data_1KUK # _entry.id 1KUK # loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.country _citation.journal_id_ISSN _citation.journal_id_CSD _citation.book_publisher _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Determinants of the inhibition of a Taiwan habu venom metalloproteinase by its endogenous inhibitors revealed by X-ray crystallography and synthetic inhibitor analogues.' Eur.J.Biochem. 269 3047 3056 2002 EJBCAI IX 0014-2956 0262 ? 12071970 10.1046/j.1432-1033.2002.02982.x 1 'Characterization of multiple metalloproteinases with fibrinogenolytic activity from the venom of Taiwan habu (Trimeresurus mucrosquamatus): protein microsequencing coupled with cDNA sequence analysis.' 'Biochem Biophys Res Commun' 216 223 233 1995 BBRCA9 US '0006-291x; 1090-2104; ' 0146 ? 7488093 . # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal _citation_author.identifier_ORCID primary 'Huang, K.F.' 1 ? primary 'Chiou, S.H.' 2 ? primary 'Ko, T.P.' 3 ? primary 'Wang, A.H.' 4 ? 1 'Huang, K.F.' 5 ? 1 'Hung, C.C.' 6 ? 1 'Pan, F.M.' 7 ? 1 'Chow, L.P.' 8 ? 1 'Tsugita, A.' 9 ? 1 'Chiou, S.H.' 10 ? # 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 metalloproteinase 23378.809 1 3.4.24.44 ? 'CATALYTIC PROTEASE DOMAIN' ? 2 polymer syn EKW 444.504 1 ? ? ? ? 3 non-polymer syn 'CADMIUM ION' 112.411 10 ? ? ? ? 4 water nat water 18.015 454 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'Atrolysin e' # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;EQQRFPQRYIELAIVVDHGMYTKYSSNFKKIRKRVHQMVSNINEMCRPLNIAITLALLDVWSEKDFITVQADAPTTAGLF GDWRERVLLKKKNHDHAQLLTDTNFARNTIGWAYVGRMCDEKYSVAVVKDHSSKVFMVAVTMTHELGHNLGMEHDDKDKC KCDTCIMSAVISDKQSKLFSDCSKDYYQTFLTNDNPQCILNAP ; ;EQQRFPQRYIELAIVVDHGMYTKYSSNFKKIRKRVHQMVSNINEMCRPLNIAITLALLDVWSEKDFITVQADAPTTAGLF GDWRERVLLKKKNHDHAQLLTDTNFARNTIGWAYVGRMCDEKYSVAVVKDHSSKVFMVAVTMTHELGHNLGMEHDDKDKC KCDTCIMSAVISDKQSKLFSDCSKDYYQTFLTNDNPQCILNAP ; A ? 2 'polypeptide(L)' no yes '(PCA)KW' QKW B ? # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 'CADMIUM ION' CD 4 water HOH # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLU n 1 2 GLN n 1 3 GLN n 1 4 ARG n 1 5 PHE n 1 6 PRO n 1 7 GLN n 1 8 ARG n 1 9 TYR n 1 10 ILE n 1 11 GLU n 1 12 LEU n 1 13 ALA n 1 14 ILE n 1 15 VAL n 1 16 VAL n 1 17 ASP n 1 18 HIS n 1 19 GLY n 1 20 MET n 1 21 TYR n 1 22 THR n 1 23 LYS n 1 24 TYR n 1 25 SER n 1 26 SER n 1 27 ASN n 1 28 PHE n 1 29 LYS n 1 30 LYS n 1 31 ILE n 1 32 ARG n 1 33 LYS n 1 34 ARG n 1 35 VAL n 1 36 HIS n 1 37 GLN n 1 38 MET n 1 39 VAL n 1 40 SER n 1 41 ASN n 1 42 ILE n 1 43 ASN n 1 44 GLU n 1 45 MET n 1 46 CYS n 1 47 ARG n 1 48 PRO n 1 49 LEU n 1 50 ASN n 1 51 ILE n 1 52 ALA n 1 53 ILE n 1 54 THR n 1 55 LEU n 1 56 ALA n 1 57 LEU n 1 58 LEU n 1 59 ASP n 1 60 VAL n 1 61 TRP n 1 62 SER n 1 63 GLU n 1 64 LYS n 1 65 ASP n 1 66 PHE n 1 67 ILE n 1 68 THR n 1 69 VAL n 1 70 GLN n 1 71 ALA n 1 72 ASP n 1 73 ALA n 1 74 PRO n 1 75 THR n 1 76 THR n 1 77 ALA n 1 78 GLY n 1 79 LEU n 1 80 PHE n 1 81 GLY n 1 82 ASP n 1 83 TRP n 1 84 ARG n 1 85 GLU n 1 86 ARG n 1 87 VAL n 1 88 LEU n 1 89 LEU n 1 90 LYS n 1 91 LYS n 1 92 LYS n 1 93 ASN n 1 94 HIS n 1 95 ASP n 1 96 HIS n 1 97 ALA n 1 98 GLN n 1 99 LEU n 1 100 LEU n 1 101 THR n 1 102 ASP n 1 103 THR n 1 104 ASN n 1 105 PHE n 1 106 ALA n 1 107 ARG n 1 108 ASN n 1 109 THR n 1 110 ILE n 1 111 GLY n 1 112 TRP n 1 113 ALA n 1 114 TYR n 1 115 VAL n 1 116 GLY n 1 117 ARG n 1 118 MET n 1 119 CYS n 1 120 ASP n 1 121 GLU n 1 122 LYS n 1 123 TYR n 1 124 SER n 1 125 VAL n 1 126 ALA n 1 127 VAL n 1 128 VAL n 1 129 LYS n 1 130 ASP n 1 131 HIS n 1 132 SER n 1 133 SER n 1 134 LYS n 1 135 VAL n 1 136 PHE n 1 137 MET n 1 138 VAL n 1 139 ALA n 1 140 VAL n 1 141 THR n 1 142 MET n 1 143 THR n 1 144 HIS n 1 145 GLU n 1 146 LEU n 1 147 GLY n 1 148 HIS n 1 149 ASN n 1 150 LEU n 1 151 GLY n 1 152 MET n 1 153 GLU n 1 154 HIS n 1 155 ASP n 1 156 ASP n 1 157 LYS n 1 158 ASP n 1 159 LYS n 1 160 CYS n 1 161 LYS n 1 162 CYS n 1 163 ASP n 1 164 THR n 1 165 CYS n 1 166 ILE n 1 167 MET n 1 168 SER n 1 169 ALA n 1 170 VAL n 1 171 ILE n 1 172 SER n 1 173 ASP n 1 174 LYS n 1 175 GLN n 1 176 SER n 1 177 LYS n 1 178 LEU n 1 179 PHE n 1 180 SER n 1 181 ASP n 1 182 CYS n 1 183 SER n 1 184 LYS n 1 185 ASP n 1 186 TYR n 1 187 TYR n 1 188 GLN n 1 189 THR n 1 190 PHE n 1 191 LEU n 1 192 THR n 1 193 ASN n 1 194 ASP n 1 195 ASN n 1 196 PRO n 1 197 GLN n 1 198 CYS n 1 199 ILE n 1 200 LEU n 1 201 ASN n 1 202 ALA n 1 203 PRO n 2 1 PCA n 2 2 LYS n 2 3 TRP n # _entity_src_nat.entity_id 1 _entity_src_nat.pdbx_src_id 1 _entity_src_nat.pdbx_alt_source_flag sample _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 'Protobothrops mucrosquamatus' _entity_src_nat.pdbx_ncbi_taxonomy_id 103944 _entity_src_nat.genus Protobothrops _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 ? # _pdbx_entity_src_syn.entity_id 2 _pdbx_entity_src_syn.pdbx_src_id 1 _pdbx_entity_src_syn.pdbx_alt_source_flag sample _pdbx_entity_src_syn.pdbx_beg_seq_num ? _pdbx_entity_src_syn.pdbx_end_seq_num ? _pdbx_entity_src_syn.organism_scientific ? _pdbx_entity_src_syn.organism_common_name ? _pdbx_entity_src_syn.ncbi_taxonomy_id ? _pdbx_entity_src_syn.details 'pEKW was synthesized by solid-phase chemical method.' # 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 CD non-polymer . 'CADMIUM ION' ? 'Cd 2' 112.411 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 PCA 'L-peptide linking' n 'PYROGLUTAMIC ACID' ? 'C5 H7 N O3' 129.114 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 # 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 GLU 1 1 ? ? ? A . n A 1 2 GLN 2 2 ? ? ? A . n A 1 3 GLN 3 3 3 GLN GLN A . n A 1 4 ARG 4 4 4 ARG ARG A . n A 1 5 PHE 5 5 5 PHE PHE A . n A 1 6 PRO 6 6 6 PRO PRO A . n A 1 7 GLN 7 7 7 GLN GLN A . n A 1 8 ARG 8 8 8 ARG ARG A . n A 1 9 TYR 9 9 9 TYR TYR A . n A 1 10 ILE 10 10 10 ILE ILE A . n A 1 11 GLU 11 11 11 GLU GLU A . n A 1 12 LEU 12 12 12 LEU LEU A . n A 1 13 ALA 13 13 13 ALA ALA A . n A 1 14 ILE 14 14 14 ILE ILE A . n A 1 15 VAL 15 15 15 VAL VAL A . n A 1 16 VAL 16 16 16 VAL VAL A . n A 1 17 ASP 17 17 17 ASP ASP A . n A 1 18 HIS 18 18 18 HIS HIS A . n A 1 19 GLY 19 19 19 GLY GLY A . n A 1 20 MET 20 20 20 MET MET A . n A 1 21 TYR 21 21 21 TYR TYR A . n A 1 22 THR 22 22 22 THR THR A . n A 1 23 LYS 23 23 23 LYS LYS A . n A 1 24 TYR 24 24 24 TYR TYR A . n A 1 25 SER 25 25 25 SER SER A . n A 1 26 SER 26 26 26 SER SER A . n A 1 27 ASN 27 27 27 ASN ASN A . n A 1 28 PHE 28 28 28 PHE PHE A . n A 1 29 LYS 29 29 29 LYS LYS A . n A 1 30 LYS 30 30 30 LYS LYS A . n A 1 31 ILE 31 31 31 ILE ILE A . n A 1 32 ARG 32 32 32 ARG ARG A . n A 1 33 LYS 33 33 33 LYS LYS A . n A 1 34 ARG 34 34 34 ARG ARG A . n A 1 35 VAL 35 35 35 VAL VAL A . n A 1 36 HIS 36 36 36 HIS HIS A . n A 1 37 GLN 37 37 37 GLN GLN A . n A 1 38 MET 38 38 38 MET MET A . n A 1 39 VAL 39 39 39 VAL VAL A . n A 1 40 SER 40 40 40 SER SER A . n A 1 41 ASN 41 41 41 ASN ASN A . n A 1 42 ILE 42 42 42 ILE ILE A . n A 1 43 ASN 43 43 43 ASN ASN A . n A 1 44 GLU 44 44 44 GLU GLU A . n A 1 45 MET 45 45 45 MET MET A . n A 1 46 CYS 46 46 46 CYS CYS A . n A 1 47 ARG 47 47 47 ARG ARG A . n A 1 48 PRO 48 48 48 PRO PRO A . n A 1 49 LEU 49 49 49 LEU LEU A . n A 1 50 ASN 50 50 50 ASN ASN A . n A 1 51 ILE 51 51 51 ILE ILE A . n A 1 52 ALA 52 52 52 ALA ALA A . n A 1 53 ILE 53 53 53 ILE ILE A . n A 1 54 THR 54 54 54 THR THR A . n A 1 55 LEU 55 55 55 LEU LEU A . n A 1 56 ALA 56 56 56 ALA ALA A . n A 1 57 LEU 57 57 57 LEU LEU A . n A 1 58 LEU 58 58 58 LEU LEU A . n A 1 59 ASP 59 59 59 ASP ASP A . n A 1 60 VAL 60 60 60 VAL VAL A . n A 1 61 TRP 61 61 61 TRP TRP A . n A 1 62 SER 62 62 62 SER SER A . n A 1 63 GLU 63 63 63 GLU GLU A . n A 1 64 LYS 64 64 64 LYS LYS A . n A 1 65 ASP 65 65 65 ASP ASP A . n A 1 66 PHE 66 66 66 PHE PHE A . n A 1 67 ILE 67 67 67 ILE ILE A . n A 1 68 THR 68 68 68 THR THR A . n A 1 69 VAL 69 69 69 VAL VAL A . n A 1 70 GLN 70 70 70 GLN GLN A . n A 1 71 ALA 71 71 71 ALA ALA A . n A 1 72 ASP 72 72 72 ASP ASP A . n A 1 73 ALA 73 73 73 ALA ALA A . n A 1 74 PRO 74 74 74 PRO PRO A . n A 1 75 THR 75 75 75 THR THR A . n A 1 76 THR 76 76 76 THR THR A . n A 1 77 ALA 77 77 77 ALA ALA A . n A 1 78 GLY 78 78 78 GLY GLY A . n A 1 79 LEU 79 79 79 LEU LEU A . n A 1 80 PHE 80 80 80 PHE PHE A . n A 1 81 GLY 81 81 81 GLY GLY A . n A 1 82 ASP 82 82 82 ASP ASP A . n A 1 83 TRP 83 83 83 TRP TRP A . n A 1 84 ARG 84 84 84 ARG ARG A . n A 1 85 GLU 85 85 85 GLU GLU A . n A 1 86 ARG 86 86 86 ARG ARG A . n A 1 87 VAL 87 87 87 VAL VAL A . n A 1 88 LEU 88 88 88 LEU LEU A . n A 1 89 LEU 89 89 89 LEU LEU A . n A 1 90 LYS 90 90 90 LYS LYS A . n A 1 91 LYS 91 91 91 LYS LYS A . n A 1 92 LYS 92 92 92 LYS LYS A . n A 1 93 ASN 93 93 93 ASN ASN A . n A 1 94 HIS 94 94 94 HIS HIS A . n A 1 95 ASP 95 95 95 ASP ASP A . n A 1 96 HIS 96 96 96 HIS HIS A . n A 1 97 ALA 97 97 97 ALA ALA A . n A 1 98 GLN 98 98 98 GLN GLN A . n A 1 99 LEU 99 99 99 LEU LEU A . n A 1 100 LEU 100 100 100 LEU LEU A . n A 1 101 THR 101 101 101 THR THR A . n A 1 102 ASP 102 102 102 ASP ASP A . n A 1 103 THR 103 103 103 THR THR A . n A 1 104 ASN 104 104 104 ASN ASN A . n A 1 105 PHE 105 105 105 PHE PHE A . n A 1 106 ALA 106 106 106 ALA ALA A . n A 1 107 ARG 107 107 107 ARG ARG A . n A 1 108 ASN 108 108 108 ASN ASN A . n A 1 109 THR 109 109 109 THR THR A . n A 1 110 ILE 110 110 110 ILE ILE A . n A 1 111 GLY 111 111 111 GLY GLY A . n A 1 112 TRP 112 112 112 TRP TRP A . n A 1 113 ALA 113 113 113 ALA ALA A . n A 1 114 TYR 114 114 114 TYR TYR A . n A 1 115 VAL 115 115 115 VAL VAL A . n A 1 116 GLY 116 116 116 GLY GLY A . n A 1 117 ARG 117 117 117 ARG ARG A . n A 1 118 MET 118 118 118 MET MET A . n A 1 119 CYS 119 119 119 CYS CYS A . n A 1 120 ASP 120 120 120 ASP ASP A . n A 1 121 GLU 121 121 121 GLU GLU A . n A 1 122 LYS 122 122 122 LYS LYS A . n A 1 123 TYR 123 123 123 TYR TYR A . n A 1 124 SER 124 124 124 SER SER A . n A 1 125 VAL 125 125 125 VAL VAL A . n A 1 126 ALA 126 126 126 ALA ALA A . n A 1 127 VAL 127 127 127 VAL VAL A . n A 1 128 VAL 128 128 128 VAL VAL A . n A 1 129 LYS 129 129 129 LYS LYS A . n A 1 130 ASP 130 130 130 ASP ASP A . n A 1 131 HIS 131 131 131 HIS HIS A . n A 1 132 SER 132 132 132 SER SER A . n A 1 133 SER 133 133 133 SER SER A . n A 1 134 LYS 134 134 134 LYS LYS A . n A 1 135 VAL 135 135 135 VAL VAL A . n A 1 136 PHE 136 136 136 PHE PHE A . n A 1 137 MET 137 137 137 MET MET A . n A 1 138 VAL 138 138 138 VAL VAL A . n A 1 139 ALA 139 139 139 ALA ALA A . n A 1 140 VAL 140 140 140 VAL VAL A . n A 1 141 THR 141 141 141 THR THR A . n A 1 142 MET 142 142 142 MET MET A . n A 1 143 THR 143 143 143 THR THR A . n A 1 144 HIS 144 144 144 HIS HIS A . n A 1 145 GLU 145 145 145 GLU GLU A . n A 1 146 LEU 146 146 146 LEU LEU A . n A 1 147 GLY 147 147 147 GLY GLY A . n A 1 148 HIS 148 148 148 HIS HIS A . n A 1 149 ASN 149 149 149 ASN ASN A . n A 1 150 LEU 150 150 150 LEU LEU A . n A 1 151 GLY 151 151 151 GLY GLY A . n A 1 152 MET 152 152 152 MET MET A . n A 1 153 GLU 153 153 153 GLU GLU A . n A 1 154 HIS 154 154 154 HIS HIS A . n A 1 155 ASP 155 155 155 ASP ASP A . n A 1 156 ASP 156 156 156 ASP ASP A . n A 1 157 LYS 157 157 157 LYS LYS A . n A 1 158 ASP 158 158 158 ASP ASP A . n A 1 159 LYS 159 159 159 LYS LYS A . n A 1 160 CYS 160 160 160 CYS CYS A . n A 1 161 LYS 161 161 161 LYS LYS A . n A 1 162 CYS 162 162 162 CYS CYS A . n A 1 163 ASP 163 163 163 ASP ASP A . n A 1 164 THR 164 164 164 THR THR A . n A 1 165 CYS 165 165 165 CYS CYS A . n A 1 166 ILE 166 166 166 ILE ILE A . n A 1 167 MET 167 167 167 MET MET A . n A 1 168 SER 168 168 168 SER SER A . n A 1 169 ALA 169 169 169 ALA ALA A . n A 1 170 VAL 170 170 170 VAL VAL A . n A 1 171 ILE 171 171 171 ILE ILE A . n A 1 172 SER 172 172 172 SER SER A . n A 1 173 ASP 173 173 173 ASP ASP A . n A 1 174 LYS 174 174 174 LYS LYS A . n A 1 175 GLN 175 175 175 GLN GLN A . n A 1 176 SER 176 176 176 SER SER A . n A 1 177 LYS 177 177 177 LYS LYS A . n A 1 178 LEU 178 178 178 LEU LEU A . n A 1 179 PHE 179 179 179 PHE PHE A . n A 1 180 SER 180 180 180 SER SER A . n A 1 181 ASP 181 181 181 ASP ASP A . n A 1 182 CYS 182 182 182 CYS CYS A . n A 1 183 SER 183 183 183 SER SER A . n A 1 184 LYS 184 184 184 LYS LYS A . n A 1 185 ASP 185 185 185 ASP ASP A . n A 1 186 TYR 186 186 186 TYR TYR A . n A 1 187 TYR 187 187 187 TYR TYR A . n A 1 188 GLN 188 188 188 GLN GLN A . n A 1 189 THR 189 189 189 THR THR A . n A 1 190 PHE 190 190 190 PHE PHE A . n A 1 191 LEU 191 191 191 LEU LEU A . n A 1 192 THR 192 192 192 THR THR A . n A 1 193 ASN 193 193 193 ASN ASN A . n A 1 194 ASP 194 194 194 ASP ASP A . n A 1 195 ASN 195 195 195 ASN ASN A . n A 1 196 PRO 196 196 196 PRO PRO A . n A 1 197 GLN 197 197 197 GLN GLN A . n A 1 198 CYS 198 198 198 CYS CYS A . n A 1 199 ILE 199 199 199 ILE ILE A . n A 1 200 LEU 200 200 200 LEU LEU A . n A 1 201 ASN 201 201 201 ASN ASN A . n A 1 202 ALA 202 202 202 ALA ALA A . n A 1 203 PRO 203 203 203 PRO PRO A . n B 2 1 PCA 1 251 251 PCA PCA B . n B 2 2 LYS 2 252 252 LYS LYS B . n B 2 3 TRP 3 253 253 TRP TRP B . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code C 3 CD 1 801 801 CD CD A . D 3 CD 1 802 802 CD CD A . E 3 CD 1 803 803 CD CD A . F 3 CD 1 804 804 CD CD A . G 3 CD 1 805 805 CD CD A . H 3 CD 1 806 806 CD CD A . I 3 CD 1 807 807 CD CD A . J 3 CD 1 808 808 CD CD A . K 3 CD 1 809 809 CD CD A . L 3 CD 1 810 810 CD CD A . M 4 HOH 1 301 301 HOH HOH A . M 4 HOH 2 302 302 HOH HOH A . M 4 HOH 3 303 303 HOH HOH A . M 4 HOH 4 304 304 HOH HOH A . M 4 HOH 5 305 305 HOH HOH A . M 4 HOH 6 306 306 HOH HOH A . M 4 HOH 7 307 307 HOH HOH A . M 4 HOH 8 308 308 HOH HOH A . M 4 HOH 9 309 309 HOH HOH A . M 4 HOH 10 310 310 HOH HOH A . M 4 HOH 11 311 311 HOH HOH A . M 4 HOH 12 312 312 HOH HOH A . M 4 HOH 13 313 313 HOH HOH A . M 4 HOH 14 314 314 HOH HOH A . M 4 HOH 15 315 315 HOH HOH A . M 4 HOH 16 316 316 HOH HOH A . M 4 HOH 17 317 317 HOH HOH A . M 4 HOH 18 318 318 HOH HOH A . M 4 HOH 19 319 319 HOH HOH A . M 4 HOH 20 320 320 HOH HOH A . M 4 HOH 21 321 321 HOH HOH A . M 4 HOH 22 322 322 HOH HOH A . M 4 HOH 23 323 323 HOH HOH A . M 4 HOH 24 324 324 HOH HOH A . M 4 HOH 25 325 325 HOH HOH A . M 4 HOH 26 326 326 HOH HOH A . M 4 HOH 27 327 327 HOH HOH A . M 4 HOH 28 328 328 HOH HOH A . M 4 HOH 29 329 329 HOH HOH A . M 4 HOH 30 330 330 HOH HOH A . M 4 HOH 31 331 331 HOH HOH A . M 4 HOH 32 332 332 HOH HOH A . M 4 HOH 33 333 333 HOH HOH A . M 4 HOH 34 334 334 HOH HOH A . M 4 HOH 35 335 335 HOH HOH A . M 4 HOH 36 336 336 HOH HOH A . M 4 HOH 37 337 337 HOH HOH A . M 4 HOH 38 338 338 HOH HOH A . M 4 HOH 39 339 339 HOH HOH A . M 4 HOH 40 340 340 HOH HOH A . M 4 HOH 41 341 341 HOH HOH A . M 4 HOH 42 342 342 HOH HOH A . M 4 HOH 43 343 343 HOH HOH A . M 4 HOH 44 344 344 HOH HOH A . M 4 HOH 45 345 345 HOH HOH A . M 4 HOH 46 346 346 HOH HOH A . M 4 HOH 47 347 347 HOH HOH A . M 4 HOH 48 348 348 HOH HOH A . M 4 HOH 49 349 349 HOH HOH A . M 4 HOH 50 350 350 HOH HOH A . M 4 HOH 51 351 351 HOH HOH A . M 4 HOH 52 352 352 HOH HOH A . M 4 HOH 53 353 353 HOH HOH A . M 4 HOH 54 354 354 HOH HOH A . M 4 HOH 55 355 355 HOH HOH A . M 4 HOH 56 356 356 HOH HOH A . M 4 HOH 57 357 357 HOH HOH A . M 4 HOH 58 358 358 HOH HOH A . M 4 HOH 59 359 359 HOH HOH A . M 4 HOH 60 360 360 HOH HOH A . M 4 HOH 61 361 361 HOH HOH A . M 4 HOH 62 362 362 HOH HOH A . M 4 HOH 63 363 363 HOH HOH A . M 4 HOH 64 364 364 HOH HOH A . M 4 HOH 65 365 365 HOH HOH A . M 4 HOH 66 366 366 HOH HOH A . M 4 HOH 67 367 367 HOH HOH A . M 4 HOH 68 368 368 HOH HOH A . M 4 HOH 69 369 369 HOH HOH A . M 4 HOH 70 370 370 HOH HOH A . M 4 HOH 71 371 371 HOH HOH A . M 4 HOH 72 372 372 HOH HOH A . M 4 HOH 73 373 373 HOH HOH A . M 4 HOH 74 374 374 HOH HOH A . M 4 HOH 75 375 375 HOH HOH A . M 4 HOH 76 376 376 HOH HOH A . M 4 HOH 77 377 377 HOH HOH A . M 4 HOH 78 378 378 HOH HOH A . M 4 HOH 79 379 379 HOH HOH A . M 4 HOH 80 380 380 HOH HOH A . M 4 HOH 81 381 381 HOH HOH A . M 4 HOH 82 382 382 HOH HOH A . M 4 HOH 83 383 383 HOH HOH A . M 4 HOH 84 384 384 HOH HOH A . M 4 HOH 85 385 385 HOH HOH A . M 4 HOH 86 386 386 HOH HOH A . M 4 HOH 87 387 387 HOH HOH A . M 4 HOH 88 388 388 HOH HOH A . M 4 HOH 89 389 389 HOH HOH A . M 4 HOH 90 390 390 HOH HOH A . M 4 HOH 91 391 391 HOH HOH A . M 4 HOH 92 392 392 HOH HOH A . M 4 HOH 93 393 393 HOH HOH A . M 4 HOH 94 394 394 HOH HOH A . M 4 HOH 95 395 395 HOH HOH A . M 4 HOH 96 396 396 HOH HOH A . M 4 HOH 97 397 397 HOH HOH A . M 4 HOH 98 398 398 HOH HOH A . M 4 HOH 99 399 399 HOH HOH A . M 4 HOH 100 400 400 HOH HOH A . M 4 HOH 101 401 401 HOH HOH A . M 4 HOH 102 402 402 HOH HOH A . M 4 HOH 103 403 403 HOH HOH A . M 4 HOH 104 404 404 HOH HOH A . M 4 HOH 105 405 405 HOH HOH A . M 4 HOH 106 406 406 HOH HOH A . M 4 HOH 107 407 407 HOH HOH A . M 4 HOH 108 408 408 HOH HOH A . M 4 HOH 109 409 409 HOH HOH A . M 4 HOH 110 410 410 HOH HOH A . M 4 HOH 111 411 411 HOH HOH A . M 4 HOH 112 412 412 HOH HOH A . M 4 HOH 113 415 415 HOH HOH A . M 4 HOH 114 416 416 HOH HOH A . M 4 HOH 115 417 417 HOH HOH A . M 4 HOH 116 418 418 HOH HOH A . M 4 HOH 117 419 419 HOH HOH A . M 4 HOH 118 420 420 HOH HOH A . M 4 HOH 119 421 421 HOH HOH A . M 4 HOH 120 422 422 HOH HOH A . M 4 HOH 121 423 423 HOH HOH A . M 4 HOH 122 424 424 HOH HOH A . M 4 HOH 123 425 425 HOH HOH A . M 4 HOH 124 426 426 HOH HOH A . M 4 HOH 125 427 427 HOH HOH A . M 4 HOH 126 428 428 HOH HOH A . M 4 HOH 127 429 429 HOH HOH A . M 4 HOH 128 430 430 HOH HOH A . M 4 HOH 129 431 431 HOH HOH A . M 4 HOH 130 432 432 HOH HOH A . M 4 HOH 131 433 433 HOH HOH A . M 4 HOH 132 434 434 HOH HOH A . M 4 HOH 133 435 435 HOH HOH A . M 4 HOH 134 436 436 HOH HOH A . M 4 HOH 135 437 437 HOH HOH A . M 4 HOH 136 438 438 HOH HOH A . M 4 HOH 137 439 439 HOH HOH A . M 4 HOH 138 440 440 HOH HOH A . M 4 HOH 139 441 441 HOH HOH A . M 4 HOH 140 442 442 HOH HOH A . M 4 HOH 141 443 443 HOH HOH A . M 4 HOH 142 444 444 HOH HOH A . M 4 HOH 143 445 445 HOH HOH A . M 4 HOH 144 446 446 HOH HOH A . M 4 HOH 145 447 447 HOH HOH A . M 4 HOH 146 448 448 HOH HOH A . M 4 HOH 147 449 449 HOH HOH A . M 4 HOH 148 450 450 HOH HOH A . M 4 HOH 149 451 451 HOH HOH A . M 4 HOH 150 452 452 HOH HOH A . M 4 HOH 151 453 453 HOH HOH A . M 4 HOH 152 454 454 HOH HOH A . M 4 HOH 153 455 455 HOH HOH A . M 4 HOH 154 456 456 HOH HOH A . M 4 HOH 155 457 457 HOH HOH A . M 4 HOH 156 458 458 HOH HOH A . M 4 HOH 157 459 459 HOH HOH A . M 4 HOH 158 460 460 HOH HOH A . M 4 HOH 159 461 461 HOH HOH A . M 4 HOH 160 462 462 HOH HOH A . M 4 HOH 161 463 463 HOH HOH A . M 4 HOH 162 464 464 HOH HOH A . M 4 HOH 163 465 465 HOH HOH A . M 4 HOH 164 466 466 HOH HOH A . M 4 HOH 165 467 467 HOH HOH A . M 4 HOH 166 468 468 HOH HOH A . M 4 HOH 167 469 469 HOH