1915 94 ARG E CA 2361 C C . ARG B 97 ? 0.3643 1.0851 1.1198 -0.1925 0.0703 -0.2063 94 ARG E C 2362 O O . ARG B 97 ? 0.3480 1.0688 1.0389 -0.2049 0.0315 -0.1883 94 ARG E O 2363 C CB . ARG B 97 ? 0.3871 1.1361 1.3677 -0.1707 0.0399 -0.1387 94 ARG E CB 2364 C CG . ARG B 97 ? 0.4138 1.1635 1.5563 -0.1490 0.0544 -0.1195 94 ARG E CG 2365 C CD . ARG B 97 ? 0.4180 1.2053 1.7027 -0.1364 0.0767 -0.1052 94 ARG E CD 2366 N NE . ARG B 97 ? 0.4106 1.2170 1.6337 -0.1460 0.1031 -0.1323 94 ARG E NE 2367 C CZ . ARG B 97 ? 0.4335 1.2188 1.5973 -0.1483 0.1693 -0.1885 94 ARG E CZ 2368 N NH1 . ARG B 97 ? 0.4748 1.2133 1.6231 -0.1442 0.2243 -0.2307 94 ARG E NH1 2369 N NH2 . ARG B 97 ? 0.4241 1.2287 1.5319 -0.1615 0.1782 -0.2013 94 ARG E NH2 2370 N N . MET B 98 ? 0.3686 1.0879 1.0940 -0.1972 0.1099 -0.2397 95 MET E N 2371 C CA . MET B 98 ? 0.3511 1.0773 0.9786 -0.2142 0.1006 -0.2500 95 MET E CA 2372 C C . MET B 98 ? 0.3558 1.0983 1.0055 -0.2173 0.1323 -0.2628 95 MET E C 2373 O O . MET B 98 ? 0.3705 1.1182 1.1170 -0.2056 0.1665 -0.2657 95 MET E O 2374 C CB . MET B 98 ? 0.3729 1.0647 0.9081 -0.2286 0.1097 -0.2792 95 MET E CB 2375 C CG . MET B 98 ? 0.3711 1.0441 0.8977 -0.2256 0.0893 -0.2718 95 MET E CG 2376 S SD . MET B 98 ? 0.3929 1.0360 0.8236 -0.2475 0.0856 -0.2943 95 MET E SD 2377 C CE . MET B 98 ? 0.3516 1.0232 0.7425 -0.2543 0.0517 -0.2737 95 MET E CE 2378 N N . ARG B 99 ? 0.3451 1.0932 0.9138 -0.2334 0.1245 -0.2699 96 ARG E N 2379 C CA . ARG B 99 ? 0.3539 1.1166 0.9300 -0.2410 0.1508 -0.2801 96 ARG E CA 2380 C C . ARG B 99 ? 0.3241 1.1296 1.0082 -0.2272 0.1366 -0.2459 96 ARG E C 2381 O O . ARG B 99 ? 0.3383 1.1545 1.1208 -0.2182 0.1738 -0.2501 96 ARG E O 2382 C CB . ARG B 99 ? 0.4150 1.1411 0.9884 -0.2513 0.2153 -0.3219 96 ARG E CB 2383 C CG . ARG B 99 ? 0.4631 1.1368 0.9256 -0.2755 0.2238 -0.3515 96 ARG E CG 2384 C CD . ARG B 99 ? 0.5418 1.1712 0.9357 -0.3087 0.2761 -0.3904 96 ARG E CD 2385 N NE . ARG B 99 ? 0.5682 1.1991 1.0560 -0.2998 0.3391 -0.4062 96 ARG E NE 2386 C CZ . ARG B 99 ? 0.6315 1.2341 1.0849 -0.3263 0.3938 -0.4366 96 ARG E CZ 2387 N NH1 . ARG B 99 ? 0.6834 1.2488 0.9950 -0.3684 0.3872 -0.4528 96 ARG E NH1 2388 N NH2 . ARG B 99 ? 0.6514 1.2603 1.2198 -0.3134 0.4562 -0.4485 96 ARG E NH2 2389 N N . ILE B 100 ? 0.2902 1.1147 0.9566 -0.2304 0.0839 -0.2109 97 ILE E N 2390 C CA . ILE B 100 ? 0.2750 1.1307 1.0304 -0.2272 0.0496 -0.1663 97 ILE E CA 2391 C C . ILE B 100 ? 0.2655 1.1534 1.0342 -0.2377 0.0455 -0.1541 97 ILE E C 2392 O O . ILE B 100 ? 0.2611 1.1438 0.9367 -0.2511 0.0481 -0.1698 97 ILE E O 2393 C CB . ILE B 100 ? 0.2706 1.1133 0.9752 -0.2391 -0.0046 -0.1346 97 ILE E CB 2394 C CG1 . ILE B 100 ? 0.2783 1.0876 0.9609 -0.2311 -0.0005 -0.1478 97 ILE E CG1 2395 C CG2 . ILE B 100 ? 0.2777 1.1423 1.0623 -0.2481 -0.0504 -0.0818 97 ILE E CG2 2396 C CD1 . ILE B 100 ? 0.2912 1.0985 1.0820 -0.2108 0.0208 -0.1487 97 ILE E CD1 2397 N N . THR B 101 ? 0.2642 1.1856 1.1601 -0.2323 0.0355 -0.1214 98 THR E N 2398 C CA . THR B 101 ? 0.2595 1.2173 1.2010 -0.2414 0.0351 -0.1066 98 THR E CA 2399 C C . THR B 101 ? 0.2592 1.2445 1.2572 -0.2576 -0.0316 -0.0447 98 THR E C 2400 O O . THR B 101 ? 0.2575 1.2747 1.2939 -0.2698 -0.0419 -0.0253 98 THR E O 2401 C CB . THR B 101 ? 0.2708 1.2480 1.3501 -0.2239 0.0958 -0.1232 98 THR E CB 2402 O OG1 . THR B 101 ? 0.2747 1.2624 1.5028 -0.2051 0.0892 -0.0947 98 THR E OG1 2403 C CG2 . THR B 101 ? 0.2968 1.2345 1.3030 -0.2221 0.1653 -0.1850 98 THR E CG2 2404 N N . THR B 102 ? 0.2705 1.2400 1.2744 -0.2633 -0.0789 -0.0111 99 THR E N 2405 C CA . THR B 102 ? 0.2928 1.2740 1.3278 -0.2924 -0.1525 0.0533 99 THR E CA 2406 C C . THR B 102 ? 0.3236 1.2554 1.2329 -0.3199 -0.1979 0.0691 99 THR E C 2407 O O . THR B 102 ? 0.3193 1.2184 1.1643 -0.3075 -0.1740 0.0368 99 THR E O 2408 C CB . THR B 102 ? 0.3003 1.3157 1.5341 -0.2807 -0.1764 0.1028 99 THR E CB 2409 O OG1 . THR B 102 ? 0.3135 1.3004 1.5668 -0.2697 -0.1873 0.1098 99 THR E OG1 2410 C CG2 . THR B 102 ? 0.2787 1.3333 1.6625 -0.2478 -0.1091 0.0783 99 THR E CG2 2411 N N . ASP B 103 ? 0.3667 1.2889 1.2437 -0.3630 -0.2633 0.1208 100 ASP E N 2412 C CA . ASP B 103 ? 0.4212 1.2833 1.1632 -0.4035 -0.3033 0.1375 100 ASP E CA 2413 C C . ASP B 103 ? 0.4462 1.2847 1.2284 -0.4010 -0.3284 0.1602 100 ASP E C 2414 O O . ASP B 103 ? 0.4970 1.2772 1.1561 -0.4339 -0.3478 0.1637 100 ASP E O 2415 C CB . ASP B 103 ? 0.4857 1.3323 1.1777 -0.4633 -0.3710 0.1928 100 ASP E CB 2416 C CG . ASP B 103 ? 0.4844 1.3293 1.0812 -0.4807 -0.3512 0.1701 100 ASP E CG 2417 O OD1 . ASP B 103 ? 0.4312 1.2909 1.0078 -0.4459 -0.2893 0.1156 100 ASP E OD1 2418 O OD2 . ASP B 103 ? 0.5475 1.3707 1.0853 -0.5354 -0.4030 0.2115 100 ASP E OD2 2419 N N . TRP B 104 A 0.4213 1.2968 1.3705 -0.3648 -0.3223 0.1731 100 TRP E N 2420 C CA . TRP B 104 A 0.4592 1.3119 1.4615 -0.3723 -0.3660 0.2140 100 TRP E CA 2421 C C . TRP B 104 A 0.4316 1.2769 1.4844 -0.3278 -0.3171 0.1766 100 TRP E C 2422 O O . TRP B 104 A 0.4604 1.2590 1.4358 -0.3407 -0.3306 0.1762 100 TRP E O 2423 C CB . TRP B 104 A 0.4850 1.3743 1.6537 -0.3868 -0.4332 0.2919 100 TRP E CB 2424 C CG . TRP B 104 A 0.5522 1.4195 1.6259 -0.4549 -0.5096 0.3452 100 TRP E CG 2425 C CD1 . TRP B 104 A 0.6418 1.4443 1.5948 -0.5178 -0.5786 0.3890 100 TRP E CD1 2426 C CD2 . TRP B 104 A 0.5496 1.4480 1.6210 -0.4746 -0.5205 0.3568 100 TRP E CD2 2427 N NE1 . TRP B 104 A 0.7031 1.4892 1.5726 -0.5793 -0.6322 0.4272 100 TRP E NE1 2428 C CE2 . TRP B 104 A 0.6430 1.4909 1.5880 -0.5517 -0.5993 0.4090 100 TRP E CE2 2429 C CE3 . TRP B 104 A 0.4877 1.4455 1.6437 -0.4399 -0.4700 0.3276 100 TRP E CE3 2430 C CZ2 . TRP B 104 A 0.6735 1.5307 1.5780 -0.5934 -0.6314 0.4339 100 TRP E CZ2 2431 C CZ3 . TRP B 104 A 0.5098 1.4825 1.6329 -0.4773 -0.5016 0.3526 100 TRP E CZ3 2432 C CH2 . TRP B 104 A 0.6001 1.5241 1.6009 -0.5524 -0.5830 0.4059 100 TRP E CH2 2433 N N . PHE B 105 B 0.3881 1.2716 1.5625 -0.2810 -0.2572 0.1443 100 PHE E N 2434 C CA . PHE B 105 B 0.3823 1.2562 1.6433 -0.2447 -0.2195 0.1242 100 PHE E CA 2435 C C . PHE B 105 B 0.3653 1.2077 1.5086 -0.2274 -0.1569 0.0532 100 PHE E C 2436 O O . PHE B 105 B 0.3514 1.1977 1.5527 -0.1959 -0.0926 0.0110 100 PHE E O 2437 C CB . PHE B 105 B 0.3658 1.2834 1.8379 -0.2089 -0.1814 0.1297 100 PHE E CB 2438 C CG . PHE B 105 B 0.3888 1.3386 2.0291 -0.2206 -0.2500 0.2116 100 PHE E CG 2439 C CD1 . PHE B 105 B 0.4270 1.3551 2.1246 -0.2317 -0.3116 0.2668 100 PHE E CD1 2440 C CD2 . PHE B 105 B 0.3775 1.3789 2.1271 -0.2235 -0.2574 0.2385 100 PHE E CD2 2441 C CE1 . PHE B 105 B 0.4565 1.4136 2.3203 -0.2476 -0.3867 0.3527 100 PHE E CE1 2442 C CE2 . PHE B 105 B 0.4025 1.4374 2.3248 -0.2375 -0.3291 0.3224 100 PHE E CE2 2443 C CZ . PHE B 105 B 0.4437 1.4563 2.4253 -0.2505 -0.3975 0.3823 100 PHE E CZ 2444 N N . ALA B 106 ? 0.3785 1.1847 1.3594 -0.2526 -0.1737 0.0412 101 ALA E N 2445 C CA . ALA B 106 ? 0.3636 1.1435 1.2473 -0.2399 -0.1249 -0.0165 101 ALA E CA 2446 C C . ALA B 106 ? 0.3896 1.1250 1.2112 -0.2486 -0.1385 -0.0167 101 ALA E C 2447 O O . ALA B 106 ? 0.3977 1.1038 1.0955 -0.2700 -0.1426 -0.0294 101 ALA E O 2448 C CB . ALA B 106 ? 0.3470 1.1272 1.1110 -0.2533 -0.1098 -0.0450 101 ALA E CB 2449 N N . TYR B 107 ? 0.4022 1.1304 1.3175 -0.2291 -0.1335 -0.0094 102 TYR E N 2450 C CA . TYR B 107 ? 0.4332 1.1200 1.3106 -0.2399 -0.1551 0.0015 102 TYR E CA 2451 C C . TYR B 107 ? 0.4180 1.0842 1.2415 -0.2227 -0.1036 -0.0536 102 TYR E C 2452 O O . TYR B 107 ? 0.4044 1.0806 1.2790 -0.1971 -0.0551 -0.0880 102 TYR E O 2453 C CB . TYR B 107 ? 0.4580 1.1457 1.4783 -0.2284 -0.1811 0.0442 102 TYR E CB 2454 C CG . TYR B 107 ? 0.4846 1.1913 1.5852 -0.2498 -0.2472 0.1136 102 TYR E CG 2455 C CD1 . TYR B 107 ? 0.4627 1.2180 1.6565 -0.2402 -0.2437 0.1262 102 TYR E CD1 2456 C CD2 . TYR B 107 ? 0.5421 1.2153 1.6311 -0.2842 -0.3169 0.1708 102 TYR E CD2 2457 C CE1 . TYR B 107 ? 0.4912 1.2667 1.7713 -0.2639 -0.3126 0.1971 102 TYR E CE1 2458 C CE2 . TYR B 107 ? 0.5809 1.2672 1.7434 -0.3130 -0.3903 0.2439 102 TYR E CE2 2459 C CZ . TYR B 107 ? 0.5525 1.2931 1.8163 -0.3018 -0.3897 0.2582 102 TYR E CZ 2460 O OH . TYR B 107 ? 0.5958 1.3531 1.9441 -0.3339 -0.4696 0.3369 102 TYR E OH 2461 N N . TRP B 108 ? 0.4320 1.0642 1.1510 -0.2421 -0.1123 -0.0616 103 TRP E N 2462 C CA . TRP B 108 ? 0.4259 1.0364 1.1091 -0.2310 -0.0771 -0.1016 103 TRP E CA 2463 C C . TRP B 108 ? 0.4586 1.0367 1.1760 -0.2321 -0.0951 -0.0814 103 TRP E C 2464 O O . TRP B 108 ? 0.4913 1.0532 1.2131 -0.2536 -0.1419 -0.0364 103 TRP E O 2465 C CB . TRP B 108 ? 0.4193 1.0160 0.9876 -0.2502 -0.0700 -0.1226 103 TRP E CB 2466 C CG . TRP B 108 ? 0.3873 1.0103 0.9255 -0.2450 -0.0460 -0.1494 103 TRP E CG 2467 C CD1 . TRP B 108 ? 0.3734 1.0253 0.9273 -0.2443 -0.0497 -0.1413 103 TRP E CD1 2468 C CD2 . TRP B 108 ? 0.3703 0.9917 0.8608 -0.2435 -0.0204 -0.1835 103 TRP E CD2 2469 N NE1 . TRP B 108 ? 0.3502 1.0153 0.8623 -0.2419 -0.0257 -0.1703 103 TRP E NE1 2470 C CE2 . TRP B 108 ? 0.3495 0.9964 0.8251 -0.2424 -0.0110 -0.1937 103 TRP E CE2 2471 C CE3 . TRP B 108 ? 0.3755 0.9767 0.8398 -0.2460 -0.0093 -0.2019 103 TRP E CE3 2472 C CZ2 . TRP B 108 ? 0.3374 0.9878 0.7740 -0.2450 0.0039 -0.2176 103 TRP E CZ2 2473 C CZ3 . TRP B 108 ? 0.3611 0.9699 0.7944 -0.2487 0.0043 -0.2242 103 TRP E CZ3 2474 C CH2 . TRP B 108 ? 0.3444 0.9765 0.7643 -0.2488 0.0085 -0.2301 103 TRP E CH2 2475 N N . GLY B 109 ? 0.4596 1.0217 1.1926 -0.2148 -0.0608 -0.1130 104 GLY E N 2476 C CA . GLY B 109 ? 0.4923 1.0175 1.2357 -0.2181 -0.0729 -0.1014 104 GLY E CA 2477 C C . GLY B 109 ? 0.5086 1.0064 1.1431 -0.2489 -0.0923 -0.0974 104 GLY E C 2478 O O . GLY B 109 ? 0.4904 0.9970 1.0499 -0.2615 -0.0826 -0.1143 104 GLY E O 2479 N N . GLN B 110 ? 0.5498 1.0100 1.1808 -0.2630 -0.1163 -0.0742 105 GLN E N 2480 C CA . GLN B 110 ? 0.5808 1.0039 1.1073 -0.2978 -0.1255 -0.0727 105 GLN E CA 2481 C C . GLN B 110 ? 0.5537 0.9766 1.0334 -0.2927 -0.0840 -0.1185 105 GLN E C 2482 O O . GLN B 110 ? 0.5626 0.9714 0.9695 -0.3161 -0.0747 -0.1272 105 GLN E O 2483 C CB . GLN B 110 ? 0.6429 1.0187 1.1678 -0.3199 -0.1607 -0.0370 105 GLN E CB 2484 C CG . GLN B 110 ? 0.6502 1.0042 1.2043 -0.3036 -0.1412 -0.0556 105 GLN E CG 2485 C CD . GLN B 110 ? 0.6523 1.0140 1.3325 -0.2719 -0.1460 -0.0403 105 GLN E CD 2486 O OE1 . GLN B 110 ? 0.6175 1.0146 1.3665 -0.2422 -0.1198 -0.0577 105 GLN E OE1 2487 N NE2 . GLN B 110 ? 0.7021 1.0258 1.4179 -0.2801 -0.1759 -0.0070 105 GLN E NE2 2488 N N . GLY B 111 ? 0.5323 0.9651 1.0580 -0.2666 -0.0583 -0.1457 106 GLY E N 2489 C CA . GLY B 111 ? 0.5143 0.9488 1.0034 -0.2667 -0.0295 -0.1821 106 GLY E CA 2490 C C . GLY B 111 ? 0.5432 0.9426 1.0334 -0.2703 -0.0250 -0.1885 106 GLY E C 2491 O O . GLY B 111 ? 0.5778 0.9455 1.0603 -0.2844 -0.0450 -0.1645 106 GLY E O 2492 N N . THR B 112 ? 0.5378 0.9371 1.0298 -0.2634 -0.0015 -0.2193 107 THR E N 2493 C CA . THR B 112 ? 0.5692 0.9341 1.0570 -0.2695 0.0050 -0.2291 107 THR E CA 2494 C C . THR B 112 ? 0.5586 0.9324 1.0056 -0.2863 0.0130 -0.2482 107 THR E C 2495 O O . THR B 112 ? 0.5458 0.9379 0.9843 -0.2867 0.0219 -0.2670 107 THR E O 2496 C CB . THR B 112 ? 0.5942 0.9387 1.1233 -0.2534 0.0276 -0.2475 107 THR E CB 2497 O OG1 . THR B 112 ? 0.6008 0.9457 1.1998 -0.2341 0.0223 -0.2254 107 THR E OG1 2498 C CG2 . THR B 112 ? 0.6347 0.9358 1.1572 -0.2614 0.0345 -0.2565 107 THR E CG2 2499 N N . LEU B 113 ? 0.5705 0.9297 0.9963 -0.3041 0.0084 -0.2400 108 LEU E N 2500 C CA . LEU B 113 ? 0.5640 0.9329 0.9799 -0.3198 0.0160 -0.2526 108 LEU E CA 2501 C C . LEU B 113 ? 0.5933 0.9392 1.0097 -0.3251 0.0187 -0.2685 108 LEU E C 2502 O O . LEU B 113 ? 0.6257 0.9351 1.0410 -0.3273 0.0190 -0.2657 108 LEU E O 2503 C CB . LEU B 113 ? 0.5774 0.9324 0.9786 -0.3398 0.0220 -0.2418 108 LEU E CB 2504 C CG . LEU B 113 ? 0.5740 0.9395 0.9943 -0.3557 0.0335 -0.2507 108 LEU E CG 2505 C CD1 . LEU B 113 ? 0.5367 0.9470 0.9881 -0.3516 0.0310 -0.2555 108 LEU E CD1 2506 C CD2 . LEU B 113 ? 0.5970 0.9407 1.0058 -0.3774 0.0547 -0.2443 108 LEU E CD2 2507 N N . VAL B 114 ? 0.5914 0.9521 1.0023 -0.3328 0.0180 -0.2832 109 VAL E N 2508 C CA . VAL B 114 ? 0.6372 0.9671 1.0299 -0.3491 0.0191 -0.2988 109 VAL E CA 2509 C C . VAL B 114 ? 0.6339 0.9823 1.0337 -0.3747 0.0035 -0.2938 109 VAL E C 2510 O O . VAL B 114 ? 0.6078 0.9929 1.0231 -0.3803 -0.0086 -0.2864 109 VAL E O 2511 C CB . VAL B 114 ? 0.6695 0.9809 1.0352 -0.3500 0.0307 -0.3197 109 VAL E CB 2512 C CG1 . VAL B 114 ? 0.7375 0.9989 1.0640 -0.3769 0.0369 -0.3390 109 VAL E CG1 2513 C CG2 . VAL B 114 ? 0.6695 0.9699 1.0610 -0.3213 0.0498 -0.3205 109 VAL E CG2 2514 N N . THR B 115 ? 0.6629 0.9868 1.0632 -0.3903 0.0024 -0.2940 110 THR E N 2515 C CA . THR B 115 ? 0.6682 1.0078 1.0907 -0.4180 -0.0149 -0.2860 110 THR E CA 2516 C C . THR B 115 ? 0.7338 1.0327 1.1110 -0.4467 -0.0262 -0.2990 110 THR E C 2517 O O . THR B 115 ? 0.7741 1.0243 1.1188 -0.4453 -0.0102 -0.3138 110 THR E O 2518 C CB . THR B 115 ? 0.6578 0.9991 1.1172 -0.4213 -0.0041 -0.2755 110 THR E CB 2519 O OG1 . THR B 115 ? 0.6216 0.9801 1.0970 -0.4035 0.0136 -0.2679 110 THR E OG1 2520 C CG2 . THR B 115 ? 0.6551 1.0243 1.1695 -0.4472 -0.0197 -0.2623 110 THR E CG2 2521 N N . VAL B 116 ? 0.7543 1.0676 1.1279 -0.4775 -0.0555 -0.2909 111 VAL E N 2522 C CA . VAL B 116 ? 0.8381 1.1034 1.1484 -0.5192 -0.0712 -0.3011 111 VAL E CA 2523 C C . VAL B 116 ? 0.8464 1.1254 1.2009 -0.5482 -0.0986 -0.2804 111 VAL E C 2524 O O . VAL B 116 ? 0.8162 1.1451 1.2377 -0.5607 -0.1295 -0.2523 111 VAL E O 2525 C CB . VAL B 116 ? 0.8815 1.1397 1.1379 -0.5491 -0.0943 -0.3016 111 VAL E CB 2526 C CG1 . VAL B 116 ? 0.9023 1.1261 1.1022 -0.5293 -0.0558 -0.3311 111 VAL E CG1 2527 C CG2 . VAL B 116 ? 0.8227 1.1490 1.1481 -0.5443 -0.1250 -0.2709 111 VAL E CG2 2528 N N . SER B 117 ? 0.8382 0.5870 1.1506 -0.1063 0.4028 -0.1897 112 SER E N 2529 C CA . SER B 117 ? 0.8249 0.5585 1.0798 -0.0991 0.3532 -0.1795 112 SER E CA 2530 C C . SER B 117 ? 0.8279 0.5599 1.1195 -0.0879 0.3408 -0.2002 112 SER E C 2531 O O . SER B 117 ? 0.8176 0.5700 1.1992 -0.0801 0.3550 -0.2143 112 SER E O 2532 C CB . SER B 117 ? 0.7553 0.5169 1.0365 -0.1019 0.3050 -0.1516 112 SER E CB 2533 O OG . SER B 117 ? 0.7298 0.4906 0.9968 -0.0965 0.2601 -0.1466 112 SER E OG 2534 N N . ALA B 118 ? 0.8482 0.5552 1.0714 -0.0866 0.3149 -0.2043 113 ALA E N 2535 C CA . ALA B 118 ? 0.8598 0.5537 1.1071 -0.0806 0.3018 -0.2249 113 ALA E CA 2536 C C . ALA B 118 ? 0.8037 0.5127 1.0903 -0.0819 0.2517 -0.2058 113 ALA E C 2537 O O . ALA B 118 ? 0.8152 0.5063 1.1224 -0.0798 0.2391 -0.2180 113 ALA E O 2538 C CB . ALA B 118 ? 0.9313 0.5876 1.0819 -0.0828 0.3093 -0.2497 113 ALA E CB 2539 N N . ALA B 119 ? 0.7512 0.4872 1.0465 -0.0863 0.2277 -0.1764 114 ALA E N 2540 C CA . ALA B 119 ? 0.7088 0.4561 1.0233 -0.0897 0.1845 -0.1562 114 ALA E CA 2541 C C . ALA B 119 ? 0.6942 0.4441 1.0927 -0.0790 0.1746 -0.1519 114 ALA E C 2542 O O . ALA B 119 ? 0.6905 0.4556 1.1497 -0.0674 0.1927 -0.1566 114 ALA E O 2543 C CB . ALA B 119 ? 0.6660 0.4390 0.9663 -0.0948 0.1667 -0.1286 114 ALA E CB 2544 N N . LYS B 120 ? 0.6949 0.4290 1.0961 -0.0823 0.1468 -0.1434 115 LYS E N 2545 C CA . LYS B 120 ? 0.6952 0.4202 1.1594 -0.0690 0.1318 -0.1312 115 LYS E CA 2546 C C . LYS B 120 ? 0.6502 0.4016 1.1255 -0.0699 0.1007 -0.0978 115 LYS E C 2547 O O . LYS B 120 ? 0.6227 0.3951 1.0574 -0.0829 0.0928 -0.0874 115 LYS E O 2548 C CB . LYS B 120 ? 0.7403 0.4178 1.1923 -0.0745 0.1259 -0.1404 115 LYS E CB 2549 C CG . LYS B 120 ? 0.7964 0.4419 1.2227 -0.0789 0.1523 -0.1782 115 LYS E CG 2550 C CD . LYS B 120 ? 0.8158 0.4700 1.2632 -0.0632 0.1875 -0.2001 115 LYS E CD 2551 C CE . LYS B 120 ? 0.8751 0.5007 1.2682 -0.0714 0.2137 -0.2382 115 LYS E CE 2552 N NZ . LYS B 120 ? 0.9010 0.5327 1.3082 -0.0580 0.2555 -0.2591 115 LYS E NZ 2553 N N . THR B 121 ? 0.6513 0.3995 1.1773 -0.0528 0.0825 -0.0818 116 THR E N 2554 C CA . THR B 121 ? 0.6247 0.3882 1.1487 -0.0530 0.0502 -0.0506 116 THR E CA 2555 C C . THR B 121 ? 0.6267 0.3684 1.0922 -0.0744 0.0386 -0.0385 116 THR E C 2556 O O . THR B 121 ? 0.6648 0.3651 1.1175 -0.0810 0.0429 -0.0443 116 THR E O 2557 C CB . THR B 121 ? 0.6483 0.4001 1.2221 -0.0266 0.0284 -0.0346 116 THR E CB 2558 O OG1 . THR B 121 ? 0.6451 0.4297 1.2891 -0.0050 0.0379 -0.0509 116 THR E OG1 2559 C CG2 . THR B 121 ? 0.6318 0.3980 1.1898 -0.0265 -0.0054 -0.0036 116 THR E CG2 2560 N N . THR B 122 ? 0.5905 0.3609 1.0251 -0.0864 0.0267 -0.0245 117 THR E N 2561 C CA . THR B 122 ? 0.5886 0.3529 0.9763 -0.1067 0.0191 -0.0174 117 THR E CA 2562 C C . THR B 122 ? 0.5628 0.3477 0.9369 -0.1083 -0.0016 0.0089 117 THR E C 2563 O O . THR B 122 ? 0.5309 0.3470 0.9092 -0.1034 -0.0047 0.0114 117 THR E O 2564 C CB . THR B 122 ? 0.5794 0.3610 0.9290 -0.1193 0.0322 -0.0387 117 THR E CB 2565 O OG1 . THR B 122 ? 0.6092 0.3743 0.9654 -0.1145 0.0537 -0.0655 117 THR E OG1 2566 C CG2 . THR B 122 ? 0.5850 0.3660 0.9031 -0.1396 0.0244 -0.0408 117 THR E CG2 2567 N N . PRO B 123 ? 0.5849 0.3475 0.9402 -0.1170 -0.0124 0.0272 118 PRO E N 2568 C CA . PRO B 123 ? 0.5693 0.3492 0.9011 -0.1198 -0.0286 0.0497 118 PRO E CA 2569 C C . PRO B 123 ? 0.5375 0.3508 0.8383 -0.1349 -0.0236 0.0416 118 PRO E C 2570 O O . PRO B 123 ? 0.5386 0.3567 0.8311 -0.1454 -0.0121 0.0219 118 PRO E O 2571 C CB . PRO B 123 ? 0.6158 0.3523 0.9295 -0.1261 -0.0332 0.0705 118 PRO E CB 2572 C CG . PRO B 123 ? 0.6469 0.3506 0.9685 -0.1384 -0.0151 0.0531 118 PRO E CG 2573 C CD . PRO B 123 ? 0.6328 0.3474 0.9850 -0.1262 -0.0059 0.0275 118 PRO E CD 2574 N N . PRO B 124 ? 0.5158 0.3517 0.7987 -0.1335 -0.0341 0.0545 119 PRO E N 2575 C CA . PRO B 124 ? 0.4895 0.3542 0.7435 -0.1414 -0.0307 0.0489 119 PRO E CA 2576 C C . PRO B 124 ? 0.4980 0.3645 0.7330 -0.1577 -0.0287 0.0535 119 PRO E C 2577 O O . PRO B 124 ? 0.5275 0.3684 0.7584 -0.1638 -0.0307 0.0700 119 PRO E O 2578 C CB . PRO B 124 ? 0.4767 0.3552 0.7227 -0.1335 -0.0416 0.0606 119 PRO E CB 2579 C CG . PRO B 124 ? 0.5021 0.3606 0.7585 -0.1273 -0.0571 0.0784 119 PRO E CG 2580 C CD . PRO B 124 ? 0.5234 0.3569 0.8109 -0.1217 -0.0526 0.0738 119 PRO E CD 2581 N N . SER B 125 ? 0.4810 0.3773 0.7046 -0.1636 -0.0239 0.0385 120 SER E N 2582 C CA . SER B 125 ? 0.4809 0.3975 0.6938 -0.1773 -0.0211 0.0403 120 SER E CA 2583 C C . SER B 125 ? 0.4619 0.3960 0.6515 -0.1668 -0.0264 0.0513 120 SER E C 2584 O O . SER B 125 ? 0.4434 0.3850 0.6243 -0.1518 -0.0301 0.0472 120 SER E O 2585 C CB . SER B 125 ? 0.4755 0.4261 0.6962 -0.1844 -0.0182 0.0143 120 SER E CB 2586 O OG . SER B 125 ? 0.4993 0.4305 0.7400 -0.1978 -0.0127 0.0000 120 SER E OG 2587 N N . VAL B 126 ? 0.4748 0.4090 0.6500 -0.1760 -0.0232 0.0645 121 VAL E N 2588 C CA . VAL B 126 ? 0.4695 0.4150 0.6183 -0.1670 -0.0267 0.0726 121 VAL E CA 2589 C C . VAL B 126 ? 0.4705 0.4505 0.6143 -0.1743 -0.0152 0.0648 121 VAL E C 2590 O O . VAL B 126 ? 0.4918 0.4727 0.6414 -0.1934 -0.0023 0.0670 121 VAL E O 2591 C CB . VAL B 126 ? 0.4972 0.4105 0.6241 -0.1665 -0.0348 0.0948 121 VAL E CB 2592 C CG1 . VAL B 126 ? 0.4962 0.4189 0.5933 -0.1580 -0.0398 0.0974 121 VAL E CG1 2593 C CG2 . VAL B 126 ? 0.4983 0.3879 0.6448 -0.1566 -0.0481 0.0991 121 VAL E CG2 2594 N N . TYR B 127 ? 0.4534 0.4602 0.5887 -0.1585 -0.0174 0.0548 122 TYR E N 2595 C CA . TYR B 127 ? 0.4527 0.5011 0.5925 -0.1585 -0.0078 0.0434 122 TYR E CA 2596 C C . TYR B 127 ? 0.4621 0.5085 0.5706 -0.1452 -0.0057 0.0489 122 TYR E C 2597 O O . TYR B 127 ? 0.4580 0.4847 0.5475 -0.1293 -0.0144 0.0512 122 TYR E O 2598 C CB . TYR B 127 ? 0.4335 0.5194 0.5931 -0.1449 -0.0147 0.0215 122 TYR E CB 2599 C CG . TYR B 127 ? 0.4314 0.5179 0.6169 -0.1576 -0.0184 0.0102 122 TYR E CG 2600 C CD1 . TYR B 127 ? 0.4443 0.5398 0.6588 -0.1855 -0.0074 0.0044 122 TYR E CD1 2601 C CD2 . TYR B 127 ? 0.4266 0.4987 0.6038 -0.1438 -0.0289 0.0039 122 TYR E CD2 2602 C CE1 . TYR B 127 ? 0.4508 0.5413 0.6883 -0.1990 -0.0096 -0.0098 122 TYR E CE1 2603 C CE2 . TYR B 127 ? 0.4336 0.5032 0.6296 -0.1552 -0.0310 -0.0100 122 TYR E CE2 2604 C CZ . TYR B 127 ? 0.4456 0.5246 0.6734 -0.1828 -0.0228 -0.0181 122 TYR E CZ 2605 O OH . TYR B 127 ? 0.4612 0.5328 0.7079 -0.1966 -0.0235 -0.0359 122 TYR E OH 2606 N N . PRO B 128 ? 0.4829 0.5477 0.5861 -0.1537 0.0097 0.0486 123 PRO E N 2607 C CA . PRO B 128 ? 0.5007 0.5630 0.5717 -0.1409 0.0148 0.0496 123 PRO E CA 2608 C C . PRO B 128 ? 0.4895 0.5833 0.5701 -0.1146 0.0128 0.0322 123 PRO E C 2609 O O . PRO B 128 ? 0.4781 0.6134 0.5938 -0.1095 0.0108 0.0175 123 PRO E O 2610 C CB . PRO B 128 ? 0.5298 0.6042 0.5950 -0.1600 0.0381 0.0522 123 PRO E CB 2611 C CG . PRO B 128 ? 0.5184 0.6302 0.6338 -0.1765 0.0473 0.0403 123 PRO E CG 2612 C CD . PRO B 128 ? 0.4969 0.5880 0.6272 -0.1771 0.0279 0.0429 123 PRO E CD 2613 N N . LEU B 129 ? 0.5040 0.5751 0.5515 -0.0968 0.0115 0.0329 124 LEU E N 2614 C CA . LEU B 129 ? 0.5095 0.5968 0.5553 -0.0666 0.0118 0.0197 124 LEU E CA 2615 C C . LEU B 129 ? 0.5358 0.6267 0.5609 -0.0600 0.0285 0.0140 124 LEU E C 2616 O O . LEU B 129 ? 0.5584 0.6066 0.5435 -0.0575 0.0294 0.0180 124 LEU E O 2617 C CB . LEU B 129 ? 0.5170 0.5587 0.5367 -0.0502 0.0008 0.0244 124 LEU E CB 2618 C CG . LEU B 129 ? 0.4998 0.5297 0.5328 -0.0589 -0.0105 0.0300 124 LEU E CG 2619 C CD1 . LEU B 129 ? 0.5142 0.4935 0.5204 -0.0509 -0.0123 0.0353 124 LEU E CD1 2620 C CD2 . LEU B 129 ? 0.4903 0.5614 0.5495 -0.0480 -0.0175 0.0187 124 LEU E CD2 2621 N N . ALA B 130 ? 0.5376 0.6818 0.5932 -0.0594 0.0433 0.0013 125 ALA E N 2622 C CA . ALA B 130 ? 0.5686 0.7252 0.6111 -0.0497 0.0646 -0.0089 125 ALA E CA 2623 C C . ALA B 130 ? 0.5741 0.7586 0.6344 -0.0085 0.0611 -0.0260 125 ALA E C 2624 O O . ALA B 130 ? 0.5520 0.7725 0.6486 0.0064 0.0453 -0.0330 125 ALA E O 2625 C CB . ALA B 130 ? 0.5766 0.7765 0.6459 -0.0755 0.0899 -0.0140 125 ALA E CB 2626 N N . PRO B 131 ? 0.6148 0.7795 0.6456 0.0126 0.0741 -0.0336 126 PRO E N 2627 C CA . PRO B 131 ? 0.6358 0.8186 0.6797 0.0588 0.0702 -0.0480 126 PRO E CA 2628 C C . PRO B 131 ? 0.6258 0.9019 0.7414 0.0709 0.0719 -0.0677 126 PRO E C 2629 O O . PRO B 131 ? 0.6144 0.9382 0.7657 0.0409 0.0912 -0.0750 126 PRO E O 2630 C CB . PRO B 131 ? 0.6819 0.8289 0.6852 0.0720 0.0918 -0.0561 126 PRO E CB 2631 C CG . PRO B 131 ? 0.6886 0.8220 0.6661 0.0309 0.1090 -0.0503 126 PRO E CG 2632 C CD . PRO B 131 ? 0.6523 0.7724 0.6313 -0.0012 0.0908 -0.0306 126 PRO E CD 2633 N N . GLY B 132 ? 0.6398 0.9403 0.7753 0.1140 0.0517 -0.0768 127 GLY E N 2634 C CA . GLY B 132 ? 0.6356 1.0354 0.8472 0.1321 0.0471 -0.1017 127 GLY E CA 2635 C C . GLY B 132 ? 0.6628 1.1132 0.9098 0.1373 0.0798 -0.1230 127 GLY E C 2636 O O . GLY B 132 ? 0.6995 1.0994 0.9003 0.1476 0.1001 -0.1204 127 GLY E O 2637 N N . SER B 133 ? 0.6509 1.2028 0.9826 0.1287 0.0868 -0.1476 128 SER E N 2638 C CA . SER B 133 ? 0.6743 1.2881 1.0534 0.1283 0.1247 -0.1719 128 SER E CA 2639 C C . SER B 133 ? 0.7247 1.3265 1.0884 0.1873 0.1280 -0.1828 128 SER E C 2640 O O . SER B 133 ? 0.7602 1.3368 1.0965 0.1847 0.1640 -0.1873 128 SER E O 2641 C CB . SER B 133 ? 0.6491 1.3866 1.1388 0.1181 0.1255 -0.2032 128 SER E CB 2642 O OG . SER B 133 ? 0.6160 1.3575 1.1201 0.0651 0.1218 -0.1954 128 SER E OG 2643 N N . ALA B 134 ? 0.7407 1.3553 1.1160 0.2422 0.0908 -0.1873 129 ALA E N 2644 C CA . ALA B 134 ? 0.7986 1.3910 1.1555 0.3068 0.0899 -0.1953 129 ALA E CA 2645 C C . ALA B 134 ? 0.8447 1.3017 1.0936 0.3236 0.0836 -0.1669 129 ALA E C 2646 O O . ALA B 134 ? 0.8967 1.3170 1.1197 0.3824 0.0693 -0.1663 129 ALA E O 2647 C CB . ALA B 134 ? 0.8046 1.4791 1.2267 0.3655 0.0524 -0.2152 129 ALA E CB 2648 N N . ALA B 135 ? 0.8343 1.2167 1.0225 0.2730 0.0944 -0.1448 130 ALA E N 2649 C CA . ALA B 135 ? 0.8777 1.1402 0.9752 0.2784 0.0958 -0.1249 130 ALA E CA 2650 C C . ALA B 135 ? 0.9328 1.1613 1.0023 0.2906 0.1302 -0.1396 130 ALA E C 2651 O O . ALA B 135 ? 0.9299 1.2132 1.0325 0.2726 0.1600 -0.1579 130 ALA E O 2652 C CB . ALA B 135 ? 0.8472 1.0561 0.9023 0.2218 0.0927 -0.1019 130 ALA E CB 2653 N N . GLN B 136 ? 0.9914 1.1251 0.9972 0.3208 0.1292 -0.1328 131 GLN E N 2654 C CA . GLN B 136 ? 1.0497 1.1286 1.0137 0.3296 0.1606 -0.1474 131 GLN E CA 2655 C C . GLN B 136 ? 1.0365 1.0725 0.9527 0.2686 0.1758 -0.1415 131 GLN E C 2656 O O . GLN B 136 ? 1.0101 1.0093 0.9003 0.2343 0.1572 -0.1204 131 GLN E O 2657 C CB . GLN B 136 ? 1.1229 1.0965 1.0264 0.3726 0.1547 -0.1402 131 GLN E CB 2658 C CG . GLN B 136 ? 1.1592 1.1543 1.0903 0.4450 0.1371 -0.1431 131 GLN E CG 2659 C CD . GLN B 136 ? 1.1701 1.2575 1.1701 0.4807 0.1540 -0.1740 131 GLN E CD 2660 O OE1 . GLN B 136 ? 1.1944 1.2802 1.1899 0.4687 0.1898 -0.1947 131 GLN E OE1 2661 N NE2 . GLN B 136 ? 1.1585 1.3292 1.2230 0.5258 0.1285 -0.1802 131 GLN E NE2 2662 N N . THR B 137 ? 1.0634 1.1061 0.9671 0.2572 0.2088 -0.1613 132 THR E N 2663 C CA . THR B 137 ? 1.0732 1.0640 0.9143 0.2066 0.2201 -0.1580 132 THR E CA 2664 C C . THR B 137 ? 1.1489 1.0433 0.9180 0.2176 0.2345 -0.1728 132 THR E C 2665 O O . THR B 137 ? 1.2029 1.0969 0.9669 0.2455 0.2630 -0.1978 132 THR E O 2666 C CB . THR B 137 ? 1.0599 1.1168 0.9182 0.1720 0.2470 -0.1659 132 THR E CB 2667 O OG1 . THR B 137 ? 1.0583 1.2014 0.9876 0.2022 0.2687 -0.1865 132 THR E OG1 2668 C CG2 . THR B 137 ? 0.9948 1.0812 0.8696 0.1262 0.2283 -0.1414 132 THR E CG2 2669 N N . ASN B 138 ? 1.1522 0.9674 0.8715 0.1941 0.2160 -0.1604 133 ASN E N 2670 C CA . ASN B 138 ? 1.2220 0.9416 0.8746 0.1921 0.2263 -0.1765 133 ASN E CA 2671 C C . ASN B 138 ? 1.2183 0.9202 0.8243 0.1385 0.2225 -0.1794 133 ASN E C 2672 O O . ASN B 138 ? 1.1680 0.9262 0.7897 0.1094 0.2150 -0.1660 133 ASN E O 2673 C CB . ASN B 138 ? 1.2409 0.8854 0.8795 0.2063 0.2093 -0.1628 133 ASN E CB 2674 C CG . ASN B 138 ? 1.2611 0.9106 0.9287 0.2671 0.2099 -0.1584 133 ASN E CG 2675 O OD1 . ASN B 138 ? 1.2773 0.9773 0.9754 0.3042 0.2254 -0.1740 133 ASN E OD1 2676 N ND2 . ASN B 138 ? 1.2691 0.8658 0.9254 0.2796 0.1935 -0.1378 133 ASN E ND2 2677 N N . SER B 139 ? 1.2760 0.8987 0.8229 0.1266 0.2268 -0.1983 134 SER E N 2678 C CA . SER B 139 ? 1.2865 0.8952 0.7842 0.0808 0.2177 -0.2058 134 SER E CA 2679 C C . SER B 139 ? 1.2126 0.8467 0.7295 0.0441 0.1833 -0.1789 134 SER E C 2680 O O . SER B 139 ? 1.2078 0.8679 0.7012 0.0153 0.1747 -0.1746 134 SER E O 2681 C CB . SER B 139 ? 1.3709 0.8910 0.8096 0.0722 0.2223 -0.2352 134 SER E CB 2682 O OG . SER B 139 ? 1.3700 0.8336 0.8218 0.0728 0.2097 -0.2284 134 SER E OG 2683 N N . MET B 140 ? 1.1621 0.7848 0.7162 0.0472 0.1653 -0.1604 135 MET E N 2684 C CA . MET B 140 ? 1.0907 0.7430 0.6713 0.0169 0.1362 -0.1363 135 MET E CA 2685 C C . MET B 140 ? 1.0135 0.7283 0.6519 0.0327 0.1326 -0.1116 135 MET E C 2686 O O . MET B 140 ? 1.0100 0.7280 0.6729 0.0683 0.1418 -0.1101 135 MET E O 2687 C CB . MET B 140 ? 1.0962 0.6929 0.6774 0.0001 0.1201 -0.1363 135 MET E CB 2688 C CG . MET B 140 ? 1.1605 0.7048 0.6964 -0.0272 0.1152 -0.1640 135 MET E CG 2689 S SD . MET B 140 ? 1.1756 0.7558 0.6706 -0.0571 0.0964 -0.1720 135 MET E SD 2690 C CE . MET B 140 ? 1.1309 0.7260 0.6572 -0.0935 0.0547 -0.1608 135 MET E CE 2691 N N . VAL B 141 ? 0.9579 0.7196 0.6154 0.0078 0.1173 -0.0938 136 VAL E N 2692 C CA . VAL B 141 ? 0.8884 0.7069 0.6019 0.0147 0.1110 -0.0735 136 VAL E CA 2693 C C . VAL B 141 ? 0.8382 0.6522 0.5710 -0.0089 0.0839 -0.0542 136 VAL E C 2694 O O . VAL B 141 ? 0.8428 0.6438 0.5552 -0.0371 0.0691 -0.0518 136 VAL E O 2695 C CB . VAL B 141 ? 0.8764 0.7571 0.6038 0.0078 0.1264 -0.0714 136 VAL E CB 2696 C CG1 . VAL B 141 ? 0.8838 0.7611 0.5779 -0.0287 0.1173 -0.0607 136 VAL E CG1 2697 C CG2 . VAL B 141 ? 0.8189 0.7619 0.6120 0.0195 0.1244 -0.0609 136 VAL E CG2 2698 N N . THR B 142 ? 0.7966 0.6213 0.5666 0.0054 0.0766 -0.0423 137 THR E N 2699 C CA . THR B 142 ? 0.7537 0.5745 0.5449 -0.0136 0.0565 -0.0266 137 THR E CA 2700 C C . THR B 142 ? 0.7016 0.5811 0.5336 -0.0199 0.0490 -0.0121 137 THR E C 2701 O O . THR B 142 ? 0.6859 0.6041 0.5447 0.0008 0.0552 -0.0132 137 THR E O 2702 C CB . THR B 142 ? 0.7615 0.5390 0.5530 0.0032 0.0569 -0.0237 137 THR E CB 2703 O OG1 . THR B 142 ? 0.8187 0.5325 0.5727 0.0043 0.0679 -0.0386 137 THR E OG1 2704 C CG2 . THR B 142 ? 0.7255 0.4998 0.5394 -0.0183 0.0422 -0.0106 137 THR E CG2 2705 N N . LEU B 143 ? 0.6819 0.5680 0.5205 -0.0478 0.0347 -0.0010 138 LEU E N 2706 C CA . LEU B 143 ? 0.6424 0.5705 0.5169 -0.0584 0.0286 0.0124 138 LEU E CA 2707 C C . LEU B 143 ? 0.6138 0.5286 0.5098 -0.0678 0.0114 0.0224 138 LEU E C 2708 O O . LEU B 143 ? 0.6276 0.5057 0.5129 -0.0699 0.0063 0.0188 138 LEU E O 2709 C CB . LEU B 143 ? 0.6577 0.5966 0.5145 -0.0803 0.0307 0.0193 138 LEU E CB 2710 C CG . LEU B 143 ? 0.7020 0.6481 0.5269 -0.0760 0.0535 0.0082 138 LEU E CG 2711 C CD1 . LEU B 143 ? 0.7360 0.6730 0.5217 -0.0989 0.0549 0.0189 138 LEU E CD1 2712 C CD2 . LEU B 143 ? 0.6859 0.6830 0.5510 -0.0612 0.0733 0.0005 138 LEU E CD2 2713 N N . GLY B 144 ? 0.5817 0.5260 0.5109 -0.0751 0.0059 0.0321 139 GLY E N 2714 C CA . GLY B 144 ? 0.5609 0.4943 0.5121 -0.0831 -0.0069 0.0396 139 GLY E CA 2715 C C . GLY B 144 ? 0.5413 0.4983 0.5213 -0.0976 -0.0128 0.0496 139 GLY E C 2716 O O . GLY B 144 ? 0.5447 0.5260 0.5287 -0.1051 -0.0052 0.0520 139 GLY E O 2717 N N . CYS B 145 ? 0.5288 0.4745 0.5296 -0.1025 -0.0224 0.0538 140 CYS E N 2718 C CA . CYS B 145 ? 0.5160 0.4722 0.5445 -0.1144 -0.0280 0.0616 140 CYS E CA 2719 C C . CYS B 145 ? 0.4882 0.4414 0.5377 -0.1077 -0.0285 0.0568 140 CYS E C 2720 O O . CYS B 145 ? 0.4888 0.4196 0.5334 -0.1031 -0.0277 0.0540 140 CYS E O 2721 C CB . CYS B 145 ? 0.5417 0.4800 0.5661 -0.1271 -0.0411 0.0730 140 CYS E CB 2722 S SG . CYS B 145 ? 0.5920 0.5345 0.6002 -0.1404 -0.0347 0.0864 140 CYS E SG 2723 N N . LEU B 146 ? 0.4694 0.4438 0.5389 -0.1087 -0.0271 0.0534 141 LEU E N 2724 C CA . LEU B 146 ? 0.4572 0.4270 0.5372 -0.1025 -0.0273 0.0473 141 LEU E CA 2725 C C . LEU B 146 ? 0.4479 0.4114 0.5557 -0.1172 -0.0308 0.0508 141 LEU E C 2726 O O . LEU B 146 ? 0.4480 0.4232 0.5702 -0.1294 -0.0311 0.0523 141 LEU E O 2727 C CB . LEU B 146 ? 0.4570 0.4568 0.5367 -0.0898 -0.0276 0.0354 141 LEU E CB 2728 C CG . LEU B 146 ? 0.4612 0.4571 0.5401 -0.0823 -0.0301 0.0266 141 LEU E CG 2729 C CD1 . LEU B 146 ? 0.4795 0.4347 0.5273 -0.0693 -0.0227 0.0309 141 LEU E CD1 2730 C CD2 . LEU B 146 ? 0.4677 0.5036 0.5474 -0.0682 -0.0384 0.0117 141 LEU E CD2 2731 N N . VAL B 147 ? 0.4473 0.3893 0.5642 -0.1164 -0.0302 0.0509 142 VAL E N 2732 C CA . VAL B 147 ? 0.4447 0.3778 0.5917 -0.1246 -0.0329 0.0526 142 VAL E CA 2733 C C . VAL B 147 ? 0.4458 0.3748 0.5964 -0.1195 -0.0237 0.0400 142 VAL E C 2734 O O . VAL B 147 ? 0.4498 0.3652 0.5895 -0.1123 -0.0140 0.0360 142 VAL E O 2735 C CB . VAL B 147 ? 0.4468 0.3674 0.6107 -0.1259 -0.0397 0.0584 142 VAL E CB 2736 C CG1 . VAL B 147 ? 0.4522 0.3650 0.6508 -0.1281 -0.0455 0.0613 142 VAL E CG1 2737 C CG2 . VAL B 147 ? 0.4560 0.3781 0.5996 -0.1283 -0.0508 0.0677 142 VAL E CG2 2738 N N . LYS B 148 ? 0.4491 0.3853 0.6112 -0.1254 -0.0243 0.0327 143 LYS E N 2739 C CA . LYS B 148 ? 0.4635 0.3992 0.6161 -0.1198 -0.0184 0.0167 143 LYS E CA 2740 C C . LYS B 148 ? 0.4755 0.3967 0.6540 -0.1276 -0.0138 0.0078 143 LYS E C 2741 O O . LYS B 148 ? 0.4775 0.3929 0.6809 -0.1389 -0.0174 0.0127 143 LYS E O 2742 C CB . LYS B 148 ? 0.4703 0.4366 0.6091 -0.1173 -0.0258 0.0061 143 LYS E CB 2743 C CG . LYS B 148 ? 0.4953 0.4649 0.6061 -0.1036 -0.0270 -0.0103 143 LYS E CG 2744 C CD . LYS B 148 ? 0.5035 0.5071 0.5949 -0.0885 -0.0393 -0.0162 143 LYS E CD 2745 C CE . LYS B 148 ? 0.5410 0.5423 0.5895 -0.0669 -0.0460 -0.0293 143 LYS E CE 2746 N NZ . LYS B 148 ? 0.5556 0.5652 0.6157 -0.0788 -0.0505 -0.0514 143 LYS E NZ 2747 N N . GLY B 149 ? 0.4949 0.4031 0.6613 -0.1205 -0.0029 -0.0048 144 GLY E N 2748 C CA . GLY B 149 ? 0.5124 0.4056 0.6965 -0.1256 0.0043 -0.0199 144 GLY E CA 2749 C C . GLY B 149 ? 0.5112 0.3859 0.7397 -0.1285 0.0084 -0.0135 144 GLY E C 2750 O O . GLY B 149 ? 0.5268 0.3878 0.7757 -0.1358 0.0077 -0.0194 144 GLY E O 2751 N N . TYR B 150 ? 0.4992 0.3723 0.7451 -0.1219 0.0127 -0.0040 145 TYR E N 2752 C CA . TYR B 150 ? 0.5000 0.3642 0.7952 -0.1182 0.0115 0.0000 145 TYR E CA 2753 C C . TYR B 150 ? 0.5136 0.3752 0.8335 -0.1113 0.0329 -0.0141 145 TYR E C 2754 O O . TYR B 150 ? 0.5168 0.3793 0.8117 -0.1117 0.0502 -0.0205 145 TYR E O 2755 C CB . TYR B 150 ? 0.4817 0.3568 0.7917 -0.1164 -0.0070 0.0193 145 TYR E CB 2756 C CG . TYR B 150 ? 0.4644 0.3551 0.7683 -0.1160 -0.0034 0.0200 145 TYR E CG 2757 C CD1 . TYR B 150 ? 0.4552 0.3505 0.7146 -0.1195 -0.0043 0.0247 145 TYR E CD1 2758 C CD2 . TYR B 150 ? 0.4626 0.3636 0.8102 -0.1125 0.0025 0.0135 145 TYR E CD2 2759 C CE1 . TYR B 150 ? 0.4533 0.3511 0.7033 -0.1201 0.0020 0.0247 145 TYR E CE1 2760 C CE2 . TYR B 150 ? 0.4555 0.3662 0.8002 -0.1179 0.0096 0.0110 145 TYR E CE2 2761 C CZ . TYR B 150 ? 0.4532 0.3564 0.7448 -0.1220 0.0101 0.0176 145 TYR E CZ 2762 O OH . TYR B 150 ? 0.4551 0.3567 0.7405 -0.1282 0.0199 0.0147 145 TYR E OH 2763 N N . PHE B 151 ? 0.5288 0.3843 0.8985 -0.1038 0.0337 -0.0180 146 PHE E N 2764 C CA . PHE B 151 ? 0.5399 0.4004 0.9497 -0.0967 0.0567 -0.0342 146 PHE E CA 2765 C C . PHE B 151 ? 0.5470 0.4114 1.0235 -0.0819 0.0450 -0.0328 146 PHE E C 2766 O O . PHE B 151 ? 0.5646 0.4048 1.0415 -0.0765 0.0315 -0.0261 146 PHE E O 2767 C CB . PHE B 151 ? 0.5718 0.4107 0.9532 -0.0980 0.0837 -0.0558 146 PHE E CB 2768 C CG . PHE B 151 ? 0.5919 0.4339 1.0067 -0.0929 0.1168 -0.0744 146 PHE E CG 2769 C CD1 . PHE B 151 ? 0.6062 0.4484 1.0845 -0.0803 0.1236 -0.0866 146 PHE E CD1 2770 C CD2 . PHE B 151 ? 0.6046 0.4460 0.9870 -0.0997 0.1445 -0.0797 146 PHE E CD2 2771 C CE1 . PHE B 151 ? 0.6222 0.4742 1.1399 -0.0760 0.1587 -0.1071 146 PHE E CE1 2772 C CE2 . PHE B 151 ? 0.6289 0.4720 1.0420 -0.0989 0.1827 -0.0979 146 PHE E CE2 2773 C CZ . PHE B 151 ? 0.6338 0.4874 1.1191 -0.0877 0.1905 -0.1133 146 PHE E CZ 2774 N N . PRO B 152 ? 0.5428 0.4367 1.0782 -0.0746 0.0507 -0.0404 147 PRO E N 2775 C CA . PRO B 152 ? 0.5322 0.4507 1.0764 -0.0853 0.0718 -0.0498 147 PRO E CA 2776 C C . PRO B 152 ? 0.5100 0.4484 1.0458 -0.0929 0.0469 -0.0345 147 PRO E C 2777 O O . PRO B 152 ? 0.5075 0.4421 1.0262 -0.0886 0.0141 -0.0162 147 PRO E O 2778 C CB . PRO B 152 ? 0.5379 0.4857 1.1710 -0.0738 0.0856 -0.0692 147 PRO E CB 2779 C CG . PRO B 152 ? 0.5394 0.4913 1.2127 -0.0520 0.0481 -0.0582 147 PRO E CG 2780 C CD . PRO B 152 ? 0.5534 0.4582 1.1601 -0.0530 0.0355 -0.0417 147 PRO E CD 2781 N N . GLU B 153 ? 0.5077 0.4620 1.0520 -0.1058 0.0660 -0.0432 148 GLU E N 2782 C CA . GLU B 153 ? 0.4931 0.4700 1.0472 -0.1135 0.0440 -0.0368 148 GLU E CA 2783 C C . GLU B 153 ? 0.4855 0.5038 1.1205 -0.1006 0.0139 -0.0420 148 GLU E C 2784 O O . GLU B 153 ? 0.4937 0.5282 1.1905 -0.0871 0.0208 -0.0550 148 GLU E O 2785 C CB . GLU B 153 ? 0.5061 0.4832 1.0567 -0.1330 0.0775 -0.0487 148 GLU E CB 2786 C CG . GLU B 153 ? 0.5288 0.4611 0.9888 -0.1398 0.0997 -0.0394 148 GLU E CG 2787 C CD . GLU B 153 ? 0.5477 0.4694 0.9907 -0.1576 0.1183 -0.0418 148 GLU E CD 2788 O OE1 . GLU B 153 ? 0.5851 0.4941 1.0363 -0.1700 0.1608 -0.0543 148 GLU E OE1 2789 O OE2 . GLU B 153 ? 0.5390 0.4619 0.9610 -0.1603 0.0932 -0.0323 148 GLU E OE2 2790 N N . PRO B 154 ? 0.4787 0.5148 1.1122 -0.1017 -0.0211 -0.0336 149 PRO E N 2791 C CA . PRO B 154 ? 0.4742 0.4925 1.0394 -0.1149 -0.0300 -0.0206 149 PRO E CA 2792 C C . PRO B 154 ? 0.4790 0.4755 0.9899 -0.1043 -0.0610 0.0040 149 PRO E C 2793 O O . PRO B 154 ? 0.4908 0.4822 1.0168 -0.0870 -0.0793 0.0132 149 PRO E O 2794 C CB . PRO B 154 ? 0.4764 0.5341 1.0882 -0.1237 -0.0480 -0.0348 149 PRO E CB 2795 C CG . PRO B 154 ? 0.4807 0.5785 1.1702 -0.1028 -0.0769 -0.0422 149 PRO E CG 2796 C CD . PRO B 154 ? 0.4822 0.5657 1.1926 -0.0885 -0.0543 -0.0428 149 PRO E CD 2797 N N . VAL B 155 ? 0.4780 0.4576 0.9254 -0.1146 -0.0628 0.0143 150 VAL E N 2798 C CA . VAL B 155 ? 0.4927 0.4606 0.8938 -0.1094 -0.0915 0.0343 150 VAL E CA 2799 C C . VAL B 155 ? 0.5022 0.4862 0.8944 -0.1168 -0.1097 0.0294 150 VAL E C 2800 O O . VAL B 155 ? 0.4925 0.4838 0.8953 -0.1308 -0.0921 0.0131 150 VAL E O 2801 C CB . VAL B 155 ? 0.4910 0.4311 0.8268 -0.1148 -0.0778 0.0467 150 VAL E CB 2802 C CG1 . VAL B 155 ? 0.4908 0.4144 0.8312 -0.1105 -0.0639 0.0480 150 VAL E CG1 2803 C CG2 . VAL B 155 ? 0.4820 0.4177 0.7872 -0.1253 -0.0555 0.0385 150 VAL E CG2 2804 N N . THR B 156 ? 0.5289 0.5113 0.8947 -0.1084 -0.1428 0.0430 151 THR E N 2805 C CA . THR B 156 ? 0.5443 0.5363 0.8854 -0.1155 -0.1621 0.0372 151 THR E CA 2806 C C . THR B 156 ? 0.5572 0.5194 0.8178 -0.1172 -0.1613 0.0561 151 THR E C 2807 O O . THR B 156 ? 0.5745 0.5158 0.8074 -0.1093 -0.1633 0.0766 151 THR E O 2808 C CB . THR B 156 ? 0.5770 0.5949 0.9456 -0.1018 -0.2062 0.0346 151 THR E CB 2809 O OG1 . THR B 156 ? 0.6151 0.6048 0.9369 -0.0841 -0.2261 0.0626 151 THR E OG1 2810 C CG2 . THR B 156 ? 0.5650 0.6227 1.0289 -0.0945 -0.2103 0.0153 151 THR E CG2 2811 N N . VAL B 157 ? 0.5571 0.5158 0.7829 -0.1285 -0.1554 0.0474 152 VAL E N 2812 C CA . VAL B 157 ? 0.5709 0.5076 0.7265 -0.1299 -0.1499 0.0602 152 VAL E CA 2813 C C . VAL B 157 ? 0.6057 0.5437 0.7260 -0.1321 -0.1737 0.0534 152 VAL E C 2814 O O . VAL B 157 ? 0.6130 0.5630 0.7533 -0.1414 -0.1772 0.0310 152 VAL E O 2815 C CB . VAL B 157 ? 0.5489 0.4746 0.6863 -0.1364 -0.1163 0.0545 152 VAL E CB 2816 C CG1 . VAL B 157 ? 0.5659 0.4789 0.6435 -0.1354 -0.1091 0.0645 152 VAL E CG1 2817 C CG2 . VAL B 157 ? 0.5206 0.4457 0.6862 -0.1336 -0.0962 0.0573 152 VAL E CG2 2818 N N . THR B 158 ? 0.6388 0.5608 0.7027 -0.1256 -0.1879 0.0712 153 THR E N 2819 C CA . THR B 158 ? 0.6805 0.5974 0.6915 -0.1275 -0.2073 0.0642 153 THR E CA 2820 C C . THR B 158 ? 0.6950 0.5865 0.6362 -0.1300 -0.1839 0.0777 153 THR E C 2821 O O . THR B 158 ? 0.6696 0.5537 0.6121 -0.1302 -0.1600 0.0926 153 THR E O 2822 C CB . THR B 158 ? 0.7316 0.6531 0.7317 -0.1136 -0.2525 0.0715 153 THR E CB 2823 O OG1 . THR B 158 ? 0.7580 0.6514 0.7241 -0.1013 -0.2529 0.1036 153 THR E OG1 2824 C CG2 . THR B 158 ? 0.7077 0.6669 0.7939 -0.1089 -0.2753 0.0543 153 THR E CG2 2825 N N . TRP B 159 ? 0.7351 0.6168 0.6199 -0.1332 -0.1892 0.0682 154 TRP E N 2826 C CA . TRP B 159 ? 0.7602 0.6221 0.5808 -0.1354 -0.1635 0.0768 154 TRP E CA 2827 C C . TRP B 159 ? 0.8402 0.6809 0.5829 -0.1313 -0.1851 0.0859 154 TRP E C 2828 O O . TRP B 159 ? 0.8750 0.7194 0.6011 -0.1301 -0.2164 0.0690 154 TRP E O 2829 C CB . TRP B 159 ? 0.7452 0.6078 0.5624 -0.1408 -0.1396 0.0536 154 TRP E CB 2830 C CG . TRP B 159 ? 0.6828 0.5560 0.5535 -0.1403 -0.1146 0.0501 154 TRP E CG 2831 C CD1 . TRP B 159 ? 0.6497 0.5287 0.5711 -0.1432 -0.1148 0.0361 154 TRP E CD1 2832 C CD2 . TRP B 159 ? 0.6559 0.5350 0.5307 -0.1364 -0.0857 0.0594 154 TRP E CD2 2833 N NE1 . TRP B 159 ? 0.6110 0.4916 0.5551 -0.1383 -0.0889 0.0393 154 TRP E NE1 2834 C CE2 . TRP B 159 ? 0.6123 0.4978 0.5322 -0.1330 -0.0744 0.0517 154 TRP E CE2 2835 C CE3 . TRP B 159 ? 0.6713 0.5529 0.5172 -0.1366 -0.0672 0.0715 154 TRP E CE3 2836 C CZ2 . TRP B 159 ? 0.5835 0.4809 0.5177 -0.1258 -0.0531 0.0550 154 TRP E CZ2 2837 C CZ3 . TRP B 159 ? 0.6359 0.5368 0.5100 -0.1332 -0.0436 0.0714 154 TRP E CZ3 2838 C CH2 . TRP B 159 ? 0.5924 0.5024 0.5089 -0.1259 -0.0405 0.0629 154 TRP E CH2 2839 N N . ASN B 160 ? 0.8764 0.6935 0.5692 -0.1307 -0.1676 0.1113 155 ASN E N 2840 C CA . ASN B 160 ? 0.9714 0.7554 0.5734 -0.1254 -0.1829 0.1274 155 ASN E CA 2841 C C . ASN B 160 ? 1.0097 0.7932 0.6109 -0.1101 -0.2368 0.1313 155 ASN E C 2842 O O . ASN B 160 ? 1.0722 0.8502 0.6189 -0.1045 -0.2677 0.1202 155 ASN E O 2843 C CB . ASN B 160 ? 1.0177 0.7930 0.5526 -0.1309 -0.1701 0.1080 155 ASN E CB 2844 C CG . ASN B 160 ? 1.0046 0.7788 0.5281 -0.1404 -0.1167 0.1091 155 ASN E CG 2845 O OD1 . ASN B 160 ? 0.9725 0.7509 0.5280 -0.1452 -0.0912 0.1263 155 ASN E OD1 2846 N ND2 . ASN B 160 ? 1.0336 0.8045 0.5148 -0.1428 -0.0999 0.0873 155 ASN E ND2 2847 N N . SER B 161 ? 0.9736 0.7663 0.6396 -0.1018 -0.2490 0.1436 156 SER E N 2848 C CA . SER B 161 ? 1.0026 0.8046 0.6900 -0.0818 -0.3008 0.1461 156 SER E CA 2849 C C . SER B 161 ? 0.9848 0.8331 0.7204 -0.0830 -0.3352 0.1081 156 SER E C 2850 O O . SER B 161 ? 1.0251 0.8891 0.7680 -0.0657 -0.3847 0.1040 156 SER E O 2851 C CB . SER B 161 ? 1.1173 0.8721 0.7017 -0.0642 -0.3258 0.1748 156 SER E CB 2852 O OG . SER B 161 ? 1.1487 0.8540 0.6829 -0.0700 -0.2858 0.2079 156 SER E OG 2853 N N . GLY B 162 ? 0.9325 0.8022 0.7045 -0.1028 -0.3097 0.0794 157 GLY E N 2854 C CA . GLY B 162 ? 0.9259 0.8308 0.7402 -0.1114 -0.3336 0.0408 157 GLY E CA 2855 C C . GLY B 162 ? 0.9940 0.8855 0.7315 -0.1190 -0.3434 0.0199 157 GLY E C 2856 O O . GLY B 162 ? 0.9984 0.9147 0.7660 -0.1305 -0.3623 -0.0166 157 GLY E O 2857 N N . SER B 163 ? 1.0550 0.9059 0.6938 -0.1150 -0.3277 0.0402 158 SER E N 2858 C CA . SER B 163 ? 1.1253 0.9575 0.6824 -0.1224 -0.3282 0.0190 158 SER E CA 2859 C C . SER B 163 ? 1.0846 0.9175 0.6685 -0.1409 -0.2880 -0.0092 158 SER E C 2860 O O . SER B 163 ? 1.1220 0.9504 0.6778 -0.1506 -0.2958 -0.0423 158 SER E O 2861 C CB . SER B 163 ? 1.2008 0.9872 0.6467 -0.1145 -0.3109 0.0489 158 SER E CB 2862 O OG . SER B 163 ? 1.2643 1.0350 0.6680 -0.0944 -0.3493 0.0772 158 SER E OG 2863 N N . LEU B 164 ? 1.0203 0.8547 0.6537 -0.1439 -0.2463 0.0033 159 LEU E N 2864 C CA . LEU B 164 ? 0.9833 0.8161 0.6517 -0.1548 -0.2117 -0.0193 159 LEU E CA 2865 C C . LEU B 164 ? 0.9313 0.7891 0.6923 -0.1637 -0.2211 -0.0365 159 LEU E C 2866 O O . LEU B 164 ? 0.8717 0.7426 0.6913 -0.1606 -0.2080 -0.0204 159 LEU E O 2867 C CB . LEU B 164 ? 0.9432 0.7687 0.6164 -0.1499 -0.1657 0.0011 159 LEU E CB 2868 C CG . LEU B 164 ? 0.9904 0.7943 0.5918 -0.1472 -0.1345 0.0009 159 LEU E CG 2869 C CD1 . LEU B 164 ? 0.9412 0.7552 0.5715 -0.1420 -0.0962 0.0188 159 LEU E CD1 2870 C CD2 . LEU B 164 ? 1.0226 0.8089 0.6023 -0.1515 -0.1241 -0.0338 159 LEU E CD2 2871 N N . SER B 165 ? 0.9994 0.9698 0.6271 -0.0888 -0.3728 -0.0869 160 SER E N 2872 C CA . SER B 165 ? 0.9473 0.9450 0.6820 -0.1065 -0.3818 -0.1146 160 SER E CA 2873 C C . SER B 165 ? 0.9222 0.8870 0.6737 -0.1258 -0.3367 -0.1444 160 SER E C 2874 O O . SER B 165 ? 0.8564 0.8160 0.6765 -0.1311 -0.3064 -0.1392 160 SER E O 2875 C CB . SER B 165 ? 1.0028 1.0441 0.7555 -0.1138 -0.4416 -0.1485 160 SER E CB 2876 O OG . SER B 165 ? 1.0556 1.1214 0.7646 -0.0880 -0.4879 -0.1191 160 SER E OG 2877 N N . SER B 166 ? 0.9853 0.9226 0.6667 -0.1337 -0.3305 -0.1743 161 SER E N 2878 C CA . SER B 166 ? 0.9836 0.8803 0.6735 -0.1493 -0.2875 -0.2051 161 SER E CA 2879 C C . SER B 166 ? 0.9384 0.8037 0.6142 -0.1327 -0.2354 -0.1729 161 SER E C 2880 O O . SER B 166 ? 0.9318 0.8029 0.5686 -0.1142 -0.2316 -0.1375 161 SER E O 2881 C CB . SER B 166 ? 1.0778 0.9489 0.6896 -0.1603 -0.2925 -0.2470 161 SER E CB 2882 O OG . SER B 166 ? 1.1196 1.0245 0.7603 -0.1819 -0.3398 -0.2904 161 SER E OG 2883 N N . GLY B 167 ? 0.9154 0.7482 0.6246 -0.1386 -0.1951 -0.1857 162 GLY E N 2884 C CA . GLY B 167 ? 0.8775 0.6871 0.5796 -0.1191 -0.1497 -0.1584 162 GLY E CA 2885 C C . GLY B 167 ? 0.8005 0.6408 0.5483 -0.1075 -0.1492 -0.1201 162 GLY E C 2886 O O . GLY B 167 ? 0.7786 0.6192 0.5098 -0.0896 -0.1254 -0.0957 162 GLY E O 2887 N N . VAL B 168 ? 0.7618 0.6310 0.5713 -0.1183 -0.1746 -0.1188 163 VAL E N 2888 C CA . VAL B 168 ? 0.6923 0.5859 0.5482 -0.1105 -0.1720 -0.0885 163 VAL E CA 2889 C C . VAL B 168 ? 0.6592 0.5414 0.5772 -0.1185 -0.1491 -0.0958 163 VAL E C 2890 O O . VAL B 168 ? 0.6830 0.5546 0.6347 -0.1364 -0.1502 -0.1239 163 VAL E O 2891 C CB . VAL B 168 ? 0.6831 0.6141 0.5628 -0.1114 -0.2129 -0.0764 163 VAL E CB 2892 C CG1 . VAL B 168 ? 0.6224 0.5710 0.5593 -0.1069 -0.2048 -0.0523 163 VAL E CG1 2893 C CG2 . VAL B 168 ? 0.7255 0.6583 0.5313 -0.0996 -0.2287 -0.0602 163 VAL E CG2 2894 N N . HIS B 169 ? 0.6135 0.4971 0.5440 -0.1065 -0.1261 -0.0726 164 HIS E N 2895 C CA . HIS B 169 ? 0.5847 0.4586 0.5652 -0.1112 -0.1043 -0.0729 164 HIS E CA 2896 C C . HIS B 169 ? 0.5346 0.4394 0.5407 -0.1050 -0.1099 -0.0501 164 HIS E C 2897 O O . HIS B 169 ? 0.5210 0.4370 0.4964 -0.0917 -0.1057 -0.0326 164 HIS E O 2898 C CB . HIS B 169 ? 0.6024 0.4353 0.5521 -0.0978 -0.0640 -0.0694 164 HIS E CB 2899 C CG . HIS B 169 ? 0.6595 0.4510 0.5768 -0.1006 -0.0499 -0.0902 164 HIS E CG 2900 N ND1 . HIS B 169 ? 0.6943 0.4609 0.6431 -0.1242 -0.0447 -0.1199 164 HIS E ND1 2901 C CD2 . HIS B 169 ? 0.6951 0.4640 0.5565 -0.0838 -0.0357 -0.0891 164 HIS E CD2 2902 C CE1 . HIS B 169 ? 0.7505 0.4754 0.6594 -0.1236 -0.0274 -0.1374 164 HIS E CE1 2903 N NE2 . HIS B 169 ? 0.7509 0.4748 0.6049 -0.0970 -0.0209 -0.1177 164 HIS E NE2 2904 N N . THR B 170 ? 0.5108 0.4312 0.5787 -0.1162 -0.1180 -0.0536 165 THR E N 2905 C CA . THR B 170 ? 0.4716 0.4097 0.5678 -0.1121 -0.1129 -0.0371 165 THR E CA 2906 C C . THR B 170 ? 0.4650 0.3830 0.5910 -0.1171 -0.0808 -0.0438 165 THR E C 2907 O O . THR B 170 ? 0.4804 0.3889 0.6500 -0.1310 -0.0744 -0.0610 165 THR E O 2908 C CB . THR B 170 ? 0.4613 0.4290 0.6032 -0.1156 -0.1430 -0.0322 165 THR E CB 2909 O OG1 . THR B 170 ? 0.4872 0.4635 0.5833 -0.1080 -0.1684 -0.0218 165 THR E OG1 2910 C CG2 . THR B 170 ? 0.4309 0.4081 0.6014 -0.1123 -0.1316 -0.0179 165 THR E CG2 2911 N N . PHE B 171 ? 0.4528 0.3647 0.5525 -0.1060 -0.0591 -0.0319 166 PHE E N 2912 C CA . PHE B 171 ? 0.4643 0.3475 0.5655 -0.1053 -0.0240 -0.0340 166 PHE E CA 2913 C C . PHE B 171 ? 0.4410 0.3357 0.5958 -0.1150 -0.0157 -0.0367 166 PHE E C 2914 O O . PHE B 171 ? 0.4119 0.3357 0.5907 -0.1163 -0.0340 -0.0321 166 PHE E O 2915 C CB . PHE B 171 ? 0.4784 0.3520 0.5138 -0.0832 -0.0087 -0.0208 166 PHE E CB 2916 C CG . PHE B 171 ? 0.5047 0.3626 0.4940 -0.0699 -0.0096 -0.0184 166 PHE E CG 2917 C CD1 . PHE B 171 ? 0.4902 0.3770 0.4607 -0.0638 -0.0323 -0.0144 166 PHE E CD1 2918 C CD2 . PHE B 171 ? 0.5535 0.3605 0.5192 -0.0638 0.0187 -0.0205 166 PHE E CD2 2919 C CE1 . PHE B 171 ? 0.5197 0.3899 0.4497 -0.0510 -0.0283 -0.0147 166 PHE E CE1 2920 C CE2 . PHE B 171 ? 0.5835 0.3694 0.5093 -0.0503 0.0223 -0.0202 166 PHE E CE2 2921 C CZ . PHE B 171 ? 0.5655 0.3853 0.4741 -0.0434 -0.0018 -0.0183 166 PHE E CZ 2922 N N . PRO B 172 ? 0.4634 0.3292 0.6382 -0.1221 0.0176 -0.0443 167 PRO E N 2923 C CA . PRO B 172 ? 0.4509 0.3241 0.6748 -0.1302 0.0329 -0.0488 167 PRO E CA 2924 C C . PRO B 172 ? 0.4418 0.3248 0.6283 -0.1199 0.0366 -0.0403 167 PRO E C 2925 O O . PRO B 172 ? 0.4589 0.3332 0.5771 -0.1051 0.0423 -0.0321 167 PRO E O 2926 C CB . PRO B 172 ? 0.4918 0.3209 0.7217 -0.1376 0.0791 -0.0563 167 PRO E CB 2927 C CG . PRO B 172 ? 0.5165 0.3234 0.7389 -0.1424 0.0793 -0.0626 167 PRO E CG 2928 C CD . PRO B 172 ? 0.5064 0.3268 0.6694 -0.1261 0.0474 -0.0513 167 PRO E CD 2929 N N . ALA B 173 ? 0.4234 0.3253 0.6587 -0.1272 0.0344 -0.0450 168 ALA E N 2930 C CA . ALA B 173 ? 0.4254 0.3355 0.6343 -0.1238 0.0408 -0.0455 168 ALA E CA 2931 C C . ALA B 173 ? 0.4703 0.3507 0.6289 -0.1189 0.0773 -0.0498 168 ALA E C 2932 O O . ALA B 173 ? 0.4967 0.3441 0.6593 -0.1214 0.1065 -0.0513 168 ALA E O 2933 C CB . ALA B 173 ? 0.4054 0.3298 0.6833 -0.1330 0.0386 -0.0513 168 ALA E CB 2934 N N . VAL B 174 ? 0.4874 0.3799 0.5949 -0.1118 0.0757 -0.0524 169 VAL E N 2935 C CA . VAL B 174 ? 0.5432 0.4120 0.5957 -0.1057 0.1061 -0.0585 169 VAL E CA 2936 C C . VAL B 174 ? 0.5470 0.4378 0.6031 -0.1149 0.1051 -0.0771 169 VAL E C 2937 O O . VAL B 174 ? 0.5103 0.4355 0.5924 -0.1215 0.0790 -0.0813 169 VAL E O 2938 C CB . VAL B 174 ? 0.5838 0.4438 0.5461 -0.0809 0.1039 -0.0449 169 VAL E CB 2939 C CG1 . VAL B 174 ? 0.5932 0.4206 0.5542 -0.0739 0.1115 -0.0293 169 VAL E CG1 2940 C CG2 . VAL B 174 ? 0.5628 0.4738 0.5012 -0.0713 0.0667 -0.0456 169 VAL E CG2 2941 N N . LEU B 175 ? 0.6019 0.4672 0.6311 -0.1173 0.1385 -0.0899 170 LEU E N 2942 C CA . LEU B 175 ? 0.6210 0.5011 0.6447 -0.1280 0.1422 -0.1144 170 LEU E CA 2943 C C . LEU B 175 ? 0.6496 0.5647 0.5989 -0.1164 0.1163 -0.1207 170 LEU E C 2944 O O . LEU B 175 ? 0.6874 0.5988 0.5671 -0.0936 0.1109 -0.1056 170 LEU E O 2945 C CB . LEU B 175 ? 0.6759 0.5161 0.6872 -0.1342 0.1890 -0.1298 170 LEU E CB 2946 C CG . LEU B 175 ? 0.6640 0.4930 0.7602 -0.1533 0.2140 -0.1476 170 LEU E CG 2947 C CD1 . LEU B 175 ? 0.6115 0.4723 0.7725 -0.1642 0.1856 -0.1533 170 LEU E CD1 2948 C CD2 . LEU B 175 ? 0.6534 0.4578 0.8190 -0.1553 0.2395 -0.1361 170 LEU E CD2 2949 N N . GLN B 176 ? 0.6432 0.5932 0.6134 -0.1316 0.1012 -0.1438 171 GLN E N 2950 C CA . GLN B 176 ? 0.6751 0.6716 0.5905 -0.1258 0.0757 -0.1601 171 GLN E CA 2951 C C . GLN B 176 ? 0.7006 0.7047 0.6290 -0.1508 0.0879 -0.2003 171 GLN E C 2952 O O . GLN B 176 ? 0.6691 0.6857 0.6647 -0.1733 0.0852 -0.2137 171 GLN E O 2953 C CB . GLN B 176 ? 0.6322 0.6748 0.5749 -0.1224 0.0404 -0.1487 171 GLN E CB 2954 C CG . GLN B 176 ? 0.6609 0.7658 0.5670 -0.1170 0.0121 -0.1689 171 GLN E CG 2955 C CD . GLN B 176 ? 0.6236 0.7695 0.5542 -0.1079 -0.0153 -0.1523 171 GLN E CD 2956 O OE1 . GLN B 176 ? 0.5810 0.7081 0.5616 -0.1157 -0.0122 -0.1340 171 GLN E OE1 2957 N NE2 . GLN B 176 ? 0.6468 0.8508 0.5424 -0.0894 -0.0422 -0.1592 171 GLN E NE2 2958 N N . SER B 177 ? 0.7692 0.7574 0.6272 -0.1462 0.1059 -0.2189 172 SER E N 2959 C CA . SER B 177 ? 0.8061 0.7759 0.6717 -0.1701 0.1340 -0.2576 172 SER E CA 2960 C C . SER B 177 ? 0.7672 0.6873 0.7172 -0.1828 0.1701 -0.2481 172 SER E C 2961 O O . SER B 177 ? 0.7649 0.6501 0.7186 -0.1697 0.1896 -0.2214 172 SER E O 2962 C CB . SER B 177 ? 0.8126 0.8340 0.6956 -0.1934 0.1116 -0.2983 172 SER E CB 2963 O OG . SER B 177 ? 0.8769 0.9438 0.6722 -0.1819 0.0854 -0.3204 172 SER E OG 2964 N N . ASP B 178 ? 0.7406 0.6579 0.7624 -0.2068 0.1803 -0.2698 173 ASP E N 2965 C CA . ASP B 178 ? 0.7065 0.5850 0.8183 -0.2120 0.2083 -0.2573 173 ASP E CA 2966 C C . ASP B 178 ? 0.6294 0.5201 0.8114 -0.2052 0.1829 -0.2215 173 ASP E C 2967 O O . ASP B 178 ? 0.6066 0.4744 0.8647 -0.2048 0.1977 -0.2093 173 ASP E O 2968 C CB . ASP B 178 ? 0.7353 0.5932 0.8947 -0.2356 0.2366 -0.2927 173 ASP E CB 2969 C CG . ASP B 178 ? 0.8169 0.6506 0.9156 -0.2444 0.2717 -0.3323 173 ASP E CG 2970 O OD1 . ASP B 178 ? 0.8526 0.6644 0.8964 -0.2301 0.2917 -0.3240 173 ASP E OD1 2971 O OD2 . ASP B 178 ? 0.8513 0.6825 0.9570 -0.2674 0.2835 -0.3732 173 ASP E OD2 2972 N N . LEU B 179 ? 0.5948 0.5226 0.7522 -0.1979 0.1448 -0.2054 174 LEU E N 2973 C CA . LEU B 179 ? 0.5389 0.4755 0.7539 -0.1946 0.1229 -0.1770 174 LEU E CA 2974 C C . LEU B 179 ? 0.5112 0.4598 0.6998 -0.1749 0.0991 -0.1463 174 LEU E C 2975 O O . LEU B 179 ? 0.5297 0.4892 0.6508 -0.1630 0.0922 -0.1455 174 LEU E O 2976 C CB . LEU B 179 ? 0.5276 0.4915 0.7565 -0.2096 0.1067 -0.1875 174 LEU E CB 2977 C CG . LEU B 179 ? 0.5612 0.5118 0.8203 -0.2349 0.1312 -0.2227 174 LEU E CG 2978 C CD1 . LEU B 179 ? 0.5531 0.5365 0.8219 -0.2525 0.1163 -0.2345 174 LEU E CD1 2979 C CD2 . LEU B 179 ? 0.5638 0.4667 0.8967 -0.2359 0.1585 -0.2131 174 LEU E CD2 2980 N N . TYR B 180 ? 0.4765 0.4206 0.7165 -0.1698 0.0866 -0.1216 175 TYR E N 2981 C CA . TYR B 180 ? 0.4583 0.4067 0.6827 -0.1549 0.0681 -0.0976 175 TYR E CA 2982 C C . TYR B 180 ? 0.4387 0.4165 0.6385 -0.1501 0.0375 -0.0851 175 TYR E C 2983 O O . TYR B 180 ? 0.4258 0.4168 0.6465 -0.1594 0.0299 -0.0867 175 TYR E O 2984 C CB . TYR B 180 ? 0.4396 0.3741 0.7319 -0.1521 0.0673 -0.0826 175 TYR E CB 2985 C CG . TYR B 180 ? 0.4629 0.3729 0.7887 -0.1544 0.1006 -0.0932 175 TYR E CG 2986 C CD1 . TYR B 180 ? 0.4810 0.3752 0.7776 -0.1501 0.1169 -0.0922 175 TYR E CD1 2987 C CD2 . TYR B 180 ? 0.4733 0.3709 0.8630 -0.1606 0.1220 -0.1040 175 TYR E CD2 2988 C CE1 . TYR B 180 ? 0.5069 0.3767 0.8381 -0.1549 0.1553 -0.1027 175 TYR E CE1 2989 C CE2 . TYR B 180 ? 0.4950 0.3725 0.9230 -0.1627 0.1581 -0.1157 175 TYR E CE2 2990 C CZ . TYR B 180 ? 0.5126 0.3779 0.9119 -0.1614 0.1753 -0.1155 175 TYR E CZ 2991 O OH . TYR B 180 ? 0.5432 0.3865 0.9837 -0.1660 0.2188 -0.1279 175 TYR E OH 2992 N N . THR B 181 ? 0.4421 0.4242 0.6000 -0.1357 0.0260 -0.0724 176 THR E N 2993 C CA . THR B 181 ? 0.4315 0.4392 0.5646 -0.1277 0.0016 -0.0607 176 THR E CA 2994 C C . THR B 181 ? 0.4268 0.4190 0.5491 -0.1154 -0.0062 -0.0434 176 THR E C 2995 O O . THR B 181 ? 0.4477 0.4167 0.5471 -0.1076 0.0083 -0.0427 176 THR E O 2996 C CB . THR B 181 ? 0.4547 0.4921 0.5304 -0.1175 -0.0037 -0.0702 176 THR E CB 2997 O OG1 . THR B 181 ? 0.4756 0.5344 0.5568 -0.1320 0.0015 -0.0951 176 THR E OG1 2998 C CG2 . THR B 181 ? 0.4400 0.5078 0.5032 -0.1084 -0.0247 -0.0593 176 THR E CG2 2999 N N . LEU B 182 ? 0.4119 0.4124 0.5451 -0.1145 -0.0258 -0.0308 177 LEU E N 3000 C CA . LEU B 182 ? 0.4180 0.4076 0.5288 -0.1040 -0.0346 -0.0208 177 LEU E CA 3001 C C . LEU B 182 ? 0.4146 0.4241 0.4996 -0.0978 -0.0515 -0.0122 177 LEU E C 3002 O O . LEU B 182 ? 0.4068 0.4399 0.4968 -0.1033 -0.0549 -0.0128 177 LEU E O 3003 C CB . LEU B 182 ? 0.4163 0.3877 0.5721 -0.1104 -0.0391 -0.0190 177 LEU E CB 3004 C CG . LEU B 182 ? 0.4052 0.3862 0.6030 -0.1152 -0.0597 -0.0110 177 LEU E CG 3005 C CD1 . LEU B 182 ? 0.4130 0.4025 0.5760 -0.1094 -0.0818 0.0006 177 LEU E CD1 3006 C CD2 . LEU B 182 ? 0.4053 0.3798 0.6584 -0.1191 -0.0635 -0.0157 177 LEU E CD2 3007 N N . SER B 183 ? 0.4246 0.4213 0.4832 -0.0881 -0.0566 -0.0069 178 SER E N 3008 C CA . SER B 183 ? 0.4300 0.4387 0.4636 -0.0823 -0.0685 0.0000 178 SER E CA 3009 C C . SER B 183 ? 0.4402 0.4257 0.4680 -0.0830 -0.0792 0.0012 178 SER E C 3010 O O . SER B 183 ? 0.4520 0.4165 0.5000 -0.0881 -0.0766 -0.0056 178 SER E O 3011 C CB . SER B 183 ? 0.4478 0.4726 0.4425 -0.0645 -0.0611 -0.0006 178 SER E CB 3012 O OG . SER B 183 ? 0.4802 0.4751 0.4520 -0.0520 -0.0485 -0.0009 178 SER E OG 3013 N N . SER B 184 ? 0.4428 0.4339 0.4454 -0.0803 -0.0899 0.0070 179 SER E N 3014 C CA . SER B 184 ? 0.4625 0.4355 0.4481 -0.0816 -0.1038 0.0036 179 SER E CA 3015 C C . SER B 184 ? 0.4811 0.4529 0.4162 -0.0706 -0.0976 0.0046 179 SER E C 3016 O O . SER B 184 ? 0.4698 0.4630 0.3947 -0.0667 -0.0912 0.0129 179 SER E O 3017 C CB . SER B 184 ? 0.4691 0.4481 0.4704 -0.0886 -0.1271 0.0120 179 SER E CB 3018 O OG . SER B 184 ? 0.5025 0.4712 0.4814 -0.0894 -0.1469 0.0048 179 SER E OG 3019 N N . SER B 185 ? 0.5071 0.4530 0.4165 -0.0672 -0.0949 -0.0066 180 SER E N 3020 C CA . SER B 185 ? 0.5356 0.4742 0.3975 -0.0551 -0.0845 -0.0083 180 SER E CA 3021 C C . SER B 185 ? 0.5759 0.4978 0.4069 -0.0636 -0.1012 -0.0180 180 SER E C 3022 O O . SER B 185 ? 0.5851 0.4995 0.4351 -0.0767 -0.1209 -0.0290 180 SER E O 3023 C CB . SER B 185 ? 0.5530 0.4672 0.4012 -0.0396 -0.0611 -0.0143 180 SER E CB 3024 O OG . SER B 185 ? 0.5863 0.4597 0.4304 -0.0486 -0.0585 -0.0312 180 SER E OG 3025 N N . VAL B 186 ? 0.6043 0.5252 0.3886 -0.0560 -0.0939 -0.0158 181 VAL E N 3026 C CA . VAL B 186 ? 0.6588 0.5597 0.3944 -0.0614 -0.1069 -0.0281 181 VAL E CA 3027 C C . VAL B 186 ? 0.6965 0.5795 0.3843 -0.0484 -0.0795 -0.0359 181 VAL E C 3028 O O . VAL B 186 ? 0.6791 0.5806 0.3696 -0.0352 -0.0576 -0.0237 181 VAL E O 3029 C CB . VAL B 186 ? 0.6759 0.5898 0.3920 -0.0662 -0.1299 -0.0119 181 VAL E CB 3030 C CG1 . VAL B 186 ? 0.6682 0.5971 0.3729 -0.0593 -0.1077 0.0097 181 VAL E CG1 3031 C CG2 . VAL B 186 ? 0.7480 0.6426 0.4020 -0.0697 -0.1498 -0.0268 181 VAL E CG2 3032 N N . THR B 187 ? 0.7536 0.6030 0.4042 -0.0528 -0.0797 -0.0602 182 THR E N 3033 C CA . THR B 187 ? 0.8025 0.6264 0.4086 -0.0396 -0.0492 -0.0717 182 THR E CA 3034 C C . THR B 187 ? 0.8753 0.6834 0.4113 -0.0476 -0.0592 -0.0853 182 THR E C 3035 O O . THR B 187 ? 0.9093 0.7075 0.4295 -0.0640 -0.0888 -0.1046 182 THR E O 3036 C CB . THR B 187 ? 0.8229 0.6059 0.4399 -0.0365 -0.0295 -0.0923 182 THR E CB 3037 O OG1 . THR B 187 ? 0.7706 0.5650 0.4388 -0.0254 -0.0199 -0.0749 182 THR E OG1 3038 C CG2 . THR B 187 ? 0.8807 0.6309 0.4536 -0.0187 0.0063 -0.1042 182 THR E CG2 3039 N N . VAL B 188 ? 0.9071 0.7167 0.4017 -0.0355 -0.0344 -0.0766 183 VAL E N 3040 C CA . VAL B 188 ? 0.9910 0.7800 0.4031 -0.0400 -0.0364 -0.0869 183 VAL E CA 3041 C C . VAL B 188 ? 1.0460 0.8073 0.4185 -0.0262 0.0079 -0.1030 183 VAL E C 3042 O O . VAL B 188 ? 1.0096 0.7759 0.4261 -0.0091 0.0373 -0.0995 183 VAL E O 3043 C CB . VAL B 188 ? 0.9955 0.8064 0.3842 -0.0403 -0.0436 -0.0558 183 VAL E CB 3044 C CG1 . VAL B 188 ? 0.9648 0.7942 0.3828 -0.0507 -0.0889 -0.0421 183 VAL E CG1 3045 C CG2 . VAL B 188 ? 0.9455 0.7863 0.3787 -0.0294 -0.0086 -0.0323 183 VAL E CG2 3046 N N . PRO B 189 ? 1.1418 0.8729 0.4273 -0.0309 0.0124 -0.1212 184 PRO E N 3047 C CA . PRO B 189 ? 1.2024 0.9069 0.4462 -0.0167 0.0613 -0.1350 184 PRO E CA 3048 C C . PRO B 189 ? 1.1784 0.9162 0.4423 -0.0015 0.0962 -0.1053 184 PRO E C 3049 O O . PRO B 189 ? 1.1807 0.9366 0.4250 -0.0084 0.0884 -0.0812 184 PRO E O 3050 C CB . PRO B 189 ? 1.3142 0.9811 0.4503 -0.0292 0.0515 -0.1612 184 PRO E CB 3051 C CG . PRO B 189 ? 1.3096 0.9825 0.4488 -0.0493 -0.0067 -0.1734 184 PRO E CG 3052 C CD . PRO B 189 ? 1.2048 0.9236 0.4269 -0.0481 -0.0295 -0.1364 184 PRO E CD 3053 N N . SER B 190 ? 1.1629 0.9081 0.4691 0.0198 0.1364 -0.1081 185 SER E N 3054 C CA . SER B 190 ? 1.1352 0.9243 0.4821 0.0347 0.1720 -0.0879 185 SER E CA 3055 C C . SER B 190 ? 1.2048 0.9844 0.4832 0.0270 0.1988 -0.0825 185 SER E C 3056 O O . SER B 190 ? 1.1776 0.9958 0.4887 0.0247 0.2154 -0.0598 185 SER E O 3057 C CB . SER B 190 ? 1.1388 0.9302 0.5256 0.0644 0.2112 -0.0993 185 SER E CB 3058 O OG . SER B 190 ? 1.0784 0.9375 0.5469 0.0801 0.2264 -0.0796 185 SER E OG 3059 N N . SER B 191 ? 1.3035 1.0284 0.4840 0.0220 0.2067 -0.1055 186 SER E N 3060 C CA . SER B 191 ? 1.3934 1.0970 0.4865 0.0164 0.2350 -0.1001 186 SER E CA 3061 C C . SER B 191 ? 1.3893 1.1030 0.4573 0.0010 0.2064 -0.0671 186 SER E C 3062 O O . SER B 191 ? 1.4433 1.1493 0.4661 -0.0011 0.2400 -0.0483 186 SER E O 3063 C CB . SER B 191 ? 1.5118 1.1519 0.4906 0.0122 0.2386 -0.1352 186 SER E CB 3064 O OG . SER B 191 ? 1.5179 1.1417 0.4685 -0.0031 0.1788 -0.1495 186 SER E OG 3065 N N . THR B 192 ? 1.3319 1.0578 0.4293 -0.0081 0.1496 -0.0592 187 THR E N 3066 C CA . THR B 192 ? 1.3383 1.0658 0.4078 -0.0181 0.1177 -0.0282 187 THR E CA 3067 C C . THR B 192 ? 1.2454 1.0169 0.4091 -0.0215 0.1222 0.0036 187 THR E C 3068 O O . THR B 192 ? 1.2598 1.0253 0.4032 -0.0275 0.1102 0.0330 187 THR E O 3069 C CB . THR B 192 ? 1.3385 1.0581 0.3897 -0.0260 0.0514 -0.0388 187 THR E CB 3070 O OG1 . THR B 192 ? 1.2331 0.9844 0.3902 -0.0283 0.0295 -0.0452 187 THR E OG1 3071 C CG2 . THR B 192 ? 1.4348 1.1143 0.3958 -0.0282 0.0430 -0.0786 187 THR E CG2 3072 N N . TRP B 193 ? 1.1572 0.9711 0.4211 -0.0161 0.1384 -0.0028 188 TRP E N 3073 C CA . TRP B 193 ? 1.0763 0.9370 0.4299 -0.0219 0.1444 0.0189 188 TRP E CA 3074 C C . TRP B 193 ? 1.0582 0.9586 0.4703 -0.0142 0.1960 0.0125 188 TRP E C 3075 O O . TRP B 193 ? 1.0520 0.9613 0.4824 0.0027 0.2095 -0.0087 188 TRP E O 3076 C CB . TRP B 193 ? 0.9829 0.8719 0.4131 -0.0230 0.1020 0.0164 188 TRP E CB 3077 C CG . TRP B 193 ? 0.9100 0.8430 0.4229 -0.0321 0.1035 0.0339 188 TRP E CG 3078 C CD1 . TRP B 193 ? 0.9039 0.8300 0.4203 -0.0459 0.0883 0.0568 188 TRP E CD1 3079 C CD2 . TRP B 193 ? 0.8425 0.8333 0.4453 -0.0275 0.1220 0.0272 188 TRP E CD2 3080 N NE1 . TRP B 193 ? 0.8399 0.8111 0.4430 -0.0547 0.1001 0.0609 188 TRP E NE1 3081 C CE2 . TRP B 193 ? 0.8010 0.8177 0.4580 -0.0443 0.1173 0.0415 188 TRP E CE2 3082 C CE3 . TRP B 193 ? 0.8208 0.8455 0.4642 -0.0082 0.1406 0.0099 188 TRP E CE3 3083 C CZ2 . TRP B 193 ? 0.7386 0.8191 0.4873 -0.0468 0.1271 0.0334 188 TRP E CZ2 3084 C CZ3 . TRP B 193 ? 0.7594 0.8521 0.4941 -0.0051 0.1468 0.0069 188 TRP E CZ3 3085 C CH2 . TRP B 193 ? 0.7180 0.8406 0.5038 -0.0266 0.1384 0.0159 188 TRP E CH2 3086 N N . PRO B 194 ? 1.0538 0.9798 0.5030 -0.0259 0.2267 0.0297 189 PRO E N 3087 C CA . PRO B 194 ? 1.0643 0.9757 0.5046 -0.0444 0.2203 0.0578 189 PRO E CA 3088 C C . PRO B 194 ? 1.1822 1.0288 0.5061 -0.0483 0.2414 0.0788 189 PRO E C 3089 O O . PRO B 194 ? 1.2057 1.0317 0.5179 -0.0593 0.2447 0.1073 189 PRO E O 3090 C CB . PRO B 194 ? 1.0125 0.9830 0.5573 -0.0561 0.2556 0.0581 189 PRO E CB 3091 C CG . PRO B 194 ? 1.0270 1.0279 0.5944 -0.0433 0.2987 0.0370 189 PRO E CG 3092 C CD . PRO B 194 ? 1.0339 1.0131 0.5571 -0.0204 0.2746 0.0189 189 PRO E CD 3093 N N . SER B 195 ? 1.2657 1.0751 0.4984 -0.0378 0.2568 0.0658 190 SER E N 3094 C CA . SER B 195 ? 1.3977 1.1434 0.5033 -0.0385 0.2793 0.0856 190 SER E CA 3095 C C . SER B 195 ? 1.4332 1.1426 0.4746 -0.0378 0.2257 0.1119 190 SER E C 3096 O O . SER B 195 ? 1.5110 1.1802 0.4908 -0.0394 0.2442 0.1463 190 SER E O 3097 C CB . SER B 195 ? 1.4863 1.1974 0.4975 -0.0272 0.3000 0.0597 190 SER E CB 3098 O OG . SER B 195 ? 1.4505 1.1671 0.4669 -0.0195 0.2539 0.0289 190 SER E OG 3099 N N . GLU B 196 ? 1.3819 1.1051 0.4419 -0.0336 0.1625 0.0969 191 GLU E N 3100 C CA . GLU B 196 ? 1.3969 1.1037 0.4266 -0.0306 0.1062 0.1184 191 GLU E CA 3101 C C . GLU B 196 ? 1.2768 1.0252 0.4296 -0.0385 0.0849 0.1271 191 GLU E C 3102 O O . GLU B 196 ? 1.1799 0.9711 0.4226 -0.0425 0.0801 0.1030 191 GLU E O 3103 C CB . GLU B 196 ? 1.4262 1.1253 0.4016 -0.0242 0.0500 0.0903 191 GLU E CB 3104 C CG . GLU B 196 ? 1.5462 1.2059 0.3988 -0.0186 0.0646 0.0688 191 GLU E CG 3105 C CD . GLU B 196 ? 1.6874 1.2963 0.4080 -0.0093 0.0768 0.1012 191 GLU E CD 3106 O OE1 . GLU B 196 ? 1.7244 1.3137 0.4338 -0.0108 0.1377 0.1276 191 GLU E OE1 3107 O OE2 . GLU B 196 ? 1.7725 1.3613 0.3986 -0.0001 0.0266 0.0991 191 GLU E OE2 3108 N N . THR B 197 ? 1.2938 1.0242 0.4428 -0.0380 0.0731 0.1624 192 THR E N 3109 C CA . THR B 197 ? 1.1983 0.9588 0.4546 -0.0461 0.0575 0.1711 192 THR E CA 3110 C C . THR B 197 ? 1.1161 0.9103 0.4311 -0.0444 0.0012 0.1478 192 THR E C 3111 O O . THR B 197 ? 1.1527 0.9371 0.4167 -0.0354 -0.0423 0.1382 192 THR E O 3112 C CB . THR B 197 ? 1.2602 0.9795 0.4845 -0.0406 0.0560 0.2157 192 THR E CB 3113 O OG1 . THR B 197 ? 1.2827 0.9855 0.5255 -0.0539 0.1205 0.2345 192 THR E OG1 3114 C CG2 . THR B 197 ? 1.1885 0.9281 0.4925 -0.0396 0.0127 0.2214 192 THR E CG2 3115 N N . VAL B 198 ? 1.0123 0.8467 0.4341 -0.0545 0.0042 0.1371 193 VAL E N 3116 C CA . VAL B 198 ? 0.9372 0.7978 0.4209 -0.0547 -0.0386 0.1205 193 VAL E CA 3117 C C . VAL B 198 ? 0.8800 0.7556 0.4453 -0.0633 -0.0364 0.1351 193 VAL E C 3118 O O . VAL B 198 ? 0.8424 0.7395 0.4612 -0.0747 -0.0018 0.1325 193 VAL E O 3119 C CB . VAL B 198 ? 0.8802 0.7691 0.3999 -0.0552 -0.0342 0.0865 193 VAL E CB 3120 C CG1 . VAL B 198 ? 0.8032 0.7149 0.3943 -0.0579 -0.0650 0.0735 193 VAL E CG1 3121 C CG2 . VAL B 198 ? 0.9449 0.8098 0.3853 -0.0479 -0.0383 0.0675 193 VAL E CG2 3122 N N . THR B 199 ? 0.8792 0.7464 0.4567 -0.0579 -0.0733 0.1471 194 THR E N 3123 C CA . THR B 199 ? 0.8450 0.7143 0.4898 -0.0637 -0.0695 0.1624 194 THR E CA 3124 C C . THR B 199 ? 0.7922 0.6822 0.4935 -0.0612 -0.1095 0.1491 194 THR E C 3125 O O . THR B 199 ? 0.8205 0.7064 0.4954 -0.0496 -0.1487 0.1495 194 THR E O 3126 C CB . THR B 199 ? 0.9307 0.7536 0.5272 -0.0533 -0.0640 0.2030 194 THR E CB 3127 O OG1 . THR B 199 ? 1.0009 0.7960 0.5299 -0.0553 -0.0227 0.2165 194 THR E OG1 3128 C CG2 . THR B 199 ? 0.9034 0.7181 0.5712 -0.0610 -0.0472 0.2178 194 THR E CG2 3129 N N . CYS B 200 ? 0.7230 0.6377 0.5026 -0.0727 -0.0995 0.1350 195 CYS E N 3130 C CA . CYS B 200 ? 0.6839 0.6131 0.5193 -0.0715 -0.1281 0.1241 195 CYS E CA 3131 C C . CYS B 200 ? 0.6946 0.6060 0.5643 -0.0673 -0.1312 0.1480 195 CYS E C 3132 O O . CYS B 200 ? 0.7007 0.5967 0.5851 -0.0751 -0.0992 0.1611 195 CYS E O 3133 C CB . CYS B 200 ? 0.6200 0.5783 0.5088 -0.0822 -0.1162 0.0973 195 CYS E CB 3134 S SG . CYS B 200 ? 0.5942 0.5648 0.5478 -0.0970 -0.0863 0.0955 195 CYS E SG 3135 N N . ASN B 201 ? 0.6987 0.6128 0.5858 -0.0546 -0.1681 0.1516 196 ASN E N 3136 C CA . ASN B 201 ? 0.7158 0.6144 0.6408 -0.0432 -0.1749 0.1751 196 ASN E CA 3137 C C . ASN B 201 ? 0.6480 0.5711 0.6608 -0.0517 -0.1771 0.1522 196 ASN E C 3138 O O . ASN B 201 ? 0.6208 0.5703 0.6546 -0.0541 -0.1988 0.1285 196 ASN E O 3139 C CB . ASN B 201 ? 0.7846 0.6767 0.6670 -0.0174 -0.2178 0.1964 196 ASN E CB 3140 C CG . ASN B 201 ? 0.8507 0.7269 0.6294 -0.0117 -0.2221 0.2044 196 ASN E CG 3141 O OD1 . ASN B 201 ? 0.8633 0.7595 0.6088 -0.0094 -0.2543 0.1845 196 ASN E OD1 3142 N ND2 . ASN B 201 ? 0.8981 0.7361 0.6266 -0.0122 -0.1847 0.2299 196 ASN E ND2 3143 N N . VAL B 202 ? 0.6292 0.5395 0.6909 -0.0592 -0.1484 0.1560 197 VAL E N 3144 C CA . VAL B 202 ? 0.5745 0.5013 0.7120 -0.0675 -0.1428 0.1342 197 VAL E CA 3145 C C . VAL B 202 ? 0.5957 0.5036 0.7862 -0.0532 -0.1439 0.1530 197 VAL E C 3146 O O . VAL B 202 ? 0.6348 0.5065 0.8196 -0.0494 -0.1216 0.1763 197 VAL E O 3147 C CB . VAL B 202 ? 0.5367 0.4697 0.6887 -0.0906 -0.1064 0.1118 197 VAL E CB 3148 C CG1 . VAL B 202 ? 0.4957 0.4398 0.7106 -0.0981 -0.0980 0.0892 197 VAL E CG1 3149 C CG2 . VAL B 202 ? 0.5193 0.4740 0.6251 -0.0974 -0.1064 0.0961 197 VAL E CG2 3150 N N . ALA B 203 ? 0.5722 0.5029 0.8198 -0.0448 -0.1657 0.1424 198 ALA E N 3151 C CA . ALA B 203 ? 0.5911 0.5104 0.9024 -0.0271 -0.1664 0.1577 198 ALA E CA 3152 C C . ALA B 203 ? 0.5379 0.4677 0.9227 -0.0425 -0.1414 0.1280 198 ALA E C 3153 O O . ALA B 203 ? 0.4917 0.4483 0.8855 -0.0568 -0.1431 0.0998 198 ALA E O 3154 C CB . ALA B 203 ? 0.6250 0.5688 0.9489 0.0016 -0.2163 0.1725 198 ALA E CB 3155 N N . HIS B 204 ? 0.5538 0.4541 0.9831 -0.0397 -0.1123 0.1348 199 HIS E N 3156 C CA . HIS B 204 ? 0.5238 0.4268 1.0220 -0.0504 -0.0851 0.1083 199 HIS E CA 3157 C C . HIS B 204 ? 0.5641 0.4478 1.1306 -0.0240 -0.0821 0.1288 199 HIS E C 3158 O O . HIS B 204 ? 0.6000 0.4378 1.1744 -0.0233 -0.0496 0.1400 199 HIS E O 3159 C CB . HIS B 204 ? 0.5093 0.3926 0.9863 -0.0793 -0.0433 0.0857 199 HIS E CB 3160 C CG . HIS B 204 ? 0.4870 0.3717 1.0130 -0.0927 -0.0141 0.0538 199 HIS E CG 3161 N ND1 . HIS B 204 ? 0.5093 0.3607 1.0635 -0.1032 0.0251 0.0417 199 HIS E ND1 3162 C CD2 . HIS B 204 ? 0.4539 0.3635 1.0003 -0.0984 -0.0136 0.0303 199 HIS E CD2 3163 C CE1 . HIS B 204 ? 0.4919 0.3500 1.0766 -0.1134 0.0462 0.0117 199 HIS E CE1 3164 N NE2 . HIS B 204 ? 0.4589 0.3507 1.0383 -0.1103 0.0250 0.0064 199 HIS E NE2 3165 N N . PRO B 205 ? 0.5646 0.4844 1.1852 -0.0012 -0.1160 0.1330 200 PRO E N 3166 C CA . PRO B 205 ? 0.6072 0.5206 1.2995 0.0334 -0.1227 0.1562 200 PRO E CA 3167 C C . PRO B 205 ? 0.6131 0.4925 1.3717 0.0287 -0.0714 0.1432 200 PRO E C 3168 O O . PRO B 205 ? 0.6657 0.5103 1.4589 0.0561 -0.0605 0.1699 200 PRO E O 3169 C CB . PRO B 205 ? 0.5846 0.5640 1.3393 0.0462 -0.1647 0.1434 200 PRO E CB 3170 C CG . PRO B 205 ? 0.5582 0.5648 1.2434 0.0266 -0.1921 0.1296 200 PRO E CG 3171 C CD . PRO B 205 ? 0.5312 0.5031 1.1512 -0.0063 -0.1516 0.1148 200 PRO E CD 3172 N N . ALA B 206 ? 0.5718 0.4566 1.3425 -0.0033 -0.0384 0.1031 201 ALA E N 3173 C CA . ALA B 206 ? 0.5844 0.4368 1.4093 -0.0116 0.0131 0.0827 201 ALA E CA 3174 C C . ALA B 206 ? 0.6357 0.4242 1.4305 -0.0165 0.0473 0.0950 201 ALA E C 3175 O O . ALA B 206 ? 0.6783 0.4282 1.5295 -0.0006 0.0765 0.1022 201 ALA E O 3176 C CB . ALA B 206 ? 0.5417 0.4072 1.3564 -0.0456 0.0408 0.0389 201 ALA E CB 3177 N N . SER B 207 ? 0.6389 0.4156 1.3518 -0.0383 0.0468 0.0963 202 SER E N 3178 C CA . SER B 207 ? 0.6901 0.4078 1.3776 -0.0494 0.0825 0.1047 202 SER E CA 3179 C C . SER B 207 ? 0.7512 0.4374 1.4077 -0.0202 0.0648 0.1572 202 SER E C 3180 O O . SER B 207 ? 0.8054 0.4343 1.4410 -0.0282 0.0990 0.1699 202 SER E O 3181 C CB . SER B 207 ? 0.6628 0.3895 1.2902 -0.0913 0.0980 0.0724 202 SER E CB 3182 O OG . SER B 207 ? 0.6342 0.3989 1.2001 -0.0916 0.0600 0.0840 202 SER E OG 3183 N N . SER B 208 ? 0.7522 0.4737 1.4051 0.0128 0.0139 0.1858 203 SER E N 3184 C CA . SER B 208 ? 0.8170 0.5159 1.4190 0.0445 -0.0123 0.2370 203 SER E CA 3185 C C . SER B 208 ? 0.8273 0.5085 1.3368 0.0199 -0.0037 0.2423 203 SER E C 3186 O O . SER B 208 ? 0.8976 0.5219 1.3665 0.0299 0.0157 0.2774 203 SER E O 3187 C CB . SER B 208 ? 0.9021 0.5352 1.5411 0.0784 0.0133 0.2742 203 SER E CB 3188 O OG . SER B 208 ? 0.8918 0.5462 1.6271 0.1026 0.0088 0.2665 203 SER E OG 3189 N N . THR B 209 ? 0.7626 0.4911 1.2418 -0.0103 -0.0150 0.2084 204 THR E N 3190 C CA . THR B 209 ? 0.7637 0.4892 1.1690 -0.0345 -0.0062 0.2060 204 THR E CA 3191 C C . THR B 209 ? 0.7622 0.5216 1.1042 -0.0191 -0.0539 0.2225 204 THR E C 3192 O O . THR B 209 ? 0.7192 0.5267 1.0784 -0.0108 -0.0916 0.2092 204 THR E O 3193 C CB . THR B 209 ? 0.7011 0.4565 1.1140 -0.0755 0.0153 0.1558 204 THR E CB 3194 O OG1 . THR B 209 ? 0.7141 0.4385 1.1793 -0.0926 0.0590 0.1339 204 THR E OG1 3195 C CG2 . THR B 209 ? 0.6965 0.4617 1.0454 -0.0982 0.0226 0.1504 204 THR E CG2 3196 N N . LYS B 210 ? 0.8183 0.5479 1.0879 -0.0169 -0.0472 0.2497 205 LYS E N 3197 C CA . LYS B 210 ? 0.8265 0.5821 1.0205 -0.0113 -0.0808 0.2571 205 LYS E CA 3198 C C . LYS B 210 ? 0.8361 0.5742 0.9775 -0.0385 -0.0440 0.2528 205 LYS E C 3199 O O . LYS B 210 ? 0.9035 0.5878 1.0253 -0.0397 -0.0073 0.2779 205 LYS E O 3200 C CB . LYS B 210 ? 0.9144 0.6498 1.0599 0.0306 -0.1156 0.3037 205 LYS E CB 3201 C CG . LYS B 210 ? 0.9574 0.6785 1.1626 0.0666 -0.1301 0.3285 205 LYS E CG 3202 C CD . LYS B 210 ? 1.0095 0.7598 1.1816 0.1077 -0.1940 0.3533 205 LYS E CD 3203 C CE . LYS B 210 ? 0.9386 0.7678 1.1438 0.0981 -0.2403 0.3123 205 LYS E CE 3204 N NZ . LYS B 210 ? 0.9949 0.8589 1.1941 0.1390 -0.3038 0.3317 205 LYS E NZ 3205 N N . VAL B 211 ? 0.7800 0.5626 0.9034 -0.0595 -0.0504 0.2213 206 VAL E N 3206 C CA . VAL B 211 ? 0.7845 0.5656 0.8702 -0.0835 -0.0182 0.2128 206 VAL E CA 3207 C C . VAL B 211 ? 0.7790 0.5865 0.7974 -0.0773 -0.0433 0.2117 206 VAL E C 3208 O O . VAL B 211 ? 0.7324 0.5795 0.7556 -0.0737 -0.0762 0.1908 206 VAL E O 3209 C CB . VAL B 211 ? 0.7202 0.5351 0.8574 -0.1165 0.0063 0.1687 206 VAL E CB 3210 C CG1 . VAL B 211 ? 0.7191 0.5535 0.8268 -0.1371 0.0296 0.1557 206 VAL E CG1 3211 C CG2 . VAL B 211 ? 0.7358 0.5182 0.9331 -0.1297 0.0409 0.1629 206 VAL E CG2 3212 N N . ASP B 212 ? 0.8351 0.6150 0.7911 -0.0776 -0.0217 0.2328 207 ASP E N 3213 C CA . ASP B 212 ? 0.8409 0.6402 0.7310 -0.0756 -0.0329 0.2275 207 ASP E CA 3214 C C . ASP B 212 ? 0.8012 0.6276 0.7121 -0.1041 0.0049 0.1998 207 ASP E C 3215 O O . ASP B 212 ? 0.8150 0.6260 0.7594 -0.1237 0.0464 0.1993 207 ASP E O 3216 C CB . ASP B 212 ? 0.9452 0.6961 0.7451 -0.0540 -0.0327 0.2690 207 ASP E CB 3217 C CG . ASP B 212 ? 0.9897 0.7258 0.7724 -0.0206 -0.0787 0.2957 207 ASP E CG 3218 O OD1 . ASP B 212 ? 0.9354 0.7136 0.7533 -0.0142 -0.1223 0.2742 207 ASP E OD1 3219 O OD2 . ASP B 212 ? 1.0888 0.7715 0.8238 0.0008 -0.0704 0.3390 207 ASP E OD2 3220 N N . LYS B 213 ? 0.7532 0.6230 0.6533 -0.1065 -0.0092 0.1738 208 LYS E N 3221 C CA . LYS B 213 ? 0.7213 0.6264 0.6402 -0.1259 0.0210 0.1493 208 LYS E CA 3222 C C . LYS B 213 ? 0.7398 0.6531 0.5952 -0.1163 0.0195 0.1483 208 LYS E C 3223 O O . LYS B 213 ? 0.7108 0.6391 0.5444 -0.1035 -0.0114 0.1368 208 LYS E O 3224 C CB . LYS B 213 ? 0.6428 0.5982 0.6254 -0.1359 0.0110 0.1137 208 LYS E CB 3225 C CG . LYS B 213 ? 0.6220 0.6144 0.6550 -0.1598 0.0437 0.0892 208 LYS E CG 3226 C CD . LYS B 213 ? 0.6267 0.6004 0.7139 -0.1783 0.0613 0.0854 208 LYS E CD 3227 C CE . LYS B 213 ? 0.6530 0.6333 0.7781 -0.2071 0.1065 0.0733 208 LYS E CE 3228 N NZ . LYS B 213 ? 0.6725 0.6173 0.8436 -0.2244 0.1263 0.0709 208 LYS E NZ 3229 N N . LYS B 214 ? 0.7916 0.6894 0.6187 -0.1240 0.0590 0.1592 209 LYS E N 3230 C CA . LYS B 214 ? 0.8258 0.7252 0.5897 -0.1155 0.0679 0.1580 209 LYS E CA 3231 C C . LYS B 214 ? 0.7595 0.7210 0.5700 -0.1213 0.0751 0.1229 209 LYS E C 3232 O O . LYS B 214 ? 0.7206 0.7209 0.6011 -0.1389 0.0970 0.1054 209 LYS E O 3233 C CB . LYS B 214 ? 0.9147 0.7710 0.6306 -0.1213 0.1154 0.1837 209 LYS E CB 3234 C CG . LYS B 214 ? 0.9620 0.8167 0.6096 -0.1135 0.1337 0.1805 209 LYS E CG 3235 C CD . LYS B 214 ? 1.0795 0.8662 0.6121 -0.0982 0.1419 0.2161 209 LYS E CD 3236 C CE . LYS B 214 ? 1.1550 0.9207 0.6424 -0.1060 0.2030 0.2232 209 LYS E CE 3237 N NZ . LYS B 214 ? 1.1593 0.9230 0.7153 -0.1321 0.2585 0.2284 209 LYS E NZ 3238 N N . ILE B 215 ? 0.7525 0.7236 0.5249 -0.1051 0.0556 0.1115 210 ILE E N 3239 C CA . ILE B 215 ? 0.7033 0.7269 0.5131 -0.1015 0.0612 0.0837 210 ILE E CA 3240 C C . ILE B 215 ? 0.7513 0.7812 0.5394 -0.1023 0.1035 0.0826 210 ILE E C 3241 O O . ILE B 215 ? 0.8168 0.8101 0.5278 -0.0918 0.1104 0.0913 210 ILE E O 3242 C CB . ILE B 215 ? 0.6794 0.7025 0.4666 -0.0833 0.0273 0.0710 210 ILE E CB 3243 C CG1 . ILE B 215 ? 0.6520 0.6594 0.4539 -0.0841 -0.0094 0.0750 210 ILE E CG1 3244 C CG2 . ILE B 215 ? 0.6316 0.7050 0.4634 -0.0741 0.0321 0.0482 210 ILE E CG2 3245 C CD1 . ILE B 215 ? 0.6026 0.6345 0.4757 -0.0971 -0.0090 0.0709 210 ILE E CD1 3246 N N . VAL B 216 ? 0.7267 0.8051 0.5854 -0.1168 0.1334 0.0689 211 VAL E N 3247 C CA . VAL B 216 ? 0.7660 0.8619 0.6289 -0.1218 0.1817 0.0643 211 VAL E CA 3248 C C . VAL B 216 ? 0.7135 0.8861 0.6395 -0.1096 0.1805 0.0347 211 VAL E C 3249 O O . VAL B 216 ? 0.6521 0.8685 0.6313 -0.1060 0.1507 0.0194 211 VAL E O 3250 C CB . VAL B 216 ? 0.7963 0.8871 0.6990 -0.1518 0.2263 0.0716 211 VAL E CB 3251 C CG1 . VAL B 216 ? 0.8523 0.8626 0.6940 -0.1564 0.2235 0.1065 211 VAL E CG1 3252 C CG2 . VAL B 216 ? 0.7284 0.8895 0.7420 -0.1719 0.2251 0.0434 211 VAL E CG2 3253 N N . PRO B 217 ? 0.7484 0.9360 0.6649 -0.0994 0.2136 0.0278 212 PRO E N 3254 C CA . PRO B 217 ? 0.7072 0.9726 0.6908 -0.0813 0.2134 0.0023 212 PRO E CA 3255 C C . PRO B 217 ? 0.6636 1.0145 0.7583 -0.0993 0.2209 -0.0197 212 PRO E C 3256 O O . PRO B 217 ? 0.6838 1.0335 0.8102 -0.1315 0.2512 -0.0192 212 PRO E O 3257 C CB . PRO B 217 ? 0.7669 1.0246 0.7213 -0.0707 0.2592 0.0007 212 PRO E CB 3258 C CG . PRO B 217 ? 0.8397 1.0037 0.6807 -0.0746 0.2664 0.0245 212 PRO E CG 3259 C CD . PRO B 217 ? 0.8354 0.9653 0.6684 -0.0975 0.2492 0.0436 212 PRO E CD 3260 N N . ARG B 218 ? 0.6168 1.0409 0.7683 -0.0775 0.1954 -0.0399 213 ARG E N 3261 C CA . ARG B 218 ? 0.5775 1.0983 0.8355 -0.0909 0.1916 -0.0679 213 ARG E CA 3262 C C . ARG B 218 ? 0.5994 1.1847 0.9308 -0.1006 0.2388 -0.0865 213 ARG E C 3263 O O . ARG B 218 ? 0.6391 1.2073 0.9415 -0.0829 0.2697 -0.0795 213 ARG E O 3264 C CB . ARG B 218 ? 0.5340 1.1125 0.8158 -0.0562 0.1455 -0.0801 213 ARG E CB 3265 C CG . ARG B 218 ? 0.5149 1.0340 0.7335 -0.0481 0.1049 -0.0647 213 ARG E CG 3266 C CD . ARG B 218 ? 0.4897 1.0559 0.7204 -0.0119 0.0667 -0.0724 213 ARG E CD 3267 N NE . ARG B 218 ? 0.4663 1.0170 0.6849 -0.0233 0.0344 -0.0733 213 ARG E NE 3268 C CZ . ARG B 218 ? 0.4457 1.0528 0.7210 -0.0468 0.0224 -0.0964 213 ARG E CZ 3269 N NH1 . ARG B 218 ? 0.4330 1.0142 0.6861 -0.0549 -0.0020 -0.0966 213 ARG E NH1 3270 N NH2 . ARG B 218 ? 0.4454 1.1359 0.8031 -0.0644 0.0372 -0.1234 213 ARG E NH2 3271 N N . ASP B 219 ? 0.5800 1.2395 1.0096 -0.1312 0.2466 -0.1141 214 ASP E N 3272 C CA . ASP B 219 ? 0.5885 1.3410 1.1245 -0.1441 0.2860 -0.1436 214 ASP E CA 3273 C C . ASP B 219 ? 0.6569 1.3597 1.1741 -0.1644 0.3581 -0.1310 214 ASP E C 3274 O O . ASP B 219 ? 0.7042 1.3219 1.1203 -0.1464 0.3744 -0.1016 214 ASP E O 3275 C CB . ASP B 219 ? 0.5587 1.4125 1.1516 -0.0982 0.2590 -0.1627 214 ASP E CB 3276 C CG . ASP B 219 ? 0.5946 1.4153 1.1383 -0.0604 0.2863 -0.1450 214 ASP E CG 3277 O OD1 . ASP B 219 ? 0.6321 1.4656 1.2103 -0.0726 0.3440 -0.1515 214 ASP E OD1 3278 O OD2 . ASP B 219 ? 0.5868 1.3684 1.0607 -0.0192 0.2540 -0.1272 214 ASP E OD2 3279 N N . PCA C 1 ? 0.6736 0.6429 0.7364 -0.0227 0.0756 0.4114 1 PCA H N 3280 C CA . PCA C 1 ? 0.6549 0.5835 0.7524 -0.0361 0.0783 0.3751 1 PCA H CA 3281 C CB . PCA C 1 ? 0.6121 0.5729 0.6676 -0.0349 0.0771 0.3263 1 PCA H CB 3282 C CG . PCA C 1 ? 0.6064 0.6098 0.6072 -0.0191 0.0707 0.3257 1 PCA H CG 3283 C CD . PCA C 1 ? 0.6477 0.6584 0.6566 -0.0137 0.0700 0.3818 1 PCA H CD 3284 O OE . PCA C 1 ? 0.6601 0.7108 0.6330 -0.0027 0.0643 0.3972 1 PCA H OE 3285 C C . PCA C 1 ? 0.6459 0.5077 0.7783 -0.0301 0.0678 0.3491 1 PCA H C 3286 O O . PCA C 1 ? 0.6435 0.4917 0.7661 -0.0123 0.0577 0.3482 1 PCA H O 3287 N N . VAL C 2 ? 0.6420 0.4673 0.8150 -0.0447 0.0701 0.3254 2 VAL H N 3288 C CA . VAL C 2 ? 0.6352 0.4023 0.8387 -0.0397 0.0609 0.2910 2 VAL H CA 3289 C C . VAL C 2 ? 0.5864 0.3625 0.7492 -0.0264 0.0506 0.2412 2 VAL H C 3290 O O . VAL C 2 ? 0.5534 0.3602 0.6908 -0.0318 0.0514 0.2158 2 VAL H O 3291 C CB . VAL C 2 ? 0.6495 0.3840 0.9055 -0.0615 0.0645 0.2727 2 VAL H CB 3292 C CG1 . VAL C 2 ? 0.6470 0.3307 0.9256 -0.0550 0.0544 0.2266 2 VAL H CG1 3293 C CG2 . VAL C 2 ? 0.7004 0.4174 1.0083 -0.0766 0.0754 0.3247 2 VAL H CG2 3294 N N . GLN C 3 ? 0.5823 0.3325 0.7442 -0.0083 0.0419 0.2303 3 GLN H N 3295 C CA . GLN C 3 ? 0.5427 0.3002 0.6714 0.0047 0.0329 0.1894 3 GLN H CA 3296 C C . GLN C 3 ? 0.5383 0.2580 0.6919 0.0049 0.0285 0.1469 3 GLN H C 3297 O O . GLN C 3 ? 0.5690 0.2461 0.7642 0.0060 0.0290 0.1476 3 GLN H O 3298 C CB . GLN C 3 ? 0.5424 0.3087 0.6515 0.0247 0.0266 0.2057 3 GLN H CB 3299 C CG . GLN C 3 ? 0.5373 0.3558 0.6055 0.0263 0.0268 0.2312 3 GLN H CG 3300 C CD . GLN C 3 ? 0.5448 0.3753 0.6030 0.0441 0.0188 0.2527 3 GLN H CD 3301 O OE1 . GLN C 3 ? 0.5754 0.3800 0.6669 0.0530 0.0182 0.2790 3 GLN H OE1 3302 N NE2 . GLN C 3 ? 0.5227 0.3930 0.5395 0.0493 0.0122 0.2410 3 GLN H NE2 3303 N N . LEU C 4 ? 0.5048 0.2429 0.6332 0.0044 0.0246 0.1100 4 LEU H N 3304 C CA . LEU C 4 ? 0.4965 0.2164 0.6321 0.0087 0.0187 0.0670 4 LEU H CA 3305 C C . LEU C 4 ? 0.4987 0.2049 0.6294 0.0296 0.0149 0.0653 4 LEU H C 3306 O O . LEU C 4 ? 0.4872 0.2141 0.5927 0.0399 0.0136 0.0856 4 LEU H O 3307 C CB . LEU C 4 ? 0.4626 0.2173 0.5655 0.0075 0.0155 0.0408 4 LEU H CB 3308 C CG . LEU C 4 ? 0.4607 0.2266 0.5764 -0.0083 0.0150 0.0189 4 LEU H CG 3309 C CD1 . LEU C 4 ? 0.4795 0.2449 0.6239 -0.0275 0.0222 0.0425 4 LEU H CD1 3310 C CD2 . LEU C 4 ? 0.4263 0.2310 0.5079 -0.0038 0.0131 0.0071 4 LEU H CD2 3311 N N . LYS C 5 ? 0.5177 0.1921 0.6747 0.0358 0.0134 0.0397 5 LYS H N 3312 C CA . LYS C 5 ? 0.5228 0.1854 0.6824 0.0576 0.0119 0.0377 5 LYS H CA 3313 C C . LYS C 5 ? 0.4880 0.1780 0.6138 0.0676 0.0078 0.0069 5 LYS H C 3314 O O . LYS C 5 ? 0.4761 0.1753 0.5941 0.0609 0.0059 -0.0252 5 LYS H O 3315 C CB . LYS C 5 ? 0.5695 0.1838 0.7782 0.0619 0.0146 0.0249 5 LYS H CB 3316 C CG . LYS C 5 ? 0.6112 0.1936 0.8622 0.0517 0.0197 0.0616 5 LYS H CG 3317 C CD . LYS C 5 ? 0.6626 0.1908 0.9705 0.0491 0.0226 0.0388 5 LYS H CD 3318 C CE . LYS C 5 ? 0.7108 0.1995 1.0698 0.0472 0.0288 0.0844 5 LYS H CE 3319 N NZ . LYS C 5 ? 0.7320 0.2029 1.1088 0.0754 0.0301 0.1053 5 LYS H NZ 3320 N N . GLU C 6 ? 0.4680 0.1766 0.5747 0.0825 0.0062 0.0207 6 GLU H N 3321 C CA . GLU C 6 ? 0.4416 0.1751 0.5239 0.0930 0.0040 -0.0010 6 GLU H CA 3322 C C . GLU C 6 ? 0.4505 0.1758 0.5493 0.1137 0.0057 -0.0060 6 GLU H C 3323 O O . GLU C 6 ? 0.4652 0.1797 0.5827 0.1232 0.0061 0.0194 6 GLU H O 3324 C CB . GLU C 6 ? 0.4116 0.1794 0.4611 0.0910 0.0009 0.0154 6 GLU H CB 3325 C CG . GLU C 6 ? 0.4014 0.1815 0.4348 0.0742 0.0010 0.0177 6 GLU H CG 3326 C CD . GLU C 6 ? 0.3784 0.1885 0.3828 0.0732 -0.0011 0.0252 6 GLU H CD 3327 O OE1 . GLU C 6 ? 0.3732 0.1963 0.3689 0.0825 -0.0036 0.0217 6 GLU H OE1 3328 O OE2 . GLU C 6 ? 0.3779 0.1996 0.3710 0.0627 0.0001 0.0328 6 GLU H OE2 3329 N N . SER C 7 ? 0.4433 0.1800 0.5347 0.1217 0.0072 -0.0376 7 SER H N 3330 C CA . SER C 7 ? 0.4573 0.1943 0.5630 0.1428 0.0111 -0.0486 7 SER H CA 3331 C C . SER C 7 ? 0.4273 0.2072 0.5047 0.1495 0.0115 -0.0549 7 SER H C 3332 O O . SER C 7 ? 0.4100 0.2096 0.4641 0.1415 0.0106 -0.0719 7 SER H O 3333 C CB . SER C 7 ? 0.4930 0.2038 0.6221 0.1465 0.0152 -0.0866 7 SER H CB 3334 O OG . SER C 7 ? 0.5147 0.2218 0.6641 0.1696 0.0213 -0.0985 7 SER H OG 3335 N N . GLY C 8 ? 0.4213 0.2188 0.5037 0.1635 0.0125 -0.0379 8 GLY H N 3336 C CA . GLY C 8 ? 0.3983 0.2370 0.4604 0.1673 0.0136 -0.0390 8 GLY H CA 3337 C C . GLY C 8 ? 0.3913 0.2524 0.4634 0.1772 0.0123 -0.0144 8 GLY H C 3338 O O . GLY C 8 ? 0.4053 0.2537 0.4956 0.1813 0.0085 0.0074 8 GLY H O 3339 N N . PRO C 9 ? 0.3744 0.2735 0.4371 0.1806 0.0150 -0.0153 9 PRO H N 3340 C CA . PRO C 9 ? 0.3684 0.2976 0.4460 0.1897 0.0143 0.0038 9 PRO H CA 3341 C C . PRO C 9 ? 0.3546 0.2927 0.4269 0.1761 0.0032 0.0299 9 PRO H C 3342 O O . PRO C 9 ? 0.3421 0.2770 0.3922 0.1583 -0.0012 0.0303 9 PRO H O 3343 C CB . PRO C 9 ? 0.3549 0.3223 0.4225 0.1912 0.0215 -0.0048 9 PRO H CB 3344 C CG . PRO C 9 ? 0.3449 0.3047 0.3849 0.1767 0.0210 -0.0169 9 PRO H CG 3345 C CD . PRO C 9 ? 0.3619 0.2815 0.4013 0.1746 0.0189 -0.0316 9 PRO H CD 3346 N N . GLY C 10 ? 0.3653 0.3174 0.4589 0.1855 -0.0014 0.0500 10 GLY H N 3347 C CA . GLY C 10 ? 0.3566 0.3311 0.4450 0.1734 -0.0134 0.0714 10 GLY H CA 3348 C C . GLY C 10 ? 0.3392 0.3533 0.4280 0.1655 -0.0148 0.0715 10 GLY H C 3349 O O . GLY C 10 ? 0.3359 0.3651 0.4149 0.1487 -0.0243 0.0782 10 GLY H O 3350 N N . LEU C 11 ? 0.3348 0.3666 0.4360 0.1764 -0.0043 0.0626 11 LEU H N 3351 C CA . LEU C 11 ? 0.3194 0.3929 0.4307 0.1696 -0.0037 0.0684 11 LEU H CA 3352 C C . LEU C 11 ? 0.3127 0.3956 0.4173 0.1720 0.0103 0.0554 11 LEU H C 3353 O O . LEU C 11 ? 0.3232 0.4028 0.4292 0.1894 0.0211 0.0419 11 LEU H O 3354 C CB . LEU C 11 ? 0.3267 0.4368 0.4718 0.1838 -0.0064 0.0840 11 LEU H CB 3355 C CG . LEU C 11 ? 0.3176 0.4785 0.4854 0.1750 -0.0121 0.0976 11 LEU H CG 3356 C CD1 . LEU C 11 ? 0.3286 0.5281 0.5343 0.1962 -0.0112 0.1110 11 LEU H CD1 3357 C CD2 . LEU C 11 ? 0.3069 0.4828 0.4722 0.1639 -0.0018 0.0916 11 LEU H CD2 3358 N N . VAL C 12 ? 0.2976 0.3934 0.3957 0.1544 0.0099 0.0597 12 VAL H N 3359 C CA . VAL C 12 ? 0.2965 0.4076 0.3873 0.1552 0.0225 0.0556 12 VAL H CA 3360 C C . VAL C 12 ? 0.2892 0.4401 0.4023 0.1447 0.0252 0.0732 12 VAL H C 3361 O O . VAL C 12 ? 0.2804 0.4291 0.4025 0.1257 0.0150 0.0816 12 VAL H O 3362 C CB . VAL C 12 ? 0.2905 0.3721 0.3538 0.1430 0.0211 0.0482 12 VAL H CB 3363 C CG1 . VAL C 12 ? 0.2908 0.3955 0.3465 0.1448 0.0328 0.0502 12 VAL H CG1 3364 C CG2 . VAL C 12 ? 0.2993 0.3439 0.3446 0.1496 0.0184 0.0313 12 VAL H CG2 3365 N N . GLN C 13 ? 0.2952 0.4838 0.4180 0.1561 0.0397 0.0771 13 GLN H N 3366 C CA . GLN C 13 ? 0.2911 0.5228 0.4403 0.1457 0.0456 0.0979 13 GLN H CA 3367 C C . GLN C 13 ? 0.2815 0.4997 0.4238 0.1250 0.0449 0.1083 13 GLN H C 3368 O O . GLN C 13 ? 0.2839 0.4814 0.3984 0.1279 0.0481 0.1011 13 GLN H O 3369 C CB . GLN C 13 ? 0.3046 0.5836 0.4596 0.1644 0.0648 0.1003 13 GLN H CB 3370 C CG . GLN C 13 ? 0.3172 0.6140 0.4857 0.1898 0.0700 0.0885 13 GLN H CG 3371 C CD . GLN C 13 ? 0.3123 0.6362 0.5206 0.1872 0.0626 0.1037 13 GLN H CD 3372 O OE1 . GLN C 13 ? 0.3108 0.6786 0.5469 0.1763 0.0670 0.1233 13 GLN H OE1 3373 N NE2 . GLN C 13 ? 0.3165 0.6183 0.5309 0.1967 0.0512 0.0972 13 GLN H NE2 3374 N N . PRO C 14 ? 0.2772 0.5078 0.4491 0.1043 0.0405 0.1250 14 PRO H N 3375 C CA . PRO C 14 ? 0.2822 0.4997 0.4590 0.0859 0.0424 0.1383 14 PRO H CA 3376 C C . PRO C 14 ? 0.2920 0.5294 0.4541 0.0964 0.0590 0.1512 14 PRO H C 3377 O O . PRO C 14 ? 0.2929 0.5756 0.4593 0.1098 0.0722 0.1589 14 PRO H O 3378 C CB . PRO C 14 ? 0.2834 0.5271 0.5068 0.0656 0.0396 0.1551 14 PRO H CB 3379 C CG . PRO C 14 ? 0.2791 0.5315 0.5116 0.0674 0.0264 0.1424 14 PRO H CG 3380 C CD . PRO C 14 ? 0.2770 0.5319 0.4832 0.0959 0.0313 0.1305 14 PRO H CD 3381 N N . SER C 15 ? 0.3025 0.5098 0.4450 0.0925 0.0579 0.1519 15 SER H N 3382 C CA . SER C 15 ? 0.3198 0.5488 0.4441 0.1024 0.0706 0.1660 15 SER H CA 3383 C C . SER C 15 ? 0.3268 0.5654 0.4113 0.1249 0.0744 0.1431 15 SER H C 3384 O O . SER C 15 ? 0.3484 0.6062 0.4113 0.1329 0.0814 0.1495 15 SER H O 3385 C CB . SER C 15 ? 0.3339 0.6169 0.4858 0.0999 0.0861 0.1992 15 SER H CB 3386 O OG . SER C 15 ? 0.3423 0.6744 0.4822 0.1200 0.0981 0.1928 15 SER H OG 3387 N N . GLN C 16 ? 0.3222 0.5483 0.3991 0.1349 0.0691 0.1167 16 GLN H N 3388 C CA . GLN C 16 ? 0.3292 0.5551 0.3749 0.1539 0.0717 0.0897 16 GLN H CA 3389 C C . GLN C 16 ? 0.3216 0.4974 0.3454 0.1488 0.0592 0.0721 16 GLN H C 3390 O O . GLN C 16 ? 0.3160 0.4604 0.3473 0.1332 0.0500 0.0799 16 GLN H O 3391 C CB . GLN C 16 ? 0.3342 0.5697 0.3899 0.1696 0.0745 0.0720 16 GLN H CB 3392 C CG . GLN C 16 ? 0.3433 0.6381 0.4203 0.1798 0.0898 0.0851 16 GLN H CG 3393 C CD . GLN C 16 ? 0.3629 0.7088 0.4229 0.1874 0.1057 0.0950 16 GLN H CD 3394 O OE1 . GLN C 16 ? 0.3837 0.7273 0.4103 0.1938 0.1061 0.0800 16 GLN H OE1 3395 N NE2 . GLN C 16 ? 0.3637 0.7618 0.4475 0.1860 0.1186 0.1219 16 GLN H NE2 3396 N N . SER C 17 ? 0.3294 0.5012 0.3285 0.1613 0.0598 0.0466 17 SER H N 3397 C CA . SER C 17 ? 0.3290 0.4630 0.3093 0.1561 0.0497 0.0310 17 SER H CA 3398 C C . SER C 17 ? 0.3204 0.4117 0.3046 0.1561 0.0411 0.0111 17 SER H C 3399 O O . SER C 17 ? 0.3242 0.4165 0.3215 0.1659 0.0436 0.0036 17 SER H O 3400 C CB . SER C 17 ? 0.3479 0.5073 0.3014 0.1663 0.0537 0.0150 17 SER H CB 3401 O OG . SER C 17 ? 0.3691 0.5360 0.3188 0.1813 0.0585 -0.0141 17 SER H OG 3402 N N . LEU C 18 ? 0.3102 0.3672 0.2853 0.1461 0.0320 0.0057 18 LEU H N 3403 C CA . LEU C 18 ? 0.3100 0.3284 0.2878 0.1437 0.0246 -0.0071 18 LEU H CA 3404 C C . LEU C 18 ? 0.3176 0.3217 0.2807 0.1449 0.0224 -0.0297 18 LEU H C 3405 O O . LEU C 18 ? 0.3111 0.3187 0.2617 0.1381 0.0197 -0.0289 18 LEU H O 3406 C CB . LEU C 18 ? 0.2962 0.2910 0.2781 0.1285 0.0163 0.0060 18 LEU H CB 3407 C CG . LEU C 18 ? 0.3004 0.2610 0.2794 0.1236 0.0094 -0.0024 18 LEU H CG 3408 C CD1 . LEU C 18 ? 0.3123 0.2645 0.3044 0.1333 0.0093 -0.0049 18 LEU H CD1 3409 C CD2 . LEU C 18 ? 0.2914 0.2397 0.2701 0.1098 0.0030 0.0080 18 LEU H CD2 3410 N N . SER C 19 ? 0.3302 0.3179 0.2999 0.1530 0.0231 -0.0494 19 SER H N 3411 C CA . SER C 19 ? 0.3448 0.3166 0.3080 0.1515 0.0204 -0.0749 19 SER H CA 3412 C C . SER C 19 ? 0.3511 0.2789 0.3307 0.1465 0.0157 -0.0774 19 SER H C 3413 O O . SER C 19 ? 0.3667 0.2803 0.3651 0.1564 0.0185 -0.0779 19 SER H O 3414 C CB . SER C 19 ? 0.3720 0.3673 0.3316 0.1662 0.0274 -0.1030 19 SER H CB 3415 O OG . SER C 19 ? 0.3694 0.4135 0.3094 0.1704 0.0320 -0.0990 19 SER H OG 3416 N N . ILE C 20 ? 0.3430 0.2525 0.3184 0.1324 0.0097 -0.0760 20 ILE H N 3417 C CA . ILE C 20 ? 0.3529 0.2253 0.3439 0.1255 0.0065 -0.0740 20 ILE H CA 3418 C C . ILE C 20 ? 0.3713 0.2316 0.3658 0.1170 0.0040 -0.0974 20 ILE H C 3419 O O . ILE C 20 ? 0.3589 0.2396 0.3389 0.1100 0.0009 -0.1045 20 ILE H O 3420 C CB . ILE C 20 ? 0.3335 0.1988 0.3200 0.1139 0.0026 -0.0488 20 ILE H CB 3421 C CG1 . ILE C 20 ? 0.3195 0.2007 0.3044 0.1187 0.0026 -0.0293 20 ILE H CG1 3422 C CG2 . ILE C 20 ? 0.3474 0.1816 0.3496 0.1076 0.0010 -0.0409 20 ILE H CG2 3423 C CD1 . ILE C 20 ? 0.3029 0.1849 0.2793 0.1070 -0.0015 -0.0125 20 ILE H CD1 3424 N N . THR C 21 ? 0.4005 0.2279 0.4191 0.1172 0.0048 -0.1074 21 THR H N 3425 C CA . THR C 21 ? 0.4267 0.2372 0.4584 0.1055 0.0019 -0.1301 21 THR H CA 3426 C C . THR C 21 ? 0.4381 0.2188 0.4874 0.0918 0.0006 -0.1076 21 THR H C 3427 O O . THR C 21 ? 0.4503 0.2067 0.5169 0.0967 0.0033 -0.0874 21 THR H O 3428 C CB . THR C 21 ? 0.4623 0.2561 0.5151 0.1152 0.0051 -0.1640 21 THR H CB 3429 O OG1 . THR C 21 ? 0.4599 0.2934 0.4903 0.1274 0.0073 -0.1859 21 THR H OG1 3430 C CG2 . THR C 21 ? 0.4889 0.2604 0.5634 0.0994 0.0009 -0.1896 21 THR H CG2 3431 N N . CYS C 22 ? 0.4417 0.2307 0.4867 0.0755 -0.0029 -0.1084 22 CYS H N 3432 C CA . CYS C 22 ? 0.4614 0.2318 0.5222 0.0606 -0.0024 -0.0875 22 CYS H CA 3433 C C . CYS C 22 ? 0.4961 0.2436 0.5890 0.0472 -0.0037 -0.1088 22 CYS H C 3434 O O . CYS C 22 ? 0.5031 0.2698 0.5938 0.0392 -0.0086 -0.1357 22 CYS H O 3435 C CB . CYS C 22 ? 0.4415 0.2408 0.4807 0.0520 -0.0039 -0.0746 22 CYS H CB 3436 S SG . CYS C 22 ? 0.4642 0.2561 0.5189 0.0330 -0.0009 -0.0516 22 CYS H SG 3437 N N . THR C 23 ? 0.5275 0.2357 0.6535 0.0448 0.0000 -0.0965 23 THR H N 3438 C CA . THR C 23 ? 0.5699 0.2498 0.7359 0.0286 -0.0005 -0.1139 23 THR H CA 3439 C C . THR C 23 ? 0.5727 0.2524 0.7524 0.0085 0.0016 -0.0840 23 THR H C 3440 O O . THR C 23 ? 0.5661 0.2426 0.7422 0.0105 0.0066 -0.0442 23 THR H O 3441 C CB . THR C 23 ? 0.6115 0.2424 0.8172 0.0380 0.0038 -0.1179 23 THR H CB 3442 O OG1 . THR C 23 ? 0.6158 0.2541 0.8078 0.0589 0.0039 -0.1467 23 THR H OG1 3443 C CG2 . THR C 23 ? 0.6555 0.2500 0.9113 0.0191 0.0033 -0.1393 23 THR H CG2 3444 N N . VAL C 24 ? 0.5926 0.2818 0.7886 -0.0109 -0.0021 -0.1044 24 VAL H N 3445 C CA . VAL C 24 ? 0.5919 0.2938 0.8009 -0.0314 0.0007 -0.0802 24 VAL H CA 3446 C C . VAL C 24 ? 0.6400 0.3051 0.9062 -0.0523 0.0033 -0.0792 24 VAL H C 3447 O O . VAL C 24 ? 0.6740 0.3151 0.9695 -0.0577 -0.0014 -0.1162 24 VAL H O 3448 C CB . VAL C 24 ? 0.5644 0.3156 0.7514 -0.0379 -0.0054 -0.0985 24 VAL H CB 3449 C CG1 . VAL C 24 ? 0.5813 0.3414 0.8052 -0.0642 -0.0068 -0.1043 24 VAL H CG1 3450 C CG2 . VAL C 24 ? 0.5293 0.3121 0.6767 -0.0275 -0.0016 -0.0715 24 VAL H CG2 3451 N N . SER C 25 ? 0.6514 0.3142 0.9341 -0.0644 0.0115 -0.0367 25 SER H N 3452 C CA . SER C 25 ? 0.7048 0.3278 1.0470 -0.0833 0.0173 -0.0187 25 SER H CA 3453 C C . SER C 25 ? 0.7116 0.3532 1.0876 -0.1136 0.0198 -0.0115 25 SER H C 3454 O O . SER C 25 ? 0.7475 0.3697 1.1691 -0.1329 0.0150 -0.0416 25 SER H O 3455 C CB . SER C 25 ? 0.7235 0.3258 1.0687 -0.0724 0.0267 0.0348 25 SER H CB 3456 O OG . SER C 25 ? 0.6931 0.3418 0.9946 -0.0682 0.0311 0.0676 25 SER H OG 3457 N N . GLY C 26 ? 0.6853 0.3662 1.0432 -0.1188 0.0276 0.0256 26 GLY H N 3458 C CA . GLY C 26 ? 0.6952 0.3924 1.0945 -0.1475 0.0344 0.0450 26 GLY H CA 3459 C C . GLY C 26 ? 0.6688 0.4112 1.0717 -0.1629 0.0274 0.0123 26 GLY H C 3460 O O . GLY C 26 ? 0.6839 0.4419 1.1294 -0.1889 0.0316 0.0220 26 GLY H O 3461 N N . PHE C 27 ? 0.6310 0.3974 0.9928 -0.1468 0.0166 -0.0240 27 PHE H N 3462 C CA . PHE C 27 ? 0.5995 0.4193 0.9551 -0.1541 0.0089 -0.0492 27 PHE H CA 3463 C C . PHE C 27 ? 0.5967 0.4173 0.9349 -0.1439 -0.0067 -0.0993 27 PHE H C 3464 O O . PHE C 27 ? 0.6076 0.3919 0.9314 -0.1282 -0.0089 -0.1116 27 PHE H O 3465 C CB . PHE C 27 ? 0.5521 0.4191 0.8629 -0.1387 0.0156 -0.0268 27 PHE H CB 3466 C CG . PHE C 27 ? 0.5256 0.3880 0.7811 -0.1092 0.0128 -0.0317 27 PHE H CG 3467 C CD1 . PHE C 27 ? 0.5256 0.3613 0.7599 -0.0954 0.0203 -0.0042 27 PHE H CD1 3468 C CD2 . PHE C 27 ? 0.4980 0.3866 0.7259 -0.0960 0.0021 -0.0612 27 PHE H CD2 3469 C CE1 . PHE C 27 ? 0.5022 0.3363 0.6918 -0.0712 0.0172 -0.0094 27 PHE H CE1 3470 C CE2 . PHE C 27 ? 0.4760 0.3603 0.6597 -0.0715 0.0005 -0.0628 27 PHE H CE2 3471 C CZ . PHE C 27 ? 0.4771 0.3336 0.6431 -0.0601 0.0080 -0.0386 27 PHE H CZ 3472 N N . SER C 28 ? 0.5873 0.4561 0.9263 -0.1512 -0.0172 -0.1259 28 SER H N 3473 C CA . SER C 28 ? 0.5932 0.4760 0.9185 -0.1451 -0.0332 -0.1735 28 SER H CA 3474 C C . SER C 28 ? 0.5536 0.4806 0.8239 -0.1196 -0.0372 -0.1731 28 SER H C 3475 O O . SER C 28 ? 0.5244 0.4898 0.7837 -0.1159 -0.0329 -0.1502 28 SER H O 3476 C CB . SER C 28 ? 0.6147 0.5272 0.9842 -0.1728 -0.0451 -0.2045 28 SER H CB 3477 O OG . SER C 28 ? 0.6287 0.5562 0.9835 -0.1674 -0.0610 -0.2534 28 SER H OG 3478 N N . LEU C 29 ? 0.5572 0.4790 0.7964 -0.1016 -0.0442 -0.1978 29 LEU H N 3479 C CA . LEU C 29 ? 0.5253 0.4863 0.7169 -0.0780 -0.0476 -0.1945 29 LEU H CA 3480 C C . LEU C 29 ? 0.5148 0.5405 0.7081 -0.0826 -0.0603 -0.2099 29 LEU H C 3481 O O . LEU C 29 ? 0.4837 0.5453 0.6490 -0.0654 -0.0607 -0.1944 29 LEU H O 3482 C CB . LEU C 29 ? 0.5325 0.4768 0.6930 -0.0582 -0.0499 -0.2130 29 LEU H CB 3483 C CG . LEU C 29 ? 0.5357 0.4285 0.6865 -0.0455 -0.0380 -0.1910 29 LEU H CG 3484 C CD1 . LEU C 29 ? 0.5531 0.4329 0.6862 -0.0296 -0.0405 -0.2175 29 LEU H CD1 3485 C CD2 . LEU C 29 ? 0.4980 0.3995 0.6200 -0.0314 -0.0295 -0.1530 29 LEU H CD2 3486 N N . THR C 30 ? 0.5422 0.5836 0.7724 -0.1062 -0.0708 -0.2388 30 THR H N 3487 C CA . THR C 30 ? 0.5346 0.6457 0.7732 -0.1131 -0.0846 -0.2513 30 THR H CA 3488 C C . THR C 30 ? 0.5100 0.6490 0.7661 -0.1170 -0.0764 -0.2158 30 THR H C 3489 O O . THR C 30 ? 0.4924 0.6933 0.7501 -0.1135 -0.0848 -0.2141 30 THR H O 3490 C CB . THR C 30 ? 0.5737 0.6979 0.8540 -0.1416 -0.0993 -0.2948 30 THR H CB 3491 O OG1 . THR C 30 ? 0.5922 0.6749 0.9239 -0.1678 -0.0905 -0.2858 30 THR H OG1 3492 C CG2 . THR C 30 ? 0.6058 0.7121 0.8693 -0.1366 -0.1078 -0.3390 30 THR H CG2 3493 N N . THR C 31 ? 0.5113 0.6096 0.7819 -0.1233 -0.0598 -0.1872 31 THR H N 3494 C CA . THR C 31 ? 0.4950 0.6205 0.7835 -0.1279 -0.0490 -0.1562 31 THR H CA 3495 C C . THR C 31 ? 0.4632 0.5833 0.7132 -0.1017 -0.0353 -0.1250 31 THR H C 3496 O O . THR C 31 ? 0.4524 0.6121 0.7057 -0.0949 -0.0297 -0.1083 31 THR H O 3497 C CB . THR C 31 ? 0.5223 0.6173 0.8551 -0.1545 -0.0379 -0.1417 31 THR H CB 3498 O OG1 . THR C 31 ? 0.5600 0.6436 0.9337 -0.1805 -0.0498 -0.1740 31 THR H OG1 3499 C CG2 . THR C 31 ? 0.5110 0.6511 0.8686 -0.1625 -0.0271 -0.1144 31 THR H CG2 3500 N N . TYR C 32 ? 0.4532 0.5262 0.6708 -0.0872 -0.0298 -0.1190 32 TYR H N 3501 C CA . TYR C 32 ? 0.4255 0.4894 0.6106 -0.0665 -0.0173 -0.0926 32 TYR H CA 3502 C C . TYR C 32 ? 0.4044 0.4535 0.5491 -0.0435 -0.0217 -0.0984 32 TYR H C 3503 O O . TYR C 32 ? 0.4219 0.4493 0.5592 -0.0431 -0.0291 -0.1170 32 TYR H O 3504 C CB . TYR C 32 ? 0.4402 0.4660 0.6298 -0.0741 -0.0030 -0.0691 32 TYR H CB 3505 C CG . TYR C 32 ? 0.4583 0.5080 0.6838 -0.0934 0.0062 -0.0529 32 TYR H CG 3506 C CD1 . TYR C 32 ? 0.4449 0.5372 0.6670 -0.0855 0.0156 -0.0387 32 TYR H CD1 3507 C CD2 . TYR C 32 ? 0.4897 0.5218 0.7572 -0.1195 0.0069 -0.0518 32 TYR H CD2 3508 C CE1 . TYR C 32 ? 0.4506 0.5733 0.7060 -0.1020 0.0263 -0.0228 32 TYR H CE1 3509 C CE2 . TYR C 32 ? 0.5015 0.5614 0.8054 -0.1388 0.0171 -0.0326 32 TYR H CE2 3510 C CZ . TYR C 32 ? 0.4826 0.5912 0.7782 -0.1294 0.0273 -0.0177 32 TYR H CZ 3511 O OH . TYR C 32 ? 0.4979 0.6437 0.8291 -0.1465 0.0398 0.0021 32 TYR H OH 3512 N N . GLY C 33 ? 0.3703 0.4319 0.4921 -0.0246 -0.0160 -0.0831 33 GLY H N 3513 C CA . GLY C 33 ? 0.3507 0.3978 0.4390 -0.0045 -0.0177 -0.0824 33 GLY H CA 3514 C C . GLY C 33 ? 0.3421 0.3445 0.4134 -0.0014 -0.0089 -0.0707 33 GLY H C 3515 O O . GLY C 33 ? 0.3474 0.3360 0.4285 -0.0114 -0.0001 -0.0577 33 GLY H O 3516 N N . VAL C 34 ? 0.3287 0.3145 0.3759 0.0121 -0.0115 -0.0730 34 VAL H N 3517 C CA . VAL C 34 ? 0.3199 0.2703 0.3515 0.0170 -0.0054 -0.0619 34 VAL H CA 3518 C C . VAL C 34 ? 0.2969 0.2502 0.3054 0.0337 -0.0038 -0.0542 34 VAL H C 3519 O O . VAL C 34 ? 0.2833 0.2514 0.2840 0.0435 -0.0092 -0.0596 34 VAL H O 3520 C CB . VAL C 34 ? 0.3355 0.2586 0.3699 0.0150 -0.0096 -0.0740 34 VAL H CB 3521 C CG1 . VAL C 34 ? 0.3362 0.2310 0.3566 0.0231 -0.0047 -0.0600 34 VAL H CG1 3522 C CG2 . VAL C 34 ? 0.3589 0.2706 0.4243 -0.0036 -0.0102 -0.0813 34 VAL H CG2 3523 N N . HIS C 35 ? 0.2910 0.2334 0.2906 0.0357 0.0036 -0.0409 35 HIS H N 3524 C CA . HIS C 35 ? 0.2783 0.2195 0.2627 0.0480 0.0055 -0.0358 35 HIS H CA 3525 C C . HIS C 35 ? 0.2855 0.2040 0.2568 0.0511 0.0044 -0.0318 35 HIS H C 3526 O O . HIS C 35 ? 0.2954 0.1979 0.2688 0.0453 0.0045 -0.0286 35 HIS H O 3527 C CB . HIS C 35 ? 0.2752 0.2245 0.2589 0.0485 0.0139 -0.0306 35 HIS H CB 3528 C CG . HIS C 35 ? 0.2709 0.2467 0.2719 0.0466 0.0170 -0.0328 35 HIS H CG 3529 N ND1 . HIS C 35 ? 0.2661 0.2585 0.2745 0.0581 0.0193 -0.0340 35 HIS H ND1 3530 C CD2 . HIS C 35 ? 0.2749 0.2655 0.2927 0.0346 0.0186 -0.0325 35 HIS H CD2 3531 C CE1 . HIS C 35 ? 0.2643 0.2843 0.2918 0.0551 0.0219 -0.0348 35 HIS H CE1 3532 N NE2 . HIS C 35 ? 0.2706 0.2914 0.3039 0.0394 0.0214 -0.0343 35 HIS H NE2 3533 N N . TRP C 36 ? 0.2796 0.1978 0.2424 0.0605 0.0035 -0.0299 36 TRP H N 3534 C CA . TRP C 36 ? 0.2825 0.1865 0.2364 0.0633 0.0025 -0.0252 36 TRP H CA 3535 C C . TRP C 36 ? 0.2828 0.1857 0.2314 0.0644 0.0052 -0.0218 36 TRP H C 3536 O O . TRP C 36 ? 0.2810 0.1894 0.2348 0.0687 0.0072 -0.0237 36 TRP H O 3537 C CB . TRP C 36 ? 0.2825 0.1902 0.2353 0.0711 -0.0009 -0.0274 36 TRP H CB 3538 C CG . TRP C 36 ? 0.2913 0.1972 0.2482 0.0695 -0.0036 -0.0379 36 TRP H CG 3539 C CD1 . TRP C 36 ? 0.2981 0.2184 0.2605 0.0671 -0.0066 -0.0492 36 TRP H CD1 3540 C CD2 . TRP C 36 ? 0.3008 0.1899 0.2609 0.0703 -0.0039 -0.0405 36 TRP H CD2 3541 N NE1 . TRP C 36 ? 0.3135 0.2246 0.2820 0.0646 -0.0088 -0.0631 36 TRP H NE1 3542 C CE2 . TRP C 36 ? 0.3162 0.2052 0.2849 0.0678 -0.0063 -0.0572 36 TRP H CE2 3543 C CE3 . TRP C 36 ? 0.3054 0.1814 0.2650 0.0736 -0.0029 -0.0308 36 TRP H CE3 3544 C CZ2 . TRP C 36 ? 0.3376 0.2073 0.3170 0.0695 -0.0061 -0.0665 36 TRP H CZ2 3545 C CZ3 . TRP C 36 ? 0.3219 0.1826 0.2919 0.0772 -0.0029 -0.0350 36 TRP H CZ3 3546 C CH2 . TRP C 36 ? 0.3379 0.1924 0.3187 0.0757 -0.0037 -0.0537 36 TRP H CH2 3547 N N . VAL C 37 ? 0.2919 0.1888 0.2327 0.0606 0.0047 -0.0175 37 VAL H N 3548 C CA . VAL C 37 ? 0.2972 0.1972 0.2309 0.0590 0.0058 -0.0198 37 VAL H CA 3549 C C . VAL C 37 ? 0.3024 0.2001 0.2319 0.0589 0.0001 -0.0140 37 VAL H C 3550 O O . VAL C 37 ? 0.3037 0.1974 0.2343 0.0603 -0.0023 -0.0055 37 VAL H O 3551 C CB . VAL C 37 ? 0.3087 0.2194 0.2338 0.0533 0.0107 -0.0200 37 VAL H CB 3552 C CG1 . VAL C 37 ? 0.3219 0.2420 0.2347 0.0512 0.0106 -0.0271 37 VAL H CG1 3553 C CG2 . VAL C 37 ? 0.3064 0.2253 0.2406 0.0544 0.0172 -0.0262 37 VAL H CG2 3554 N N . ARG C 38 ? 0.3057 0.2060 0.2357 0.0575 -0.0019 -0.0197 38 ARG H N 3555 C CA . ARG C 38 ? 0.3129 0.2194 0.2416 0.0554 -0.0085 -0.0150 38 ARG H CA 3556 C C . ARG C 38 ? 0.3406 0.2595 0.2606 0.0484 -0.0114 -0.0255 38 ARG H C 3557 O O . ARG C 38 ? 0.3539 0.2724 0.2718 0.0463 -0.0070 -0.0404 38 ARG H O 3558 C CB . ARG C 38 ? 0.2982 0.2019 0.2420 0.0585 -0.0102 -0.0118 38 ARG H CB 3559 C CG . ARG C 38 ? 0.2961 0.1969 0.2527 0.0539 -0.0100 -0.0202 38 ARG H CG 3560 C CD . ARG C 38 ? 0.2869 0.1892 0.2614 0.0561 -0.0099 -0.0099 38 ARG H CD 3561 N NE . ARG C 38 ? 0.2918 0.1866 0.2865 0.0503 -0.0088 -0.0139 38 ARG H NE 3562 C CZ . ARG C 38 ? 0.2900 0.1872 0.3061 0.0491 -0.0073 -0.0021 38 ARG H CZ 3563 N NH1 . ARG C 38 ? 0.2815 0.1942 0.2976 0.0548 -0.0062 0.0124 38 ARG H NH1 3564 N NH2 . ARG C 38 ? 0.3059 0.1906 0.3468 0.0420 -0.0059 -0.0051 38 ARG H NH2 3565 N N . GLN C 39 ? 0.3624 0.2960 0.2785 0.0457 -0.0193 -0.0195 39 GLN H N 3566 C CA . GLN C 39 ? 0.3984 0.3536 0.3013 0.0383 -0.0246 -0.0303 39 GLN H CA 3567 C C . GLN C 39 ? 0.4151 0.3861 0.3270 0.0337 -0.0355 -0.0298 39 GLN H C 3568 O O . GLN C 39 ? 0.3964 0.3749 0.3141 0.0386 -0.0401 -0.0110 39 GLN H O 3569 C CB . GLN C 39 ? 0.4170 0.3903 0.2990 0.0392 -0.0238 -0.0173 39 GLN H CB 3570 C CG . GLN C 39 ? 0.4494 0.4580 0.3155 0.0344 -0.0335 -0.0157 39 GLN H CG 3571 C CD . GLN C 39 ? 0.4833 0.5150 0.3255 0.0341 -0.0294 -0.0057 39 GLN H CD 3572 O OE1 . GLN C 39 ? 0.5180 0.5747 0.3410 0.0290 -0.0285 -0.0247 39 GLN H OE1 3573 N NE2 . GLN C 39 ? 0.4861 0.5107 0.3314 0.0394 -0.0255 0.0233 39 GLN H NE2 3574 N N . SER C 40 ? 0.4558 0.4328 0.3729 0.0242 -0.0395 -0.0522 40 SER H N 3575 C CA . SER C 40 ? 0.4798 0.4771 0.4099 0.0155 -0.0515 -0.0563 40 SER H CA 3576 C C . SER C 40 ? 0.5144 0.5377 0.4296 0.0045 -0.0589 -0.0829 40 SER H C 3577 O O . SER C 40 ? 0.5465 0.5624 0.4496 0.0039 -0.0518 -0.1035 40 SER H O 3578 C CB . SER C 40 ? 0.4697 0.4455 0.4335 0.0116 -0.0490 -0.0589 40 SER H CB 3579 O OG . SER C 40 ? 0.4770 0.4236 0.4482 0.0120 -0.0392 -0.0731 40 SER H OG 3580 N N . PRO C 41 ? 0.5482 0.6077 0.4640 -0.0034 -0.0735 -0.0844 41 PRO H N 3581 C CA . PRO C 41 ? 0.5785 0.6709 0.4777 -0.0152 -0.0827 -0.1151 41 PRO H CA 3582 C C . PRO C 41 ? 0.6008 0.6667 0.5192 -0.0258 -0.0787 -0.1546 41 PRO H C 3583 O O . PRO C 41 ? 0.6305 0.7092 0.5306 -0.0300 -0.0780 -0.1862 41 PRO H O 3584 C CB . PRO C 41 ? 0.5845 0.7196 0.4927 -0.0229 -0.1009 -0.1079 41 PRO H CB 3585 C CG . PRO C 41 ? 0.5589 0.6731 0.5004 -0.0178 -0.0984 -0.0822 41 PRO H CG 3586 C CD . PRO C 41 ? 0.5354 0.6121 0.4698 -0.0019 -0.0824 -0.0613 41 PRO H CD 3587 N N . GLY C 42 ? 0.6011 0.6316 0.5584 -0.0290 -0.0748 -0.1517 42 GLY H N 3588 C CA . GLY C 42 ? 0.6244 0.6226 0.6105 -0.0381 -0.0701 -0.1827 42 GLY H CA 3589 C C . GLY C 42 ? 0.6336 0.5977 0.6142 -0.0260 -0.0536 -0.1903 42 GLY H C 3590 O O . GLY C 42 ? 0.6708 0.6262 0.6543 -0.0296 -0.0502 -0.2265 42 GLY H O 3591 N N . LYS C 43 ? 0.6078 0.5554 0.5830 -0.0114 -0.0437 -0.1589 43 LYS H N 3592 C CA . LYS C 43 ? 0.6070 0.5247 0.5858 0.0003 -0.0289 -0.1610 43 LYS H CA 3593 C C . LYS C 43 ? 0.5871 0.5227 0.5295 0.0099 -0.0221 -0.1619 43 LYS H C 3594 O O . LYS C 43 ? 0.5999 0.5182 0.5466 0.0195 -0.0102 -0.1655 43 LYS H O 3595 C CB . LYS C 43 ? 0.5982 0.4913 0.5969 0.0094 -0.0224 -0.1284 43 LYS H CB 3596 C CG . LYS C 43 ? 0.6302 0.4965 0.6731 0.0034 -0.0212 -0.1266 43 LYS H CG 3597 C CD . LYS C 43 ? 0.6669 0.5013 0.7333 0.0085 -0.0111 -0.1441 43 LYS H CD 3598 C CE . LYS C 43 ? 0.7084 0.5154 0.8237 -0.0033 -0.0120 -0.1555 43 LYS H CE 3599 N NZ . LYS C 43 ? 0.7044 0.4851 0.8558 0.0037 -0.0037 -0.1230 43 LYS H NZ 3600 N N . GLY C 44 ? 0.5601 0.5331 0.4701 0.0077 -0.0290 -0.1549 44 GLY H N 3601 C CA . GLY C 44 ? 0.5296 0.5207 0.4094 0.0159 -0.0210 -0.1452 44 GLY H CA 3602 C C . GLY C 44 ? 0.4733 0.4409 0.3621 0.0257 -0.0134 -0.1151 44 GLY H C 3603 O O . GLY C 44 ? 0.4549 0.4107 0.3570 0.0265 -0.0182 -0.0948 44 GLY H O 3604 N N . LEU C 45 ? 0.4462 0.4114 0.3293 0.0328 -0.0017 -0.1148 45 LEU H N 3605 C CA . LEU C 45 ? 0.4058 0.3550 0.2974 0.0399 0.0037 -0.0905 45 LEU H CA 3606 C C . LEU C 45 ? 0.3863 0.3073 0.3058 0.0460 0.0087 -0.0954 45 LEU H C 3607 O O . LEU C 45 ? 0.3956 0.3086 0.3273 0.0480 0.0139 -0.1173 45 LEU H O 3608 C CB . LEU C 45 ? 0.4088 0.3765 0.2841 0.0424 0.0128 -0.0833 45 LEU H CB 3609 C CG . LEU C 45 ? 0.4179 0.4122 0.2699 0.0381 0.0093 -0.0631 45 LEU H CG 3610 C CD1 . LEU C 45 ? 0.4244 0.4422 0.2632 0.0384 0.0209 -0.0573 45 LEU H CD1 3611 C CD2 . LEU C 45 ? 0.4031 0.3800 0.2658 0.0394 0.0035 -0.0361 45 LEU H CD2 3612 N N . GLU C 46 ? 0.3583 0.2663 0.2887 0.0500 0.0075 -0.0746 46 GLU H N 3613 C CA . GLU C 46 ? 0.3496 0.2382 0.3051 0.0563 0.0103 -0.0710 46 GLU H CA 3614 C C . GLU C 46 ? 0.3185 0.2100 0.2734 0.0627 0.0129 -0.0545 46 GLU H C 3615 O O . GLU C 46 ? 0.3060 0.2022 0.2506 0.0608 0.0090 -0.0426 46 GLU H O 3616 C CB . GLU C 46 ? 0.3603 0.2396 0.3298 0.0522 0.0036 -0.0642 46 GLU H CB 3617 C CG . GLU C 46 ? 0.3772 0.2379 0.3769 0.0564 0.0071 -0.0599 46 GLU H CG 3618 C CD . GLU C 46 ? 0.3952 0.2495 0.4148 0.0488 0.0023 -0.0539 46 GLU H CD 3619 O OE1 . GLU C 46 ? 0.3962 0.2634 0.4068 0.0405 -0.0050 -0.0543 46 GLU H OE1 3620 O OE2 . GLU C 46 ? 0.4118 0.2502 0.4603 0.0518 0.0064 -0.0452 46 GLU H OE2 3621 N N . TRP C 47 ? 0.3036 0.1944 0.2717 0.0703 0.0192 -0.0563 47 TRP H N 3622 C CA . TRP C 47 ? 0.2825 0.1813 0.2543 0.0753 0.0195 -0.0438 47 TRP H CA 3623 C C . TRP C 47 ? 0.2721 0.1667 0.2564 0.0811 0.0157 -0.0298 47 TRP H C 3624 O O . TRP C 47 ? 0.2743 0.1598 0.2773 0.0863 0.0174 -0.0261 47 TRP H O 3625 C CB . TRP C 47 ? 0.2834 0.1933 0.2664 0.0818 0.0269 -0.0497 47 TRP H CB 3626 C CG . TRP C 47 ? 0.2693 0.1952 0.2574 0.0841 0.0255 -0.0399 47 TRP H CG 3627 C CD1 . TRP C 47 ? 0.2640 0.2030 0.2440 0.0764 0.0252 -0.0384 47 TRP H CD1 3628 C CD2 . TRP C 47 ? 0.2624 0.1966 0.2671 0.0935 0.0228 -0.0297 47 TRP H CD2 3629 N NE1 . TRP C 47 ? 0.2541 0.2080 0.2453 0.0787 0.0217 -0.0332 47 TRP H NE1 3630 C CE2 . TRP C 47 ? 0.2543 0.2095 0.2578 0.0900 0.0196 -0.0274 47 TRP H CE2 3631 C CE3 . TRP C 47 ? 0.2664 0.1946 0.2890 0.1040 0.0227 -0.0202 47 TRP H CE3 3632 C CZ2 . TRP C 47 ? 0.2499 0.2266 0.2652 0.0971 0.0146 -0.0192 47 TRP H CZ2 3633 C CZ3 . TRP C 47 ? 0.2623 0.2112 0.2962 0.1128 0.0191 -0.0062 47 TRP H CZ3 3634 C CH2 . TRP C 47 ? 0.2539 0.2300 0.2819 0.1095 0.0143 -0.0073 47 TRP H CH2 3635 N N . LEU C 48 ? 0.2625 0.1654 0.2379 0.0803 0.0114 -0.0217 48 LEU H N 3636 C CA . LEU C 48 ? 0.2604 0.1682 0.2405 0.0855 0.0084 -0.0092 48 LEU H CA 3637 C C . LEU C 48 ? 0.2583 0.1865 0.2415 0.0925 0.0070 -0.0034 48 LEU H C 3638 O O . LEU C 48 ? 0.2622 0.2008 0.2555 0.1006 0.0070 0.0103 48 LEU H O 3639 C CB . LEU C 48 ? 0.2541 0.1616 0.2217 0.0817 0.0048 -0.0081 48 LEU H CB 3640 C CG . LEU C 48 ? 0.2582 0.1550 0.2247 0.0756 0.0035 -0.0096 48 LEU H CG 3641 C CD1 . LEU C 48 ? 0.2569 0.1571 0.2149 0.0753 0.0003 -0.0069 48 LEU H CD1 3642 C CD2 . LEU C 48 ? 0.2613 0.1533 0.2452 0.0758 0.0048 -0.0029 48 LEU H CD2 3643 N N . GLY C 49 ? 0.2573 0.1949 0.2339 0.0885 0.0051 -0.0121 49 GLY H N 3644 C CA . GLY C 49 ? 0.2577 0.2211 0.2390 0.0928 0.0015 -0.0109 49 GLY H CA 3645 C C . GLY C 49 ? 0.2593 0.2305 0.2403 0.0840 -0.0003 -0.0230 49 GLY H C 3646 O O . GLY C 49 ? 0.2582 0.2135 0.2358 0.0752 0.0028 -0.0282 49 GLY H O 3647 N N . VAL C 50 ? 0.2627 0.2624 0.2494 0.0855 -0.0060 -0.0254 50 VAL H N 3648 C CA . VAL C 50 ? 0.2653 0.2760 0.2590 0.0745 -0.0091 -0.0378 50 VAL H CA 3649 C C . VAL C 50 ? 0.2736 0.3157 0.2664 0.0750 -0.0190 -0.0465 50 VAL H C 3650 O O . VAL C 50 ? 0.2762 0.3458 0.2666 0.0866 -0.0229 -0.0369 50 VAL H O 3651 C CB . VAL C 50 ? 0.2639 0.2872 0.2750 0.0735 -0.0041 -0.0349 50 VAL H CB 3652 C CG1 . VAL C 50 ? 0.2630 0.3142 0.2868 0.0881 -0.0058 -0.0244 50 VAL H CG1 3653 C CG2 . VAL C 50 ? 0.2705 0.3077 0.2947 0.0588 -0.0064 -0.0449 50 VAL H CG2 3654 N N . ILE C 51 ? 0.2829 0.3220 0.2786 0.0623 -0.0233 -0.0644 51 ILE H N 3655 C CA . ILE C 51 ? 0.2946 0.3691 0.2942 0.0585 -0.0340 -0.0808 51 ILE H CA 3656 C C . ILE C 51 ? 0.2982 0.3843 0.3232 0.0434 -0.0360 -0.0883 51 ILE H C 3657 O O . ILE C 51 ? 0.3037 0.3610 0.3397 0.0302 -0.0308 -0.0918 51 ILE H O 3658 C CB . ILE C 51 ? 0.3111 0.3780 0.2987 0.0562 -0.0382 -0.1021 51 ILE H CB 3659 C CG1 . ILE C 51 ? 0.3280 0.4418 0.3159 0.0533 -0.0509 -0.1236 51 ILE H CG1 3660 C CG2 . ILE C 51 ? 0.3229 0.3461 0.3218 0.0432 -0.0340 -0.1132 51 ILE H CG2 3661 C CD1 . ILE C 51 ? 0.3464 0.4700 0.3132 0.0602 -0.0537 -0.1424 51 ILE H CD1 3662 N N . TRP C 52 ? 0.2967 0.4287 0.3335 0.0462 -0.0428 -0.0861 52 TRP H N 3663 C CA . TRP C 52 ? 0.2969 0.4514 0.3624 0.0324 -0.0449 -0.0913 52 TRP H CA 3664 C C . TRP C 52 ? 0.3196 0.4861 0.3972 0.0134 -0.0563 -0.1200 52 TRP H C 3665 O O . TRP C 52 ? 0.3351 0.5072 0.3963 0.0154 -0.0646 -0.1381 52 TRP H O 3666 C CB . TRP C 52 ? 0.2873 0.4912 0.3652 0.0451 -0.0487 -0.0769 52 TRP H CB 3667 C CG . TRP C 52 ? 0.2742 0.4619 0.3475 0.0639 -0.0372 -0.0532 52 TRP H CG 3668 C CD1 . TRP C 52 ? 0.2720 0.4655 0.3337 0.0835 -0.0378 -0.0365 52 TRP H CD1 3669 C CD2 . TRP C 52 ? 0.2680 0.4319 0.3511 0.0639 -0.0228 -0.0450 52 TRP H CD2 3670 N NE1 . TRP C 52 ? 0.2648 0.4333 0.3327 0.0948 -0.0253 -0.0214 52 TRP H NE1 3671 C CE2 . TRP C 52 ? 0.2629 0.4163 0.3416 0.0838 -0.0162 -0.0290 52 TRP H CE2 3672 C CE3 . TRP C 52 ? 0.2706 0.4243 0.3667 0.0489 -0.0143 -0.0492 52 TRP H CE3 3673 C CZ2 . TRP C 52 ? 0.2605 0.3926 0.3453 0.0892 -0.0022 -0.0243 52 TRP H CZ2 3674 C CZ3 . TRP C 52 ? 0.2668 0.4061 0.3644 0.0553 0.0002 -0.0403 52 TRP H CZ3 3675 C CH2 . TRP C 52 ? 0.2607 0.3891 0.3516 0.0754 0.0058 -0.0315 52 TRP H CH2 3676 N N . SER C 53 ? 0.3241 0.4963 0.4331 -0.0056 -0.0560 -0.1255 53 SER H N 3677 C CA . SER C 53 ? 0.3472 0.5235 0.4771 -0.0278 -0.0661 -0.1548 53 SER H CA 3678 C C . SER C 53 ? 0.3612 0.5915 0.4840 -0.0255 -0.0844 -0.1783 53 SER H C 3679 O O . SER C 53 ? 0.3844 0.6094 0.5044 -0.0346 -0.0930 -0.2103 53 SER H O 3680 C CB . SER C 53 ? 0.3493 0.5359 0.5209 -0.0494 -0.0628 -0.1513 53 SER H CB 3681 O OG . SER C 53 ? 0.3347 0.5806 0.5210 -0.0445 -0.0673 -0.1416 53 SER H OG 3682 N N . GLY C 54 ? 0.3486 0.6339 0.4697 -0.0121 -0.0903 -0.1629 54 GLY H N 3683 C CA . GLY C 54 ? 0.3607 0.7098 0.4707 -0.0067 -0.1087 -0.1783 54 GLY H CA 3684 C C . GLY C 54 ? 0.3658 0.7124 0.4333 0.0120 -0.1095 -0.1793 54 GLY H C 3685 O O . GLY C 54 ? 0.3817 0.7824 0.4333 0.0170 -0.1235 -0.1927 54 GLY H O 3686 N N . GLY C 55 ? 0.3556 0.6467 0.4044 0.0229 -0.0946 -0.1630 55 GLY H N 3687 C CA . GLY C 55 ? 0.3643 0.6479 0.3784 0.0367 -0.0930 -0.1665 55 GLY H CA 3688 C C . GLY C 55 ? 0.3505 0.6494 0.3449 0.0606 -0.0877 -0.1298 55 GLY H C 3689 O O . GLY C 55 ? 0.3572 0.6521 0.3251 0.0722 -0.0840 -0.1265 55 GLY H O 3690 N N . SER C 56 ? 0.3370 0.6511 0.3484 0.0686 -0.0857 -0.1013 56 SER H N 3691 C CA . SER C 56 ? 0.3275 0.6429 0.3293 0.0908 -0.0785 -0.0645 56 SER H CA 3692 C C . SER C 56 ? 0.3116 0.5580 0.3119 0.0918 -0.0621 -0.0540 56 SER H C 3693 O O . SER C 56 ? 0.3057 0.5115 0.3141 0.0774 -0.0565 -0.0689 56 SER H O 3694 C CB . SER C 56 ? 0.3230 0.6801 0.3482 0.1027 -0.0822 -0.0385 56 SER H CB 3695 O OG . SER C 56 ? 0.3114 0.6461 0.3654 0.0954 -0.0750 -0.0384 56 SER H OG 3696 N N . THR C 57 ? 0.3069 0.5440 0.2981 0.1079 -0.0551 -0.0273 57 THR H N 3697 C CA . THR C 57 ? 0.2976 0.4773 0.2860 0.1087 -0.0419 -0.0190 57 THR H CA 3698 C C . THR C 57 ? 0.2895 0.4579 0.2946 0.1222 -0.0340 0.0095 57 THR H C 3699 O O . THR C 57 ? 0.2946 0.4985 0.3102 0.1356 -0.0378 0.0306 57 THR H O 3700 C CB . THR C 57 ? 0.3072 0.4779 0.2714 0.1124 -0.0393 -0.0190 57 THR H CB 3701 O OG1 . THR C 57 ? 0.3206 0.5386 0.2756 0.1263 -0.0436 0.0009 57 THR H OG1 3702 C CG2 . THR C 57 ? 0.3159 0.4797 0.2677 0.1001 -0.0432 -0.0524 57 THR H CG2 3703 N N . ASP C 58 ? 0.2804 0.4000 0.2897 0.1189 -0.0235 0.0093 58 ASP H N 3704 C CA . ASP C 58 ? 0.2792 0.3776 0.3053 0.1301 -0.0148 0.0291 58 ASP H CA 3705 C C . ASP C 58 ? 0.2769 0.3304 0.2927 0.1249 -0.0075 0.0268 58 ASP H C 3706 O O . ASP C 58 ? 0.2762 0.3097 0.2777 0.1127 -0.0069 0.0091 58 ASP H O 3707 C CB . ASP C 58 ? 0.2767 0.3724 0.3264 0.1318 -0.0098 0.0252 58 ASP H CB 3708 C CG . ASP C 58 ? 0.2813 0.4248 0.3516 0.1432 -0.0160 0.0375 58 ASP H CG 3709 O OD1 . ASP C 58 ? 0.2919 0.4514 0.3732 0.1595 -0.0175 0.0632 58 ASP H OD1 3710 O OD2 . ASP C 58 ? 0.2764 0.4436 0.3556 0.1359 -0.0193 0.0242 58 ASP H OD2 3711 N N . TYR C 59 ? 0.2813 0.3220 0.3081 0.1340 -0.0026 0.0469 59 TYR H N 3712 C CA . TYR C 59 ? 0.2808 0.2884 0.3020 0.1285 0.0023 0.0473 59 TYR H CA 3713 C C . TYR C 59 ? 0.2900 0.2647 0.3361 0.1318 0.0100 0.0530 59 TYR H C 3714 O O . TYR C 59 ? 0.3102 0.2879 0.3822 0.1437 0.0128 0.0684 59 TYR H O 3715 C CB . TYR C 59 ? 0.2856 0.3137 0.2968 0.1326 0.0006 0.0650 59 TYR H CB 3716 C CG . TYR C 59 ? 0.2834 0.3439 0.2692 0.1301 -0.0062 0.0523 59 TYR H CG 3717 C CD1 . TYR C 59 ? 0.2781 0.3220 0.2480 0.1195 -0.0071 0.0278 59 TYR H CD1 3718 C CD2 . TYR C 59 ? 0.2929 0.4019 0.2718 0.1391 -0.0118 0.0644 59 TYR H CD2 3719 C CE1 . TYR C 59 ? 0.2821 0.3499 0.2344 0.1176 -0.0126 0.0112 59 TYR H CE1 3720 C CE2 . TYR C 59 ? 0.2973 0.4376 0.2529 0.1364 -0.0184 0.0455 59 TYR H CE2 3721 C CZ . TYR C 59 ? 0.2931 0.4089 0.2374 0.1254 -0.0183 0.0167 59 TYR H CZ 3722 O OH . TYR C 59 ? 0.3042 0.4450 0.2309 0.1228 -0.0240 -0.0071 59 TYR H OH 3723 N N . ASN C 60 ? 0.2858 0.2299 0.3263 0.1215 0.0131 0.0390 60 ASN H N 3724 C CA . ASN C 60 ? 0.2952 0.2073 0.3580 0.1208 0.0190 0.0387 60 ASN H CA 3725 C C . ASN C 60 ? 0.3054 0.2184 0.3908 0.1279 0.0208 0.0681 60 ASN H C 3726 O O . ASN C 60 ? 0.3011 0.2329 0.3743 0.1267 0.0184 0.0832 60 ASN H O 3727 C CB . ASN C 60 ? 0.2896 0.1829 0.3367 0.1067 0.0181 0.0212 60 ASN H CB 3728 C CG . ASN C 60 ? 0.3072 0.1708 0.3757 0.1014 0.0217 0.0141 60 ASN H CG 3729 O OD1 . ASN C 60 ? 0.3219 0.1745 0.4164 0.1031 0.0239 0.0311 60 ASN H OD1 3730 N ND2 . ASN C 60 ? 0.3060 0.1594 0.3631 0.0928 0.0216 -0.0107 60 ASN H ND2 3731 N N . ALA C 61 ? 0.3229 0.2174 0.4435 0.1364 0.0262 0.0775 61 ALA H N 3732 C CA . ALA C 61 ? 0.3423 0.2382 0.4920 0.1449 0.0290 0.1136 61 ALA H CA 3733 C C . ALA C 61 ? 0.3456 0.2343 0.4960 0.1332 0.0300 0.1255 61 ALA H C 3734 O O . ALA C 61 ? 0.3553 0.2681 0.5100 0.1380 0.0309 0.1590 61 ALA H O 3735 C CB . ALA C 61 ? 0.3674 0.2323 0.5633 0.1549 0.0360 0.1178 61 ALA H CB 3736 N N . ALA C 62 ? 0.3410 0.2042 0.4868 0.1182 0.0297 0.0995 62 ALA H N 3737 C CA . ALA C 62 ? 0.3445 0.2038 0.4957 0.1056 0.0300 0.1079 62 ALA H CA 3738 C C . ALA C 62 ? 0.3250 0.2223 0.4423 0.1048 0.0270 0.1168 62 ALA H C 3739 O O . ALA C 62 ? 0.3280 0.2354 0.4532 0.0992 0.0295 0.1342 62 ALA H O 3740 C CB . ALA C 62 ? 0.3459 0.1760 0.5006 0.0901 0.0281 0.0749 62 ALA H CB 3741 N N . PHE C 63 ? 0.3091 0.2284 0.3931 0.1105 0.0226 0.1040 63 PHE H N 3742 C CA . PHE C 63 ? 0.2986 0.2485 0.3524 0.1102 0.0200 0.1029 63 PHE H CA 3743 C C . PHE C 63 ? 0.3058 0.2980 0.3451 0.1230 0.0189 0.1198 63 PHE H C 3744 O O . PHE C 63 ? 0.2975 0.3185 0.3111 0.1248 0.0170 0.1138 63 PHE H O 3745 C CB . PHE C 63 ? 0.2840 0.2254 0.3129 0.1044 0.0151 0.0715 63 PHE H CB 3746 C CG . PHE C 63 ? 0.2834 0.1973 0.3182 0.0924 0.0143 0.0554 63 PHE H CG 3747 C CD1 . PHE C 63 ? 0.2916 0.1795 0.3413 0.0886 0.0151 0.0430 63 PHE H CD1 3748 C CD2 . PHE C 63 ? 0.2777 0.1969 0.3041 0.0861 0.0125 0.0516 63 PHE H CD2 3749 C CE1 . PHE C 63 ? 0.2952 0.1661 0.3471 0.0770 0.0129 0.0252 63 PHE H CE1 3750 C CE2 . PHE C 63 ? 0.2784 0.1809 0.3099 0.0750 0.0095 0.0379 63 PHE H CE2 3751 C CZ . PHE C 63 ? 0.2882 0.1683 0.3305 0.0697 0.0090 0.0241 63 PHE H CZ 3752 N N . ILE C 64 ? 0.3230 0.3211 0.3805 0.1328 0.0196 0.1394 64 ILE H N 3753 C CA . ILE C 64 ? 0.3377 0.3835 0.3839 0.1458 0.0164 0.1581 64 ILE H CA 3754 C C . ILE C 64 ? 0.3455 0.4353 0.3714 0.1488 0.0181 0.1740 64 ILE H C 3755 O O . ILE C 64 ? 0.3462 0.4789 0.3444 0.1546 0.0128 0.1664 64 ILE H O 3756 C CB . ILE C 64 ? 0.3589 0.4050 0.4396 0.1579 0.0190 0.1914 64 ILE H CB 3757 C CG1 . ILE C 64 ? 0.3562 0.3886 0.4478 0.1631 0.0156 0.1744 64 ILE H CG1 3758 C CG2 . ILE C 64 ? 0.3762 0.4803 0.4491 0.1709 0.0176 0.2271 64 ILE H CG2 3759 C CD1 . ILE C 64 ? 0.3810 0.4006 0.5165 0.1766 0.0201 0.2030 64 ILE H CD1 3760 N N . SER C 65 ? 0.3573 0.4405 0.3986 0.1443 0.0260 0.1945 65 SER H N 3761 C CA . SER C 65 ? 0.3679 0.5007 0.3938 0.1491 0.0308 0.2160 65 SER H CA 3762 C C . SER C 65 ? 0.3519 0.4932 0.3533 0.1433 0.0325 0.1896 65 SER H C 3763 O O . SER C 65 ? 0.3559 0.5445 0.3389 0.1494 0.0371 0.1985 65 SER H O 3764 C CB . SER C 65 ? 0.3910 0.5220 0.4530 0.1484 0.0404 0.2611 65 SER H CB 3765 O OG . SER C 65 ? 0.3949 0.4924 0.4742 0.1339 0.0449 0.2513 65 SER H OG 3766 N N . ARG C 66 ? 0.3333 0.4334 0.3352 0.1333 0.0295 0.1584 66 ARG H N 3767 C CA . ARG C 66 ? 0.3237 0.4314 0.3083 0.1307 0.0310 0.1368 66 ARG H CA 3768 C C . ARG C 66 ? 0.3127 0.4004 0.2779 0.1285 0.0236 0.0975 66 ARG H C 3769 O O . ARG C 66 ? 0.3098 0.3926 0.2687 0.1268 0.0246 0.0802 66 ARG H O 3770 C CB . ARG C 66 ? 0.3190 0.4067 0.3292 0.1205 0.0364 0.1465 66 ARG H CB 3771 C CG . ARG C 66 ? 0.3100 0.3464 0.3440 0.1085 0.0321 0.1383 66 ARG H CG 3772 C CD . ARG C 66 ? 0.3024 0.3280 0.3550 0.0968 0.0338 0.1365 66 ARG H CD 3773 N NE . ARG C 66 ? 0.2912 0.2759 0.3518 0.0862 0.0268 0.1144 66 ARG H NE 3774 C CZ . ARG C 66 ? 0.2814 0.2571 0.3447 0.0773 0.0226 0.0988 66 ARG H CZ 3775 N NH1 . ARG C 66 ? 0.2779 0.2789 0.3399 0.0784 0.0247 0.1018 66 ARG H NH1 3776 N NH2 . ARG C 66 ? 0.2810 0.2266 0.3480 0.0684 0.0162 0.0797 66 ARG H NH2 3777 N N . LEU C 67 ? 0.3121 0.3919 0.2714 0.1294 0.0167 0.0862 67 LEU H N 3778 C CA . LEU C 67 ? 0.3069 0.3668 0.2543 0.1249 0.0104 0.0538 67 LEU H CA 3779 C C . LEU C 67 ? 0.3152 0.4054 0.2463 0.1300 0.0042 0.0413 67 LEU H C 3780 O O . LEU C 67 ? 0.3149 0.4252 0.2506 0.1348 0.0016 0.0573 67 LEU H O 3781 C CB . LEU C 67 ? 0.3006 0.3188 0.2630 0.1164 0.0083 0.0490 67 LEU H CB 3782 C CG . LEU C 67 ? 0.2984 0.2900 0.2540 0.1087 0.0046 0.0236 67 LEU H CG 3783 C CD1 . LEU C 67 ? 0.3018 0.2922 0.2560 0.1068 0.0002 0.0121 67 LEU H CD1 3784 C CD2 . LEU C 67 ? 0.3047 0.3016 0.2479 0.1101 0.0044 0.0081 67 LEU H CD2 3785 N N . SER C 68 ? 0.3229 0.4178 0.2390 0.1291 0.0014 0.0124 68 SER H N 3786 C CA . SER C 68 ? 0.3357 0.4522 0.2413 0.1287 -0.0067 -0.0086 68 SER H CA 3787 C C . SER C 68 ? 0.3323 0.4150 0.2412 0.1192 -0.0099 -0.0391 68 SER H C 3788 O O . SER C 68 ? 0.3315 0.3943 0.2400 0.1192 -0.0060 -0.0516 68 SER H O 3789 C CB . SER C 68 ? 0.3619 0.5328 0.2462 0.1379 -0.0076 -0.0164 68 SER H CB 3790 O OG . SER C 68 ? 0.3856 0.5483 0.2621 0.1382 -0.0049 -0.0464 68 SER H OG 3791 N N . ILE C 69 ? 0.3288 0.4090 0.2445 0.1118 -0.0167 -0.0486 69 ILE H N 3792 C CA . ILE C 69 ? 0.3325 0.3856 0.2563 0.1007 -0.0198 -0.0735 69 ILE H CA 3793 C C . ILE C 69 ? 0.3462 0.4333 0.2653 0.0980 -0.0286 -0.0996 69 ILE H C 3794 O O . ILE C 69 ? 0.3443 0.4733 0.2582 0.1019 -0.0343 -0.0923 69 ILE H O 3795 C CB . ILE C 69 ? 0.3195 0.3475 0.2589 0.0918 -0.0195 -0.0639 69 ILE H CB 3796 C CG1 . ILE C 69 ? 0.3090 0.3086 0.2509 0.0937 -0.0123 -0.0440 69 ILE H CG1 3797 C CG2 . ILE C 69 ? 0.3274 0.3311 0.2787 0.0787 -0.0215 -0.0834 69 ILE H CG2 3798 C CD1 . ILE C 69 ? 0.3000 0.2897 0.2530 0.0903 -0.0104 -0.0326 69 ILE H CD1 3799 N N . SER C 70 ? 0.3633 0.4337 0.2871 0.0917 -0.0302 -0.1299 70 SER H N 3800 C CA . SER C 70 ? 0.3871 0.4861 0.3116 0.0851 -0.0400 -0.1630 70 SER H CA 3801 C C . SER C 70 ? 0.4038 0.4600 0.3517 0.0711 -0.0407 -0.1886 70 SER H C 3802 O O . SER C 70 ? 0.3943 0.4043 0.3552 0.0682 -0.0337 -0.1747 70 SER H O 3803 C CB . SER C 70 ? 0.4083 0.5511 0.3088 0.0972 -0.0407 -0.1809 70 SER H CB 3804 O OG . SER C 70 ? 0.4201 0.5365 0.3189 0.1047 -0.0315 -0.1921 70 SER H OG 3805 N N . LYS C 71 ? 0.4365 0.5087 0.3924 0.0617 -0.0494 -0.2252 71 LYS H N 3806 C CA . LYS C 71 ? 0.4613 0.4873 0.4491 0.0460 -0.0496 -0.2470 71 LYS H CA 3807 C C . LYS C 71 ? 0.5065 0.5455 0.5055 0.0365 -0.0585 -0.2967 71 LYS H C 3808 O O . LYS C 71 ? 0.5248 0.6209 0.5048 0.0389 -0.0679 -0.3161 71 LYS H O 3809 C CB . LYS C 71 ? 0.4432 0.4562 0.4541 0.0298 -0.0510 -0.2266 71 LYS H CB 3810 C CG . LYS C 71 ? 0.4386 0.5053 0.4510 0.0219 -0.0626 -0.2321 71 LYS H CG 3811 C CD . LYS C 71 ? 0.4297 0.4832 0.4735 0.0037 -0.0624 -0.2194 71 LYS H CD 3812 C CE . LYS C 71 ? 0.4225 0.5347 0.4714 -0.0014 -0.0732 -0.2190 71 LYS H CE 3813 N NZ . LYS C 71 ? 0.4190 0.5252 0.5046 -0.0214 -0.0726 -0.2126 71 LYS H NZ 3814 N N . ASP C 72 ? 0.5360 0.5229 0.5689 0.0249 -0.0560 -0.3162 72 ASP H N 3815 C CA . ASP C 72 ? 0.5865 0.5724 0.6424 0.0115 -0.0643 -0.3684 72 ASP H CA 3816 C C . ASP C 72 ? 0.5962 0.5441 0.6990 -0.0140 -0.0663 -0.3643 72 ASP H C 3817 O O . ASP C 72 ? 0.6057 0.4929 0.7374 -0.0173 -0.0570 -0.3514 72 ASP H O 3818 C CB . ASP C 72 ? 0.6227 0.5760 0.6826 0.0247 -0.0565 -0.3989 72 ASP H CB 3819 C CG . ASP C 72 ? 0.6815 0.6218 0.7732 0.0101 -0.0638 -0.4589 72 ASP H CG 3820 O OD1 . ASP C 72 ? 0.6939 0.6402 0.8128 -0.0147 -0.0749 -0.4746 72 ASP H OD1 3821 O OD2 . ASP C 72 ? 0.7154 0.6395 0.8079 0.0240 -0.0577 -0.4926 72 ASP H OD2 3822 N N . ASN C 73 ? 0.5958 0.5844 0.7081 -0.0316 -0.0781 -0.3714 73 ASN H N 3823 C CA . ASN C 73 ? 0.6018 0.5663 0.7606 -0.0579 -0.0794 -0.3635 73 ASN H CA 3824 C C . ASN C 73 ? 0.6487 0.5531 0.8545 -0.0729 -0.0769 -0.3931 73 ASN H C 3825 O O . ASN C 73 ? 0.6495 0.5031 0.8887 -0.0826 -0.0674 -0.3649 73 ASN H O 3826 C CB . ASN C 73 ? 0.6007 0.6295 0.7659 -0.0740 -0.0948 -0.3770 73 ASN H CB 3827 C CG . ASN C 73 ? 0.5567 0.6288 0.6972 -0.0634 -0.0937 -0.3332 73 ASN H CG 3828 O OD1 . ASN C 73 ? 0.5265 0.5715 0.6587 -0.0535 -0.0808 -0.2914 73 ASN H OD1 3829 N ND2 . ASN C 73 ? 0.5569 0.6986 0.6879 -0.0649 -0.1079 -0.3440 73 ASN H ND2 3830 N N . SER C 74 ? 0.6923 0.6027 0.9016 -0.0736 -0.0846 -0.4489 74 SER H N 3831 C CA . SER C 74 ? 0.7501 0.6014 1.0140 -0.0902 -0.0835 -0.4846 74 SER H CA 3832 C C . SER C 74 ? 0.7569 0.5333 1.0376 -0.0757 -0.0665 -0.4586 74 SER H C 3833 O O . SER C 74 ? 0.7913 0.5084 1.1272 -0.0919 -0.0613 -0.4526 74 SER H O 3834 C CB . SER C 74 ? 0.8011 0.6770 1.0622 -0.0911 -0.0947 -0.5573 74 SER H CB 3835 O OG . SER C 74 ? 0.8062 0.6853 1.0272 -0.0602 -0.0870 -0.5698 74 SER H OG 3836 N N . LYS C 75 ? 0.7258 0.5080 0.9631 -0.0459 -0.0581 -0.4393 75 LYS H N 3837 C CA . LYS C 75 ? 0.7263 0.4480 0.9773 -0.0295 -0.0434 -0.4103 75 LYS H CA 3838 C C . LYS C 75 ? 0.6777 0.3871 0.9242 -0.0295 -0.0357 -0.3436 75 LYS H C 3839 O O . LYS C 75 ? 0.6739 0.3410 0.9312 -0.0171 -0.0253 -0.3134 75 LYS H O 3840 C CB . LYS C 75 ? 0.7250 0.4598 0.9380 0.0022 -0.0373 -0.4220 75 LYS H CB 3841 C CG . LYS C 75 ? 0.7859 0.5014 1.0189 0.0099 -0.0364 -0.4837 75 LYS H CG 3842 C CD . LYS C 75 ? 0.7952 0.4758 1.0304 0.0390 -0.0222 -0.4728 75 LYS H CD 3843 C CE . LYS C 75 ? 0.8525 0.5268 1.0987 0.0533 -0.0191 -0.5376 75 LYS H CE 3844 N NZ . LYS C 75 ? 0.9162 0.5477 1.2189 0.0313 -0.0247 -0.5875 75 LYS H NZ 3845 N N . SER C 76 ? 0.6408 0.3914 0.8722 -0.0423 -0.0410 -0.3225 76 SER H N 3846 C CA . SER C 76 ? 0.5988 0.3505 0.8187 -0.0414 -0.0338 -0.2662 76 SER H CA 3847 C C . SER C 76 ? 0.5630 0.3177 0.7420 -0.0145 -0.0267 -0.2393 76 SER H C 3848 O O . SER C 76 ? 0.5503 0.2790 0.7328 -0.0095 -0.0184 -0.2003 76 SER H O 3849 C CB . SER C 76 ? 0.6227 0.3266 0.8907 -0.0586 -0.0265 -0.2381 76 SER H CB 3850 O OG . SER C 76 ? 0.6520 0.3019 0.9395 -0.0457 -0.0183 -0.2294 76 SER H OG 3851 N N . HIS C 77 ? 0.5474 0.3399 0.6894 0.0013 -0.0307 -0.2601 77 HIS H N 3852 C CA . HIS C 77 ? 0.5214 0.3224 0.6286 0.0255 -0.0247 -0.2407 77 HIS H CA 3853 C C . HIS C 77 ? 0.4797 0.3317 0.5484 0.0305 -0.0278 -0.2231 77 HIS H C 3854 O O . HIS C 77 ? 0.4801 0.3742 0.5376 0.0261 -0.0361 -0.2429 77 HIS H O 3855 C CB . HIS C 77 ? 0.5476 0.3508 0.6474 0.0426 -0.0233 -0.2768 77 HIS H CB 3856 C CG . HIS C 77 ? 0.5845 0.3315 0.7211 0.0482 -0.0163 -0.2856 77 HIS H CG 3857 N ND1 . HIS C 77 ? 0.6239 0.3634 0.7689 0.0609 -0.0140 -0.3284 77 HIS H ND1 3858 C CD2 . HIS C 77 ? 0.5928 0.2907 0.7613 0.0452 -0.0103 -0.2546 77 HIS H CD2 3859 C CE1 . HIS C 77 ? 0.6542 0.3374 0.8391 0.0664 -0.0068 -0.3237 77 HIS H CE1 3860 N NE2 . HIS C 77 ? 0.6360 0.2941 0.8355 0.0569 -0.0049 -0.2762 77 HIS H NE2 3861 N N . VAL C 78 ? 0.4484 0.2976 0.5001 0.0399 -0.0217 -0.1861 78 VAL H N 3862 C CA . VAL C 78 ? 0.4152 0.3042 0.4350 0.0482 -0.0227 -0.1688 78 VAL H CA 3863 C C . VAL C 78 ? 0.4055 0.2964 0.4050 0.0672 -0.0170 -0.1570 78 VAL H C 3864 O O . VAL C 78 ? 0.4037 0.2657 0.4100 0.0718 -0.0114 -0.1394 78 VAL H O 3865 C CB . VAL C 78 ? 0.3891 0.2777 0.4097 0.0403 -0.0205 -0.1376 78 VAL H CB 3866 C CG1 . VAL C 78 ? 0.3591 0.2838 0.3550 0.0494 -0.0214 -0.1235 78 VAL H CG1 3867 C CG2 . VAL C 78 ? 0.4010 0.2897 0.4476 0.0205 -0.0239 -0.1444 78 VAL H CG2 3868 N N . PHE C 79 ? 0.3994 0.3304 0.3754 0.0775 -0.0186 -0.1631 79 PHE H N 3869 C CA . PHE C 79 ? 0.3936 0.3354 0.3540 0.0941 -0.0126 -0.1553 79 PHE H CA 3870 C C . PHE C 79 ? 0.3667 0.3264 0.3124 0.0974 -0.0108 -0.1227 79 PHE H C 3871 O O . PHE C 79 ? 0.3606 0.3515 0.2960 0.0964 -0.0146 -0.1165 79 PHE H O 3872 C CB . PHE C 79 ? 0.4167 0.3955 0.3630 0.1035 -0.0135 -0.1846 79 PHE H CB 3873 C CG . PHE C 79 ? 0.4529 0.4134 0.4168 0.0997 -0.0156 -0.2250 79 PHE H CG 3874 C CD1 . PHE C 79 ? 0.4687 0.3831 0.4566 0.1037 -0.0095 -0.2302 79 PHE H CD1 3875 C CD2 . PHE C 79 ? 0.4746 0.4644 0.4350 0.0921 -0.0243 -0.2585 79 PHE H CD2 3876 C CE1 . PHE C 79 ? 0.5096 0.3993 0.5216 0.1005 -0.0104 -0.2684 79 PHE H CE1 3877 C CE2 . PHE C 79 ? 0.5149 0.4838 0.4970 0.0866 -0.0266 -0.3015 79 PHE H CE2 3878 C CZ . PHE C 79 ? 0.5328 0.4476 0.5426 0.0909 -0.0188 -0.3066 79 PHE H CZ 3879 N N . PHE C 80 ? 0.3554 0.2945 0.3043 0.1011 -0.0057 -0.1020 80 PHE H N 3880 C CA . PHE C 80 ? 0.3372 0.2878 0.2779 0.1038 -0.0034 -0.0755 80 PHE H CA 3881 C C . PHE C 80 ? 0.3437 0.3157 0.2779 0.1165 0.0021 -0.0708 80 PHE H C 3882 O O . PHE C 80 ? 0.3534 0.3172 0.2941 0.1235 0.0057 -0.0792 80 PHE H O 3883 C CB . PHE C 80 ? 0.3276 0.2485 0.2769 0.0973 -0.0027 -0.0588 80 PHE H CB 3884 C CG . PHE C 80 ? 0.3134 0.2406 0.2593 0.0982 -0.0008 -0.0380 80 PHE H CG 3885 C CD1 . PHE C 80 ? 0.3137 0.2473 0.2617 0.1049 0.0021 -0.0293 80 PHE H CD1 3886 C CD2 . PHE C 80 ? 0.3060 0.2327 0.2515 0.0920 -0.0018 -0.0291 80 PHE H CD2 3887 C CE1 . PHE C 80 ? 0.3043 0.2422 0.2553 0.1022 0.0029 -0.0124 80 PHE H CE1 3888 C CE2 . PHE C 80 ? 0.2989 0.2259 0.2467 0.0915 -0.0002 -0.0149 80 PHE H CE2 3889 C CZ . PHE C 80 ? 0.2964 0.2278 0.2477 0.0950 0.0014 -0.0068 80 PHE H CZ 3890 N N . LYS C 81 ? 0.3416 0.3428 0.2670 0.1199 0.0037 -0.0547 81 LYS H N 3891 C CA . LYS C 81 ? 0.3517 0.3813 0.2728 0.1305 0.0106 -0.0460 81 LYS H CA 3892 C C . LYS C 81 ? 0.3376 0.3803 0.2622 0.1289 0.0133 -0.0149 81 LYS H C 3893 O O . LYS C 81 ? 0.3336 0.3931 0.2539 0.1284 0.0112 -0.0042 81 LYS H O 3894 C CB . LYS C 81 ? 0.3795 0.4483 0.2847 0.1398 0.0120 -0.0662 81 LYS H CB 3895 C CG . LYS C 81 ? 0.3942 0.5103 0.2897 0.1500 0.0200 -0.0483 81 LYS H CG 3896 C CD . LYS C 81 ? 0.4255 0.5830 0.3040 0.1625 0.0247 -0.0744 81 LYS H CD 3897 C CE . LYS C 81 ? 0.4387 0.5922 0.3274 0.1725 0.0345 -0.0834 81 LYS H CE 3898 N NZ . LYS C 81 ? 0.4785 0.6850 0.3496 0.1878 0.0432 -0.1045 81 LYS H NZ 3899 N N . MET C 82 ? 0.3288 0.3649 0.2660 0.1283 0.0175 -0.0002 82 MET H N 3900 C CA . MET C 82 ? 0.3195 0.3606 0.2688 0.1237 0.0201 0.0269 82 MET H CA 3901 C C . MET C 82 ? 0.3260 0.3988 0.2823 0.1295 0.0288 0.0417 82 MET H C 3902 O O . MET C 82 ? 0.3236 0.3999 0.2834 0.1343 0.0316 0.0324 82 MET H O 3903 C CB . MET C 82 ? 0.3122 0.3166 0.2752 0.1123 0.0155 0.0290 82 MET H CB 3904 C CG . MET C 82 ? 0.3113 0.3101 0.2916 0.1049 0.0166 0.0492 82 MET H CG 3905 S SD . MET C 82 ? 0.3118 0.2718 0.2996 0.0926 0.0101 0.0394 82 MET H SD 3906 C CE . MET C 82 ? 0.3045 0.2648 0.3045 0.0860 0.0078 0.0400 82 MET H CE 3907 N N . ASN C 83 A 0.3354 0.4326 0.2983 0.1295 0.0339 0.0682 82 ASN H N 3908 C CA . ASN C 83 A 0.3496 0.4830 0.3229 0.1331 0.0441 0.0887 82 ASN H CA 3909 C C . ASN C 83 A 0.3440 0.4596 0.3498 0.1198 0.0447 0.1092 82 ASN H C 3910 O O . ASN C 83 A 0.3412 0.4196 0.3583 0.1092 0.0378 0.1086 82 ASN H O 3911 C CB . ASN C 83 A 0.3688 0.5472 0.3324 0.1405 0.0506 0.1115 82 ASN H CB 3912 C CG . ASN C 83 A 0.3901 0.6009 0.3206 0.1533 0.0499 0.0881 82 ASN H CG 3913 O OD1 . ASN C 83 A 0.4007 0.6045 0.3208 0.1582 0.0487 0.0554 82 ASN H OD1 3914 N ND2 . ASN C 83 A 0.4070 0.6539 0.3236 0.1588 0.0499 0.1041 82 ASN H ND2 3915 N N . SER C 84 B 0.3468 0.4926 0.3686 0.1202 0.0532 0.1244 82 SER H N 3916 C CA . SER C 84 B 0.3495 0.4914 0.4086 0.1056 0.0552 0.1474 82 SER H CA 3917 C C . SER C 84 B 0.3326 0.4320 0.4079 0.0912 0.0438 0.1327 82 SER H C 3918 O O . SER C 84 B 0.3383 0.4133 0.4362 0.0775 0.0406 0.1417 82 SER H O 3919 C CB . SER C 84 B 0.3676 0.5146 0.4439 0.1002 0.0605 0.1811 82 SER H CB 3920 O OG . SER C 84 B 0.3891 0.5774 0.4421 0.1146 0.0682 0.1944 82 SER H OG 3921 N N . LEU C 85 C 0.3172 0.4106 0.3828 0.0951 0.0381 0.1105 82 LEU H N 3922 C CA . LEU C 85 C 0.3062 0.3692 0.3805 0.0831 0.0264 0.0969 82 LEU H CA 3923 C C . LEU C 85 C 0.3079 0.3855 0.4181 0.0690 0.0252 0.1095 82 LEU H C 3924 O O . LEU C 85 C 0.3132 0.4283 0.4401 0.0721 0.0335 0.1249 82 LEU H O 3925 C CB . LEU C 85 C 0.2976 0.3532 0.3534 0.0926 0.0207 0.0764 82 LEU H CB 3926 C CG . LEU C 85 C 0.2933 0.3197 0.3216 0.0971 0.0168 0.0596 82 LEU H CG 3927 C CD1 . LEU C 85 C 0.2997 0.3418 0.3101 0.1102 0.0245 0.0572 82 LEU H CD1 3928 C CD2 . LEU C 85 C 0.2920 0.3028 0.3120 0.1005 0.0098 0.0452 82 LEU H CD2 3929 N N . GLN C 86 ? 0.3107 0.3625 0.4345 0.0526 0.0155 0.1013 83 GLN H N 3930 C CA . GLN C 86 ? 0.3190 0.3840 0.4800 0.0351 0.0110 0.1068 83 GLN H CA 3931 C C . GLN C 86 ? 0.3153 0.3692 0.4695 0.0275 -0.0041 0.0838 83 GLN H C 3932 O O . GLN C 86 ? 0.3058 0.3421 0.4282 0.0365 -0.0085 0.0690 83 GLN H O 3933 C CB . GLN C 86 ? 0.3366 0.3852 0.5298 0.0192 0.0150 0.1205 83 GLN H CB 3934 C CG . GLN C 86 ? 0.3476 0.4113 0.5447 0.0282 0.0301 0.1502 83 GLN H CG 3935 C CD . GLN C 86 ? 0.3534 0.4689 0.5659 0.0323 0.0406 0.1730 83 GLN H CD 3936 O OE1 . GLN C 86 ? 0.3540 0.4928 0.5870 0.0250 0.0367 0.1700 83 GLN H OE1 3937 N NE2 . GLN C 86 ? 0.3629 0.5035 0.5655 0.0449 0.0542 0.1963 83 GLN H NE2 3938 N N . ALA C 87 ? 0.3259 0.3960 0.5110 0.0104 -0.0122 0.0824 84 ALA H N 3939 C CA . ALA C 87 ? 0.3393 0.4136 0.5179 0.0029 -0.0282 0.0625 84 ALA H CA 3940 C C . ALA C 87 ? 0.3525 0.3905 0.5007 0.0020 -0.0338 0.0403 84 ALA H C 3941 O O . ALA C 87 ? 0.3465 0.3865 0.4660 0.0105 -0.0403 0.0317 84 ALA H O 3942 C CB . ALA C 87 ? 0.3498 0.4458 0.5702 -0.0206 -0.0375 0.0597 84 ALA H CB 3943 N N . ASN C 88 ? 0.3784 0.3851 0.5359 -0.0067 -0.0297 0.0340 85 ASN H N 3944 C CA . ASN C 88 ? 0.3974 0.3739 0.5308 -0.0070 -0.0329 0.0114 85 ASN H CA 3945 C C . ASN C 88 ? 0.3585 0.3193 0.4554 0.0122 -0.0257 0.0144 85 ASN H C 3946 O O . ASN C 88 ? 0.3567 0.2968 0.4354 0.0132 -0.0263 -0.0016 85 ASN H O 3947 C CB . ASN C 88 ? 0.4570 0.4037 0.6192 -0.0212 -0.0308 0.0003 85 ASN H CB 3948 C CG . ASN C 88 ? 0.5099 0.4372 0.6874 -0.0134 -0.0168 0.0235 85 ASN H CG 3949 O OD1 . ASN C 88 ? 0.4909 0.4320 0.6537 0.0015 -0.0090 0.0453 85 ASN H OD1 3950 N ND2 . ASN C 88 ? 0.6172 0.5141 0.8263 -0.0231 -0.0137 0.0185 85 ASN H ND2 3951 N N . ASP C 89 ? 0.3240 0.2980 0.4126 0.0267 -0.0189 0.0323 86 ASP H N 3952 C CA . ASP C 89 ? 0.3023 0.2669 0.3588 0.0425 -0.0150 0.0309 86 ASP H CA 3953 C C . ASP C 89 ? 0.2885 0.2639 0.3269 0.0481 -0.0221 0.0262 86 ASP H C 3954 O O . ASP C 89 ? 0.2790 0.2448 0.2965 0.0583 -0.0201 0.0244 86 ASP H O 3955 C CB . ASP C 89 ? 0.2943 0.2686 0.3502 0.0554 -0.0044 0.0468 86 ASP H CB 3956 C CG . ASP C 89 ? 0.2995 0.2623 0.3662 0.0541 0.0028 0.0564 86 ASP H CG 3957 O OD1 . ASP C 89 ? 0.3062 0.2461 0.3630 0.0548 0.0024 0.0473 86 ASP H OD1 3958 O OD2 . ASP C 89 ? 0.3008 0.2801 0.3874 0.0536 0.0096 0.0760 86 ASP H OD2 3959 N N . THR C 90 ? 0.2888 0.2855 0.3388 0.0406 -0.0313 0.0258 87 THR H N 3960 C CA . THR C 90 ? 0.2867 0.2970 0.3226 0.0460 -0.0395 0.0265 87 THR H CA 3961 C C . THR C 90 ? 0.2948 0.2878 0.3041 0.0431 -0.0421 0.0141 87 THR H C 3962 O O . THR C 90 ? 0.3040 0.2905 0.3125 0.0310 -0.0447 -0.0013 87 THR H O 3963 C CB . THR C 90 ? 0.2915 0.3365 0.3465 0.0369 -0.0512 0.0286 87 THR H CB 3964 O OG1 . THR C 90 ? 0.2802 0.3470 0.3618 0.0426 -0.0465 0.0433 87 THR H OG1 3965 C CG2 . THR C 90 ? 0.2990 0.3625 0.3373 0.0420 -0.0620 0.0323 87 THR H CG2 3966 N N . ALA C 91 ? 0.2954 0.2806 0.2867 0.0544 -0.0399 0.0204 88 ALA H N 3967 C CA . ALA C 91 ? 0.3047 0.2773 0.2724 0.0526 -0.0393 0.0136 88 ALA H CA 3968 C C . ALA C 91 ? 0.3099 0.2745 0.2689 0.0641 -0.0365 0.0266 88 ALA H C 3969 O O . ALA C 91 ? 0.3109 0.2720 0.2820 0.0752 -0.0334 0.0354 88 ALA H O 3970 C CB . ALA C 91 ? 0.3011 0.2501 0.2656 0.0497 -0.0311 0.0014 88 ALA H CB 3971 N N . ILE C 92 ? 0.3185 0.2804 0.2591 0.0611 -0.0364 0.0267 89 ILE H N 3972 C CA . ILE C 92 ? 0.3208 0.2674 0.2583 0.0682 -0.0314 0.0383 89 ILE H CA 3973 C C . ILE C 92 ? 0.3119 0.2355 0.2471 0.0669 -0.0226 0.0261 89 ILE H C 3974 O O . ILE C 92 ? 0.3090 0.2329 0.2352 0.0599 -0.0202 0.0139 89 ILE H O 3975 C CB . ILE C 92 ? 0.3376 0.2989 0.2590 0.0648 -0.0344 0.0508 89 ILE H CB 3976 C CG1 . ILE C 92 ? 0.3482 0.3426 0.2700 0.0663 -0.0458 0.0645 89 ILE H CG1 3977 C CG2 . ILE C 92 ? 0.3455 0.2861 0.2730 0.0701 -0.0280 0.0663 89 ILE H CG2 3978 C CD1 . ILE C 92 ? 0.3701 0.3934 0.2698 0.0617 -0.0501 0.0761 89 ILE H CD1 3979 N N . TYR C 93 ? 0.3087 0.2154 0.2543 0.0745 -0.0181 0.0276 90 TYR H N 3980 C CA . TYR C 93 ? 0.3048 0.1972 0.2499 0.0736 -0.0119 0.0160 90 TYR H CA 3981 C C . TYR C 93 ? 0.3211 0.2001 0.2678 0.0713 -0.0089 0.0204 90 TYR H C 3982 O O . TYR C 93 ? 0.3365 0.2060 0.2938 0.0757 -0.0094 0.0313 90 TYR H O 3983 C CB . TYR C 93 ? 0.2961 0.1869 0.2510 0.0821 -0.0096 0.0094 90 TYR H CB 3984 C CG . TYR C 93 ? 0.2832 0.1882 0.2406 0.0817 -0.0101 0.0085 90 TYR H CG 3985 C CD1 . TYR C 93 ? 0.2841 0.2032 0.2491 0.0818 -0.0143 0.0160 90 TYR H CD1 3986 C CD2 . TYR C 93 ? 0.2764 0.1826 0.2328 0.0805 -0.0067 0.0030 90 TYR H CD2 3987 C CE1 . TYR C 93 ? 0.2774 0.2086 0.2515 0.0781 -0.0143 0.0166 90 TYR H CE1 3988 C CE2 . TYR C 93 ? 0.2711 0.1870 0.2362 0.0789 -0.0060 0.0070 90 TYR H CE2 3989 C CZ . TYR C 93 ? 0.2717 0.1985 0.2467 0.0763 -0.0094 0.0131 90 TYR H CZ 3990 O OH . TYR C 93 ? 0.2648 0.2002 0.2550 0.0717 -0.0083 0.0182 90 TYR H OH 3991 N N . TYR C 94 ? 0.3222 0.2008 0.2633 0.0643 -0.0051 0.0135 91 TYR H N 3992 C CA . TYR C 94 ? 0.3340 0.2038 0.2812 0.0586 -0.0013 0.0182 91 TYR H CA 3993 C C . TYR C 94 ? 0.3315 0.1979 0.2859 0.0560 0.0011 0.0031 91 TYR H C 3994 O O . TYR C 94 ? 0.3151 0.1928 0.2634 0.0566 0.0018 -0.0061 91 TYR H O 3995 C CB . TYR C 94 ? 0.3417 0.2269 0.2767 0.0508 0.0019 0.0268 91 TYR H CB 3996 C CG . TYR C 94 ? 0.3488 0.2507 0.2705 0.0512 -0.0016 0.0407 91 TYR H CG 3997 C CD1 . TYR C 94 ? 0.3444 0.2631 0.2518 0.0511 -0.0051 0.0298 91 TYR H CD1 3998 C CD2 . TYR C 94 ? 0.3678 0.2718 0.2929 0.0507 -0.0017 0.0653 91 TYR H CD2 3999 C CE1 . TYR C 94 ? 0.3580 0.3002 0.2516 0.0498 -0.0104 0.0384 91 TYR H CE1 4000 C CE2 . TYR C 94 ? 0.3801 0.3097 0.2901 0.0517 -0.0066 0.0803 91 TYR H CE2 4001 C CZ . TYR C 94 ? 0.3747 0.3260 0.2673 0.0508 -0.0117 0.0644 91 TYR H CZ 4002 O OH . TYR C 94 ? 0.3976 0.3814 0.2742 0.0504 -0.0189 0.0748 91 TYR H OH 4003 N N . CYS C 95 ? 0.3473 0.1992 0.3179 0.0529 0.0018 0.0008 92 CYS H N 4004 C CA . CYS C 95 ? 0.3479 0.2040 0.3275 0.0455 0.0031 -0.0112 92 CYS H CA 4005 C C . CYS C 95 ? 0.3479 0.2098 0.3316 0.0344 0.0085 0.0025 92 CYS H C 4006 O O . CYS C 95 ? 0.3596 0.2161 0.3429 0.0327 0.0107 0.0218 92 CYS H O 4007 C CB . CYS C 95 ? 0.3742 0.2155 0.3722 0.0448 0.0005 -0.0265 92 CYS H CB 4008 S SG . CYS C 95 ? 0.4240 0.2322 0.4491 0.0396 0.0027 -0.0153 92 CYS H SG 4009 N N . ALA C 96 ? 0.3325 0.2116 0.3197 0.0284 0.0111 -0.0043 93 ALA H N 4010 C CA . ALA C 96 ? 0.3360 0.2297 0.3270 0.0187 0.0186 0.0084 93 ALA H CA 4011 C C . ALA C 96 ? 0.3280 0.2419 0.3346 0.0114 0.0211 -0.0008 93 ALA H C 4012 O O . ALA C 96 ? 0.3093 0.2348 0.3152 0.0174 0.0170 -0.0158 93 ALA H O 4013 C CB . ALA C 96 ? 0.3330 0.2433 0.3001 0.0240 0.0226 0.0149 93 ALA H CB 4014 N N . ARG C 97 ? 0.3420 0.2641 0.3653 -0.0016 0.0278 0.0119 94 ARG H N 4015 C CA . ARG C 97 ? 0.3379 0.2898 0.3768 -0.0089 0.0328 0.0083 94 ARG H CA 4016 C C . ARG C 97 ? 0.3301 0.3085 0.3492 -0.0006 0.0419 0.0118 94 ARG H C 4017 O O . ARG C 97 ? 0.3400 0.3218 0.3418 -0.0001 0.0482 0.0259 94 ARG H O 4018 C CB . ARG C 97 ? 0.3638 0.3164 0.4331 -0.0280 0.0383 0.0233 94 ARG H CB 4019 C CG . ARG C 97 ? 0.3795 0.3081 0.4779 -0.0385 0.0291 0.0098 94 ARG H CG 4020 C CD . ARG C 97 ? 0.3886 0.3409 0.5215 -0.0550 0.0281 0.0003 94 ARG H CD 4021 N NE . ARG C 97 ? 0.3740 0.3704 0.5007 -0.0492 0.0323 -0.0020 94 ARG H NE 4022 C CZ . ARG C 97 ? 0.3799 0.4104 0.5261 -0.0593 0.0425 0.0101 94 ARG H CZ 4023 N NH1 . ARG C 97 ? 0.3695 0.4380 0.5101 -0.0484 0.0462 0.0045 94 ARG H NH1 4024 N NH2 . ARG C 97 ? 0.4024 0.4313 0.5777 -0.0794 0.0501 0.0292 94 ARG H NH2 4025 N N . MET C 98 ? 0.3151 0.3143 0.3377 0.0071 0.0420 -0.0022 95 MET H N 4026 C CA . MET C 98 ? 0.3149 0.3376 0.3264 0.0169 0.0516 -0.0056 95 MET H CA 4027 C C . MET C 98 ? 0.3090 0.3649 0.3459 0.0174 0.0558 -0.0112 95 MET H C 4028 O O . MET C 98 ? 0.3021 0.3647 0.3630 0.0082 0.0494 -0.0122 95 MET H O 4029 C CB . MET C 98 ? 0.3079 0.3141 0.3002 0.0323 0.0466 -0.0175 95 MET H CB 4030 C CG . MET C 98 ? 0.3110 0.2887 0.2837 0.0321 0.0397 -0.0129 95 MET H CG 4031 S SD . MET C 98 ? 0.3080 0.2727 0.2647 0.0460 0.0360 -0.0256 95 MET H SD 4032 C CE . MET C 98 ? 0.3234 0.3106 0.2647 0.0471 0.0476 -0.0318 95 MET H CE 4033 N N . ARG C 99 ? 0.3133 0.3927 0.3475 0.0285 0.0664 -0.0171 96 ARG H N 4034 C CA . ARG C 99 ? 0.3099 0.4275 0.3719 0.0323 0.0728 -0.0206 96 ARG H CA 4035 C C . ARG C 99 ? 0.3166 0.4593 0.4003 0.0130 0.0786 -0.0069 96 ARG H C 4036 O O . ARG C 99 ? 0.3137 0.4728 0.4272 0.0047 0.0723 -0.0073 96 ARG H O 4037 C CB . ARG C 99 ? 0.2956 0.4151 0.3760 0.0410 0.0604 -0.0278 96 ARG H CB 4038 C CG . ARG C 99 ? 0.2934 0.3865 0.3586 0.0584 0.0546 -0.0351 96 ARG H CG 4039 C CD . ARG C 99 ? 0.2901 0.4039 0.3790 0.0746 0.0511 -0.0368 96 ARG H CD 4040 N NE . ARG C 99 ? 0.2880 0.4347 0.4010 0.0659 0.0432 -0.0332 96 ARG H NE 4041 C CZ . ARG C 99 ? 0.2847 0.4683 0.4256 0.0767 0.0410 -0.0311 96 ARG H CZ 4042 N NH1 . ARG C 99 ? 0.2934 0.4813 0.4450 0.0991 0.0473 -0.0302 96 ARG H NH1 4043 N NH2 . ARG C 99 ? 0.2849 0.5022 0.4468 0.0650 0.0316 -0.0302 96 ARG H NH2 4044 N N . ILE C 100 ? 0.3315 0.4816 0.4026 0.0046 0.0905 0.0064 97 ILE H N 4045 C CA . ILE C 100 ? 0.3428 0.5057 0.4374 -0.0172 0.0946 0.0261 97 ILE H CA 4046 C C . ILE C 100 ? 0.3495 0.5682 0.4682 -0.0210 0.1114 0.0330 97 ILE H C 4047 O O . ILE C 100 ? 0.3493 0.5976 0.4564 -0.0056 0.1244 0.0248 97 ILE H O 4048 C CB . ILE C 100 ? 0.3598 0.4965 0.4359 -0.0276 0.0956 0.0467 97 ILE H CB 4049 C CG1 . ILE C 100 ? 0.3783 0.5481 0.4336 -0.0261 0.1129 0.0618 97 ILE H CG1 4050 C CG2 . ILE C 100 ? 0.3521 0.4431 0.4013 -0.0182 0.0820 0.0382 97 ILE H CG2 4051 C CD1 . ILE C 100 ? 0.3992 0.5988 0.4819 -0.0459 0.1256 0.0906 97 ILE H CD1 4052 N N . THR C 101 ? 0.3558 0.5887 0.5125 -0.0422 0.1110 0.0457 98 THR H N 4053 C CA . THR C 101 ? 0.3588 0.6488 0.5509 -0.0494 0.1242 0.0528 98 THR H CA 4054 C C . THR C 101 ? 0.3817 0.6903 0.5907 -0.0726 0.1384 0.0838 98 THR H C 4055 O O . THR C 101 ? 0.3915 0.7550 0.6219 -0.0769 0.1554 0.0948 98 THR H O 4056 C CB . THR C 101 ? 0.3459 0.6476 0.5787 -0.0566 0.1096 0.0400 98 THR H CB 4057 O OG1 . THR C 101 ? 0.3561 0.6182 0.6016 -0.0773 0.0949 0.0418 98 THR H OG1 4058 C CG2 . THR C 101 ? 0.3246 0.6187 0.5433 -0.0312 0.0977 0.0164 98 THR H CG2 4059 N N . THR C 102 ? 0.3952 0.6606 0.5971 -0.0861 0.1328 0.1007 99 THR H N 4060 C CA . THR C 102 ? 0.4242 0.6996 0.6490 -0.1095 0.1451 0.1375 99 THR H CA 4061 C C . THR C 102 ? 0.4434 0.6741 0.6406 -0.1100 0.1422 0.1579 99 THR H C 4062 O O . THR C 102 ? 0.4326 0.6209 0.6005 -0.0963 0.1283 0.1408 99 THR H O 4063 C CB . THR C 102 ? 0.4316 0.7002 0.7172 -0.1377 0.1375 0.1414 99 THR H CB 4064 O OG1 . THR C 102 ? 0.4319 0.6364 0.7193 -0.1422 0.1179 0.1287 99 THR H OG1 4065 C CG2 . THR C 102 ? 0.4116 0.7233 0.7287 -0.1375 0.1335 0.1180 99 THR H CG2 4066 N N . ASP C 103 ? 0.4776 0.7211 0.6893 -0.1265 0.1557 0.1983 100 ASP H N 4067 C CA . ASP C 103 ? 0.5030 0.7118 0.6953 -0.1268 0.1543 0.2272 100 ASP H CA 4068 C C . ASP C 103 ? 0.5100 0.6475 0.7274 -0.1353 0.1364 0.2238 100 ASP H C 4069 O O . ASP C 103 ? 0.5295 0.6344 0.7310 -0.1303 0.1331 0.2443 100 ASP H O 4070 C CB . ASP C 103 ? 0.5403 0.7878 0.7499 -0.1433 0.1749 0.2785 100 ASP H CB 4071 C CG . ASP C 103 ? 0.5445 0.8664 0.7170 -0.1309 0.1949 0.2844 100 ASP H CG 4072 O OD1 . ASP C 103 ? 0.5251 0.8568 0.6502 -0.1074 0.1916 0.2521 100 ASP H OD1 4073 O OD2 . ASP C 103 ? 0.5715 0.9435 0.7648 -0.1454 0.2149 0.3209 100 ASP H OD2 4074 N N . TRP C 104 A 0.4987 0.6156 0.7542 -0.1463 0.1246 0.1961 100 TRP H N 4075 C CA . TRP C 104 A 0.5142 0.5688 0.8026 -0.1580 0.1109 0.1911 100 TRP H CA 4076 C C . TRP C 104 A 0.4867 0.5004 0.7479 -0.1397 0.0918 0.1521 100 TRP H C 4077 O O . TRP C 104 A 0.4571 0.4882 0.6994 -0.1277 0.0842 0.1194 100 TRP H O 4078 C CB . TRP C 104 A 0.5294 0.5876 0.8826 -0.1864 0.1090 0.1840 100 TRP H CB 4079 C CG . TRP C 104 A 0.5527 0.6563 0.9398 -0.2066 0.1280 0.2209 100 TRP H CG 4080 C CD1 . TRP C 104 A 0.5392 0.7058 0.9402 -0.2125 0.1367 0.2162 100 TRP H CD1 4081 C CD2 . TRP C 104 A 0.5971 0.6917 1.0126 -0.2233 0.1422 0.2730 100 TRP H CD2 4082 N NE1 . TRP C 104 A 0.5703 0.7708 1.0053 -0.2329 0.1565 0.2602 100 TRP H NE1 4083 C CE2 . TRP C 104 A 0.6063 0.7636 1.0503 -0.2405 0.1604 0.2979 100 TRP H CE2 4084 C CE3 . TRP C 104 A 0.6324 0.6745 1.0548 -0.2241 0.1420 0.3043 100 TRP H CE3 4085 C CZ2 . TRP C 104 A 0.6497 0.8206 1.1278 -0.2604 0.1791 0.3553 100 TRP H CZ2 4086 C CZ3 . TRP C 104 A 0.6750 0.7273 1.1329 -0.2426 0.1596 0.3629 100 TRP H CZ3 4087 C CH2 . TRP C 104 A 0.6840 0.8007 1.1681 -0.2613 0.1781 0.3886 100 TRP H CH2 4088 N N . PHE C 105 B 0.5017 0.4623 0.7669 -0.1378 0.0853 0.1594 100 PHE H N 4089 C CA . PHE C 105 B 0.4847 0.4056 0.7275 -0.1207 0.0701 0.1296 100 PHE H CA 4090 C C . PHE C 105 B 0.4472 0.3882 0.6342 -0.0958 0.0655 0.1086 100 PHE H C 4091 O O . PHE C 105 B 0.4272 0.3539 0.6032 -0.0857 0.0529 0.0752 100 PHE H O 4092 C CB . PHE C 105 B 0.4909 0.3850 0.7740 -0.1343 0.0575 0.0948 100 PHE H CB 4093 C CG . PHE C 105 B 0.5314 0.4039 0.8777 -0.1622 0.0621 0.1118 100 PHE H CG 4094 C CD1 . PHE C 105 B 0.5678 0.3975 0.9351 -0.1649 0.0679 0.1451 100 PHE H CD1 4095 C CD2 . PHE C 105 B 0.5365 0.4331 0.9263 -0.1862 0.0607 0.0972 100 PHE H CD2 4096 C CE1 . PHE C 105 B 0.6119 0.4160 1.0446 -0.1913 0.0733 0.1642 100 PHE H CE1 4097 C CE2 . PHE C 105 B 0.5789 0.4539 1.0340 -0.2152 0.0652 0.1132 100 PHE H CE2 4098 C CZ . PHE C 105 B 0.6180 0.4432 1.0958 -0.2181 0.0721 0.1472 100 PHE H CZ 4099 N N . ALA C 106 ? 0.4400 0.4128 0.5928 -0.0859 0.0757 0.1286 101 ALA H N 4100 C CA . ALA C 106 ? 0.4130 0.3970 0.5184 -0.0638 0.0715 0.1092 101 ALA H CA 4101 C C . ALA C 106 ? 0.4202 0.3765 0.4994 -0.0511 0.0662 0.1204 101 ALA H C 4102 O O . ALA C 106 ? 0.4294 0.4059 0.4818 -0.0452 0.0724 0.1417 101 ALA H O 4103 C CB . ALA C 106 ? 0.4062 0.4418 0.4901 -0.0589 0.0843 0.1132 101 ALA H CB 4104 N N . TYR C 107 ? 0.4173 0.3334 0.5041 -0.0461 0.0542 0.1034 102 TYR H N 4105 C CA . TYR C 107 ? 0.4285 0.3142 0.5066 -0.0361 0.0488 0.1152 102 TYR H CA 4106 C C . TYR C 107 ? 0.4031 0.2869 0.4482 -0.0182 0.0398 0.0906 102 TYR H C 4107 O O . TYR C 107 ? 0.3835 0.2696 0.4267 -0.0152 0.0347 0.0614 102 TYR H O 4108 C CB . TYR C 107 ? 0.4486 0.2898 0.5684 -0.0439 0.0441 0.1116 102 TYR H CB 4109 C CG . TYR C 107 ? 0.4828 0.3150 0.6466 -0.0640 0.0526 0.1397 102 TYR H CG 4110 C CD1 . TYR C 107 ? 0.4983 0.3607 0.6586 -0.0707 0.0650 0.1804 102 TYR H CD1 4111 C CD2 . TYR C 107 ? 0.5041 0.2984 0.7155 -0.0769 0.0489 0.1259 102 TYR H CD2 4112 C CE1 . TYR C 107 ? 0.5322 0.3873 0.7376 -0.0903 0.0742 0.2118 102 TYR H CE1 4113 C CE2 . TYR C 107 ? 0.5400 0.3212 0.7999 -0.0976 0.0569 0.1526 102 TYR H CE2 4114 C CZ . TYR C 107 ? 0.5535 0.3648 0.8115 -0.1045 0.0700 0.1987 102 TYR H CZ 4115 O OH . TYR C 107 ? 0.5930 0.3933 0.9036 -0.1265 0.0795 0.2313 102 TYR H OH 4116 N N . TRP C 108 ? 0.4077 0.2924 0.4291 -0.0071 0.0376 0.1048 103 TRP H N 4117 C CA . TRP C 108 ? 0.3888 0.2655 0.3893 0.0076 0.0286 0.0864 103 TRP H CA 4118 C C . TRP C 108 ? 0.4051 0.2468 0.4245 0.0139 0.0228 0.0922 103 TRP H C 4119 O O . TRP C 108 ? 0.4287 0.2535 0.4720 0.0095 0.0258 0.1172 103 TRP H O 4120 C CB . TRP C 108 ? 0.3844 0.2903 0.3504 0.0147 0.0286 0.0937 103 TRP H CB 4121 C CG . TRP C 108 ? 0.3695 0.3037 0.3172 0.0141 0.0333 0.0755 103 TRP H CG 4122 C CD1 . TRP C 108 ? 0.3714 0.3264 0.3262 0.0059 0.0429 0.0751 103 TRP H CD1 4123 C CD2 . TRP C 108 ? 0.3544 0.2987 0.2793 0.0229 0.0294 0.0547 103 TRP H CD2 4124 N NE1 . TRP C 108 ? 0.3593 0.3360 0.2966 0.0119 0.0458 0.0541 103 TRP H NE1 4125 C CE2 . TRP C 108 ? 0.3496 0.3169 0.2694 0.0215 0.0374 0.0411 103 TRP H CE2 4126 C CE3 . TRP C 108 ? 0.3466 0.2832 0.2600 0.0312 0.0205 0.0468 103 TRP H CE3 4127 C CZ2 . TRP C 108 ? 0.3418 0.3179 0.2475 0.0289 0.0369 0.0186 103 TRP H CZ2 4128 C CZ3 . TRP C 108 ? 0.3384 0.2854 0.2379 0.0354 0.0194 0.0253 103 TRP H CZ3 4129 C CH2 . TRP C 108 ? 0.3376 0.3008 0.2342 0.0346 0.0275 0.0110 103 TRP H CH2 4130 N N . GLY C 109 ? 0.3919 0.2230 0.4044 0.0250 0.0158 0.0699 104 GLY H N 4131 C CA . GLY C 109 ? 0.4090 0.2158 0.4341 0.0360 0.0114 0.0737 104 GLY H CA 4132 C C . GLY C 109 ? 0.4204 0.2419 0.4312 0.0442 0.0091 0.1005 104 GLY H C 4133 O O . GLY C 109 ? 0.4090 0.2618 0.3923 0.0425 0.0090 0.1056 104 GLY H O 4134 N N . GLN C 110 ? 0.4489 0.2503 0.4806 0.0539 0.0070 0.1162 105 GLN H N 4135 C CA . GLN C 110 ? 0.4653 0.2853 0.4886 0.0631 0.0029 0.1458 105 GLN H CA 4136 C C . GLN C 110 ? 0.4406 0.2892 0.4353 0.0699 -0.0042 0.1311 105 GLN H C 4137 O O . GLN C 110 ? 0.4539 0.3352 0.4283 0.0704 -0.0086 0.1470 105 GLN H O 4138 C CB . GLN C 110 ? 0.4972 0.2868 0.5570 0.0755 0.0023 0.1632 105 GLN H CB 4139 C CG . GLN C 110 ? 0.4938 0.2598 0.5686 0.0871 0.0008 0.1318 105 GLN H CG 4140 C CD . GLN C 110 ? 0.5326 0.2538 0.6532 0.0939 0.0049 0.1334 105 GLN H CD 4141 O OE1 . GLN C 110 ? 0.5341 0.2338 0.6684 0.0994 0.0063 0.0997 105 GLN H OE1 4142 N NE2 . GLN C 110 ? 0.5673 0.2754 0.7131 0.0941 0.0074 0.1722 105 GLN H NE2 4143 N N . GLY C 111 ? 0.4169 0.2568 0.4111 0.0738 -0.0055 0.1011 106 GLY H N 4144 C CA . GLY C 111 ? 0.3957 0.2593 0.3699 0.0772 -0.0110 0.0876 106 GLY H CA 4145 C C . GLY C 111 ? 0.3952 0.2553 0.3852 0.0915 -0.0146 0.0866 106 GLY H C 4146 O O . GLY C 111 ? 0.4251 0.2775 0.4349 0.1012 -0.0156 0.1067 106 GLY H O 4147 N N . THR C 112 ? 0.3704 0.2377 0.3549 0.0940 -0.0153 0.0659 107 THR H N 4148 C CA . THR C 112 ? 0.3659 0.2381 0.3652 0.1074 -0.0166 0.0635 107 THR H CA 4149 C C . THR C 112 ? 0.3490 0.2534 0.3369 0.1040 -0.0228 0.0639 107 THR H C 4150 O O . THR C 112 ? 0.3321 0.2421 0.3077 0.0958 -0.0218 0.0491 107 THR H O 4151 C CB . THR C 112 ? 0.3617 0.2199 0.3675 0.1123 -0.0103 0.0390 107 THR H CB 4152 O OG1 . THR C 112 ? 0.3792 0.2079 0.3969 0.1109 -0.0061 0.0324 107 THR H OG1 4153 C CG2 . THR C 112 ? 0.3641 0.2321 0.3860 0.1282 -0.0086 0.0360 107 THR H CG2 4154 N N . LEU C 113 ? 0.3548 0.2809 0.3509 0.1099 -0.0297 0.0817 108 LEU H N 4155 C CA . LEU C 113 ? 0.3414 0.3006 0.3344 0.1053 -0.0371 0.0801 108 LEU H CA 4156 C C . LEU C 113 ? 0.3277 0.2911 0.3374 0.1129 -0.0325 0.0700 108 LEU H C 4157 O O . LEU C 113 ? 0.3426 0.3031 0.3721 0.1284 -0.0286 0.0745 108 LEU H O 4158 C CB . LEU C 113 ? 0.3546 0.3447 0.3525 0.1090 -0.0478 0.1027 108 LEU H CB 4159 C CG . LEU C 113 ? 0.3499 0.3803 0.3521 0.1031 -0.0578 0.0998 108 LEU H CG 4160 C CD1 . LEU C 113 ? 0.3408 0.3750 0.3247 0.0842 -0.0596 0.0776 108 LEU H CD1 4161 C CD2 . LEU C 113 ? 0.3677 0.4365 0.3728 0.1070 -0.0708 0.1235 108 LEU H CD2 4162 N N . VAL C 114 ? 0.3086 0.2794 0.3124 0.1030 -0.0314 0.0570 109 VAL H N 4163 C CA . VAL C 114 ? 0.2957 0.2786 0.3148 0.1087 -0.0258 0.0527 109 VAL H CA 4164 C C . VAL C 114 ? 0.2857 0.2991 0.3156 0.0980 -0.0324 0.0558 109 VAL H C 4165 O O . VAL C 114 ? 0.2803 0.2914 0.3016 0.0826 -0.0357 0.0479 109 VAL H O 4166 C CB . VAL C 114 ? 0.2855 0.2519 0.2950 0.1072 -0.0166 0.0389 109 VAL H CB 4167 C CG1 . VAL C 114 ? 0.2791 0.2665 0.3023 0.1141 -0.0093 0.0388 109 VAL H CG1 4168 C CG2 . VAL C 114 ? 0.2958 0.2353 0.2981 0.1142 -0.0120 0.0315 109 VAL H CG2 4169 N N . THR C 115 ? 0.2823 0.3239 0.3355 0.1065 -0.0334 0.0657 110 THR H N 4170 C CA . THR C 115 ? 0.2731 0.3489 0.3454 0.0952 -0.0396 0.0693 110 THR H CA 4171 C C . THR C 115 ? 0.2649 0.3538 0.3554 0.0989 -0.0278 0.0706 110 THR H C 4172 O O . THR C 115 ? 0.2694 0.3652 0.3684 0.1173 -0.0187 0.0737 110 THR H O 4173 C CB . THR C 115 ? 0.2768 0.3885 0.3670 0.1005 -0.0509 0.0833 110 THR H CB 4174 O OG1 . THR C 115 ? 0.2865 0.3932 0.3572 0.0986 -0.0611 0.0872 110 THR H OG1 4175 C CG2 . THR C 115 ? 0.2739 0.4237 0.3859 0.0842 -0.0596 0.0836 110 THR H CG2 4176 N N . VAL C 116 ? 0.2568 0.3509 0.3557 0.0819 -0.0273 0.0687 111 VAL H N 4177 C CA . VAL C 116 ? 0.2515 0.3622 0.3679 0.0831 -0.0152 0.0760 111 VAL H CA 4178 C C . VAL C 116 ? 0.2522 0.4058 0.4051 0.0743 -0.0197 0.0872 111 VAL H C 4179 O O . VAL C 116 ? 0.2572 0.4152 0.4248 0.0529 -0.0290 0.0847 111 VAL H O 4180 C CB . VAL C 116 ? 0.2504 0.3378 0.3593 0.0712 -0.0096 0.0734 111 VAL H CB 4181 C CG1 . VAL C 116 ? 0.2492 0.3586 0.3721 0.0758 0.0047 0.0874 111 VAL H CG1 4182 C CG2 . VAL C 116 ? 0.2498 0.3008 0.3258 0.0778 -0.0081 0.0615 111 VAL H CG2 4183 N N . SER C 117 ? 0.3337 1.0094 0.4548 0.1919 -0.0197 0.1416 112 SER H N 4184 C CA . SER C 117 ? 0.3363 0.9218 0.4536 0.1868 -0.0094 0.1484 112 SER H CA 4185 C C . SER C 117 ? 0.3382 0.9445 0.4470 0.1692 -0.0083 0.1318 112 SER H C 4186 O O . SER C 117 ? 0.3325 0.9919 0.4394 0.1506 -0.0169 0.1004 112 SER H O 4187 C CB . SER C 117 ? 0.3118 0.8179 0.4478 0.1658 -0.0081 0.1304 112 SER H CB 4188 O OG . SER C 117 ? 0.3072 0.7516 0.4439 0.1514 -0.0011 0.1283 112 SER H OG 4189 N N . ALA C 118 ? 0.3534 0.9173 0.4545 0.1741 0.0020 0.1529 113 ALA H N 4190 C CA . ALA C 118 ? 0.3597 0.9463 0.4526 0.1631 0.0063 0.1399 113 ALA H CA 4191 C C . ALA C 118 ? 0.3447 0.8696 0.4525 0.1415 0.0108 0.1175 113 ALA H C 4192 O O . ALA C 118 ? 0.3540 0.8946 0.4556 0.1376 0.0166 0.1066 113 ALA H O 4193 C CB . ALA C 118 ? 0.3887 0.9932 0.4632 0.1818 0.0156 0.1828 113 ALA H CB 4194 N N . ALA C 119 ? 0.3286 0.7908 0.4546 0.1313 0.0088 0.1111 114 ALA H N 4195 C CA . ALA C 119 ? 0.3165 0.7239 0.4574 0.1139 0.0125 0.0941 114 ALA H CA 4196 C C . ALA C 119 ? 0.3198 0.7395 0.4584 0.1011 0.0084 0.0504 114 ALA H C 4197 O O . ALA C 119 ? 0.3283 0.7778 0.4595 0.0935 -0.0014 0.0269 114 ALA H O 4198 C CB . ALA C 119 ? 0.3010 0.6449 0.4582 0.1069 0.0100 0.0973 114 ALA H CB 4199 N N . LYS C 120 ? 0.3240 0.7200 0.4660 0.0987 0.0154 0.0404 115 LYS H N 4200 C CA . LYS C 120 ? 0.3425 0.7250 0.4766 0.0923 0.0127 -0.0011 115 LYS H CA 4201 C C . LYS C 120 ? 0.3296 0.6441 0.4822 0.0792 0.0101 -0.0116 115 LYS H C 4202 O O . LYS C 120 ? 0.3065 0.5910 0.4789 0.0765 0.0125 0.0127 115 LYS H O 4203 C CB . LYS C 120 ? 0.3644 0.7721 0.4865 0.1081 0.0239 -0.0054 115 LYS H CB 4204 C CG . LYS C 120 ? 0.3861 0.8687 0.4870 0.1213 0.0272 0.0066 115 LYS H CG 4205 C CD . LYS C 120 ? 0.4179 0.9379 0.4986 0.1392 0.0374 -0.0098 115 LYS H CD 4206 C CE . LYS C 120 ? 0.4441 1.0423 0.4957 0.1504 0.0374 -0.0097 115 LYS H CE 4207 N NZ . LYS C 120 ? 0.4787 1.1176 0.5062 0.1721 0.0486 -0.0287 115 LYS H NZ 4208 N N . THR C 121 ? 0.3532 0.6388 0.4947 0.0707 0.0047 -0.0478 116 THR H N 4209 C CA . THR C 121 ? 0.3498 0.5704 0.5047 0.0592 0.0021 -0.0564 116 THR H CA 4210 C C . THR C 121 ? 0.3336 0.5344 0.5065 0.0722 0.0126 -0.0369 116 THR H C 4211 O O . THR C 121 ? 0.3521 0.5715 0.5174 0.0907 0.0216 -0.0399 116 THR H O 4212 C CB . THR C 121 ? 0.3985 0.5781 0.5296 0.0520 -0.0035 -0.0967 116 THR H CB 4213 O OG1 . THR C 121 ? 0.4229 0.6262 0.5344 0.0318 -0.0157 -0.1176 116 THR H OG1 4214 C CG2 . THR C 121 ? 0.3990 0.5090 0.5431 0.0400 -0.0064 -0.0987 116 THR H CG2 4215 N N . THR C 122 ? 0.3047 0.4756 0.5000 0.0625 0.0110 -0.0177 117 THR H N 4216 C CA . THR C 122 ? 0.2863 0.4478 0.4998 0.0677 0.0181 0.0042 117 THR H CA 4217 C C . THR C 122 ? 0.2746 0.3859 0.5026 0.0566 0.0131 0.0027 117 THR H C 4218 O O . THR C 122 ? 0.2627 0.3561 0.4939 0.0430 0.0062 0.0034 117 THR H O 4219 C CB . THR C 122 ? 0.2700 0.4540 0.4903 0.0651 0.0210 0.0381 117 THR H CB 4220 O OG1 . THR C 122 ? 0.2859 0.5177 0.4900 0.0745 0.0242 0.0423 117 THR H OG1 4221 C CG2 . THR C 122 ? 0.2627 0.4519 0.4980 0.0637 0.0275 0.0602 117 THR H CG2 4222 N N . PRO C 123 ? 0.2801 0.3764 0.5158 0.0656 0.0173 0.0017 118 PRO H N 4223 C CA . PRO C 123 ? 0.2729 0.3279 0.5216 0.0562 0.0126 0.0053 118 PRO H CA 4224 C C . PRO C 123 ? 0.2455 0.3057 0.5109 0.0447 0.0115 0.0318 118 PRO H C 4225 O O . PRO C 123 ? 0.2364 0.3268 0.5047 0.0448 0.0157 0.0496 118 PRO H O 4226 C CB . PRO C 123 ? 0.2950 0.3413 0.5440 0.0763 0.0179 -0.0011 118 PRO H CB 4227 C CG . PRO C 123 ? 0.3003 0.4001 0.5457 0.0953 0.0277 0.0026 118 PRO H CG 4228 C CD . PRO C 123 ? 0.2985 0.4215 0.5293 0.0886 0.0266 -0.0026 118 PRO H CD 4229 N N . PRO C 124 ? 0.2392 0.2676 0.5116 0.0328 0.0054 0.0344 119 PRO H N 4230 C CA . PRO C 124 ? 0.2279 0.2509 0.5081 0.0215 0.0028 0.0536 119 PRO H CA 4231 C C . PRO C 124 ? 0.2293 0.2661 0.5237 0.0214 0.0044 0.0665 119 PRO H C 4232 O O . PRO C 124 ? 0.2397 0.2827 0.5400 0.0349 0.0072 0.0604 119 PRO H O 4233 C CB . PRO C 124 ? 0.2258 0.2190 0.5056 0.0127 -0.0033 0.0478 119 PRO H CB 4234 C CG . PRO C 124 ? 0.2372 0.2150 0.5167 0.0163 -0.0038 0.0328 119 PRO H CG 4235 C CD . PRO C 124 ? 0.2534 0.2469 0.5228 0.0282 0.0006 0.0197 119 PRO H CD 4236 N N . SER C 125 ? 0.2283 0.2709 0.5253 0.0067 0.0024 0.0847 120 SER H N 4237 C CA . SER C 125 ? 0.2238 0.2804 0.5346 -0.0036 -0.0007 0.0976 120 SER H CA 4238 C C . SER C 125 ? 0.2224 0.2415 0.5288 -0.0143 -0.0090 0.0940 120 SER H C 4239 O O . SER C 125 ? 0.2272 0.2150 0.5181 -0.0197 -0.0118 0.0904 120 SER H O 4240 C CB . SER C 125 ? 0.2341 0.3118 0.5449 -0.0236 -0.0012 0.1186 120 SER H CB 4241 O OG . SER C 125 ? 0.2388 0.3615 0.5534 -0.0138 0.0075 0.1254 120 SER H OG 4242 N N . VAL C 126 ? 0.2197 0.2473 0.5378 -0.0137 -0.0123 0.0965 121 VAL H N 4243 C CA . VAL C 126 ? 0.2220 0.2225 0.5344 -0.0224 -0.0197 0.0939 121 VAL H CA 4244 C C . VAL C 126 ? 0.2238 0.2440 0.5411 -0.0413 -0.0275 0.1068 121 VAL H C 4245 O O . VAL C 126 ? 0.2216 0.2856 0.5566 -0.0383 -0.0273 0.1177 121 VAL H O 4246 C CB . VAL C 126 ? 0.2213 0.2108 0.5384 -0.0077 -0.0187 0.0873 121 VAL H CB 4247 C CG1 . VAL C 126 ? 0.2248 0.1951 0.5347 -0.0174 -0.0252 0.0876 121 VAL H CG1 4248 C CG2 . VAL C 126 ? 0.2269 0.1986 0.5365 0.0024 -0.0135 0.0730 121 VAL H CG2 4249 N N . TYR C 127 ? 0.2350 0.2254 0.5336 -0.0597 -0.0348 0.1046 122 TYR H N 4250 C CA . TYR C 127 ? 0.2484 0.2523 0.5446 -0.0849 -0.0451 0.1129 122 TYR H CA 4251 C C . TYR C 127 ? 0.2519 0.2344 0.5338 -0.0869 -0.0521 0.1043 122 TYR H C 4252 O O . TYR C 127 ? 0.2529 0.1983 0.5172 -0.0763 -0.0496 0.0924 122 TYR H O 4253 C CB . TYR C 127 ? 0.2804 0.2585 0.5568 -0.1106 -0.0491 0.1172 122 TYR H CB 4254 C CG . TYR C 127 ? 0.2756 0.2795 0.5639 -0.1088 -0.0410 0.1291 122 TYR H CG 4255 C CD1 . TYR C 127 ? 0.2592 0.3334 0.5761 -0.1089 -0.0378 0.1436 122 TYR H CD1 4256 C CD2 . TYR C 127 ? 0.2901 0.2562 0.5600 -0.1026 -0.0355 0.1276 122 TYR H CD2 4257 C CE1 . TYR C 127 ? 0.2583 0.3657 0.5842 -0.1050 -0.0289 0.1548 122 TYR H CE1 4258 C CE2 . TYR C 127 ? 0.2877 0.2841 0.5666 -0.1004 -0.0278 0.1402 122 TYR H CE2 4259 C CZ . TYR C 127 ? 0.2716 0.3385 0.5779 -0.1023 -0.0242 0.1529 122 TYR H CZ 4260 O OH . TYR C 127 ? 0.2772 0.3802 0.5892 -0.0980 -0.0152 0.1654 122 TYR H OH 4261 N N . PRO C 128 ? 0.2513 0.2684 0.5413 -0.0986 -0.0606 0.1120 123 PRO H N 4262 C CA . PRO C 128 ? 0.2651 0.2695 0.5375 -0.1031 -0.0683 0.1049 123 PRO H CA 4263 C C . PRO C 128 ? 0.3118 0.2730 0.5479 -0.1283 -0.0778 0.0930 123 PRO H C 4264 O O . PRO C 128 ? 0.3362 0.2889 0.5656 -0.1528 -0.0825 0.0969 123 PRO H O 4265 C CB . PRO C 128 ? 0.2548 0.3214 0.5491 -0.1060 -0.0747 0.1204 123 PRO H CB 4266 C CG . PRO C 128 ? 0.2550 0.3638 0.5676 -0.1208 -0.0758 0.1330 123 PRO H CG 4267 C CD . PRO C 128 ? 0.2455 0.3274 0.5609 -0.1071 -0.0634 0.1293 123 PRO H CD 4268 N N . LEU C 129 ? 0.3349 0.2648 0.5434 -0.1215 -0.0799 0.0786 124 LEU H N 4269 C CA . LEU C 129 ? 0.3986 0.2784 0.5624 -0.1395 -0.0896 0.0624 124 LEU H CA 4270 C C . LEU C 129 ? 0.4172 0.3250 0.5701 -0.1480 -0.1000 0.0580 124 LEU H C 4271 O O . LEU C 129 ? 0.4053 0.3197 0.5522 -0.1262 -0.0954 0.0531 124 LEU H O 4272 C CB . LEU C 129 ? 0.4189 0.2403 0.5521 -0.1144 -0.0811 0.0470 124 LEU H CB 4273 C CG . LEU C 129 ? 0.4005 0.2101 0.5487 -0.1000 -0.0700 0.0544 124 LEU H CG 4274 C CD1 . LEU C 129 ? 0.4119 0.1889 0.5377 -0.0681 -0.0608 0.0432 124 LEU H CD1 4275 C CD2 . LEU C 129 ? 0.4363 0.2161 0.5741 -0.1263 -0.0752 0.0612 124 LEU H CD2 4276 N N . ALA C 130 ? 0.4449 0.3820 0.5989 -0.1814 -0.1140 0.0633 125 ALA H N 4277 C CA . ALA C 130 ? 0.4768 0.4434 0.6138 -0.1962 -0.1276 0.0577 125 ALA H CA 4278 C C . ALA C 130 ? 0.5709 0.4748 0.6518 -0.2281 -0.1420 0.0336 125 ALA H C 4279 O O . ALA C 130 ? 0.6100 0.4725 0.6786 -0.2553 -0.1468 0.0327 125 ALA H O 4280 C CB . ALA C 130 ? 0.4482 0.5027 0.6235 -0.2127 -0.1357 0.0809 125 ALA H CB 4281 N N . PRO C 131 ? 0.6277 0.5218 0.6698 -0.2270 -0.1499 0.0145 126 PRO H N 4282 C CA . PRO C 131 ? 0.7396 0.5608 0.7180 -0.2572 -0.1650 -0.0136 126 PRO H CA 4283 C C . PRO C 131 ? 0.7989 0.6353 0.7790 -0.3162 -0.1841 -0.0065 126 PRO H C 4284 O O . PRO C 131 ? 0.7502 0.6842 0.7772 -0.3323 -0.1895 0.0175 126 PRO H O 4285 C CB . PRO C 131 ? 0.7578 0.5990 0.7028 -0.2472 -0.1715 -0.0315 126 PRO H CB 4286 C CG . PRO C 131 ? 0.6693 0.6099 0.6689 -0.2256 -0.1641 -0.0039 126 PRO H CG 4287 C CD . PRO C 131 ? 0.5975 0.5450 0.6476 -0.2014 -0.1464 0.0184 126 PRO H CD 4288 N N . GLY C 132 ? 0.9185 0.6589 0.8459 -0.3472 -0.1938 -0.0255 127 GLY H N 4289 C CA . GLY C 132 ? 0.9951 0.7388 0.9157 -0.4136 -0.2136 -0.0192 127 GLY H CA 4290 C C . GLY C 132 ? 1.0416 0.8625 0.9586 -0.4518 -0.2352 -0.0232 127 GLY H C 4291 O O . GLY C 132 ? 1.0482 0.8823 0.9421 -0.4302 -0.2378 -0.0414 127 GLY H O 4292 N N . SER C 133 ? 1.0886 0.9707 1.0291 -0.5094 -0.2509 -0.0040 128 SER H N 4293 C CA . SER C 133 ? 1.1352 1.1142 1.0805 -0.5511 -0.2734 -0.0016 128 SER H CA 4294 C C . SER C 133 ? 1.2624 1.1691 1.1274 -0.5689 -0.2912 -0.0447 128 SER H C 4295 O O . SER C 133 ? 1.2549 1.2244 1.1183 -0.5484 -0.2949 -0.0514 128 SER H O 4296 C CB . SER C 133 ? 1.1662 1.2020 1.1340 -0.6222 -0.2900 0.0212 128 SER H CB 4297 O OG . SER C 133 ? 1.0881 1.1822 1.1219 -0.6017 -0.2715 0.0579 128 SER H OG 4298 N N . ALA C 134 ? 1.4001 1.1682 1.1940 -0.6017 -0.3008 -0.0735 129 ALA H N 4299 C CA . ALA C 134 ? 1.5357 1.2147 1.2386 -0.6268 -0.3208 -0.1201 129 ALA H CA 4300 C C . ALA C 134 ? 1.5274 1.1669 1.2043 -0.5490 -0.3017 -0.1431 129 ALA H C 4301 O O . ALA C 134 ? 1.6028 1.1113 1.2208 -0.5186 -0.2926 -0.1704 129 ALA H O 4302 C CB . ALA C 134 ? 1.6740 1.1969 1.3053 -0.6754 -0.3332 -0.1416 129 ALA H CB 4303 N N . ALA C 135 ? 1.4377 1.2000 1.1598 -0.5170 -0.2960 -0.1280 130 ALA H N 4304 C CA . ALA C 135 ? 1.3643 1.1371 1.0949 -0.4413 -0.2725 -0.1300 130 ALA H CA 4305 C C . ALA C 135 ? 1.4461 1.1135 1.0900 -0.4094 -0.2699 -0.1762 130 ALA H C 4306 O O . ALA C 135 ? 1.4486 1.0311 1.0751 -0.3657 -0.2511 -0.1844 130 ALA H O 4307 C CB . ALA C 135 ? 1.2789 1.1995 1.0634 -0.4261 -0.2723 -0.1034 130 ALA H CB 4308 N N . GLN C 136 ? 1.4983 1.1782 1.0872 -0.4272 -0.2881 -0.2057 131 GLN H N 4309 C CA . GLN C 136 ? 1.5476 1.1743 1.0664 -0.3786 -0.2804 -0.2440 131 GLN H CA 4310 C C . GLN C 136 ? 1.4272 1.1321 1.0017 -0.3094 -0.2517 -0.2165 131 GLN H C 4311 O O . GLN C 136 ? 1.3967 1.0577 0.9901 -0.2676 -0.2296 -0.2074 131 GLN H O 4312 C CB . GLN C 136 ? 1.6709 1.1245 1.1038 -0.3658 -0.2781 -0.2850 131 GLN H CB 4313 C CG . GLN C 136 ? 1.8309 1.1957 1.1557 -0.3948 -0.3017 -0.3397 131 GLN H CG 4314 C CD . GLN C 136 ? 1.8963 1.2596 1.2073 -0.4877 -0.3352 -0.3440 131 GLN H CD 4315 O OE1 . GLN C 136 ? 2.0080 1.2428 1.2673 -0.5307 -0.3485 -0.3620 131 GLN H OE1 4316 N NE2 . GLN C 136 ? 1.8382 1.3466 1.1932 -0.5205 -0.3497 -0.3253 131 GLN H NE2 4317 N N . THR C 137 ? 1.3513 1.1742 0.9515 -0.3007 -0.2532 -0.2009 132 THR H N 4318 C CA . THR C 137 ? 1.2235 1.1240 0.8792 -0.2478 -0.2291 -0.1683 132 THR H CA 4319 C C . THR C 137 ? 1.2422 1.1404 0.8421 -0.2028 -0.2192 -0.1939 132 THR H C 4320 O O . THR C 137 ? 1.3297 1.2081 0.8571 -0.2133 -0.2340 -0.2312 132 THR H O 4321 C CB . THR C 137 ? 1.1290 1.1634 0.8598 -0.2594 -0.2324 -0.1216 132 THR H CB 4322 O OG1 . THR C 137 ? 1.1778 1.2585 0.8932 -0.3117 -0.2601 -0.1276 132 THR H OG1 4323 C CG2 . THR C 137 ? 1.0410 1.0893 0.8497 -0.2573 -0.2204 -0.0834 132 THR H CG2 4324 N N . ASN C 138 ? 1.1479 1.0727 0.7839 -0.1538 -0.1939 -0.1720 133 ASN H N 4325 C CA . ASN C 138 ? 1.1523 1.0718 0.7458 -0.1016 -0.1768 -0.1904 133 ASN H CA 4326 C C . ASN C 138 ? 1.0436 1.0846 0.6859 -0.0781 -0.1632 -0.1510 133 ASN H C 4327 O O . ASN C 138 ? 0.9684 1.0796 0.6707 -0.0999 -0.1679 -0.1126 133 ASN H O 4328 C CB . ASN C 138 ? 1.1585 0.9928 0.7505 -0.0691 -0.1590 -0.1975 133 ASN H CB 4329 C CG . ASN C 138 ? 1.1878 1.0232 0.7415 -0.0089 -0.1386 -0.2134 133 ASN H CG 4330 O OD1 . ASN C 138 ? 1.1177 0.9981 0.7180 0.0231 -0.1177 -0.1862 133 ASN H OD1 4331 N ND2 . ASN C 138 ? 1.2985 1.0880 0.7644 0.0063 -0.1450 -0.2584 133 ASN H ND2 4332 N N . SER C 139 ? 1.0340 1.1009 0.6460 -0.0339 -0.1469 -0.1593 134 SER H N 4333 C CA . SER C 139 ? 0.9402 1.1136 0.5983 -0.0122 -0.1305 -0.1173 134 SER H CA 4334 C C . SER C 139 ? 0.8262 1.0123 0.5676 -0.0145 -0.1180 -0.0734 134 SER H C 4335 O O . SER C 139 ? 0.7566 1.0067 0.5515 -0.0284 -0.1185 -0.0317 134 SER H O 4336 C CB . SER C 139 ? 0.9782 1.1701 0.5906 0.0377 -0.1117 -0.1347 134 SER H CB 4337 O OG . SER C 139 ? 0.9120 1.2056 0.5683 0.0529 -0.0954 -0.0912 134 SER H OG 4338 N N . MET C 140 ? 0.8091 0.9286 0.5549 0.0017 -0.1072 -0.0846 135 MET H N 4339 C CA . MET C 140 ? 0.7216 0.8408 0.5357 0.0002 -0.0962 -0.0522 135 MET H CA 4340 C C . MET C 140 ? 0.7115 0.7558 0.5381 -0.0262 -0.1073 -0.0612 135 MET H C 4341 O O . MET C 140 ? 0.7855 0.7545 0.5603 -0.0317 -0.1167 -0.0968 135 MET H O 4342 C CB . MET C 140 ? 0.7167 0.8338 0.5294 0.0397 -0.0749 -0.0541 135 MET H CB 4343 C CG . MET C 140 ? 0.7030 0.9129 0.5194 0.0624 -0.0603 -0.0335 135 MET H CG 4344 S SD . MET C 140 ? 0.6397 0.9349 0.5165 0.0341 -0.0618 0.0213 135 MET H SD 4345 C CE . MET C 140 ? 0.5698 0.8798 0.5085 0.0365 -0.0445 0.0554 135 MET H CE 4346 N N . VAL C 141 ? 0.6290 0.6904 0.5195 -0.0427 -0.1060 -0.0290 136 VAL H N 4347 C CA . VAL C 141 ? 0.6165 0.6188 0.5242 -0.0639 -0.1125 -0.0328 136 VAL H CA 4348 C C . VAL C 141 ? 0.5560 0.5461 0.5052 -0.0467 -0.0963 -0.0163 136 VAL H C 4349 O O . VAL C 141 ? 0.5028 0.5432 0.4887 -0.0347 -0.0851 0.0094 136 VAL H O 4350 C CB . VAL C 141 ? 0.5875 0.6234 0.5327 -0.0994 -0.1271 -0.0120 136 VAL H CB 4351 C CG1 . VAL C 141 ? 0.6495 0.6975 0.5527 -0.1263 -0.1477 -0.0307 136 VAL H CG1 4352 C CG2 . VAL C 141 ? 0.5184 0.6246 0.5196 -0.0915 -0.1195 0.0287 136 VAL H CG2 4353 N N . THR C 142 ? 0.5685 0.4903 0.5095 -0.0494 -0.0966 -0.0302 137 THR H N 4354 C CA . THR C 142 ? 0.5213 0.4306 0.4973 -0.0348 -0.0833 -0.0174 137 THR H CA 4355 C C . THR C 142 ? 0.4825 0.3823 0.4984 -0.0613 -0.0891 -0.0020 137 THR H C 4356 O O . THR C 142 ? 0.5169 0.3809 0.5163 -0.0869 -0.1015 -0.0117 137 THR H O 4357 C CB . THR C 142 ? 0.5736 0.4185 0.5068 -0.0070 -0.0759 -0.0414 137 THR H CB 4358 O OG1 . THR C 142 ? 0.6080 0.4732 0.5026 0.0240 -0.0689 -0.0559 137 THR H OG1 4359 C CG2 . THR C 142 ? 0.5285 0.3750 0.4979 0.0089 -0.0629 -0.0266 137 THR H CG2 4360 N N . LEU C 143 ? 0.4167 0.3512 0.4827 -0.0565 -0.0801 0.0221 138 LEU H N 4361 C CA . LEU C 143 ? 0.3816 0.3142 0.4853 -0.0719 -0.0818 0.0364 138 LEU H CA 4362 C C . LEU C 143 ? 0.3552 0.2706 0.4778 -0.0548 -0.0689 0.0398 138 LEU H C 4363 O O . LEU C 143 ? 0.3501 0.2718 0.4667 -0.0337 -0.0592 0.0371 138 LEU H O 4364 C CB . LEU C 143 ? 0.3405 0.3288 0.4837 -0.0774 -0.0833 0.0618 138 LEU H CB 4365 C CG . LEU C 143 ? 0.3594 0.3878 0.4913 -0.0896 -0.0952 0.0662 138 LEU H CG 4366 C CD1 . LEU C 143 ? 0.3255 0.4039 0.4941 -0.0832 -0.0932 0.0963 138 LEU H CD1 4367 C CD2 . LEU C 143 ? 0.3907 0.4119 0.5091 -0.1186 -0.1106 0.0563 138 LEU H CD2 4368 N N . GLY C 144 ? 0.3370 0.2427 0.4837 -0.0644 -0.0688 0.0475 139 GLY H N 4369 C CA . GLY C 144 ? 0.3149 0.2072 0.4755 -0.0500 -0.0583 0.0491 139 GLY H CA 4370 C C . GLY C 144 ? 0.2831 0.1889 0.4789 -0.0576 -0.0566 0.0624 139 GLY H C 4371 O O . GLY C 144 ? 0.2744 0.2021 0.4856 -0.0722 -0.0630 0.0718 139 GLY H O 4372 N N A CYS C 145 ? 0.2705 0.1680 0.4754 -0.0454 -0.0480 0.0620 140 CYS H N 4373 N N B CYS C 145 ? 0.2650 0.1688 0.4747 -0.0451 -0.0477 0.0639 140 CYS H N 4374 C CA A CYS C 145 ? 0.2481 0.1579 0.4806 -0.0465 -0.0442 0.0707 140 CYS H CA 4375 C CA B CYS C 145 ? 0.2504 0.1594 0.4823 -0.0492 -0.0455 0.0712 140 CYS H CA 4376 C C A CYS C 145 ? 0.2562 0.1424 0.4783 -0.0390 -0.0393 0.0658 140 CYS H C 4377 C C B CYS C 145 ? 0.2560 0.1429 0.4786 -0.0397 -0.0396 0.0661 140 CYS H C 4378 O O A CYS C 145 ? 0.2610 0.1392 0.4694 -0.0238 -0.0347 0.0592 140 CYS H O 4379 O O B CYS C 145 ? 0.2580 0.1397 0.4692 -0.0244 -0.0348 0.0597 140 CYS H O 4380 C CB A CYS C 145 ? 0.2247 0.1569 0.4804 -0.0384 -0.0392 0.0772 140 CYS H CB 4381 C CB B CYS C 145 ? 0.2246 0.1626 0.4870 -0.0445 -0.0422 0.0817 140 CYS H CB 4382 S SG A CYS C 145 ? 0.2216 0.1791 0.5011 -0.0414 -0.0427 0.0919 140 CYS H SG 4383 S SG B CYS C 145 ? 0.2135 0.1523 0.4868 -0.0326 -0.0343 0.0808 140 CYS H SG 4384 N N . LEU C 146 ? 0.2611 0.1434 0.4883 -0.0490 -0.0402 0.0720 141 LEU H N 4385 C CA . LEU C 146 ? 0.2750 0.1367 0.4910 -0.0422 -0.0356 0.0726 141 LEU H CA 4386 C C . LEU C 146 ? 0.2443 0.1395 0.4866 -0.0350 -0.0288 0.0773 141 LEU H C 4387 O O . LEU C 146 ? 0.2294 0.1520 0.4923 -0.0418 -0.0289 0.0844 141 LEU H O 4388 C CB . LEU C 146 ? 0.3135 0.1450 0.5114 -0.0630 -0.0415 0.0791 141 LEU H CB 4389 C CG . LEU C 146 ? 0.3361 0.1436 0.5208 -0.0592 -0.0371 0.0871 141 LEU H CG 4390 C CD1 . LEU C 146 ? 0.3598 0.1317 0.5164 -0.0314 -0.0327 0.0793 141 LEU H CD1 4391 C CD2 . LEU C 146 ? 0.3856 0.1591 0.5510 -0.0903 -0.0449 0.0973 141 LEU H CD2 4392 N N . VAL C 147 ? 0.2394 0.1378 0.4790 -0.0188 -0.0231 0.0722 142 VAL H N 4393 C CA . VAL C 147 ? 0.2218 0.1475 0.4780 -0.0121 -0.0178 0.0712 142 VAL H CA 4394 C C . VAL C 147 ? 0.2342 0.1592 0.4791 -0.0048 -0.0141 0.0762 142 VAL H C 4395 O O . VAL C 147 ? 0.2424 0.1628 0.4730 0.0084 -0.0125 0.0740 142 VAL H O 4396 C CB . VAL C 147 ? 0.2118 0.1510 0.4735 -0.0058 -0.0164 0.0616 142 VAL H CB 4397 C CG1 . VAL C 147 ? 0.2041 0.1608 0.4763 -0.0033 -0.0133 0.0557 142 VAL H CG1 4398 C CG2 . VAL C 147 ? 0.2112 0.1466 0.4790 -0.0131 -0.0199 0.0618 142 VAL H CG2 4399 N N . LYS C 148 ? 0.2365 0.1748 0.4883 -0.0111 -0.0120 0.0856 143 LYS H N 4400 C CA . LYS C 148 ? 0.2633 0.1956 0.5005 -0.0097 -0.0093 0.0979 143 LYS H CA 4401 C C . LYS C 148 ? 0.2535 0.2275 0.4998 -0.0010 -0.0027 0.0998 143 LYS H C 4402 O O . LYS C 148 ? 0.2339 0.2383 0.4976 -0.0004 -0.0001 0.0946 143 LYS H O 4403 C CB . LYS C 148 ? 0.2891 0.2021 0.5202 -0.0328 -0.0134 0.1131 143 LYS H CB 4404 C CG . LYS C 148 ? 0.3325 0.2135 0.5382 -0.0373 -0.0128 0.1298 143 LYS H CG 4405 C CD . LYS C 148 ? 0.3799 0.2093 0.5649 -0.0649 -0.0214 0.1374 143 LYS H CD 4406 C CE . LYS C 148 ? 0.4438 0.2161 0.5930 -0.0694 -0.0219 0.1545 143 LYS H CE 4407 N NZ . LYS C 148 ? 0.4407 0.2558 0.6019 -0.0769 -0.0155 0.1771 143 LYS H NZ 4408 N N . GLY C 149 ? 0.2746 0.2494 0.5049 0.0096 0.0000 0.1073 144 GLY H N 4409 C CA . GLY C 149 ? 0.2771 0.2942 0.5090 0.0173 0.0060 0.1124 144 GLY H CA 4410 C C . GLY C 149 ? 0.2572 0.3101 0.4989 0.0277 0.0078 0.0906 144 GLY H C 4411 O O . GLY C 149 ? 0.2592 0.3435 0.5078 0.0306 0.0124 0.0869 144 GLY H O 4412 N N . TYR C 150 ? 0.2496 0.2991 0.4887 0.0330 0.0040 0.0758 145 TYR H N 4413 C CA . TYR C 150 ? 0.2441 0.3178 0.4861 0.0349 0.0032 0.0539 145 TYR H CA 4414 C C . TYR C 150 ? 0.2490 0.3561 0.4791 0.0428 0.0014 0.0508 145 TYR H C 4415 O O . TYR C 150 ? 0.2568 0.3651 0.4788 0.0519 0.0012 0.0656 145 TYR H O 4416 C CB . TYR C 150 ? 0.2351 0.2852 0.4859 0.0250 -0.0015 0.0395 145 TYR H CB 4417 C CG . TYR C 150 ? 0.2300 0.2736 0.4795 0.0224 -0.0056 0.0425 145 TYR H CG 4418 C CD1 . TYR C 150 ? 0.2272 0.2430 0.4758 0.0226 -0.0060 0.0543 145 TYR H CD1 4419 C CD2 . TYR C 150 ? 0.2312 0.3025 0.4784 0.0190 -0.0095 0.0326 145 TYR H CD2 4420 C CE1 . TYR C 150 ? 0.2280 0.2420 0.4714 0.0265 -0.0081 0.0553 145 TYR H CE1 4421 C CE2 . TYR C 150 ? 0.2295 0.3107 0.4769 0.0205 -0.0115 0.0377 145 TYR H CE2 4422 C CZ . TYR C 150 ? 0.2287 0.2797 0.4733 0.0277 -0.0098 0.0485 145 TYR H CZ 4423 O OH . TYR C 150 ? 0.2301 0.2940 0.4708 0.0354 -0.0103 0.0518 145 TYR H OH 4424 N N . PHE C 151 ? 0.2529 0.3862 0.4786 0.0409 -0.0001 0.0308 146 PHE H N 4425 C CA . PHE C 151 ? 0.2576 0.4353 0.4725 0.0432 -0.0044 0.0241 146 PHE H CA 4426 C C . PHE C 151 ? 0.2717 0.4550 0.4791 0.0298 -0.0095 -0.0064 146 PHE H C 4427 O O . PHE C 151 ? 0.2809 0.4432 0.4834 0.0327 -0.0057 -0.0187 146 PHE H O 4428 C CB . PHE C 151 ? 0.2653 0.4795 0.4680 0.0601 0.0003 0.0417 146 PHE H CB 4429 C CG . PHE C 151 ? 0.2735 0.5446 0.4652 0.0660 -0.0047 0.0393 146 PHE H CG 4430 C CD1 . PHE C 151 ? 0.2879 0.5967 0.4682 0.0586 -0.0091 0.0152 146 PHE H CD1 4431 C CD2 . PHE C 151 ? 0.2728 0.5619 0.4621 0.0811 -0.0058 0.0601 146 PHE H CD2 4432 C CE1 . PHE C 151 ? 0.2968 0.6700 0.4670 0.0602 -0.0160 0.0129 146 PHE H CE1 4433 C CE2 . PHE C 151 ? 0.2811 0.6386 0.4624 0.0895 -0.0110 0.0609 146 PHE H CE2 4434 C CZ . PHE C 151 ? 0.2899 0.6943 0.4635 0.0760 -0.0169 0.0377 146 PHE H CZ 4435 N N . PRO C 152 ? 0.2782 0.4881 0.4819 0.0147 -0.0185 -0.0189 147 PRO H N 4436 C CA . PRO C 152 ? 0.2667 0.5136 0.4783 0.0142 -0.0226 -0.0051 147 PRO H CA 4437 C C . PRO C 152 ? 0.2573 0.4712 0.4835 0.0017 -0.0240 -0.0019 147 PRO H C 4438 O O . PRO C 152 ? 0.2591 0.4202 0.4890 -0.0077 -0.0228 -0.0095 147 PRO H O 4439 C CB . PRO C 152 ? 0.2853 0.5858 0.4869 -0.0047 -0.0330 -0.0241 147 PRO H CB 4440 C CG . PRO C 152 ? 0.3144 0.5664 0.5042 -0.0264 -0.0368 -0.0534 147 PRO H CG 4441 C CD . PRO C 152 ? 0.3117 0.5173 0.4997 -0.0049 -0.0261 -0.0505 147 PRO H CD 4442 N N . GLU C 153 ? 0.2541 0.5063 0.4871 0.0050 -0.0261 0.0102 148 GLU H N 4443 C CA . GLU C 153 ? 0.2555 0.4978 0.5006 -0.0106 -0.0283 0.0115 148 GLU H CA 4444 C C . GLU C 153 ? 0.2768 0.5226 0.5219 -0.0496 -0.0377 -0.0079 148 GLU H C 4445 O O . GLU C 153 ? 0.2931 0.5651 0.5269 -0.0629 -0.0442 -0.0236 148 GLU H O 4446 C CB . GLU C 153 ? 0.2533 0.5526 0.5028 0.0070 -0.0272 0.0285 148 GLU H CB 4447 C CG . GLU C 153 ? 0.2592 0.5313 0.4998 0.0449 -0.0186 0.0468 148 GLU H CG 4448 C CD . GLU C 153 ? 0.2683 0.5710 0.5089 0.0659 -0.0158 0.0593 148 GLU H CD 4449 O OE1 . GLU C 153 ? 0.2889 0.6376 0.5202 0.0974 -0.0135 0.0721 148 GLU H OE1 4450 O OE2 . GLU C 153 ? 0.2642 0.5499 0.5120 0.0547 -0.0152 0.0573 148 GLU H OE2 4451 N N . PRO C 154 ? 0.2836 0.4993 0.5369 -0.0703 -0.0394 -0.0069 149 PRO H N 4452 C CA . PRO C 154 ? 0.2661 0.4533 0.5291 -0.0580 -0.0331 0.0084 149 PRO H CA 4453 C C . PRO C 154 ? 0.2751 0.3852 0.5362 -0.0577 -0.0301 0.0043 149 PRO H C 4454 O O . PRO C 154 ? 0.2985 0.3752 0.5498 -0.0641 -0.0319 -0.0109 149 PRO H O 4455 C CB . PRO C 154 ? 0.2711 0.4926 0.5434 -0.0862 -0.0380 0.0137 149 PRO H CB 4456 C CG . PRO C 154 ? 0.3076 0.5205 0.5717 -0.1256 -0.0482 -0.0038 149 PRO H CG 4457 C CD . PRO C 154 ? 0.3164 0.5327 0.5666 -0.1137 -0.0496 -0.0198 149 PRO H CD 4458 N N . VAL C 155 ? 0.2575 0.3452 0.5250 -0.0466 -0.0256 0.0174 150 VAL H N 4459 C CA . VAL C 155 ? 0.2639 0.2961 0.5338 -0.0521 -0.0249 0.0187 150 VAL H CA 4460 C C . VAL C 155 ? 0.2618 0.3017 0.5379 -0.0682 -0.0268 0.0291 150 VAL H C 4461 O O . VAL C 155 ? 0.2530 0.3420 0.5323 -0.0663 -0.0261 0.0366 150 VAL H O 4462 C CB . VAL C 155 ? 0.2509 0.2584 0.5221 -0.0299 -0.0197 0.0268 150 VAL H CB 4463 C CG1 . VAL C 155 ? 0.2515 0.2576 0.5180 -0.0169 -0.0166 0.0213 150 VAL H CG1 4464 C CG2 . VAL C 155 ? 0.2391 0.2637 0.5079 -0.0160 -0.0173 0.0380 150 VAL H CG2 4465 N N . THR C 156 ? 0.2727 0.2688 0.5487 -0.0815 -0.0286 0.0316 151 THR H N 4466 C CA . THR C 156 ? 0.2718 0.2746 0.5526 -0.0950 -0.0293 0.0464 151 THR H CA 4467 C C . THR C 156 ? 0.2584 0.2288 0.5403 -0.0781 -0.0264 0.0551 151 THR H C 4468 O O . THR C 156 ? 0.2626 0.1979 0.5432 -0.0658 -0.0255 0.0507 151 THR H O 4469 C CB . THR C 156 ? 0.3153 0.2956 0.5915 -0.1312 -0.0354 0.0479 151 THR H CB 4470 O OG1 . THR C 156 ? 0.3526 0.2588 0.6186 -0.1289 -0.0365 0.0439 151 THR H OG1 4471 C CG2 . THR C 156 ? 0.3337 0.3438 0.6057 -0.1549 -0.0412 0.0351 151 THR H CG2 4472 N N . VAL C 157 ? 0.2422 0.2346 0.5258 -0.0762 -0.0250 0.0675 152 VAL H N 4473 C CA . VAL C 157 ? 0.2335 0.2045 0.5161 -0.0653 -0.0245 0.0760 152 VAL H CA 4474 C C . VAL C 157 ? 0.2431 0.2221 0.5256 -0.0809 -0.0257 0.0924 152 VAL H C 4475 O O . VAL C 157 ? 0.2398 0.2618 0.5225 -0.0911 -0.0243 0.0982 152 VAL H O 4476 C CB . VAL C 157 ? 0.2171 0.2029 0.4928 -0.0450 -0.0224 0.0728 152 VAL H CB 4477 C CG1 . VAL C 157 ? 0.2183 0.1862 0.4911 -0.0402 -0.0248 0.0791 152 VAL H CG1 4478 C CG2 . VAL C 157 ? 0.2120 0.1909 0.4858 -0.0328 -0.0210 0.0622 152 VAL H CG2 4479 N N . THR C 158 ? 0.2542 0.1985 0.5364 -0.0814 -0.0277 0.1029 153 THR H N 4480 C CA . THR C 158 ? 0.2683 0.2214 0.5480 -0.0917 -0.0285 0.1232 153 THR H CA 4481 C C . THR C 158 ? 0.2608 0.2073 0.5389 -0.0738 -0.0300 0.1299 153 THR H C 4482 O O . THR C 158 ? 0.2509 0.1839 0.5322 -0.0588 -0.0308 0.1203 153 THR H O 4483 C CB . THR C 158 ? 0.3132 0.2274 0.5895 -0.1156 -0.0310 0.1363 153 THR H CB 4484 O OG1 . THR C 158 ? 0.3384 0.1920 0.6105 -0.1023 -0.0326 0.1335 153 THR H OG1 4485 C CG2 . THR C 158 ? 0.3247 0.2506 0.6013 -0.1417 -0.0323 0.1276 153 THR H CG2 4486 N N . TRP C 159 ? 0.2698 0.2356 0.5431 -0.0777 -0.0309 0.1478 154 TRP H N 4487 C CA . TRP C 159 ? 0.2689 0.2397 0.5393 -0.0644 -0.0345 0.1560 154 TRP H CA 4488 C C . TRP C 159 ? 0.3023 0.2586 0.5708 -0.0690 -0.0362 0.1834 154 TRP H C 4489 O O . TRP C 159 ? 0.3182 0.2867 0.5818 -0.0859 -0.0345 0.1995 154 TRP H O 4490 C CB . TRP C 159 ? 0.2565 0.2701 0.5143 -0.0600 -0.0348 0.1500 154 TRP H CB 4491 C CG . TRP C 159 ? 0.2386 0.2511 0.4908 -0.0505 -0.0342 0.1256 154 TRP H CG 4492 C CD1 . TRP C 159 ? 0.2332 0.2584 0.4804 -0.0472 -0.0292 0.1132 154 TRP H CD1 4493 C CD2 . TRP C 159 ? 0.2341 0.2329 0.4833 -0.0435 -0.0390 0.1144 154 TRP H CD2 4494 N NE1 . TRP C 159 ? 0.2298 0.2387 0.4672 -0.0354 -0.0302 0.0953 154 TRP H NE1 4495 C CE2 . TRP C 159 ? 0.2300 0.2207 0.4683 -0.0372 -0.0366 0.0957 154 TRP H CE2 4496 C CE3 . TRP C 159 ? 0.2365 0.2347 0.4908 -0.0432 -0.0455 0.1210 154 TRP H CE3 4497 C CZ2 . TRP C 159 ? 0.2347 0.2052 0.4646 -0.0357 -0.0408 0.0842 154 TRP H CZ2 4498 C CZ3 . TRP C 159 ? 0.2358 0.2280 0.4858 -0.0445 -0.0502 0.1086 154 TRP H CZ3 4499 C CH2 . TRP C 159 ? 0.2360 0.2085 0.4728 -0.0432 -0.0478 0.0907 154 TRP H CH2 4500 N N . ASN C 160 ? 