HOH A . M 4 HOH 168 470 470 HOH HOH A . M 4 HOH 169 471 471 HOH HOH A . M 4 HOH 170 472 472 HOH HOH A . M 4 HOH 171 473 473 HOH HOH A . M 4 HOH 172 474 474 HOH HOH A . M 4 HOH 173 475 475 HOH HOH A . M 4 HOH 174 476 476 HOH HOH A . M 4 HOH 175 477 477 HOH HOH A . M 4 HOH 176 478 478 HOH HOH A . M 4 HOH 177 479 479 HOH HOH A . M 4 HOH 178 480 480 HOH HOH A . M 4 HOH 179 481 481 HOH HOH A . M 4 HOH 180 482 482 HOH HOH A . M 4 HOH 181 483 483 HOH HOH A . M 4 HOH 182 484 484 HOH HOH A . M 4 HOH 183 485 485 HOH HOH A . M 4 HOH 184 486 486 HOH HOH A . M 4 HOH 185 487 487 HOH HOH A . M 4 HOH 186 488 488 HOH HOH A . M 4 HOH 187 489 489 HOH HOH A . M 4 HOH 188 490 490 HOH HOH A . M 4 HOH 189 491 491 HOH HOH A . M 4 HOH 190 492 492 HOH HOH A . M 4 HOH 191 493 493 HOH HOH A . M 4 HOH 192 494 494 HOH HOH A . M 4 HOH 193 496 496 HOH HOH A . M 4 HOH 194 497 497 HOH HOH A . M 4 HOH 195 498 498 HOH HOH A . M 4 HOH 196 499 499 HOH HOH A . M 4 HOH 197 500 500 HOH HOH A . M 4 HOH 198 501 501 HOH HOH A . M 4 HOH 199 502 502 HOH HOH A . M 4 HOH 200 503 503 HOH HOH A . M 4 HOH 201 504 504 HOH HOH A . M 4 HOH 202 505 505 HOH HOH A . M 4 HOH 203 506 506 HOH HOH A . M 4 HOH 204 507 507 HOH HOH A . M 4 HOH 205 508 508 HOH HOH A . M 4 HOH 206 509 509 HOH HOH A . M 4 HOH 207 510 510 HOH HOH A . M 4 HOH 208 512 512 HOH HOH A . M 4 HOH 209 513 513 HOH HOH A . M 4 HOH 210 514 514 HOH HOH A . M 4 HOH 211 515 515 HOH HOH A . M 4 HOH 212 516 516 HOH HOH A . M 4 HOH 213 517 517 HOH HOH A . M 4 HOH 214 518 518 HOH HOH A . M 4 HOH 215 519 519 HOH HOH A . M 4 HOH 216 520 520 HOH HOH A . M 4 HOH 217 521 521 HOH HOH A . M 4 HOH 218 522 522 HOH HOH A . M 4 HOH 219 523 523 HOH HOH A . M 4 HOH 220 524 524 HOH HOH A . M 4 HOH 221 525 525 HOH HOH A . M 4 HOH 222 526 526 HOH HOH A . M 4 HOH 223 527 527 HOH HOH A . M 4 HOH 224 528 528 HOH HOH A . M 4 HOH 225 529 529 HOH HOH A . M 4 HOH 226 530 530 HOH HOH A . M 4 HOH 227 531 531 HOH HOH A . M 4 HOH 228 532 532 HOH HOH A . M 4 HOH 229 533 533 HOH HOH A . M 4 HOH 230 534 534 HOH HOH A . M 4 HOH 231 535 535 HOH HOH A . M 4 HOH 232 536 536 HOH HOH A . M 4 HOH 233 537 537 HOH HOH A . M 4 HOH 234 538 538 HOH HOH A . M 4 HOH 235 539 539 HOH HOH A . M 4 HOH 236 540 540 HOH HOH A . M 4 HOH 237 541 541 HOH HOH A . M 4 HOH 238 542 542 HOH HOH A . M 4 HOH 239 543 543 HOH HOH A . M 4 HOH 240 544 544 HOH HOH A . M 4 HOH 241 545 545 HOH HOH A . M 4 HOH 242 546 546 HOH HOH A . M 4 HOH 243 547 547 HOH HOH A . M 4 HOH 244 548 548 HOH HOH A . M 4 HOH 245 549 549 HOH HOH A . M 4 HOH 246 550 550 HOH HOH A . M 4 HOH 247 551 551 HOH HOH A . M 4 HOH 248 552 552 HOH HOH A . M 4 HOH 249 553 553 HOH HOH A . M 4 HOH 250 554 554 HOH HOH A . M 4 HOH 251 555 555 HOH HOH A . M 4 HOH 252 556 556 HOH HOH A . M 4 HOH 253 557 557 HOH HOH A . M 4 HOH 254 558 558 HOH HOH A . M 4 HOH 255 559 559 HOH HOH A . M 4 HOH 256 560 560 HOH HOH A . M 4 HOH 257 561 561 HOH HOH A . M 4 HOH 258 562 562 HOH HOH A . M 4 HOH 259 563 563 HOH HOH A . M 4 HOH 260 564 564 HOH HOH A . M 4 HOH 261 565 565 HOH HOH A . M 4 HOH 262 566 566 HOH HOH A . M 4 HOH 263 567 567 HOH HOH A . M 4 HOH 264 568 568 HOH HOH A . M 4 HOH 265 569 569 HOH HOH A . M 4 HOH 266 570 570 HOH HOH A . M 4 HOH 267 571 571 HOH HOH A . M 4 HOH 268 572 572 HOH HOH A . M 4 HOH 269 573 573 HOH HOH A . M 4 HOH 270 574 574 HOH HOH A . M 4 HOH 271 575 575 HOH HOH A . M 4 HOH 272 576 576 HOH HOH A . M 4 HOH 273 577 577 HOH HOH A . M 4 HOH 274 578 578 HOH HOH A . M 4 HOH 275 579 579 HOH HOH A . M 4 HOH 276 580 580 HOH HOH A . M 4 HOH 277 581 581 HOH HOH A . M 4 HOH 278 582 582 HOH HOH A . M 4 HOH 279 583 583 HOH HOH A . M 4 HOH 280 584 584 HOH HOH A . M 4 HOH 281 585 585 HOH HOH A . M 4 HOH 282 586 586 HOH HOH A . M 4 HOH 283 587 587 HOH HOH A . M 4 HOH 284 588 588 HOH HOH A . M 4 HOH 285 589 589 HOH HOH A . M 4 HOH 286 590 590 HOH HOH A . M 4 HOH 287 591 591 HOH HOH A . M 4 HOH 288 592 592 HOH HOH A . M 4 HOH 289 593 593 HOH HOH A . M 4 HOH 290 594 594 HOH HOH A . M 4 HOH 291 595 595 HOH HOH A . M 4 HOH 292 596 596 HOH HOH A . M 4 HOH 293 597 597 HOH HOH A . M 4 HOH 294 598 598 HOH HOH A . M 4 HOH 295 599 599 HOH HOH A . M 4 HOH 296 600 600 HOH HOH A . M 4 HOH 297 601 601 HOH HOH A . M 4 HOH 298 602 602 HOH HOH A . M 4 HOH 299 603 603 HOH HOH A . M 4 HOH 300 604 604 HOH HOH A . M 4 HOH 301 605 605 HOH HOH A . M 4 HOH 302 606 606 HOH HOH A . M 4 HOH 303 607 607 HOH HOH A . M 4 HOH 304 608 608 HOH HOH A . M 4 HOH 305 609 609 HOH HOH A . M 4 HOH 306 610 610 HOH HOH A . M 4 HOH 307 611 611 HOH HOH A . M 4 HOH 308 612 612 HOH HOH A . M 4 HOH 309 613 613 HOH HOH A . M 4 HOH 310 614 614 HOH HOH A . M 4 HOH 311 615 615 HOH HOH A . M 4 HOH 312 616 616 HOH HOH A . M 4 HOH 313 617 617 HOH HOH A . M 4 HOH 314 618 618 HOH HOH A . M 4 HOH 315 619 619 HOH HOH A . M 4 HOH 316 620 620 HOH HOH A . M 4 HOH 317 621 621 HOH HOH A . M 4 HOH 318 622 622 HOH HOH A . M 4 HOH 319 623 623 HOH HOH A . M 4 HOH 320 624 624 HOH HOH A . M 4 HOH 321 625 625 HOH HOH A . M 4 HOH 322 626 626 HOH HOH A . M 4 HOH 323 627 627 HOH HOH A . M 4 HOH 324 628 628 HOH HOH A . M 4 HOH 325 629 629 HOH HOH A . M 4 HOH 326 630 630 HOH HOH A . M 4 HOH 327 631 631 HOH HOH A . M 4 HOH 328 632 632 HOH HOH A . M 4 HOH 329 633 633 HOH HOH A . M 4 HOH 330 634 634 HOH HOH A . M 4 HOH 331 635 635 HOH HOH A . M 4 HOH 332 636 636 HOH HOH A . M 4 HOH 333 637 637 HOH HOH A . M 4 HOH 334 638 638 HOH HOH A . M 4 HOH 335 639 639 HOH HOH A . M 4 HOH 336 640 640 HOH HOH A . M 4 HOH 337 641 641 HOH HOH A . M 4 HOH 338 642 642 HOH HOH A . M 4 HOH 339 643 643 HOH HOH A . M 4 HOH 340 644 644 HOH HOH A . M 4 HOH 341 645 645 HOH HOH A . M 4 HOH 342 646 646 HOH HOH A . M 4 HOH 343 647 647 HOH HOH A . M 4 HOH 344 648 648 HOH HOH A . M 4 HOH 345 649 649 HOH HOH A . M 4 HOH 346 650 650 HOH HOH A . M 4 HOH 347 651 651 HOH HOH A . M 4 HOH 348 652 652 HOH HOH A . M 4 HOH 349 653 653 HOH HOH A . M 4 HOH 350 654 654 HOH HOH A . M 4 HOH 351 655 655 HOH HOH A . M 4 HOH 352 656 656 HOH HOH A . M 4 HOH 353 657 657 HOH HOH A . M 4 HOH 354 658 658 HOH HOH A . M 4 HOH 355 659 659 HOH HOH A . M 4 HOH 356 660 660 HOH HOH A . M 4 HOH 357 661 661 HOH HOH A . M 4 HOH 358 662 662 HOH HOH A . M 4 HOH 359 663 663 HOH HOH A . M 4 HOH 360 664 664 HOH HOH A . M 4 HOH 361 665 665 HOH HOH A . M 4 HOH 362 666 666 HOH HOH A . M 4 HOH 363 667 667 HOH HOH A . M 4 HOH 364 668 668 HOH HOH A . M 4 HOH 365 669 669 HOH HOH A . M 4 HOH 366 670 670 HOH HOH A . M 4 HOH 367 671 671 HOH HOH A . M 4 HOH 368 672 672 HOH HOH A . M 4 HOH 369 673 673 HOH HOH A . M 4 HOH 370 674 674 HOH HOH A . M 4 HOH 371 675 675 HOH HOH A . M 4 HOH 372 676 676 HOH HOH A . M 4 HOH 373 677 677 HOH HOH A . M 4 HOH 374 678 678 HOH HOH A . M 4 HOH 375 679 679 HOH HOH A . M 4 HOH 376 680 680 HOH HOH A . M 4 HOH 377 681 681 HOH HOH A . M 4 HOH 378 682 682 HOH HOH A . M 4 HOH 379 683 683 HOH HOH A . M 4 HOH 380 684 684 HOH HOH A . M 4 HOH 381 685 685 HOH HOH A . M 4 HOH 382 686 686 HOH HOH A . M 4 HOH 383 687 687 HOH HOH A . M 4 HOH 384 688 688 HOH HOH A . M 4 HOH 385 689 689 HOH HOH A . M 4 HOH 386 690 690 HOH HOH A . M 4 HOH 387 691 691 HOH HOH A . M 4 HOH 388 692 692 HOH HOH A . M 4 HOH 389 693 693 HOH HOH A . M 4 HOH 390 694 694 HOH HOH A . M 4 HOH 391 695 695 HOH HOH A . M 4 HOH 392 696 696 HOH HOH A . M 4 HOH 393 697 697 HOH HOH A . M 4 HOH 394 698 698 HOH HOH A . M 4 HOH 395 699 699 HOH HOH A . M 4 HOH 396 700 700 HOH HOH A . M 4 HOH 397 701 701 HOH HOH A . M 4 HOH 398 702 702 HOH HOH A . M 4 HOH 399 703 703 HOH HOH A . M 4 HOH 400 704 704 HOH HOH A . M 4 HOH 401 705 705 HOH HOH A . M 4 HOH 402 706 706 HOH HOH A . M 4 HOH 403 707 707 HOH HOH A . M 4 HOH 404 708 708 HOH HOH A . M 4 HOH 405 709 709 HOH HOH A . M 4 HOH 406 710 710 HOH HOH A . M 4 HOH 407 711 711 HOH HOH A . M 4 HOH 408 712 712 HOH HOH A . M 4 HOH 409 713 713 HOH HOH A . M 4 HOH 410 714 714 HOH HOH A . M 4 HOH 411 715 715 HOH HOH A . M 4 HOH 412 716 716 HOH HOH A . M 4 HOH 413 717 717 HOH HOH A . M 4 HOH 414 718 718 HOH HOH A . M 4 HOH 415 719 719 HOH HOH A . M 4 HOH 416 720 720 HOH HOH A . M 4 HOH 417 721 721 HOH HOH A . M 4 HOH 418 722 722 HOH HOH A . M 4 HOH 419 723 723 HOH HOH A . M 4 HOH 420 724 724 HOH HOH A . M 4 HOH 421 725 725 HOH HOH A . M 4 HOH 422 726 726 HOH HOH A . M 4 HOH 423 727 727 HOH HOH A . M 4 HOH 424 728 728 HOH HOH A . M 4 HOH 425 729 729 HOH HOH A . M 4 HOH 426 730 730 HOH HOH A . M 4 HOH 427 731 731 HOH HOH A . M 4 HOH 428 732 732 HOH HOH A . M 4 HOH 429 733 733 HOH HOH A . M 4 HOH 430 734 734 HOH HOH A . M 4 HOH 431 735 735 HOH HOH A . M 4 HOH 432 736 736 HOH HOH A . M 4 HOH 433 737 737 HOH HOH A . M 4 HOH 434 739 739 HOH HOH A . M 4 HOH 435 740 740 HOH HOH A . M 4 HOH 436 741 741 HOH HOH A . M 4 HOH 437 742 742 HOH HOH A . M 4 HOH 438 743 743 HOH HOH A . M 4 HOH 439 744 744 HOH HOH A . M 4 HOH 440 745 745 HOH HOH A . M 4 HOH 441 746 746 HOH HOH A . M 4 HOH 442 747 747 HOH HOH A . M 4 HOH 443 748 748 HOH HOH A . M 4 HOH 444 749 749 HOH HOH A . M 4 HOH 445 750 750 HOH HOH A . M 4 HOH 446 751 751 HOH HOH A . M 4 HOH 447 752 752 HOH HOH A . M 4 HOH 448 753 753 HOH HOH A . M 4 HOH 449 754 754 HOH HOH A . M 4 HOH 450 755 755 HOH HOH A . N 4 HOH 1 413 413 HOH HOH B . N 4 HOH 2 414 414 HOH HOH B . N 4 HOH 3 495 495 HOH HOH B . N 4 HOH 4 511 511 HOH HOH B . # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal DENZO 'data reduction' . ? 1 SCALEPACK 'data scaling' . ? 2 AMoRE phasing . ? 3 CNS refinement 1.0 ? 4 # _cell.entry_id 1KUK _cell.length_a 61.220 _cell.length_b 61.220 _cell.length_c 128.086 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 8 _cell.pdbx_unique_axis ? # _symmetry.entry_id 1KUK _symmetry.space_group_name_H-M 'P 41 21 2' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 92 # _exptl.entry_id 1KUK _exptl.method 'X-ray diffraction' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_percent_sol 51.12 _exptl_crystal.density_Matthews 2.52 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp 277 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 4.6 _exptl_crystal_grow.pdbx_details 'PEG400, sodium acetate, cadmium chloride, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 277K' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp 123 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector 'Image plate' _diffrn_detector.type RIGAKU _diffrn_detector.pdbx_collection_date 2000-12-22 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator ? _diffrn_radiation.pdbx_diffrn_protocol 'Single wavelength' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.54 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source Synchrotron _diffrn_source.type 'NSRRC BEAMLINE BL17B2' _diffrn_source.pdbx_synchrotron_site NSRRC _diffrn_source.pdbx_synchrotron_beamline BL17B2 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.54 # _reflns.entry_id 1KUK _reflns.observed_criterion_sigma_I 2.0 _reflns.observed_criterion_sigma_F 2.0 _reflns.d_resolution_low 30 _reflns.d_resolution_high 1.45 _reflns.number_obs 42718 _reflns.number_all 96550 _reflns.percent_possible_obs 96.8 _reflns.pdbx_Rmerge_I_obs 0.065 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 16.7 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 2.3 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 1.45 _reflns_shell.d_res_low 1.50 _reflns_shell.percent_possible_all 98.5 _reflns_shell.Rmerge_I_obs 0.41 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs 2.2 _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all 4269 _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 1KUK _refine.ls_number_reflns_obs 38792 _refine.ls_number_reflns_all 40834 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 2.0 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_d_res_low 30 _refine.ls_d_res_high 1.45 _refine.ls_percent_reflns_obs ? _refine.ls_R_factor_obs ? _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.182 _refine.ls_R_factor_R_free 0.207 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free ? _refine.ls_number_reflns_R_free 1742 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.B_iso_mean ? _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details ? _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values 'Engh & Huber' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details random _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_B ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_SU_ML ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.pdbx_refine_id 'X-ray diffraction' _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_phase_error ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-ray diffraction' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 1648 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 10 _refine_hist.number_atoms_solvent 454 _refine_hist.number_atoms_total 2112 _refine_hist.d_res_high 1.45 _refine_hist.d_res_low 30 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function 'c_bond_d' 0.014 ? ? ? 'X-ray diffraction' ? 'c_angle_deg' 1.61 ? ? ? 'X-ray diffraction' ? # _struct.entry_id 1KUK _struct.title 'Crystal Structure of a Taiwan Habu Venom Metalloproteinase complexed with pEKW.' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1KUK _struct_keywords.pdbx_keywords 'HYDROLASE/HYDROLASE INHIBITOR' _struct_keywords.text 'alpha/beta protein, retro-binding manner, HYDROLASE-HYDROLASE INHIBITOR COMPLEX' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 3 ? E N N 3 ? F N N 3 ? G N N 3 ? H N N 3 ? I N N 3 ? J N N 3 ? K N N 3 ? L N N 3 ? M N N 4 ? N N N 4 ? # loop_ _struct_ref.entity_id _struct_ref.pdbx_db_accession _struct_ref.db_code _struct_ref.db_name _struct_ref.id _struct_ref.pdbx_align_begin _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_db_isoform 1 O57413 O57413_TRIMU UNP 1 196 ;EQQRFPQRYIELAIVVDHGMHTKYSSNFKKIRKRVHQMVSNMNEMCRPLNIAITLALLDVWSEKDFITVQADAPTTAGLF GDWRERVLLKKKNHDHAQLLTDTNFARNTIGWAYVGRMCDEKYSVAVVKDHSSKVFMVAVTMTHELGHNLGMEHDDKDKC KCDTCIMSPVISDKQSKLFSDCSKDYYQTFLTNDNPQCILNAP ; ? 2 1KUK 1KUK PDB 2 1 EKW ? # 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 1KUK A 1 ? 203 ? O57413 196 ? 398 ? 1 203 2 2 1KUK B 1 ? 3 ? 1KUK 251 ? 253 ? 251 253 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 1KUK TYR A 21 ? UNP O57413 HIS 216 Conflict 21 1 1 1KUK ILE A 42 ? UNP O57413 MET 237 Conflict 42 2 1 1KUK ALA A 169 ? UNP O57413 PRO 364 Conflict 169 3 # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_and_software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details dimeric _pdbx_struct_assembly.oligomeric_count 2 # 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)' 1710 ? 1 MORE -50 ? 1 'SSA (A^2)' 9320 ? # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N # _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 # _struct_biol.id 1 _struct_biol.pdbx_parent_biol_id ? _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 ASP A 17 ? TYR A 24 ? ASP A 17 TYR A 24 1 ? 8 HELX_P HELX_P2 2 ASN A 27 ? ARG A 47 ? ASN A 27 ARG A 47 1 ? 21 HELX_P HELX_P3 3 ASP A 72 ? VAL A 87 ? ASP A 72 VAL A 87 1 ? 16 HELX_P HELX_P4 4 VAL A 87 ? LYS A 92 ? VAL A 87 LYS A 92 1 ? 6 HELX_P HELX_P5 5 PHE A 105 ? THR A 109 ? PHE A 105 THR A 109 5 ? 5 HELX_P HELX_P6 6 LYS A 134 ? LEU A 150 ? LYS A 134 LEU A 150 1 ? 17 HELX_P HELX_P7 7 SER A 180 ? ASP A 194 ? SER A 180 ASP A 194 1 ? 15 HELX_P HELX_P8 8 PRO A 196 ? LEU A 200 ? PRO A 196 LEU A 200 5 ? 5 # _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 _struct_conn.pdbx_role disulf1 disulf ? ? A CYS 119 SG ? ? ? 1_555 A CYS 198 SG ? ? A CYS 119 A CYS 198 1_555 ? ? ? ? ? ? ? 2.034 ? ? disulf2 disulf ? ? A CYS 160 SG ? ? ? 1_555 A CYS 182 SG ? ? A CYS 160 A CYS 182 1_555 ? ? ? ? ? ? ? 2.086 ? ? disulf3 disulf ? ? A CYS 162 SG ? ? ? 1_555 A CYS 165 SG ? ? A CYS 162 A CYS 165 1_555 ? ? ? ? ? ? ? 2.026 ? ? covale1 covale both ? B PCA 1 C ? ? ? 1_555 B LYS 2 N ? ? B PCA 251 B LYS 252 1_555 ? ? ? ? ? ? ? 1.330 ? ? metalc1 metalc ? ? A GLN 7 OE1 ? ? ? 1_555 G CD . CD ? ? A GLN 7 A CD 805 1_555 ? ? ? ? ? ? ? 2.227 ? ? metalc2 metalc ? ? A HIS 18 NE2 ? ? ? 1_555 F CD . CD ? ? A HIS 18 A CD 804 1_555 ? ? ? ? ? ? ? 2.268 ? ? metalc3 metalc ? ? A HIS 36 ND1 ? ? ? 1_555 D CD . CD ? ? A HIS 36 A CD 802 1_555 ? ? ? ? ? ? ? 2.268 ? ? metalc4 metalc ? ? A ASN 50 OD1 ? ? ? 1_555 G CD . CD ? ? A ASN 50 A CD 805 1_555 ? ? ? ? ? ? ? 2.204 ? ? metalc5 metalc ? ? A GLU 85 OE2 ? ? ? 1_555 L CD . CD ? ? A GLU 85 A CD 810 1_555 ? ? ? ? ? ? ? 2.153 ? ? metalc6 metalc ? ? A GLU 85 OE1 ? ? ? 1_555 L CD . CD ? ? A GLU 85 A CD 810 1_555 ? ? ? ? ? ? ? 2.969 ? ? metalc7 metalc ? ? A HIS 131 ND1 ? ? ? 1_555 J CD . CD ? ? A HIS 131 A CD 808 1_555 ? ? ? ? ? ? ? 2.244 ? ? metalc8 metalc ? ? A HIS 131 O ? ? ? 1_555 J CD . CD ? ? A HIS 131 A CD 808 1_555 ? ? ? ? ? ? ? 2.584 ? ? metalc9 metalc ? ? A HIS 144 NE2 ? ? ? 1_555 C CD . CD ? ? A HIS 144 A CD 801 1_555 ? ? ? ? ? ? ? 2.305 ? ? metalc10 metalc ? ? A HIS 148 NE2 ? ? ? 1_555 C CD . CD ? ? A HIS 148 A CD 801 1_555 ? ? ? ? ? ? ? 2.212 ? ? metalc11 metalc ? ? A HIS 154 NE2 ? ? ? 1_555 C CD . CD ? ? A HIS 154 A CD 801 1_555 ? ? ? ? ? ? ? 2.188 ? ? metalc12 metalc ? ? A ASP 156 OD1 ? ? ? 3_555 D CD . CD ? ? A ASP 156 A CD 802 1_555 ? ? ? ? ? ? ? 2.441 ? ? metalc13 metalc ? ? A ASP 156 OD2 ? ? ? 3_555 D CD . CD ? ? A ASP 156 A CD 802 1_555 ? ? ? ? ? ? ? 2.263 ? ? metalc14 metalc ? ? A ASP 158 OD2 ? ? ? 3_555 D CD . CD ? ? A ASP 158 A CD 802 1_555 ? ? ? ? ? ? ? 2.230 ? ? metalc15 metalc ? ? A ASP 181 OD2 ? ? ? 1_555 E CD . CD ? ? A ASP 181 A CD 803 1_555 ? ? ? ? ? ? ? 2.269 ? ? metalc16 metalc ? ? A ASP 181 OD1 ? ? ? 1_555 E CD . CD ? ? A ASP 181 A CD 803 1_555 ? ? ? ? ? ? ? 2.726 ? ? metalc17 metalc ? ? A ASP 185 OD1 ? ? ? 1_555 E CD . CD ? ? A ASP 185 A CD 803 1_555 ? ? ? ? ? ? ? 2.501 ? ? metalc18 metalc ? ? A ASP 185 OD2 ? ? ? 1_555 E CD . CD ? ? A ASP 185 A CD 803 1_555 ? ? ? ? ? ? ? 2.285 ? ? metalc19 metalc ? ? A ASP 194 OD2 ? ? ? 1_555 H CD . CD ? ? A ASP 194 A CD 806 1_555 ? ? ? ? ? ? ? 2.268 ? ? metalc20 metalc ? ? A ASP 194 OD1 ? ? ? 1_555 H CD . CD ? ? A ASP 194 A CD 806 1_555 ? ? ? ? ? ? ? 2.226 ? ? metalc21 metalc ? ? A PRO 203 O ? ? ? 1_555 I CD . CD ? ? A PRO 203 A CD 807 1_555 ? ? ? ? ? ? ? 2.422 ? ? metalc22 metalc ? ? A PRO 203 OXT ? ? ? 1_555 I CD . CD ? ? A PRO 203 A CD 807 1_555 ? ? ? ? ? ? ? 2.331 ? ? metalc23 metalc ? ? M HOH . O ? ? ? 1_555 G CD . CD ? ? A HOH 320 A CD 805 1_555 ? ? ? ? ? ? ? 2.505 ? ? metalc24 metalc ? ? M HOH . O ? ? ? 1_555 G CD . CD ? ? A HOH 321 A CD 805 1_555 ? ? ? ? ? ? ? 2.449 ? ? metalc25 metalc ? ? M HOH . O ? ? ? 4_454 E CD . CD ? ? A HOH 326 A CD 803 1_555 ? ? ? ? ? ? ? 