0.3180 0.2533 0.5899 -0.0528 -0.0392 0.1916 155 ASN H N 4501 C CA . ASN C 160 ? 0.3636 0.2746 0.6305 -0.0489 -0.0406 0.2201 155 ASN H CA 4502 C C . ASN C 160 ? 0.4077 0.2680 0.6671 -0.0689 -0.0382 0.2285 155 ASN H C 4503 O O . ASN C 160 ? 0.4352 0.2964 0.6860 -0.0861 -0.0382 0.2535 155 ASN H O 4504 C CB . ASN C 160 ? 0.3673 0.3266 0.6272 -0.0506 -0.0435 0.2409 155 ASN H CB 4505 C CG . ASN C 160 ? 0.3438 0.3465 0.6062 -0.0354 -0.0493 0.2337 155 ASN H CG 4506 O OD1 . ASN C 160 ? 0.3306 0.3292 0.6028 -0.0249 -0.0509 0.2180 155 ASN H OD1 4507 N ND2 . ASN C 160 ? 0.3478 0.3966 0.5995 -0.0373 -0.0533 0.2462 155 ASN H ND2 4508 N N . SER C 161 ? 0.4176 0.2363 0.6777 -0.0701 -0.0367 0.2077 156 SER H N 4509 C CA . SER C 161 ? 0.4704 0.2322 0.7182 -0.0950 -0.0370 0.2096 156 SER H CA 4510 C C . SER C 161 ? 0.4686 0.2684 0.7170 -0.1331 -0.0368 0.2179 156 SER H C 4511 O O . SER C 161 ? 0.5229 0.2821 0.7594 -0.1631 -0.0390 0.2312 156 SER H O 4512 C CB . SER C 161 ? 0.5436 0.2336 0.7734 -0.0863 -0.0386 0.2347 156 SER H CB 4513 O OG . SER C 161 ? 0.5417 0.2206 0.7739 -0.0441 -0.0376 0.2316 156 SER H OG 4514 N N . GLY C 162 ? 0.4165 0.2931 0.6756 -0.1321 -0.0344 0.2108 157 GLY H N 4515 C CA . GLY C 162 ? 0.4134 0.3460 0.6744 -0.1600 -0.0323 0.2199 157 GLY H CA 4516 C C . GLY C 162 ? 0.4286 0.4017 0.6845 -0.1650 -0.0307 0.2502 157 GLY H C 4517 O O . GLY C 162 ? 0.4216 0.4572 0.6792 -0.1838 -0.0273 0.2602 157 GLY H O 4518 N N . SER C 163 ? 0.4509 0.3993 0.7002 -0.1462 -0.0328 0.2665 158 SER H N 4519 C CA . SER C 163 ? 0.4669 0.4602 0.7087 -0.1476 -0.0319 0.2963 158 SER H CA 4520 C C . SER C 163 ? 0.4258 0.5003 0.6667 -0.1325 -0.0290 0.2813 158 SER H C 4521 O O . SER C 163 ? 0.4312 0.5650 0.6645 -0.1400 -0.0256 0.2992 158 SER H O 4522 C CB . SER C 163 ? 0.4963 0.4519 0.7308 -0.1260 -0.0359 0.3165 158 SER H CB 4523 O OG . SER C 163 ? 0.5625 0.4354 0.7879 -0.1374 -0.0375 0.3359 158 SER H OG 4524 N N . LEU C 164 ? 0.3974 0.4708 0.6417 -0.1108 -0.0302 0.2486 159 LEU H N 4525 C CA . LEU C 164 ? 0.3784 0.5071 0.6139 -0.0963 -0.0277 0.2274 159 LEU H CA 4526 C C . LEU C 164 ? 0.3686 0.5221 0.6091 -0.1022 -0.0217 0.2116 159 LEU H C 4527 O O . LEU C 164 ? 0.3566 0.4827 0.6038 -0.0954 -0.0223 0.1889 159 LEU H O 4528 C CB . LEU C 164 ? 0.3647 0.4731 0.5967 -0.0747 -0.0331 0.2027 159 LEU H CB 4529 C CG . LEU C 164 ? 0.3780 0.5053 0.5976 -0.0646 -0.0396 0.2097 159 LEU H CG 4530 C CD1 . LEU C 164 ? 0.3662 0.4731 0.5858 -0.0538 -0.0462 0.1858 159 LEU H CD1 4531 C CD2 . LEU C 164 ? 0.3902 0.5757 0.5864 -0.0611 -0.0372 0.2091 159 LEU H CD2 4532 N N . SER C 165 ? 0.4601 0.5921 0.6148 -0.2113 -0.0343 0.1648 160 SER H N 4533 C CA . SER C 165 ? 0.4476 0.6495 0.6124 -0.2223 -0.0308 0.1544 160 SER H CA 4534 C C . SER C 165 ? 0.4136 0.6979 0.5794 -0.1832 -0.0248 0.1379 160 SER H C 4535 O O . SER C 165 ? 0.3959 0.6981 0.5649 -0.1589 -0.0233 0.1143 160 SER H O 4536 C CB . SER C 165 ? 0.4862 0.7368 0.6475 -0.2761 -0.0311 0.1832 160 SER H CB 4537 O OG . SER C 165 ? 0.5472 0.7017 0.6926 -0.3128 -0.0389 0.2021 160 SER H OG 4538 N N . SER C 166 ? 0.4162 0.7486 0.5733 -0.1749 -0.0223 0.1510 161 SER H N 4539 C CA . SER C 166 ? 0.3962 0.8047 0.5437 -0.1339 -0.0181 0.1342 161 SER H CA 4540 C C . SER C 166 ? 0.3764 0.7179 0.5121 -0.0922 -0.0218 0.1043 161 SER H C 4541 O O . SER C 166 ? 0.3764 0.6341 0.5157 -0.0972 -0.0265 0.1023 161 SER H O 4542 C CB . SER C 166 ? 0.4121 0.8906 0.5499 -0.1354 -0.0152 0.1547 161 SER H CB 4543 O OG . SER C 166 ? 0.4182 0.8473 0.5434 -0.1112 -0.0189 0.1471 161 SER H OG 4544 N N . GLY C 167 ? 0.3705 0.7505 0.4871 -0.0508 -0.0207 0.0815 162 GLY H N 4545 C CA . GLY C 167 ? 0.3703 0.6808 0.4641 -0.0161 -0.0264 0.0537 162 GLY H CA 4546 C C . GLY C 167 ? 0.3547 0.5862 0.4566 -0.0205 -0.0294 0.0427 162 GLY H C 4547 O O . GLY C 167 ? 0.3643 0.5271 0.4530 -0.0115 -0.0353 0.0295 162 GLY H O 4548 N N . VAL C 168 ? 0.3316 0.5801 0.4540 -0.0379 -0.0261 0.0488 163 VAL H N 4549 C CA . VAL C 168 ? 0.3149 0.5029 0.4449 -0.0399 -0.0283 0.0385 163 VAL H CA 4550 C C . VAL C 168 ? 0.3138 0.5317 0.4310 -0.0092 -0.0264 0.0223 163 VAL H C 4551 O O . VAL C 168 ? 0.3088 0.6133 0.4259 -0.0004 -0.0219 0.0248 163 VAL H O 4552 C CB . VAL C 168 ? 0.3058 0.4789 0.4626 -0.0806 -0.0281 0.0540 163 VAL H CB 4553 C CG1 . VAL C 168 ? 0.2967 0.4253 0.4603 -0.0782 -0.0298 0.0409 163 VAL H CG1 4554 C CG2 . VAL C 168 ? 0.3148 0.4416 0.4759 -0.0999 -0.0312 0.0698 163 VAL H CG2 4555 N N . HIS C 169 ? 0.3169 0.4685 0.4206 0.0083 -0.0300 0.0077 164 HIS H N 4556 C CA . HIS C 169 ? 0.3247 0.4896 0.4149 0.0371 -0.0289 -0.0039 164 HIS H CA 4557 C C . HIS C 169 ? 0.3120 0.4190 0.4151 0.0224 -0.0308 -0.0053 164 HIS H C 4558 O O . HIS C 169 ? 0.3210 0.3551 0.4131 0.0206 -0.0354 -0.0088 164 HIS H O 4559 C CB . HIS C 169 ? 0.3703 0.5010 0.4102 0.0864 -0.0330 -0.0213 164 HIS H CB 4560 C CG . HIS C 169 ? 0.3913 0.5711 0.4092 0.1103 -0.0325 -0.0254 164 HIS H CG 4561 N ND1 . HIS C 169 ? 0.3872 0.6788 0.4093 0.1284 -0.0262 -0.0218 164 HIS H ND1 4562 C CD2 . HIS C 169 ? 0.4207 0.5630 0.4101 0.1199 -0.0379 -0.0336 164 HIS H CD2 4563 C CE1 . HIS C 169 ? 0.4113 0.7335 0.4083 0.1522 -0.0269 -0.0273 164 HIS H CE1 4564 N NE2 . HIS C 169 ? 0.4347 0.6626 0.4101 0.1481 -0.0344 -0.0360 164 HIS H NE2 4565 N N . THR C 170 ? 0.2948 0.4422 0.4197 0.0099 -0.0278 -0.0028 165 THR H N 4566 C CA . THR C 170 ? 0.2876 0.3925 0.4202 0.0042 -0.0293 -0.0069 165 THR H CA 4567 C C . THR C 170 ? 0.3019 0.4335 0.4151 0.0401 -0.0281 -0.0152 165 THR H C 4568 O O . THR C 170 ? 0.2975 0.5122 0.4171 0.0467 -0.0248 -0.0151 165 THR H O 4569 C CB . THR C 170 ? 0.2692 0.3885 0.4336 -0.0346 -0.0290 -0.0012 165 THR H CB 4570 O OG1 . THR C 170 ? 0.2727 0.3616 0.4460 -0.0595 -0.0308 0.0088 165 THR H OG1 4571 C CG2 . THR C 170 ? 0.2650 0.3445 0.4349 -0.0352 -0.0308 -0.0081 165 THR H CG2 4572 N N . PHE C 171 ? 0.3254 0.3907 0.4119 0.0619 -0.0312 -0.0200 166 PHE H N 4573 C CA . PHE C 171 ? 0.3611 0.4323 0.4137 0.1068 -0.0314 -0.0258 166 PHE H CA 4574 C C . PHE C 171 ? 0.3420 0.4443 0.4136 0.1019 -0.0292 -0.0246 166 PHE H C 4575 O O . PHE C 171 ? 0.3189 0.4037 0.4185 0.0678 -0.0295 -0.0222 166 PHE H O 4576 C CB . PHE C 171 ? 0.4155 0.3850 0.4182 0.1287 -0.0381 -0.0288 166 PHE H CB 4577 C CG . PHE C 171 ? 0.4439 0.3834 0.4201 0.1368 -0.0421 -0.0346 166 PHE H CG 4578 C CD1 . PHE C 171 ? 0.4259 0.3338 0.4193 0.0989 -0.0446 -0.0311 166 PHE H CD1 4579 C CD2 . PHE C 171 ? 0.4936 0.4446 0.4249 0.1871 -0.0436 -0.0448 166 PHE H CD2 4580 C CE1 . PHE C 171 ? 0.4543 0.3425 0.4229 0.1055 -0.0489 -0.0377 166 PHE H CE1 4581 C CE2 . PHE C 171 ? 0.5251 0.4514 0.4285 0.1967 -0.0481 -0.0535 166 PHE H CE2 4582 C CZ . PHE C 171 ? 0.5028 0.3981 0.4259 0.1531 -0.0508 -0.0499 166 PHE H CZ 4583 N N . PRO C 172 ? 0.3586 0.5144 0.4127 0.1403 -0.0275 -0.0275 167 PRO H N 4584 C CA . PRO C 172 ? 0.3439 0.5346 0.4134 0.1374 -0.0261 -0.0271 167 PRO H CA 4585 C C . PRO C 172 ? 0.3592 0.4640 0.4162 0.1333 -0.0289 -0.0227 167 PRO H C 4586 O O . PRO C 172 ? 0.4024 0.4220 0.4217 0.1477 -0.0328 -0.0189 167 PRO H O 4587 C CB . PRO C 172 ? 0.3730 0.6311 0.4135 0.1928 -0.0245 -0.0293 167 PRO H CB 4588 C CG . PRO C 172 ? 0.3832 0.6861 0.4130 0.2111 -0.0232 -0.0322 167 PRO H CG 4589 C CD . PRO C 172 ? 0.3920 0.5996 0.4145 0.1896 -0.0264 -0.0319 167 PRO H CD 4590 N N . ALA C 173 ? 0.3321 0.4622 0.4175 0.1104 -0.0278 -0.0233 168 ALA H N 4591 C CA . ALA C 173 ? 0.3453 0.4191 0.4209 0.1077 -0.0293 -0.0171 168 ALA H CA 4592 C C . ALA C 173 ? 0.3995 0.4541 0.4295 0.1530 -0.0303 -0.0096 168 ALA H C 4593 O O . ALA C 173 ? 0.4138 0.5276 0.4316 0.1882 -0.0288 -0.0127 168 ALA H O 4594 C CB . ALA C 173 ? 0.3070 0.4234 0.4189 0.0808 -0.0281 -0.0229 168 ALA H CB 4595 N N . VAL C 174 ? 0.4427 0.4177 0.4444 0.1514 -0.0334 0.0022 169 VAL H N 4596 C CA . VAL C 174 ? 0.5104 0.4515 0.4629 0.1890 -0.0355 0.0146 169 VAL H CA 4597 C C . VAL C 174 ? 0.5085 0.4366 0.4693 0.1648 -0.0350 0.0275 169 VAL H C 4598 O O . VAL C 174 ? 0.4692 0.3863 0.4586 0.1234 -0.0349 0.0282 169 VAL H O 4599 C CB . VAL C 174 ? 0.6013 0.4346 0.4858 0.2149 -0.0426 0.0210 169 VAL H CB 4600 C CG1 . VAL C 174 ? 0.6114 0.4690 0.4854 0.2456 -0.0427 0.0063 169 VAL H CG1 4601 C CG2 . VAL C 174 ? 0.6202 0.3675 0.4979 0.1689 -0.0479 0.0283 169 VAL H CG2 4602 N N . LEU C 175 ? 0.5494 0.4896 0.4843 0.1945 -0.0345 0.0385 170 LEU H N 4603 C CA . LEU C 175 ? 0.5639 0.4980 0.4991 0.1761 -0.0339 0.0546 170 LEU H CA 4604 C C . LEU C 175 ? 0.6431 0.4656 0.5312 0.1561 -0.0401 0.0770 170 LEU H C 4605 O O . LEU C 175 ? 0.7193 0.4518 0.5459 0.1787 -0.0466 0.0856 170 LEU H O 4606 C CB . LEU C 175 ? 0.5869 0.5692 0.5031 0.2156 -0.0320 0.0630 170 LEU H CB 4607 C CG . LEU C 175 ? 0.5233 0.6258 0.4899 0.2106 -0.0269 0.0490 170 LEU H CG 4608 C CD1 . LEU C 175 ? 0.5496 0.6925 0.4938 0.2409 -0.0256 0.0641 170 LEU H CD1 4609 C CD2 . LEU C 175 ? 0.4625 0.5888 0.4794 0.1621 -0.0252 0.0374 170 LEU H CD2 4610 N N . GLN C 176 ? 0.6342 0.4674 0.5481 0.1131 -0.0390 0.0858 171 GLN H N 4611 C CA . GLN C 176 ? 0.7048 0.4594 0.5865 0.0765 -0.0449 0.1077 171 GLN H CA 4612 C C . GLN C 176 ? 0.6823 0.4876 0.5806 0.0532 -0.0413 0.1259 171 GLN H C 4613 O O . GLN C 176 ? 0.6173 0.4949 0.5681 0.0300 -0.0367 0.1161 171 GLN H O 4614 C CB . GLN C 176 ? 0.6907 0.4379 0.6022 0.0427 -0.0466 0.0938 171 GLN H CB 4615 C CG . GLN C 176 ? 0.7111 0.4537 0.6334 -0.0106 -0.0493 0.1080 171 GLN H CG 4616 C CD . GLN C 176 ? 0.6484 0.4926 0.6364 -0.0253 -0.0421 0.0975 171 GLN H CD 4617 O OE1 . GLN C 176 ? 0.6721 0.5547 0.6707 -0.0521 -0.0411 0.1126 171 GLN H OE1 4618 N NE2 . GLN C 176 ? 0.5925 0.4787 0.6192 -0.0076 -0.0380 0.0721 171 GLN H NE2 4619 N N . SER C 177 ? 0.7474 0.5148 0.5958 0.0635 -0.0437 0.1531 172 SER H N 4620 C CA . SER C 177 ? 0.7339 0.5614 0.5936 0.0462 -0.0396 0.1738 172 SER H CA 4621 C C . SER C 177 ? 0.6271 0.5804 0.5509 0.0635 -0.0307 0.1484 172 SER H C 4622 O O . SER C 177 ? 0.5741 0.5945 0.5383 0.0383 -0.0270 0.1441 172 SER H O 4623 C CB . SER C 177 ? 0.7411 0.5661 0.6106 -0.0121 -0.0420 0.1891 172 SER H CB 4624 O OG . SER C 177 ? 0.8257 0.5346 0.6431 -0.0377 -0.0523 0.2016 172 SER H OG 4625 N N . ASP C 178 ? 0.5959 0.5816 0.5263 0.1055 -0.0286 0.1291 173 ASP H N 4626 C CA . ASP C 178 ? 0.5196 0.6147 0.4997 0.1179 -0.0231 0.1036 173 ASP H CA 4627 C C . ASP C 178 ? 0.4346 0.5677 0.4691 0.0962 -0.0219 0.0719 173 ASP H C 4628 O O . ASP C 178 ? 0.3869 0.5936 0.4546 0.0993 -0.0198 0.0495 173 ASP H O 4629 C CB . ASP C 178 ? 0.5261 0.6812 0.5068 0.1151 -0.0198 0.1199 173 ASP H CB 4630 C CG . ASP C 178 ? 0.6109 0.7288 0.5339 0.1392 -0.0213 0.1540 173 ASP H CG 4631 O OD1 . ASP C 178 ? 0.6355 0.7538 0.5379 0.1814 -0.0222 0.1491 173 ASP H OD1 4632 O OD2 . ASP C 178 ? 0.6646 0.7545 0.5592 0.1163 -0.0221 0.1876 173 ASP H OD2 4633 N N . LEU C 179 ? 0.4218 0.4980 0.4585 0.0743 -0.0245 0.0707 174 LEU H N 4634 C CA . LEU C 179 ? 0.3633 0.4562 0.4409 0.0590 -0.0244 0.0448 174 LEU H CA 4635 C C . LEU C 179 ? 0.3663 0.4068 0.4330 0.0636 -0.0271 0.0390 174 LEU H C 4636 O O . LEU C 179 ? 0.4151 0.3962 0.4400 0.0759 -0.0299 0.0544 174 LEU H O 4637 C CB . LEU C 179 ? 0.3504 0.4441 0.4436 0.0295 -0.0244 0.0509 174 LEU H CB 4638 C CG . LEU C 179 ? 0.3416 0.5020 0.4456 0.0265 -0.0212 0.0572 174 LEU H CG 4639 C CD1 . LEU C 179 ? 0.3382 0.5082 0.4521 -0.0004 -0.0215 0.0683 174 LEU H CD1 4640 C CD2 . LEU C 179 ? 0.3050 0.5303 0.4372 0.0441 -0.0197 0.0266 174 LEU H CD2 4641 N N . TYR C 180 ? 0.3218 0.3812 0.4205 0.0553 -0.0270 0.0170 175 TYR H N 4642 C CA . TYR C 180 ? 0.3226 0.3524 0.4158 0.0593 -0.0287 0.0108 175 TYR H CA 4643 C C . TYR C 180 ? 0.3218 0.2996 0.4153 0.0361 -0.0312 0.0154 175 TYR H C 4644 O O . TYR C 180 ? 0.3085 0.2915 0.4186 0.0154 -0.0312 0.0180 175 TYR H O 4645 C CB . TYR C 180 ? 0.2868 0.3716 0.4106 0.0574 -0.0279 -0.0112 175 TYR H CB 4646 C CG . TYR C 180 ? 0.2880 0.4359 0.4082 0.0802 -0.0267 -0.0168 175 TYR H CG 4647 C CD1 . TYR C 180 ? 0.3139 0.4716 0.4090 0.1107 -0.0264 -0.0116 175 TYR H CD1 4648 C CD2 . TYR C 180 ? 0.2701 0.4740 0.4085 0.0751 -0.0267 -0.0290 175 TYR H CD2 4649 C CE1 . TYR C 180 ? 0.3162 0.5486 0.4080 0.1355 -0.0254 -0.0155 175 TYR H CE1 4650 C CE2 . TYR C 180 ? 0.2726 0.5460 0.4080 0.0939 -0.0265 -0.0345 175 TYR H CE2 4651 C CZ . TYR C 180 ? 0.2923 0.5849 0.4062 0.1238 -0.0255 -0.0265 175 TYR H CZ 4652 O OH . TYR C 180 ? 0.2959 0.6729 0.4075 0.1453 -0.0254 -0.0310 175 TYR H OH 4653 N N . THR C 181 ? 0.3427 0.2794 0.4153 0.0434 -0.0336 0.0157 176 THR H N 4654 C CA . THR C 181 ? 0.3492 0.2432 0.4204 0.0229 -0.0369 0.0173 176 THR H CA 4655 C C . THR C 181 ? 0.3465 0.2436 0.4172 0.0359 -0.0369 0.0063 176 THR H C 4656 O O . THR C 181 ? 0.3686 0.2739 0.4173 0.0658 -0.0364 0.0039 176 THR H O 4657 C CB . THR C 181 ? 0.4127 0.2315 0.4366 0.0157 -0.0429 0.0341 176 THR H CB 4658 O OG1 . THR C 181 ? 0.4257 0.2512 0.4471 -0.0008 -0.0428 0.0499 176 THR H OG1 4659 C CG2 . THR C 181 ? 0.4187 0.2032 0.4414 -0.0100 -0.0477 0.0336 176 THR H CG2 4660 N N . LEU C 182 ? 0.3237 0.2226 0.4163 0.0168 -0.0374 0.0011 177 LEU H N 4661 C CA . LEU C 182 ? 0.3338 0.2270 0.4167 0.0259 -0.0383 -0.0042 177 LEU H CA 4662 C C . LEU C 182 ? 0.3327 0.1972 0.4201 0.0036 -0.0415 -0.0019 177 LEU H C 4663 O O . LEU C 182 ? 0.3232 0.1818 0.4245 -0.0177 -0.0426 0.0035 177 LEU H O 4664 C CB . LEU C 182 ? 0.3033 0.2624 0.4135 0.0283 -0.0342 -0.0131 177 LEU H CB 4665 C CG . LEU C 182 ? 0.2690 0.2545 0.4176 0.0000 -0.0333 -0.0173 177 LEU H CG 4666 C CD1 . LEU C 182 ? 0.2640 0.2258 0.4198 -0.0170 -0.0349 -0.0135 177 LEU H CD1 4667 C CD2 . LEU C 182 ? 0.2567 0.3047 0.4194 -0.0023 -0.0314 -0.0244 177 LEU H CD2 4668 N N . SER C 183 ? 0.3462 0.2046 0.4208 0.0116 -0.0428 -0.0062 178 SER H N 4669 C CA . SER C 183 ? 0.3413 0.1855 0.4214 -0.0072 -0.0457 -0.0048 178 SER H CA 4670 C C . SER C 183 ? 0.3218 0.2062 0.4146 -0.0018 -0.0428 -0.0086 178 SER H C 4671 O O . SER C 183 ? 0.3202 0.2422 0.4106 0.0170 -0.0394 -0.0127 178 SER H O 4672 C CB . SER C 183 ? 0.3982 0.1780 0.4332 -0.0078 -0.0537 -0.0045 178 SER H CB 4673 O OG . SER C 183 ? 0.4506 0.2033 0.4419 0.0261 -0.0559 -0.0120 178 SER H OG 4674 N N . SER C 184 ? 0.3092 0.1953 0.4158 -0.0195 -0.0440 -0.0048 179 SER H N 4675 C CA . SER C 184 ? 0.2968 0.2208 0.4143 -0.0212 -0.0415 -0.0029 179 SER H CA 4676 C C . SER C 184 ? 0.3118 0.2164 0.4143 -0.0249 -0.0459 -0.0018 179 SER H C 4677 O O . SER C 184 ? 0.3144 0.1944 0.4202 -0.0407 -0.0499 0.0019 179 SER H O 4678 C CB . SER C 184 ? 0.2716 0.2170 0.4231 -0.0432 -0.0390 0.0045 179 SER H CB 4679 O OG . SER C 184 ? 0.2731 0.2523 0.4309 -0.0516 -0.0372 0.0116 179 SER H OG 4680 N N . SER C 185 ? 0.3221 0.2492 0.4081 -0.0102 -0.0456 -0.0054 180 SER H N 4681 C CA . SER C 185 ? 0.3405 0.2547 0.4084 -0.0119 -0.0505 -0.0072 180 SER H CA 4682 C C . SER C 185 ? 0.3203 0.2880 0.4097 -0.0209 -0.0464 0.0042 180 SER H C 4683 O O . SER C 185 ? 0.3063 0.3223 0.4112 -0.0212 -0.0405 0.0106 180 SER H O 4684 C CB . SER C 185 ? 0.3933 0.2775 0.4101 0.0176 -0.0559 -0.0237 180 SER H CB 4685 O OG . SER C 185 ? 0.3962 0.3352 0.4040 0.0450 -0.0515 -0.0278 180 SER H OG 4686 N N . VAL C 186 ? 0.3240 0.2871 0.4126 -0.0318 -0.0502 0.0092 181 VAL H N 4687 C CA . VAL C 186 ? 0.3181 0.3276 0.4190 -0.0387 -0.0471 0.0233 181 VAL H CA 4688 C C . VAL C 186 ? 0.3423 0.3528 0.4190 -0.0326 -0.0530 0.0173 181 VAL H C 4689 O O . VAL C 186 ? 0.3580 0.3307 0.4225 -0.0395 -0.0603 0.0095 181 VAL H O 4690 C CB . VAL C 186 ? 0.2985 0.3051 0.4295 -0.0611 -0.0453 0.0431 181 VAL H CB 4691 C CG1 . VAL C 186 ? 0.2980 0.2732 0.4320 -0.0663 -0.0506 0.0435 181 VAL H CG1 4692 C CG2 . VAL C 186 ? 0.3025 0.3481 0.4384 -0.0703 -0.0426 0.0628 181 VAL H CG2 4693 N N . THR C 187 ? 0.3505 0.4121 0.4191 -0.0226 -0.0503 0.0208 182 THR H N 4694 C CA . THR C 187 ? 0.3799 0.4512 0.4217 -0.0133 -0.0561 0.0121 182 THR H CA 4695 C C . THR C 187 ? 0.3657 0.4871 0.4275 -0.0274 -0.0529 0.0368 182 THR H C 4696 O O . THR C 187 ? 0.3555 0.5226 0.4343 -0.0341 -0.0454 0.0564 182 THR H O 4697 C CB . THR C 187 ? 0.4163 0.5078 0.4200 0.0214 -0.0567 -0.0082 182 THR H CB 4698 O OG1 . THR C 187 ? 0.4499 0.4785 0.4269 0.0376 -0.0611 -0.0283 182 THR H OG1 4699 C CG2 . THR C 187 ? 0.4542 0.5521 0.4228 0.0336 -0.0642 -0.0222 182 THR H CG2 4700 N N . VAL C 188 ? 0.3739 0.4873 0.4308 -0.0349 -0.0594 0.0380 183 VAL H N 4701 C CA . VAL C 188 ? 0.3701 0.5266 0.4391 -0.0432 -0.0578 0.0628 183 VAL H CA 4702 C C . VAL C 188 ? 0.3931 0.5739 0.4357 -0.0354 -0.0656 0.0505 183 VAL H C 4703 O O . VAL C 188 ? 0.4146 0.5612 0.4296 -0.0317 -0.0746 0.0225 183 VAL H O 4704 C CB . VAL C 188 ? 0.3577 0.4892 0.4517 -0.0579 -0.0582 0.0831 183 VAL H CB 4705 C CG1 . VAL C 188 ? 0.3475 0.4525 0.4617 -0.0668 -0.0520 0.0951 183 VAL H CG1 4706 C CG2 . VAL C 188 ? 0.3594 0.4610 0.4495 -0.0619 -0.0665 0.0668 183 VAL H CG2 4707 N N . PRO C 189 ? 0.3948 0.6308 0.4409 -0.0355 -0.0634 0.0721 184 PRO H N 4708 C CA . PRO C 189 ? 0.4184 0.6862 0.4403 -0.0291 -0.0715 0.0607 184 PRO H CA 4709 C C . PRO C 189 ? 0.4216 0.6618 0.4437 -0.0431 -0.0816 0.0521 184 PRO H C 4710 O O . PRO C 189 ? 0.4023 0.6354 0.4508 -0.0523 -0.0798 0.0730 184 PRO H O 4711 C CB . PRO C 189 ? 0.4152 0.7481 0.4477 -0.0293 -0.0656 0.0955 184 PRO H CB 4712 C CG . PRO C 189 ? 0.4038 0.7424 0.4542 -0.0360 -0.0548 0.1182 184 PRO H CG 4713 C CD . PRO C 189 ? 0.3865 0.6563 0.4526 -0.0442 -0.0545 0.1085 184 PRO H CD 4714 N N . SER C 190 ? 0.4573 0.6831 0.4449 -0.0446 -0.0932 0.0206 185 SER H N 4715 C CA . SER C 190 ? 0.4717 0.6822 0.4544 -0.0673 -0.1049 0.0104 185 SER H CA 4716 C C . SER C 190 ? 0.4498 0.7240 0.4572 -0.0722 -0.1051 0.0374 185 SER H C 4717 O O . SER C 190 ? 0.4366 0.7132 0.4626 -0.0859 -0.1081 0.0455 185 SER H O 4718 C CB . SER C 190 ? 0.5336 0.7209 0.4637 -0.0722 -0.1198 -0.0269 185 SER H CB 4719 O OG . SER C 190 ? 0.5653 0.7075 0.4825 -0.1042 -0.1319 -0.0416 185 SER H OG 4720 N N . SER C 191 ? 0.4505 0.7826 0.4563 -0.0574 -0.1015 0.0536 186 SER H N 4721 C CA . SER C 191 ? 0.4431 0.8369 0.4647 -0.0541 -0.1020 0.0822 186 SER H CA 4722 C C . SER C 191 ? 0.4193 0.7969 0.4732 -0.0479 -0.0941 0.1151 186 SER H C 4723 O O . SER C 191 ? 0.4211 0.8388 0.4839 -0.0398 -0.0964 0.1358 186 SER H O 4724 C CB . SER C 191 ? 0.4525 0.9049 0.4640 -0.0376 -0.0976 0.0995 186 SER H CB 4725 O OG . SER C 191 ? 0.4463 0.8822 0.4664 -0.0299 -0.0854 0.1171 186 SER H OG 4726 N N . THR C 192 ? 0.4057 0.7267 0.4719 -0.0477 -0.0858 0.1190 187 THR H N 4727 C CA . THR C 192 ? 0.3995 0.6901 0.4865 -0.0402 -0.0795 0.1464 187 THR H CA 4728 C C . THR C 192 ? 0.3827 0.6363 0.4846 -0.0448 -0.0814 0.1350 187 THR H C 4729 O O . THR C 192 ? 0.3827 0.6140 0.4962 -0.0323 -0.0784 0.1534 187 THR H O 4730 C CB . THR C 192 ? 0.4074 0.6702 0.4960 -0.0412 -0.0699 0.1637 187 THR H CB 4731 O OG1 . THR C 192 ? 0.4351 0.6785 0.5267 -0.0326 -0.0671 0.1999 187 THR H OG1 4732 C CG2 . THR C 192 ? 0.3901 0.6032 0.4860 -0.0509 -0.0661 0.1438 187 THR H CG2 4733 N N . TRP C 193 ? 0.3754 0.6197 0.4710 -0.0618 -0.0873 0.1051 188 TRP H N 4734 C CA . TRP C 193 ? 0.3625 0.5868 0.4708 -0.0702 -0.0894 0.0971 188 TRP H CA 4735 C C . TRP C 193 ? 0.3710 0.6397 0.4695 -0.0908 -0.1011 0.0824 188 TRP H C 4736 O O . TRP C 193 ? 0.3937 0.6631 0.4666 -0.1065 -0.1086 0.0623 188 TRP H O 4737 C CB . TRP C 193 ? 0.3570 0.5189 0.4640 -0.0788 -0.0856 0.0799 188 TRP H CB 4738 C CG . TRP C 193 ? 0.3471 0.4930 0.4672 -0.0871 -0.0866 0.0753 188 TRP H CG 4739 C CD1 . TRP C 193 ? 0.3339 0.4651 0.4741 -0.0732 -0.0807 0.0875 188 TRP H CD1 4740 C CD2 . TRP C 193 ? 0.3577 0.5024 0.4668 -0.1129 -0.0951 0.0579 188 TRP H CD2 4741 N NE1 . TRP C 193 ? 0.3284 0.4638 0.4751 -0.0850 -0.0835 0.0790 188 TRP H NE1 4742 C CE2 . TRP C 193 ? 0.3415 0.4849 0.4699 -0.1131 -0.0922 0.0633 188 TRP H CE2 4743 C CE3 . TRP C 193 ? 0.3917 0.5315 0.4703 -0.1385 -0.1062 0.0382 188 TRP H CE3 4744 C CZ2 . TRP C 193 ? 0.3534 0.4998 0.4758 -0.1413 -0.0986 0.0541 188 TRP H CZ2 4745 C CZ3 . TRP C 193 ? 0.4109 0.5381 0.4782 -0.1699 -0.1143 0.0283 188 TRP H CZ3 4746 C CH2 . TRP C 193 ? 0.3907 0.5263 0.4820 -0.1730 -0.1099 0.0385 188 TRP H CH2 4747 N N . PRO C 194 ? 0.3578 0.6674 0.4726 -0.0915 -0.1038 0.0913 189 PRO H N 4748 C CA . PRO C 194 ? 0.3418 0.6482 0.4788 -0.0673 -0.0970 0.1090 189 PRO H CA 4749 C C . PRO C 194 ? 0.3507 0.6858 0.4914 -0.0294 -0.0937 0.1373 189 PRO H C 4750 O O . PRO C 194 ? 0.3525 0.6801 0.5017 -0.0025 -0.0904 0.1497 189 PRO H O 4751 C CB . PRO C 194 ? 0.3371 0.6948 0.4823 -0.0863 -0.1035 0.1024 189 PRO H CB 4752 C CG . PRO C 194 ? 0.3542 0.7718 0.4844 -0.1139 -0.1150 0.0934 189 PRO H CG 4753 C CD . PRO C 194 ? 0.3706 0.7378 0.4767 -0.1212 -0.1161 0.0795 189 PRO H CD 4754 N N . SER C 195 ? 0.3630 0.7263 0.4918 -0.0233 -0.0953 0.1478 190 SER H N 4755 C CA . SER C 195 ? 0.3882 0.7741 0.5132 0.0144 -0.0935 0.1789 190 SER H CA 4756 C C . SER C 195 ? 0.4105 0.7094 0.5316 0.0356 -0.0857 0.1963 190 SER H C 4757 O O . SER C 195 ? 0.4373 0.7254 0.5523 0.0713 -0.0857 0.2145 190 SER H O 4758 C CB . SER C 195 ? 0.4008 0.8346 0.5114 0.0161 -0.0962 0.1901 190 SER H CB 4759 O OG . SER C 195 ? 0.3997 0.7990 0.5015 -0.0049 -0.0932 0.1791 190 SER H OG 4760 N N . GLU C 196 ? 0.4063 0.6451 0.5261 0.0145 -0.0805 0.1893 191 GLU H N 4761 C CA . GLU C 196 ? 0.4322 0.5885 0.5470 0.0203 -0.0750 0.2013 191 GLU H CA 4762 C C . GLU C 196 ? 0.4049 0.5229 0.5340 0.0083 -0.0730 0.1771 191 GLU H C 4763 O O . GLU C 196 ? 0.3699 0.4983 0.5074 -0.0160 -0.0727 0.1537 191 GLU H O 4764 C CB . GLU C 196 ? 0.4472 0.5815 0.5530 0.0007 -0.0704 0.2122 191 GLU H CB 4765 C CG . GLU C 196 ? 0.4735 0.6534 0.5644 0.0067 -0.0713 0.2365 191 GLU H CG 4766 C CD . GLU C 196 ? 0.5345 0.6892 0.6050 0.0356 -0.0733 0.2724 191 GLU H CD 4767 O OE1 . GLU C 196 ? 0.5508 0.6928 0.6199 0.0641 -0.0768 0.2717 191 GLU H OE1 4768 O OE2 . GLU C 196 ? 0.5770 0.7257 0.6285 0.0321 -0.0716 0.3026 191 GLU H OE2 4769 N N . THR C 197 ? 0.4279 0.4957 0.5532 0.0285 -0.0724 0.1828 192 THR H N 4770 C CA . THR C 197 ? 0.4062 0.4511 0.5445 0.0244 -0.0710 0.1611 192 THR H CA 4771 C C . THR C 197 ? 0.3897 0.3896 0.5331 -0.0042 -0.0665 0.1482 192 THR H C 4772 O O . THR C 197 ? 0.4073 0.3739 0.5411 -0.0161 -0.0641 0.1600 192 THR H O 4773 C CB . THR C 197 ? 0.4456 0.4509 0.5731 0.0597 -0.0725 0.1660 192 THR H CB 4774 O OG1 . THR C 197 ? 0.5034 0.4219 0.6063 0.0633 -0.0726 0.1811 192 THR H OG1 4775 C CG2 . THR C 197 ? 0.4629 0.5291 0.5847 0.0987 -0.0768 0.1775 192 THR H CG2 4776 N N . VAL C 198 ? 0.3576 0.3646 0.5145 -0.0159 -0.0656 0.1260 193 VAL H N 4777 C CA . VAL C 198 ? 0.3417 0.3161 0.5029 -0.0359 -0.0616 0.1120 193 VAL H CA 4778 C C . VAL C 198 ? 0.3339 0.2897 0.5037 -0.0304 -0.0610 0.0982 193 VAL H C 4779 O O . VAL C 198 ? 0.3169 0.3064 0.4943 -0.0295 -0.0629 0.0896 193 VAL H O 4780 C CB . VAL C 198 ? 0.3186 0.3203 0.4786 -0.0543 -0.0618 0.0980 193 VAL H CB 4781 C CG1 . VAL C 198 ? 0.3061 0.2819 0.4679 -0.0647 -0.0582 0.0823 193 VAL H CG1 4782 C CG2 . VAL C 198 ? 0.3271 0.3513 0.4765 -0.0570 -0.0616 0.1096 193 VAL H CG2 4783 N N . THR C 199 ? 0.3511 0.2579 0.5177 -0.0307 -0.0591 0.0968 194 THR H N 4784 C CA . THR C 199 ? 0.3524 0.2406 0.5232 -0.0206 -0.0590 0.0837 194 THR H CA 4785 C C . THR C 199 ? 0.3450 0.2069 0.5188 -0.0401 -0.0560 0.0722 194 THR H C 4786 O O . THR C 199 ? 0.3729 0.2067 0.5384 -0.0544 -0.0558 0.0795 194 THR H O 4787 C CB . THR C 199 ? 0.4038 0.2497 0.5567 0.0076 -0.0628 0.0913 194 THR H CB 4788 O OG1 . THR C 199 ? 0.4187 0.2956 0.5650 0.0312 -0.0656 0.1063 194 THR H OG1 4789 C CG2 . THR C 199 ? 0.4069 0.2453 0.5606 0.0266 -0.0634 0.0744 194 THR H CG2 4790 N N . CYS C 200 ? 0.3150 0.1925 0.4989 -0.0431 -0.0540 0.0569 195 CYS H N 4791 C CA . CYS C 200 ? 0.3126 0.1744 0.4987 -0.0555 -0.0516 0.0460 195 CYS H CA 4792 C C . CYS C 200 ? 0.3352 0.1641 0.5166 -0.0451 -0.0538 0.0372 195 CYS H C 4793 O O . CYS C 200 ? 0.3384 0.1729 0.5193 -0.0233 -0.0553 0.0331 195 CYS H O 4794 C CB . CYS C 200 ? 0.2844 0.1719 0.4757 -0.0610 -0.0490 0.0355 195 CYS H CB 4795 S SG . CYS C 200 ? 0.2782 0.1790 0.4753 -0.0520 -0.0490 0.0262 195 CYS H SG 4796 N N . ASN C 201 ? 0.3546 0.1541 0.5293 -0.0615 -0.0548 0.0338 196 ASN H N 4797 C CA . ASN C 201 ? 0.3903 0.1477 0.5523 -0.0562 -0.0592 0.0213 196 ASN H CA 4798 C C . ASN C 201 ? 0.3612 0.1441 0.5342 -0.0679 -0.0567 0.0052 196 ASN H C 4799 O O . ASN C 201 ? 0.3515 0.1540 0.5295 -0.0917 -0.0547 0.0070 196 ASN H O 4800 C CB . ASN C 201 ? 0.4558 0.1495 0.5923 -0.0742 -0.0656 0.0306 196 ASN H CB 4801 C CG . ASN C 201 ? 0.4755 0.1581 0.6027 -0.0712 -0.0663 0.0545 196 ASN H CG 4802 O OD1 . ASN C 201 ? 0.4749 0.1684 0.6024 -0.0986 -0.0649 0.0702 196 ASN H OD1 4803 N ND2 . ASN C 201 ? 0.4900 0.1645 0.6091 -0.0353 -0.0682 0.0584 196 ASN H ND2 4804 N N . VAL C 202 ? 0.3495 0.1432 0.5257 -0.0487 -0.0564 -0.0090 197 VAL H N 4805 C CA . VAL C 202 ? 0.3237 0.1474 0.5089 -0.0547 -0.0538 -0.0225 197 VAL H CA 4806 C C . VAL C 202 ? 0.3613 0.1546 0.5319 -0.0504 -0.0596 -0.0414 197 VAL H C 4807 O O . VAL C 202 ? 0.3859 0.1571 0.5441 -0.0242 -0.0629 -0.0483 197 VAL H O 4808 C CB . VAL C 202 ? 0.2823 0.1510 0.4801 -0.0398 -0.0488 -0.0214 197 VAL H CB 4809 C CG1 . VAL C 202 ? 0.2652 0.1621 0.4674 -0.0421 -0.0462 -0.0317 197 VAL H CG1 4810 C CG2 . VAL C 202 ? 0.2593 0.1431 0.4613 -0.0466 -0.0461 -0.0069 197 VAL H CG2 4811 N N . ALA C 203 ? 0.3695 0.1686 0.5389 -0.0741 -0.0614 -0.0512 198 ALA H N 4812 C CA . ALA C 203 ? 0.4136 0.1860 0.5656 -0.0765 -0.0687 -0.0736 198 ALA H CA 4813 C C . ALA C 203 ? 0.3753 0.2107 0.5424 -0.0768 -0.0647 -0.0852 198 ALA H C 4814 O O . ALA C 203 ? 0.3397 0.2245 0.5223 -0.0904 -0.0596 -0.0770 198 ALA H O 4815 C CB . ALA C 203 ? 0.4755 0.1939 0.6044 -0.1142 -0.0779 -0.0748 198 ALA H CB 4816 N N . HIS C 204 ? 0.3888 0.2253 0.5476 -0.0563 -0.0673 -0.1041 199 HIS H N 4817 C CA . HIS C 204 ? 0.3638 0.2576 0.5315 -0.0546 -0.0649 -0.1159 199 HIS H CA 4818 C C . HIS C 204 ? 0.4231 0.2865 0.5659 -0.0575 -0.0754 -0.1450 199 HIS H C 4819 O O . HIS C 204 ? 0.4378 0.3002 0.5701 -0.0263 -0.0767 -0.1596 199 HIS H O 4820 C CB . HIS C 204 ? 0.3203 0.2607 0.5017 -0.0246 -0.0568 -0.1077 199 HIS H CB 4821 C CG . HIS C 204 ? 0.2957 0.2960 0.4840 -0.0205 -0.0533 -0.1126 199 HIS H CG 4822 N ND1 . HIS C 204 ? 0.2964 0.3281 0.4813 0.0021 -0.0525 -0.1230 199 HIS H ND1 4823 C CD2 . HIS C 204 ? 0.2731 0.3141 0.4689 -0.0315 -0.0502 -0.1073 199 HIS H CD2 4824 C CE1 . HIS C 204 ? 0.2754 0.3592 0.4654 0.0020 -0.0493 -0.1221 199 HIS H CE1 4825 N NE2 . HIS C 204 ? 0.2624 0.3516 0.4581 -0.0158 -0.0481 -0.1131 199 HIS H NE2 4826 N N . PRO C 205 ? 0.4635 0.3057 0.5934 -0.0970 -0.0837 -0.1539 200 PRO H N 4827 C CA . PRO C 205 ? 0.5431 0.3344 0.6382 -0.1108 -0.0977 -0.1838 200 PRO H CA 4828 C C . PRO C 205 ? 0.5369 0.3740 0.6302 -0.0852 -0.0981 -0.2081 200 PRO H C 4829 O O . PRO C 205 ? 0.6022 0.3856 0.6610 -0.0691 -0.1082 -0.2349 200 PRO H O 4830 C CB . PRO C 205 ? 0.5630 0.3687 0.6568 -0.1689 -0.1038 -0.1821 200 PRO H CB 4831 C CG . PRO C 205 ? 0.5181 0.3456 0.6355 -0.1799 -0.0948 -0.1496 200 PRO H CG 4832 C CD . PRO C 205 ? 0.4428 0.3139 0.5874 -0.1338 -0.0812 -0.1357 200 PRO H CD 4833 N N . ALA C 206 ? 0.4674 0.3995 0.5920 -0.0770 -0.0876 -0.1981 201 ALA H N 4834 C CA . ALA C 206 ? 0.4577 0.4480 0.5822 -0.0551 -0.0869 -0.2164 201 ALA H CA 4835 C C . ALA C 206 ? 0.4715 0.4464 0.5839 -0.0097 -0.0858 -0.2256 201 ALA H C 4836 O O . ALA C 206 ? 0.5123 0.4910 0.6029 0.0057 -0.0928 -0.2545 201 ALA H O 4837 C CB . ALA C 206 ? 0.3865 0.4699 0.5410 -0.0482 -0.0752 -0.1959 201 ALA H CB 4838 N N . SER C 207 ? 0.4414 0.4080 0.5662 0.0115 -0.0778 -0.2024 202 SER H N 4839 C CA . SER C 207 ? 0.4551 0.4245 0.5700 0.0557 -0.0763 -0.2074 202 SER H CA 4840 C C . SER C 207 ? 0.5253 0.4035 0.6086 0.0712 -0.0852 -0.2175 202 SER H C 4841 O O . SER C 207 ? 0.5368 0.4226 0.6109 0.1135 -0.0838 -0.2189 202 SER H O 4842 C CB . SER C 207 ? 0.3881 0.4197 0.5328 0.0682 -0.0631 -0.1746 202 SER H CB 4843 O OG . SER C 207 ? 0.3669 0.3664 0.5238 0.0511 -0.0601 -0.1506 202 SER H OG 4844 N N . SER C 208 ? 0.5761 0.3737 0.6403 0.0374 -0.0946 -0.2218 203 SER H N 4845 C CA . SER C 208 ? 0.6576 0.3508 0.6842 0.0476 -0.1043 -0.2257 203 SER H CA 4846 C C . SER C 208 ? 0.6253 0.3316 0.6682 0.0758 -0.0957 -0.1982 203 SER H C 4847 O O . SER C 208 ? 0.6795 0.3434 0.6933 0.1177 -0.1003 -0.2044 203 SER H O 4848 C CB . SER C 208 ? 0.7563 0.3870 0.7294 0.0824 -0.1177 -0.2635 203 SER H CB 4849 O OG . SER C 208 ? 0.7940 0.4136 0.7498 0.0492 -0.1275 -0.2904 203 SER H OG 4850 N N . THR C 209 ? 0.5446 0.3097 0.6297 0.0539 -0.0843 -0.1691 204 THR H N 4851 C CA . THR C 209 ? 0.5086 0.2988 0.6119 0.0711 -0.0766 -0.1430 204 THR H CA 4852 C C . THR C 209 ? 0.5209 0.2559 0.6225 0.0431 -0.0785 -0.1241 204 THR H C 4853 O O . THR C 209 ? 0.5035 0.2348 0.6148 0.0020 -0.0783 -0.1185 204 THR H O 4854 C CB . THR C 209 ? 0.4248 0.3095 0.5674 0.0648 -0.0644 -0.1235 204 THR H CB 4855 O OG1 . THR C 209 ? 0.4173 0.3633 0.5612 0.0910 -0.0617 -0.1346 204 THR H OG1 4856 C CG2 . THR C 209 ? 0.3953 0.3036 0.5534 0.0706 -0.0589 -0.0979 204 THR H CG2 4857 N N . LYS C 210 ? 0.5525 0.2548 0.6402 0.0681 -0.0804 -0.1135 205 LYS H N 4858 C CA . LYS C 210 ? 0.5576 0.2286 0.6481 0.0479 -0.0800 -0.0896 205 LYS H CA 4859 C C . LYS C 210 ? 0.5213 0.2476 0.6294 0.0765 -0.0735 -0.0715 205 LYS H C 4860 O O . LYS C 210 ? 0.5499 0.2857 0.6430 0.1210 -0.0755 -0.0774 205 LYS H O 4861 C CB . LYS C 210 ? 0.6618 0.2207 0.7053 0.0462 -0.0922 -0.0926 205 LYS H CB 4862 C CG . LYS C 210 ? 0.7464 0.2330 0.7496 0.0397 -0.1043 -0.1218 205 LYS H CG 4863 C CD . LYS C 210 ? 0.7234 0.2301 0.7430 -0.0181 -0.1044 -0.1259 205 LYS H CD 4864 C CE . LYS C 210 ? 0.7460 0.2616 0.7537 -0.0170 -0.1099 -0.1590 205 LYS H CE 4865 N NZ . LYS C 210 ? 0.8671 0.2788 0.8128 0.0050 -0.1259 -0.1883 205 LYS H NZ 4866 N N . VAL C 211 ? 0.4637 0.2340 0.6010 0.0523 -0.0664 -0.0509 206 VAL H N 4867 C CA . VAL C 211 ? 0.4368 0.2602 0.5884 0.0686 -0.0623 -0.0337 206 VAL H CA 4868 C C . VAL C 211 ? 0.4293 0.2345 0.5847 0.0470 -0.0620 -0.0136 206 VAL H C 4869 O O . VAL C 211 ? 0.4090 0.2034 0.5725 0.0134 -0.0601 -0.0096 206 VAL H O 4870 C CB . VAL C 211 ? 0.3762 0.2830 0.5552 0.0596 -0.0552 -0.0295 206 VAL H CB 4871 C CG1 . VAL C 211 ? 0.3524 0.3130 0.5443 0.0596 -0.0530 -0.0102 206 VAL H CG1 4872 C CG2 . VAL C 211 ? 0.3835 0.3270 0.5589 0.0859 -0.0548 -0.0451 206 VAL H CG2 4873 N N . ASP C 212 ? 0.4484 0.2601 0.5963 0.0707 -0.0638 -0.0012 207 ASP H N 4874 C CA . ASP C 212 ? 0.4390 0.2546 0.5924 0.0549 -0.0630 0.0189 207 ASP H CA 4875 C C . ASP C 212 ? 0.3973 0.2973 0.5723 0.0558 -0.0595 0.0280 207 ASP H C 4876 O O . ASP C 212 ? 0.4021 0.3503 0.5770 0.0855 -0.0601 0.0278 207 ASP H O 4877 C CB . ASP C 212 ? 0.5039 0.2634 0.6271 0.0800 -0.0692 0.0294 207 ASP H CB 4878 C CG . ASP C 212 ? 0.5757 0.2350 0.6663 0.0711 -0.0758 0.0224 207 ASP H CG 4879 O OD1 . ASP C 212 ? 0.5603 0.2036 0.6587 0.0286 -0.0745 0.0219 207 ASP H OD1 4880 O OD2 . ASP C 212 ? 0.6576 0.2538 0.7099 0.1067 -0.0834 0.0169 207 ASP H OD2 4881 N N . LYS C 213 ? 0.3635 0.2842 0.5526 0.0234 -0.0568 0.0353 208 LYS H N 4882 C CA . LYS C 213 ? 0.3394 0.3270 0.5410 0.0131 -0.0563 0.0427 208 LYS H CA 4883 C C . LYS C 213 ? 0.3345 0.3263 0.5334 0.0019 -0.0584 0.0554 208 LYS H C 4884 O O . LYS C 213 ? 0.3204 0.2844 0.5168 -0.0193 -0.0575 0.0556 208 LYS H O 4885 C CB . LYS C 213 ? 0.3190 0.3203 0.5283 -0.0144 -0.0538 0.0369 208 LYS H CB 4886 C CG . LYS C 213 ? 0.3208 0.3894 0.5363 -0.0261 -0.0552 0.0436 208 LYS H CG 4887 C CD . LYS C 213 ? 0.3326 0.4495 0.5543 -0.0034 -0.0534 0.0407 208 LYS H CD 4888 C CE . LYS C 213 ? 0.3395 0.5491 0.5686 -0.0088 -0.0555 0.0528 208 LYS H CE 4889 N NZ . LYS C 213 ? 0.3563 0.6261 0.5903 0.0202 -0.0529 0.0495 208 LYS H NZ 4890 N N . LYS C 214 ? 0.3444 0.3821 0.5426 0.0203 -0.0613 0.0657 209 LYS H N 4891 C CA . LYS C 214 ? 0.3510 0.4042 0.5457 0.0131 -0.0639 0.0778 209 LYS H CA 4892 C C . LYS C 214 ? 0.3229 0.4166 0.5233 -0.0230 -0.0660 0.0752 209 LYS H C 4893 O O . LYS C 214 ? 0.3147 0.4585 0.5217 -0.0344 -0.0676 0.0737 209 LYS H O 4894 C CB . LYS C 214 ? 0.3847 0.4795 0.5734 0.0499 -0.0670 0.0902 209 LYS H CB 4895 C CG . LYS C 214 ? 0.3963 0.5233 0.5819 0.0435 -0.0702 0.1038 209 LYS H CG 4896 C CD . LYS C 214 ? 0.4460 0.5387 0.6118 0.0790 -0.0718 0.1200 209 LYS H CD 4897 C CE . LYS C 214 ? 0.4718 0.6362 0.6330 0.1205 -0.0752 0.1304 209 LYS H CE 4898 N NZ . LYS C 214 ? 0.4832 0.6705 0.6465 0.1487 -0.0744 0.1198 209 LYS H NZ 4899 N N . ILE C 215 ? 0.3228 0.3928 0.5154 -0.0423 -0.0671 0.0749 210 ILE H N 4900 C CA . ILE C 215 ? 0.3204 0.4046 0.5051 -0.0749 -0.0716 0.0683 210 ILE H CA 4901 C C . ILE C 215 ? 0.3321 0.4790 0.5151 -0.0796 -0.0779 0.0766 210 ILE H C 4902 O O . ILE C 215 ? 0.3437 0.4936 0.5217 -0.0695 -0.0787 0.0833 210 ILE H O 4903 C CB . ILE C 215 ? 0.3244 0.3565 0.4943 -0.0860 -0.0706 0.0593 210 ILE H CB 4904 C CG1 . ILE C 215 ? 0.3168 0.3039 0.4910 -0.0770 -0.0641 0.0538 210 ILE H CG1 4905 C CG2 . ILE C 215 ? 0.3409 0.3629 0.4892 -0.1145 -0.0774 0.0481 210 ILE H CG2 4906 C CD1 . ILE C 215 ? 0.3079 0.2924 0.4879 -0.0800 -0.0627 0.0480 210 ILE H CD1 4907 N N . VAL C 216 ? 0.3341 0.5397 0.5211 -0.0976 -0.0826 0.0777 211 VAL H N 4908 C CA . VAL C 216 ? 0.3433 0.6326 0.5321 -0.1049 -0.0893 0.0859 211 VAL H CA 4909 C C . VAL C 216 ? 0.3653 0.6628 0.5358 -0.1590 -0.0994 0.0773 211 VAL H C 4910 O O . VAL C 216 ? 0.3757 0.6351 0.5361 -0.1864 -0.1008 0.0707 211 VAL H O 4911 C CB . VAL C 216 ? 0.3348 0.6993 0.5416 -0.0800 -0.0869 0.0957 211 VAL H CB 4912 C CG1 . VAL C 216 ? 0.3413 0.8104 0.5526 -0.1131 -0.0942 0.1011 211 VAL H CG1 4913 C CG2 . VAL C 216 ? 0.3440 0.7191 0.5532 -0.0248 -0.0836 0.1068 211 VAL H CG2 4914 N N . PRO C 217 ? 0.3857 0.7255 0.5458 -0.1754 -0.1079 0.0772 212 PRO H N 4915 C CA . PRO C 217 ? 0.4261 0.7577 0.5579 -0.2315 -0.1207 0.0657 212 PRO H CA 4916 C C . PRO C 217 ? 0.4448 0.8187 0.5761 -0.2758 -0.1264 0.0710 212 PRO H C 4917 O O . PRO C 217 ? 0.4148 0.8663 0.5743 -0.2594 -0.1206 0.0850 212 PRO H O 4918 C CB . PRO C 217 ? 0.4345 0.8339 0.5612 -0.2363 -0.1289 0.0668 212 PRO H CB 4919 C CG . PRO C 217 ? 0.4079 0.8105 0.5518 -0.1797 -0.1188 0.0773 212 PRO H CG 4920 C CD . PRO C 217 ? 0.3802 0.7684 0.5472 -0.1438 -0.1074 0.0874 212 PRO H CD 4921 N N . ARG C 218 ? 0.5070 0.8223 0.6000 -0.3297 -0.1382 0.0599 213 ARG H N 4922 C CA . ARG C 218 ? 0.5515 0.8958 0.6279 -0.3945 -0.1490 0.0666 213 ARG H CA 4923 C C . ARG C 218 ? 0.5764 0.8225 0.6314 -0.4088 -0.1469 0.0660 213 ARG H C 4924 O O . ARG C 218 ? 0.5919 0.7243 0.6234 -0.3863 -0.1442 0.0522 213 ARG H O 4925 C CB . ARG C 218 ? 0.5239 1.0255 0.6371 -0.4023 -0.1476 0.0872 213 ARG H CB 4926 C CG . ARG C 218 ? 0.4998 1.0371 0.6387 -0.3872 -0.1368 0.1019 213 ARG H CG 4927 C CD . ARG C 218 ? 0.4831 1.1900 0.6510 -0.3976 -0.1371 0.1214 213 ARG H CD 4928 N NE . ARG C 218 ? 0.5237 1.3142 0.6778 -0.4594 -0.1528 0.1250 213 ARG H NE 4929 C CZ . ARG C 218 ? 0.5867 1.3715 0.7090 -0.5455 -0.1672 0.1292 213 ARG H CZ 4930 N NH1 . ARG C 218 ? 0.6204 1.4884 0.7298 -0.6027 -0.1828 0.1307 213 ARG H NH1 4931 N NH2 . ARG C 218 ? 0.6241 1.3183 0.7229 -0.5777 -0.1675 0.1331 213 ARG H NH2 4932 N N . ASP D 1 ? 0.6305 0.8465 0.6271 0.0737 0.0393 0.2431 1 ASP C N 4933 C CA . ASP D 1 ? 0.5780 0.8199 0.5740 0.0391 0.0277 0.2223 1 ASP C CA 4934 C C . ASP D 1 ? 0.5561 0.8557 0.5392 0.0426 0.0100 0.2288 1 ASP C C 4935 O O . ASP D 1 ? 0.5833 0.8937 0.5511 0.0655 0.0090 0.2534 1 ASP C O 4936 C CB . ASP D 1 ? 0.5850 0.7813 0.5736 0.0150 0.0404 0.2230 1 ASP C CB 4937 C CG . ASP D 1 ? 0.6113 0.7482 0.6116 0.0066 0.0603 0.2143 1 ASP C CG 4938 O OD1 . ASP D 1 ? 0.6333 0.7541 0.6443 0.0236 0.0672 0.2120 1 ASP C OD1 4939 O OD2 . ASP D 1 ? 0.6148 0.7225 0.6141 -0.0176 0.0700 0.2084 1 ASP C OD2 4940 N N . ILE D 2 ? 0.5106 0.8438 0.4974 0.0186 -0.0022 0.2068 2 ILE C N 4941 C CA . ILE D 2 ? 0.4920 0.8758 0.4668 0.0149 -0.0170 0.2066 2 ILE C CA 4942 C C . ILE D 2 ? 0.4959 0.8619 0.4525 0.0021 -0.0128 0.2159 2 ILE C C 4943 O O . ILE D 2 ? 0.4853 0.8258 0.4442 -0.0218 -0.0076 0.2040 2 ILE C O 4944 C CB . ILE D 2 ? 0.4475 0.8675 0.4326 -0.0067 -0.0286 0.1788 2 ILE C CB 4945 C CG1 . ILE D 2 ? 0.4456 0.8951 0.4480 0.0070 -0.0329 0.1707 2 ILE C CG1 4946 C CG2 . ILE D 2 ? 0.4300 0.8939 0.4023 -0.0163 -0.0407 0.1740 2 ILE C CG2 4947 C CD1 . ILE D 2 ? 0.4496 0.8613 0.4676 0.0040 -0.0221 0.1607 2 ILE C CD1 4948 N N . LEU D 3 ? 0.5177 0.9024 0.4559 0.0197 -0.0152 0.2372 3 LEU C N 4949 C CA . LEU D 3 ? 0.5255 0.9008 0.4441 0.0099 -0.0109 0.2471 3 LEU C CA 4950 C C . LEU D 3 ? 0.4885 0.9087 0.4025 -0.0085 -0.0246 0.2275 3 LEU C C 4951 O O . LEU D 3 ? 0.4820 0.9530 0.3960 -0.0023 -0.0382 0.2201 3 LEU C O 4952 C CB . LEU D 3 ? 0.5727 0.9509 0.4693 0.0381 -0.0071 0.2796 3 LEU C CB 4953 C CG . LEU D 3 ? 0.5941 0.9670 0.4656 0.0331 -0.0010 0.2952 3 LEU C CG 4954 C CD1 . LEU D 3 ? 0.5931 0.9123 0.4694 0.0089 0.0159 0.2910 3 LEU C CD1 4955 C CD2 . LEU D 3 ? 0.6492 1.0222 0.4966 0.0656 0.0039 0.3313 3 LEU C CD2 4956 N N . MET D 4 ? 0.4716 0.8731 0.3833 -0.0316 -0.0199 0.2175 4 MET C N 4957 C CA . MET D 4 ? 0.4458 0.8790 0.3506 -0.0485 -0.0289 0.2003 4 MET C CA 4958 C C . MET D 4 ? 0.4659 0.9014 0.3483 -0.0475 -0.0239 0.2145 4 MET C C 4959 O O . MET D 4 ? 0.4707 0.8712 0.3514 -0.0553 -0.0113 0.2215 4 MET C O 4960 C CB . MET D 4 ? 0.4167 0.8278 0.3350 -0.0724 -0.0265 0.1789 4 MET C CB 4961 C CG . MET D 4 ? 0.4023 0.8065 0.3401 -0.0751 -0.0289 0.1657 4 MET C CG 4962 S SD . MET D 4 ? 0.3893 0.8458 0.3303 -0.0754 -0.0434 0.1493 4 MET C SD 4963 C CE . MET D 4 ? 0.3640 0.8192 0.3011 -0.1020 -0.0451 0.1270 4 MET C CE 4964 N N . ASN D 5 ? 0.4750 0.9558 0.3405 -0.0386 -0.0333 0.2176 5 ASN C N 4965 C CA . ASN D 5 ? 0.4990 0.9903 0.3394 -0.0365 -0.0293 0.2304 5 ASN C CA 4966 C C . ASN D 5 ? 0.4716 0.9846 0.3065 -0.0574 -0.0335 0.2067 5 ASN C C 4967 O O . ASN D 5 ? 0.4603 1.0133 0.2951 -0.0625 -0.0453 0.1879 5 ASN C O 4968 C CB . ASN D 5 ? 0.5363 1.0673 0.3576 -0.0105 -0.0367 0.2505 5 ASN C CB 4969 C CG . ASN D 5 ? 0.5667 1.0778 0.3957 0.0141 -0.0334 0.2720 5 ASN C CG 4970 O OD1 . ASN D 5 ? 0.6028 1.0665 0.4264 0.0223 -0.0180 0.2948 5 ASN C OD1 4971 N ND2 . ASN D 5 ? 0.5602 1.1044 0.4041 0.0245 -0.0458 0.2628 5 ASN C ND2 4972 N N . GLN D 6 ? 0.4669 0.9533 0.2983 -0.0698 -0.0222 0.2066 6 GLN C N 4973 C CA . GLN D 6 ? 0.4507 0.9496 0.2783 -0.0875 -0.0231 0.1848 6 GLN C CA 4974 C C . GLN D 6 ? 0.4772 1.0002 0.2774 -0.0828 -0.0196 0.1946 6 GLN C C 4975 O O . GLN D 6 ? 0.5082 1.0172 0.2961 -0.0726 -0.0098 0.2197 6 GLN C O 4976 C CB . GLN D 6 ? 0.4356 0.8953 0.2798 -0.1021 -0.0130 0.1771 6 GLN C CB 4977 C CG . GLN D 6 ? 0.4060 0.8661 0.2621 -0.1172 -0.0181 0.1500 6 GLN C CG 4978 C CD . GLN D 6 ? 0.3922 0.8192 0.2657 -0.1269 -0.0102 0.1452 6 GLN C CD 4979 O OE1 . GLN D 6 ? 0.3838 0.7875 0.2725 -0.1260 -0.0078 0.1511 6 GLN C OE1 4980 N NE2 . GLN D 6 ? 0.3909 0.8184 0.2626 -0.1355 -0.0058 0.1336 6 GLN C NE2 4981 N N . THR D 7 ? 0.4726 1.0312 0.2615 -0.0908 -0.0264 0.1747 7 THR C N 4982 C CA . THR D 7 ? 0.4991 1.0835 0.2606 -0.0890 -0.0226 0.1791 7 THR C CA 4983 C C . THR D 7 ? 0.4844 1.0803 0.2441 -0.1073 -0.0222 0.1481 7 THR C C 4984 O O . THR D 7 ? 0.4592 1.0596 0.2317 -0.1179 -0.0295 0.1242 7 THR C O 4985 C CB . THR D 7 ? 0.5275 1.1620 0.2664 -0.0721 -0.0334 0.1904 7 THR C CB 4986 O OG1 . THR D 7 ? 0.5098 1.1801 0.2578 -0.0776 -0.0481 0.1665 7 THR C OG1 4987 C CG2 . THR D 7 ? 0.5535 1.1738 0.2889 -0.0485 -0.0312 0.2258 7 THR C CG2 4988 N N . PRO D 8 ? 0.4982 1.0964 0.2417 -0.1111 -0.0117 0.1484 8 PRO C N 4989 C CA . PRO D 8 ? 0.5237 1.1131 0.2516 -0.1020 0.0003 0.1765 8 PRO C CA 4990 C C . PRO D 8 ? 0.5120 1.0527 0.2619 -0.1062 0.0129 0.1874 8 PRO C C 4991 O O . PRO D 8 ? 0.4787 0.9969 0.2543 -0.1151 0.0108 0.1722 8 PRO C O 4992 C CB . PRO D 8 ? 0.5385 1.1514 0.2454 -0.1095 0.0073 0.1633 8 PRO C CB 4993 C CG . PRO D 8 ? 0.5134 1.1195 0.2370 -0.1250 0.0054 0.1292 8 PRO C CG 4994 C CD . PRO D 8 ? 0.4934 1.1025 0.2319 -0.1257 -0.0090 0.1191 8 PRO C CD 4995 N N . LEU D 9 ? 0.5394 1.0658 0.2781 -0.1007 0.0265 0.2133 9 LEU C N 4996 C CA . LEU D 9 ? 0.5393 1.0238 0.2982 -0.1080 0.0409 0.2222 9 LEU C CA 4997 C C . LEU D 9 ? 0.5180 1.0025 0.2885 -0.1236 0.0495 0.2016 9 LEU C C 4998 O O . LEU D 9 ? 0.4875 0.9495 0.2853 -0.1329 0.0526 0.1917 9 LEU C O 4999 C CB . LEU D 9 ? 0.5878 1.0557 0.3288 -0.0994 0.0560 0.2561 9 LEU C CB 5000 C CG . LEU D 9 ? 0.6023 1.0216 0.3636 -0.1049 0.0708 0.2701 9 LEU C CG 5001 C CD1 . LEU D 9 ? 0.6543 1.0502 0.3946 -0.0903 0.0831 0.3068 9 LEU C CD1 5002 C CD2 . LEU D 9 ? 0.5963 1.0057 0.3733 -0.1245 0.0865 0.2592 9 LEU C CD2 5003 N N . SER D 10 ? 0.5290 1.0422 0.2782 -0.1249 0.0533 0.1948 10 SER C N 5004 C CA . SER D 10 ? 0.5137 1.0331 0.2723 -0.1360 0.0601 0.1717 10 SER C CA 5005 C C . SER D 10 ? 0.5141 1.0657 0.2537 -0.1357 0.0527 0.1504 10 SER C C 5006 O O . SER D 10 ? 0.5423 1.1208 0.2545 -0.1287 0.0477 0.1581 10 SER C O 5007 C CB . SER D 10 ? 0.5353 1.0532 0.2894 -0.1411 0.0802 0.1838 10 SER C CB 5008 O OG . SER D 10 ? 0.5712 1.1052 0.2913 -0.1334 0.0857 0.2055 10 SER C OG 5009 N N . LEU D 11 ? 0.4911 1.0398 0.2450 -0.1429 0.0525 0.1234 11 LEU C N 5010 C CA . LEU D 11 ? 0.4943 1.0654 0.2332 -0.1457 0.0480 0.0978 11 LEU C CA 5011 C C . LEU D 11 ? 0.4976 1.0700 0.2399 -0.1501 0.0614 0.0791 11 LEU C C 5012 O O . LEU D 11 ? 0.4845 1.0364 0.2491 -0.1520 0.0626 0.0635 11 LEU C O 5013 C CB . LEU D 11 ? 0.4726 1.0326 0.2247 -0.1488 0.0345 0.0803 11 LEU C CB 5014 C CG . LEU D 11 ? 0.4816 1.0583 0.2206 -0.1556 0.0314 0.0501 11 LEU C CG 5015 C CD1 . LEU D 11 ? 0.5108 1.1311 0.2181 -0.1547 0.0285 0.0495 11 LEU C CD1 5016 C CD2 . LEU D 11 ? 0.4634 1.0256 0.2165 -0.1606 0.0201 0.0376 11 LEU C CD2 5017 N N . PRO D 12 ? 0.5194 1.1167 0.2391 -0.1497 0.0724 0.0818 12 PRO C N 5018 C CA . PRO D 12 ? 0.5255 1.1294 0.2466 -0.1525 0.0860 0.0616 12 PRO C CA 5019 C C . PRO D 12 ? 0.5227 1.1270 0.2396 -0.1555 0.0816 0.0285 12 PRO C C 5020 O O . PRO D 12 ? 0.5359 1.1591 0.2315 -0.1584 0.0729 0.0199 12 PRO C O 5021 C CB . PRO D 12 ? 0.5596 1.1948 0.2503 -0.1518 0.0975 0.0734 12 PRO C CB 5022 C CG . PRO D 12 ? 0.5686 1.2025 0.2486 -0.1473 0.0930 0.1072 12 PRO C CG 5023 C CD . PRO D 12 ? 0.5469 1.1660 0.2385 -0.1449 0.0742 0.1069 12 PRO C CD 5024 N N . VAL D 13 ? 0.5090 1.0925 0.2464 -0.1546 0.0879 0.0100 13 VAL C N 5025 C CA . VAL D 13 ? 0.5196 1.0954 0.2511 -0.1575 0.0890 -0.0218 13 VAL C CA 5026 C C . VAL D 13 ? 0.5310 1.1009 0.2711 -0.1522 0.1053 -0.0394 13 VAL C C 5027 O O . VAL D 13 ? 0.5180 1.0843 0.2797 -0.1455 0.1120 -0.0283 13 VAL C O 5028 C CB . VAL D 13 ? 0.5008 1.0435 0.2490 -0.1593 0.0781 -0.0289 13 VAL C CB 5029 C CG1 . VAL D 13 ? 0.4938 1.0476 0.2319 -0.1653 0.0626 -0.0206 13 VAL C CG1 5030 C CG2 . VAL D 13 ? 0.4746 0.9915 0.2534 -0.1519 0.0775 -0.0145 13 VAL C CG2 5031 N N . SER D 14 ? 0.5572 1.1287 0.2811 -0.1553 0.1124 -0.0686 14 SER C N 5032 C CA . SER D 14 ? 0.5711 1.1284 0.3044 -0.1474 0.1281 -0.0896 14 SER C CA 5033 C C . SER D 14 ? 0.5631 1.0751 0.3145 -0.1432 0.1244 -0.0992 14 SER C C 5034 O O . SER D 14 ? 0.5533 1.0501 0.3019 -0.1515 0.1122 -0.0986 14 SER C O 5035 C CB . SER D 14 ? 0.6093 1.1846 0.3150 -0.1529 0.1397 -0.1185 14 SER C CB 5036 O OG . SER D 14 ? 0.6188 1.2384 0.3024 -0.1569 0.1418 -0.1071 14 SER C OG 5037 N N . LEU D 15 ? 0.5685 1.0607 0.3381 -0.1292 0.1355 -0.1068 15 LEU C N 5038 C CA . LEU D 15 ? 0.5725 1.0180 0.3543 -0.1219 0.1352 -0.1157 15 LEU C CA 5039 C C . LEU D 15 ? 0.6099 1.0324 0.3694 -0.1329 0.1412 -0.1451 15 LEU C C 5040 O O . LEU D 15 ? 0.6410 1.0800 0.3815 -0.1382 0.1524 -0.1667 15 LEU C O 5041 C CB . LEU D 15 ? 0.5781 1.0130 0.3814 -0.1003 0.1471 -0.1178 15 LEU C CB 5042 C CG . LEU D 15 ? 0.5454 1.0078 0.3750 -0.0914 0.1427 -0.0935 15 LEU C CG 5043 C CD1 . LEU D 15 ? 0.5558 1.0165 0.4076 -0.0683 0.1540 -0.0991 15 LEU C CD1 5044 C CD2 . LEU D 15 ? 0.5116 0.9628 0.3539 -0.0956 0.1251 -0.0714 15 LEU C CD2 5045 N N . GLY D 16 ? 0.6114 0.9971 0.3727 -0.1385 0.1347 -0.1471 16 GLY C N 5046 C CA . GLY D 16 ? 0.6464 1.0095 0.3884 -0.1545 0.1405 -0.1756 16 GLY C CA 5047 C C . GLY D 16 ? 0.6365 1.0288 0.3647 -0.1763 0.1259 -0.1759 16 GLY C C 5048 O O . GLY D 16 ? 0.6535 1.0269 0.3723 -0.1926 0.1269 -0.1958 16 GLY C O 5049 N N . ASP D 17 ? 0.6120 1.0504 0.3390 -0.1764 0.1135 -0.1539 17 ASP C N 5050 C CA . ASP D 17 ? 0.6060 1.0799 0.3191 -0.1920 0.0990 -0.1515 17 ASP C CA 5051 C C . ASP D 17 ? 0.5872 1.0397 0.3132 -0.1981 0.0866 -0.1421 17 ASP C C 5052 O O . ASP D 17 ? 0.5702 0.9879 0.3154 -0.1883 0.0860 -0.1280 17 ASP C O 5053 C CB . ASP D 17 ? 0.5854 1.1065 0.2933 -0.1863 0.0906 -0.1247 17 ASP C CB 5054 C CG . ASP D 17 ? 0.6135 1.1721 0.2975 -0.1876 0.1004 -0.1373 17 ASP C CG 5055 O OD1 . ASP D 17 ? 0.6463 1.2077 0.3133 -0.1981 0.1086 -0.1701 17 ASP C OD1 5056 O OD2 . ASP D 17 ? 0.6054 1.1910 0.2860 -0.1798 0.1009 -0.1149 17 ASP C OD2 5057 N N . GLN D 18 ? 0.5940 1.0724 0.3088 -0.2142 0.0768 -0.1514 18 GLN C N 5058 C CA . GLN D 18 ? 0.5713 1.0478 0.2978 -0.2192 0.0626 -0.1379 18 GLN C CA 5059 C C . GLN D 18 ? 0.5416 1.0477 0.2739 -0.2070 0.0496 -0.1037 18 GLN C C 5060 O O . GLN D 18 ? 0.5479 1.0849 0.2685 -0.2006 0.0508 -0.0950 18 GLN C O 5061 C CB . GLN D 18 ? 0.5894 1.0951 0.3032 -0.2401 0.0568 -0.1614 18 GLN C CB 5062 C CG . GLN D 18 ? 0.6332 1.1153 0.3363 -0.2568 0.0729 -0.2008 18 GLN C CG 5063 C CD . GLN D 18 ? 0.6471 1.1416 0.3480 -0.2820 0.0689 -0.2250 18 GLN C CD 5064 O OE1 . GLN D 18 ? 0.6698 1.2032 0.3543 -0.2987 0.0695 -0.2528 18 GLN C OE1 5065 N NE2 . GLN D 18 ? 0.6334 1.1003 0.3510 -0.2857 0.0647 -0.2151 18 GLN C NE2 5066 N N . ALA D 19 ? 0.5176 1.0123 0.2666 -0.2043 0.0390 -0.0845 19 ALA C N 5067 C CA . ALA D 19 ? 0.4970 1.0147 0.2512 -0.1940 0.0280 -0.0536 19 ALA C CA 5068 C C . ALA D 19 ? 0.4873 1.0111 0.2506 -0.1984 0.0145 -0.0466 19 ALA C C 5069 O O . ALA D 19 ? 0.4831 0.9786 0.2575 -0.2059 0.0149 -0.0566 19 ALA C O 5070 C CB . ALA D 19 ? 0.4790 0.9710 0.2502 -0.1807 0.0328 -0.0331 19 ALA C CB 5071 N N . SER D 20 ? 0.4876 1.0482 0.2454 -0.1924 0.0038 -0.0285 20 SER C N 5072 C CA . SER D 20 ? 0.4790 1.0538 0.2458 -0.1936 -0.0090 -0.0216 20 SER C CA 5073 C C . SER D 20 ? 0.4691 1.0491 0.2421 -0.1773 -0.0154 0.0118 20 SER C C 5074 O O . SER D 20 ? 0.4871 1.0907 0.2455 -0.1677 -0.0153 0.0276 20 SER C O 5075 C CB . SER D 20 ? 0.4955 1.1202 0.2474 -0.2034 -0.0165 -0.0401 20 SER C CB 5076 O OG . SER D 20 ? 0.4845 1.1143 0.2508 -0.2107 -0.0249 -0.0456 20 SER C OG 5077 N N . ILE D 21 ? 0.4549 1.0098 0.2480 -0.1746 -0.0190 0.0225 21 ILE C N 5078 C CA . ILE D 21 ? 0.4507 1.0014 0.2519 -0.1607 -0.0225 0.0515 21 ILE C CA 5079 C C . ILE D 21 ? 0.4453 1.0142 0.2545 -0.1587 -0.0340 0.0539 21 ILE C C 5080 O O . ILE D 21 ? 0.4346 0.9966 0.2544 -0.1696 -0.0364 0.0370 21 ILE C O 5081 C CB . ILE D 21 ? 0.4389 0.9459 0.2587 -0.1590 -0.0158 0.0599 21 ILE C CB 5082 C CG1 . ILE D 21 ? 0.4474 0.9439 0.2623 -0.1592 -0.0042 0.0573 21 ILE C CG1 5083 C CG2 . ILE D 21 ? 0.4359 0.9346 0.2658 -0.1480 -0.0179 0.0858 21 ILE C CG2 5084 C CD1 . ILE D 21 ? 0.4317 0.8950 0.2661 -0.1579 0.0015 0.0612 21 ILE C CD1 5085 N N . SER D 22 ? 0.4573 1.0492 0.2612 -0.1440 -0.0398 0.0756 22 SER C N 5086 C CA . SER D 22 ? 0.4568 1.0728 0.2691 -0.1376 -0.0508 0.0795 22 SER C CA 5087 C C . SER D 22 ? 0.4513 1.0361 0.2798 -0.1251 -0.0494 0.1025 22 SER C C 5088 O O . SER D 22 ? 0.4521 1.0081 0.2797 -0.1190 -0.0409 0.1200 22 SER C O 5089 C CB . SER D 22 ? 0.4776 1.1498 0.2706 -0.1270 -0.0595 0.0852 22 SER C CB 5090 O OG . SER D 22 ? 0.4828 1.1727 0.2836 -0.1098 -0.0679 0.1030 22 SER C OG 5091 N N . CYS D 23 ? 0.4467 1.0376 0.2910 -0.1237 -0.0561 0.0992 23 CYS C N 5092 C CA . CYS D 23 ? 0.4469 1.0139 0.3059 -0.1111 -0.0551 0.1178 23 CYS C CA 5093 C C . CYS D 23 ? 0.4452 1.0497 0.3113 -0.0994 -0.0655 0.1199 23 CYS C C 5094 O O . CYS D 23 ? 0.4268 1.0553 0.3017 -0.1109 -0.0714 0.0990 23 CYS C O 5095 C CB . CYS D 23 ? 0.4313 0.9566 0.3079 -0.1235 -0.0498 0.1079 23 CYS C CB 5096 S SG . CYS D 23 ? 0.4420 0.9382 0.3380 -0.1122 -0.0476 0.1232 23 CYS C SG 5097 N N . ARG D 24 ? 0.4664 1.0750 0.3289 -0.0762 -0.0661 0.1455 24 ARG C N 5098 C CA . ARG D 24 ? 0.4744 1.1198 0.3445 -0.0583 -0.0754 0.1518 24 ARG C CA 5099 C C . ARG D 24 ? 0.4663 1.0757 0.3526 -0.0432 -0.0699 0.1683 24 ARG C C 5100 O O . ARG D 24 ? 0.4835 1.0548 0.3634 -0.0315 -0.0602 0.1910 24 ARG C O 5101 C CB . ARG D 24 ? 0.5172 1.2033 0.3655 -0.0367 -0.0811 0.1711 24 ARG C CB 5102 C CG . ARG D 24 ? 0.5319 1.2813 0.3673 -0.0450 -0.0920 0.1523 24 ARG C CG 5103 C CD . ARG D 24 ? 0.5745 1.3775 0.3989 -0.0148 -0.1024 0.1729 24 ARG C CD 5104 N NE . ARG D 24 ? 0.6207 1.3919 0.4246 0.0079 -0.0937 0.2093 24 ARG C NE 5105 C CZ . ARG D 24 ? 0.6640 1.4701 0.4440 0.0346 -0.0984 0.2344 24 ARG C CZ 5106 N NH1 . ARG D 24 ? 0.6959 1.4585 0.4573 0.0513 -0.0857 0.2678 24 ARG C NH1 5107 N NH2 . ARG D 24 ? 0.6696 1.5542 0.4431 0.0445 -0.1147 0.2268 24 ARG C NH2 5108 N N . SER D 25 ? 0.4398 1.0630 0.3464 -0.0437 -0.0747 0.1562 25 SER C N 5109 C CA . SER D 25 ? 0.4378 1.0317 0.3605 -0.0289 -0.0692 0.1677 25 SER C CA 5110 C C . SER D 25 ? 0.4554 1.0853 0.3785 0.0028 -0.0753 0.1858 25 SER C C 5111 O O . SER D 25 ? 0.4533 1.1446 0.3731 0.0084 -0.0873 0.1800 25 SER C O 5112 C CB . SER D 25 ? 0.4095 0.9985 0.3533 -0.0461 -0.0695 0.1445 25 SER C CB 5113 O OG . SER D 25 ? 0.4050 1.0508 0.3545 -0.0530 -0.0798 0.1259 25 SER C OG 5114 N N . SER D 26 ? 0.4718 1.0638 0.4001 0.0236 -0.0663 0.2061 26 SER C N 5115 C CA . SER D 26 ? 0.4996 1.1162 0.4281 0.0595 -0.0696 0.2274 26 SER C CA 5116 C C . SER D 26 ? 0.4843 1.1417 0.4379 0.0656 -0.0774 0.2112 26 SER C C 5117 O O . SER D 26 ? 0.5096 1.1983 0.4675 0.0974 -0.0818 0.2257 26 SER C O 5118 C CB . SER D 26 ? 0.5336 1.0846 0.4591 0.0785 -0.0532 0.2535 26 SER C CB 5119 O OG . SER D 26 ? 0.5154 1.0190 0.4604 0.0629 -0.0432 0.2390 26 SER C OG 5120 N N . GLN D 27 ? 0.4450 1.1009 0.4148 0.0371 -0.0777 0.1830 27 GLN C N 5121 C CA . GLN D 27 ? 0.4275 1.1300 0.4204 0.0360 -0.0845 0.1633 27 GLN C CA 5122 C C . GLN D 27 ? 0.3849 1.0957 0.3847 -0.0017 -0.0861 0.1323 27 GLN C C 5123 O O . GLN D 27 ? 0.3722 1.0384 0.3632 -0.0246 -0.0797 0.1262 27 GLN C O 5124 C CB . GLN D 27 ? 0.4435 1.1176 0.4555 0.0537 -0.0757 0.1683 27 GLN C CB 5125 C CG . GLN D 27 ? 0.4545 1.0485 0.4647 0.0456 -0.0603 0.1734 27 GLN C CG 5126 C CD . GLN D 27 ? 0.4751 1.0481 0.5047 0.0617 -0.0514 0.1729 27 GLN C CD 5127 O OE1 . GLN D 27 ? 0.4612 1.0554 0.5089 0.0509 -0.0527 0.1516 27 GLN C OE1 5128 N NE2 . GLN D 27 ? 0.5160 1.0451 0.5412 0.0873 -0.0404 0.1961 27 GLN C NE2 5129 N N . TYR D 28 A 0.3630 1.1311 0.3792 -0.0068 -0.0933 0.1134 27 TYR C N 5130 C CA . TYR D 28 A 0.3345 1.1160 0.3561 -0.0422 -0.0935 0.0844 27 TYR C CA 5131 C C . TYR D 28 A 0.3222 1.0384 0.3460 -0.0609 -0.0816 0.0782 27 TYR C C 5132 O O . TYR D 28 A 0.3246 1.0159 0.3603 -0.0499 -0.0752 0.0830 27 TYR C O 5133 C CB . TYR D 28 A 0.3278 1.1800 0.3719 -0.0431 -0.0998 0.0660 27 TYR C CB 5134 C CG . TYR D 28 A 0.3124 1.1944 0.3583 -0.0799 -0.1006 0.0362 27 TYR C CG 5135 C CD1 . TYR D 28 A 0.2982 1.1393 0.3463 -0.1087 -0.0900 0.0205 27 TYR C CD1 5136 C CD2 . TYR D 28 A 0.3204 1.2706 0.3644 -0.0862 -0.1110 0.0233 27 TYR C CD2 5137 C CE1 . TYR D 28 A 0.2917 1.1506 0.3395 -0.1424 -0.0873 -0.0051 27 TYR C CE1 5138 C CE2 . TYR D 28 A 0.3133 1.2849 0.3591 -0.1231 -0.1086 -0.0064 27 TYR C CE2 5139 C CZ . TYR D 28 A 0.3001 1.2209 0.3474 -0.1509 -0.0956 -0.0194 27 TYR C CZ 5140 O OH . TYR D 28 A 0.3022 1.2321 0.3492 -0.1875 -0.0895 -0.0469 27 TYR C OH 5141 N N . ILE D 29 B 0.3106 0.9996 0.3215 -0.0875 -0.0784 0.0676 27 ILE C N 5142 C CA . ILE D 29 B 0.2965 0.9319 0.3072 -0.1053 -0.0689 0.0610 27 ILE C CA 5143 C C . ILE D 29 B 0.2856 0.9401 0.3089 -0.1246 -0.0661 0.0395 27 ILE C C 5144 O O . ILE D 29 B 0.2846 0.9522 0.3030 -0.1481 -0.0655 0.0228 27 ILE C O 5145 C CB . ILE D 29 B 0.2934 0.8932 0.2851 -0.1219 -0.0661 0.0601 27 ILE C CB 5146 C CG1 . ILE D 29 B 0.3051 0.8873 0.2847 -0.1047 -0.0667 0.0813 27 ILE C CG1 5147 C CG2 . ILE D 29 B 0.2845 0.8349 0.2753 -0.1367 -0.0578 0.0550 27 ILE C CG2 5148 C CD1 . ILE D 29 B 0.3110 0.8579 0.2966 -0.0862 -0.0608 0.0989 27 ILE C CD1 5149 N N . VAL D 30 C 0.2820 0.9355 0.3208 -0.1152 -0.0622 0.0397 27 VAL C N 5150 C CA . VAL D 30 C 0.2724 0.9503 0.3245 -0.1307 -0.0582 0.0209 27 VAL C CA 5151 C C . VAL D 30 C 0.2654 0.8949 0.3084 -0.1525 -0.0486 0.0139 27 VAL C C 5152 O O . VAL D 30 C 0.2663 0.8467 0.2983 -0.1501 -0.0458 0.0239 27 VAL C O 5153 C CB . VAL D 30 C 0.2760 0.9816 0.3498 -0.1090 -0.0575 0.0227 27 VAL C CB 5154 C CG1 . VAL D 30 C 0.2893 1.0444 0.3708 -0.0818 -0.0675 0.0332 27 VAL C CG1 5155 C CG2 . VAL D 30 C 0.2818 0.9350 0.3558 -0.0964 -0.0498 0.0329 27 VAL C CG2 5156 N N . HIS D 31 D 0.2608 0.9065 0.3082 -0.1736 -0.0430 -0.0029 27 HIS C N 5157 C CA . HIS D 31 D 0.2592 0.8612 0.2945 -0.1924 -0.0334 -0.0074 27 HIS C CA 5158 C C . HIS D 31 D 0.2572 0.8383 0.2984 -0.1808 -0.0287 -0.0027 27 HIS C C 5159 O O . HIS D 31 D 0.2516 0.8569 0.3100 -0.1621 -0.0301 -0.0009 27 HIS C O 5160 C CB . HIS D 31 D 0.2624 0.8849 0.2988 -0.2194 -0.0256 -0.0257 27 HIS C CB 5161 C CG . HIS D 31 D 0.2615 0.9223 0.3178 -0.2188 -0.0211 -0.0353 27 HIS C CG 5162 N ND1 . HIS D 31 D 0.2623 0.9008 0.3176 -0.2202 -0.0123 -0.0355 27 HIS C ND1 5163 C CD2 . HIS D 31 D 0.2586 0.9830 0.3371 -0.2149 -0.0244 -0.0455 27 HIS C CD2 5164 C CE1 . HIS D 31 D 0.2612 0.9448 0.3373 -0.2177 -0.0091 -0.0456 27 HIS C CE1 5165 N NE2 . HIS D 31 D 0.2612 0.9987 0.3529 -0.2143 -0.0164 -0.0518 27 HIS C NE2 5166 N N . ARG D 32 E 0.2616 0.7987 0.2878 -0.1908 -0.0229 -0.0011 27 ARG C N 5167 C CA . ARG D 32 E 0.2658 0.7880 0.2940 -0.1884 -0.0164 -0.0031 27 ARG C CA 5168 C C . ARG D 32 E 0.2771 0.7822 0.2889 -0.2110 -0.0082 -0.0096 27 ARG C C 5169 O O . ARG D 32 E 0.2803 0.7550 0.2739 -0.2195 -0.0083 -0.0046 27 ARG C O 5170 C CB . ARG D 32 E 0.2660 0.7509 0.2892 -0.1755 -0.0181 0.0070 27 ARG C CB 5171 C CG . ARG D 32 E 0.2667 0.7542 0.3002 -0.1541 -0.0236 0.0175 27 ARG C CG 5172 C CD . ARG D 32 E 0.2735 0.7886 0.3273 -0.1367 -0.0217 0.0150 27 ARG C CD 5173 N NE . ARG D 32 E 0.2835 0.7987 0.3440 -0.1135 -0.0258 0.0287 27 ARG C NE 5174 C CZ . ARG D 32 E 0.2934 0.8422 0.3697 -0.0929 -0.0276 0.0318 27 ARG C CZ 5175 N NH1 . ARG D 32 E 0.2890 0.8810 0.3798 -0.0937 -0.0264 0.0196 27 ARG C NH1 5176 N NH2 . ARG D 32 E 0.3117 0.8533 0.3888 -0.0705 -0.0302 0.0482 27 ARG C NH2 5177 N N . ASN D 33 ? 0.2883 0.8138 0.3063 -0.2196 0.0000 -0.0199 28 ASN C N 5178 C CA . ASN D 33 ? 0.3045 0.8160 0.3057 -0.2419 0.0108 -0.0250 28 ASN C CA 5179 C C . ASN D 33 ? 0.3110 0.8133 0.3002 -0.2602 0.0134 -0.0267 28 ASN C C 5180 O O . ASN D 33 ? 0.3287 0.7968 0.2957 -0.2739 0.0216 -0.0238 28 ASN C O 5181 C CB . ASN D 33 ? 0.3202 0.7924 0.3018 -0.2398 0.0134 -0.0178 28 ASN C CB 5182 C CG . ASN D 33 ? 0.3235 0.8052 0.3163 -0.2263 0.0140 -0.0214 28 ASN C CG 5183 O OD1 . ASN D 33 ? 0.3347 0.8439 0.3382 -0.2294 0.0213 -0.0314 28 ASN C OD1 5184 N ND2 . ASN D 33 ? 0.3223 0.7823 0.3140 -0.2122 0.0076 -0.0151 28 ASN C ND2 5185 N N . GLY D 34 ? 0.3010 0.8349 0.3040 -0.2596 0.0072 -0.0319 29 GLY C N 5186 C CA . GLY D 34 ? 0.3137 0.8463 0.3086 -0.2795 0.0110 -0.0392 29 GLY C CA 5187 C C . GLY D 34 ? 0.3133 0.8118 0.2929 -0.2743 0.0050 -0.0300 29 GLY C C 5188 O O . GLY D 34 ? 0.3312 0.8222 0.3020 -0.2901 0.0092 -0.0370 29 GLY C O 5189 N N . ASN D 35 ? 0.3016 0.7804 0.2791 -0.2533 -0.0033 -0.0162 30 ASN C N 5190 C CA . ASN D 35 ? 0.2997 0.7486 0.2642 -0.2469 -0.0083 -0.0071 30 ASN C CA 5191 C C . ASN D 35 ? 0.2874 0.7605 0.2644 -0.2294 -0.0196 -0.0020 30 ASN C C 5192 O O . ASN D 35 ? 0.2791 0.7671 0.2697 -0.2137 -0.0238 0.0028 30 ASN C O 5193 C CB . ASN D 35 ? 0.3005 0.7095 0.2522 -0.2381 -0.0079 0.0046 30 ASN C CB 5194 C CG . ASN D 35 ? 0.3201 0.6999 0.2526 -0.2516 0.0030 0.0044 30 ASN C CG 5195 O OD1 . ASN D 35 ? 0.3398 0.7037 0.2599 -0.2662 0.0111 0.0004 30 ASN C OD1 5196 N ND2 . ASN D 35 ? 0.3238 0.6932 0.2513 -0.2459 0.0041 0.0093 30 ASN C ND2 5197 N N . THR D 36 ? 0.2946 0.7700 0.2657 -0.2312 -0.0232 -0.0026 31 THR C N 5198 C CA . THR D 36 ? 0.2874 0.7821 0.2653 -0.2130 -0.0331 0.0059 31 THR C CA 5199 C C . THR D 36 ? 0.2820 0.7383 0.2479 -0.2048 -0.0343 0.0181 31 THR C C 5200 O O . THR D 36 ? 0.2885 0.7261 0.2411 -0.2126 -0.0319 0.0160 31 THR C O 5201 C CB . THR D 36 ? 0.2969 0.8360 0.2786 -0.2166 -0.0384 -0.0028 31 THR C CB 5202 O OG1 . THR D 36 ? 0.3046 0.8326 0.2737 -0.2129 -0.0418 0.0023 31 THR C OG1 5203 C CG2 . THR D 36 ? 0.3095 0.8677 0.2922 -0.2410 -0.0318 -0.0224 31 THR C CG2 5204 N N . TYR D 37 ? 0.2723 0.7174 0.2444 -0.1896 -0.0365 0.0294 32 TYR C N 5205 C CA . TYR D 37 ? 0.2710 0.6839 0.2360 -0.1838 -0.0364 0.0390 32 TYR C CA 5206 C C . TYR D 37 ? 0.2778 0.6968 0.2412 -0.1737 -0.0404 0.0481 32 TYR C C 5207 O O . TYR D 37 ? 0.2793 0.7016 0.2503 -0.1597 -0.0421 0.0585 32 TYR C O 5208 C CB . TYR D 37 ? 0.2642 0.6626 0.2369 -0.1763 -0.0349 0.0434 32 TYR C CB 5209 C CG . TYR D 37 ? 0.2640 0.6541 0.2335 -0.1858 -0.0305 0.0359 32 TYR C CG 5210 C CD1 . TYR D 37 ? 0.2720 0.6409 0.2262 -0.1956 -0.0273 0.0342 32 TYR C CD1 5211 C CD2 . TYR D 37 ? 0.2629 0.6655 0.2432 -0.1832 -0.0283 0.0314 32 TYR C CD2 5212 C CE1 . TYR D 37 ? 0.2803 0.6404 0.2273 -0.2030 -0.0223 0.0303 32 TYR C CE1 5213 C CE2 . TYR D 37 ? 0.2688 0.6652 0.2435 -0.1922 -0.0231 0.0248 32 TYR C CE2 5214 C CZ . TYR D 37 ? 0.2779 0.6531 0.2347 -0.2024 -0.0203 0.0253 32 TYR C CZ 5215 O OH . TYR D 37 ? 0.2864 0.6559 0.2342 -0.2100 -0.0143 0.0213 32 TYR C OH 5216 N N . LEU D 38 ? 0.2870 0.7049 0.2388 -0.1810 -0.0402 0.0442 33 LEU C N 5217 C CA . LEU D 38 ? 0.2904 0.7133 0.2365 -0.1737 -0.0424 0.0517 33 LEU C CA 5218 C C . LEU D 38 ? 0.2940 0.6894 0.2291 -0.1799 -0.0381 0.0494 33 LEU C C 5219 O O . LEU D 38 ? 0.2981 0.6843 0.2246 -0.1914 -0.0343 0.0386 33 LEU C O 5220 C CB . LEU D 38 ? 0.2976 0.7588 0.2408 -0.1750 -0.0468 0.0458 33 LEU C CB 5221 C CG . LEU D 38 ? 0.3081 0.7885 0.2441 -0.1641 -0.0507 0.0552 33 LEU C CG 5222 C CD1 . LEU D 38 ? 0.3157 0.7806 0.2375 -0.1700 -0.0469 0.0525 33 LEU C CD1 5223 C CD2 . LEU D 38 ? 0.3109 0.7856 0.2529 -0.1452 -0.0513 0.0749 33 LEU C CD2 5224 N N . GLU D 39 ? 0.2899 0.6709 0.2262 -0.1719 -0.0372 0.0597 34 GLU C N 5225 C CA . GLU D 39 ? 0.2927 0.6521 0.2231 -0.1736 -0.0335 0.0590 34 GLU C CA 5226 C C . GLU D 39 ? 0.2885 0.6529 0.2149 -0.1684 -0.0320 0.0649 34 GLU C C 5227 O O . GLU D 39 ? 0.2853 0.6612 0.2148 -0.1617 -0.0331 0.0747 34 GLU C O 5228 C CB . GLU D 39 ? 0.2890 0.6318 0.2274 -0.1710 -0.0329 0.0629 34 GLU C CB 5229 C CG . GLU D 39 ? 0.2930 0.6291 0.2307 -0.1765 -0.0329 0.0569 34 GLU C CG 5230 C CD . GLU D 39 ? 0.2990 0.6274 0.2443 -0.1741 -0.0335 0.0589 34 GLU C CD 5231 O OE1 . GLU D 39 ? 0.2992 0.6266 0.2534 -0.1699 -0.0336 0.0633 34 GLU C OE1 5232 O OE2 . GLU D 39 ? 0.3089 0.6329 0.2503 -0.1785 -0.0328 0.0545 34 GLU C OE2 5233 N N . TRP D 40 ? 0.2915 0.6457 0.2100 -0.1705 -0.0282 0.0598 35 TRP C N 5234 C CA . TRP D 40 ? 0.2946 0.6534 0.2099 -0.1661 -0.0249 0.0640 35 TRP C CA 5235 C C . TRP D 40 ? 0.2911 0.6357 0.2125 -0.1626 -0.0216 0.0654 35 TRP C C 5236 O O . TRP D 40 ? 0.2959 0.6259 0.2146 -0.1628 -0.0207 0.0595 35 TRP C O 5237 C CB . TRP D 40 ? 0.3052 0.6708 0.2063 -0.1703 -0.0222 0.0535 35 TRP C CB 5238 C CG . TRP D 40 ? 0.3079 0.6984 0.2029 -0.1737 -0.0262 0.0502 35 TRP C CG 5239 C CD1 . TRP D 40 ? 0.3117 0.7101 0.2051 -0.1826 -0.0285 0.0389 35 TRP C CD1 5240 C CD2 . TRP D 40 ? 0.3130 0.7292 0.2024 -0.1679 -0.0283 0.0582 35 TRP C CD2 5241 N NE1 . TRP D 40 ? 0.3142 0.7474 0.2036 -0.1823 -0.0336 0.0379 35 TRP C NE1 5242 C CE2 . TRP D 40 ? 0.3171 0.7608 0.2020 -0.1719 -0.0340 0.0509 35 TRP C CE2 5243 C CE3 . TRP D 40 ? 0.3166 0.7368 0.2032 -0.1601 -0.0251 0.0714 35 TRP C CE3 5244 C CZ2 . TRP D 40 ? 0.3268 0.8040 0.2036 -0.1650 -0.0384 0.0577 35 TRP C CZ2 5245 C CZ3 . TRP D 40 ? 0.3286 0.7754 0.2048 -0.1542 -0.0276 0.0797 35 TRP C CZ3 5246 C CH2 . TRP D 40 ? 0.3338 0.8099 0.2045 -0.1551 -0.0351 0.0735 35 TRP C CH2 5247 N N . TYR D 41 ? 0.2901 0.6407 0.2192 -0.1592 -0.0192 0.0736 36 TYR C N 5248 C CA . TYR D 41 ? 0.2868 0.6353 0.2255 -0.1567 -0.0161 0.0737 36 TYR C CA 5249 C C . TYR D 41 ? 0.2911 0.6503 0.2269 -0.1546 -0.0095 0.0746 36 TYR C C 5250 O O . TYR D 41 ? 0.2925 0.6607 0.2204 -0.1554 -0.0070 0.0799 36 TYR C O 5251 C CB . TYR D 41 ? 0.2837 0.6326 0.2378 -0.1588 -0.0163 0.0794 36 TYR C CB 5252 C CG . TYR D 41 ? 0.2826 0.6232 0.2401 -0.1605 -0.0217 0.0765 36 TYR C CG 5253 C CD1 . TYR D 41 ? 0.2852 0.6233 0.2411 -0.1616 -0.0239 0.0793 36 TYR C CD1 5254 C CD2 . TYR D 41 ? 0.2806 0.6191 0.2417 -0.1593 -0.0246 0.0711 36 TYR C CD2 5255 C CE1 . TYR D 41 ? 0.2816 0.6140 0.2404 -0.1634 -0.0275 0.0752 36 TYR C CE1 5256 C CE2 . TYR D 41 ? 0.2810 0.6134 0.2420 -0.1612 -0.0288 0.0684 36 TYR C CE2 5257 C CZ . TYR D 41 ? 0.2793 0.6082 0.2396 -0.1642 -0.0295 0.0698 36 TYR C CZ 5258 O OH . TYR D 41 ? 0.2869 0.6118 0.2474 -0.1664 -0.0322 0.0660 36 TYR C OH 5259 N N . LEU D 42 ? 0.2900 0.6508 0.2314 -0.1502 -0.0066 0.0697 37 LEU C N 5260 C CA . LEU D 42 ? 0.2972 0.6716 0.2401 -0.1477 0.0009 0.0691 37 LEU C CA 5261 C C . LEU D 42 ? 0.2915 0.6786 0.2547 -0.1482 0.0029 0.0710 37 LEU C C 5262 O O . LEU D 42 ? 0.2891 0.6768 0.2615 -0.1442 -0.0017 0.0671 37 LEU C O 5263 C CB . LEU D 42 ? 0.3068 0.6759 0.2407 -0.1404 0.0041 0.0591 37 LEU C CB 5264 C CG . LEU D 42 ? 0.3152 0.7005 0.2541 -0.1347 0.0127 0.0558 37 LEU C CG 5265 C CD1 . LEU D 42 ? 0.3206 0.7209 0.2527 -0.1410 0.0190 0.0605 37 LEU C CD1 5266 C CD2 . LEU D 42 ? 0.3321 0.7044 0.2604 -0.1253 0.0169 0.0448 37 LEU C CD2 5267 N N . GLN D 43 ? 0.2986 0.6973 0.2682 -0.1541 0.0103 0.0769 38 GLN C N 5268 C CA . GLN D 43 ? 0.2999 0.7159 0.2908 -0.1583 0.0150 0.0752 38 GLN C CA 5269 C C . GLN D 43 ? 0.3155 0.7525 0.3098 -0.1560 0.0247 0.0723 38 GLN C C 5270 O O . GLN D 43 ? 0.3296 0.7675 0.3115 -0.1583 0.0325 0.0776 38 GLN C O 5271 C CB . GLN D 43 ? 0.3013 0.7117 0.3005 -0.1703 0.0198 0.0829 38 GLN C CB 5272 C CG . GLN D 43 ? 0.2977 0.7276 0.3215 -0.1793 0.0253 0.0768 38 GLN C CG 5273 C CD . GLN D 43 ? 0.3038 0.7194 0.3362 -0.1929 0.0308 0.0808 38 GLN C CD 5274 O OE1 . GLN D 43 ? 0.3162 0.7088 0.3360 -0.1942 0.0352 0.0927 38 GLN C OE1 5275 N NE2 . GLN D 43 ? 0.3025 0.7327 0.3564 -0.2023 0.0309 0.0701 38 GLN C NE2 5276 N N . LYS D 44 ? 0.3179 0.7757 0.3290 -0.1504 0.0242 0.0638 39 LYS C N 5277 C CA . LYS D 44 ? 0.3341 0.8183 0.3541 -0.1476 0.0341 0.0592 39 LYS C CA 5278 C C . LYS D 44 ? 0.3358 0.8458 0.3810 -0.1608 0.0409 0.0578 39 LYS C C 5279 O O . LYS D 44 ? 0.3279 0.8388 0.3863 -0.1684 0.0355 0.0560 39 LYS C O 5280 C CB . LYS D 44 ? 0.3406 0.8334 0.3627 -0.1290 0.0303 0.0502 39 LYS C CB 5281 C CG . LYS D 44 ? 0.3592 0.8209 0.3554 -0.1201 0.0278 0.0494 39 LYS C CG 5282 C CD . LYS D 44 ? 0.3799 0.8441 0.3733 -0.1024 0.0324 0.0408 39 LYS C CD 5283 C CE . LYS D 44 ? 0.3914 0.8303 0.3767 -0.0888 0.0246 0.0398 39 LYS C CE 5284 N NZ . LYS D 44 ? 0.4198 0.8574 0.4035 -0.0683 0.0314 0.0326 39 LYS C NZ 5285 N N . PRO D 45 ? 0.3503 0.8818 0.4018 -0.1660 0.0544 0.0572 40 PRO C N 5286 C CA . PRO D 45 ? 0.3606 0.9167 0.4365 -0.1832 0.0648 0.0548 40 PRO C CA 5287 C C . PRO D 45 ? 0.3498 0.9352 0.4536 -0.1835 0.0562 0.0422 40 PRO C C 5288 O O . PRO D 45 ? 0.3402 0.9498 0.4519 -0.1660 0.0486 0.0341 40 PRO C O 5289 C CB . PRO D 45 ? 0.3734 0.9574 0.4528 -0.1824 0.0792 0.0520 40 PRO C CB 5290 C CG . PRO D 45 ? 0.3799 0.9415 0.4284 -0.1707 0.0792 0.0580 40 PRO C CG 5291 C CD . PRO D 45 ? 0.3674 0.9017 0.4026 -0.1582 0.0626 0.0574 40 PRO C CD 5292 N N . GLY D 46 ? 0.3507 0.9324 0.4671 -0.2019 0.0575 0.0407 41 GLY C N 5293 C CA . GLY D 46 ? 0.3433 0.9594 0.4866 -0.2070 0.0504 0.0262 41 GLY C CA 5294 C C . GLY D 46 ? 0.3331 0.9430 0.4701 -0.1923 0.0313 0.0237 41 GLY C C 5295 O O . GLY D 46 ? 0.3316 0.9735 0.4877 -0.1949 0.0236 0.0118 41 GLY C O 5296 N N . GLN D 47 ? 0.3364 0.9083 0.4462 -0.1781 0.0243 0.0339 42 GLN C N 5297 C CA . GLN D 47 ? 0.3264 0.8856 0.4257 -0.1654 0.0089 0.0339 42 GLN C CA 5298 C C . GLN D 47 ? 0.3221 0.8404 0.4064 -0.1752 0.0071 0.0406 42 GLN C C 5299 O O . GLN D 47 ? 0.3191 0.8142 0.3964 -0.1860 0.0166 0.0483 42 GLN C O 5300 C CB . GLN D 47 ? 0.3438 0.8895 0.4240 -0.1420 0.0043 0.0389 42 GLN C CB 5301 C CG . GLN D 47 ? 0.3595 0.9412 0.4521 -0.1248 0.0053 0.0330 42 GLN C CG 5302 C CD . GLN D 47 ? 0.3814 0.9375 0.4522 -0.1019 0.0034 0.0375 42 GLN C CD 5303 O OE1 . GLN D 47 ? 0.3853 0.9011 0.4332 -0.1001 -0.0007 0.0434 42 GLN C OE1 5304 N NE2 . GLN D 47 ? 0.3963 0.9752 0.4747 -0.0851 0.0083 0.0333 42 GLN C NE2 5305 N N . SER D 48 ? 0.3149 0.8260 0.3932 -0.1693 -0.0048 0.0387 43 SER C N 5306 C CA . SER D 48 ? 0.3097 0.7851 0.3737 -0.1748 -0.0075 0.0439 43 SER C CA 5307 C C . SER D 48 ? 0.3146 0.7598 0.3544 -0.1645 -0.0080 0.0541 43 SER C C 5308 O O . SER D 48 ? 0.3307 0.7793 0.3628 -0.1514 -0.0088 0.0549 43 SER C O 5309 C CB . SER D 48 ? 0.3018 0.7827 0.3653 -0.1715 -0.0191 0.0378 43 SER C CB 5310 O OG . SER D 48 ? 0.2992 0.8122 0.3848 -0.1834 -0.0192 0.0251 43 SER C OG 5311 N N . PRO D 49 ? 0.3107 0.7281 0.3393 -0.1701 -0.0071 0.0604 44 PRO C N 5312 C CA . PRO D 49 ? 0.3127 0.7087 0.3200 -0.1623 -0.0093 0.0667 44 PRO C CA 5313 C C . PRO D 49 ? 0.3103 0.7000 0.3073 -0.1521 -0.0180 0.0636 44 PRO C C 5314 O O . PRO D 49 ? 0.3069 0.6998 0.3081 -0.1527 -0.0240 0.0601 44 PRO C O 5315 C CB . PRO D 49 ? 0.3133 0.6896 0.3159 -0.1693 -0.0080 0.0728 44 PRO C CB 5316 C CG . PRO D 49 ? 0.3199 0.6998 0.3390 -0.1808 -0.0003 0.0724 44 PRO C CG 5317 C CD . PRO D 49 ? 0.3136 0.7194 0.3498 -0.1837 -0.0022 0.0612 44 PRO C CD 5318 N N . LYS D 50 ? 0.3161 0.6954 0.2983 -0.1436 -0.0172 0.0644 45 LYS C N 5319 C CA . LYS D 50 ? 0.3218 0.6861 0.2907 -0.1346 -0.0216 0.0633 45 LYS C CA 5320 C C . LYS D 50 ? 0.3123 0.6537 0.2641 -0.1393 -0.0206 0.0640 45 LYS C C 5321 O O . LYS D 50 ? 0.3083 0.6497 0.2554 -0.1431 -0.0165 0.0641 45 LYS C O 5322 C CB . LYS D 50 ? 0.3453 0.7129 0.3115 -0.1204 -0.0185 0.0613 45 LYS C CB 5323 C CG . LYS D 50 ? 0.3636 0.7630 0.3487 -0.1132 -0.0205 0.0593 45 LYS C CG 5324 C CD . LYS D 50 ? 0.3955 0.7975 0.3776 -0.0945 -0.0171 0.0582 45 LYS C CD 5325 C CE . LYS D 50 ? 0.4080 0.8529 0.4131 -0.0870 -0.0183 0.0546 45 LYS C CE 5326 N NZ . LYS D 50 ? 0.4146 0.8803 0.4275 -0.0830 -0.0288 0.0547 45 LYS C NZ 5327 N N . LEU D 51 ? 0.3071 0.6331 0.2497 -0.1395 -0.0242 0.0639 46 LEU C N 5328 C CA . LEU D 51 ? 0.3042 0.6140 0.2339 -0.1467 -0.0231 0.0623 46 LEU C CA 5329 C C . LEU D 51 ? 0.3178 0.6113 0.2329 -0.1443 -0.0169 0.0576 46 LEU C C 5330 O O . LEU D 51 ? 0.3350 0.6148 0.2437 -0.1347 -0.0140 0.0577 46 LEU C O 5331 C CB . LEU D 51 ? 0.3038 0.6034 0.2286 -0.1488 -0.0265 0.0629 46 LEU C CB 5332 C CG . LEU D 51 ? 0.3119 0.5996 0.2263 -0.1582 -0.0246 0.0596 46 LEU C CG 5333 C CD1 . LEU D 51 ? 0.2976 0.6011 0.2211 -0.1649 -0.0271 0.0595 46 LEU C CD1 5334 C CD2 . LEU D 51 ? 0.3239 0.6002 0.2311 -0.1593 -0.0254 0.0608 46 LEU C CD2 5335 N N . LEU D 52 ? 0.3153 0.6106 0.2244 -0.1522 -0.0143 0.0529 47 LEU C N 5336 C CA . LEU D 52 ? 0.3364 0.6154 0.2308 -0.1542 -0.0070 0.0439 47 LEU C CA 5337 C C . LEU D 52 ? 0.3408 0.6065 0.2255 -0.1662 -0.0057 0.0378 47 LEU C C 5338 O O . LEU D 52 ? 0.3611 0.5991 0.2337 -0.1678 0.0014 0.0332 47 LEU C O 5339 C CB . LEU D 52 ? 0.3379 0.6341 0.2304 -0.1567 -0.0043 0.0391 47 LEU C CB 5340 C CG . LEU D 52 ? 0.3370 0.6474 0.2381 -0.1472 -0.0022 0.0434 47 LEU C CG 5341 C CD1 . LEU D 52 ? 0.3468 0.6735 0.2409 -0.1508 0.0018 0.0387 47 LEU C CD1 5342 C CD2 . LEU D 52 ? 0.3523 0.6481 0.2533 -0.1345 0.0028 0.0414 47 LEU C CD2 5343 N N . ILE D 53 ? 0.3253 0.6112 0.2158 -0.1742 -0.0114 0.0383 48 ILE C N 5344 C CA . ILE D 53 ? 0.3316 0.6180 0.2170 -0.1875 -0.0104 0.0300 48 ILE C CA 5345 C C . ILE D 53 ? 0.3107 0.6091 0.2064 -0.1887 -0.0169 0.0362 48 ILE C C 5346 O O . ILE D 53 ? 0.2920 0.6089 0.1987 -0.1830 -0.0228 0.0437 48 ILE C O 5347 C CB . ILE D 53 ? 0.3345 0.6460 0.2173 -0.1950 -0.0112 0.0210 48 ILE C CB 5348 C CG1 . ILE D 53 ? 0.3565 0.6588 0.2281 -0.1948 -0.0037 0.0118 48 ILE C CG1 5349 C CG2 . ILE D 53 ? 0.3439 0.6646 0.2248 -0.2102 -0.0105 0.0097 48 ILE C CG2 5350 C CD1 . ILE D 53 ? 0.3879 0.6547 0.2471 -0.2021 0.0076 0.0000 48 ILE C CD1 5351 N N . TYR D 54 ? 0.3200 0.6060 0.2114 -0.1967 -0.0138 0.0326 49 TYR C N 5352 C CA . TYR D 54 ? 0.3070 0.6062 0.2076 -0.1989 -0.0183 0.0354 49 TYR C CA 5353 C C . TYR D 54 ? 0.3158 0.6267 0.2155 -0.2137 -0.0152 0.0244 49 TYR C C 5354 O O . TYR D 54 ? 0.3363 0.6358 0.2256 -0.2251 -0.0075 0.0138 49 TYR C O 5355 C CB . TYR D 54 ? 0.3076 0.5885 0.2057 -0.1941 -0.0176 0.0422 49 TYR C CB 5356 C CG . TYR D 54 ? 0.3340 0.5856 0.2153 -0.2001 -0.0085 0.0401 49 TYR C CG 5357 C CD1 . TYR D 54 ? 0.3561 0.5808 0.2246 -0.1942 -0.0024 0.0417 49 TYR C CD1 5358 C CD2 . TYR D 54 ? 0.3435 0.5918 0.2207 -0.2107 -0.0042 0.0374 49 TYR C CD2 5359 C CE1 . TYR D 54 ? 0.3879 0.5781 0.2385 -0.1977 0.0083 0.0423 49 TYR C CE1 5360 C CE2 . TYR D 54 ? 0.3731 0.5890 0.2319 -0.2170 0.0070 0.0377 49 TYR C CE2 5361 C CZ . TYR D 54 ? 0.3970 0.5811 0.2416 -0.2100 0.0135 0.0409 49 TYR C CZ 5362 O OH . TYR D 54 ? 0.4316 0.5761 0.2557 -0.2140 0.0270 0.0436 49 TYR C OH 5363 N N . LYS D 55 ? 0.3036 0.6383 0.2154 -0.2137 -0.0200 0.0253 50 LYS C N 5364 C CA . LYS D 55 ? 0.3052 0.6633 0.2217 -0.2264 -0.0184 0.0142 50 LYS C CA 5365 C C . LYS D 55 ? 0.3106 0.6890 0.2243 -0.2351 -0.0182 0.0025 50 LYS C C 5366 O O . LYS D 55 ? 0.3243 0.7038 0.2333 -0.2527 -0.0110 -0.0118 50 LYS C O 5367 C CB . LYS D 55 ? 0.3250 0.6610 0.2331 -0.2392 -0.0088 0.0095 50 LYS C CB 5368 C CG . LYS D 55 ? 0.3199 0.6592 0.2349 -0.2345 -0.0104 0.0156 50 LYS C CG 5369 C CD . LYS D 55 ? 0.3421 0.6536 0.2425 -0.2449 0.0003 0.0151 50 LYS C CD 5370 C CE . LYS D 55 ? 0.3615 0.6849 0.2625 -0.2659 0.0095 0.0012 50 LYS C CE 5371 N NZ . LYS D 55 ? 0.3903 0.6820 0.2743 -0.2773 0.0230 0.0027 50 LYS C NZ 5372 N N . VAL D 56 ? 0.3026 0.6975 0.2181 -0.2237 -0.0251 0.0082 51 VAL C N 5373 C CA . VAL D 56 ? 0.3088 0.7316 0.2203 -0.2284 -0.0273 -0.0015 51 VAL C CA 5374 C C . VAL D 56 ? 0.3316 0.7293 0.2277 -0.2372 -0.0190 -0.0116 51 VAL C C 5375 O O . VAL D 56 ? 0.3333 0.7408 0.2232 -0.2319 -0.0210 -0.0118 51 VAL C O 5376 C CB . VAL D 56 ? 0.3110 0.7758 0.2303 -0.2412 -0.0292 -0.0163 51 VAL C CB 5377 C CG1 . VAL D 56 ? 0.3191 0.8227 0.2337 -0.2438 -0.0340 -0.0263 51 VAL C CG1 5378 C CG2 . VAL D 56 ? 0.2924 0.7833 0.2282 -0.2297 -0.0362 -0.0071 51 VAL C CG2 5379 N N . SER D 57 ? 0.3541 0.7189 0.2426 -0.2505 -0.0081 -0.0204 52 SER C N 5380 C CA . SER D 57 ? 0.3856 0.7245 0.2592 -0.2608 0.0027 -0.0340 52 SER C CA 5381 C C . SER D 57 ? 0.4097 0.6923 0.2716 -0.2590 0.0144 -0.0291 52 SER C C 5382 O O . SER D 57 ? 0.4433 0.6966 0.2924 -0.2659 0.0260 -0.0398 52 SER C O 5383 C CB . SER D 57 ? 0.4035 0.7639 0.2760 -0.2849 0.0083 -0.0579 52 SER C CB 5384 O OG . SER D 57 ? 0.4096 0.7630 0.2866 -0.2985 0.0143 -0.0615 52 SER C OG 5385 N N . ASN D 58 ? 0.4002 0.6676 0.2652 -0.2481 0.0118 -0.0130 53 ASN C N 5386 C CA . ASN D 58 ? 0.4253 0.6442 0.2770 -0.2440 0.0220 -0.0062 53 ASN C CA 5387 C C . ASN D 58 ? 0.4273 0.6331 0.2772 -0.2228 0.0188 0.0054 53 ASN C C 5388 O O . ASN D 58 ? 0.3969 0.6255 0.2584 -0.2102 0.0077 0.0159 53 ASN C O 5389 C CB . ASN D 58 ? 0.4174 0.6311 0.2705 -0.2447 0.0215 0.0031 53 ASN C CB 5390 C CG . ASN D 58 ? 0.4188 0.6502 0.2762 -0.2664 0.0261 -0.0098 53 ASN C CG 5391 O OD1 . ASN D 58 ? 0.3898 0.6608 0.2628 -0.2672 0.0168 -0.0103 53 ASN C OD1 5392 N ND2 . ASN D 58 ? 0.4530 0.6563 0.2979 -0.2846 0.0416 -0.0218 53 ASN C ND2 5393 N N . ARG D 59 ? 0.4682 0.6371 0.3042 -0.2195 0.0302 0.0023 54 ARG C N 5394 C CA . ARG D 59 ? 0.4799 0.6409 0.3156 -0.1992 0.0289 0.0101 54 ARG C CA 5395 C C . ARG D 59 ? 0.4770 0.6213 0.3107 -0.1815 0.0265 0.0279 54 ARG C C 5396 O O . ARG D 59 ? 0.5150 0.6228 0.3338 -0.1809 0.0360 0.0325 54 ARG C O 5397 C CB . ARG D 59 ? 0.5342 0.6667 0.3569 -0.2025 0.0430 -0.0038 54 ARG C CB 5398 C CG . ARG D 59 ? 0.5714 0.6756 0.3878 -0.1805 0.0493 0.0032 54 ARG C CG 5399 C CD . ARG D 59 ? 0.6173 0.6942 0.4217 -0.1853 0.0649 -0.0145 54 ARG C CD 5400 N NE . ARG D 59 ? 0.6275 0.7257 0.4317 -0.2100 0.0663 -0.0355 54 ARG C NE 5401 C CZ . ARG D 59 ? 0.6712 0.7453 0.4647 -0.2326 0.0795 -0.0529 54 ARG C CZ 5402 N NH1 . ARG D 59 ? 0.7141 0.7325 0.4936 -0.2338 0.0953 -0.0501 54 ARG C NH1 5403 N NH2 . ARG D 59 ? 0.6640 0.7712 0.4600 -0.2545 0.0780 -0.0737 54 ARG C NH2 5404 N N . PHE D 60 ? 0.4378 0.6105 0.2856 -0.1683 0.0144 0.0377 55 PHE C N 5405 C CA . PHE D 60 ? 0.4275 0.5975 0.2757 -0.1528 0.0095 0.0518 55 PHE C CA 5406 C C . PHE D 60 ? 0.4566 0.5955 0.2920 -0.1355 0.0179 0.0570 55 PHE C C 5407 O O . PHE D 60 ? 0.4670 0.5940 0.2994 -0.1329 0.0256 0.0494 55 PHE C O 5408 C CB . PHE D 60 ? 0.3927 0.6011 0.2607 -0.1458 -0.0029 0.0565 55 PHE C CB 5409 C CG . PHE D 60 ? 0.3857 0.6025 0.2568 -0.1344 -0.0099 0.0667 55 PHE C CG 5410 C CD1 . PHE D 60 ? 0.3818 0.5985 0.2490 -0.1409 -0.0126 0.0697 55 PHE C CD1 5411 C CD2 . PHE D 60 ? 0.3852 0.6168 0.2642 -0.1178 -0.0138 0.0714 55 PHE C CD2 5412 C CE1 . PHE D 60 ? 0.3827 0.6120 0.2511 -0.1313 -0.0195 0.0768 55 PHE C CE1 5413 C CE2 . PHE D 60 ? 0.3838 0.6318 0.2663 -0.1083 -0.0215 0.0781 55 PHE C CE2 5414 C CZ . PHE D 60 ? 0.3819 0.6279 0.2576 -0.1151 -0.0245 0.0807 55 PHE C CZ 5415 N N . SER D 61 ? 0.4743 0.6004 0.3008 -0.1222 0.0171 0.0699 56 SER C N 5416 C CA . SER D 61 ? 0.5195 0.6125 0.3309 -0.1014 0.0261 0.0781 56 SER C CA 5417 C C . SER D 61 ? 0.5097 0.6243 0.3348 -0.0833 0.0224 0.0770 56 SER C C 5418 O O . SER D 61 ? 0.4758 0.6339 0.3205 -0.0807 0.0099 0.0776 56 SER C O 5419 C CB . SER D 61 ? 0.5416 0.6274 0.3403 -0.0865 0.0229 0.0952 56 SER C CB 5420 O OG . SER D 61 ? 0.5147 0.6477 0.3303 -0.0756 0.0069 0.1000 56 SER C OG 5421 N N . GLY D 62 ? 0.5459 0.6289 0.3611 -0.0716 0.0350 0.0744 57 GLY C N 5422 C CA . GLY D 62 ? 0.5434 0.6468 0.3718 -0.0544 0.0343 0.0711 57 GLY C CA 5423 C C . GLY D 62 ? 0.5277 0.6473 0.3662 -0.0698 0.0369 0.0543 57 GLY C C 5424 O O . GLY D 62 ? 0.5339 0.6639 0.3798 -0.0571 0.0406 0.0494 57 GLY C O 5425 N N . VAL D 63 ? 0.5086 0.6349 0.3473 -0.0954 0.0347 0.0457 58 VAL C N 5426 C CA . VAL D 63 ? 0.4967 0.6421 0.3411 -0.1094 0.0361 0.0313 58 VAL C CA 5427 C C . VAL D 63 ? 0.5462 0.6509 0.3728 -0.1161 0.0528 0.0168 58 VAL C C 5428 O O . VAL D 63 ? 0.5773 0.6456 0.3893 -0.1263 0.0609 0.0150 58 VAL C O 5429 C CB . VAL D 63 ? 0.4594 0.6326 0.3110 -0.1303 0.0263 0.0293 58 VAL C CB 5430 C CG1 . VAL D 63 ? 0.4503 0.6480 0.3050 -0.1413 0.0266 0.0174 58 VAL C CG1 5431 C CG2 . VAL D 63 ? 0.4255 0.6293 0.2932 -0.1246 0.0129 0.0421 58 VAL C CG2 5432 N N . PRO D 64 ? 0.5610 0.6700 0.3882 -0.1117 0.0599 0.0052 59 PRO C N 5433 C CA . PRO D 64 ? 0.6093 0.6776 0.4193 -0.1193 0.0777 -0.0123 59 PRO C CA 5434 C C . PRO D 64 ? 0.6083 0.6874 0.4130 -0.1497 0.0785 -0.0305 59 PRO C C 5435 O O . PRO D 64 ? 0.5671 0.6916 0.3823 -0.1599 0.0648 -0.0289 59 PRO C O 5436 C CB . PRO D 64 ? 0.6204 0.6968 0.4345 -0.1022 0.0843 -0.0192 59 PRO C CB 5437 C CG . PRO D 64 ? 0.5717 0.7058 0.4055 -0.0985 0.0690 -0.0108 59 PRO C CG 5438 C CD . PRO D 64 ? 0.5392 0.6879 0.3820 -0.0997 0.0545 0.0066 59 PRO C CD 5439 N N . ASP D 65 ? 0.6574 0.6960 0.4461 -0.1632 0.0952 -0.0482 60 ASP C N 5440 C CA . ASP D 65 ? 0.6629 0.7130 0.4465 -0.1944 0.0971 -0.0686 60 ASP C CA 5441 C C . ASP D 65 ? 0.6413 0.7373 0.4275 -0.2041 0.0925 -0.0858 60 ASP C C 5442 O O . ASP D 65 ? 0.6388 0.7574 0.4223 -0.2278 0.0908 -0.1022 60 ASP C O 5443 C CB . ASP D 65 ? 0.7296 0.7206 0.4956 -0.2109 0.1189 -0.0850 60 ASP C CB 5444 C CG . ASP D 65 ? 0.7871 0.7148 0.5414 -0.1876 0.1354 -0.0756 60 ASP C CG 5445 O OD1 . ASP D 65 ? 0.7800 0.7097 0.5403 -0.1602 0.1269 -0.0507 60 ASP C OD1 5446 O OD2 . ASP D 65 ? 0.8504 0.7262 0.5891 -0.1966 0.1576 -0.0932 60 ASP C OD2 5447 N N . ARG D 66 ? 0.6250 0.7410 0.4163 -0.1860 0.0899 -0.0815 61 ARG C N 5448 C CA . ARG D 66 ? 0.6107 0.7745 0.4017 -0.1944 0.0848 -0.0938 61 ARG C CA 5449 C C . ARG D 66 ? 0.5613 0.7761 0.3632 -0.1998 0.0653 -0.0798 61 ARG C C 5450 O O . ARG D 66 ? 0.5502 0.8064 0.3488 -0.2095 0.0596 -0.0880 61 ARG C O 5451 C CB . ARG D 66 ? 0.6157 0.7875 0.4080 -0.1753 0.0902 -0.0943 61 ARG C CB 5452 C CG . ARG D 66 ? 0.5940 0.7687 0.4016 -0.1496 0.0844 -0.0702 61 ARG C CG 5453 C CD . ARG D 66 ? 0.5948 0.7942 0.4067 -0.1356 0.0887 -0.0727 61 ARG C CD 5454 N NE . ARG D 66 ? 0.5629 0.7845 0.3938 -0.1171 0.0801 -0.0512 61 ARG C NE 5455 C CZ . ARG D 66 ? 0.5711 0.7727 0.4109 -0.0957 0.0826 -0.0411 61 ARG C CZ 5456 N NH1 . ARG D 66 ? 0.6108 0.7625 0.4398 -0.0871 0.0945 -0.0469 61 ARG C NH1 5457 N NH2 . ARG D 66 ? 0.5426 0.7748 0.4016 -0.0826 0.0738 -0.0250 61 ARG C NH2 5458 N N . PHE D 67 ? 0.5348 0.7458 0.3481 -0.1921 0.0560 -0.0587 62 PHE C N 5459 C CA . PHE D 67 ? 0.4983 0.7472 0.3219 -0.1968 0.0402 -0.0460 62 PHE C CA 5460 C C . PHE D 67 ? 0.5045 0.7515 0.3253 -0.2167 0.0394 -0.0555 62 PHE C C 5461 O O . PHE D 67 ? 0.5314 0.7379 0.3462 -0.2230 0.0496 -0.0612 62 PHE C O 5462 C CB . PHE D 67 ? 0.4711 0.7182 0.3089 -0.1806 0.0320 -0.0225 62 PHE C CB 5463 C CG . PHE D 67 ? 0.4589 0.7201 0.3044 -0.1639 0.0316 -0.0135 62 PHE C CG 5464 C CD1 . PHE D 67 ? 0.4366 0.7360 0.2881 -0.1636 0.0245 -0.0061 62 PHE C CD1 5465 C CD2 . PHE D 67 ? 0.4746 0.7118 0.3216 -0.1478 0.0392 -0.0114 62 PHE C CD2 5466 C CE1 . PHE D 67 ? 0.4289 0.7421 0.2884 -0.1516 0.0264 0.0012 62 PHE C CE1 5467 C CE2 . PHE D 67 ? 0.4633 0.7206 0.3209 -0.1336 0.0391 -0.0049 62 PHE C CE2 5468 C CZ . PHE D 67 ? 0.4414 0.7366 0.3056 -0.1375 0.0335 0.0005 62 PHE C CZ 5469 N N . SER D 68 ? 0.4858 0.7774 0.3106 -0.2259 0.0284 -0.0568 63 SER C N 5470 C CA . SER D 68 ? 0.4863 0.7894 0.3139 -0.2432 0.0253 -0.0643 63 SER C CA 5471 C C . SER D 68 ? 0.4545 0.8064 0.2928 -0.2389 0.0093 -0.0517 63 SER C C 5472 O O . SER D 68 ? 0.4446 0.8270 0.2815 -0.2301 0.0030 -0.0456 63 SER C O 5473 C CB . SER D 68 ? 0.5202 0.8268 0.3367 -0.2658 0.0347 -0.0936 63 SER C CB 5474 O OG . SER D 68 ? 0.5230 0.8741 0.3338 -0.2676 0.0294 -0.1036 63 SER C OG 5475 N N . GLY D 69 ? 0.4412 0.7969 0.2895 -0.2432 0.0043 -0.0459 64 GLY C N 5476 C CA . GLY D 69 ? 0.4176 0.8156 0.2771 -0.2376 -0.0090 -0.0347 64 GLY C CA 5477 C C . GLY D 69 ? 0.4213 0.8521 0.2833 -0.2556 -0.0109 -0.0523 64 GLY C C 5478 O O . GLY D 69 ? 0.4462 0.8568 0.3050 -0.2741 -0.0007 -0.0694 64 GLY C O 5479 N N . SER D 70 ? 0.4040 0.8864 0.2716 -0.2500 -0.0228 -0.0482 65 SER C N 5480 C CA . SER D 70 ? 0.4036 0.9302 0.2777 -0.2648 -0.0269 -0.0648 65 SER C CA 5481 C C . SER D 70 ? 0.3808 0.9560 0.2651 -0.2476 -0.0413 -0.0490 65 SER C C 5482 O O . SER D 70 ? 0.3638 0.9319 0.2475 -0.2265 -0.0461 -0.0260 65 SER C O 5483 C CB . SER D 70 ? 0.4322 0.9831 0.2942 -0.2825 -0.0230 -0.0916 65 SER C CB 5484 O OG . SER D 70 ? 0.4335 1.0229 0.2863 -0.2691 -0.0321 -0.0853 65 SER C OG 5485 N N . GLY D 71 ? 0.3799 1.0039 0.2742 -0.2566 -0.0470 -0.0619 66 GLY C N 5486 C CA . GLY D 71 ? 0.3682 1.0454 0.2725 -0.2379 -0.0608 -0.0485 66 GLY C CA 5487 C C . GLY D 71 ? 0.3560 1.0436 0.2807 -0.2375 -0.0624 -0.0466 66 GLY C C 5488 O O . GLY D 71 ? 0.3539 1.0062 0.2834 -0.2527 -0.0526 -0.0544 66 GLY C O 5489 N N . SER D 72 ? 0.3535 1.0912 0.2889 -0.2187 -0.0740 -0.0360 67 SER C N 5490 C CA . SER D 72 ? 0.3404 1.0920 0.2968 -0.2123 -0.0758 -0.0319 67 SER C CA 5491 C C . SER D 72 ? 0.3344 1.1277 0.2976 -0.1810 -0.0878 -0.0116 67 SER C C 5492 O O . SER D 72 ? 0.3382 1.1641 0.2897 -0.1683 -0.0959 -0.0048 67 SER C O 5493 C CB . SER D 72 ? 0.3447 1.1335 0.3144 -0.2384 -0.0726 -0.0600 67 SER C CB 5494 O OG . SER D 72 ? 0.3618 1.2245 0.3337 -0.2413 -0.0823 -0.0749 67 SER C OG 5495 N N . GLY D 73 ? 0.3233 1.1113 0.3033 -0.1674 -0.0875 -0.0011 68 GLY C N 5496 C CA . GLY D 73 ? 0.3258 1.1518 0.3155 -0.1360 -0.0967 0.0170 68 GLY C CA 5497 C C . GLY D 73 ? 0.3346 1.1236 0.3107 -0.1102 -0.0967 0.0466 68 GLY C C 5498 O O . GLY D 73 ? 0.3281 1.0649 0.3077 -0.1025 -0.0895 0.0599 68 GLY C O 5499 N N . THR D 74 ? 0.3542 1.1729 0.3143 -0.0977 -0.1040 0.0561 69 THR C N 5500 C CA . THR D 74 ? 0.3750 1.1587 0.3188 -0.0756 -0.1017 0.0849 69 THR C CA 5501 C C . THR D 74 ? 0.3882 1.1562 0.3087 -0.0885 -0.0990 0.0826 69 THR C C 5502 O O . THR D 74 ? 0.4108 1.1570 0.3157 -0.0732 -0.0963 0.1049 69 THR C O 5503 C CB . THR D 74 ? 0.3976 1.2256 0.3380 -0.0407 -0.1106 0.1076 69 THR C CB 5504 O OG1 . THR D 74 ? 0.4073 1.3037 0.3361 -0.0425 -0.1220 0.0976 69 THR C OG1 5505 C CG2 . THR D 74 ? 0.3949 1.2437 0.3596 -0.0233 -0.1130 0.1100 69 THR C CG2 5506 N N . ASP D 75 ? 0.3874 1.1636 0.3051 -0.1167 -0.0978 0.0556 70 ASP C N 5507 C CA . ASP D 75 ? 0.4033 1.1774 0.2989 -0.1275 -0.0959 0.0492 70 ASP C CA 5508 C C . ASP D 75 ? 0.3938 1.1198 0.2889 -0.1547 -0.0850 0.0298 70 ASP C C 5509 O O . ASP D 75 ? 0.3967 1.1311 0.3008 -0.1762 -0.0831 0.0056 70 ASP C O 5510 C CB . ASP D 75 ? 0.4195 1.2693 0.3068 -0.1301 -0.1067 0.0342 70 ASP C CB 5511 C CG . ASP D 75 ? 0.4459 1.3279 0.3151 -0.1013 -0.1144 0.0598 70 ASP C CG 5512 O OD1 . ASP D 75 ? 0.4539 1.2913 0.3102 -0.0879 -0.1076 0.0844 70 ASP C OD1 5513 O OD2 . ASP D 75 ? 0.4608 1.4149 0.3284 -0.0919 -0.1268 0.0558 70 ASP C OD2 5514 N N . PHE D 76 ? 0.3854 1.0612 0.2706 -0.1526 -0.0769 0.0415 71 PHE C N 5515 C CA . PHE D 76 ? 0.3741 1.0017 0.2585 -0.1716 -0.0666 0.0281 71 PHE C CA 5516 C C . PHE D 76 ? 0.3827 0.9946 0.2486 -0.1734 -0.0609 0.0284 71 PHE C C 5517 O O . PHE D 76 ? 0.3827 1.0023 0.2382 -0.1580 -0.0622 0.0468 71 PHE C O 5518 C CB . PHE D 76 ? 0.3597 0.9394 0.2574 -0.1666 -0.0615 0.0407 71 PHE C CB 5519 C CG . PHE D 76 ? 0.3491 0.9413 0.2646 -0.1647 -0.0651 0.0397 71 PHE C CG 5520 C CD1 . PHE D 76 ? 0.3451 0.9334 0.2684 -0.1837 -0.0617 0.0203 71 PHE C CD1 5521 C CD2 . PHE D 76 ? 0.3506 0.9573 0.2744 -0.1431 -0.0702 0.0583 71 PHE C CD2 5522 C CE1 . PHE D 76 ? 0.3403 0.9440 0.2802 -0.1828 -0.0637 0.0182 71 PHE C CE1 5523 C CE2 . PHE D 76 ? 0.3451 0.9661 0.2864 -0.1397 -0.0725 0.0558 71 PHE C CE2 5524 C CZ . PHE D 76 ? 0.3393 0.9616 0.2893 -0.1602 -0.0696 0.0350 71 PHE C CZ 5525 N N . THR D 77 ? 0.3873 0.9753 0.2486 -0.1917 -0.0528 0.0082 72 THR C N 5526 C CA . THR D 77 ? 0.4078 0.9840 0.2528 -0.1946 -0.0460 0.0030 72 THR C CA 5527 C C . THR D 77 ? 0.4120 0.9347 0.2590 -0.2027 -0.0346 -0.0041 72 THR C C 5528 O O . THR D 77 ? 0.4210 0.9242 0.2733 -0.2163 -0.0303 -0.0188 72 THR C O 5529 C CB . THR D 77 ? 0.4284 1.0437 0.2598 -0.2090 -0.0470 -0.0222 72 THR C CB 5530 O OG1 . THR D 77 ? 0.4333 1.1079 0.2612 -0.1997 -0.0592 -0.0163 72 THR C OG1 5531 C CG2 . THR D 77 ? 0.4444 1.0494 0.2578 -0.2108 -0.0388 -0.0289 72 THR C CG2 5532 N N . LEU D 78 ? 0.4153 0.9168 0.2570 -0.1939 -0.0289 0.0062 73 LEU C N 5533 C CA . LEU D 78 ? 0.4244 0.8839 0.2663 -0.1977 -0.0185 -0.0010 73 LEU C CA 5534 C C . LEU D 78 ? 0.4475 0.9139 0.2728 -0.2025 -0.0111 -0.0169 73 LEU C C 5535 O O . LEU D 78 ? 0.4409 0.9314 0.2565 -0.1952 -0.0120 -0.0093 73 LEU C O 5536 C CB . LEU D 78 ? 0.4132 0.8492 0.2650 -0.1844 -0.0167 0.0194 73 LEU C CB 5537 C CG . LEU D 78 ? 0.4260 0.8264 0.2799 -0.1833 -0.0075 0.0144 73 LEU C CG 5538 C CD1 . LEU D 78 ? 0.4340 0.8048 0.2922 -0.1901 -0.0054 0.0060 73 LEU C CD1 5539 C CD2 . LEU D 78 ? 0.4139 0.8060 0.2790 -0.1718 -0.0067 0.0322 73 LEU C CD2 5540 N N . LYS D 79 ? 0.4720 0.9142 0.2926 -0.2148 -0.0020 -0.0387 74 LYS C N 5541 C CA . LYS D 79 ? 0.5068 0.9480 0.3120 -0.2201 0.0078 -0.0579 74 LYS C CA 5542 C C . LYS D 79 ? 0.5103 0.9042 0.3165 -0.2143 0.0207 -0.0609 74 LYS C C 5543 O O . LYS D 79 ? 0.5067 0.8626 0.3198 -0.2151 0.0249 -0.0605 74 LYS C O 5544 C CB . LYS D 79 ? 0.5462 0.9991 0.3425 -0.2414 0.0110 -0.0873 74 LYS C CB 5545 C CG . LYS D 79 ? 0.5562 1.0694 0.3488 -0.2469 -0.0014 -0.0907 74 LYS C CG 5546 C CD . LYS D 79 ? 0.6026 1.1371 0.3829 -0.2692 0.0037 -0.1255 74 LYS C CD 5547 C CE . LYS D 79 ? 0.6098 1.2133 0.3894 -0.2745 -0.0109 -0.1300 74 LYS C CE 5548 N NZ . LYS D 79 ? 0.5932 1.2017 0.3914 -0.2800 -0.0175 -0.1261 74 LYS C NZ 5549 N N . ILE D 80 ? 0.5144 0.9135 0.3122 -0.2074 0.0276 -0.0643 75 ILE C N 5550 C CA . ILE D 80 ? 0.5261 0.8873 0.3241 -0.1995 0.0410 -0.0704 75 ILE C CA 5551 C C . ILE D 80 ? 0.5554 0.9175 0.3359 -0.2101 0.0525 -0.0990 75 ILE C C 5552 O O . ILE D 80 ? 0.5602 0.9597 0.3293 -0.2118 0.0516 -0.1045 75 ILE C O 5553 C CB . ILE D 80 ? 0.5118 0.8805 0.3184 -0.1817 0.0415 -0.0516 75 ILE C CB 5554 C CG1 . ILE D 80 ? 0.4780 0.8535 0.3008 -0.1753 0.0298 -0.0261 75 ILE C CG1 5555 C CG2 . ILE D 80 ? 0.5298 0.8625 0.3413 -0.1698 0.0536 -0.0563 75 ILE C CG2 5556 C CD1 . ILE D 80 ? 0.4630 0.8533 0.2949 -0.1635 0.0306 -0.0090 75 ILE C CD1 5557 N N . SER D 81 ? 0.5783 0.8980 0.3548 -0.2178 0.0647 -0.1175 76 SER C N 5558 C CA . SER D 81 ? 0.6173 0.9336 0.3772 -0.2324 0.0775 -0.1497 76 SER C CA 5559 C C . SER D 81 ? 0.6353 0.9524 0.3878 -0.2197 0.0886 -0.1566 76 SER C C 5560 O O . SER D 81 ? 0.6579 1.0014 0.3951 -0.2298 0.0932 -0.1781 76 SER C O 5561 C CB . SER D 81 ? 0.6497 0.9106 0.4065 -0.2445 0.0917 -0.1672 76 SER C CB 5562 O OG . SER D 81 ? 0.6554 0.8662 0.4186 -0.2246 0.1002 -0.1530 76 SER C OG 5563 N N . ARG D 82 ? 0.6287 0.9221 0.3927 -0.1977 0.0925 -0.1392 77 ARG C N 5564 C CA . ARG D 82 ? 0.6437 0.9363 0.4051 -0.1829 0.1050 -0.1455 77 ARG C CA 5565 C C . ARG D 82 ? 0.6089 0.9085 0.3893 -0.1604 0.0997 -0.1176 77 ARG C C 5566 O O . ARG D 82 ? 0.6027 0.8676 0.3947 -0.1457 0.1031 -0.1086 77 ARG C O 5567 C CB . ARG D 82 ? 0.6960 0.9321 0.4509 -0.1799 0.1253 -0.1673 77 ARG C CB 5568 C CG . ARG D 82 ? 0.7445 0.9717 0.4797 -0.2026 0.1375 -0.2033 77 ARG C CG 5569 C CD . ARG D 82 ? 0.7921 0.9491 0.5238 -0.2067 0.1536 -0.2160 77 ARG C CD 5570 N NE . ARG D 82 ? 0.7742 0.9134 0.5158 -0.2095 0.1432 -0.1950 77 ARG C NE 5571 C CZ . ARG D 82 ? 0.7994 0.9057 0.5353 -0.2300 0.1490 -0.2063 77 ARG C CZ 5572 N NH1 . ARG D 82 ? 0.8522 0.9353 0.5734 -0.2526 0.1662 -0.2408 77 ARG C NH1 5573 N NH2 . ARG D 82 ? 0.7745 0.8715 0.5199 -0.2296 0.1388 -0.1841 77 ARG C NH2 5574 N N . VAL D 83 ? 0.5850 0.9306 0.3676 -0.1582 0.0927 -0.1047 78 VAL C N 5575 C CA . VAL D 83 ? 0.5542 0.9132 0.3565 -0.1434 0.0870 -0.0792 78 VAL C CA 5576 C C . VAL D 83 ? 0.5668 0.9126 0.3805 -0.1237 0.0994 -0.0818 78 VAL C C 5577 O O . VAL D 83 ? 0.5911 0.9388 0.3956 -0.1202 0.1132 -0.1001 78 VAL C O 5578 C CB . VAL D 83 ? 0.5365 0.9429 0.3353 -0.1476 0.0810 -0.0656 78 VAL C CB 5579 C CG1 . VAL D 83 ? 0.5148 0.9343 0.3343 -0.1354 0.0807 -0.0448 78 VAL C CG1 5580 C CG2 . VAL D 83 ? 0.5175 0.9379 0.3106 -0.1600 0.0663 -0.0558 78 VAL C CG2 5581 N N . GLU D 84 ? 0.5508 0.8865 0.3849 -0.1102 0.0941 -0.0646 79 GLU C N 5582 C CA . GLU D 84 ? 0.5575 0.8949 0.4084 -0.0884 0.1020 -0.0621 79 GLU C CA 5583 C C . GLU D 84 ? 0.5252 0.9007 0.3978 -0.0850 0.0940 -0.0423 79 GLU C C 5584 O O . GLU D 84 ? 0.4985 0.8856 0.3736 -0.0971 0.0822 -0.0281 79 GLU C O 5585 C CB . GLU D 84 ? 0.5732 0.8679 0.4292 -0.0731 0.1035 -0.0605 79 GLU C CB 5586 C CG . GLU D 84 ? 0.6131 0.8610 0.4478 -0.0812 0.1122 -0.0780 79 GLU C CG 5587 C CD . GLU D 84 ? 0.6558 0.8585 0.4910 -0.0586 0.1242 -0.0811 79 GLU C CD 5588 O OE1 . GLU D 84 ? 0.6660 0.8315 0.4983 -0.0559 0.1213 -0.0720 79 GLU C OE1 5589 O OE2 . GLU D 84 ? 0.6795 0.8847 0.5173 -0.0421 0.1375 -0.0918 79 GLU C OE2 5590 N N . ALA D 85 ? 0.5320 0.9265 0.4215 -0.0686 0.1017 -0.0427 80 ALA C N 5591 C CA . ALA D 85 ? 0.5084 0.9445 0.4199 -0.0688 0.0985 -0.0290 80 ALA C CA 5592 C C . ALA D 85 ? 0.4851 0.9190 0.4097 -0.0736 0.0833 -0.0118 80 ALA C C 5593 O O . ALA D 85 ? 0.4663 0.9201 0.3957 -0.0874 0.0782 -0.0002 80 ALA C O 5594 C CB . ALA D 85 ? 0.5169 0.9743 0.4490 -0.0481 0.1083 -0.0344 80 ALA C CB 5595 N N . GLU D 86 ? 0.4953 0.9016 0.4229 -0.0620 0.0776 -0.0102 81 GLU C N 5596 C CA . GLU D 86 ? 0.4813 0.8879 0.4214 -0.0641 0.0638 0.0038 81 GLU C CA 5597 C C . GLU D 86 ? 0.4637 0.8605 0.3924 -0.0849 0.0547 0.0111 81 GLU C C 5598 O O . GLU D 86 ? 0.4428 0.8446 0.3824 -0.0898 0.0448 0.0220 81 GLU C O 5599 C CB . GLU D 86 ? 0.5041 0.8805 0.4433 -0.0461 0.0609 0.0049 81 GLU C CB 5600 C CG . GLU D 86 ? 0.5378 0.8653 0.4513 -0.0508 0.0644 -0.0020 81 GLU C CG 5601 C CD . GLU D 86 ? 0.5799 0.8708 0.4881 -0.0288 0.0696 -0.0024 81 GLU C CD 5602 O OE1 . GLU D 86 ? 0.5985 0.8538 0.4941 -0.0325 0.0659 0.0024 81 GLU C OE1 5603 O OE2 . GLU D 86 ? 0.6044 0.9019 0.5204 -0.0070 0.0784 -0.0069 81 GLU C OE2 5604 N N . ASP D 87 ? 0.4740 0.8600 0.3814 -0.0960 0.0583 0.0038 82 ASP C N 5605 C CA . ASP D 87 ? 0.4590 0.8419 0.3559 -0.1126 0.0496 0.0102 82 ASP C CA 5606 C C . ASP D 87 ? 0.4387 0.8512 0.3401 -0.1219 0.0486 0.0220 82 ASP C C 5607 O O . ASP D 87 ? 0.4276 0.8396 0.3244 -0.1316 0.0410 0.0313 82 ASP C O 5608 C CB . ASP D 87 ? 0.4859 0.8547 0.3588 -0.1213 0.0531 -0.0036 82 ASP C CB 5609 C CG . ASP D 87 ? 0.5148 0.8457 0.3799 -0.1156 0.0583 -0.0165 82 ASP C CG 5610 O OD1 . ASP D 87 ? 0.5247 0.8360 0.3992 -0.1062 0.0548 -0.0093 82 ASP C OD1 5611 O OD2 . ASP D 87 ? 0.5459 0.8652 0.3939 -0.1211 0.0668 -0.0340 82 ASP C OD2 5612 N N . LEU D 88 ? 0.4333 0.8706 0.3434 -0.1186 0.0577 0.0222 83 LEU C N 5613 C CA . LEU D 88 ? 0.4209 0.8813 0.3325 -0.1282 0.0609 0.0344 83 LEU C CA 5614 C C . LEU D 88 ? 0.3930 0.8534 0.3242 -0.1329 0.0540 0.0476 83 LEU C C 5615 O O . LEU D 88 ? 0.3835 0.8424 0.3332 -0.1265 0.0497 0.0451 83 LEU C O 5616 C CB . LEU D 88 ? 0.4354 0.9229 0.3527 -0.1251 0.0750 0.0300 83 LEU C CB 5617 C CG . LEU D 88 ? 0.4613 0.9512 0.3604 -0.1197 0.0845 0.0136 83 LEU C CG 5618 C CD1 . LEU D 88 ? 0.4695 0.9895 0.3804 -0.1149 0.0990 0.0092 83 LEU C CD1 5619 C CD2 . LEU D 88 ? 0.4743 0.9653 0.3438 -0.1297 0.0836 0.0141 83 LEU C CD2 5620 N N . GLY D 89 ? 0.3833 0.8450 0.3088 -0.1431 0.0534 0.0612 84 GLY C N 5621 C CA . GLY D 89 ? 0.3639 0.8205 0.3058 -0.1496 0.0491 0.0722 84 GLY C CA 5622 C C . GLY D 89 ? 0.3624 0.8060 0.2885 -0.1547 0.0447 0.0849 84 GLY C C 5623 O O . GLY D 89 ? 0.3811 0.8292 0.2852 -0.1538 0.0462 0.0869 84 GLY C O 5624 N N . VAL D 90 ? 0.3460 0.7763 0.2829 -0.1587 0.0391 0.0923 85 VAL C N 5625 C CA . VAL D 90 ? 0.3468 0.7648 0.2716 -0.1601 0.0354 0.1054 85 VAL C CA 5626 C C . VAL D 90 ? 0.3316 0.7363 0.2560 -0.1572 0.0223 0.1000 85 VAL C C 5627 O O . VAL D 90 ? 0.3192 0.7156 0.2595 -0.1583 0.0177 0.0949 85 VAL C O 5628 C CB . VAL D 90 ? 0.3528 0.7611 0.2895 -0.1673 0.0428 0.1188 85 VAL C CB 5629 C CG1 . VAL D 90 ? 0.3660 0.7604 0.2880 -0.1638 0.0409 0.1350 85 VAL C CG1 5630 C CG2 . VAL D 90 ? 0.3676 0.7888 0.3085 -0.1740 0.0585 0.1230 85 VAL C CG2 5631 N N . TYR D 91 ? 0.3353 0.7420 0.2415 -0.1543 0.0167 0.1008 86 TYR C N 5632 C CA . TYR D 91 ? 0.3228 0.7210 0.2281 -0.1535 0.0060 0.0949 86 TYR C CA 5633 C C . TYR D 91 ? 0.3293 0.7223 0.2363 -0.1519 0.0025 0.1083 86 TYR C C 5634 O O . TYR D 91 ? 0.3433 0.7427 0.2403 -0.1484 0.0065 0.1223 86 TYR C O 5635 C CB . TYR D 91 ? 0.3266 0.7355 0.2135 -0.1535 0.0028 0.0841 86 TYR C CB 5636 C CG . TYR D 91 ? 0.3262 0.7320 0.2109 -0.1538 0.0074 0.0684 86 TYR C CG 5637 C CD1 . TYR D 91 ? 0.3358 0.7534 0.2154 -0.1521 0.0166 0.0667 86 TYR C CD1 5638 C CD2 . TYR D 91 ? 0.3196 0.7087 0.2063 -0.1548 0.0044 0.0559 86 TYR C CD2 5639 C CE1 . TYR D 91 ? 0.3424 0.7558 0.2208 -0.1496 0.0222 0.0517 86 TYR C CE1 5640 C CE2 . TYR D 91 ? 0.3299 0.7101 0.2132 -0.1522 0.0106 0.0430 86 TYR C CE2 5641 C CZ . TYR D 91 ? 0.3410 0.7335 0.2211 -0.1487 0.0192 0.0403 86 TYR C CZ 5642 O OH . TYR D 91 ? 0.3560 0.7368 0.2340 -0.1433 0.0262 0.0269 86 TYR C OH 5643 N N . TYR D 92 ? 0.3216 0.7027 0.2393 -0.1528 -0.0040 0.1047 87 TYR C N 5644 C CA . TYR D 92 ? 0.3266 0.7014 0.2480 -0.1495 -0.0070 0.1146 87 TYR C CA 5645 C C . TYR D 92 ? 0.3261 0.7045 0.2466 -0.1494 -0.0166 0.1054 87 TYR C C 5646 O O . TYR D 92 ? 0.3114 0.6833 0.2354 -0.1544 -0.0192 0.0928 87 TYR C O 5647 C CB . TYR D 92 ? 0.3192 0.6760 0.2586 -0.1532 -0.0026 0.1174 87 TYR C CB 5648 C CG . TYR D 92 ? 0.3281 0.6807 0.2723 -0.1571 0.0091 0.1255 87 TYR C CG 5649 C CD1 . TYR D 92 ? 0.3500 0.6926 0.2893 -0.1540 0.0175 0.1426 87 TYR C CD1 5650 C CD2 . TYR D 92 ? 0.3200 0.6787 0.2746 -0.1635 0.0131 0.1166 87 TYR C CD2 5651 C CE1 . TYR D 92 ? 0.3661 0.7016 0.3096 -0.1608 0.0314 0.1499 87 TYR C CE1 5652 C CE2 . TYR D 92 ? 0.3290 0.6886 0.2908 -0.1700 0.0253 0.1219 87 TYR C CE2 5653 C CZ . TYR D 92 ? 0.3529 0.6991 0.3088 -0.1704 0.0352 0.1382 87 TYR C CZ 5654 O OH . TYR D 92 ? 0.3700 0.7138 0.3325 -0.1797 0.0502 0.1435 87 TYR C OH 5655 N N . CYS D 93 ? 0.3447 0.7352 0.2598 -0.1431 -0.0209 0.1122 88 CYS C N 5656 C CA . CYS D 93 ? 0.3397 0.7356 0.2596 -0.1437 -0.0283 0.1045 88 CYS C CA 5657 C C . CYS D 93 ? 0.3282 0.7063 0.2629 -0.1403 -0.0267 0.1107 88 CYS C C 5658 O O . CYS D 93 ? 0.3300 0.6935 0.2690 -0.1365 -0.0200 0.1224 88 CYS C O 5659 C CB . CYS D 93 ? 0.3631 0.7904 0.2729 -0.1384 -0.0347 0.1049 88 CYS C CB 5660 S SG . CYS D 93 ? 0.4008 0.8409 0.3035 -0.1203 -0.0340 0.1289 88 CYS C SG 5661 N N . PHE D 94 ? 0.3161 0.6939 0.2580 -0.1435 -0.0311 0.1011 89 PHE C N 5662 C CA . PHE D 94 ? 0.3109 0.6744 0.2660 -0.1412 -0.0296 0.1025 89 PHE C CA 5663 C C . PHE D 94 ? 0.3013 0.6798 0.2601 -0.1406 -0.0351 0.0948 89 PHE C C 5664 O O . PHE D 94 ? 0.2913 0.6778 0.2459 -0.1497 -0.0381 0.0828 89 PHE C O 5665 C CB . PHE D 94 ? 0.3049 0.6499 0.2668 -0.1501 -0.0270 0.0949 89 PHE C CB 5666 C CG . PHE D 94 ? 0.3038 0.6381 0.2772 -0.1511 -0.0262 0.0902 89 PHE C CG 5667 C CD1 . PHE D 94 ? 0.3151 0.6340 0.2979 -0.1480 -0.0196 0.0959 89 PHE C CD1 5668 C CD2 . PHE D 94 ? 0.2960 0.6331 0.2690 -0.1564 -0.0300 0.0794 89 PHE C CD2 5669 C CE1 . PHE D 94 ? 0.3174 0.6265 0.3100 -0.1500 -0.0177 0.0884 89 PHE C CE1 5670 C CE2 . PHE D 94 ? 0.3001 0.6303 0.2815 -0.1577 -0.0287 0.0738 89 PHE C CE2 5671 C CZ . PHE D 94 ? 0.3109 0.6282 0.3026 -0.1544 -0.0230 0.0770 89 PHE C CZ 5672 N N . GLN D 95 ? 0.3028 0.6830 0.2699 -0.1300 -0.0344 0.1013 90 GLN C N 5673 C CA . GLN D 95 ? 0.2944 0.6922 0.2688 -0.1284 -0.0382 0.0934 90 GLN C CA 5674 C C . GLN D 95 ? 0.2927 0.6705 0.2785 -0.1300 -0.0338 0.0881 90 GLN C C 5675 O O . GLN D 95 ? 0.3002 0.6567 0.2922 -0.1234 -0.0277 0.0951 90 GLN C O 5676 C CB . GLN D 95 ? 0.3061 0.7308 0.2819 -0.1116 -0.0416 0.1030 90 GLN C CB 5677 C CG . GLN D 95 ? 0.3238 0.7295 0.3048 -0.0937 -0.0355 0.1195 90 GLN C CG 5678 C CD . GLN D 95 ? 0.3222 0.7220 0.3183 -0.0869 -0.0323 0.1148 90 GLN C CD 5679 O OE1 . GLN D 95 ? 0.3021 0.7233 0.3052 -0.0928 -0.0364 0.1009 90 GLN C OE1 5680 N NE2 . GLN D 95 ? 0.3407 0.7100 0.3418 -0.0753 -0.0232 0.1255 90 GLN C NE2 5681 N N . GLY D 96 ? 0.2832 0.6673 0.2704 -0.1401 -0.0355 0.0749 91 GLY C N 5682 C CA . GLY D 96 ? 0.2820 0.6538 0.2773 -0.1426 -0.0317 0.0674 91 GLY C CA 5683 C C . GLY D 96 ? 0.2821 0.6771 0.2859 -0.1386 -0.0323 0.0610 91 GLY C C 5684 O O . GLY D 96 ? 0.2800 0.6740 0.2861 -0.1458 -0.0297 0.0506 91 GLY C O 5685 N N . SER D 97 ? 0.2852 0.7050 0.2934 -0.1262 -0.0354 0.0672 92 SER C N 5686 C CA . SER D 97 ? 0.2850 0.7367 0.3049 -0.1199 -0.0365 0.0610 92 SER C CA 5687 C C . SER D 97 ? 0.2957 0.7391 0.3284 -0.1006 -0.0314 0.0668 92 SER C C 5688 O O . SER D 97 ? 0.2950 0.7465 0.3383 -0.0992 -0.0278 0.0572 92 SER C O 5689 C CB . SER D 97 ? 0.2874 0.7804 0.3065 -0.1155 -0.0438 0.0627 92 SER C CB 5690 O OG . SER D 97 ? 0.2950 0.8267 0.3291 -0.1057 -0.0453 0.0575 92 SER C OG 5691 N N . HIS D 98 ? 0.3101 0.7347 0.3407 -0.0858 -0.0293 0.0825 93 HIS C N 5692 C CA . HIS D 98 ? 0.3327 0.7438 0.3738 -0.0643 -0.0223 0.0907 93 HIS C CA 5693 C C . HIS D 98 ? 0.3494 0.7096 0.3883 -0.0669 -0.0120 0.0950 93 HIS C C 5694 O O . HIS D 98 ? 0.3580 0.7001 0.3872 -0.0694 -0.0108 0.1062 93 HIS C O 5695 C CB . HIS D 98 ? 0.3510 0.7829 0.3901 -0.0407 -0.0262 0.1092 93 HIS C CB 5696 C CG . HIS D 98 ? 0.3378 0.8289 0.3803 -0.0376 -0.0373 0.1042 93 HIS C CG 5697 N ND1 . HIS D 98 ? 0.3412 0.8684 0.4000 -0.0228 -0.0388 0.0991 93 HIS C ND1 5698 C CD2 . HIS D 98 ? 0.3263 0.8497 0.3590 -0.0477 -0.0467 0.1021 93 HIS C CD2 5699 C CE1 . HIS D 98 ? 0.3295 0.9125 0.3897 -0.0257 -0.0492 0.0932 93 HIS C CE1 5700 N NE2 . HIS D 98 ? 0.3224 0.9023 0.3661 -0.0414 -0.0539 0.0943 93 HIS C NE2 5701 N N . VAL D 99 ? 0.3580 0.6975 0.4065 -0.0680 -0.0034 0.0841 94 VAL C N 5702 C CA . VAL D 99 ? 0.3763 0.6692 0.4258 -0.0720 0.0084 0.0838 94 VAL C CA 5703 C C . VAL D 99 ? 0.4109 0.6790 0.4614 -0.0490 0.0175 0.1036 94 VAL C C 5704 O O . VAL D 99 ? 0.4252 0.7064 0.4826 -0.0259 0.0183 0.1100 94 VAL C O 5705 C CB . VAL D 99 ? 0.3821 0.6638 0.4415 -0.0778 0.0159 0.0641 94 VAL C CB 5706 C CG1 . VAL D 99 ? 0.4098 0.6447 0.4718 -0.0840 0.0297 0.0598 94 VAL C CG1 5707 C CG2 . VAL D 99 ? 0.3535 0.6577 0.4080 -0.0987 0.0082 0.0475 94 VAL C CG2 5708 N N . PRO D 100 ? 0.4273 0.6599 0.4709 -0.0540 0.0256 0.1140 95 PRO C N 5709 C CA . PRO D 100 ? 0.4123 0.6329 0.4504 -0.0788 0.0257 0.1076 95 PRO C CA 5710 C C . PRO D 100 ? 0.3840 0.6352 0.4104 -0.0844 0.0129 0.1143 95 PRO C C 5711 O O . PRO D 100 ? 0.3913 0.6579 0.4099 -0.0693 0.0089 0.1311 95 PRO C O 5712 C CB . PRO D 100 ? 0.4520 0.6259 0.4888 -0.0768 0.0423 0.1197 95 PRO C CB 5713 C CG . PRO D 100 ? 0.4832 0.6512 0.5161 -0.0472 0.0463 0.1426 95 PRO C CG 5714 C CD . PRO D 100 ? 0.4715 0.6714 0.5131 -0.0319 0.0381 0.1352 95 PRO C CD 5715 N N . TYR D 101 ? 0.3544 0.6152 0.3785 -0.1048 0.0069 0.1010 96 TYR C N 5716 C CA . TYR D 101 ? 0.3297 0.6159 0.3430 -0.1108 -0.0034 0.1040 96 TYR C CA 5717 C C . TYR D 101 ? 0.3400 0.6124 0.3456 -0.1111 0.0015 0.1184 96 TYR C C 5718 O O . TYR D 101 ? 0.3593 0.6016 0.3692 -0.1153 0.0131 0.1210 96 TYR C O 5719 C CB . TYR D 101 ? 0.3046 0.6004 0.3167 -0.1289 -0.0095 0.0873 96 TYR C CB 5720 C CG . TYR D 101 ? 0.2954 0.6030 0.3124 -0.1305 -0.0121 0.0738 96 TYR C CG 5721 C CD1 . TYR D 101 ? 0.2940 0.6240 0.3137 -0.1195 -0.0155 0.0750 96 TYR C CD1 5722 C CD2 . TYR D 101 ? 0.2897 0.5910 0.3084 -0.1430 -0.0110 0.0592 96 TYR C CD2 5723 C CE1 . TYR D 101 ? 0.2855 0.6286 0.3103 -0.1224 -0.0160 0.0620 96 TYR C CE1 5724 C CE2 . TYR D 101 ? 0.2834 0.5960 0.3038 -0.1449 -0.0119 0.0476 96 TYR C CE2 5725 C CZ . TYR D 101 ? 0.2807 0.6126 0.3045 -0.1354 -0.0135 0.0489 96 TYR C CZ 5726 O OH . TYR D 101 ? 0.2744 0.6186 0.3001 -0.1393 -0.0126 0.0366 96 TYR C OH 5727 N N . THR D 102 ? 0.3313 0.6264 0.3252 -0.1079 -0.0056 0.1266 97 THR C N 5728 C CA . THR D 102 ? 0.3494 0.6363 0.3330 -0.1039 -0.0001 0.1434 97 THR C CA 5729 C C . THR D 102 ? 0.3334 0.6430 0.3059 -0.1121 -0.0071 0.1412 97 THR C C 5730 O O . THR D 102 ? 0.3125 0.6474 0.2820 -0.1154 -0.0172 0.1309 97 THR C O 5731 C CB . THR D 102 ? 0.3745 0.6647 0.3510 -0.0807 0.0016 0.1638 97 THR C CB 5732 O OG1 . THR D 102 ? 0.3599 0.6884 0.3365 -0.0716 -0.0108 0.1592 97 THR C OG1 5733 C CG2 . THR D 102 ? 0.4049 0.6584 0.3902 -0.0701 0.0146 0.1711 97 THR C CG2 5734 N N . PHE D 103 ? 0.3477 0.6452 0.3144 -0.1164 0.0005 0.1500 98 PHE C N 5735 C CA . PHE D 103 ? 0.3387 0.6530 0.2952 -0.1235 -0.0024 0.1481 98 PHE C CA 5736 C C . PHE D 103 ? 0.3612 0.6863 0.3007 -0.1116 -0.0005 0.1665 98 PHE C C 5737 O O . PHE D 103 ? 0.3891 0.6969 0.3250 -0.1003 0.0078 0.1844 98 PHE C O 5738 C CB . PHE D 103 ? 0.3416 0.6397 0.3051 -0.1374 0.0066 0.1442 98 PHE C CB 5739 C CG . PHE D 103 ? 0.3201 0.6168 0.2973 -0.1493 0.0031 0.1256 98 PHE C CG 5740 C CD1 . PHE D 103 ? 0.3267 0.6043 0.3175 -0.1541 0.0084 0.1197 98 PHE C CD1 5741 C CD2 . PHE D 103 ? 0.2998 0.6134 0.2745 -0.1550 -0.0041 0.1143 98 PHE C CD2 5742 C CE1 . PHE D 103 ? 0.3105 0.5924 0.3113 -0.1644 0.0044 0.1028 98 PHE C CE1 5743 C CE2 . PHE D 103 ? 0.2875 0.6013 0.2717 -0.1627 -0.0075 0.1003 98 PHE C CE2 5744 C CZ . PHE D 103 ? 0.2908 0.5920 0.2875 -0.1675 -0.0042 0.0947 98 PHE C CZ 5745 N N . GLY D 104 ? 0.3536 0.7053 0.2807 -0.1138 -0.0070 0.1623 99 GLY C N 5746 C CA . GLY D 104 ? 0.3766 0.7415 0.2846 -0.1055 -0.0041 0.1778 99 GLY C CA 5747 C C . GLY D 104 ? 0.3954 0.7381 0.3018 -0.1126 0.0102 0.1869 99 GLY C C 5748 O O . GLY D 104 ? 0.3946 0.7187 0.3168 -0.1256 0.0160 0.1772 99 GLY C O 5749 N N . GLY D 105 ? 0.4214 0.7694 0.3088 -0.1043 0.0164 0.2055 100 GLY C N 5750 C CA . GLY D 105 ? 0.4428 0.7702 0.3268 -0.1113 0.0331 0.2169 100 GLY C CA 5751 C C . GLY D 105 ? 0.4269 0.7686 0.3127 -0.1263 0.0355 0.2025 100 GLY C C 5752 O O . GLY D 105 ? 0.4373 0.7659 0.3264 -0.1359 0.0498 0.2071 100 GLY C O 5753 N N . GLY D 106 ? 0.4023 0.7704 0.2861 -0.1282 0.0231 0.1847 101 GLY C N 5754 C CA . GLY D 106 ? 0.3913 0.7715 0.2771 -0.1387 0.0255 0.1703 101 GLY C CA 5755 C C . GLY D 106 ? 0.4096 0.8162 0.2719 -0.1351 0.0261 0.1720 101 GLY C C 5756 O O . GLY D 106 ? 0.4337 0.8455 0.2768 -0.1270 0.0315 0.1912 101 GLY C O 5757 N N . THR D 107 ? 0.4011 0.8231 0.2633 -0.1402 0.0213 0.1517 102 THR C N 5758 C CA . THR D 107 ? 0.4185 0.8651 0.2604 -0.1398 0.0237 0.1467 102 THR C CA 5759 C C . THR D 107 ? 0.4192 0.8647 0.2717 -0.1474 0.0323 0.1333 102 THR C C 5760 O O . THR D 107 ? 0.3994 0.8376 0.2668 -0.1506 0.0279 0.1167 102 THR C O 5761 C CB . THR D 107 ? 0.4120 0.8790 0.2431 -0.1387 0.0114 0.1305 102 THR C CB 5762 O OG1 . THR D 107 ? 0.4189 0.8960 0.2428 -0.1300 0.0025 0.1422 102 THR C OG1 5763 C CG2 . THR D 107 ? 0.4290 0.9217 0.2389 -0.1406 0.0153 0.1199 102 THR C CG2 5764 N N . LYS D 108 ? 0.4449 0.8990 0.2887 -0.1490 0.0452 0.1418 103 LYS C N 5765 C CA . LYS D 108 ? 0.4451 0.9047 0.3006 -0.1547 0.0552 0.1306 103 LYS C CA 5766 C C . LYS D 108 ? 0.4483 0.9284 0.2880 -0.1528 0.0555 0.1136 103 LYS C C 5767 O O . LYS D 108 ? 0.4741 0.9727 0.2893 -0.1510 0.0598 0.1189 103 LYS C O 5768 C CB . LYS D 108 ? 0.4753 0.9349 0.3304 -0.1597 0.0719 0.1474 103 LYS C CB 5769 C CG . LYS D 108 ? 0.4773 0.9460 0.3536 -0.1670 0.0828 0.1358 103 LYS C CG 5770 C CD . LYS D 108 ? 0.4961 0.9565 0.3852 -0.1776 0.0983 0.1499 103 LYS C CD 5771 C CE . LYS D 108 ? 0.4908 0.9692 0.4070 -0.1854 0.1067 0.1346 103 LYS C CE 5772 N NZ . LYS D 108 ? 0.5104 1.0165 0.4158 -0.1823 0.1152 0.1261 103 LYS C NZ 5773 N N . LEU D 109 ? 0.4287 0.9044 0.2805 -0.1525 0.0520 0.0932 104 LEU C N 5774 C CA . LEU D 109 ? 0.4395 0.9272 0.2779 -0.1510 0.0546 0.0739 104 LEU C CA 5775 C C . LEU D 109 ? 0.4468 0.9471 0.2929 -0.1505 0.0693 0.0699 104 LEU C C 5776 O O . LEU D 109 ? 0.4355 0.9309 0.3063 -0.1496 0.0722 0.0682 104 LEU C O 5777 C CB . LEU D 109 ? 0.4283 0.8982 0.2742 -0.1496 0.0466 0.0556 104 LEU C CB 5778 C CG . LEU D 109 ? 0.4468 0.9202 0.2761 -0.1499 0.0496 0.0331 104 LEU C CG 5779 C CD1 . LEU D 109 ? 0.4640 0.9551 0.2689 -0.1551 0.0435 0.0311 104 LEU C CD1 5780 C CD2 . LEU D 109 ? 0.4422 0.8881 0.2813 -0.1480 0.0467 0.0180 104 LEU C CD2 5781 N N . GLU D 110 ? 0.6182 0.8024 0.4199 -0.0063 0.0089 -0.0345 105 GLU C N 5782 C CA . GLU D 110 ? 0.6138 0.7416 0.3997 -0.0335 -0.0024 -0.0336 105 GLU C CA 5783 C C . GLU D 110 ? 0.5602 0.7343 0.3862 -0.0464 -0.0206 -0.0312 105 GLU C C 5784 O O . GLU D 110 ? 0.5502 0.7860 0.3914 -0.0524 -0.0238 -0.0359 105 GLU C O 5785 C CB . GLU D 110 ? 0.7000 0.7390 0.4159 -0.0031 0.0192 -0.0272 105 GLU C CB 5786 C CG . GLU D 110 ? 0.8459 0.7392 0.4408 -0.0054 0.0681 -0.0343 105 GLU C CG 5787 C CD . GLU D 110 ? 1.0122 0.7467 0.4773 0.0466 0.1193 -0.0222 105 GLU C CD 5788 O OE1 . GLU D 110 ? 1.1889 0.7288 0.4892 -0.0055 0.1720 -0.0401 105 GLU C OE1 5789 O OE2 . GLU D 110 ? 0.9993 0.7927 0.4981 0.1300 0.1150 0.0066 105 GLU C OE2 5790 N N . LEU D 111 ? 0.5548 0.7064 0.3776 -0.0593 -0.0234 -0.0222 106 LEU C N 5791 C CA . LEU D 111 ? 0.5575 0.7010 0.3821 -0.0574 -0.0171 -0.0157 106 LEU C CA 5792 C C . LEU D 111 ? 0.5665 0.7017 0.3830 -0.0544 -0.0217 -0.0204 106 LEU C C 5793 O O . LEU D 111 ? 0.5743 0.6954 0.3801 -0.0462 -0.0273 -0.0174 106 LEU C O 5794 C CB . LEU D 111 ? 0.5651 0.7266 0.3928 -0.0412 -0.0067 0.0138 106 LEU C CB 5795 C CG . LEU D 111 ? 0.6196 0.7510 0.4186 -0.0068 0.0260 0.0413 106 LEU C CG 5796 C CD1 . LEU D 111 ? 0.6637 0.7207 0.4180 -0.0331 0.0406 0.0181 106 LEU C CD1 5797 C CD2 . LEU D 111 ? 0.6114 0.8602 0.4365 0.0213 0.0220 0.0887 106 LEU C CD2 5798 N N . LYS D 112 ? 0.5994 0.7217 0.3899 -0.0767 -0.0108 -0.0298 107 LYS C N 5799 C CA . LYS D 112 ? 0.6181 0.7490 0.3914 -0.0876 -0.0166 -0.0334 107 LYS C CA 5800 C C . LYS D 112 ? 0.6520 0.7047 0.3996 -0.0778 0.0084 -0.0256 107 LYS C C 5801 O O . LYS D 112 ? 0.7034 0.6925 0.4180 -0.0631 0.0454 -0.0151 107 LYS C O 5802 C CB . LYS D 112 ? 0.6693 0.8509 0.3999 -0.1522 -0.0125 -0.0512 107 LYS C CB 5803 C CG . LYS D 112 ? 0.6626 0.9823 0.4030 -0.1617 -0.0400 -0.0419 107 LYS C CG 5804 C CD . LYS D 112 ? 0.7093 1.1598 0.4114 -0.2555 -0.0395 -0.0578 107 LYS C CD 5805 C CE . LYS D 112 ? 0.7199 1.3795 0.4234 -0.2830 -0.0679 -0.0376 107 LYS C CE 5806 N NZ . LYS D 112 ? 0.7712 1.6392 0.4369 -0.4031 -0.0713 -0.0505 107 LYS C NZ 5807 N N . ARG D 113 ? 0.6446 0.7016 0.3953 -0.0713 -0.0024 -0.0223 108 ARG C N 5808 C CA . ARG D 113 ? 0.6763 0.6880 0.4054 -0.0615 0.0244 -0.0136 108 ARG C CA 5809 C C . ARG D 113 ? 0.6940 0.6951 0.3963 -0.0836 0.0125 -0.0232 108 ARG C C 5810 O O . ARG D 113 ? 0.6843 0.7274 0.3901 -0.0846 -0.0174 -0.0232 108 ARG C O 5811 C CB . ARG D 113 ? 0.6411 0.7161 0.4114 -0.0352 0.0249 0.0106 108 ARG C CB 5812 C CG . ARG D 113 ? 0.6207 0.7241 0.3922 -0.0648 -0.0034 0.0027 108 ARG C CG 5813 C CD . ARG D 113 ? 0.6295 0.8089 0.3986 -0.0935 0.0028 0.0153 108 ARG C CD 5814 N NE . ARG D 113 ? 0.6470 0.8120 0.4040 -0.0881 0.0186 0.0168 108 ARG C NE 5815 C CZ . ARG D 113 ? 0.6472 0.9116 0.4306 -0.0663 0.0444 0.0446 108 ARG C CZ 5816 N NH1 . ARG D 113 ? 0.6256 1.0536 0.4577 -0.0369 0.0551 0.0860 108 ARG C NH1 5817 N NH2 . ARG D 113 ? 0.6817 0.9040 0.4398 -0.0647 0.0638 0.0394 108 ARG C NH2 5818 N N . ALA D 114 ? 0.7414 0.6882 0.4067 -0.0859 0.0443 -0.0224 109 ALA C N 5819 C CA . ALA D 114 ? 0.7598 0.6921 0.3932 -0.1103 0.0351 -0.0298 109 ALA C CA 5820 C C . ALA D 114 ? 0.7219 0.6852 0.3757 -0.0974 0.0044 -0.0216 109 ALA C C 5821 O O . ALA D 114 ? 0.7019 0.6887 0.3790 -0.0915 0.0069 -0.0149 109 ALA C O 5822 C CB . ALA D 114 ? 0.8261 0.6922 0.4186 -0.1030 0.0851 -0.0270 109 ALA C CB 5823 N N . ASP D 115 ? 0.7520 0.7098 0.3677 -0.1002 -0.0151 -0.0183 110 ASP C N 5824 C CA . ASP D 115 ? 0.8008 0.7054 0.3682 -0.0825 -0.0178 -0.0079 110 ASP C CA 5825 C C . ASP D 115 ? 0.8229 0.6900 0.3681 -0.1213 0.0031 -0.0192 110 ASP C C 5826 O O . ASP D 115 ? 0.8038 0.6974 0.3727 -0.1359 0.0182 -0.0242 110 ASP C O 5827 C CB . ASP D 115 ? 0.8627 0.7746 0.3763 -0.0532 -0.0315 0.0155 110 ASP C CB 5828 C CG . ASP D 115 ? 0.8598 0.8699 0.3939 0.0045 -0.0470 0.0451 110 ASP C CG 5829 O OD1 . ASP D 115 ? 0.8086 0.8481 0.3934 0.0087 -0.0466 0.0360 110 ASP C OD1 5830 O OD2 . ASP D 115 ? 0.9166 1.0005 0.4161 0.0539 -0.0573 0.0857 110 ASP C OD2 5831 N N . ALA D 116 ? 0.6690 1.0269 0.3974 -0.2486 0.0790 -0.0550 111 ALA C N 5832 C CA . ALA D 116 ? 0.6731 1.0121 0.3861 -0.2420 0.1058 -0.0722 111 ALA C CA 5833 C C . ALA D 116 ? 0.6593 1.0128 0.3515 -0.2328 0.0990 -0.0518 111 ALA C C 5834 O O . ALA D 116 ? 0.6202 0.9973 0.3386 -0.2149 0.0840 -0.0249 111 ALA C O 5835 C CB . ALA D 116 ? 0.6341 0.9672 0.4032 -0.2187 0.1236 -0.0767 111 ALA C CB 5836 N N . ALA D 117 ? 0.6970 1.0333 0.3425 -0.2464 0.1132 -0.0654 112 ALA C N 5837 C CA . ALA D 117 ? 0.6913 1.0367 0.3154 -0.2404 0.1078 -0.0464 112 ALA C CA 5838 C C . ALA D 117 ? 0.6414 0.9898 0.3079 -0.2114 0.1243 -0.0430 112 ALA C C 5839 O O . ALA D 117 ? 0.6298 0.9659 0.3287 -0.2033 0.1455 -0.0610 112 ALA C O 5840 C CB . ALA D 117 ? 0.7577 1.0806 0.3106 -0.2697 0.1185 -0.0608 112 ALA C CB 5841 N N . PRO D 118 ? 0.6137 0.9770 0.2849 -0.1968 0.1122 -0.0183 113 PRO C N 5842 C CA . PRO D 118 ? 0.5791 0.9406 0.2805 -0.1747 0.1243 -0.0157 113 PRO C CA 5843 C C . PRO D 118 ? 0.6034 0.9481 0.2882 -0.1821 0.1480 -0.0316 113 PRO C C 5844 O O . PRO D 118 ? 0.6478 0.9853 0.2842 -0.2020 0.1515 -0.0343 113 PRO C O 5845 C CB . PRO D 118 ? 0.5603 0.9368 0.2646 -0.1615 0.1071 0.0118 113 PRO C CB 5846 C CG . PRO D 118 ? 0.5932 0.9782 0.2656 -0.1798 0.0881 0.0247 113 PRO C CG 5847 C CD . PRO D 118 ? 0.6182 0.9994 0.2769 -0.1998 0.0853 0.0091 113 PRO C CD 5848 N N . THR D 119 ? 0.5823 0.9206 0.3093 -0.1686 0.1633 -0.0403 114 THR C N 5849 C CA . THR D 119 ? 0.5955 0.9226 0.3272 -0.1709 0.1870 -0.0510 114 THR C CA 5850 C C . THR D 119 ? 0.5725 0.9068 0.3056 -0.1577 0.1749 -0.0288 114 THR C C 5851 O O . THR D 119 ? 0.5393 0.8780 0.3046 -0.1400 0.1617 -0.0171 114 THR C O 5852 C CB . THR D 119 ? 0.5810 0.9005 0.3754 -0.1621 0.2038 -0.0658 114 THR C CB 5853 O OG1 . THR D 119 ? 0.6016 0.9123 0.4017 -0.1719 0.2127 -0.0851 114 THR C OG1 5854 C CG2 . THR D 119 ? 0.5972 0.9077 0.4113 -0.1653 0.2328 -0.0776 114 THR C CG2 5855 N N . VAL D 120 ? 0.5945 0.9263 0.2869 -0.1691 0.1784 -0.0226 115 VAL C N 5856 C CA . VAL D 120 ? 0.5774 0.9129 0.2692 -0.1587 0.1665 -0.0011 115 VAL C CA 5857 C C . VAL D 120 ? 0.5796 0.9062 0.2894 -0.1588 0.1869 -0.0063 115 VAL C C 5858 O O . VAL D 120 ? 0.6187 0.9363 0.3124 -0.1755 0.2129 -0.0210 115 VAL C O 5859 C CB . VAL D 120 ? 0.6071 0.9468 0.2517 -0.1704 0.1500 0.0180 115 VAL C CB 5860 C CG1 . VAL D 120 ? 0.5887 0.9309 0.2462 -0.1553 0.1362 0.0414 115 VAL C CG1 5861 C CG2 . VAL D 120 ? 0.6082 0.9591 0.2431 -0.1748 0.1299 0.0235 115 VAL C CG2 5862 N N . SER D 121 ? 0.5449 0.8719 0.2862 -0.1425 0.1764 0.0054 116 SER C N 5863 C CA . SER D 121 ? 0.5405 0.8611 0.3080 -0.1421 0.1892 0.0053 116 SER C CA 5864 C C . SER D 121 ? 0.5279 0.8449 0.2920 -0.1325 0.1711 0.0250 116 SER C C 5865 O O . SER D 121 ? 0.5087 0.8245 0.2790 -0.1192 0.1518 0.0325 116 SER C O 5866 C CB . SER D 121 ? 0.5192 0.8393 0.3487 -0.1338 0.1925 -0.0038 116 SER C CB 5867 O OG . SER D 121 ? 0.5286 0.8494 0.3734 -0.1399 0.2101 -0.0229 116 SER C OG 5868 N N . ILE D 122 ? 0.5417 0.8533 0.2964 -0.1405 0.1807 0.0319 117 ILE C N 5869 C CA . ILE D 122 ? 0.5364 0.8402 0.2897 -0.1335 0.1663 0.0498 117 ILE C CA 5870 C C . ILE D 122 ? 0.5277 0.8243 0.3231 -0.1329 0.1724 0.0480 117 ILE C C 5871 O O . ILE D 122 ? 0.5328 0.8333 0.3549 -0.1415 0.1936 0.0374 117 ILE C O 5872 C CB . ILE D 122 ? 0.5689 0.8709 0.2792 -0.1447 0.1650 0.0664 117 ILE C CB 5873 C CG1 . ILE D 122 ? 0.5661 0.8582 0.2832 -0.1338 0.1481 0.0858 117 ILE C CG1 5874 C CG2 . ILE D 122 ? 0.6052 0.9033 0.2980 -0.1657 0.1906 0.0624 117 ILE C CG2 5875 C CD1 . ILE D 122 ? 0.5951 0.8878 0.2815 -0.1405 0.1362 0.1087 117 ILE C CD1 5876 N N . PHE D 123 ? 0.5168 0.8016 0.3232 -0.1235 0.1542 0.0571 118 PHE C N 5877 C CA . PHE D 123 ? 0.5129 0.7896 0.3612 -0.1252 0.1518 0.0575 118 PHE C CA 5878 C C . PHE D 123 ? 0.5265 0.7855 0.3646 -0.1240 0.1412 0.0706 118 PHE C C 5879 O O . PHE D 123 ? 0.5280 0.7729 0.3467 -0.1146 0.1256 0.0734 118 PHE C O 5880 C CB . PHE D 123 ? 0.4944 0.7671 0.3702 -0.1190 0.1333 0.0520 118 PHE C CB 5881 C CG . PHE D 123 ? 0.4803 0.7680 0.3802 -0.1195 0.1422 0.0409 118 PHE C CG 5882 C CD1 . PHE D 123 ? 0.4736 0.7666 0.3441 -0.1145 0.1404 0.0358 118 PHE C CD1 5883 C CD2 . PHE D 123 ? 0.4761 0.7720 0.4361 -0.1248 0.1539 0.0359 118 PHE C CD2 5884 C CE1 . PHE D 123 ? 0.4656 0.7688 0.3605 -0.1157 0.1491 0.0249 118 PHE C CE1 5885 C CE2 . PHE D 123 ? 0.4678 0.7740 0.4592 -0.1242 0.1647 0.0248 118 PHE C CE2 5886 C CZ . PHE D 123 ? 0.4627 0.7709 0.4184 -0.1200 0.1617 0.0187 118 PHE C CZ 5887 N N . PRO D 124 ? 0.5415 0.7987 0.3943 -0.1341 0.1531 0.0776 119 PRO C N 5888 C CA . PRO D 124 ? 0.5577 0.7949 0.4087 -0.1341 0.1425 0.0902 119 PRO C CA 5889 C C . PRO D 124 ? 0.5533 0.7723 0.4270 -0.1307 0.1207 0.0857 119 PRO C C 5890 O O . PRO D 124 ? 0.5376 0.7633 0.4364 -0.1313 0.1136 0.0775 119 PRO C O 5891 C CB . PRO D 124 ? 0.5755 0.8174 0.4464 -0.1491 0.1628 0.0976 119 PRO C CB 5892 C CG . PRO D 124 ? 0.5792 0.8410 0.4430 -0.1575 0.1892 0.0880 119 PRO C CG 5893 C CD . PRO D 124 ? 0.5519 0.8227 0.4260 -0.1473 0.1810 0.0729 119 PRO C CD 5894 N N . PRO D 125 ? 0.5751 0.7676 0.4390 -0.1295 0.1087 0.0917 120 PRO C N 5895 C CA . PRO D 125 ? 0.5885 0.7550 0.4612 -0.1328 0.0865 0.0861 120 PRO C CA 5896 C C . PRO D 125 ? 0.5863 0.7614 0.5135 -0.1460 0.0797 0.0886 120 PRO C C 5897 O O . PRO D 125 ? 0.5827 0.7735 0.5427 -0.1528 0.0973 0.0962 120 PRO C O 5898 C CB . PRO D 125 ? 0.6180 0.7533 0.4753 -0.1322 0.0836 0.0919 120 PRO C CB 5899 C CG . PRO D 125 ? 0.6161 0.7617 0.4540 -0.1227 0.0991 0.1015 120 PRO C CG 5900 C CD . PRO D 125 ? 0.5950 0.7766 0.4386 -0.1270 0.1141 0.1049 120 PRO C CD 5901 N N . SER D 126 ? 0.5930 0.7569 0.5314 -0.1515 0.0541 0.0843 121 SER C N 5902 C CA . SER D 126 ? 0.5946 0.7654 0.5978 -0.1651 0.0389 0.0912 121 SER C CA 5903 C C . SER D 126 ? 0.6248 0.7713 0.6373 -0.1764 0.0287 0.0980 121 SER C C 5904 O O . SER D 126 ? 0.6473 0.7629 0.6098 -0.1739 0.0267 0.0942 121 SER C O 5905 C CB . SER D 126 ? 0.6029 0.7641 0.6094 -0.1715 0.0052 0.0902 121 SER C CB 5906 O OG . SER D 126 ? 0.6452 0.7630 0.6029 -0.1819 -0.0228 0.0874 121 SER C OG 5907 N N . SER D 127 ? 0.6274 0.7875 0.7117 -0.1886 0.0246 0.1081 122 SER C N 5908 C CA . SER D 127 ? 0.6590 0.7965 0.7622 -0.2027 0.0112 0.1161 122 SER C CA 5909 C C . SER D 127 ? 0.7025 0.7975 0.7732 -0.2158 -0.0323 0.1120 122 SER C C 5910 O O . SER D 127 ? 0.7374 0.7963 0.7814 -0.2238 -0.0408 0.1101 122 SER C O 5911 C CB . SER D 127 ? 0.6478 0.8139 0.8467 -0.2138 0.0193 0.1291 122 SER C CB 5912 O OG . SER D 127 ? 0.6347 0.8200 0.8948 -0.2183 -0.0009 0.1329 122 SER C OG 5913 N N . GLU D 128 ? 0.7090 0.8043 0.7780 -0.2205 -0.0596 0.1108 123 GLU C N 5914 C CA . GLU D 128 ? 0.7660 0.8147 0.7822 -0.2383 -0.1017 0.1061 123 GLU C CA 5915 C C . GLU D 128 ? 0.7986 0.8061 0.7180 -0.2306 -0.0874 0.0872 123 GLU C C 5916 O O . GLU D 128 ? 0.8533 0.8116 0.7276 -0.2457 -0.1044 0.0786 123 GLU C O 5917 C CB . GLU D 128 ? 0.7697 0.8250 0.7891 -0.2453 -0.1322 0.1115 123 GLU C CB 5918 C CG . GLU D 128 ? 0.7496 0.8416 0.8797 -0.2541 -0.1529 0.1326 123 GLU C CG 5919 C CD . GLU D 128 ? 0.6950 0.8371 0.8831 -0.2334 -0.1192 0.1341 123 GLU C CD 5920 O OE1 . GLU D 128 ? 0.6883 0.8478 0.9297 -0.2369 -0.1417 0.1460 123 GLU C OE1 5921 O OE2 . GLU D 128 ? 0.6677 0.8282 0.8469 -0.2157 -0.0718 0.1240 123 GLU C OE2 5922 N N . GLN D 129 ? 0.7700 0.7961 0.6621 -0.2081 -0.0547 0.0800 124 GLN C N 5923 C CA . GLN D 129 ? 0.7992 0.7914 0.6180 -0.1981 -0.0372 0.0640 124 GLN C CA 5924 C C . GLN D 129 ? 0.8160 0.7899 0.6405 -0.1946 -0.0206 0.0644 124 GLN C C 5925 O O . GLN D 129 ? 0.8637 0.7895 0.6420 -0.1979 -0.0198 0.0509 124 GLN C O 5926 C CB . GLN D 129 ? 0.7615 0.7812 0.5610 -0.1759 -0.0097 0.0600 124 GLN C CB 5927 C CG . GLN D 129 ? 0.7949 0.7779 0.5280 -0.1678 0.0050 0.0437 124 GLN C CG 5928 C CD . GLN D 129 ? 0.7592 0.7708 0.4841 -0.1460 0.0317 0.0426 124 GLN C CD 5929 O OE1 . GLN D 129 ? 0.7100 0.7660 0.4711 -0.1365 0.0420 0.0535 124 GLN C OE1 5930 N NE2 . GLN D 129 ? 0.7897 0.7732 0.4659 -0.1401 0.0449 0.0284 124 GLN C NE2 5931 N N . LEU D 130 ? 0.7826 0.7922 0.6626 -0.1889 -0.0046 0.0795 125 LEU C N 5932 C CA . LEU D 130 ? 0.7985 0.7940 0.6919 -0.1882 0.0084 0.0866 125 LEU C CA 5933 C C . LEU D 130 ? 0.8532 0.8039 0.7490 -0.2091 -0.0164 0.0832 125 LEU C C 5934 O O . LEU D 130 ? 0.8895 0.8010 0.7639 -0.2082 -0.0099 0.0776 125 LEU C O 5935 C CB . LEU D 130 ? 0.7601 0.8001 0.7067 -0.1859 0.0287 0.1051 125 LEU C CB 5936 C CG . LEU D 130 ? 0.7256 0.7992 0.6554 -0.1686 0.0550 0.1077 125 LEU C CG 5937 C CD1 . LEU D 130 ? 0.7012 0.8145 0.6726 -0.1735 0.0762 0.1209 125 LEU C CD1 5938 C CD2 . LEU D 130 ? 0.7404 0.7948 0.6353 -0.1555 0.0671 0.1103 125 LEU C CD2 5939 N N . THR D 131 ? 0.8647 0.8189 0.7898 -0.2289 -0.0469 0.0872 126 THR C N 5940 C CA . THR D 131 ? 0.9237 0.8337 0.8482 -0.2546 -0.0794 0.0846 126 THR C CA 5941 C C . THR D 131 ? 0.9923 0.8369 0.8293 -0.2603 -0.0850 0.0601 126 THR C C 5942 O O . THR D 131 ? 1.0448 0.8414 0.8669 -0.2737 -0.0919 0.0522 126 THR C O 5943 C CB . THR D 131 ? 0.9260 0.8513 0.8938 -0.2763 -0.1197 0.0954 126 THR C CB 5944 O OG1 . THR D 131 ? 0.8720 0.8550 0.9329 -0.2710 -0.1064 0.1153 126 THR C OG1 5945 C CG2 . THR D 131 ? 0.9923 0.8689 0.9541 -0.3083 -0.1610 0.0942 126 THR C CG2 5946 N N . SER D 132 ? 0.9973 0.8379 0.7776 -0.2510 -0.0778 0.0468 127 SER C N 5947 C CA . SER D 132 ? 1.0677 0.8460 0.7609 -0.2564 -0.0730 0.0203 127 SER C CA 5948 C C . SER D 132 ? 1.0709 0.8333 0.7520 -0.2319 -0.0304 0.0095 127 SER C C 5949 O O . SER D 132 ? 1.1282 0.8393 0.7477 -0.2325 -0.0151 -0.0149 127 SER C O 5950 C CB . SER D 132 ? 1.0721 0.8534 0.7124 -0.2576 -0.0787 0.0125 127 SER C CB 5951 O OG . SER D 132 ? 1.0807 0.8712 0.7333 -0.2818 -0.1232 0.0256 127 SER C OG 5952 N N . GLY D 133 ? 1.0168 0.8219 0.7571 -0.2115 -0.0102 0.0285 128 GLY C N 5953 C CA . GLY D 133 ? 1.0206 0.8134 0.7661 -0.1900 0.0221 0.0272 128 GLY C CA 5954 C C . GLY D 133 ? 0.9926 0.8092 0.7215 -0.1656 0.0477 0.0239 128 GLY C C 5955 O O . GLY D 133 ? 1.0018 0.8052 0.7373 -0.1475 0.0728 0.0221 128 GLY C O 5956 N N . GLY D 134 ? 0.9599 0.8109 0.6751 -0.1656 0.0400 0.0247 129 GLY C N 5957 C CA . GLY D 134 ? 0.9260 0.8075 0.6329 -0.1446 0.0610 0.0248 129 GLY C CA 5958 C C . GLY D 134 ? 0.8592 0.8047 0.6086 -0.1357 0.0615 0.0471 129 GLY C C 5959 O O . GLY D 134 ? 0.8409 0.8083 0.6197 -0.1477 0.0461 0.0578 129 GLY C O 5960 N N . ALA D 135 ? 0.8292 0.8028 0.5838 -0.1166 0.0804 0.0534 130 ALA C N 5961 C CA . ALA D 135 ? 0.7753 0.8028 0.5562 -0.1115 0.0832 0.0710 130 ALA C CA 5962 C C . ALA D 135 ? 0.7510 0.8023 0.5161 -0.0984 0.0932 0.0673 130 ALA C C 5963 O O . ALA D 135 ? 0.7590 0.8078 0.5253 -0.0841 0.1068 0.0700 130 ALA C O 5964 C CB . ALA D 135 ? 0.7721 0.8101 0.5822 -0.1077 0.0912 0.0924 130 ALA C CB 5965 N N . SER D 136 ? 0.7260 0.7997 0.4844 -0.1037 0.0855 0.0625 131 SER C N 5966 C CA . SER D 136 ? 0.6990 0.7979 0.4461 -0.0939 0.0934 0.0601 131 SER C CA 5967 C C . SER D 136 ? 0.6571 0.7999 0.4262 -0.0948 0.0958 0.0708 131 SER C C 5968 O O . SER D 136 ? 0.6461 0.8009 0.4347 -0.1052 0.0896 0.0715 131 SER C O 5969 C CB . SER D 136 ? 0.7103 0.7952 0.4279 -0.1007 0.0839 0.0459 131 SER C CB 5970 O OG . SER D 136 ? 0.7620 0.8023 0.4431 -0.1015 0.0898 0.0318 131 SER C OG 5971 N N . VAL D 137 ? 0.6395 0.8041 0.4076 -0.0854 0.1055 0.0786 132 VAL C N 5972 C CA . VAL D 137 ? 0.6113 0.8112 0.3849 -0.0894 0.1098 0.0847 132 VAL C CA 5973 C C . VAL D 137 ? 0.5919 0.8063 0.3548 -0.0839 0.1103 0.0759 132 VAL C C 5974 O O . VAL D 137 ? 0.5954 0.8057 0.3507 -0.0737 0.1130 0.0759 132 VAL C O 5975 C CB . VAL D 137 ? 0.6177 0.8289 0.3908 -0.0890 0.1137 0.1036 132 VAL C CB 5976 C CG1 . VAL D 137 ? 0.6117 0.8487 0.3770 -0.1019 0.1203 0.1068 132 VAL C CG1 5977 C CG2 . VAL D 137 ? 0.6410 0.8292 0.4253 -0.0909 0.1121 0.1152 132 VAL C CG2 5978 N N . VAL D 138 ? 0.5726 0.8032 0.3426 -0.0907 0.1099 0.0687 133 VAL C N 5979 C CA . VAL D 138 ? 0.5574 0.7983 0.3217 -0.0879 0.1083 0.0605 133 VAL C CA 5980 C C . VAL D 138 ? 0.5452 0.8136 0.3120 -0.0917 0.1164 0.0603 133 VAL C C 5981 O O . VAL D 138 ? 0.5431 0.8203 0.3211 -0.1009 0.1247 0.0587 133 VAL C O 5982 C CB . VAL D 138 ? 0.5534 0.7849 0.3297 -0.0942 0.0971 0.0531 133 VAL C CB 5983 C CG1 . VAL D 138 ? 0.5393 0.7827 0.3147 -0.0931 0.0951 0.0480 133 VAL C CG1 5984 C CG2 . VAL D 138 ? 0.5816 0.7786 0.3392 -0.0961 0.0855 0.0512 133 VAL C CG2 5985 N N . CYS D 139 ? 0.5445 0.8239 0.3006 -0.0865 0.1162 0.0603 134 CYS C N 5986 C CA . CYS D 139 ? 0.5473 0.8482 0.2995 -0.0930 0.1208 0.0579 134 CYS C CA 5987 C C . CYS D 139 ? 0.5238 0.8297 0.2822 -0.0905 0.1184 0.0486 134 CYS C C 5988 O O . CYS D 139 ? 0.5190 0.8185 0.2730 -0.0827 0.1142 0.0503 134 CYS C O 5989 C CB . CYS D 139 ? 0.5727 0.8839 0.3117 -0.0926 0.1170 0.0722 134 CYS C CB 5990 S SG . CYS D 139 ? 0.6115 0.9403 0.3277 -0.1111 0.1195 0.0714 134 CYS C SG 5991 N N . PHE D 140 ? 0.5099 0.8241 0.2801 -0.0982 0.1242 0.0383 135 PHE C N 5992 C CA . PHE D 140 ? 0.4927 0.8117 0.2728 -0.0975 0.1214 0.0317 135 PHE C CA 5993 C C . PHE D 140 ? 0.4948 0.8289 0.2630 -0.1051 0.1270 0.0272 135 PHE C C 5994 O O . PHE D 140 ? 0.5081 0.8448 0.2658 -0.1163 0.1377 0.0212 135 PHE C O 5995 C CB . PHE D 140 ? 0.4858 0.8000 0.3009 -0.1009 0.1223 0.0236 135 PHE C CB 5996 C CG . PHE D 140 ? 0.4881 0.7860 0.3162 -0.0984 0.1081 0.0303 135 PHE C CG 5997 C CD1 . PHE D 140 ? 0.4983 0.7811 0.2985 -0.0944 0.0960 0.0372 135 PHE C CD1 5998 C CD2 . PHE D 140 ? 0.4879 0.7832 0.3573 -0.1027 0.1074 0.0293 135 PHE C CD2 5999 C CE1 . PHE D 140 ? 0.5131 0.7741 0.3122 -0.0980 0.0800 0.0421 135 PHE C CE1 6000 C CE2 . PHE D 140 ? 0.4971 0.7763 0.3786 -0.1046 0.0872 0.0381 135 PHE C CE2 6001 C CZ . PHE D 140 ? 0.5125 0.7723 0.3518 -0.1040 0.0716 0.0441 135 PHE C CZ 6002 N N . LEU D 141 ? 0.4836 0.8250 0.2501 -0.1020 0.1204 0.0298 136 LEU C N 6003 C CA . LEU D 141 ? 0.4892 0.8435 0.2474 -0.1117 0.1205 0.0258 136 LEU C CA 6004 C C . LEU D 141 ? 0.4744 0.8280 0.2532 -0.1110 0.1199 0.0182 136 LEU C C 6005 O O . LEU D 141 ? 0.4653 0.8206 0.2491 -0.1041 0.1135 0.0263 136 LEU C O 6006 C CB . LEU D 141 ? 0.4938 0.8609 0.2423 -0.1095 0.1100 0.0418 136 LEU C CB 6007 C CG . LEU D 141 ? 0.5075 0.8727 0.2451 -0.1075 0.1067 0.0556 136 LEU C CG 6008 C CD1 . LEU D 141 ? 0.4980 0.8511 0.2484 -0.0911 0.1089 0.0616 136 LEU C CD1 6009 C CD2 . LEU D 141 ? 0.5245 0.9057 0.2584 -0.1135 0.0922 0.0729 136 LEU C CD2 6010 N N . ASN D 142 ? 0.4798 0.8284 0.2735 -0.1188 0.1294 0.0028 137 ASN C N 6011 C CA . ASN D 142 ? 0.4698 0.8132 0.2953 -0.1168 0.1272 -0.0013 137 ASN C CA 6012 C C . ASN D 142 ? 0.4800 0.8259 0.3096 -0.1274 0.1322 -0.0139 137 ASN C C 6013 O O . ASN D 142 ? 0.4999 0.8446 0.3101 -0.1402 0.1436 -0.0279 137 ASN C O 6014 C CB . ASN D 142 ? 0.4669 0.7991 0.3298 -0.1143 0.1322 -0.0060 137 ASN C CB 6015 C CG . ASN D 142 ? 0.4618 0.7869 0.3234 -0.1063 0.1194 0.0083 137 ASN C CG 6016 O OD1 . ASN D 142 ? 0.4622 0.7852 0.2967 -0.1016 0.1091 0.0196 137 ASN C OD1 6017 N ND2 . ASN D 142 ? 0.4622 0.7812 0.3560 -0.1063 0.1216 0.0070 137 ASN C ND2 6018 N N . ASN D 143 ? 0.4716 0.8174 0.3205 -0.1248 0.1234 -0.0083 138 ASN C N 6019 C CA . ASN D 143 ? 0.4827 0.8266 0.3466 -0.1344 0.1263 -0.0196 138 ASN C CA 6020 C C . ASN D 143 ? 0.5018 0.8550 0.3336 -0.1480 0.1250 -0.0253 138 ASN C C 6021 O O . ASN D 143 ? 0.5281 0.8719 0.3523 -0.1627 0.1355 -0.0454 138 ASN C O 6022 C CB . ASN D 143 ? 0.4948 0.8235 0.3957 -0.1379 0.1425 -0.0387 138 ASN C CB 6023 C CG . ASN D 143 ? 0.4807 0.8020 0.4266 -0.1268 0.1360 -0.0276 138 ASN C CG 6024 O OD1 . ASN D 143 ? 0.4805 0.7996 0.4382 -0.1231 0.1425 -0.0290 138 ASN C OD1 6025 N ND2 . ASN D 143 ? 0.4752 0.7919 0.4470 -0.1242 0.1206 -0.0140 138 ASN C ND2 6026 N N . PHE D 144 ? 0.4958 0.8653 0.3118 -0.1446 0.1120 -0.0073 139 PHE C N 6027 C CA . PHE D 144 ? 0.5154 0.8978 0.3114 -0.1584 0.1018 -0.0046 139 PHE C CA 6028 C C . PHE D 144 ? 0.5100 0.9046 0.3298 -0.1590 0.0917 0.0059 139 PHE C C 6029 O O . PHE D 144 ? 0.4897 0.8835 0.3327 -0.1473 0.0941 0.0150 139 PHE C O 6030 C CB . PHE D 144 ? 0.5170 0.9118 0.2911 -0.1557 0.0932 0.0114 139 PHE C CB 6031 C CG . PHE D 144 ? 0.4895 0.8924 0.2819 -0.1357 0.0921 0.0302 139 PHE C CG 6032 C CD1 . PHE D 144 ? 0.4790 0.8696 0.2683 -0.1232 0.1007 0.0298 139 PHE C CD1 6033 C CD2 . PHE D 144 ? 0.4833 0.9041 0.2967 -0.1314 0.0846 0.0470 139 PHE C CD2 6034 C CE1 . PHE D 144 ? 0.4679 0.8582 0.2640 -0.1085 0.1024 0.0428 139 PHE C CE1 6035 C CE2 . PHE D 144 ? 0.4707 0.8934 0.2984 -0.1144 0.0918 0.0598 139 PHE C CE2 6036 C CZ . PHE D 144 ? 0.4660 0.8705 0.2792 -0.1039 0.1011 0.0560 139 PHE C CZ 6037 N N . TYR D 145 ? 0.5356 0.9397 0.3464 -0.1764 0.0793 0.0058 140 TYR C N 6038 C CA . TYR D 145 ? 0.5338 0.9534 0.3728 -0.1807 0.0681 0.0175 140 TYR C CA 6039 C C . TYR D 145 ? 0.5649 0.9993 0.3907 -0.2009 0.0461 0.0248 140 TYR C C 6040 O O . TYR D 145 ? 0.6018 1.0215 0.3872 -0.2214 0.0419 0.0089 140 TYR C O 6041 C CB . TYR D 145 ? 0.5386 0.9426 0.3964 -0.1876 0.0743 0.0027 140 TYR C CB 6042 C CG . TYR D 145 ? 0.5316 0.9518 0.4231 -0.1907 0.0653 0.0181 140 TYR C CG 6043 C CD1 . TYR D 145 ? 0.5533 0.9847 0.4482 -0.2111 0.0479 0.0192 140 TYR C CD1 6044 C CD2 . TYR D 145 ? 0.5090 0.9323 0.4260 -0.1761 0.0735 0.0331 140 TYR C CD2 6045 C CE1 . TYR D 145 ? 0.5470 0.9962 0.4823 -0.2144 0.0406 0.0353 140 TYR C CE1 6046 C CE2 . TYR D 145 ? 0.5076 0.9457 0.4563 -0.1802 0.0705 0.0480 140 TYR C CE2 6047 C CZ . TYR D 145 ? 0.5230 0.9762 0.4869 -0.1979 0.0549 0.0494 140 TYR C CZ 6048 O OH . TYR D 145 ? 0.5202 0.9904 0.5248 -0.2021 0.0535 0.0660 140 TYR C OH 6049 N N . PRO D 146 ? 0.5595 1.0212 0.4203 -0.1976 0.0322 0.0496 141 PRO C N 6050 C CA . PRO D 146 ? 0.5295 1.0058 0.4347 -0.1775 0.0437 0.0661 141 PRO C CA 6051 C C . PRO D 146 ? 0.5168 0.9916 0.4181 -0.1553 0.0576 0.0739 141 PRO C C 6052 O O . PRO D 146 ? 0.5270 0.9918 0.3968 -0.1542 0.0566 0.0684 141 PRO C O 6053 C CB . PRO D 146 ? 0.5346 1.0415 0.4832 -0.1860 0.0249 0.0883 141 PRO C CB 6054 C CG . PRO D 146 ? 0.5635 1.0750 0.4867 -0.2042 -0.0021 0.0931 141 PRO C CG 6055 C CD . PRO D 146 ? 0.5879 1.0672 0.4471 -0.2178 0.0029 0.0643 141 PRO C CD 6056 N N . LYS D 147 ? 0.5056 0.9868 0.4357 -0.1402 0.0731 0.0853 142 LYS C N 6057 C CA . LYS D 147 ? 0.5029 0.9741 0.4244 -0.1214 0.0906 0.0882 142 LYS C CA 6058 C C . LYS D 147 ? 0.5006 0.9860 0.4378 -0.1134 0.0854 0.1026 142 LYS C C 6059 O O . LYS D 147 ? 0.4958 0.9675 0.4166 -0.1012 0.0955 0.1007 142 LYS C O 6060 C CB . LYS D 147 ? 0.5118 0.9791 0.4493 -0.1135 0.1124 0.0935 142 LYS C CB 6061 C CG . LYS D 147 ? 0.5236 0.9945 0.4800 -0.0983 0.1334 0.1039 142 LYS C CG 6062 C CD . LYS D 147 ? 0.5420 1.0085 0.5100 -0.0977 0.1591 0.1081 142 LYS C CD 6063 C CE . LYS D 147 ? 0.5410 1.0381 0.5648 -0.1061 0.1552 0.1210 142 LYS C CE 6064 N NZ . LYS D 147 ? 0.5632 1.0611 0.6112 -0.1023 0.1897 0.1285 142 LYS C NZ 6065 N N . ASP D 148 ? 0.5091 1.0213 0.4838 -0.1212 0.0671 0.1195 143 ASP C N 6066 C CA . ASP D 148 ? 0.5165 1.0438 0.5207 -0.1139 0.0577 0.1396 143 ASP C CA 6067 C C . ASP D 148 ? 0.5275 1.0390 0.4816 -0.1193 0.0447 0.1344 143 ASP C C 6068 O O . ASP D 148 ? 0.5405 1.0475 0.4566 -0.1401 0.0257 0.1270 143 ASP C O 6069 C CB . ASP D 148 ? 0.5315 1.0916 0.5890 -0.1267 0.0297 0.1636 143 ASP C CB 6070 C CG . ASP D 148 ? 0.5282 1.1085 0.6460 -0.1239 0.0428 0.1711 143 ASP C CG 6071 O OD1 . ASP D 148 ? 0.5220 1.0993 0.6669 -0.1048 0.0773 0.1706 143 ASP C OD1 6072 O OD2 . ASP D 148 ? 0.5423 1.1389 0.6780 -0.1432 0.0202 0.1771 143 ASP C OD2 6073 N N . ILE D 149 ? 0.5251 1.0251 0.4769 -0.1027 0.0577 0.1367 144 ILE C N 6074 C CA . ILE D 149 ? 0.5403 1.0261 0.4502 -0.1080 0.0474 0.1353 144 ILE C CA 6075 C C . ILE D 149 ? 0.5441 1.0286 0.4813 -0.0916 0.0510 0.1520 144 ILE C C 6076 O O . ILE D 149 ? 0.5308 1.0121 0.5026 -0.0725 0.0738 0.1525 144 ILE C O 6077 C CB . ILE D 149 ? 0.5361 0.9947 0.3935 -0.1090 0.0630 0.1085 144 ILE C CB 6078 C CG1 . ILE D 149 ? 0.5568 1.0045 0.3692 -0.1235 0.0522 0.1050 144 ILE C CG1 6079 C CG2 . ILE D 149 ? 0.5243 0.9646 0.3836 -0.0892 0.0866 0.1018 144 ILE C CG2 6080 C CD1 . ILE D 149 ? 0.5570 0.9845 0.3323 -0.1306 0.0657 0.0785 144 ILE C CD1 6081 N N . ASN D 150 ? 0.5709 1.0537 0.4885 -0.1015 0.0302 0.1648 145 ASN C N 6082 C CA . ASN D 150 ? 0.5802 1.0576 0.5229 -0.0876 0.0312 0.1817 145 ASN C CA 6083 C C . ASN D 150 ? 0.5898 1.0429 0.4759 -0.0933 0.0328 0.1728 145 ASN C C 6084 O O . ASN D 150 ? 0.6094 1.0585 0.4444 -0.1154 0.0191 0.1689 145 ASN C O 6085 C CB . ASN D 150 ? 0.6044 1.1060 0.5966 -0.0945 -0.0010 0.2182 145 ASN C CB 6086 C CG . ASN D 150 ? 0.6097 1.1093 0.6616 -0.0733 0.0053 0.2384 145 ASN C CG 6087 O OD1 . ASN D 150 ? 0.5978 1.1032 0.7144 -0.0522 0.0290 0.2388 145 ASN C OD1 6088 N ND2 . ASN D 150 ? 0.6340 1.1220 0.6648 -0.0797 -0.0120 0.2543 145 ASN C ND2 6089 N N . VAL D 151 ? 0.5780 1.0124 0.4730 -0.0750 0.0525 0.1680 146 VAL C N 6090 C CA . VAL D 151 ? 0.5820 0.9945 0.4371 -0.0787 0.0547 0.1633 146 VAL C CA 6091 C C . VAL D 151 ? 0.5946 1.0028 0.4849 -0.0694 0.0473 0.1883 146 VAL C C 6092 O O . VAL D 151 ? 0.5830 0.9918 0.5290 -0.0501 0.0585 0.1951 146 VAL C O 6093 C CB . VAL D 151 ? 0.5668 0.9554 0.4003 -0.0689 0.0801 0.1364 146 VAL C CB 6094 C CG1 . VAL D 151 ? 0.5757 0.9449 0.3771 -0.0746 0.0812 0.1331 146 VAL C CG1 6095 C CG2 . VAL D 151 ? 0.5547 0.9465 0.3661 -0.0763 0.0860 0.1156 146 VAL C CG2 6096 N N . LYS D 152 ? 0.6168 1.0173 0.4743 -0.0839 0.0321 0.2007 147 LYS C N 6097 C CA . LYS D 152 ? 0.6348 1.0286 0.5225 -0.0788 0.0205 0.2285 147 LYS C CA 6098 C C . LYS D 152 ? 0.6416 1.0103 0.4823 -0.0856 0.0295 0.2195 147 LYS C C 6099 O O . LYS D 152 ? 0.6532 1.0187 0.4363 -0.1052 0.0306 0.2070 147 LYS C O 6100 C CB . LYS D 152 ? 0.6712 1.0852 0.5694 -0.0974 -0.0180 0.2653 147 LYS C CB 6101 C CG . LYS D 152 ? 0.6981 1.1096 0.6478 -0.0913 -0.0373 0.3037 147 LYS C CG 6102 C CD . LYS D 152 ? 0.7269 1.1648 0.7153 -0.1054 -0.0802 0.3447 147 LYS C CD 6103 C CE . LYS D 152 ? 0.7650 1.2071 0.6689 -0.1439 -0.1073 0.3473 147 LYS C CE 6104 N NZ . LYS D 152 ? 0.8109 1.2709 0.7388 -0.1659 -0.1601 0.3956 147 LYS C NZ 6105 N N . TRP D 153 ? 0.6343 0.9833 0.5041 -0.0695 0.0401 0.2232 148 TRP C N 6106 C CA . TRP D 153 ? 0.6452 0.9713 0.4839 -0.0765 0.0450 0.2219 148 TRP C CA 6107 C C . TRP D 153 ? 0.6780 1.0013 0.5289 -0.0858 0.0212 0.2606 148 TRP C C 6108 O O . TRP D 153 ? 0.6841 1.0120 0.5961 -0.0733 0.0086 0.2862 148 TRP C O 6109 C CB . TRP D 153 ? 0.6314 0.9308 0.4878 -0.0575 0.0690 0.2011 148 TRP C CB 6110 C CG . TRP D 153 ? 0.6069 0.9013 0.4354 -0.0560 0.0872 0.1667 148 TRP C CG 6111 C CD1 . TRP D 153 ? 0.5884 0.8862 0.4280 -0.0452 0.0991 0.1502 148 TRP C CD1 6112 C CD2 . TRP D 153 ? 0.6002 0.8849 0.3908 -0.0672 0.0942 0.1484 148 TRP C CD2 6113 N NE1 . TRP D 153 ? 0.5745 0.8639 0.3812 -0.0500 0.1084 0.1252 148 TRP C NE1 6114 C CE2 . TRP D 153 ? 0.5795 0.8623 0.3625 -0.0623 0.1050 0.1239 148 TRP C CE2 6115 C CE3 . TRP D 153 ? 0.6129 0.8910 0.3809 -0.0817 0.0934 0.1524 148 TRP C CE3 6116 C CZ2 . TRP D 153 ? 0.5708 0.8466 0.3333 -0.0704 0.1102 0.1058 148 TRP C CZ2 6117 C CZ3 . TRP D 153 ? 0.6010 0.8736 0.3522 -0.0886 0.1043 0.1313 148 TRP C CZ3 6118 C CH2 . TRP D 153 ? 0.5784 0.8508 0.3313 -0.0823 0.1103 0.1094 148 TRP C CH2 6119 N N . LYS D 154 ? 0.7005 1.0151 0.4974 -0.1084 0.0167 0.2661 149 LYS C N 6120 C CA . LYS D 154 ? 0.7412 1.0467 0.5380 -0.1213 -0.0047 0.3040 149 LYS C CA 6121 C C . LYS D 154 ? 0.7446 1.0244 0.5215 -0.1243 0.0130 0.2962 149 LYS C C 6122 O O . LYS D 154 ? 0.7282 1.0030 0.4677 -0.1307 0.0355 0.2667 149 LYS C O 6123 C CB . LYS D 154 ? 0.7885 1.1055 0.5294 -0.1551 -0.0318 0.3272 149 LYS C CB 6124 C CG . LYS D 154 ? 0.7914 1.1336 0.5639 -0.1553 -0.0603 0.3459 149 LYS C CG 6125 C CD . LYS D 154 ? 0.8561 1.2027 0.5701 -0.1943 -0.0970 0.3770 149 LYS C CD 6126 C CE . LYS D 154 ? 0.8559 1.2296 0.6031 -0.1969 -0.1268 0.3916 149 LYS C CE 6127 N NZ . LYS D 154 ? 0.9250 1.2991 0.5987 -0.2413 -0.1647 0.4155 149 LYS C NZ 6128 N N . ILE D 155 ? 0.7626 1.0266 0.5753 -0.1192 0.0020 0.3249 150 ILE C N 6129 C CA . ILE D 155 ? 0.7719 1.0101 0.5753 -0.1230 0.0151 0.3236 150 ILE C CA 6130 C C . ILE D 155 ? 0.8235 1.0537 0.6158 -0.1439 -0.0099 0.3697 150 ILE C C 6131 O O . ILE D 155 ? 0.8372 1.0637 0.6853 -0.1340 -0.0324 0.4036 150 ILE C O 6132 C CB . ILE D 155 ? 0.7507 0.9666 0.6134 -0.0946 0.0304 0.3092 150 ILE C CB 6133 C CG1 . ILE D 155 ? 0.7101 0.9278 0.5664 -0.0810 0.0541 0.2648 150 ILE C CG1 6134 C CG2 . ILE D 155 ? 0.7727 0.9603 0.6330 -0.1012 0.0373 0.3146 150 ILE C CG2 6135 C CD1 . ILE D 155 ? 0.7035 0.8948 0.6039 -0.0573 0.0699 0.2470 150 ILE C CD1 6136 N N . ASP D 156 ? 0.8549 1.0803 0.5781 -0.1737 -0.0040 0.3716 151 ASP C N 6137 C CA . ASP D 156 ? 0.9194 1.1360 0.6058 -0.2036 -0.0282 0.4161 151 ASP C CA 6138 C C . ASP D 156 ? 0.9459 1.1785 0.6414 -0.2113 -0.0700 0.4530 151 ASP C C 6139 O O . ASP D 156 ? 0.9827 1.2080 0.7115 -0.2153 -0.1027 0.5007 151 ASP C O 6140 C CB . ASP D 156 ? 0.9363 1.1273 0.6643 -0.1972 -0.0302 0.4403 151 ASP C CB 6141 C CG . ASP D 156 ? 0.9277 1.1028 0.6357 -0.2017 0.0044 0.4131 151 ASP C CG 6142 O OD1 . ASP D 156 ? 0.9328 1.1145 0.5803 -0.2221 0.0266 0.3909 151 ASP C OD1 6143 O OD2 . ASP D 156 ? 0.9183 1.0730 0.6773 -0.1855 0.0101 0.4142 151 ASP C OD2 6144 N N . GLY D 157 ? 0.9276 1.1820 0.6013 -0.2136 -0.0714 0.4328 152 GLY C N 6145 C CA . GLY D 157 ? 0.9556 1.2282 0.6360 -0.2253 -0.1137 0.4659 152 GLY C CA 6146 C C . GLY D 157 ? 0.9166 1.2066 0.7053 -0.1913 -0.1301 0.4792 152 GLY C C 6147 O O . GLY D 157 ? 0.9279 1.2390 0.7349 -0.1987 -0.1632 0.5022 152 GLY C O 6148 N N . SER D 158 ? 0.8778 1.1570 0.7396 -0.1563 -0.1062 0.4652 153 SER C N 6149 C CA . SER D 158 ? 0.8497 1.1400 0.8185 -0.1231 -0.1103 0.4733 153 SER C CA 6150 C C . SER D 158 ? 0.7950 1.0964 0.7754 -0.1001 -0.0758 0.4236 153 SER C C 6151 O O . SER D 158 ? 0.7695 1.0567 0.7121 -0.0945 -0.0419 0.3825 153 SER C O 6152 C CB . SER D 158 ? 0.8537 1.1180 0.8970 -0.1003 -0.1019 0.4871 153 SER C CB 6153 O OG . SER D 158 ? 0.9099 1.1652 0.9616 -0.1194 -0.1400 0.5424 153 SER C OG 6154 N N . GLU D 159 ? 0.7812 1.1080 0.8183 -0.0886 -0.0866 0.4308 154 GLU C N 6155 C CA . GLU D 159 ? 0.7365 1.0729 0.7916 -0.0673 -0.0545 0.3895 154 GLU C CA 6156 C C . GLU D 159 ? 0.7192 1.0278 0.8168 -0.0379 -0.0159 0.3629 154 GLU C C 6157 O O . GLU D 159 ? 0.7364 1.0269 0.8936 -0.0255 -0.0175 0.3839 154 GLU C O 6158 C CB . GLU D 159 ? 0.7302 1.0987 0.8559 -0.0599 -0.0726 0.4089 154 GLU C CB 6159 C CG . GLU D 159 ? 0.6922 1.0757 0.8026 -0.0525 -0.0471 0.3695 154 GLU C CG 6160 C CD . GLU D 159 ? 0.6787 1.0887 0.8836 -0.0353 -0.0481 0.3813 154 GLU C CD 6161 O OE1 . GLU D 159 ? 0.7031 1.1348 0.9700 -0.0415 -0.0864 0.4264 154 GLU C OE1 6162 O OE2 . GLU D 159 ? 0.6487 1.0573 0.8667 -0.0172 -0.0107 0.3467 154 GLU C OE2 6163 N N . ARG D 160 ? 0.6918 0.9935 0.7564 -0.0295 0.0172 0.3174 155 ARG C N 6164 C CA . ARG D 160 ? 0.6902 0.9593 0.7721 -0.0090 0.0528 0.2873 155 ARG C CA 6165 C C . ARG D 160 ? 0.6689 0.9407 0.7524 0.0042 0.0824 0.2520 155 ARG C C 6166 O O . ARG D 160 ? 0.6471 0.9290 0.6722 -0.0064 0.0856 0.2297 155 ARG C O 6167 C CB . ARG D 160 ? 0.6959 0.9408 0.7095 -0.0218 0.0601 0.2683 155 ARG C CB 6168 C CG . ARG D 160 ? 0.6984 0.9062 0.7100 -0.0084 0.0915 0.2335 155 ARG C CG 6169 C CD . ARG D 160 ? 0.7289 0.9068 0.8050 0.0078 0.1000 0.2451 155 ARG C CD 6170 N NE . ARG D 160 ? 0.7431 0.8783 0.7989 0.0138 0.1286 0.2080 155 ARG C NE 6171 C CZ . ARG D 160 ? 0.7663 0.8663 0.8138 0.0094 0.1304 0.2048 155 ARG C CZ 6172 N NH1 . ARG D 160 ? 0.7831 0.8429 0.8050 0.0110 0.1535 0.1688 155 ARG C NH1 6173 N NH2 . ARG D 160 ? 0.7797 0.8816 0.8408 0.0006 0.1082 0.2382 155 ARG C NH2 6174 N N . GLN D 161 ? 0.6811 0.9396 0.8315 0.0265 0.1071 0.2462 156 GLN C N 6175 C CA . GLN D 161 ? 0.6717 0.9316 0.8280 0.0373 0.1384 0.2173 156 GLN C CA 6176 C C . GLN D 161 ? 0.6934 0.9064 0.8190 0.0447 0.1772 0.1775 156 GLN C C 6177 O O . GLN D 161 ? 0.6889 0.8958 0.7601 0.0392 0.1932 0.1483 156 GLN C O 6178 C CB . GLN D 161 ? 0.6756 0.9584 0.9326 0.0538 0.1433 0.2390 156 GLN C CB 6179 C CG . GLN D 161 ? 0.6545 0.9862 0.9218 0.0427 0.1135 0.2613 156 GLN C CG 6180 C CD . GLN D 161 ? 0.6661 1.0265 1.0421 0.0503 0.0893 0.3069 156 GLN C CD 6181 O OE1 . GLN D 161 ? 0.6808 1.0579 1.0570 0.0348 0.0439 0.3444 156 GLN C OE1 6182 N NE2 . GLN D 161 ? 0.6695 1.0335 1.1399 0.0723 0.1199 0.3053 156 GLN C NE2 6183 N N . ASN D 162 ? 0.7248 0.9016 0.8826 0.0547 0.1906 0.1770 157 ASN C N 6184 C CA . ASN D 162 ? 0.7578 0.8824 0.8805 0.0576 0.2270 0.1374 157 ASN C CA 6185 C C . ASN D 162 ? 0.7506 0.8570 0.7801 0.0377 0.2142 0.1179 157 ASN C C 6186 O O . ASN D 162 ? 0.7353 0.8526 0.7485 0.0268 0.1855 0.1360 157 ASN C O 6187 C CB . ASN D 162 ? 0.8025 0.8886 0.9906 0.0732 0.2476 0.1395 157 ASN C CB 6188 C CG . ASN D 162 ? 0.8137 0.8845 0.9950 0.0654 0.2211 0.1577 157 ASN C CG 6189 O OD1 . ASN D 162 ? 0.7966 0.9003 0.9998 0.0601 0.1847 0.1966 157 ASN C OD1 6190 N ND2 . ASN D 162 ? 0.8514 0.8692 0.9971 0.0613 0.2386 0.1302 157 ASN C ND2 6191 N N . GLY D 163 ? 0.7653 0.8449 0.7362 0.0311 0.2354 0.0831 158 GLY C N 6192 C CA . GLY D 163 ? 0.7626 0.8276 0.6559 0.0116 0.2205 0.0666 158 GLY C CA 6193 C C . GLY D 163 ? 0.7201 0.8244 0.5788 0.0011 0.2022 0.0693 158 GLY C C 6194 O O . GLY D 163 ? 0.7132 0.8131 0.5238 -0.0140 0.1868 0.0608 158 GLY C O 6195 N N . VAL D 164 ? 0.6940 0.8358 0.5850 0.0088 0.2039 0.0816 159 VAL C N 6196 C CA . VAL D 164 ? 0.6575 0.8347 0.5222 -0.0006 0.1887 0.0835 159 VAL C CA 6197 C C . VAL D 164 ? 0.6716 0.8360 0.5056 -0.0024 0.2104 0.0610 159 VAL C C 6198 O O . VAL D 164 ? 0.6992 0.8494 0.5567 0.0078 0.2403 0.0529 159 VAL C O 6199 C CB . VAL D 164 ? 0.6296 0.8539 0.5416 0.0035 0.1728 0.1113 159 VAL C CB 6200 C CG1 . VAL D 164 ? 0.5997 0.8542 0.4817 -0.0080 0.1596 0.1089 159 VAL C CG1 6201 C CG2 . VAL D 164 ? 0.6279 0.8613 0.5595 0.0003 0.1491 0.1377 159 VAL C CG2 6202 N N . LEU D 165 ? 0.6581 0.8257 0.4425 -0.0167 0.1973 0.0518 160 LEU C N 6203 C CA . LEU D 165 ? 0.6696 0.8266 0.4186 -0.0229 0.2114 0.0361 160 LEU C CA 6204 C C . LEU D 165 ? 0.6276 0.8193 0.3676 -0.0315 0.1905 0.0430 160 LEU C C 6205 O O . LEU D 165 ? 0.6123 0.8113 0.3389 -0.0405 0.1679 0.0457 160 LEU C O 6206 C CB . LEU D 165 ? 0.7186 0.8236 0.4053 -0.0363 0.2169 0.0147 160 LEU C CB 6207 C CG . LEU D 165 ? 0.7759 0.8341 0.4597 -0.0309 0.2471 -0.0009 160 LEU C CG 6208 C CD1 . LEU D 165 ? 0.8315 0.8352 0.4421 -0.0513 0.2424 -0.0212 160 LEU C CD1 6209 C CD2 . LEU D 165 ? 0.8021 0.8548 0.5047 -0.0211 0.2879 -0.0094 160 LEU C CD2 6210 N N . ASN D 166 ? 0.6145 0.8262 0.3687 -0.0287 0.2012 0.0454 161 ASN C N 6211 C CA . ASN D 166 ? 0.5791 0.8211 0.3309 -0.0363 0.1848 0.0508 161 ASN C CA 6212 C C . ASN D 166 ? 0.5984 0.8221 0.3094 -0.0468 0.1928 0.0399 161 ASN C C 6213 O O . ASN D 166 ? 0.6374 0.8301 0.3232 -0.0480 0.2172 0.0292 161 ASN C O 6214 C CB . ASN D 166 ? 0.5532 0.8360 0.3577 -0.0287 0.1837 0.0669 161 ASN C CB 6215 C CG . ASN D 166 ? 0.5386 0.8397 0.3741 -0.0248 0.1666 0.0834 161 ASN C CG 6216 O OD1 . ASN D 166 ? 0.5363 0.8281 0.3505 -0.0304 0.1537 0.0825 161 ASN C OD1 6217 N ND2 . ASN D 166 ? 0.5322 0.8594 0.4201 -0.0176 0.1649 0.1014 161 ASN C ND2 6218 N N . SER D 167 ? 0.5737 0.8133 0.2765 -0.0562 0.1732 0.0429 162 SER C N 6219 C CA . SER D 167 ? 0.5930 0.8188 0.2625 -0.0681 0.1736 0.0392 162 SER C CA 6220 C C . SER D 167 ? 0.5578 0.8167 0.2526 -0.0711 0.1591 0.0469 162 SER C C 6221 O O . SER D 167 ? 0.5291 0.8054 0.2421 -0.0718 0.1416 0.0490 162 SER C O 6222 C CB . SER D 167 ? 0.6212 0.8115 0.2443 -0.0821 0.1571 0.0337 162 SER C CB 6223 O OG . SER D 167 ? 0.6508 0.8228 0.2361 -0.0969 0.1542 0.0348 162 SER C OG 6224 N N . TRP D 168 ? 0.5682 0.8330 0.2639 -0.0743 0.1700 0.0497 163 TRP C N 6225 C CA . TRP D 168 ? 0.5424 0.8356 0.2646 -0.0780 0.1583 0.0559 163 TRP C CA 6226 C C . TRP D 168 ? 0.5667 0.8421 0.2617 -0.0916 0.1503 0.0578 163 TRP C C 6227 O O . TRP D 168 ? 0.6072 0.8542 0.2619 -0.0996 0.1618 0.0574 163 TRP C O 6228 C CB . TRP D 168 ? 0.5324 0.8533 0.2933 -0.0717 0.1736 0.0627 163 TRP C CB 6229 C CG . TRP D 168 ? 0.5169 0.8564 0.3140 -0.0595 0.1769 0.0677 163 TRP C CG 6230 C CD1 . TRP D 168 ? 0.4910 0.8601 0.3191 -0.0593 0.1588 0.0758 163 TRP C CD1 6231 C CD2 . TRP D 168 ? 0.5374 0.8638 0.3440 -0.0482 0.1985 0.0669 163 TRP C CD2 6232 N NE1 . TRP D 168 ? 0.4920 0.8699 0.3510 -0.0488 0.1626 0.0851 163 TRP C NE1 6233 C CE2 . TRP D 168 ? 0.5174 0.8702 0.3708 -0.0398 0.1884 0.0792 163 TRP C CE2 6234 C CE3 . TRP D 168 ? 0.5804 0.8710 0.3582 -0.0466 0.2263 0.0563 163 TRP C CE3 6235 C CZ2 . TRP D 168 ? 0.5304 0.8781 0.4168 -0.0263 0.2040 0.0840 163 TRP C CZ2 6236 C CZ3 . TRP D 168 ? 0.5960 0.8785 0.4023 -0.0332 0.2478 0.0553 163 TRP C CZ3 6237 C CH2 . TRP D 168 ? 0.5667 0.8794 0.4339 -0.0215 0.2358 0.0705 163 TRP C CH2 6238 N N . THR D 169 ? 0.5497 0.8396 0.2667 -0.0962 0.1314 0.0601 164 THR C N 6239 C CA . THR D 169 ? 0.5688 0.8452 0.2760 -0.1086 0.1186 0.0665 164 THR C CA 6240 C C . THR D 169 ? 0.5736 0.8651 0.2960 -0.1119 0.1294 0.0727 164 THR C C 6241 O O . THR D 169 ? 0.5460 0.8648 0.2988 -0.1047 0.1401 0.0715 164 THR C O 6242 C CB . THR D 169 ? 0.5482 0.8305 0.2858 -0.1100 0.0971 0.0646 164 THR C CB 6243 O OG1 . THR D 169 ? 0.5792 0.8345 0.3008 -0.1204 0.0776 0.0726 164 THR C OG1 6244 C CG2 . THR D 169 ? 0.5266 0.8298 0.3032 -0.1117 0.0947 0.0635 164 THR C CG2 6245 N N . ASP D 170 ? 0.6087 0.8812 0.3100 -0.1251 0.1246 0.0825 165 ASP C N 6246 C CA . ASP D 170 ? 0.6144 0.9000 0.3357 -0.1311 0.1309 0.0907 165 ASP C CA 6247 C C . ASP D 170 ? 0.5762 0.8826 0.3471 -0.1300 0.1137 0.0883 165 ASP C C 6248 O O . ASP D 170 ? 0.5602 0.8656 0.3453 -0.1268 0.0993 0.0814 165 ASP C O 6249 C CB . ASP D 170 ? 0.6725 0.9268 0.3519 -0.1491 0.1275 0.1049 165 ASP C CB 6250 C CG . ASP D 170 ? 0.7301 0.9657 0.3606 -0.1548 0.1590 0.1047 165 ASP C CG 6251 O OD1 . ASP D 170 ? 0.7243 0.9833 0.3827 -0.1428 0.1860 0.0977 165 ASP C OD1 6252 O OD2 . ASP D 170 ? 0.7928 0.9892 0.3591 -0.1730 0.1572 0.1122 165 ASP C OD2 6253 N N . GLN D 171 ? 0.5669 0.8896 0.3654 -0.1344 0.1181 0.0927 166 GLN C N 6254 C CA . GLN D 171 ? 0.5481 0.8818 0.3879 -0.1374 0.1041 0.0877 166 GLN C CA 6255 C C . GLN D 171 ? 0.5642 0.8740 0.4098 -0.1434 0.0850 0.0933 166 GLN C C 6256 O O . GLN D 171 ? 0.5997 0.8877 0.4210 -0.1526 0.0786 0.1098 166 GLN C O 6257 C CB . GLN D 171 ? 0.5462 0.8959 0.4127 -0.1448 0.1099 0.0938 166 GLN C CB 6258 C CG . GLN D 171 ? 0.5271 0.8870 0.4330 -0.1495 0.0990 0.0828 166 GLN C CG 6259 C CD . GLN D 171 ? 0.5236 0.9035 0.4570 -0.1578 0.1026 0.0871 166 GLN C CD 6260 O OE1 . GLN D 171 ? 0.5378 0.9185 0.4720 -0.1627 0.1119 0.1027 166 GLN C OE1 6261 N NE2 . GLN D 171 ? 0.5114 0.9054 0.4650 -0.1624 0.0953 0.0734 166 GLN C NE2 6262 N N . ASP D 172 ? 0.5541 0.8662 0.4330 -0.1399 0.0766 0.0808 167 ASP C N 6263 C CA . ASP D 172 ? 0.5706 0.8639 0.4796 -0.1435 0.0592 0.0869 167 ASP C CA 6264 C C . ASP D 172 ? 0.5859 0.8727 0.5251 -0.1532 0.0523 0.0982 167 ASP C C 6265 O O . ASP D 172 ? 0.5746 0.8746 0.5328 -0.1555 0.0618 0.0885 167 ASP C O 6266 C CB . ASP D 172 ? 0.5558 0.8544 0.5011 -0.1365 0.0624 0.0666 167 ASP C CB 6267 C CG . ASP D 172 ? 0.5669 0.8487 0.5626 -0.1372 0.0470 0.0735 167 ASP C CG 6268 O OD1 . ASP D 172 ? 0.5763 0.8499 0.6162 -0.1421 0.0408 0.0789 167 ASP C OD1 6269 O OD2 . ASP D 172 ? 0.5702 0.8476 0.5700 -0.1329 0.0407 0.0747 167 ASP C OD2 6270 N N . SER D 173 ? 0.6168 0.8811 0.5588 -0.1617 0.0326 0.1213 168 SER C N 6271 C CA . SER D 173 ? 0.6366 0.8906 0.6086 -0.1726 0.0230 0.1377 168 SER C CA 6272 C C . SER D 173 ? 0.6206 0.8750 0.6683 -0.1689 0.0219 0.1239 168 SER C C 6273 O O . SER D 173 ? 0.6366 0.8859 0.7139 -0.1767 0.0199 0.1305 168 SER C O 6274 C CB . SER D 173 ? 0.6848 0.9101 0.6378 -0.1865 -0.0038 0.1717 168 SER C CB 6275 O OG . SER D 173 ? 0.7073 0.9220 0.6024 -0.1882 -0.0096 0.1764 168 SER C OG 6276 N N . LYS D 174 ? 0.5985 0.8562 0.6785 -0.1587 0.0267 0.1040 169 LYS C N 6277 C CA . LYS D 174 ? 0.5920 0.8439 0.7448 -0.1560 0.0338 0.0862 169 LYS C CA 6278 C C . LYS D 174 ? 0.5728 0.8371 0.7191 -0.1550 0.0604 0.0500 169 LYS C C 6279 O O . LYS D 174 ? 0.5834 0.8416 0.7575 -0.1618 0.0676 0.0380 169 LYS C O 6280 C CB . LYS D 174 ? 0.5940 0.8367 0.8015 -0.1484 0.0256 0.0881 169 LYS C CB 6281 C CG . LYS D 174 ? 0.6189 0.8447 0.8459 -0.1545 -0.0098 0.1278 169 LYS C CG 6282 C CD . LYS D 174 ? 0.6256 0.8398 0.9562 -0.1497 -0.0210 0.1345 169 LYS C CD 6283 C CE . LYS D 174 ? 0.6583 0.8524 1.0220 -0.1610 -0.0580 0.1766 169 LYS C CE 6284 N NZ . LYS D 174 ? 0.6669 0.8513 1.1449 -0.1555 -0.0753 0.1907 169 LYS C NZ 6285 N N . ASP D 175 ? 0.5505 0.8284 0.6584 -0.1493 0.0728 0.0337 170 ASP C N 6286 C CA . ASP D 175 ? 0.5454 0.8319 0.6341 -0.1535 0.0934 0.0029 170 ASP C CA 6287 C C . ASP D 175 ? 0.5329 0.8402 0.5657 -0.1581 0.0921 0.0070 170 ASP C C 6288 O O . ASP D 175 ? 0.5392 0.8540 0.5511 -0.1657 0.1008 -0.0122 170 ASP C O 6289 C CB . ASP D 175 ? 0.5436 0.8296 0.6321 -0.1480 0.1098 -0.0178 170 ASP C CB 6290 C CG . ASP D 175 ? 0.5308 0.8302 0.5747 -0.1400 0.1038 -0.0055 170 ASP C CG 6291 O OD1 . ASP D 175 ? 0.5245 0.8336 0.5308 -0.1392 0.0920 0.0132 170 ASP C OD1 6292 O OD2 . ASP D 175 ? 0.5300 0.8283 0.5798 -0.1351 0.1139 -0.0157 170 ASP C OD2 6293 N N . SER D 176 ? 0.5203 0.8350 0.5306 -0.1554 0.0816 0.0325 171 SER C N 6294 C CA . SER D 176 ? 0.5116 0.8467 0.4903 -0.1585 0.0834 0.0398 171 SER C CA 6295 C C . SER D 176 ? 0.5008 0.8529 0.4461 -0.1535 0.0895 0.0309 171 SER C C 6296 O O . SER D 176 ? 0.4962 0.8680 0.4311 -0.1571 0.0897 0.0343 171 SER C O 6297 C CB . SER D 176 ? 0.5187 0.8582 0.5192 -0.1716 0.0828 0.0342 171 SER C CB 6298 O OG . SER D 176 ? 0.5278 0.8502 0.5620 -0.1765 0.0766 0.0458 171 SER C OG 6299 N N . THR D 177 ? 0.4956 0.8410 0.4311 -0.1459 0.0926 0.0230 172 THR C N 6300 C CA . THR D 177 ? 0.4904 0.8485 0.3949 -0.1419 0.0971 0.0176 172 THR C CA 6301 C C . THR D 177 ? 0.4838 0.8442 0.3660 -0.1310 0.0965 0.0341 172 THR C C 6302 O O . THR D 177 ? 0.4897 0.8378 0.3700 -0.1291 0.0931 0.0474 172 THR C O 6303 C CB . THR D 177 ? 0.4953 0.8439 0.3993 -0.1420 0.1054 -0.0014 172 THR C CB 6304 O OG1 . THR D 177 ? 0.4908 0.8246 0.4189 -0.1342 0.1039 0.0030 172 THR C OG1 6305 C CG2 . THR D 177 ? 0.5175 0.8577 0.4319 -0.1561 0.1140 -0.0250 172 THR C CG2 6306 N N . TYR D 178 ? 0.4808 0.8530 0.3423 -0.1267 0.0996 0.0331 173 TYR C N 6307 C CA . TYR D 178 ? 0.4801 0.8503 0.3213 -0.1162 0.1031 0.0432 173 TYR C CA 6308 C C . TYR D 178 ? 0.4786 0.8422 0.3076 -0.1120 0.1038 0.0352 173 TYR C C 6309 O O . TYR D 178 ? 0.4790 0.8453 0.3104 -0.1179 0.1052 0.0228 173 TYR C O 6310 C CB . TYR D 178 ? 0.4795 0.8702 0.3223 -0.1134 0.1072 0.0530 173 TYR C CB 6311 C CG . TYR D 178 ? 0.4816 0.8811 0.3433 -0.1180 0.1104 0.0625 173 TYR C CG 6312 C CD1 . TYR D 178 ? 0.4812 0.8955 0.3658 -0.1292 0.1024 0.0606 173 TYR C CD1 6313 C CD2 . TYR D 178 ? 0.4938 0.8838 0.3468 -0.1142 0.1232 0.0725 173 TYR C CD2 6314 C CE1 . TYR D 178 ? 0.4846 0.9081 0.3926 -0.1346 0.1055 0.0708 173 TYR C CE1 6315 C CE2 . TYR D 178 ? 0.5008 0.8985 0.3715 -0.1201 0.1305 0.0821 173 TYR C CE2 6316 C CZ . TYR D 178 ? 0.4931 0.9096 0.3961 -0.1293 0.1210 0.0824 173 TYR C CZ 6317 O OH . TYR D 178 ? 0.5024 0.9282 0.4295 -0.1365 0.1280 0.0933 173 TYR C OH 6318 N N . SER D 179 ? 0.4847 0.8365 0.2973 -0.1044 0.1049 0.0415 174 SER C N 6319 C CA . SER D 179 ? 0.4862 0.8311 0.2896 -0.1004 0.1052 0.0370 174 SER C CA 6320 C C . SER D 179 ? 0.4951 0.8344 0.2772 -0.0921 0.1097 0.0446 174 SER C C 6321 O O . SER D 179 ? 0.5079 0.8401 0.2793 -0.0902 0.1150 0.0509 174 SER C O 6322 C CB . SER D 179 ? 0.4888 0.8160 0.3050 -0.1023 0.0982 0.0351 174 SER C CB 6323 O OG . SER D 179 ? 0.4892 0.8186 0.3378 -0.1079 0.0989 0.0259 174 SER C OG 6324 N N . MET D 180 ? 0.4953 0.8337 0.2711 -0.0886 0.1108 0.0431 175 MET C N 6325 C CA . MET D 180 ? 0.5049 0.8352 0.2676 -0.0803 0.1167 0.0489 175 MET C CA 6326 C C . MET D 180 ? 0.5042 0.8214 0.2595 -0.0794 0.1139 0.0463 175 MET C C 6327 O O . MET D 180 ? 0.4932 0.8172 0.2569 -0.0845 0.1115 0.0421 175 MET C O 6328 C CB . MET D 180 ? 0.5054 0.8577 0.2824 -0.0763 0.1196 0.0572 175 MET C CB 6329 C CG . MET D 180 ? 0.5202 0.8661 0.3000 -0.0659 0.1269 0.0644 175 MET C CG 6330 S SD . MET D 180 ? 0.5226 0.8981 0.3320 -0.0653 0.1180 0.0812 175 MET C SD 6331 C CE . MET D 180 ? 0.5365 0.9001 0.3691 -0.0485 0.1326 0.0901 175 MET C CE 6332 N N . SER D 181 ? 0.5167 0.8122 0.2557 -0.0749 0.1172 0.0475 176 SER C N 6333 C CA . SER D 181 ? 0.5214 0.8036 0.2561 -0.0739 0.1149 0.0470 176 SER C CA 6334 C C . SER D 181 ? 0.5307 0.8097 0.2661 -0.0645 0.1245 0.0525 176 SER C C 6335 O O . SER D 181 ? 0.5453 0.8189 0.2794 -0.0583 0.1363 0.0530 176 SER C O 6336 C CB . SER D 181 ? 0.5412 0.7936 0.2577 -0.0800 0.1064 0.0433 176 SER C CB 6337 O OG . SER D 181 ? 0.5771 0.8049 0.2635 -0.0788 0.1152 0.0410 176 SER C OG 6338 N N . SER D 182 ? 0.5283 0.8096 0.2710 -0.0640 0.1217 0.0575 177 SER C N 6339 C CA . SER D 182 ? 0.5403 0.8157 0.2930 -0.0550 0.1276 0.0662 177 SER C CA 6340 C C . SER D 182 ? 0.5529 0.8060 0.2983 -0.0576 0.1246 0.0648 177 SER C C 6341 O O . SER D 182 ? 0.5459 0.8056 0.2915 -0.0661 0.1177 0.0654 177 SER C O 6342 C CB . SER D 182 ? 0.5304 0.8341 0.3036 -0.0548 0.1215 0.0820 177 SER C CB 6343 O OG . SER D 182 ? 0.5429 0.8420 0.3398 -0.0448 0.1244 0.0954 177 SER C OG 6344 N N . THR D 183 ? 0.5784 0.8031 0.3195 -0.0514 0.1329 0.0615 178 THR C N 6345 C CA . THR D 183 ? 0.5965 0.7939 0.3288 -0.0560 0.1288 0.0581 178 THR C CA 6346 C C . THR D 183 ? 0.6182 0.7990 0.3677 -0.0464 0.1379 0.0647 178 THR C C 6347 O O . THR D 183 ? 0.6391 0.8024 0.3926 -0.0370 0.1544 0.0588 178 THR C O 6348 C CB . THR D 183 ? 0.6228 0.7875 0.3221 -0.0644 0.1265 0.0429 178 THR C CB 6349 O OG1 . THR D 183 ? 0.6035 0.7841 0.2985 -0.0731 0.1143 0.0416 178 THR C OG1 6350 C CG2 . THR D 183 ? 0.6479 0.7823 0.3394 -0.0723 0.1181 0.0396 178 THR C CG2 6351 N N . LEU D 184 ? 0.6166 0.8005 0.3794 -0.0495 0.1297 0.0768 179 LEU C N 6352 C CA . LEU D 184 ? 0.6390 0.8064 0.4252 -0.0415 0.1343 0.0876 179 LEU C CA 6353 C C . LEU D 184 ? 0.6653 0.7940 0.4381 -0.0481 0.1336 0.0771 179 LEU C C 6354 O O . LEU D 184 ? 0.6584 0.7905 0.4273 -0.0596 0.1224 0.0807 179 LEU C O 6355 C CB . LEU D 184 ? 0.6297 0.8235 0.4346 -0.0449 0.1227 0.1129 179 LEU C CB 6356 C CG . LEU D 184 ? 0.6548 0.8317 0.4876 -0.0401 0.1209 0.1312 179 LEU C CG 6357 C CD1 . LEU D 184 ? 0.6729 0.8354 0.5435 -0.0220 0.1339 0.1324 179 LEU C CD1 6358 C CD2 . LEU D 184 ? 0.6534 0.8567 0.4900 -0.0499 0.1053 0.1594 179 LEU C CD2 6359 N N . THR D 185 ? 0.7014 0.7914 0.4687 -0.0424 0.1478 0.0631 180 THR C N 6360 C CA . THR D 185 ? 0.7390 0.7852 0.4863 -0.0523 0.1454 0.0501 180 THR C CA 6361 C C . THR D 185 ? 0.7611 0.7868 0.5431 -0.0445 0.1514 0.0607 180 THR C C 6362 O O . THR D 185 ? 0.7684 0.7932 0.5842 -0.0288 0.1667 0.0671 180 THR C O 6363 C CB . THR D 185 ? 0.7815 0.7871 0.4827 -0.0586 0.1568 0.0233 180 THR C CB 6364 O OG1 . THR D 185 ? 0.7627 0.7870 0.4348 -0.0690 0.1438 0.0197 180 THR C OG1 6365 C CG2 . THR D 185 ? 0.8332 0.7860 0.5077 -0.0727 0.1520 0.0087 180 THR C CG2 6366 N N . LEU D 186 ? 0.7725 0.7842 0.5552 -0.0560 0.1383 0.0653 181 LEU C N 6367 C CA . LEU D 186 ? 0.7970 0.7862 0.6128 -0.0521 0.1404 0.0778 181 LEU C CA 6368 C C . LEU D 186 ? 0.8331 0.7785 0.6300 -0.0676 0.1335 0.0633 181 LEU C C 6369 O O . LEU D 186 ? 0.8344 0.7753 0.5979 -0.0834 0.1208 0.0500 181 LEU C O 6370 C CB . LEU D 186 ? 0.7686 0.7955 0.6111 -0.0545 0.1270 0.1100 181 LEU C CB 6371 C CG . LEU D 186 ? 0.7365 0.8096 0.5891 -0.0476 0.1244 0.1282 181 LEU C CG 6372 C CD1 . LEU D 186 ? 0.7182 0.8221 0.5650 -0.0618 0.1116 0.1498 181 LEU C CD1 6373 C CD2 . LEU D 186 ? 0.7519 0.8218 0.6495 -0.0304 0.1306 0.1449 181 LEU C CD2 6374 N N . THR D 187 ? 0.8650 0.7775 0.6887 -0.0646 0.1387 0.0684 182 THR C N 6375 C CA . THR D 187 ? 0.8977 0.7742 0.7128 -0.0822 0.1271 0.0616 182 THR C CA 6376 C C . THR D 187 ? 0.8634 0.7782 0.6995 -0.0927 0.1093 0.0878 182 THR C C 6377 O O . THR D 187 ? 0.8333 0.7876 0.6907 -0.0855 0.1100 0.1126 182 THR C O 6378 C CB . THR D 187 ? 0.9490 0.7736 0.7904 -0.0768 0.1397 0.0582 182 THR C CB 6379 O OG1 . THR D 187 ? 0.9304 0.7773 0.8270 -0.0647 0.1389 0.0924 182 THR C OG1 6380 C CG2 . THR D 187 ? 0.9930 0.7762 0.8196 -0.0654 0.1682 0.0292 182 THR C CG2 6381 N N . LYS D 188 ? 0.8761 0.7776 0.7049 -0.1124 0.0941 0.0821 183 LYS C N 6382 C CA . LYS D 188 ? 0.8537 0.7832 0.7108 -0.1244 0.0843 0.1049 183 LYS C CA 6383 C C . LYS D 188 ? 0.8646 0.7928 0.7540 -0.1178 0.0913 0.1319 183 LYS C C 6384 O O . LYS D 188 ? 0.8407 0.8069 0.7404 -0.1182 0.0933 0.1566 183 LYS C O 6385 C CB . LYS D 188 ? 0.8799 0.7821 0.7392 -0.1461 0.0670 0.0951 183 LYS C CB 6386 C CG . LYS D 188 ? 0.8588 0.7907 0.7556 -0.1613 0.0598 0.1149 183 LYS C CG 6387 C CD . LYS D 188 ? 0.8951 0.7922 0.8036 -0.1828 0.0394 0.1067 183 LYS C CD 6388 C CE . LYS D 188 ? 0.8718 0.8029 0.8260 -0.1999 0.0301 0.1207 183 LYS C CE 6389 N NZ . LYS D 188 ? 0.8755 0.8141 0.8699 -0.2064 0.0413 0.1449 183 LYS C NZ 6390 N N . ASP D 189 ? 0.9085 0.7890 0.8107 -0.1133 0.0952 0.1274 184 ASP C N 6391 C CA . ASP D 189 ? 0.9273 0.8001 0.8683 -0.1081 0.0978 0.1566 184 ASP C CA 6392 C C . ASP D 189 ? 0.9035 0.8134 0.8570 -0.0934 0.1011 0.1828 184 ASP C C 6393 O O . ASP D 189 ? 0.9042 0.8316 0.8743 -0.0995 0.0948 0.2170 184 ASP C O 6394 C CB . ASP D 189 ? 0.9827 0.7938 0.9422 -0.1014 0.1057 0.1431 184 ASP C CB 6395 C CG . ASP D 189 ? 1.0210 0.7903 0.9766 -0.1224 0.0960 0.1292 184 ASP C CG 6396 O OD1 . ASP D 189 ? 1.0041 0.7913 0.9412 -0.1406 0.0822 0.1236 184 ASP C OD1 6397 O OD2 . ASP D 189 ? 1.0704 0.7883 1.0485 -0.1213 0.1012 0.1251 184 ASP C OD2 6398 N N . GLU D 190 ? 0.8883 0.8081 0.8322 -0.0772 0.1096 0.1689 185 GLU C N 6399 C CA . GLU D 190 ? 0.8675 0.8251 0.8257 -0.0657 0.1077 0.1940 185 GLU C CA 6400 C C . GLU D 190 ? 0.8279 0.8349 0.7541 -0.0788 0.0999 0.2045 185 GLU C C 6401 O O . GLU D 190 ? 0.8273 0.8605 0.7565 -0.0831 0.0914 0.2356 185 GLU C O 6402 C CB . GLU D 190 ? 0.8672 0.8217 0.8335 -0.0453 0.1217 0.1758 185 GLU C CB 6403 C CG . GLU D 190 ? 0.8533 0.8436 0.8514 -0.0335 0.1153 0.2063 185 GLU C CG 6404 C CD . GLU D 190 ? 0.8569 0.8439 0.8807 -0.0124 0.1331 0.1905 185 GLU C CD 6405 O OE1 . GLU D 190 ? 0.8575 0.8289 0.8473 -0.0112 0.1504 0.1533 185 GLU C OE1 6406 O OE2 . GLU D 190 ? 0.8634 0.8633 0.9438 0.0010 0.1292 0.2178 185 GLU C OE2 6407 N N . TYR D 191 ? 0.8027 0.8192 0.6982 -0.0871 0.1022 0.1790 186 TYR C N 6408 C CA . TYR D 191 ? 0.7702 0.8284 0.6425 -0.0990 0.1008 0.1837 186 TYR C CA 6409 C C . TYR D 191 ? 0.7872 0.8537 0.6632 -0.1167 0.0993 0.2107 186 TYR C C 6410 O O . TYR D 191 ? 0.7812 0.8766 0.6377 -0.1257 0.1002 0.2276 186 TYR C O 6411 C CB . TYR D 191 ? 0.7472 0.8089 0.6031 -0.1055 0.1018 0.1552 186 TYR C CB 6412 C CG . TYR D 191 ? 0.7183 0.8181 0.5647 -0.1180 0.1056 0.1573 186 TYR C CG 6413 C CD1 . TYR D 191 ? 0.6969 0.8286 0.5246 -0.1152 0.1098 0.1608 186 TYR C CD1 6414 C CD2 . TYR D 191 ? 0.7168 0.8191 0.5788 -0.1336 0.1071 0.1544 186 TYR C CD2 6415 C CE1 . TYR D 191 ? 0.6805 0.8405 0.4987 -0.1276 0.1189 0.1580 186 TYR C CE1 6416 C CE2 . TYR D 191 ? 0.6964 0.8311 0.5598 -0.1439 0.1181 0.1533 186 TYR C CE2 6417 C CZ . TYR D 191 ? 0.6803 0.8413 0.5183 -0.1408 0.1259 0.1533 186 TYR C CZ 6418 O OH . TYR D 191 ? 0.6704 0.8576 0.5073 -0.1516 0.1420 0.1479 186 TYR C OH 6419 N N . GLU D 192 ? 0.8165 0.8540 0.7131 -0.1244 0.0979 0.2147 187 GLU C N 6420 C CA . GLU D 192 ? 0.8430 0.8841 0.7450 -0.1436 0.0996 0.2413 187 GLU C CA 6421 C C . GLU D 192 ? 0.8766 0.9105 0.7857 -0.1440 0.0917 0.2794 187 GLU C C 6422 O O . GLU D 192 ? 0.9022 0.9370 0.8068 -0.1630 0.0930 0.3054 187 GLU C O 6423 C CB . GLU D 192 ? 0.8620 0.8752 0.7898 -0.1540 0.0990 0.2333 187 GLU C CB 6424 C CG . GLU D 192 ? 0.8386 0.8633 0.7667 -0.1601 0.1004 0.2051 187 GLU C CG 6425 C CD . GLU D 192 ? 0.8595 0.8595 0.8177 -0.1739 0.0935 0.1992 187 GLU C CD 6426 O OE1 . GLU D 192 ? 0.8953 0.8690 0.8731 -0.1805 0.0914 0.2162 187 GLU C OE1 6427 O OE2 . GLU D 192 ? 0.8440 0.8514 0.8099 -0.1799 0.0874 0.1799 187 GLU C OE2 6428 N N . ARG D 193 ? 0.8826 0.9090 0.8074 -0.1249 0.0833 0.2855 188 ARG C N 6429 C CA . ARG D 193 ? 0.9151 0.9388 0.8562 -0.1259 0.0692 0.3277 188 ARG C CA 6430 C C . ARG D 193 ? 0.9145 0.9757 0.8159 -0.1375 0.0610 0.3482 188 ARG C C 6431 O O . ARG D 193 ? 0.9477 1.0098 0.8493 -0.1471 0.0436 0.3891 188 ARG C O 6432 C CB . ARG D 193 ? 0.9275 0.9246 0.9216 -0.1004 0.0649 0.3286 188 ARG C CB 6433 C CG . ARG D 193 ? 0.9425 0.8937 0.9626 -0.0928 0.0765 0.3005 188 ARG C CG 6434 C CD . ARG D 193 ? 0.9833 0.8947 1.0633 -0.0810 0.0732 0.3198 188 ARG C CD 6435 N NE . ARG D 193 ? 1.0162 0.9154 1.1071 -0.0994 0.0618 0.3556 188 ARG C NE 6436 C CZ . ARG D 193 ? 1.0396 0.9047 1.1389 -0.1105 0.0663 0.3472 188 ARG C CZ 6437 N NH1 . ARG D 193 ? 1.0384 0.8744 1.1329 -0.1070 0.0784 0.3034 188 ARG C NH1 6438 N NH2 . ARG D 193 ? 1.0703 0.9280 1.1802 -0.1286 0.0565 0.3849 188 ARG C NH2 6439 N N . HIS D 194 ? 0.8861 0.9746 0.7510 -0.1401 0.0715 0.3213 189 HIS C N 6440 C CA . HIS D 194 ? 0.8914 1.0110 0.7140 -0.1517 0.0650 0.3331 189 HIS C CA 6441 C C . HIS D 194 ? 0.8836 1.0215 0.6588 -0.1720 0.0852 0.3136 189 HIS C C 6442 O O . HIS D 194 ? 0.8549 0.9910 0.6420 -0.1687 0.1019 0.2841 189 HIS C O 6443 C CB . HIS D 194 ? 0.8635 0.9986 0.7006 -0.1303 0.0586 0.3192 189 HIS C CB 6444 C CG . HIS D 194 ? 0.8775 0.9973 0.7728 -0.1094 0.0447 0.3382 189 HIS C CG 6445 N ND1 . HIS D 194 ? 0.9142 1.0360 0.8280 -0.1153 0.0196 0.3842 189 HIS C ND1 6446 C CD2 . HIS D 194 ? 0.8659 0.9656 0.8085 -0.0840 0.0542 0.3178 189 HIS C CD2 6447 C CE1 . HIS D 194 ? 0.9173 1.0238 0.9013 -0.0910 0.0151 0.3919 189 HIS C CE1 6448 N NE2 . HIS D 194 ? 0.8901 0.9814 0.8891 -0.0719 0.0397 0.3494 189 HIS C NE2 6449 N N . ASN D 195 ? 0.9149 1.0681 0.6382 -0.1949 0.0829 0.3310 190 ASN C N 6450 C CA . ASN D 195 ? 0.9233 1.0893 0.6001 -0.2175 0.1092 0.3129 190 ASN C CA 6451 C C . ASN D 195 ? 0.8949 1.0840 0.5437 -0.2156 0.1141 0.2879 190 ASN C C 6452 O O . ASN D 195 ? 0.8690 1.0680 0.5201 -0.2149 0.1379 0.2556 190 ASN C O 6453 C CB . ASN D 195 ? 0.9930 1.1506 0.6159 -0.2524 0.1124 0.3446 190 ASN C CB 6454 C CG . ASN D 195 ? 1.0205 1.1567 0.6702 -0.2594 0.1197 0.3617 190 ASN C CG 6455 O OD1 . ASN D 195 ? 0.9920 1.1267 0.6775 -0.2538 0.1415 0.3378 190 ASN C OD1 6456 N ND2 . ASN D 195 ? 1.0779 1.1970 0.7154 -0.2733 0.0982 0.4062 190 ASN C ND2 6457 N N . SER D 196 ? 0.9007 1.0983 0.5311 -0.2152 0.0897 0.3048 191 SER C N 6458 C CA . SER D 196 ? 0.8885 1.1060 0.4849 -0.2197 0.0923 0.2851 191 SER C CA 6459 C C . SER D 196 ? 0.8300 1.0600 0.4721 -0.1887 0.0824 0.2669 191 SER C C 6460 O O . SER D 196 ? 0.8207 1.0486 0.5014 -0.1714 0.0607 0.2856 191 SER C O 6461 C CB . SER D 196 ? 0.9494 1.1680 0.4859 -0.2478 0.0700 0.3160 191 SER C CB 6462 O OG . SER D 196 ? 0.9520 1.1850 0.4480 -0.2577 0.0740 0.2949 191 SER C OG 6463 N N . TYR D 197 ? 0.7943 1.0358 0.4353 -0.1826 0.1011 0.2313 192 TYR C N 6464 C CA . TYR D 197 ? 0.7473 0.9988 0.4220 -0.1575 0.0959 0.2126 192 TYR C CA 6465 C C . TYR D 197 ? 0.7459 1.0160 0.3896 -0.1662 0.0982 0.1972 192 TYR C C 6466 O O . TYR D 197 ? 0.7484 1.0212 0.3684 -0.1793 0.1198 0.1756 192 TYR C O 6467 C CB . TYR D 197 ? 0.7093 0.9516 0.4183 -0.1419 0.1110 0.1865 192 TYR C CB 6468 C CG . TYR D 197 ? 0.7149 0.9340 0.4561 -0.1321 0.1058 0.1984 192 TYR C CG 6469 C CD1 . TYR D 197 ? 0.7415 0.9474 0.4808 -0.1465 0.1124 0.2107 192 TYR C CD1 6470 C CD2 . TYR D 197 ? 0.6997 0.9067 0.4733 -0.1102 0.0975 0.1966 192 TYR C CD2 6471 C CE1 . TYR D 197 ? 0.7506 0.9318 0.5210 -0.1390 0.1067 0.2212 192 TYR C CE1 6472 C CE2 . TYR D 197 ? 0.7138 0.8930 0.5156 -0.1026 0.0956 0.2038 192 TYR C CE2 6473 C CZ . TYR D 197 ? 0.7388 0.9051 0.5398 -0.1169 0.0980 0.2166 192 TYR C CZ 6474 O OH . TYR D 197 ? 0.7549 0.8906 0.5855 -0.1108 0.0954 0.2233 192 TYR C OH 6475 N N . THR D 198 ? 0.7462 1.0286 0.3979 -0.1591 0.0774 0.2083 193 THR C N 6476 C CA . THR D 198 ? 0.7555 1.0538 0.3767 -0.1708 0.0739 0.1982 193 THR C CA 6477 C C . THR D 198 ? 0.7144 1.0264 0.3760 -0.1474 0.0692 0.1858 193 THR C C 6478 O O . THR D 198 ? 0.6899 1.0018 0.3965 -0.1271 0.0596 0.1980 193 THR C O 6479 C CB . THR D 198 ? 0.8103 1.1117 0.3916 -0.1958 0.0473 0.2301 193 THR C CB 6480 O OG1 . THR D 198 ? 0.8699 1.1544 0.4010 -0.2225 0.0543 0.2425 193 THR C OG1 6481 C CG2 . THR D 198 ? 0.8222 1.1358 0.3674 -0.2118 0.0417 0.2177 193 THR C CG2 6482 N N . CYS D 199 ? 0.7107 1.0318 0.3563 -0.1519 0.0799 0.1607 194 CYS C N 6483 C CA . CYS D 199 ? 0.6853 1.0193 0.3592 -0.1357 0.0777 0.1482 194 CYS C CA 6484 C C . CYS D 199 ? 0.7043 1.0531 0.3513 -0.1536 0.0644 0.1504 194 CYS C C 6485 O O . CYS D 199 ? 0.7226 1.0680 0.3296 -0.1726 0.0761 0.1320 194 CYS C O 6486 C CB . CYS D 199 ? 0.6608 0.9889 0.3440 -0.1271 0.0994 0.1179 194 CYS C CB 6487 S SG . CYS D 199 ? 0.6464 0.9862 0.3522 -0.1135 0.0992 0.1022 194 CYS C SG 6488 N N . GLU D 200 ? 0.7070 1.0706 0.3808 -0.1483 0.0412 0.1721 195 GLU C N 6489 C CA . GLU D 200 ? 0.7334 1.1113 0.3859 -0.1686 0.0196 0.1806 195 GLU C CA 6490 C C . GLU D 200 ? 0.6900 1.0851 0.3803 -0.1551 0.0199 0.1694 195 GLU C C 6491 O O . GLU D 200 ? 0.6597 1.0655 0.4075 -0.1332 0.0170 0.1809 195 GLU C O 6492 C CB . GLU D 200 ? 0.7771 1.1624 0.4390 -0.1791 -0.0157 0.2225 195 GLU C CB 6493 C CG . GLU D 200 ? 0.8457 1.2138 0.4477 -0.2069 -0.0254 0.2399 195 GLU C CG 6494 C CD . GLU D 200 ? 0.9049 1.2815 0.5053 -0.2272 -0.0711 0.2842 195 GLU C CD 6495 O OE1 . GLU D 200 ? 0.9643 1.3266 0.5313 -0.2460 -0.0861 0.3112 195 GLU C OE1 6496 O OE2 . GLU D 200 ? 0.9086 1.3062 0.5439 -0.2263 -0.0947 0.2951 195 GLU C OE2 6497 N N . ALA D 201 ? 0.6892 1.0849 0.3480 -0.1701 0.0259 0.1471 196 ALA C N 6498 C CA . ALA D 201 ? 0.6591 1.0691 0.3478 -0.1621 0.0262 0.1365 196 ALA C CA 6499 C C . ALA D 201 ? 0.6887 1.1130 0.3664 -0.1853 -0.0031 0.1509 196 ALA C C 6500 O O . ALA D 201 ? 0.7326 1.1455 0.3507 -0.2145 -0.0079 0.1413 196 ALA C O 6501 C CB . ALA D 201 ? 0.6438 1.0421 0.3164 -0.1616 0.0525 0.1018 196 ALA C CB 6502 N N . THR D 202 ? 0.6705 1.1177 0.4068 -0.1742 -0.0211 0.1728 197 THR C N 6503 C CA . THR D 202 ? 0.6957 1.1604 0.4372 -0.1955 -0.0525 0.1877 197 THR C CA 6504 C C . THR D 202 ? 0.6613 1.1356 0.4288 -0.1885 -0.0392 0.1670 197 THR C C 6505 O O . THR D 202 ? 0.6200 1.1027 0.4406 -0.1615 -0.0197 0.1640 197 THR C O 6506 C CB . THR D 202 ? 0.7026 1.1914 0.5099 -0.1902 -0.0848 0.2312 197 THR C CB 6507 O OG1 . THR D 202 ? 0.7396 1.2178 0.5240 -0.1994 -0.1024 0.2557 197 THR C OG1 6508 C CG2 . THR D 202 ? 0.7299 1.2395 0.5522 -0.2141 -0.1221 0.2488 197 THR C CG2 6509 N N . HIS D 203 ? 0.6877 1.1561 0.4125 -0.2156 -0.0486 0.1522 198 HIS C N 6510 C CA . HIS D 203 ? 0.6666 1.1385 0.4086 -0.2135 -0.0363 0.1309 198 HIS C CA 6511 C C . HIS D 203 ? 0.7155 1.1907 0.4330 -0.2480 -0.0674 0.1347 198 HIS C C 6512 O O . HIS D 203 ? 0.7748 1.2383 0.4350 -0.2774 -0.0903 0.1427 198 HIS C O 6513 C CB . HIS D 203 ? 0.6553 1.1013 0.3619 -0.2089 -0.0014 0.0942 198 HIS C CB 6514 C CG . HIS D 203 ? 0.6301 1.0765 0.3618 -0.2031 0.0124 0.0751 198 HIS C CG 6515 N ND1 . HIS D 203 ? 0.6574 1.0875 0.3575 -0.2245 0.0166 0.0501 198 HIS C ND1 6516 C CD2 . HIS D 203 ? 0.5862 1.0439 0.3692 -0.1805 0.0242 0.0780 198 HIS C CD2 6517 C CE1 . HIS D 203 ? 0.6279 1.0612 0.3657 -0.2137 0.0272 0.0412 198 HIS C CE1 6518 N NE2 . HIS D 203 ? 0.5865 1.0367 0.3706 -0.1884 0.0312 0.0590 198 HIS C NE2 6519 N N . LYS D 204 ? 0.7038 1.1921 0.4590 -0.2483 -0.0701 0.1302 199 LYS C N 6520 C CA . LYS D 204 ? 0.7531 1.2457 0.4923 -0.2831 -0.1054 0.1370 199 LYS C CA 6521 C C . LYS D 204 ? 0.8166 1.2717 0.4610 -0.3181 -0.1015 0.1046 199 LYS C C 6522 O O . LYS D 204 ? 0.8823 1.3296 0.4797 -0.3560 -0.1354 0.1124 199 LYS C O 6523 C CB . LYS D 204 ? 0.7259 1.2422 0.5351 -0.2762 -0.1088 0.1416 199 LYS C CB 6524 C CG . LYS D 204 ? 0.7237 1.2204 0.5154 -0.2800 -0.0844 0.1058 199 LYS C CG 6525 C CD . LYS D 204 ? 0.6918 1.2135 0.5592 -0.2701 -0.0845 0.1157 199 LYS C CD 6526 C CE . LYS D 204 ? 0.7291 1.2694 0.6188 -0.3000 -0.1274 0.1357 199 LYS C CE 6527 N NZ . LYS D 204 ? 0.7791 1.2905 0.6126 -0.3332 -0.1341 0.1064 199 LYS C NZ 6528 N N . THR D 205 ? 0.8045 1.2343 0.4215 -0.3073 -0.0600 0.0694 200 THR C N 6529 C CA . THR D 205 ? 0.8654 1.2563 0.4026 -0.3370 -0.0435 0.0333 200 THR C CA 6530 C C . THR D 205 ? 0.9423 1.3129 0.3951 -0.3681 -0.0562 0.0394 200 THR C C 6531 O O . THR D 205 ? 1.0124 1.3462 0.3873 -0.3990 -0.0403 0.0090 200 THR C O 6532 C CB . THR D 205 ? 0.8329 1.2045 0.3781 -0.3150 0.0050 -0.0003 200 THR C CB 6533 O OG1 . THR D 205 ? 0.7883 1.1699 0.3565 -0.2861 0.0182 0.0132 200 THR C OG1 6534 C CG2 . THR D 205 ? 0.7877 1.1664 0.3941 -0.2973 0.0162 -0.0113 200 THR C CG2 6535 N N . SER D 206 ? 0.9384 1.3290 0.4052 -0.3616 -0.0823 0.0780 201 SER C N 6536 C CA . SER D 206 ? 1.0184 1.3910 0.4048 -0.3967 -0.1054 0.0938 201 SER C CA 6537 C C . SER D 206 ? 1.0154 1.4188 0.4457 -0.3933 -0.1536 0.1480 201 SER C C 6538 O O . SER D 206 ? 0.9473 1.3815 0.4688 -0.3542 -0.1512 0.1680 201 SER C O 6539 C CB . SER D 206 ? 1.0279 1.3752 0.3666 -0.3920 -0.0654 0.0752 201 SER C CB 6540 O OG . SER D 206 ? 1.1035 1.4343 0.3655 -0.4256 -0.0884 0.0968 201 SER C OG 6541 N N . THR D 207 ? 1.1007 1.4921 0.4649 -0.4365 -0.1965 0.1717 202 THR C N 6542 C CA . THR D 207 ? 1.1089 1.5248 0.5121 -0.4384 -0.2467 0.2283 202 THR C CA 6543 C C . THR D 207 ? 1.1115 1.5170 0.4941 -0.4269 -0.2324 0.2423 202 THR C C 6544 O O . THR D 207 ? 1.0950 1.5228 0.5385 -0.4123 -0.2609 0.2868 202 THR C O 6545 C CB . THR D 207 ? 1.2106 1.6144 0.5453 -0.4954 -0.3067 0.2537 202 THR C CB 6546 O OG1 . THR D 207 ? 1.3053 1.6586 0.5002 -0.5378 -0.2903 0.2258 202 THR C OG1 6547 C CG2 . THR D 207 ? 1.2114 1.6273 0.5750 -0.5092 -0.3278 0.2450 202 THR C CG2 6548 N N . SER D 208 ? 1.1372 1.5078 0.4402 -0.4347 -0.1876 0.2049 203 SER C N 6549 C CA . SER D 208 ? 1.1315 1.4909 0.4196 -0.4210 -0.1633 0.2105 203 SER C CA 6550 C C . SER D 208 ? 1.0302 1.4035 0.3969 -0.3688 -0.1161 0.1864 203 SER C C 6551 O O . SER D 208 ? 0.9932 1.3642 0.3724 -0.3577 -0.0860 0.1492 203 SER C O 6552 C CB . SER D 208 ? 1.2228 1.5362 0.3828 -0.4627 -0.1392 0.1858 203 SER C CB 6553 O OG . SER D 208 ? 1.3192 1.6183 0.4065 -0.5068 -0.1864 0.2249 203 SER C OG 6554 N N . PRO D 209 ? 0.9910 1.3762 0.4113 -0.3388 -0.1129 0.2094 204 PRO C N 6555 C CA . PRO D 209 ? 0.9177 1.3074 0.3933 -0.2966 -0.0700 0.1860 204 PRO C CA 6556 C C . PRO D 209 ? 0.9355 1.2970 0.3548 -0.3032 -0.0245 0.1472 204 PRO C C 6557 O O . PRO D 209 ? 1.0044 1.3413 0.3429 -0.3367 -0.0213 0.1453 204 PRO C O 6558 C CB . PRO D 209 ? 0.8927 1.2926 0.4215 -0.2735 -0.0816 0.2212 204 PRO C CB 6559 C CG . PRO D 209 ? 0.9656 1.3578 0.4463 -0.3077 -0.1214 0.2588 204 PRO C CG 6560 C CD . PRO D 209 ? 1.0177 1.4107 0.4545 -0.3437 -0.1522 0.2601 204 PRO C CD 6561 N N . ILE D 210 ? 0.8768 1.2408 0.3398 -0.2742 0.0100 0.1183 205 ILE C N 6562 C CA . ILE D 210 ? 0.8841 1.2275 0.3247 -0.2729 0.0522 0.0881 205 ILE C CA 6563 C C . ILE D 210 ? 0.8569 1.2010 0.3239 -0.2534 0.0572 0.1063 205 ILE C C 6564 O O . ILE D 210 ? 0.8032 1.1625 0.3322 -0.2237 0.0485 0.1208 205 ILE C O 6565 C CB . ILE D 210 ? 0.8402 1.1843 0.3201 -0.2543 0.0805 0.0539 205 ILE C CB 6566 C CG1 . ILE D 210 ? 0.8792 1.2170 0.3289 -0.2776 0.0764 0.0350 205 ILE C CG1 6567 C CG2 . ILE D 210 ? 0.8403 1.1665 0.3173 -0.2513 0.1217 0.0279 205 ILE C CG2 6568 C CD1 . ILE D 210 ? 0.8355 1.1768 0.3349 -0.2590 0.0946 0.0098 205 ILE C CD1 6569 N N . VAL D 211 ? 0.9025 1.2265 0.3175 -0.2736 0.0728 0.1051 206 VAL C N 6570 C CA . VAL D 211 ? 0.8947 1.2153 0.3256 -0.2624 0.0761 0.1241 206 VAL C CA 6571 C C . VAL D 211 ? 0.8787 1.1876 0.3208 -0.2548 0.1194 0.0947 206 VAL C C 6572 O O . VAL D 211 ? 0.9163 1.2104 0.3197 -0.2752 0.1487 0.0675 206 VAL C O 6573 C CB . VAL D 211 ? 0.9684 1.2752 0.3324 -0.2959 0.0562 0.1537 206 VAL C CB 6574 C CG1 . VAL D 211 ? 0.9583 1.2609 0.3458 -0.2840 0.0561 0.1780 206 VAL C CG1 6575 C CG2 . VAL D 211 ? 0.9923 1.3116 0.3498 -0.3089 0.0074 0.1850 206 VAL C CG2 6576 N N . LYS D 212 ? 0.8256 1.1397 0.3250 -0.2264 0.1238 0.0994 207 LYS C N 6577 C CA . LYS D 212 ? 0.8147 1.1194 0.3336 -0.2214 0.1566 0.0816 207 LYS C CA 6578 C C . LYS D 212 ? 0.8060 1.1070 0.3460 -0.2109 0.1479 0.1059 207 LYS C C 6579 O O . LYS D 212 ? 0.7706 1.0783 0.3454 -0.1902 0.1248 0.1232 207 LYS C O 6580 C CB . LYS D 212 ? 0.7630 1.0749 0.3389 -0.1984 0.1690 0.0575 207 LYS C CB 6581 C CG . LYS D 212 ? 0.7783 1.0871 0.3437 -0.2104 0.1908 0.0276 207 LYS C CG 6582 C CD . LYS D 212 ? 0.8247 1.1171 0.3621 -0.2333 0.2290 0.0099 207 LYS C CD 6583 C CE . LYS D 212 ? 0.8295 1.1160 0.3863 -0.2370 0.2600 -0.0249 207 LYS C CE 6584 N NZ . LYS D 212 ? 0.8614 1.1427 0.3698 -0.2540 0.2511 -0.0353 207 LYS C NZ 6585 N N . SER D 213 ? 0.8396 1.1276 0.3604 -0.2262 0.1699 0.1061 208 SER C N 6586 C CA . SER D 213 ? 0.8433 1.1244 0.3824 -0.2199 0.1624 0.1297 208 SER C CA 6587 C C . SER D 213 ? 0.8569 1.1286 0.4085 -0.2272 0.1955 0.1184 208 SER C C 6588 O O . SER D 213 ? 0.8761 1.1461 0.4196 -0.2396 0.2279 0.0934 208 SER C O 6589 C CB . SER D 213 ? 0.8957 1.1699 0.3862 -0.2399 0.1383 0.1645 208 SER C CB 6590 O OG . SER D 213 ? 0.9620 1.2226 0.3808 -0.2760 0.1574 0.1614 208 SER C OG 6591 N N . PHE D 214 ? 0.8561 1.1209 0.4345 -0.2195 0.1886 0.1371 209 PHE C N 6592 C CA . PHE D 214 ? 0.8796 1.1360 0.4731 -0.2295 0.2165 0.1340 209 PHE C CA 6593 C C . PHE D 214 ? 0.9104 1.1540 0.4988 -0.2336 0.2002 0.1671 209 PHE C C 6594 O O . PHE D 214 ? 0.8986 1.1406 0.4992 -0.2183 0.1686 0.1864 209 PHE C O 6595 C CB . PHE D 214 ? 0.8242 1.0870 0.4908 -0.2091 0.2251 0.1141 209 PHE C CB 6596 C CG . PHE D 214 ? 0.7834 1.0422 0.4882 -0.1852 0.1953 0.1242 209 PHE C CG 6597 C CD1 . PHE D 214 ? 0.7483 1.0128 0.4610 -0.1664 0.1751 0.1176 209 PHE C CD1 6598 C CD2 . PHE D 214 ? 0.7880 1.0337 0.5181 -0.1839 0.1908 0.1386 209 PHE C CD2 6599 C CE1 . PHE D 214 ? 0.7262 0.9807 0.4652 -0.1478 0.1549 0.1229 209 PHE C CE1 6600 C CE2 . PHE D 214 ? 0.7623 0.9968 0.5203 -0.1650 0.1674 0.1432 209 PHE C CE2 6601 C CZ . PHE D 214 ? 0.7349 0.9723 0.4941 -0.1474 0.1514 0.1341 209 PHE C CZ 6602 N N . ASN D 215 ? 0.9584 1.1918 0.5352 -0.2539 0.2248 0.1733 210 ASN C N 6603 C CA . ASN D 215 ? 0.9883 1.2070 0.5689 -0.2589 0.2125 0.2052 210 ASN C CA 6604 C C . ASN D 215 ? 0.9586 1.1754 0.6104 -0.2449 0.2223 0.1967 210 ASN C C 6605 O O . ASN D 215 ? 0.9623 1.1846 0.6377 -0.2532 0.2551 0.1782 210 ASN C O 6606 C CB . ASN D 215 ? 1.0676 1.2723 0.5814 -0.2960 0.2309 0.2241 210 ASN C CB 6607 C CG . ASN D 215 ? 1.1172 1.3131 0.5690 -0.3114 0.1965 0.2589 210 ASN C CG 6608 O OD1 . ASN D 215 ? 1.1069 1.3124 0.5485 -0.3025 0.1707 0.2587 210 ASN C OD1 6609 N ND2 . ASN D 215 ? 1.1845 1.3621 0.5965 -0.3377 0.1950 0.2918 210 ASN C ND2 6610 N N . ARG D 216 ? 0.9410 1.1481 0.6298 -0.2256 0.1947 0.2101 211 ARG C N 6611 C CA . ARG D 216 ? 0.9160 1.1158 0.6668 -0.2148 0.1954 0.2028 211 ARG C CA 6612 C C . ARG D 216 ? 0.9559 1.1526 0.7194 -0.2372 0.2243 0.2091 211 ARG C C 6613 O O . ARG D 216 ? 0.9417 1.1457 0.7578 -0.2365 0.2400 0.1928 211 ARG C O 6614 C CB . ARG D 216 ? 0.9050 1.0843 0.6752 -0.1983 0.1654 0.2195 211 ARG C CB 6615 C CG . ARG D 216 ? 0.8749 1.0406 0.6979 -0.1862 0.1581 0.2060 211 ARG C CG 6616 C CD . ARG D 216 ? 0.8834 1.0208 0.7201 -0.1733 0.1362 0.2188 211 ARG C CD 6617 N NE . ARG D 216 ? 0.9145 1.0320 0.7718 -0.1860 0.1379 0.2381 211 ARG C NE 6618 C CZ . ARG D 216 ? 0.9549 1.0639 0.7963 -0.1978 0.1367 0.2700 211 ARG C CZ 6619 N NH1 . ARG D 216 ? 0.9717 1.0899 0.7749 -0.2001 0.1298 0.2887 211 ARG C NH1 6620 N NH2 . ARG D 216 ? 0.9896 1.0793 0.8548 -0.2098 0.1389 0.2862 211 ARG C NH2 6621 N N . ASN D 217 ? 1.0171 1.2034 0.7343 -0.2590 0.2303 0.2353 212 ASN C N 6622 C CA . ASN D 217 ? 1.0668 1.2471 0.7831 -0.2851 0.2618 0.2461 212 ASN C CA 6623 C C . ASN D 217 ? 1.0899 1.2836 0.7970 -0.3043 0.3107 0.2228 212 ASN C C 6624 O O . ASN D 217 ? 1.1354 1.3236 0.8428 -0.3278 0.3442 0.2306 212 ASN C O 6625 C CB . ASN D 217 ? 1.1375 1.2987 0.7926 -0.3072 0.2517 0.2849 212 ASN C CB 6626 C CG . ASN D 217 ? 1.1712 1.3343 0.7471 -0.3183 0.2404 0.2918 212 ASN C CG 6627 O OD1 . ASN D 217 ? 1.1516 1.3196 0.7304 -0.2978 0.2071 0.2933 212 ASN C OD1 6628 N ND2 . ASN D 217 ? 1.2373 1.3949 0.7415 -0.3531 0.2694 0.2948 212 ASN C ND2 6629 N N . GLU D 218 ? 1.0603 1.2688 0.7611 -0.2960 0.3191 0.1945 213 GLU C N 6630 C CA . GLU D 218 ? 1.0748 1.2935 0.7847 -0.3102 0.3696 0.1674 213 GLU C CA 6631 C C . GLU D 218 ? 1.0114 1.2498 0.8128 -0.2865 0.3717 0.1406 213 GLU C C 6632 O O . GLU D 218 ? 1.0125 1.2613 0.8449 -0.2928 0.4124 0.1169 213 GLU C O 6633 C CB . GLU D 218 ? 1.1190 1.3327 0.7392 -0.3284 0.3849 0.1561 213 GLU C CB 6634 C CG . GLU D 218 ? 1.1739 1.3696 0.7014 -0.3468 0.3570 0.1883 213 GLU C CG 6635 C CD . GLU D 218 ? 1.2385 1.4248 0.6682 -0.3737 0.3714 0.1778 213 GLU C CD 6636 O OE1 . GLU D 218 ? 1.3217 1.4871 0.6639 -0.4080 0.3731 0.2015 213 GLU C OE1 6637 O OE2 . GLU D 218 ? 1.2152 1.4119 0.6513 -0.3634 0.3784 0.1469 213 GLU C OE2 6638 N N . CYS D 219 ? 0.9646 1.2049 0.8087 -0.2614 0.3283 0.1452 214 CYS C N 6639 C CA . CYS D 219 ? 0.9111 1.1656 0.8342 -0.2421 0.3183 0.1268 214 CYS C CA 6640 C C . CYS D 219 ? 0.9012 1.1564 0.9043 -0.2450 0.3186 0.1358 214 CYS C C 6641 O O . CYS D 219 ? 