2.427 ? ? metalc26 metalc ? ? M HOH . O ? ? ? 5_555 D CD . CD ? ? A HOH 349 A CD 802 1_555 ? ? ? ? ? ? ? 2.413 ? ? metalc27 metalc ? ? M HOH . O ? ? ? 3_555 D CD . CD ? ? A HOH 350 A CD 802 1_555 ? ? ? ? ? ? ? 2.287 ? ? metalc28 metalc ? ? M HOH . O ? ? ? 1_555 J CD . CD ? ? A HOH 355 A CD 808 1_555 ? ? ? ? ? ? ? 2.199 ? ? metalc29 metalc ? ? M HOH . O ? ? ? 1_555 J CD . CD ? ? A HOH 356 A CD 808 1_555 ? ? ? ? ? ? ? 2.540 ? ? metalc30 metalc ? ? M HOH . O ? ? ? 1_555 J CD . CD ? ? A HOH 357 A CD 808 1_555 ? ? ? ? ? ? ? 2.433 ? ? metalc31 metalc ? ? M HOH . O ? ? ? 1_555 K CD . CD ? ? A HOH 381 A CD 809 1_555 ? ? ? ? ? ? ? 2.543 ? ? metalc32 metalc ? ? M HOH . O ? ? ? 1_555 K CD . CD ? ? A HOH 387 A CD 809 1_555 ? ? ? ? ? ? ? 2.334 ? ? metalc33 metalc ? ? M HOH . O ? ? ? 3_555 I CD . CD ? ? A HOH 393 A CD 807 1_555 ? ? ? ? ? ? ? 2.959 ? ? metalc34 metalc ? ? M HOH . O ? ? ? 1_555 J CD . CD ? ? A HOH 425 A CD 808 1_555 ? ? ? ? ? ? ? 2.274 ? ? metalc35 metalc ? ? M HOH . O ? ? ? 1_555 E CD . CD ? ? A HOH 432 A CD 803 1_555 ? ? ? ? ? ? ? 2.257 ? ? metalc36 metalc ? ? M HOH . O ? ? ? 1_555 E CD . CD ? ? A HOH 434 A CD 803 1_555 ? ? ? ? ? ? ? 2.249 ? ? metalc37 metalc ? ? M HOH . O ? ? ? 1_555 G CD . CD ? ? A HOH 439 A CD 805 1_555 ? ? ? ? ? ? ? 2.303 ? ? metalc38 metalc ? ? M HOH . O ? ? ? 1_555 H CD . CD ? ? A HOH 443 A CD 806 1_555 ? ? ? ? ? ? ? 2.751 ? ? metalc39 metalc ? ? M HOH . O ? ? ? 1_555 L CD . CD ? ? A HOH 454 A CD 810 1_555 ? ? ? ? ? ? ? 2.374 ? ? metalc40 metalc ? ? M HOH . O ? ? ? 1_555 L CD . CD ? ? A HOH 455 A CD 810 1_555 ? ? ? ? ? ? ? 2.374 ? ? metalc41 metalc ? ? M HOH . O ? ? ? 1_555 L CD . CD ? ? A HOH 456 A CD 810 1_555 ? ? ? ? ? ? ? 2.070 ? ? metalc42 metalc ? ? M HOH . O ? ? ? 1_555 F CD . CD ? ? A HOH 468 A CD 804 1_555 ? ? ? ? ? ? ? 2.071 ? ? metalc43 metalc ? ? M HOH . O ? ? ? 1_555 K CD . CD ? ? A HOH 555 A CD 809 1_555 ? ? ? ? ? ? ? 2.875 ? ? metalc44 metalc ? ? M HOH . O ? ? ? 1_555 K CD . CD ? ? A HOH 556 A CD 809 1_555 ? ? ? ? ? ? ? 2.664 ? ? metalc45 metalc ? ? M HOH . O ? ? ? 1_555 K CD . CD ? ? A HOH 557 A CD 809 1_555 ? ? ? ? ? ? ? 2.151 ? ? metalc46 metalc ? ? M HOH . O ? ? ? 1_555 H CD . CD ? ? A HOH 578 A CD 806 1_555 ? ? ? ? ? ? ? 2.174 ? ? metalc47 metalc ? ? M HOH . O ? ? ? 1_555 F CD . CD ? ? A HOH 592 A CD 804 1_555 ? ? ? ? ? ? ? 3.047 ? ? metalc48 metalc ? ? M HOH . O ? ? ? 1_555 F CD . CD ? ? A HOH 626 A CD 804 1_555 ? ? ? ? ? ? ? 2.424 ? ? metalc49 metalc ? ? M HOH . O ? ? ? 1_555 G CD . CD ? ? A HOH 641 A CD 805 1_555 ? ? ? ? ? ? ? 2.353 ? ? metalc50 metalc ? ? M HOH . O ? ? ? 3_555 I CD . CD ? ? A HOH 741 A CD 807 1_555 ? ? ? ? ? ? ? 2.537 ? ? metalc51 metalc ? ? C CD . CD ? ? ? 1_555 B TRP 3 OXT ? ? A CD 801 B TRP 253 1_555 ? ? ? ? ? ? ? 2.133 ? ? metalc52 metalc ? ? C CD . CD ? ? ? 1_555 B TRP 3 O ? ? A CD 801 B TRP 253 1_555 ? ? ? ? ? ? ? 2.464 ? ? metalc53 metalc ? ? C CD . CD ? ? ? 1_555 N HOH . O ? ? A CD 801 B HOH 414 1_555 ? ? ? ? ? ? ? 2.369 ? ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # 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 OE1 ? A GLN 7 ? A GLN 7 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 OD1 ? A ASN 50 ? A ASN 50 ? 1_555 99.5 ? 2 OE1 ? A GLN 7 ? A GLN 7 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 320 ? 1_555 89.9 ? 3 OD1 ? A ASN 50 ? A ASN 50 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 320 ? 1_555 92.0 ? 4 OE1 ? A GLN 7 ? A GLN 7 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 321 ? 1_555 84.2 ? 5 OD1 ? A ASN 50 ? A ASN 50 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 321 ? 1_555 81.7 ? 6 O ? M HOH . ? A HOH 320 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 321 ? 1_555 170.6 ? 7 OE1 ? A GLN 7 ? A GLN 7 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 439 ? 1_555 83.3 ? 8 OD1 ? A ASN 50 ? A ASN 50 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 439 ? 1_555 166.7 ? 9 O ? M HOH . ? A HOH 320 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 439 ? 1_555 101.1 ? 10 O ? M HOH . ? A HOH 321 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 439 ? 1_555 85.6 ? 11 OE1 ? A GLN 7 ? A GLN 7 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 641 ? 1_555 177.4 ? 12 OD1 ? A ASN 50 ? A ASN 50 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 641 ? 1_555 82.6 ? 13 O ? M HOH . ? A HOH 320 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 641 ? 1_555 91.5 ? 14 O ? M HOH . ? A HOH 321 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 641 ? 1_555 94.6 ? 15 O ? M HOH . ? A HOH 439 ? 1_555 CD ? G CD . ? A CD 805 ? 1_555 O ? M HOH . ? A HOH 641 ? 1_555 94.3 ? 16 NE2 ? A HIS 18 ? A HIS 18 ? 1_555 CD ? F CD . ? A CD 804 ? 1_555 O ? M HOH . ? A HOH 468 ? 1_555 96.5 ? 17 NE2 ? A HIS 18 ? A HIS 18 ? 1_555 CD ? F CD . ? A CD 804 ? 1_555 O ? M HOH . ? A HOH 592 ? 1_555 92.1 ? 18 O ? M HOH . ? A HOH 468 ? 1_555 CD ? F CD . ? A CD 804 ? 1_555 O ? M HOH . ? A HOH 592 ? 1_555 141.0 ? 19 NE2 ? A HIS 18 ? A HIS 18 ? 1_555 CD ? F CD . ? A CD 804 ? 1_555 O ? M HOH . ? A HOH 626 ? 1_555 167.4 ? 20 O ? M HOH . ? A HOH 468 ? 1_555 CD ? F CD . ? A CD 804 ? 1_555 O ? M HOH . ? A HOH 626 ? 1_555 95.7 ? 21 O ? M HOH . ? A HOH 592 ? 1_555 CD ? F CD . ? A CD 804 ? 1_555 O ? M HOH . ? A HOH 626 ? 1_555 76.3 ? 22 ND1 ? A HIS 36 ? A HIS 36 ? 1_555 CD ? D CD . ? A CD 802 ? 1_555 OD1 ? A ASP 156 ? A ASP 156 ? 3_555 90.0 ? 23 ND1 ? A HIS 36 ? A HIS 36 ? 1_555 CD ? D CD . ? A CD 802 ? 1_555 OD2 ? A ASP 156 ? A ASP 156 ? 3_555 102.3 ? 24 OD1 ? A ASP 156 ? A ASP 156 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 OD2 ? A ASP 156 ? A ASP 156 ? 3_555 55.0 ? 25 ND1 ? A HIS 36 ? A HIS 36 ? 1_555 CD ? D CD . ? A CD 802 ? 1_555 OD2 ? A ASP 158 ? A ASP 158 ? 3_555 91.2 ? 26 OD1 ? A ASP 156 ? A ASP 156 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 OD2 ? A ASP 158 ? A ASP 158 ? 3_555 100.6 ? 27 OD2 ? A ASP 156 ? A ASP 156 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 OD2 ? A ASP 158 ? A ASP 158 ? 3_555 151.4 ? 28 ND1 ? A HIS 36 ? A HIS 36 ? 1_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 349 ? 5_555 98.6 ? 29 OD1 ? A ASP 156 ? A ASP 156 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 349 ? 5_555 154.7 ? 30 OD2 ? A ASP 156 ? A ASP 156 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 349 ? 5_555 99.7 ? 31 OD2 ? A ASP 158 ? A ASP 158 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 349 ? 5_555 103.0 ? 32 ND1 ? A HIS 36 ? A HIS 36 ? 1_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 350 ? 3_555 158.0 ? 33 OD1 ? A ASP 156 ? A ASP 156 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 350 ? 3_555 77.3 ? 34 OD2 ? A ASP 156 ? A ASP 156 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 350 ? 3_555 85.2 ? 35 OD2 ? A ASP 158 ? A ASP 158 ? 3_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 350 ? 3_555 73.9 ? 36 O ? M HOH . ? A HOH 349 ? 5_555 CD ? D CD . ? A CD 802 ? 1_555 O ? M HOH . ? A HOH 350 ? 3_555 100.5 ? 37 OE2 ? A GLU 85 ? A GLU 85 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 OE1 ? A GLU 85 ? A GLU 85 ? 1_555 47.9 ? 38 OE2 ? A GLU 85 ? A GLU 85 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 454 ? 1_555 126.2 ? 39 OE1 ? A GLU 85 ? A GLU 85 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 454 ? 1_555 84.4 ? 40 OE2 ? A GLU 85 ? A GLU 85 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 455 ? 1_555 105.9 ? 41 OE1 ? A GLU 85 ? A GLU 85 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 455 ? 1_555 85.5 ? 42 O ? M HOH . ? A HOH 454 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 455 ? 1_555 90.6 ? 43 OE2 ? A GLU 85 ? A GLU 85 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 456 ? 1_555 90.8 ? 44 OE1 ? A GLU 85 ? A GLU 85 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 456 ? 1_555 110.3 ? 45 O ? M HOH . ? A HOH 454 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 456 ? 1_555 83.6 ? 46 O ? M HOH . ? A HOH 455 ? 1_555 CD ? L CD . ? A CD 810 ? 1_555 O ? M HOH . ? A HOH 456 ? 1_555 162.5 ? 47 ND1 ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? A HIS 131 ? A HIS 131 ? 1_555 79.4 ? 48 ND1 ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 355 ? 1_555 99.3 ? 49 O ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 355 ? 1_555 87.8 ? 50 ND1 ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 356 ? 1_555 89.8 ? 51 O ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 356 ? 1_555 114.2 ? 52 O ? M HOH . ? A HOH 355 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 356 ? 1_555 157.5 ? 53 ND1 ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 357 ? 1_555 99.8 ? 54 O ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 357 ? 1_555 156.7 ? 55 O ? M HOH . ? A HOH 355 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 357 ? 1_555 69.3 ? 56 O ? M HOH . ? A HOH 356 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 357 ? 1_555 89.0 ? 57 ND1 ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 425 ? 1_555 162.2 ? 58 O ? A HIS 131 ? A HIS 131 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 425 ? 1_555 82.9 ? 59 O ? M HOH . ? A HOH 355 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 425 ? 1_555 81.1 ? 60 O ? M HOH . ? A HOH 356 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 425 ? 1_555 96.4 ? 61 O ? M HOH . ? A HOH 357 ? 1_555 CD ? J CD . ? A CD 808 ? 1_555 O ? M HOH . ? A HOH 425 ? 1_555 97.0 ? 62 NE2 ? A HIS 144 ? A HIS 144 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 NE2 ? A HIS 148 ? A HIS 148 ? 1_555 89.7 ? 63 NE2 ? A HIS 144 ? A HIS 144 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 NE2 ? A HIS 154 ? A HIS 154 ? 1_555 100.2 ? 64 NE2 ? A HIS 148 ? A HIS 148 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 NE2 ? A HIS 154 ? A HIS 154 ? 1_555 101.5 ? 65 NE2 ? A HIS 144 ? A HIS 144 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 OXT ? B TRP 3 ? B TRP 253 ? 1_555 102.5 ? 66 NE2 ? A HIS 148 ? A HIS 148 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 OXT ? B TRP 3 ? B TRP 253 ? 1_555 153.7 ? 67 NE2 ? A HIS 154 ? A HIS 154 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 OXT ? B TRP 3 ? B TRP 253 ? 1_555 99.2 ? 68 NE2 ? A HIS 144 ? A HIS 144 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? B TRP 3 ? B TRP 253 ? 1_555 80.5 ? 69 NE2 ? A HIS 148 ? A HIS 148 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? B TRP 3 ? B TRP 253 ? 1_555 104.5 ? 70 NE2 ? A HIS 154 ? A HIS 154 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? B TRP 3 ? B TRP 253 ? 1_555 154.0 ? 71 OXT ? B TRP 3 ? B TRP 253 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? B TRP 3 ? B TRP 253 ? 1_555 55.8 ? 72 NE2 ? A HIS 144 ? A HIS 144 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? N HOH . ? B HOH 414 ? 1_555 172.0 ? 73 NE2 ? A HIS 148 ? A HIS 148 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? N HOH . ? B HOH 414 ? 1_555 85.9 ? 74 NE2 ? A HIS 154 ? A HIS 154 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? N HOH . ? B HOH 414 ? 1_555 87.3 ? 75 OXT ? B TRP 3 ? B TRP 253 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? N HOH . ? B HOH 414 ? 1_555 79.0 ? 76 O ? B TRP 3 ? B TRP 253 ? 1_555 CD ? C CD . ? A CD 801 ? 1_555 O ? N HOH . ? B HOH 414 ? 1_555 94.1 ? 77 OD2 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 OD1 ? A ASP 181 ? A ASP 181 ? 1_555 50.8 ? 78 OD2 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 OD1 ? A ASP 185 ? A ASP 185 ? 1_555 101.9 ? 79 OD1 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 OD1 ? A ASP 185 ? A ASP 185 ? 1_555 78.2 ? 80 OD2 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 OD2 ? A ASP 185 ? A ASP 185 ? 1_555 86.2 ? 81 OD1 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 OD2 ? A ASP 185 ? A ASP 185 ? 1_555 106.4 ? 82 OD1 ? A ASP 185 ? A ASP 185 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 OD2 ? A ASP 185 ? A ASP 185 ? 1_555 53.3 ? 83 OD2 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 326 ? 4_454 94.5 ? 84 OD1 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 326 ? 4_454 138.7 ? 85 OD1 ? A ASP 185 ? A ASP 185 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 326 ? 4_454 137.9 ? 86 OD2 ? A ASP 185 ? A ASP 185 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 326 ? 4_454 90.2 ? 87 OD2 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 432 ? 1_555 169.5 ? 88 OD1 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 432 ? 1_555 118.8 ? 89 OD1 ? A ASP 185 ? A ASP 185 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 432 ? 1_555 72.4 ? 90 OD2 ? A ASP 185 ? A ASP 185 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 432 ? 1_555 96.9 ? 91 O ? M HOH . ? A HOH 326 ? 4_454 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 432 ? 1_555 95.5 ? 92 OD2 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 434 ? 1_555 96.5 ? 93 OD1 ? A ASP 181 ? A ASP 181 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 434 ? 1_555 70.3 ? 94 OD1 ? A ASP 185 ? A ASP 185 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 434 ? 1_555 119.1 ? 95 OD2 ? A ASP 185 ? A ASP 185 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 434 ? 1_555 172.4 ? 96 O ? M HOH . ? A HOH 326 ? 4_454 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 434 ? 1_555 96.7 ? 97 O ? M HOH . ? A HOH 432 ? 1_555 CD ? E CD . ? A CD 803 ? 1_555 O ? M HOH . ? A HOH 434 ? 1_555 79.2 ? 98 OD2 ? A ASP 194 ? A ASP 194 ? 1_555 CD ? H CD . ? A CD 806 ? 1_555 OD1 ? A ASP 194 ? A ASP 194 ? 1_555 58.3 ? 99 OD2 ? A ASP 194 ? A ASP 194 ? 1_555 CD ? H CD . ? A CD 806 ? 1_555 O ? M HOH . ? A HOH 443 ? 1_555 178.2 ? 100 OD1 ? A ASP 194 ? A ASP 194 ? 1_555 CD ? H CD . ? A CD 806 ? 1_555 O ? M HOH . ? A HOH 443 ? 1_555 120.3 ? 101 OD2 ? A ASP 194 ? A ASP 194 ? 1_555 CD ? H CD . ? A CD 806 ? 1_555 O ? M HOH . ? A HOH 578 ? 1_555 92.8 ? 102 OD1 ? A ASP 194 ? A ASP 194 ? 1_555 CD ? H CD . ? A CD 806 ? 1_555 O ? M HOH . ? A HOH 578 ? 1_555 87.4 ? 103 O ? M HOH . ? A HOH 443 ? 1_555 CD ? H CD . ? A CD 806 ? 1_555 O ? M HOH . ? A HOH 578 ? 1_555 85.9 ? 104 O ? A PRO 203 ? A PRO 203 ? 1_555 CD ? I CD . ? A CD 807 ? 1_555 OXT ? A PRO 203 ? A PRO 203 ? 1_555 55.4 ? 105 O ? A PRO 203 ? A PRO 203 ? 1_555 CD ? I CD . ? A CD 807 ? 1_555 O ? M HOH . ? A HOH 393 ? 3_555 156.7 ? 106 OXT ? A PRO 203 ? A PRO 203 ? 1_555 CD ? I CD . ? A CD 807 ? 1_555 O ? M HOH . ? A HOH 393 ? 3_555 101.7 ? 107 O ? A PRO 203 ? A PRO 203 ? 1_555 CD ? I CD . ? A CD 807 ? 1_555 O ? M HOH . ? A HOH 741 ? 3_555 108.5 ? 108 OXT ? A PRO 203 ? A PRO 203 ? 1_555 CD ? I CD . ? A CD 807 ? 1_555 O ? M HOH . ? A HOH 741 ? 3_555 139.0 ? 109 O ? M HOH . ? A HOH 393 ? 3_555 CD ? I CD . ? A CD 807 ? 1_555 O ? M HOH . ? A HOH 741 ? 3_555 91.6 ? 110 O ? M HOH . ? A HOH 381 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 387 ? 1_555 92.1 ? 111 O ? M HOH . ? A HOH 381 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 555 ? 1_555 98.0 ? 112 O ? M HOH . ? A HOH 387 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 555 ? 1_555 83.5 ? 113 O ? M HOH . ? A HOH 381 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 556 ? 1_555 163.9 ? 114 O ? M HOH . ? A HOH 387 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 556 ? 1_555 84.9 ? 115 O ? M HOH . ? A HOH 555 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 556 ? 1_555 97.4 ? 116 O ? M HOH . ? A HOH 381 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 557 ? 1_555 98.4 ? 117 O ? M HOH . ? A HOH 387 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 557 ? 1_555 169.5 ? 118 O ? M HOH . ? A HOH 555 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 557 ? 1_555 94.5 ? 119 O ? M HOH . ? A HOH 556 ? 1_555 CD ? K CD . ? A CD 809 ? 1_555 O ? M HOH . ? A HOH 557 ? 1_555 85.2 ? # loop_ _pdbx_modification_feature.ordinal _pdbx_modification_feature.label_comp_id _pdbx_modification_feature.label_asym_id _pdbx_modification_feature.label_seq_id _pdbx_modification_feature.label_alt_id _pdbx_modification_feature.modified_residue_label_comp_id _pdbx_modification_feature.modified_residue_label_asym_id _pdbx_modification_feature.modified_residue_label_seq_id _pdbx_modification_feature.modified_residue_label_alt_id _pdbx_modification_feature.auth_comp_id _pdbx_modification_feature.auth_asym_id _pdbx_modification_feature.auth_seq_id _pdbx_modification_feature.PDB_ins_code _pdbx_modification_feature.symmetry _pdbx_modification_feature.modified_residue_auth_comp_id _pdbx_modification_feature.modified_residue_auth_asym_id _pdbx_modification_feature.modified_residue_auth_seq_id _pdbx_modification_feature.modified_residue_PDB_ins_code _pdbx_modification_feature.modified_residue_symmetry _pdbx_modification_feature.comp_id_linking_atom _pdbx_modification_feature.modified_residue_id_linking_atom _pdbx_modification_feature.modified_residue_id _pdbx_modification_feature.ref_pcm_id _pdbx_modification_feature.ref_comp_id _pdbx_modification_feature.type _pdbx_modification_feature.category 1 PCA B 1 ? . . . . PCA B 251 ? 1_555 . . . . . . . GLN 1 PCA 'Pyrrolidone carboxylic acid' 'Named protein modification' 2 CYS A 119 ? CYS A 198 ? CYS A 119 ? 1_555 CYS A 198 ? 1_555 SG SG . . . None 'Disulfide bridge' 3 CYS A 160 ? CYS A 182 ? CYS A 160 ? 1_555 CYS A 182 ? 1_555 SG SG . . . None 'Disulfide bridge' 4 CYS A 162 ? CYS A 165 ? CYS A 162 ? 1_555 CYS A 165 ? 1_555 SG SG . . . None 'Disulfide bridge' # _struct_sheet.id A _struct_sheet.type ? _struct_sheet.number_strands 5 _struct_sheet.details ? # 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 ? parallel A 2 3 ? parallel A 3 4 ? parallel A 4 5 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 ILE A 51 ? VAL A 60 ? ILE A 51 VAL A 60 A 2 ARG A 8 ? VAL A 16 ? ARG A 8 VAL A 16 A 3 HIS A 96 ? THR A 101 ? HIS A 96 THR A 101 A 4 VAL A 125 ? LYS A 129 ? VAL A 125 LYS A 129 A 5 GLY A 111 ? ALA A 113 ? GLY A 111 ALA A 113 # 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 O THR A 54 ? O THR A 54 N LEU A 12 ? N LEU A 12 A 2 3 N VAL A 15 ? N VAL A 15 O LEU A 100 ? O LEU A 100 A 3 4 N LEU A 99 ? N LEU A 99 O VAL A 128 ? O VAL A 128 A 4 5 O VAL A 127 ? O VAL A 127 N TRP A 112 ? N TRP A 112 # loop_ _struct_site.id _struct_site.details _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code AC1 'BINDING SITE FOR RESIDUE CD' Software CD A 801 . AC2 'BINDING SITE FOR RESIDUE CD' Software CD A 802 . AC3 'BINDING SITE FOR RESIDUE CD' Software CD A 803 . AC4 'BINDING SITE FOR RESIDUE CD' Software CD A 804 . AC5 'BINDING SITE FOR RESIDUE CD' Software CD A 805 . AC6 'BINDING SITE FOR RESIDUE CD' Software CD A 806 . AC7 'BINDING SITE FOR RESIDUE CD' Software CD A 807 . AC8 'BINDING SITE FOR RESIDUE CD' Software CD A 808 . AC9 'BINDING SITE FOR RESIDUE CD' Software CD A 809 . BC1 'BINDING SITE FOR RESIDUE CD' Software CD A 810 . # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.symmetry 1 AC1 HIS A 144 . '1_555' 2 AC1 HIS A 148 . '1_555' 3 AC1 HIS A 154 . '1_555' 4 AC1 TRP B 253 . '1_555' 5 AC1 HOH B 414 . '1_555' 6 AC2 HIS A 36 . '1_555' 7 AC2 ASP A 156 . '3_555' 8 AC2 ASP A 158 . '3_555' 9 AC2 HOH A 349 . '5_555' 10 AC2 HOH A 350 . '3_555' 11 AC3 ASP A 181 . '1_555' 12 AC3 ASP A 185 . '1_555' 13 AC3 HOH A 326 . '4_454' 14 AC3 HOH A 432 . '1_555' 15 AC3 HOH A 434 . '1_555' 16 AC4 HIS A 18 . '1_555' 17 AC4 HOH A 468 . '1_555' 18 AC4 HOH A 592 . '1_555' 19 AC4 HOH A 626 . '1_555' 20 AC5 GLN A 7 . '1_555' 21 AC5 ASN A 50 . '1_555' 22 AC5 HOH A 320 . '1_555' 23 AC5 HOH A 321 . '1_555' 24 AC5 HOH A 439 . '1_555' 25 AC5 HOH A 641 . '1_555' 26 AC6 ASP A 194 . '1_555' 27 AC6 HOH A 443 . '1_555' 28 AC6 HOH A 578 . '1_555' 29 AC7 PRO A 203 . '1_555' 30 AC7 HOH A 393 . '3_555' 31 AC7 HOH A 741 . '3_555' 32 AC8 HIS A 131 . '1_555' 33 AC8 HOH A 355 . '1_555' 34 AC8 HOH A 356 . '1_555' 35 AC8 HOH A 357 . '1_555' 36 AC8 HOH A 425 . '1_555' 37 AC9 HOH A 381 . '1_555' 38 AC9 HOH A 387 . '1_555' 39 AC9 HOH A 555 . '1_555' 40 AC9 HOH A 556 . '1_555' 41 AC9 HOH A 557 . '1_555' 42 BC1 GLU A 85 . '8_555' 43 BC1 GLU A 85 . '1_555' 44 BC1 HOH A 454 . '1_555' 45 BC1 HOH A 455 . '1_555' 46 BC1 HOH A 456 . '1_555' # _pdbx_entry_details.entry_id 1KUK _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details ? _pdbx_entry_details.has_ligand_of_interest ? _pdbx_entry_details.has_protein_modification Y # 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 OD1 A ASP 173 ? ? O A HOH 740 ? ? 2.18 2 1 OD2 A ASP 95 ? ? O A HOH 343 ? ? 2.19 # loop_ _pdbx_validate_symm_contact.id _pdbx_validate_symm_contact.PDB_model_num _pdbx_validate_symm_contact.auth_atom_id_1 _pdbx_validate_symm_contact.auth_asym_id_1 _pdbx_validate_symm_contact.auth_comp_id_1 _pdbx_validate_symm_contact.auth_seq_id_1 _pdbx_validate_symm_contact.PDB_ins_code_1 _pdbx_validate_symm_contact.label_alt_id_1 _pdbx_validate_symm_contact.site_symmetry_1 _pdbx_validate_symm_contact.auth_atom_id_2 _pdbx_validate_symm_contact.auth_asym_id_2 _pdbx_validate_symm_contact.auth_comp_id_2 _pdbx_validate_symm_contact.auth_seq_id_2 _pdbx_validate_symm_contact.PDB_ins_code_2 _pdbx_validate_symm_contact.label_alt_id_2 _pdbx_validate_symm_contact.site_symmetry_2 _pdbx_validate_symm_contact.dist 1 1 O A HOH 703 ? ? 1_555 O A HOH 703 ? ? 8_555 1.35 2 1 O A HOH 747 ? ? 1_555 O A HOH 747 ? ? 7_555 2.05 3 1 O A HOH 740 ? ? 1_555 O A HOH 740 ? ? 7_555 2.15 # 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 TYR A 24 ? ? -92.14 39.00 2 1 VAL A 87 ? ? -121.18 -56.79 3 1 CYS A 119 ? ? 85.72 -19.09 # _pdbx_struct_mod_residue.id 1 _pdbx_struct_mod_residue.label_asym_id B _pdbx_struct_mod_residue.label_comp_id PCA _pdbx_struct_mod_residue.label_seq_id 1 _pdbx_struct_mod_residue.auth_asym_id B _pdbx_struct_mod_residue.auth_comp_id PCA _pdbx_struct_mod_residue.auth_seq_id 251 _pdbx_struct_mod_residue.PDB_ins_code ? _pdbx_struct_mod_residue.parent_comp_id GLN _pdbx_struct_mod_residue.details 'PYROGLUTAMIC ACID' # loop_ _pdbx_struct_special_symmetry.id _pdbx_struct_special_symmetry.PDB_model_num _pdbx_struct_special_symmetry.auth_asym_id _pdbx_struct_special_symmetry.auth_comp_id _pdbx_struct_special_symmetry.auth_seq_id _pdbx_struct_special_symmetry.PDB_ins_code _pdbx_struct_special_symmetry.label_asym_id _pdbx_struct_special_symmetry.label_comp_id _pdbx_struct_special_symmetry.label_seq_id 1 1 A HOH 601 ? M HOH . 2 1 A HOH 737 ? M HOH . # 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 A GLU 1 ? A GLU 1 2 1 Y 1 A GLN 2 ? A GLN 2 # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.pdbx_aromatic_flag _chem_comp_atom.pdbx_stereo_config _chem_comp_atom.pdbx_ordinal ALA N N N N 1 ALA CA C N S 2 ALA C C N N 3 ALA O O N N 4 ALA CB C N N 5 ALA OXT O N N 6 ALA H H N N 7 ALA H2 H N N 8 ALA HA H N N 9 ALA HB1 H N N 10 ALA HB2 H N N 11 ALA HB3 H N N 12 ALA HXT H N N 13 ARG N N N N 14 ARG CA C N S 15 ARG C C N N 16 ARG O O N N 17 ARG CB C N N 18 ARG CG C N N 19 ARG CD C N N 20 ARG NE N N N 21 ARG CZ C N N 22 ARG NH1 N N N 23 ARG NH2 N N N 24 ARG OXT O N N 25 ARG H H N N 26 ARG H2 H N N 27 ARG HA H N N 28 ARG HB2 H N N 29 ARG HB3 H N N 30 ARG HG2 H N N 31 ARG HG3 H N N 32 ARG HD2 H N N 33 ARG HD3 H N N 34 ARG HE H N N 35 ARG HH11 H N N 36 ARG HH12 H N N 37 ARG HH21 H N N 38 ARG HH22 H N N 39 ARG HXT H N N 40 ASN N N N N 41 ASN CA C N S 42 ASN C C N N 43 ASN O O N N 44 ASN CB C N N 45 ASN CG C N N 46 ASN OD1 O N N 47 ASN ND2 N N N 48 ASN OXT O N N 49 ASN H H N N 50 ASN H2 H N N 51 ASN HA H N N 52 ASN HB2 H N N 53 ASN HB3 H N N 54 ASN HD21 H N N 55 ASN HD22 H N N 56 ASN HXT H N N 57 ASP N N N N 58 ASP CA C N S 59 ASP C C N N 60 ASP O O N N 61 ASP CB C N N 62 ASP CG C N N 63 ASP OD1 O N N 64 ASP OD2 O N N 65 ASP OXT O N N 66 ASP H H N N 67 ASP H2 H N N 68 ASP HA H N N 69 ASP HB2 H N N 70 ASP HB3 H N N 71 ASP HD2 H N N 72 ASP HXT H N N 73 CD CD CD N N 74 CYS N N N N 75 CYS CA C N R 76 CYS C C N N 77 CYS O O N N 78 CYS CB C N N 79 CYS SG S N N 80 CYS OXT O N N 81 CYS H H N N 82 CYS H2 H N N 83 CYS HA H N N 84 CYS HB2 H N N 85 CYS HB3 H N N 86 CYS HG H N N 87 CYS HXT H N N 88 GLN N N N N 89 GLN CA C N S 90 GLN C C N N 91 GLN O O N N 92 GLN CB C N N 93 GLN CG C N N 94 GLN CD C N N 95 GLN OE1 O N N 96 GLN NE2 N N N 97 GLN OXT O N N 98 GLN H H N N 99 GLN H2 H N N 100 GLN HA H N N 101 GLN HB2 H N N 102 GLN HB3 H N N 103 GLN HG2 H N N 104 GLN HG3 H N N 105 GLN HE21 H N N 106 GLN HE22 H N N 107 GLN HXT H N N 108 GLU N N N N 109 GLU CA C N S 110 GLU C C N N 111 GLU O O N N 112 GLU CB C N N 113 GLU CG C N N 114 GLU CD C N N 115 GLU OE1 O N N 116 GLU OE2 O N N 117 GLU OXT O N N 118 GLU H H N N 119 GLU H2 H N N 120 GLU HA H N N 121 GLU HB2 H N N 122 GLU HB3 H N N 123 GLU HG2 H N N 124 GLU HG3 H N N 125 GLU HE2 H N N 126 GLU HXT H N N 127 GLY N N N N 128 GLY CA C N N 129 GLY C C N N 130 GLY O O N N 131 GLY OXT O N N 132 GLY H H N N 133 GLY H2 H N N 134 GLY HA2 H N N 135 GLY HA3 H N N 136 GLY HXT H N N 137 HIS N N N N 138 HIS CA C N S 139 HIS C C N N 140 HIS O O N N 141 HIS CB C N N 142 HIS CG C Y N 143 HIS ND1 N Y N 144 HIS CD2 C Y N 145 HIS CE1 C Y N 146 HIS NE2 N Y N 147 HIS OXT O N N 148 HIS H H N N 149 HIS H2 H N N 150 HIS HA H N N 151 HIS HB2 H N N 152 HIS HB3 H N N 153 HIS HD1 H N N 154 HIS HD2 H N N 155 HIS HE1 H N N 156 HIS HE2 H N N 157 HIS HXT H N N 158 HOH O O N N 159 HOH H1 H N N 160 HOH H2 H N N 161 ILE N N N N 162 ILE CA C N S 163 ILE C C N N 164 ILE O O N N 165 ILE CB C N S 166 ILE CG1 C N N 167 ILE CG2 C N N 168 ILE CD1 C N N 169 ILE OXT O N N 170 ILE H H N N 171 ILE H2 H N N 172 ILE HA H N N 173 ILE HB H N N 174 ILE HG12 H N N 175 ILE HG13 H N N 176 ILE HG21 H N N 177 ILE HG22 H N N 178 ILE HG23 H N N 179 ILE HD11 H N N 180 ILE HD12 H N N 181 ILE HD13 H N N 182 ILE HXT H N N 183 LEU N N N N 184 LEU CA C N S 185 LEU C C N N 186 LEU O O N N 187 LEU CB C N N 188 LEU CG C N N 189 LEU CD1 C N N 190 LEU CD2 C N N 191 LEU OXT O N N 192 LEU H H N N 193 LEU H2 H N N 194 LEU HA H N N 195 LEU HB2 H N N 196 LEU HB3 H N N 197 LEU HG H N N 198 LEU HD11 H N N 199 LEU HD12 H N N 200 LEU HD13 H N N 201 LEU HD21 H N N 202 LEU HD22 H N N 203 LEU HD23 H N N 204 LEU HXT H N N 205 LYS N N N N 206 LYS CA C N S 207 LYS C C N N 208 LYS O O N N 209 LYS CB C N N 210 LYS CG C N N 211 LYS CD C N N 212 LYS CE C N N 213 LYS NZ N N N 214 LYS OXT O N N 215 LYS H H N N 216 LYS H2 H N N 217 LYS HA H N N 218 LYS HB2 H N N 219 LYS HB3 H N N 220 LYS HG2 H N N 221 LYS HG3 H N N 222 LYS HD2 H N N 223 LYS HD3 H N N 224 LYS HE2 H N N 225 LYS HE3 H N N 226 LYS HZ1 H N N 227 LYS HZ2 H N N 228 LYS HZ3 H N N 229 LYS HXT H N N 230 MET N N N N 231 MET CA C N S 232 MET C C N N 233 MET O O N N 234 MET CB C N N 235 MET CG C N N 236 MET SD S N N 237 MET CE C N N 238 MET OXT O N N 239 MET H H N N 240 MET H2 H N N 241 MET HA H N N 242 MET HB2 H N N 243 MET HB3 H N N 244 MET HG2 H N N 245 MET HG3 H N N 246 MET HE1 H N N 247 MET HE2 H N N 248 MET HE3 H N N 249 MET HXT H N N 250 PCA N N N N 251 PCA CA C N S 252 PCA CB C N N 253 PCA CG C N N 254 PCA CD C N N 255 PCA OE O N N 256 PCA C C N N 257 PCA O O N N 258 PCA OXT O N N 259 PCA H H N N 260 PCA HA H N N 261 PCA HB2 H N N 262 PCA HB3 H N N 263 PCA HG2 H N N 264 PCA HG3 H N N 265 PCA HXT H N N 266 PHE N N N N 267 PHE CA C N S 268 PHE C C N N 269 PHE O O N N 270 PHE CB C N N 271 PHE CG C Y N 272 PHE CD1 C Y N 273 PHE CD2 C Y N 274 PHE CE1 C Y N 275 PHE CE2 C Y N 276 PHE CZ C Y N 277 PHE OXT O N N 278 PHE H H N N 279 PHE H2 H N N 280 PHE HA H N N 281 PHE HB2 H N N 282 PHE HB3 H N N 283 PHE HD1 H N N 284 PHE HD2 H N N 285 PHE HE1 H N N 286 PHE HE2 H N N 287 PHE HZ H N N 288 PHE HXT H N N 289 PRO N N N N 290 PRO CA C N S 291 PRO C C N N 292 PRO O O N N 293 PRO CB C N N 294 PRO CG C N N 295 PRO CD C N N 296 PRO OXT O N N 297 PRO H H N N 298 PRO HA H N N 299 PRO HB2 H N N 300 PRO HB3 H N N 301 PRO HG2 H N N 302 PRO HG3 H N N 303 PRO HD2 H N N 304 PRO HD3 H N N 305 PRO HXT H N N 306 SER N N N N 307 SER CA C N S 308 SER C C N N 309 SER O O N N 310 SER CB C N N 311 SER OG O N N 312 SER OXT O N N 313 SER H H N N 314 SER H2 H N N 315 SER HA H N N 316 SER HB2 H N N 317 SER HB3 H N N 318 SER HG H N N 319 SER HXT H N N 320 THR N N N N 321 THR CA C N S 322 THR C C N N 323 THR O O N N 324 THR CB C N R 325 THR OG1 O N N 326 THR CG2 C N N 327 THR OXT O N N 328 THR H H N N 329 THR H2 H N N 330 THR HA H N N 331 THR HB H N N 332 THR HG1 H N N 333 THR HG21 H N N 334 THR HG22 H N N 335 THR HG23 H N N 336 THR HXT H N N 337 TRP N N N N 338 TRP CA C N S 339 TRP C C N N 340 TRP O O N N 341 TRP CB C N N 342 TRP CG C Y N 343 TRP CD1 C Y N 344 TRP CD2 C Y N 345 TRP NE1 N Y N 346 TRP CE2 C Y N 347 TRP CE3 C Y N 348 TRP CZ2 C Y N 349 TRP CZ3 C Y N 350 TRP CH2 C Y N 351 TRP OXT O N N 352 TRP H H N N 353 TRP H2 H N N 354 TRP HA H N N 355 TRP HB2 H N N 356 TRP HB3 H N N 357 TRP HD1 H N N 358 TRP HE1 H N N 359 TRP HE3 H N N 360 TRP HZ2 H N N 361 TRP HZ3 H N N 362 TRP HH2 H N N 363 TRP HXT H N N 364 TYR N N N N 365 TYR CA C N S 366 TYR C C N N 367 TYR O O N N 368 TYR CB C N N 369 TYR CG C Y N 370 TYR CD1 C Y N 371 TYR CD2 C Y N 372 TYR CE1 C Y N 373 TYR CE2 C Y N 374 TYR CZ C Y N 375 TYR OH O N N 376 TYR OXT O N N 377 TYR H H N N 378 TYR H2 H N N 379 TYR HA H N N 380 TYR HB2 H N N 381 TYR HB3 H N N 382 TYR HD1 H N N 383 TYR HD2 H N N 384 TYR HE1 H N N 385 TYR HE2 H N N 386 TYR HH H N N 387 TYR HXT H N N 388 VAL N N N N 389 VAL CA C N S 390 VAL C C N N 391 VAL O O N N 392 VAL CB C N N 393 VAL CG1 C N N 394 VAL CG2 C N N 395 VAL OXT O N N 396 VAL H H N N 397 VAL H2 H N N 398 VAL HA H N N 399 VAL HB H N N 400 VAL HG11 H N N 401 VAL HG12 H N N 402 VAL HG13 H N N 403 VAL HG21 H N N 404 VAL HG22 H N N 405 VAL HG23 H N N 406 VAL HXT H N N 407 # loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.value_order _chem_comp_bond.pdbx_aromatic_flag _chem_comp_bond.pdbx_stereo_config _chem_comp_bond.pdbx_ordinal ALA N CA SING N N 1 ALA N H SING N N 2 ALA N H2 SING N N 3 ALA CA C SING N N 4 ALA CA CB SING N N 5 ALA CA HA SING N N 6 ALA C O DOUB N N 7 ALA C OXT SING N N 8 ALA CB HB1 SING N N 9 ALA CB HB2 SING N N 10 ALA CB HB3 SING N N 11 ALA OXT HXT SING N N 12 ARG N CA SING N N 1 ARG N H SING N N 2 ARG N H2 SING N N 3 ARG CA C SING N N 4 ARG CA CB SING N N 5 ARG CA HA SING N N 6 ARG C O DOUB N N 7 ARG C OXT SING N N 8 ARG CB CG SING N N 9 ARG CB HB2 SING N N 10 ARG CB HB3 SING N N 11 ARG CG CD SING N N 12 ARG CG HG2 SING N N 13 ARG CG HG3 SING N N 14 ARG CD NE SING N N 15 ARG CD HD2 SING N N 16 ARG CD HD3 SING N N 17 ARG NE CZ SING N N 18 ARG NE HE SING N N 19 ARG CZ NH1 SING N N 20 ARG CZ NH2 DOUB N N 21 ARG NH1 HH11 SING N N 22 ARG NH1 HH12 SING N N 23 ARG NH2 HH21 SING N N 24 ARG NH2 HH22 SING N N 25 ARG OXT HXT SING N N 26 ASN N CA SING N N 1 ASN N H SING N N 2 ASN N H2 SING N N 3 ASN CA C SING N N 4 ASN CA CB SING N N 5 ASN CA HA SING N N 6 ASN C O DOUB N N 7 ASN C OXT SING N N 8 ASN CB CG SING N N 9 ASN CB HB2 SING N N 10 ASN CB HB3 SING N N 11 ASN CG OD1 DOUB N N 12 ASN CG ND2 SING N N 13 ASN ND2 HD21 SING N N 14 ASN ND2 HD22 SING N N 15 ASN OXT HXT SING N N 16 ASP N CA SING N N 1 ASP N H SING N N 2 ASP N H2 SING N N 3 ASP CA C SING N N 4 ASP CA CB SING N N 5 ASP CA HA SING N N 6 ASP C O DOUB N N 7 ASP C OXT SING N N 8 ASP CB CG SING N N 9 ASP CB HB2 SING N N 10 ASP CB HB3 SING N N 11 ASP CG OD1 DOUB N N 12 ASP CG OD2 SING N N 13 ASP OD2 HD2 SING N N 14 ASP OXT HXT SING N N 15 CYS N CA SING N N 1 CYS N H SING N N 2 CYS N H2 SING N N 3 CYS CA C SING N N 4 CYS CA CB SING N N 5 CYS CA HA SING N N 6 CYS C O DOUB N N 7 CYS C OXT SING N N 8 CYS CB SG SING N N 9 CYS CB HB2 SING N N 10 CYS CB HB3 SING N N 11 CYS SG HG SING N N 12 CYS OXT HXT SING N N 13 GLN N CA SING N N 1 GLN N H SING N N 2 GLN N H2 SING N N 3 GLN CA C SING N N 4 GLN CA CB SING N N 5 GLN CA HA SING N N 6 GLN C O DOUB N N 7 GLN C OXT SING N N 8 GLN CB CG SING N N 9 GLN CB HB2 SING N N 10 GLN CB HB3 SING N N 11 GLN CG CD SING N N 12 GLN CG HG2 SING N N 13 GLN CG HG3 SING N N 14 GLN CD OE1 DOUB N N 15 GLN CD NE2 SING N N 16 GLN NE2 HE21 SING N N 17 GLN NE2 HE22 SING N N 18 GLN OXT HXT SING N N 19 GLU N CA SING N N 1 GLU N H SING N N 2 GLU N H2 SING N N 3 GLU CA C SING N N 4 GLU CA CB SING N N 5 GLU CA HA SING N N 6 GLU C O DOUB N N 7 GLU C OXT SING N N 8 GLU CB CG SING N N 9 GLU CB HB2 SING N N 10 GLU CB HB3 SING N N 11 GLU CG CD SING N N 12 GLU CG HG2 SING N N 13 GLU CG HG3 SING N N 14 GLU CD OE1 DOUB N N 15 GLU CD OE2 SING N N 16 GLU OE2 HE2 SING N N 17 GLU OXT HXT SING N N 18 GLY N CA SING N N 1 GLY N H SING N N 2 GLY N H2 SING N N 3 GLY CA C SING N N 4 GLY CA HA2 SING N N 5 GLY CA HA3 SING N N 6 GLY C O DOUB N N 7 GLY C OXT SING N N 8 GLY OXT HXT SING N N 9 HIS N CA SING N N 1 HIS N H SING N N 2 HIS N H2 SING N N 3 HIS CA C SING N N 4 HIS CA CB SING N N 5 HIS CA HA SING N N 6 HIS C O DOUB N N 7 HIS C OXT SING N N 8 HIS CB CG SING N N 9 HIS CB HB2 SING N N 10 HIS CB HB3 SING N N 11 HIS CG ND1 SING Y N 12 HIS CG CD2 DOUB Y N 13 HIS ND1 CE1 DOUB Y N 14 HIS ND1 HD1 SING N N 15 HIS CD2 NE2 SING Y N 16 HIS CD2 HD2 SING N N 17 HIS CE1 NE2 SING Y N 18 HIS CE1 HE1 SING N N 19 HIS NE2 HE2 SING N N 20 HIS OXT HXT SING N N 21 HOH O H1 SING N N 1 HOH O H2 SING N N 2 ILE N CA SING N N 1 ILE N H SING N N 2 ILE N H2 SING N N 3 ILE CA C SING N N 4 ILE CA CB SING N N 5 ILE CA HA SING N N 6 ILE C O DOUB N N 7 ILE C OXT SING N N 8 ILE CB CG1 SING N N 9 ILE CB CG2 SING N N 10 ILE CB HB SING N N 11 ILE CG1 CD1 SING N N 12 ILE CG1 HG12 SING N N 13 ILE CG1 HG13 SING N N 14 ILE CG2 HG21 SING N N 15 ILE CG2 HG22 SING N N 16 ILE CG2 HG23 SING N N 17 ILE CD1 HD11 SING N N 18 ILE CD1 HD12 SING N N 19 ILE CD1 HD13 SING N N 20 ILE OXT HXT SING N N 21 LEU N CA SING N N 1 LEU N H SING N N 2 LEU N H2 SING N N 3 LEU CA C SING N N 4 LEU CA CB SING N N 5 LEU CA HA SING N N 6 LEU C O DOUB N N 7 LEU C OXT SING N N 8 LEU CB CG SING N N 9 LEU CB HB2 SING N N 10 LEU CB HB3 SING N N 11 LEU CG CD1 SING N N 12 LEU CG CD2 SING N N 13 LEU CG HG SING N N 14 LEU CD1 HD11 SING N N 15 LEU CD1 HD12 SING N N 16 LEU CD1 HD13 SING N N 17 LEU CD2 HD21 SING N N 18 LEU CD2 HD22 SING N N 19 LEU CD2 HD23 SING N N 20 LEU OXT HXT SING N N 21 LYS N CA SING N N 1 LYS N H SING N N 2 LYS N H2 SING N N 3 LYS CA C SING N N 4 LYS CA CB SING N N 5 LYS CA HA SING N N 6 LYS C O DOUB N N 7 LYS C OXT SING N N 8 LYS CB CG SING N N 9 LYS CB HB2 SING N N 10 LYS CB HB3 SING N N 11 LYS CG CD SING N N 12 LYS CG HG2 SING N N 13 LYS CG HG3 SING N N 14 LYS CD CE SING N N 15 LYS CD HD2 SING N N 16 LYS CD HD3 SING N N 17 LYS CE NZ SING N N 18 LYS CE HE2 SING N N 19 LYS CE HE3 SING N N 20 LYS NZ HZ1 SING N N 21 LYS NZ HZ2 SING N N 22 LYS NZ HZ3 SING N N 23 LYS OXT HXT SING N N 24 MET N CA SING N N 1 MET N H SING N N 2 MET N H2 SING N N 3 MET CA C SING N N 4 MET CA CB SING N N 5 MET CA HA SING N N 6 MET C O DOUB N N 7 MET C OXT SING N N 8 MET CB CG SING N N 9 MET CB HB2 SING N N 10 MET CB HB3 SING N N 11 MET CG SD SING N N 12 MET CG HG2 SING N N 13 MET CG HG3 SING N N 14 MET SD CE SING N N 15 MET CE HE1 SING N N 16 MET CE HE2 SING N N 17 MET CE HE3 SING N N 18 MET OXT HXT SING N N 19 PCA N CA SING N N 1 PCA N CD SING N N 2 PCA N H SING N N 3 PCA CA CB SING N N 4 PCA CA C SING N N 5 PCA CA HA SING N N 6 PCA CB CG SING N N 7 PCA CB HB2 SING N N 8 PCA CB HB3 SING N N 9 PCA CG CD SING N N 10 PCA CG HG2 SING N N 11 PCA CG HG3 SING N N 12 PCA CD OE DOUB N N 13 PCA C O DOUB N N 14 PCA C OXT SING N N 15 PCA OXT HXT SING N N 16 PHE N CA SING N N 1 PHE N H SING N N 2 PHE N H2 SING N N 3 PHE CA C SING N N 4 PHE CA CB SING N N 5 PHE CA HA SING N N 6 PHE C O DOUB N N 7 PHE C OXT SING N N 8 PHE CB CG SING N N 9 PHE CB HB2 SING N N 10 PHE CB HB3 SING N N 11 PHE CG CD1 DOUB Y N 12 PHE CG CD2 SING Y N 13 PHE CD1 CE1 SING Y N 14 PHE CD1 HD1 SING N N 15 PHE CD2 CE2 DOUB Y N 16 PHE CD2 HD2 SING N N 17 PHE CE1 CZ DOUB Y N 18 PHE CE1 HE1 SING N N 19 PHE CE2 CZ SING Y N 20 PHE CE2 HE2 SING N N 21 PHE CZ HZ SING N N 22 PHE OXT HXT SING N N 23 PRO N CA SING N N 1 PRO N CD SING N N 2 PRO N H SING N N 3 PRO CA C SING N N 4 PRO CA CB SING N N 5 PRO CA HA SING N N 6 PRO C O DOUB N N 7 PRO C OXT SING N N 8 PRO CB CG SING N N 9 PRO CB HB2 SING N N 10 PRO CB HB3 SING N N 11 PRO CG CD SING N N 12 PRO CG HG2 SING N N 13 PRO CG HG3 SING N N 14 PRO CD HD2 SING N N 15 PRO CD HD3 SING N N 16 PRO OXT HXT SING N N 17 SER N CA SING N N 1 SER N H SING N N 2 SER N H2 SING N N 3 SER CA C SING N N 4 SER CA CB SING N N 5 SER CA HA SING N N 6 SER C O DOUB N N 7 SER C OXT SING N N 8 SER CB OG SING N N 9 SER CB HB2 SING N N 10 SER CB HB3 SING N N 11 SER OG HG SING N N 12 SER OXT HXT SING N N 13 THR N CA SING N N 1 THR N H SING N N 2 THR N H2 SING N N 3 THR CA C SING N N 4 THR CA CB SING N N 5 THR CA HA SING N N 6 THR C O DOUB N N 7 THR C OXT SING N N 8 THR CB OG1 SING N N 9 THR CB CG2 SING N N 10 THR CB HB SING N N 11 THR OG1 HG1 SING N N 12 THR CG2 HG21 SING N N 13 THR CG2 HG22 SING N N 14 THR CG2 HG23 SING N N 15 THR OXT HXT SING N N 16 TRP N CA SING N N 1 TRP N H SING N N 2 TRP N H2 SING N N 3 TRP CA C SING N N 4 TRP CA CB SING N N 5 TRP CA HA SING N N 6 TRP C O DOUB N N 7 TRP C OXT SING N N 8 TRP CB CG SING N N 9 TRP CB HB2 SING N N 10 TRP CB HB3 SING N N 11 TRP CG CD1 DOUB Y N 12 TRP CG CD2 SING Y N 13 TRP CD1 NE1 SING Y N 14 TRP CD1 HD1 SING N N 15 TRP CD2 CE2 DOUB Y N 16 TRP CD2 CE3 SING Y N 17 TRP NE1 CE2 SING Y N 18 TRP NE1 HE1 SING N N 19 TRP CE2 CZ2 SING Y N 20 TRP CE3 CZ3 DOUB Y N 21 TRP CE3 HE3 SING N N 22 TRP CZ2 CH2 DOUB Y N 23 TRP CZ2 HZ2 SING N N 24 TRP CZ3 CH2 SING Y N 25 TRP CZ3 HZ3 SING N N 26 TRP CH2 HH2 SING N N 27 TRP OXT HXT SING N N 28 TYR N CA SING N N 1 TYR N H SING N N 2 TYR N H2 SING N N 3 TYR CA C SING N N 4 TYR CA CB SING N N 5 TYR CA HA SING N N 6 TYR C O DOUB N N 7 TYR C OXT SING N N 8 TYR CB CG SING N N 9 TYR CB HB2 SING N N 10 TYR CB HB3 SING N N 11 TYR CG CD1 DOUB Y N 12 TYR CG CD2 SING Y N 13 TYR CD1 CE1 SING Y N 14 TYR CD1 HD1 SING N N 15 TYR CD2 CE2 DOUB Y N 16 TYR CD2 HD2 SING N N 17 TYR CE1 CZ DOUB Y N 18 TYR CE1 HE1 SING N N 19 TYR CE2 CZ SING Y N 20 TYR CE2 HE2 SING N N 21 TYR CZ OH SING N N 22 TYR OH HH SING N N 23 TYR OXT HXT SING N N 24 VAL N CA SING N N 1 VAL N H SING N N 2 VAL N H2 SING N N 3 VAL CA C SING N N 4 VAL CA CB SING N N 5 VAL CA HA SING N N 6 VAL C O DOUB N N 7 VAL C OXT SING N N 8 VAL CB CG1 SING N N 9 VAL CB CG2 SING N N 10 VAL CB HB SING N N 11 VAL CG1 HG11 SING N N 12 VAL CG1 HG12 SING N N 13 VAL CG1 HG13 SING N N 14 VAL CG2 HG21 SING N N 15 VAL CG2 HG22 SING N N 16 VAL CG2 HG23 SING N N 17 VAL OXT HXT SING N N 18 # _atom_sites.entry_id 1KUK _atom_sites.fract_transf_matrix[1][1] 0.016335 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.016335 _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] 0.007807 _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 CD N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num _atom_site.pdbx_label_index _atom_site.pdbx_sifts_xref_db_name _atom_site.pdbx_sifts_xref_db_acc _atom_site.pdbx_sifts_xref_db_num _atom_site.pdbx_sifts_xref_db_res ATOM 1 N N . GLN A 1 3 ? -5.285 36.306 15.064 1.00 30.59 ? 