0.9378 1.1877 0.9419 -0.2637 0.3436 0.1492 214 CYS C O 6642 C CB . CYS D 219 ? 0.8712 1.1219 0.7818 -0.2188 0.2722 0.1257 214 CYS C CB 6643 S SG . CYS D 219 ? 0.8707 1.1278 0.7152 -0.2130 0.2693 0.1124 214 CYS C SG 6644 N N . ASP E 1 ? 0.6178 2.1238 0.4348 -0.5667 -0.0364 -0.2891 1 ASP F N 6645 C CA . ASP E 1 ? 0.5926 1.9458 0.4277 -0.5349 -0.0287 -0.2667 1 ASP F CA 6646 C C . ASP E 1 ? 0.5690 1.8903 0.3922 -0.4954 -0.0568 -0.1855 1 ASP F C 6647 O O . ASP E 1 ? 0.5708 1.9742 0.3814 -0.4886 -0.0807 -0.1458 1 ASP F O 6648 C CB . ASP E 1 ? 0.5916 1.8798 0.4606 -0.5374 -0.0128 -0.2997 1 ASP F CB 6649 C CG . ASP E 1 ? 0.6202 1.9281 0.5105 -0.5779 0.0210 -0.3830 1 ASP F CG 6650 O OD1 . ASP E 1 ? 0.6361 2.0510 0.5147 -0.6109 0.0259 -0.4216 1 ASP F OD1 6651 O OD2 . ASP E 1 ? 0.6258 1.8432 0.5463 -0.5776 0.0446 -0.4098 1 ASP F OD2 6652 N N . ILE E 2 ? 0.5523 1.7573 0.3826 -0.4693 -0.0521 -0.1618 2 ILE F N 6653 C CA . ILE E 2 ? 0.5299 1.6839 0.3584 -0.4331 -0.0722 -0.0942 2 ILE F CA 6654 C C . ILE E 2 ? 0.5010 1.6000 0.3537 -0.4161 -0.0755 -0.0870 2 ILE F C 6655 O O . ILE E 2 ? 0.4794 1.4956 0.3498 -0.4141 -0.0585 -0.1139 2 ILE F O 6656 C CB . ILE E 2 ? 0.5306 1.5960 0.3561 -0.4161 -0.0652 -0.0763 2 ILE F CB 6657 C CG1 . ILE E 2 ? 0.5542 1.6802 0.3548 -0.4311 -0.0640 -0.0743 2 ILE F CG1 6658 C CG2 . ILE E 2 ? 0.5169 1.5199 0.3479 -0.3825 -0.0802 -0.0175 2 ILE F CG2 6659 C CD1 . ILE E 2 ? 0.5741 1.7204 0.3764 -0.4604 -0.0399 -0.1402 2 ILE F CD1 6660 N N . LEU E 3 ? 0.4985 1.6486 0.3525 -0.4029 -0.0968 -0.0479 3 LEU F N 6661 C CA . LEU E 3 ? 0.4807 1.5932 0.3586 -0.3865 -0.1015 -0.0385 3 LEU F CA 6662 C C . LEU E 3 ? 0.4577 1.4731 0.3435 -0.3535 -0.1058 0.0050 3 LEU F C 6663 O O . LEU E 3 ? 0.4561 1.4782 0.3350 -0.3352 -0.1188 0.0543 3 LEU F O 6664 C CB . LEU E 3 ? 0.4972 1.7139 0.3786 -0.3833 -0.1226 -0.0136 3 LEU F CB 6665 C CG . LEU E 3 ? 0.4908 1.6933 0.3999 -0.3656 -0.1302 -0.0007 3 LEU F CG 6666 C CD1 . LEU E 3 ? 0.4842 1.6388 0.4112 -0.3839 -0.1093 -0.0569 3 LEU F CD1 6667 C CD2 . LEU E 3 ? 0.5003 1.8264 0.4140 -0.3626 -0.1518 0.0229 3 LEU F CD2 6668 N N . MET E 4 ? 0.4450 1.3740 0.3472 -0.3470 -0.0933 -0.0134 4 MET F N 6669 C CA . MET E 4 ? 0.4239 1.2658 0.3351 -0.3193 -0.0953 0.0185 4 MET F CA 6670 C C . MET E 4 ? 0.4155 1.2581 0.3484 -0.3058 -0.1029 0.0315 4 MET F C 6671 O O . MET E 4 ? 0.4158 1.2486 0.3604 -0.3165 -0.0927 -0.0013 4 MET F O 6672 C CB . MET E 4 ? 0.4174 1.1739 0.3308 -0.3206 -0.0763 -0.0097 4 MET F CB 6673 C CG . MET E 4 ? 0.4290 1.1862 0.3274 -0.3345 -0.0651 -0.0311 4 MET F CG 6674 S SD . MET E 4 ? 0.4333 1.1846 0.3166 -0.3202 -0.0760 0.0122 4 MET F SD 6675 C CE . MET E 4 ? 0.4199 1.0666 0.3150 -0.2982 -0.0691 0.0190 4 MET F CE 6676 N N . ASN E 5 ? 0.4141 1.2677 0.3565 -0.2828 -0.1179 0.0782 5 ASN F N 6677 C CA . ASN E 5 ? 0.4055 1.2535 0.3737 -0.2695 -0.1217 0.0839 5 ASN F CA 6678 C C . ASN E 5 ? 0.3838 1.1473 0.3670 -0.2456 -0.1185 0.1059 5 ASN F C 6679 O O . ASN E 5 ? 0.3855 1.1241 0.3706 -0.2294 -0.1223 0.1406 5 ASN F O 6680 C CB . ASN E 5 ? 0.4258 1.3690 0.4074 -0.2641 -0.1382 0.1048 5 ASN F CB 6681 C CG . ASN E 5 ? 0.4545 1.4425 0.4299 -0.2493 -0.1524 0.1551 5 ASN F CG 6682 O OD1 . ASN E 5 ? 0.4806 1.4351 0.4749 -0.2217 -0.1568 0.1983 5 ASN F OD1 6683 N ND2 . ASN E 5 ? 0.4676 1.5319 0.4181 -0.2681 -0.1571 0.1501 5 ASN F ND2 6684 N N . GLN E 6 ? 0.3633 1.0877 0.3590 -0.2462 -0.1094 0.0824 6 GLN F N 6685 C CA . GLN E 6 ? 0.3504 0.9976 0.3572 -0.2306 -0.1023 0.0879 6 GLN F CA 6686 C C . GLN E 6 ? 0.3453 1.0054 0.3830 -0.2129 -0.1080 0.1051 6 GLN F C 6687 O O . GLN E 6 ? 0.3476 1.0583 0.3971 -0.2186 -0.1112 0.0939 6 GLN F O 6688 C CB . GLN E 6 ? 0.3423 0.9436 0.3408 -0.2438 -0.0863 0.0512 6 GLN F CB 6689 C CG . GLN E 6 ? 0.3385 0.8694 0.3268 -0.2367 -0.0780 0.0518 6 GLN F CG 6690 C CD . GLN E 6 ? 0.3385 0.8326 0.3175 -0.2477 -0.0620 0.0225 6 GLN F CD 6691 O OE1 . GLN E 6 ? 0.3406 0.8491 0.3103 -0.2642 -0.0542 0.0009 6 GLN F OE1 6692 N NE2 . GLN E 6 ? 0.3386 0.7869 0.3222 -0.2387 -0.0546 0.0216 6 GLN F NE2 6693 N N . THR E 7 ? 0.3452 0.9612 0.3999 -0.1925 -0.1072 0.1289 7 THR F N 6694 C CA . THR E 7 ? 0.3421 0.9619 0.4323 -0.1741 -0.1084 0.1416 7 THR F CA 6695 C C . THR E 7 ? 0.3377 0.8827 0.4389 -0.1647 -0.0963 0.1366 7 THR F C 6696 O O . THR E 7 ? 0.3399 0.8424 0.4273 -0.1662 -0.0916 0.1391 7 THR F O 6697 C CB . THR E 7 ? 0.3605 1.0272 0.4746 -0.1534 -0.1205 0.1858 7 THR F CB 6698 O OG1 . THR E 7 ? 0.3728 1.0077 0.4812 -0.1461 -0.1192 0.2141 7 THR F OG1 6699 C CG2 . THR E 7 ? 0.3662 1.1272 0.4709 -0.1626 -0.1345 0.1895 7 THR F CG2 6700 N N . PRO E 8 ? 0.3329 0.8684 0.4587 -0.1576 -0.0902 0.1252 8 PRO F N 6701 C CA . PRO E 8 ? 0.3272 0.9139 0.4697 -0.1593 -0.0935 0.1151 8 PRO F CA 6702 C C . PRO E 8 ? 0.3188 0.9113 0.4350 -0.1848 -0.0871 0.0797 8 PRO F C 6703 O O . PRO E 8 ? 0.3169 0.8695 0.4042 -0.1969 -0.0799 0.0662 8 PRO F O 6704 C CB . PRO E 8 ? 0.3273 0.8867 0.5044 -0.1443 -0.0842 0.1117 8 PRO F CB 6705 C CG . PRO E 8 ? 0.3273 0.8179 0.4893 -0.1477 -0.0723 0.1000 8 PRO F CG 6706 C CD . PRO E 8 ? 0.3315 0.8090 0.4722 -0.1494 -0.0778 0.1178 8 PRO F CD 6707 N N . LEU E 9 ? 0.3185 0.9617 0.4486 -0.1924 -0.0880 0.0653 9 LEU F N 6708 C CA . LEU E 9 ? 0.3181 0.9639 0.4314 -0.2187 -0.0766 0.0299 9 LEU F CA 6709 C C . LEU E 9 ? 0.3097 0.8962 0.4216 -0.2209 -0.0594 0.0133 9 LEU F C 6710 O O . LEU E 9 ? 0.3085 0.8597 0.3978 -0.2371 -0.0458 -0.0053 9 LEU F O 6711 C CB . LEU E 9 ? 0.3251 1.0524 0.4577 -0.2291 -0.0817 0.0172 9 LEU F CB 6712 C CG . LEU E 9 ? 0.3388 1.0901 0.4570 -0.2625 -0.0704 -0.0207 9 LEU F CG 6713 C CD1 . LEU E 9 ? 0.3437 1.1999 0.4783 -0.2743 -0.0812 -0.0308 9 LEU F CD1 6714 C CD2 . LEU E 9 ? 0.3448 1.0495 0.4649 -0.2763 -0.0480 -0.0473 9 LEU F CD2 6715 N N . SER E 10 ? 0.3038 0.8840 0.4423 -0.2040 -0.0586 0.0212 10 SER F N 6716 C CA . SER E 10 ? 0.3029 0.8323 0.4383 -0.2036 -0.0436 0.0093 10 SER F CA 6717 C C . SER E 10 ? 0.2985 0.8021 0.4535 -0.1817 -0.0452 0.0248 10 SER F C 6718 O O . SER E 10 ? 0.2968 0.8252 0.4823 -0.1639 -0.0545 0.0445 10 SER F O 6719 C CB . SER E 10 ? 0.3084 0.8600 0.4598 -0.2141 -0.0322 -0.0118 10 SER F CB 6720 O OG . SER E 10 ? 0.3104 0.9166 0.5013 -0.2016 -0.0408 -0.0058 10 SER F OG 6721 N N . LEU E 11 ? 0.2950 0.7503 0.4336 -0.1833 -0.0346 0.0163 11 LEU F N 6722 C CA . LEU E 11 ? 0.2972 0.7264 0.4540 -0.1686 -0.0317 0.0217 11 LEU F CA 6723 C C . LEU E 11 ? 0.3013 0.7133 0.4582 -0.1731 -0.0162 0.0000 11 LEU F C 6724 O O . LEU E 11 ? 0.3080 0.6942 0.4329 -0.1821 -0.0097 -0.0083 11 LEU F O 6725 C CB . LEU E 11 ? 0.2967 0.6945 0.4312 -0.1679 -0.0359 0.0323 11 LEU F CB 6726 C CG . LEU E 11 ? 0.3042 0.6733 0.4589 -0.1573 -0.0300 0.0336 11 LEU F CG 6727 C CD1 . LEU E 11 ? 0.3140 0.6946 0.5190 -0.1390 -0.0298 0.0481 11 LEU F CD1 6728 C CD2 . LEU E 11 ? 0.3040 0.6515 0.4365 -0.1601 -0.0346 0.0434 11 LEU F CD2 6729 N N . PRO E 12 ? 0.3020 0.7347 0.4955 -0.1660 -0.0101 -0.0084 12 PRO F N 6730 C CA . PRO E 12 ? 0.3077 0.7310 0.5054 -0.1704 0.0061 -0.0311 12 PRO F CA 6731 C C . PRO E 12 ? 0.3140 0.7072 0.5165 -0.1648 0.0121 -0.0370 12 PRO F C 6732 O O . PRO E 12 ? 0.3215 0.7062 0.5570 -0.1506 0.0099 -0.0268 12 PRO F O 6733 C CB . PRO E 12 ? 0.3108 0.7685 0.5568 -0.1606 0.0101 -0.0374 12 PRO F CB 6734 C CG . PRO E 12 ? 0.3031 0.7973 0.5590 -0.1566 -0.0048 -0.0195 12 PRO F CG 6735 C CD . PRO E 12 ? 0.2998 0.7760 0.5319 -0.1546 -0.0178 0.0019 12 PRO F CD 6736 N N . VAL E 13 ? 0.3145 0.6947 0.4851 -0.1766 0.0208 -0.0523 13 VAL F N 6737 C CA . VAL E 13 ? 0.3200 0.6844 0.4963 -0.1763 0.0287 -0.0668 13 VAL F CA 6738 C C . VAL E 13 ? 0.3274 0.7060 0.4916 -0.1877 0.0440 -0.0936 13 VAL F C 6739 O O . VAL E 13 ? 0.3262 0.7178 0.4615 -0.1970 0.0471 -0.0933 13 VAL F O 6740 C CB . VAL E 13 ? 0.3188 0.6638 0.4623 -0.1796 0.0201 -0.0563 13 VAL F CB 6741 C CG1 . VAL E 13 ? 0.3137 0.6462 0.4736 -0.1693 0.0082 -0.0327 13 VAL F CG1 6742 C CG2 . VAL E 13 ? 0.3157 0.6627 0.4095 -0.1888 0.0158 -0.0482 13 VAL F CG2 6743 N N . SER E 14 ? 0.3364 0.7144 0.5252 -0.1883 0.0560 -0.1177 14 SER F N 6744 C CA . SER E 14 ? 0.3463 0.7466 0.5178 -0.2020 0.0703 -0.1465 14 SER F CA 6745 C C . SER E 14 ? 0.3480 0.7478 0.4785 -0.2096 0.0643 -0.1448 14 SER F C 6746 O O . SER E 14 ? 0.3398 0.7178 0.4725 -0.2045 0.0545 -0.1320 14 SER F O 6747 C CB . SER E 14 ? 0.3616 0.7677 0.5845 -0.2017 0.0890 -0.1810 14 SER F CB 6748 O OG . SER E 14 ? 0.3635 0.7729 0.6327 -0.1903 0.0946 -0.1812 14 SER F OG 6749 N N . LEU E 15 ? 0.3587 0.7883 0.4526 -0.2213 0.0703 -0.1563 15 LEU F N 6750 C CA . LEU E 15 ? 0.3643 0.8078 0.4230 -0.2271 0.0648 -0.1567 15 LEU F CA 6751 C C . LEU E 15 ? 0.3727 0.8180 0.4645 -0.2325 0.0723 -0.1881 15 LEU F C 6752 O O . LEU E 15 ? 0.3831 0.8351 0.5143 -0.2373 0.0890 -0.2198 15 LEU F O 6753 C CB . LEU E 15 ? 0.3800 0.8665 0.3956 -0.2370 0.0709 -0.1607 15 LEU F CB 6754 C CG . LEU E 15 ? 0.3818 0.8619 0.3657 -0.2340 0.0693 -0.1291 15 LEU F CG 6755 C CD1 . LEU E 15 ? 0.4073 0.9319 0.3494 -0.2427 0.0780 -0.1279 15 LEU F CD1 6756 C CD2 . LEU E 15 ? 0.3701 0.8169 0.3352 -0.2237 0.0544 -0.0943 15 LEU F CD2 6757 N N . GLY E 16 ? 0.3705 0.8083 0.4511 -0.2324 0.0625 -0.1809 16 GLY F N 6758 C CA . GLY E 16 ? 0.3825 0.8152 0.4983 -0.2399 0.0717 -0.2094 16 GLY F CA 6759 C C . GLY E 16 ? 0.3811 0.7627 0.5379 -0.2288 0.0699 -0.1927 16 GLY F C 6760 O O . GLY E 16 ? 0.3904 0.7586 0.5711 -0.2345 0.0762 -0.2061 16 GLY F O 6761 N N . ASP E 17 ? 0.3740 0.7315 0.5397 -0.2140 0.0624 -0.1631 17 ASP F N 6762 C CA . ASP E 17 ? 0.3782 0.6972 0.5815 -0.2010 0.0597 -0.1410 17 ASP F CA 6763 C C . ASP E 17 ? 0.3706 0.6755 0.5487 -0.1997 0.0443 -0.1149 17 ASP F C 6764 O O . ASP E 17 ? 0.3517 0.6713 0.4830 -0.2022 0.0314 -0.1031 17 ASP F O 6765 C CB . ASP E 17 ? 0.3712 0.6854 0.5871 -0.1861 0.0530 -0.1159 17 ASP F CB 6766 C CG . ASP E 17 ? 0.3857 0.7105 0.6415 -0.1830 0.0691 -0.1380 17 ASP F CG 6767 O OD1 . ASP E 17 ? 0.4064 0.7375 0.6849 -0.1923 0.0879 -0.1745 17 ASP F OD1 6768 O OD2 . ASP E 17 ? 0.3820 0.7143 0.6481 -0.1725 0.0639 -0.1216 17 ASP F OD2 6769 N N . GLN E 18 ? 0.3891 0.6643 0.6013 -0.1944 0.0475 -0.1035 18 GLN F N 6770 C CA . GLN E 18 ? 0.3882 0.6504 0.5813 -0.1913 0.0333 -0.0735 18 GLN F CA 6771 C C . GLN E 18 ? 0.3709 0.6371 0.5495 -0.1787 0.0177 -0.0411 18 GLN F C 6772 O O . GLN E 18 ? 0.3717 0.6446 0.5692 -0.1708 0.0202 -0.0400 18 GLN F O 6773 C CB . GLN E 18 ? 0.4191 0.6487 0.6551 -0.1895 0.0442 -0.0660 18 GLN F CB 6774 C CG . GLN E 18 ? 0.4262 0.6475 0.6405 -0.1912 0.0326 -0.0400 18 GLN F CG 6775 C CD . GLN E 18 ? 0.4388 0.6454 0.6667 -0.1762 0.0248 0.0031 18 GLN F CD 6776 O OE1 . GLN E 18 ? 0.4662 0.6574 0.6988 -0.1785 0.0260 0.0208 18 GLN F OE1 6777 N NE2 . GLN E 18 ? 0.4336 0.6529 0.6642 -0.1625 0.0161 0.0204 18 GLN F NE2 6778 N N . ALA E 19 ? 0.3538 0.6219 0.5000 -0.1789 0.0030 -0.0193 19 ALA F N 6779 C CA . ALA E 19 ? 0.3383 0.6150 0.4747 -0.1708 -0.0098 0.0067 19 ALA F CA 6780 C C . ALA E 19 ? 0.3370 0.6092 0.4623 -0.1703 -0.0197 0.0307 19 ALA F C 6781 O O . ALA E 19 ? 0.3369 0.6043 0.4423 -0.1782 -0.0206 0.0257 19 ALA F O 6782 C CB . ALA E 19 ? 0.3243 0.6175 0.4240 -0.1759 -0.0147 0.0009 19 ALA F CB 6783 N N . SER E 20 ? 0.3373 0.6188 0.4759 -0.1611 -0.0271 0.0565 20 SER F N 6784 C CA . SER E 20 ? 0.3396 0.6248 0.4690 -0.1610 -0.0356 0.0819 20 SER F CA 6785 C C . SER E 20 ? 0.3259 0.6451 0.4385 -0.1597 -0.0492 0.0971 20 SER F C 6786 O O . SER E 20 ? 0.3273 0.6677 0.4605 -0.1507 -0.0522 0.1062 20 SER F O 6787 C CB . SER E 20 ? 0.3657 0.6328 0.5361 -0.1513 -0.0275 0.1027 20 SER F CB 6788 O OG . SER E 20 ? 0.3797 0.6381 0.5396 -0.1575 -0.0279 0.1171 20 SER F OG 6789 N N . ILE E 21 ? 0.3164 0.6453 0.3944 -0.1697 -0.0560 0.0960 21 ILE F N 6790 C CA . ILE E 21 ? 0.3107 0.6747 0.3719 -0.1742 -0.0655 0.1009 21 ILE F CA 6791 C C . ILE E 21 ? 0.3236 0.7054 0.3745 -0.1770 -0.0724 0.1214 21 ILE F C 6792 O O . ILE E 21 ? 0.3242 0.6883 0.3609 -0.1828 -0.0697 0.1189 21 ILE F O 6793 C CB . ILE E 21 ? 0.2974 0.6573 0.3291 -0.1855 -0.0627 0.0774 21 ILE F CB 6794 C CG1 . ILE E 21 ? 0.2956 0.6426 0.3340 -0.1840 -0.0545 0.0607 21 ILE F CG1 6795 C CG2 . ILE E 21 ? 0.2983 0.6930 0.3167 -0.1949 -0.0681 0.0758 21 ILE F CG2 6796 C CD1 . ILE E 21 ? 0.2919 0.6271 0.3040 -0.1922 -0.0479 0.0443 21 ILE F CD1 6797 N N . SER E 22 ? 0.3390 0.7635 0.3957 -0.1739 -0.0815 0.1407 22 SER F N 6798 C CA . SER E 22 ? 0.3607 0.8134 0.4070 -0.1764 -0.0883 0.1650 22 SER F CA 6799 C C . SER E 22 ? 0.3683 0.8692 0.3866 -0.1919 -0.0952 0.1523 22 SER F C 6800 O O . SER E 22 ? 0.3619 0.8924 0.3811 -0.1967 -0.0978 0.1369 22 SER F O 6801 C CB . SER E 22 ? 0.3795 0.8554 0.4553 -0.1593 -0.0930 0.2038 22 SER F CB 6802 O OG . SER E 22 ? 0.3962 0.9275 0.4561 -0.1632 -0.1033 0.2272 22 SER F OG 6803 N N . CYS E 23 ? 0.3868 0.8990 0.3837 -0.2017 -0.0961 0.1564 23 CYS F N 6804 C CA . CYS E 23 ? 0.3968 0.9565 0.3698 -0.2189 -0.0994 0.1399 23 CYS F CA 6805 C C . CYS E 23 ? 0.4104 1.0166 0.3718 -0.2226 -0.1061 0.1669 23 CYS F C 6806 O O . CYS E 23 ? 0.4167 0.9988 0.3718 -0.2230 -0.1017 0.1787 23 CYS F O 6807 C CB . CYS E 23 ? 0.4000 0.9253 0.3552 -0.2304 -0.0891 0.1068 23 CYS F CB 6808 S SG . CYS E 23 ? 0.4296 1.0048 0.3623 -0.2535 -0.0862 0.0787 23 CYS F SG 6809 N N . ARG E 24 ? 0.4149 1.0944 0.3725 -0.2273 -0.1159 0.1752 24 ARG F N 6810 C CA . ARG E 24 ? 0.4350 1.1744 0.3781 -0.2312 -0.1233 0.2043 24 ARG F CA 6811 C C . ARG E 24 ? 0.4285 1.2305 0.3448 -0.2571 -0.1235 0.1712 24 ARG F C 6812 O O . ARG E 24 ? 0.4139 1.2488 0.3321 -0.2681 -0.1239 0.1402 24 ARG F O 6813 C CB . ARG E 24 ? 0.4642 1.2544 0.4271 -0.2128 -0.1358 0.2478 24 ARG F CB 6814 C CG . ARG E 24 ? 0.4889 1.2271 0.4792 -0.1880 -0.1321 0.2928 24 ARG F CG 6815 C CD . ARG E 24 ? 0.5344 1.3292 0.5309 -0.1732 -0.1407 0.3520 24 ARG F CD 6816 N NE . ARG E 24 ? 0.5631 1.2929 0.5875 -0.1536 -0.1297 0.3918 24 ARG F NE 6817 C CZ . ARG E 24 ? 0.6034 1.3589 0.6427 -0.1351 -0.1314 0.4526 24 ARG F CZ 6818 N NH1 . ARG E 24 ? 0.6214 1.4760 0.6464 -0.1323 -0.1472 0.4823 24 ARG F NH1 6819 N NH2 . ARG E 24 ? 0.6305 1.3161 0.7010 -0.1195 -0.1157 0.4845 24 ARG F NH2 6820 N N . SER E 25 ? 0.4369 1.2555 0.3310 -0.2689 -0.1203 0.1744 25 SER F N 6821 C CA . SER E 25 ? 0.4398 1.3265 0.3100 -0.2950 -0.1183 0.1430 25 SER F CA 6822 C C . SER E 25 ? 0.4595 1.4469 0.3149 -0.2990 -0.1313 0.1767 25 SER F C 6823 O O . SER E 25 ? 0.4742 1.4645 0.3331 -0.2814 -0.1381 0.2309 25 SER F O 6824 C CB . SER E 25 ? 0.4377 1.2869 0.2935 -0.3067 -0.1048 0.1205 25 SER F CB 6825 O OG . SER E 25 ? 0.4538 1.2797 0.3067 -0.2968 -0.1052 0.1600 25 SER F OG 6826 N N . SER E 26 ? 0.4628 1.5355 0.3030 -0.3229 -0.1327 0.1439 26 SER F N 6827 C CA . SER E 26 ? 0.4870 1.6758 0.3095 -0.3298 -0.1461 0.1707 26 SER F CA 6828 C C . SER E 26 ? 0.5003 1.7144 0.2948 -0.3406 -0.1420 0.1878 26 SER F C 6829 O O . SER E 26 ? 0.5236 1.8262 0.3007 -0.3409 -0.1531 0.2273 26 SER F O 6830 C CB . SER E 26 ? 0.4912 1.7701 0.3089 -0.3569 -0.1469 0.1198 26 SER F CB 6831 O OG . SER E 26 ? 0.4858 1.7279 0.2994 -0.3818 -0.1266 0.0561 26 SER F OG 6832 N N . GLN E 27 ? 0.4836 1.6248 0.2745 -0.3483 -0.1259 0.1608 27 GLN F N 6833 C CA . GLN E 27 ? 0.4977 1.6519 0.2657 -0.3581 -0.1192 0.1758 27 GLN F CA 6834 C C . GLN E 27 ? 0.4722 1.5179 0.2518 -0.3490 -0.1061 0.1716 27 GLN F C 6835 O O . GLN E 27 ? 0.4448 1.4154 0.2446 -0.3408 -0.1004 0.1440 27 GLN F O 6836 C CB . GLN E 27 ? 0.5149 1.7522 0.2577 -0.3921 -0.1112 0.1283 27 GLN F CB 6837 C CG . GLN E 27 ? 0.5011 1.7300 0.2552 -0.4109 -0.0989 0.0550 27 GLN F CG 6838 C CD . GLN E 27 ? 0.5219 1.8418 0.2557 -0.4467 -0.0881 0.0056 27 GLN F CD 6839 O OE1 . GLN E 27 ? 0.5315 1.9356 0.2628 -0.4669 -0.0901 -0.0265 27 GLN F OE1 6840 N NE2 . GLN E 27 ? 0.5295 1.8393 0.2506 -0.4567 -0.0752 -0.0039 27 GLN F NE2 6841 N N . TYR E 28 A 0.4813 1.5265 0.2477 -0.3514 -0.1011 0.2004 27 TYR F N 6842 C CA . TYR E 28 A 0.4623 1.4193 0.2399 -0.3450 -0.0890 0.1998 27 TYR F CA 6843 C C . TYR E 28 A 0.4320 1.3516 0.2150 -0.3552 -0.0768 0.1367 27 TYR F C 6844 O O . TYR E 28 A 0.4322 1.4029 0.2015 -0.3764 -0.0698 0.0965 27 TYR F O 6845 C CB . TYR E 28 A 0.4894 1.4731 0.2487 -0.3542 -0.0827 0.2338 27 TYR F CB 6846 C CG . TYR E 28 A 0.4849 1.3837 0.2619 -0.3442 -0.0722 0.2525 27 TYR F CG 6847 C CD1 . TYR E 28 A 0.4625 1.3111 0.2474 -0.3501 -0.0605 0.2095 27 TYR F CD1 6848 C CD2 . TYR E 28 A 0.5083 1.3801 0.2981 -0.3290 -0.0722 0.3121 27 TYR F CD2 6849 C CE1 . TYR E 28 A 0.4599 1.2426 0.2622 -0.3441 -0.0509 0.2211 27 TYR F CE1 6850 C CE2 . TYR E 28 A 0.5113 1.3084 0.3210 -0.3248 -0.0590 0.3221 27 TYR F CE2 6851 C CZ . TYR E 28 A 0.4846 1.2415 0.2991 -0.3338 -0.0494 0.2747 27 TYR F CZ 6852 O OH . TYR E 28 A 0.4850 1.1793 0.3205 -0.3320 -0.0368 0.2816 27 TYR F OH 6853 N N . ILE E 29 B 0.4064 1.2397 0.2116 -0.3393 -0.0728 0.1283 27 ILE F N 6854 C CA . ILE E 29 B 0.3861 1.1776 0.1999 -0.3424 -0.0607 0.0796 27 ILE F CA 6855 C C . ILE E 29 B 0.3915 1.1753 0.2005 -0.3493 -0.0503 0.0774 27 ILE F C 6856 O O . ILE E 29 B 0.3941 1.1323 0.2129 -0.3391 -0.0495 0.1010 27 ILE F O 6857 C CB . ILE E 29 B 0.3631 1.0778 0.1999 -0.3222 -0.0618 0.0749 27 ILE F CB 6858 C CG1 . ILE E 29 B 0.3597 1.0877 0.2024 -0.3173 -0.0709 0.0768 27 ILE F CG1 6859 C CG2 . ILE E 29 B 0.3467 1.0221 0.1932 -0.3212 -0.0493 0.0326 27 ILE F CG2 6860 C CD1 . ILE E 29 B 0.3655 1.1473 0.2010 -0.3362 -0.0666 0.0384 27 ILE F CD1 6861 N N . VAL E 30 C 0.4001 1.2338 0.1961 -0.3690 -0.0408 0.0464 27 VAL F N 6862 C CA . VAL E 30 C 0.4078 1.2499 0.1987 -0.3790 -0.0296 0.0399 27 VAL F CA 6863 C C . VAL E 30 C 0.3918 1.1889 0.2031 -0.3725 -0.0173 -0.0016 27 VAL F C 6864 O O . VAL E 30 C 0.3795 1.1505 0.2046 -0.3651 -0.0142 -0.0303 27 VAL F O 6865 C CB . VAL E 30 C 0.4323 1.3643 0.1981 -0.4053 -0.0240 0.0284 27 VAL F CB 6866 C CG1 . VAL E 30 C 0.4542 1.4448 0.1982 -0.4095 -0.0374 0.0749 27 VAL F CG1 6867 C CG2 . VAL E 30 C 0.4303 1.3924 0.1999 -0.4189 -0.0136 -0.0303 27 VAL F CG2 6868 N N . HIS E 31 D 0.3976 1.1883 0.2129 -0.3748 -0.0091 -0.0032 27 HIS F N 6869 C CA . HIS E 31 D 0.3850 1.1398 0.2229 -0.3640 0.0009 -0.0364 27 HIS F CA 6870 C C . HIS E 31 D 0.3937 1.1811 0.2364 -0.3747 0.0159 -0.0841 27 HIS F C 6871 O O . HIS E 31 D 0.4121 1.2629 0.2368 -0.3974 0.0208 -0.0953 27 HIS F O 6872 C CB . HIS E 31 D 0.3902 1.1401 0.2343 -0.3651 0.0058 -0.0274 27 HIS F CB 6873 C CG . HIS E 31 D 0.4118 1.2214 0.2442 -0.3874 0.0180 -0.0415 27 HIS F CG 6874 N ND1 . HIS E 31 D 0.4133 1.2434 0.2588 -0.3906 0.0324 -0.0859 27 HIS F ND1 6875 C CD2 . HIS E 31 D 0.4350 1.2910 0.2447 -0.4076 0.0195 -0.0166 27 HIS F CD2 6876 C CE1 . HIS E 31 D 0.4329 1.3220 0.2634 -0.4136 0.0421 -0.0921 27 HIS F CE1 6877 N NE2 . HIS E 31 D 0.4471 1.3539 0.2536 -0.4248 0.0342 -0.0487 27 HIS F NE2 6878 N N . ARG E 32 E 0.3837 1.1313 0.2527 -0.3583 0.0251 -0.1116 27 ARG F N 6879 C CA . ARG E 32 E 0.3979 1.1655 0.2834 -0.3642 0.0453 -0.1580 27 ARG F CA 6880 C C . ARG E 32 E 0.3871 1.1251 0.2995 -0.3437 0.0520 -0.1657 27 ARG F C 6881 O O . ARG E 32 E 0.3806 1.0670 0.3106 -0.3187 0.0483 -0.1581 27 ARG F O 6882 C CB . ARG E 32 E 0.4048 1.1512 0.3053 -0.3614 0.0552 -0.1870 27 ARG F CB 6883 C CG . ARG E 32 E 0.4068 1.1642 0.2897 -0.3719 0.0448 -0.1766 27 ARG F CG 6884 C CD . ARG E 32 E 0.4202 1.2522 0.2722 -0.3986 0.0368 -0.1682 27 ARG F CD 6885 N NE . ARG E 32 E 0.4420 1.3405 0.2890 -0.4244 0.0532 -0.2068 27 ARG F NE 6886 C CZ . ARG E 32 E 0.4616 1.4356 0.2880 -0.4515 0.0535 -0.2214 27 ARG F CZ 6887 N NH1 . ARG E 32 E 0.4626 1.4563 0.2741 -0.4546 0.0377 -0.2002 27 ARG F NH1 6888 N NH2 . ARG E 32 E 0.4820 1.5196 0.3048 -0.4762 0.0707 -0.2609 27 ARG F NH2 6889 N N . ASN E 33 ? 0.3949 1.1729 0.3106 -0.3543 0.0624 -0.1814 28 ASN F N 6890 C CA . ASN E 33 ? 0.3855 1.1546 0.3263 -0.3375 0.0672 -0.1869 28 ASN F CA 6891 C C . ASN E 33 ? 0.3635 1.1044 0.3010 -0.3251 0.0502 -0.1507 28 ASN F C 6892 O O . ASN E 33 ? 0.3538 1.0732 0.3146 -0.3024 0.0489 -0.1517 28 ASN F O 6893 C CB . ASN E 33 ? 0.3914 1.1292 0.3697 -0.3124 0.0812 -0.2144 28 ASN F CB 6894 C CG . ASN E 33 ? 0.4169 1.1794 0.4081 -0.3262 0.1045 -0.2588 28 ASN F CG 6895 O OD1 . ASN E 33 ? 0.4341 1.2460 0.4285 -0.3425 0.1176 -0.2837 28 ASN F OD1 6896 N ND2 . ASN E 33 ? 0.4286 1.1584 0.4295 -0.3221 0.1125 -0.2723 28 ASN F ND2 6897 N N . GLY E 34 ? 0.3600 1.1048 0.2711 -0.3399 0.0385 -0.1192 29 GLY F N 6898 C CA . GLY E 34 ? 0.3463 1.0680 0.2573 -0.3348 0.0275 -0.0894 29 GLY F CA 6899 C C . GLY E 34 ? 0.3295 1.0004 0.2429 -0.3162 0.0145 -0.0711 29 GLY F C 6900 O O . GLY E 34 ? 0.3206 0.9713 0.2361 -0.3133 0.0071 -0.0505 29 GLY F O 6901 N N . ASN E 35 ? 0.3290 0.9810 0.2432 -0.3066 0.0144 -0.0809 30 ASN F N 6902 C CA . ASN E 35 ? 0.3173 0.9232 0.2339 -0.2893 0.0043 -0.0663 30 ASN F CA 6903 C C . ASN E 35 ? 0.3245 0.9305 0.2222 -0.3000 -0.0023 -0.0514 30 ASN F C 6904 O O . ASN E 35 ? 0.3318 0.9685 0.2206 -0.3141 0.0037 -0.0665 30 ASN F O 6905 C CB . ASN E 35 ? 0.3144 0.8962 0.2509 -0.2686 0.0121 -0.0869 30 ASN F CB 6906 C CG . ASN E 35 ? 0.3072 0.8912 0.2660 -0.2502 0.0157 -0.0949 30 ASN F CG 6907 O OD1 . ASN E 35 ? 0.2953 0.8832 0.2551 -0.2475 0.0070 -0.0817 30 ASN F OD1 6908 N ND2 . ASN E 35 ? 0.3166 0.9021 0.2972 -0.2378 0.0301 -0.1179 30 ASN F ND2 6909 N N . THR E 36 ? 0.3213 0.8998 0.2154 -0.2939 -0.0141 -0.0241 31 THR F N 6910 C CA . THR E 36 ? 0.3307 0.9110 0.2126 -0.2988 -0.0215 -0.0089 31 THR F CA 6911 C C . THR E 36 ? 0.3195 0.8610 0.2110 -0.2827 -0.0232 -0.0166 31 THR F C 6912 O O . THR E 36 ? 0.3079 0.8138 0.2076 -0.2680 -0.0287 -0.0052 31 THR F O 6913 C CB . THR E 36 ? 0.3426 0.9268 0.2158 -0.3047 -0.0303 0.0288 31 THR F CB 6914 O OG1 . THR E 36 ? 0.3463 0.8978 0.2254 -0.2924 -0.0392 0.0458 31 THR F OG1 6915 C CG2 . THR E 36 ? 0.3474 0.9274 0.2260 -0.3086 -0.0267 0.0398 31 THR F CG2 6916 N N . TYR E 37 ? 0.3272 0.8795 0.2185 -0.2883 -0.0160 -0.0387 32 TYR F N 6917 C CA . TYR E 37 ? 0.3275 0.8435 0.2299 -0.2764 -0.0118 -0.0492 32 TYR F CA 6918 C C . TYR E 37 ? 0.3249 0.8373 0.2207 -0.2783 -0.0224 -0.0321 32 TYR F C 6919 O O . TYR E 37 ? 0.3377 0.8825 0.2268 -0.2930 -0.0221 -0.0402 32 TYR F O 6920 C CB . TYR E 37 ? 0.3429 0.8672 0.2553 -0.2840 0.0062 -0.0850 32 TYR F CB 6921 C CG . TYR E 37 ? 0.3490 0.8709 0.2763 -0.2760 0.0188 -0.1022 32 TYR F CG 6922 C CD1 . TYR E 37 ? 0.3432 0.8304 0.2846 -0.2514 0.0185 -0.0922 32 TYR F CD1 6923 C CD2 . TYR E 37 ? 0.3626 0.9255 0.2909 -0.2927 0.0309 -0.1285 32 TYR F CD2 6924 C CE1 . TYR E 37 ? 0.3508 0.8437 0.3099 -0.2407 0.0290 -0.1058 32 TYR F CE1 6925 C CE2 . TYR E 37 ? 0.3696 0.9334 0.3166 -0.2837 0.0435 -0.1455 32 TYR F CE2 6926 C CZ . TYR E 37 ? 0.3617 0.8904 0.3255 -0.2562 0.0419 -0.1326 32 TYR F CZ 6927 O OH . TYR E 37 ? 0.3640 0.8999 0.3503 -0.2434 0.0533 -0.1469 32 TYR F OH 6928 N N . LEU E 38 ? 0.3142 0.7950 0.2133 -0.2643 -0.0315 -0.0101 33 LEU F N 6929 C CA . LEU E 38 ? 0.3144 0.7846 0.2138 -0.2612 -0.0396 0.0043 33 LEU F CA 6930 C C . LEU E 38 ? 0.3102 0.7350 0.2191 -0.2438 -0.0380 0.0051 33 LEU F C 6931 O O . LEU E 38 ? 0.3062 0.7165 0.2183 -0.2343 -0.0409 0.0135 33 LEU F O 6932 C CB . LEU E 38 ? 0.3145 0.7996 0.2103 -0.2630 -0.0513 0.0346 33 LEU F CB 6933 C CG . LEU E 38 ? 0.3157 0.8080 0.2150 -0.2606 -0.0605 0.0540 33 LEU F CG 6934 C CD1 . LEU E 38 ? 0.3072 0.7564 0.2195 -0.2460 -0.0618 0.0579 33 LEU F CD1 6935 C CD2 . LEU E 38 ? 0.3227 0.8558 0.2162 -0.2727 -0.0605 0.0401 33 LEU F CD2 6936 N N . GLU E 39 ? 0.3178 0.7257 0.2311 -0.2417 -0.0319 -0.0051 34 GLU F N 6937 C CA . GLU E 39 ? 0.3168 0.6857 0.2364 -0.2259 -0.0271 -0.0039 34 GLU F CA 6938 C C . GLU E 39 ? 0.3108 0.6681 0.2322 -0.2252 -0.0306 0.0034 34 GLU F C 6939 O O . GLU E 39 ? 0.3111 0.6889 0.2329 -0.2371 -0.0320 -0.0006 34 GLU F O 6940 C CB . GLU E 39 ? 0.3381 0.6903 0.2659 -0.2231 -0.0095 -0.0229 34 GLU F CB 6941 C CG . GLU E 39 ? 0.3457 0.7062 0.2779 -0.2180 -0.0040 -0.0308 34 GLU F CG 6942 C CD . GLU E 39 ? 0.3719 0.7202 0.3193 -0.2180 0.0173 -0.0536 34 GLU F CD 6943 O OE1 . GLU E 39 ? 0.3917 0.7216 0.3467 -0.2246 0.0306 -0.0657 34 GLU F OE1 6944 O OE2 . GLU E 39 ? 0.3823 0.7392 0.3379 -0.2119 0.0233 -0.0616 34 GLU F OE2 6945 N N . TRP E 40 ? 0.3060 0.6380 0.2290 -0.2118 -0.0316 0.0127 35 TRP F N 6946 C CA . TRP E 40 ? 0.3048 0.6243 0.2309 -0.2102 -0.0317 0.0169 35 TRP F CA 6947 C C . TRP E 40 ? 0.3207 0.6111 0.2468 -0.2010 -0.0188 0.0145 35 TRP F C 6948 O O . TRP E 40 ? 0.3223 0.6027 0.2455 -0.1874 -0.0168 0.0205 35 TRP F O 6949 C CB . TRP E 40 ? 0.2920 0.6107 0.2208 -0.2041 -0.0418 0.0299 35 TRP F CB 6950 C CG . TRP E 40 ? 0.2856 0.6246 0.2195 -0.2103 -0.0511 0.0395 35 TRP F CG 6951 C CD1 . TRP E 40 ? 0.2866 0.6350 0.2202 -0.2122 -0.0549 0.0458 35 TRP F CD1 6952 C CD2 . TRP E 40 ? 0.2871 0.6417 0.2299 -0.2140 -0.0564 0.0477 35 TRP F CD2 6953 N NE1 . TRP E 40 ? 0.2891 0.6529 0.2300 -0.2162 -0.0610 0.0612 35 TRP F NE1 6954 C CE2 . TRP E 40 ? 0.2881 0.6586 0.2352 -0.2156 -0.0632 0.0637 35 TRP F CE2 6955 C CE3 . TRP E 40 ? 0.2858 0.6458 0.2352 -0.2157 -0.0553 0.0442 35 TRP F CE3 6956 C CZ2 . TRP E 40 ? 0.2916 0.6834 0.2503 -0.2149 -0.0698 0.0811 35 TRP F CZ2 6957 C CZ3 . TRP E 40 ? 0.2849 0.6711 0.2464 -0.2162 -0.0632 0.0567 35 TRP F CZ3 6958 C CH2 . TRP E 40 ? 0.2895 0.6915 0.2559 -0.2138 -0.0708 0.0772 35 TRP F CH2 6959 N N . TYR E 41 ? 0.3331 0.6142 0.2636 -0.2083 -0.0096 0.0078 36 TYR F N 6960 C CA . TYR E 41 ? 0.3559 0.6058 0.2879 -0.2017 0.0062 0.0097 36 TYR F CA 6961 C C . TYR E 41 ? 0.3549 0.6016 0.2862 -0.2025 0.0047 0.0158 36 TYR F C 6962 O O . TYR E 41 ? 0.3398 0.6076 0.2759 -0.2113 -0.0044 0.0123 36 TYR F O 6963 C CB . TYR E 41 ? 0.3799 0.6171 0.3228 -0.2139 0.0261 -0.0087 36 TYR F CB 6964 C CG . TYR E 41 ? 0.3900 0.6274 0.3376 -0.2116 0.0324 -0.0178 36 TYR F CG 6965 C CD1 . TYR E 41 ? 0.3807 0.6531 0.3274 -0.2256 0.0247 -0.0326 36 TYR F CD1 6966 C CD2 . TYR E 41 ? 0.4132 0.6212 0.3669 -0.1939 0.0459 -0.0093 36 TYR F CD2 6967 C CE1 . TYR E 41 ? 0.3926 0.6694 0.3445 -0.2247 0.0319 -0.0441 36 TYR F CE1 6968 C CE2 . TYR E 41 ? 0.4261 0.6369 0.3890 -0.1895 0.0526 -0.0190 36 TYR F CE2 6969 C CZ . TYR E 41 ? 0.4140 0.6585 0.3760 -0.2063 0.0461 -0.0389 36 TYR F CZ 6970 O OH . TYR E 41 ? 0.4335 0.6841 0.4057 -0.2034 0.0545 -0.0517 36 TYR F OH 6971 N N . LEU E 42 ? 0.3756 0.6003 0.3017 -0.1916 0.0141 0.0271 37 LEU F N 6972 C CA . LEU E 42 ? 0.3854 0.6063 0.3102 -0.1940 0.0180 0.0310 37 LEU F CA 6973 C C . LEU E 42 ? 0.4272 0.6172 0.3555 -0.1969 0.0416 0.0323 37 LEU F C 6974 O O . LEU E 42 ? 0.4512 0.6189 0.3766 -0.1837 0.0528 0.0454 37 LEU F O 6975 C CB . LEU E 42 ? 0.3786 0.6077 0.2917 -0.1804 0.0101 0.0444 37 LEU F CB 6976 C CG . LEU E 42 ? 0.3872 0.6141 0.2954 -0.1812 0.0179 0.0495 37 LEU F CG 6977 C CD1 . LEU E 42 ? 0.3738 0.6116 0.2956 -0.1953 0.0159 0.0357 37 LEU F CD1 6978 C CD2 . LEU E 42 ? 0.3865 0.6341 0.2824 -0.1705 0.0094 0.0568 37 LEU F CD2 6979 N N . GLN E 43 ? 0.4431 0.6328 0.3809 -0.2135 0.0509 0.0198 38 GLN F N 6980 C CA . GLN E 43 ? 0.4959 0.6529 0.4393 -0.2195 0.0774 0.0212 38 GLN F CA 6981 C C . GLN E 43 ? 0.5121 0.6707 0.4498 -0.2215 0.0819 0.0297 38 GLN F C 6982 O O . GLN E 43 ? 0.4859 0.6724 0.4293 -0.2317 0.0720 0.0174 38 GLN F O 6983 C CB . GLN E 43 ? 0.5074 0.6628 0.4700 -0.2428 0.0923 -0.0060 38 GLN F CB 6984 C CG . GLN E 43 ? 0.5597 0.6716 0.5333 -0.2503 0.1258 -0.0054 38 GLN F CG 6985 C CD . GLN E 43 ? 0.5818 0.6888 0.5789 -0.2751 0.1460 -0.0388 38 GLN F CD 6986 O OE1 . GLN E 43 ? 0.5608 0.7115 0.5635 -0.2918 0.1331 -0.0644 38 GLN F OE1 6987 N NE2 . GLN E 43 ? 0.6297 0.6864 0.6422 -0.2775 0.1794 -0.0386 38 GLN F NE2 6988 N N . LYS E 44 ? 0.5634 0.6952 0.4911 -0.2104 0.0978 0.0525 39 LYS F N 6989 C CA . LYS E 44 ? 0.5920 0.7257 0.5113 -0.2133 0.1065 0.0626 39 LYS F CA 6990 C C . LYS E 44 ? 0.6346 0.7329 0.5666 -0.2284 0.1382 0.0609 39 LYS F C 6991 O O . LYS E 44 ? 0.6499 0.7132 0.5943 -0.2287 0.1563 0.0609 39 LYS F O 6992 C CB . LYS E 44 ? 0.6200 0.7596 0.5159 -0.1913 0.1023 0.0925 39 LYS F CB 6993 C CG . LYS E 44 ? 0.5938 0.7717 0.4811 -0.1817 0.0740 0.0874 39 LYS F CG 6994 C CD . LYS E 44 ? 0.6150 0.8210 0.4805 -0.1705 0.0686 0.1033 39 LYS F CD 6995 C CE . LYS E 44 ? 0.6282 0.8501 0.4816 -0.1500 0.0572 0.1194 39 LYS F CE 6996 N NZ . LYS E 44 ? 0.6517 0.9125 0.4821 -0.1414 0.0539 0.1340 39 LYS F NZ 6997 N N . PRO E 45 ? 0.6586 0.7652 0.5911 -0.2422 0.1479 0.0570 40 PRO F N 6998 C CA . PRO E 45 ? 0.7025 0.7770 0.6498 -0.2619 0.1814 0.0521 40 PRO F CA 6999 C C . PRO E 45 ? 0.7576 0.7768 0.7045 -0.2508 0.2103 0.0813 40 PRO F C 7000 O O . PRO E 45 ? 0.7729 0.7869 0.6982 -0.2293 0.2110 0.1184 40 PRO F O 7001 C CB . PRO E 45 ? 0.7051 0.8018 0.6433 -0.2694 0.1844 0.0559 40 PRO F CB 7002 C CG . PRO E 45 ? 0.6542 0.8007 0.5866 -0.2619 0.1513 0.0445 40 PRO F CG 7003 C CD . PRO E 45 ? 0.6305 0.7781 0.5534 -0.2415 0.1302 0.0536 40 PRO F CD 7004 N N . GLY E 46 ? 0.7884 0.7709 0.7618 -0.2652 0.2349 0.0638 41 GLY F N 7005 C CA . GLY E 46 ? 0.8508 0.7709 0.8354 -0.2556 0.2696 0.0892 41 GLY F CA 7006 C C . GLY E 46 ? 0.8507 0.7551 0.8352 -0.2266 0.2622 0.1078 41 GLY F C 7007 O O . GLY E 46 ? 0.9054 0.7564 0.9078 -0.2159 0.2923 0.1270 41 GLY F O 7008 N N . GLN E 47 ? 0.7927 0.7420 0.7619 -0.2142 0.2250 0.1013 42 GLN F N 7009 C CA . GLN E 47 ? 0.7885 0.7338 0.7570 -0.1872 0.2150 0.1170 42 GLN F CA 7010 C C . GLN E 47 ? 0.7366 0.6929 0.7231 -0.1999 0.2067 0.0775 42 GLN F C 7011 O O . GLN E 47 ? 0.7060 0.6881 0.6983 -0.2263 0.1991 0.0418 42 GLN F O 7012 C CB . GLN E 47 ? 0.7708 0.7636 0.7081 -0.1644 0.1809 0.1394 42 GLN F CB 7013 C CG . GLN E 47 ? 0.8161 0.8143 0.7301 -0.1488 0.1858 0.1804 42 GLN F CG 7014 C CD . GLN E 47 ? 0.8018 0.8556 0.6883 -0.1291 0.1536 0.1947 42 GLN F CD 7015 O OE1 . GLN E 47 ? 0.7867 0.8626 0.6748 -0.1200 0.1325 0.1840 42 GLN F OE1 7016 N NE2 . GLN E 47 ? 0.8268 0.9071 0.6887 -0.1250 0.1518 0.2165 42 GLN F NE2 7017 N N . SER E 48 ? 0.7255 0.6689 0.7208 -0.1798 0.2076 0.0856 43 SER F N 7018 C CA . SER E 48 ? 0.6858 0.6487 0.6930 -0.1891 0.1971 0.0516 43 SER F CA 7019 C C . SER E 48 ? 0.6180 0.6396 0.6004 -0.1878 0.1560 0.0466 43 SER F C 7020 O O . SER E 48 ? 0.5969 0.6397 0.5564 -0.1744 0.1375 0.0701 43 SER F O 7021 C CB . SER E 48 ? 0.7127 0.6482 0.7382 -0.1656 0.2105 0.0629 43 SER F CB 7022 O OG . SER E 48 ? 0.7753 0.6485 0.8300 -0.1648 0.2530 0.0703 43 SER F OG 7023 N N . PRO E 49 ? 0.5806 0.6306 0.5689 -0.2035 0.1440 0.0148 44 PRO F N 7024 C CA . PRO E 49 ? 0.5289 0.6262 0.4984 -0.1985 0.1094 0.0156 44 PRO F CA 7025 C C . PRO E 49 ? 0.5236 0.6231 0.4860 -0.1708 0.0997 0.0380 44 PRO F C 7026 O O . PRO E 49 ? 0.5453 0.6210 0.5235 -0.1598 0.1163 0.0397 44 PRO F O 7027 C CB . PRO E 49 ? 0.5117 0.6367 0.4910 -0.2209 0.1050 -0.0190 44 PRO F CB 7028 C CG . PRO E 49 ? 0.5440 0.6485 0.5445 -0.2443 0.1336 -0.0446 44 PRO F CG 7029 C CD . PRO E 49 ? 0.5899 0.6361 0.6017 -0.2302 0.1627 -0.0242 44 PRO F CD 7030 N N . LYS E 50 ? 0.4963 0.6265 0.4390 -0.1603 0.0749 0.0525 45 LYS F N 7031 C CA . LYS E 50 ? 0.4944 0.6413 0.4304 -0.1375 0.0628 0.0690 45 LYS F CA 7032 C C . LYS E 50 ? 0.4533 0.6378 0.3835 -0.1453 0.0392 0.0543 45 LYS F C 7033 O O . LYS E 50 ? 0.4263 0.6281 0.3507 -0.1600 0.0266 0.0449 45 LYS F O 7034 C CB . LYS E 50 ? 0.5087 0.6666 0.4275 -0.1203 0.0568 0.0971 45 LYS F CB 7035 C CG . LYS E 50 ? 0.5598 0.6828 0.4814 -0.1085 0.0809 0.1221 45 LYS F CG 7036 C CD . LYS E 50 ? 0.5733 0.7235 0.4729 -0.0918 0.0722 0.1510 45 LYS F CD 7037 C CE . LYS E 50 ? 0.6283 0.7461 0.5266 -0.0826 0.0971 0.1812 45 LYS F CE 7038 N NZ . LYS E 50 ? 0.6742 0.7586 0.5921 -0.0592 0.1177 0.2050 45 LYS F NZ 7039 N N . LEU E 51 ? 0.4489 0.6460 0.3837 -0.1341 0.0349 0.0543 46 LEU F N 7040 C CA . LEU E 51 ? 0.4176 0.6479 0.3485 -0.1421 0.0164 0.0424 46 LEU F CA 7041 C C . LEU E 51 ? 0.3925 0.6486 0.3102 -0.1371 -0.0011 0.0524 46 LEU F C 7042 O O . LEU E 51 ? 0.4081 0.6721 0.3202 -0.1201 -0.0016 0.0682 46 LEU F O 7043 C CB . LEU E 51 ? 0.4243 0.6627 0.3663 -0.1319 0.0201 0.0382 46 LEU F CB 7044 C CG . LEU E 51 ? 0.4028 0.6756 0.3417 -0.1414 0.0047 0.0267 46 LEU F CG 7045 C CD1 . LEU E 51 ? 0.3925 0.6710 0.3309 -0.1657 0.0041 0.0086 46 LEU F CD1 7046 C CD2 . LEU E 51 ? 0.4144 0.6989 0.3659 -0.1272 0.0097 0.0245 46 LEU F CD2 7047 N N . LEU E 52 ? 0.3659 0.6376 0.2808 -0.1519 -0.0137 0.0431 47 LEU F N 7048 C CA . LEU E 52 ? 0.3535 0.6483 0.2631 -0.1510 -0.0265 0.0451 47 LEU F CA 7049 C C . LEU E 52 ? 0.3334 0.6507 0.2474 -0.1552 -0.0352 0.0378 47 LEU F C 7050 O O . LEU E 52 ? 0.3357 0.6771 0.2486 -0.1481 -0.0405 0.0379 47 LEU F O 7051 C CB . LEU E 52 ? 0.3478 0.6394 0.2586 -0.1630 -0.0305 0.0413 47 LEU F CB 7052 C CG . LEU E 52 ? 0.3650 0.6404 0.2721 -0.1618 -0.0218 0.0462 47 LEU F CG 7053 C CD1 . LEU E 52 ? 0.3561 0.6352 0.2702 -0.1722 -0.0263 0.0400 47 LEU F CD1 7054 C CD2 . LEU E 52 ? 0.3810 0.6635 0.2766 -0.1475 -0.0183 0.0582 47 LEU F CD2 7055 N N . ILE E 53 ? 0.3142 0.6298 0.2326 -0.1683 -0.0359 0.0310 48 ILE F N 7056 C CA . ILE E 53 ? 0.3023 0.6376 0.2243 -0.1767 -0.0423 0.0265 48 ILE F CA 7057 C C . ILE E 53 ? 0.3039 0.6437 0.2272 -0.1817 -0.0368 0.0197 48 ILE F C 7058 O O . ILE E 53 ? 0.3010 0.6313 0.2241 -0.1882 -0.0308 0.0154 48 ILE F O 7059 C CB . ILE E 53 ? 0.2930 0.6284 0.2194 -0.1895 -0.0481 0.0296 48 ILE F CB 7060 C CG1 . ILE E 53 ? 0.2912 0.6209 0.2215 -0.1865 -0.0499 0.0303 48 ILE F CG1 7061 C CG2 . ILE E 53 ? 0.2876 0.6390 0.2184 -0.1989 -0.0509 0.0294 48 ILE F CG2 7062 C CD1 . ILE E 53 ? 0.2932 0.6408 0.2254 -0.1836 -0.0514 0.0230 48 ILE F CD1 7063 N N . TYR E 54 ? 0.3002 0.6597 0.2268 -0.1803 -0.0372 0.0148 49 TYR F N 7064 C CA . TYR E 54 ? 0.3053 0.6765 0.2342 -0.1881 -0.0312 0.0044 49 TYR F CA 7065 C C . TYR E 54 ? 0.2997 0.6966 0.2279 -0.2010 -0.0364 0.0037 49 TYR F C 7066 O O . TYR E 54 ? 0.2971 0.7011 0.2280 -0.2013 -0.0420 0.0079 49 TYR F O 7067 C CB . TYR E 54 ? 0.3164 0.6858 0.2553 -0.1722 -0.0207 -0.0022 49 TYR F CB 7068 C CG . TYR E 54 ? 0.3110 0.7032 0.2561 -0.1583 -0.0253 0.0005 49 TYR F CG 7069 C CD1 . TYR E 54 ? 0.3115 0.7060 0.2546 -0.1433 -0.0311 0.0120 49 TYR F CD1 7070 C CD2 . TYR E 54 ? 0.3097 0.7299 0.2630 -0.1612 -0.0234 -0.0103 49 TYR F CD2 7071 C CE1 . TYR E 54 ? 0.3098 0.7395 0.2591 -0.1318 -0.0365 0.0122 49 TYR F CE1 7072 C CE2 . TYR E 54 ? 0.3072 0.7581 0.2692 -0.1494 -0.0278 -0.0104 49 TYR F CE2 7073 C CZ . TYR E 54 ? 0.3064 0.7647 0.2667 -0.1347 -0.0351 0.0005 49 TYR F CZ 7074 O OH . TYR E 54 ? 0.3020 0.8038 0.2718 -0.1244 -0.0402 -0.0021 49 TYR F OH 7075 N N . LYS E 55 ? 0.3041 0.7173 0.2296 -0.2139 -0.0321 -0.0036 50 LYS F N 7076 C CA . LYS E 55 ? 0.3044 0.7432 0.2268 -0.2284 -0.0342 -0.0011 50 LYS F CA 7077 C C . LYS E 55 ? 0.3010 0.7319 0.2228 -0.2343 -0.0417 0.0171 50 LYS F C 7078 O O . LYS E 55 ? 0.2981 0.7345 0.2264 -0.2383 -0.0418 0.0194 50 LYS F O 7079 C CB . LYS E 55 ? 0.3066 0.7643 0.2382 -0.2236 -0.0304 -0.0118 50 LYS F CB 7080 C CG . LYS E 55 ? 0.3142 0.7895 0.2502 -0.2244 -0.0195 -0.0304 50 LYS F CG 7081 C CD . LYS E 55 ? 0.3110 0.8058 0.2624 -0.2126 -0.0160 -0.0404 50 LYS F CD 7082 C CE . LYS E 55 ? 0.3037 0.8282 0.2541 -0.2288 -0.0183 -0.0400 50 LYS F CE 7083 N NZ . LYS E 55 ? 0.3011 0.8542 0.2691 -0.2183 -0.0152 -0.0528 50 LYS F NZ 7084 N N . VAL E 56 ? 0.3015 0.7201 0.2199 -0.2352 -0.0457 0.0279 51 VAL F N 7085 C CA . VAL E 56 ? 0.3056 0.7143 0.2290 -0.2382 -0.0505 0.0474 51 VAL F CA 7086 C C . VAL E 56 ? 0.3043 0.6892 0.2392 -0.2294 -0.0512 0.0459 51 VAL F C 7087 O O . VAL E 56 ? 0.3017 0.6703 0.2420 -0.2249 -0.0536 0.0532 51 VAL F O 7088 C CB . VAL E 56 ? 0.3178 0.7423 0.2420 -0.2511 -0.0487 0.0627 51 VAL F CB 7089 C CG1 . VAL E 56 ? 0.3281 0.7364 0.2639 -0.2505 -0.0504 0.0876 51 VAL F CG1 7090 C CG2 . VAL E 56 ? 0.3255 0.7857 0.2346 -0.2622 -0.0479 0.0631 51 VAL F CG2 7091 N N . SER E 57 ? 0.3060 0.6965 0.2458 -0.2281 -0.0487 0.0340 52 SER F N 7092 C CA . SER E 57 ? 0.3063 0.6881 0.2582 -0.2264 -0.0479 0.0284 52 SER F CA 7093 C C . SER E 57 ? 0.2921 0.6894 0.2431 -0.2166 -0.0490 0.0127 52 SER F C 7094 O O . SER E 57 ? 0.2863 0.6899 0.2468 -0.2188 -0.0480 0.0028 52 SER F O 7095 C CB . SER E 57 ? 0.3253 0.7115 0.2902 -0.2417 -0.0416 0.0305 52 SER F CB 7096 O OG . SER E 57 ? 0.3516 0.7138 0.3303 -0.2459 -0.0378 0.0451 52 SER F OG 7097 N N . ASN E 58 ? 0.2850 0.6930 0.2277 -0.2058 -0.0496 0.0097 53 ASN F N 7098 C CA . ASN E 58 ? 0.2808 0.7117 0.2250 -0.1922 -0.0511 0.0013 53 ASN F CA 7099 C C . ASN E 58 ? 0.2818 0.6992 0.2185 -0.1762 -0.0523 0.0080 53 ASN F C 7100 O O . ASN E 58 ? 0.2843 0.6788 0.2155 -0.1710 -0.0488 0.0149 53 ASN F O 7101 C CB . ASN E 58 ? 0.2810 0.7321 0.2275 -0.1861 -0.0481 -0.0035 53 ASN F CB 7102 C CG . ASN E 58 ? 0.2805 0.7490 0.2328 -0.2040 -0.0453 -0.0101 53 ASN F CG 7103 O OD1 . ASN E 58 ? 0.2895 0.7544 0.2374 -0.2122 -0.0413 -0.0083 53 ASN F OD1 7104 N ND2 . ASN E 58 ? 0.2784 0.7690 0.2403 -0.2128 -0.0457 -0.0192 53 ASN F ND2 7105 N N . ARG E 59 ? 0.2833 0.7193 0.2200 -0.1708 -0.0555 0.0044 54 ARG F N 7106 C CA . ARG E 59 ? 0.2923 0.7205 0.2194 -0.1570 -0.0557 0.0135 54 ARG F CA 7107 C C . ARG E 59 ? 0.2994 0.7377 0.2235 -0.1348 -0.0538 0.0248 54 ARG F C 7108 O O . ARG E 59 ? 0.2990 0.7750 0.2286 -0.1257 -0.0569 0.0223 54 ARG F O 7109 C CB . ARG E 59 ? 0.2970 0.7516 0.2235 -0.1604 -0.0589 0.0042 54 ARG F CB 7110 C CG . ARG E 59 ? 0.3018 0.7279 0.2294 -0.1708 -0.0560 0.0021 54 ARG F CG 7111 C CD . ARG E 59 ? 0.3141 0.7677 0.2412 -0.1742 -0.0560 -0.0108 54 ARG F CD 7112 N NE . ARG E 59 ? 0.3205 0.8163 0.2578 -0.1844 -0.0572 -0.0314 54 ARG F NE 7113 C CZ . ARG E 59 ? 0.3267 0.8161 0.2842 -0.2041 -0.0517 -0.0489 54 ARG F CZ 7114 N NH1 . ARG E 59 ? 0.3283 0.8620 0.2962 -0.2153 -0.0507 -0.0713 54 ARG F NH1 7115 N NH2 . ARG E 59 ? 0.3253 0.7677 0.2948 -0.2127 -0.0460 -0.0429 54 ARG F NH2 7116 N N . PHE E 60 ? 0.3088 0.7140 0.2281 -0.1256 -0.0467 0.0374 55 PHE F N 7117 C CA . PHE E 60 ? 0.3279 0.7320 0.2501 -0.1020 -0.0397 0.0522 55 PHE F CA 7118 C C . PHE E 60 ? 0.3424 0.7827 0.2567 -0.0851 -0.0452 0.0657 55 PHE F C 7119 O O . PHE E 60 ? 0.3367 0.7931 0.2410 -0.0949 -0.0513 0.0603 55 PHE F O 7120 C CB . PHE E 60 ? 0.3393 0.6946 0.2620 -0.1008 -0.0262 0.0595 55 PHE F CB 7121 C CG . PHE E 60 ? 0.3640 0.7044 0.2984 -0.0781 -0.0124 0.0734 55 PHE F CG 7122 C CD1 . PHE E 60 ? 0.3668 0.7116 0.3187 -0.0728 -0.0065 0.0645 55 PHE F CD1 7123 C CD2 . PHE E 60 ? 0.3896 0.7081 0.3208 -0.0624 -0.0020 0.0960 55 PHE F CD2 7124 C CE1 . PHE E 60 ? 0.3965 0.7218 0.3669 -0.0499 0.0102 0.0765 55 PHE F CE1 7125 C CE2 . PHE E 60 ? 0.4223 0.7186 0.3703 -0.0396 0.0151 0.1126 55 PHE F CE2 7126 C CZ . PHE E 60 ? 0.4255 0.7236 0.3954 -0.0324 0.0217 0.1022 55 PHE F CZ 7127 N N . SER E 61 ? 0.3676 0.8276 0.2884 -0.0594 -0.0426 0.0825 56 SER F N 7128 C CA . SER E 61 ? 0.3880 0.8970 0.2999 -0.0402 -0.0492 0.1004 56 SER F CA 7129 C C . SER E 61 ? 0.4013 0.8903 0.2949 -0.0404 -0.0447 0.1157 56 SER F C 7130 O O . SER E 61 ? 0.4117 0.8440 0.3055 -0.0435 -0.0321 0.1226 56 SER F O 7131 C CB . SER E 61 ? 0.4166 0.9446 0.3424 -0.0063 -0.0448 0.1252 56 SER F CB 7132 O OG . SER E 61 ? 0.4496 0.9198 0.3802 0.0086 -0.0269 0.1488 56 SER F OG 7133 N N . GLY E 62 ? 0.4064 0.9480 0.2850 -0.0407 -0.0541 0.1166 57 GLY F N 7134 C CA . GLY E 62 ? 0.4224 0.9573 0.2819 -0.0425 -0.0497 0.1291 57 GLY F CA 7135 C C . GLY E 62 ? 0.4046 0.9118 0.2610 -0.0719 -0.0489 0.1026 57 GLY F C 7136 O O . GLY E 62 ? 0.4123 0.9298 0.2545 -0.0779 -0.0471 0.1034 57 GLY F O 7137 N N . VAL E 63 ? 0.3849 0.8605 0.2557 -0.0892 -0.0494 0.0809 58 VAL F N 7138 C CA . VAL E 63 ? 0.3708 0.8197 0.2442 -0.1122 -0.0479 0.0615 58 VAL F CA 7139 C C . VAL E 63 ? 0.3621 0.8543 0.2391 -0.1276 -0.0551 0.0357 58 VAL F C 7140 O O . VAL E 63 ? 0.3535 0.8716 0.2406 -0.1320 -0.0606 0.0225 58 VAL F O 7141 C CB . VAL E 63 ? 0.3570 0.7628 0.2444 -0.1233 -0.0457 0.0531 58 VAL F CB 7142 C CG1 . VAL E 63 ? 0.3465 0.7295 0.2397 -0.1420 -0.0446 0.0398 58 VAL F CG1 7143 C CG2 . VAL E 63 ? 0.3713 0.7396 0.2600 -0.1121 -0.0355 0.0696 58 VAL F CG2 7144 N N . PRO E 64 ? 0.3672 0.8677 0.2393 -0.1381 -0.0523 0.0248 59 PRO F N 7145 C CA . PRO E 64 ? 0.3644 0.9090 0.2438 -0.1546 -0.0544 -0.0053 59 PRO F CA 7146 C C . PRO E 64 ? 0.3523 0.8680 0.2573 -0.1742 -0.0514 -0.0284 59 PRO F C 7147 O O . PRO E 64 ? 0.3461 0.8111 0.2591 -0.1750 -0.0491 -0.0188 59 PRO F O 7148 C CB . PRO E 64 ? 0.3754 0.9333 0.2430 -0.1585 -0.0487 -0.0091 59 PRO F CB 7149 C CG . PRO E 64 ? 0.3768 0.8780 0.2401 -0.1519 -0.0424 0.0126 59 PRO F CG 7150 C CD . PRO E 64 ? 0.3757 0.8484 0.2378 -0.1366 -0.0443 0.0368 59 PRO F CD 7151 N N . ASP E 65 ? 0.3585 0.9094 0.2774 -0.1905 -0.0497 -0.0582 60 ASP F N 7152 C CA . ASP E 65 ? 0.3578 0.8794 0.3048 -0.2081 -0.0435 -0.0758 60 ASP F CA 7153 C C . ASP E 65 ? 0.3575 0.8345 0.3245 -0.2179 -0.0331 -0.0835 60 ASP F C 7154 O O . ASP E 65 ? 0.3565 0.8074 0.3506 -0.2306 -0.0251 -0.0940 60 ASP F O 7155 C CB . ASP E 65 ? 0.3696 0.9376 0.3326 -0.2254 -0.0407 -0.1073 60 ASP F CB 7156 C CG . ASP E 65 ? 0.3909 1.0213 0.3501 -0.2346 -0.0382 -0.1355 60 ASP F CG 7157 O OD1 . ASP E 65 ? 0.4035 1.0476 0.3420 -0.2245 -0.0404 -0.1255 60 ASP F OD1 7158 O OD2 . ASP E 65 ? 0.4084 1.0782 0.3861 -0.2548 -0.0323 -0.1700 60 ASP F OD2 7159 N N . ARG E 66 ? 0.3622 0.8304 0.3189 -0.2112 -0.0316 -0.0763 61 ARG F N 7160 C CA . ARG E 66 ? 0.3633 0.7900 0.3423 -0.2161 -0.0228 -0.0793 61 ARG F CA 7161 C C . ARG E 66 ? 0.3450 0.7264 0.3266 -0.2078 -0.0274 -0.0516 61 ARG F C 7162 O O . ARG E 66 ? 0.3460 0.6966 0.3516 -0.2105 -0.0220 -0.0493 61 ARG F O 7163 C CB . ARG E 66 ? 0.3793 0.8180 0.3507 -0.2149 -0.0175 -0.0862 61 ARG F CB 7164 C CG . ARG E 66 ? 0.3934 0.8444 0.3299 -0.2006 -0.0240 -0.0620 61 ARG F CG 7165 C CD . ARG E 66 ? 0.4087 0.8617 0.3415 -0.2020 -0.0158 -0.0663 61 ARG F CD 7166 N NE . ARG E 66 ? 0.4100 0.8547 0.3161 -0.1894 -0.0176 -0.0372 61 ARG F NE 7167 C CZ . ARG E 66 ? 0.4287 0.9066 0.3055 -0.1803 -0.0200 -0.0218 61 ARG F CZ 7168 N NH1 . ARG E 66 ? 0.4389 0.9721 0.3063 -0.1821 -0.0243 -0.0338 61 ARG F NH1 7169 N NH2 . ARG E 66 ? 0.4424 0.9016 0.3012 -0.1695 -0.0167 0.0062 61 ARG F NH2 7170 N N . PHE E 67 ? 0.3293 0.7117 0.2890 -0.1977 -0.0362 -0.0316 62 PHE F N 7171 C CA . PHE E 67 ? 0.3174 0.6696 0.2780 -0.1939 -0.0399 -0.0115 62 PHE F CA 7172 C C . PHE E 67 ? 0.3125 0.6642 0.2837 -0.2010 -0.0412 -0.0119 62 PHE F C 7173 O O . PHE E 67 ? 0.3153 0.6934 0.2822 -0.2033 -0.0429 -0.0213 62 PHE F O 7174 C CB . PHE E 67 ? 0.3165 0.6679 0.2535 -0.1820 -0.0439 0.0049 62 PHE F CB 7175 C CG . PHE E 67 ? 0.3239 0.6683 0.2509 -0.1766 -0.0398 0.0107 62 PHE F CG 7176 C CD1 . PHE E 67 ? 0.3212 0.6417 0.2554 -0.1788 -0.0373 0.0165 62 PHE F CD1 7177 C CD2 . PHE E 67 ? 0.3370 0.7045 0.2469 -0.1697 -0.0379 0.0119 62 PHE F CD2 7178 C CE1 . PHE E 67 ? 0.3286 0.6437 0.2553 -0.1766 -0.0312 0.0199 62 PHE F CE1 7179 C CE2 . PHE E 67 ? 0.3478 0.7079 0.2475 -0.1663 -0.0315 0.0199 62 PHE F CE2 7180 C CZ . PHE E 67 ? 0.3415 0.6730 0.2505 -0.1709 -0.0272 0.0222 62 PHE F CZ 7181 N N . SER E 68 ? 0.3051 0.6326 0.2901 -0.2043 -0.0403 -0.0001 63 SER F N 7182 C CA . SER E 68 ? 0.3017 0.6279 0.2935 -0.2116 -0.0401 0.0053 63 SER F CA 7183 C C . SER E 68 ? 0.2994 0.6117 0.2902 -0.2099 -0.0437 0.0280 63 SER F C 7184 O O . SER E 68 ? 0.3063 0.6057 0.3074 -0.2063 -0.0435 0.0385 63 SER F O 7185 C CB . SER E 68 ? 0.3154 0.6352 0.3353 -0.2239 -0.0293 -0.0077 63 SER F CB 7186 O OG . SER E 68 ? 0.3258 0.6193 0.3686 -0.2220 -0.0230 -0.0004 63 SER F OG 7187 N N . GLY E 69 ? 0.2938 0.6167 0.2732 -0.2128 -0.0468 0.0341 64 GLY F N 7188 C CA . GLY E 69 ? 0.2908 0.6147 0.2653 -0.2143 -0.0503 0.0524 64 GLY F CA 7189 C C . GLY E 69 ? 0.3033 0.6267 0.2900 -0.2239 -0.0458 0.0636 64 GLY F C 7190 O O . GLY E 69 ? 0.3059 0.6313 0.2998 -0.2313 -0.0399 0.0519 64 GLY F O 7191 N N . SER E 70 ? 0.3097 0.6344 0.3000 -0.2244 -0.0474 0.0874 65 SER F N 7192 C CA . SER E 70 ? 0.3282 0.6524 0.3283 -0.2329 -0.0413 0.1061 65 SER F CA 7193 C C . SER E 70 ? 0.3357 0.6822 0.3261 -0.2319 -0.0477 0.1340 65 SER F C 7194 O O . SER E 70 ? 0.3287 0.6916 0.3083 -0.2263 -0.0564 0.1341 65 SER F O 7195 C CB . SER E 70 ? 0.3471 0.6401 0.3810 -0.2330 -0.0291 0.1110 65 SER F CB 7196 O OG . SER E 70 ? 0.3579 0.6402 0.4083 -0.2208 -0.0306 0.1303 65 SER F OG 7197 N N . GLY E 71 ? 0.3570 0.7089 0.3512 -0.2390 -0.0422 0.1575 66 GLY F N 7198 C CA . GLY E 71 ? 0.3719 0.7554 0.3565 -0.2381 -0.0482 0.1899 66 GLY F CA 7199 C C . GLY E 71 ? 0.3779 0.7970 0.3373 -0.2524 -0.0483 0.1904 66 GLY F C 7200 O O . GLY E 71 ? 0.3670 0.7850 0.3181 -0.2612 -0.0443 0.1638 66 GLY F O 7201 N N . SER E 72 ? 0.3987 0.8569 0.3464 -0.2543 -0.0530 0.2208 67 SER F N 7202 C CA . SER E 72 ? 0.4067 0.9102 0.3276 -0.2701 -0.0528 0.2197 67 SER F CA 7203 C C . SER E 72 ? 0.4250 0.9865 0.3300 -0.2702 -0.0621 0.2488 67 SER F C 7204 O O . SER E 72 ? 0.4423 1.0064 0.3614 -0.2564 -0.0671 0.2824 67 SER F O 7205 C CB . SER E 72 ? 0.4293 0.9194 0.3550 -0.2821 -0.0386 0.2310 67 SER F CB 7206 O OG . SER E 72 ? 0.4662 0.9437 0.4083 -0.2781 -0.0313 0.2781 67 SER F OG 7207 N N . GLY E 73 ? 0.4266 1.0414 0.3041 -0.2857 -0.0641 0.2340 68 GLY F N 7208 C CA . GLY E 73 ? 0.4456 1.1340 0.3030 -0.2912 -0.0724 0.2582 68 GLY F CA 7209 C C . GLY E 73 ? 0.4304 1.1475 0.2877 -0.2850 -0.0848 0.2437 68 GLY F C 7210 O O . GLY E 73 ? 0.4092 1.1401 0.2568 -0.2952 -0.0846 0.1990 68 GLY F O 7211 N N . THR E 74 ? 0.4427 1.1669 0.3154 -0.2682 -0.0932 0.2805 69 THR F N 7212 C CA . THR E 74 ? 0.4318 1.1904 0.3084 -0.2625 -0.1050 0.2685 69 THR F CA 7213 C C . THR E 74 ? 0.4178 1.1153 0.3256 -0.2430 -0.1052 0.2667 69 THR F C 7214 O O . THR E 74 ? 0.4132 1.1345 0.3288 -0.2375 -0.1135 0.2585 69 THR F O 7215 C CB . THR E 74 ? 0.4589 1.3041 0.3279 -0.2583 -0.1179 0.3109 69 THR F CB 7216 O OG1 . THR E 74 ? 0.4835 1.3031 0.3776 -0.2348 -0.1178 0.3687 69 THR F OG1 7217 C CG2 . THR E 74 ? 0.4782 1.3977 0.3129 -0.2798 -0.1176 0.3140 69 THR F CG2 7218 N N . ASP E 75 ? 0.4209 1.0452 0.3471 -0.2352 -0.0949 0.2702 70 ASP F N 7219 C CA . ASP E 75 ? 0.4171 0.9885 0.3755 -0.2170 -0.0926 0.2738 70 ASP F CA 7220 C C . ASP E 75 ? 0.3912 0.8984 0.3554 -0.2202 -0.0828 0.2364 70 ASP F C 7221 O O . ASP E 75 ? 0.3961 0.8716 0.3622 -0.2258 -0.0728 0.2353 70 ASP F O 7222 C CB . ASP E 75 ? 0.4567 1.0083 0.4406 -0.2026 -0.0865 0.3245 70 ASP F CB 7223 C CG . ASP E 75 ? 0.4680 1.0018 0.4882 -0.1800 -0.0879 0.3426 70 ASP F CG 7224 O OD1 . ASP E 75 ? 0.4463 0.9338 0.4829 -0.1765 -0.0830 0.3116 70 ASP F OD1 7225 O OD2 . ASP E 75 ? 0.5027 1.0733 0.5359 -0.1648 -0.0933 0.3897 70 ASP F OD2 7226 N N . PHE E 76 ? 0.3677 0.8614 0.3352 -0.2170 -0.0852 0.2069 71 PHE F N 7227 C CA . PHE E 76 ? 0.3474 0.7936 0.3162 -0.2187 -0.0776 0.1739 71 PHE F CA 7228 C C . PHE E 76 ? 0.3386 0.7552 0.3293 -0.2064 -0.0765 0.1664 71 PHE F C 7229 O O . PHE E 76 ? 0.3393 0.7778 0.3397 -0.1991 -0.0827 0.1758 71 PHE F O 7230 C CB . PHE E 76 ? 0.3317 0.7943 0.2758 -0.2305 -0.0779 0.1411 71 PHE F CB 7231 C CG . PHE E 76 ? 0.3414 0.8375 0.2656 -0.2442 -0.0769 0.1422 71 PHE F CG 7232 C CD1 . PHE E 76 ? 0.3433 0.8203 0.2643 -0.2494 -0.0694 0.1357 71 PHE F CD1 7233 C CD2 . PHE E 76 ? 0.3520 0.9065 0.2615 -0.2534 -0.0828 0.1476 71 PHE F CD2 7234 C CE1 . PHE E 76 ? 0.3519 0.8626 0.2560 -0.2629 -0.0668 0.1350 71 PHE F CE1 7235 C CE2 . PHE E 76 ? 0.3617 0.9533 0.2519 -0.2681 -0.0803 0.1457 71 PHE F CE2 7236 C CZ . PHE E 76 ? 0.3647 0.9319 0.2525 -0.2725 -0.0717 0.1399 71 PHE F CZ 7237 N N . THR E 77 ? 0.3338 0.7083 0.3328 -0.2052 -0.0683 0.1481 72 THR F N 7238 C CA . THR E 77 ? 0.3331 0.6818 0.3518 -0.1962 -0.0647 0.1374 72 THR F CA 7239 C C . THR E 77 ? 0.3212 0.6510 0.3277 -0.1998 -0.0606 0.1062 72 THR F C 7240 O O . THR E 77 ? 0.3262 0.6514 0.3219 -0.2062 -0.0576 0.0966 72 THR F O 7241 C CB . THR E 77 ? 0.3535 0.6732 0.4058 -0.1896 -0.0550 0.1528 72 THR F CB 7242 O OG1 . THR E 77 ? 0.3775 0.7148 0.4420 -0.1829 -0.0576 0.1905 72 THR F OG1 7243 C CG2 . THR E 77 ? 0.3531 0.6514 0.4305 -0.1807 -0.0491 0.1386 72 THR F CG2 7244 N N . LEU E 78 ? 0.3150 0.6394 0.3234 -0.1951 -0.0602 0.0926 73 LEU F N 7245 C CA . LEU E 78 ? 0.3130 0.6220 0.3133 -0.1953 -0.0552 0.0701 73 LEU F CA 7246 C C . LEU E 78 ? 0.3199 0.6132 0.3446 -0.1904 -0.0484 0.0638 73 LEU F C 7247 O O . LEU E 78 ? 0.3190 0.6149 0.3606 -0.1845 -0.0487 0.0702 73 LEU F O 7248 C CB . LEU E 78 ? 0.3081 0.6236 0.2894 -0.1957 -0.0561 0.0599 73 LEU F CB 7249 C CG . LEU E 78 ? 0.3084 0.6123 0.2792 -0.1928 -0.0507 0.0448 73 LEU F CG 7250 C CD1 . LEU E 78 ? 0.3121 0.6180 0.2711 -0.1931 -0.0505 0.0397 73 LEU F CD1 7251 C CD2 . LEU E 78 ? 0.3115 0.6144 0.2700 -0.1929 -0.0472 0.0403 73 LEU F CD2 7252 N N . LYS E 79 ? 0.3272 0.6104 0.3571 -0.1940 -0.0415 0.0486 74 LYS F N 7253 C CA . LYS E 79 ? 0.3425 0.6151 0.3963 -0.1931 -0.0318 0.0335 74 LYS F CA 7254 C C . LYS E 79 ? 0.3317 0.6157 0.3674 -0.1954 -0.0297 0.0106 74 LYS F C 7255 O O . LYS E 79 ? 0.3242 0.6208 0.3366 -0.1977 -0.0334 0.0057 74 LYS F O 7256 C CB . LYS E 79 ? 0.3671 0.6240 0.4493 -0.1990 -0.0209 0.0296 74 LYS F CB 7257 C CG . LYS E 79 ? 0.3924 0.6346 0.5005 -0.1933 -0.0186 0.0583 74 LYS F CG 7258 C CD . LYS E 79 ? 0.4264 0.6411 0.5766 -0.1972 0.0000 0.0520 74 LYS F CD 7259 C CE . LYS E 79 ? 0.4567 0.6555 0.6316 -0.1892 0.0035 0.0903 74 LYS F CE 7260 N NZ . LYS E 79 ? 0.4606 0.6686 0.6120 -0.1976 -0.0020 0.1078 74 LYS F NZ 7261 N N . ILE E 80 ? 0.3320 0.6161 0.3796 -0.1936 -0.0234 -0.0012 75 ILE F N 7262 C CA . ILE E 80 ? 0.3288 0.6305 0.3620 -0.1971 -0.0190 -0.0226 75 ILE F CA 7263 C C . ILE E 80 ? 0.3401 0.6397 0.4064 -0.2037 -0.0054 -0.0465 75 ILE F C 7264 O O . ILE E 80 ? 0.3448 0.6297 0.4413 -0.1998 0.0016 -0.0463 75 ILE F O 7265 C CB . ILE E 80 ? 0.3217 0.6295 0.3379 -0.1924 -0.0199 -0.0187 75 ILE F CB 7266 C CG1 . ILE E 80 ? 0.3140 0.6162 0.3093 -0.1881 -0.0284 0.0017 75 ILE F CG1 7267 C CG2 . ILE E 80 ? 0.3272 0.6594 0.3212 -0.1950 -0.0162 -0.0329 75 ILE F CG2 7268 C CD1 . ILE E 80 ? 0.3157 0.6177 0.3022 -0.1867 -0.0256 0.0056 75 ILE F CD1 7269 N N . SER E 81 ? 0.3460 0.6631 0.4112 -0.2142 -0.0003 -0.0691 76 SER F N 7270 C CA . SER E 81 ? 0.3636 0.6781 0.4660 -0.2252 0.0169 -0.0993 76 SER F CA 7271 C C . SER E 81 ? 0.3663 0.6963 0.4758 -0.2269 0.0265 -0.1219 76 SER F C 7272 O O . SER E 81 ? 0.3769 0.6910 0.5278 -0.2298 0.0426 -0.1394 76 SER F O 7273 C CB . SER E 81 ? 0.3739 0.7136 0.4740 -0.2406 0.0210 -0.1241 76 SER F CB 7274 O OG . SER E 81 ? 0.3736 0.7617 0.4355 -0.2419 0.0116 -0.1325 76 SER F OG 7275 N N . ARG E 82 ? 0.3589 0.7193 0.4301 -0.2244 0.0185 -0.1196 77 ARG F N 7276 C CA . ARG E 82 ? 0.3678 0.7503 0.4387 -0.2277 0.0275 -0.1391 77 ARG F CA 7277 C C . ARG E 82 ? 0.3567 0.7496 0.3860 -0.2182 0.0165 -0.1132 77 ARG F C 7278 O O . ARG E 82 ? 0.3576 0.7713 0.3517 -0.2157 0.0072 -0.1010 77 ARG F O 7279 C CB . ARG E 82 ? 0.3845 0.8110 0.4553 -0.2443 0.0375 -0.1784 77 ARG F CB 7280 C CG . ARG E 82 ? 0.4056 0.8513 0.4948 -0.2527 0.0543 -0.2106 77 ARG F CG 7281 C CD . ARG E 82 ? 0.4272 0.9347 0.5072 -0.2720 0.0633 -0.2527 77 ARG F CD 7282 N NE . ARG E 82 ? 0.4248 0.9782 0.4509 -0.2678 0.0462 -0.2326 77 ARG F NE 7283 C CZ . ARG E 82 ? 0.4280 1.0160 0.4404 -0.2736 0.0387 -0.2387 77 ARG F CZ 7284 N NH1 . ARG E 82 ? 0.4427 1.0292 0.4894 -0.2895 0.0487 -0.2712 77 ARG F NH1 7285 N NH2 . ARG E 82 ? 0.4293 1.0572 0.3960 -0.2635 0.0230 -0.2127 77 ARG F NH2 7286 N N . VAL E 83 ? 0.3513 0.7272 0.3894 -0.2121 0.0188 -0.1029 78 VAL F N 7287 C CA . VAL E 83 ? 0.3444 0.7211 0.3505 -0.2059 0.0129 -0.0793 78 VAL F CA 7288 C C . VAL E 83 ? 0.3589 0.7724 0.3367 -0.2109 0.0195 -0.0876 78 VAL F C 7289 O O . VAL E 83 ? 0.3644 0.8005 0.3557 -0.2195 0.0312 -0.1146 78 VAL F O 7290 C CB . VAL E 83 ? 0.3373 0.6917 0.3653 -0.2007 0.0142 -0.0688 78 VAL F CB 7291 C CG1 . VAL E 83 ? 0.3403 0.6980 0.3411 -0.2002 0.0149 -0.0537 78 VAL F CG1 7292 C CG2 . VAL E 83 ? 0.3255 0.6542 0.3699 -0.1940 0.0044 -0.0503 78 VAL F CG2 7293 N N . GLU E 84 ? 0.3662 0.7861 0.3065 -0.2050 0.0136 -0.0631 79 GLU F N 7294 C CA . GLU E 84 ? 0.3898 0.8413 0.2984 -0.2062 0.0201 -0.0568 79 GLU F CA 7295 C C . GLU E 84 ? 0.3937 0.8171 0.2895 -0.2010 0.0239 -0.0295 79 GLU F C 7296 O O . GLU E 84 ? 0.3825 0.7695 0.2891 -0.1966 0.0188 -0.0171 79 GLU F O 7297 C CB . GLU E 84 ? 0.4041 0.8918 0.2821 -0.2011 0.0130 -0.0466 79 GLU F CB 7298 C CG . GLU E 84 ? 0.4025 0.9171 0.2953 -0.2084 0.0086 -0.0747 79 GLU F CG 7299 C CD . GLU E 84 ? 0.4245 0.9985 0.2880 -0.2060 0.0023 -0.0716 79 GLU F CD 7300 O OE1 . GLU E 84 ? 0.4535 1.0454 0.2845 -0.1950 0.0014 -0.0416 79 GLU F OE1 7301 O OE2 . GLU E 84 ? 0.4205 1.0246 0.2956 -0.2145 -0.0007 -0.0972 79 GLU F OE2 7302 N N . ALA E 85 ? 0.4147 0.8587 0.2876 -0.2037 0.0345 -0.0216 80 ALA F N 7303 C CA . ALA E 85 ? 0.4262 0.8439 0.2914 -0.2040 0.0446 -0.0008 80 ALA F CA 7304 C C . ALA E 85 ? 0.4288 0.8098 0.2852 -0.1940 0.0410 0.0273 80 ALA F C 7305 O O . ALA E 85 ? 0.4254 0.7729 0.2954 -0.1973 0.0454 0.0312 80 ALA F O 7306 C CB . ALA E 85 ? 0.4578 0.9073 0.2938 -0.2077 0.0580 0.0095 80 ALA F CB 7307 N N . GLU E 86 ? 0.4399 0.8328 0.2769 -0.1825 0.0337 0.0434 81 GLU F N 7308 C CA . GLU E 86 ? 0.4528 0.8135 0.2839 -0.1707 0.0330 0.0695 81 GLU F CA 7309 C C . GLU E 86 ? 0.4204 0.7499 0.2756 -0.1724 0.0241 0.0586 81 GLU F C 7310 O O . GLU E 86 ? 0.4246 0.7252 0.2804 -0.1668 0.0267 0.0728 81 GLU F O 7311 C CB . GLU E 86 ? 0.4765 0.8683 0.2860 -0.1552 0.0258 0.0880 81 GLU F CB 7312 C CG . GLU E 86 ? 0.4604 0.8820 0.2792 -0.1562 0.0093 0.0650 81 GLU F CG 7313 C CD . GLU E 86 ? 0.4826 0.9593 0.2806 -0.1452 0.0016 0.0746 81 GLU F CD 7314 O OE1 . GLU E 86 ? 0.5186 1.0434 0.2949 -0.1456 0.0055 0.0794 81 GLU F OE1 7315 O OE2 . GLU E 86 ? 0.4742 0.9538 0.2784 -0.1371 -0.0086 0.0757 81 GLU F OE2 7316 N N . ASP E 87 ? 0.3947 0.7321 0.2710 -0.1799 0.0154 0.0343 82 ASP F N 7317 C CA . ASP E 87 ? 0.3741 0.6902 0.2718 -0.1816 0.0066 0.0280 82 ASP F CA 7318 C C . ASP E 87 ? 0.3695 0.6662 0.2841 -0.1898 0.0121 0.0247 82 ASP F C 7319 O O . ASP E 87 ? 0.3537 0.6412 0.2829 -0.1917 0.0051 0.0224 82 ASP F O 7320 C CB . ASP E 87 ? 0.3592 0.6896 0.2769 -0.1848 -0.0020 0.0086 82 ASP F CB 7321 C CG . ASP E 87 ? 0.3677 0.7260 0.2751 -0.1823 -0.0064 0.0020 82 ASP F CG 7322 O OD1 . ASP E 87 ? 0.3837 0.7551 0.2673 -0.1741 -0.0076 0.0169 82 ASP F OD1 7323 O OD2 . ASP E 87 ? 0.3670 0.7361 0.2944 -0.1886 -0.0074 -0.0188 82 ASP F OD2 7324 N N . LEU E 88 ? 0.3799 0.6792 0.2931 -0.1962 0.0245 0.0231 83 LEU F N 7325 C CA . LEU E 88 ? 0.3727 0.6642 0.3042 -0.2061 0.0306 0.0162 83 LEU F CA 7326 C C . LEU E 88 ? 0.3836 0.6493 0.3098 -0.2098 0.0386 0.0258 83 LEU F C 7327 O O . LEU E 88 ? 0.4070 0.6550 0.3142 -0.2044 0.0482 0.0422 83 LEU F O 7328 C CB . LEU E 88 ? 0.3838 0.6881 0.3165 -0.2140 0.0442 0.0095 83 LEU F CB 7329 C CG . LEU E 88 ? 0.3779 0.7101 0.3191 -0.2131 0.0424 -0.0063 83 LEU F CG 7330 C CD1 . LEU E 88 ? 0.3958 0.7427 0.3325 -0.2224 0.0592 -0.0116 83 LEU F CD1 7331 C CD2 . LEU E 88 ? 0.3556 0.6945 0.3326 -0.2108 0.0321 -0.0213 83 LEU F CD2 7332 N N . GLY E 89 ? 0.3673 0.6349 0.3129 -0.2184 0.0355 0.0152 84 GLY F N 7333 C CA . GLY E 89 ? 0.3778 0.6267 0.3244 -0.2265 0.0443 0.0145 84 GLY F CA 7334 C C . GLY E 89 ? 0.3565 0.6258 0.3194 -0.2310 0.0301 0.0036 84 GLY F C 7335 O O . GLY E 89 ? 0.3414 0.6355 0.3174 -0.2269 0.0159 0.0012 84 GLY F O 7336 N N . VAL E 90 ? 0.3607 0.6214 0.3239 -0.2384 0.0349 -0.0016 85 VAL F N 7337 C CA . VAL E 90 ? 0.3435 0.6338 0.3182 -0.2453 0.0224 -0.0118 85 VAL F CA 7338 C C . VAL E 90 ? 0.3381 0.6219 0.3018 -0.2359 0.0125 -0.0039 85 VAL F C 7339 O O . VAL E 90 ? 0.3544 0.6105 0.3082 -0.2324 0.0227 -0.0010 85 VAL F O 7340 C CB . VAL E 90 ? 0.3577 0.6573 0.3437 -0.2668 0.0368 -0.0328 85 VAL F CB 7341 C CG1 . VAL E 90 ? 0.3433 0.6923 0.3392 -0.2749 0.0215 -0.0431 85 VAL F CG1 7342 C CG2 . VAL E 90 ? 0.3712 0.6745 0.3688 -0.2786 0.0511 -0.0421 85 VAL F CG2 7343 N N . TYR E 91 ? 0.3185 0.6283 0.2868 -0.2307 -0.0058 0.0014 86 TYR F N 7344 C CA . TYR E 91 ? 0.3110 0.6211 0.2707 -0.2248 -0.0152 0.0080 86 TYR F CA 7345 C C . TYR E 91 ? 0.3128 0.6540 0.2758 -0.2374 -0.0191 -0.0011 86 TYR F C 7346 O O . TYR E 91 ? 0.3101 0.6872 0.2846 -0.2451 -0.0248 -0.0050 86 TYR F O 7347 C CB . TYR E 91 ? 0.2947 0.6116 0.2588 -0.2132 -0.0291 0.0211 86 TYR F CB 7348 C CG . TYR E 91 ? 0.2936 0.5899 0.2525 -0.2035 -0.0253 0.0245 86 TYR F CG 7349 C CD1 . TYR E 91 ? 0.2944 0.5907 0.2605 -0.2034 -0.0198 0.0211 86 TYR F CD1 7350 C CD2 . TYR E 91 ? 0.2915 0.5772 0.2383 -0.1958 -0.0270 0.0291 86 TYR F CD2 7351 C CE1 . TYR E 91 ? 0.2985 0.5863 0.2574 -0.1970 -0.0156 0.0216 86 TYR F CE1 7352 C CE2 . TYR E 91 ? 0.2945 0.5753 0.2349 -0.1889 -0.0242 0.0298 86 TYR F CE2 7353 C CZ . TYR E 91 ? 0.2997 0.5825 0.2449 -0.1901 -0.0185 0.0258 86 TYR F CZ 7354 O OH . TYR E 91 ? 0.3041 0.5920 0.2408 -0.1856 -0.0151 0.0240 86 TYR F OH 7355 N N . TYR E 92 ? 0.3208 0.6554 0.2747 -0.2394 -0.0158 -0.0055 87 TYR F N 7356 C CA . TYR E 92 ? 0.3290 0.6993 0.2832 -0.2537 -0.0178 -0.0180 87 TYR F CA 7357 C C . TYR E 92 ? 0.3317 0.7076 0.2760 -0.2482 -0.0262 -0.0091 87 TYR F C 7358 O O . TYR E 92 ? 0.3340 0.6788 0.2727 -0.2387 -0.0205 -0.0070 87 TYR F O 7359 C CB . TYR E 92 ? 0.3481 0.7055 0.3061 -0.2683 0.0034 -0.0435 87 TYR F CB 7360 C CG . TYR E 92 ? 0.3591 0.7128 0.3292 -0.2806 0.0173 -0.0582 87 TYR F CG 7361 C CD1 . TYR E 92 ? 0.3585 0.7640 0.3387 -0.3003 0.0153 -0.0767 87 TYR F CD1 7362 C CD2 . TYR E 92 ? 0.3718 0.6765 0.3435 -0.2741 0.0339 -0.0536 87 TYR F CD2 7363 C CE1 . TYR E 92 ? 0.3716 0.7779 0.3660 -0.3151 0.0302 -0.0945 87 TYR F CE1 7364 C CE2 . TYR E 92 ? 0.3864 0.6862 0.3702 -0.2882 0.0500 -0.0672 87 TYR F CE2 7365 C CZ . TYR E 92 ? 0.3856 0.7344 0.3819 -0.3095 0.0487 -0.0896 87 TYR F CZ 7366 O OH . TYR E 92 ? 0.4025 0.7467 0.4129 -0.3253 0.0669 -0.1053 87 TYR F OH 7367 N N . CYS E 93 ? 0.3361 0.7558 0.2790 -0.2536 -0.0392 -0.0020 88 CYS F N 7368 C CA . CYS E 93 ? 0.3429 0.7746 0.2756 -0.2541 -0.0436 0.0030 88 CYS F CA 7369 C C . CYS E 93 ? 0.3448 0.8000 0.2740 -0.2719 -0.0325 -0.0240 88 CYS F C 7370 O O . CYS E 93 ? 0.3487 0.8276 0.2840 -0.2867 -0.0261 -0.0435 88 CYS F O 7371 C CB . CYS E 93 ? 0.3542 0.8202 0.2864 -0.2512 -0.0596 0.0285 88 CYS F CB 7372 S SG . CYS E 93 ? 0.3947 0.9316 0.3315 -0.2618 -0.0699 0.0332 88 CYS F SG 7373 N N . PHE E 94 ? 0.3377 0.7895 0.2602 -0.2721 -0.0284 -0.0290 89 PHE F N 7374 C CA . PHE E 94 ? 0.3457 0.8174 0.2686 -0.2887 -0.0142 -0.0593 89 PHE F CA 7375 C C . PHE E 94 ? 0.3419 0.8417 0.2536 -0.2913 -0.0200 -0.0537 89 PHE F C 7376 O O . PHE E 94 ? 0.3332 0.8086 0.2423 -0.2767 -0.0253 -0.0353 89 PHE F O 7377 C CB . PHE E 94 ? 0.3547 0.7733 0.2897 -0.2821 0.0070 -0.0765 89 PHE F CB 7378 C CG . PHE E 94 ? 0.3691 0.7961 0.3119 -0.2943 0.0257 -0.1079 89 PHE F CG 7379 C CD1 . PHE E 94 ? 0.3888 0.8399 0.3416 -0.3184 0.0417 -0.1432 89 PHE F CD1 7380 C CD2 . PHE E 94 ? 0.3716 0.7852 0.3157 -0.2829 0.0296 -0.1065 89 PHE F CD2 7381 C CE1 . PHE E 94 ? 0.4098 0.8684 0.3745 -0.3316 0.0630 -0.1783 89 PHE F CE1 7382 C CE2 . PHE E 94 ? 0.3910 0.8125 0.3473 -0.2931 0.0495 -0.1382 89 PHE F CE2 7383 C CZ . PHE E 94 ? 0.4112 0.8527 0.3785 -0.3178 0.0674 -0.1753 89 PHE F CZ 7384 N N . GLN E 95 ? 0.3493 0.9056 0.2546 -0.3120 -0.0179 -0.0718 90 GLN F N 7385 C CA . GLN E 95 ? 0.3544 0.9434 0.2481 -0.3187 -0.0192 -0.0714 90 GLN F CA 7386 C C . GLN E 95 ? 0.3720 0.9648 0.2743 -0.3320 0.0027 -0.1135 90 GLN F C 7387 O O . GLN E 95 ? 0.3807 0.9899 0.2918 -0.3490 0.0161 -0.1461 90 GLN F O 7388 C CB . GLN E 95 ? 0.3582 1.0193 0.2354 -0.3311 -0.0345 -0.0532 90 GLN F CB 7389 C CG . GLN E 95 ? 0.3722 1.1012 0.2464 -0.3554 -0.0311 -0.0809 90 GLN F CG 7390 C CD . GLN E 95 ? 0.3886 1.1675 0.2552 -0.3787 -0.0180 -0.1157 90 GLN F CD 7391 O OE1 . GLN E 95 ? 0.3917 1.1675 0.2509 -0.3767 -0.0155 -0.1107 90 GLN F OE1 7392 N NE2 . GLN E 95 ? 0.4046 1.2350 0.2748 -0.4034 -0.0081 -0.1550 90 GLN F NE2 7393 N N . GLY E 96 ? 0.3760 0.9522 0.2799 -0.3239 0.0084 -0.1145 91 GLY F N 7394 C CA . GLY E 96 ? 0.3963 0.9777 0.3129 -0.3333 0.0305 -0.1530 91 GLY F CA 7395 C C . GLY E 96 ? 0.4013 1.0381 0.3035 -0.3469 0.0283 -0.1569 91 GLY F C 7396 O O . GLY E 96 ? 0.4099 1.0423 0.3236 -0.3456 0.0429 -0.1775 91 GLY F O 7397 N N . SER E 97 ? 0.4008 1.0921 0.2795 -0.3587 0.0111 -0.1348 92 SER F N 7398 C CA . SER E 97 ? 0.4106 1.1613 0.2711 -0.3736 0.0087 -0.1314 92 SER F CA 7399 C C . SER E 97 ? 0.4356 1.2606 0.2888 -0.4037 0.0193 -0.1699 92 SER F C 7400 O O . SER E 97 ? 0.4567 1.3143 0.3096 -0.4180 0.0335 -0.1982 92 SER F O 7401 C CB . SER E 97 ? 0.4028 1.1717 0.2432 -0.3681 -0.0131 -0.0796 92 SER F CB 7402 O OG . SER E 97 ? 0.4124 1.2428 0.2327 -0.3841 -0.0143 -0.0706 92 SER F OG 7403 N N . HIS E 98 ? 0.4428 1.3000 0.2925 -0.4147 0.0137 -0.1750 93 HIS F N 7404 C CA . HIS E 98 ? 0.4636 1.4103 0.3035 -0.4468 0.0203 -0.2106 93 HIS F CA 7405 C C . HIS E 98 ? 0.4773 1.4091 0.3429 -0.4601 0.0407 -0.2622 93 HIS F C 7406 O O . HIS E 98 ? 0.4704 1.3713 0.3455 -0.4516 0.0350 -0.2525 93 HIS F O 7407 C CB . HIS E 98 ? 0.4634 1.4818 0.2785 -0.4514 -0.0042 -0.1729 93 HIS F CB 7408 C CG . HIS E 98 ? 0.4575 1.4872 0.2507 -0.4385 -0.0218 -0.1156 93 HIS F CG 7409 N ND1 . HIS E 98 ? 0.4751 1.5800 0.2436 -0.4558 -0.0222 -0.1095 93 HIS F ND1 7410 C CD2 . HIS E 98 ? 0.4409 1.4184 0.2352 -0.4121 -0.0372 -0.0622 93 HIS F CD2 7411 C CE1 . HIS E 98 ? 0.4752 1.5674 0.2313 -0.4398 -0.0359 -0.0517 93 HIS F CE1 7412 N NE2 . HIS E 98 ? 0.4556 1.4690 0.2291 -0.4135 -0.0443 -0.0246 93 HIS F NE2 7413 N N . VAL E 99 ? 0.5040 1.4587 0.3833 -0.4827 0.0671 -0.3188 94 VAL F N 7414 C CA . VAL E 99 ? 0.5275 1.4773 0.4349 -0.5033 0.0932 -0.3762 94 VAL F CA 7415 C C . VAL E 99 ? 0.5365 1.5864 0.4277 -0.5323 0.0823 -0.3901 94 VAL F C 7416 O O . VAL E 99 ? 0.5436 1.6899 0.4056 -0.5488 0.0689 -0.3837 94 VAL F O 7417 C CB . VAL E 99 ? 0.5592 1.5153 0.4897 -0.5223 0.1278 -0.4374 94 VAL F CB 7418 C CG1 . VAL E 99 ? 0.5895 1.5404 0.5546 -0.5481 0.1603 -0.5018 94 VAL F CG1 7419 C CG2 . VAL E 99 ? 0.5531 1.4211 0.5035 -0.4909 0.1379 -0.4228 94 VAL F CG2 7420 N N . PRO E 100 ? 0.5385 1.5725 0.4481 -0.5386 0.0878 -0.4066 95 PRO F N 7421 C CA . PRO E 100 ? 0.5352 1.4615 0.4759 -0.5202 0.1028 -0.4072 95 PRO F CA 7422 C C . PRO E 100 ? 0.5010 1.3684 0.4294 -0.4822 0.0755 -0.3391 95 PRO F C 7423 O O . PRO E 100 ? 0.4850 1.4029 0.3890 -0.4768 0.0463 -0.2994 95 PRO F O 7424 C CB . PRO E 100 ? 0.5535 1.5199 0.5097 -0.5491 0.1137 -0.4476 95 PRO F CB 7425 C CG . PRO E 100 ? 0.5496 1.6425 0.4744 -0.5671 0.0864 -0.4373 95 PRO F CG 7426 C CD . PRO E 100 ? 0.5509 1.6934 0.4494 -0.5687 0.0788 -0.4270 95 PRO F CD 7427 N N . TYR E 101 ? 0.4947 1.2601 0.4419 -0.4558 0.0864 -0.3259 96 TYR F N 7428 C CA . TYR E 101 ? 0.4624 1.1713 0.4004 -0.4216 0.0643 -0.2685 96 TYR F CA 7429 C C . TYR E 101 ? 0.4531 1.1556 0.3955 -0.4210 0.0563 -0.2577 96 TYR F C 7430 O O . TYR E 101 ? 0.4711 1.1846 0.4314 -0.4431 0.0748 -0.2969 96 TYR F O 7431 C CB . TYR E 101 ? 0.4631 1.0821 0.4186 -0.3953 0.0785 -0.2604 96 TYR F CB 7432 C CG . TYR E 101 ? 0.4719 1.1020 0.4287 -0.3958 0.0884 -0.2753 96 TYR F CG 7433 C CD1 . TYR E 101 ? 0.4615 1.1544 0.3917 -0.4023 0.0702 -0.2601 96 TYR F CD1 7434 C CD2 . TYR E 101 ? 0.4942 1.0724 0.4817 -0.3885 0.1175 -0.3023 96 TYR F CD2 7435 C CE1 . TYR E 101 ? 0.4689 1.1753 0.4008 -0.4042 0.0802 -0.2748 96 TYR F CE1 7436 C CE2 . TYR E 101 ? 0.5014 1.0937 0.4945 -0.3875 0.1272 -0.3176 96 TYR F CE2 7437 C CZ . TYR E 101 ? 0.4874 1.1458 0.4514 -0.3969 0.1081 -0.3056 96 TYR F CZ 7438 O OH . TYR E 101 ? 0.4953 1.1732 0.4641 -0.3980 0.1182 -0.3216 96 TYR F OH 7439 N N . THR E 102 ? 0.4228 1.1128 0.3516 -0.3984 0.0306 -0.2082 97 THR F N 7440 C CA . THR E 102 ? 0.4128 1.1183 0.3445 -0.3989 0.0194 -0.1967 97 THR F CA 7441 C C . THR E 102 ? 0.3881 1.0355 0.3188 -0.3686 0.0046 -0.1517 97 THR F C 7442 O O . THR E 102 ? 0.3722 1.0019 0.2912 -0.3491 -0.0093 -0.1174 97 THR F O 7443 C CB . THR E 102 ? 0.4111 1.2183 0.3263 -0.4118 -0.0026 -0.1858 97 THR F CB 7444 O OG1 . THR E 102 ? 0.4065 1.2325 0.3004 -0.3983 -0.0208 -0.1472 97 THR F OG1 7445 C CG2 . THR E 102 ? 0.4356 1.3225 0.3536 -0.4489 0.0116 -0.2387 97 THR F CG2 7446 N N . PHE E 103 ? 0.3822 1.0097 0.3266 -0.3688 0.0089 -0.1556 98 PHE F N 7447 C CA . PHE E 103 ? 0.3613 0.9376 0.3085 -0.3447 0.0000 -0.1228 98 PHE F CA 7448 C C . PHE E 103 ? 0.3484 0.9784 0.2936 -0.3417 -0.0224 -0.0998 98 PHE F C 7449 O O . PHE E 103 ? 0.3638 1.0669 0.3103 -0.3607 -0.0263 -0.1159 98 PHE F O 7450 C CB . PHE E 103 ? 0.3708 0.8960 0.3359 -0.3488 0.0221 -0.1426 98 PHE F CB 7451 C CG . PHE E 103 ? 0.3847 0.8425 0.3574 -0.3420 0.0453 -0.1530 98 PHE F CG 7452 C CD1 . PHE E 103 ? 0.3749 0.7756 0.3426 -0.3147 0.0417 -0.1228 98 PHE F CD1 7453 C CD2 . PHE E 103 ? 0.4128 0.8683 0.4010 -0.3627 0.0723 -0.1939 98 PHE F CD2 7454 C CE1 . PHE E 103 ? 0.3936 0.7397 0.3702 -0.3041 0.0618 -0.1267 98 PHE F CE1 7455 C CE2 . PHE E 103 ? 0.4330 0.8238 0.4345 -0.3519 0.0958 -0.1993 98 PHE F CE2 7456 C CZ . PHE E 103 ? 0.4232 0.7608 0.4184 -0.3206 0.0893 -0.1624 98 PHE F CZ 7457 N N . GLY E 104 ? 0.3311 0.9289 0.2765 -0.3178 -0.0356 -0.0640 99 GLY F N 7458 C CA . GLY E 104 ? 0.3224 0.9539 0.2769 -0.3105 -0.0509 -0.0439 99 GLY F CA 7459 C C . GLY E 104 ? 0.3269 0.9474 0.2978 -0.3195 -0.0385 -0.0666 99 GLY F C 7460 O O . GLY E 104 ? 0.3370 0.9093 0.3111 -0.3276 -0.0172 -0.0902 99 GLY F O 7461 N N . GLY E 105 ? 0.3228 0.9892 0.3065 -0.3173 -0.0501 -0.0575 100 GLY F N 7462 C CA . GLY E 105 ? 0.3266 0.9991 0.3280 -0.3299 -0.0387 -0.0814 100 GLY F CA 7463 C C . GLY E 105 ? 0.3233 0.9223 0.3313 -0.3163 -0.0286 -0.0736 100 GLY F C 7464 O O . GLY E 105 ? 0.3287 0.9181 0.3491 -0.3287 -0.0131 -0.0945 100 GLY F O 7465 N N . GLY E 106 ? 0.3149 0.8660 0.3147 -0.2930 -0.0355 -0.0453 101 GLY F N 7466 C CA . GLY E 106 ? 0.3146 0.8064 0.3172 -0.2809 -0.0267 -0.0385 101 GLY F CA 7467 C C . GLY E 106 ? 0.3029 0.8036 0.3196 -0.2629 -0.0396 -0.0166 101 GLY F C 7468 O O . GLY E 106 ? 0.2958 0.8507 0.3291 -0.2626 -0.0501 -0.0127 101 GLY F O 7469 N N . THR E 107 ? 0.3051 0.7562 0.3172 -0.2473 -0.0377 -0.0033 102 THR F N 7470 C CA . THR E 107 ? 0.3010 0.7491 0.3302 -0.2318 -0.0431 0.0099 102 THR F CA 7471 C C . THR E 107 ? 0.3102 0.7172 0.3347 -0.2320 -0.0279 0.0008 102 THR F C 7472 O O . THR E 107 ? 0.3093 0.6772 0.3154 -0.2285 -0.0218 0.0032 102 THR F O 7473 C CB . THR E 107 ? 0.2940 0.7282 0.3248 -0.2146 -0.0537 0.0326 102 THR F CB 7474 O OG1 . THR E 107 ? 0.2967 0.7725 0.3322 -0.2130 -0.0669 0.0479 102 THR F OG1 7475 C CG2 . THR E 107 ? 0.2912 0.7153 0.3455 -0.2002 -0.0533 0.0396 102 THR F CG2 7476 N N . LYS E 108 ? 0.3166 0.7401 0.3581 -0.2359 -0.0222 -0.0080 103 LYS F N 7477 C CA . LYS E 108 ? 0.3334 0.7277 0.3702 -0.2387 -0.0062 -0.0158 103 LYS F CA 7478 C C . LYS E 108 ? 0.3182 0.7024 0.3637 -0.2228 -0.0097 -0.0076 103 LYS F C 7479 O O . LYS E 108 ? 0.3053 0.7153 0.3781 -0.2141 -0.0167 -0.0051 103 LYS F O 7480 C CB . LYS E 108 ? 0.3509 0.7727 0.4038 -0.2543 0.0041 -0.0331 103 LYS F CB 7481 C CG . LYS E 108 ? 0.3857 0.7758 0.4292 -0.2627 0.0255 -0.0402 103 LYS F CG 7482 C CD . LYS E 108 ? 0.4161 0.8215 0.4697 -0.2865 0.0424 -0.0609 103 LYS F CD 7483 C CE . LYS E 108 ? 0.4493 0.8152 0.4909 -0.2950 0.0673 -0.0615 103 LYS F CE 7484 N NZ . LYS E 108 ? 0.4541 0.8293 0.5016 -0.2868 0.0679 -0.0582 103 LYS F NZ 7485 N N . LEU E 109 ? 0.3193 0.6698 0.3444 -0.2182 -0.0041 -0.0041 104 LEU F N 7486 C CA . LEU E 109 ? 0.3126 0.6575 0.3449 -0.2080 -0.0039 -0.0042 104 LEU F CA 7487 C C . LEU E 109 ? 0.3150 0.6612 0.3457 -0.2143 0.0110 -0.0147 104 LEU F C 7488 O O . LEU E 109 ? 0.3286 0.6577 0.3344 -0.2207 0.0221 -0.0127 104 LEU F O 7489 C CB . LEU E 109 ? 0.3142 0.6372 0.3254 -0.2020 -0.0067 0.0021 104 LEU F CB 7490 C CG . LEU E 109 ? 0.3170 0.6401 0.3401 -0.1946 -0.0070 -0.0035 104 LEU F CG 7491 C CD1 . LEU E 109 ? 0.3113 0.6401 0.3663 -0.1866 -0.0154 0.0013 104 LEU F CD1 7492 C CD2 . LEU E 109 ? 0.3219 0.6342 0.3204 -0.1928 -0.0077 -0.0020 104 LEU F CD2 7493 N N . GLU E 110 ? 0.3425 1.1493 0.9641 0.0231 -0.0185 -0.3444 105 GLU F N 7494 C CA . GLU E 110 ? 0.3473 0.8850 0.9785 0.0218 -0.0347 -0.3114 105 GLU F CA 7495 C C . GLU E 110 ? 0.3175 0.7712 0.8745 -0.0670 -0.0228 -0.2205 105 GLU F C 7496 O O . GLU E 110 ? 0.3092 0.8368 0.8112 -0.1352 -0.0111 -0.1836 105 GLU F O 7497 C CB . GLU E 110 ? 0.3580 0.7817 0.9808 0.0244 -0.0348 -0.3472 105 GLU F CB 7498 C CG . GLU E 110 ? 0.4151 0.8851 1.1226 0.1111 -0.0583 -0.4713 105 GLU F CG 7499 C CD . GLU E 110 ? 0.4201 0.8549 1.0982 0.0902 -0.0520 -0.5092 105 GLU F CD 7500 O OE1 . GLU E 110 ? 0.3717 0.8006 0.9664 0.0160 -0.0246 -0.4312 105 GLU F OE1 7501 O OE2 . GLU E 110 ? 0.4889 0.9015 1.2429 0.1509 -0.0836 -0.6227 105 GLU F OE2 7502 N N . LEU E 111 ? 0.3196 0.6355 0.8873 -0.0724 -0.0360 -0.1878 106 LEU F N 7503 C CA . LEU E 111 ? 0.3119 0.5862 0.8196 -0.1434 -0.0259 -0.1430 106 LEU F CA 7504 C C . LEU E 111 ? 0.3105 0.4794 0.7739 -0.1712 -0.0122 -0.1567 106 LEU F C 7505 O O . LEU E 111 ? 0.3058 0.4130 0.7848 -0.1416 -0.0129 -0.1733 106 LEU F O 7506 C CB . LEU E 111 ? 0.3242 0.5893 0.8636 -0.1473 -0.0471 -0.0969 106 LEU F CB 7507 C CG . LEU E 111 ? 0.3305 0.7215 0.8673 -0.1838 -0.0542 -0.0508 106 LEU F CG 7508 C CD1 . LEU E 111 ? 0.3253 0.8294 0.8405 -0.1986 -0.0428 -0.0628 106 LEU F CD1 7509 C CD2 . LEU E 111 ? 0.3585 0.7863 0.9929 -0.1524 -0.1008 0.0230 106 LEU F CD2 7510 N N . LYS E 112 ? 0.3329 0.4815 0.7564 -0.2255 -0.0091 -0.1562 107 LYS F N 7511 C CA . LYS E 112 ? 0.3619 0.4049 0.7747 -0.2367 -0.0098 -0.1785 107 LYS F CA 7512 C C . LYS E 112 ? 0.3753 0.4165 0.7791 -0.2342 -0.0029 -0.2165 107 LYS F C 7513 O O . LYS E 112 ? 0.3792 0.5099 0.7697 -0.2602 -0.0029 -0.2187 107 LYS F O 7514 C CB . LYS E 112 ? 0.4304 0.4382 0.8430 -0.2943 -0.0351 -0.1657 107 LYS F CB 7515 C CG . LYS E 112 ? 0.4789 0.3940 0.9231 -0.3029 -0.0603 -0.1395 107 LYS F CG 7516 C CD . LYS E 112 ? 0.5672 0.4736 1.0318 -0.3871 -0.1093 -0.0813 107 LYS F CD 7517 C CE . LYS E 112 ? 0.6630 0.4491 1.1946 -0.4117 -0.1641 -0.0257 107 LYS F CE 7518 N NZ . LYS E 112 ? 0.7743 0.5582 1.3439 -0.5222 -0.2349 0.0705 107 LYS F NZ 7519 N N . ARG E 113 ? 0.3799 0.3730 0.7931 -0.2052 0.0027 -0.2410 108 ARG F N 7520 C CA . ARG E 113 ? 0.3994 0.4524 0.8098 -0.1954 0.0114 -0.2917 108 ARG F CA 7521 C C . ARG E 113 ? 0.4543 0.4297 0.8957 -0.1582 0.0053 -0.3536 108 ARG F C 7522 O O . ARG E 113 ? 0.4653 0.3321 0.9332 -0.1460 -0.0090 -0.3199 108 ARG F O 7523 C CB . ARG E 113 ? 0.3562 0.4550 0.7733 -0.1807 0.0167 -0.2470 108 ARG F CB 7524 C CG . ARG E 113 ? 0.3301 0.4802 0.7605 -0.2026 0.0005 -0.1694 108 ARG F CG 7525 C CD . ARG E 113 ? 0.3277 0.5553 0.7712 -0.2173 -0.0093 -0.1295 108 ARG F CD 7526 N NE . ARG E 113 ? 0.3392 0.6911 0.7626 -0.2112 0.0129 -0.1880 108 ARG F NE 7527 C CZ . ARG E 113 ? 0.3509 0.9376 0.7637 -0.2487 0.0144 -0.1815 108 ARG F CZ 7528 N NH1 . ARG E 113 ? 0.3541 1.0728 0.7744 -0.3131 -0.0117 -0.0862 108 ARG F NH1 7529 N NH2 . ARG E 113 ? 0.3695 1.1002 0.7766 -0.2199 0.0368 -0.2684 108 ARG F NH2 7530 N N . ALA E 114 ? 0.4870 0.5669 0.9358 -0.1351 0.0139 -0.4362 109 ALA F N 7531 C CA . ALA E 114 ? 0.5266 0.5911 1.0236 -0.0725 0.0109 -0.4941 109 ALA F CA 7532 C C . ALA E 114 ? 0.4501 0.5315 0.9392 -0.0644 0.0237 -0.4056 109 ALA F C 7533 O O . ALA E 114 ? 0.3838 0.5543 0.8379 -0.1021 0.0338 -0.3373 109 ALA F O 7534 C CB . ALA E 114 ? 0.5721 0.8418 1.0778 -0.0426 0.0241 -0.6180 109 ALA F CB 7535 N N . ASP E 115 ? 0.4794 0.4717 1.0176 -0.0203 0.0101 -0.4035 110 ASP F N 7536 C CA . ASP E 115 ? 0.4259 0.4633 0.9613 -0.0133 0.0197 -0.3415 110 ASP F CA 7537 C C . ASP E 115 ? 0.4018 0.6499 0.9220 -0.0106 0.0398 -0.3615 110 ASP F C 7538 O O . ASP E 115 ? 0.4478 0.8292 0.9899 0.0277 0.0469 -0.4571 110 ASP F O 7539 C CB . ASP E 115 ? 0.4771 0.4293 1.0839 0.0360 -0.0045 -0.3322 110 ASP F CB 7540 C CG . ASP E 115 ? 0.4897 0.3132 1.1071 -0.0012 -0.0316 -0.2525 110 ASP F CG 7541 O OD1 . ASP E 115 ? 0.4477 0.2669 1.0106 -0.0538 -0.0221 -0.2218 110 ASP F OD1 7542 O OD2 . ASP E 115 ? 0.5496 0.3125 1.2410 0.0205 -0.0681 -0.2106 110 ASP F OD2 7543 N N . ALA E 116 ? 0.4661 0.2940 0.5776 -0.1209 0.0789 -0.2197 111 ALA F N 7544 C CA . ALA E 116 ? 0.4681 0.3182 0.5643 -0.1209 0.0997 -0.2420 111 ALA F CA 7545 C C . ALA E 116 ? 0.4457 0.2902 0.5524 -0.1060 0.0972 -0.2198 111 ALA F C 7546 O O . ALA E 116 ? 0.4269 0.2648 0.5135 -0.1013 0.0848 -0.1832 111 ALA F O 7547 C CB . ALA E 116 ? 0.4730 0.3501 0.5010 -0.1368 0.1061 -0.2361 111 ALA F CB 7548 N N . ALA E 117 ? 0.4513 0.3026 0.5932 -0.1010 0.1107 -0.2469 112 ALA F N 7549 C CA . ALA E 117 ? 0.4348 0.2826 0.5912 -0.0883 0.1080 -0.2292 112 ALA F CA 7550 C C . ALA E 117 ? 0.4247 0.2951 0.5186 -0.0937 0.1188 -0.2146 112 ALA F C 7551 O O . ALA E 117 ? 0.4386 0.3328 0.4927 -0.1104 0.1325 -0.2296 112 ALA F O 7552 C CB . ALA E 117 ? 0.4462 0.2968 0.6774 -0.0810 0.1179 -0.2669 112 ALA F CB 7553 N N . PRO E 118 ? 0.4057 0.2686 0.4920 -0.0837 0.1091 -0.1836 113 PRO F N 7554 C CA . PRO E 118 ? 0.3993 0.2783 0.4415 -0.0873 0.1146 -0.1691 113 PRO F CA 7555 C C . PRO E 118 ? 0.4117 0.3116 0.4596 -0.0941 0.1335 -0.1920 113 PRO F C 7556 O O . PRO E 118 ? 0.4190 0.3186 0.5191 -0.0869 0.1408 -0.2143 113 PRO F O 7557 C CB . PRO E 118 ? 0.3775 0.2427 0.4231 -0.0756 0.1006 -0.1395 113 PRO F CB 7558 C CG . PRO E 118 ? 0.3809 0.2268 0.4743 -0.0692 0.0893 -0.1391 113 PRO F CG 7559 C CD . PRO E 118 ? 0.3975 0.2371 0.5135 -0.0739 0.0891 -0.1587 113 PRO F CD 7560 N N . THR E 119 ? 0.4247 0.3453 0.4246 -0.1115 0.1395 -0.1866 114 THR F N 7561 C CA . THR E 119 ? 0.4392 0.3853 0.4312 -0.1258 0.1567 -0.1997 114 THR F CA 7562 C C . THR E 119 ? 0.4168 0.3510 0.4095 -0.1127 0.1447 -0.1682 114 THR F C 7563 O O . THR E 119 ? 0.4100 0.3347 0.3761 -0.1118 0.1276 -0.1379 114 THR F O 7564 C CB . THR E 119 ? 0.4734 0.4469 0.4053 -0.1606 0.1615 -0.1997 114 THR F CB 7565 O OG1 . THR E 119 ? 0.4958 0.4792 0.4253 -0.1734 0.1712 -0.2311 114 THR F OG1 7566 C CG2 . THR E 119 ? 0.4964 0.5042 0.4116 -0.1863 0.1815 -0.2133 114 THR F CG2 7567 N N . VAL E 120 ? 0.4086 0.3438 0.4422 -0.1020 0.1523 -0.1785 115 VAL F N 7568 C CA . VAL E 120 ? 0.3875 0.3110 0.4262 -0.0901 0.1407 -0.1526 115 VAL F CA 7569 C C . VAL E 120 ? 0.3970 0.3444 0.4234 -0.1063 0.1528 -0.1536 115 VAL F C 7570 O O . VAL E 120 ? 0.4134 0.3881 0.4578 -0.1189 0.1752 -0.1842 115 VAL F O 7571 C CB . VAL E 120 ? 0.3723 0.2777 0.4654 -0.0700 0.1319 -0.1536 115 VAL F CB 7572 C CG1 . VAL E 120 ? 0.3564 0.2497 0.4438 -0.0620 0.1174 -0.1262 115 VAL F CG1 7573 C CG2 . VAL E 120 ? 0.3718 0.2565 0.4775 -0.0628 0.1188 -0.1509 115 VAL F CG2 7574 N N . SER E 121 ? 0.3917 0.3308 0.3937 -0.1078 0.1381 -0.1227 116 SER F N 7575 C CA . SER E 121 ? 0.4026 0.3591 0.3922 -0.1256 0.1426 -0.1138 116 SER F CA 7576 C C . SER E 121 ? 0.3788 0.3134 0.3838 -0.1088 0.1249 -0.0901 116 SER F C 7577 O O . SER E 121 ? 0.3644 0.2768 0.3670 -0.0956 0.1067 -0.0742 116 SER F O 7578 C CB . SER E 121 ? 0.4372 0.4059 0.3756 -0.1563 0.1345 -0.0943 116 SER F CB 7579 O OG . SER E 121 ? 0.4644 0.4525 0.3789 -0.1751 0.1474 -0.1154 116 SER F OG 7580 N N . ILE E 122 ? 0.3723 0.3179 0.3976 -0.1115 0.1325 -0.0933 117 ILE F N 7581 C CA . ILE E 122 ? 0.3544 0.2824 0.3954 -0.0994 0.1172 -0.0754 117 ILE F CA 7582 C C . ILE E 122 ? 0.3714 0.3099 0.3975 -0.1212 0.1137 -0.0572 117 ILE F C 7583 O O . ILE E 122 ? 0.3901 0.3583 0.4052 -0.1458 0.1307 -0.0653 117 ILE F O 7584 C CB . ILE E 122 ? 0.3375 0.2643 0.4236 -0.0833 0.1209 -0.0890 117 ILE F CB 7585 C CG1 . ILE E 122 ? 0.3251 0.2325 0.4188 -0.0731 0.1023 -0.0716 117 ILE F CG1 7586 C CG2 . ILE E 122 ? 0.3475 0.3061 0.4630 -0.0952 0.1426 -0.1105 117 ILE F CG2 7587 C CD1 . ILE E 122 ? 0.3141 0.2138 0.4429 -0.0603 0.0944 -0.0758 117 ILE F CD1 7588 N N . PHE E 123 ? 0.3682 0.2846 0.3976 -0.1155 0.0914 -0.0348 118 PHE F N 7589 C CA . PHE E 123 ? 0.3922 0.3102 0.4131 -0.1380 0.0782 -0.0095 118 PHE F CA 7590 C C . PHE E 123 ? 0.3797 0.2808 0.4319 -0.1249 0.0665 -0.0041 118 PHE F C 7591 O O . PHE E 123 ? 0.3626 0.2405 0.4324 -0.1049 0.0525 -0.0062 118 PHE F O 7592 C CB . PHE E 123 ? 0.4124 0.3157 0.4180 -0.1488 0.0523 0.0160 118 PHE F CB 7593 C CG . PHE E 123 ? 0.4332 0.3547 0.4012 -0.1686 0.0597 0.0145 118 PHE F CG 7594 C CD1 . PHE E 123 ? 0.4142 0.3309 0.3817 -0.1498 0.0664 -0.0041 118 PHE F CD1 7595 C CD2 . PHE E 123 ? 0.4763 0.4242 0.4053 -0.2115 0.0613 0.0301 118 PHE F CD2 7596 C CE1 . PHE E 123 ? 0.4362 0.3703 0.3695 -0.1694 0.0733 -0.0088 118 PHE F CE1 7597 C CE2 . PHE E 123 ? 0.5028 0.4725 0.3907 -0.2358 0.0695 0.0246 118 PHE F CE2 7598 C CZ . PHE E 123 ? 0.4811 0.4422 0.3735 -0.2125 0.0752 0.0039 118 PHE F CZ 7599 N N . PRO E 124 ? 0.3907 0.3083 0.4512 -0.1393 0.0745 -0.0016 119 PRO F N 7600 C CA . PRO E 124 ? 0.3849 0.2867 0.4738 -0.1317 0.0607 0.0055 119 PRO F CA 7601 C C . PRO E 124 ? 0.4062 0.2831 0.5016 -0.1392 0.0308 0.0315 119 PRO F C 7602 O O . PRO E 124 ? 0.4302 0.3074 0.5065 -0.1586 0.0189 0.0524 119 PRO F O 7603 C CB . PRO E 124 ? 0.3977 0.3291 0.4929 -0.1530 0.0763 0.0053 119 PRO F CB 7604 C CG . PRO E 124 ? 0.4033 0.3696 0.4842 -0.1646 0.1051 -0.0157 119 PRO F CG 7605 C CD . PRO E 124 ? 0.4110 0.3679 0.4578 -0.1667 0.0990 -0.0102 119 PRO F CD 7606 N N . PRO E 125 ? 0.4027 0.2585 0.5311 -0.1264 0.0156 0.0298 120 PRO F N 7607 C CA . PRO E 125 ? 0.4255 0.2546 0.5830 -0.1310 -0.0160 0.0490 120 PRO F CA 7608 C C . PRO E 125 ? 0.4662 0.3000 0.6131 -0.1666 -0.0320 0.0873 120 PRO F C 7609 O O . PRO E 125 ? 0.4753 0.3338 0.6038 -0.1865 -0.0157 0.0920 120 PRO F O 7610 C CB . PRO E 125 ? 0.4156 0.2313 0.6086 -0.1180 -0.0215 0.0335 120 PRO F CB 7611 C CG . PRO E 125 ? 0.3873 0.2179 0.5645 -0.1025 0.0023 0.0064 120 PRO F CG 7612 C CD . PRO E 125 ? 0.3822 0.2387 0.5278 -0.1108 0.0240 0.0096 120 PRO F CD 7613 N N . SER E 126 ? 0.4981 0.3113 0.6607 -0.1784 -0.0657 0.1157 121 SER F N 7614 C CA . SER E 126 ? 0.5512 0.3655 0.7026 -0.2214 -0.0915 0.1628 121 SER F CA 7615 C C . SER E 126 ? 0.5640 0.3617 0.7558 -0.2277 -0.1091 0.1749 121 SER F C 7616 O O . SER E 126 ? 0.5401 0.3142 0.7830 -0.1974 -0.1148 0.1501 121 SER F O 7617 C CB . SER E 126 ? 0.5863 0.3765 0.7580 -0.2329 -0.1351 0.1966 121 SER F CB 7618 O OG . SER E 126 ? 0.5902 0.3397 0.8452 -0.2123 -0.1719 0.1979 121 SER F OG 7619 N N . SER E 127 ? 0.6082 0.4217 0.7746 -0.2722 -0.1169 0.2117 122 SER F N 7620 C CA . SER E 127 ? 0.6286 0.4270 0.8322 -0.2846 -0.1364 0.2292 122 SER F CA 7621 C C . SER E 127 ? 0.6525 0.3982 0.9316 -0.2767 -0.1915 0.2516 122 SER F C 7622 O O . SER E 127 ? 0.6476 0.3698 0.9818 -0.2632 -0.2044 0.2413 122 SER F O 7623 C CB . SER E 127 ? 0.6769 0.5103 0.8329 -0.3427 -0.1327 0.2666 122 SER F CB 7624 O OG . SER E 127 ? 0.7304 0.5697 0.8468 -0.3838 -0.1563 0.3089 122 SER F OG 7625 N N . GLU E 128 ? 0.6812 0.4088 0.9727 -0.2845 -0.2256 0.2787 123 GLU F N 7626 C CA . GLU E 128 ? 0.7031 0.3804 1.0913 -0.2703 -0.2799 0.2916 123 GLU F CA 7627 C C . GLU E 128 ? 0.6493 0.3120 1.0992 -0.2145 -0.2613 0.2256 123 GLU F C 7628 O O . GLU E 128 ? 0.6585 0.2897 1.1923 -0.2005 -0.2865 0.2128 123 GLU F O 7629 C CB . GLU E 128 ? 0.7407 0.4043 1.1411 -0.2849 -0.3209 0.3288 123 GLU F CB 7630 C CG . GLU E 128 ? 0.8123 0.4886 1.1528 -0.3518 -0.3521 0.4021 123 GLU F CG 7631 C CD . GLU E 128 ? 0.8163 0.5357 1.0589 -0.3726 -0.3212 0.4029 123 GLU F CD 7632 O OE1 . GLU E 128 ? 0.7671 0.5223 0.9567 -0.3503 -0.2588 0.3515 123 GLU F OE1 7633 O OE2 . GLU E 128 ? 0.8739 0.5899 1.0986 -0.4134 -0.3642 0.4561 123 GLU F OE2 7634 N N . GLN E 129 ? 0.5992 0.2871 1.0076 -0.1875 -0.2175 0.1825 124 GLN F N 7635 C CA . GLN E 129 ? 0.5581 0.2413 1.0104 -0.1451 -0.1975 0.1209 124 GLN F CA 7636 C C . GLN E 129 ? 0.5449 0.2309 1.0001 -0.1398 -0.1795 0.0957 124 GLN F C 7637 O O . GLN E 129 ? 0.5430 0.2102 1.0663 -0.1221 -0.1890 0.0615 124 GLN F O 7638 C CB . GLN E 129 ? 0.5152 0.2257 0.9162 -0.1252 -0.1581 0.0881 124 GLN F CB 7639 C CG . GLN E 129 ? 0.4874 0.1962 0.9365 -0.0918 -0.1442 0.0294 124 GLN F CG 7640 C CD . GLN E 129 ? 0.4506 0.1874 0.8452 -0.0773 -0.1056 -0.0005 124 GLN F CD 7641 O OE1 . GLN E 129 ? 0.4368 0.1933 0.7595 -0.0864 -0.0843 0.0149 124 GLN F OE1 7642 N NE2 . GLN E 129 ? 0.4376 0.1787 0.8725 -0.0572 -0.0961 -0.0472 124 GLN F NE2 7643 N N . LEU E 130 ? 0.5401 0.2525 0.9276 -0.1573 -0.1541 0.1095 125 LEU F N 7644 C CA . LEU E 130 ? 0.5322 0.2509 0.9200 -0.1566 -0.1399 0.0927 125 LEU F CA 7645 C C . LEU E 130 ? 0.5665 0.2534 1.0216 -0.1673 -0.1769 0.1074 125 LEU F C 7646 O O . LEU E 130 ? 0.5585 0.2385 1.0448 -0.1544 -0.1729 0.0742 125 LEU F O 7647 C CB . LEU E 130 ? 0.5252 0.2802 0.8487 -0.1775 -0.1118 0.1093 125 LEU F CB 7648 C CG . LEU E 130 ? 0.4900 0.2748 0.7632 -0.1616 -0.0736 0.0834 125 LEU F CG 7649 C CD1 . LEU E 130 ? 0.4933 0.3167 0.7225 -0.1855 -0.0485 0.0971 125 LEU F CD1 7650 C CD2 . LEU E 130 ? 0.4577 0.2433 0.7397 -0.1346 -0.0581 0.0412 125 LEU F CD2 7651 N N . THR E 131 ? 0.6133 0.2802 1.0921 -0.1942 -0.2164 0.1580 126 THR F N 7652 C CA . THR E 131 ? 0.6572 0.2856 1.2155 -0.2063 -0.2625 0.1789 126 THR F CA 7653 C C . THR E 131 ? 0.6536 0.2519 1.3081 -0.1711 -0.2771 0.1276 126 THR F C 7654 O O . THR E 131 ? 0.6692 0.2458 1.3855 -0.1684 -0.2930 0.1105 126 THR F O 7655 C CB . THR E 131 ? 0.7151 0.3239 1.2866 -0.2451 -0.3126 0.2495 126 THR F CB 7656 O OG1 . THR E 131 ? 0.7313 0.3770 1.2117 -0.2881 -0.2951 0.2912 126 THR F OG1 7657 C CG2 . THR E 131 ? 0.7632 0.3253 1.4320 -0.2581 -0.3690 0.2754 126 THR F CG2 7658 N N . SER E 132 ? 0.6399 0.2414 1.3095 -0.1462 -0.2686 0.0976 127 SER F N 7659 C CA . SER E 132 ? 0.6404 0.2259 1.4048 -0.1153 -0.2739 0.0370 127 SER F CA 7660 C C . SER E 132 ? 0.6100 0.2218 1.3469 -0.0969 -0.2276 -0.0309 127 SER F C 7661 O O . SER E 132 ? 0.6143 0.2215 1.4243 -0.0793 -0.2256 -0.0902 127 SER F O 7662 C CB . SER E 132 ? 0.6380 0.2230 1.4352 -0.0999 -0.2825 0.0302 127 SER F CB 7663 O OG . SER E 132 ? 0.6860 0.2409 1.5247 -0.1218 -0.3380 0.0960 127 SER F OG 7664 N N . GLY E 133 ? 0.5879 0.2300 1.2249 -0.1045 -0.1922 -0.0239 128 GLY F N 7665 C CA . GLY E 133 ? 0.5691 0.2361 1.1718 -0.0952 -0.1564 -0.0760 128 GLY F CA 7666 C C . GLY E 133 ? 0.5430 0.2396 1.0948 -0.0818 -0.1226 -0.1058 128 GLY F C 7667 O O . GLY E 133 ? 0.5433 0.2622 1.0654 -0.0798 -0.0972 -0.1470 128 GLY F O 7668 N N . GLY E 134 ? 0.5317 0.2296 1.0713 -0.0773 -0.1248 -0.0829 129 GLY F N 7669 C CA . GLY E 134 ? 0.5045 0.2295 0.9946 -0.0669 -0.0945 -0.1051 129 GLY F CA 7670 C C . GLY E 134 ? 0.4837 0.2255 0.8896 -0.0749 -0.0784 -0.0665 129 GLY F C 7671 O O . GLY E 134 ? 0.4959 0.2315 0.8867 -0.0897 -0.0913 -0.0215 129 GLY F O 7672 N N . ALA E 135 ? 0.4576 0.2237 0.8114 -0.0691 -0.0503 -0.0858 130 ALA F N 7673 C CA . ALA E 135 ? 0.4366 0.2186 0.7264 -0.0743 -0.0347 -0.0581 130 ALA F CA 7674 C C . ALA E 135 ? 0.4183 0.2152 0.6781 -0.0652 -0.0172 -0.0724 130 ALA F C 7675 O O . ALA E 135 ? 0.4152 0.2267 0.6532 -0.0630 -0.0015 -0.0987 130 ALA F O 7676 C CB . ALA E 135 ? 0.4276 0.2226 0.6870 -0.0812 -0.0234 -0.0566 130 ALA F CB 7677 N N . SER E 136 ? 0.4138 0.2080 0.6699 -0.0650 -0.0226 -0.0520 131 SER F N 7678 C CA . SER E 136 ? 0.3965 0.2037 0.6264 -0.0580 -0.0080 -0.0620 131 SER F CA 7679 C C . SER E 136 ? 0.3855 0.2048 0.5640 -0.0654 0.0049 -0.0391 131 SER F C 7680 O O . SER E 136 ? 0.3958 0.2143 0.5659 -0.0788 -0.0024 -0.0117 131 SER F O 7681 C CB . SER E 136 ? 0.4055 0.2030 0.6774 -0.0525 -0.0251 -0.0612 131 SER F CB 7682 O OG . SER E 136 ? 0.4151 0.2070 0.7531 -0.0428 -0.0331 -0.0956 131 SER F OG 7683 N N . VAL E 137 ? 0.3695 0.2022 0.5174 -0.0607 0.0233 -0.0525 132 VAL F N 7684 C CA . VAL E 137 ? 0.3647 0.2093 0.4811 -0.0644 0.0364 -0.0419 132 VAL F CA 7685 C C . VAL E 137 ? 0.3656 0.2132 0.4689 -0.0593 0.0410 -0.0483 132 VAL F C 7686 O O . VAL E 137 ? 0.3568 0.2066 0.4604 -0.0530 0.0447 -0.0664 132 VAL F O 7687 C CB . VAL E 137 ? 0.3536 0.2071 0.4610 -0.0631 0.0460 -0.0484 132 VAL F CB 7688 C CG1 . VAL E 137 ? 0.3497 0.2167 0.4498 -0.0668 0.0588 -0.0431 132 VAL F CG1 7689 C CG2 . VAL E 137 ? 0.3600 0.2102 0.4853 -0.0668 0.0380 -0.0477 132 VAL F CG2 7690 N N . VAL E 138 ? 0.3784 0.2301 0.4669 -0.0672 0.0415 -0.0341 133 VAL F N 7691 C CA . VAL E 138 ? 0.3818 0.2352 0.4612 -0.0650 0.0413 -0.0363 133 VAL F CA 7692 C C . VAL E 138 ? 0.3871 0.2531 0.4378 -0.0688 0.0584 -0.0404 133 VAL F C 7693 O O . VAL E 138 ? 0.3924 0.2700 0.4321 -0.0804 0.0678 -0.0368 133 VAL F O 7694 C CB . VAL E 138 ? 0.4017 0.2488 0.4905 -0.0764 0.0202 -0.0144 133 VAL F CB 7695 C CG1 . VAL E 138 ? 0.4045 0.2564 0.4813 -0.0776 0.0184 -0.0140 133 VAL F CG1 7696 C CG2 . VAL E 138 ? 0.4082 0.2389 0.5487 -0.0690 -0.0016 -0.0149 133 VAL F CG2 7697 N N . CYS E 139 ? 0.3920 0.2587 0.4370 -0.0611 0.0635 -0.0520 134 CYS F N 7698 C CA . CYS E 139 ? 0.4060 0.2804 0.4352 -0.0633 0.0761 -0.0589 134 CYS F CA 7699 C C . CYS E 139 ? 0.4022 0.2776 0.4204 -0.0653 0.0727 -0.0590 134 CYS F C 7700 O O . CYS E 139 ? 0.3949 0.2669 0.4235 -0.0583 0.0666 -0.0629 134 CYS F O 7701 C CB . CYS E 139 ? 0.4176 0.2886 0.4547 -0.0556 0.0796 -0.0675 134 CYS F CB 7702 S SG . CYS E 139 ? 0.4595 0.3357 0.5066 -0.0564 0.0904 -0.0782 134 CYS F SG 7703 N N . PHE E 140 ? 0.4069 0.2919 0.4057 -0.0783 0.0777 -0.0579 135 PHE F N 7704 C CA . PHE E 140 ? 0.4056 0.2928 0.3921 -0.0829 0.0732 -0.0578 135 PHE F CA 7705 C C . PHE E 140 ? 0.3957 0.2863 0.3787 -0.0806 0.0882 -0.0766 135 PHE F C 7706 O O . PHE E 140 ? 0.3925 0.2906 0.3801 -0.0840 0.1022 -0.0901 135 PHE F O 7707 C CB . PHE E 140 ? 0.4373 0.3347 0.3991 -0.1072 0.0639 -0.0423 135 PHE F CB 7708 C CG . PHE E 140 ? 0.4536 0.3422 0.4297 -0.1129 0.0380 -0.0159 135 PHE F CG 7709 C CD1 . PHE E 140 ? 0.4417 0.3163 0.4596 -0.0941 0.0222 -0.0147 135 PHE F CD1 7710 C CD2 . PHE E 140 ? 0.4925 0.3894 0.4460 -0.1412 0.0280 0.0062 135 PHE F CD2 7711 C CE1 . PHE E 140 ? 0.4585 0.3219 0.5097 -0.0976 -0.0061 0.0062 135 PHE F CE1 7712 C CE2 . PHE E 140 ? 0.5153 0.3987 0.4913 -0.1491 -0.0043 0.0370 135 PHE F CE2 7713 C CZ . PHE E 140 ? 0.4957 0.3595 0.5279 -0.1243 -0.0231 0.0362 135 PHE F CZ 7714 N N . LEU E 141 ? 0.3867 0.2728 0.3711 -0.0754 0.0842 -0.0793 136 LEU F N 7715 C CA . LEU E 141 ? 