3 GLN A N 1 3 UNP O57413 192 Q ATOM 2 C CA . GLN A 1 3 ? -4.736 34.916 14.985 1.00 29.67 ? 3 GLN A CA 1 3 UNP O57413 192 Q ATOM 3 C C . GLN A 1 3 ? -5.795 34.014 14.359 1.00 27.57 ? 3 GLN A C 1 3 UNP O57413 192 Q ATOM 4 O O . GLN A 1 3 ? -6.982 34.110 14.695 1.00 27.35 ? 3 GLN A O 1 3 UNP O57413 192 Q ATOM 5 C CB . GLN A 1 3 ? -4.406 34.388 16.385 1.00 31.66 ? 3 GLN A CB 1 3 UNP O57413 192 Q ATOM 6 C CG . GLN A 1 3 ? -3.306 35.141 17.135 1.00 34.35 ? 3 GLN A CG 1 3 UNP O57413 192 Q ATOM 7 C CD . GLN A 1 3 ? -1.955 34.463 17.032 1.00 36.16 ? 3 GLN A CD 1 3 UNP O57413 192 Q ATOM 8 O OE1 . GLN A 1 3 ? -1.012 34.831 17.739 1.00 37.30 ? 3 GLN A OE1 1 3 UNP O57413 192 Q ATOM 9 N NE2 . GLN A 1 3 ? -1.845 33.469 16.149 1.00 36.47 ? 3 GLN A NE2 1 3 UNP O57413 192 Q ATOM 10 N N . ARG A 1 4 ? -5.373 33.142 13.450 1.00 24.77 ? 4 ARG A N 1 4 UNP O57413 193 R ATOM 11 C CA . ARG A 1 4 ? -6.307 32.226 12.816 1.00 21.84 ? 4 ARG A CA 1 4 UNP O57413 193 R ATOM 12 C C . ARG A 1 4 ? -6.821 31.194 13.826 1.00 19.71 ? 4 ARG A C 1 4 UNP O57413 193 R ATOM 13 O O . ARG A 1 4 ? -7.980 30.761 13.757 1.00 19.44 ? 4 ARG A O 1 4 UNP O57413 193 R ATOM 14 C CB . ARG A 1 4 ? -5.642 31.506 11.647 1.00 22.38 ? 4 ARG A CB 1 4 UNP O57413 193 R ATOM 15 C CG . ARG A 1 4 ? -6.524 30.401 11.075 1.00 22.15 ? 4 ARG A CG 1 4 UNP O57413 193 R ATOM 16 C CD . ARG A 1 4 ? -5.940 29.774 9.835 1.00 22.16 ? 4 ARG A CD 1 4 UNP O57413 193 R ATOM 17 N NE . ARG A 1 4 ? -6.727 28.602 9.469 1.00 22.80 ? 4 ARG A NE 1 4 UNP O57413 193 R ATOM 18 C CZ . ARG A 1 4 ? -6.542 27.873 8.381 1.00 21.82 ? 4 ARG A CZ 1 4 UNP O57413 193 R ATOM 19 N NH1 . ARG A 1 4 ? -5.590 28.191 7.521 1.00 23.62 ? 4 ARG A NH1 1 4 UNP O57413 193 R ATOM 20 N NH2 . ARG A 1 4 ? -7.306 26.815 8.179 1.00 22.97 ? 4 ARG A NH2 1 4 UNP O57413 193 R ATOM 21 N N . PHE A 1 5 ? -5.975 30.826 14.790 1.00 17.03 ? 5 PHE A N 1 5 UNP O57413 194 F ATOM 22 C CA . PHE A 1 5 ? -6.348 29.832 15.784 1.00 14.62 ? 5 PHE A CA 1 5 UNP O57413 194 F ATOM 23 C C . PHE A 1 5 ? -6.416 30.334 17.215 1.00 13.96 ? 5 PHE A C 1 5 UNP O57413 194 F ATOM 24 O O . PHE A 1 5 ? -5.705 31.266 17.582 1.00 14.55 ? 5 PHE A O 1 5 UNP O57413 194 F ATOM 25 C CB . PHE A 1 5 ? -5.356 28.658 15.745 1.00 13.98 ? 5 PHE A CB 1 5 UNP O57413 194 F ATOM 26 C CG . PHE A 1 5 ? -5.328 27.944 14.428 1.00 12.11 ? 5 PHE A CG 1 5 UNP O57413 194 F ATOM 27 C CD1 . PHE A 1 5 ? -4.300 28.157 13.519 1.00 12.10 ? 5 PHE A CD1 1 5 UNP O57413 194 F ATOM 28 C CD2 . PHE A 1 5 ? -6.336 27.065 14.088 1.00 11.97 ? 5 PHE A CD2 1 5 UNP O57413 194 F ATOM 29 C CE1 . PHE A 1 5 ? -4.283 27.498 12.293 1.00 12.92 ? 5 PHE A CE1 1 5 UNP O57413 194 F ATOM 30 C CE2 . PHE A 1 5 ? -6.336 26.399 12.869 1.00 12.53 ? 5 PHE A CE2 1 5 UNP O57413 194 F ATOM 31 C CZ . PHE A 1 5 ? -5.292 26.622 11.964 1.00 11.81 ? 5 PHE A CZ 1 5 UNP O57413 194 F ATOM 32 N N . PRO A 1 6 ? -7.256 29.703 18.044 1.00 13.33 ? 6 PRO A N 1 6 UNP O57413 195 P ATOM 33 C CA . PRO A 1 6 ? -7.383 30.105 19.449 1.00 13.61 ? 6 PRO A CA 1 6 UNP O57413 195 P ATOM 34 C C . PRO A 1 6 ? -6.157 29.589 20.187 1.00 13.61 ? 6 PRO A C 1 6 UNP O57413 195 P ATOM 35 O O . PRO A 1 6 ? -5.481 28.664 19.734 1.00 14.37 ? 6 PRO A O 1 6 UNP O57413 195 P ATOM 36 C CB . PRO A 1 6 ? -8.649 29.393 19.902 1.00 14.19 ? 6 PRO A CB 1 6 UNP O57413 195 P ATOM 37 C CG . PRO A 1 6 ? -8.604 28.114 19.112 1.00 14.51 ? 6 PRO A CG 1 6 UNP O57413 195 P ATOM 38 C CD . PRO A 1 6 ? -8.206 28.630 17.722 1.00 14.56 ? 6 PRO A CD 1 6 UNP O57413 195 P ATOM 39 N N . GLN A 1 7 ? -5.887 30.163 21.344 1.00 13.07 ? 7 GLN A N 1 7 UNP O57413 196 Q ATOM 40 C CA . GLN A 1 7 ? -4.724 29.772 22.121 1.00 12.59 ? 7 GLN A CA 1 7 UNP O57413 196 Q ATOM 41 C C . GLN A 1 7 ? -4.776 28.343 22.630 1.00 11.74 ? 7 GLN A C 1 7 UNP O57413 196 Q ATOM 42 O O . GLN A 1 7 ? -5.789 27.911 23.180 1.00 12.16 ? 7 GLN A O 1 7 UNP O57413 196 Q ATOM 43 C CB . GLN A 1 7 ? -4.614 30.702 23.335 1.00 13.50 ? 7 GLN A CB 1 7 UNP O57413 196 Q ATOM 44 C CG . GLN A 1 7 ? -3.396 30.443 24.208 1.00 17.19 ? 7 GLN A CG 1 7 UNP O57413 196 Q ATOM 45 C CD . GLN A 1 7 ? -2.114 30.929 23.558 1.00 18.81 ? 7 GLN A CD 1 7 UNP O57413 196 Q ATOM 46 O OE1 . GLN A 1 7 ? -1.943 32.136 23.347 1.00 21.83 ? 7 GLN A OE1 1 7 UNP O57413 196 Q ATOM 47 N NE2 . GLN A 1 7 ? -1.208 29.998 23.209 1.00 19.23 ? 7 GLN A NE2 1 7 UNP O57413 196 Q ATOM 48 N N . ARG A 1 8 ? -3.661 27.631 22.471 1.00 10.35 ? 8 ARG A N 1 8 UNP O57413 197 R ATOM 49 C CA . ARG A 1 8 ? -3.510 26.291 23.000 1.00 11.30 ? 8 ARG A CA 1 8 UNP O57413 197 R ATOM 50 C C . ARG A 1 8 ? -2.110 26.190 23.605 1.00 10.76 ? 8 ARG A C 1 8 UNP O57413 197 R ATOM 51 O O . ARG A 1 8 ? -1.235 27.034 23.347 1.00 9.97 ? 8 ARG A O 1 8 UNP O57413 197 R ATOM 52 C CB . ARG A 1 8 ? -3.735 25.225 21.909 1.00 10.51 ? 8 ARG A CB 1 8 UNP O57413 197 R ATOM 53 C CG . ARG A 1 8 ? -5.187 25.134 21.447 1.00 11.65 ? 8 ARG A CG 1 8 UNP O57413 197 R ATOM 54 C CD . ARG A 1 8 ? -6.065 24.599 22.558 1.00 12.53 ? 8 ARG A CD 1 8 UNP O57413 197 R ATOM 55 N NE . ARG A 1 8 ? -7.433 24.270 22.123 1.00 14.21 ? 8 ARG A NE 1 8 UNP O57413 197 R ATOM 56 C CZ . ARG A 1 8 ? -8.408 25.168 21.945 1.00 15.42 ? 8 ARG A CZ 1 8 UNP O57413 197 R ATOM 57 N NH1 . ARG A 1 8 ? -9.618 24.757 21.574 1.00 15.55 ? 8 ARG A NH1 1 8 UNP O57413 197 R ATOM 58 N NH2 . ARG A 1 8 ? -8.183 26.468 22.127 1.00 15.75 ? 8 ARG A NH2 1 8 UNP O57413 197 R ATOM 59 N N . TYR A 1 9 ? -1.904 25.157 24.413 1.00 10.99 ? 9 TYR A N 1 9 UNP O57413 198 Y ATOM 60 C CA . TYR A 1 9 ? -0.635 24.969 25.110 1.00 11.16 ? 9 TYR A CA 1 9 UNP O57413 198 Y ATOM 61 C C . TYR A 1 9 ? -0.242 23.503 25.121 1.00 11.38 ? 9 TYR A C 1 9 UNP O57413 198 Y ATOM 62 O O . TYR A 1 9 ? -1.078 22.672 25.456 1.00 13.51 ? 9 TYR A O 1 9 UNP O57413 198 Y ATOM 63 C CB . TYR A 1 9 ? -0.807 25.388 26.570 1.00 12.70 ? 9 TYR A CB 1 9 UNP O57413 198 Y ATOM 64 C CG . TYR A 1 9 ? -1.435 26.727 26.777 1.00 13.61 ? 9 TYR A CG 1 9 UNP O57413 198 Y ATOM 65 C CD1 . TYR A 1 9 ? -2.821 26.863 26.801 1.00 14.55 ? 9 TYR A CD1 1 9 UNP O57413 198 Y ATOM 66 C CD2 . TYR A 1 9 ? -0.643 27.855 26.962 1.00 14.53 ? 9 TYR A CD2 1 9 UNP O57413 198 Y ATOM 67 C CE1 . TYR A 1 9 ? -3.397 28.104 27.018 1.00 16.53 ? 9 TYR A CE1 1 9 UNP O57413 198 Y ATOM 68 C CE2 . TYR A 1 9 ? -1.209 29.096 27.167 1.00 16.01 ? 9 TYR A CE2 1 9 UNP O57413 198 Y ATOM 69 C CZ . TYR A 1 9 ? -2.575 29.211 27.201 1.00 16.21 ? 9 TYR A CZ 1 9 UNP O57413 198 Y ATOM 70 O OH . TYR A 1 9 ? -3.127 30.446 27.426 1.00 19.34 ? 9 TYR A OH 1 9 UNP O57413 198 Y ATOM 71 N N . ILE A 1 10 ? 1.002 23.189 24.766 1.00 9.21 ? 10 ILE A N 1 10 UNP O57413 199 I ATOM 72 C CA . ILE A 1 10 ? 1.451 21.806 24.808 1.00 9.18 ? 10 ILE A CA 1 10 UNP O57413 199 I ATOM 73 C C . ILE A 1 10 ? 2.676 21.729 25.725 1.00 9.37 ? 10 ILE A C 1 10 UNP O57413 199 I ATOM 74 O O . ILE A 1 10 ? 3.699 22.354 25.441 1.00 9.51 ? 10 ILE A O 1 10 UNP O57413 199 I ATOM 75 C CB . ILE A 1 10 ? 1.800 21.241 23.419 1.00 8.96 ? 10 ILE A CB 1 10 UNP O57413 199 I ATOM 76 C CG1 . ILE A 1 10 ? 0.552 21.198 22.539 1.00 9.82 ? 10 ILE A CG1 1 10 UNP O57413 199 I ATOM 77 C CG2 . ILE A 1 10 ? 2.330 19.804 23.545 1.00 10.50 ? 10 ILE A CG2 1 10 UNP O57413 199 I ATOM 78 C CD1 . ILE A 1 10 ? 0.848 20.788 21.082 1.00 10.74 ? 10 ILE A CD1 1 10 UNP O57413 199 I ATOM 79 N N . GLU A 1 11 ? 2.516 20.985 26.820 1.00 9.54 ? 11 GLU A N 1 11 UNP O57413 200 K ATOM 80 C CA . GLU A 1 11 ? 3.563 20.758 27.814 1.00 10.78 ? 11 GLU A CA 1 11 UNP O57413 200 K ATOM 81 C C . GLU A 1 11 ? 4.284 19.482 27.407 1.00 9.94 ? 11 GLU A C 1 11 UNP O57413 200 K ATOM 82 O O . GLU A 1 11 ? 3.728 18.386 27.499 1.00 11.35 ? 11 GLU A O 1 11 UNP O57413 200 K ATOM 83 C CB . GLU A 1 11 ? 2.965 20.571 29.206 1.00 14.29 ? 11 GLU A CB 1 11 UNP O57413 200 K ATOM 84 C CG . GLU A 1 11 ? 2.533 21.880 29.794 1.00 20.44 ? 11 GLU A CG 1 11 UNP O57413 200 K ATOM 85 C CD . GLU A 1 11 ? 1.195 22.321 29.332 1.00 23.88 ? 11 GLU A CD 1 11 UNP O57413 200 K ATOM 86 O OE1 . GLU A 1 11 ? 0.951 22.303 28.108 1.00 27.29 ? 11 GLU A OE1 1 11 UNP O57413 200 K ATOM 87 O OE2 . GLU A 1 11 ? 0.370 22.691 30.199 1.00 27.44 ? 11 GLU A OE2 1 11 UNP O57413 200 K ATOM 88 N N . LEU A 1 12 ? 5.501 19.610 26.932 1.00 9.35 ? 12 LEU A N 1 12 UNP O57413 201 L ATOM 89 C CA . LEU A 1 12 ? 6.224 18.449 26.466 1.00 9.27 ? 12 LEU A CA 1 12 UNP O57413 201 L ATOM 90 C C . LEU A 1 12 ? 7.112 17.776 27.480 1.00 10.10 ? 12 LEU A C 1 12 UNP O57413 201 L ATOM 91 O O . LEU A 1 12 ? 7.684 18.405 28.375 1.00 9.74 ? 12 LEU A O 1 12 UNP O57413 201 L ATOM 92 C CB . LEU A 1 12 ? 7.169 18.830 25.327 1.00 10.05 ? 12 LEU A CB 1 12 UNP O57413 201 L ATOM 93 C CG . LEU A 1 12 ? 6.757 19.367 23.993 1.00 10.77 ? 12 LEU A CG 1 12 UNP O57413 201 L ATOM 94 C CD1 . LEU A 1 12 ? 8.031 19.783 23.231 1.00 11.45 ? 12 LEU A CD1 1 12 UNP O57413 201 L ATOM 95 C CD2 . LEU A 1 12 ? 5.950 18.265 23.241 1.00 10.91 ? 12 LEU A CD2 1 12 UNP O57413 201 L ATOM 96 N N . ALA A 1 13 ? 7.222 16.460 27.357 1.00 8.95 ? 13 ALA A N 1 13 UNP O57413 202 A ATOM 97 C CA . ALA A 1 13 ? 8.229 15.734 28.118 1.00 10.34 ? 13 ALA A CA 1 13 UNP O57413 202 A ATOM 98 C C . ALA A 1 13 ? 9.188 15.202 27.034 1.00 9.55 ? 13 ALA A C 1 13 UNP O57413 202 A ATOM 99 O O . ALA A 1 13 ? 8.750 14.736 25.990 1.00 10.08 ? 13 ALA A O 1 13 UNP O57413 202 A ATOM 100 C CB . ALA A 1 13 ? 7.644 14.590 28.893 1.00 10.10 ? 13 ALA A CB 1 13 UNP O57413 202 A ATOM 101 N N . ILE A 1 14 ? 10.490 15.357 27.235 1.00 9.65 ? 14 ILE A N 1 14 UNP O57413 203 I ATOM 102 C CA . ILE A 1 14 ? 11.459 14.840 26.265 1.00 10.10 ? 14 ILE A CA 1 14 UNP O57413 203 I ATOM 103 C C . ILE A 1 14 ? 12.304 13.840 27.005 1.00 10.26 ? 14 ILE A C 1 14 UNP O57413 203 I ATOM 104 O O . ILE A 1 14 ? 12.806 14.126 28.097 1.00 10.75 ? 14 ILE A O 1 14 UNP O57413 203 I ATOM 105 C CB . ILE A 1 14 ? 12.356 15.952 25.691 1.00 10.26 ? 14 ILE A CB 1 14 UNP O57413 203 I ATOM 106 C CG1 . ILE A 1 14 ? 11.533 16.957 24.863 1.00 11.84 ? 14 ILE A CG1 1 14 UNP O57413 203 I ATOM 107 C CG2 . ILE A 1 14 ? 13.498 15.331 24.865 1.00 10.66 ? 14 ILE A CG2 1 14 UNP O57413 203 I ATOM 108 C CD1 . ILE A 1 14 ? 10.720 16.392 23.751 1.00 14.42 ? 14 ILE A CD1 1 14 UNP O57413 203 I ATOM 109 N N . VAL A 1 15 ? 12.450 12.655 26.434 1.00 9.66 ? 15 VAL A N 1 15 UNP O57413 204 V ATOM 110 C CA . VAL A 1 15 ? 13.249 11.601 27.058 1.00 9.89 ? 15 VAL A CA 1 15 UNP O57413 204 V ATOM 111 C C . VAL A 1 15 ? 14.441 11.362 26.129 1.00 9.80 ? 15 VAL A C 1 15 UNP O57413 204 V ATOM 112 O O . VAL A 1 15 ? 14.258 11.159 24.925 1.00 9.87 ? 15 VAL A O 1 15 UNP O57413 204 V ATOM 113 C CB . VAL A 1 15 ? 12.415 10.307 27.207 1.00 10.71 ? 15 VAL A CB 1 15 UNP O57413 204 V ATOM 114 C CG1 . VAL A 1 15 ? 13.286 9.216 27.785 1.00 11.75 ? 15 VAL A CG1 1 15 UNP O57413 204 V ATOM 115 C CG2 . VAL A 1 15 ? 11.167 10.554 28.091 1.00 11.75 ? 15 VAL A CG2 1 15 UNP O57413 204 V ATOM 116 N N . VAL A 1 16 ? 15.659 11.390 26.669 1.00 9.12 ? 16 VAL A N 1 16 UNP O57413 205 V ATOM 117 C CA . VAL A 1 16 ? 16.872 11.164 25.879 1.00 9.79 ? 16 VAL A CA 1 16 UNP O57413 205 V ATOM 118 C C . VAL A 1 16 ? 17.358 9.775 26.287 1.00 10.11 ? 16 VAL A C 1 16 UNP O57413 205 V ATOM 119 O O . VAL A 1 16 ? 17.639 9.529 27.487 1.00 10.71 ? 16 VAL A O 1 16 UNP O57413 205 V ATOM 120 C CB . VAL A 1 16 ? 17.967 12.219 26.195 1.00 10.07 ? 16 VAL A CB 1 16 UNP O57413 205 V ATOM 121 C CG1 . VAL A 1 16 ? 19.294 11.864 25.510 1.00 10.88 ? 16 VAL A CG1 1 16 UNP O57413 205 V ATOM 122 C CG2 . VAL A 1 16 ? 17.534 13.564 25.699 1.00 10.86 ? 16 VAL A CG2 1 16 UNP O57413 205 V ATOM 123 N N . ASP A 1 17 ? 17.440 8.858 25.332 1.00 8.88 ? 17 ASP A N 1 17 UNP O57413 206 D ATOM 124 C CA . ASP A 1 17 ? 17.852 7.514 25.691 1.00 9.87 ? 17 ASP A CA 1 17 UNP O57413 206 D ATOM 125 C C . ASP A 1 17 ? 19.342 7.320 25.983 1.00 9.64 ? 17 ASP A C 1 17 UNP O57413 206 D ATOM 126 O O . ASP A 1 17 ? 20.150 8.268 25.912 1.00 10.64 ? 17 ASP A O 1 17 UNP O57413 206 D ATOM 127 C CB . ASP A 1 17 ? 17.264 6.500 24.682 1.00 9.95 ? 17 ASP A CB 1 17 UNP O57413 206 D ATOM 128 C CG . ASP A 1 17 ? 18.045 6.378 23.392 1.00 10.89 ? 17 ASP A CG 1 17 UNP O57413 206 D ATOM 129 O OD1 . ASP A 1 17 ? 17.680 5.448 22.646 1.00 10.93 ? 17 ASP A OD1 1 17 UNP O57413 206 D ATOM 130 O OD2 . ASP A 1 17 ? 18.987 7.147 23.123 1.00 11.01 ? 17 ASP A OD2 1 17 UNP O57413 206 D ATOM 131 N N . HIS A 1 18 ? 19.696 6.090 26.377 1.00 11.42 ? 18 HIS A N 1 18 UNP O57413 207 H ATOM 132 C CA . HIS A 1 18 ? 21.076 5.863 26.757 1.00 12.01 ? 18 HIS A CA 1 18 UNP O57413 207 H ATOM 133 C C . HIS A 1 18 ? 22.065 5.961 25.616 1.00 12.20 ? 18 HIS A C 1 18 UNP O57413 207 H ATOM 134 O O . HIS A 1 18 ? 23.188 6.445 25.786 1.00 12.45 ? 18 HIS A O 1 18 UNP O57413 207 H ATOM 135 C CB . HIS A 1 18 ? 21.231 4.528 27.491 1.00 13.83 ? 18 HIS A CB 1 18 UNP O57413 207 H ATOM 136 C CG . HIS A 1 18 ? 22.534 4.412 28.224 1.00 15.41 ? 18 HIS A CG 1 18 UNP O57413 207 H ATOM 137 N ND1 . HIS A 1 18 ? 22.895 5.285 29.236 1.00 17.51 ? 18 HIS A ND1 1 18 UNP O57413 207 H ATOM 138 C CD2 . HIS A 1 18 ? 23.574 3.563 28.075 1.00 17.11 ? 18 HIS A CD2 1 18 UNP O57413 207 H ATOM 139 C CE1 . HIS A 1 18 ? 24.108 4.974 29.669 1.00 17.69 ? 18 HIS A CE1 1 18 UNP O57413 207 H ATOM 140 N NE2 . HIS A 1 18 ? 24.541 3.936 28.980 1.00 16.34 ? 18 HIS A NE2 1 18 UNP O57413 207 H ATOM 141 N N . GLY A 1 19 ? 21.633 5.554 24.430 1.00 12.44 ? 19 GLY A N 1 19 UNP O57413 208 G ATOM 142 C CA . GLY A 1 19 ? 22.502 5.644 23.269 1.00 12.51 ? 19 GLY A CA 1 19 UNP O57413 208 G ATOM 143 C C . GLY A 1 19 ? 22.782 7.108 22.944 1.00 12.33 ? 19 GLY A C 1 19 UNP O57413 208 G ATOM 144 O O . GLY A 1 19 ? 23.906 7.478 22.603 1.00 12.12 ? 19 GLY A O 1 19 UNP O57413 208 G ATOM 145 N N . MET A 1 20 ? 21.759 7.953 23.032 1.00 12.36 ? 20 MET A N 1 20 UNP O57413 209 M ATOM 146 C CA . MET A 1 20 ? 21.986 9.377 22.770 1.00 13.04 ? 20 MET A CA 1 20 UNP O57413 209 M ATOM 147 C C . MET A 1 20 ? 22.872 10.007 23.869 1.00 13.16 ? 20 MET A C 1 20 UNP O57413 209 M ATOM 148 O O . MET A 1 20 ? 23.712 10.873 23.590 1.00 12.54 ? 20 MET A O 1 20 UNP O57413 209 M ATOM 149 C CB . MET A 1 20 ? 20.657 10.107 22.698 1.00 14.43 ? 20 MET A CB 1 20 UNP O57413 209 M ATOM 150 C CG . MET A 1 20 ? 20.848 11.581 22.401 1.00 15.14 ? 20 MET A CG 1 20 UNP O57413 209 M ATOM 151 S SD . MET A 1 20 ? 19.335 12.312 21.638 1.00 15.75 ? 20 MET A SD 1 20 UNP O57413 209 M ATOM 152 C CE . MET A 1 20 ? 19.905 14.047 21.570 1.00 15.67 ? 20 MET A CE 1 20 UNP O57413 209 M ATOM 153 N N . TYR A 1 21 ? 22.682 9.558 25.100 1.00 13.63 ? 21 TYR A N 1 21 UNP O57413 210 Y ATOM 154 C CA . TYR A 1 21 ? 23.477 10.030 26.235 1.00 15.55 ? 21 TYR A CA 1 21 UNP O57413 210 Y ATOM 155 C C . TYR A 1 21 ? 24.944 9.761 25.948 1.00 15.88 ? 21 TYR A C 1 21 UNP O57413 210 Y ATOM 156 O O . TYR A 1 21 ? 25.792 10.653 26.055 1.00 16.14 ? 21 TYR A O 1 21 UNP O57413 210 Y ATOM 157 C CB . TYR A 1 21 ? 23.035 9.306 27.507 1.00 15.94 ? 21 TYR A CB 1 21 UNP O57413 210 Y ATOM 158 C CG . TYR A 1 21 ? 23.862 9.617 28.747 1.00 18.09 ? 21 TYR A CG 1 21 UNP O57413 210 Y ATOM 159 C CD1 . TYR A 1 21 ? 23.727 10.827 29.419 1.00 18.70 ? 21 TYR A CD1 1 21 UNP O57413 210 Y ATOM 160 C CD2 . TYR A 1 21 ? 24.759 8.673 29.262 1.00 18.77 ? 21 TYR A CD2 1 21 UNP O57413 210 Y ATOM 161 C CE1 . TYR A 1 21 ? 24.469 11.093 30.597 1.00 20.21 ? 21 TYR A CE1 1 21 UNP O57413 210 Y ATOM 162 C CE2 . TYR A 1 21 ? 25.492 8.930 30.426 1.00 19.14 ? 21 TYR A CE2 1 21 UNP O57413 210 Y ATOM 163 C CZ . TYR A 1 21 ? 25.336 10.137 31.082 1.00 20.01 ? 21 TYR A CZ 1 21 UNP O57413 210 Y ATOM 164 O OH . TYR A 1 21 ? 26.031 10.393 32.261 1.00 21.44 ? 21 TYR A OH 1 21 UNP O57413 210 Y ATOM 165 N N . THR A 1 22 ? 25.225 8.531 25.529 1.00 15.78 ? 22 THR A N 1 22 UNP O57413 211 T ATOM 166 C CA . THR A 1 22 ? 26.572 8.095 25.173 1.00 16.21 ? 22 THR A CA 1 22 UNP O57413 211 T ATOM 167 C C . THR A 1 22 ? 27.128 8.896 24.000 1.00 16.12 ? 22 THR A C 1 22 UNP O57413 211 T ATOM 168 O O . THR A 1 22 ? 28.295 9.304 24.004 1.00 16.41 ? 22 THR A O 1 22 UNP O57413 211 T ATOM 169 C CB . THR A 1 22 ? 26.541 6.587 24.822 1.00 17.34 ? 22 THR A CB 1 22 UNP O57413 211 T ATOM 170 O OG1 . THR A 1 22 ? 26.107 5.872 25.978 1.00 17.76 ? 22 THR A OG1 1 22 UNP O57413 211 T ATOM 171 C CG2 . THR A 1 22 ? 27.930 6.083 24.397 1.00 18.52 ? 22 THR A CG2 1 22 UNP O57413 211 T ATOM 172 N N . LYS A 1 23 ? 26.289 9.123 22.988 1.00 15.14 ? 23 LYS A N 1 23 UNP O57413 212 K ATOM 173 C CA . LYS A 1 23 ? 26.679 9.866 21.801 1.00 14.51 ? 23 LYS A CA 1 23 UNP O57413 212 K ATOM 174 C C . LYS A 1 23 ? 27.213 11.236 22.179 1.00 14.86 ? 23 LYS A C 1 23 UNP O57413 212 K ATOM 175 O O . LYS A 1 23 ? 28.189 11.687 21.615 1.00 16.16 ? 23 LYS A O 1 23 UNP O57413 212 K ATOM 176 C CB . LYS A 1 23 ? 25.476 10.021 20.853 1.00 13.26 ? 23 LYS A CB 1 23 UNP O57413 212 K ATOM 177 C CG . LYS A 1 23 ? 25.747 10.861 19.616 1.00 12.05 ? 23 LYS A CG 1 23 UNP O57413 212 K ATOM 178 C CD . LYS A 1 23 ? 24.509 10.878 18.692 1.00 13.50 ? 23 LYS A CD 1 23 UNP O57413 212 K ATOM 179 C CE . LYS A 1 23 ? 24.705 11.864 17.556 1.00 14.24 ? 23 LYS A CE 1 23 UNP O57413 212 K ATOM 180 N NZ . LYS A 1 23 ? 23.519 11.871 16.663 1.00 16.76 ? 23 LYS A NZ 1 23 UNP O57413 212 K ATOM 181 N N . TYR A 1 24 ? 26.550 11.894 23.118 1.00 16.12 ? 24 TYR A N 1 24 UNP O57413 213 Y ATOM 182 C CA . TYR A 1 24 ? 26.973 13.216 23.547 1.00 17.04 ? 24 TYR A CA 1 24 UNP O57413 213 Y ATOM 183 C C . TYR A 1 24 ? 27.928 13.194 24.745 1.00 18.69 ? 24 TYR A C 1 24 UNP O57413 213 Y ATOM 184 O O . TYR A 1 24 ? 27.860 14.049 25.620 1.00 18.28 ? 24 TYR A O 1 24 UNP O57413 213 Y ATOM 185 C CB . TYR A 1 24 ? 25.742 14.096 23.826 1.00 16.83 ? 24 TYR A CB 1 24 UNP O57413 213 Y ATOM 186 C CG . TYR A 1 24 ? 25.058 14.493 22.528 1.00 16.66 ? 24 TYR A CG 1 24 UNP O57413 213 Y ATOM 187 C CD1 . TYR A 1 24 ? 25.495 15.596 21.801 1.00 17.18 ? 24 TYR A CD1 1 24 UNP O57413 213 Y ATOM 188 C CD2 . TYR A 1 24 ? 24.086 13.675 21.956 1.00 15.82 ? 24 TYR A CD2 1 24 UNP O57413 213 Y ATOM 189 C CE1 . TYR A 1 24 ? 24.996 15.878 20.526 1.00 16.55 ? 24 TYR A CE1 1 24 UNP O57413 213 Y ATOM 190 C CE2 . TYR A 1 24 ? 23.586 13.934 20.688 1.00 15.50 ? 24 TYR A CE2 1 24 UNP O57413 213 Y ATOM 191 C CZ . TYR A 1 24 ? 24.036 15.030 19.971 1.00 16.12 ? 24 TYR A CZ 1 24 UNP O57413 213 Y ATOM 192 O OH . TYR A 1 24 ? 23.562 15.264 18.695 1.00 15.76 ? 24 TYR A OH 1 24 UNP O57413 213 Y ATOM 193 N N . SER A 1 25 ? 28.825 12.216 24.728 1.00 19.49 ? 25 SER A N 1 25 UNP O57413 214 S ATOM 194 C CA . SER A 1 25 ? 29.835 12.044 25.768 1.00 20.71 ? 25 SER A CA 1 25 UNP O57413 214 S ATOM 195 C C . SER A 1 25 ? 29.356 11.997 27.209 1.00 20.43 ? 25 SER A C 1 25 UNP O57413 214 S ATOM 196 O O . SER A 1 25 ? 30.071 12.435 28.126 1.00 19.57 ? 25 SER A O 1 25 UNP O57413 214 S ATOM 197 C CB . SER A 1 25 ? 30.900 13.113 25.589 1.00 22.24 ? 25 SER A CB 1 25 UNP O57413 214 S ATOM 198 O OG . SER A 1 25 ? 31.518 12.913 24.327 1.00 24.46 ? 25 SER A OG 1 25 UNP O57413 214 S ATOM 199 N N . SER A 1 26 ? 28.162 11.439 27.411 1.00 19.73 ? 26 SER A N 1 26 UNP O57413 215 S ATOM 200 C CA . SER A 1 26 ? 27.579 11.284 28.734 1.00 20.22 ? 26 SER A CA 1 26 UNP O57413 215 S ATOM 201 C C . SER A 1 26 ? 27.571 12.600 29.498 1.00 20.66 ? 26 SER A C 1 26 UNP O57413 215 S ATOM 202 O O . SER A 1 26 ? 27.681 12.616 30.732 1.00 20.52 ? 26 SER A O 1 26 UNP O57413 215 S ATOM 203 C CB . SER A 1 26 ? 28.372 10.222 29.509 1.00 20.33 ? 26 SER A CB 1 26 UNP O57413 215 S ATOM 204 O OG . SER A 1 26 ? 28.464 9.034 28.736 1.00 21.19 ? 26 SER A OG 1 26 UNP O57413 215 S ATOM 205 N N . ASN A 1 27 ? 27.429 13.695 28.749 1.00 20.74 ? 27 ASN A N 1 27 UNP O57413 216 N ATOM 206 C CA . ASN A 1 27 ? 27.438 15.055 29.285 1.00 21.21 ? 27 ASN A CA 1 27 UNP O57413 216 N ATOM 207 C C . ASN A 1 27 ? 26.010 15.605 29.402 1.00 20.95 ? 27 ASN A C 1 27 UNP O57413 216 N ATOM 208 O O . ASN A 1 27 ? 25.437 16.080 28.413 1.00 20.46 ? 27 ASN A O 1 27 UNP O57413 216 N ATOM 209 C CB . ASN A 1 27 ? 28.287 15.938 28.362 1.00 22.70 ? 27 ASN A CB 1 27 UNP O57413 216 N ATOM 210 C CG . ASN A 1 27 ? 28.483 17.350 28.879 1.00 24.42 ? 27 ASN A CG 1 27 UNP O57413 216 N ATOM 211 O OD1 . ASN A 1 27 ? 29.427 18.033 28.471 1.00 27.43 ? 27 ASN A OD1 1 27 UNP O57413 216 N ATOM 212 N ND2 . ASN A 1 27 ? 27.600 17.800 29.748 1.00 23.91 ? 27 ASN A ND2 1 27 UNP O57413 216 N ATOM 213 N N . PHE A 1 28 ? 25.459 15.529 30.605 1.00 20.50 ? 28 PHE A N 1 28 UNP O57413 217 F ATOM 214 C CA . PHE A 1 28 ? 24.114 16.019 30.874 1.00 21.10 ? 28 PHE A CA 1 28 UNP O57413 217 F ATOM 215 C C . PHE A 1 28 ? 23.925 17.484 30.468 1.00 20.84 ? 28 PHE A C 1 28 UNP O57413 217 F ATOM 216 O O . PHE A 1 28 ? 22.926 17.830 29.855 1.00 18.81 ? 28 PHE A O 1 28 UNP O57413 217 F ATOM 217 C CB . PHE A 1 28 ? 23.762 15.855 32.358 1.00 22.72 ? 28 PHE A CB 1 28 UNP O57413 217 F ATOM 218 C CG . PHE A 1 28 ? 22.384 16.337 32.699 1.00 24.36 ? 28 PHE A CG 1 28 UNP O57413 217 F ATOM 219 C CD1 . PHE A 1 28 ? 21.268 15.547 32.424 1.00 25.10 ? 28 PHE A CD1 1 28 UNP O57413 217 F ATOM 220 C CD2 . PHE A 1 28 ? 22.192 17.614 33.235 1.00 24.95 ? 28 PHE A CD2 1 28 UNP O57413 217 F ATOM 221 C CE1 . PHE A 1 28 ? 19.980 16.017 32.669 1.00 25.38 ? 28 PHE A CE1 1 28 UNP O57413 217 F ATOM 222 C CE2 . PHE A 1 28 ? 20.909 18.100 33.487 1.00 25.42 ? 28 PHE A CE2 1 28 UNP O57413 217 F ATOM 223 C CZ . PHE A 1 28 ? 19.798 17.302 33.203 1.00 25.48 ? 28 PHE A CZ 1 28 UNP O57413 217 F ATOM 224 N N . LYS A 1 29 ? 24.880 18.351 30.784 1.00 20.61 ? 29 LYS A N 1 29 UNP O57413 218 K ATOM 225 C CA . LYS A 1 29 ? 24.730 19.764 30.428 1.00 20.90 ? 29 LYS A CA 1 29 UNP O57413 218 K ATOM 226 C C . LYS A 1 29 ? 24.544 20.004 28.935 1.00 19.75 ? 29 LYS A C 1 29 UNP O57413 218 K ATOM 227 O O . LYS A 1 29 ? 23.652 20.764 28.508 1.00 18.43 ? 29 LYS A O 1 29 UNP O57413 218 K ATOM 228 C CB . LYS A 1 29 ? 25.948 20.571 30.882 1.00 23.70 ? 29 LYS A CB 1 29 UNP O57413 218 K ATOM 229 C CG . LYS A 1 29 ? 26.153 20.551 32.357 1.00 27.63 ? 29 LYS A CG 1 29 UNP O57413 218 K ATOM 230 C CD . LYS A 1 29 ? 24.942 21.045 33.103 1.00 30.41 ? 29 LYS A CD 1 29 UNP O57413 218 K ATOM 231 C CE . LYS A 1 29 ? 25.203 20.910 34.585 1.00 32.03 ? 29 LYS A CE 1 29 UNP O57413 218 K ATOM 232 N NZ . LYS A 1 29 ? 25.556 19.487 34.925 1.00 33.63 ? 29 LYS A NZ 1 29 UNP O57413 218 K ATOM 233 N N . LYS A 1 30 ? 25.419 19.374 28.164 1.00 18.17 ? 30 LYS A N 1 30 UNP O57413 219 K ATOM 234 C CA . LYS A 1 30 ? 25.416 19.485 26.725 1.00 17.05 ? 30 LYS A CA 1 30 UNP O57413 219 K ATOM 235 C C . LYS A 1 30 ? 24.080 18.950 26.198 1.00 15.52 ? 30 LYS A C 1 30 UNP O57413 219 K ATOM 236 O O . LYS A 1 30 ? 23.494 19.528 25.301 1.00 14.73 ? 30 LYS A O 1 30 UNP O57413 219 K ATOM 237 C CB . LYS A 1 30 ? 26.582 18.676 26.145 1.00 19.65 ? 30 LYS A CB 1 30 UNP O57413 219 K ATOM 238 C CG . LYS A 1 30 ? 26.675 18.670 24.640 1.00 22.79 ? 30 LYS A CG 1 30 UNP O57413 219 K ATOM 239 C CD . LYS A 1 30 ? 27.840 17.800 24.142 1.00 25.76 ? 30 LYS A CD 1 30 UNP O57413 219 K ATOM 240 C CE . LYS A 1 30 ? 29.192 18.383 24.520 1.00 27.64 ? 30 LYS A CE 1 30 UNP O57413 219 K ATOM 241 N NZ . LYS A 1 30 ? 30.298 17.661 23.845 1.00 29.21 ? 30 LYS A NZ 1 30 UNP O57413 219 K ATOM 242 N N . ILE A 1 31 ? 23.632 17.828 26.739 1.00 14.46 ? 31 ILE A N 1 31 UNP O57413 220 I ATOM 243 C CA . ILE A 1 31 ? 22.349 17.250 26.301 1.00 13.32 ? 31 ILE A CA 1 31 UNP O57413 220 I ATOM 244 C C . ILE A 1 31 ? 21.186 18.190 26.620 1.00 12.81 ? 31 ILE A C 1 31 UNP O57413 220 I ATOM 245 O O . ILE A 1 31 ? 20.319 18.446 25.765 1.00 12.14 ? 31 ILE A O 1 31 UNP O57413 220 I ATOM 246 C CB . ILE A 1 31 ? 22.100 15.915 26.978 1.00 14.26 ? 31 ILE A CB 1 31 UNP O57413 220 I ATOM 247 C CG1 . ILE A 1 31 ? 23.154 14.921 26.492 1.00 15.69 ? 31 ILE A CG1 1 31 UNP O57413 220 I ATOM 248 C CG2 . ILE A 1 31 ? 20.676 15.417 26.690 1.00 14.05 ? 31 ILE A CG2 1 31 UNP O57413 220 I ATOM 249 C CD1 . ILE A 1 31 ? 23.224 13.631 27.311 1.00 16.86 ? 31 ILE A CD1 1 31 UNP O57413 220 I ATOM 250 N N . ARG A 1 32 ? 21.174 18.733 27.832 1.00 11.94 ? 32 ARG A N 1 32 UNP O57413 221 R ATOM 251 C CA . ARG A 1 32 ? 20.087 19.626 28.225 1.00 12.65 ? 32 ARG A CA 1 32 UNP O57413 221 R ATOM 252 C C . ARG A 1 32 ? 20.057 20.859 27.331 1.00 12.01 ? 32 ARG A C 1 32 UNP O57413 221 R ATOM 253 O O . ARG A 1 32 ? 18.984 21.284 26.898 1.00 11.37 ? 32 ARG A O 1 32 UNP O57413 221 R ATOM 254 C CB . ARG A 1 32 ? 20.224 20.004 29.711 1.00 13.61 ? 32 ARG A CB 1 32 UNP O57413 221 R ATOM 255 C CG . ARG A 1 32 ? 19.018 20.789 30.249 1.00 17.45 ? 32 ARG A CG 1 32 UNP O57413 221 R ATOM 256 C CD . ARG A 1 32 ? 19.154 21.096 31.727 1.00 21.38 ? 32 ARG A CD 1 32 UNP O57413 221 R ATOM 257 N NE . ARG A 1 32 ? 20.408 21.793 31.972 1.00 26.29 ? 32 ARG A NE 1 32 UNP O57413 221 R ATOM 258 C CZ . ARG A 1 32 ? 20.762 22.310 33.143 1.00 29.22 ? 32 ARG A CZ 1 32 UNP O57413 221 R ATOM 259 N NH1 . ARG A 1 32 ? 19.943 22.217 34.185 1.00 30.69 ? 32 ARG A NH1 1 32 UNP O57413 221 R ATOM 260 N NH2 . ARG A 1 32 ? 21.954 22.888 33.271 1.00 31.01 ? 32 ARG A NH2 1 32 UNP O57413 221 R ATOM 261 N N . LYS A 1 33 ? 21.225 21.417 26.994 1.00 11.98 ? 33 LYS A N 1 33 UNP O57413 222 K ATOM 262 C CA . LYS A 1 33 ? 21.306 22.581 26.109 1.00 11.91 ? 33 LYS A CA 1 33 UNP O57413 222 K ATOM 263 C C . LYS A 1 33 ? 20.739 22.244 24.730 1.00 11.72 ? 33 LYS A C 1 33 UNP O57413 222 K ATOM 264 O O . LYS A 1 33 ? 19.980 23.042 24.146 1.00 10.72 ? 33 LYS A O 1 33 UNP O57413 222 K ATOM 265 C CB . LYS A 1 33 ? 22.762 23.025 25.917 1.00 15.64 ? 33 LYS A CB 1 33 UNP O57413 222 K ATOM 266 C CG . LYS A 1 33 ? 22.951 24.180 24.955 1.00 20.86 ? 33 LYS A CG 1 33 UNP O57413 222 K ATOM 267 C CD . LYS A 1 33 ? 24.398 24.266 24.467 1.00 24.84 ? 33 LYS A CD 1 33 UNP O57413 222 K ATOM 268 C CE . LYS A 1 33 ? 24.586 25.307 23.366 1.00 26.15 ? 33 LYS A CE 1 33 UNP O57413 222 K ATOM 269 N NZ . LYS A 1 33 ? 24.146 26.687 23.732 1.00 29.69 ? 33 LYS A NZ 1 33 UNP O57413 222 K ATOM 270 N N . ARG A 1 34 ? 21.112 21.072 24.219 1.00 10.53 ? 34 ARG A N 1 34 UNP O57413 223 R ATOM 271 C CA . ARG A 1 34 ? 20.629 20.654 22.913 1.00 10.56 ? 34 ARG A CA 1 34 UNP O57413 223 R ATOM 272 C C . ARG A 1 34 ? 19.107 20.489 22.927 1.00 8.92 ? 34 ARG A C 1 34 UNP O57413 223 R ATOM 273 O O . ARG A 1 34 ? 18.432 20.960 22.006 1.00 9.13 ? 34 ARG A O 1 34 UNP O57413 223 R ATOM 274 C CB . ARG A 1 34 ? 21.306 19.342 22.477 1.00 11.43 ? 34 ARG A CB 1 34 UNP O57413 223 R ATOM 275 C CG . ARG A 1 34 ? 20.914 18.970 21.026 1.00 12.86 ? 34 ARG A CG 1 34 UNP O57413 223 R ATOM 276 C CD . ARG A 1 34 ? 21.648 17.728 20.559 1.00 14.66 ? 34 ARG A CD 1 34 UNP O57413 223 R ATOM 277 N NE . ARG A 1 34 ? 21.238 17.267 19.229 1.00 14.41 ? 34 ARG A NE 1 34 UNP O57413 223 R ATOM 278 C CZ . ARG A 1 34 ? 21.744 17.679 18.067 1.00 13.86 ? 34 ARG A CZ 1 34 UNP O57413 223 R ATOM 279 N NH1 . ARG A 1 34 ? 22.702 18.607 18.014 1.00 14.26 ? 34 ARG A NH1 1 34 UNP O57413 223 R ATOM 280 N NH2 . ARG A 1 34 ? 21.323 17.094 16.937 1.00 13.80 ? 34 ARG A NH2 1 34 UNP O57413 223 R ATOM 281 N N . VAL A 1 35 ? 18.577 19.840 23.953 1.00 8.31 ? 35 VAL A N 1 35 UNP O57413 224 V ATOM 282 C CA . VAL A 1 35 ? 17.120 19.673 24.058 1.00 7.96 ? 35 VAL A CA 1 35 UNP O57413 224 V ATOM 283 C C . VAL A 1 35 ? 16.401 21.000 24.148 1.00 8.02 ? 35 VAL A C 1 35 UNP O57413 224 V ATOM 284 O O . VAL A 1 35 ? 15.352 21.207 23.505 1.00 8.38 ? 35 VAL A O 1 35 UNP O57413 224 V ATOM 285 C CB . VAL A 1 35 ? 16.765 18.794 25.265 1.00 8.71 ? 35 VAL A CB 1 35 UNP O57413 224 V ATOM 286 C CG1 . VAL A 1 35 ? 15.273 18.780 25.505 1.00 10.48 ? 35 VAL A CG1 1 35 UNP O57413 224 V ATOM 287 C CG2 . VAL A 1 35 ? 17.283 17.371 24.959 1.00 9.35 ? 35 VAL A CG2 1 35 UNP O57413 224 V ATOM 288 N N . HIS A 1 36 ? 16.927 21.925 24.954 1.00 8.37 ? 36 HIS A N 1 36 UNP O57413 225 H ATOM 289 C CA . HIS A 1 36 ? 16.304 23.248 25.017 1.00 7.57 ? 36 HIS A CA 1 36 UNP O57413 225 H ATOM 290 C C . HIS A 1 36 ? 16.313 23.944 23.640 1.00 8.14 ? 36 HIS A C 1 36 UNP O57413 225 H ATOM 291 O O . HIS A 1 36 ? 15.305 24.570 23.239 1.00 8.40 ? 36 HIS A O 1 36 UNP O57413 225 H ATOM 292 C CB . HIS A 1 36 ? 17.017 24.131 26.053 1.00 7.31 ? 36 HIS A CB 1 36 UNP O57413 225 H ATOM 293 C CG . HIS A 1 36 ? 16.544 23.915 27.458 1.00 7.95 ? 36 HIS A CG 1 36 UNP O57413 225 H ATOM 294 N ND1 . HIS A 1 36 ? 16.057 24.943 28.242 1.00 8.89 ? 36 HIS A ND1 1 36 UNP O57413 225 H ATOM 295 C CD2 . HIS A 1 36 ? 16.451 22.794 28.210 1.00 9.29 ? 36 HIS A CD2 1 36 UNP O57413 225 H ATOM 296 C CE1 . HIS A 1 36 ? 15.680 24.459 29.416 1.00 9.36 ? 36 HIS A CE1 1 36 UNP O57413 225 H ATOM 297 N NE2 . HIS A 1 36 ? 15.909 23.155 29.422 1.00 10.33 ? 36 HIS A NE2 1 36 UNP O57413 225 H ATOM 298 N N . GLN A 1 37 ? 17.414 23.831 22.882 1.00 8.02 ? 37 GLN A N 1 37 UNP O57413 226 Q ATOM 299 C CA . GLN A 1 37 ? 17.452 24.452 21.573 1.00 8.72 ? 37 GLN A CA 1 37 UNP O57413 226 Q ATOM 300 C C . GLN A 1 37 ? 16.404 23.823 20.640 1.00 7.93 ? 37 GLN A C 1 37 UNP O57413 226 Q ATOM 301 O O . GLN A 1 37 ? 15.809 24.507 19.820 1.00 8.92 ? 37 GLN A O 1 37 UNP O57413 226 Q ATOM 302 C CB . GLN A 1 37 ? 18.856 24.337 20.940 1.00 9.93 ? 37 GLN A CB 1 37 UNP O57413 226 Q ATOM 303 C CG . GLN A 1 37 ? 19.017 25.352 19.809 1.00 13.36 ? 37 GLN A CG 1 37 UNP O57413 226 Q ATOM 304 C CD . GLN A 1 37 ? 20.292 25.220 19.023 1.00 14.44 ? 37 GLN A CD 1 37 UNP O57413 226 Q ATOM 305 O OE1 . GLN A 1 37 ? 20.284 25.307 17.797 1.00 14.34 ? 37 GLN A OE1 1 37 UNP O57413 226 Q ATOM 306 N NE2 . GLN A 1 37 ? 21.406 25.025 19.726 1.00 16.03 ? 37 GLN A NE2 1 37 UNP O57413 226 Q ATOM 307 N N . MET A 1 38 ? 16.182 22.528 20.795 1.00 8.87 ? 38 MET A N 1 38 UNP O57413 227 M ATOM 308 C CA . MET A 1 38 ? 15.154 21.862 20.008 1.00 8.77 ? 38 MET A CA 1 38 UNP O57413 227 M ATOM 309 C C . MET A 1 38 ? 13.785 22.416 20.372 1.00 8.05 ? 38 MET A C 1 38 UNP O57413 227 M ATOM 310 O O . MET A 1 38 ? 12.991 22.774 19.505 1.00 7.99 ? 38 MET A O 1 38 UNP O57413 227 M ATOM 311 C CB . MET A 1 38 ? 15.169 20.370 20.271 1.00 9.36 ? 38 MET A CB 1 38 UNP O57413 227 M ATOM 312 C CG . MET A 1 38 ? 16.468 19.747 19.879 1.00 14.04 ? 38 MET A CG 1 38 UNP O57413 227 M ATOM 313 S SD . MET A 1 38 ? 16.556 18.039 20.426 1.00 17.95 ? 38 MET A SD 1 38 UNP O57413 227 M ATOM 314 C CE . MET A 1 38 ? 17.502 17.372 19.111 1.00 19.07 ? 38 MET A CE 1 38 UNP O57413 227 M ATOM 315 N N . VAL A 1 39 ? 13.500 22.513 21.662 1.00 6.63 ? 39 VAL A N 1 39 UNP O57413 228 V ATOM 316 C CA . VAL A 1 39 ? 12.207 23.023 22.100 1.00 8.05 ? 39 VAL A CA 1 39 UNP O57413 228 V ATOM 317 C C . VAL A 1 39 ? 11.980 24.463 21.617 1.00 7.00 ? 39 VAL A C 1 39 UNP O57413 228 V ATOM 318 O O . VAL A 1 39 ? 10.891 24.827 21.172 1.00 7.88 ? 39 VAL A O 1 39 UNP O57413 228 V ATOM 319 C CB . VAL A 1 39 ? 12.075 22.911 23.634 1.00 7.95 ? 39 VAL A CB 1 39 UNP O57413 228 V ATOM 320 C CG1 . VAL A 1 39 ? 10.788 23.620 24.097 1.00 9.83 ? 39 VAL A CG1 1 39 UNP O57413 228 V ATOM 321 C CG2 . VAL A 1 39 ? 11.993 21.447 24.023 1.00 10.18 ? 39 VAL A CG2 1 39 UNP O57413 228 V ATOM 322 N N . SER A 1 40 ? 13.022 25.295 21.678 1.00 6.99 ? 40 SER A N 1 40 UNP O57413 229 S ATOM 323 C CA . SER A 1 40 ? 12.884 26.664 21.215 1.00 7.14 ? 40 SER A CA 1 40 UNP O57413 229 S ATOM 324 C C . SER A 1 40 ? 12.491 26.668 19.735 1.00 7.03 ? 40 SER A C 1 40 UNP O57413 229 S ATOM 325 O O . SER A 1 40 ? 11.696 27.487 19.307 1.00 7.81 ? 40 SER A O 1 40 UNP O57413 229 S ATOM 326 C CB . SER A 1 40 ? 14.183 27.464 21.403 1.00 8.63 ? 40 SER A CB 1 40 UNP O57413 229 S ATOM 327 O OG . SER A 1 40 ? 14.460 27.564 22.787 1.00 11.99 ? 40 SER A OG 1 40 UNP O57413 229 S ATOM 328 N N . ASN A 1 41 ? 13.032 25.724 18.956 1.00 7.03 ? 41 ASN A N 1 41 UNP O57413 230 N ATOM 329 C CA . ASN A 1 41 ? 12.653 25.656 17.551 1.00 6.71 ? 41 ASN A CA 1 41 UNP O57413 230 N ATOM 330 C C . ASN A 1 41 ? 11.215 25.138 17.374 1.00 5.90 ? 41 ASN A C 1 41 UNP O57413 230 N ATOM 331 O O . ASN A 1 41 ? 10.495 25.634 16.514 1.00 6.47 ? 41 ASN A O 1 41 UNP O57413 230 N ATOM 332 C CB . ASN A 1 41 ? 13.656 24.757 16.785 1.00 6.72 ? 41 ASN A CB 1 41 UNP O57413 230 N ATOM 333 C CG . ASN A 1 41 ? 14.881 25.527 16.343 1.00 6.12 ? 41 ASN A CG 1 41 UNP O57413 230 N ATOM 334 O OD1 . ASN A 1 41 ? 14.805 26.398 15.460 1.00 7.91 ? 41 ASN A OD1 1 41 UNP O57413 230 N ATOM 335 N ND2 . ASN A 1 41 ? 16.012 25.231 16.960 1.00 8.46 ? 41 ASN A ND2 1 41 UNP O57413 230 N ATOM 336 N N . ILE A 1 42 ? 10.829 24.125 18.139 1.00 6.32 ? 42 ILE A N 1 42 UNP O57413 231 I ATOM 337 C CA . ILE A 1 42 ? 9.445 23.624 18.046 1.00 6.20 ? 42 ILE A CA 1 42 UNP O57413 231 I ATOM 338 C C . ILE A 1 42 ? 8.501 24.764 18.408 1.00 7.52 ? 42 ILE A C 1 42 UNP O57413 231 I ATOM 339 O O . ILE A 1 42 ? 7.506 24.966 17.731 1.00 7.60 ? 42 ILE A O 1 42 UNP O57413 231 I ATOM 340 C CB . ILE A 1 42 ? 9.232 22.433 18.994 1.00 5.87 ? 42 ILE A CB 1 42 UNP O57413 231 I ATOM 341 C CG1 . ILE A 1 42 ? 10.174 21.295 18.624 1.00 7.56 ? 42 ILE A CG1 1 42 UNP O57413 231 I ATOM 342 C CG2 . ILE A 1 42 ? 7.751 21.992 18.951 1.00 7.19 ? 42 ILE A CG2 1 42 UNP O57413 231 I ATOM 343 C CD1 . ILE A 1 42 ? 10.227 20.226 19.714 1.00 7.79 ? 42 ILE A CD1 1 42 UNP O57413 231 I ATOM 344 N N . ASN A 1 43 ? 8.823 25.523 19.457 1.00 6.18 ? 43 ASN A N 1 43 UNP O57413 232 N ATOM 345 C CA . ASN A 1 43 ? 7.984 26.652 19.860 1.00 7.50 ? 43 ASN A CA 1 43 UNP O57413 232 N ATOM 346 C C . ASN A 1 43 ? 7.861 27.673 18.714 1.00 7.73 ? 43 ASN A C 1 43 UNP O57413 232 N ATOM 347 O O . ASN A 1 43 ? 6.786 28.155 18.419 1.00 7.83 ? 43 ASN A O 1 43 UNP O57413 232 N ATOM 348 C CB . ASN A 1 43 ? 8.579 27.332 21.092 1.00 8.23 ? 43 ASN A CB 1 43 UNP O57413 232 N ATOM 349 C CG . ASN A 1 43 ? 7.707 28.433 21.608 1.00 10.56 ? 43 ASN A CG 1 43 UNP O57413 232 N ATOM 350 O OD1 . ASN A 1 43 ? 6.612 28.191 22.090 1.00 9.95 ? 43 ASN A OD1 1 43 UNP O57413 232 N ATOM 351 N ND2 . ASN A 1 43 ? 8.170 29.682 21.426 1.00 11.17 ? 43 ASN A ND2 1 43 UNP O57413 232 N ATOM 352 N N . GLU A 1 44 ? 8.975 27.978 18.057 1.00 6.90 ? 44 GLU A N 1 44 UNP O57413 233 E ATOM 353 C CA . GLU A 1 44 ? 8.953 28.930 16.948 1.00 7.04 ? 44 GLU A CA 1 44 UNP O57413 233 E ATOM 354 C C . GLU A 1 44 ? 8.069 28.435 15.813 1.00 7.51 ? 44 GLU A C 1 44 UNP O57413 233 E ATOM 355 O O . GLU A 1 44 ? 7.288 29.182 15.255 1.00 8.56 ? 44 GLU A O 1 44 UNP O57413 233 E ATOM 356 C CB . GLU A 1 44 ? 10.398 29.183 16.467 1.00 8.33 ? 44 GLU A CB 1 44 UNP O57413 233 E ATOM 357 C CG . GLU A 1 44 ? 10.512 29.921 15.126 1.00 9.05 ? 44 GLU A CG 1 44 UNP O57413 233 E ATOM 358 C CD . GLU A 1 44 ? 9.872 31.295 15.145 1.00 8.98 ? 44 GLU A CD 1 44 UNP O57413 233 E ATOM 359 O OE1 . GLU A 1 44 ? 9.599 31.853 16.237 1.00 9.14 ? 44 GLU A OE1 1 44 UNP O57413 233 E ATOM 360 O OE2 . GLU A 1 44 ? 9.663 31.815 14.025 1.00 11.05 ? 44 GLU A OE2 1 44 UNP O57413 233 E ATOM 361 N N . MET A 1 45 ? 8.208 27.158 15.487 1.00 8.05 ? 45 MET A N 1 45 UNP O57413 234 M ATOM 362 C CA . MET A 1 45 ? 7.416 26.590 14.398 1.00 7.89 ? 45 MET A CA 1 45 UNP O57413 234 M ATOM 363 C C . MET A 1 45 ? 5.938 26.538 14.718 1.00 7.83 ? 45 MET A C 1 45 UNP O57413 234 M ATOM 364 O O . MET A 1 45 ? 5.136 26.596 13.809 1.00 8.52 ? 45 MET A O 1 45 UNP O57413 234 M ATOM 365 C CB . MET A 1 45 ? 7.954 25.215 14.036 1.00 7.55 ? 45 MET A CB 1 45 UNP O57413 234 M ATOM 366 C CG . MET A 1 45 ? 9.260 25.310 13.247 1.00 8.18 ? 45 MET A CG 1 45 UNP O57413 234 M ATOM 367 S SD . MET A 1 45 ? 9.960 23.718 12.733 1.00 9.04 ? 45 MET A SD 1 45 UNP O57413 234 M ATOM 368 C CE . MET A 1 45 ? 11.120 23.402 14.118 1.00 8.05 ? 45 MET A CE 1 45 UNP O57413 234 M ATOM 369 N N . CYS A 1 46 ? 5.565 26.438 15.998 1.00 7.27 ? 46 CYS A N 1 46 UNP O57413 235 C ATOM 370 C CA . CYS A 1 46 ? 