0.3883 0.2735 0.3740 -0.0757 0.0922 -0.0935 136 LEU F CA 7716 C C . LEU E 141 ? 0.3950 0.2857 0.3648 -0.0849 0.0865 -0.0925 136 LEU F C 7717 O O . LEU E 141 ? 0.3885 0.2775 0.3653 -0.0802 0.0772 -0.0862 136 LEU F O 7718 C CB . LEU E 141 ? 0.3803 0.2548 0.3824 -0.0662 0.0886 -0.0922 136 LEU F CB 7719 C CG . LEU E 141 ? 0.3754 0.2449 0.3908 -0.0607 0.0871 -0.0873 136 LEU F CG 7720 C CD1 . LEU E 141 ? 0.3671 0.2395 0.3785 -0.0585 0.0821 -0.0804 136 LEU F CD1 7721 C CD2 . LEU E 141 ? 0.3831 0.2424 0.4131 -0.0615 0.0795 -0.0833 136 LEU F CD2 7722 N N . ASN E 142 ? 0.4108 0.3130 0.3607 -0.1013 0.0927 -0.1015 137 ASN F N 7723 C CA . ASN E 142 ? 0.4271 0.3372 0.3550 -0.1168 0.0816 -0.0945 137 ASN F CA 7724 C C . ASN E 142 ? 0.4359 0.3499 0.3573 -0.1248 0.0896 -0.1154 137 ASN F C 7725 O O . ASN E 142 ? 0.4426 0.3605 0.3724 -0.1272 0.1074 -0.1419 137 ASN F O 7726 C CB . ASN E 142 ? 0.4569 0.3814 0.3542 -0.1420 0.0745 -0.0801 137 ASN F CB 7727 C CG . ASN E 142 ? 0.4506 0.3659 0.3637 -0.1351 0.0564 -0.0536 137 ASN F CG 7728 O OD1 . ASN E 142 ? 0.4256 0.3278 0.3725 -0.1122 0.0499 -0.0511 137 ASN F OD1 7729 N ND2 . ASN E 142 ? 0.4790 0.4036 0.3696 -0.1588 0.0481 -0.0356 137 ASN F ND2 7730 N N . ASN E 143 ? 0.4344 0.3481 0.3515 -0.1285 0.0751 -0.1061 138 ASN F N 7731 C CA . ASN E 143 ? 0.4467 0.3650 0.3542 -0.1405 0.0779 -0.1229 138 ASN F CA 7732 C C . ASN E 143 ? 0.4324 0.3375 0.3688 -0.1281 0.0904 -0.1452 138 ASN F C 7733 O O . ASN E 143 ? 0.4509 0.3602 0.3917 -0.1370 0.1036 -0.1740 138 ASN F O 7734 C CB . ASN E 143 ? 0.4870 0.4268 0.3539 -0.1721 0.0836 -0.1344 138 ASN F CB 7735 C CG . ASN E 143 ? 0.5081 0.4574 0.3469 -0.1915 0.0607 -0.1007 138 ASN F CG 7736 O OD1 . ASN E 143 ? 0.5118 0.4650 0.3427 -0.1964 0.0613 -0.0890 138 ASN F OD1 7737 N ND2 . ASN E 143 ? 0.5226 0.4729 0.3564 -0.2014 0.0351 -0.0810 138 ASN F ND2 7738 N N . PHE E 144 ? 0.4039 0.2951 0.3644 -0.1113 0.0843 -0.1323 139 PHE F N 7739 C CA . PHE E 144 ? 0.3979 0.2731 0.3873 -0.1051 0.0853 -0.1404 139 PHE F CA 7740 C C . PHE E 144 ? 0.3957 0.2688 0.3878 -0.1096 0.0754 -0.1319 139 PHE F C 7741 O O . PHE E 144 ? 0.3868 0.2729 0.3679 -0.1123 0.0692 -0.1209 139 PHE F O 7742 C CB . PHE E 144 ? 0.3824 0.2462 0.3917 -0.0930 0.0841 -0.1292 139 PHE F CB 7743 C CG . PHE E 144 ? 0.3656 0.2358 0.3636 -0.0890 0.0792 -0.1090 139 PHE F CG 7744 C CD1 . PHE E 144 ? 0.3641 0.2353 0.3654 -0.0939 0.0735 -0.0988 139 PHE F CD1 7745 C CD2 . PHE E 144 ? 0.3562 0.2345 0.3449 -0.0841 0.0812 -0.1040 139 PHE F CD2 7746 C CE1 . PHE E 144 ? 0.3566 0.2423 0.3536 -0.0937 0.0750 -0.0923 139 PHE F CE1 7747 C CE2 . PHE E 144 ? 0.3428 0.2281 0.3346 -0.0799 0.0780 -0.0950 139 PHE F CE2 7748 C CZ . PHE E 144 ? 0.3431 0.2347 0.3402 -0.0845 0.0774 -0.0934 139 PHE F CZ 7749 N N . TYR E 145 ? 0.4044 0.2616 0.4212 -0.1115 0.0716 -0.1373 140 TYR F N 7750 C CA . TYR E 145 ? 0.4107 0.2657 0.4326 -0.1203 0.0620 -0.1276 140 TYR F CA 7751 C C . TYR E 145 ? 0.4272 0.2574 0.4835 -0.1237 0.0508 -0.1220 140 TYR F C 7752 O O . TYR E 145 ? 0.4396 0.2533 0.5295 -0.1199 0.0498 -0.1412 140 TYR F O 7753 C CB . TYR E 145 ? 0.4238 0.2873 0.4352 -0.1307 0.0612 -0.1420 140 TYR F CB 7754 C CG . TYR E 145 ? 0.4256 0.2926 0.4428 -0.1402 0.0519 -0.1299 140 TYR F CG 7755 C CD1 . TYR E 145 ? 0.4442 0.2922 0.4860 -0.1487 0.0433 -0.1293 140 TYR F CD1 7756 C CD2 . TYR E 145 ? 0.4124 0.3031 0.4212 -0.1421 0.0502 -0.1189 140 TYR F CD2 7757 C CE1 . TYR E 145 ? 0.4488 0.3038 0.4937 -0.1628 0.0354 -0.1158 140 TYR F CE1 7758 C CE2 . TYR E 145 ? 0.4156 0.3177 0.4356 -0.1533 0.0456 -0.1121 140 TYR F CE2 7759 C CZ . TYR E 145 ? 0.4334 0.3188 0.4652 -0.1655 0.0395 -0.1092 140 TYR F CZ 7760 O OH . TYR E 145 ? 0.4397 0.3391 0.4801 -0.1819 0.0355 -0.1006 140 TYR F OH 7761 N N . PRO E 146 ? 0.4355 0.2654 0.4897 -0.1352 0.0403 -0.0970 141 PRO F N 7762 C CA . PRO E 146 ? 0.4306 0.2876 0.4591 -0.1440 0.0455 -0.0853 141 PRO F CA 7763 C C . PRO E 146 ? 0.4197 0.2928 0.4323 -0.1363 0.0550 -0.0817 141 PRO F C 7764 O O . PRO E 146 ? 0.4135 0.2753 0.4290 -0.1249 0.0559 -0.0829 141 PRO F O 7765 C CB . PRO E 146 ? 0.4507 0.3032 0.4840 -0.1679 0.0322 -0.0632 141 PRO F CB 7766 C CG . PRO E 146 ? 0.4669 0.2865 0.5267 -0.1682 0.0141 -0.0508 141 PRO F CG 7767 C CD . PRO E 146 ? 0.4589 0.2628 0.5450 -0.1455 0.0198 -0.0793 141 PRO F CD 7768 N N . LYS E 147 ? 0.4247 0.3268 0.4290 -0.1436 0.0627 -0.0817 142 LYS F N 7769 C CA . LYS E 147 ? 0.4249 0.3461 0.4256 -0.1360 0.0729 -0.0875 142 LYS F CA 7770 C C . LYS E 147 ? 0.4411 0.3610 0.4280 -0.1461 0.0728 -0.0765 142 LYS F C 7771 O O . LYS E 147 ? 0.4247 0.3524 0.4100 -0.1372 0.0796 -0.0832 142 LYS F O 7772 C CB . LYS E 147 ? 0.4280 0.3855 0.4432 -0.1418 0.0821 -0.1005 142 LYS F CB 7773 C CG . LYS E 147 ? 0.4395 0.4281 0.4559 -0.1527 0.0964 -0.1111 142 LYS F CG 7774 C CD . LYS E 147 ? 0.4462 0.4780 0.4925 -0.1627 0.1089 -0.1327 142 LYS F CD 7775 C CE . LYS E 147 ? 0.4694 0.5132 0.5018 -0.1913 0.1096 -0.1234 142 LYS F CE 7776 N NZ . LYS E 147 ? 0.4825 0.5825 0.5394 -0.2113 0.1307 -0.1502 142 LYS F NZ 7777 N N . ASP E 148 ? 0.4755 0.3859 0.4538 -0.1686 0.0610 -0.0568 143 ASP F N 7778 C CA . ASP E 148 ? 0.5002 0.4091 0.4612 -0.1865 0.0529 -0.0387 143 ASP F CA 7779 C C . ASP E 148 ? 0.4857 0.3658 0.4619 -0.1641 0.0441 -0.0356 143 ASP F C 7780 O O . ASP E 148 ? 0.4855 0.3380 0.4891 -0.1504 0.0340 -0.0354 143 ASP F O 7781 C CB . ASP E 148 ? 0.5484 0.4473 0.5019 -0.2203 0.0313 -0.0082 143 ASP F CB 7782 C CG . ASP E 148 ? 0.5719 0.4984 0.5154 -0.2440 0.0398 -0.0112 143 ASP F CG 7783 O OD1 . ASP E 148 ? 0.5938 0.5632 0.5104 -0.2715 0.0559 -0.0179 143 ASP F OD1 7784 O OD2 . ASP E 148 ? 0.5754 0.4844 0.5408 -0.2370 0.0324 -0.0113 143 ASP F OD2 7785 N N . ILE E 149 ? 0.4736 0.3641 0.4376 -0.1615 0.0503 -0.0387 144 ILE F N 7786 C CA . ILE E 149 ? 0.4640 0.3323 0.4444 -0.1434 0.0427 -0.0354 144 ILE F CA 7787 C C . ILE E 149 ? 0.4741 0.3532 0.4349 -0.1559 0.0401 -0.0275 144 ILE F C 7788 O O . ILE E 149 ? 0.4716 0.3806 0.4076 -0.1704 0.0540 -0.0387 144 ILE F O 7789 C CB . ILE E 149 ? 0.4329 0.2996 0.4269 -0.1143 0.0573 -0.0577 144 ILE F CB 7790 C CG1 . ILE E 149 ? 0.4258 0.2717 0.4456 -0.0997 0.0512 -0.0578 144 ILE F CG1 7791 C CG2 . ILE E 149 ? 0.4158 0.3047 0.3986 -0.1085 0.0715 -0.0713 144 ILE F CG2 7792 C CD1 . ILE E 149 ? 0.4099 0.2565 0.4384 -0.0837 0.0643 -0.0782 144 ILE F CD1 7793 N N . ASN E 150 ? 0.4928 0.3502 0.4715 -0.1518 0.0223 -0.0121 145 ASN F N 7794 C CA . ASN E 150 ? 0.5136 0.3790 0.4750 -0.1635 0.0166 -0.0037 145 ASN F CA 7795 C C . ASN E 150 ? 0.4896 0.3430 0.4776 -0.1365 0.0192 -0.0127 145 ASN F C 7796 O O . ASN E 150 ? 0.4855 0.3179 0.5151 -0.1196 0.0106 -0.0115 145 ASN F O 7797 C CB . ASN E 150 ? 0.5677 0.4219 0.5241 -0.1959 -0.0167 0.0336 145 ASN F CB 7798 C CG . ASN E 150 ? 0.6058 0.4809 0.5221 -0.2236 -0.0206 0.0417 145 ASN F CG 7799 O OD1 . ASN E 150 ? 0.6450 0.5552 0.5158 -0.2507 -0.0031 0.0293 145 ASN F OD1 7800 N ND2 . ASN E 150 ? 0.6153 0.4746 0.5517 -0.2183 -0.0403 0.0560 145 ASN F ND2 7801 N N . VAL E 151 ? 0.4787 0.3488 0.4484 -0.1349 0.0320 -0.0257 146 VAL F N 7802 C CA . VAL E 151 ? 0.4605 0.3227 0.4511 -0.1151 0.0337 -0.0314 146 VAL F CA 7803 C C . VAL E 151 ? 0.4803 0.3464 0.4577 -0.1332 0.0191 -0.0181 146 VAL F C 7804 O O . VAL E 151 ? 0.4985 0.3856 0.4384 -0.1592 0.0216 -0.0203 146 VAL F O 7805 C CB . VAL E 151 ? 0.4431 0.3167 0.4321 -0.0978 0.0553 -0.0553 146 VAL F CB 7806 C CG1 . VAL E 151 ? 0.4327 0.2985 0.4416 -0.0826 0.0555 -0.0568 146 VAL F CG1 7807 C CG2 . VAL E 151 ? 0.4399 0.3124 0.4358 -0.0863 0.0649 -0.0646 146 VAL F CG2 7808 N N . LYS E 152 ? 0.4746 0.3253 0.4854 -0.1221 0.0054 -0.0082 147 LYS F N 7809 C CA . LYS E 152 ? 0.4949 0.3467 0.5000 -0.1391 -0.0142 0.0083 147 LYS F CA 7810 C C . LYS E 152 ? 0.4562 0.3043 0.4931 -0.1165 -0.0083 -0.0020 147 LYS F C 7811 O O . LYS E 152 ? 0.4327 0.2708 0.5160 -0.0958 -0.0063 -0.0066 147 LYS F O 7812 C CB . LYS E 152 ? 0.5360 0.3703 0.5654 -0.1567 -0.0522 0.0436 147 LYS F CB 7813 C CG . LYS E 152 ? 0.5843 0.4212 0.5989 -0.1856 -0.0820 0.0702 147 LYS F CG 7814 C CD . LYS E 152 ? 0.6445 0.4661 0.6690 -0.2173 -0.1276 0.1151 147 LYS F CD 7815 C CE . LYS E 152 ? 0.6408 0.4323 0.7529 -0.1904 -0.1453 0.1217 147 LYS F CE 7816 N NZ . LYS E 152 ? 0.7012 0.4701 0.8499 -0.2190 -0.2032 0.1718 147 LYS F NZ 7817 N N . TRP E 153 ? 0.4490 0.3090 0.4630 -0.1240 -0.0037 -0.0097 148 TRP F N 7818 C CA . TRP E 153 ? 0.4264 0.2838 0.4684 -0.1082 -0.0011 -0.0156 148 TRP F CA 7819 C C . TRP E 153 ? 0.4453 0.2966 0.5088 -0.1211 -0.0315 0.0083 148 TRP F C 7820 O O . TRP E 153 ? 0.4837 0.3385 0.5172 -0.1511 -0.0536 0.0275 148 TRP F O 7821 C CB . TRP E 153 ? 0.4168 0.2862 0.4358 -0.1083 0.0158 -0.0375 148 TRP F CB 7822 C CG . TRP E 153 ? 0.3903 0.2611 0.4126 -0.0906 0.0375 -0.0561 148 TRP F CG 7823 C CD1 . TRP E 153 ? 0.3887 0.2690 0.3935 -0.0940 0.0489 -0.0699 148 TRP F CD1 7824 C CD2 . TRP E 153 ? 0.3685 0.2337 0.4147 -0.0719 0.0468 -0.0599 148 TRP F CD2 7825 N NE1 . TRP E 153 ? 0.3694 0.2463 0.3909 -0.0762 0.0598 -0.0791 148 TRP F NE1 7826 C CE2 . TRP E 153 ? 0.3614 0.2291 0.4022 -0.0656 0.0578 -0.0709 148 TRP F CE2 7827 C CE3 . TRP E 153 ? 0.3597 0.2220 0.4317 -0.0647 0.0459 -0.0544 148 TRP F CE3 7828 C CZ2 . TRP E 153 ? 0.3507 0.2151 0.4039 -0.0563 0.0627 -0.0698 148 TRP F CZ2 7829 C CZ3 . TRP E 153 ? 0.3504 0.2142 0.4301 -0.0575 0.0569 -0.0576 148 TRP F CZ3 7830 C CH2 . TRP E 153 ? 0.3492 0.2125 0.4159 -0.0553 0.0627 -0.0621 148 TRP F CH2 7831 N N . LYS E 154 ? 0.4270 0.2728 0.5443 -0.1028 -0.0341 0.0078 149 LYS F N 7832 C CA . LYS E 154 ? 0.4430 0.2854 0.5952 -0.1115 -0.0638 0.0277 149 LYS F CA 7833 C C . LYS E 154 ? 0.4215 0.2721 0.5950 -0.0988 -0.0509 0.0137 149 LYS F C 7834 O O . LYS E 154 ? 0.3958 0.2519 0.5894 -0.0793 -0.0247 -0.0061 149 LYS F O 7835 C CB . LYS E 154 ? 0.4511 0.2807 0.6774 -0.1039 -0.0882 0.0425 149 LYS F CB 7836 C CG . LYS E 154 ? 0.4842 0.3007 0.6965 -0.1239 -0.1145 0.0682 149 LYS F CG 7837 C CD . LYS E 154 ? 0.5025 0.3008 0.8076 -0.1190 -0.1516 0.0877 149 LYS F CD 7838 C CE . LYS E 154 ? 0.5386 0.3202 0.8314 -0.1399 -0.1785 0.1153 149 LYS F CE 7839 N NZ . LYS E 154 ? 0.5560 0.3143 0.9591 -0.1303 -0.2157 0.1295 149 LYS F NZ 7840 N N . ILE E 155 ? 0.4362 0.2894 0.6022 -0.1156 -0.0717 0.0264 150 ILE F N 7841 C CA . ILE E 155 ? 0.4232 0.2835 0.6090 -0.1084 -0.0644 0.0168 150 ILE F CA 7842 C C . ILE E 155 ? 0.4378 0.2969 0.6787 -0.1154 -0.0995 0.0393 150 ILE F C 7843 O O . ILE E 155 ? 0.4682 0.3239 0.6874 -0.1422 -0.1335 0.0642 150 ILE F O 7844 C CB . ILE E 155 ? 0.4342 0.3001 0.5633 -0.1228 -0.0560 0.0042 150 ILE F CB 7845 C CG1 . ILE E 155 ? 0.4184 0.2850 0.5191 -0.1112 -0.0252 -0.0190 150 ILE F CG1 7846 C CG2 . ILE E 155 ? 0.4293 0.2988 0.5836 -0.1199 -0.0570 0.0000 150 ILE F CG2 7847 C CD1 . ILE E 155 ? 0.4349 0.3082 0.4980 -0.1241 -0.0170 -0.0400 150 ILE F CD1 7848 N N . ASP E 156 ? 0.4173 0.2831 0.7321 -0.0953 -0.0919 0.0298 151 ASP F N 7849 C CA . ASP E 156 ? 0.4311 0.2984 0.8269 -0.0959 -0.1247 0.0460 151 ASP F CA 7850 C C . ASP E 156 ? 0.4645 0.3147 0.8737 -0.1114 -0.1686 0.0785 151 ASP F C 7851 O O . ASP E 156 ? 0.4973 0.3425 0.9140 -0.1339 -0.2123 0.1101 151 ASP F O 7852 C CB . ASP E 156 ? 0.4430 0.3171 0.8316 -0.1096 -0.1394 0.0547 151 ASP F CB 7853 C CG . ASP E 156 ? 0.4191 0.3089 0.8162 -0.0962 -0.1033 0.0286 151 ASP F CG 7854 O OD1 . ASP E 156 ? 0.3987 0.3021 0.8442 -0.0783 -0.0767 0.0079 151 ASP F OD1 7855 O OD2 . ASP E 156 ? 0.4324 0.3232 0.7896 -0.1074 -0.1021 0.0277 151 ASP F OD2 7856 N N . GLY E 157 ? 0.4633 0.3042 0.8708 -0.1039 -0.1601 0.0741 152 GLY F N 7857 C CA . GLY E 157 ? 0.5017 0.3233 0.9318 -0.1198 -0.2045 0.1080 152 GLY F CA 7858 C C . GLY E 157 ? 0.5446 0.3603 0.8748 -0.1581 -0.2240 0.1374 152 GLY F C 7859 O O . GLY E 157 ? 0.5779 0.3785 0.9138 -0.1752 -0.2559 0.1664 152 GLY F O 7860 N N . SER E 158 ? 0.5547 0.3851 0.7984 -0.1748 -0.2044 0.1271 153 SER F N 7861 C CA . SER E 158 ? 0.6030 0.4403 0.7503 -0.2174 -0.2146 0.1431 153 SER F CA 7862 C C . SER E 158 ? 0.5888 0.4351 0.6760 -0.2106 -0.1692 0.1116 153 SER F C 7863 O O . SER E 158 ? 0.5454 0.3987 0.6283 -0.1846 -0.1291 0.0755 153 SER F O 7864 C CB . SER E 158 ? 0.6281 0.4820 0.7235 -0.2457 -0.2209 0.1421 153 SER F CB 7865 O OG . SER E 158 ? 0.6628 0.5096 0.8030 -0.2633 -0.2730 0.1805 153 SER F OG 7866 N N . GLU E 159 ? 0.6341 0.4815 0.6767 -0.2388 -0.1800 0.1289 154 GLU F N 7867 C CA . GLU E 159 ? 0.6304 0.4908 0.6202 -0.2374 -0.1406 0.1001 154 GLU F CA 7868 C C . GLU E 159 ? 0.6375 0.5234 0.5732 -0.2471 -0.1099 0.0643 154 GLU F C 7869 O O . GLU E 159 ? 0.6632 0.5612 0.5710 -0.2761 -0.1257 0.0698 154 GLU F O 7870 C CB . GLU E 159 ? 0.6793 0.5433 0.6255 -0.2775 -0.1611 0.1282 154 GLU F CB 7871 C CG . GLU E 159 ? 0.6631 0.5334 0.5894 -0.2651 -0.1257 0.1033 154 GLU F CG 7872 C CD . GLU E 159 ? 0.7234 0.6067 0.5939 -0.3142 -0.1413 0.1280 154 GLU F CD 7873 O OE1 . GLU E 159 ? 0.7150 0.6033 0.5755 -0.3072 -0.1177 0.1128 154 GLU F OE1 7874 O OE2 . GLU E 159 ? 0.7857 0.6755 0.6212 -0.3644 -0.1799 0.1661 154 GLU F OE2 7875 N N . ARG E 160 ? 0.6185 0.5117 0.5480 -0.2234 -0.0692 0.0266 155 ARG F N 7876 C CA . ARG E 160 ? 0.6322 0.5458 0.5361 -0.2256 -0.0409 -0.0135 155 ARG F CA 7877 C C . ARG E 160 ? 0.6383 0.5697 0.5187 -0.2271 -0.0107 -0.0427 155 ARG F C 7878 O O . ARG E 160 ? 0.6086 0.5272 0.5141 -0.1996 0.0000 -0.0428 155 ARG F O 7879 C CB . ARG E 160 ? 0.6017 0.5006 0.5552 -0.1863 -0.0286 -0.0282 155 ARG F CB 7880 C CG . ARG E 160 ? 0.6053 0.5162 0.5562 -0.1805 -0.0034 -0.0690 155 ARG F CG 7881 C CD . ARG E 160 ? 0.6522 0.5817 0.5730 -0.2135 -0.0104 -0.0829 155 ARG F CD 7882 N NE . ARG E 160 ? 0.6584 0.5950 0.5989 -0.2025 0.0122 -0.1272 155 ARG F NE 7883 C CZ . ARG E 160 ? 0.6696 0.5989 0.6352 -0.1964 0.0077 -0.1374 155 ARG F CZ 7884 N NH1 . ARG E 160 ? 0.6670 0.5995 0.6627 -0.1862 0.0249 -0.1785 155 ARG F NH1 7885 N NH2 . ARG E 160 ? 0.6866 0.6050 0.6573 -0.2006 -0.0163 -0.1074 155 ARG F NH2 7886 N N . GLN E 161 ? 0.6832 0.6485 0.5190 -0.2620 0.0035 -0.0711 156 GLN F N 7887 C CA . GLN E 161 ? 0.6928 0.6851 0.5150 -0.2686 0.0341 -0.1063 156 GLN F CA 7888 C C . GLN E 161 ? 0.6751 0.6864 0.5242 -0.2557 0.0645 -0.1639 156 GLN F C 7889 O O . GLN E 161 ? 0.6612 0.6732 0.5475 -0.2292 0.0843 -0.1884 156 GLN F O 7890 C CB . GLN E 161 ? 0.7603 0.7869 0.5161 -0.3274 0.0293 -0.0980 156 GLN F CB 7891 C CG . GLN E 161 ? 0.7748 0.7859 0.5228 -0.3327 0.0108 -0.0550 156 GLN F CG 7892 C CD . GLN E 161 ? 0.8629 0.8873 0.5511 -0.3944 -0.0223 -0.0128 156 GLN F CD 7893 O OE1 . GLN E 161 ? 0.9136 0.9829 0.5402 -0.4492 -0.0103 -0.0263 156 GLN F OE1 7894 N NE2 . GLN E 161 ? 0.8798 0.8679 0.5898 -0.3901 -0.0663 0.0389 156 GLN F NE2 7895 N N . ASN E 162 ? 0.6940 0.7198 0.5328 -0.2751 0.0646 -0.1859 157 ASN F N 7896 C CA . ASN E 162 ? 0.6851 0.7270 0.5647 -0.2636 0.0900 -0.2450 157 ASN F CA 7897 C C . ASN E 162 ? 0.6259 0.6287 0.5778 -0.2097 0.0867 -0.2421 157 ASN F C 7898 O O . ASN E 162 ? 0.5974 0.5677 0.5591 -0.1909 0.0660 -0.2042 157 ASN F O 7899 C CB . ASN E 162 ? 0.7387 0.8054 0.5875 -0.3021 0.0886 -0.2697 157 ASN F CB 7900 C CG . ASN E 162 ? 0.7444 0.8205 0.6519 -0.2874 0.1093 -0.3325 157 ASN F CG 7901 O OD1 . ASN E 162 ? 0.7135 0.7537 0.6754 -0.2506 0.0979 -0.3254 157 ASN F OD1 7902 N ND2 . ASN E 162 ? 0.7860 0.9138 0.6868 -0.3208 0.1394 -0.3968 157 ASN F ND2 7903 N N . GLY E 163 ? 0.6002 0.6099 0.6065 -0.1892 0.1054 -0.2816 158 GLY F N 7904 C CA . GLY E 163 ? 0.5570 0.5320 0.6302 -0.1470 0.0968 -0.2740 158 GLY F CA 7905 C C . GLY E 163 ? 0.5179 0.4737 0.5956 -0.1239 0.0920 -0.2398 158 GLY F C 7906 O O . GLY E 163 ? 0.4859 0.4139 0.6029 -0.0970 0.0808 -0.2218 158 GLY F O 7907 N N . VAL E 164 ? 0.5160 0.4880 0.5508 -0.1398 0.0987 -0.2298 159 VAL F N 7908 C CA . VAL E 164 ? 0.4871 0.4436 0.5241 -0.1215 0.0954 -0.2023 159 VAL F CA 7909 C C . VAL E 164 ? 0.4813 0.4588 0.5544 -0.1164 0.1111 -0.2356 159 VAL F C 7910 O O . VAL E 164 ? 0.5124 0.5279 0.5797 -0.1399 0.1301 -0.2735 159 VAL F O 7911 C CB . VAL E 164 ? 0.4941 0.4507 0.4767 -0.1400 0.0882 -0.1688 159 VAL F CB 7912 C CG1 . VAL E 164 ? 0.4717 0.4132 0.4624 -0.1214 0.0865 -0.1482 159 VAL F CG1 7913 C CG2 . VAL E 164 ? 0.5010 0.4387 0.4662 -0.1442 0.0682 -0.1369 159 VAL F CG2 7914 N N . LEU E 165 ? 0.4490 0.4063 0.5604 -0.0899 0.1030 -0.2224 160 LEU F N 7915 C CA . LEU E 165 ? 0.4363 0.4105 0.5922 -0.0826 0.1113 -0.2471 160 LEU F CA 7916 C C . LEU E 165 ? 0.4122 0.3679 0.5554 -0.0704 0.1011 -0.2112 160 LEU F C 7917 O O . LEU E 165 ? 0.3961 0.3227 0.5377 -0.0569 0.0848 -0.1791 160 LEU F O 7918 C CB . LEU E 165 ? 0.4342 0.4039 0.6770 -0.0645 0.1039 -0.2756 160 LEU F CB 7919 C CG . LEU E 165 ? 0.4566 0.4533 0.7313 -0.0772 0.1196 -0.3302 160 LEU F CG 7920 C CD1 . LEU E 165 ? 0.4593 0.4393 0.8357 -0.0551 0.1031 -0.3515 160 LEU F CD1 7921 C CD2 . LEU E 165 ? 0.4744 0.5248 0.7470 -0.1014 0.1507 -0.3808 160 LEU F CD2 7922 N N . ASN E 166 ? 0.4111 0.3884 0.5429 -0.0801 0.1126 -0.2197 161 ASN F N 7923 C CA . ASN E 166 ? 0.3961 0.3602 0.5150 -0.0725 0.1049 -0.1920 161 ASN F CA 7924 C C . ASN E 166 ? 0.3861 0.3629 0.5636 -0.0621 0.1033 -0.2099 161 ASN F C 7925 O O . ASN E 166 ? 0.3877 0.3940 0.6154 -0.0649 0.1155 -0.2512 161 ASN F O 7926 C CB . ASN E 166 ? 0.4081 0.3814 0.4704 -0.0934 0.1124 -0.1790 161 ASN F CB 7927 C CG . ASN E 166 ? 0.4193 0.3743 0.4382 -0.1019 0.1038 -0.1529 161 ASN F CG 7928 O OD1 . ASN E 166 ? 0.4118 0.3441 0.4379 -0.0877 0.0939 -0.1390 161 ASN F OD1 7929 N ND2 . ASN E 166 ? 0.4419 0.4082 0.4203 -0.1282 0.1046 -0.1437 161 ASN F ND2 7930 N N . SER E 167 ? 0.3715 0.3289 0.5478 -0.0520 0.0877 -0.1815 162 SER F N 7931 C CA . SER E 167 ? 0.3678 0.3334 0.5995 -0.0436 0.0778 -0.1888 162 SER F CA 7932 C C . SER E 167 ? 0.3620 0.3180 0.5542 -0.0471 0.0715 -0.1608 162 SER F C 7933 O O . SER E 167 ? 0.3616 0.2940 0.5132 -0.0471 0.0623 -0.1317 162 SER F O 7934 C CB . SER E 167 ? 0.3686 0.3147 0.6631 -0.0289 0.0507 -0.1803 162 SER F CB 7935 O OG . SER E 167 ? 0.3763 0.3327 0.7450 -0.0215 0.0353 -0.1898 162 SER F OG 7936 N N . TRP E 168 ? 0.3660 0.3446 0.5738 -0.0522 0.0787 -0.1746 163 TRP F N 7937 C CA . TRP E 168 ? 0.3693 0.3409 0.5421 -0.0578 0.0739 -0.1534 163 TRP F CA 7938 C C . TRP E 168 ? 0.3660 0.3392 0.5898 -0.0510 0.0518 -0.1476 163 TRP F C 7939 O O . TRP E 168 ? 0.3637 0.3561 0.6621 -0.0441 0.0467 -0.1696 163 TRP F O 7940 C CB . TRP E 168 ? 0.3800 0.3747 0.5253 -0.0750 0.0947 -0.1661 163 TRP F CB 7941 C CG . TRP E 168 ? 0.3945 0.3888 0.4922 -0.0890 0.1079 -0.1649 163 TRP F CG 7942 C CD1 . TRP E 168 ? 0.4082 0.3807 0.4560 -0.0966 0.1040 -0.1400 163 TRP F CD1 7943 C CD2 . TRP E 168 ? 0.4104 0.4285 0.5123 -0.1002 0.1233 -0.1902 163 TRP F CD2 7944 N NE1 . TRP E 168 ? 0.4276 0.4059 0.4483 -0.1122 0.1103 -0.1403 163 TRP F NE1 7945 C CE2 . TRP E 168 ? 0.4249 0.4326 0.4692 -0.1173 0.1237 -0.1710 163 TRP F CE2 7946 C CE3 . TRP E 168 ? 0.4151 0.4646 0.5707 -0.0996 0.1360 -0.2310 163 TRP F CE3 7947 C CZ2 . TRP E 168 ? 0.4461 0.4739 0.4702 -0.1381 0.1345 -0.1856 163 TRP F CZ2 7948 C CZ3 . TRP E 168 ? 0.4333 0.5062 0.5699 -0.1197 0.1535 -0.2549 163 TRP F CZ3 7949 C CH2 . TRP E 168 ? 0.4493 0.5115 0.5133 -0.1408 0.1517 -0.2292 163 TRP F CH2 7950 N N . THR E 169 ? 0.3729 0.3282 0.5606 -0.0554 0.0374 -0.1198 164 THR F N 7951 C CA . THR E 169 ? 0.3850 0.3402 0.6058 -0.0565 0.0104 -0.1053 164 THR F CA 7952 C C . THR E 169 ? 0.3831 0.3592 0.6085 -0.0628 0.0197 -0.1178 164 THR F C 7953 O O . THR E 169 ? 0.3769 0.3577 0.5588 -0.0704 0.0429 -0.1260 164 THR F O 7954 C CB . THR E 169 ? 0.4045 0.3369 0.5713 -0.0678 -0.0066 -0.0723 164 THR F CB 7955 O OG1 . THR E 169 ? 0.4307 0.3551 0.6377 -0.0707 -0.0432 -0.0488 164 THR F OG1 7956 C CG2 . THR E 169 ? 0.4155 0.3494 0.5351 -0.0814 -0.0029 -0.0671 164 THR F CG2 7957 N N . ASP E 170 ? 0.3920 0.3808 0.6779 -0.0613 -0.0018 -0.1175 165 ASP F N 7958 C CA . ASP E 170 ? 0.3909 0.4001 0.6839 -0.0694 0.0028 -0.1258 165 ASP F CA 7959 C C . ASP E 170 ? 0.4019 0.3912 0.6223 -0.0833 -0.0050 -0.1004 165 ASP F C 7960 O O . ASP E 170 ? 0.4139 0.3814 0.5957 -0.0884 -0.0192 -0.0780 165 ASP F O 7961 C CB . ASP E 170 ? 0.3991 0.4260 0.7864 -0.0640 -0.0250 -0.1290 165 ASP F CB 7962 C CG . ASP E 170 ? 0.3898 0.4529 0.8708 -0.0527 -0.0078 -0.1733 165 ASP F CG 7963 O OD1 . ASP E 170 ? 0.3829 0.4604 0.8468 -0.0536 0.0266 -0.2017 165 ASP F OD1 7964 O OD2 . ASP E 170 ? 0.4002 0.4809 0.9793 -0.0456 -0.0303 -0.1824 165 ASP F OD2 7965 N N . GLN E 171 ? 0.4015 0.4020 0.6071 -0.0930 0.0043 -0.1070 166 GLN F N 7966 C CA . GLN E 171 ? 0.4194 0.4036 0.5673 -0.1072 -0.0025 -0.0917 166 GLN F CA 7967 C C . GLN E 171 ? 0.4493 0.4255 0.5967 -0.1163 -0.0378 -0.0667 166 GLN F C 7968 O O . GLN E 171 ? 0.4559 0.4433 0.6647 -0.1141 -0.0647 -0.0586 166 GLN F O 7969 C CB . GLN E 171 ? 0.4187 0.4174 0.5696 -0.1171 0.0050 -0.1016 166 GLN F CB 7970 C CG . GLN E 171 ? 0.4369 0.4170 0.5308 -0.1315 0.0044 -0.0957 166 GLN F CG 7971 C CD . GLN E 171 ? 0.4349 0.4230 0.5307 -0.1413 0.0149 -0.1052 166 GLN F CD 7972 O OE1 . GLN E 171 ? 0.4273 0.4418 0.5670 -0.1433 0.0144 -0.1117 166 GLN F OE1 7973 N NE2 . GLN E 171 ? 0.4448 0.4119 0.5023 -0.1487 0.0239 -0.1077 166 GLN F NE2 7974 N N . ASP E 172 ? 0.4772 0.4372 0.5596 -0.1305 -0.0390 -0.0552 167 ASP F N 7975 C CA . ASP E 172 ? 0.5225 0.4797 0.5837 -0.1523 -0.0722 -0.0279 167 ASP F CA 7976 C C . ASP E 172 ? 0.5482 0.5162 0.6092 -0.1710 -0.0935 -0.0213 167 ASP F C 7977 O O . ASP E 172 ? 0.5484 0.5177 0.5744 -0.1791 -0.0753 -0.0389 167 ASP F O 7978 C CB . ASP E 172 ? 0.5485 0.4971 0.5346 -0.1701 -0.0581 -0.0279 167 ASP F CB 7979 C CG . ASP E 172 ? 0.6047 0.5579 0.5535 -0.2052 -0.0909 0.0023 167 ASP F CG 7980 O OD1 . ASP E 172 ? 0.6138 0.5617 0.5821 -0.2079 -0.1159 0.0299 167 ASP F OD1 7981 O OD2 . ASP E 172 ? 0.6456 0.6088 0.5442 -0.2348 -0.0935 -0.0007 167 ASP F OD2 7982 N N . SER E 173 ? 0.5774 0.5512 0.6823 -0.1795 -0.1364 0.0055 168 SER F N 7983 C CA . SER E 173 ? 0.6089 0.5950 0.7258 -0.1975 -0.1637 0.0154 168 SER F CA 7984 C C . SER E 173 ? 0.6563 0.6432 0.6822 -0.2328 -0.1611 0.0154 168 SER F C 7985 O O . SER E 173 ? 0.6685 0.6649 0.6920 -0.2449 -0.1676 0.0092 168 SER F O 7986 C CB . SER E 173 ? 0.6357 0.6240 0.8177 -0.2055 -0.2206 0.0527 168 SER F CB 7987 O OG . SER E 173 ? 0.6798 0.6559 0.8136 -0.2313 -0.2463 0.0872 168 SER F OG 7988 N N . LYS E 174 ? 0.6847 0.6656 0.6404 -0.2510 -0.1493 0.0172 169 LYS F N 7989 C CA . LYS E 174 ? 0.7416 0.7322 0.6129 -0.2927 -0.1463 0.0111 169 LYS F CA 7990 C C . LYS E 174 ? 0.7248 0.7129 0.5611 -0.2859 -0.0966 -0.0362 169 LYS F C 7991 O O . LYS E 174 ? 0.7496 0.7444 0.5642 -0.3022 -0.0908 -0.0572 169 LYS F O 7992 C CB . LYS E 174 ? 0.7968 0.7928 0.6133 -0.3287 -0.1650 0.0394 169 LYS F CB 7993 C CG . LYS E 174 ? 0.8359 0.8314 0.6858 -0.3473 -0.2279 0.0952 169 LYS F CG 7994 C CD . LYS E 174 ? 0.9228 0.9349 0.6828 -0.4131 -0.2553 0.1265 169 LYS F CD 7995 C CE . LYS E 174 ? 0.9346 0.9469 0.6518 -0.4237 -0.2351 0.1291 169 LYS F CE 7996 N NZ . LYS E 174 ? 1.0250 1.0656 0.6376 -0.4963 -0.2455 0.1456 169 LYS F NZ 7997 N N . ASP E 175 ? 0.6823 0.6599 0.5210 -0.2632 -0.0650 -0.0527 170 ASP F N 7998 C CA . ASP E 175 ? 0.6612 0.6330 0.4869 -0.2546 -0.0248 -0.0949 170 ASP F CA 7999 C C . ASP E 175 ? 0.5949 0.5500 0.4735 -0.2176 -0.0088 -0.1059 170 ASP F C 8000 O O . ASP E 175 ? 0.5830 0.5280 0.4642 -0.2105 0.0151 -0.1337 170 ASP F O 8001 C CB . ASP E 175 ? 0.6776 0.6532 0.4699 -0.2623 -0.0011 -0.1093 170 ASP F CB 8002 C CG . ASP E 175 ? 0.6459 0.6081 0.4696 -0.2323 0.0035 -0.0945 170 ASP F CG 8003 O OD1 . ASP E 175 ? 0.6151 0.5648 0.4873 -0.2024 -0.0003 -0.0863 170 ASP F OD1 8004 O OD2 . ASP E 175 ? 0.6603 0.6286 0.4593 -0.2421 0.0132 -0.0941 170 ASP F OD2 8005 N N . SER E 176 ? 0.5531 0.5081 0.4780 -0.1982 -0.0232 -0.0855 171 SER F N 8006 C CA . SER E 176 ? 0.5076 0.4573 0.4744 -0.1749 -0.0087 -0.0948 171 SER F CA 8007 C C . SER E 176 ? 0.4806 0.4165 0.4480 -0.1572 0.0155 -0.1043 171 SER F C 8008 O O . SER E 176 ? 0.4617 0.3906 0.4452 -0.1493 0.0280 -0.1124 171 SER F O 8009 C CB . SER E 176 ? 0.5155 0.4639 0.4831 -0.1844 -0.0049 -0.1101 171 SER F CB 8010 O OG . SER E 176 ? 0.5322 0.4953 0.5054 -0.2007 -0.0291 -0.1007 171 SER F OG 8011 N N . THR E 177 ? 0.4809 0.4134 0.4301 -0.1555 0.0187 -0.0999 172 THR F N 8012 C CA . THR E 177 ? 0.4617 0.3826 0.4156 -0.1396 0.0373 -0.1063 172 THR F CA 8013 C C . THR E 177 ? 0.4328 0.3574 0.4139 -0.1239 0.0330 -0.0928 172 THR F C 8014 O O . THR E 177 ? 0.4328 0.3677 0.4365 -0.1241 0.0147 -0.0802 172 THR F O 8015 C CB . THR E 177 ? 0.4808 0.3999 0.4043 -0.1481 0.0479 -0.1155 172 THR F CB 8016 O OG1 . THR E 177 ? 0.5005 0.4309 0.4030 -0.1627 0.0314 -0.0962 172 THR F OG1 8017 C CG2 . THR E 177 ? 0.5075 0.4274 0.4153 -0.1636 0.0598 -0.1440 172 THR F CG2 8018 N N . TYR E 178 ? 0.4124 0.3285 0.3980 -0.1118 0.0479 -0.0974 173 TYR F N 8019 C CA . TYR E 178 ? 0.3901 0.3102 0.3976 -0.0993 0.0489 -0.0926 173 TYR F CA 8020 C C . TYR E 178 ? 0.3948 0.3048 0.3865 -0.0956 0.0531 -0.0890 173 TYR F C 8021 O O . TYR E 178 ? 0.4038 0.3059 0.3740 -0.1004 0.0623 -0.0959 173 TYR F O 8022 C CB . TYR E 178 ? 0.3736 0.2977 0.3925 -0.0968 0.0614 -0.0997 173 TYR F CB 8023 C CG . TYR E 178 ? 0.3729 0.3140 0.4093 -0.1048 0.0606 -0.1045 173 TYR F CG 8024 C CD1 . TYR E 178 ? 0.3846 0.3180 0.4079 -0.1158 0.0601 -0.1044 173 TYR F CD1 8025 C CD2 . TYR E 178 ? 0.3620 0.3291 0.4380 -0.1023 0.0603 -0.1130 173 TYR F CD2 8026 C CE1 . TYR E 178 ? 0.3868 0.3375 0.4262 -0.1260 0.0591 -0.1073 173 TYR F CE1 8027 C CE2 . TYR E 178 ? 0.3632 0.3526 0.4614 -0.1119 0.0623 -0.1210 173 TYR F CE2 8028 C CZ . TYR E 178 ? 0.3752 0.3564 0.4502 -0.1248 0.0616 -0.1155 173 TYR F CZ 8029 O OH . TYR E 178 ? 0.3783 0.3832 0.4753 -0.1371 0.0633 -0.1219 173 TYR F OH 8030 N N . SER E 179 ? 0.3907 0.3033 0.4027 -0.0874 0.0470 -0.0823 174 SER F N 8031 C CA . SER E 179 ? 0.3931 0.2976 0.3958 -0.0843 0.0495 -0.0770 174 SER F CA 8032 C C . SER E 179 ? 0.3836 0.2897 0.4134 -0.0718 0.0543 -0.0828 174 SER F C 8033 O O . SER E 179 ? 0.3747 0.2936 0.4323 -0.0685 0.0557 -0.0933 174 SER F O 8034 C CB . SER E 179 ? 0.4123 0.3175 0.4088 -0.0958 0.0300 -0.0584 174 SER F CB 8035 O OG . SER E 179 ? 0.4352 0.3455 0.3930 -0.1160 0.0303 -0.0577 174 SER F OG 8036 N N . MET E 180 ? 0.3925 0.2905 0.4150 -0.0680 0.0593 -0.0807 175 MET F N 8037 C CA . MET E 180 ? 0.3908 0.2918 0.4336 -0.0604 0.0640 -0.0891 175 MET F CA 8038 C C . MET E 180 ? 0.3837 0.2749 0.4263 -0.0573 0.0607 -0.0812 175 MET F C 8039 O O . MET E 180 ? 0.3882 0.2729 0.4074 -0.0618 0.0642 -0.0737 175 MET F O 8040 C CB . MET E 180 ? 0.4060 0.3093 0.4323 -0.0647 0.0769 -0.0962 175 MET F CB 8041 C CG . MET E 180 ? 0.4232 0.3331 0.4546 -0.0658 0.0825 -0.1047 175 MET F CG 8042 S SD . MET E 180 ? 0.4676 0.3722 0.4698 -0.0794 0.0849 -0.0957 175 MET F SD 8043 C CE . MET E 180 ? 0.4806 0.4054 0.4788 -0.0927 0.0913 -0.1091 175 MET F CE 8044 N N . SER E 181 ? 0.3702 0.2634 0.4457 -0.0510 0.0554 -0.0877 176 SER F N 8045 C CA . SER E 181 ? 0.3655 0.2489 0.4440 -0.0491 0.0522 -0.0816 176 SER F CA 8046 C C . SER E 181 ? 0.3578 0.2471 0.4352 -0.0478 0.0649 -0.0986 176 SER F C 8047 O O . SER E 181 ? 0.3605 0.2657 0.4468 -0.0506 0.0735 -0.1180 176 SER F O 8048 C CB . SER E 181 ? 0.3743 0.2511 0.4967 -0.0464 0.0302 -0.0732 176 SER F CB 8049 O OG . SER E 181 ? 0.3698 0.2552 0.5475 -0.0371 0.0288 -0.0981 176 SER F OG 8050 N N . SER E 182 ? 0.3572 0.2381 0.4211 -0.0487 0.0662 -0.0914 177 SER F N 8051 C CA . SER E 182 ? 0.3577 0.2435 0.4183 -0.0524 0.0721 -0.1029 177 SER F CA 8052 C C . SER E 182 ? 0.3610 0.2368 0.4358 -0.0492 0.0649 -0.0976 177 SER F C 8053 O O . SER E 182 ? 0.3599 0.2270 0.4255 -0.0492 0.0622 -0.0802 177 SER F O 8054 C CB . SER E 182 ? 0.3587 0.2432 0.3891 -0.0603 0.0756 -0.0939 177 SER F CB 8055 O OG . SER E 182 ? 0.3683 0.2594 0.3901 -0.0710 0.0754 -0.0995 177 SER F OG 8056 N N . THR E 183 ? 0.3665 0.2475 0.4665 -0.0492 0.0642 -0.1169 178 THR F N 8057 C CA . THR E 183 ? 0.3700 0.2393 0.4953 -0.0460 0.0540 -0.1138 178 THR F CA 8058 C C . THR E 183 ? 0.3785 0.2559 0.4960 -0.0542 0.0599 -0.1314 178 THR F C 8059 O O . THR E 183 ? 0.3909 0.2877 0.5078 -0.0630 0.0704 -0.1593 178 THR F O 8060 C CB . THR E 183 ? 0.3775 0.2417 0.5609 -0.0382 0.0402 -0.1231 178 THR F CB 8061 O OG1 . THR E 183 ? 0.3791 0.2371 0.5619 -0.0369 0.0292 -0.1001 178 THR F OG1 8062 C CG2 . THR E 183 ? 0.3877 0.2354 0.6049 -0.0371 0.0243 -0.1166 178 THR F CG2 8063 N N . LEU E 184 ? 0.3809 0.2482 0.4896 -0.0561 0.0541 -0.1155 179 LEU F N 8064 C CA . LEU E 184 ? 0.3913 0.2644 0.4923 -0.0667 0.0541 -0.1270 179 LEU F CA 8065 C C . LEU E 184 ? 0.3943 0.2560 0.5354 -0.0624 0.0444 -0.1341 179 LEU F C 8066 O O . LEU E 184 ? 0.3931 0.2405 0.5432 -0.0586 0.0348 -0.1101 179 LEU F O 8067 C CB . LEU E 184 ? 0.3890 0.2590 0.4625 -0.0721 0.0501 -0.1026 179 LEU F CB 8068 C CG . LEU E 184 ? 0.4044 0.2774 0.4719 -0.0848 0.0422 -0.1042 179 LEU F CG 8069 C CD1 . LEU E 184 ? 0.4323 0.3252 0.4762 -0.1060 0.0468 -0.1295 179 LEU F CD1 8070 C CD2 . LEU E 184 ? 0.4019 0.2712 0.4620 -0.0872 0.0330 -0.0778 179 LEU F CD2 8071 N N . THR E 185 ? 0.4056 0.2766 0.5747 -0.0661 0.0475 -0.1699 180 THR F N 8072 C CA . THR E 185 ? 0.4168 0.2736 0.6393 -0.0611 0.0350 -0.1809 180 THR F CA 8073 C C . THR E 185 ? 0.4338 0.2965 0.6418 -0.0755 0.0355 -0.1944 180 THR F C 8074 O O . THR E 185 ? 0.4534 0.3402 0.6300 -0.0932 0.0481 -0.2203 180 THR F O 8075 C CB . THR E 185 ? 0.4233 0.2852 0.7140 -0.0532 0.0351 -0.2201 180 THR F CB 8076 O OG1 . THR E 185 ? 0.4106 0.2634 0.7213 -0.0410 0.0260 -0.1994 180 THR F OG1 8077 C CG2 . THR E 185 ? 0.4390 0.2828 0.7989 -0.0488 0.0178 -0.2347 180 THR F CG2 8078 N N . LEU E 186 ? 0.4316 0.2746 0.6585 -0.0730 0.0204 -0.1743 181 LEU F N 8079 C CA . LEU E 186 ? 0.4460 0.2918 0.6631 -0.0864 0.0165 -0.1818 181 LEU F CA 8080 C C . LEU E 186 ? 0.4554 0.2801 0.7331 -0.0816 0.0002 -0.1870 181 LEU F C 8081 O O . LEU E 186 ? 0.4470 0.2523 0.7686 -0.0700 -0.0125 -0.1723 181 LEU F O 8082 C CB . LEU E 186 ? 0.4350 0.2797 0.6131 -0.0907 0.0120 -0.1424 181 LEU F CB 8083 C CG . LEU E 186 ? 0.4251 0.2820 0.5584 -0.0932 0.0197 -0.1265 181 LEU F CG 8084 C CD1 . LEU E 186 ? 0.4095 0.2612 0.5409 -0.0882 0.0148 -0.0917 181 LEU F CD1 8085 C CD2 . LEU E 186 ? 0.4491 0.3256 0.5437 -0.1160 0.0206 -0.1415 181 LEU F CD2 8086 N N . THR E 187 ? 0.4765 0.3037 0.7573 -0.0941 -0.0035 -0.2043 182 THR F N 8087 C CA . THR E 187 ? 0.4943 0.2977 0.8283 -0.0922 -0.0230 -0.1982 182 THR F CA 8088 C C . THR E 187 ? 0.4801 0.2742 0.7915 -0.0932 -0.0321 -0.1444 182 THR F C 8089 O O . THR E 187 ? 0.4615 0.2704 0.7236 -0.0960 -0.0225 -0.1248 182 THR F O 8090 C CB . THR E 187 ? 0.5238 0.3347 0.8683 -0.1079 -0.0239 -0.2369 182 THR F CB 8091 O OG1 . THR E 187 ? 0.5263 0.3529 0.8080 -0.1242 -0.0220 -0.2186 182 THR F OG1 8092 C CG2 . THR E 187 ? 0.5459 0.3797 0.9103 -0.1143 -0.0064 -0.3034 182 THR F CG2 8093 N N . LYS E 188 ? 0.4934 0.2652 0.8482 -0.0934 -0.0513 -0.1225 183 LYS F N 8094 C CA . LYS E 188 ? 0.4947 0.2660 0.8341 -0.1025 -0.0568 -0.0799 183 LYS F CA 8095 C C . LYS E 188 ? 0.4938 0.2818 0.8069 -0.1113 -0.0511 -0.0855 183 LYS F C 8096 O O . LYS E 188 ? 0.4812 0.2857 0.7648 -0.1132 -0.0422 -0.0646 183 LYS F O 8097 C CB . LYS E 188 ? 0.5235 0.2693 0.9166 -0.1103 -0.0825 -0.0597 183 LYS F CB 8098 C CG . LYS E 188 ? 0.5311 0.2819 0.9109 -0.1275 -0.0871 -0.0144 183 LYS F CG 8099 C CD . LYS E 188 ? 0.5719 0.2946 1.0083 -0.1409 -0.1183 0.0042 183 LYS F CD 8100 C CE . LYS E 188 ? 0.5916 0.3200 1.0151 -0.1674 -0.1269 0.0566 183 LYS F CE 8101 N NZ . LYS E 188 ? 0.5906 0.3403 1.0022 -0.1823 -0.1167 0.0642 183 LYS F NZ 8102 N N . ASP E 189 ? 0.5193 0.3045 0.8495 -0.1181 -0.0578 -0.1167 184 ASP F N 8103 C CA . ASP E 189 ? 0.5278 0.3278 0.8350 -0.1318 -0.0600 -0.1193 184 ASP F CA 8104 C C . ASP E 189 ? 0.5125 0.3350 0.7675 -0.1341 -0.0498 -0.1124 184 ASP F C 8105 O O . ASP E 189 ? 0.4970 0.3297 0.7448 -0.1381 -0.0544 -0.0874 184 ASP F O 8106 C CB . ASP E 189 ? 0.5649 0.3631 0.8895 -0.1440 -0.0665 -0.1632 184 ASP F CB 8107 C CG . ASP E 189 ? 0.5897 0.3630 0.9761 -0.1456 -0.0849 -0.1633 184 ASP F CG 8108 O OD1 . ASP E 189 ? 0.5885 0.3447 1.0023 -0.1396 -0.0943 -0.1269 184 ASP F OD1 8109 O OD2 . ASP E 189 ? 0.6256 0.3978 1.0320 -0.1575 -0.0914 -0.1996 184 ASP F OD2 8110 N N . GLU E 190 ? 0.5134 0.3441 0.7416 -0.1323 -0.0379 -0.1336 185 GLU F N 8111 C CA . GLU E 190 ? 0.5107 0.3592 0.6919 -0.1383 -0.0336 -0.1225 185 GLU F CA 8112 C C . GLU E 190 ? 0.4664 0.3137 0.6495 -0.1227 -0.0283 -0.0889 185 GLU F C 8113 O O . GLU E 190 ? 0.4634 0.3205 0.6344 -0.1258 -0.0332 -0.0700 185 GLU F O 8114 C CB . GLU E 190 ? 0.5400 0.4020 0.6901 -0.1459 -0.0204 -0.1537 185 GLU F CB 8115 C CG . GLU E 190 ? 0.5621 0.4411 0.6609 -0.1614 -0.0237 -0.1360 185 GLU F CG 8116 C CD . GLU E 190 ? 0.6033 0.5041 0.6605 -0.1809 -0.0109 -0.1646 185 GLU F CD 8117 O OE1 . GLU E 190 ? 0.6228 0.5270 0.6986 -0.1722 0.0075 -0.1996 185 GLU F OE1 8118 O OE2 . GLU E 190 ? 0.6375 0.5545 0.6469 -0.2085 -0.0217 -0.1502 185 GLU F OE2 8119 N N . TYR E 191 ? 0.4385 0.2749 0.6410 -0.1088 -0.0204 -0.0832 186 TYR F N 8120 C CA . TYR E 191 ? 0.4110 0.2521 0.6125 -0.1001 -0.0116 -0.0587 186 TYR F CA 8121 C C . TYR E 191 ? 0.4035 0.2553 0.6255 -0.1052 -0.0153 -0.0401 186 TYR F C 8122 O O . TYR E 191 ? 0.3864 0.2520 0.6114 -0.1016 -0.0093 -0.0313 186 TYR F O 8123 C CB . TYR E 191 ? 0.4066 0.2363 0.6210 -0.0942 -0.0083 -0.0517 186 TYR F CB 8124 C CG . TYR E 191 ? 0.3947 0.2358 0.6024 -0.0948 0.0027 -0.0298 186 TYR F CG 8125 C CD1 . TYR E 191 ? 0.3811 0.2339 0.5682 -0.0881 0.0159 -0.0317 186 TYR F CD1 8126 C CD2 . TYR E 191 ? 0.4046 0.2479 0.6266 -0.1071 0.0006 -0.0098 186 TYR F CD2 8127 C CE1 . TYR E 191 ? 0.3753 0.2437 0.5595 -0.0916 0.0299 -0.0221 186 TYR F CE1 8128 C CE2 . TYR E 191 ? 0.4030 0.2667 0.6128 -0.1159 0.0158 0.0026 186 TYR F CE2 8129 C CZ . TYR E 191 ? 0.3882 0.2654 0.5807 -0.1070 0.0321 -0.0074 186 TYR F CZ 8130 O OH . TYR E 191 ? 0.3924 0.2947 0.5761 -0.1187 0.0509 -0.0047 186 TYR F OH 8131 N N . GLU E 192 ? 0.4152 0.2620 0.6608 -0.1137 -0.0258 -0.0382 187 GLU F N 8132 C CA . GLU E 192 ? 0.4134 0.2749 0.6873 -0.1209 -0.0288 -0.0233 187 GLU F CA 8133 C C . GLU E 192 ? 0.4134 0.2850 0.6932 -0.1257 -0.0430 -0.0235 187 GLU F C 8134 O O . GLU E 192 ? 0.4130 0.2992 0.7279 -0.1301 -0.0479 -0.0134 187 GLU F O 8135 C CB . GLU E 192 ? 0.4315 0.2831 0.7304 -0.1318 -0.0380 -0.0173 187 GLU F CB 8136 C CG . GLU E 192 ? 0.4427 0.2842 0.7432 -0.1349 -0.0340 -0.0041 187 GLU F CG 8137 C CD . GLU E 192 ? 0.4723 0.2952 0.8034 -0.1485 -0.0525 0.0060 187 GLU F CD 8138 O OE1 . GLU E 192 ? 0.4847 0.3010 0.8370 -0.1534 -0.0660 -0.0033 187 GLU F OE1 8139 O OE2 . GLU E 192 ? 0.4904 0.3032 0.8258 -0.1571 -0.0578 0.0259 187 GLU F OE2 8140 N N . ARG E 193 ? 0.4204 0.2874 0.6683 -0.1297 -0.0522 -0.0335 188 ARG F N 8141 C CA . ARG E 193 ? 0.4316 0.3081 0.6805 -0.1414 -0.0736 -0.0240 188 ARG F CA 8142 C C . ARG E 193 ? 0.4119 0.2961 0.6716 -0.1331 -0.0749 -0.0095 188 ARG F C 8143 O O . ARG E 193 ? 0.4242 0.3129 0.6919 -0.1437 -0.1000 0.0053 188 ARG F O 8144 C CB . ARG E 193 ? 0.4677 0.3416 0.6704 -0.1620 -0.0859 -0.0397 188 ARG F CB 8145 C CG . ARG E 193 ? 0.4866 0.3520 0.6907 -0.1687 -0.0829 -0.0654 188 ARG F CG 8146 C CD . ARG E 193 ? 0.5269 0.3998 0.7200 -0.1957 -0.1055 -0.0713 188 ARG F CD 8147 N NE . ARG E 193 ? 0.5503 0.4367 0.7186 -0.2151 -0.1285 -0.0488 188 ARG F NE 8148 C CZ . ARG E 193 ? 0.5733 0.4672 0.7541 -0.2341 -0.1583 -0.0300 188 ARG F CZ 8149 N NH1 . ARG E 193 ? 0.5974 0.5004 0.7609 -0.2546 -0.1872 -0.0027 188 ARG F NH1 8150 N NH2 . ARG E 193 ? 0.5770 0.4684 0.7928 -0.2348 -0.1640 -0.0342 188 ARG F NH2 8151 N N . HIS E 194 ? 0.3859 0.2711 0.6501 -0.1168 -0.0519 -0.0127 189 HIS F N 8152 C CA . HIS E 194 ? 0.3746 0.2661 0.6591 -0.1073 -0.0509 -0.0057 189 HIS F CA 8153 C C . HIS E 194 ? 0.3506 0.2565 0.6696 -0.0944 -0.0240 -0.0134 189 HIS F C 8154 O O . HIS E 194 ? 0.3432 0.2498 0.6446 -0.0949 -0.0048 -0.0192 189 HIS F O 8155 C CB . HIS E 194 ? 0.3812 0.2620 0.6155 -0.1088 -0.0502 -0.0081 189 HIS F CB 8156 C CG . HIS E 194 ? 0.4145 0.2918 0.6070 -0.1316 -0.0728 -0.0040 189 HIS F CG 8157 N ND1 . HIS E 194 ? 0.4390 0.3188 0.6425 -0.1485 -0.1062 0.0186 189 HIS F ND1 8158 C CD2 . HIS E 194 ? 0.4322 0.3085 0.5753 -0.1454 -0.0675 -0.0223 189 HIS F CD2 8159 C CE1 . HIS E 194 ? 0.4751 0.3577 0.6228 -0.1771 -0.1197 0.0169 189 HIS F CE1 8160 N NE2 . HIS E 194 ? 0.4702 0.3533 0.5828 -0.1748 -0.0928 -0.0131 189 HIS F NE2 8161 N N . ASN E 195 ? 0.3434 0.2621 0.7135 -0.0865 -0.0248 -0.0143 190 ASN F N 8162 C CA . ASN E 195 ? 0.3305 0.2740 0.7410 -0.0800 0.0044 -0.0315 190 ASN F CA 8163 C C . ASN E 195 ? 0.3266 0.2687 0.7219 -0.0712 0.0214 -0.0431 190 ASN F C 8164 O O . ASN E 195 ? 0.3206 0.2762 0.6962 -0.0744 0.0498 -0.0558 190 ASN F O 8165 C CB . ASN E 195 ? 0.3279 0.2949 0.8313 -0.0766 -0.0034 -0.0375 190 ASN F CB 8166 C CG . ASN E 195 ? 0.3332 0.3063 0.8581 -0.0868 -0.0192 -0.0268 190 ASN F CG 8167 O OD1 . ASN E 195 ? 0.3346 0.3106 0.8263 -0.0970 -0.0059 -0.0263 190 ASN F OD1 8168 N ND2 . ASN E 195 ? 0.3405 0.3138 0.9247 -0.0862 -0.0524 -0.0152 190 ASN F ND2 8169 N N . SER E 196 ? 0.3347 0.2611 0.7381 -0.0649 0.0009 -0.0358 191 SER F N 8170 C CA . SER E 196 ? 0.3352 0.2596 0.7382 -0.0564 0.0134 -0.0475 191 SER F CA 8171 C C . SER E 196 ? 0.3395 0.2413 0.6635 -0.0591 0.0113 -0.0378 191 SER F C 8172 O O . SER E 196 ? 0.3536 0.2392 0.6449 -0.0674 -0.0119 -0.0207 191 SER F O 8173 C CB . SER E 196 ? 0.3418 0.2639 0.8237 -0.0485 -0.0100 -0.0462 191 SER F CB 8174 O OG . SER E 196 ? 0.3418 0.2614 0.8292 -0.0405 0.0033 -0.0617 191 SER F OG 8175 N N . TYR E 197 ? 0.3346 0.2406 0.6293 -0.0563 0.0366 -0.0512 192 TYR F N 8176 C CA . TYR E 197 ? 0.3383 0.2280 0.5724 -0.0573 0.0370 -0.0465 192 TYR F CA 8177 C C . TYR E 197 ? 0.3413 0.2322 0.5839 -0.0510 0.0473 -0.0575 192 TYR F C 8178 O O . TYR E 197 ? 0.3361 0.2450 0.5956 -0.0502 0.0700 -0.0760 192 TYR F O 8179 C CB . TYR E 197 ? 0.3349 0.2250 0.5287 -0.0620 0.0502 -0.0476 192 TYR F CB 8180 C CG . TYR E 197 ? 0.3406 0.2242 0.5289 -0.0681 0.0368 -0.0398 192 TYR F CG 8181 C CD1 . TYR E 197 ? 0.3395 0.2342 0.5592 -0.0727 0.0365 -0.0375 192 TYR F CD1 8182 C CD2 . TYR E 197 ? 0.3490 0.2194 0.5048 -0.0718 0.0261 -0.0399 192 TYR F CD2 8183 C CE1 . TYR E 197 ? 0.3473 0.2346 0.5645 -0.0793 0.0227 -0.0319 192 TYR F CE1 8184 C CE2 . TYR E 197 ? 0.3576 0.2240 0.5125 -0.0793 0.0156 -0.0407 192 TYR F CE2 8185 C CZ . TYR E 197 ? 0.3579 0.2298 0.5424 -0.0823 0.0121 -0.0349 192 TYR F CZ 8186 O OH . TYR E 197 ? 0.3725 0.2390 0.5575 -0.0908 0.0000 -0.0373 192 TYR F OH 8187 N N . THR E 198 ? 0.3574 0.2321 0.5854 -0.0516 0.0308 -0.0472 193 THR F N 8188 C CA . THR E 198 ? 0.3674 0.2387 0.6101 -0.0464 0.0347 -0.0554 193 THR F CA 8189 C C . THR E 198 ? 0.3830 0.2430 0.5672 -0.0515 0.0341 -0.0485 193 THR F C 8190 O O . THR E 198 ? 0.3941 0.2478 0.5417 -0.0621 0.0208 -0.0347 193 THR F O 8191 C CB . THR E 198 ? 0.3797 0.2420 0.6899 -0.0442 0.0077 -0.0468 193 THR F CB 8192 O OG1 . THR E 198 ? 0.3763 0.2544 0.7569 -0.0377 0.0102 -0.0596 193 THR F OG1 8193 C CG2 . THR E 198 ? 0.3840 0.2391 0.7216 -0.0386 0.0089 -0.0577 193 THR F CG2 8194 N N . CYS E 199 ? 0.3891 0.2522 0.5677 -0.0471 0.0507 -0.0627 194 CYS F N 8195 C CA . CYS E 199 ? 0.4016 0.2582 0.5375 -0.0506 0.0524 -0.0600 194 CYS F CA 8196 C C . CYS E 199 ? 0.4019 0.2499 0.5690 -0.0489 0.0450 -0.0626 194 CYS F C 8197 O O . CYS E 199 ? 0.3991 0.2544 0.6044 -0.0420 0.0579 -0.0837 194 CYS F O 8198 C CB . CYS E 199 ? 0.4143 0.2810 0.5210 -0.0495 0.0729 -0.0714 194 CYS F CB 8199 S SG . CYS E 199 ? 0.4565 0.3197 0.5267 -0.0519 0.0756 -0.0722 194 CYS F SG 8200 N N . GLU E 200 ? 0.4119 0.2470 0.5672 -0.0591 0.0237 -0.0429 195 GLU F N 8201 C CA . GLU E 200 ? 0.4245 0.2450 0.6166 -0.0609 0.0071 -0.0374 195 GLU F CA 8202 C C . GLU E 200 ? 0.4256 0.2434 0.5743 -0.0707 0.0097 -0.0330 195 GLU F C 8203 O O . GLU E 200 ? 0.4324 0.2528 0.5364 -0.0889 0.0005 -0.0149 195 GLU F O 8204 C CB . GLU E 200 ? 0.4518 0.2570 0.6745 -0.0740 -0.0318 -0.0063 195 GLU F CB 8205 C CG . GLU E 200 ? 0.4576 0.2606 0.7586 -0.0631 -0.0454 -0.0091 195 GLU F CG 8206 C CD . GLU E 200 ? 0.4943 0.2752 0.8491 -0.0765 -0.0954 0.0260 195 GLU F CD 8207 O OE1 . GLU E 200 ? 0.5177 0.2823 0.8633 -0.0920 -0.1174 0.0480 195 GLU F OE1 8208 O OE2 . GLU E 200 ? 0.5052 0.2850 0.9162 -0.0739 -0.1165 0.0347 195 GLU F OE2 8209 N N . ALA E 201 ? 0.4159 0.2323 0.5819 -0.0624 0.0222 -0.0523 196 ALA F N 8210 C CA . ALA E 201 ? 0.4135 0.2288 0.5470 -0.0700 0.0259 -0.0515 196 ALA F CA 8211 C C . ALA E 201 ? 0.4352 0.2296 0.6101 -0.0773 0.0010 -0.0391 196 ALA F C 8212 O O . ALA E 201 ? 0.4374 0.2223 0.6765 -0.0662 -0.0018 -0.0563 196 ALA F O 8213 C CB . ALA E 201 ? 0.3974 0.2255 0.5181 -0.0607 0.0527 -0.0791 196 ALA F CB 8214 N N . THR E 202 ? 0.4531 0.2428 0.5966 -0.0994 -0.0172 -0.0111 197 THR F N 8215 C CA . THR E 202 ? 0.4810 0.2491 0.6571 -0.1125 -0.0448 0.0074 197 THR F CA 8216 C C . THR E 202 ? 0.4738 0.2495 0.6153 -0.1182 -0.0290 -0.0023 197 THR F C 8217 O O . THR E 202 ? 0.4701 0.2674 0.5522 -0.1304 -0.0144 0.0000 197 THR F O 8218 C CB . THR E 202 ? 0.5224 0.2822 0.6837 -0.1455 -0.0829 0.0541 197 THR F CB 8219 O OG1 . THR E 202 ? 0.5353 0.2841 0.7420 -0.1411 -0.1062 0.0671 197 THR F OG1 8220 C CG2 . THR E 202 ? 0.5613 0.2967 0.7543 -0.1654 -0.1171 0.0814 197 THR F CG2 8221 N N . HIS E 203 ? 0.4737 0.2333 0.6619 -0.1104 -0.0330 -0.0163 198 HIS F N 8222 C CA . HIS E 203 ? 0.4659 0.2321 0.6298 -0.1134 -0.0181 -0.0301 198 HIS F CA 8223 C C . HIS E 203 ? 0.4889 0.2269 0.7113 -0.1199 -0.0441 -0.0241 198 HIS F C 8224 O O . HIS E 203 ? 0.5043 0.2199 0.8013 -0.1119 -0.0653 -0.0252 198 HIS F O 8225 C CB . HIS E 203 ? 0.4383 0.2215 0.5936 -0.0931 0.0151 -0.0699 198 HIS F CB 8226 C CG . HIS E 203 ? 0.4359 0.2296 0.5616 -0.0975 0.0285 -0.0826 198 HIS F CG 8227 N ND1 . HIS E 203 ? 0.4436 0.2313 0.5984 -0.0937 0.0338 -0.1099 198 HIS F ND1 8228 C CD2 . HIS E 203 ? 0.4274 0.2395 0.5043 -0.1064 0.0367 -0.0748 198 HIS F CD2 8229 C CE1 . HIS E 203 ? 0.4406 0.2406 0.5585 -0.1012 0.0419 -0.1128 198 HIS F CE1 8230 N NE2 . HIS E 203 ? 0.4297 0.2446 0.5056 -0.1075 0.0432 -0.0915 198 HIS F NE2 8231 N N . LYS E 204 ? 0.4958 0.2342 0.6963 -0.1343 -0.0449 -0.0189 199 LYS F N 8232 C CA . LYS E 204 ? 0.5284 0.2357 0.7874 -0.1454 -0.0765 -0.0062 199 LYS F CA 8233 C C . LYS E 204 ? 0.5244 0.2153 0.8647 -0.1218 -0.0716 -0.0506 199 LYS F C 8234 O O . LYS E 204 ? 0.5496 0.2090 0.9692 -0.1248 -0.1034 -0.0445 199 LYS F O 8235 C CB . LYS E 204 ? 0.5433 0.2578 0.7601 -0.1697 -0.0777 0.0092 199 LYS F CB 8236 C CG . LYS E 204 ? 0.5302 0.2530 0.7457 -0.1571 -0.0530 -0.0297 199 LYS F CG 8237 C CD . LYS E 204 ? 0.5412 0.2777 0.7142 -0.1817 -0.0528 -0.0131 199 LYS F CD 8238 C CE . LYS E 204 ? 0.5850 0.2912 0.7982 -0.2072 -0.0909 0.0181 199 LYS F CE 8239 N NZ . LYS E 204 ? 0.5941 0.2760 0.8688 -0.1943 -0.0954 -0.0129 199 LYS F NZ 8240 N N . THR E 205 ? 0.4967 0.2116 0.8202 -0.1028 -0.0333 -0.0957 200 THR F N 8241 C CA . THR E 205 ? 0.5021 0.2156 0.8940 -0.0871 -0.0192 -0.1489 200 THR F CA 8242 C C . THR E 205 ? 0.5113 0.2107 1.0002 -0.0728 -0.0341 -0.1610 200 THR F C 8243 O O . THR E 205 ? 0.5230 0.2268 1.0849 -0.0610 -0.0198 -0.2139 200 THR F O 8244 C CB . THR E 205 ? 0.4809 0.2313 0.8183 -0.0812 0.0244 -0.1891 200 THR F CB 8245 O OG1 . THR E 205 ? 0.4592 0.2279 0.7486 -0.0766 0.0357 -0.1728 200 THR F OG1 8246 C CG2 . THR E 205 ? 0.4791 0.2417 0.7511 -0.0937 0.0348 -0.1886 200 THR F CG2 8247 N N . SER E 206 ? 0.5105 0.1980 1.0039 -0.0762 -0.0615 -0.1168 201 SER F N 8248 C CA . SER E 206 ? 0.5233 0.1923 1.1245 -0.0648 -0.0882 -0.1186 201 SER F CA 8249 C C . SER E 206 ? 0.5383 0.1890 1.1309 -0.0805 -0.1320 -0.0533 201 SER F C 8250 O O . SER E 206 ? 0.5298 0.1969 1.0230 -0.0948 -0.1244 -0.0221 201 SER F O 8251 C CB . SER E 206 ? 0.4990 0.1997 1.1192 -0.0451 -0.0503 -0.1675 201 SER F CB 8252 O OG . SER E 206 ? 0.5099 0.1978 1.2411 -0.0333 -0.0759 -0.1697 201 SER F OG 8253 N N . THR E 207 ? 0.5686 0.1871 1.2723 -0.0800 -0.1796 -0.0352 202 THR F N 8254 C CA . THR E 207 ? 0.5918 0.1938 1.2949 -0.1001 -0.2283 0.0291 202 THR F CA 8255 C C . THR E 207 ? 0.5643 0.1894 1.2668 -0.0844 -0.2116 0.0169 202 THR F C 8256 O O . THR E 207 ? 0.5728 0.1989 1.2289 -0.1035 -0.2352 0.0640 202 THR F O 8257 C CB . THR E 207 ? 0.6401 0.1959 1.4772 -0.1073 -0.2963 0.0601 202 THR F CB 8258 O OG1 . THR E 207 ? 0.6313 0.1841 1.6107 -0.0725 -0.2902 0.0019 202 THR F OG1 8259 C CG2 . THR E 207 ? 0.6721 0.2020 1.5100 -0.1275 -0.3185 0.0793 202 THR F CG2 8260 N N . SER E 208 ? 0.5365 0.1830 1.2910 -0.0545 -0.1711 -0.0476 203 SER F N 8261 C CA . SER E 208 ? 0.5125 0.1855 1.2680 -0.0406 -0.1496 -0.0647 203 SER F CA 8262 C C . SER E 208 ? 0.4792 0.1864 1.0999 -0.0434 -0.1010 -0.0728 203 SER F C 8263 O O . SER E 208 ? 0.4646 0.1904 1.0401 -0.0391 -0.0608 -0.1089 203 SER F O 8264 C CB . SER E 208 ? 0.5036 0.1935 1.3770 -0.0139 -0.1241 -0.1346 203 SER F CB 8265 O OG . SER E 208 ? 0.5353 0.1945 1.5655 -0.0058 -0.1709 -0.1361 203 SER F OG 8266 N N . PRO E 209 ? 0.4732 0.1887 1.0352 -0.0525 -0.1073 -0.0398 204 PRO F N 8267 C CA . PRO E 209 ? 0.4447 0.1898 0.9000 -0.0525 -0.0642 -0.0519 204 PRO F CA 8268 C C . PRO E 209 ? 0.4229 0.1965 0.8982 -0.0338 -0.0203 -0.1059 204 PRO F C 8269 O O . PRO E 209 ? 0.4251 0.2035 0.9942 -0.0212 -0.0206 -0.1335 204 PRO F O 8270 C CB . PRO E 209 ? 0.4458 0.1936 0.8595 -0.0650 -0.0823 -0.0140 204 PRO F CB 8271 C CG . PRO E 209 ? 0.4709 0.1981 0.9835 -0.0650 -0.1272 0.0064 204 PRO F CG 8272 C CD . PRO E 209 ? 0.4955 0.1956 1.0875 -0.0644 -0.1538 0.0064 204 PRO F CD 8273 N N . ILE E 210 ? 0.4105 0.2057 0.8029 -0.0361 0.0151 -0.1209 205 ILE F N 8274 C CA . ILE E 210 ? 0.4042 0.2312 0.7911 -0.0302 0.0536 -0.1602 205 ILE F CA 8275 C C . ILE E 210 ? 0.3945 0.2329 0.7478 -0.0306 0.0562 -0.1420 205 ILE F C 8276 O O . ILE E 210 ? 0.3873 0.2225 0.6680 -0.0376 0.0520 -0.1134 205 ILE F O 8277 C CB . ILE E 210 ? 0.4043 0.2478 0.7220 -0.0382 0.0821 -0.1783 205 ILE F CB 8278 C CG1 . ILE E 210 ? 0.4235 0.2579 0.7799 -0.0389 0.0812 -0.2027 205 ILE F CG1 8279 C CG2 . ILE E 210 ? 0.4019 0.2814 0.7013 -0.0435 0.1170 -0.2097 205 ILE F CG2 8280 C CD1 . ILE E 210 ? 0.4286 0.2739 0.7137 -0.0502 0.0988 -0.2104 205 ILE F CD1 8281 N N . VAL E 211 ? 0.3969 0.2517 0.8117 -0.0238 0.0649 -0.1642 206 VAL F N 8282 C CA . VAL E 211 ? 0.3912 0.2546 0.7943 -0.0240 0.0624 -0.1479 206 VAL F CA 8283 C C . VAL E 211 ? 0.3892 0.2873 0.7584 -0.0301 0.1010 -0.1749 206 VAL F C 8284 O O . VAL E 211 ? 0.4006 0.3247 0.8013 -0.0336 0.1282 -0.2170 206 VAL F O 8285 C CB . VAL E 211 ? 0.3986 0.2566 0.9059 -0.0150 0.0380 -0.1481 206 VAL F CB 8286 C CG1 . VAL E 211 ? 0.3895 0.2548 0.8841 -0.0171 0.0310 -0.1277 206 VAL F CG1 8287 C CG2 . VAL E 211 ? 0.4191 0.2408 0.9651 -0.0163 -0.0079 -0.1157 206 VAL F CG2 8288 N N . LYS E 212 ? 0.3829 0.2833 0.6870 -0.0363 0.1025 -0.1514 207 LYS F N 8289 C CA . LYS E 212 ? 0.3824 0.3128 0.6614 -0.0473 0.1292 -0.1652 207 LYS F CA 8290 C C . LYS E 212 ? 0.3705 0.2968 0.6435 -0.0463 0.1164 -0.1407 207 LYS F C 8291 O O . LYS E 212 ? 0.3612 0.2645 0.6014 -0.0436 0.0950 -0.1118 207 LYS F O 8292 C CB . LYS E 212 ? 0.3921 0.3274 0.5927 -0.0609 0.1411 -0.1598 207 LYS F CB 8293 C CG . LYS E 212 ? 0.4130 0.3675 0.6133 -0.0715 0.1627 -0.1929 207 LYS F CG 8294 C CD . LYS E 212 ? 0.4317 0.4286 0.6692 -0.0858 0.1935 -0.2341 207 LYS F CD 8295 C CE . LYS E 212 ? 0.4639 0.4908 0.6721 -0.1097 0.2201 -0.2680 207 LYS F CE 8296 N NZ . LYS E 212 ? 0.4694 0.4822 0.7218 -0.0967 0.2174 -0.2935 207 LYS F NZ 8297 N N . SER E 213 ? 0.3759 0.3287 0.6842 -0.0513 0.1314 -0.1568 208 SER F N 8298 C CA . SER E 213 ? 0.3694 0.3194 0.6791 -0.0515 0.1189 -0.1358 208 SER F CA 8299 C C . SER E 213 ? 0.3762 0.3611 0.6843 -0.0680 0.1436 -0.1489 208 SER F C 8300 O O . SER E 213 ? 0.3890 0.4061 0.6922 -0.0840 0.1726 -0.1760 208 SER F O 8301 C CB . SER E 213 ? 0.3685 0.3068 0.7528 -0.0386 0.0930 -0.1302 208 SER F CB 8302 O OG . SER E 213 ? 0.3753 0.3404 0.8484 -0.0348 0.1073 -0.1653 208 SER F OG 8303 N N . PHE E 214 ? 0.3777 0.3578 0.6833 -0.0696 0.1313 -0.1284 209 PHE F N 8304 C CA . PHE E 214 ? 0.3911 0.4042 0.7079 -0.0869 0.1498 -0.1366 209 PHE F CA 8305 C C . PHE E 214 ? 0.3955 0.3989 0.7502 -0.0787 0.1282 -0.1206 209 PHE F C 8306 O O . PHE E 214 ? 0.3823 0.3523 0.7281 -0.0661 0.0989 -0.0983 209 PHE F O 8307 C CB . PHE E 214 ? 0.3995 0.4144 0.6401 -0.1095 0.1555 -0.1172 209 PHE F CB 8308 C CG . PHE E 214 ? 0.3862 0.3626 0.5897 -0.1020 0.1269 -0.0830 209 PHE F CG 8309 C CD1 . PHE E 214 ? 0.3790 0.3269 0.5483 -0.0911 0.1133 -0.0727 209 PHE F CD1 8310 C CD2 . PHE E 214 ? 0.3865 0.3590 0.5965 -0.1076 0.1156 -0.0666 209 PHE F CD2 8311 C CE1 . PHE E 214 ? 0.3747 0.2949 0.5228 -0.0855 0.0919 -0.0530 209 PHE F CE1 8312 C CE2 . PHE E 214 ? 0.3807 0.3208 0.5676 -0.1015 0.0917 -0.0452 209 PHE F CE2 8313 C CZ . PHE E 214 ? 0.3770 0.2931 0.5358 -0.0904 0.0814 -0.0416 209 PHE F CZ 8314 N N . ASN E 215 ? 0.4228 0.4603 0.8179 -0.0906 0.1437 -0.1340 210 ASN F N 8315 C CA . ASN E 215 ? 0.4376 0.4712 0.8657 -0.0881 0.1247 -0.1184 210 ASN F CA 8316 C C . ASN E 215 ? 0.4604 0.4963 0.8328 -0.1096 0.1284 -0.0980 210 ASN F C 8317 O O . ASN E 215 ? 0.4799 0.5476 0.8313 -0.1343 0.1545 -0.1069 210 ASN F O 8318 C CB . ASN E 215 ? 0.4538 0.5277 0.9828 -0.0872 0.1382 -0.1494 210 ASN F CB 8319 C CG . ASN E 215 ? 0.4714 0.5764 1.0505 -0.0854 0.1672 -0.1945 210 ASN F CG 8320 O OD1 . ASN E 215 ? 0.5014 0.6107 1.0235 -0.0957 0.1873 -0.2043 210 ASN F OD1 8321 N ND2 . ASN E 215 ? 0.4762 0.6052 1.1711 -0.0738 0.1683 -0.2255 210 ASN F ND2 8322 N N . ARG E 216 ? 0.4702 0.4731 0.8189 -0.1046 0.1006 -0.0708 211 ARG F N 8323 C CA . ARG E 216 ? 0.5001 0.4954 0.8110 -0.1220 0.0951 -0.0496 211 ARG F CA 8324 C C . ARG E 216 ? 0.5399 0.5732 0.8811 -0.1450 0.1110 -0.0533 211 ARG F C 8325 O O . ARG E 216 ? 0.5597 0.6015 0.8667 -0.1711 0.1169 -0.0386 211 ARG F O 8326 C CB . ARG E 216 ? 0.4908 0.4501 0.7938 -0.1115 0.0641 -0.0328 211 ARG F CB 8327 C CG . ARG E 216 ? 0.4976 0.4380 0.7699 -0.1241 0.0529 -0.0145 211 ARG F CG 8328 C CD . ARG E 216 ? 0.4888 0.4009 0.7621 -0.1163 0.0274 -0.0106 211 ARG F CD 8329 N NE . ARG E 216 ? 0.5024 0.4220 0.8067 -0.1275 0.0191 -0.0043 211 ARG F NE 8330 C CZ . ARG E 216 ? 0.4940 0.4272 0.8361 -0.1252 0.0125 -0.0083 211 ARG F CZ 8331 N NH1 . ARG E 216 ? 0.4877 0.4255 0.8458 -0.1128 0.0087 -0.0155 211 ARG F NH1 8332 N NH2 . ARG E 216 ? 0.5071 0.4477 0.8770 -0.1374 0.0048 -0.0018 211 ARG F NH2 8333 N N . ASN E 217 ? 0.5645 0.6208 0.9752 -0.1378 0.1141 -0.0704 212 ASN F N 8334 C CA . ASN E 217 ? 0.6079 0.7091 1.0645 -0.1586 0.1324 -0.0813 212 ASN F CA 8335 C C . ASN E 217 ? 0.6513 0.8060 1.0964 -0.1909 0.1739 -0.1029 212 ASN F C 8336 O O . ASN E 217 ? 0.6568 0.8575 1.1357 -0.2156 0.1940 -0.1146 212 ASN F O 8337 C CB . ASN E 217 ? 0.6072 0.7256 1.1604 -0.1401 0.1262 -0.1017 212 ASN F CB 8338 C CG . ASN E 217 ? 0.6097 0.7295 1.2045 -0.1184 0.1306 -0.1272 212 ASN F CG 8339 O OD1 . ASN E 217 ? 0.6098 0.6872 1.1732 -0.1003 0.1067 -0.1117 212 ASN F OD1 8340 N ND2 . ASN E 217 ? 0.6033 0.7739 1.2725 -0.1229 0.1621 -0.1696 212 ASN F ND2 8341 N N . GLU E 218 ? 0.6725 0.8263 1.0688 -0.1957 0.1874 -0.1099 213 GLU F N 8342 C CA . GLU E 218 ? 0.7206 0.9292 1.0921 -0.2346 0.2267 -0.1320 213 GLU F CA 8343 C C . GLU E 218 ? 0.7763 0.9682 1.0514 -0.2647 0.2173 -0.0953 213 GLU F C 8344 O O . GLU E 218 ? 0.8261 1.0611 1.0610 -0.3051 0.2442 -0.1060 213 GLU F O 8345 C CB . GLU E 218 ? 0.7032 0.9368 1.1132 -0.2214 0.2530 -0.1804 213 GLU F CB 8346 C CG . GLU E 218 ? 0.6660 0.8908 1.1784 -0.1813 0.2415 -0.2033 213 GLU F CG 8347 C CD . GLU E 218 ? 0.6749 0.9360 1.2568 -0.1737 0.2708 -0.2602 213 GLU F CD 8348 O OE1 . GLU E 218 ? 0.6606 0.9066 1.2040 -0.1691 0.2746 -0.2675 213 GLU F OE1 8349 O OE2 . GLU E 218 ? 0.6806 0.9869 1.3655 -0.1726 0.2897 -0.3010 213 GLU F OE2 8350 N N . CYS E 219 ? 0.7957 0.9283 1.0401 -0.2482 0.1777 -0.0541 214 CYS F N 8351 C CA . CYS E 219 ? 0.8313 0.9377 1.0062 -0.2704 0.1566 -0.0147 214 CYS F CA 8352 C C . CYS E 219 ? 0.8508 0.9460 1.0171 -0.2973 0.1331 0.0251 214 CYS F C 8353 O O . CYS E 219 ? 0.8445 0.9662 1.0458 -0.3096 0.1429 0.0197 214 CYS F O 8354 C CB . CYS E 219 ? 0.8089 0.8583 0.9704 -0.2323 0.1288 -0.0041 214 CYS F CB 8355 S SG . CYS E 219 ? 0.7774 0.8337 0.9322 -0.2115 0.1490 -0.0379 214 CYS F SG 8356 N N . ASP F 1 ? 0.4506 0.4941 0.6249 -0.1226 0.0243 0.2551 1 ASP L N 8357 C CA . ASP F 1 ? 0.4155 0.4561 0.5676 -0.1008 0.0349 0.2092 1 ASP L CA 8358 C C . ASP F 1 ? 0.4024 0.3818 0.5643 -0.0944 0.0200 0.1796 1 ASP L C 8359 O O . ASP F 1 ? 0.4199 0.3625 0.6114 -0.1070 0.0011 0.1870 1 ASP L O 8360 C CB . ASP F 1 ? 0.4058 0.4906 0.5633 -0.1040 0.0472 0.2029 1 ASP L CB 8361 C CG . ASP F 1 ? 0.4097 0.5683 0.5536 -0.1029 0.0651 0.2217 1 ASP L CG 8362 O OD1 . ASP F 1 ? 0.4210 0.6012 0.5517 -0.1040 0.0678 0.2460 1 ASP L OD1 8363 O OD2 . ASP F 1 ? 0.4069 0.6053 0.5518 -0.0979 0.0760 0.2089 1 ASP L OD2 8364 N N . ILE F 2 ? 0.3737 0.3452 0.5122 -0.0746 0.0274 0.1453 2 ILE L N 8365 C CA . ILE F 2 ? 0.3669 0.2950 0.5113 -0.0671 0.0165 0.1164 2 ILE L CA 8366 C C . ILE F 2 ? 0.3467 0.2831 0.5006 -0.0714 0.0173 0.1022 2 ILE L C 8367 O O . ILE F 2 ? 0.3249 0.2896 0.4632 -0.0645 0.0306 0.0931 2 ILE L O 8368 C CB . ILE F 2 ? 0.3573 0.2722 0.4775 -0.0474 0.0208 0.0933 2 ILE L CB 8369 C CG1 . ILE F 2 ? 0.3362 0.2580 0.4403 -0.0369 0.0305 0.0664 2 ILE L CG1 8370 C CG2 . ILE F 2 ? 0.3548 0.2920 0.4560 -0.0419 0.0290 0.1069 2 ILE L CG2 8371 C CD1 . ILE F 2 ? 0.3427 0.2395 0.4564 -0.0345 0.0206 0.0449 2 ILE L CD1 8372 N N . LEU F 3 ? 0.3621 0.2737 0.5447 -0.0831 0.0000 0.1017 3 LEU L N 8373 C CA . LEU F 3 ? 0.3535 0.2725 0.5491 -0.0885 -0.0041 0.0885 3 LEU L CA 8374 C C . LEU F 3 ? 0.3318 0.2339 0.5082 -0.0699 -0.0048 0.0520 3 LEU L C 8375 O O . LEU F 3 ? 0.3396 0.2119 0.5129 -0.0600 -0.0135 0.0358 3 LEU L O 8376 C CB . LEU F 3 ? 0.3877 0.2871 0.6254 -0.1100 -0.0260 0.1020 3 LEU L CB 8377 C CG . LEU F 3 ? 0.4094 0.3464 0.6707 -0.1346 -0.0218 0.1440 3 LEU L CG 8378 C CD1 . LEU F 3 ? 0.3847 0.3839 0.6233 -0.1300 0.0043 0.1566 3 LEU L CD1 8379 C CD2 . LEU F 3 ? 0.4418 0.3548 0.7216 -0.1483 -0.0344 0.1765 3 LEU L CD2 8380 N N . MET F 4 ? 0.3045 0.2309 0.4677 -0.0643 0.0045 0.0410 4 MET L N 8381 C CA . MET F 4 ? 0.2969 0.2162 0.4414 -0.0496 0.0042 0.0133 4 MET L CA 8382 C C . MET F 4 ? 0.2999 0.2215 0.4619 -0.0556 -0.0094 0.0016 4 MET L C 8383 O O . MET F 4 ? 0.2962 0.2438 0.4679 -0.0631 -0.0069 0.0107 4 MET L O 8384 C CB . MET F 4 ? 0.2823 0.2243 0.4004 -0.0387 0.0212 0.0124 4 MET L CB 8385 C CG . MET F 4 ? 0.2806 0.2248 0.3840 -0.0337 0.0329 0.0222 4 MET L CG 8386 S SD . MET F 4 ? 0.3036 0.2209 0.3952 -0.0238 0.0304 0.0082 4 MET L SD 8387 C CE . MET F 4 ? 0.2972 0.2235 0.3649 -0.0127 0.0386 -0.0063 4 MET L CE 8388 N N . ASN F 5 ? 0.3157 0.2135 0.4835 -0.0510 -0.0255 -0.0209 5 ASN L N 8389 C CA . ASN F 5 ? 0.3313 0.2303 0.5148 -0.0545 -0.0427 -0.0386 5 ASN L CA 8390 C C . ASN F 5 ? 0.3152 0.2293 0.4691 -0.0373 -0.0395 -0.0629 5 ASN L C 8391 O O . ASN F 5 ? 0.3178 0.2234 0.4554 -0.0232 -0.0409 -0.0826 5 ASN L O 8392 C CB . ASN F 5 ? 0.3720 0.2347 0.5848 -0.0591 -0.0679 -0.0521 5 ASN L CB 8393 C CG . ASN F 5 ? 0.3942 0.2365 0.6340 -0.0754 -0.0724 -0.0228 5 ASN L CG 8394 O OD1 . ASN F 5 ? 0.4247 0.2753 0.6934 -0.0969 -0.0778 0.0004 5 ASN L OD1 8395 N ND2 . ASN F 5 ? 0.4084 0.2290 0.6401 -0.0662 -0.0704 -0.0209 5 ASN L ND2 8396 N N . GLN F 6 ? 0.2998 0.2408 0.4489 -0.0383 -0.0365 -0.0602 6 GLN L N 8397 C CA . GLN F 6 ? 0.2971 0.2562 0.4171 -0.0237 -0.0339 -0.0752 6 GLN L CA 8398 C C . GLN F 6 ? 0.3183 0.2817 0.4507 -0.0237 -0.0560 -0.0996 6 GLN L C 8399 O O . GLN F 6 ? 0.3266 0.2886 0.4924 -0.0384 -0.0699 -0.0969 6 GLN L O 8400 C CB . GLN F 6 ? 0.2816 0.2649 0.3908 -0.0225 -0.0210 -0.0573 6 GLN L CB 8401 C CG . GLN F 6 ? 0.2764 0.2649 0.3511 -0.0091 -0.0079 -0.0547 6 GLN L CG 8402 C CD . GLN F 6 ? 0.2635 0.2654 0.3334 -0.0064 0.0014 -0.0376 6 GLN L CD 8403 O OE1 . GLN F 6 ? 0.2596 0.2595 0.3388 -0.0101 0.0103 -0.0249 6 GLN L OE1 8404 N NE2 . GLN F 6 ? 0.2693 0.2863 0.3244 0.0019 -0.0019 -0.0378 6 GLN L NE2 8405 N N . THR F 7 ? 0.3280 0.3006 0.4355 -0.0080 -0.0604 -0.1236 7 THR L N 8406 C CA . THR F 7 ? 0.3525 0.3375 0.4648 -0.0039 -0.0819 -0.1508 7 THR L CA 8407 C C . THR F 7 ? 0.3537 0.3716 0.4238 0.0135 -0.0752 -0.1598 7 THR L C 8408 O O . THR F 7 ? 0.3424 0.3655 0.3861 0.0221 -0.0582 -0.1525 7 THR L O 8409 C CB . THR F 7 ? 0.3876 0.3463 0.5212 -0.0011 -0.1041 -0.1819 7 THR L CB 8410 O OG1 . THR F 7 ? 0.3885 0.3408 0.5017 0.0137 -0.0939 -0.1911 7 THR L OG1 8411 C CG2 . THR F 7 ? 0.3945 0.3190 0.5756 -0.0226 -0.1164 -0.1680 7 THR L CG2 8412 N N . PRO F 8 ? 0.3684 0.4124 0.4331 0.0175 -0.0893 -0.1729 8 PRO L N 8413 C CA . PRO F 8 ? 0.3766 0.4207 0.4763 0.0048 -0.1093 -0.1781 8 PRO L CA 8414 C C . PRO F 8 ? 0.3514 0.4035 0.4653 -0.0074 -0.0975 -0.1441 8 PRO L C 8415 O O . PRO F 8 ? 0.3294 0.3831 0.4235 -0.0035 -0.0762 -0.1204 8 PRO L O 8416 C CB . PRO F 8 ? 0.4012 0.4798 0.4797 0.0184 -0.1255 -0.2036 8 PRO L CB 8417 C CG . PRO F 8 ? 0.3944 0.4983 0.4247 0.0333 -0.1057 -0.1897 8 PRO L CG 8418 C CD . PRO F 8 ? 0.3797 0.4613 0.4028 0.0343 -0.0868 -0.1812 8 PRO L CD 8419 N N . LEU F 9 ? 0.3579 0.4171 0.5089 -0.0215 -0.1128 -0.1441 9 LEU L N 8420 C CA . LEU F 9 ? 0.3412 0.4200 0.5104 -0.0307 -0.1037 -0.1172 9 LEU L CA 8421 C C . LEU F 9 ? 0.3386 0.4514 0.4832 -0.0159 -0.1032 -0.1144 9 LEU L C 8422 O O . LEU F 9 ? 0.3219 0.4475 0.4624 -0.0118 -0.0893 -0.0923 9 LEU L O 8423 C CB . LEU F 9 ? 0.3556 0.4392 0.5776 -0.0527 -0.1219 -0.1179 9 LEU L CB 8424 C CG . LEU F 9 ? 0.3424 0.4473 0.5971 -0.0685 -0.1112 -0.0885 9 LEU L CG 8425 C CD1 . LEU F 9 ? 0.3189 0.4127 0.5566 -0.0653 -0.0848 -0.0651 9 LEU L CD1 8426 C CD2 . LEU F 9 ? 0.3635 0.4651 0.6740 -0.0963 -0.1293 -0.0851 9 LEU L CD2 8427 N N . SER F 10 ? 0.3601 0.4885 0.4904 -0.0068 -0.1213 -0.1382 10 SER L N 8428 C CA . SER F 10 ? 0.3646 0.5230 0.4625 0.0097 -0.1224 -0.1343 10 SER L CA 8429 C C . SER F 10 ? 0.3891 0.5567 0.4471 0.0247 -0.1293 -0.1562 10 SER L C 8430 O O . SER F 10 ? 0.4072 0.5695 0.4726 0.0242 -0.1449 -0.1873 10 SER L O 8431 C CB . SER F 10 ? 0.3722 0.5632 0.4957 0.0068 -0.1412 -0.1381 10 SER L CB 8432 O OG . SER F 10 ? 0.3949 0.5863 0.5475 -0.0039 -0.1651 -0.1664 10 SER L OG 8433 N N . LEU F 11 ? 0.3915 0.5753 0.4087 0.0386 -0.1188 -0.1395 11 LEU L N 8434 C CA . LEU F 11 ? 0.4197 0.6246 0.3941 0.0530 -0.1201 -0.1527 11 LEU L CA 8435 C C . LEU F 11 ? 0.4359 0.6801 0.3824 0.0651 -0.1294 -0.1417 11 LEU L C 8436 O O . LEU F 11 ? 0.4305 0.6759 0.3590 0.0689 -0.1183 -0.1085 11 LEU L O 8437 C CB . LEU F 11 ? 0.4099 0.5988 0.3608 0.0548 -0.0960 -0.1361 11 LEU L CB 8438 C CG . LEU F 11 ? 0.4406 0.6616 0.3478 0.0686 -0.0924 -0.1455 11 LEU L CG 8439 C CD1 . LEU F 11 ? 0.4706 0.7087 0.3775 0.0775 -0.1103 -0.1924 11 LEU L CD1 8440 C CD2 . LEU F 11 ? 0.4300 0.6346 0.3265 0.0659 -0.0688 -0.1278 11 LEU L CD2 8441 N N . PRO F 12 ? 0.4603 0.7348 0.4061 0.0711 -0.1532 -0.1699 12 PRO L N 8442 C CA . PRO F 12 ? 0.4872 0.8062 0.3993 0.0854 -0.1647 -0.1623 12 PRO L CA 8443 C C . PRO F 12 ? 0.5109 0.8597 0.3680 0.0988 -0.1548 -0.1560 12 PRO L C 8444 O O . PRO F 12 ? 0.5285 0.8928 0.3713 0.1056 -0.1577 -0.1890 12 PRO L O 8445 C CB . PRO F 12 ? 0.5117 0.8553 0.4406 0.0876 -0.1948 -0.2034 12 PRO L CB 8446 C CG . PRO F 12 ? 0.4924 0.7981 0.4764 0.0693 -0.1997 -0.2208 12 PRO L CG 8447 C CD . PRO F 12 ? 0.4678 0.7340 0.4516 0.0629 -0.1743 -0.2076 12 PRO L CD 8448 N N . VAL F 13 ? 0.5163 0.8769 0.3453 0.1032 -0.1453 -0.1145 13 VAL L N 8449 C CA . VAL F 13 ? 0.5455 0.9437 0.3228 0.1125 -0.1354 -0.0981 13 VAL L CA 8450 C C . VAL F 13 ? 0.5793 1.0170 0.3253 0.1225 -0.1477 -0.0695 13 VAL L C 8451 O O . VAL F 13 ? 0.5787 1.0024 0.3445 0.1222 -0.1591 -0.0519 13 VAL L O 8452 C CB . VAL F 13 ? 0.5267 0.8968 0.2989 0.1033 -0.1085 -0.0645 13 VAL L CB 8453 C CG1 . VAL F 13 ? 0.5038 0.8493 0.2949 0.0976 -0.0966 -0.0935 13 VAL L CG1 8454 C CG2 . VAL F 13 ? 0.5054 0.8306 0.3035 0.0947 -0.1042 -0.0280 13 VAL L CG2 8455 N N . SER F 14 ? 0.6157 1.1084 0.3127 0.1328 -0.1464 -0.0653 14 SER L N 8456 C CA . SER F 14 ? 0.6520 1.1838 0.3119 0.1404 -0.1540 -0.0246 14 SER L CA 8457 C C . SER F 14 ? 0.6510 1.1635 0.2996 0.1296 -0.1323 0.0295 14 SER L C 8458 O O . SER F 14 ? 0.6309 1.1274 0.2844 0.1208 -0.1113 0.0265 14 SER L O 8459 C CB . SER F 14 ? 0.6978 1.3097 0.3071 0.1566 -0.1631 -0.0446 14 SER L CB 8460 O OG . SER F 14 ? 0.7023 1.3305 0.3245 0.1665 -0.1861 -0.1017 14 SER L OG 8461 N N . LEU F 15 ? 0.6789 1.1923 0.3148 0.1302 -0.1399 0.0792 15 LEU L N 8462 C CA . LEU F 15 ? 0.6913 1.1880 0.3172 0.1181 -0.1243 0.1348 15 LEU L CA 8463 C C . LEU F 15 ? 0.7209 1.2816 0.3027 0.1170 -0.1079 0.1412 15 LEU L C 8464 O O . LEU F 15 ? 0.7526 1.3825 0.2972 0.1307 -0.1160 0.1218 15 LEU L O 8465 C CB . LEU F 15 ? 0.7272 1.2163 0.3467 0.1211 -0.1419 0.1873 15 LEU L CB 8466 C CG . LEU F 15 ? 0.7067 1.1419 0.3706 0.1267 -0.1592 0.1820 15 LEU L CG 8467 C CD1 . LEU F 15 ? 0.7513 1.1811 0.4077 0.1335 -0.1795 0.2338 15 LEU L CD1 8468 C CD2 . LEU F 15 ? 0.6600 1.0267 0.3682 0.1153 -0.1441 0.1746 15 LEU L CD2 8469 N N . GLY F 16 ? 0.7117 1.2547 0.2990 0.1015 -0.0853 0.1652 16 GLY L N 8470 C CA . GLY F 16 ? 0.7345 1.3425 0.2873 0.0992 -0.0658 0.1701 16 GLY L CA 8471 C C . GLY F 16 ? 0.7047 1.3153 0.2707 0.1031 -0.0515 0.1131 16 GLY L C 8472 O O . GLY F 16 ? 0.7077 1.3530 0.2616 0.0979 -0.0308 0.1186 16 GLY L O 8473 N N . ASP F 17 ? 0.6824 1.2573 0.2765 0.1115 -0.0636 0.0607 17 ASP L N 8474 C CA . ASP F 17 ? 0.6655 1.2386 0.2744 0.1173 -0.0562 0.0045 17 ASP L CA 8475 C C . ASP F 17 ? 0.6334 1.1567 0.2728 0.1017 -0.0352 0.0153 17 ASP L C 8476 O O . ASP F 17 ? 0.6088 1.0766 0.2719 0.0870 -0.0319 0.0510 17 ASP L O 8477 C CB . ASP F 17 ? 0.6482 1.1846 0.2890 0.1245 -0.0770 -0.0456 17 ASP L CB 8478 C CG . ASP F 17 ? 0.6867 1.2786 0.3020 0.1433 -0.1006 -0.0799 17 ASP L CG 8479 O OD1 . ASP F 17 ? 0.7315 1.3973 0.2989 0.1545 -0.1004 -0.0704 17 ASP L OD1 8480 O OD2 . ASP F 17 ? 0.6748 1.2389 0.3200 0.1460 -0.1206 -0.1167 17 ASP L OD2 8481 N N . GLN F 18 ? 0.6371 1.1816 0.2767 0.1077 -0.0235 -0.0198 18 GLN L N 8482 C CA . GLN F 18 ? 0.6082 1.1041 0.2809 0.0963 -0.0079 -0.0221 18 GLN L CA 8483 C C . GLN F 18 ? 0.5801 1.0107 0.2931 0.0966 -0.0214 -0.0577 18 GLN L C 8484 O O . GLN F 18 ? 0.5985 1.0381 0.3126 0.1086 -0.0400 -0.0961 18 GLN L O 8485 C CB . GLN F 18 ? 0.6247 1.1711 0.2853 0.1052 0.0075 -0.0472 18 GLN L CB 8486 C CG . GLN F 18 ? 0.6021 1.1155 0.2892 0.0913 0.0268 -0.0332 18 GLN L CG 8487 C CD . GLN F 18 ? 0.6072 1.1485 0.2993 0.1059 0.0342 -0.0792 18 GLN L CD 8488 O OE1 . GLN F 18 ? 0.5900 1.0831 0.3149 0.1019 0.0379 -0.0937 18 GLN L OE1 8489 N NE2 . GLN F 18 ? 0.6468 1.2697 0.3061 0.1254 0.0348 -0.1041 18 GLN L NE2 8490 N N . ALA F 19 ? 0.5444 0.9134 0.2913 0.0827 -0.0133 -0.0445 19 ALA L N 8491 C CA . ALA F 19 ? 0.5167 0.8299 0.3022 0.0799 -0.0236 -0.0701 19 ALA L CA 8492 C C . ALA F 19 ? 0.4863 0.7654 0.2962 0.0734 -0.0100 -0.0783 19 ALA L C 8493 O O . ALA F 19 ? 0.4726 0.7497 0.2795 0.0651 0.0067 -0.0510 19 ALA L O 8494 C CB . ALA F 19 ? 0.5039 0.7788 0.3069 0.0712 -0.0307 -0.0421 19 ALA L CB 8495 N N . SER F 20 ? 0.4757 0.7277 0.3123 0.0762 -0.0197 -0.1145 20 SER L N 8496 C CA . SER F 20 ? 0.4532 0.6736 0.3129 0.0722 -0.0104 -0.1240 20 SER L CA 8497 C C . SER F 20 ? 0.4284 0.5946 0.3270 0.0630 -0.0204 -0.1314 20 SER L C 8498 O O . SER F 20 ? 0.4369 0.5971 0.3506 0.0654 -0.0392 -0.1566 20 SER L O 8499 C CB . SER F 20 ? 0.4807 0.7331 0.3325 0.0885 -0.0125 -0.1633 20 SER L CB 8500 O OG . SER F 20 ? 0.4749 0.7191 0.3359 0.0867 0.0029 -0.1596 20 SER L OG 8501 N N . ILE F 21 ? 0.3973 0.5284 0.3127 0.0513 -0.0085 -0.1079 21 ILE L N 8502 C CA . ILE F 21 ? 0.3768 0.4663 0.3263 0.0413 -0.0142 -0.1075 21 ILE L CA 8503 C C . ILE F 21 ? 0.3621 0.4258 0.3283 0.0384 -0.0069 -0.1124 21 ILE L C 8504 O O . ILE F 21 ? 0.3481 0.4124 0.3052 0.0372 0.0082 -0.0971 21 ILE L O 8505 C CB . ILE F 21 ? 0.3623 0.4371 0.3167 0.0328 -0.0077 -0.0756 21 ILE L CB 8506 C CG1 . ILE F 21 ? 0.3796 0.4773 0.3215 0.0371 -0.0177 -0.0687 21 ILE L CG1 8507 C CG2 . ILE F 21 ? 0.3491 0.3933 0.3368 0.0230 -0.0095 -0.0739 21 ILE L CG2 8508 C CD1 . ILE F 21 ? 0.3704 0.4558 0.3166 0.0340 -0.0141 -0.0398 21 ILE L CD1 8509 N N . SER F 22 ? 0.3659 0.4058 0.3594 0.0360 -0.0199 -0.1316 22 SER L N 8510 C CA . SER F 22 ? 0.3654 0.3806 0.3754 0.0358 -0.0177 -0.1381 22 SER L CA 8511 C C . SER F 22 ? 0.3475 0.3307 0.3821 0.0208 -0.0144 -0.1155 22 SER L C 8512 O O . SER F 22 ? 0.3448 0.3235 0.3942 0.0113 -0.0204 -0.1064 22 SER L O 8513 C CB . SER F 22 ? 0.3942 0.4028 0.4194 0.0454 -0.0381 -0.1756 22 SER L CB 8514 O OG . SER F 22 ? 0.3992 0.3693 0.4543 0.0405 -0.0447 -0.1770 22 SER L OG 8515 N N . CYS F 23 ? 0.3440 0.3118 0.3827 0.0198 -0.0048 -0.1068 23 CYS L N 8516 C CA . CYS F 23 ? 0.3418 0.2861 0.4002 0.0079 -0.0019 -0.0869 23 CYS L CA 8517 C C . CYS F 23 ? 0.3382 0.2599 0.4120 0.0101 -0.0066 -0.0934 23 CYS L C 8518 O O . CYS F 23 ? 0.3365 0.2639 0.3992 0.0197 0.0004 -0.0998 23 CYS L O 8519 C CB . CYS F 23 ? 0.3411 0.2927 0.3847 0.0052 0.0153 -0.0635 23 CYS L CB 8520 S SG . CYS F 23 ? 0.3820 0.3177 0.4423 -0.0048 0.0212 -0.0420 23 CYS L SG 8521 N N . ARG F 24 ? 0.3421 0.2397 0.4441 0.0005 -0.0199 -0.0897 24 ARG L N 8522 C CA . ARG F 24 ? 0.3533 0.2239 0.4738 0.0021 -0.0289 -0.0918 24 ARG L CA 8523 C C . ARG F 24 ? 0.3325 0.1906 0.4664 -0.0122 -0.0242 -0.0598 24 ARG L C 8524 O O . ARG F 24 ? 0.3370 0.1952 0.4877 -0.0276 -0.0281 -0.0428 24 ARG L O 8525 C CB . ARG F 24 ? 0.3963 0.2436 0.5438 0.0035 -0.0555 -0.1149 24 ARG L CB 8526 C CG . ARG F 24 ? 0.4273 0.2844 0.5643 0.0253 -0.0640 -0.1544 24 ARG L CG 8527 C CD . ARG F 24 ? 0.4812 0.3022 0.6479 0.0345 -0.0887 -0.1758 24 ARG L CD 8528 N NE . ARG F 24 ? 0.5308 0.3278 0.7264 0.0323 -0.1186 -0.1991 24 ARG L NE 8529 C CZ . ARG F 24 ? 0.5825 0.3389 0.8112 0.0393 -0.1466 -0.2185 24 ARG L CZ 8530 N NH1 . ARG F 24 ? 0.5942 0.3319 0.8298 0.0498 -0.1472 -0.2152 24 ARG L NH1 8531 N NH2 . ARG F 24 ? 0.6240 0.3563 0.8821 0.0363 -0.1771 -0.2423 24 ARG L NH2 8532 N N . SER F 25 ? 0.3156 0.1684 0.4435 -0.0070 -0.0169 -0.0518 25 SER L N 8533 C CA . SER F 25 ? 0.3060 0.1526 0.4425 -0.0180 -0.0134 -0.0226 25 SER L CA 8534 C C . SER F 25 ? 0.3295 0.1431 0.4945 -0.0216 -0.0335 -0.0168 25 SER L C 8535 O O . SER F 25 ? 0.3508 0.1446 0.5245 -0.0085 -0.0472 -0.0395 25 SER L O 8536 C CB . SER F 25 ? 0.2881 0.1490 0.4022 -0.0104 0.0033 -0.0164 25 SER L CB 8537 O OG . SER F 25 ? 0.2959 0.1514 0.4068 0.0041 0.0005 -0.0352 25 SER L OG 8538 N N . SER F 26 ? 0.3309 0.1411 0.5114 -0.0383 -0.0360 0.0148 26 SER L N 8539 C CA . SER F 26 ? 0.3628 0.1385 0.5741 -0.0459 -0.0577 0.0298 26 SER L CA 8540 C C . SER F 26 ? 0.3671 0.1310 0.5713 -0.0321 -0.0586 0.0320 26 SER L C 8541 O O . SER F 26 ? 0.3980 0.1278 0.6267 -0.0319 -0.0797 0.0393 26 SER L O 8542 C CB . SER F 26 ? 0.3721 0.1589 0.6005 -0.0709 -0.0574 0.0712 26 SER L CB 8543 O OG . SER F 26 ? 0.3482 0.1735 0.5509 -0.0719 -0.0343 0.0930 26 SER L OG 8544 N N . GLN F 27 ? 0.3382 0.1298 0.5117 -0.0210 -0.0379 0.0262 27 GLN L N 8545 C CA . GLN F 27 ? 0.3381 0.1295 0.5026 -0.0083 -0.0360 0.0274 27 GLN L CA 8546 C C . GLN F 27 ? 0.3041 0.1207 0.4434 0.0063 -0.0191 0.0039 27 GLN L C 8547 O O . GLN F 27 ? 0.2755 0.1142 0.3973 0.0032 -0.0041 -0.0014 27 GLN L O 8548 C CB . GLN F 27 ? 0.3402 0.1508 0.4950 -0.0199 -0.0264 0.0627 27 GLN L CB 8549 C CG . GLN F 27 ? 0.3676 0.1690 0.5268 -0.0166 -0.0356 0.0832 27 GLN L CG 8550 C CD . GLN F 27 ? 0.3687 0.2031 0.5127 -0.0288 -0.0234 0.1170 27 GLN L CD 8551 O OE1 . GLN F 27 ? 0.3830 0.2275 0.5363 -0.0464 -0.0226 0.1405 27 GLN L OE1 8552 N NE2 . GLN F 27 ? 0.3572 0.2152 0.4782 -0.0190 -0.0134 0.1169 27 GLN L NE2 8553 N N . TYR F 28 A 0.3021 0.1168 0.4422 0.0210 -0.0226 -0.0061 27 TYR L N 8554 C CA . TYR F 28 A 0.2793 0.1209 0.4027 0.0326 -0.0087 -0.0256 27 TYR L CA 8555 C C . TYR F 28 A 0.2504 0.1170 0.3513 0.0237 0.0099 -0.0120 27 TYR L C 8556 O O . TYR F 28 A 0.2470 0.1169 0.3433 0.0185 0.0112 0.0080 27 TYR L O 8557 C CB . TYR F 28 A 0.2910 0.1316 0.4248 0.0487 -0.0171 -0.0343 27 TYR L CB 8558 C CG . TYR F 28 A 0.2784 0.1496 0.4062 0.0620 -0.0073 -0.0601 27 TYR L CG 8559 C CD1 . TYR F 28 A 0.2528 0.1546 0.3638 0.0565 0.0103 -0.0554 27 TYR L CD1 8560 C CD2 . TYR F 28 A 0.2941 0.1675 0.4354 0.0798 -0.0167 -0.0892 27 TYR L CD2 8561 C CE1 . TYR F 28 A 0.2420 0.1768 0.3513 0.0641 0.0196 -0.0727 27 TYR L CE1 8562 C CE2 . TYR F 28 A 0.2845 0.1987 0.4205 0.0912 -0.0054 -0.1099 27 TYR L CE2 8563 C CZ . TYR F 28 A 0.2581 0.2039 0.3789 0.0812 0.0134 -0.0983 27 TYR L CZ 8564 O OH . TYR F 28 A 0.2482 0.2395 0.3670 0.0879 0.0251 -0.1131 27 TYR L OH 8565 N N . ILE F 29 B 0.2338 0.1185 0.3210 0.0230 0.0223 -0.0236 27 ILE L N 8566 C CA . ILE F 29 B 0.2166 0.1190 0.2868 0.0170 0.0358 -0.0157 27 ILE L CA 8567 C C . ILE F 29 B 0.2089 0.1261 0.2772 0.0227 0.0395 -0.0207 27 ILE L C 8568 O O . ILE F 29 B 0.2057 0.1382 0.2742 0.0263 0.0443 -0.0331 27 ILE L O 8569 C CB . ILE F 29 B 0.2085 0.1198 0.2683 0.0132 0.0439 -0.0217 27 ILE L CB 8570 C CG1 . ILE F 29 B 0.2143 0.1153 0.2793 0.0075 0.0385 -0.0181 27 ILE L CG1 8571 C CG2 . ILE F 29 B 0.1969 0.1185 0.2442 0.0085 0.0531 -0.0145 27 ILE L CG2 8572 C CD1 . ILE F 29 B 0.2157 0.1147 0.2845 -0.0008 0.0377 0.0014 27 ILE L CD1 8573 N N . VAL F 30 C 0.2097 0.1278 0.2770 0.0227 0.0368 -0.0096 27 VAL L N 8574 C CA . VAL F 30 C 0.2036 0.1360 0.2729 0.0278 0.0365 -0.0142 27 VAL L CA 8575 C C . VAL F 30 C 0.1944 0.1401 0.2535 0.0213 0.0444 -0.0153 27 VAL L C 8576 O O . VAL F 30 C 0.1871 0.1290 0.2359 0.0160 0.0484 -0.0106 27 VAL L O 8577 C CB . VAL F 30 C 0.2166 0.1455 0.2894 0.0326 0.0261 -0.0023 27 VAL L CB 8578 C CG1 . VAL F 30 C 0.2352 0.1421 0.3233 0.0381 0.0135 0.0015 27 VAL L CG1 8579 C CG2 . VAL F 30 C 0.2182 0.1530 0.2756 0.0265 0.0284 0.0134 27 VAL L CG2 8580 N N . HIS F 31 D 0.1935 0.1551 0.2593 0.0223 0.0444 -0.0223 27 HIS L N 8581 C CA . HIS F 31 D 0.1933 0.1620 0.2561 0.0145 0.0472 -0.0242 27 HIS L CA 8582 C C . HIS F 31 D 0.2042 0.1722 0.2572 0.0166 0.0416 -0.0220 27 HIS L C 8583 O O . HIS F 31 D 0.2125 0.1835 0.2619 0.0231 0.0361 -0.0161 27 HIS L O 8584 C CB . HIS F 31 D 0.1898 0.1800 0.2687 0.0119 0.0470 -0.0307 27 HIS L CB 8585 C CG . HIS F 31 D 0.1924 0.1944 0.2788 0.0184 0.0380 -0.0338 27 HIS L CG 8586 N ND1 . HIS F 31 D 0.1957 0.2002 0.2790 0.0161 0.0309 -0.0361 27 HIS L ND1 8587 C CD2 . HIS F 31 D 0.1961 0.2083 0.2930 0.0294 0.0324 -0.0364 27 HIS L CD2 8588 C CE1 . HIS F 31 D 0.2026 0.2209 0.2918 0.0241 0.0223 -0.0380 27 HIS L CE1 8589 N NE2 . HIS F 31 D 0.2021 0.2243 0.3008 0.0323 0.0229 -0.0370 27 HIS L NE2 8590 N N . ARG F 32 E 0.2149 0.1807 0.2640 0.0120 0.0412 -0.0270 27 ARG L N 8591 C CA . ARG F 32 E 0.2290 0.2019 0.2707 0.0165 0.0336 -0.0338 27 ARG L CA 8592 C C . ARG F 32 E 0.2424 0.2128 0.2972 0.0092 0.0275 -0.0446 27 ARG L C 8593 O O . ARG F 32 E 0.2467 0.2024 0.3061 0.0020 0.0293 -0.0442 27 ARG L O 8594 C CB . ARG F 32 E 0.2324 0.2039 0.2581 0.0215 0.0356 -0.0335 27 ARG L CB 8595 C CG . ARG F 32 E 0.2329 0.2067 0.2506 0.0233 0.0419 -0.0184 27 ARG L CG 8596 C CD . ARG F 32 E 0.2421 0.2303 0.2548 0.0281 0.0374 -0.0076 27 ARG L CD 8597 N NE . ARG F 32 E 0.2473 0.2331 0.2591 0.0255 0.0406 0.0115 27 ARG L NE 8598 C CZ . ARG F 32 E 0.2567 0.2403 0.2731 0.0260 0.0347 0.0274 27 ARG L CZ 8599 N NH1 . ARG F 32 E 0.2608 0.2472 0.2816 0.0316 0.0264 0.0253 27 ARG L NH1 8600 N NH2 . ARG F 32 E 0.2699 0.2468 0.2909 0.0203 0.0351 0.0460 27 ARG L NH2 8601 N N . ASN F 33 ? 0.2549 0.2394 0.3185 0.0099 0.0185 -0.0521 28 ASN L N 8602 C CA . ASN F 33 ? 0.2684 0.2530 0.3525 -0.0006 0.0097 -0.0609 28 ASN L CA 8603 C C . ASN F 33 ? 0.2533 0.2372 0.3557 -0.0151 0.0172 -0.0505 28 ASN L C 8604 O O . ASN F 33 ? 0.2676 0.2419 0.3858 -0.0284 0.0116 -0.0499 28 ASN L O 8605 C CB . ASN F 33 ? 0.2968 0.2652 0.3776 0.0009 -0.0012 -0.0752 28 ASN L CB 8606 C CG . ASN F 33 ? 0.3238 0.3067 0.3841 0.0173 -0.0078 -0.0879 28 ASN L CG 8607 O OD1 . ASN F 33 ? 0.3482 0.3519 0.4088 0.0216 -0.0153 -0.0930 28 ASN L OD1 8608 N ND2 . ASN F 33 ? 0.3404 0.3198 0.3821 0.0276 -0.0047 -0.0916 28 ASN L ND2 8609 N N . GLY F 34 ? 0.2306 0.2271 0.3320 -0.0122 0.0280 -0.0421 29 GLY L N 8610 C CA . GLY F 34 ? 0.2227 0.2345 0.3390 -0.0227 0.0367 -0.0338 29 GLY L CA 8611 C C . GLY F 34 ? 0.2202 0.2172 0.3262 -0.0275 0.0450 -0.0242 29 GLY L C 8612 O O . GLY F 34 ? 0.2219 0.2360 0.3363 -0.0368 0.0525 -0.0149 29 GLY L O 8613 N N . ASN F 35 ? 0.2208 0.1926 0.3087 -0.0206 0.0435 -0.0257 30 ASN L N 8614 C CA . ASN F 35 ? 0.2180 0.1756 0.2956 -0.0227 0.0490 -0.0177 30 ASN L CA 8615 C C . ASN F 35 ? 0.2091 0.1653 0.2716 -0.0118 0.0553 -0.0183 30 ASN L C 8616 O O . ASN F 35 ? 0.2074 0.1600 0.2627 -0.0029 0.0526 -0.0223 30 ASN L O 8617 C CB . ASN F 35 ? 0.2307 0.1628 0.3056 -0.0231 0.0401 -0.0206 30 ASN L CB 8618 C CG . ASN F 35 ? 0.2478 0.1714 0.3435 -0.0367 0.0290 -0.0192 30 ASN L CG 8619 O OD1 . ASN F 35 ? 0.2517 0.1867 0.3618 -0.0514 0.0318 -0.0057 30 ASN L OD1 8620 N ND2 . ASN F 35 ? 0.2633 0.1694 0.3620 -0.0319 0.0153 -0.0331 30 ASN L ND2 8621 N N . THR F 36 ? 0.2061 0.1675 0.2647 -0.0133 0.0623 -0.0132 31 THR L N 8622 C CA . THR F 36 ? 0.2010 0.1568 0.2496 -0.0050 0.0645 -0.0153 31 THR L CA 8623 C C . THR F 36 ? 0.2050 0.1460 0.2442 -0.0067 0.0644 -0.0102 31 THR L C 8624 O O . THR F 36 ? 0.2108 0.1545 0.2477 -0.0121 0.0667 -0.0037 31 THR L O 8625 C CB . THR F 36 ? 0.1991 0.1740 0.2500 -0.0016 0.0694 -0.0196 31 THR L CB 8626 O OG1 . THR F 36 ? 0.1960 0.1892 0.2594 0.0023 0.0688 -0.0262 31 THR L OG1 8627 C CG2 . THR F 36 ? 0.1994 0.1646 0.2449 0.0060 0.0673 -0.0251 31 THR L CG2 8628 N N . TYR F 37 ? 0.2071 0.1381 0.2412 -0.0015 0.0615 -0.0117 32 TYR L N 8629 C CA . TYR F 37 ? 0.2153 0.1374 0.2438 0.0000 0.0602 -0.0096 32 TYR L CA 8630 C C . TYR F 37 ? 0.2176 0.1421 0.2426 0.0013 0.0627 -0.0072 32 TYR L C 8631 O O . TYR F 37 ? 0.2176 0.1449 0.2432 0.0038 0.0625 -0.0064 32 TYR L O 8632 C CB . TYR F 37 ? 0.2139 0.1364 0.2399 0.0069 0.0568 -0.0148 32 TYR L CB 8633 C CG . TYR F 37 ? 0.2190 0.1368 0.2493 0.0070 0.0502 -0.0223 32 TYR L CG 8634 C CD1 . TYR F 37 ? 0.2293 0.1317 0.2674 0.0021 0.0440 -0.0222 32 TYR L CD1 8635 C CD2 . TYR F 37 ? 0.2188 0.1472 0.2474 0.0115 0.0475 -0.0286 32 TYR L CD2 8636 C CE1 . TYR F 37 ? 0.2411 0.1352 0.2888 0.0004 0.0339 -0.0306 32 TYR L CE1 8637 C CE2 . TYR F 37 ? 0.2286 0.1538 0.2629 0.0120 0.0384 -0.0395 32 TYR L CE2 8638 C CZ . TYR F 37 ? 0.2387 0.1450 0.2846 0.0058 0.0310 -0.0416 32 TYR L CZ 8639 O OH . TYR F 37 ? 0.2517 0.1512 0.3087 0.0043 0.0183 -0.0535 32 TYR L OH 8640 N N . LEU F 38 ? 0.2315 0.1583 0.2537 -0.0016 0.0640 -0.0045 33 LEU L N 8641 C CA . LEU F 38 ? 0.2385 0.1686 0.2572 -0.0001 0.0634 -0.0050 33 LEU L CA 8642 C C . LEU F 38 ? 0.2401 0.1693 0.2529 -0.0014 0.0618 0.0020 33 LEU L C 8643 O O . LEU F 38 ? 0.2432 0.1782 0.2527 -0.0061 0.0634 0.0085 33 LEU L O 8644 C CB . LEU F 38 ? 0.2456 0.1855 0.2647 0.0009 0.0641 -0.0123 33 LEU L CB 8645 C CG . LEU F 38 ? 0.2605 0.2008 0.2790 0.0024 0.0595 -0.0161 33 LEU L CG 8646 C CD1 . LEU F 38 ? 0.2687 0.2017 0.2992 0.0035 0.0540 -0.0230 33 LEU L CD1 8647 C CD2 . LEU F 38 ? 0.2757 0.2321 0.2836 0.0041 0.0598 -0.0196 33 LEU L CD2 8648 N N . GLU F 39 ? 0.2352 0.1610 0.2483 0.0026 0.0581 0.0029 34 GLU L N 8649 C CA . GLU F 39 ? 0.2459 0.1662 0.2561 0.0046 0.0528 0.0105 34 GLU L CA 8650 C C . GLU F 39 ? 0.2423 0.1739 0.2490 0.0075 0.0499 0.0102 34 GLU L C 8651 O O . GLU F 39 ? 0.2286 0.1685 0.2409 0.0080 0.0504 0.0028 34 GLU L O 8652 C CB . GLU F 39 ? 0.2500 0.1587 0.2675 0.0119 0.0478 0.0071 34 GLU L CB 8653 C CG . GLU F 39 ? 0.2576 0.1532 0.2795 0.0094 0.0461 0.0052 34 GLU L CG 8654 C CD . GLU F 39 ? 0.2581 0.1485 0.2859 0.0199 0.0409 -0.0070 34 GLU L CD 8655 O OE1 . GLU F 39 ? 0.2575 0.1596 0.2862 0.0304 0.0405 -0.0133 34 GLU L OE1 8656 O OE2 . GLU F 39 ? 0.2637 0.1428 0.2962 0.0182 0.0364 -0.0118 34 GLU L OE2 8657 N N . TRP F 40 ? 0.2517 0.1837 0.2513 0.0082 0.0448 0.0202 35 TRP L N 8658 C CA . TRP F 40 ? 0.2577 0.2018 0.2537 0.0128 0.0389 0.0204 35 TRP L CA 8659 C C . TRP F 40 ? 0.2709 0.2045 0.2715 0.0207 0.0295 0.0285 35 TRP L C 8660 O O . TRP F 40 ? 0.2916 0.2075 0.2913 0.0196 0.0247 0.0412 35 TRP L O 8661 C CB . TRP F 40 ? 0.2690 0.2306 0.2488 0.0098 0.0389 0.0254 35 TRP L CB 8662 C CG . TRP F 40 ? 0.2621 0.2371 0.2391 0.0076 0.0446 0.0113 35 TRP L CG 8663 C CD1 . TRP F 40 ? 0.2612 0.2410 0.2359 0.0037 0.0523 0.0104 35 TRP L CD1 8664 C CD2 . TRP F 40 ? 0.2592 0.2448 0.2394 0.0104 0.0401 -0.0057 35 TRP L CD2 8665 N NE1 . TRP F 40 ? 0.2609 0.2529 0.2360 0.0071 0.0528 -0.0080 35 TRP L NE1 8666 C CE2 . TRP F 40 ? 0.2582 0.2503 0.2373 0.0105 0.0441 -0.0184 35 TRP L CE2 8667 C CE3 . TRP F 40 ? 0.2587 0.2493 0.2463 0.0127 0.0311 -0.0126 35 TRP L CE3 8668 C CZ2 . TRP F 40 ? 0.2599 0.2563 0.2454 0.0140 0.0370 -0.0390 35 TRP L CZ2 8669 C CZ3 . TRP F 40 ? 0.2609 0.2575 0.2556 0.0125 0.0247 -0.0308 35 TRP L CZ3 8670 C CH2 . TRP F 40 ? 0.2639 0.2601 0.2577 0.0137 0.0266 -0.0446 35 TRP L CH2 8671 N N . TYR F 41 ? 0.2623 0.2072 0.2714 0.0283 0.0252 0.0214 36 TYR L N 8672 C CA . TYR F 41 ? 0.2744 0.2155 0.2912 0.0404 0.0145 0.0247 36 TYR L CA 8673 C C . TYR F 41 ? 0.2878 0.2481 0.3009 0.0439 0.0065 0.0279 36 TYR L C 8674 O O . TYR F 41 ? 0.2750 0.2556 0.2874 0.0385 0.0090 0.0200 36 TYR L O 8675 C CB . TYR F 41 ? 0.2592 0.2092 0.2930 0.0499 0.0164 0.0111 36 TYR L CB 8676 C CG . TYR F 41 ? 0.2551 0.1889 0.2907 0.0502 0.0210 0.0056 36 TYR L CG 8677 C CD1 . TYR F 41 ? 0.2365 0.1762 0.2696 0.0406 0.0321 0.0016 36 TYR L CD1 8678 C CD2 . TYR F 41 ? 0.2755 0.1858 0.3166 0.0606 0.0110 0.0038 36 TYR L CD2 8679 C CE1 . TYR F 41 ? 0.2394 0.1679 0.2728 0.0416 0.0347 -0.0041 36 TYR L CE1 8680 C CE2 . TYR F 41 ? 0.2782 0.1744 0.3217 0.0612 0.0122 -0.0048 36 TYR L CE2 8681 C CZ . TYR F 41 ? 0.2580 0.1661 0.2962 0.0516 0.0248 -0.0086 36 TYR L CZ 8682 O OH . TYR F 41 ? 0.2589 0.1568 0.2985 0.0530 0.0244 -0.0179 36 TYR L OH 8683 N N . LEU F 42 ? 0.3158 0.2678 0.3290 0.0536 -0.0059 0.0389 37 LEU L N 8684 C CA . LEU F 42 ? 0.3315 0.3033 0.3428 0.0606 -0.0169 0.0425 37 LEU L CA 8685 C C . LEU F 42 ? 0.3488 0.3226 0.3811 0.0779 -0.0266 0.0362 37 LEU L C 8686 O O . LEU F 42 ? 0.3693 0.3164 0.4088 0.0881 -0.0346 0.0403 37 LEU L O 8687 C CB . LEU F 42 ? 0.3589 0.3233 0.3508 0.0588 -0.0257 0.0658 37 LEU L CB 8688 C CG . LEU F 42 ? 0.3790 0.3604 0.3668 0.0693 -0.0415 0.0747 37 LEU L CG 8689 C CD1 . LEU F 42 ? 0.3635 0.3823 0.3503 0.0681 -0.0406 0.0570 37 LEU L CD1 8690 C CD2 . LEU F 42 ? 0.4112 0.3878 0.3761 0.0646 -0.0486 0.1045 37 LEU L CD2 8691 N N . GLN F 43 ? 0.3495 0.3564 0.3950 0.0821 -0.0278 0.0246 38 GLN L N 8692 C CA . GLN F 43 ? 0.3689 0.3900 0.4355 0.1009 -0.0377 0.0181 38 GLN L CA 8693 C C . GLN F 43 ? 0.3942 0.4335 0.4602 0.1087 -0.0535 0.0251 38 GLN L C 8694 O O . GLN F 43 ? 0.3811 0.4447 0.4417 0.0989 -0.0537 0.0231 38 GLN L O 8695 C CB . GLN F 43 ? 0.3507 0.4067 0.4397 0.1010 -0.0272 0.0014 38 GLN L CB 8696 C CG . GLN F 43 ? 0.3627 0.4422 0.4755 0.1246 -0.0361 -0.0081 38 GLN L CG 8697 C CD . GLN F 43 ? 0.3489 0.4682 0.4818 0.1254 -0.0227 -0.0217 38 GLN L CD 8698 O OE1 . GLN F 43 ? 0.3599 0.4900 0.5052 0.1458 -0.0235 -0.0344 38 GLN L OE1 8699 N NE2 . GLN F 43 ? 0.3266 0.4694 0.4635 0.1034 -0.0112 -0.0192 38 GLN L NE2 8700 N N . LYS F 44 ? 0.4431 0.4689 0.5159 0.1279 -0.0697 0.0319 39 LYS L N 8701 C CA . LYS F 44 ? 0.4773 0.5221 0.5525 0.1397 -0.0876 0.0390 39 LYS L CA 8702 C C . LYS F 44 ? 0.4755 0.5536 0.5837 0.1595 -0.0931 0.0210 39 LYS L C 8703 O O . LYS F 44 ? 0.4719 0.5505 0.5973 0.1687 -0.0858 0.0062 39 LYS L O 8704 C CB . LYS F 44 ? 0.5293 0.5363 0.5901 0.1471 -0.1049 0.0646 39 LYS L CB 8705 C CG . LYS F 44 ? 0.5466 0.5376 0.5752 0.1254 -0.0968 0.0847 39 LYS L CG 8706 C CD . LYS F 44 ? 0.6038 0.5820 0.6135 0.1275 -0.1144 0.1175 39 LYS L CD 8707 C CE . LYS F 44 ? 0.6375 0.5692 0.6415 0.1182 -0.1155 0.1418 39 LYS L CE 8708 N NZ . LYS F 44 ? 0.6971 0.6177 0.6871 0.1199 -0.1356 0.1807 39 LYS L NZ 8709 N N . PRO F 45 ? 0.4820 0.5962 0.5995 0.1666 -0.1056 0.0204 40 PRO L N 8710 C CA . PRO F 45 ? 0.4738 0.6309 0.6264 0.1859 -0.1112 0.0038 40 PRO L CA 8711 C C . PRO F 45 ? 0.4919 0.6273 0.6604 0.2144 -0.1206 -0.0029 40 PRO L C 8712 O O . PRO F 45 ? 0.5247 0.6153 0.6832 0.2265 -0.1388 0.0121 40 PRO L O 8713 C CB . PRO F 45 ? 0.4946 0.6789 0.6483 0.1923 -0.1309 0.0108 40 PRO L CB 8714 C CG . PRO F 45 ? 0.4941 0.6680 0.6147 0.1687 -0.1279 0.0225 40 PRO L CG 8715 C CD . PRO F 45 ? 0.4964 0.6205 0.5919 0.1572 -0.1152 0.0333 40 PRO L CD 8716 N N . GLY F 46 ? 0.4692 0.6369 0.6625 0.2246 -0.1092 -0.0250 41 GLY L N 8717 C CA . GLY F 46 ? 0.4819 0.6419 0.6955 0.2580 -0.1201 -0.0415 41 GLY L CA 8718 C C . GLY F 46 ? 0.4953 0.5894 0.6946 0.2612 -0.1233 -0.0403 41 GLY L C 8719 O O . GLY F 46 ? 0.5202 0.5940 0.7360 0.2904 -0.1396 -0.0544 41 GLY L O 8720 N N . GLN F 47 ? 0.4772 0.5379 0.6490 0.2321 -0.1104 -0.0249 42 GLN L N 8721 C CA . GLN F 47 ? 0.4862 0.4912 0.6471 0.2292 -0.1106 -0.0240 42 GLN L CA 8722 C C . GLN F 47 ? 0.4449 0.4642 0.5962 0.2095 -0.0846 -0.0336 42 GLN L C 8723 O O . GLN F 47 ? 0.4120 0.4714 0.5597 0.1913 -0.0673 -0.0321 42 GLN L O 8724 C CB . GLN F 47 ? 0.5088 0.4621 0.6456 0.2108 -0.1198 0.0081 42 GLN L CB 8725 C CG . GLN F 47 ? 0.5537 0.4821 0.6949 0.2265 -0.1482 0.0277 42 GLN L CG 8726 C CD . GLN F 47 ? 0.5784 0.4650 0.6935 0.2042 -0.1541 0.0653 42 GLN L CD 8727 O OE1 . GLN F 47 ? 0.5699 0.4389 0.6682 0.1806 -0.1389 0.0730 42 GLN L OE1 8728 N NE2 . GLN F 47 ? 0.6145 0.4907 0.7264 0.2119 -0.1761 0.0904 42 GLN L NE2 8729 N N . SER F 48 ? 0.4499 0.4327 0.5983 0.2123 -0.0849 -0.0421 43 SER L N 8730 C CA . SER F 48 ? 0.4173 0.4068 0.5540 0.1946 -0.0634 -0.0483 43 SER L CA 8731 C C . SER F 48 ? 0.3971 0.3663 0.5097 0.1626 -0.0535 -0.0238 43 SER L C 8732 O O . SER F 48 ? 0.4119 0.3553 0.5145 0.1559 -0.0645 -0.0024 43 SER L O 8733 C CB . SER F 48 ? 0.4395 0.3924 0.5796 0.2069 -0.0712 -0.0647 43 SER L CB 8734 O OG . SER F 48 ? 0.4696 0.4394 0.6323 0.2418 -0.0841 -0.0926 43 SER L OG 8735 N N . PRO F 49 ? 0.3575 0.3435 0.4607 0.1442 -0.0331 -0.0265 44 PRO L N 8736 C CA . PRO F 49 ? 0.3445 0.3082 0.4269 0.1188 -0.0252 -0.0090 44 PRO L CA 8737 C C . PRO F 49 ? 0.3631 0.2759 0.4388 0.1164 -0.0341 -0.0008 44 PRO L C 8738 O O . PRO F 49 ? 0.3739 0.2698 0.4599 0.1293 -0.0402 -0.0158 44 PRO L O 8739 C CB . PRO F 49 ? 0.3126 0.3018 0.3926 0.1055 -0.0056 -0.0167 44 PRO L CB 8740 C CG . PRO F 49 ? 0.3044 0.3414 0.4032 0.1186 -0.0014 -0.0309 44 PRO L CG 8741 C CD . PRO F 49 ? 0.3325 0.3640 0.4445 0.1464 -0.0173 -0.0429 44 PRO L CD 8742 N N . LYS F 50 ? 0.3665 0.2598 0.4271 0.1004 -0.0363 0.0221 45 LYS L N 8743 C CA . LYS F 50 ? 0.3862 0.2374 0.4430 0.0909 -0.0433 0.0370 45 LYS L CA 8744 C C . LYS F 50 ? 0.3557 0.2134 0.3959 0.0677 -0.0264 0.0454 45 LYS L C 8745 O O . LYS F 50 ? 0.3294 0.2145 0.3559 0.0587 -0.0159 0.0491 45 LYS L O 8746 C CB . LYS F 50 ? 0.4276 0.2563 0.4828 0.0918 -0.0616 0.0633 45 LYS L CB 8747 C CG . LYS F 50 ? 0.4626 0.2782 0.5376 0.1177 -0.0832 0.0561 45 LYS L CG 8748 C CD . LYS F 50 ? 0.5100 0.2998 0.5823 0.1161 -0.1033 0.0892 45 LYS L CD 8749 C CE . LYS F 50 ? 0.5462 0.3262 0.6388 0.1447 -0.1272 0.0827 45 LYS L CE 8750 N NZ . LYS F 50 ? 0.5734 0.3141 0.6928 0.1634 -0.1438 0.0613 45 LYS L NZ 8751 N N . LEU F 51 ? 0.3548 0.1877 0.3988 0.0599 -0.0261 0.0456 46 LEU L N 8752 C CA . LEU F 51 ? 0.3317 0.1720 0.3645 0.0405 -0.0116 0.0518 46 LEU L CA 8753 C C . LEU F 51 ? 0.3450 0.1874 0.3650 0.0259 -0.0125 0.0806 46 LEU L C 8754 O O . LEU F 51 ? 0.3744 0.1926 0.4000 0.0237 -0.0273 0.1020 46 LEU L O 8755 C CB . LEU F 51 ? 0.3356 0.1520 0.3795 0.0367 -0.0140 0.0439 46 LEU L CB 8756 C CG . LEU F 51 ? 0.3189 0.1455 0.3558 0.0186 -0.0003 0.0485 46 LEU L CG 8757 C CD1 . LEU F 51 ? 0.2836 0.1398 0.3119 0.0201 0.0158 0.0322 46 LEU L CD1 8758 C CD2 . LEU F 51 ? 0.3348 0.1345 0.3871 0.0143 -0.0087 0.0435 46 LEU L CD2 8759 N N . LEU F 52 ? 0.3235 0.1972 0.3271 0.0170 0.0019 0.0810 47 LEU L N 8760 C CA . LEU F 52 ? 0.3405 0.2307 0.3285 0.0042 0.0046 0.1053 47 LEU L CA 8761 C C . LEU F 52 ? 0.3329 0.2317 0.3206 -0.0108 0.0168 0.1083 47 LEU L C 8762 O O . LEU F 52 ? 0.3514 0.2498 0.3402 -0.0246 0.0152 0.1333 47 LEU L O 8763 C CB . LEU F 52 ? 0.3312 0.2582 0.3003 0.0083 0.0098 0.1000 47 LEU L CB 8764 C CG . LEU F 52 ? 0.3426 0.2719 0.3116 0.0219 -0.0027 0.0993 47 LEU L CG 8765 C CD1 . LEU F 52 ? 0.3373 0.3052 0.2882 0.0235 0.0006 0.0914 47 LEU L CD1 8766 C CD2 . LEU F 52 ? 0.3802 0.2888 0.3510 0.0237 -0.0193 0.1277 47 LEU L CD2 8767 N N . ILE F 53 ? 0.3050 0.2145 0.2935 -0.0085 0.0280 0.0845 48 ILE L N 8768 C CA . ILE F 53 ? 0.2948 0.2199 0.2831 -0.0188 0.0397 0.0823 48 ILE L CA 8769 C C . ILE F 53 ? 0.2719 0.1803 0.2738 -0.0158 0.0417 0.0628 48 ILE L C 8770 O O . ILE F 53 ? 0.2575 0.1626 0.2608 -0.0055 0.0416 0.0461 48 ILE L O 8771 C CB . ILE F 53 ? 0.2840 0.2464 0.2566 -0.0163 0.0501 0.0713 48 ILE L CB 8772 C CG1 . ILE F 53 ? 0.3061 0.2952 0.2599 -0.0166 0.0481 0.0874 48 ILE L CG1 8773 C CG2 . ILE F 53 ? 0.2756 0.2575 0.2513 -0.0232 0.0611 0.0667 48 ILE L CG2 8774 C CD1 . ILE F 53 ? 0.3333 0.3370 0.2838 -0.0306 0.0498 0.1184 48 ILE L CD1 8775 N N . TYR F 54 ? 0.2730 0.1754 0.2857 -0.0257 0.0428 0.0672 49 TYR L N 8776 C CA . TYR F 54 ? 0.2595 0.1537 0.2820 -0.0229 0.0445 0.0490 49 TYR L CA 8777 C C . TYR F 54 ? 0.2483 0.1655 0.2732 -0.0313 0.0543 0.0480 49 TYR L C 8778 O O . TYR F 54 ? 0.2605 0.2002 0.2840 -0.0418 0.0593 0.0633 49 TYR L O 8779 C CB . TYR F 54 ? 0.2781 0.1400 0.3164 -0.0221 0.0311 0.0470 49 TYR L CB 8780 C CG . TYR F 54 ? 0.3040 0.1544 0.3570 -0.0386 0.0236 0.0658 49 TYR L CG 8781 C CD1 . TYR F 54 ? 