4.153 26.407 16.335 1.00 8.75 ? 46 CYS A CA 1 46 UNP O57413 235 C ATOM 371 C C . CYS A 1 46 ? 3.544 27.787 16.551 1.00 8.77 ? 46 CYS A C 1 46 UNP O57413 235 C ATOM 372 O O . CYS A 1 46 ? 2.345 27.894 16.774 1.00 9.35 ? 46 CYS A O 1 46 UNP O57413 235 C ATOM 373 C CB . CYS A 1 46 ? 3.921 25.562 17.587 1.00 7.86 ? 46 CYS A CB 1 46 UNP O57413 235 C ATOM 374 S SG . CYS A 1 46 ? 4.226 23.781 17.281 1.00 8.98 ? 46 CYS A SG 1 46 UNP O57413 235 C ATOM 375 N N . ARG A 1 47 ? 4.368 28.837 16.494 1.00 11.01 ? 47 ARG A N 1 47 UNP O57413 236 R ATOM 376 C CA . ARG A 1 47 ? 3.875 30.198 16.710 1.00 12.69 ? 47 ARG A CA 1 47 UNP O57413 236 R ATOM 377 C C . ARG A 1 47 ? 2.715 30.532 15.779 1.00 12.57 ? 47 ARG A C 1 47 UNP O57413 236 R ATOM 378 O O . ARG A 1 47 ? 1.714 31.068 16.234 1.00 13.28 ? 47 ARG A O 1 47 UNP O57413 236 R ATOM 379 C CB . ARG A 1 47 ? 5.054 31.196 16.587 1.00 14.46 ? 47 ARG A CB 1 47 UNP O57413 236 R ATOM 380 C CG . ARG A 1 47 ? 4.805 32.646 17.007 1.00 16.87 ? 47 ARG A CG 1 47 UNP O57413 236 R ATOM 381 C CD . ARG A 1 47 ? 6.184 33.343 17.154 1.00 15.42 ? 47 ARG A CD 1 47 UNP O57413 236 R ATOM 382 N NE . ARG A 1 47 ? 7.048 33.195 15.965 1.00 17.37 ? 47 ARG A NE 1 47 UNP O57413 236 R ATOM 383 C CZ . ARG A 1 47 ? 6.998 33.998 14.896 1.00 16.55 ? 47 ARG A CZ 1 47 UNP O57413 236 R ATOM 384 N NH1 . ARG A 1 47 ? 6.122 35.003 14.848 1.00 16.07 ? 47 ARG A NH1 1 47 UNP O57413 236 R ATOM 385 N NH2 . ARG A 1 47 ? 7.850 33.835 13.904 1.00 16.39 ? 47 ARG A NH2 1 47 UNP O57413 236 R ATOM 386 N N . PRO A 1 48 ? 2.791 30.176 14.471 1.00 12.63 ? 48 PRO A N 1 48 UNP O57413 237 P ATOM 387 C CA . PRO A 1 48 ? 1.647 30.510 13.629 1.00 13.01 ? 48 PRO A CA 1 48 UNP O57413 237 P ATOM 388 C C . PRO A 1 48 ? 0.370 29.690 13.904 1.00 12.80 ? 48 PRO A C 1 48 UNP O57413 237 P ATOM 389 O O . PRO A 1 48 ? -0.708 29.977 13.343 1.00 14.20 ? 48 PRO A O 1 48 UNP O57413 237 P ATOM 390 C CB . PRO A 1 48 ? 2.184 30.304 12.193 1.00 13.12 ? 48 PRO A CB 1 48 UNP O57413 237 P ATOM 391 C CG . PRO A 1 48 ? 3.644 30.463 12.336 1.00 13.42 ? 48 PRO A CG 1 48 UNP O57413 237 P ATOM 392 C CD . PRO A 1 48 ? 3.956 29.785 13.654 1.00 12.95 ? 48 PRO A CD 1 48 UNP O57413 237 P ATOM 393 N N . LEU A 1 49 ? 0.472 28.623 14.711 1.00 11.23 ? 49 LEU A N 1 49 UNP O57413 238 L ATOM 394 C CA . LEU A 1 49 ? -0.701 27.827 15.069 1.00 11.57 ? 49 LEU A CA 1 49 UNP O57413 238 L ATOM 395 C C . LEU A 1 49 ? -1.258 28.306 16.410 1.00 10.66 ? 49 LEU A C 1 49 UNP O57413 238 L ATOM 396 O O . LEU A 1 49 ? -2.266 27.795 16.874 1.00 10.90 ? 49 LEU A O 1 49 UNP O57413 238 L ATOM 397 C CB . LEU A 1 49 ? -0.343 26.331 15.198 1.00 10.89 ? 49 LEU A CB 1 49 UNP O57413 238 L ATOM 398 C CG . LEU A 1 49 ? 0.225 25.599 13.964 1.00 11.13 ? 49 LEU A CG 1 49 UNP O57413 238 L ATOM 399 C CD1 . LEU A 1 49 ? 0.414 24.105 14.296 1.00 9.54 ? 49 LEU A CD1 1 49 UNP O57413 238 L ATOM 400 C CD2 . LEU A 1 49 ? -0.712 25.781 12.752 1.00 12.53 ? 49 LEU A CD2 1 49 UNP O57413 238 L ATOM 401 N N . ASN A 1 50 ? -0.590 29.292 17.002 1.00 10.71 ? 50 ASN A N 1 50 UNP O57413 239 N ATOM 402 C CA . ASN A 1 50 ? -0.955 29.858 18.300 1.00 10.89 ? 50 ASN A CA 1 50 UNP O57413 239 N ATOM 403 C C . ASN A 1 50 ? -0.905 28.801 19.403 1.00 11.42 ? 50 ASN A C 1 50 UNP O57413 239 N ATOM 404 O O . ASN A 1 50 ? -1.762 28.749 20.276 1.00 10.80 ? 50 ASN A O 1 50 UNP O57413 239 N ATOM 405 C CB . ASN A 1 50 ? -2.349 30.521 18.263 1.00 11.51 ? 50 ASN A CB 1 50 UNP O57413 239 N ATOM 406 C CG . ASN A 1 50 ? -2.492 31.598 19.320 1.00 13.37 ? 50 ASN A CG 1 50 UNP O57413 239 N ATOM 407 O OD1 . ASN A 1 50 ? -1.518 31.964 19.997 1.00 12.93 ? 50 ASN A OD1 1 50 UNP O57413 239 N ATOM 408 N ND2 . ASN A 1 50 ? -3.713 32.126 19.467 1.00 12.38 ? 50 ASN A ND2 1 50 UNP O57413 239 N ATOM 409 N N . ILE A 1 51 ? 0.143 27.975 19.375 1.00 11.09 ? 51 ILE A N 1 51 UNP O57413 240 I ATOM 410 C CA . ILE A 1 51 ? 0.303 26.941 20.397 1.00 10.53 ? 51 ILE A CA 1 51 UNP O57413 240 I ATOM 411 C C . ILE A 1 51 ? 1.589 27.273 21.122 1.00 9.92 ? 51 ILE A C 1 51 UNP O57413 240 I ATOM 412 O O . ILE A 1 51 ? 2.636 27.331 20.502 1.00 12.02 ? 51 ILE A O 1 51 UNP O57413 240 I ATOM 413 C CB . ILE A 1 51 ? 0.478 25.506 19.811 1.00 11.39 ? 51 ILE A CB 1 51 UNP O57413 240 I ATOM 414 C CG1 . ILE A 1 51 ? -0.725 25.111 18.945 1.00 10.85 ? 51 ILE A CG1 1 51 UNP O57413 240 I ATOM 415 C CG2 . ILE A 1 51 ? 0.612 24.489 20.976 1.00 11.62 ? 51 ILE A CG2 1 51 UNP O57413 240 I ATOM 416 C CD1 . ILE A 1 51 ? -0.489 23.784 18.161 1.00 12.57 ? 51 ILE A CD1 1 51 UNP O57413 240 I ATOM 417 N N . ALA A 1 52 ? 1.510 27.503 22.434 1.00 9.89 ? 52 ALA A N 1 52 UNP O57413 241 A ATOM 418 C CA . ALA A 1 52 ? 2.697 27.798 23.231 1.00 9.29 ? 52 ALA A CA 1 52 UNP O57413 241 A ATOM 419 C C . ALA A 1 52 ? 3.281 26.440 23.664 1.00 9.26 ? 52 ALA A C 1 52 UNP O57413 241 A ATOM 420 O O . ALA A 1 52 ? 2.600 25.620 24.274 1.00 9.57 ? 52 ALA A O 1 52 UNP O57413 241 A ATOM 421 C CB . ALA A 1 52 ? 2.320 28.659 24.479 1.00 10.37 ? 52 ALA A CB 1 52 UNP O57413 241 A ATOM 422 N N . ILE A 1 53 ? 4.552 26.223 23.337 1.00 9.03 ? 53 ILE A N 1 53 UNP O57413 242 I ATOM 423 C CA . ILE A 1 53 ? 5.223 24.965 23.630 1.00 9.31 ? 53 ILE A CA 1 53 UNP O57413 242 I ATOM 424 C C . ILE A 1 53 ? 6.178 25.129 24.806 1.00 10.00 ? 53 ILE A C 1 53 UNP O57413 242 I ATOM 425 O O . ILE A 1 53 ? 7.024 26.025 24.779 1.00 11.49 ? 53 ILE A O 1 53 UNP O57413 242 I ATOM 426 C CB . ILE A 1 53 ? 6.075 24.526 22.411 1.00 8.49 ? 53 ILE A CB 1 53 UNP O57413 242 I ATOM 427 C CG1 . ILE A 1 53 ? 5.221 24.402 21.149 1.00 9.22 ? 53 ILE A CG1 1 53 UNP O57413 242 I ATOM 428 C CG2 . ILE A 1 53 ? 6.732 23.186 22.680 1.00 10.72 ? 53 ILE A CG2 1 53 UNP O57413 242 I ATOM 429 C CD1 . ILE A 1 53 ? 4.227 23.174 21.172 1.00 11.02 ? 53 ILE A CD1 1 53 UNP O57413 242 I ATOM 430 N N . THR A 1 54 ? 6.043 24.293 25.832 1.00 9.57 ? 54 THR A N 1 54 UNP O57413 243 T ATOM 431 C CA . THR A 1 54 ? 6.972 24.334 26.970 1.00 10.22 ? 54 THR A CA 1 54 UNP O57413 243 T ATOM 432 C C . THR A 1 54 ? 7.531 22.964 27.252 1.00 10.09 ? 54 THR A C 1 54 UNP O57413 243 T ATOM 433 O O . THR A 1 54 ? 6.957 21.929 26.857 1.00 10.74 ? 54 THR A O 1 54 UNP O57413 243 T ATOM 434 C CB . THR A 1 54 ? 6.270 24.826 28.234 1.00 10.31 ? 54 THR A CB 1 54 UNP O57413 243 T ATOM 435 O OG1 . THR A 1 54 ? 5.047 24.081 28.433 1.00 11.44 ? 54 THR A OG1 1 54 UNP O57413 243 T ATOM 436 C CG2 . THR A 1 54 ? 5.978 26.326 28.095 1.00 12.06 ? 54 THR A CG2 1 54 UNP O57413 243 T ATOM 437 N N . LEU A 1 55 ? 8.710 22.947 27.869 1.00 8.32 ? 55 LEU A N 1 55 UNP O57413 244 L ATOM 438 C CA . LEU A 1 55 ? 9.342 21.719 28.270 1.00 9.07 ? 55 LEU A CA 1 55 UNP O57413 244 L ATOM 439 C C . LEU A 1 55 ? 9.003 21.521 29.726 1.00 9.49 ? 55 LEU A C 1 55 UNP O57413 244 L ATOM 440 O O . LEU A 1 55 ? 9.598 22.150 30.624 1.00 10.34 ? 55 LEU A O 1 55 UNP O57413 244 L ATOM 441 C CB . LEU A 1 55 ? 10.857 21.828 28.124 1.00 9.44 ? 55 LEU A CB 1 55 UNP O57413 244 L ATOM 442 C CG . LEU A 1 55 ? 11.615 20.587 28.578 1.00 11.19 ? 55 LEU A CG 1 55 UNP O57413 244 L ATOM 443 C CD1 . LEU A 1 55 ? 11.241 19.363 27.708 1.00 11.36 ? 55 LEU A CD1 1 55 UNP O57413 244 L ATOM 444 C CD2 . LEU A 1 55 ? 13.116 20.889 28.473 1.00 12.89 ? 55 LEU A CD2 1 55 UNP O57413 244 L ATOM 445 N N . ALA A 1 56 ? 8.040 20.648 29.970 1.00 9.37 ? 56 ALA A N 1 56 UNP O57413 245 A ATOM 446 C CA . ALA A 1 56 ? 7.617 20.312 31.315 1.00 9.90 ? 56 ALA A CA 1 56 UNP O57413 245 A ATOM 447 C C . ALA A 1 56 ? 8.569 19.362 32.024 1.00 10.73 ? 56 ALA A C 1 56 UNP O57413 245 A ATOM 448 O O . ALA A 1 56 ? 8.752 19.428 33.261 1.00 11.30 ? 56 ALA A O 1 56 UNP O57413 245 A ATOM 449 C CB . ALA A 1 56 ? 6.204 19.685 31.252 1.00 11.34 ? 56 ALA A CB 1 56 UNP O57413 245 A ATOM 450 N N . LEU A 1 57 ? 9.207 18.482 31.275 1.00 10.77 ? 57 LEU A N 1 57 UNP O57413 246 L ATOM 451 C CA . LEU A 1 57 ? 10.049 17.484 31.910 1.00 12.13 ? 57 LEU A CA 1 57 UNP O57413 246 L ATOM 452 C C . LEU A 1 57 ? 11.112 16.980 30.967 1.00 11.65 ? 57 LEU A C 1 57 UNP O57413 246 L ATOM 453 O O . LEU A 1 57 ? 10.838 16.748 29.799 1.00 11.32 ? 57 LEU A O 1 57 UNP O57413 246 L ATOM 454 C CB . LEU A 1 57 ? 9.171 16.304 32.335 1.00 14.15 ? 57 LEU A CB 1 57 UNP O57413 246 L ATOM 455 C CG . LEU A 1 57 ? 9.781 15.047 32.949 1.00 16.38 ? 57 LEU A CG 1 57 UNP O57413 246 L ATOM 456 C CD1 . LEU A 1 57 ? 10.462 15.376 34.292 1.00 19.07 ? 57 LEU A CD1 1 57 UNP O57413 246 L ATOM 457 C CD2 . LEU A 1 57 ? 8.670 14.033 33.144 1.00 18.13 ? 57 LEU A CD2 1 57 UNP O57413 246 L ATOM 458 N N . LEU A 1 58 ? 12.333 16.848 31.466 1.00 12.47 ? 58 LEU A N 1 58 UNP O57413 247 L ATOM 459 C CA . LEU A 1 58 ? 13.427 16.283 30.688 1.00 11.90 ? 58 LEU A CA 1 58 UNP O57413 247 L ATOM 460 C C . LEU A 1 58 ? 13.947 15.090 31.449 1.00 12.74 ? 58 LEU A C 1 58 UNP O57413 247 L ATOM 461 O O . LEU A 1 58 ? 14.325 15.204 32.620 1.00 13.78 ? 58 LEU A O 1 58 UNP O57413 247 L ATOM 462 C CB . LEU A 1 58 ? 14.578 17.261 30.473 1.00 12.04 ? 58 LEU A CB 1 58 UNP O57413 247 L ATOM 463 C CG . LEU A 1 58 ? 15.879 16.653 29.926 1.00 12.78 ? 58 LEU A CG 1 58 UNP O57413 247 L ATOM 464 C CD1 . LEU A 1 58 ? 15.695 16.038 28.513 1.00 13.00 ? 58 LEU A CD1 1 58 UNP O57413 247 L ATOM 465 C CD2 . LEU A 1 58 ? 16.942 17.756 29.900 1.00 13.58 ? 58 LEU A CD2 1 58 UNP O57413 247 L ATOM 466 N N . ASP A 1 59 ? 13.969 13.935 30.803 1.00 12.81 ? 59 ASP A N 1 59 UNP O57413 248 D ATOM 467 C CA . ASP A 1 59 ? 14.477 12.738 31.460 1.00 13.39 ? 59 ASP A CA 1 59 UNP O57413 248 D ATOM 468 C C . ASP A 1 59 ? 15.611 12.192 30.611 1.00 13.82 ? 59 ASP A C 1 59 UNP O57413 248 D ATOM 469 O O . ASP A 1 59 ? 15.393 11.874 29.446 1.00 13.08 ? 59 ASP A O 1 59 UNP O57413 248 D ATOM 470 C CB . ASP A 1 59 ? 13.361 11.682 31.596 1.00 15.25 ? 59 ASP A CB 1 59 UNP O57413 248 D ATOM 471 C CG . ASP A 1 59 ? 13.806 10.468 32.397 1.00 18.24 ? 59 ASP A CG 1 59 UNP O57413 248 D ATOM 472 O OD1 . ASP A 1 59 ? 14.793 10.614 33.149 1.00 21.10 ? 59 ASP A OD1 1 59 UNP O57413 248 D ATOM 473 O OD2 . ASP A 1 59 ? 13.182 9.382 32.304 1.00 19.83 ? 59 ASP A OD2 1 59 UNP O57413 248 D ATOM 474 N N . VAL A 1 60 ? 16.810 12.099 31.171 1.00 13.24 ? 60 VAL A N 1 60 UNP O57413 249 V ATOM 475 C CA . VAL A 1 60 ? 17.973 11.574 30.452 1.00 13.33 ? 60 VAL A CA 1 60 UNP O57413 249 V ATOM 476 C C . VAL A 1 60 ? 18.318 10.225 31.055 1.00 14.54 ? 60 VAL A C 1 60 UNP O57413 249 V ATOM 477 O O . VAL A 1 60 ? 18.586 10.132 32.272 1.00 14.80 ? 60 VAL A O 1 60 UNP O57413 249 V ATOM 478 C CB . VAL A 1 60 ? 19.162 12.567 30.570 1.00 13.02 ? 60 VAL A CB 1 60 UNP O57413 249 V ATOM 479 C CG1 . VAL A 1 60 ? 20.404 12.041 29.846 1.00 14.30 ? 60 VAL A CG1 1 60 UNP O57413 249 V ATOM 480 C CG2 . VAL A 1 60 ? 18.761 13.899 29.984 1.00 13.65 ? 60 VAL A CG2 1 60 UNP O57413 249 V ATOM 481 N N . TRP A 1 61 ? 18.281 9.168 30.233 1.00 13.80 ? 61 TRP A N 1 61 UNP O57413 250 W ATOM 482 C CA . TRP A 1 61 ? 18.569 7.816 30.706 1.00 14.05 ? 61 TRP A CA 1 61 UNP O57413 250 W ATOM 483 C C . TRP A 1 61 ? 20.069 7.615 30.762 1.00 15.43 ? 61 TRP A C 1 61 UNP O57413 250 W ATOM 484 O O . TRP A 1 61 ? 20.689 7.032 29.877 1.00 15.25 ? 61 TRP A O 1 61 UNP O57413 250 W ATOM 485 C CB . TRP A 1 61 ? 17.877 6.789 29.799 1.00 12.80 ? 61 TRP A CB 1 61 UNP O57413 250 W ATOM 486 C CG . TRP A 1 61 ? 16.389 6.829 29.881 1.00 11.94 ? 61 TRP A CG 1 61 UNP O57413 250 W ATOM 487 C CD1 . TRP A 1 61 ? 15.607 7.525 30.784 1.00 12.10 ? 61 TRP A CD1 1 61 UNP O57413 250 W ATOM 488 C CD2 . TRP A 1 61 ? 15.483 6.104 29.059 1.00 11.46 ? 61 TRP A CD2 1 61 UNP O57413 250 W ATOM 489 N NE1 . TRP A 1 61 ? 14.280 7.261 30.568 1.00 12.13 ? 61 TRP A NE1 1 61 UNP O57413 250 W ATOM 490 C CE2 . TRP A 1 61 ? 14.171 6.390 29.514 1.00 11.43 ? 61 TRP A CE2 1 61 UNP O57413 250 W ATOM 491 C CE3 . TRP A 1 61 ? 15.651 5.239 27.974 1.00 11.08 ? 61 TRP A CE3 1 61 UNP O57413 250 W ATOM 492 C CZ2 . TRP A 1 61 ? 13.028 5.838 28.916 1.00 11.77 ? 61 TRP A CZ2 1 61 UNP O57413 250 W ATOM 493 C CZ3 . TRP A 1 61 ? 14.528 4.690 27.384 1.00 11.05 ? 61 TRP A CZ3 1 61 UNP O57413 250 W ATOM 494 C CH2 . TRP A 1 61 ? 13.235 4.990 27.850 1.00 11.60 ? 61 TRP A CH2 1 61 UNP O57413 250 W ATOM 495 N N . SER A 1 62 ? 20.650 8.138 31.838 1.00 16.43 ? 62 SER A N 1 62 UNP O57413 251 S ATOM 496 C CA . SER A 1 62 ? 22.094 8.122 32.031 1.00 18.43 ? 62 SER A CA 1 62 UNP O57413 251 S ATOM 497 C C . SER A 1 62 ? 22.694 6.791 32.451 1.00 19.53 ? 62 SER A C 1 62 UNP O57413 251 S ATOM 498 O O . SER A 1 62 ? 23.910 6.632 32.411 1.00 20.53 ? 62 SER A O 1 62 UNP O57413 251 S ATOM 499 C CB . SER A 1 62 ? 22.473 9.190 33.064 1.00 19.38 ? 62 SER A CB 1 62 UNP O57413 251 S ATOM 500 O OG . SER A 1 62 ? 21.626 9.092 34.201 1.00 21.77 ? 62 SER A OG 1 62 UNP O57413 251 S ATOM 501 N N . GLU A 1 63 ? 21.859 5.841 32.847 1.00 20.30 ? 63 GLU A N 1 63 UNP O57413 252 E ATOM 502 C CA . GLU A 1 63 ? 22.387 4.543 33.274 1.00 21.67 ? 63 GLU A CA 1 63 UNP O57413 252 E ATOM 503 C C . GLU A 1 63 ? 22.103 3.409 32.287 1.00 20.90 ? 63 GLU A C 1 63 UNP O57413 252 E ATOM 504 O O . GLU A 1 63 ? 23.012 2.682 31.876 1.00 20.86 ? 63 GLU A O 1 63 UNP O57413 252 E ATOM 505 C CB . GLU A 1 63 ? 21.829 4.207 34.662 1.00 23.76 ? 63 GLU A CB 1 63 UNP O57413 252 E ATOM 506 C CG . GLU A 1 63 ? 22.195 5.256 35.710 1.00 29.06 ? 63 GLU A CG 1 63 UNP O57413 252 E ATOM 507 C CD . GLU A 1 63 ? 21.554 5.010 37.068 1.00 31.27 ? 63 GLU A CD 1 63 UNP O57413 252 E ATOM 508 O OE1 . GLU A 1 63 ? 21.808 5.805 37.999 1.00 33.85 ? 63 GLU A OE1 1 63 UNP O57413 252 E ATOM 509 O OE2 . GLU A 1 63 ? 20.789 4.029 37.210 1.00 33.47 ? 63 GLU A OE2 1 63 UNP O57413 252 E ATOM 510 N N . LYS A 1 64 ? 20.849 3.290 31.877 1.00 19.82 ? 64 LYS A N 1 64 UNP O57413 253 K ATOM 511 C CA . LYS A 1 64 ? 20.435 2.248 30.946 1.00 19.73 ? 64 LYS A CA 1 64 UNP O57413 253 K ATOM 512 C C . LYS A 1 64 ? 19.077 2.612 30.357 1.00 18.19 ? 64 LYS A C 1 64 UNP O57413 253 K ATOM 513 O O . LYS A 1 64 ? 18.364 3.473 30.880 1.00 18.36 ? 64 LYS A O 1 64 UNP O57413 253 K ATOM 514 C CB . LYS A 1 64 ? 20.296 0.912 31.696 1.00 21.59 ? 64 LYS A CB 1 64 UNP O57413 253 K ATOM 515 C CG . LYS A 1 64 ? 19.095 0.893 32.647 1.00 24.01 ? 64 LYS A CG 1 64 UNP O57413 253 K ATOM 516 C CD . LYS A 1 64 ? 19.053 -0.385 33.483 1.00 26.72 ? 64 LYS A CD 1 64 UNP O57413 253 K ATOM 517 C CE . LYS A 1 64 ? 17.645 -0.738 33.891 1.00 28.54 ? 64 LYS A CE 1 64 UNP O57413 253 K ATOM 518 N NZ . LYS A 1 64 ? 17.629 -2.015 34.672 1.00 30.21 ? 64 LYS A NZ 1 64 UNP O57413 253 K ATOM 519 N N . ASP A 1 65 ? 18.727 1.954 29.260 1.00 16.87 ? 65 ASP A N 1 65 UNP O57413 254 D ATOM 520 C CA . ASP A 1 65 ? 17.436 2.149 28.630 1.00 17.02 ? 65 ASP A CA 1 65 UNP O57413 254 D ATOM 521 C C . ASP A 1 65 ? 16.372 1.423 29.439 1.00 16.66 ? 65 ASP A C 1 65 UNP O57413 254 D ATOM 522 O O . ASP A 1 65 ? 16.572 0.284 29.875 1.00 18.26 ? 65 ASP A O 1 65 UNP O57413 254 D ATOM 523 C CB . ASP A 1 65 ? 17.445 1.594 27.204 1.00 15.93 ? 65 ASP A CB 1 65 UNP O57413 254 D ATOM 524 C CG . ASP A 1 65 ? 18.174 2.498 26.241 1.00 17.44 ? 65 ASP A CG 1 65 UNP O57413 254 D ATOM 525 O OD1 . ASP A 1 65 ? 18.591 2.012 25.178 1.00 16.18 ? 65 ASP A OD1 1 65 UNP O57413 254 D ATOM 526 O OD2 . ASP A 1 65 ? 18.319 3.704 26.538 1.00 16.11 ? 65 ASP A OD2 1 65 UNP O57413 254 D ATOM 527 N N . PHE A 1 66 ? 15.243 2.078 29.636 1.00 16.19 ? 66 PHE A N 1 66 UNP O57413 255 F ATOM 528 C CA . PHE A 1 66 ? 14.148 1.501 30.398 1.00 16.55 ? 66 PHE A CA 1 66 UNP O57413 255 F ATOM 529 C C . PHE A 1 66 ? 13.154 0.744 29.548 1.00 16.39 ? 66 PHE A C 1 66 UNP O57413 255 F ATOM 530 O O . PHE A 1 66 ? 12.206 0.143 30.073 1.00 17.68 ? 66 PHE A O 1 66 UNP O57413 255 F ATOM 531 C CB . PHE A 1 66 ? 13.481 2.594 31.245 1.00 17.89 ? 66 PHE A CB 1 66 UNP O57413 255 F ATOM 532 C CG . PHE A 1 66 ? 14.359 3.070 32.364 1.00 18.82 ? 66 PHE A CG 1 66 UNP O57413 255 F ATOM 533 C CD1 . PHE A 1 66 ? 14.856 4.366 32.384 1.00 19.98 ? 66 PHE A CD1 1 66 UNP O57413 255 F ATOM 534 C CD2 . PHE A 1 66 ? 14.740 2.190 33.370 1.00 21.06 ? 66 PHE A CD2 1 66 UNP O57413 255 F ATOM 535 C CE1 . PHE A 1 66 ? 15.728 4.793 33.390 1.00 21.23 ? 66 PHE A CE1 1 66 UNP O57413 255 F ATOM 536 C CE2 . PHE A 1 66 ? 15.614 2.602 34.391 1.00 21.46 ? 66 PHE A CE2 1 66 UNP O57413 255 F ATOM 537 C CZ . PHE A 1 66 ? 16.108 3.901 34.399 1.00 21.82 ? 66 PHE A CZ 1 66 UNP O57413 255 F ATOM 538 N N . ILE A 1 67 ? 13.344 0.830 28.226 1.00 15.04 ? 67 ILE A N 1 67 UNP O57413 256 I ATOM 539 C CA . ILE A 1 67 ? 12.544 0.061 27.286 1.00 14.98 ? 67 ILE A CA 1 67 UNP O57413 256 I ATOM 540 C C . ILE A 1 67 ? 13.539 -0.429 26.243 1.00 14.65 ? 67 ILE A C 1 67 UNP O57413 256 I ATOM 541 O O . ILE A 1 67 ? 14.655 0.075 26.176 1.00 14.37 ? 67 ILE A O 1 67 UNP O57413 256 I ATOM 542 C CB . ILE A 1 67 ? 11.430 0.885 26.572 1.00 15.07 ? 67 ILE A CB 1 67 UNP O57413 256 I ATOM 543 C CG1 . ILE A 1 67 ? 12.047 1.926 25.641 1.00 14.29 ? 67 ILE A CG1 1 67 UNP O57413 256 I ATOM 544 C CG2 . ILE A 1 67 ? 10.522 1.537 27.585 1.00 16.24 ? 67 ILE A CG2 1 67 UNP O57413 256 I ATOM 545 C CD1 . ILE A 1 67 ? 10.984 2.710 24.893 1.00 15.28 ? 67 ILE A CD1 1 67 UNP O57413 256 I ATOM 546 N N . THR A 1 68 ? 13.130 -1.412 25.442 1.00 15.74 ? 68 THR A N 1 68 UNP O57413 257 T ATOM 547 C CA . THR A 1 68 ? 13.991 -1.901 24.387 1.00 16.38 ? 68 THR A CA 1 68 UNP O57413 257 T ATOM 548 C C . THR A 1 68 ? 13.837 -0.955 23.187 1.00 14.15 ? 68 THR A C 1 68 UNP O57413 257 T ATOM 549 O O . THR A 1 68 ? 12.885 -1.087 22.429 1.00 14.16 ? 68 THR A O 1 68 UNP O57413 257 T ATOM 550 C CB . THR A 1 68 ? 13.571 -3.346 23.984 1.00 18.28 ? 68 THR A CB 1 68 UNP O57413 257 T ATOM 551 O OG1 . THR A 1 68 ? 13.559 -4.163 25.162 1.00 20.89 ? 68 THR A OG1 1 68 UNP O57413 257 T ATOM 552 C CG2 . THR A 1 68 ? 14.535 -3.949 22.969 1.00 20.83 ? 68 THR A CG2 1 68 UNP O57413 257 T ATOM 553 N N . VAL A 1 69 ? 14.783 -0.021 23.010 1.00 13.89 ? 69 VAL A N 1 69 UNP O57413 258 V ATOM 554 C CA . VAL A 1 69 ? 14.727 0.925 21.879 1.00 12.44 ? 69 VAL A CA 1 69 UNP O57413 258 V ATOM 555 C C . VAL A 1 69 ? 15.267 0.210 20.657 1.00 12.81 ? 69 VAL A C 1 69 UNP O57413 258 V ATOM 556 O O . VAL A 1 69 ? 16.461 0.207 20.361 1.00 13.98 ? 69 VAL A O 1 69 UNP O57413 258 V ATOM 557 C CB . VAL A 1 69 ? 15.550 2.196 22.136 1.00 12.02 ? 69 VAL A CB 1 69 UNP O57413 258 V ATOM 558 C CG1 . VAL A 1 69 ? 15.265 3.255 21.028 1.00 11.03 ? 69 VAL A CG1 1 69 UNP O57413 258 V ATOM 559 C CG2 . VAL A 1 69 ? 15.115 2.794 23.530 1.00 12.54 ? 69 VAL A CG2 1 69 UNP O57413 258 V ATOM 560 N N . GLN A 1 70 ? 14.355 -0.347 19.897 1.00 11.31 ? 70 GLN A N 1 70 UNP O57413 259 Q ATOM 561 C CA . GLN A 1 70 ? 14.727 -1.207 18.773 1.00 10.83 ? 70 GLN A CA 1 70 UNP O57413 259 Q ATOM 562 C C . GLN A 1 70 ? 