0.3354 0.1753 0.3905 -0.0466 0.0151 0.0917 49 TYR L CD1 8782 C CD2 . TYR F 54 ? 0.3049 0.1555 0.3723 -0.0475 0.0229 0.0605 49 TYR L CD2 8783 C CE1 . TYR F 54 ? 0.3659 0.1951 0.4391 -0.0660 0.0066 0.1152 49 TYR L CE1 8784 C CE2 . TYR F 54 ? 0.3312 0.1733 0.4182 -0.0665 0.0145 0.0801 49 TYR L CE2 8785 C CZ . TYR F 54 ? 0.3631 0.1940 0.4539 -0.0769 0.0066 0.1088 49 TYR L CZ 8786 O OH . TYR F 54 ? 0.3979 0.2205 0.5119 -0.0996 -0.0029 0.1342 49 TYR L OH 8787 N N . LYS F 55 ? 0.2285 0.1454 0.2573 -0.0258 0.0569 0.0309 50 LYS L N 8788 C CA . LYS F 55 ? 0.2180 0.1564 0.2516 -0.0294 0.0640 0.0262 50 LYS L CA 8789 C C . LYS F 55 ? 0.2137 0.1841 0.2379 -0.0291 0.0730 0.0283 50 LYS L C 8790 O O . LYS F 55 ? 0.2177 0.2157 0.2460 -0.0371 0.0786 0.0365 50 LYS L O 8791 C CB . LYS F 55 ? 0.2281 0.1643 0.2786 -0.0420 0.0597 0.0343 50 LYS L CB 8792 C CG . LYS F 55 ? 0.2264 0.1428 0.2860 -0.0377 0.0513 0.0202 50 LYS L CG 8793 C CD . LYS F 55 ? 0.2453 0.1528 0.3259 -0.0518 0.0415 0.0270 50 LYS L CD 8794 C CE . LYS F 55 ? 0.2389 0.1800 0.3319 -0.0626 0.0487 0.0320 50 LYS L CE 8795 N NZ . LYS F 55 ? 0.2603 0.1947 0.3795 -0.0802 0.0375 0.0407 50 LYS L NZ 8796 N N . VAL F 56 ? 0.2070 0.1775 0.2199 -0.0196 0.0732 0.0195 51 VAL L N 8797 C CA . VAL F 56 ? 0.2076 0.2064 0.2106 -0.0139 0.0780 0.0119 51 VAL L CA 8798 C C . VAL F 56 ? 0.2276 0.2514 0.2179 -0.0188 0.0808 0.0271 51 VAL L C 8799 O O . VAL F 56 ? 0.2345 0.2693 0.2112 -0.0118 0.0790 0.0213 51 VAL L O 8800 C CB . VAL F 56 ? 0.2026 0.2247 0.2131 -0.0094 0.0831 -0.0013 51 VAL L CB 8801 C CG1 . VAL F 56 ? 0.2106 0.2601 0.2117 0.0019 0.0846 -0.0177 51 VAL L CG1 8802 C CG2 . VAL F 56 ? 0.1896 0.1883 0.2114 -0.0045 0.0787 -0.0119 51 VAL L CG2 8803 N N . SER F 57 ? 0.2419 0.2767 0.2376 -0.0319 0.0836 0.0479 52 SER L N 8804 C CA . SER F 57 ? 0.2664 0.3368 0.2498 -0.0388 0.0881 0.0682 52 SER L CA 8805 C C . SER F 57 ? 0.2885 0.3458 0.2797 -0.0564 0.0827 0.1017 52 SER L C 8806 O O . SER F 57 ? 0.3073 0.3991 0.2900 -0.0660 0.0868 0.1266 52 SER L O 8807 C CB . SER F 57 ? 0.2690 0.3958 0.2508 -0.0375 0.1003 0.0622 52 SER L CB 8808 O OG . SER F 57 ? 0.2693 0.4027 0.2723 -0.0475 0.1041 0.0669 52 SER L OG 8809 N N . ASN F 58 ? 0.2889 0.2986 0.2964 -0.0600 0.0720 0.1031 53 ASN L N 8810 C CA . ASN F 58 ? 0.3211 0.3088 0.3430 -0.0765 0.0617 0.1323 53 ASN L CA 8811 C C . ASN F 58 ? 0.3431 0.2987 0.3579 -0.0708 0.0485 0.1429 53 ASN L C 8812 O O . ASN F 58 ? 0.3326 0.2580 0.3473 -0.0563 0.0416 0.1231 53 ASN L O 8813 C CB . ASN F 58 ? 0.3191 0.2734 0.3666 -0.0825 0.0531 0.1243 53 ASN L CB 8814 C CG . ASN F 58 ? 0.3007 0.2866 0.3596 -0.0882 0.0634 0.1149 53 ASN L CG 8815 O OD1 . ASN F 58 ? 0.3179 0.3197 0.3952 -0.1070 0.0632 0.1342 53 ASN L OD1 8816 N ND2 . ASN F 58 ? 0.2744 0.2689 0.3257 -0.0727 0.0704 0.0871 53 ASN L ND2 8817 N N . ARG F 59 ? 0.3797 0.3462 0.3899 -0.0821 0.0446 0.1765 54 ARG L N 8818 C CA . ARG F 59 ? 0.4075 0.3503 0.4094 -0.0748 0.0311 0.1893 54 ARG L CA 8819 C C . ARG F 59 ? 0.4223 0.3055 0.4499 -0.0766 0.0106 0.1938 54 ARG L C 8820 O O . ARG F 59 ? 0.4415 0.3095 0.4913 -0.0945 0.0036 0.2118 54 ARG L O 8821 C CB . ARG F 59 ? 0.4479 0.4307 0.4336 -0.0865 0.0344 0.2261 54 ARG L CB 8822 C CG . ARG F 59 ? 0.4974 0.4611 0.4756 -0.0838 0.0181 0.2528 54 ARG L CG 8823 C CD . ARG F 59 ? 0.5382 0.5568 0.4948 -0.0962 0.0246 0.2915 54 ARG L CD 8824 N NE . ARG F 59 ? 0.5270 0.6129 0.4617 -0.0920 0.0468 0.2729 54 ARG L NE 8825 C CZ . ARG F 59 ? 0.5477 0.6871 0.4825 -0.1076 0.0621 0.2889 54 ARG L CZ 8826 N NH1 . ARG F 59 ? 0.5801 0.7162 0.5369 -0.1337 0.0584 0.3302 54 ARG L NH1 8827 N NH2 . ARG F 59 ? 0.5385 0.7382 0.4539 -0.0966 0.0800 0.2629 54 ARG L NH2 8828 N N . PHE F 60 ? 0.4164 0.2687 0.4439 -0.0570 0.0002 0.1738 55 PHE L N 8829 C CA . PHE F 60 ? 0.4390 0.2366 0.4909 -0.0516 -0.0216 0.1699 55 PHE L CA 8830 C C . PHE F 60 ? 0.4936 0.2673 0.5545 -0.0616 -0.0407 0.2097 55 PHE L C 8831 O O . PHE F 60 ? 0.5033 0.3038 0.5449 -0.0648 -0.0375 0.2357 55 PHE L O 8832 C CB . PHE F 60 ? 0.4193 0.2048 0.4682 -0.0253 -0.0255 0.1371 55 PHE L CB 8833 C CG . PHE F 60 ? 0.4375 0.1759 0.5107 -0.0129 -0.0465 0.1208 55 PHE L CG 8834 C CD1 . PHE F 60 ? 0.4321 0.1553 0.5210 -0.0151 -0.0488 0.1007 55 PHE L CD1 8835 C CD2 . PHE F 60 ? 0.4627 0.1758 0.5432 0.0044 -0.0654 0.1213 55 PHE L CD2 8836 C CE1 . PHE F 60 ? 0.4541 0.1385 0.5641 0.0000 -0.0698 0.0790 55 PHE L CE1 8837 C CE2 . PHE F 60 ? 0.4857 0.1590 0.5896 0.0207 -0.0862 0.0998 55 PHE L CE2 8838 C CZ . PHE F 60 ? 0.4820 0.1411 0.5999 0.0188 -0.0886 0.0772 55 PHE L CZ 8839 N N . SER F 61 ? 0.5343 0.2570 0.6254 -0.0661 -0.0630 0.2142 56 SER L N 8840 C CA . SER F 61 ? 0.5958 0.2849 0.7039 -0.0791 -0.0862 0.2558 56 SER L CA 8841 C C . SER F 61 ? 0.6156 0.2999 0.7089 -0.0597 -0.0963 0.2642 56 SER L C 8842 O O . SER F 61 ? 0.5985 0.2792 0.6862 -0.0330 -0.0967 0.2288 56 SER L O 8843 C CB . SER F 61 ? 0.6301 0.2566 0.7779 -0.0811 -0.1130 0.2454 56 SER L CB 8844 O OG . SER F 61 ? 0.6972 0.2809 0.8699 -0.0965 -0.1404 0.2874 56 SER L OG 8845 N N . GLY F 62 ? 0.6555 0.3488 0.7411 -0.0734 -0.1029 0.3120 57 GLY L N 8846 C CA . GLY F 62 ? 0.6786 0.3729 0.7484 -0.0556 -0.1137 0.3235 57 GLY L CA 8847 C C . GLY F 62 ? 0.6479 0.4079 0.6777 -0.0475 -0.0904 0.3163 57 GLY L C 8848 O O . GLY F 62 ? 0.6769 0.4488 0.6906 -0.0378 -0.0990 0.3341 57 GLY L O 8849 N N . VAL F 63 ? 0.5997 0.4011 0.6150 -0.0504 -0.0638 0.2894 58 VAL L N 8850 C CA . VAL F 63 ? 0.5688 0.4291 0.5503 -0.0426 -0.0444 0.2765 58 VAL L CA 8851 C C . VAL F 63 ? 0.5920 0.5036 0.5525 -0.0627 -0.0326 0.3135 58 VAL L C 8852 O O . VAL F 63 ? 0.5950 0.5192 0.5645 -0.0824 -0.0220 0.3246 58 VAL L O 8853 C CB . VAL F 63 ? 0.5150 0.3934 0.4941 -0.0363 -0.0243 0.2318 58 VAL L CB 8854 C CG1 . VAL F 63 ? 0.4900 0.4212 0.4400 -0.0275 -0.0096 0.2151 58 VAL L CG1 8855 C CG2 . VAL F 63 ? 0.4970 0.3349 0.4967 -0.0188 -0.0331 0.1980 58 VAL L CG2 8856 N N . PRO F 64 ? 0.6157 0.5649 0.5478 -0.0571 -0.0340 0.3318 59 PRO L N 8857 C CA . PRO F 64 ? 0.6442 0.6524 0.5530 -0.0750 -0.0234 0.3712 59 PRO L CA 8858 C C . PRO F 64 ? 0.6118 0.6852 0.4995 -0.0748 0.0035 0.3442 59 PRO L C 8859 O O . PRO F 64 ? 0.5722 0.6484 0.4553 -0.0575 0.0109 0.2971 59 PRO L O 8860 C CB . PRO F 64 ? 0.6764 0.7044 0.5593 -0.0633 -0.0363 0.3920 59 PRO L CB 8861 C CG . PRO F 64 ? 0.6446 0.6491 0.5299 -0.0366 -0.0433 0.3461 59 PRO L CG 8862 C CD . PRO F 64 ? 0.6163 0.5627 0.5367 -0.0337 -0.0457 0.3168 59 PRO L CD 8863 N N . ASP F 65 ? 0.6374 0.7667 0.5137 -0.0933 0.0169 0.3752 60 ASP L N 8864 C CA . ASP F 65 ? 0.6111 0.8005 0.4761 -0.0927 0.0416 0.3479 60 ASP L CA 8865 C C . ASP F 65 ? 0.5981 0.8445 0.4268 -0.0705 0.0505 0.3142 60 ASP L C 8866 O O . ASP F 65 ? 0.5795 0.8785 0.3985 -0.0660 0.0684 0.2890 60 ASP L O 8867 C CB . ASP F 65 ? 0.6354 0.8764 0.5052 -0.1189 0.0552 0.3876 60 ASP L CB 8868 C CG . ASP F 65 ? 0.6933 0.9641 0.5486 -0.1352 0.0478 0.4501 60 ASP L CG 8869 O OD1 . ASP F 65 ? 0.7126 0.9766 0.5459 -0.1220 0.0340 0.4587 60 ASP L OD1 8870 O OD2 . ASP F 65 ? 0.7230 1.0267 0.5910 -0.1624 0.0550 0.4932 60 ASP L OD2 8871 N N . ARG F 66 ? 0.6087 0.8454 0.4204 -0.0551 0.0361 0.3107 61 ARG L N 8872 C CA . ARG F 66 ? 0.5949 0.8741 0.3792 -0.0330 0.0396 0.2695 61 ARG L CA 8873 C C . ARG F 66 ? 0.5423 0.7851 0.3461 -0.0202 0.0418 0.2147 61 ARG L C 8874 O O . ARG F 66 ? 0.5281 0.8017 0.3186 -0.0052 0.0458 0.1753 61 ARG L O 8875 C CB . ARG F 66 ? 0.6268 0.9141 0.3881 -0.0210 0.0220 0.2815 61 ARG L CB 8876 C CG . ARG F 66 ? 0.6337 0.8492 0.4177 -0.0185 0.0006 0.2944 61 ARG L CG 8877 C CD . ARG F 66 ? 0.6531 0.8849 0.4157 -0.0014 -0.0163 0.2930 61 ARG L CD 8878 N NE . ARG F 66 ? 0.6431 0.8123 0.4317 0.0081 -0.0356 0.2880 61 ARG L NE 8879 C CZ . ARG F 66 ? 0.6753 0.7987 0.4811 0.0032 -0.0524 0.3261 61 ARG L CZ 8880 N NH1 . ARG F 66 ? 0.7156 0.8433 0.5174 -0.0154 -0.0534 0.3779 61 ARG L NH1 8881 N NH2 . ARG F 66 ? 0.6698 0.7442 0.5002 0.0174 -0.0696 0.3126 61 ARG L NH2 8882 N N . PHE F 67 ? 0.5187 0.6970 0.3547 -0.0263 0.0374 0.2133 62 PHE L N 8883 C CA . PHE F 67 ? 0.4737 0.6203 0.3295 -0.0183 0.0411 0.1705 62 PHE L CA 8884 C C . PHE F 67 ? 0.4543 0.6122 0.3221 -0.0268 0.0569 0.1611 62 PHE L C 8885 O O . PHE F 67 ? 0.4678 0.6166 0.3495 -0.0435 0.0598 0.1889 62 PHE L O 8886 C CB . PHE F 67 ? 0.4637 0.5439 0.3463 -0.0178 0.0288 0.1713 62 PHE L CB 8887 C CG . PHE F 67 ? 0.4735 0.5390 0.3529 -0.0051 0.0125 0.1709 62 PHE L CG 8888 C CD1 . PHE F 67 ? 0.4503 0.5187 0.3308 0.0085 0.0099 0.1357 62 PHE L CD1 8889 C CD2 . PHE F 67 ? 0.5062 0.5544 0.3858 -0.0075 -0.0024 0.2069 62 PHE L CD2 8890 C CE1 . PHE F 67 ? 0.4595 0.5212 0.3409 0.0198 -0.0053 0.1349 62 PHE L CE1 8891 C CE2 . PHE F 67 ? 0.5158 0.5536 0.3947 0.0067 -0.0188 0.2053 62 PHE L CE2 8892 C CZ . PHE F 67 ? 0.4910 0.5389 0.3709 0.0205 -0.0193 0.1684 62 PHE L CZ 8893 N N . SER F 68 ? 0.4270 0.6008 0.2937 -0.0155 0.0642 0.1216 63 SER L N 8894 C CA . SER F 68 ? 0.4084 0.5928 0.2887 -0.0196 0.0771 0.1087 63 SER L CA 8895 C C . SER F 68 ? 0.3740 0.5300 0.2679 -0.0074 0.0750 0.0682 63 SER L C 8896 O O . SER F 68 ? 0.3799 0.5359 0.2666 0.0051 0.0675 0.0442 63 SER L O 8897 C CB . SER F 68 ? 0.4291 0.6875 0.2908 -0.0180 0.0903 0.1089 63 SER L CB 8898 O OG . SER F 68 ? 0.4415 0.7308 0.2852 0.0020 0.0882 0.0725 63 SER L OG 8899 N N . GLY F 69 ? 0.3445 0.4761 0.2600 -0.0129 0.0796 0.0632 64 GLY L N 8900 C CA . GLY F 69 ? 0.3125 0.4188 0.2424 -0.0038 0.0776 0.0318 64 GLY L CA 8901 C C . GLY F 69 ? 0.3014 0.4388 0.2362 0.0002 0.0871 0.0156 64 GLY L C 8902 O O . GLY F 69 ? 0.3030 0.4700 0.2391 -0.0087 0.0964 0.0326 64 GLY L O 8903 N N . SER F 70 ? 0.2887 0.4198 0.2296 0.0135 0.0830 -0.0163 65 SER L N 8904 C CA . SER F 70 ? 0.2839 0.4400 0.2334 0.0219 0.0887 -0.0359 65 SER L CA 8905 C C . SER F 70 ? 0.2692 0.3890 0.2353 0.0319 0.0785 -0.0622 65 SER L C 8906 O O . SER F 70 ? 0.2643 0.3472 0.2342 0.0302 0.0689 -0.0635 65 SER L O 8907 C CB . SER F 70 ? 0.3063 0.5255 0.2376 0.0340 0.0936 -0.0501 65 SER L CB 8908 O OG . SER F 70 ? 0.3225 0.5365 0.2469 0.0493 0.0811 -0.0798 65 SER L OG 8909 N N . GLY F 71 ? 0.2656 0.3990 0.2438 0.0420 0.0799 -0.0810 66 GLY L N 8910 C CA . GLY F 71 ? 0.2657 0.3647 0.2621 0.0521 0.0675 -0.1034 66 GLY L CA 8911 C C . GLY F 71 ? 0.2510 0.3301 0.2665 0.0488 0.0690 -0.0968 66 GLY L C 8912 O O . GLY F 71 ? 0.2380 0.3280 0.2544 0.0379 0.0792 -0.0771 66 GLY L O 8913 N N . SER F 72 ? 0.2568 0.3071 0.2892 0.0584 0.0564 -0.1133 67 SER L N 8914 C CA . SER F 72 ? 0.2487 0.2813 0.2979 0.0580 0.0548 -0.1076 67 SER L CA 8915 C C . SER F 72 ? 0.2581 0.2475 0.3245 0.0638 0.0372 -0.1161 67 SER L C 8916 O O . SER F 72 ? 0.2761 0.2560 0.3480 0.0737 0.0242 -0.1368 67 SER L O 8917 C CB . SER F 72 ? 0.2542 0.3309 0.3101 0.0702 0.0611 -0.1212 67 SER L CB 8918 O OG . SER F 72 ? 0.2463 0.3163 0.3176 0.0690 0.0609 -0.1137 67 SER L OG 8919 N N . GLY F 73 ? 0.2491 0.2134 0.3247 0.0572 0.0349 -0.0993 68 GLY L N 8920 C CA . GLY F 73 ? 0.2637 0.1906 0.3584 0.0612 0.0175 -0.1000 68 GLY L CA 8921 C C . GLY F 73 ? 0.2662 0.1640 0.3628 0.0490 0.0099 -0.0887 68 GLY L C 8922 O O . GLY F 73 ? 0.2496 0.1400 0.3405 0.0352 0.0159 -0.0651 68 GLY L O 8923 N N . THR F 74 ? 0.2888 0.1744 0.3954 0.0550 -0.0041 -0.1077 69 THR L N 8924 C CA . THR F 74 ? 0.2962 0.1593 0.4097 0.0414 -0.0128 -0.0980 69 THR L CA 8925 C C . THR F 74 ? 0.3001 0.1818 0.4008 0.0416 -0.0107 -0.1125 69 THR L C 8926 O O . THR F 74 ? 0.3116 0.1800 0.4207 0.0312 -0.0192 -0.1079 69 THR L O 8927 C CB . THR F 74 ? 0.3249 0.1482 0.4693 0.0426 -0.0382 -0.1028 69 THR L CB 8928 O OG1 . THR F 74 ? 0.3508 0.1735 0.5041 0.0621 -0.0529 -0.1406 69 THR L OG1 8929 C CG2 . THR F 74 ? 0.3287 0.1329 0.4857 0.0428 -0.0431 -0.0836 69 THR L CG2 8930 N N . ASP F 75 ? 0.3004 0.2173 0.3818 0.0523 0.0000 -0.1276 70 ASP L N 8931 C CA . ASP F 75 ? 0.3140 0.2546 0.3813 0.0572 -0.0010 -0.1452 70 ASP L CA 8932 C C . ASP F 75 ? 0.2953 0.2736 0.3348 0.0531 0.0191 -0.1310 70 ASP L C 8933 O O . ASP F 75 ? 0.2906 0.2971 0.3213 0.0586 0.0311 -0.1309 70 ASP L O 8934 C CB . ASP F 75 ? 0.3469 0.3017 0.4194 0.0792 -0.0124 -0.1825 70 ASP L CB 8935 C CG . ASP F 75 ? 0.3804 0.3419 0.4503 0.0858 -0.0268 -0.2086 70 ASP L CG 8936 O OD1 . ASP F 75 ? 0.3808 0.3539 0.4352 0.0748 -0.0213 -0.1958 70 ASP L OD1 8937 O OD2 . ASP F 75 ? 0.4209 0.3761 0.5055 0.1038 -0.0460 -0.2441 70 ASP L OD2 8938 N N . PHE F 76 ? 0.2881 0.2666 0.3175 0.0426 0.0213 -0.1171 71 PHE L N 8939 C CA . PHE F 76 ? 0.2787 0.2821 0.2860 0.0367 0.0361 -0.0978 71 PHE L CA 8940 C C . PHE F 76 ? 0.2878 0.3090 0.2800 0.0376 0.0316 -0.1012 71 PHE L C 8941 O O . PHE F 76 ? 0.2912 0.2975 0.2935 0.0363 0.0186 -0.1100 71 PHE L O 8942 C CB . PHE F 76 ? 0.2603 0.2418 0.2719 0.0236 0.0429 -0.0710 71 PHE L CB 8943 C CG . PHE F 76 ? 0.2548 0.2224 0.2783 0.0227 0.0463 -0.0663 71 PHE L CG 8944 C CD1 . PHE F 76 ? 0.2542 0.2385 0.2723 0.0223 0.0568 -0.0596 71 PHE L CD1 8945 C CD2 . PHE F 76 ? 0.2613 0.2020 0.3027 0.0208 0.0376 -0.0661 71 PHE L CD2 8946 C CE1 . PHE F 76 ? 0.2488 0.2234 0.2783 0.0223 0.0580 -0.0568 71 PHE L CE1 8947 C CE2 . PHE F 76 ? 0.2565 0.1876 0.3066 0.0211 0.0391 -0.0600 71 PHE L CE2 8948 C CZ . PHE F 76 ? 0.2474 0.1955 0.2909 0.0230 0.0490 -0.0574 71 PHE L CZ 8949 N N . THR F 77 ? 0.2926 0.3471 0.2625 0.0380 0.0417 -0.0904 72 THR L N 8950 C CA . THR F 77 ? 0.3126 0.3923 0.2635 0.0411 0.0371 -0.0919 72 THR L CA 8951 C C . THR F 77 ? 0.3204 0.4095 0.2558 0.0318 0.0461 -0.0591 72 THR L C 8952 O O . THR F 77 ? 0.3232 0.4190 0.2564 0.0256 0.0578 -0.0408 72 THR L O 8953 C CB . THR F 77 ? 0.3326 0.4579 0.2677 0.0563 0.0365 -0.1168 72 THR L CB 8954 O OG1 . THR F 77 ? 0.3414 0.4494 0.2959 0.0672 0.0232 -0.1505 72 THR L OG1 8955 C CG2 . THR F 77 ? 0.3532 0.5112 0.2647 0.0615 0.0301 -0.1201 72 THR L CG2 8956 N N . LEU F 78 ? 0.3340 0.4213 0.2629 0.0305 0.0382 -0.0513 73 LEU L N 8957 C CA . LEU F 78 ? 0.3538 0.4512 0.2671 0.0251 0.0416 -0.0215 73 LEU L CA 8958 C C . LEU F 78 ? 0.3933 0.5347 0.2807 0.0331 0.0367 -0.0253 73 LEU L C 8959 O O . LEU F 78 ? 0.3981 0.5442 0.2851 0.0406 0.0240 -0.0464 73 LEU L O 8960 C CB . LEU F 78 ? 0.3425 0.4067 0.2690 0.0208 0.0346 -0.0086 73 LEU L CB 8961 C CG . LEU F 78 ? 0.3611 0.4269 0.2764 0.0180 0.0324 0.0212 73 LEU L CG 8962 C CD1 . LEU F 78 ? 0.3650 0.4216 0.2815 0.0085 0.0416 0.0451 73 LEU L CD1 8963 C CD2 . LEU F 78 ? 0.3589 0.3990 0.2897 0.0200 0.0230 0.0249 73 LEU L CD2 8964 N N . LYS F 79 ? 0.4327 0.6099 0.2994 0.0303 0.0459 -0.0037 74 LYS L N 8965 C CA . LYS F 79 ? 0.4827 0.7120 0.3191 0.0378 0.0426 -0.0013 74 LYS L CA 8966 C C . LYS F 79 ? 0.4954 0.7244 0.3198 0.0291 0.0399 0.0412 74 LYS L C 8967 O O . LYS F 79 ? 0.4780 0.6816 0.3138 0.0160 0.0452 0.0717 74 LYS L O 8968 C CB . LYS F 79 ? 0.5190 0.8068 0.3381 0.0431 0.0553 -0.0084 74 LYS L CB 8969 C CG . LYS F 79 ? 0.5433 0.8381 0.3715 0.0584 0.0526 -0.0564 74 LYS L CG 8970 C CD . LYS F 79 ? 0.5976 0.9689 0.4012 0.0724 0.0606 -0.0727 74 LYS L CD 8971 C CE . LYS F 79 ? 0.6177 0.9902 0.4366 0.0906 0.0559 -0.1232 74 LYS L CE 8972 N NZ . LYS F 79 ? 0.6055 0.9499 0.4514 0.0835 0.0663 -0.1181 74 LYS L NZ 8973 N N . ILE F 80 ? 0.5239 0.7789 0.3276 0.0373 0.0284 0.0415 75 ILE L N 8974 C CA . ILE F 80 ? 0.5522 0.8178 0.3390 0.0322 0.0231 0.0834 75 ILE L CA 8975 C C . ILE F 80 ? 0.5892 0.9291 0.3384 0.0398 0.0257 0.0847 75 ILE L C 8976 O O . ILE F 80 ? 0.5985 0.9662 0.3346 0.0550 0.0167 0.0500 75 ILE L O 8977 C CB . ILE F 80 ? 0.5490 0.7846 0.3445 0.0379 0.0047 0.0838 75 ILE L CB 8978 C CG1 . ILE F 80 ? 0.5115 0.6874 0.3436 0.0345 0.0036 0.0716 75 ILE L CG1 8979 C CG2 . ILE F 80 ? 0.5875 0.8237 0.3708 0.0332 -0.0030 0.1311 75 ILE L CG2 8980 C CD1 . ILE F 80 ? 0.5094 0.6663 0.3555 0.0419 -0.0125 0.0633 75 ILE L CD1 8981 N N . SER F 81 ? 0.6229 0.9987 0.3564 0.0288 0.0372 0.1238 76 SER L N 8982 C CA . SER F 81 ? 0.6612 1.1225 0.3572 0.0359 0.0444 0.1254 76 SER L CA 8983 C C . SER F 81 ? 0.7016 1.1941 0.3670 0.0464 0.0282 0.1343 76 SER L C 8984 O O . SER F 81 ? 0.7269 1.2828 0.3628 0.0633 0.0261 0.1056 76 SER L O 8985 C CB . SER F 81 ? 0.6820 1.1774 0.3736 0.0171 0.0611 0.1728 76 SER L CB 8986 O OG . SER F 81 ? 0.6986 1.1456 0.4025 0.0000 0.0518 0.2236 76 SER L OG 8987 N N . ARG F 82 ? 0.7116 1.1604 0.3849 0.0388 0.0145 0.1706 77 ARG L N 8988 C CA . ARG F 82 ? 0.7481 1.2257 0.3935 0.0476 -0.0027 0.1886 77 ARG L CA 8989 C C . ARG F 82 ? 0.7323 1.1396 0.4038 0.0481 -0.0227 0.1997 77 ARG L C 8990 O O . ARG F 82 ? 0.7543 1.1260 0.4370 0.0366 -0.0282 0.2465 77 ARG L O 8991 C CB . ARG F 82 ? 0.8053 1.3444 0.4176 0.0368 0.0045 0.2459 77 ARG L CB 8992 C CG . ARG F 82 ? 0.8420 1.3384 0.4652 0.0202 -0.0064 0.3110 77 ARG L CG 8993 C CD . ARG F 82 ? 0.8892 1.4318 0.4974 -0.0009 0.0064 0.3710 77 ARG L CD 8994 N NE . ARG F 82 ? 0.8675 1.4126 0.4964 -0.0141 0.0291 0.3601 77 ARG L NE 8995 C CZ . ARG F 82 ? 0.8778 1.5057 0.4855 -0.0133 0.0503 0.3494 77 ARG L CZ 8996 N NH1 . ARG F 82 ? 0.9153 1.6357 0.4766 -0.0002 0.0530 0.3486 77 ARG L NH1 8997 N NH2 . ARG F 82 ? 0.8468 1.4700 0.4798 -0.0240 0.0683 0.3381 77 ARG L NH2 8998 N N . VAL F 83 ? 0.6934 1.0849 0.3769 0.0620 -0.0353 0.1558 78 VAL L N 8999 C CA . VAL F 83 ? 0.6640 0.9950 0.3800 0.0641 -0.0505 0.1551 78 VAL L CA 9000 C C . VAL F 83 ? 0.6992 1.0282 0.4059 0.0680 -0.0696 0.1965 78 VAL L C 9001 O O . VAL F 83 ? 0.7378 1.1182 0.4127 0.0779 -0.0810 0.2018 78 VAL L O 9002 C CB . VAL F 83 ? 0.6336 0.9625 0.3651 0.0759 -0.0607 0.1021 78 VAL L CB 9003 C CG1 . VAL F 83 ? 0.6220 0.9105 0.3833 0.0802 -0.0773 0.1049 78 VAL L CG1 9004 C CG2 . VAL F 83 ? 0.5933 0.9018 0.3465 0.0713 -0.0466 0.0652 78 VAL L CG2 9005 N N . GLU F 84 ? 0.6912 0.9602 0.4275 0.0628 -0.0756 0.2218 79 GLU L N 9006 C CA . GLU F 84 ? 0.7227 0.9744 0.4615 0.0699 -0.0982 0.2569 79 GLU L CA 9007 C C . GLU F 84 ? 0.6819 0.8932 0.4578 0.0829 -0.1120 0.2300 79 GLU L C 9008 O O . GLU F 84 ? 0.6297 0.8186 0.4322 0.0818 -0.1023 0.1935 79 GLU L O 9009 C CB . GLU F 84 ? 0.7617 0.9767 0.5081 0.0557 -0.0991 0.3104 79 GLU L CB 9010 C CG . GLU F 84 ? 0.7912 1.0475 0.5108 0.0378 -0.0808 0.3381 79 GLU L CG 9011 C CD . GLU F 84 ? 0.8509 1.0895 0.5704 0.0225 -0.0899 0.4053 79 GLU L CD 9012 O OE1 . GLU F 84 ? 0.8881 1.1838 0.5761 0.0102 -0.0807 0.4405 79 GLU L OE1 9013 O OE2 . GLU F 84 ? 0.8647 1.0352 0.6171 0.0233 -0.1076 0.4227 79 GLU L OE2 9014 N N . ALA F 85 ? 0.7003 0.9071 0.4788 0.0954 -0.1351 0.2509 80 ALA L N 9015 C CA . ALA F 85 ? 0.6712 0.8578 0.4836 0.1111 -0.1499 0.2255 80 ALA L CA 9016 C C . ALA F 85 ? 0.6316 0.7626 0.4853 0.1094 -0.1423 0.2115 80 ALA L C 9017 O O . ALA F 85 ? 0.5907 0.7197 0.4718 0.1162 -0.1413 0.1763 80 ALA L O 9018 C CB . ALA F 85 ? 0.7165 0.9019 0.5276 0.1263 -0.1775 0.2576 80 ALA L CB 9019 N N . GLU F 86 ? 0.6432 0.7328 0.5021 0.1000 -0.1389 0.2411 81 GLU L N 9020 C CA . GLU F 86 ? 0.6168 0.6542 0.5117 0.1000 -0.1343 0.2284 81 GLU L CA 9021 C C . GLU F 86 ? 0.5575 0.5976 0.4595 0.0892 -0.1097 0.1928 81 GLU L C 9022 O O . GLU F 86 ? 0.5340 0.5431 0.4647 0.0921 -0.1053 0.1742 81 GLU L O 9023 C CB . GLU F 86 ? 0.6619 0.6534 0.5617 0.0909 -0.1411 0.2694 81 GLU L CB 9024 C CG . GLU F 86 ? 0.6718 0.6774 0.5481 0.0667 -0.1226 0.2906 81 GLU L CG 9025 C CD . GLU F 86 ? 0.7317 0.7050 0.6101 0.0544 -0.1354 0.3445 81 GLU L CD 9026 O OE1 . GLU F 86 ? 0.7332 0.6661 0.6329 0.0414 -0.1303 0.3491 81 GLU L OE1 9027 O OE2 . GLU F 86 ? 0.7841 0.7723 0.6449 0.0570 -0.1527 0.3834 81 GLU L OE2 9028 N N . ASP F 87 ? 0.5373 0.6163 0.4135 0.0789 -0.0953 0.1824 82 ASP L N 9029 C CA . ASP F 87 ? 0.4872 0.5687 0.3703 0.0698 -0.0749 0.1496 82 ASP L CA 9030 C C . ASP F 87 ? 0.4489 0.5433 0.3519 0.0770 -0.0761 0.1110 82 ASP L C 9031 O O . ASP F 87 ? 0.4156 0.5027 0.3324 0.0701 -0.0627 0.0870 82 ASP L O 9032 C CB . ASP F 87 ? 0.4921 0.6119 0.3433 0.0598 -0.0619 0.1492 82 ASP L CB 9033 C CG . ASP F 87 ? 0.5278 0.6491 0.3600 0.0489 -0.0584 0.1915 82 ASP L CG 9034 O OD1 . ASP F 87 ? 0.5368 0.6141 0.3874 0.0433 -0.0620 0.2157 82 ASP L OD1 9035 O OD2 . ASP F 87 ? 0.5526 0.7225 0.3526 0.0456 -0.0530 0.2004 82 ASP L OD2 9036 N N . LEU F 88 ? 0.4565 0.5716 0.3633 0.0894 -0.0933 0.1078 83 LEU L N 9037 C CA . LEU F 88 ? 0.4274 0.5623 0.3571 0.0929 -0.0967 0.0747 83 LEU L CA 9038 C C . LEU F 88 ? 0.3981 0.5084 0.3652 0.0955 -0.0915 0.0641 83 LEU L C 9039 O O . LEU F 88 ? 0.4127 0.4983 0.3917 0.1054 -0.0973 0.0787 83 LEU L O 9040 C CB . LEU F 88 ? 0.4479 0.6161 0.3749 0.1058 -0.1182 0.0755 83 LEU L CB 9041 C CG . LEU F 88 ? 0.4822 0.6860 0.3683 0.1074 -0.1268 0.0862 83 LEU L CG 9042 C CD1 . LEU F 88 ? 0.5079 0.7405 0.3955 0.1229 -0.1514 0.0903 83 LEU L CD1 9043 C CD2 . LEU F 88 ? 0.4698 0.7003 0.3416 0.0988 -0.1186 0.0560 83 LEU L CD2 9044 N N . GLY F 89 ? 0.3641 0.4837 0.3506 0.0873 -0.0825 0.0385 84 GLY L N 9045 C CA . GLY F 89 ? 0.3363 0.4439 0.3548 0.0876 -0.0738 0.0288 84 GLY L CA 9046 C C . GLY F 89 ? 0.3074 0.4163 0.3341 0.0714 -0.0599 0.0111 84 GLY L C 9047 O O . GLY F 89 ? 0.3089 0.4303 0.3247 0.0631 -0.0619 0.0002 84 GLY L O 9048 N N . VAL F 90 ? 0.2866 0.3831 0.3324 0.0683 -0.0477 0.0074 85 VAL L N 9049 C CA . VAL F 90 ? 0.2653 0.3603 0.3211 0.0528 -0.0360 -0.0043 85 VAL L CA 9050 C C . VAL F 90 ? 0.2603 0.3238 0.3018 0.0482 -0.0220 0.0013 85 VAL L C 9051 O O . VAL F 90 ? 0.2568 0.3053 0.3019 0.0552 -0.0172 0.0076 85 VAL L O 9052 C CB . VAL F 90 ? 0.2465 0.3637 0.3374 0.0501 -0.0324 -0.0104 85 VAL L CB 9053 C CG1 . VAL F 90 ? 0.2320 0.3465 0.3347 0.0314 -0.0240 -0.0166 85 VAL L CG1 9054 C CG2 . VAL F 90 ? 0.2520 0.4066 0.3636 0.0551 -0.0468 -0.0151 85 VAL L CG2 9055 N N . TYR F 91 ? 0.2648 0.3209 0.2934 0.0379 -0.0171 -0.0044 86 TYR L N 9056 C CA . TYR F 91 ? 0.2637 0.2956 0.2807 0.0328 -0.0045 -0.0006 86 TYR L CA 9057 C C . TYR F 91 ? 0.2462 0.2727 0.2818 0.0235 0.0041 -0.0085 86 TYR L C 9058 O O . TYR F 91 ? 0.2493 0.2864 0.3004 0.0158 -0.0004 -0.0183 86 TYR L O 9059 C CB . TYR F 91 ? 0.2751 0.3096 0.2676 0.0300 -0.0041 -0.0028 86 TYR L CB 9060 C CG . TYR F 91 ? 0.3005 0.3432 0.2702 0.0367 -0.0101 0.0130 86 TYR L CG 9061 C CD1 . TYR F 91 ? 0.3176 0.3840 0.2816 0.0433 -0.0237 0.0117 86 TYR L CD1 9062 C CD2 . TYR F 91 ? 0.3099 0.3387 0.2652 0.0348 -0.0037 0.0319 86 TYR L CD2 9063 C CE1 . TYR F 91 ? 0.3456 0.4218 0.2867 0.0492 -0.0305 0.0314 86 TYR L CE1 9064 C CE2 . TYR F 91 ? 0.3386 0.3758 0.2746 0.0379 -0.0104 0.0536 86 TYR L CE2 9065 C CZ . TYR F 91 ? 0.3557 0.4169 0.2830 0.0457 -0.0237 0.0543 86 TYR L CZ 9066 O OH . TYR F 91 ? 0.3892 0.4616 0.2957 0.0491 -0.0321 0.0800 86 TYR L OH 9067 N N . TYR F 92 ? 0.2372 0.2468 0.2722 0.0236 0.0142 -0.0031 87 TYR L N 9068 C CA . TYR F 92 ? 0.2264 0.2329 0.2748 0.0156 0.0222 -0.0061 87 TYR L CA 9069 C C . TYR F 92 ? 0.2319 0.2170 0.2669 0.0132 0.0303 -0.0046 87 TYR L C 9070 O O . TYR F 92 ? 0.2322 0.2055 0.2565 0.0182 0.0326 0.0015 87 TYR L O 9071 C CB . TYR F 92 ? 0.2186 0.2376 0.2817 0.0212 0.0266 -0.0028 87 TYR L CB 9072 C CG . TYR F 92 ? 0.2134 0.2637 0.2964 0.0240 0.0207 -0.0040 87 TYR L CG 9073 C CD1 . TYR F 92 ? 0.2073 0.2799 0.3131 0.0112 0.0205 -0.0033 87 TYR L CD1 9074 C CD2 . TYR F 92 ? 0.2224 0.2808 0.3052 0.0390 0.0133 -0.0041 87 TYR L CD2 9075 C CE1 . TYR F 92 ? 0.2074 0.3157 0.3361 0.0116 0.0150 -0.0034 87 TYR L CE1 9076 C CE2 . TYR F 92 ? 0.2212 0.3144 0.3252 0.0433 0.0072 -0.0065 87 TYR L CE2 9077 C CZ . TYR F 92 ? 0.2129 0.3338 0.3400 0.0287 0.0091 -0.0065 87 TYR L CZ 9078 O OH . TYR F 92 ? 0.2156 0.3774 0.3685 0.0300 0.0034 -0.0077 87 TYR L OH 9079 N N . CYS F 93 ? 0.2396 0.2192 0.2793 0.0053 0.0324 -0.0101 88 CYS L N 9080 C CA . CYS F 93 ? 0.2429 0.2074 0.2760 0.0038 0.0399 -0.0091 88 CYS L CA 9081 C C . CYS F 93 ? 0.2198 0.1856 0.2633 0.0026 0.0454 -0.0034 88 CYS L C 9082 O O . CYS F 93 ? 0.2166 0.1983 0.2748 0.0000 0.0445 -0.0002 88 CYS L O 9083 C CB . CYS F 93 ? 0.2702 0.2287 0.3035 0.0004 0.0373 -0.0192 88 CYS L CB 9084 S SG . CYS F 93 ? 0.3138 0.2689 0.3725 -0.0081 0.0273 -0.0247 88 CYS L SG 9085 N N . PHE F 94 ? 0.2049 0.1601 0.2412 0.0044 0.0511 -0.0019 89 PHE L N 9086 C CA . PHE F 94 ? 0.1886 0.1496 0.2292 0.0056 0.0560 0.0013 89 PHE L CA 9087 C C . PHE F 94 ? 0.1806 0.1287 0.2158 0.0036 0.0587 0.0007 89 PHE L C 9088 O O . PHE F 94 ? 0.1846 0.1219 0.2122 0.0042 0.0588 -0.0022 89 PHE L O 9089 C CB . PHE F 94 ? 0.1884 0.1541 0.2261 0.0165 0.0560 -0.0012 89 PHE L CB 9090 C CG . PHE F 94 ? 0.1848 0.1594 0.2214 0.0220 0.0600 -0.0040 89 PHE L CG 9091 C CD1 . PHE F 94 ? 0.1799 0.1848 0.2232 0.0233 0.0644 -0.0010 89 PHE L CD1 9092 C CD2 . PHE F 94 ? 0.1918 0.1493 0.2211 0.0255 0.0585 -0.0095 89 PHE L CD2 9093 C CE1 . PHE F 94 ? 0.1831 0.2049 0.2211 0.0307 0.0681 -0.0048 89 PHE L CE1 9094 C CE2 . PHE F 94 ? 0.1926 0.1612 0.2191 0.0325 0.0597 -0.0161 89 PHE L CE2 9095 C CZ . PHE F 94 ? 0.1885 0.1910 0.2169 0.0365 0.0649 -0.0145 89 PHE L CZ 9096 N N . GLN F 95 ? 0.1726 0.1264 0.2134 0.0004 0.0604 0.0060 90 GLN L N 9097 C CA . GLN F 95 ? 0.1679 0.1136 0.2048 0.0006 0.0614 0.0060 90 GLN L CA 9098 C C . GLN F 95 ? 0.1712 0.1311 0.2025 0.0060 0.0647 0.0075 90 GLN L C 9099 O O . GLN F 95 ? 0.1704 0.1523 0.2044 0.0061 0.0672 0.0145 90 GLN L O 9100 C CB . GLN F 95 ? 0.1694 0.1073 0.2167 -0.0053 0.0566 0.0112 90 GLN L CB 9101 C CG . GLN F 95 ? 0.1736 0.1235 0.2322 -0.0126 0.0552 0.0270 90 GLN L CG 9102 C CD . GLN F 95 ? 0.1749 0.1365 0.2277 -0.0110 0.0579 0.0377 90 GLN L CD 9103 O OE1 . GLN F 95 ? 0.1741 0.1292 0.2175 -0.0046 0.0582 0.0308 90 GLN L OE1 9104 N NE2 . GLN F 95 ? 0.1806 0.1651 0.2391 -0.0173 0.0597 0.0554 90 GLN L NE2 9105 N N . GLY F 96 ? 0.1765 0.1284 0.2011 0.0103 0.0640 0.0001 91 GLY L N 9106 C CA . GLY F 96 ? 0.1840 0.1490 0.2021 0.0175 0.0639 -0.0043 91 GLY L CA 9107 C C . GLY F 96 ? 0.1906 0.1546 0.2067 0.0161 0.0619 -0.0021 91 GLY L C 9108 O O . GLY F 96 ? 0.2018 0.1704 0.2126 0.0216 0.0588 -0.0106 91 GLY L O 9109 N N . SER F 97 ? 0.1896 0.1469 0.2119 0.0100 0.0611 0.0076 92 SER L N 9110 C CA . SER F 97 ? 0.1965 0.1520 0.2200 0.0108 0.0571 0.0106 92 SER L CA 9111 C C . SER F 97 ? 0.2104 0.1834 0.2303 0.0107 0.0558 0.0264 92 SER L C 9112 O O . SER F 97 ? 0.2215 0.2045 0.2349 0.0155 0.0524 0.0273 92 SER L O 9113 C CB . SER F 97 ? 0.1944 0.1326 0.2294 0.0080 0.0535 0.0103 92 SER L CB 9114 O OG . SER F 97 ? 0.2010 0.1381 0.2401 0.0113 0.0476 0.0133 92 SER L OG 9115 N N . HIS F 98 ? 0.2161 0.1954 0.2420 0.0040 0.0574 0.0414 93 HIS L N 9116 C CA . HIS F 98 ? 0.2317 0.2310 0.2575 -0.0004 0.0562 0.0648 93 HIS L CA 9117 C C . HIS F 98 ? 0.2323 0.2694 0.2528 -0.0014 0.0647 0.0723 93 HIS L C 9118 O O . HIS F 98 ? 0.2333 0.2714 0.2647 -0.0073 0.0675 0.0734 93 HIS L O 9119 C CB . HIS F 98 ? 0.2443 0.2204 0.2902 -0.0113 0.0477 0.0815 93 HIS L CB 9120 C CG . HIS F 98 ? 0.2472 0.1904 0.3017 -0.0068 0.0380 0.0710 93 HIS L CG 9121 N ND1 . HIS F 98 ? 0.2627 0.2001 0.3190 -0.0027 0.0291 0.0805 93 HIS L ND1 9122 C CD2 . HIS F 98 ? 0.2396 0.1600 0.3023 -0.0040 0.0354 0.0517 93 HIS L CD2 9123 C CE1 . HIS F 98 ? 0.2643 0.1767 0.3318 0.0036 0.0216 0.0649 93 HIS L CE1 9124 N NE2 . HIS F 98 ? 0.2517 0.1559 0.3226 0.0028 0.0259 0.0472 93 HIS L NE2 9125 N N . VAL F 99 ? 0.2373 0.3113 0.2417 0.0054 0.0682 0.0769 94 VAL L N 9126 C CA . VAL F 99 ? 0.2406 0.3649 0.2396 0.0066 0.0774 0.0854 94 VAL L CA 9127 C C . VAL F 99 ? 0.2550 0.3949 0.2695 -0.0117 0.0778 0.1226 94 VAL L C 9128 O O . VAL F 99 ? 0.2712 0.4042 0.2874 -0.0193 0.0710 0.1465 94 VAL L O 9129 C CB . VAL F 99 ? 0.2531 0.4213 0.2279 0.0210 0.0799 0.0794 94 VAL L CB 9130 C CG1 . VAL F 99 ? 0.2624 0.4966 0.2306 0.0248 0.0910 0.0876 94 VAL L CG1 9131 C CG2 . VAL F 99 ? 0.2473 0.3978 0.2123 0.0373 0.0752 0.0422 94 VAL L CG2 9132 N N . PRO F 100 ? 0.2510 0.4150 0.2794 -0.0194 0.0843 0.1298 95 PRO L N 9133 C CA . PRO F 100 ? 0.2349 0.4150 0.2641 -0.0094 0.0912 0.1060 95 PRO L CA 9134 C C . PRO F 100 ? 0.2175 0.3451 0.2577 -0.0103 0.0846 0.0871 95 PRO L C 9135 O O . PRO F 100 ? 0.2211 0.3166 0.2783 -0.0243 0.0771 0.0980 95 PRO L O 9136 C CB . PRO F 100 ? 0.2464 0.4758 0.2928 -0.0226 0.0984 0.1308 95 PRO L CB 9137 C CG . PRO F 100 ? 0.2638 0.4727 0.3291 -0.0464 0.0901 0.1663 95 PRO L CG 9138 C CD . PRO F 100 ? 0.2702 0.4509 0.3190 -0.0413 0.0829 0.1690 95 PRO L CD 9139 N N . TYR F 101 ? 0.2039 0.3244 0.2354 0.0051 0.0857 0.0591 96 TYR L N 9140 C CA . TYR F 101 ? 0.1883 0.2648 0.2259 0.0049 0.0798 0.0441 96 TYR L CA 9141 C C . TYR F 101 ? 0.1818 0.2673 0.2382 -0.0039 0.0798 0.0508 96 TYR L C 9142 O O . TYR F 101 ? 0.1795 0.3093 0.2444 -0.0057 0.0856 0.0606 96 TYR L O 9143 C CB . TYR F 101 ? 0.1856 0.2507 0.2115 0.0215 0.0782 0.0184 96 TYR L CB 9144 C CG . TYR F 101 ? 0.1915 0.2516 0.2028 0.0290 0.0758 0.0096 96 TYR L CG 9145 C CD1 . TYR F 101 ? 0.1919 0.2325 0.2019 0.0210 0.0726 0.0190 96 TYR L CD1 9146 C CD2 . TYR F 101 ? 0.1999 0.2756 0.2014 0.0456 0.0742 -0.0105 96 TYR L CD2 9147 C CE1 . TYR F 101 ? 0.1978 0.2386 0.1968 0.0277 0.0690 0.0110 96 TYR L CE1 9148 C CE2 . TYR F 101 ? 0.2089 0.2821 0.1992 0.0519 0.0693 -0.0207 96 TYR L CE2 9149 C CZ . TYR F 101 ? 0.2064 0.2643 0.1953 0.0419 0.0674 -0.0083 96 TYR L CZ 9150 O OH . TYR F 101 ? 0.2136 0.2714 0.1937 0.0475 0.0611 -0.0183 96 TYR L OH 9151 N N . THR F 102 ? 0.1754 0.2251 0.2391 -0.0093 0.0728 0.0451 97 THR L N 9152 C CA . THR F 102 ? 0.1751 0.2299 0.2585 -0.0200 0.0688 0.0512 97 THR L CA 9153 C C . THR F 102 ? 0.1675 0.1974 0.2485 -0.0148 0.0631 0.0343 97 THR L C 9154 O O . THR F 102 ? 0.1617 0.1637 0.2288 -0.0087 0.0614 0.0235 97 THR L O 9155 C CB . THR F 102 ? 0.1865 0.2268 0.2883 -0.0382 0.0610 0.0691 97 THR L CB 9156 O OG1 . THR F 102 ? 0.1892 0.1911 0.2825 -0.0355 0.0553 0.0625 97 THR L OG1 9157 C CG2 . THR F 102 ? 0.1996 0.2754 0.3095 -0.0485 0.0659 0.0960 97 THR L CG2 9158 N N . PHE F 103 ? 0.1679 0.2151 0.2634 -0.0182 0.0602 0.0347 98 PHE L N 9159 C CA . PHE F 103 ? 0.1668 0.2003 0.2609 -0.0140 0.0532 0.0223 98 PHE L CA 9160 C C . PHE F 103 ? 0.1756 0.1990 0.2871 -0.0279 0.0425 0.0236 98 PHE L C 9161 O O . PHE F 103 ? 0.1793 0.2143 0.3125 -0.0422 0.0398 0.0370 98 PHE L O 9162 C CB . PHE F 103 ? 0.1632 0.2283 0.2642 -0.0053 0.0544 0.0194 98 PHE L CB 9163 C CG . PHE F 103 ? 0.1631 0.2320 0.2499 0.0130 0.0591 0.0106 98 PHE L CG 9164 C CD1 . PHE F 103 ? 0.1676 0.2087 0.2407 0.0234 0.0535 0.0013 98 PHE L CD1 9165 C CD2 . PHE F 103 ? 0.1637 0.2669 0.2525 0.0203 0.0671 0.0116 98 PHE L CD2 9166 C CE1 . PHE F 103 ? 0.1736 0.2104 0.2394 0.0396 0.0529 -0.0074 98 PHE L CE1 9167 C CE2 . PHE F 103 ? 0.1702 0.2747 0.2486 0.0404 0.0672 -0.0030 98 PHE L CE2 9168 C CZ . PHE F 103 ? 0.1761 0.2424 0.2453 0.0495 0.0586 -0.0128 98 PHE L CZ 9169 N N . GLY F 104 ? 0.1816 0.1856 0.2847 -0.0239 0.0349 0.0098 99 GLY L N 9170 C CA . GLY F 104 ? 0.1930 0.1936 0.3127 -0.0326 0.0213 0.0033 99 GLY L CA 9171 C C . GLY F 104 ? 0.1917 0.2237 0.3277 -0.0349 0.0179 0.0058 99 GLY L C 9172 O O . GLY F 104 ? 0.1819 0.2353 0.3117 -0.0248 0.0256 0.0085 99 GLY L O 9173 N N . GLY F 105 ? 0.2054 0.2400 0.3649 -0.0468 0.0038 0.0020 100 GLY L N 9174 C CA . GLY F 105 ? 0.2067 0.2763 0.3900 -0.0526 -0.0016 0.0053 100 GLY L CA 9175 C C . GLY F 105 ? 0.2082 0.2910 0.3777 -0.0376 -0.0059 -0.0072 100 GLY L C 9176 O O . GLY F 105 ? 0.2094 0.3265 0.3971 -0.0379 -0.0090 -0.0047 100 GLY L O 9177 N N . GLY F 106 ? 0.2140 0.2742 0.3523 -0.0247 -0.0063 -0.0182 101 GLY L N 9178 C CA . GLY F 106 ? 0.2216 0.2930 0.3436 -0.0108 -0.0114 -0.0244 101 GLY L CA 9179 C C . GLY F 106 ? 0.2413 0.3104 0.3566 -0.0106 -0.0273 -0.0411 101 GLY L C 9180 O O . GLY F 106 ? 0.2521 0.3214 0.3904 -0.0225 -0.0400 -0.0510 101 GLY L O 9181 N N . THR F 107 ? 0.2526 0.3209 0.3371 0.0027 -0.0279 -0.0438 102 THR L N 9182 C CA . THR F 107 ? 0.2772 0.3566 0.3480 0.0076 -0.0425 -0.0595 102 THR L CA 9183 C C . THR F 107 ? 0.2893 0.3897 0.3463 0.0199 -0.0471 -0.0504 102 THR L C 9184 O O . THR F 107 ? 0.2918 0.3839 0.3274 0.0286 -0.0385 -0.0352 102 THR L O 9185 C CB . THR F 107 ? 0.2868 0.3540 0.3282 0.0132 -0.0387 -0.0689 102 THR L CB 9186 O OG1 . THR F 107 ? 0.2890 0.3351 0.3459 0.0049 -0.0388 -0.0805 102 THR L OG1 9187 C CG2 . THR F 107 ? 0.3122 0.4027 0.3336 0.0220 -0.0529 -0.0862 102 THR L CG2 9188 N N . LYS F 108 ? 0.3033 0.4292 0.3752 0.0200 -0.0635 -0.0595 103 LYS L N 9189 C CA . LYS F 108 ? 0.3189 0.4680 0.3822 0.0327 -0.0723 -0.0516 103 LYS L CA 9190 C C . LYS F 108 ? 0.3401 0.5011 0.3674 0.0421 -0.0822 -0.0577 103 LYS L C 9191 O O . LYS F 108 ? 0.3569 0.5329 0.3847 0.0400 -0.0961 -0.0798 103 LYS L O 9192 C CB . LYS F 108 ? 0.3262 0.5052 0.4270 0.0279 -0.0859 -0.0585 103 LYS L CB 9193 C CG . LYS F 108 ? 0.3460 0.5499 0.4461 0.0436 -0.0945 -0.0485 103 LYS L CG 9194 C CD . LYS F 108 ? 0.3432 0.5793 0.4884 0.0396 -0.0990 -0.0494 103 LYS L CD 9195 C CE . LYS F 108 ? 0.3593 0.6177 0.5052 0.0603 -0.1069 -0.0400 103 LYS L CE 9196 N NZ . LYS F 108 ? 0.3952 0.6705 0.5215 0.0694 -0.1279 -0.0449 103 LYS L NZ 9197 N N . LEU F 109 ? 0.3444 0.5010 0.3416 0.0523 -0.0765 -0.0376 104 LEU L N 9198 C CA . LEU F 109 ? 0.3696 0.5465 0.3292 0.0607 -0.0836 -0.0358 104 LEU L CA 9199 C C . LEU F 109 ? 0.3845 0.5891 0.3420 0.0716 -0.1018 -0.0290 104 LEU L C 9200 O O . LEU F 109 ? 0.3850 0.5811 0.3483 0.0787 -0.1027 -0.0069 104 LEU L O 9201 C CB . LEU F 109 ? 0.3791 0.5402 0.3104 0.0622 -0.0691 -0.0107 104 LEU L CB 9202 C CG . LEU F 109 ? 0.4118 0.6021 0.3016 0.0673 -0.0705 -0.0057 104 LEU L CG 9203 C CD1 . LEU F 109 ? 0.4136 0.6172 0.2959 0.0652 -0.0670 -0.0370 104 LEU L CD1 9204 C CD2 . LEU F 109 ? 0.4211 0.5985 0.2913 0.0651 -0.0586 0.0292 104 LEU L CD2 9205 N N . GLU F 110 ? 0.4794 1.1099 0.3045 -0.0613 0.0441 0.0007 105 GLU L N 9206 C CA . GLU F 110 ? 0.4429 1.0568 0.3096 -0.0497 0.0616 -0.0570 105 GLU L CA 9207 C C . GLU F 110 ? 0.4189 0.8867 0.3055 0.0283 0.0557 -0.0388 105 GLU L C 9208 O O . GLU F 110 ? 0.4387 0.8321 0.2962 0.0704 0.0446 0.0016 105 GLU L O 9209 C CB . GLU F 110 ? 0.5148 1.1352 0.3036 -0.1214 0.0448 -0.0267 105 GLU L CB 9210 C CG . GLU F 110 ? 0.6246 1.2586 0.3196 -0.2033 -0.0063 0.0772 105 GLU L CG 9211 C CD . GLU F 110 ? 0.7108 1.3814 0.3335 -0.3050 -0.0381 0.1225 105 GLU L CD 9212 O OE1 . GLU F 110 ? 0.7706 1.6423 0.3356 -0.4416 -0.0539 0.1532 105 GLU L OE1 9213 O OE2 . GLU F 110 ? 0.7269 1.2539 0.3451 -0.2645 -0.0485 0.1283 105 GLU L OE2 9214 N N . LEU F 111 ? 0.3833 0.8461 0.3340 0.0338 0.0574 -0.0770 106 LEU L N 9215 C CA . LEU F 111 ? 0.3810 0.7577 0.3370 0.0657 0.0436 -0.0470 106 LEU L CA 9216 C C . LEU F 111 ? 0.4409 0.7352 0.3044 0.0597 0.0413 -0.0221 106 LEU L C 9217 O O . LEU F 111 ? 0.4718 0.7600 0.2995 0.0248 0.0394 -0.0265 106 LEU L O 9218 C CB . LEU F 111 ? 0.3382 0.7438 0.4387 0.0601 0.0147 -0.0751 106 LEU L CB 9219 C CG . LEU F 111 ? 0.3050 0.7381 0.5350 0.0725 -0.0207 -0.0697 106 LEU L CG 9220 C CD1 . LEU F 111 ? 0.3087 0.7179 0.6950 0.0540 -0.0966 -0.0430 106 LEU L CD1 9221 C CD2 . LEU F 111 ? 0.3188 0.7418 0.4508 0.0856 -0.0075 -0.0095 106 LEU L CD2 9222 N N . LYS F 112 ? 0.4647 0.7255 0.2976 0.0845 0.0403 -0.0078 107 LYS L N 9223 C CA . LYS F 112 ? 0.5271 0.7309 0.3054 0.0864 0.0368 -0.0171 107 LYS L CA 9224 C C . LYS F 112 ? 0.5179 0.7476 0.2979 0.0537 0.0347 -0.0099 107 LYS L C 9225 O O . LYS F 112 ? 0.4839 0.7790 0.3104 0.0324 0.0212 0.0189 107 LYS L O 9226 C CB . LYS F 112 ? 0.5655 0.7844 0.3468 0.1267 0.0395 -0.0526 107 LYS L CB 9227 C CG . LYS F 112 ? 0.6538 0.7826 0.4405 0.1453 0.0112 -0.0878 107 LYS L CG 9228 C CD . LYS F 112 ? 0.7046 0.8840 0.5496 0.1867 0.0119 -0.1877 107 LYS L CD 9229 C CE . LYS F 112 ? 0.8002 0.8830 0.6911 0.1989 -0.0296 -0.2419 107 LYS L CE 9230 N NZ . LYS F 112 ? 0.8581 1.0244 0.8701 0.2503 -0.0343 -0.3947 107 LYS L NZ 9231 N N . ARG F 113 ? 0.5628 0.7414 0.3013 0.0367 0.0315 -0.0197 108 ARG L N 9232 C CA . ARG F 113 ? 0.5690 0.7784 0.3003 -0.0051 0.0234 -0.0054 108 ARG L CA 9233 C C . ARG F 113 ? 0.6371 0.7963 0.3077 -0.0119 0.0280 -0.0398 108 ARG L C 9234 O O . ARG F 113 ? 0.6823 0.7565 0.3404 0.0120 0.0189 -0.0613 108 ARG L O 9235 C CB . ARG F 113 ? 0.5229 0.7370 0.3368 -0.0307 -0.0031 0.0213 108 ARG L CB 9236 C CG . ARG F 113 ? 0.5187 0.7069 0.3370 -0.0317 0.0064 -0.0113 108 ARG L CG 9237 C CD . ARG F 113 ? 0.4966 0.7153 0.4043 -0.0596 -0.0167 -0.0254 108 ARG L CD 9238 N NE . ARG F 113 ? 0.5380 0.7223 0.3894 -0.0884 -0.0289 0.0076 108 ARG L NE 9239 C CZ . ARG F 113 ? 0.5342 0.7418 0.4685 -0.1193 -0.0761 0.0458 108 ARG L CZ 9240 N NH1 . ARG F 113 ? 0.4985 0.7387 0.6176 -0.1179 -0.1359 0.0576 108 ARG L NH1 9241 N NH2 . ARG F 113 ? 0.5824 0.7815 0.4370 -0.1590 -0.0797 0.0748 108 ARG L NH2 9242 N N . ALA F 114 ? 0.6591 0.8765 0.3056 -0.0579 0.0259 -0.0347 109 ALA L N 9243 C CA . ALA F 114 ? 0.7254 0.9069 0.3254 -0.0729 0.0286 -0.0755 109 ALA L CA 9244 C C . ALA F 114 ? 0.7344 0.7989 0.3277 -0.0716 0.0128 -0.0527 109 ALA L C 9245 O O . ALA F 114 ? 0.6810 0.7555 0.3090 -0.0857 0.0063 -0.0151 109 ALA L O 9246 C CB . ALA F 114 ? 0.7399 1.0285 0.3108 -0.1473 0.0229 -0.0495 109 ALA L CB 9247 N N . ASP F 115 ? 0.8155 0.7936 0.3880 -0.0634 -0.0027 -0.0878 110 ASP L N 9248 C CA . ASP F 115 ? 0.8531 0.7498 0.3989 -0.0955 -0.0286 -0.0510 110 ASP L CA 9249 C C . ASP F 115 ? 0.8211 0.7650 0.3445 -0.1423 -0.0167 -0.0305 110 ASP L C 9250 O O . ASP F 115 ? 0.8208 0.8163 0.3352 -0.1584 -0.0072 -0.0430 110 ASP L O 9251 C CB . ASP F 115 ? 0.9725 0.7541 0.5326 -0.0888 -0.0769 -0.0819 110 ASP L CB 9252 C CG . ASP F 115 ? 1.0269 0.7362 0.6605 -0.0482 -0.1267 -0.0806 110 ASP L CG 9253 O OD1 . ASP F 115 ? 0.9671 0.7407 0.6275 -0.0076 -0.0984 -0.0968 110 ASP L OD1 9254 O OD2 . ASP F 115 ? 1.1401 0.7259 0.8197 -0.0649 -0.2100 -0.0507 110 ASP L OD2 9255 N N . ALA F 116 ? 0.5338 0.5794 0.4411 0.0351 -0.0887 -0.1017 111 ALA L N 9256 C CA . ALA F 116 ? 0.5322 0.5816 0.4221 0.0190 -0.0964 -0.0858 111 ALA L CA 9257 C C . ALA F 116 ? 0.5349 0.5338 0.4266 0.0199 -0.1047 -0.0886 111 ALA L C 9258 O O . ALA F 116 ? 0.5249 0.4849 0.4315 0.0315 -0.1081 -0.0820 111 ALA L O 9259 C CB . ALA F 116 ? 0.5101 0.5720 0.4048 0.0133 -0.0976 -0.0487 111 ALA L CB 9260 N N . ALA F 117 ? 0.5502 0.5588 0.4268 0.0060 -0.1075 -0.0980 112 ALA L N 9261 C CA . ALA F 117 ? 0.5556 0.5212 0.4343 0.0027 -0.1136 -0.1012 112 ALA L CA 9262 C C . ALA F 117 ? 0.5303 0.4847 0.4116 0.0006 -0.1242 -0.0642 112 ALA L C 9263 O O . ALA F 117 ? 0.5165 0.5047 0.3953 -0.0036 -0.1251 -0.0381 112 ALA L O 9264 C CB . ALA F 117 ? 0.5826 0.5726 0.4467 -0.0161 -0.1113 -0.1299 112 ALA L CB 9265 N N . PRO F 118 ? 0.5282 0.4344 0.4181 0.0045 -0.1288 -0.0605 113 PRO L N 9266 C CA . PRO F 118 ? 0.5085 0.4031 0.4029 0.0013 -0.1356 -0.0317 113 PRO L CA 9267 C C . PRO F 118 ? 0.5149 0.4353 0.4006 -0.0123 -0.1407 -0.0234 113 PRO L C 9268 O O . PRO F 118 ? 0.5381 0.4662 0.4149 -0.0226 -0.1418 -0.0467 113 PRO L O 9269 C CB . PRO F 118 ? 0.5097 0.3533 0.4127 0.0085 -0.1380 -0.0341 113 PRO L CB 9270 C CG . PRO F 118 ? 0.5395 0.3642 0.4430 0.0121 -0.1316 -0.0622 113 PRO L CG 9271 C CD . PRO F 118 ? 0.5488 0.4087 0.4486 0.0142 -0.1243 -0.0794 113 PRO L CD 9272 N N . THR F 119 ? 0.4989 0.4355 0.3918 -0.0130 -0.1410 0.0089 114 THR L N 9273 C CA . THR F 119 ? 0.4965 0.4610 0.3890 -0.0207 -0.1459 0.0274 114 THR L CA 9274 C C . THR F 119 ? 0.4873 0.4055 0.3900 -0.0211 -0.1495 0.0306 114 THR L C 9275 O O . THR F 119 ? 0.4808 0.3686 0.3982 -0.0150 -0.1446 0.0456 114 THR L O 9276 C CB . THR F 119 ? 0.4918 0.4905 0.3962 -0.0159 -0.1388 0.0674 114 THR L CB 9277 O OG1 . THR F 119 ? 0.5030 0.5445 0.3970 -0.0156 -0.1339 0.0660 114 THR L OG1 9278 C CG2 . THR F 119 ? 0.4948 0.5359 0.4038 -0.0189 -0.1433 0.0951 114 THR L CG2 9279 N N . VAL F 120 ? 0.4956 0.4111 0.3914 -0.0311 -0.1557 0.0128 115 VAL L N 9280 C CA . VAL F 120 ? 0.4908 0.3624 0.3945 -0.0331 -0.1579 0.0127 115 VAL L CA 9281 C C . VAL F 120 ? 0.4806 0.3803 0.3931 -0.0394 -0.1620 0.0344 115 VAL L C 9282 O O . VAL F 120 ? 0.4915 0.4475 0.3983 -0.0488 -0.1670 0.0347 115 VAL L O 9283 C CB . VAL F 120 ? 0.5161 0.3568 0.4139 -0.0404 -0.1569 -0.0203 115 VAL L CB 9284 C CG1 . VAL F 120 ? 0.5166 0.3081 0.4231 -0.0396 -0.1567 -0.0145 115 VAL L CG1 9285 C CG2 . VAL F 120 ? 0.5304 0.3517 0.4255 -0.0302 -0.1501 -0.0391 115 VAL L CG2 9286 N N . SER F 121 ? 0.4657 0.3338 0.3932 -0.0345 -0.1591 0.0521 116 SER L N 9287 C CA . SER F 121 ? 0.4559 0.3443 0.3983 -0.0372 -0.1600 0.0736 116 SER L CA 9288 C C . SER F 121 ? 0.4499 0.2896 0.3970 -0.0407 -0.1590 0.0659 116 SER L C 9289 O O . SER F 121 ? 0.4454 0.2428 0.3906 -0.0356 -0.1547 0.0592 116 SER L O 9290 C CB . SER F 121 ? 0.4469 0.3496 0.4117 -0.0248 -0.1494 0.1094 116 SER L CB 9291 O OG . SER F 121 ? 0.4559 0.3970 0.4154 -0.0201 -0.1475 0.1196 116 SER L OG 9292 N N . ILE F 122 ? 0.4476 0.3028 0.4005 -0.0504 -0.1632 0.0671 117 ILE L N 9293 C CA . ILE F 122 ? 0.4423 0.2593 0.4010 -0.0553 -0.1609 0.0636 117 ILE L CA 9294 C C . ILE F 122 ? 0.4278 0.2681 0.4105 -0.0526 -0.1569 0.0892 117 ILE L C 9295 O O . ILE F 122 ? 0.4233 0.3186 0.4170 -0.0505 -0.1596 0.1074 117 ILE L O 9296 C CB . ILE F 122 ? 0.4624 0.2686 0.4106 -0.0719 -0.1648 0.0369 117 ILE L CB 9297 C CG1 . ILE F 122 ? 0.4662 0.2255 0.4184 -0.0750 -0.1598 0.0366 117 ILE L CG1 9298 C CG2 . ILE F 122 ? 0.4694 0.3373 0.4211 -0.0876 -0.1714 0.0319 117 ILE L CG2 9299 C CD1 . ILE F 122 ? 0.4955 0.2219 0.4412 -0.0870 -0.1562 0.0127 117 ILE L CD1 9300 N N . PHE F 123 ? 0.4196 0.2240 0.4123 -0.0509 -0.1486 0.0928 118 PHE L N 9301 C CA . PHE F 123 ? 0.4089 0.2276 0.4303 -0.0460 -0.1391 0.1149 118 PHE L CA 9302 C C . PHE F 123 ? 0.4133 0.2081 0.4353 -0.0562 -0.1373 0.1055 118 PHE L C 9303 O O . PHE F 123 ? 0.4147 0.1694 0.4233 -0.0589 -0.1339 0.0926 118 PHE L O 9304 C CB . PHE F 123 ? 0.4015 0.2018 0.4420 -0.0336 -0.1217 0.1276 118 PHE L CB 9305 C CG . PHE F 123 ? 0.4000 0.2230 0.4440 -0.0238 -0.1197 0.1419 118 PHE L CG 9306 C CD1 . PHE F 123 ? 0.4003 0.2093 0.4216 -0.0249 -0.1243 0.1254 118 PHE L CD1 9307 C CD2 . PHE F 123 ? 0.4006 0.2651 0.4727 -0.0117 -0.1124 0.1761 118 PHE L CD2 9308 C CE1 . PHE F 123 ? 0.4018 0.2351 0.4258 -0.0171 -0.1213 0.1391 118 PHE L CE1 9309 C CE2 . PHE F 123 ? 0.4035 0.2934 0.4786 -0.0023 -0.1091 0.1949 118 PHE L CE2 9310 C CZ . PHE F 123 ? 0.4038 0.2765 0.4536 -0.0065 -0.1133 0.1746 118 PHE L CZ 9311 N N . PRO F 124 ? 0.4142 0.2424 0.4515 -0.0625 -0.1398 0.1135 119 PRO L N 9312 C CA . PRO F 124 ? 0.4194 0.2300 0.4621 -0.0722 -0.1351 0.1081 119 PRO L CA 9313 C C . PRO F 124 ? 0.4147 0.2066 0.4787 -0.0630 -0.1170 0.1181 119 PRO L C 9314 O O . PRO F 124 ? 0.4097 0.2074 0.4942 -0.0492 -0.1059 0.1325 119 PRO L O 9315 C CB . PRO F 124 ? 0.4220 0.2890 0.4822 -0.0802 -0.1415 0.1162 119 PRO L CB 9316 C CG . PRO F 124 ? 0.4237 0.3390 0.4768 -0.0798 -0.1534 0.1181 119 PRO L CG 9317 C CD . PRO F 124 ? 0.4150 0.3101 0.4637 -0.0624 -0.1483 0.1278 119 PRO L CD 9318 N N . PRO F 125 ? 0.4226 0.1934 0.4846 -0.0722 -0.1106 0.1097 120 PRO L N 9319 C CA . PRO F 125 ? 0.4222 0.1814 0.5055 -0.0678 -0.0900 0.1117 120 PRO L CA 9320 C C . PRO F 125 ? 0.4210 0.2112 0.5484 -0.0550 -0.0771 0.1338 120 PRO L C 9321 O O . PRO F 125 ? 0.4214 0.2524 0.5615 -0.0545 -0.0865 0.1481 120 PRO L O 9322 C CB . PRO F 125 ? 0.4307 0.1794 0.5036 -0.0822 -0.0882 0.1022 120 PRO L CB 9323 C CG . PRO F 125 ? 0.4412 0.1765 0.4829 -0.0921 -0.1051 0.0945 120 PRO L CG 9324 C CD . PRO F 125 ? 0.4352 0.1931 0.4782 -0.0886 -0.1182 0.0975 120 PRO L CD 9325 N N . SER F 126 ? 0.4253 0.2001 0.5802 -0.0451 -0.0532 0.1368 121 SER L N 9326 C CA . SER F 126 ? 0.4282 0.2249 0.6354 -0.0286 -0.0330 0.1621 121 SER L CA 9327 C C . SER F 126 ? 0.4329 0.2390 0.6591 -0.0342 -0.0228 0.1589 121 SER L C 9328 O O . SER F 126 ? 0.4359 0.2201 0.6382 -0.0510 -0.0217 0.1337 121 SER L O 9329 C CB . SER F 126 ? 0.4411 0.2065 0.6780 -0.0192 -0.0023 0.1606 121 SER L CB 9330 O OG . SER F 126 ? 0.4538 0.1896 0.6905 -0.0331 0.0174 0.1296 121 SER L OG 9331 N N . SER F 127 ? 0.4365 0.2817 0.7080 -0.0186 -0.0140 0.1878 122 SER L N 9332 C CA . SER F 127 ? 0.4406 0.3023 0.7381 -0.0215 -0.0019 0.1874 122 SER L CA 9333 C C . SER F 127 ? 0.4561 0.2760 0.7744 -0.0238 0.0330 0.1652 122 SER L C 9334 O O . SER F 127 ? 0.4581 0.2778 0.7730 -0.0374 0.0399 0.1476 122 SER L O 9335 C CB . SER F 127 ? 0.4411 0.3643 0.7904 0.0004 0.0016 0.2283 122 SER L CB 9336 O OG . SER F 127 ? 0.4525 0.3708 0.8465 0.0275 0.0255 0.2571 122 SER L OG 9337 N N . GLU F 128 ? 0.4683 0.2560 0.8090 -0.0137 0.0577 0.1631 123 GLU L N 9338 C CA . GLU F 128 ? 0.4892 0.2389 0.8468 -0.0233 0.0937 0.1303 123 GLU L CA 9339 C C . GLU F 128 ? 0.4846 0.2214 0.7823 -0.0519 0.0791 0.0911 123 GLU L C 9340 O O . GLU F 128 ? 0.4950 0.2293 0.7937 -0.0663 0.0974 0.0651 123 GLU L O 9341 C CB . GLU F 128 ? 0.5092 0.2238 0.8992 -0.0141 0.1240 0.1280 123 GLU L CB 9342 C CG . GLU F 128 ? 0.5255 0.2474 0.9849 0.0182 0.1488 0.1733 123 GLU L CG 9343 C CD . GLU F 128 ? 0.5180 0.2586 0.9658 0.0335 0.1251 0.2099 123 GLU L CD 9344 O OE1 . GLU F 128 ? 0.5391 0.2634 1.0340 0.0533 0.1535 0.2358 123 GLU L OE1 9345 O OE2 . GLU F 128 ? 0.4961 0.2673 0.8895 0.0244 0.0814 0.2118 123 GLU L OE2 9346 N N . GLN F 129 ? 0.4729 0.2066 0.7208 -0.0589 0.0481 0.0891 124 GLN L N 9347 C CA . GLN F 129 ? 0.4779 0.2056 0.6727 -0.0808 0.0345 0.0616 124 GLN L CA 9348 C C . GLN F 129 ? 0.4789 0.2245 0.6555 -0.0908 0.0217 0.0650 124 GLN L C 9349 O O . GLN F 129 ? 0.4902 0.2391 0.6496 -0.1067 0.0306 0.0451 124 GLN L O 9350 C CB . GLN F 129 ? 0.4667 0.1868 0.6191 -0.0819 0.0071 0.0624 124 GLN L CB 9351 C CG . GLN F 129 ? 0.4734 0.1933 0.5813 -0.0995 0.0001 0.0386 124 GLN L CG 9352 C CD . GLN F 129 ? 0.4650 0.1807 0.5336 -0.0977 -0.0267 0.0430 124 GLN L CD 9353 O OE1 . GLN F 129 ? 0.4542 0.1660 0.5194 -0.0876 -0.0447 0.0607 124 GLN L OE1 9354 N NE2 . GLN F 129 ? 0.4720 0.1962 0.5118 -0.1080 -0.0284 0.0261 124 GLN L NE2 9355 N N . LEU F 130 ? 0.4728 0.2365 0.6551 -0.0836 0.0029 0.0895 125 LEU L N 9356 C CA . LEU F 130 ? 0.4787 0.2604 0.6512 -0.0954 -0.0067 0.0932 125 LEU L CA 9357 C C . LEU F 130 ? 0.4964 0.2904 0.6984 -0.0996 0.0198 0.0855 125 LEU L C 9358 O O . LEU F 130 ? 0.5044 0.3047 0.6867 -0.1159 0.0190 0.0778 125 LEU L O 9359 C CB . LEU F 130 ? 0.4666 0.2777 0.6508 -0.0898 -0.0265 0.1154 125 LEU L CB 9360 C CG . LEU F 130 ? 0.4615 0.2638 0.6105 -0.0925 -0.0528 0.1160 125 LEU L CG 9361 C CD1 . LEU F 130 ? 0.4522 0.2983 0.6178 -0.0882 -0.0681 0.1330 125 LEU L CD1 9362 C CD2 . LEU F 130 ? 0.4735 0.2517 0.5809 -0.1110 -0.0636 0.1031 125 LEU L CD2 9363 N N . THR F 131 ? 0.5095 0.3064 0.7623 -0.0841 0.0465 0.0890 126 THR L N 9364 C CA . THR F 131 ? 0.5334 0.3384 0.8221 -0.0863 0.0791 0.0767 126 THR L CA 9365 C C . THR F 131 ? 0.5532 0.3457 0.8100 -0.1089 0.0937 0.0397 126 THR L C 9366 O O . THR F 131 ? 0.5626 0.3716 0.8241 -0.1208 0.1099 0.0264 126 THR L O 9367 C CB . THR F 131 ? 0.5504 0.3486 0.9059 -0.0629 0.1132 0.0858 126 THR L CB 9368 O OG1 . THR F 131 ? 0.5448 0.3725 0.9323 -0.0394 0.1000 0.1276 126 THR L OG1 9369 C CG2 . THR F 131 ? 0.5721 0.3744 0.9706 -0.0648 0.1533 0.0677 126 THR L CG2 9370 N N . SER F 132 ? 0.5564 0.3295 0.7819 -0.1154 0.0886 0.0232 127 SER L N 9371 C CA . SER F 132 ? 0.5748 0.3539 0.7658 -0.1381 0.0984 -0.0107 127 SER L CA 9372 C C . SER F 132 ? 0.5764 0.3712 0.7092 -0.1519 0.0700 -0.0026 127 SER L C 9373 O O . SER F 132 ? 0.5997 0.4152 0.7011 -0.1697 0.0759 -0.0231 127 SER L O 9374 C CB . SER F 132 ? 0.5795 0.3428 0.7651 -0.1407 0.1054 -0.0316 127 SER L CB 9375 O OG . SER F 132 ? 0.5921 0.3346 0.8375 -0.1296 0.1401 -0.0393 127 SER L OG 9376 N N . GLY F 133 ? 0.5581 0.3471 0.6792 -0.1445 0.0424 0.0269 128 GLY L N 9377 C CA . GLY F 133 ? 0.5597 0.3533 0.6363 -0.1554 0.0218 0.0394 128 GLY L CA 9378 C C . GLY F 133 ? 0.5539 0.3317 0.5943 -0.1511 -0.0016 0.0473 128 GLY L C 9379 O O . GLY F 133 ? 0.5605 0.3345 0.5706 -0.1556 -0.0163 0.0633 128 GLY L O 9380 N N . GLY F 134 ? 0.5383 0.3048 0.5866 -0.1412 -0.0024 0.0385 129 GLY L N 9381 C CA . GLY F 134 ? 0.5337 0.2891 0.5520 -0.1355 -0.0228 0.0441 129 GLY L CA 9382 C C . GLY F 134 ? 0.5163 0.2510 0.5444 -0.1223 -0.0405 0.0606 129 GLY L C 9383 O O . GLY F 134 ? 0.5053 0.2424 0.5665 -0.1160 -0.0360 0.0669 129 GLY L O 9384 N N . ALA F 135 ? 0.5146 0.2363 0.5161 -0.1176 -0.0593 0.0683 130 ALA L N 9385 C CA . ALA F 135 ? 0.5042 0.2123 0.5117 -0.1082 -0.0747 0.0773 130 ALA L CA 9386 C C . ALA F 135 ? 0.4992 0.1963 0.4859 -0.0997 -0.0868 0.0757 130 ALA L C 9387 O O . ALA F 135 ? 0.5151 0.2009 0.4787 -0.0991 -0.0958 0.0824 130 ALA L O 9388 C CB . ALA F 135 ? 0.5144 0.2156 0.5192 -0.1157 -0.0831 0.0874 130 ALA L CB 9389 N N . SER F 136 ? 0.4825 0.1827 0.4820 -0.0916 -0.0843 0.0698 131 SER L N 9390 C CA . SER F 136 ? 0.4780 0.1729 0.4616 -0.0838 -0.0943 0.0670 131 SER L CA 9391 C C . SER F 136 ? 0.4698 0.1610 0.4602 -0.0761 -0.1055 0.0740 131 SER L C 9392 O O . SER F 136 ? 0.4566 0.1601 0.4713 -0.0732 -0.1010 0.0806 131 SER L O 9393 C CB . SER F 136 ? 0.4736 0.1783 0.4662 -0.0843 -0.0810 0.0526 131 SER L CB 9394 O OG . SER F 136 ? 0.4863 0.2078 0.4659 -0.0955 -0.0725 0.0404 131 SER L OG 9395 N N . VAL F 137 ? 0.4776 0.1574 0.4482 -0.0726 -0.1182 0.0739 132 VAL L N 9396 C CA . VAL F 137 ? 0.4734 0.1560 0.4450 -0.0681 -0.1278 0.0734 132 VAL L CA 9397 C C . VAL F 137 ? 0.4690 0.1514 0.4310 -0.0583 -0.1306 0.0686 132 VAL L C 9398 O O . VAL F 137 ? 0.4771 0.1501 0.4235 -0.0544 -0.1330 0.0662 132 VAL L O 9399 C CB . VAL F 137 ? 0.4954 0.1622 0.4570 -0.0744 -0.1346 0.0697 132 VAL L CB 9400 C CG1 . VAL F 137 ? 0.4934 0.1788 0.4593 -0.0770 -0.1420 0.0626 132 VAL L CG1 9401 C CG2 . VAL F 137 ? 0.5073 0.1690 0.4749 -0.0867 -0.1293 0.0738 132 VAL L CG2 9402 N N . VAL F 138 ? 0.4591 0.1576 0.4333 -0.0533 -0.1294 0.0709 133 VAL L N 9403 C CA . VAL F 138 ? 0.4536 0.1560 0.4247 -0.0462 -0.1280 0.0667 133 VAL L CA 9404 C C . VAL F 138 ? 0.4593 0.1716 0.4225 -0.0415 -0.1379 0.0656 133 VAL L C 9405 O O . VAL F 138 ? 0.4539 0.1858 0.4236 -0.0439 -0.1416 0.0716 133 VAL L O 9406 C CB . VAL F 138 ? 0.4423 0.1533 0.4390 -0.0453 -0.1115 0.0717 133 VAL L CB 9407 C CG1 . VAL F 138 ? 0.4364 0.1532 0.4335 -0.0407 -0.1081 0.0678 133 VAL L CG1 9408 C CG2 . VAL F 138 ? 0.4452 0.1491 0.4499 -0.0537 -0.0974 0.0630 133 VAL L CG2 9409 N N . CYS F 139 ? 0.4696 0.1771 0.4197 -0.0356 -0.1415 0.0570 134 CYS L N 9410 C CA . CYS F 139 ? 0.4840 0.2026 0.4265 -0.0314 -0.1474 0.0510 134 CYS L CA 9411 C C . CYS F 139 ? 0.4732 0.2037 0.4173 -0.0246 -0.1434 0.0500 134 CYS L C 9412 O O . CYS F 139 ? 0.4735 0.1990 0.4145 -0.0216 -0.1416 0.0449 134 CYS L O 9413 C CB . CYS F 139 ? 0.5198 0.2171 0.4499 -0.0296 -0.1519 0.0392 134 CYS L CB 9414 S SG . CYS F 139 ? 0.5614 0.2735 0.4853 -0.0323 -0.1549 0.0220 134 CYS L SG 9415 N N . PHE F 140 ? 0.4635 0.2178 0.4135 -0.0232 -0.1414 0.0566 135 PHE L N 9416 C CA . PHE F 140 ? 0.4540 0.2207 0.4074 -0.0188 -0.1353 0.0561 135 PHE L CA 9417 C C . PHE F 140 ? 0.4637 0.2444 0.4015 -0.0146 -0.1428 0.0449 135 PHE L C 9418 O O . PHE F 140 ? 0.4765 0.2732 0.4069 -0.0180 -0.1485 0.0425 135 PHE L O 9419 C CB . PHE F 140 ? 0.4476 0.2313 0.4224 -0.0185 -0.1226 0.0766 135 PHE L CB 9420 C CG . PHE F 140 ? 0.4445 0.2105 0.4435 -0.0222 -0.1070 0.0839 135 PHE L CG 9421 C CD1 . PHE F 140 ? 0.4448 0.1933 0.4443 -0.0292 -0.1012 0.0661 135 PHE L CD1 9422 C CD2 . PHE F 140 ? 0.4472 0.2212 0.4719 -0.0186 -0.0952 0.1087 135 PHE L CD2 9423 C CE1 . PHE F 140 ? 0.4466 0.1818 0.4702 -0.0365 -0.0822 0.0651 135 PHE L CE1 9424 C CE2 . PHE F 140 ? 0.4501 0.2033 0.5043 -0.0213 -0.0745 0.1126 135 PHE L CE2 9425 C CZ . PHE F 140 ? 0.4498 0.1815 0.5026 -0.0323 -0.0670 0.0867 135 PHE L CZ 9426 N N . LEU F 141 ? 0.4612 0.2429 0.3960 -0.0089 -0.1413 0.0352 136 LEU L N 9427 C CA . LEU F 141 ? 0.4694 0.2660 0.3945 -0.0033 -0.1438 0.0228 136 LEU L CA 9428 C C . LEU F 141 ? 0.4586 0.2783 0.3915 -0.0019 -0.1359 0.0267 136 LEU L C 9429 O O . LEU F 141 ? 0.4518 0.2712 0.3904 0.0003 -0.1330 0.0213 136 LEU L O 9430 C CB . LEU F 141 ? 0.4815 0.2568 0.4017 0.0057 -0.1471 0.0093 136 LEU L CB 9431 C CG . LEU F 141 ? 0.4954 0.2398 0.4133 0.0029 -0.1499 0.0086 136 LEU L CG 9432 C CD1 . LEU F 141 ? 0.4895 0.2212 0.4114 0.0021 -0.1506 0.0215 136 LEU L CD1 9433 C CD2 . LEU F 141 ? 0.5240 0.2467 0.4424 0.0131 -0.1467 -0.0043 136 LEU L CD2 9434 N N . ASN F 142 ? 0.4576 0.3042 0.3916 -0.0045 -0.1315 0.0376 137 ASN L N 9435 C CA . ASN F 142 ? 0.4557 0.3186 0.4036 -0.0058 -0.1187 0.0485 137 ASN L CA 9436 C C . ASN F 142 ? 0.4640 0.3600 0.4036 -0.0030 -0.1167 0.0431 137 ASN L C 9437 O O . ASN F 142 ? 0.4702 0.3901 0.3938 -0.0024 -0.1228 0.0382 137 ASN L O 9438 C CB . ASN F 142 ? 0.4554 0.3218 0.4217 -0.0089 -0.1075 0.0774 137 ASN L CB 9439 C CG . ASN F 142 ? 0.4504 0.2841 0.4313 -0.0126 -0.1032 0.0795 137 ASN L CG 9440 O OD1 . ASN F 142 ? 0.4469 0.2609 0.4216 -0.0150 -0.1088 0.0601 137 ASN L OD1 9441 N ND2 . ASN F 142 ? 0.4534 0.2866 0.4549 -0.0117 -0.0924 0.1051 137 ASN L ND2 9442 N N . ASN F 143 ? 0.4606 0.3631 0.4124 -0.0043 -0.1064 0.0404 138 ASN L N 9443 C CA . ASN F 143 ? 0.4669 0.4035 0.4159 -0.0030 -0.1004 0.0382 138 ASN L CA 9444 C C . ASN F 143 ? 0.4724 0.4222 0.4022 0.0048 -0.1104 0.0140 138 ASN L C 9445 O O . ASN F 143 ? 0.4818 0.4618 0.3976 0.0040 -0.1106 0.0116 138 ASN L O 9446 C CB . ASN F 143 ? 0.4795 0.4425 0.4323 -0.0059 -0.0904 0.0678 138 ASN L CB 9447 C CG . ASN F 143 ? 0.4830 0.4244 0.4649 -0.0107 -0.0731 0.0934 138 ASN L CG 9448 O OD1 . ASN F 143 ? 0.4958 0.4241 0.4839 -0.0090 -0.0741 0.1108 138 ASN L OD1 9449 N ND2 . ASN F 143 ? 0.4857 0.4229 0.4897 -0.0178 -0.0543 0.0933 138 ASN L ND2 9450 N N . PHE F 144 ? 0.4661 0.3966 0.3981 0.0126 -0.1162 -0.0034 139 PHE L N 9451 C CA . PHE F 144 ? 0.4782 0.4130 0.4036 0.0239 -0.1187 -0.0252 139 PHE L CA 9452 C C . PHE F 144 ? 0.4748 0.4317 0.4134 0.0326 -0.1140 -0.0330 139 PHE L C 9453 O O . PHE F 144 ? 0.4576 0.4263 0.4089 0.0264 -0.1106 -0.0255 139 PHE L O 9454 C CB . PHE F 144 ? 0.4878 0.3841 0.4108 0.0310 -0.1259 -0.0330 139 PHE L CB 9455 C CG . PHE F 144 ? 0.4758 0.3521 0.4084 0.0351 -0.1307 -0.0224 139 PHE L CG 9456 C CD1 . PHE F 144 ? 0.4624 0.3229 0.3948 0.0241 -0.1335 -0.0087 139 PHE L CD1 9457 C CD2 . PHE F 144 ? 0.4804 0.3614 0.4234 0.0508 -0.1314 -0.0254 139 PHE L CD2 9458 C CE1 . PHE F 144 ? 0.4553 0.3067 0.3938 0.0251 -0.1367 -0.0033 139 PHE L CE1 9459 C CE2 . PHE F 144 ? 0.4748 0.3541 0.4237 0.0537 -0.1367 -0.0144 139 PHE L CE2 9460 C CZ . PHE F 144 ? 0.4619 0.3270 0.4064 0.0389 -0.1393 -0.0059 139 PHE L CZ 9461 N N . TYR F 145 ? 0.4903 0.4573 0.4289 0.0450 -0.1108 -0.0512 140 TYR L N 9462 C CA . TYR F 145 ? 0.4893 0.4833 0.4443 0.0579 -0.1063 -0.0585 140 TYR L CA 9463 C C . TYR F 145 ? 0.5159 0.5008 0.4759 0.0765 -0.1004 -0.0779 140 TYR L C 9464 O O . TYR F 145 ? 0.5338 0.5155 0.4814 0.0703 -0.0944 -0.0946 140 TYR L O 9465 C CB . TYR F 145 ? 0.4826 0.5201 0.4397 0.0474 -0.0971 -0.0578 140 TYR L CB 9466 C CG . TYR F 145 ? 0.4776 0.5510 0.4551 0.0578 -0.0933 -0.0647 140 TYR L CG 9467 C CD1 . TYR F 145 ? 0.4937 0.5857 0.4789 0.0754 -0.0867 -0.0812 140 TYR L CD1 9468 C CD2 . TYR F 145 ? 0.4608 0.5541 0.4530 0.0494 -0.0945 -0.0576 140 TYR L CD2 9469 C CE1 . TYR F 145 ? 0.4913 0.6247 0.4997 0.0880 -0.0835 -0.0845 140 TYR L CE1 9470 C CE2 . TYR F 145 ? 0.4580 0.5986 0.4706 0.0574 -0.0926 -0.0645 140 TYR L CE2 9471 C CZ . TYR F 145 ? 0.4712 0.6334 0.4924 0.0785 -0.0882 -0.0749 140 TYR L CZ 9472 O OH . TYR F 145 ? 0.4694 0.6871 0.5147 0.0886 -0.0864 -0.0786 140 TYR L OH 9473 N N . PRO F 146 ? 0.5237 0.5101 0.5052 0.0990 -0.0995 -0.0760 141 PRO L N 9474 C CA . PRO F 146 ? 0.5082 0.5209 0.5043 0.1054 -0.1071 -0.0589 141 PRO L CA 9475 C C . PRO F 146 ? 0.5027 0.4893 0.4925 0.0999 -0.1183 -0.0420 141 PRO L C 9476 O O . PRO F 146 ? 0.5079 0.4517 0.4834 0.0915 -0.1204 -0.0412 141 PRO L O 9477 C CB . PRO F 146 ? 0.5273 0.5563 0.5498 0.1367 -0.1007 -0.0592 141 PRO L CB 9478 C CG . PRO F 146 ? 0.5588 0.5374 0.5828 0.1477 -0.0892 -0.0724 141 PRO L CG 9479 C CD . PRO F 146 ? 0.5573 0.5243 0.5543 0.1209 -0.0872 -0.0915 141 PRO L CD 9480 N N . LYS F 147 ? 0.4976 0.5192 0.4980 0.1024 -0.1249 -0.0305 142 LYS L N 9481 C CA . LYS F 147 ? 0.4980 0.5103 0.4916 0.0933 -0.1340 -0.0177 142 LYS L CA 9482 C C . LYS F 147 ? 0.5277 0.5014 0.5215 0.1125 -0.1371 -0.0026 142 LYS L C 9483 O O . LYS F 147 ? 0.5209 0.4645 0.5022 0.1013 -0.1418 0.0040 142 LYS L O 9484 C CB . LYS F 147 ? 0.4907 0.5683 0.4955 0.0857 -0.1382 -0.0164 142 LYS L CB 9485 C CG . LYS F 147 ? 0.5005 0.6065 0.5088 0.0963 -0.1482 0.0009 142 LYS L CG 9486 C CD . LYS F 147 ? 0.4945 0.6887 0.5156 0.0867 -0.1517 -0.0045 142 LYS L CD 9487 C CE . LYS F 147 ? 0.5015 0.7489 0.5449 0.1103 -0.1503 -0.0016 142 LYS L CE 9488 N NZ . LYS F 147 ? 0.4999 0.8483 0.5572 0.1089 -0.1585 0.0024 142 LYS L NZ 9489 N N . ASP F 148 ? 0.5701 0.5398 0.5817 0.1415 -0.1306 0.0029 143 ASP L N 9490 C CA . ASP F 148 ? 0.6080 0.5367 0.6280 0.1622 -0.1272 0.0214 143 ASP L CA 9491 C C . ASP F 148 ? 0.6208 0.4813 0.6257 0.1468 -0.1220 0.0080 143 ASP L C 9492 O O . ASP F 148 ? 0.6293 0.4713 0.6308 0.1393 -0.1131 -0.0164 143 ASP L O 9493 C CB . ASP F 148 ? 0.6509 0.5814 0.7025 0.1979 -0.1131 0.0286 143 ASP L CB 9494 C CG . ASP F 148 ? 0.6528 0.6637 0.7230 0.2131 -0.1170 0.0365 143 ASP L CG 9495 O OD1 . ASP F 148 ? 0.6520 0.6833 0.7244 0.2069 -0.1115 0.0131 143 ASP L OD1 9496 O OD2 . ASP F 148 ? 0.6638 0.7253 0.7471 0.2308 -0.1250 0.0666 143 ASP L OD2 9497 N N . ILE F 149 ? 0.6237 0.4569 0.6194 0.1400 -0.1275 0.0229 144 ILE L N 9498 C CA . ILE F 149 ? 0.6344 0.4115 0.6182 0.1235 -0.1237 0.0118 144 ILE L CA 9499 C C . ILE F 149 ? 0.6524 0.3977 0.6390 0.1294 -0.1235 0.0353 144 ILE L C 9500 O O . ILE F 149 ? 0.6385 0.4147 0.6238 0.1353 -0.1323 0.0596 144 ILE L O 9501 C CB . ILE F 149 ? 0.6020 0.3884 0.5629 0.0933 -0.1328 -0.0005 144 ILE L CB 9502 C CG1 . ILE F 149 ? 0.6154 0.3635 0.5672 0.0776 -0.1282 -0.0170 144 ILE L CG1 9503 C CG2 . ILE F 149 ? 0.5807 0.3821 0.5334 0.0825 -0.1431 0.0159 144 ILE L CG2 9504 C CD1 . ILE F 149 ? 0.5933 0.3636 0.5293 0.0556 -0.1334 -0.0263 144 ILE L CD1 9505 N N . ASN F 150 ? 0.6856 0.3752 0.6756 0.1241 -0.1122 0.0260 145 ASN L N 9506 C CA . ASN F 150 ? 0.7110 0.3666 0.7050 0.1269 -0.1090 0.0489 145 ASN L CA 9507 C C . ASN F 150 ? 0.6986 0.3226 0.6767 0.0972 -0.1107 0.0317 145 ASN L C 9508 O O . ASN F 150 ? 0.7032 0.3098 0.6797 0.0821 -0.1038 0.0013 145 ASN L O 9509 C CB . ASN F 150 ? 0.7722 0.3870 0.7988 0.1546 -0.0866 0.0629 145 ASN L CB 9510 C CG . ASN F 150 ? 0.8079 0.4160 0.8437 0.1712 -0.0848 0.1072 145 ASN L CG 9511 O OD1 . ASN F 150 ? 0.8095 0.4706 0.8484 0.1921 -0.0939 0.1399 145 ASN L OD1 9512 N ND2 . ASN F 150 ? 0.8438 0.3942 0.8851 0.1612 -0.0717 0.1094 145 ASN L ND2 9513 N N . VAL F 151 ? 0.6765 0.3043 0.6431 0.0882 -0.1200 0.0506 146 VAL L N 9514 C CA . VAL F 151 ? 0.6624 0.2686 0.6178 0.0628 -0.1221 0.0405 146 VAL L CA 9515 C C . VAL F 151 ? 0.6858 0.2485 0.6531 0.0669 -0.1102 0.0582 146 VAL L C 9516 O O . VAL F 151 ? 0.7018 0.2660 0.6789 0.0886 -0.1062 0.0898 146 VAL L O 9517 C CB . VAL F 151 ? 0.6256 0.2676 0.5634 0.0478 -0.1372 0.0457 146 VAL L CB 9518 C CG1 . VAL F 151 ? 0.6194 0.2445 0.5510 0.0250 -0.1383 0.0380 146 VAL L CG1 9519 C CG2 . VAL F 151 ? 0.6030 0.2825 0.5354 0.0447 -0.1433 0.0321 146 VAL L CG2 9520 N N . LYS F 152 ? 0.6863 0.2163 0.6547 0.0456 -0.1032 0.0396 147 LYS L N 9521 C CA . LYS F 152 ? 0.7158 0.2012 0.6975 0.0435 -0.0888 0.0537 147 LYS L CA 9522 C C . LYS F 152 ? 0.6940 0.1790 0.6647 0.0128 -0.0945 0.0391 147 LYS L C 9523 O O . LYS F 152 ? 0.6818 0.1785 0.6479 -0.0070 -0.0972 0.0074 147 LYS L O 9524 C CB . LYS F 152 ? 0.7705 0.2038 0.7810 0.0505 -0.0620 0.0388 147 LYS L CB 9525 C CG . LYS F 152 ? 0.8215 0.1993 0.8554 0.0534 -0.0393 0.0597 147 LYS L CG 9526 C CD . LYS F 152 ? 0.8851 0.2093 0.9581 0.0727 -0.0065 0.0560 147 LYS L CD 9527 C CE . LYS F 152 ? 0.8988 0.2136 0.9775 0.0528 0.0044 -0.0022 147 LYS L CE 9528 N NZ . LYS F 152 ? 0.9721 0.2195 1.0964 0.0625 0.0462 -0.0164 147 LYS L NZ 9529 N N . TRP F 153 ? 0.6832 0.1648 0.6502 0.0096 -0.0963 0.0640 148 TRP L N 9530 C CA . TRP F 153 ? 0.6667 0.1480 0.6291 -0.0171 -0.0988 0.0539 148 TRP L CA 9531 C C . TRP F 153 ? 0.7124 0.1412 0.6957 -0.0289 -0.0765 0.0478 148 TRP L C 9532 O O . TRP F 153 ? 0.7490 0.1395 0.7491 -0.0118 -0.0591 0.0708 148 TRP L O 9533 C CB . TRP F 153 ? 0.6381 0.1464 0.5869 -0.0176 -0.1095 0.0788 148 TRP L CB 9534 C CG . TRP F 153 ? 0.5912 0.1465 0.5257 -0.0173 -0.1257 0.0740 148 TRP L CG 9535 C CD1 . TRP F 153 ? 0.5755 0.1597 0.5027 -0.0016 -0.1324 0.0837 148 TRP L CD1 9536 C CD2 . TRP F 153 ? 0.5598 0.1400 0.4909 -0.0338 -0.1337 0.0597 148 TRP L CD2 9537 N NE1 . TRP F 153 ? 0.5390 0.1559 0.4596 -0.0100 -0.1410 0.0729 148 TRP L NE1 9538 C CE2 . TRP F 153 ? 0.5306 0.1438 0.4549 -0.0269 -0.1413 0.0618 148 TRP L CE2 9539 C CE3 . TRP F 153 ? 0.5569 0.1399 0.4938 -0.0533 -0.1336 0.0472 148 TRP L CE3 9540 C CZ2 . TRP F 153 ? 0.5036 0.1422 0.4304 -0.0358 -0.1451 0.0557 148 TRP L CZ2 9541 C CZ3 . TRP F 153 ? 0.5255 0.1445 0.4628 -0.0595 -0.1413 0.0446 148 TRP L CZ3 9542 C CH2 . TRP F 153 ? 0.5001 0.1415 0.4340 -0.0493 -0.1452 0.0509 148 TRP L CH2 9543 N N . LYS F 154 ? 0.7102 0.1416 0.6961 -0.0582 -0.0750 0.0173 149 LYS L N 9544 C CA . LYS F 154 ? 0.7541 0.1420 0.7610 -0.0783 -0.0529 0.0063 149 LYS L CA 9545 C C . LYS F 154 ? 0.7305 0.1466 0.7307 -0.1031 -0.0627 0.0051 149 LYS L C 9546 O O . LYS F 154 ? 0.6877 0.1572 0.6727 -0.1097 -0.0833 -0.0013 149 LYS L O 9547 C CB . LYS F 154 ? 0.7915 0.1589 0.8158 -0.0954 -0.0349 -0.0396 149 LYS L CB 9548 C CG . LYS F 154 ? 0.8271 0.1535 0.8686 -0.0688 -0.0162 -0.0365 149 LYS L CG 9549 C CD . LYS F 154 ? 0.8788 0.1727 0.9452 -0.0894 0.0118 -0.0871 149 LYS L CD 9550 C CE . LYS F 154 ? 0.9103 0.1699 0.9964 -0.0590 0.0305 -0.0846 149 LYS L CE 9551 N NZ . LYS F 154 ? 0.9623 0.1976 1.0719 -0.0803 0.0595 -0.1434 149 LYS L NZ 9552 N N . ILE F 155 ? 0.7611 0.1415 0.7762 -0.1137 -0.0456 0.0171 150 ILE L N 9553 C CA . ILE F 155 ? 0.7457 0.1498 0.7601 -0.1380 -0.0503 0.0157 150 ILE L CA 9554 C C . ILE F 155 ? 0.7973 0.1607 0.8390 -0.1669 -0.0236 -0.0085 150 ILE L C 9555 O O . ILE F 155 ? 0.8460 0.1486 0.9069 -0.1599 0.0020 0.0089 150 ILE L O 9556 C CB . ILE F 155 ? 0.7307 0.1399 0.7343 -0.1236 -0.0551 0.0585 150 ILE L CB 9557 C CG1 . ILE F 155 ? 0.6786 0.1338 0.6587 -0.1032 -0.0784 0.0710 150 ILE L CG1 9558 C CG2 . ILE F 155 ? 0.7262 0.1526 0.7352 -0.1491 -0.0537 0.0569 150 ILE L CG2 9559 C CD1 . ILE F 155 ? 0.6705 0.1380 0.6383 -0.0902 -0.0807 0.1064 150 ILE L CD1 9560 N N . ASP F 156 ? 0.7908 0.1928 0.8369 -0.1996 -0.0279 -0.0478 151 ASP L N 9561 C CA . ASP F 156 ? 0.8441 0.2199 0.9177 -0.2359 -0.0017 -0.0854 151 ASP L CA 9562 C C . ASP F 156 ? 0.9052 0.2056 1.0015 -0.2279 0.0301 -0.0971 151 ASP L C 9563 O O . ASP F 156 ? 0.9633 0.1984 1.0896 -0.2380 0.0636 -0.0946 151 ASP L O 9564 C CB . ASP F 156 ? 0.8613 0.2216 0.9487 -0.2534 0.0103 -0.0678 151 ASP L CB 9565 C CG . ASP F 156 ? 0.8102 0.2480 0.8853 -0.2666 -0.0151 -0.0655 151 ASP L CG 9566 O OD1 . ASP F 156 ? 0.7830 0.2878 0.8518 -0.2800 -0.0330 -0.0936 151 ASP L OD1 9567 O OD2 . ASP F 156 ? 0.8000 0.2359 0.8742 -0.2628 -0.0152 -0.0337 151 ASP L OD2 9568 N N . GLY F 157 ? 0.8951 0.2028 0.9809 -0.2073 0.0225 -0.1062 152 GLY L N 9569 C CA . GLY F 157 ? 0.9540 0.1965 1.0650 -0.1961 0.0535 -0.1201 152 GLY L CA 9570 C C . GLY F 157 ? 0.9710 0.1615 1.0895 -0.1503 0.0631 -0.0645 152 GLY L C 9571 O O . GLY F 157 ? 0.9989 0.1548 1.1335 -0.1291 0.0800 -0.0682 152 GLY L O 9572 N N . SER F 158 ? 0.9584 0.1520 1.0663 -0.1349 0.0530 -0.0129 153 SER L N 9573 C CA . SER F 158 ? 0.9837 0.1435 1.0991 -0.0940 0.0625 0.0449 153 SER L CA 9574 C C . SER F 158 ? 0.9300 0.1460 1.0126 -0.0623 0.0289 0.0693 153 SER L C 9575 O O . SER F 158 ? 0.8675 0.1430 0.9190 -0.0700 -0.0016 0.0656 153 SER L O 9576 C CB . SER F 158 ? 1.0007 0.1458 1.1198 -0.0965 0.0710 0.0881 153 SER L CB 9577 O OG . SER F 158 ? 1.0569 0.1524 1.2081 -0.1305 0.1033 0.0642 153 SER L OG 9578 N N . GLU F 159 ? 0.9604 0.1573 1.0552 -0.0264 0.0383 0.0949 154 GLU L N 9579 C CA . GLU F 159 ? 0.9197 0.1716 0.9885 0.0027 0.0105 0.1195 154 GLU L CA 9580 C C . GLU F 159 ? 0.8969 0.1897 0.9418 0.0088 -0.0072 0.1623 154 GLU L C 9581 O O . GLU F 159 ? 0.9316 0.1995 0.9876 0.0079 0.0087 0.1933 154 GLU L O 9582 C CB . GLU F 159 ? 0.9591 0.1879 1.0525 0.0417 0.0273 0.1449 154 GLU L CB 9583 C CG . GLU F 159 ? 0.9152 0.2044 0.9861 0.0626 0.0002 0.1460 154 GLU L CG 9584 C CD . GLU F 159 ? 0.9495 0.2384 1.0428 0.1068 0.0115 0.1877 154 GLU L CD 9585 O OE1 . GLU F 159 ? 1.0189 0.2462 1.1543 0.1240 0.0468 0.2057 154 GLU L OE1 9586 O OE2 . GLU F 159 ? 0.9120 0.2659 0.9843 0.1242 -0.0132 0.2035 154 GLU L OE2 9587 N N . ARG F 160 ? 0.8444 0.2010 0.8583 0.0133 -0.0372 0.1619 155 ARG L N 9588 C CA . ARG F 160 ? 0.8250 0.2283 0.8156 0.0143 -0.0525 0.1907 155 ARG L CA 9589 C C . ARG F 160 ? 0.7966 0.2585 0.7692 0.0365 -0.0718 0.2039 155 ARG L C 9590 O O . ARG F 160 ? 0.7631 0.2453 0.7281 0.0347 -0.0849 0.1752 155 ARG L O 9591 C CB . ARG F 160 ? 0.7928 0.2160 0.7682 -0.0177 -0.0651 0.1614 155 ARG L CB 9592 C CG . ARG F 160 ? 0.7647 0.2387 0.7172 -0.0213 -0.0791 0.1783 155 ARG L CG 9593 C CD . ARG F 160 ? 0.8025 0.2682 0.7574 -0.0193 -0.0653 0.2167 155 ARG L CD 9594 N NE . ARG F 160 ? 0.7791 0.2999 0.7109 -0.0279 -0.0770 0.2231 155 ARG L NE 9595 C CZ . ARG F 160 ? 0.7801 0.3044 0.7097 -0.0491 -0.0726 0.2210 155 ARG L CZ 9596 N NH1 . ARG F 160 ? 0.7582 0.3356 0.6684 -0.0556 -0.0804 0.2222 155 ARG L NH1 9597 N NH2 . ARG F 160 ? 0.8056 0.2842 0.7543 -0.0659 -0.0578 0.2150 155 ARG L NH2 9598 N N . GLN F 161 ? 0.8183 0.3141 0.7851 0.0557 -0.0725 0.2479 156 GLN L N 9599 C CA . GLN F 161 ? 0.7988 0.3644 0.7497 0.0730 -0.0900 0.2595 156 GLN L CA 9600 C C . GLN F 161 ? 0.7784 0.4116 0.7009 0.0595 -0.1044 0.2650 156 GLN L C 9601 O O . GLN F 161 ? 0.7459 0.4290 0.6527 0.0522 -0.1197 0.2425 156 GLN L O 9602 C CB . GLN F 161 ? 0.8417 0.4147 0.8122 0.1104 -0.0795 0.3052 156 GLN L CB 9603 C CG . GLN F 161 ? 0.8490 0.3978 0.8406 0.1278 -0.0747 0.2875 156 GLN L CG 9604 C CD . GLN F 161 ? 0.9149 0.4219 0.9448 0.1613 -0.0485 0.3265 156 GLN L CD 9605 O OE1 . GLN F 161 ? 0.9370 0.4912 0.9760 0.1942 -0.0488 0.3733 156 GLN L OE1 9606 N NE2 . GLN F 161 ? 0.9530 0.3746 1.0102 0.1529 -0.0230 0.3073 156 GLN L NE2 9607 N N . ASN F 162 ? 0.8126 0.4488 0.7303 0.0544 -0.0963 0.2929 157 ASN L N 9608 C CA . ASN F 162 ? 0.8009 0.5083 0.6918 0.0403 -0.1066 0.2949 157 ASN L CA 9609 C C . ASN F 162 ? 0.7543 0.4582 0.6357 0.0096 -0.1131 0.2472 157 ASN L C 9610 O O . ASN F 162 ? 0.7579 0.4075 0.6507 -0.0042 -0.1068 0.2292 157 ASN L O 9611 C CB . ASN F 162 ? 0.8486 0.5680 0.7356 0.0430 -0.0948 0.3399 157 ASN L CB 9612 C CG . ASN F 162 ? 0.8688 0.5284 0.7639 0.0210 -0.0816 0.3299 157 ASN L CG 9613 O OD1 . ASN F 162 ? 0.8943 0.4794 0.8140 0.0212 -0.0684 0.3243 157 ASN L OD1 9614 N ND2 . ASN F 162 ? 0.8652 0.5615 0.7416 -0.0005 -0.0830 0.3243 157 ASN L ND2 9615 N N . GLY F 163 ? 0.7189 0.4849 0.5836 -0.0007 -0.1232 0.2270 158 GLY L N 9616 C CA . GLY F 163 ? 0.6793 0.4435 0.5429 -0.0249 -0.1247 0.1852 158 GLY L CA 9617 C C . GLY F 163 ? 0.6509 0.3970 0.5247 -0.0226 -0.1311 0.1570 158 GLY L C 9618 O O . GLY F 163 ? 0.6177 0.3505 0.4984 -0.0372 -0.1299 0.1299 158 GLY L O 9619 N N . VAL F 164 ? 0.6583 0.4065 0.5359 -0.0024 -0.1362 0.1673 159 VAL L N 9620 C CA . VAL F 164 ? 0.6365 0.3758 0.5220 0.0004 -0.1415 0.1430 159 VAL L CA 9621 C C . VAL F 164 ? 0.6220 0.4262 0.4998 -0.0012 -0.1474 0.1323 159 VAL L C 9622 O O . VAL F 164 ? 0.6461 0.5036 0.5150 0.0073 -0.1506 0.1523 159 VAL L O 9623 C CB . VAL F 164 ? 0.6567 0.3578 0.5551 0.0218 -0.1399 0.1543 159 VAL L CB 9624 C CG1 . VAL F 164 ? 0.6343 0.3346 0.5382 0.0231 -0.1449 0.1285 159 VAL L CG1 9625 C CG2 . VAL F 164 ? 0.6772 0.3158 0.5867 0.0172 -0.1298 0.1572 159 VAL L CG2 9626 N N . LEU F 165 ? 0.5947 0.4010 0.4779 -0.0139 -0.1470 0.1019 160 LEU L N 9627 C CA . LEU F 165 ? 0.5855 0.4483 0.4671 -0.0198 -0.1488 0.0850 160 LEU L CA 9628 C C . LEU F 165 ? 0.5656 0.4068 0.4597 -0.0170 -0.1492 0.0682 160 LEU L C 9629 O O . LEU F 165 ? 0.5476 0.3470 0.4506 -0.0237 -0.1444 0.0579 160 LEU L O 9630 C CB . LEU F 165 ? 0.5848 0.4800 0.4639 -0.0464 -0.1390 0.0605 160 LEU L CB 9631 C CG . LEU F 165 ? 0.6167 0.5586 0.4787 -0.0525 -0.1385 0.0738 160 LEU L CG 9632 C CD1 . LEU F 165 ? 0.6193 0.5827 0.4830 -0.0821 -0.1235 0.0408 160 LEU L CD1 9633 C CD2 . LEU F 165 ? 0.6291 0.6489 0.4785 -0.0418 -0.1486 0.0915 160 LEU L CD2 9634 N N . ASN F 166 ? 0.5619 0.4385 0.4573 -0.0054 -0.1549 0.0696 161 ASN L N 9635 C CA . ASN F 166 ? 0.5483 0.4134 0.4544 -0.0022 -0.1546 0.0553 161 ASN L CA 9636 C C . ASN F 166 ? 0.5293 0.4469 0.4407 -0.0176 -0.1505 0.0324 161 ASN L C 9637 O O . ASN F 166 ? 0.5376 0.5170 0.4431 -0.0240 -0.1526 0.0299 161 ASN L O 9638 C CB . ASN F 166 ? 0.5686 0.4272 0.4783 0.0244 -0.1607 0.0727 161 ASN L CB 9639 C CG . ASN F 166 ? 0.5948 0.3926 0.5060 0.0355 -0.1586 0.0870 161 ASN L CG 9640 O OD1 . ASN F 166 ? 0.5942 0.3545 0.5040 0.0219 -0.1552 0.0792 161 ASN L OD1 9641 N ND2 . ASN F 166 ? 0.6185 0.4078 0.5374 0.0600 -0.1577 0.1070 161 ASN L ND2 9642 N N . SER F 167 ? 0.5086 0.4074 0.4323 -0.0247 -0.1434 0.0159 162 SER L N 9643 C CA . SER F 167 ? 0.4987 0.4373 0.4337 -0.0428 -0.1340 -0.0085 162 SER L CA 9644 C C . SER F 167 ? 0.4917 0.4165 0.4368 -0.0345 -0.1330 -0.0100 162 SER L C 9645 O O . SER F 167 ? 0.4898 0.3677 0.4376 -0.0287 -0.1309 -0.0027 162 SER L O 9646 C CB . SER F 167 ? 0.4991 0.4220 0.4465 -0.0687 -0.1148 -0.0293 162 SER L CB 9647 O OG . SER F 167 ? 0.5050 0.4688 0.4671 -0.0914 -0.1004 -0.0586 162 SER L OG 9648 N N . TRP F 168 ? 0.4914 0.4664 0.4416 -0.0345 -0.1347 -0.0191 163 TRP L N 9649 C CA . TRP F 168 ? 0.4876 0.4583 0.4467 -0.0266 -0.1330 -0.0207 163 TRP L CA 9650 C C . TRP F 168 ? 0.4821 0.4744 0.4600 -0.0524 -0.1153 -0.0453 163 TRP L C 9651 O O . TRP F 168 ? 0.4853 0.5231 0.4692 -0.0738 -0.1083 -0.0663 163 TRP L O 9652 C CB . TRP F 168 ? 0.4967 0.5081 0.4535 -0.0035 -0.1460 -0.0099 163 TRP L CB 9653 C CG . TRP F 168 ? 0.5129 0.4993 0.4597 0.0224 -0.1567 0.0153 163 TRP L CG 9654 C CD1 . TRP F 168 ? 0.5222 0.4631 0.4690 0.0422 -0.1577 0.0252 163 TRP L CD1 9655 C CD2 . TRP F 168 ? 0.5274 0.5333 0.4655 0.0295 -0.1637 0.0333 163 TRP L CD2 9656 N NE1 . TRP F 168 ? 0.5459 0.4679 0.4892 0.0609 -0.1621 0.0471 163 TRP L NE1 9657 C CE2 . TRP F 168 ? 0.5442 0.5055 0.4816 0.0553 -0.1666 0.0568 163 TRP L CE2 9658 C CE3 . TRP F 168 ? 0.5345 0.5957 0.4660 0.0146 -0.1657 0.0308 163 TRP L CE3 9659 C CZ2 . TRP F 168 ? 0.5664 0.5302 0.4991 0.0696 -0.1702 0.0845 163 TRP L CZ2 9660 C CZ3 . TRP F 168 ? 0.5525 0.6273 0.4739 0.0292 -0.1728 0.0591 163 TRP L CZ3 9661 C CH2 . TRP F 168 ? 0.5693 0.5924 0.4928 0.0578 -0.1745 0.0889 163 TRP L CH2 9662 N N . THR F 169 ? 0.4770 0.4396 0.4652 -0.0520 -0.1056 -0.0433 164 THR L N 9663 C CA . THR F 169 ? 0.4768 0.4470 0.4888 -0.0746 -0.0831 -0.0607 164 THR L CA 9664 C C . THR F 169 ? 0.4733 0.4997 0.4900 -0.0738 -0.0869 -0.0713 164 THR L C 9665 O O . THR F 169 ? 0.4658 0.5105 0.4696 -0.0497 -0.1052 -0.0589 164 THR L O 9666 C CB . THR F 169 ? 0.4795 0.3968 0.5007 -0.0705 -0.0708 -0.0427 164 THR L CB 9667 O OG1 . THR F 169 ? 0.4921 0.3856 0.5405 -0.0919 -0.0429 -0.0507 164 THR L OG1 9668 C CG2 . THR F 169 ? 0.4776 0.4054 0.5003 -0.0612 -0.0704 -0.0349 164 THR L CG2 9669 N N . ASP F 170 ? 0.4803 0.5355 0.5199 -0.1009 -0.0668 -0.0958 165 ASP L N 9670 C CA . ASP F 170 ? 0.4763 0.5850 0.5263 -0.1039 -0.0660 -0.1067 165 ASP L CA 9671 C C . ASP F 170 ? 0.4690 0.5430 0.5212 -0.0896 -0.0610 -0.0878 165 ASP L C 9672 O O . ASP F 170 ? 0.4678 0.4865 0.5197 -0.0859 -0.0528 -0.0708 165 ASP L O 9673 C CB . ASP F 170 ? 0.4928 0.6369 0.5716 -0.1438 -0.0398 -0.1426 165 ASP L CB 9674 C CG . ASP F 170 ? 0.5027 0.7256 0.5787 -0.1629 -0.0471 -0.1706 165 ASP L CG 9675 O OD1 . ASP F 170 ? 0.5015 0.7584 0.5539 -0.1410 -0.0738 -0.1551 165 ASP L OD1 9676 O OD2 . ASP F 170 ? 0.5172 0.7735 0.6173 -0.2020 -0.0233 -0.2087 165 ASP L OD2 9677 N N . GLN F 171 ? 0.4626 0.5784 0.5182 -0.0822 -0.0650 -0.0904 166 GLN L N 9678 C CA . GLN F 171 ? 0.4611 0.5569 0.5183 -0.0729 -0.0576 -0.0761 166 GLN L CA 9679 C C . GLN F 171 ? 0.4780 0.5368 0.5573 -0.0953 -0.0276 -0.0725 166 GLN L C 9680 O O . GLN F 171 ? 0.4893 0.5590 0.5948 -0.1242 -0.0054 -0.0936 166 GLN L O 9681 C CB . GLN F 171 ? 0.4548 0.6107 0.5194 -0.0677 -0.0605 -0.0856 166 GLN L CB 9682 C CG . GLN F 171 ? 0.4534 0.5971 0.5122 -0.0530 -0.0571 -0.0711 166 GLN L CG 9683 C CD . GLN F 171 ? 0.4484 0.6494 0.5123 -0.0400 -0.0627 -0.0793 166 GLN L CD 9684 O OE1 . GLN F 171 ? 0.4411 0.6993 0.5245 -0.0539 -0.0584 -0.0968 166 GLN L OE1 9685 N NE2 . GLN F 171 ? 0.4508 0.6416 0.4999 -0.0150 -0.0702 -0.0696 166 GLN L NE2 9686 N N . ASP F 172 ? 0.4900 0.5092 0.5618 -0.0822 -0.0246 -0.0451 167 ASP L N 9687 C CA . ASP F 172 ? 0.5137 0.4988 0.6101 -0.0954 0.0052 -0.0278 167 ASP L CA 9688 C C . ASP F 172 ? 0.5287 0.5402 0.6482 -0.1104 0.0281 -0.0317 167 ASP L C 9689 O O . ASP F 172 ? 0.5265 0.5698 0.6322 -0.0983 0.0183 -0.0268 167 ASP L O 9690 C CB . ASP F 172 ? 0.5177 0.4758 0.5969 -0.0742 -0.0019 0.0081 167 ASP L CB 9691 C CG . ASP F 172 ? 0.5443 0.4741 0.6523 -0.0803 0.0291 0.0394 167 ASP L CG 9692 O OD1 . ASP F 172 ? 0.5627 0.5091 0.6826 -0.0830 0.0464 0.0553 167 ASP L OD1 9693 O OD2 . ASP F 172 ? 0.5516 0.4445 0.6725 -0.0798 0.0377 0.0526 167 ASP L OD2 9694 N N . SER F 173 ? 0.5520 0.5478 0.7097 -0.1379 0.0624 -0.0418 168 SER L N 9695 C CA . SER F 173 ? 0.5755 0.5921 0.7623 -0.1579 0.0906 -0.0476 168 SER L CA 9696 C C . SER F 173 ? 0.5861 0.5993 0.7699 -0.1426 0.0993 -0.0067 168 SER L C 9697 O O . SER F 173 ? 0.5975 0.6428 0.7933 -0.1525 0.1129 -0.0097 168 SER L O 9698 C CB . SER F 173 ? 0.6069 0.5906 0.8421 -0.1916 0.1342 -0.0641 168 SER L CB 9699 O OG . SER F 173 ? 0.6244 0.5454 0.8755 -0.1817 0.1535 -0.0290 168 SER L OG 9700 N N . LYS F 174 ? 0.5848 0.5688 0.7529 -0.1201 0.0917 0.0312 169 LYS L N 9701 C CA . LYS F 174 ? 0.6008 0.5914 0.7668 -0.1069 0.1022 0.0758 169 LYS L CA 9702 C C . LYS F 174 ? 0.5742 0.6074 0.6943 -0.0845 0.0692 0.0807 169 LYS L C 9703 O O . LYS F 174 ? 0.5803 0.6516 0.6955 -0.0845 0.0745 0.0863 169 LYS L O 9704 C CB . LYS F 174 ? 0.6263 0.5737 0.8104 -0.0973 0.1194 0.1193 169 LYS L CB 9705 C CG . LYS F 174 ? 0.6617 0.5603 0.9019 -0.1194 0.1639 0.1168 169 LYS L CG 9706 C CD . LYS F 174 ? 0.7016 0.5713 0.9775 -0.1089 0.1990 0.1762 169 LYS L CD 9707 C CE . LYS F 174 ? 0.7449 0.5781 1.0832 -0.1358 0.2544 0.1718 169 LYS L CE 9708 N NZ . LYS F 174 ? 0.7897 0.5846 1.1735 -0.1211 0.2947 0.2364 169 LYS L NZ 9709 N N . ASP F 175 ? 0.5455 0.5719 0.6346 -0.0679 0.0388 0.0755 170 ASP L N 9710 C CA . ASP F 175 ? 0.5285 0.5892 0.5782 -0.0498 0.0121 0.0723 170 ASP L CA 9711 C C . ASP F 175 ? 0.5043 0.5778 0.5377 -0.0434 -0.0114 0.0327 170 ASP L C 9712 O O . ASP F 175 ? 0.4977 0.5895 0.5047 -0.0285 -0.0290 0.0244 170 ASP L O 9713 C CB . ASP F 175 ? 0.5279 0.5788 0.5566 -0.0360 -0.0016 0.0969 170 ASP L CB 9714 C CG . ASP F 175 ? 0.5119 0.5252 0.5350 -0.0324 -0.0189 0.0817 170 ASP L CG 9715 O OD1 . ASP F 175 ? 0.4943 0.4946 0.5241 -0.0383 -0.0233 0.0529 170 ASP L OD1 9716 O OD2 . ASP F 175 ? 0.5156 0.5206 0.5273 -0.0242 -0.0282 0.1002 170 ASP L OD2 9717 N N . SER F 176 ? 0.4897 0.5570 0.5413 -0.0545 -0.0097 0.0093 171 SER L N 9718 C CA . SER F 176 ? 0.4722 0.5657 0.5158 -0.0458 -0.0290 -0.0196 171 SER L CA 9719 C C . SER F 176 ? 0.4593 0.5325 0.4775 -0.0251 -0.0539 -0.0215 171 SER L C 9720 O O . SER F 176 ? 0.4527 0.5447 0.4629 -0.0089 -0.0675 -0.0352 171 SER L O 9721 C CB . SER F 176 ? 0.4760 0.6185 0.5194 -0.0401 -0.0270 -0.0293 171 SER L CB 9722 O OG . SER F 176 ? 0.4886 0.6524 0.5576 -0.0614 -0.0021 -0.0285 171 SER L OG 9723 N N . THR F 177 ? 0.4589 0.4930 0.4689 -0.0250 -0.0566 -0.0059 172 THR L N 9724 C CA . THR F 177 ? 0.4529 0.4639 0.4429 -0.0104 -0.0764 -0.0083 172 THR L CA 9725 C C . THR F 177 ? 0.4441 0.4358 0.4409 -0.0153 -0.0819 -0.0148 172 THR L C 9726 O O . THR F 177 ? 0.4371 0.4330 0.4535 -0.0330 -0.0692 -0.0207 172 THR L O 9727 C CB . THR F 177 ? 0.4604 0.4519 0.4356 -0.0079 -0.0786 0.0111 172 THR L CB 9728 O OG1 . THR F 177 ? 0.4637 0.4360 0.4561 -0.0195 -0.0643 0.0321 172 THR L OG1 9729 C CG2 . THR F 177 ? 0.4720 0.4971 0.4334 -0.0039 -0.0757 0.0155 172 THR L CG2 9730 N N . TYR F 178 ? 0.4434 0.4161 0.4246 -0.0014 -0.0984 -0.0160 173 TYR L N 9731 C CA . TYR F 178 ? 0.4385 0.3947 0.4199 -0.0037 -0.1054 -0.0175 173 TYR L CA 9732 C C . TYR F 178 ? 0.4450 0.3600 0.4153 -0.0028 -0.1097 -0.0048 173 TYR L C 9733 O O . TYR F 178 ? 0.4522 0.3583 0.4104 0.0037 -0.1132 0.0012 173 TYR L O 9734 C CB . TYR F 178 ? 0.4392 0.4133 0.4165 0.0142 -0.1190 -0.0235 173 TYR L CB 9735 C CG . TYR F 178 ? 0.4342 0.4628 0.4257 0.0153 -0.1167 -0.0340 173 TYR L CG 9736 C CD1 . TYR F 178 ? 0.4385 0.4880 0.4332 0.0277 -0.1142 -0.0382 173 TYR L CD1 9737 C CD2 . TYR F 178 ? 0.4280 0.4960 0.4308 0.0017 -0.1160 -0.0428 173 TYR L CD2 9738 C CE1 . TYR F 178 ? 0.4347 0.5404 0.4457 0.0293 -0.1118 -0.0472 173 TYR L CE1 9739 C CE2 . TYR F 178 ? 0.4244 0.5562 0.4424 0.0003 -0.1147 -0.0538 173 TYR L CE2 9740 C CZ . TYR F 178 ? 0.4277 0.5767 0.4508 0.0156 -0.1130 -0.0540 173 TYR L CZ 9741 O OH . TYR F 178 ? 0.4251 0.6418 0.4661 0.0156 -0.1113 -0.0639 173 TYR L OH 9742 N N . SER F 179 ? 0.4439 0.3423 0.4190 -0.0118 -0.1086 -0.0037 174 SER L N 9743 C CA . SER F 179 ? 0.4442 0.3084 0.4129 -0.0119 -0.1119 0.0077 174 SER L CA 9744 C C . SER F 179 ? 0.4444 0.3008 0.4078 -0.0115 -0.1201 0.0032 174 SER L C 9745 O O . SER F 179 ? 0.4431 0.3261 0.4112 -0.0163 -0.1196 -0.0072 174 SER L O 9746 C CB . SER F 179 ? 0.4466 0.2975 0.4340 -0.0248 -0.0942 0.0193 174 SER L CB 9747 O OG . SER F 179 ? 0.4546 0.3160 0.4449 -0.0219 -0.0874 0.0342 174 SER L OG 9748 N N . MET F 180 ? 0.4476 0.2758 0.4018 -0.0079 -0.1268 0.0116 175 MET L N 9749 C CA . MET F 180 ? 0.4521 0.2736 0.3999 -0.0066 -0.1337 0.0119 175 MET L CA 9750 C C . MET F 180 ? 0.4493 0.2409 0.3959 -0.0124 -0.1328 0.0203 175 MET L C 9751 O O . MET F 180 ? 0.4458 0.2232 0.3905 -0.0104 -0.1344 0.0271 175 MET L O 9752 C CB . MET F 180 ? 0.4678 0.2877 0.4056 0.0118 -0.1444 0.0149 175 MET L CB 9753 C CG . MET F 180 ? 0.4821 0.2915 0.4137 0.0167 -0.1500 0.0247 175 MET L CG 9754 S SD . MET F 180 ? 0.5135 0.2976 0.4437 0.0396 -0.1533 0.0323 175 MET L SD 9755 C CE . MET F 180 ? 0.5332 0.3200 0.4611 0.0479 -0.1564 0.0539 175 MET L CE 9756 N N . SER F 181 ? 0.4473 0.2387 0.3952 -0.0208 -0.1301 0.0186 176 SER L N 9757 C CA . SER F 181 ? 0.4509 0.2171 0.3984 -0.0251 -0.1294 0.0264 176 SER L CA 9758 C C . SER F 181 ? 0.4637 0.2249 0.3967 -0.0185 -0.1394 0.0321 176 SER L C 9759 O O . SER F 181 ? 0.4740 0.2600 0.4010 -0.0141 -0.1430 0.0317 176 SER L O 9760 C CB . SER F 181 ? 0.4479 0.2149 0.4122 -0.0407 -0.1132 0.0200 176 SER L CB 9761 O OG . SER F 181 ? 0.4623 0.2564 0.4214 -0.0494 -0.1117 0.0063 176 SER L OG 9762 N N . SER F 182 ? 0.4751 0.2092 0.4045 -0.0177 -0.1425 0.0403 177 SER L N 9763 C CA . SER F 182 ? 0.4920 0.2143 0.4121 -0.0132 -0.1468 0.0499 177 SER L CA 9764 C C . SER F 182 ? 0.4929 0.2000 0.4165 -0.0253 -0.1426 0.0531 177 SER L C 9765 O O . SER F 182 ? 0.4925 0.1886 0.4240 -0.0299 -0.1415 0.0523 177 SER L O 9766 C CB . SER F 182 ? 0.5114 0.2099 0.4289 -0.0006 -0.1507 0.0533 177 SER L CB 9767 O OG . SER F 182 ? 0.5342 0.2150 0.4489 0.0048 -0.1496 0.0677 177 SER L OG 9768 N N . THR F 183 ? 0.4978 0.2144 0.4162 -0.0303 -0.1400 0.0577 178 THR L N 9769 C CA . THR F 183 ? 0.4981 0.2075 0.4219 -0.0426 -0.1331 0.0583 178 THR L CA 9770 C C . THR F 183 ? 0.5205 0.2225 0.4334 -0.0419 -0.1347 0.0726 178 THR L C 9771 O O . THR F 183 ? 0.5343 0.2602 0.4356 -0.0378 -0.1361 0.0811 178 THR L O 9772 C CB . THR F 183 ? 0.4888 0.2223 0.4213 -0.0553 -0.1207 0.0442 178 THR L CB 9773 O OG1 . THR F 183 ? 0.4838 0.2157 0.4334 -0.0557 -0.1139 0.0356 178 THR L OG1 9774 C CG2 . THR F 183 ? 0.4887 0.2154 0.4306 -0.0663 -0.1102 0.0435 178 THR L CG2 9775 N N . LEU F 184 ? 0.5291 0.2050 0.4473 -0.0468 -0.1335 0.0773 179 LEU L N 9776 C CA . LEU F 184 ? 0.5569 0.2193 0.4693 -0.0487 -0.1311 0.0924 179 LEU L CA 9777 C C . LEU F 184 ? 0.5534 0.2270 0.4699 -0.0633 -0.1232 0.0904 179 LEU L C 9778 O O . LEU F 184 ? 0.5432 0.2097 0.4746 -0.0711 -0.1204 0.0838 179 LEU L O 9779 C CB . LEU F 184 ? 0.5756 0.2015 0.4951 -0.0487 -0.1314 0.0933 179 LEU L CB 9780 C CG . LEU F 184 ? 0.6091 0.2122 0.5303 -0.0553 -0.1237 0.1071 179 LEU L CG 9781 C CD1 . LEU F 184 ? 0.6354 0.2429 0.5466 -0.0425 -0.1200 0.1328 179 LEU L CD1 9782 C CD2 . LEU F 184 ? 0.6303 0.1983 0.5632 -0.0606 -0.1200 0.0972 179 LEU L CD2 9783 N N . THR F 185 ? 0.5641 0.2641 0.4688 -0.0667 -0.1188 0.0964 180 THR L N 9784 C CA . THR F 185 ? 0.5649 0.2807 0.4739 -0.0818 -0.1079 0.0896 180 THR L CA 9785 C C . THR F 185 ? 0.5893 0.2957 0.4920 -0.0862 -0.1045 0.1093 180 THR L C 9786 O O . THR F 185 ? 0.6153 0.3264 0.5033 -0.0784 -0.1065 0.1315 180 THR L O 9787 C CB . THR F 185 ? 0.5649 0.3271 0.4658 -0.0899 -0.1010 0.0741 180 THR L CB 9788 O OG1 . THR F 185 ? 0.5485 0.3120 0.4636 -0.0902 -0.0979 0.0530 180 THR L OG1 9789 C CG2 . THR F 185 ? 0.5690 0.3487 0.4746 -0.1068 -0.0856 0.0635 180 THR L CG2 9790 N N . LEU F 186 ? 0.5862 0.2824 0.5036 -0.0976 -0.0973 0.1045 181 LEU L N 9791 C CA . LEU F 186 ? 0.6065 0.2927 0.5225 -0.1056 -0.0912 0.1207 181 LEU L CA 9792 C C . LEU F 186 ? 0.5987 0.3080 0.5241 -0.1199 -0.0788 0.1101 181 LEU L C 9793 O O . LEU F 186 ? 0.5807 0.3039 0.5203 -0.1218 -0.0731 0.0902 181 LEU L O 9794 C CB . LEU F 186 ? 0.6164 0.2650 0.5477 -0.1079 -0.0941 0.1222 181 LEU L CB 9795 C CG . LEU F 186 ? 0.6276 0.2479 0.5573 -0.0963 -0.1020 0.1233 181 LEU L CG 9796 C CD1 . LEU F 186 ? 0.6279 0.2317 0.5754 -0.1054 -0.1045 0.1083 181 LEU L CD1 9797 C CD2 . LEU F 186 ? 0.6660 0.2641 0.5874 -0.0883 -0.0962 0.1485 181 LEU L CD2 9798 N N . THR F 187 ? 0.6206 0.3316 0.5424 -0.1295 -0.0710 0.1243 182 THR L N 9799 C CA . THR F 187 ? 0.6132 0.3408 0.5508 -0.1432 -0.0579 0.1143 182 THR L CA 9800 C C . THR F 187 ? 0.5994 0.3069 0.5656 -0.1459 -0.0606 0.1100 182 THR L C 9801 O O . THR F 187 ? 0.5981 0.2788 0.5659 -0.1442 -0.0698 0.1160 182 THR L O 9802 C CB . THR F 187 ? 0.6470 0.3891 0.5711 -0.1543 -0.0476 0.1325 182 THR L CB 9803 O OG1 . THR F 187 ? 0.6729 0.3785 0.6001 -0.1552 -0.0496 0.1543 182 THR L OG1 9804 C CG2 . THR F 187 ? 0.6644 0.4456 0.5569 -0.1518 -0.0467 0.1427 182 THR L CG2 9805 N N . LYS F 188 ? 0.5836 0.3106 0.5749 -0.1505 -0.0506 0.0982 183 LYS L N 9806 C CA . LYS F 188 ? 0.5712 0.3006 0.5921 -0.1539 -0.0524 0.0984 183 LYS L CA 9807 C C . LYS F 188 ? 0.5887 0.3042 0.6054 -0.1683 -0.0540 0.1090 183 LYS L C 9808 O O . LYS F 188 ? 0.5861 0.2919 0.6119 -0.1726 -0.0629 0.1071 183 LYS L O 9809 C CB . LYS F 188 ? 0.5629 0.3211 0.6143 -0.1555 -0.0356 0.0911 183 LYS L CB 9810 C CG . LYS F 188 ? 0.5489 0.3286 0.6383 -0.1542 -0.0369 0.0953 183 LYS L CG 9811 C CD . LYS F 188 ? 0.5486 0.3556 0.6705 -0.1542 -0.0150 0.0915 183 LYS L CD 9812 C CE . LYS F 188 ? 0.5347 0.3738 0.7045 -0.1420 -0.0126 0.1007 183 LYS L CE 9813 N NZ . LYS F 188 ? 0.5375 0.4079 0.7224 -0.1550 -0.0194 0.1084 183 LYS L NZ 9814 N N . ASP F 189 ? 0.6127 0.3303 0.6166 -0.1781 -0.0426 0.1187 184 ASP L N 9815 C CA . ASP F 189 ? 0.6457 0.3453 0.6501 -0.1937 -0.0374 0.1315 184 ASP L CA 9816 C C . ASP F 189 ? 0.6581 0.3150 0.6536 -0.1913 -0.0442 0.1385 184 ASP L C 9817 O O . ASP F 189 ? 0.6678 0.3078 0.6797 -0.2059 -0.0418 0.1334 184 ASP L O 9818 C CB . ASP F 189 ? 0.6803 0.3917 0.6680 -0.2014 -0.0226 0.1479 184 ASP L CB 9819 C CG . ASP F 189 ? 0.6800 0.4319 0.6843 -0.2106 -0.0095 0.1367 184 ASP L CG 9820 O OD1 . ASP F 189 ? 0.6629 0.4308 0.6975 -0.2088 -0.0109 0.1211 184 ASP L OD1 9821 O OD2 . ASP F 189 ? 0.7114 0.4844 0.7005 -0.2181 0.0037 0.1455 184 ASP L OD2 9822 N N . GLU F 190 ? 0.6563 0.2997 0.6295 -0.1742 -0.0505 0.1467 185 GLU L N 9823 C CA . GLU F 190 ? 0.6735 0.2753 0.6431 -0.1673 -0.0539 0.1526 185 GLU L CA 9824 C C . GLU F 190 ? 0.6444 0.2418 0.6277 -0.1672 -0.0658 0.1281 185 GLU L C 9825 O O . GLU F 190 ? 0.6671 0.2351 0.6610 -0.1761 -0.0627 0.1200 185 GLU L O 9826 C CB . GLU F 190 ? 0.6874 0.2874 0.6329 -0.1464 -0.0574 0.1715 185 GLU L CB 9827 C CG . GLU F 190 ? 0.7250 0.2786 0.6734 -0.1359 -0.0547 0.1836 185 GLU L CG 9828 C CD . GLU F 190 ? 0.7417 0.3054 0.6705 -0.1120 -0.0582 0.2086 185 GLU L CD 9829 O OE1 . GLU F 190 ? 0.7172 0.3210 0.6305 -0.1036 -0.0705 0.1991 185 GLU L OE1 9830 O OE2 . GLU F 190 ? 0.7892 0.3231 0.7219 -0.1016 -0.0465 0.2387 185 GLU L OE2 9831 N N . TYR F 191 ? 0.5972 0.2260 0.5825 -0.1587 -0.0761 0.1157 186 TYR L N 9832 C CA . TYR F 191 ? 0.5714 0.2096 0.5683 -0.1571 -0.0876 0.0984 186 TYR L CA 9833 C C . TYR F 191 ? 0.5758 0.2286 0.5951 -0.1786 -0.0862 0.0864 186 TYR L C 9834 O O . TYR F 191 ? 0.5771 0.2314 0.6018 -0.1855 -0.0923 0.0706 186 TYR L O 9835 C CB . TYR F 191 ? 0.5344 0.2058 0.5377 -0.1443 -0.0928 0.0949 186 TYR L CB 9836 C CG . TYR F 191 ? 0.5125 0.2076 0.5307 -0.1413 -0.1033 0.0861 186 TYR L CG 9837 C CD1 . TYR F 191 ? 0.5145 0.1972 0.5215 -0.1358 -0.1127 0.0784 186 TYR L CD1 9838 C CD2 . TYR F 191 ? 0.4949 0.2320 0.5397 -0.1423 -0.1024 0.0884 186 TYR L CD2 9839 C CE1 . TYR F 191 ? 0.5006 0.2162 0.5177 -0.1343 -0.1223 0.0722 186 TYR L CE1 9840 C CE2 . TYR F 191 ? 0.4825 0.2551 0.5407 -0.1375 -0.1124 0.0880 186 TYR L CE2 9841 C CZ . TYR F 191 ? 0.4857 0.2499 0.5278 -0.1348 -0.1228 0.0795 186 TYR L CZ 9842 O OH . TYR F 191 ? 0.4745 0.2869 0.5280 -0.1311 -0.1324 0.0816 186 TYR L OH 9843 N N . GLU F 192 ? 0.5760 0.2472 0.6086 -0.1913 -0.0772 0.0911 187 GLU L N 9844 C CA . GLU F 192 ? 0.5844 0.2797 0.6408 -0.2154 -0.0748 0.0790 187 GLU L CA 9845 C C . GLU F 192 ? 0.6223 0.2768 0.6808 -0.2380 -0.0618 0.0726 187 GLU L C 9846 O O . GLU F 192 ? 0.6365 0.3109 0.7155 -0.2636 -0.0583 0.0547 187 GLU L O 9847 C CB . GLU F 192 ? 0.5735 0.3108 0.6496 -0.2198 -0.0685 0.0859 187 GLU L CB 9848 C CG . GLU F 192 ? 0.5413 0.3177 0.6297 -0.1984 -0.0746 0.0906 187 GLU L CG 9849 C CD . GLU F 192 ? 0.5362 0.3520 0.6518 -0.1998 -0.0635 0.0969 187 GLU L CD 9850 O OE1 . GLU F 192 ? 0.5576 0.3706 0.6756 -0.2172 -0.0520 0.0980 187 GLU L OE1 9851 O OE2 . GLU F 192 ? 0.5171 0.3665 0.6556 -0.1825 -0.0634 0.1026 187 GLU L OE2 9852 N N . ARG F 193 ? 0.6446 0.2452 0.6862 -0.2292 -0.0523 0.0875 188 ARG L N 9853 C CA . ARG F 193 ? 0.6930 0.2433 0.7446 -0.2473 -0.0333 0.0852 188 ARG L CA 9854 C C . ARG F 193 ? 0.7076 0.2329 0.7631 -0.2497 -0.0347 0.0604 188 ARG L C 9855 O O . ARG F 193 ? 0.7546 0.2286 0.8235 -0.2629 -0.0142 0.0537 188 ARG L O 9856 C CB . ARG F 193 ? 0.7248 0.2298 0.7633 -0.2337 -0.0180 0.1201 188 ARG L CB 9857 C CG . ARG F 193 ? 0.7271 0.2512 0.7608 -0.2373 -0.0092 0.1449 188 ARG L CG 9858 C CD . ARG F 193 ? 0.7653 0.2565 0.7835 -0.2208 0.0042 0.1850 188 ARG L CD 9859 N NE . ARG F 193 ? 0.8020 0.2891 0.8257 -0.2351 0.0254 0.2108 188 ARG L NE 9860 C CZ . ARG F 193 ? 0.8562 0.2957 0.9035 -0.2530 0.0510 0.2202 188 ARG L CZ 9861 N NH1 . ARG F 193 ? 0.8840 0.2730 0.9548 -0.2625 0.0614 0.1996 188 ARG L NH1 9862 N NH2 . ARG F 193 ? 0.8885 0.3311 0.9381 -0.2640 0.0700 0.2485 188 ARG L NH2 9863 N N . HIS F 194 ? 0.6704 0.2290 0.7165 -0.2366 -0.0548 0.0475 189 HIS L N 9864 C CA . HIS F 194 ? 0.6847 0.2288 0.7318 -0.2390 -0.0562 0.0217 189 HIS L CA 9865 C C . HIS F 194 ? 0.6551 0.2676 0.7042 -0.2454 -0.0756 -0.0010 189 HIS L C 9866 O O . HIS F 194 ? 0.6155 0.2780 0.6630 -0.2343 -0.0899 0.0126 189 HIS L O 9867 C CB . HIS F 194 ? 0.6832 0.1886 0.7119 -0.2077 -0.0579 0.0390 189 HIS L CB 9868 C CG . HIS F 194 ? 0.7211 0.1700 0.7501 -0.1974 -0.0386 0.0687 189 HIS L CG 9869 N ND1 . HIS F 194 ? 0.7790 0.1703 0.8294 -0.2105 -0.0121 0.0640 189 HIS L ND1 9870 C CD2 . HIS F 194 ? 0.7135 0.1610 0.7264 -0.1758 -0.0396 0.1057 189 HIS L CD2 9871 C CE1 . HIS F 194 ? 0.8071 0.1625 0.8556 -0.1926 0.0018 0.1047 189 HIS L CE1 9872 N NE2 . HIS F 194 ? 0.7667 0.1622 0.7898 -0.1725 -0.0164 0.1298 189 HIS L NE2 9873 N N . ASN F 195 ? 0.6823 0.3001 0.7377 -0.2636 -0.0729 -0.0352 190 ASN L N 9874 C CA . ASN F 195 ? 0.6618 0.3591 0.7186 -0.2736 -0.0905 -0.0564 190 ASN L CA 9875 C C . ASN F 195 ? 0.6466 0.3496 0.6853 -0.2529 -0.1020 -0.0600 190 ASN L C 9876 O O . ASN F 195 ? 0.6082 0.3656 0.6402 -0.2364 -0.1202 -0.0452 190 ASN L O 9877 C CB . ASN F 195 ? 0.7028 0.4260 0.7791 -0.3172 -0.0791 -0.0996 190 ASN L CB 9878 C CG . ASN F 195 ? 0.7198 0.4452 0.8173 -0.3412 -0.0669 -0.0969 190 ASN L CG 9879 O OD1 . ASN F 195 ? 0.6899 0.4508 0.7899 -0.3294 -0.0772 -0.0686 190 ASN L OD1 9880 N ND2 . ASN F 195 ? 0.7745 0.4583 0.8909 -0.3749 -0.0410 -0.1266 190 ASN L ND2 9881 N N . SER F 196 ? 0.6813 0.3258 0.7161 -0.2517 -0.0884 -0.0765 191 SER L N 9882 C CA . SER F 196 ? 0.6761 0.3285 0.6964 -0.2376 -0.0959 -0.0881 191 SER L CA 9883 C C . SER F 196 ? 0.6580 0.2670 0.6629 -0.1994 -0.0996 -0.0558 191 SER L C 9884 O O . SER F 196 ? 0.6777 0.2246 0.6851 -0.1880 -0.0859 -0.0393 191 SER L O 9885 C CB . SER F 196 ? 0.7290 0.3514 0.7598 -0.2614 -0.0753 -0.1331 191 SER L CB 9886 O OG . SER F 196 ? 0.7266 0.3573 0.7441 -0.2482 -0.0801 -0.1464 191 SER L OG 9887 N N . TYR F 197 ? 0.6244 0.2735 0.6153 -0.1807 -0.1171 -0.0454 192 TYR L N 9888 C CA . TYR F 197 ? 0.6083 0.2308 0.5858 -0.1491 -0.1214 -0.0205 192 TYR L CA 9889 C C . TYR F 197 ? 0.6102 0.2480 0.5776 -0.1392 -0.1268 -0.0341 192 TYR L C 9890 O O . TYR F 197 ? 0.5914 0.2871 0.5543 -0.1411 -0.1391 -0.0369 192 TYR L O 9891 C CB . TYR F 197 ? 0.5648 0.2166 0.5399 -0.1357 -0.1322 0.0081 192 TYR L CB 9892 C CG . TYR F 197 ? 0.5684 0.2015 0.5506 -0.1412 -0.1248 0.0235 192 TYR L CG 9893 C CD1 . TYR F 197 ? 0.5701 0.2308 0.5673 -0.1627 -0.1231 0.0176 192 TYR L CD1 9894 C CD2 . TYR F 197 ? 0.5719 0.1690 0.5458 -0.1263 -0.1189 0.0441 192 TYR L CD2 9895 C CE1 . TYR F 197 ? 0.5750 0.2204 0.5790 -0.1687 -0.1145 0.0314 192 TYR L CE1 9896 C CE2 . TYR F 197 ? 0.5787 0.1659 0.5565 -0.1326 -0.1109 0.0587 192 TYR L CE2 9897 C CZ . TYR F 197 ? 0.5784 0.1858 0.5714 -0.1537 -0.1080 0.0519 192 TYR L CZ 9898 O OH . TYR F 197 ? 0.5842 0.1839 0.5811 -0.1604 -0.0986 0.0663 192 TYR L OH 9899 N N . THR F 198 ? 0.6402 0.2299 0.6060 -0.1263 -0.1165 -0.0379 193 THR L N 9900 C CA . THR F 198 ? 0.6491 0.2486 0.6085 -0.1195 -0.1169 -0.0567 193 THR L CA 9901 C C . THR F 198 ? 0.6420 0.2219 0.5938 -0.0890 -0.1197 -0.0340 193 THR L C 9902 O O . THR F 198 ? 0.6522 0.1942 0.6075 -0.0746 -0.1134 -0.0120 193 THR L O 9903 C CB . THR F 198 ? 0.7001 0.2657 0.6733 -0.1364 -0.0957 -0.0940 193 THR L CB 9904 O OG1 . THR F 198 ? 0.7093 0.3088 0.6893 -0.1710 -0.0939 -0.1216 193 THR L OG1 9905 C CG2 . THR F 198 ? 0.7076 0.2855 0.6752 -0.1298 -0.0932 -0.1175 193 THR L CG2 9906 N N . CYS F 199 ? 0.6318 0.2472 0.5734 -0.0806 -0.1290 -0.0381 194 CYS L N 9907 C CA . CYS F 199 ? 0.6299 0.2410 0.5655 -0.0560 -0.1322 -0.0228 194 CYS L CA 9908 C C . CYS F 199 ? 0.6503 0.2597 0.5870 -0.0531 -0.1242 -0.0488 194 CYS L C 9909 O O . CYS F 199 ? 0.6477 0.2969 0.5782 -0.0670 -0.1275 -0.0704 194 CYS L O 9910 C CB . CYS F 199 ? 0.6012 0.2559 0.5290 -0.0518 -0.1455 -0.0060 194 CYS L CB 9911 S SG . CYS F 199 ? 0.6133 0.2766 0.5357 -0.0298 -0.1482 0.0048 194 CYS L SG 9912 N N . GLU F 200 ? 0.6750 0.2440 0.6219 -0.0350 -0.1119 -0.0459 195 GLU L N 9913 C CA . GLU F 200 ? 0.7009 0.2602 0.6560 -0.0295 -0.0984 -0.0723 195 GLU L CA 9914 C C . GLU F 200 ? 0.6831 0.2543 0.6367 -0.0017 -0.1027 -0.0554 195 GLU L C 9915 O O . GLU F 200 ? 0.6816 0.2354 0.6425 0.0193 -0.1020 -0.0268 195 GLU L O 9916 C CB . GLU F 200 ? 0.7570 0.2543 0.7376 -0.0293 -0.0720 -0.0845 195 GLU L CB 9917 C CG . GLU F 200 ? 0.7907 0.2783 0.7787 -0.0636 -0.0599 -0.1197 195 GLU L CG 9918 C CD . GLU F 200 ? 0.8646 0.2857 0.8856 -0.0670 -0.0243 -0.1438 195 GLU L CD 9919 O OE1 . GLU F 200 ? 0.8959 0.2831 0.9356 -0.0400 -0.0079 -0.1367 195 GLU L OE1 9920 O OE2 . GLU F 200 ? 0.8944 0.2970 0.9277 -0.0972 -0.0095 -0.1703 195 GLU L OE2 9921 N N . ALA F 201 ? 0.6660 0.2756 0.6105 -0.0033 -0.1068 -0.0728 196 ALA L N 9922 C CA . ALA F 201 ? 0.6463 0.2760 0.5906 0.0183 -0.1100 -0.0624 196 ALA L CA 9923 C C . ALA F 201 ? 0.6808 0.2964 0.6404 0.0279 -0.0913 -0.0882 196 ALA L C 9924 O O . ALA F 201 ? 0.6946 0.3247 0.6498 0.0099 -0.0839 -0.1233 196 ALA L O 9925 C CB . ALA F 201 ? 0.6076 0.2912 0.5341 0.0098 -0.1246 -0.0597 196 ALA L CB 9926 N N . THR F 202 ? 0.6948 0.2875 0.6745 0.0561 -0.0817 -0.0714 197 THR L N 9927 C CA . THR F 202 ? 0.7266 0.3080 0.7273 0.0711 -0.0611 -0.0925 197 THR L CA 9928 C C . THR F 202 ? 0.6927 0.3232 0.6893 0.0892 -0.0717 -0.0805 197 THR L C 9929 O O . THR F 202 ? 0.6637 0.3154 0.6582 0.1033 -0.0856 -0.0475 197 THR L O 9930 C CB . THR F 202 ? 0.7794 0.2983 0.8166 0.0920 -0.0352 -0.0823 197 THR L CB 9931 O OG1 . THR F 202 ? 0.8152 0.3207 0.8793 0.1078 -0.0103 -0.1055 197 THR L OG1 9932 C CG2 . THR F 202 ? 0.7695 0.2909 0.8141 0.1199 -0.0445 -0.0298 197 THR L CG2 9933 N N . HIS F 203 ? 0.6953 0.3506 0.6898 0.0844 -0.0643 -0.1108 198 HIS L N 9934 C CA . HIS F 203 ? 0.6675 0.3745 0.6563 0.0943 -0.0730 -0.1049 198 HIS L CA 9935 C C . HIS F 203 ? 0.7017 0.4140 0.7055 0.1011 -0.0518 -0.1381 198 HIS L C 9936 O O . HIS F 203 ? 0.7381 0.4285 0.7444 0.0853 -0.0349 -0.1741 198 HIS L O 9937 C CB . HIS F 203 ? 0.6262 0.3771 0.5843 0.0699 -0.0915 -0.1039 198 HIS L CB 9938 C CG . HIS F 203 ? 0.5961 0.3966 0.5500 0.0756 -0.0985 -0.0945 198 HIS L CG 9939 N ND1 . HIS F 203 ? 0.5941 0.4347 0.5375 0.0657 -0.0945 -0.1136 198 HIS L ND1 9940 C CD2 . HIS F 203 ? 0.5689 0.3906 0.5287 0.0871 -0.1074 -0.0700 198 HIS L CD2 9941 C CE1 . HIS F 203 ? 0.5698 0.4467 0.5149 0.0717 -0.0994 -0.0991 198 HIS L CE1 9942 N NE2 . HIS F 203 ? 0.5541 0.4213 0.5099 0.0832 -0.1071 -0.0754 198 HIS L NE2 9943 N N . LYS F 204 ? 0.6948 0.4412 0.7096 0.1214 -0.0509 -0.1307 199 LYS L N 9944 C CA . LYS F 204 ? 0.7345 0.4828 0.7711 0.1334 -0.0264 -0.1612 199 LYS L CA 9945 C C . LYS F 204 ? 0.7460 0.5243 0.7595 0.1038 -0.0202 -0.2053 199 LYS L C 9946 O O . LYS F 204 ? 0.7887 0.5573 0.8186 0.1039 0.0057 -0.2443 199 LYS L O 9947 C CB . LYS F 204 ? 0.7219 0.5100 0.7779 0.1622 -0.0273 -0.1416 199 LYS L CB 9948 C CG . LYS F 204 ? 0.6891 0.5428 0.7230 0.1484 -0.0389 -0.1486 199 LYS L CG 9949 C CD . LYS F 204 ? 0.6758 0.5734 0.7317 0.1742 -0.0412 -0.1277 199 LYS L CD 9950 C CE . LYS F 204 ? 0.7164 0.6126 0.8097 0.2019 -0.0147 -0.1449 199 LYS L CE 9951 N NZ . LYS F 204 ? 0.7230 0.6556 0.8046 0.1864 -0.0038 -0.1818 199 LYS L NZ 9952 N N . THR F 205 ? 0.7121 0.5306 0.6902 0.0790 -0.0416 -0.1982 200 THR L N 9953 C CA . THR F 205 ? 0.7195 0.5833 0.6718 0.0508 -0.0394 -0.2301 200 THR L CA 9954 C C . THR F 205 ? 0.7628 0.6044 0.7131 0.0273 -0.0256 -0.2698 200 THR L C 9955 O O . THR F 205 ? 0.7803 0.6716 0.7086 0.0011 -0.0232 -0.3003 200 THR L O 9956 C CB . THR F 205 ? 0.6755 0.5873 0.5964 0.0333 -0.0635 -0.2022 200 THR L CB 9957 O OG1 . THR F 205 ? 0.6554 0.5351 0.5735 0.0299 -0.0784 -0.1753 200 THR L OG1 9958 C CG2 . THR F 205 ? 0.6441 0.5904 0.5662 0.0458 -0.0701 -0.1766 200 THR L CG2 9959 N N . SER F 206 ? 0.7885 0.5630 0.7617 0.0338 -0.0155 -0.2698 201 SER L N 9960 C CA . SER F 206 ? 0.8377 0.5853 0.8179 0.0091 0.0052 -0.3157 201 SER L CA 9961 C C . SER F 206 ? 0.8764 0.5372 0.8976 0.0276 0.0280 -0.3120 201 SER L C 9962 O O . SER F 206 ? 0.8567 0.4868 0.8904 0.0548 0.0181 -0.2644 201 SER L O 9963 C CB . SER F 206 ? 0.8191 0.5997 0.7681 -0.0235 -0.0154 -0.3141 201 SER L CB 9964 O OG . SER F 206 ? 0.8684 0.6254 0.8271 -0.0508 0.0044 -0.3595 201 SER L OG 9965 N N . THR F 207 ? 0.9399 0.5644 0.9843 0.0117 0.0619 -0.3630 202 THR L N 9966 C CA . THR F 207 ? 0.9871 0.5229 1.0742 0.0241 0.0891 -0.3591 202 THR L CA 9967 C C . THR F 207 ? 0.9785 0.4986 1.0503 -0.0019 0.0748 -0.3496 202 THR L C 9968 O O . THR F 207 ? 0.9891 0.4504 1.0823 0.0146 0.0787 -0.3139 202 THR L O 9969 C CB . THR F 207 ? 1.0641 0.5584 1.1907 0.0153 0.1388 -0.4215 202 THR L CB 9970 O OG1 . THR F 207 ? 1.0815 0.6226 1.1820 -0.0353 0.1425 -0.4843 202 THR L OG1 9971 C CG2 . THR F 207 ? 1.0734 0.5832 1.2202 0.0459 0.1545 -0.4268 202 THR L CG2 9972 N N . SER F 208 ? 0.9603 0.5427 0.9950 -0.0410 0.0570 -0.3763 203 SER L N 9973 C CA . SER F 208 ? 0.9495 0.5305 0.9709 -0.0684 0.0435 -0.3714 203 SER L CA 9974 C C . SER F 208 ? 0.8804 0.4856 0.8761 -0.0531 0.0043 -0.3088 203 SER L C 9975 O O . SER F 208 ? 0.8320 0.5022 0.7989 -0.0505 -0.0202 -0.2918 203 SER L O 9976 C CB . SER F 208 ? 0.9579 0.6136 0.9524 -0.1152 0.0394 -0.4223 203 SER L CB 9977 O OG . SER F 208 ? 1.0263 0.6667 1.0436 -0.1389 0.0785 -0.4918 203 SER L OG 9978 N N . PRO F 209 ? 0.8762 0.4302 0.8840 -0.0455 0.0016 -0.2759 204 PRO L N 9979 C CA . PRO F 209 ? 0.8148 0.3956 0.7991 -0.0355 -0.0319 -0.2247 204 PRO L CA 9980 C C . PRO F 209 ? 0.7793 0.4323 0.7318 -0.0645 -0.0547 -0.2320 204 PRO L C 9981 O O . PRO F 209 ? 0.8015 0.4795 0.7507 -0.0969 -0.0468 -0.2729 204 PRO L O 9982 C CB . PRO F 209 ? 0.8297 0.3485 0.8323 -0.0298 -0.0258 -0.1982 204 PRO L CB 9983 C CG . PRO F 209 ? 0.8957 0.3665 0.9257 -0.0510 0.0078 -0.2420 204 PRO L CG 9984 C CD . PRO F 209 ? 0.9296 0.4052 0.9722 -0.0493 0.0304 -0.2846 204 PRO L CD 9985 N N . ILE F 210 ? 0.7250 0.4161 0.6582 -0.0530 -0.0803 -0.1927 205 ILE L N 9986 C CA . ILE F 210 ? 0.6935 0.4471 0.6049 -0.0725 -0.1004 -0.1834 205 ILE L CA 9987 C C . ILE F 210 ? 0.6800 0.4085 0.5962 -0.0778 -0.1084 -0.1600 205 ILE L C 9988 O O . ILE F 210 ? 0.6553 0.3508 0.5763 -0.0583 -0.1143 -0.1253 205 ILE L O 9989 C CB . ILE F 210 ? 0.6545 0.4551 0.5506 -0.0581 -0.1170 -0.1516 205 ILE L CB 9990 C CG1 . ILE F 210 ? 0.6692 0.5045 0.5589 -0.0562 -0.1087 -0.1754 205 ILE L CG1 9991 C CG2 . ILE F 210 ? 0.6295 0.4898 0.5121 -0.0724 -0.1336 -0.1317 205 ILE L CG2 9992 C CD1 . ILE F 210 ? 0.6380 0.5061 0.5193 -0.0398 -0.1188 -0.1440 205 ILE L CD1 9993 N N . VAL F 211 ? 0.6944 0.4493 0.6088 -0.1068 -0.1083 -0.1818 206 VAL L N 9994 C CA . VAL F 211 ? 0.6904 0.4220 0.6134 -0.1172 -0.1108 -0.1696 206 VAL L CA 9995 C C . VAL F 211 ? 0.6508 0.4503 0.5621 -0.1257 -0.1319 -0.1458 206 VAL L C 9996 O O . VAL F 211 ? 0.6501 0.5243 0.5506 -0.1430 -0.1384 -0.1604 206 VAL L O 9997 C CB . VAL F 211 ? 0.7428 0.4560 0.6804 -0.1481 -0.0905 -0.2165 206 VAL L CB 9998 C CG1 . VAL F 211 ? 0.7442 0.4300 0.6933 -0.1595 -0.0905 -0.2032 206 VAL L CG1 9999 C CG2 . VAL F 211 ? 0.7886 0.4334 0.7463 -0.1388 -0.0622 -0.2422 206 VAL L CG2 10000 N N . LYS F 212 ? 0.6224 0.4011 0.5381 -0.1129 -0.1404 -0.1083 207 LYS L N 10001 C CA . LYS F 212 ? 0.5946 0.4281 0.5093 -0.1181 -0.1548 -0.0834 207 LYS L CA 10002 C C . LYS F 212 ? 0.5939 0.3930 0.5213 -0.1241 -0.1530 -0.0733 207 LYS L C 10003 O O . LYS F 212 ? 0.5886 0.3272 0.5206 -0.1097 -0.1477 -0.0583 207 LYS L O 10004 C CB . LYS F 212 ? 0.5590 0.4082 0.4708 -0.0945 -0.1633 -0.0449 207 LYS L CB 10005 C CG . LYS F 212 ? 0.5591 0.4686 0.4596 -0.0921 -0.1673 -0.0444 207 LYS L CG 10006 C CD . LYS F 212 ? 0.5698 0.5660 0.4668 -0.1109 -0.1752 -0.0472 207 LYS L CD 10007 C CE . LYS F 212 ? 0.5651 0.6328 0.4532 -0.1026 -0.1802 -0.0257 207 LYS L CE 10008 N NZ . LYS F 212 ? 0.5869 0.6583 0.4587 -0.1063 -0.1738 -0.0577 207 LYS L NZ 10009 N N . SER F 213 ? 0.5965 0.4443 0.5293 -0.1459 -0.1577 -0.0798 208 SER L N 10010 C CA . SER F 213 ? 0.5990 0.4212 0.5455 -0.1559 -0.1543 -0.0742 208 SER L CA 10011 C C . SER F 213 ? 0.5816 0.4778 0.5366 -0.1657 -0.1658 -0.0583 208 SER L C 10012 O O . SER F 213 ? 0.5674 0.5413 0.5185 -0.1656 -0.1763 -0.0504 208 SER L O 10013 C CB . SER F 213 ? 0.6429 0.4244 0.5977 -0.1805 -0.1371 -0.1139 208 SER L CB 10014 O OG . SER F 213 ? 0.6638 0.5100 0.6184 -0.2115 -0.1369 -0.1514 208 SER L OG 10015 N N . PHE F 214 ? 0.5841 0.4588 0.5527 -0.1713 -0.1626 -0.0485 209 PHE L N 10016 C CA . PHE F 214 ? 0.5774 0.5206 0.5609 -0.1826 -0.1704 -0.0365 209 PHE L CA 10017 C C . PHE F 214 ? 0.6029 0.5120 0.5996 -0.2038 -0.1603 -0.0508 209 PHE L C 10018 O O . PHE F 214 ? 0.6167 0.4443 0.6118 -0.2001 -0.1478 -0.0531 209 PHE L O 10019 C CB . PHE F 214 ? 0.5390 0.4990 0.5329 -0.1542 -0.1761 0.0100 209 PHE L CB 10020 C CG . PHE F 214 ? 0.5283 0.4148 0.5265 -0.1400 -0.1672 0.0259 209 PHE L CG 10021 C CD1 . PHE F 214 ? 0.5239 0.3544 0.5095 -0.1216 -0.1629 0.0310 209 PHE L CD1 10022 C CD2 . PHE F 214 ? 0.5265 0.4100 0.5412 -0.1473 -0.1627 0.0339 209 PHE L CD2 10023 C CE1 . PHE F 214 ? 0.5187 0.2982 0.5058 -0.1119 -0.1552 0.0433 209 PHE L CE1 10024 C CE2 . PHE F 214 ? 0.5207 0.3475 0.5363 -0.1369 -0.1536 0.0463 209 PHE L CE2 10025 C CZ . PHE F 214 ? 0.5171 0.2951 0.5177 -0.1199 -0.1503 0.0505 209 PHE L CZ 10026 N N . ASN F 215 ? 0.6146 0.5933 0.6258 -0.2255 -0.1650 -0.0568 210 ASN L N 10027 C CA . ASN F 215 ? 0.6399 0.5987 0.6677 -0.2464 -0.1554 -0.0655 210 ASN L CA 10028 C C . ASN F 215 ? 0.6187 0.6018 0.6633 -0.2299 -0.1605 -0.0262 210 ASN L C 10029 O O . ASN F 215 ? 0.6037 0.6681 0.6599 -0.2211 -0.1722 -0.0047 210 ASN L O 10030 C CB . ASN F 215 ? 0.6707 0.6951 0.7073 -0.2878 -0.1541 -0.1068 210 ASN L CB 10031 C CG . ASN F 215 ? 0.7147 0.6968 0.7420 -0.3096 -0.1391 -0.1553 210 ASN L CG 10032 O OD1 . ASN F 215 ? 0.7185 0.6501 0.7303 -0.2888 -0.1363 -0.1536 210 ASN L OD1 10033 N ND2 . ASN F 215 ? 0.7565 0.7553 0.7976 -0.3520 -0.1259 -0.2004 210 ASN L ND2 10034 N N . ARG F 216 ? 0.6329 0.5483 0.6813 -0.2245 -0.1493 -0.0150 211 ARG L N 10035 C CA . ARG F 216 ? 0.6208 0.5489 0.6860 -0.2093 -0.1488 0.0169 211 ARG L CA 10036 C C . ARG F 216 ? 0.6411 0.6574 0.7328 -0.2246 -0.1541 0.0199 211 ARG L C 10037 O O . ARG F 216 ? 0.6135 0.6741 0.7250 -0.2040 -0.1574 0.0512 211 ARG L O 10038 C CB . ARG F 216 ? 0.6294 0.4824 0.6920 -0.2114 -0.1340 0.0200 211 ARG L CB 10039 C CG . ARG F 216 ? 0.6047 0.4599 0.6797 -0.1933 -0.1297 0.0486 211 ARG L CG 10040 C CD . ARG F 216 ? 0.6205 0.4168 0.6893 -0.1989 -0.1153 0.0515 211 ARG L CD 10041 N NE . ARG F 216 ? 0.6283 0.4526 0.7186 -0.2196 -0.1083 0.0498 211 ARG L NE 10042 C CZ . ARG F 216 ? 0.6586 0.4771 0.7552 -0.2499 -0.1012 0.0299 211 ARG L CZ 10043 N NH1 . ARG F 216 ? 0.6882 0.4671 0.7733 -0.2629 -0.0972 0.0084 211 ARG L NH1 10044 N NH2 . ARG F 216 ? 0.6651 0.5165 0.7838 -0.2683 -0.0945 0.0298 211 ARG L NH2 10045 N N . ASN F 217 ? 0.7032 0.7447 0.7997 -0.2612 -0.1517 -0.0135 212 ASN L N 10046 C CA . ASN F 217 ? 0.7357 0.8763 0.8583 -0.2828 -0.1576 -0.0175 212 ASN L CA 10047 C C . ASN F 217 ? 0.7467 1.0046 0.8795 -0.2704 -0.1761 0.0025 212 ASN L C 10048 O O . ASN F 217 ? 0.7404 1.0960 0.8982 -0.2830 -0.1827 0.0074 212 ASN L O 10049 C CB . ASN F 217 ? 0.7790 0.9234 0.9040 -0.3312 -0.1483 -0.0676 212 ASN L CB 10050 C CG . ASN F 217 ? 0.8096 0.9296 0.9128 -0.3454 -0.1458 -0.1050 212 ASN L CG 10051 O OD1 . ASN F 217 ? 0.8251 0.8439 0.9123 -0.3341 -0.1338 -0.1087 212 ASN L OD1 10052 N ND2 . ASN F 217 ? 0.8231 1.0422 0.9271 -0.3711 -0.1555 -0.1341 212 ASN L ND2 10053 N N . GLU F 218 ? 0.7757 1.0303 0.8914 -0.2452 -0.1835 0.0178 213 GLU L N 10054 C CA . GLU F 218 ? 0.7987 1.1635 0.9224 -0.2303 -0.1988 0.0441 213 GLU L CA 10055 C C . GLU F 218 ? 0.8034 1.1525 0.9412 -0.1833 -0.1963 0.0984 213 GLU L C 10056 O O . GLU F 218 ? 0.8047 1.2313 0.9522 -0.1630 -0.2046 0.1315 213 GLU L O 10057 C CB . GLU F 218 ? 0.8205 1.2083 0.9146 -0.2452 -0.2062 0.0138 213 GLU L CB 10058 C CG . GLU F 218 ? 0.8584 1.2114 0.9387 -0.2901 -0.1973 -0.0489 213 GLU L CG 10059 C CD . GLU F 218 ? 0.8782 1.2730 0.9352 -0.3106 -0.2014 -0.0869 213 GLU L CD 10060 O OE1 . GLU F 218 ? 0.8530 1.2461 0.8925 -0.2848 -0.2074 -0.0677 213 GLU L OE1 10061 O OE2 . GLU F 218 ? 0.9121 1.3395 0.9698 -0.3554 -0.1954 -0.1400 213 GLU L OE2 10062 N N . CYS F 219 ? 0.8352 1.0880 0.9765 -0.1676 -0.1820 0.1072 214 CYS L N 10063 C CA . CYS F 219 ? 0.8329 1.0525 0.9892 -0.1287 -0.1723 0.1470 214 CYS L CA 10064 C C . CYS F 219 ? 0.8225 1.0599 1.0204 -0.1140 -0.1604 0.1751 214 CYS L C 10065 O O . CYS F 219 ? 0.8136 1.1462 1.0423 -0.1116 -0.1658 0.1965 214 CYS L O 10066 C CB . CYS F 219 ? 0.8392 0.9456 0.9687 -0.1233 -0.1625 0.1314 214 CYS L CB 10067 S SG . CYS F 219 ? 0.8619 0.9428 0.9507 -0.1297 -0.1719 0.1062 214 CYS L SG # 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 PCA 1 1 1 PCA PCA B . n A 1 2 VAL 2 2 2 VAL VAL B . n A 1 3 GLN 3 3 3 GLN GLN B . n A 1 4 LEU 4 4 4 LEU LEU B . n A 1 5 LYS 5 5 5 LYS LYS B . n A 1 6 GLU 6 6 6 GLU GLU B . n A 1 7 SER 7 7 7 SER SER B . n A 1 8 GLY 8 8 8 GLY GLY B . n A 1 9 PRO 9 9 9 PRO PRO B . n A 1 10 GLY 10 10 10 GLY GLY B . n A 1 11 LEU 11 11 11 LEU LEU B . n A 1 12 VAL 12 12 12 VAL VAL B . n A 1 13 GLN 13 13 13 GLN GLN B . n A 1 14 PRO 14 14 14 PRO PRO B . n A 1 15 SER 15 15 15 SER SER B . n A 1 16 GLN 16 16 16 GLN GLN B . n A 1 17 SER 17 17 17 SER SER B . n A 1 18 LEU 18 18 18 LEU LEU B . n A 1 19 SER 19 19 19 SER SER B . n A 1 20 ILE 20 20 20 ILE ILE B . n A 1 21 THR 21 21 21 THR THR B . n A 1 22 CYS 22 22 22 CYS CYS B . n A 1 23 THR 23 23 23 THR THR B . n A 1 24 VAL 24 24 24 VAL VAL B . n A 1 25 SER 25 25 25 SER SER B . n A 1 26 GLY 26 26 26 GLY GLY B . n A 1 27 PHE 27 27 27 PHE PHE B . n A 1 28 SER 28 28 28 SER SER B . n A 1 29 LEU 29 29 29 LEU LEU B . n A 1 30 THR 30 30 30 THR THR B . n A 1 31 THR 31 31 31 THR THR B . n A 1 32 TYR 32 32 32 TYR TYR B . n A 1 33 GLY 33 33 33 GLY GLY B . n A 1 34 VAL 34 34 34 VAL VAL B . n A 1 35 HIS 35 35 35 HIS HIS B . n A 1 36 TRP 36 36 36 TRP TRP B . n A 1 37 VAL 37 37 37 VAL VAL B . n A 1 38 ARG 38 38 38 ARG ARG B . n A 1 39 GLN 39 39 39 GLN GLN B . n A 1 40 SER 40 40 40 SER SER B . n A 1 41 PRO 41 41 41 PRO PRO B . n A 1 42 GLY 42 42 42 GLY GLY B . n A 1 43 LYS 43 43 43 LYS LYS B . n A 1 44 GLY 44 44 44 GLY GLY B . n A 1 45 LEU 45 45 45 LEU LEU B . n A 1 46 GLU 46 46 46 GLU GLU B . n A 1 47 TRP 47 47 47 TRP TRP B . n A 1 48 LEU 48 48 48 LEU LEU B . n A 1 49 GLY 49 49 49 GLY GLY B . n A 1 50 VAL 50 50 50 VAL VAL B . n A 1 51 ILE 51 51 51 ILE ILE B . n A 1 52 TRP 52 52 52 TRP TRP B . n A 1 53 SER 53 53 53 SER SER B . n A 1 54 GLY 54 54 54 GLY GLY B . n A 1 55 GLY 55 55 55 GLY GLY B . n A 1 56 SER 56 56 56 SER SER B . n A 1 57 THR 57 57 57 THR THR B . n A 1 58 ASP 58 58 58 ASP ASP B . n A 1 59 TYR 59 59 59 TYR TYR B . n A 1 60 ASN 60 60 60 ASN ASN B . n A 1 61 ALA 61 61 61 ALA ALA B . n A 1 62 ALA 62 62 62 ALA ALA B . n A 1 63 PHE 63 63 63 PHE PHE B . n A 1 64 ILE 64 64 64 ILE ILE B . n A 1 65 SER 65 65 65 SER SER B . n A 1 66 ARG 66 66 66 ARG ARG B . n A 1 67 LEU 67 67 67 LEU LEU B . n A 1 68 SER 68 68 68 SER SER B . n A 1 69 ILE 69 69 69 ILE ILE B . n A 1 70 SER 70 70 70 SER SER B . n A 1 71 LYS 71 71 71 LYS LYS B . n A 1 72 ASP 72 72 72 ASP ASP B . n A 1 73 ASN 73 73 73 ASN ASN B . n A 1 74 SER 74 74 74 SER SER B . n A 1 75 LYS 75 75 75 LYS LYS B . n A 1 76 SER 76 76 76 SER SER B . n A 1 77 HIS 77 77 77 HIS HIS B . n A 1 78 VAL 78 78 78 VAL VAL B . n A 1 79 PHE 79 79 79 PHE PHE B . n A 1 80 PHE 80 80 80 PHE PHE B . n A 1 81 LYS 81 81 81 LYS LYS B . n A 1 82 MET 82 82 82 MET MET B . n A 1 83 ASN 83 82 82 ASN ASN B A n A 1 84 SER 84 82 82 SER SER B B n A 1 85 LEU 85 82 82 LEU LEU B C n A 1 86 GLN 86 83 83 GLN GLN B . n A 1 87 ALA 87 84 84 ALA ALA B . n A 1 88 ASN 88 85 85 ASN ASN B . n A 1 89 ASP 89 86 86 ASP ASP B . n A 1 90 THR 90 87 87 THR THR B . n A 1 91 ALA 91 88 88 ALA ALA B . n A 1 92 ILE 92 89 89 ILE ILE B . n A 1 93 TYR 93 90 90 TYR TYR B . n A 1 94 TYR 94 91 91 TYR TYR B . n A 1 95 CYS 95 92 92 CYS CYS B . n A 1 96 ALA 96 93 93 ALA ALA B . n A 1 97 ARG 97 94 94 ARG ARG B . n A 1 98 MET 98 95 95 MET MET B . n A 1 99 ARG 99 96 96 ARG ARG B . n A 1 100 ILE 100 97 97 ILE ILE B . n A 1 101 THR 101 98 98 THR THR B . n A 1 102 THR 102 99 99 THR THR B . n A 1 103 ASP 103 100 100 ASP ASP B . n A 1 104 TRP 104 100 100 TRP TRP B A n A 1 105 PHE 105 100 100 PHE PHE B B n A 1 106 ALA 106 101 101 ALA ALA B . n A 1 107 TYR 107 102 102 TYR TYR B . n A 1 108 TRP 108 103 103 TRP TRP B . n A 1 109 GLY 109 104 104 GLY GLY B . n A 1 110 GLN 110 105 105 GLN GLN B . n A 1 111 GLY 111 106 106 GLY GLY B . n A 1 112 THR 112 107 107 THR THR B . n A 1 113 LEU 113 108 108 LEU LEU B . n A 1 114 VAL 114 109 109 VAL VAL B . n A 1 115 THR 115 110 110 THR THR B . n A 1 116 VAL 116 111 111 VAL VAL B . n A 1 117 SER 117 112 112 SER SER B . n A 1 118 ALA 118 113 113 ALA ALA B . n A 1 119 ALA 119 114 114 ALA ALA B . n A 1 120 LYS 120 115 115 LYS LYS B . n A 1 121 THR 121 116 116 THR THR B . n A 1 122 THR 122 117 117 THR THR B . n A 1 123 PRO 123 118 118 PRO PRO B . n A 1 124 PRO 124 119 119 PRO PRO B . n A 1 125 SER 125 120 120 SER SER B . n A 1 126 VAL 126 121 121 VAL VAL B . n A 1 127 TYR 127 122 122 TYR TYR B . n A 1 128 PRO 128 123 123 PRO PRO B . n A 1 129 LEU 129 124 124 LEU LEU B . n A 1 130 ALA 130 125 125 ALA ALA B . n A 1 131 PRO 131 126 126 PRO PRO B . n A 1 132 GLY 132 127 127 GLY GLY B . n A 1 133 SER 133 128 128 SER SER B . n A 1 134 ALA 134 129 129 ALA ALA B . n A 1 135 ALA 135 130 130 ALA ALA B . n A 1 136 GLN 136 131 131 GLN GLN B . n A 1 137 THR 137 132 132 THR THR B . n A 1 138 ASN 138 133 133 ASN ASN B . n A 1 139 SER 139 134 134 SER SER B . n A 1 140 MET 140 135 135 MET MET B . n A 1 141 VAL 141 136 136 VAL VAL B . n A 1 142 THR 142 137 137 THR THR B . n A 1 143 LEU 143 138 138 LEU LEU B . n A 1 144 GLY 144 139 139 GLY GLY B . n A 1 145 CYS 145 140 140 CYS CYS B . n A 1 146 LEU 146 141 141 LEU LEU B . n A 1 147 VAL 147 142 142 VAL VAL B . n A 1 148 LYS 148 143 143 LYS LYS B . n A 1 149 GLY 149 144 144 GLY GLY B . n A 1 150 TYR 150 145 145 TYR TYR B . n A 1 151 PHE 151 146 146 PHE PHE B . n A 1 152 PRO 152 147 147 PRO PRO B . n A 1 153 GLU 153 148 148 GLU GLU B . n A 1 154 PRO 154 149 149 PRO PRO B . n A 1 155 VAL 155 150 150 VAL VAL B . n A 1 156 THR 156 151 151 THR THR B . n A 1 157 VAL 157 152 152 VAL VAL B . n A 1 158 THR 158 153 153 THR THR B . n A 1 159 TRP 159 154 154 TRP TRP B . n A 1 160 ASN 160 155 155 ASN ASN B . n A 1 161 SER 161 156 156 SER SER B . n A 1 162 GLY 162 157 157 GLY GLY B . n A 1 163 SER 163 158 158 SER SER B . n A 1 164 LEU 164 159 159 LEU LEU B . n A 1 165 SER 165 160 160 SER SER B . n A 1 166 SER 166 161 161 SER SER B . n A 1 167 GLY 167 162 162 GLY GLY B . n A 1 168 VAL 168 163 163 VAL VAL B . n A 1 169 HIS 169 164 164 HIS HIS B . n A 1 170 THR 170 165 165 THR THR B . n A 1 171 PHE 171 166 166 PHE PHE B . n A 1 172 PRO 172 167 167 PRO PRO B . n A 1 173 ALA 173 168 168 ALA ALA B . n A 1 174 VAL 174 169 169 VAL VAL B . n A 1 175 LEU 175 170 170 LEU LEU B . n A 1 176 GLN 176 171 171 GLN GLN B . n A 1 177 SER 177 172 172 SER SER B . n A 1 178 ASP 178 173 173 ASP ASP B . n A 1 179 LEU 179 174 174 LEU LEU B . n A 1 180 TYR 180 175 175 TYR TYR B . n A 1 181 THR 181 176 176 THR THR B . n A 1 182 LEU 182 177 177 LEU LEU B . n A 1 183 SER 183 178 178 SER SER B . n A 1 184 SER 184 179 179 SER SER B . n A 1 185 SER 185 180 180 SER SER B . n A 1 186 VAL 186 181 181 VAL VAL B . n A 1 187 THR 187 182 182 THR THR B . n A 1 188 VAL 188 183 183 VAL VAL B . n A 1 189 PRO 189 184 184 PRO PRO B . n A 1 190 SER 190 185 185 SER SER B . n A 1 191 SER 191 186 186 SER SER B . n A 1 192 THR 192 187 187 THR THR B . n A 1 193 TRP 193 188 188 TRP TRP B . n A 1 194 PRO 194 189 189 PRO PRO B . n A 1 195 SER 195 190 190 SER SER B . n A 1 196 GLU 196 191 191 GLU GLU B . n A 1 197 THR 197 192 192 THR THR B . n A 1 198 VAL 198 193 193 VAL VAL B . n A 1 199 THR 199 194 194 THR THR B . n A 1 200 CYS 200 195 195 CYS CYS B . n A 1 201 ASN 201 196 196 ASN ASN B . n A 1 202 VAL 202 197 197 VAL VAL B . n A 1 203 ALA 203 198 198 ALA ALA B . n A 1 204 HIS 204 199 199 HIS HIS B . n A 1 205 PRO 205 200 200 PRO PRO B . n A 1 206 ALA 206 201 201 ALA ALA B . n A 1 207 SER 207 202 202 SER SER B . n A 1 208 SER 208 203 203 SER SER B . n A 1 209 THR 209 204 204 THR THR B . n A 1 210 LYS 210 205 205 LYS LYS B . n A 1 211 VAL 211 206 206 VAL VAL B . n A 1 212 ASP 212 207 207 ASP ASP B . n A 1 213 LYS 213 208 208 LYS LYS B . n A 1 214 LYS 214 209 209 LYS LYS B . n A 1 215 ILE 215 210 210 ILE ILE B . n A 1 216 VAL 216 211 211 VAL VAL B . n A 1 217 PRO 217 212 212 PRO PRO B . n A 1 218 ARG 218 213 213 ARG ARG B . n A 1 219 ASP 219 214 ? ? ? B . n B 1 1 PCA 1 1 ? ? ? E . n B 1 2 VAL 2 2 ? ? ? E . n B 1 3 GLN 3 3 ? ? ? E . n B 1 4 LEU 4 4 4 LEU LEU E . n B 1 5 LYS 5 5 5 LYS LYS E . n B 1 6 GLU 6 6 6 GLU GLU E . n B 1 7 SER 7 7 7 SER SER E . n B 1 8 GLY 8 8 8 GLY GLY E . n B 1 9 PRO 9 9 9 PRO PRO E . n B 1 10 GLY 10 10 10 GLY GLY E . n B 1 11 LEU 11 11 11 LEU LEU E . n B 1 12 VAL 12 12 12 VAL VAL E . n B 1 13 GLN 13 13 13 GLN GLN E . n B 1 14 PRO 14 14 14 PRO PRO E . n B 1 15 SER 15 15 15 SER SER E . n B 1 16 GLN 16 16 16 GLN GLN E . n B 1 17 SER 17 17 17 SER SER E . n B 1 18 LEU 18 18 18 LEU LEU E . n B 1 19 SER 19 19 19 SER SER E . n B 1 20 ILE 20 20 20 ILE ILE E . n B 1 21 THR 21 21 21 THR THR E . n B 1 22 CYS 22 22 22 CYS CYS E . n B 1 23 THR 23 23 23 THR THR E . n B 1 24 VAL 24 24 24 VAL VAL E . n B 1 25 SER 25 25 25 SER SER E . n B 1 26 GLY 26 26 26 GLY GLY E . n B 1 27 PHE 27 27 27 PHE PHE E . n B 1 28 SER 28 28 28 SER SER E . n B 1 29 LEU 29 29 29 LEU LEU E . n B 1 30 THR 30 30 30 THR THR E . n B 1 31 THR 31 31 31 THR THR E . n B 1 32 TYR 32 32 32 TYR TYR E . n B 1 33 GLY 33 33 33 GLY GLY E . n B 1 34 VAL 34 34 34 VAL VAL E . n B 1 35 HIS 35 35 35 HIS HIS E . n B 1 36 TRP 36 36 36 TRP TRP E . n B 1 37 VAL 37 37 37 VAL VAL E . n B 1 38 ARG 38 38 38 ARG ARG E . n B 1 39 GLN 39 39 39 GLN GLN E . n B 1 40 SER 40 40 40 SER SER E . n B 1 41 PRO 41 41 41 PRO PRO E . n B 1 42 GLY 42 42 42 GLY GLY E . n B 1 43 LYS 43 43 43 LYS LYS E . n B 1 44 GLY 44 44 44 GLY GLY E . n B 1 45 LEU 45 45 45 LEU LEU E . n B 1 46 GLU 46 46 46 GLU GLU E . n B 1 47 TRP 47 47 47 TRP TRP E . n B 1 48 LEU 48 48 48 LEU LEU E . n B 1 49 GLY 49 49 49 GLY GLY E . n B 1 50 VAL 50 50 50 VAL VAL E . n B 1 51 ILE 51 51 51 ILE ILE E . n B 1 52 TRP 52 52 52 TRP TRP E . n B 1 53 SER 53 53 53 SER SER E . n B 1 54 GLY 54 54 54 GLY GLY E . n B 1 55 GLY 55 55 55 GLY GLY E . n B 1 56 SER 56 56 56 SER SER E . n B 1 57 THR 57 57 57 THR THR E . n B 1 58 ASP 58 58 58 ASP ASP E . n B 1 59 TYR 59 59 59 TYR TYR E . n B 1 60 ASN 60 60 60 ASN ASN E . n B 1 61 ALA 61 61 61 ALA ALA E . n B 1 62 ALA 62 62 62 ALA ALA E . n B 1 63 PHE 63 63 63 PHE PHE E . n B 1 64 ILE 64 64 64 ILE ILE E . n B 1 65 SER 65 65 65 SER SER E . n B 1 66 ARG 66 66 66 ARG ARG E . n B 1 67 LEU 67 67 67 LEU LEU E . n B 1 68 SER 68 68 68 SER SER E . n B 1 69 ILE 69 69 69 ILE ILE E . n B 1 70 SER 70 70 70 SER SER E . n B 1 71 LYS 71 71 71 LYS LYS E . n B 1 72 ASP 72 72 72 ASP ASP E . n B 1 73 ASN 73 73 73 ASN ASN E . n B 1 74 SER 74 74 74 SER SER E . n B 1 75 LYS 75 75 75 LYS LYS E . n B 1 76 SER 76 76 76 SER SER E . n B 1 77 HIS 77 77 77 HIS HIS E . n B 1 78 VAL 78 78 78 VAL VAL E . n B 1 79 PHE 79 79 79 PHE PHE E . n B 1 80 PHE 80 80 80 PHE PHE E . n B 1 81 LYS 81 81 81 LYS LYS E . n B 1 82 MET 82 82 82 MET MET E . n B 1 83 ASN 83 82 82 ASN ASN E A n B 1 84 SER 84 82 82 SER SER E B n B 1 85 LEU 85 82 82 LEU LEU E C n B 1 86 GLN 86 83 83 GLN GLN E . n B 1 87 ALA 87 84 84 ALA ALA E . n B 1 88 ASN 88 85 85 ASN ASN E . n B 1 89 ASP 89 86 86 ASP ASP E . n B 1 90 THR 90 87 87 THR THR E . n B 1 91 ALA 91 88 88 ALA ALA E . n B 1 92 ILE 92 89 89 ILE ILE E . n B 1 93 TYR 93 90 90 TYR TYR E . n B 1 94 TYR 94 91 91 TYR TYR E . n B 1 95 CYS 95 92 92 CYS CYS E . n B 1 96 ALA 96 93 93 ALA ALA E . n B 1 97 ARG 97 94 94 ARG ARG E . n B 1 98 MET 98 95 95 MET MET E . n B 1 99 ARG 99 96 96 ARG ARG E . n B 1 100 ILE 100 97 97 ILE ILE E . n B 1 101 THR 101 98 98 THR THR E . n B 1 102 THR 102 99 99 THR THR E . n B 1 103 ASP 103 100 100 ASP ASP E . n B 1 104 TRP 104 100 100 TRP TRP E A n B 1 105 PHE 105 100 100 PHE PHE E B n B 1 106 ALA 106 101 101 ALA ALA E . n B 1 107 TYR 107 102 102 TYR TYR E . n B 1 108 TRP 108 103 103 TRP TRP E . n B 1 109 GLY 109 104 104 GLY GLY E . n B 1 110 GLN 110 105 105 GLN GLN E . n B 1 111 GLY 111 106 106 GLY GLY E . n B 1 112 THR 112 107 107 THR THR E . n B 1 113 LEU 113 108 108 LEU LEU E . n B 1 114 VAL 114 109 109 VAL VAL E . n B 1 115 THR 115 110 110 THR THR E . n B 1 116 VAL 116 111 111 VAL VAL E . n B 1 117 SER 117 112 112 SER SER E . n B 1 118 ALA 118 113 113 ALA ALA E . n B 1 119 ALA 119 114 114 ALA ALA E . n B 1 120 LYS 120 115 115 LYS LYS E . n B 1 121 THR 121 116 116 THR THR E . n B 1 122 THR 122 117 117 THR THR E . n B 1 123 PRO 123 118 118 PRO PRO E . n B 1 124 PRO 124 119 119 PRO PRO E . n B 1 125 SER 125 120 120 SER SER E . n B 1 126 VAL 126 121 121 VAL VAL E . n B 1 127 TYR 127 122 122 TYR TYR E . n B 1 128 PRO 128 123 123 PRO PRO E . n B 1 129 LEU 129 124 124 LEU LEU E . n B 1 130 ALA 130 125 125 ALA ALA E . n B 1 131 PRO 131 126 126 PRO PRO E . n B 1 132 GLY 132 127 127 GLY GLY E . n B 1 133 SER 133 128 128 SER SER E . n B 1 134 ALA 134 129 129 ALA ALA E . n B 1 135 ALA 135 130 130 ALA ALA E . n B 1 136 GLN 136 131 131 GLN GLN E . n B 1 137 THR 137 132 132 THR THR E . n B 1 138 ASN 138 133 133 ASN ASN E . n B 1 139 SER 139 134 134 SER SER E . n B 1 140 MET 140 135 135 MET MET E . n B 1 141 VAL 141 136 136 VAL VAL E . n B 1 142 THR 142 137 137 THR THR E . n B 1 143 LEU 143 138 138 LEU LEU E . n B 1 144 GLY 144 139 139 GLY GLY E . n B 1 145 CYS 145 140 140 CYS CYS E . n B 1 146 LEU 146 141 141 LEU LEU E . n B 1 147 VAL 147 142 142 VAL VAL E . n B 1 148 LYS 148 143 143 LYS LYS E . n B 1 149 GLY 149 144 144 GLY GLY E . n B 1 150 TYR 150 145 145 TYR TYR E . n B 1 151 PHE 151 146 146 PHE PHE E . n B 1 152 PRO 152 147 147 PRO PRO E . n B 1 153 GLU 153 148 148 GLU GLU E . n B 1 154 PRO 154 149 149 PRO PRO E . n B 1 155 VAL 155 150 150 VAL VAL E . n B 1 156 THR 156 151 151 THR THR E . n B 1 157 VAL 157 152 152 VAL VAL E . n B 1 158 THR 158 153 153 THR THR E . n B 1 159 TRP 159 154 154 TRP TRP E . n B 1 160 ASN 160 155 155 ASN ASN E . n B 1 161 SER 161 156 156 SER SER E . n B 1 162 GLY 162 157 157 GLY GLY E . n B 1 163 SER 163 158 158 SER SER E . n B 1 164 LEU 164 159 159 LEU LEU E . n B 1 165 SER 165 160 160 SER SER E . n B 1 166 SER 166 161 161 SER SER E . n B 1 167 GLY 167 162 162 GLY GLY E . n B 1 168 VAL 168 163 163 VAL VAL E . n B 1 169 HIS 169 164 164 HIS HIS E . n B 1 170 THR 170 165 165 THR THR E . n B 1 171 PHE 171 166 166 PHE PHE E . n B 1 172 PRO 172 167 167 PRO PRO E . n B 1 173 ALA 173 168 168 ALA ALA E . n B 1 174 VAL 174 169 169 VAL VAL E . n B 1 175 LEU 175 170 170 LEU LEU E . n B 1 176 GLN 176 171 171 GLN GLN E . n B 1 177 SER 177 172 172 SER SER E . n B 1 178 ASP 178 173 173 ASP ASP E . n B 1 179 LEU 179 174 174 LEU LEU E . n B 1 180 TYR 180 175 175 TYR TYR E . n B 1 181 THR 181 176 176 THR THR E . n B 1 182 LEU 182 177 177 LEU LEU E . n B 1 183 SER 183 178 178 SER SER E . n B 1 184 SER 184 179 179 SER SER E . n B 1 185 SER 185 180 180 SER SER E . n B 1 186 VAL 186 181 181 VAL VAL E . n B 1 187 THR 187 182 182 THR THR E . n B 1 188 VAL 188 183 183 VAL VAL E . n B 1 189 PRO 189 184 184 PRO PRO E . n B 1 190 SER 190 185 185 SER SER E . n B 1 191 SER 191 186 186 SER SER E . n B 1 192 THR 192 187 187 THR THR E . n B 1 193 TRP 193 188 188 TRP TRP E . n B 1 194 PRO 194 189 189 PRO PRO E . n B 1 195 SER 195 190 190 SER SER E . n B 1 196 GLU 196 191 191 GLU GLU E . n B 1 197 THR 197 192 192 THR THR E . n B 1 198 VAL 198 193 193 VAL VAL E . n B 1 199 THR 199 194 194 THR THR E . n B 1 200 CYS 200 195 195 CYS CYS E . n B 1 201 ASN 201 196 196 ASN ASN E . n B 1 202 VAL 202 197 197 VAL VAL E . n B 1 203 ALA 203 198 198 ALA ALA E . n B 1 204 HIS 204 199 199 HIS HIS E . n B 1 205 PRO 205 200 200 PRO PRO E . n B 1 206 ALA 206 201 201 ALA ALA E . n B 1 207 SER 207 202 202 SER SER E . n B 1 208 SER 208 203 203 SER SER E . n B 1 209 THR 209 204 204 THR THR E . n B 1 210 LYS 210 205 205 LYS LYS E . n B 1 211 VAL 211 206 206 VAL VAL E . n B 1 212 ASP 212 207 207 ASP ASP E . n B 1 213 LYS 213 208 208 LYS LYS E . n B 1 214 LYS 214 209 209 LYS LYS E . n B 1 215 ILE 215 210 210 ILE ILE E . n B 1 216 VAL 216 211 211 VAL VAL E . n B 1 217 PRO 217 212 212 PRO PRO E . n B 1 218 ARG 218 213 213 ARG ARG E . n B 1 219 ASP 219 214 214 ASP ASP E . n C 1 1 PCA 1 1 1 PCA PCA H . n C 1 2 VAL 2 2 2 VAL VAL H . n C 1 3 GLN 3 3 3 GLN GLN H . n C 1 4 LEU 4 4 4 LEU LEU H . n C 1 5 LYS 5 5 5 LYS LYS H . n C 1 6 GLU 6 6 6 GLU GLU H . n C 1 7 SER 7 7 7 SER SER H . n C 1 8 GLY 8 8 8 GLY GLY H . n C 1 9 PRO 9 9 9 PRO PRO H . n C 1 10 GLY 10 10 10 GLY GLY H . n C 1 11 LEU 11 11 11 LEU LEU H . n C 1 12 VAL 12 12 12 VAL VAL H . n C 1 13 GLN 13 13 13 GLN GLN H . n C 1 14 PRO 14 14 14 PRO PRO H . n C 1 15 SER 15 15 15 SER SER H . n C 1 16 GLN 16 16 16 GLN GLN H . n C 1 17 SER 17 17 17 SER SER H . n C 1 18 LEU 18 18 18 LEU LEU H . n C 1 19 SER 19 19 19 SER SER H . n C 1 20 ILE 20 20 20 ILE ILE H . n C 1 21 THR 21 21 21 THR THR H . n C 1 22 CYS 22 22 22 CYS CYS H . n C 1 23 THR 23 23 23 THR THR H . n C 1 24 VAL 24 24 24 VAL VAL H . n C 1 25 SER 25 25 25 SER SER H . n C 1 26 GLY 26 26 26 GLY GLY H . n C 1 27 PHE 27 27 27 PHE PHE H . n C 1 28 SER 28 28 28 SER SER H . n C 1 29 LEU 29 29 29 LEU LEU H . n C 1 30 THR 30 30 30 THR THR H . n C 1 31 THR 31 31 31 THR THR H . n C 1 32 TYR 32 32 32 TYR TYR H . n C 1 33 GLY 33 33 33 GLY GLY H . n C 1 34 VAL 34 34 34 VAL VAL H . n C 1 35 HIS 35 35 35 HIS HIS H . n C 1 36 TRP 36 36 36 TRP TRP H . n C 1 37 VAL 37 37 37 VAL VAL H . n C 1 38 ARG 38 38 38 ARG ARG H . n C 1 39 GLN 39 39 39 GLN GLN H . n C 1 40 SER 40 40 40 SER SER H . n C 1 41 PRO 41 41 41 PRO PRO H . n C 1 42 GLY 42 42 42 GLY GLY H . n C 1 43 LYS 43 43 43 LYS LYS H . n C 1 44 GLY 44 44 44 GLY GLY H . n C 1 45 LEU 45 45 45 LEU LEU H . n C 1 46 GLU 46 46 46 GLU GLU H . n C 1 47 TRP 47 47 47 TRP TRP H . n C 1 48 LEU 48 48 48 LEU LEU H . n C 1 49 GLY 49 49 49 GLY GLY H . n C 1 50 VAL 50 50 50 VAL VAL H . n C 1 51 ILE 51 51 51 ILE ILE H . n C 1 52 TRP 52 52 52 TRP TRP H . n C 1 53 SER 53 53 53 SER SER H . n C 1 54 GLY 54 54 54 GLY GLY H . n C 1 55 GLY 55 55 55 GLY GLY H . n C 1 56 SER 56 56 56 SER SER H . n C 1 57 THR 57 57 57 THR THR H . n C 1 58 ASP 58 58 58 ASP ASP H . n C 1 59 TYR 59 59 59 TYR TYR H . n C 1 60 ASN 60 60 60 ASN ASN H . n C 1 61 ALA 61 61 61 ALA ALA H . n C 1 62 ALA 62 62 62 ALA ALA H . n C 1 63 PHE 63 63 63 PHE PHE H . n C 1 64 ILE 64 64 64 ILE ILE H . n C 1 65 SER 65 65 65 SER SER H . n C 1 66 ARG 66 66 66 ARG ARG H . n C 1 67 LEU 67 67 67 LEU LEU H . n C 1 68 SER 68 68 68 SER SER H . n C 1 69 ILE 69 69 69 ILE ILE H . n C 1 70 SER 70 70 70 SER SER H . n C 1 71 LYS 71 71 71 LYS LYS H . n C 1 72 ASP 72 72 72 ASP ASP H . n C 1 73 ASN 73 73 73 ASN ASN H . n C 1 74 SER 74 74 74 SER SER H . n C 1 75 LYS 75 75 75 LYS LYS H . n C 1 76 SER 76 76 76 SER SER H . n C 1 77 HIS 77 77 77 HIS HIS H . n C 1 78 VAL 78 78 78 VAL VAL H . n C 1 79 PHE 79 79 79 PHE PHE H . n C 1 80 PHE 80 80 80 PHE PHE H . n C 1 81 LYS 81 81 81 LYS LYS H . n C 1 82 MET 82 82 82 MET MET H . n C 1 83 ASN 83 82 82 ASN ASN H A n C 1 84 SER 84 82 82 SER SER H B n C 1 85 LEU 85 82 82 LEU LEU H C n C 1 86 GLN 86 83 83 GLN GLN H . n C 1 87 ALA 87 84 84 ALA ALA H . n C 1 88 ASN 88 85 85 ASN ASN H . n C 1 89 ASP 89 86 86 ASP ASP H . n C 1 90 THR 90 87 87 THR THR H . n C 1 91 ALA 91 88 88 ALA ALA H . n C 1 92 ILE 92 89 89 ILE ILE H . n C 1 93 TYR 93 90 90 TYR TYR H . n C 1 94 TYR 94 91 91 TYR TYR H . n C 1 95 CYS 95 92 92 CYS CYS H . n C 1 96 ALA 96 93 93 ALA ALA H . n C 1 97 ARG 97 94 94 ARG ARG H . n C 1 98 MET 98 95 95 MET MET H . n C 1 99 ARG 99 96 96 ARG ARG H . n C 1 100 ILE 100 97 97 ILE ILE H . n C 1 101 THR 101 98 98 THR THR H . n C 1 102 THR 102 99 99 THR THR H . n C 1 103 ASP 103 100 100 ASP ASP H . n C 1 104 TRP 104 100 100 TRP TRP H A n C 1 105 PHE 105 100 100 PHE PHE H B n C 1 106 ALA 106 101 101 ALA ALA H . n C 1 107 TYR 107 102 102 TYR TYR H . n C 1 108 TRP 108 103 103 TRP TRP H . n C 1 109 GLY 109 104 104 GLY GLY H . n C 1 110 GLN 110 105 105 GLN GLN H . n C 1 111 GLY 111 106 106 GLY GLY H . n C 1 112 THR 112 107 107 THR THR H . n C 1 113 LEU 113 108 108 LEU LEU H . n C 1 114 VAL 114 109 109 VAL VAL H . n C 1 115 THR 115 110 110 THR THR H . n C 1 116 VAL 116 111 111 VAL VAL H . n C 1 117 SER 117 112 112 SER SER H . n C 1 118 ALA 118 113 113 ALA ALA H . n C 1 119 ALA 119 114 114 ALA ALA H . n C 1 120 LYS 120 115 115 LYS LYS H . n C 1 121 THR 121 116 116 THR THR H . n C 1 122 THR 122 117 117 THR THR H . n C 1 123 PRO 123 118 118 PRO PRO H . n C 1 124 PRO 124 119 119 PRO PRO H . n C 1 125 SER 125 120 120 SER SER H . n C 1 126 VAL 126 121 121 VAL VAL H . n C 1 127 TYR 127 122 122 TYR TYR H . n C 1 128 PRO 128 123 123 PRO PRO H . n C 1 129 LEU 129 124 124 LEU LEU H . n C 1 130 ALA 130 125 125 ALA ALA H . n C 1 131 PRO 131 126 126 PRO PRO H . n C 1 132 GLY 132 127 127 GLY GLY H . n C 1 133 SER 133 128 128 SER SER H . n C 1 134 ALA 134 129 129 ALA ALA H . n C 1 135 ALA 135 130 130 ALA ALA H . n C 1 136 GLN 136 131 131 GLN GLN H . n C 1 137 THR 137 132 132 THR THR H . n C 1 138 ASN 138 133 133 ASN ASN H . n C 1 139 SER 139 134 134 SER SER H . n C 1 140 MET 140 135 135 MET MET H . n C 1 141 VAL 141 136 136 VAL VAL H . n C 1 142 THR 142 137 137 THR THR H . n C 1 143 LEU 143 138 138 LEU LEU H . n C 1 144 GLY 144 139 139 GLY GLY H . n C 1 145 CYS 145 140 140 CYS CYS H . n C 1 146 LEU 146 141 141 LEU LEU H . n C 1 147 VAL 147 142 142 VAL VAL H . n C 1 148 LYS 148 143 143 LYS LYS H . n C 1 149 GLY 149 144 144 GLY GLY H . n C 1 150 TYR 150 145 145 TYR TYR H . n C 1 151 PHE 151 146 146 PHE PHE H . n C 1 152 PRO 152 147 147 PRO PRO H . n C 1 153 GLU 153 148 148 GLU GLU H . n C 1 154 PRO 154 149 149 PRO PRO H . n C 1 155 VAL 155 150 150 VAL VAL H . n C 1 156 THR 156 151 151 THR THR H . n C 1 157 VAL 157 152 152 VAL VAL H . n C 1 158 THR 158 153 153 THR THR H . n C 1 159 TRP 159 154 154 TRP TRP H . n C 1 160 ASN 160 155 155 ASN ASN H . n C 1 161 SER 161 156 156 SER SER H . n C 1 162 GLY 162 157 157 GLY GLY H . n C 1 163 SER 163 158 158 SER SER H . n C 1 164 LEU 164 159 159 LEU LEU H . n C 1 165 SER 165 160 160 SER SER H . n C 1 166 SER 166 161 161 SER SER H . n C 1 167 GLY 167 162 162 GLY GLY H . n C 1 168 VAL 168 163 163 VAL VAL H . n C 1 169 HIS 169 164 164 HIS HIS H . n C 1 170 THR 170 165 165 THR THR H . n C 1 171 PHE 171 166 166 PHE PHE H . n C 1 172 PRO 172 167 167 PRO PRO H . n C 1 173 ALA 173 168 168 ALA ALA H . n C 1 174 VAL 174 169 169 VAL VAL H . n C 1 175 LEU 175 170 170 LEU LEU H . n C 1 176 GLN 176 171 171 GLN GLN H . n C 1 177 SER 177 172 172 SER SER H . n C 1 178 ASP 178 173 173 ASP ASP H . n C 1 179 LEU 179 174 174 LEU LEU H . n C 1 180 TYR 180 175 175 TYR TYR H . n C 1 181 THR 181 176 176 THR THR H . n C 1 182 LEU 182 177 177 LEU LEU H . n C 1 183 SER 183 178 178 SER SER H . n C 1 184 SER 184 179 179 SER SER H . n C 1 185 SER 185 180 180 SER SER H . n C 1 186 VAL 186 181 181 VAL VAL H . n C 1 187 THR 187 182 182 THR THR H . n C 1 188 VAL 188 183 183 VAL VAL H . n C 1 189 PRO 189 184 184 PRO PRO H . n C 1 190 SER 190 185 185 SER SER H . n C 1 191 SER 191 186 186 SER SER H . n C 1 192 THR 192 187 187 THR THR H . n C 1 193 TRP 193 188 188 TRP TRP H . n C 1 194 PRO 194 189 189 PRO PRO H . n C 1 195 SER 195 190 190 SER SER H . n C 1 196 GLU 196 191 191 GLU GLU H . n C 1 197 THR 197 192 192 THR THR H . n C 1 198 VAL 198 193 193 VAL VAL H . n C 1 199 THR 199 194 194 THR THR H . n C 1 200 CYS 200 195 195 CYS CYS H . n C 1 201 ASN 201 196 196 ASN ASN H . n C 1 202 VAL 202 197 197 VAL VAL H . n C 1 203 ALA 203 198 198 ALA ALA H . n C 1 204 HIS 204 199 199 HIS HIS H . n C 1 205 PRO 205 200 200 PRO PRO H . n C 1 206 ALA 206 201 201 ALA ALA H . n C 1 207 SER 207 202 202 SER SER H . n C 1 208 SER 208 203 203 SER SER H . n C 1 209 THR 209 204 204 THR THR H . n C 1 210 LYS 210 205 205 LYS LYS H . n C 1 211 VAL 211 206 206 VAL VAL H . n C 1 212 ASP 212 207 207 ASP ASP H . n C 1 213 LYS 213 208 208 LYS LYS H . n C 1 214 LYS 214 209 209 LYS LYS H . n C 1 215 ILE 215 210 210 ILE ILE H . n C 1 216 VAL 216 211 211 VAL VAL H . n C 1 217 PRO 217 212 212 PRO PRO H . n C 1 218 ARG 218 213 213 ARG ARG H . n C 1 219 ASP 219 214 ? ? ? H . n D 2 1 ASP 1 1 1 ASP ASP C . n D 2 2 ILE 2 2 2 ILE ILE C . n D 2 3 LEU 3 3 3 LEU LEU C . n D 2 4 MET 4 4 4 MET MET C . n D 2 5 ASN 5 5 5 ASN ASN C . n D 2 6 GLN 6 6 6 GLN GLN C . n D 2 7 THR 7 7 7 THR THR C . n D 2 8 PRO 8 8 8 PRO PRO C . n D 2 9 LEU 9 9 9 LEU LEU C . n D 2 10 SER 10 10 10 SER SER C . n D 2 11 LEU 11 11 11 LEU LEU C . n D 2 12 PRO 12 12 12 PRO PRO C . n D 2 13 VAL 13 13 13 VAL VAL C . n D 2 14 SER 14 14 14 SER SER C . n D 2 15 LEU 15 15 15 LEU LEU C . n D 2 16 GLY 16 16 16 GLY GLY C . n D 2 17 ASP 17 17 17 ASP ASP C . n D 2 18 GLN 18 18 18 GLN GLN C . n D 2 19 ALA 19 19 19 ALA ALA C . n D 2 20 SER 20 20 20 SER SER C . n D 2 21 ILE 21 21 21 ILE ILE C . n D 2 22 SER 22 22 22 SER SER C . n D 2 23 CYS 23 23 23 CYS CYS C . n D 2 24 ARG 24 24 24 ARG ARG C . n D 2 25 SER 25 25 25 SER SER C . n D 2 26 SER 26 26 26 SER SER C . n D 2 27 GLN 27 27 27 GLN GLN C . n D 2 28 TYR 28 27 27 TYR TYR C A n D 2 29 ILE 29 27 27 ILE ILE C B n D 2 30 VAL 30 27 27 VAL VAL C C n D 2 31 HIS 31 27 27 HIS HIS C D n D 2 32 ARG 32 27 27 ARG ARG C E n D 2 33 ASN 33 28 28 ASN ASN C . n D 2 34 GLY 34 29 29 GLY GLY C . n D 2 35 ASN 35 30 30 ASN ASN C . n D 2 36 THR 36 31 31 THR THR C . n D 2 37 TYR 37 32 32 TYR TYR C . n D 2 38 LEU 38 33 33 LEU LEU C . n D 2 39 GLU 39 34 34 GLU GLU C . n D 2 40 TRP 40 35 35 TRP TRP C . n D 2 41 TYR 41 36 36 TYR TYR C . n D 2 42 LEU 42 37 37 LEU LEU C . n D 2 43 GLN 43 38 38 GLN GLN C . n D 2 44 LYS 44 39 39 LYS LYS C . n D 2 45 PRO 45 40 40 PRO PRO C . n D 2 46 GLY 46 41 41 GLY GLY C . n D 2 47 GLN 47 42 42 GLN GLN C . n D 2 48 SER 48 43 43 SER SER C . n D 2 49 PRO 49 44 44 PRO PRO C . n D 2 50 LYS 50 45 45 LYS LYS C . n D 2 51 LEU 51 46 46 LEU LEU C . n D 2 52 LEU 52 47 47 LEU LEU C . n D 2 53 ILE 53 48 48 ILE ILE C . n D 2 54 TYR 54 49 49 TYR TYR C . n D 2 55 LYS 55 50 50 LYS LYS C . n D 2 56 VAL 56 51 51 VAL VAL C . n D 2 57 SER 57 52 52 SER SER C . n D 2 58 ASN 58 53 53 ASN ASN C . n D 2 59 ARG 59 54 54 ARG ARG C . n D 2 60 PHE 60 55 55 PHE PHE C . n D 2 61 SER 61 56 56 SER SER C . n D 2 62 GLY 62 57 57 GLY GLY C . n D 2 63 VAL 63 58 58 VAL VAL C . n D 2 64 PRO 64 59 59 PRO PRO C . n D 2 65 ASP 65 60 60 ASP ASP C . n D 2 66 ARG 66 61 61 ARG ARG C . n D 2 67 PHE 67 62 62 PHE PHE C . n D 2 68 SER 68 63 63 SER SER C . n D 2 69 GLY 69 64 64 GLY GLY C . n D 2 70 SER 70 65 65 SER SER C . n D 2 71 GLY 71 66 66 GLY GLY C . n D 2 72 SER 72 67 67 SER SER C . n D 2 73 GLY 73 68 68 GLY GLY C . n D 2 74 THR 74 69 69 THR THR C . n D 2 75 ASP 75 70 70 ASP ASP C . n D 2 76 PHE 76 71 71 PHE PHE C . n D 2 77 THR 77 72 72 THR THR C . n D 2 78 LEU 78 73 73 LEU LEU C . n D 2 79 LYS 79 74 74 LYS LYS C . n D 2 80 ILE 80 75 75 ILE ILE C . n D 2 81 SER 81 76 76 SER SER C . n D 2 82 ARG 82 77 77 ARG ARG C . n D 2 83 VAL 83 78 78 VAL VAL C . n D 2 84 GLU 84 79 79 GLU GLU C . n D 2 85 ALA 85 80 80 ALA ALA C . n D 2 86 GLU 86 81 81 GLU GLU C . n D 2 87 ASP 87 82 82 ASP ASP C . n D 2 88 LEU 88 83 83 LEU LEU C . n D 2 89 GLY 89 84 84 GLY GLY C . n D 2 90 VAL 90 85 85 VAL VAL C . n D 2 91 TYR 91 86 86 TYR TYR C . n D 2 92 TYR 92 87 87 TYR TYR C . n D 2 93 CYS 93 88 88 CYS CYS C . n D 2 94 PHE 94 89 89 PHE PHE C . n D 2 95 GLN 95 90 90 GLN GLN C . n D 2 96 GLY 96 91 91 GLY GLY C . n D 2 97 SER 97 92 92 SER SER C . n D 2 98 HIS 98 93 93 HIS HIS C . n D 2 99 VAL 99 94 94 VAL VAL C . n D 2 100 PRO 100 95 95 PRO PRO C . n D 2 101 TYR 101 96 96 TYR TYR C . n D 2 102 THR 102 97 97 THR THR C . n D 2 103 PHE 103 98 98 PHE PHE C . n D 2 104 GLY 104 99 99 GLY GLY C . n D 2 105 GLY 105 100 100 GLY GLY C . n D 2 106 GLY 106 101 101 GLY GLY C . n D 2 107 THR 107 102 102 THR THR C . n D 2 108 LYS 108 103 103 LYS LYS C . n D 2 109 LEU 109 104 104 LEU LEU C . n D 2 110 GLU 110 105 105 GLU GLU C . n D 2 111 LEU 111 106 106 LEU LEU C . n D 2 112 LYS 112 107 107 LYS LYS C . n D 2 113 ARG 113 108 108 ARG ARG C . n D 2 114 ALA 114 109 109 ALA ALA C . n D 2 115 ASP 115 110 110 ASP ASP C . n D 2 116 ALA 116 111 111 ALA ALA C . n D 2 117 ALA 117 112 112 ALA ALA C . n D 2 118 PRO 118 113 113 PRO PRO C . n D 2 119 THR 119 114 114 THR THR C . n D 2 120 VAL 120 115 115 VAL VAL C . n D 2 121 SER 121 116 116 SER SER C . n D 2 122 ILE 122 117 117 ILE ILE C . n D 2 123 PHE 123 118 118 PHE PHE C . n D 2 124 PRO 124 119 119 PRO PRO C . n D 2 125 PRO 125 120 120 PRO PRO C . n D 2 126 SER 126 121 121 SER SER C . n D 2 127 SER 127 122 122 SER SER C . n D 2 128 GLU 128 123 123 GLU GLU C . n D 2 129 GLN 129 124 124 GLN GLN C . n D 2 130 LEU 130 125 125 LEU LEU C . n D 2 131 THR 131 126 126 THR THR C . n D 2 132 SER 132 127 127 SER SER C . n D 2 133 GLY 133 128 128 GLY GLY C . n D 2 134 GLY 134 129 129 GLY GLY C . n D 2 135 ALA 135 130 130 ALA ALA C . n D 2 136 SER 136 131 131 SER SER C . n D 2 137 VAL 137 132 132 VAL VAL C . n D 2 138 VAL 138 133 133 VAL VAL C . n D 2 139 CYS 139 134 134 CYS CYS C . n D 2 140 PHE 140 135 135 PHE PHE C . n D 2 141 LEU 141 136 136 LEU LEU C . n D 2 142 ASN 142 137 137 ASN ASN C . n D 2 143 ASN 143 138 138 ASN ASN C . n D 2 144 PHE 144 139 139 PHE PHE C . n D 2 145 TYR 145 140 140 TYR TYR C . n D 2 146 PRO 146 141 141 PRO PRO C . n D 2 147 LYS 147 142 142 LYS LYS C . n D 2 148 ASP 148 143 143 ASP ASP C . n D 2 149 ILE 149 144 144 ILE ILE C . n D 2 150 ASN 150 145 145 ASN ASN C . n D 2 151 VAL 151 146 146 VAL VAL C . n D 2 152 LYS 152 147 147 LYS LYS C . n D 2 153 TRP 153 148 148 TRP TRP C . n D 2 154 LYS 154 149 149 LYS LYS C . n D 2 155 ILE 155 150 150 ILE ILE C . n D 2 156 ASP 156 151 151 ASP ASP C . n D 2 157 GLY 157 152 152 GLY GLY C . n D 2 158 SER 158 153 153 SER SER C . n D 2 159 GLU 159 154 154 GLU GLU C . n D 2 160 ARG 160 155 155 ARG ARG C . n D 2 161 GLN 161 156 156 GLN GLN C . n D 2 162 ASN 162 157 157 ASN ASN C . n D 2 163 GLY 163 158 158 GLY GLY C . n D 2 164 VAL 164 159 159 VAL VAL C . n D 2 165 LEU 165 160 160 LEU LEU C . n D 2 166 ASN 166 161 161 ASN ASN C . n D 2 167 SER 167 162 162 SER SER C . n D 2 168 TRP 168 163 163 TRP TRP C . n D 2 169 THR 169 164 164 THR THR C . n D 2 170 ASP 170 165 165 ASP ASP C . n D 2 171 GLN 171 166 166 GLN GLN C . n D 2 172 ASP 172 167 167 ASP ASP C . n D 2 173 SER 173 168 168 SER SER C . n D 2 174 LYS 174 169 169 LYS LYS C . n D 2 175 ASP 175 170 170 ASP ASP C . n D 2 176 SER 176 171 171 SER SER C . n D 2 177 THR 177 172 172 THR THR C . n D 2 178 TYR 178 173 173 TYR TYR C . n D 2 179 SER 179 174 174 SER SER C . n D 2 180 MET 180 175 175 MET MET C . n D 2 181 SER 181 176 176 SER SER C . n D 2 182 SER 182 177 177 SER SER C . n D 2 183 THR 183 178 178 THR THR C . n D 2 184 LEU 184 179 179 LEU LEU C . n D 2 185 THR 185 180 180 THR THR C . n D 2 186 LEU 186 181 181 LEU LEU C . n D 2 187 THR 187 182 182 THR THR C . n D 2 188 LYS 188 183 183 LYS LYS C . n D 2 189 ASP 189 184 184 ASP ASP C . n D 2 190 GLU 190 185 185 GLU GLU C . n D 2 191 TYR 191 186 186 TYR TYR C . n D 2 192 GLU 192 187 187 GLU GLU C . n D 2 193 ARG 193 188 188 ARG ARG C . n D 2 194 HIS 194 189 189 HIS HIS C . n D 2 195 ASN 195 190 190 ASN ASN C . n D 2 196 SER 196 191 191 SER SER C . n D 2 197 TYR 197 192 192 TYR TYR C . n D 2 198 THR 198 193 193 THR THR C . n D 2 199 CYS 199 194 194 CYS CYS C . n D 2 200 GLU 200 195 195 GLU GLU C . n D 2 201 ALA 201 196 196 ALA ALA C . n D 2 202 THR 202 197 197 THR THR C . n D 2 203 HIS 203 198 198 HIS HIS C . n D 2 204 LYS 204 199 199 LYS LYS C . n D 2 205 THR 205 200 200 THR THR C . n D 2 206 SER 206 201 201 SER SER C . n D 2 207 THR 207 202 202 THR THR C . n D 2 208 SER 208 203 203 SER SER C . n D 2 209 PRO 209 204 204 PRO PRO C . n D 2 210 ILE 210 205 205 ILE ILE C . n D 2 211 VAL 211 206 206 VAL VAL C . n D 2 212 LYS 212 207 207 LYS LYS C . n D 2 213 SER 213 208 208 SER SER C . n D 2 214 PHE 214 209 209 PHE PHE C . n D 2 215 ASN 215 210 210 ASN ASN C . n D 2 216 ARG 216 211 211 ARG ARG C . n D 2 217 ASN 217 212 212 ASN ASN C . n D 2 218 GLU 218 213 213 GLU GLU C . n D 2 219 CYS 219 214 214 CYS CYS C . n E 2 1 ASP 1 1 1 ASP ASP F . n E 2 2 ILE 2 2 2 ILE ILE F . n E 2 3 LEU 3 3 3 LEU LEU F . n E 2 4 MET 4 4 4 MET MET F . n E 2 5 ASN 5 5 5 ASN ASN F . n E 2 6 GLN 6 6 6 GLN GLN F . n E 2 7 THR 7 7 7 THR THR F . n E 2 8 PRO 8 8 8 PRO PRO F . n E 2 9 LEU 9 9 9 LEU LEU F . n E 2 10 SER 10 10 10 SER SER F . n E 2 11 LEU 11 11 11 LEU LEU F . n E 2 12 PRO 12 12 12 PRO PRO F . n E 2 13 VAL 13 13 13 VAL VAL F . n E 2 14 SER 14 14 14 SER SER F . n E 2 15 LEU 15 15 15 LEU LEU F . n E 2 16 GLY 16 16 16 GLY GLY F . n E 2 17 ASP 17 17 17 ASP ASP F . n E 2 18 GLN 18 18 18 GLN GLN F . n E 2 19 ALA 19 19 19 ALA ALA F . n E 2 20 SER 20 20 20 SER SER F . n E 2 21 ILE 21 21 21 ILE ILE F . n E 2 22 SER 22 22 22 SER SER F . n E 2 23 CYS 23 23 23 CYS CYS F . n E 2 24 ARG 24 24 24 ARG ARG F . n E 2 25 SER 25 25 25 SER SER F . n E 2 26 SER 26 26 26 SER SER F . n E 2 27 GLN 27 27 27 GLN GLN F . n E 2 28 TYR 28 27 27 TYR TYR F A n E 2 29 ILE 29 27 27 ILE ILE F B n E 2 30 VAL 30 27 27 VAL VAL F C n E 2 31 HIS 31 27 27 HIS HIS F D n E 2 32 ARG 32 27 27 ARG ARG F E n E 2 33 ASN 33 28 28 ASN ASN F . n E 2 34 GLY 34 29 29 GLY GLY F . n E 2 35 ASN 35 30 30 ASN ASN F . n E 2 36 THR 36 31 31 THR THR F . n E 2 37 TYR 37 32 32 TYR TYR F . n E 2 38 LEU 38 33 33 LEU LEU F . n E 2 39 GLU 39 34 34 GLU GLU F . n E 2 40 TRP 40 35 35 TRP TRP F . n E 2 41 TYR 41 36 36 TYR TYR F . n E 2 42 LEU 42 37 37 LEU LEU F . n E 2 43 GLN 43 38 38 GLN GLN F . n E 2 44 LYS 44 39 39 LYS LYS F . n E 2 45 PRO 45 40 40 PRO PRO F . n E 2 46 GLY 46 41 41 GLY GLY F . n E 2 47 GLN 47 42 42 GLN GLN F . n E 2 48 SER 48 43 43 SER SER F . n E 2 49 PRO 49 44 44 PRO PRO F . n E 2 50 LYS 50 45 45 LYS LYS F . n E 2 51 LEU 51 46 46 LEU LEU F . n E 2 52 LEU 52 47 47 LEU LEU F . n E 2 53 ILE 53 48 48 ILE ILE F . n E 2 54 TYR 54 49 49 TYR TYR F . n E 2 55 LYS 55 50 50 LYS LYS F . n E 2 56 VAL 56 51 51 VAL VAL F . n E 2 57 SER 57 52 52 SER SER F . n E 2 58 ASN 58 53 53 ASN ASN F . n E 2 59 ARG 59 54 54 ARG ARG F . n E 2 60 PHE 60 55 55 PHE PHE F . n E 2 61 SER 61 56 56 SER SER F . n E 2 62 GLY 62 57 57 GLY GLY F . n E 2 63 VAL 63 58 58 VAL VAL F . n E 2 64 PRO 64 59 59 PRO PRO F . n E 2 65 ASP 65 60 60 ASP ASP F . n E 2 66 ARG 66 61 61 ARG ARG F . n E 2 67 PHE 67 62 62 PHE PHE F . n E 2 68 SER 68 63 63 SER SER F . n E 2 69 GLY 69 64 64 GLY GLY F . n E 2 70 SER 70 65 65 SER SER F . n E 2 71 GLY 71 66 66 GLY GLY F . n E 2 72 SER 72 67 67 SER SER F . n E 2 73 GLY 73 68 68 GLY GLY F . n E 2 74 THR 74 69 69 THR THR F . n E 2 75 ASP 75 70 70 ASP ASP F . n E 2 76 PHE 76 71 71 PHE PHE F . n E 2 77 THR 77 72 72 THR THR F . n E 2 78 LEU 78 73 73 LEU LEU F . n E 2 79 LYS 79 74 74 LYS LYS F . n E 2 80 ILE 80 75 75 ILE ILE F . n E 2 81 SER 81 76 76 SER SER F . n E 2 82 ARG 82 77 77 ARG ARG F . n E 2 83 VAL 83 78 78 VAL VAL F . n E 2 84 GLU 84 79 79 GLU GLU F . n E 2 85 ALA 85 80 80 ALA ALA F . n E 2 86 GLU 86 81 81 GLU GLU F . n E 2 87 ASP 87 82 82 ASP ASP F . n E 2 88 LEU 88 83 83 LEU LEU F . n E 2 89 GLY 89 84 84 GLY GLY F . n E 2 90 VAL 90 85 85 VAL VAL F . n E 2 91 TYR 91 86 86 TYR TYR F . n E 2 92 TYR 92 87 87 TYR TYR F . n E 2 93 CYS 93 88 88 CYS CYS F . n E 2 94 PHE 94 89 89 PHE PHE F . n E 2 95 GLN 95 90 90 GLN GLN F . n E 2 96 GLY 96 91 91 GLY GLY F . n E 2 97 SER 97 92 92 SER SER F . n E 2 98 HIS 98 93 93 HIS HIS F . n E 2 99 VAL 99 94 94 VAL VAL F . n E 2 100 PRO 100 95 95 PRO PRO F . n E 2 101 TYR 101 96 96 TYR TYR F . n E 2 102 THR 102 97 97 THR THR F . n E 2 103 PHE 103 98 98 PHE PHE F . n E 2 104 GLY 104 99 99 GLY GLY F . n E 2 105 GLY 105 100 100 GLY GLY F . n E 2 106 GLY 106 101 101 GLY GLY F . n E 2 107 THR 107 102 102 THR THR F . n E 2 108 LYS 108 103 103 LYS LYS F . n E 2 109 LEU 109 104 104 LEU LEU F . n E 2 110 GLU 110 105 105 GLU GLU F . n E 2 111 LEU 111 106 106 LEU LEU F . n E 2 112 LYS 112 107 107 LYS LYS F . n E 2 113 ARG 113 108 108 ARG ARG F . n E 2 114 ALA 114 109 109 ALA ALA F . n E 2 115 ASP 115 110 110 ASP ASP F . n E 2 116 ALA 116 111 111 ALA ALA F . n E 2 117 ALA 117 112 112 ALA ALA F . n E 2 118 PRO 118 113 113 PRO PRO F . n E 2 119 THR 119 114 114 THR THR F . n E 2 120 VAL 120 115 115 VAL VAL F . n E 2 121 SER 121 116 116 SER SER F . n E 2 122 ILE 122 117 117 ILE ILE F . n E 2 123 PHE 123 118 118 PHE PHE F . n E 2 124 PRO 124 119 119 PRO PRO F . n E 2 125 PRO 125 120 120 PRO PRO F . n E 2 126 SER 126 121 121 SER SER F . n E 2 127 SER 127 122 122 SER SER F . n E 2 128 GLU 128 123 123 GLU GLU F . n E 2 129 GLN 129 124 124 GLN GLN F . n E 2 130 LEU 130 125 125 LEU LEU F . n E 2 131 THR 131 126 126 THR THR F . n E 2 132 SER 132 127 127 SER SER F . n E 2 133 GLY 133 128 128 GLY GLY F . n E 2 134 GLY 134 129 129 GLY GLY F . n E 2 135 ALA 135 130 130 ALA ALA F . n E 2 136 SER 136 131 131 SER SER F . n E 2 137 VAL 137 132 132 VAL VAL F . n E 2 138 VAL 138 133 133 VAL VAL F . n E 2 139 CYS 139 134 134 CYS CYS F . n E 2 140 PHE 140 135 135 PHE PHE F . n E 2 141 LEU 141 136 136 LEU LEU F . n E 2 142 ASN 142 137 137 ASN ASN F . n E 2 143 ASN 143 138 138 ASN ASN F . n E 2 144 PHE 144 139 139 PHE PHE F . n E 2 145 TYR 145 140 140 TYR TYR F . n E 2 146 PRO 146 141 141 PRO PRO F . n E 2 147 LYS 147 142 142 LYS LYS F . n E 2 148 ASP 148 143 143 ASP ASP F . n E 2 149 ILE 149 144 144 ILE ILE F . n E 2 150 ASN 150 145 145 ASN ASN F . n E 2 151 VAL 151 146 146 VAL VAL F . n E 2 152 LYS 152 147 147 LYS LYS F . n E 2 153 TRP 153 148 148 TRP TRP F . n E 2 154 LYS 154 149 149 LYS LYS F . n E 2 155 ILE 155 150 150 ILE ILE F . n E 2 156 ASP 156 151 151 ASP ASP F . n E 2 157 GLY 157 152 152 GLY GLY F . n E 2 158 SER 158 153 153 SER SER F . n E 2 159 GLU 159 154 154 GLU GLU F . n E 2 160 ARG 160 155 155 ARG ARG F . n E 2 161 GLN 161 156 156 GLN GLN F . n E 2 162 ASN 162 157 157 ASN ASN F . n E 2 163 GLY 163 158 158 GLY GLY F . n E 2 164 VAL 164 159 159 VAL VAL F . n E 2 165 LEU 165 160 160 LEU LEU F . n E 2 166 ASN 166 161 161 ASN ASN F . n E 2 167 SER 167 162 162 SER SER F . n E 2 168 TRP 168 163 163 TRP TRP F . n E 2 169 THR 169 164 164 THR THR F . n E 2 170 ASP 170 165 165 ASP ASP F . n E 2 171 GLN 171 166 166 GLN GLN F . n E 2 172 ASP 172 167 167 ASP ASP F . n E 2 173 SER 173 168 168 SER SER F . n E 2 174 LYS 174 169 169 LYS LYS F . n E 2 175 ASP 175 170 170 ASP ASP F . n E 2 176 SER 176 171 171 SER SER F . n E 2 177 THR 177 172 172 THR THR F . n E 2 178 TYR 178 173 173 TYR TYR F . n E 2 179 SER 179 174 174 SER SER F . n E 2 180 MET 180 175 175 MET MET F . n E 2 181 SER 181 176 176 SER SER F . n E 2 182 SER 182 177 177 SER SER F . n E 2 183 THR 183 178 178 THR THR F . n E 2 184 LEU 184 179 179 LEU LEU F . n E 2 185 THR 185 180 180 THR THR F . n E 2 186 LEU 186 181 181 LEU LEU F . n E 2 187 THR 187 182 182 THR THR F . n E 2 188 LYS 188 183 183 LYS LYS F . n E 2 189 ASP 189 184 184 ASP ASP F . n E 2 190 GLU 190 185 185 GLU GLU F . n E 2 191 TYR 191 186 186 TYR TYR F . n E 2 192 GLU 192 187 187 GLU GLU F . n E 2 193 ARG 193 188 188 ARG ARG F . n E 2 194 HIS 194 189 189 HIS HIS F . n E 2 195 ASN 195 190 190 ASN ASN F . n E 2 196 SER 196 191 191 SER SER F . n E 2 197 TYR 197 192 192 TYR TYR F . n E 2 198 THR 198 193 193 THR THR F . n E 2 199 CYS 199 194 194 CYS CYS F . n E 2 200 GLU 200 195 195 GLU GLU F . n E 2 201 ALA 201 196 196 ALA ALA F . n E 2 202 THR 202 197 197 THR THR F . n E 2 203 HIS 203 198 198 HIS HIS F . n E 2 204 LYS 204 199 199 LYS LYS F . n E 2 205 THR 205 200 200 THR THR F . n E 2 206 SER 206 201 201 SER SER F . n E 2 207 THR 207 202 202 THR THR F . n E 2 208 SER 208 203 203 SER SER F . n E 2 209 PRO 209 204 204 PRO PRO F . n E 2 210 ILE 210 205 205 ILE ILE F . n E 2 211 VAL 211 206 206 VAL VAL F . n E 2 212 LYS 212 207 207 LYS LYS F . n E 2 213 SER 213 208 208 SER SER F . n E 2 214 PHE 214 209 209 PHE PHE F . n E 2 215 ASN 215 210 210 ASN ASN F . n E 2 216 ARG 216 211 211 ARG ARG F . n E 2 217 ASN 217 212 212 ASN ASN F . n E 2 218 GLU 218 213 213 GLU GLU F . n E 2 219 CYS 219 214 214 CYS CYS F . n F 2 1 ASP 1 1 1 ASP ASP L . n F 2 2 ILE 2 2 2 ILE ILE L . n F 2 3 LEU 3 3 3 LEU LEU L . n F 2 4 MET 4 4 4 MET MET L . n F 2 5 ASN 5 5 5 ASN ASN L . n F 2 6 GLN 6 6 6 GLN GLN L . n F 2 7 THR 7 7 7 THR THR L . n F 2 8 PRO 8 8 8 PRO PRO L . n F 2 9 LEU 9 9 9 LEU LEU L . n F 2 10 SER 10 10 10 SER SER L . n F 2 11 LEU 11 11 11 LEU LEU L . n F 2 12 PRO 12 12 12 PRO PRO L . n F 2 13 VAL 13 13 13 VAL VAL L . n F 2 14 SER 14 14 14 SER SER L . n F 2 15 LEU 15 15 15 LEU LEU L . n F 2 16 GLY 16 16 16 GLY GLY L . n F 2 17 ASP 17 17 17 ASP ASP L . n F 2 18 GLN 18 18 18 GLN GLN L . n F 2 19 ALA 19 19 19 ALA ALA L . n F 2 20 SER 20 20 20 SER SER L . n F 2 21 ILE 21 21 21 ILE ILE L . n F 2 22 SER 22 22 22 SER SER L . n F 2 23 CYS 23 23 23 CYS CYS L . n F 2 24 ARG 24 24 24 ARG ARG L . n F 2 25 SER 25 25 25 SER SER L . n F 2 26 SER 26 26 26 SER SER L . n F 2 27 GLN 27 27 27 GLN GLN L . n F 2 28 TYR 28 27 27 TYR TYR L A n F 2 29 ILE 29 27 27 ILE ILE L B n F 2 30 VAL 30 27 27 VAL VAL L C n F 2 31 HIS 31 27 27 HIS HIS L D n F 2 32 ARG 32 27 27 ARG ARG L E n F 2 33 ASN 33 28 28 ASN ASN L . n F 2 34 GLY 34 29 29 GLY GLY L . n F 2 35 ASN 35 30 30 ASN ASN L . n F 2 36 THR 36 31 31 THR THR L . n F 2 37 TYR 37 32 32 TYR TYR L . n F 2 38 LEU 38 33 33 LEU LEU L . n F 2 39 GLU 39 34 34 GLU GLU L . n F 2 40 TRP 40 35 35 TRP TRP L . n F 2 41 TYR 41 36 36 TYR TYR L . n F 2 42 LEU 42 37 37 LEU LEU L . n F 2 43 GLN 43 38 38 GLN GLN L . n F 2 44 LYS 44 39 39 LYS LYS L . n F 2 45 PRO 45 40 40 PRO PRO L . n F 2 46 GLY 46 41 41 GLY GLY L . n F 2 47 GLN 47 42 42 GLN GLN L . n F 2 48 SER 48 43 43 SER SER L . n F 2 49 PRO 49 44 44 PRO PRO L . n F 2 50 LYS 50 45 45 LYS LYS L . n F 2 51 LEU 51 46 46 LEU LEU L . n F 2 52 LEU 52 47 47 LEU LEU L . n F 2 53 ILE 53 48 48 ILE ILE L . n F 2 54 TYR 54 49 49 TYR TYR L . n F 2 55 LYS 55 50 50 LYS LYS L . n F 2 56 VAL 56 51 51 VAL VAL L . n F 2 57 SER 57 52 52 SER SER L . n F 2 58 ASN 58 53 53 ASN ASN L . n F 2 59 ARG 59 54 54 ARG ARG L . n F 2 60 PHE 60 55 55 PHE PHE L . n F 2 61 SER 61 56 56 SER SER L . n F 2 62 GLY 62 57 57 GLY GLY L . n F 2 63 VAL 63 58 58 VAL VAL L . n F 2 64 PRO 64 59 59 PRO PRO L . n F 2 65 ASP 65 60 60 ASP ASP L . n F 2 66 ARG 66 61 61 ARG ARG L . n F 2 67 PHE 67 62 62 PHE PHE L . n F 2 68 SER 68 63 63 SER SER L . n F 2 69 GLY 69 64 64 GLY GLY L . n F 2 70 SER 70 65 65 SER SER L . n F 2 71 GLY 71 66 66 GLY GLY L . n F 2 72 SER 72 67 67 SER SER L . n F 2 73 GLY 73 68 68 GLY GLY L . n F 2 74 THR 74 69 69 THR THR L . n F 2 75 ASP 75 70 70 ASP ASP L . n F 2 76 PHE 76 71 71 PHE PHE L . n F 2 77 THR 77 72 72 THR THR L . n F 2 78 LEU 78 73 73 LEU LEU L . n F 2 79 LYS 79 74 74 LYS LYS L . n F 2 80 ILE 80 75 75 ILE ILE L . n F 2 81 SER 81 76 76 SER SER L . n F 2 82 ARG 82 77 77 ARG ARG L . n F 2 83 VAL 83 78 78 VAL VAL L . n F 2 84 GLU 84 79 79 GLU GLU L . n F 2 85 ALA 85 80 80 ALA ALA L . n F 2 86 GLU 86 81 81 GLU GLU L . n F 2 87 ASP 87 82 82 ASP ASP L . n F 2 88 LEU 88 83 83 LEU LEU L . n F 2 89 GLY 89 84 84 GLY GLY L . n F 2 90 VAL 90 85 85 VAL VAL L . n F 2 91 TYR 91 86 86 TYR TYR L . n F 2 92 TYR 92 87 87 TYR TYR L . n F 2 93 CYS 93 88 88 CYS CYS L . n F 2 94 PHE 94 89 89 PHE PHE L . n F 2 95 GLN 95 90 90 GLN GLN L . n F 2 96 GLY 96 91 91 GLY GLY L . n F 2 97 SER 97 92 92 SER SER L . n F 2 98 HIS 98 93 93 HIS HIS L . n F 2 99 VAL 99 94 94 VAL VAL L . n F 2 100 PRO 100 95 95 PRO PRO L . n F 2 101 TYR 101 96 96 TYR TYR L . n F 2 102 THR 102 97 97 THR THR L . n F 2 103 PHE 103 98 98 PHE PHE L . n F 2 104 GLY 104 99 99 GLY GLY L . n F 2 105 GLY 105 100 100 GLY GLY L . n F 2 106 GLY 106 101 101 GLY GLY L . n F 2 107 THR 107 102 102 THR THR L . n F 2 108 LYS 108 103 103 LYS LYS L . n F 2 109 LEU 109 104 104 LEU LEU L . n F 2 110 GLU 110 105 105 GLU GLU L . n F 2 111 LEU 111 106 106 LEU LEU L . n F 2 112 LYS 112 107 107 LYS LYS L . n F 2 113 ARG 113 108 108 ARG ARG L . n F 2 114 ALA 114 109 109 ALA ALA L . n F 2 115 ASP 115 110 110 ASP ASP L . n F 2 116 ALA 116 111 111 ALA ALA L . n F 2 117 ALA 117 112 112 ALA ALA L . n F 2 118 PRO 118 113 113 PRO PRO L . n F 2 119 THR 119 114 114 THR THR L . n F 2 120 VAL 120 115 115 VAL VAL L . n F 2 121 SER 121 116 116 SER SER L . n F 2 122 ILE 122 117 117 ILE ILE L . n F 2 123 PHE 123 118 118 PHE PHE L . n F 2 124 PRO 124 119 119 PRO PRO L . n F 2 125 PRO 125 120 120 PRO PRO L . n F 2 126 SER 126 121 121 SER SER L . n F 2 127 SER 127 122 122 SER SER L . n F 2 128 GLU 128 123 123 GLU GLU L . n F 2 129 GLN 129 124 124 GLN GLN L . n F 2 130 LEU 130 125 125 LEU LEU L . n F 2 131 THR 131 126 126 THR THR L . n F 2 132 SER 132 127 127 SER SER L . n F 2 133 GLY 133 128 128 GLY GLY L . n F 2 134 GLY 134 129 129 GLY GLY L . n F 2 135 ALA 135 130 130 ALA ALA L . n F 2 136 SER 136 131 131 SER SER L . n F 2 137 VAL 137 132 132 VAL VAL L . n F 2 138 VAL 138 133 133 VAL VAL L . n F 2 139 CYS 139 134 134 CYS CYS L . n F 2 140 PHE 140 135 135 PHE PHE L . n F 2 141 LEU 141 136 136 LEU LEU L . n F 2 142 ASN 142 137 137 ASN ASN L . n F 2 143 ASN 143 138 138 ASN ASN L . n F 2 144 PHE 144 139 139 PHE PHE L . n F 2 145 TYR 145 140 140 TYR TYR L . n F 2 146 PRO 146 141 141 PRO PRO L . n F 2 147 LYS 147 142 142 LYS LYS L . n F 2 148 ASP 148 143 143 ASP ASP L . n F 2 149 ILE 149 144 144 ILE ILE L . n F 2 150 ASN 150 145 145 ASN ASN L . n F 2 151 VAL 151 146 146 VAL VAL L . n F 2 152 LYS 152 147 147 LYS LYS L . n F 2 153 TRP 153 148 148 TRP TRP L . n F 2 154 LYS 154 149 149 LYS LYS L . n F 2 155 ILE 155 150 150 ILE ILE L . n F 2 156 ASP 156 151 151 ASP ASP L . n F 2 157 GLY 157 152 152 GLY GLY L . n F 2 158 SER 158 153 153 SER SER L . n F 2 159 GLU 159 154 154 GLU GLU L . n F 2 160 ARG 160 155 155 ARG ARG L . n F 2 161 GLN 161 156 156 GLN GLN L . n F 2 162 ASN 162 157 157 ASN ASN L . n F 2 163 GLY 163 158 158 GLY GLY L . n F 2 164 VAL 164 159 159 VAL VAL L . n F 2 165 LEU 165 160 160 LEU LEU L . n F 2 166 ASN 166 161 161 ASN ASN L . n F 2 167 SER 167 162 162 SER SER L . n F 2 168 TRP 168 163 163 TRP TRP L . n F 2 169 THR 169 164 164 THR THR L . n F 2 170 ASP 170 165 165 ASP ASP L . n F 2 171 GLN 171 166 166 GLN GLN L . n F 2 172 ASP 172 167 167 ASP ASP L . n F 2 173 SER 173 168 168 SER SER L . n F 2 174 LYS 174 169 169 LYS LYS L . n F 2 175 ASP 175 170 170 ASP ASP L . n F 2 176 SER 176 171 171 SER SER L . n F 2 177 THR 177 172 172 THR THR L . n F 2 178 TYR 178 173 173 TYR TYR L . n F 2 179 SER 179 174 174 SER SER L . n F 2 180 MET 180 175 175 MET MET L . n F 2 181 SER 181 176 176 SER SER L . n F 2 182 SER 182 177 177 SER SER L . n F 2 183 THR 183 178 178 THR THR L . n F 2 184 LEU 184 179 179 LEU LEU L . n F 2 185 THR 185 180 180 THR THR L . n F 2 186 LEU 186 181 181 LEU LEU L . n F 2 187 THR 187 182 182 THR THR L . n F 2 188 LYS 188 183 183 LYS LYS L . n F 2 189 ASP 189 184 184 ASP ASP L . n F 2 190 GLU 190 185 185 GLU GLU L . n F 2 191 TYR 191 186 186 TYR TYR L . n F 2 192 GLU 192 187 187 GLU GLU L . n F 2 193 ARG 193 188 188 ARG ARG L . n F 2 194 HIS 194 189 189 HIS HIS L . n F 2 195 ASN 195 190 190 ASN ASN L . n F 2 196 SER 196 191 191 SER SER L . n F 2 197 TYR 197 192 192 TYR TYR L . n F 2 198 THR 198 193 193 THR THR L . n F 2 199 CYS 199 194 194 CYS CYS L . n F 2 200 GLU 200 195 195 GLU GLU L . n F 2 201 ALA 201 196 196 ALA ALA L . n F 2 202 THR 202 197 197 THR THR L . n F 2 203 HIS 203 198 198 HIS HIS L . n F 2 204 LYS 204 199 199 LYS LYS L . n F 2 205 THR 205 200 200 THR THR L . n F 2 206 SER 206 201 201 SER SER L . n F 2 207 THR 207 202 202 THR THR L . n F 2 208 SER 208 203 203 SER SER L . n F 2 209 PRO 209 204 204 PRO PRO L . n F 2 210 ILE 210 205 205 ILE ILE L . n F 2 211 VAL 211 206 206 VAL VAL L . n F 2 212 LYS 212 207 207 LYS LYS L . n F 2 213 SER 213 208 208 SER SER L . n F 2 214 PHE 214 209 209 PHE PHE L . n F 2 215 ASN 215 210 210 ASN ASN L . n F 2 216 ARG 216 211 211 ARG ARG L . n F 2 217 ASN 217 212 212 ASN ASN L . n F 2 218 GLU 218 213 213 GLU GLU L . n F 2 219 CYS 219 214 214 CYS CYS L . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code G 3 NAG 1 401 401 NAG NAG B . H 4 FUC 2 402 402 FUC FUC B . I 3 NAG 3 403 403 NAG NAG B . J 5 BMA 4 404 404 BMA BMA B . K 6 MAN 5 405 408 MAN MAN B . L 7 PEG 1 406 1 PEG PEG B . M 3 NAG 1 401 401 NAG NAG E . N 4 FUC 2 402 402 FUC FUC E . O 3 NAG 3 403 403 NAG NAG E . P 5 BMA 4 404 404 BMA BMA E . Q 6 MAN 5 405 405 MAN MAN E . R 3 NAG 1 401 401 NAG NAG H . S 4 FUC 2 402 402 FUC FUC H . T 3 NAG 3 403 403 NAG NAG H . U 5 BMA 4 404 404 BMA BMA H . V 6 MAN 5 405 405 MAN MAN H . W 3 NAG 6 406 406 NAG NAG H . X 8 GAL 7 407 407 GAL GAL H . Y 9 GLA 8 408 408 GLA GLA H . Z 6 MAN 9 409 411 MAN MAN H . AA 7 PEG 1 410 2 PEG PEG H . BA 10 K 1 301 1 K K L . CA 11 HOH 1 501 42 HOH HOH B . CA 11 HOH 2 502 52 HOH HOH B . CA 11 HOH 3 503 54 HOH HOH B . CA 11 HOH 4 504 55 HOH HOH B . CA 11 HOH 5 505 56 HOH HOH B . CA 11 HOH 6 506 57 HOH HOH B . CA 11 HOH 7 507 58 HOH HOH B . CA 11 HOH 8 508 59 HOH HOH B . CA 11 HOH 9 509 60 HOH HOH B . CA 11 HOH 10 510 61 HOH HOH B . CA 11 HOH 11 511 73 HOH HOH B . CA 11 HOH 12 512 81 HOH HOH B . CA 11 HOH 13 513 82 HOH HOH B . CA 11 HOH 14 514 92 HOH HOH B . CA 11 HOH 15 515 99 HOH HOH B . CA 11 HOH 16 516 100 HOH HOH B . CA 11 HOH 17 517 102 HOH HOH B . CA 11 HOH 18 518 104 HOH HOH B . CA 11 HOH 19 519 111 HOH HOH B . CA 11 HOH 20 520 116 HOH HOH B . CA 11 HOH 21 521 120 HOH HOH B . CA 11 HOH 22 522 121 HOH HOH B . CA 11 HOH 23 523 138 HOH HOH B . CA 11 HOH 24 524 141 HOH HOH B . CA 11 HOH 25 525 143 HOH HOH B . CA 11 HOH 26 526 147 HOH HOH B . CA 11 HOH 27 527 149 HOH HOH B . CA 11 HOH 28 528 157 HOH HOH B . CA 11 HOH 29 529 159 HOH HOH B . CA 11 HOH 30 530 192 HOH HOH B . CA 11 HOH 31 531 195 HOH HOH B . CA 11 HOH 32 532 205 HOH HOH B . CA 11 HOH 33 533 207 HOH HOH B . CA 11 HOH 34 534 216 HOH HOH B . CA 11 HOH 35 535 219 HOH HOH B . CA 11 HOH 36 536 220 HOH HOH B . CA 11 HOH 37 537 221 HOH HOH B . CA 11 HOH 38 538 227 HOH HOH B . DA 11 HOH 1 501 72 HOH HOH E . DA 11 HOH 2 502 75 HOH HOH E . DA 11 HOH 3 503 76 HOH HOH E . DA 11 HOH 4 504 80 HOH HOH E . DA 11 HOH 5 505 85 HOH HOH E . DA 11 HOH 6 506 87 HOH HOH E . DA 11 HOH 7 507 113 HOH HOH E . DA 11 HOH 8 508 131 HOH HOH E . DA 11 HOH 9 509 140 HOH HOH E . DA 11 HOH 10 510 150 HOH HOH E . DA 11 HOH 11 511 153 HOH HOH E . DA 11 HOH 12 512 162 HOH HOH E . DA 11 HOH 13 513 165 HOH HOH E . DA 11 HOH 14 514 226 HOH HOH E . DA 11 HOH 15 515 236 HOH HOH E . DA 11 HOH 16 516 242 HOH HOH E . EA 11 HOH 1 501 14 HOH HOH H . EA 11 HOH 2 502 20 HOH HOH H . EA 11 HOH 3 503 21 HOH HOH H . EA 11 HOH 4 504 22 HOH HOH H . EA 11 HOH 5 505 23 HOH HOH H . EA 11 HOH 6 506 24 HOH HOH H . EA 11 HOH 7 507 25 HOH HOH H . EA 11 HOH 8 508 26 HOH HOH H . EA 11 HOH 9 509 27 HOH HOH H . EA 11 HOH 10 510 28 HOH HOH H . EA 11 HOH 11 511 29 HOH HOH H . EA 11 HOH 12 512 30 HOH HOH H . EA 11 HOH 13 513 31 HOH HOH H . EA 11 HOH 14 514 32 HOH HOH H . EA 11 HOH 15 515 33 HOH HOH H . EA 11 HOH 16 516 34 HOH HOH H . EA 11 HOH 17 517 35 HOH HOH H . EA 11 HOH 18 518 36 HOH HOH H . EA 11 HOH 19 519 37 HOH HOH H . EA 11 HOH 20 520 38 HOH HOH H . EA 11 HOH 21 521 39 HOH HOH H . EA 11 HOH 22 522 79 HOH HOH H . EA 11 HOH 23 523 91 HOH HOH H . EA 11 HOH 24 524 93 HOH HOH H . EA 11 HOH 25 525 97 HOH HOH H . EA 11 HOH 26 526 98 HOH HOH H . EA 11 HOH 27 527 106 HOH HOH H . EA 11 HOH 28 528 119 HOH HOH H . EA 11 HOH 29 529 122 HOH HOH H . EA 11 HOH 30 530 126 HOH HOH H . EA 11 HOH 31 531 128 HOH HOH H . EA 11 HOH 32 532 139 HOH HOH H . EA 11 HOH 33 533 144 HOH HOH H . EA 11 HOH 34 534 152 HOH HOH H . EA 11 HOH 35 535 155 HOH HOH H . EA 11 HOH 36 536 163 HOH HOH H . EA 11 HOH 37 537 172 HOH HOH H . EA 11 HOH 38 538 173 HOH HOH H . EA 11 HOH 39 539 174 HOH HOH H . EA 11 HOH 40 540 177 HOH HOH H . EA 11 HOH 41 541 179 HOH HOH H . EA 11 HOH 42 542 182 HOH HOH H . EA 11 HOH 43 543 185 HOH HOH H . EA 11 HOH 44 544 186 HOH HOH H . EA 11 HOH 45 545 188 HOH HOH H . EA 11 HOH 46 546 196 HOH HOH H . EA 11 HOH 47 547 197 HOH HOH H . EA 11 HOH 48 548 198 HOH HOH H . EA 11 HOH 49 549 202 HOH HOH H . EA 11 HOH 50 550 203 HOH HOH H . EA 11 HOH 51 551 204 HOH HOH H . EA 11 HOH 52 552 222 HOH HOH H . EA 11 HOH 53 553 223 HOH HOH H . EA 11 HOH 54 554 224 HOH HOH H . EA 11 HOH 55 555 232 HOH HOH H . EA 11 HOH 56 556 234 HOH HOH H . EA 11 HOH 57 557 237 HOH HOH H . EA 11 HOH 58 558 238 HOH HOH H . EA 11 HOH 59 559 239 HOH HOH H . EA 11 HOH 60 560 240 HOH HOH H . EA 11 HOH 61 561 241 HOH HOH H . EA 11 HOH 62 562 243 HOH HOH H . FA 11 HOH 1 301 40 HOH HOH C . FA 11 HOH 2 302 41 HOH HOH C . FA 11 HOH 3 303 43 HOH HOH C . FA 11 HOH 4 304 44 HOH HOH C . FA 11 HOH 5 305 45 HOH HOH C . FA 11 HOH 6 306 46 HOH HOH C . FA 11 HOH 7 307 47 HOH HOH C . FA 11 HOH 8 308 48 HOH HOH C . FA 11 HOH 9 309 49 HOH HOH C . FA 11 HOH 10 310 50 HOH HOH C . FA 11 HOH 11 311 51 HOH HOH C . FA 11 HOH 12 312 77 HOH HOH C . FA 11 HOH 13 313 78 HOH HOH C . FA 11 HOH 14 314 95 HOH HOH C . FA 11 HOH 15 315 105 HOH HOH C . FA 11 HOH 16 316 124 HOH HOH C . FA 11 HOH 17 317 127 HOH HOH C . FA 11 HOH 18 318 132 HOH HOH C . FA 11 HOH 19 319 142 HOH HOH C . FA 11 HOH 20 320 148 HOH HOH C . FA 11 HOH 21 321 156 HOH HOH C . FA 11 HOH 22 322 164 HOH HOH C . FA 11 HOH 23 323 167 HOH HOH C . FA 11 HOH 24 324 168 HOH HOH C . FA 11 HOH 25 325 180 HOH HOH C . FA 11 HOH 26 326 181 HOH HOH C . FA 11 HOH 27 327 184 HOH HOH C . FA 11 HOH 28 328 191 HOH HOH C . FA 11 HOH 29 329 193 HOH HOH C . FA 11 HOH 30 330 200 HOH HOH C . FA 11 HOH 31 331 206 HOH HOH C . FA 11 HOH 32 332 209 HOH HOH C . FA 11 HOH 33 333 210 HOH HOH C . FA 11 HOH 34 334 229 HOH HOH C . GA 11 HOH 1 301 53 HOH HOH F . GA 11 HOH 2 302 62 HOH HOH F . GA 11 HOH 3 303 63 HOH HOH F . GA 11 HOH 4 304 64 HOH HOH F . GA 11 HOH 5 305 65 HOH HOH F . GA 11 HOH 6 306 66 HOH HOH F . GA 11 HOH 7 307 67 HOH HOH F . GA 11 HOH 8 308 68 HOH HOH F . GA 11 HOH 9 309 69 HOH HOH F . GA 11 HOH 10 310 70 HOH HOH F . GA 11 HOH 11 311 71 HOH HOH F . GA 11 HOH 12 312 74 HOH HOH F . GA 11 HOH 13 313 86 HOH HOH F . GA 11 HOH 14 314 88 HOH HOH F . GA 11 HOH 15 315 89 HOH HOH F . GA 11 HOH 16 316 101 HOH HOH F . GA 11 HOH 17 317 107 HOH HOH F . GA 11 HOH 18 318 108 HOH HOH F . GA 11 HOH 19 319 109 HOH HOH F . GA 11 HOH 20 320 112 HOH HOH F . GA 11 HOH 21 321 118 HOH HOH F . GA 11 HOH 22 322 123 HOH HOH F . GA 11 HOH 23 323 133 HOH HOH F . GA 11 HOH 24 324 134 HOH HOH F . GA 11 HOH 25 325 135 HOH HOH F . GA 11 HOH 26 326 145 HOH HOH F . GA 11 HOH 27 327 146 HOH HOH F . GA 11 HOH 28 328 151 HOH HOH F . GA 11 HOH 29 329 154 HOH HOH F . GA 11 HOH 30 330 158 HOH HOH F . GA 11 HOH 31 331 160 HOH HOH F . GA 11 HOH 32 332 161 HOH HOH F . GA 11 HOH 33 333 175 HOH HOH F . GA 11 HOH 34 334 176 HOH HOH F . GA 11 HOH 35 335 183 HOH HOH F . GA 11 HOH 36 336 187 HOH HOH F . GA 11 HOH 37 337 194 HOH HOH F . GA 11 HOH 38 338 201 HOH HOH F . GA 11 HOH 39 339 208 HOH HOH F . GA 11 HOH 40 340 212 HOH HOH F . GA 11 HOH 41 341 217 HOH HOH F . GA 11 HOH 42 342 218 HOH HOH F . GA 11 HOH 43 343 225 HOH HOH F . GA 11 HOH 44 344 228 HOH HOH F . GA 11 HOH 45 345 231 HOH HOH F . GA 11 HOH 46 346 233 HOH HOH F . GA 11 HOH 47 347 235 HOH HOH F . HA 11 HOH 1 401 1 HOH HOH L . HA 11 HOH 2 402 2 HOH HOH L . HA 11 HOH 3 403 3 HOH HOH L . HA 11 HOH 4 404 4 HOH HOH L . HA 11 HOH 5 405 5 HOH HOH L . HA 11 HOH 6 406 6 HOH HOH L . HA 11 HOH 7 407 7 HOH HOH L . HA 11 HOH 8 408 8 HOH HOH L . HA 11 HOH 9 409 9 HOH HOH L . HA 11 HOH 10 410 10 HOH HOH L . HA 11 HOH 11 411 11 HOH HOH L . HA 11 HOH 12 412 12 HOH HOH L . HA 11 HOH 13 413 13 HOH HOH L . HA 11 HOH 14 414 15 HOH HOH L . HA 11 HOH 15 415 16 HOH HOH L . HA 11 HOH 16 416 17 HOH HOH L . HA 11 HOH 17 417 18 HOH HOH L . HA 11 HOH 18 418 19 HOH HOH L . HA 11 HOH 19 419 83 HOH HOH L . HA 11 HOH 20 420 84 HOH HOH L . HA 11 HOH 21 421 90 HOH HOH L . HA 11 HOH 22 422 94 HOH HOH L . HA 11 HOH 23 423 96 HOH HOH L . HA 11 HOH 24 424 103 HOH HOH L . HA 11 HOH 25 425 110 HOH HOH L . HA 11 HOH 26 426 114 HOH HOH L . HA 11 HOH 27 427 115 HOH HOH L . HA 11 HOH 28 428 117 HOH HOH L . HA 11 HOH 29 429 125 HOH HOH L . HA 11 HOH 30 430 129 HOH HOH L . HA 11 HOH 31 431 130 HOH HOH L . HA 11 HOH 32 432 136 HOH HOH L . HA 11 HOH 33 433 137 HOH HOH L . HA 11 HOH 34 434 166 HOH HOH L . HA 11 HOH 35 435 169 HOH HOH L . HA 11 HOH 36 436 170 HOH HOH L . HA 11 HOH 37 437 171 HOH HOH L . HA 11 HOH 38 438 178 HOH HOH L . HA 11 HOH 39 439 189 HOH HOH L . HA 11 HOH 40 440 190 HOH HOH L . HA 11 HOH 41 441 199 HOH HOH L . HA 11 HOH 42 442 211 HOH HOH L . HA 11 HOH 43 443 213 HOH HOH L . HA 11 HOH 44 444 214 HOH HOH L . HA 11 HOH 45 445 215 HOH HOH L . HA 11 HOH 46 446 230 HOH HOH L . # 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 C ASN 88 H ASN 85 ? ASN 'GLYCOSYLATION SITE' 2 B ASN 88 E ASN 85 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 88 B ASN 85 ? ASN 'GLYCOSYLATION SITE' 4 A PCA 1 B PCA 1 ? GLU 'PYROGLUTAMIC ACID' 5 C PCA 1 H PCA 1 ? GLU 'PYROGLUTAMIC ACID' # 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 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,D,G,H,I,J,K,L,CA,FA 2 1 B,E,M,N,O,P,Q,DA,GA 3 1 C,F,R,S,T,U,V,W,X,Y,Z,AA,BA,EA,HA # 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)' 5130 ? 1 MORE -3 ? 1 'SSA (A^2)' 20520 ? 2 'ABSA (A^2)' 4830 ? 2 MORE -9 ? 2 'SSA (A^2)' 20610 ? 3 'ABSA (A^2)' 5860 ? 3 MORE 5 ? 3 'SSA (A^2)' 21320 ? # _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 # _pdbx_struct_special_symmetry.id 1 _pdbx_struct_special_symmetry.PDB_model_num 1 _pdbx_struct_special_symmetry.auth_asym_id L _pdbx_struct_special_symmetry.auth_comp_id HOH _pdbx_struct_special_symmetry.auth_seq_id 439 _pdbx_struct_special_symmetry.PDB_ins_code ? _pdbx_struct_special_symmetry.label_asym_id HA _pdbx_struct_special_symmetry.label_comp_id HOH _pdbx_struct_special_symmetry.label_seq_id . # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 O ? HA HOH . ? L HOH 443 ? 1_555 K ? BA K . ? L K 301 ? 1_555 OH ? F TYR 28 ? L TYR 27 A 1_555 99.7 ? 2 O ? HA HOH . ? L HOH 443 ? 1_555 K ? BA K . ? L K 301 ? 1_555 O ? HA HOH . ? L HOH 444 ? 1_555 62.9 ? 3 OH ? F TYR 28 ? L TYR 27 A 1_555 K ? BA K . ? L K 301 ? 1_555 O ? HA HOH . ? L HOH 444 ? 1_555 133.6 ? # 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 2014-04-09 2 'Structure model' 1 1 2014-06-11 3 'Structure model' 1 2 2014-07-09 4 'Structure model' 1 3 2017-11-15 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Database references' 2 3 'Structure model' 'Database references' 3 4 'Structure model' 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 4 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # 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 48.6886 -23.9037 35.1861 0.1709 0.2199 0.1442 -0.0769 -0.0117 0.0239 5.8018 4.2609 4.2141 2.7461 -1.0260 -1.2640 0.0406 -0.1934 -0.3097 -0.0271 -0.0813 0.0667 0.0505 0.1062 0.0407 'X-RAY DIFFRACTION' 2 ? refined 21.7630 -28.9094 59.2803 0.2431 0.6164 0.2897 -0.1971 -0.0148 0.0393 3.8322 2.0827 8.5882 -0.8089 -3.8140 1.4567 0.0266 -0.0285 0.0278 0.1106 -0.0378 0.2602 -0.0266 -0.5342 0.0111 'X-RAY DIFFRACTION' 3 ? refined 20.2106 -26.5654 59.4477 0.3609 0.5657 0.3102 -0.1195 -0.0060 0.0541 3.9176 3.5323 6.1993 0.1611 -2.7627 2.0237 0.0237 -0.0858 -0.1326 -0.1448 -0.0033 0.6314 -0.2810 -0.4229 -0.0204 'X-RAY DIFFRACTION' 4 ? refined -16.1268 -20.2086 36.7205 0.5390 0.9300 1.0837 -0.2382 0.2077 -0.3747 4.2401 12.2839 2.5768 6.7261 -1.2970 -2.2864 0.7189 -0.4619 1.6570 1.3146 -0.3330 1.7962 -0.9330 -0.2018 -0.3860 'X-RAY DIFFRACTION' 5 ? refined 14.6540 -19.6933 16.6858 0.3406 0.2764 0.4116 -0.1212 -0.0406 0.0653 4.3282 7.0710 6.1522 -0.7330 -1.5729 2.4580 -0.1535 0.2962 0.2953 -0.3478 0.1069 0.2854 0.1413 0.3600 0.0466 'X-RAY DIFFRACTION' 6 ? refined 14.5367 -20.1270 13.8488 0.3555 0.3572 0.3240 -0.0916 -0.1025 0.0554 6.0228 7.5990 5.6486 -0.9827 -3.4011 1.7778 0.1586 0.5502 0.5760 -0.9029 -0.0487 0.3743 -0.0551 0.3045 -0.1099 'X-RAY DIFFRACTION' 7 ? refined 23.0355 1.8320 -9.3007 0.1818 0.0638 0.1407 0.0674 -0.0024 -0.0311 7.3831 2.3562 3.3139 -0.3232 -0.3751 -0.4818 0.0870 0.1873 -0.4954 0.0144 -0.1505 0.0837 0.3006 -0.1238 0.0634 'X-RAY DIFFRACTION' 8 ? refined 52.7581 3.0150 11.8374 0.1210 0.0317 0.3674 -0.0283 -0.0318 0.0680 5.1466 1.6315 9.5741 -0.5035 0.3414 -1.5324 0.0323 -0.1519 0.0164 0.1751 -0.1542 -0.1944 -0.4826 0.0371 0.1219 'X-RAY DIFFRACTION' 9 ? refined 52.6870 1.0128 13.9142 0.1507 0.0499 0.3315 -0.0646 -0.0463 0.0183 4.7112 0.6673 11.5427 -0.7921 1.3167 -0.6871 0.0370 -0.1452 -0.2564 0.1187 -0.1145 -0.0616 -0.0451 0.0182 0.0776 'X-RAY DIFFRACTION' 10 ? refined 56.1450 -11.7582 50.5942 0.1840 0.5827 0.0803 -0.1646 -0.0255 0.0649 3.4913 1.6425 4.1152 -0.1570 -1.6147 0.8370 0.0048 -0.6687 -0.0385 0.2447 0.0782 0.0389 -0.1168 0.3262 -0.0830 'X-RAY DIFFRACTION' 11 ? refined 41.5504 -9.7010 67.9604 0.4536 0.5433 0.2326 -0.0558 -0.0202 -0.0180 7.0814 5.6692 42.0438 5.1927 -14.6402 -6.0616 0.3591 -0.1527 0.1383 0.5058 0.0083 0.0393 -0.2126 0.5811 -0.3675 'X-RAY DIFFRACTION' 12 ? refined 31.3449 -31.6978 70.6910 0.4147 0.7270 0.1553 -0.0872 0.1091 0.0933 4.6564 8.0195 1.7716 3.1263 -0.2690 -1.3084 0.2224 -0.5525 -0.4159 0.3112 -0.3453 -0.1603 0.2666 0.2370 0.1229 'X-RAY DIFFRACTION' 13 ? refined -14.7235 -40.6968 31.7368 0.1618 0.5061 0.1003 -0.2143 -0.0497 0.0366 7.4561 1.6841 3.9403 0.8080 -2.6838 0.8730 0.2639 -0.6163 -0.0256 0.0402 -0.1423 -0.1596 -0.1259 0.1640 -0.1216 'X-RAY DIFFRACTION' 14 ? refined 2.7748 -45.4686 17.9368 0.2431 0.2396 0.6663 -0.1898 0.0027 -0.1998 43.1381 1.8287 23.8263 6.4818 13.7933 -1.9990 -0.2060 1.1766 -0.6028 -0.2382 0.4551 -0.0956 0.8671 -0.8286 -0.2491 'X-RAY DIFFRACTION' 15 ? refined 20.7938 -30.8031 24.7266 0.2144 0.0806 0.2593 -0.0533 0.0736 -0.0679 9.3070 5.7969 2.2283 5.4174 2.5683 1.3468 -0.0181 0.0529 -0.0103 0.0129 -0.0635 -0.2998 0.0099 -0.0089 0.0816 'X-RAY DIFFRACTION' 16 ? refined 14.5753 9.6839 8.0624 0.1302 0.1083 0.1150 0.0113 0.0376 0.0019 6.5577 2.0749 3.9170 -0.7831 2.4642 0.0895 -0.0324 -0.6986 -0.0251 0.3208 0.0503 -0.1541 0.1416 0.0352 -0.0179 'X-RAY DIFFRACTION' 17 ? refined 29.6748 12.1785 25.3745 0.4511 0.6150 0.2051 0.0316 0.0283 -0.0129 41.0831 7.4623 11.5129 17.3063 16.8250 6.2069 -0.0801 -0.2401 0.0832 0.2281 -0.0009 0.0332 -1.4779 -0.2173 0.0811 'X-RAY DIFFRACTION' 18 ? refined 51.1166 17.1941 15.4984 0.3742 0.0379 0.2996 -0.0280 -0.1505 0.0371 8.8969 1.6442 4.5293 0.9996 -3.7955 -0.1634 0.0740 -0.2789 0.4988 -0.0081 -0.0677 -0.0904 -0.5506 -0.0494 -0.0063 # 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 B 1 ? ? B 116 ? ? ? ? 'X-RAY DIFFRACTION' 2 2 B 117 ? ? B 164 ? ? ? ? 'X-RAY DIFFRACTION' 3 3 B 165 ? ? B 213 ? ? ? ? 'X-RAY DIFFRACTION' 4 4 E 4 ? ? E 116 ? ? ? ? 'X-RAY DIFFRACTION' 5 5 E 117 ? ? E 164 ? ? ? ? 'X-RAY DIFFRACTION' 6 6 E 165 ? ? E 214 ? ? ? ? 'X-RAY DIFFRACTION' 7 7 H 1 ? ? H 116 ? ? ? ? 'X-RAY DIFFRACTION' 8 8 H 117 ? ? H 164 ? ? ? ? 'X-RAY DIFFRACTION' 9 9 H 165 ? ? H 213 ? ? ? ? 'X-RAY DIFFRACTION' 10 10 C 1 ? ? C 109 ? ? ? ? 'X-RAY DIFFRACTION' 11 11 C 110 ? ? C 115 ? ? ? ? 'X-RAY DIFFRACTION' 12 12 C 116 ? ? C 214 ? ? ? ? 'X-RAY DIFFRACTION' 13 13 F 1 ? ? F 109 ? ? ? ? 'X-RAY DIFFRACTION' 14 14 F 110 ? ? F 115 ? ? ? ? 'X-RAY DIFFRACTION' 15 15 F 116 ? ? F 214 ? ? ? ? 'X-RAY DIFFRACTION' 16 16 L 1 ? ? L 109 ? ? ? ? 'X-RAY DIFFRACTION' 17 17 L 110 ? ? L 115 ? ? ? ? 'X-RAY DIFFRACTION' 18 18 L 116 ? ? L 214 ? ? ? ? # _pdbx_phasing_MR.entry_id 4MA1 _pdbx_phasing_MR.method_rotation ? _pdbx_phasing_MR.method_translation ? _pdbx_phasing_MR.model_details 'Phaser MODE: MR_AUTO' _pdbx_phasing_MR.R_factor ? _pdbx_phasing_MR.R_rigid_body ? _pdbx_phasing_MR.correlation_coeff_Fo_to_Fc ? _pdbx_phasing_MR.correlation_coeff_Io_to_Ic ? _pdbx_phasing_MR.d_res_high_rotation 2.500 _pdbx_phasing_MR.d_res_low_rotation 29.910 _pdbx_phasing_MR.d_res_high_translation 2.500 _pdbx_phasing_MR.d_res_low_translation 29.910 _pdbx_phasing_MR.packing ? _pdbx_phasing_MR.reflns_percent_rotation ? _pdbx_phasing_MR.reflns_percent_translation ? _pdbx_phasing_MR.sigma_F_rotation ? _pdbx_phasing_MR.sigma_F_translation ? _pdbx_phasing_MR.sigma_I_rotation ? _pdbx_phasing_MR.sigma_I_translation ? # _phasing.method MR # loop_ _software.pdbx_ordinal _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id 1 DENZO . ? program 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data reduction' http://www.hkl-xray.com/ ? ? 2 SCALEPACK . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data scaling' http://www.hkl-xray.com/ ? ? 3 PHASER 2.3.0 'Tue Oct 18 19:46:39 2011 (svn )' program 'Randy J. Read' cimr-phaser@lists.cam.ac.uk phasing http://www-structmed.cimr.cam.ac.uk/phaser/ ? ? 4 REFMAC . ? program 'Garib N. Murshudov' garib@ysbl.york.ac.uk refinement http://www.ccp4.ac.uk/dist/html/refmac5.html Fortran_77 ? 5 PDB_EXTRACT 3.11 'April 22, 2011' package PDB deposit@deposit.rcsb.org 'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? # 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 O4 H NAG 401 ? ? O5 H NAG 403 ? ? 2.01 2 1 C6 H BMA 404 ? ? C1 H MAN 409 ? ? 2.16 3 1 ND2 H ASN 85 ? ? O5 H NAG 401 ? ? 2.16 4 1 CG H ASN 85 ? ? C1 H NAG 401 ? ? 2.18 5 1 ND2 H ASN 85 ? ? C2 H NAG 401 ? ? 2.18 # loop_ _pdbx_validate_rmsd_angle.id _pdbx_validate_rmsd_angle.PDB_model_num _pdbx_validate_rmsd_angle.auth_atom_id_1 _pdbx_validate_rmsd_angle.auth_asym_id_1 _pdbx_validate_rmsd_angle.auth_comp_id_1 _pdbx_validate_rmsd_angle.auth_seq_id_1 _pdbx_validate_rmsd_angle.PDB_ins_code_1 _pdbx_validate_rmsd_angle.label_alt_id_1 _pdbx_validate_rmsd_angle.auth_atom_id_2 _pdbx_validate_rmsd_angle.auth_asym_id_2 _pdbx_validate_rmsd_angle.auth_comp_id_2 _pdbx_validate_rmsd_angle.auth_seq_id_2 _pdbx_validate_rmsd_angle.PDB_ins_code_2 _pdbx_validate_rmsd_angle.label_alt_id_2 _pdbx_validate_rmsd_angle.auth_atom_id_3 _pdbx_validate_rmsd_angle.auth_asym_id_3 _pdbx_validate_rmsd_angle.auth_comp_id_3 _pdbx_validate_rmsd_angle.auth_seq_id_3 _pdbx_validate_rmsd_angle.PDB_ins_code_3 _pdbx_validate_rmsd_angle.label_alt_id_3 _pdbx_validate_rmsd_angle.angle_value _pdbx_validate_rmsd_angle.angle_target_value _pdbx_validate_rmsd_angle.angle_deviation _pdbx_validate_rmsd_angle.angle_standard_deviation _pdbx_validate_rmsd_angle.linker_flag 1 1 CA B CYS 140 ? ? CB B CYS 140 ? ? SG B CYS 140 ? ? 124.22 114.20 10.02 1.10 N 2 1 CA H CYS 140 ? B CB H CYS 140 ? B SG H CYS 140 ? B 123.96 114.20 9.76 1.10 N 3 1 CB F ARG 108 ? ? CA F ARG 108 ? ? C F ARG 108 ? ? 94.25 110.40 -16.15 2.00 N # 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 B 15 ? ? 78.69 -0.16 2 1 ARG B 66 ? ? -141.27 12.98 3 1 ASN B 85 ? ? -69.98 1.79 4 1 TRP B 100 A ? -125.70 -55.63 5 1 SER B 156 ? ? 60.31 -118.83 6 1 SER B 172 ? ? 57.31 -132.98 7 1 SER E 15 ? ? 81.92 -7.43 8 1 LYS E 75 ? ? 54.44 -130.60 9 1 SER E 82 B ? -116.90 73.23 10 1 PHE E 100 B ? -92.30 52.08 11 1 ALA E 101 ? ? -117.22 75.44 12 1 SER E 172 ? ? 57.97 -127.09 13 1 SER H 15 ? ? 77.97 -8.64 14 1 VAL C 51 ? ? 76.08 -55.23 15 1 VAL F 51 ? ? 73.72 -52.51 16 1 ASN F 212 ? ? -56.74 -3.19 17 1 VAL L 51 ? ? 74.22 -55.23 18 1 ASN L 212 ? ? -57.44 -5.48 # _pdbx_validate_peptide_omega.id 1 _pdbx_validate_peptide_omega.PDB_model_num 1 _pdbx_validate_peptide_omega.auth_comp_id_1 ASP _pdbx_validate_peptide_omega.auth_asym_id_1 B _pdbx_validate_peptide_omega.auth_seq_id_1 100 _pdbx_validate_peptide_omega.PDB_ins_code_1 ? _pdbx_validate_peptide_omega.label_alt_id_1 ? _pdbx_validate_peptide_omega.auth_comp_id_2 TRP _pdbx_validate_peptide_omega.auth_asym_id_2 B _pdbx_validate_peptide_omega.auth_seq_id_2 100 _pdbx_validate_peptide_omega.PDB_ins_code_2 A _pdbx_validate_peptide_omega.label_alt_id_2 ? _pdbx_validate_peptide_omega.omega -147.62 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 B ASP 214 ? A ASP 219 2 1 Y 1 E PCA 1 ? B PCA 1 3 1 Y 1 E VAL 2 ? B VAL 2 4 1 Y 1 E GLN 3 ? B GLN 3 5 1 Y 1 H ASP 214 ? C ASP 219 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 N-ACETYL-D-GLUCOSAMINE NAG 4 ALPHA-L-FUCOSE FUC 5 BETA-D-MANNOSE BMA 6 ALPHA-D-MANNOSE MAN 7 'DI(HYDROXYETHYL)ETHER' PEG 8 BETA-D-GALACTOSE GAL 9 'ALPHA D-GALACTOSE' GLA 10 'POTASSIUM ION' K 11 water HOH #