14.558 -0.621 17.399 1.00 11.20 ? 70 GLN A C 1 70 UNP O57413 259 Q ATOM 563 O O . GLN A 1 70 ? 14.032 0.464 17.242 1.00 11.02 ? 70 GLN A O 1 70 UNP O57413 259 Q ATOM 564 C CB . GLN A 1 70 ? 13.926 -2.493 18.896 1.00 11.89 ? 70 GLN A CB 1 70 UNP O57413 259 Q ATOM 565 C CG . GLN A 1 70 ? 12.444 -2.264 18.994 1.00 12.10 ? 70 GLN A CG 1 70 UNP O57413 259 Q ATOM 566 C CD . GLN A 1 70 ? 11.745 -3.537 19.430 1.00 13.08 ? 70 GLN A CD 1 70 UNP O57413 259 Q ATOM 567 O OE1 . GLN A 1 70 ? 11.431 -4.385 18.602 1.00 12.70 ? 70 GLN A OE1 1 70 UNP O57413 259 Q ATOM 568 N NE2 . GLN A 1 70 ? 11.524 -3.683 20.729 1.00 13.62 ? 70 GLN A NE2 1 70 UNP O57413 259 Q ATOM 569 N N . ALA A 1 71 ? 14.914 -1.396 16.378 1.00 11.48 ? 71 ALA A N 1 71 UNP O57413 260 A ATOM 570 C CA . ALA A 1 71 ? 14.873 -0.884 15.012 1.00 12.01 ? 71 ALA A CA 1 71 UNP O57413 260 A ATOM 571 C C . ALA A 1 71 ? 13.496 -0.510 14.488 1.00 11.68 ? 71 ALA A C 1 71 UNP O57413 260 A ATOM 572 O O . ALA A 1 71 ? 13.371 0.450 13.731 1.00 12.24 ? 71 ALA A O 1 71 UNP O57413 260 A ATOM 573 C CB . ALA A 1 71 ? 15.528 -1.877 14.073 1.00 12.40 ? 71 ALA A CB 1 71 UNP O57413 260 A ATOM 574 N N . ASP A 1 72 ? 12.457 -1.253 14.835 1.00 11.59 ? 72 ASP A N 1 72 UNP O57413 261 D ATOM 575 C CA . ASP A 1 72 ? 11.119 -0.885 14.332 1.00 11.50 ? 72 ASP A CA 1 72 UNP O57413 261 D ATOM 576 C C . ASP A 1 72 ? 10.590 0.306 15.143 1.00 10.41 ? 72 ASP A C 1 72 UNP O57413 261 D ATOM 577 O O . ASP A 1 72 ? 10.331 0.180 16.344 1.00 10.24 ? 72 ASP A O 1 72 UNP O57413 261 D ATOM 578 C CB . ASP A 1 72 ? 10.132 -2.071 14.429 1.00 12.07 ? 72 ASP A CB 1 72 UNP O57413 261 D ATOM 579 C CG . ASP A 1 72 ? 8.790 -1.782 13.744 1.00 13.55 ? 72 ASP A CG 1 72 UNP O57413 261 D ATOM 580 O OD1 . ASP A 1 72 ? 8.779 -1.645 12.506 1.00 15.76 ? 72 ASP A OD1 1 72 UNP O57413 261 D ATOM 581 O OD2 . ASP A 1 72 ? 7.750 -1.670 14.437 1.00 15.34 ? 72 ASP A OD2 1 72 UNP O57413 261 D ATOM 582 N N . ALA A 1 73 ? 10.430 1.456 14.481 1.00 9.80 ? 73 ALA A N 1 73 UNP O57413 262 A ATOM 583 C CA . ALA A 1 73 ? 9.990 2.665 15.179 1.00 9.55 ? 73 ALA A CA 1 73 UNP O57413 262 A ATOM 584 C C . ALA A 1 73 ? 8.591 2.506 15.760 1.00 9.81 ? 73 ALA A C 1 73 UNP O57413 262 A ATOM 585 O O . ALA A 1 73 ? 8.356 2.872 16.907 1.00 10.07 ? 73 ALA A O 1 73 UNP O57413 262 A ATOM 586 C CB . ALA A 1 73 ? 10.058 3.880 14.251 1.00 10.29 ? 73 ALA A CB 1 73 UNP O57413 262 A ATOM 587 N N . PRO A 1 74 ? 7.641 1.943 14.998 1.00 10.93 ? 74 PRO A N 1 74 UNP O57413 263 P ATOM 588 C CA . PRO A 1 74 ? 6.313 1.803 15.615 1.00 11.35 ? 74 PRO A CA 1 74 UNP O57413 263 P ATOM 589 C C . PRO A 1 74 ? 6.350 0.922 16.888 1.00 11.16 ? 74 PRO A C 1 74 UNP O57413 263 P ATOM 590 O O . PRO A 1 74 ? 5.667 1.205 17.869 1.00 10.44 ? 74 PRO A O 1 74 UNP O57413 263 P ATOM 591 C CB . PRO A 1 74 ? 5.479 1.171 14.505 1.00 12.44 ? 74 PRO A CB 1 74 UNP O57413 263 P ATOM 592 C CG . PRO A 1 74 ? 6.130 1.735 13.242 1.00 11.95 ? 74 PRO A CG 1 74 UNP O57413 263 P ATOM 593 C CD . PRO A 1 74 ? 7.614 1.664 13.549 1.00 11.67 ? 74 PRO A CD 1 74 UNP O57413 263 P ATOM 594 N N . THR A 1 75 ? 7.131 -0.156 16.861 1.00 10.82 ? 75 THR A N 1 75 UNP O57413 264 T ATOM 595 C CA . THR A 1 75 ? 7.219 -1.017 18.044 1.00 10.72 ? 75 THR A CA 1 75 UNP O57413 264 T ATOM 596 C C . THR A 1 75 ? 7.825 -0.246 19.216 1.00 10.42 ? 75 THR A C 1 75 UNP O57413 264 T ATOM 597 O O . THR A 1 75 ? 7.355 -0.336 20.345 1.00 10.12 ? 75 THR A O 1 75 UNP O57413 264 T ATOM 598 C CB . THR A 1 75 ? 8.043 -2.308 17.766 1.00 11.28 ? 75 THR A CB 1 75 UNP O57413 264 T ATOM 599 O OG1 . THR A 1 75 ? 7.416 -3.014 16.670 1.00 12.69 ? 75 THR A OG1 1 75 UNP O57413 264 T ATOM 600 C CG2 . THR A 1 75 ? 8.071 -3.216 19.010 1.00 11.82 ? 75 THR A CG2 1 75 UNP O57413 264 T ATOM 601 N N . THR A 1 76 ? 8.898 0.490 18.944 1.00 9.15 ? 76 THR A N 1 76 UNP O57413 265 T ATOM 602 C CA . THR A 1 76 ? 9.516 1.315 19.962 1.00 8.57 ? 76 THR A CA 1 76 UNP O57413 265 T ATOM 603 C C . THR A 1 76 ? 8.533 2.344 20.512 1.00 8.74 ? 76 THR A C 1 76 UNP O57413 265 T ATOM 604 O O . THR A 1 76 ? 8.531 2.605 21.726 1.00 8.62 ? 76 THR A O 1 76 UNP O57413 265 T ATOM 605 C CB . THR A 1 76 ? 10.760 1.979 19.382 1.00 9.29 ? 76 THR A CB 1 76 UNP O57413 265 T ATOM 606 O OG1 . THR A 1 76 ? 11.702 0.954 19.054 1.00 10.33 ? 76 THR A OG1 1 76 UNP O57413 265 T ATOM 607 C CG2 . THR A 1 76 ? 11.377 2.913 20.403 1.00 9.07 ? 76 THR A CG2 1 76 UNP O57413 265 T ATOM 608 N N . ALA A 1 77 ? 7.732 2.935 19.635 1.00 8.02 ? 77 ALA A N 1 77 UNP O57413 266 A ATOM 609 C CA . ALA A 1 77 ? 6.737 3.926 20.053 1.00 9.00 ? 77 ALA A CA 1 77 UNP O57413 266 A ATOM 610 C C . ALA A 1 77 ? 5.713 3.327 20.998 1.00 9.45 ? 77 ALA A C 1 77 UNP O57413 266 A ATOM 611 O O . ALA A 1 77 ? 5.335 3.959 21.986 1.00 10.43 ? 77 ALA A O 1 77 UNP O57413 266 A ATOM 612 C CB . ALA A 1 77 ? 6.045 4.519 18.841 1.00 8.50 ? 77 ALA A CB 1 77 UNP O57413 266 A ATOM 613 N N . GLY A 1 78 ? 5.270 2.104 20.719 1.00 10.24 ? 78 GLY A N 1 78 UNP O57413 267 G ATOM 614 C CA . GLY A 1 78 ? 4.305 1.468 21.601 1.00 10.74 ? 78 GLY A CA 1 78 UNP O57413 267 G ATOM 615 C C . GLY A 1 78 ? 4.915 1.186 22.980 1.00 11.07 ? 78 GLY A C 1 78 UNP O57413 267 G ATOM 616 O O . GLY A 1 78 ? 4.260 1.374 24.006 1.00 11.86 ? 78 GLY A O 1 78 UNP O57413 267 G ATOM 617 N N . LEU A 1 79 ? 6.159 0.718 23.006 1.00 10.67 ? 79 LEU A N 1 79 UNP O57413 268 L ATOM 618 C CA . LEU A 1 79 ? 6.820 0.448 24.291 1.00 11.74 ? 79 LEU A CA 1 79 UNP O57413 268 L ATOM 619 C C . LEU A 1 79 ? 7.032 1.754 25.036 1.00 11.63 ? 79 LEU A C 1 79 UNP O57413 268 L ATOM 620 O O . LEU A 1 79 ? 6.918 1.818 26.266 1.00 11.20 ? 79 LEU A O 1 79 UNP O57413 268 L ATOM 621 C CB . LEU A 1 79 ? 8.172 -0.232 24.080 1.00 12.24 ? 79 LEU A CB 1 79 UNP O57413 268 L ATOM 622 C CG . LEU A 1 79 ? 8.025 -1.616 23.448 1.00 14.53 ? 79 LEU A CG 1 79 UNP O57413 268 L ATOM 623 C CD1 . LEU A 1 79 ? 9.422 -2.120 23.137 1.00 13.95 ? 79 LEU A CD1 1 79 UNP O57413 268 L ATOM 624 C CD2 . LEU A 1 79 ? 7.272 -2.601 24.387 1.00 14.67 ? 79 LEU A CD2 1 79 UNP O57413 268 L ATOM 625 N N . PHE A 1 80 ? 7.317 2.804 24.282 1.00 11.23 ? 80 PHE A N 1 80 UNP O57413 269 F ATOM 626 C CA . PHE A 1 80 ? 7.528 4.107 24.909 1.00 10.87 ? 80 PHE A CA 1 80 UNP O57413 269 F ATOM 627 C C . PHE A 1 80 ? 6.227 4.680 25.442 1.00 11.58 ? 80 PHE A C 1 80 UNP O57413 269 F ATOM 628 O O . PHE A 1 80 ? 6.219 5.303 26.534 1.00 11.91 ? 80 PHE A O 1 80 UNP O57413 269 F ATOM 629 C CB . PHE A 1 80 ? 8.208 5.071 23.905 1.00 9.34 ? 80 PHE A CB 1 80 UNP O57413 269 F ATOM 630 C CG . PHE A 1 80 ? 8.484 6.434 24.471 1.00 9.01 ? 80 PHE A CG 1 80 UNP O57413 269 F ATOM 631 C CD1 . PHE A 1 80 ? 9.390 6.588 25.540 1.00 8.94 ? 80 PHE A CD1 1 80 UNP O57413 269 F ATOM 632 C CD2 . PHE A 1 80 ? 7.830 7.556 23.986 1.00 9.80 ? 80 PHE A CD2 1 80 UNP O57413 269 F ATOM 633 C CE1 . PHE A 1 80 ? 9.628 7.852 26.112 1.00 10.21 ? 80 PHE A CE1 1 80 UNP O57413 269 F ATOM 634 C CE2 . PHE A 1 80 ? 8.052 8.834 24.552 1.00 10.51 ? 80 PHE A CE2 1 80 UNP O57413 269 F ATOM 635 C CZ . PHE A 1 80 ? 8.954 8.978 25.620 1.00 9.35 ? 80 PHE A CZ 1 80 UNP O57413 269 F ATOM 636 N N . GLY A 1 81 ? 5.138 4.483 24.712 1.00 11.33 ? 81 GLY A N 1 81 UNP O57413 270 G ATOM 637 C CA . GLY A 1 81 ? 3.862 4.995 25.191 1.00 11.44 ? 81 GLY A CA 1 81 UNP O57413 270 G ATOM 638 C C . GLY A 1 81 ? 3.477 4.285 26.479 1.00 12.76 ? 81 GLY A C 1 81 UNP O57413 270 G ATOM 639 O O . GLY A 1 81 ? 2.929 4.883 27.396 1.00 12.35 ? 81 GLY A O 1 81 UNP O57413 270 G ATOM 640 N N . ASP A 1 82 ? 3.762 2.989 26.550 1.00 13.83 ? 82 ASP A N 1 82 UNP O57413 271 D ATOM 641 C CA . ASP A 1 82 ? 3.435 2.233 27.758 1.00 15.83 ? 82 ASP A CA 1 82 UNP O57413 271 D ATOM 642 C C . ASP A 1 82 ? 4.214 2.763 28.946 1.00 15.36 ? 82 ASP A C 1 82 UNP O57413 271 D ATOM 643 O O . ASP A 1 82 ? 3.648 3.003 30.024 1.00 15.55 ? 82 ASP A O 1 82 UNP O57413 271 D ATOM 644 C CB . ASP A 1 82 ? 3.791 0.756 27.566 1.00 17.14 ? 82 ASP A CB 1 82 UNP O57413 271 D ATOM 645 C CG . ASP A 1 82 ? 2.768 0.004 26.725 1.00 20.22 ? 82 ASP A CG 1 82 UNP O57413 271 D ATOM 646 O OD1 . ASP A 1 82 ? 3.105 -1.122 26.298 1.00 22.31 ? 82 ASP A OD1 1 82 UNP O57413 271 D ATOM 647 O OD2 . ASP A 1 82 ? 1.647 0.509 26.489 1.00 20.52 ? 82 ASP A OD2 1 82 UNP O57413 271 D ATOM 648 N N . TRP A 1 83 ? 5.515 2.924 28.762 1.00 14.89 ? 83 TRP A N 1 83 UNP O57413 272 W ATOM 649 C CA . TRP A 1 83 ? 6.386 3.406 29.833 1.00 15.78 ? 83 TRP A CA 1 83 UNP O57413 272 W ATOM 650 C C . TRP A 1 83 ? 6.002 4.846 30.208 1.00 15.91 ? 83 TRP A C 1 83 UNP O57413 272 W ATOM 651 O O . TRP A 1 83 ? 6.037 5.225 31.384 1.00 15.44 ? 83 TRP A O 1 83 UNP O57413 272 W ATOM 652 C CB . TRP A 1 83 ? 7.856 3.319 29.383 1.00 16.78 ? 83 TRP A CB 1 83 UNP O57413 272 W ATOM 653 C CG . TRP A 1 83 ? 8.821 3.821 30.405 1.00 17.78 ? 83 TRP A CG 1 83 UNP O57413 272 W ATOM 654 C CD1 . TRP A 1 83 ? 9.335 3.136 31.475 1.00 18.35 ? 83 TRP A CD1 1 83 UNP O57413 272 W ATOM 655 C CD2 . TRP A 1 83 ? 9.348 5.139 30.480 1.00 18.09 ? 83 TRP A CD2 1 83 UNP O57413 272 W ATOM 656 N NE1 . TRP A 1 83 ? 10.156 3.962 32.214 1.00 19.02 ? 83 TRP A NE1 1 83 UNP O57413 272 W ATOM 657 C CE2 . TRP A 1 83 ? 10.181 5.198 31.623 1.00 18.27 ? 83 TRP A CE2 1 83 UNP O57413 272 W ATOM 658 C CE3 . TRP A 1 83 ? 9.198 6.287 29.694 1.00 17.91 ? 83 TRP A CE3 1 83 UNP O57413 272 W ATOM 659 C CZ2 . TRP A 1 83 ? 10.853 6.352 31.991 1.00 19.31 ? 83 TRP A CZ2 1 83 UNP O57413 272 W ATOM 660 C CZ3 . TRP A 1 83 ? 9.867 7.436 30.057 1.00 18.92 ? 83 TRP A CZ3 1 83 UNP O57413 272 W ATOM 661 C CH2 . TRP A 1 83 ? 10.690 7.465 31.203 1.00 18.66 ? 83 TRP A CH2 1 83 UNP O57413 272 W ATOM 662 N N . ARG A 1 84 ? 5.634 5.644 29.212 1.00 15.13 ? 84 ARG A N 1 84 UNP O57413 273 R ATOM 663 C CA . ARG A 1 84 ? 5.223 7.025 29.442 1.00 15.11 ? 84 ARG A CA 1 84 UNP O57413 273 R ATOM 664 C C . ARG A 1 84 ? 4.000 7.104 30.352 1.00 15.59 ? 84 ARG A C 1 84 UNP O57413 273 R ATOM 665 O O . ARG A 1 84 ? 3.938 7.915 31.292 1.00 15.51 ? 84 ARG A O 1 84 UNP O57413 273 R ATOM 666 C CB . ARG A 1 84 ? 4.898 7.708 28.123 1.00 15.17 ? 84 ARG A CB 1 84 UNP O57413 273 R ATOM 667 C CG . ARG A 1 84 ? 4.601 9.178 28.289 1.00 15.30 ? 84 ARG A CG 1 84 UNP O57413 273 R ATOM 668 C CD . ARG A 1 84 ? 3.193 9.475 27.955 1.00 14.74 ? 84 ARG A CD 1 84 UNP O57413 273 R ATOM 669 N NE . ARG A 1 84 ? 2.911 10.885 28.128 1.00 13.74 ? 84 ARG A NE 1 84 UNP O57413 273 R ATOM 670 C CZ . ARG A 1 84 ? 1.769 11.448 27.781 1.00 14.09 ? 84 ARG A CZ 1 84 UNP O57413 273 R ATOM 671 N NH1 . ARG A 1 84 ? 0.825 10.709 27.237 1.00 13.22 ? 84 ARG A NH1 1 84 UNP O57413 273 R ATOM 672 N NH2 . ARG A 1 84 ? 1.566 12.740 28.010 1.00 11.24 ? 84 ARG A NH2 1 84 UNP O57413 273 R ATOM 673 N N . GLU A 1 85 ? 3.022 6.260 30.064 1.00 14.63 ? 85 GLU A N 1 85 UNP O57413 274 E ATOM 674 C CA . GLU A 1 85 ? 1.801 6.214 30.845 1.00 15.79 ? 85 GLU A CA 1 85 UNP O57413 274 E ATOM 675 C C . GLU A 1 85 ? 2.061 5.680 32.257 1.00 16.11 ? 85 GLU A C 1 85 UNP O57413 274 E ATOM 676 O O . GLU A 1 85 ? 1.598 6.259 33.245 1.00 16.60 ? 85 GLU A O 1 85 UNP O57413 274 E ATOM 677 C CB . GLU A 1 85 ? 0.781 5.293 30.148 1.00 15.98 ? 85 GLU A CB 1 85 UNP O57413 274 E ATOM 678 C CG . GLU A 1 85 ? -0.507 5.122 30.975 1.00 18.01 ? 85 GLU A CG 1 85 UNP O57413 274 E ATOM 679 C CD . GLU A 1 85 ? -1.580 4.318 30.278 1.00 19.83 ? 85 GLU A CD 1 85 UNP O57413 274 E ATOM 680 O OE1 . GLU A 1 85 ? -1.338 3.792 29.170 1.00 21.46 ? 85 GLU A OE1 1 85 UNP O57413 274 E ATOM 681 O OE2 . GLU A 1 85 ? -2.680 4.229 30.870 1.00 20.84 ? 85 GLU A OE2 1 85 UNP O57413 274 E ATOM 682 N N . ARG A 1 86 ? 2.825 4.599 32.348 1.00 16.38 ? 86 ARG A N 1 86 UNP O57413 275 R ATOM 683 C CA . ARG A 1 86 ? 3.066 3.955 33.634 1.00 18.20 ? 86 ARG A CA 1 86 UNP O57413 275 R ATOM 684 C C . ARG A 1 86 ? 4.109 4.590 34.520 1.00 17.52 ? 86 ARG A C 1 86 UNP O57413 275 R ATOM 685 O O . ARG A 1 86 ? 4.025 4.493 35.747 1.00 18.20 ? 86 ARG A O 1 86 UNP O57413 275 R ATOM 686 C CB . ARG A 1 86 ? 3.423 2.484 33.405 1.00 19.94 ? 86 ARG A CB 1 86 UNP O57413 275 R ATOM 687 C CG . ARG A 1 86 ? 2.309 1.746 32.697 1.00 24.16 ? 86 ARG A CG 1 86 UNP O57413 275 R ATOM 688 C CD . ARG A 1 86 ? 2.780 0.523 31.943 1.00 26.80 ? 86 ARG A CD 1 86 UNP O57413 275 R ATOM 689 N NE . ARG A 1 86 ? 1.798 0.145 30.923 1.00 29.69 ? 86 ARG A NE 1 86 UNP O57413 275 R ATOM 690 C CZ . ARG A 1 86 ? 1.877 -0.952 30.173 1.00 31.06 ? 86 ARG A CZ 1 86 UNP O57413 275 R ATOM 691 N NH1 . ARG A 1 86 ? 2.886 -1.791 30.326 1.00 32.50 ? 86 ARG A NH1 1 86 UNP O57413 275 R ATOM 692 N NH2 . ARG A 1 86 ? 0.956 -1.193 29.253 1.00 32.12 ? 86 ARG A NH2 1 86 UNP O57413 275 R ATOM 693 N N . VAL A 1 87 ? 5.080 5.255 33.920 1.00 16.91 ? 87 VAL A N 1 87 UNP O57413 276 V ATOM 694 C CA . VAL A 1 87 ? 6.147 5.847 34.704 1.00 16.42 ? 87 VAL A CA 1 87 UNP O57413 276 V ATOM 695 C C . VAL A 1 87 ? 6.299 7.357 34.549 1.00 16.32 ? 87 VAL A C 1 87 UNP O57413 276 V ATOM 696 O O . VAL A 1 87 ? 6.246 8.102 35.521 1.00 15.83 ? 87 VAL A O 1 87 UNP O57413 276 V ATOM 697 C CB . VAL A 1 87 ? 7.507 5.170 34.359 1.00 16.67 ? 87 VAL A CB 1 87 UNP O57413 276 V ATOM 698 C CG1 . VAL A 1 87 ? 8.642 5.865 35.112 1.00 17.20 ? 87 VAL A CG1 1 87 UNP O57413 276 V ATOM 699 C CG2 . VAL A 1 87 ? 7.450 3.678 34.698 1.00 17.24 ? 87 VAL A CG2 1 87 UNP O57413 276 V ATOM 700 N N . LEU A 1 88 ? 6.493 7.829 33.324 1.00 15.45 ? 88 LEU A N 1 88 UNP O57413 277 L ATOM 701 C CA . LEU A 1 88 ? 6.718 9.261 33.127 1.00 16.31 ? 88 LEU A CA 1 88 UNP O57413 277 L ATOM 702 C C . LEU A 1 88 ? 5.590 10.203 33.586 1.00 15.94 ? 88 LEU A C 1 88 UNP O57413 277 L ATOM 703 O O . LEU A 1 88 ? 5.842 11.252 34.214 1.00 15.69 ? 88 LEU A O 1 88 UNP O57413 277 L ATOM 704 C CB . LEU A 1 88 ? 7.077 9.492 31.647 1.00 16.37 ? 88 LEU A CB 1 88 UNP O57413 277 L ATOM 705 C CG . LEU A 1 88 ? 7.805 10.803 31.332 1.00 18.02 ? 88 LEU A CG 1 88 UNP O57413 277 L ATOM 706 C CD1 . LEU A 1 88 ? 9.213 10.794 31.953 1.00 19.61 ? 88 LEU A CD1 1 88 UNP O57413 277 L ATOM 707 C CD2 . LEU A 1 88 ? 7.917 10.935 29.827 1.00 18.69 ? 88 LEU A CD2 1 88 UNP O57413 277 L ATOM 708 N N . LEU A 1 89 ? 4.343 9.844 33.299 1.00 15.54 ? 89 LEU A N 1 89 UNP O57413 278 L ATOM 709 C CA . LEU A 1 89 ? 3.232 10.671 33.702 1.00 16.56 ? 89 LEU A CA 1 89 UNP O57413 278 L ATOM 710 C C . LEU A 1 89 ? 3.094 10.728 35.205 1.00 17.79 ? 89 LEU A C 1 89 UNP O57413 278 L ATOM 711 O O . LEU A 1 89 ? 2.512 11.673 35.724 1.00 18.04 ? 89 LEU A O 1 89 UNP O57413 278 L ATOM 712 C CB . LEU A 1 89 ? 1.920 10.183 33.079 1.00 15.82 ? 89 LEU A CB 1 89 UNP O57413 278 L ATOM 713 C CG . LEU A 1 89 ? 1.625 10.793 31.706 1.00 15.31 ? 89 LEU A CG 1 89 UNP O57413 278 L ATOM 714 C CD1 . LEU A 1 89 ? 0.418 10.103 31.080 1.00 16.11 ? 89 LEU A CD1 1 89 UNP O57413 278 L ATOM 715 C CD2 . LEU A 1 89 ? 1.329 12.298 31.873 1.00 16.15 ? 89 LEU A CD2 1 89 UNP O57413 278 L ATOM 716 N N . LYS A 1 90 ? 3.634 9.729 35.901 1.00 19.14 ? 90 LYS A N 1 90 UNP O57413 279 K ATOM 717 C CA . LYS A 1 90 ? 3.561 9.709 37.355 1.00 20.56 ? 90 LYS A CA 1 90 UNP O57413 279 K ATOM 718 C C . LYS A 1 90 ? 4.584 10.656 37.957 1.00 20.28 ? 90 LYS A C 1 90 UNP O57413 279 K ATOM 719 O O . LYS A 1 90 ? 4.417 11.108 39.101 1.00 21.00 ? 90 LYS A O 1 90 UNP O57413 279 K ATOM 720 C CB . LYS A 1 90 ? 3.796 8.293 37.893 1.00 22.57 ? 90 LYS A CB 1 90 UNP O57413 279 K ATOM 721 C CG . LYS A 1 90 ? 2.789 7.259 37.383 1.00 25.84 ? 90 LYS A CG 1 90 UNP O57413 279 K ATOM 722 C CD . LYS A 1 90 ? 1.352 7.722 37.579 1.00 27.38 ? 90 LYS A CD 1 90 UNP O57413 279 K ATOM 723 C CE . LYS A 1 90 ? 0.316 6.657 37.181 1.00 29.04 ? 90 LYS A CE 1 90 UNP O57413 279 K ATOM 724 N NZ . LYS A 1 90 ? 0.238 6.439 35.702 1.00 30.27 ? 90 LYS A NZ 1 90 UNP O57413 279 K ATOM 725 N N . LYS A 1 91 ? 5.648 10.960 37.216 1.00 19.77 ? 91 LYS A N 1 91 UNP O57413 280 K ATOM 726 C CA . LYS A 1 91 ? 6.677 11.865 37.726 1.00 19.74 ? 91 LYS A CA 1 91 UNP O57413 280 K ATOM 727 C C . LYS A 1 91 ? 6.227 13.321 37.634 1.00 18.99 ? 91 LYS A C 1 91 UNP O57413 280 K ATOM 728 O O . LYS A 1 91 ? 6.439 14.102 38.563 1.00 19.34 ? 91 LYS A O 1 91 UNP O57413 280 K ATOM 729 C CB . LYS A 1 91 ? 7.977 11.667 36.965 1.00 21.04 ? 91 LYS A CB 1 91 UNP O57413 280 K ATOM 730 C CG . LYS A 1 91 ? 8.433 10.199 36.938 1.00 24.21 ? 91 LYS A CG 1 91 UNP O57413 280 K ATOM 731 C CD . LYS A 1 91 ? 9.942 10.070 36.841 1.00 27.33 ? 91 LYS A CD 1 91 UNP O57413 280 K ATOM 732 C CE . LYS A 1 91 ? 10.474 10.657 35.561 1.00 27.47 ? 91 LYS A CE 1 91 UNP O57413 280 K ATOM 733 N NZ . LYS A 1 91 ? 11.943 10.402 35.378 1.00 30.50 ? 91 LYS A NZ 1 91 UNP O57413 280 K ATOM 734 N N . LYS A 1 92 ? 5.608 13.683 36.508 1.00 16.98 ? 92 LYS A N 1 92 UNP O57413 281 K ATOM 735 C CA . LYS A 1 92 ? 5.094 15.031 36.309 1.00 15.27 ? 92 LYS A CA 1 92 UNP O57413 281 K ATOM 736 C C . LYS A 1 92 ? 4.111 14.994 35.158 1.00 15.40 ? 92 LYS A C 1 92 UNP O57413 281 K ATOM 737 O O . LYS A 1 92 ? 4.389 14.384 34.128 1.00 15.56 ? 92 LYS A O 1 92 UNP O57413 281 K ATOM 738 C CB . LYS A 1 92 ? 6.221 15.995 35.966 1.00 14.12 ? 92 LYS A CB 1 92 UNP O57413 281 K ATOM 739 C CG . LYS A 1 92 ? 5.824 17.451 36.069 1.00 14.36 ? 92 LYS A CG 1 92 UNP O57413 281 K ATOM 740 C CD . LYS A 1 92 ? 7.011 18.378 35.772 1.00 13.71 ? 92 LYS A CD 1 92 UNP O57413 281 K ATOM 741 C CE . LYS A 1 92 ? 6.574 19.840 35.852 1.00 14.01 ? 92 LYS A CE 1 92 UNP O57413 281 K ATOM 742 N NZ . LYS A 1 92 ? 7.679 20.804 35.560 1.00 13.36 ? 92 LYS A NZ 1 92 UNP O57413 281 K ATOM 743 N N . ASN A 1 93 ? 2.967 15.631 35.326 1.00 14.83 ? 93 ASN A N 1 93 UNP O57413 282 N ATOM 744 C CA . ASN A 1 93 ? 1.994 15.653 34.244 1.00 15.31 ? 93 ASN A CA 1 93 UNP O57413 282 N ATOM 745 C C . ASN A 1 93 ? 2.504 16.484 33.053 1.00 13.35 ? 93 ASN A C 1 93 UNP O57413 282 N ATOM 746 O O . ASN A 1 93 ? 3.205 17.489 33.224 1.00 13.62 ? 93 ASN A O 1 93 UNP O57413 282 N ATOM 747 C CB . ASN A 1 93 ? 0.658 16.196 34.722 1.00 18.41 ? 93 ASN A CB 1 93 UNP O57413 282 N ATOM 748 C CG . ASN A 1 93 ? -0.416 16.057 33.663 1.00 20.84 ? 93 ASN A CG 1 93 UNP O57413 282 N ATOM 749 O OD1 . ASN A 1 93 ? -0.607 14.980 33.108 1.00 23.38 ? 93 ASN A OD1 1 93 UNP O57413 282 N ATOM 750 N ND2 . ASN A 1 93 ? -1.119 17.139 33.380 1.00 24.20 ? 93 ASN A ND2 1 93 UNP O57413 282 N ATOM 751 N N . HIS A 1 94 ? 2.134 16.048 31.857 1.00 11.93 ? 94 HIS A N 1 94 UNP O57413 283 H ATOM 752 C CA . HIS A 1 94 ? 2.515 16.702 30.622 1.00 10.30 ? 94 HIS A CA 1 94 UNP O57413 283 H ATOM 753 C C . HIS A 1 94 ? 1.576 16.159 29.559 1.00 10.34 ? 94 HIS A C 1 94 UNP O57413 283 H ATOM 754 O O . HIS A 1 94 ? 0.908 15.136 29.777 1.00 9.46 ? 94 HIS A O 1 94 UNP O57413 283 H ATOM 755 C CB . HIS A 1 94 ? 3.987 16.413 30.305 1.00 10.99 ? 94 HIS A CB 1 94 UNP O57413 283 H ATOM 756 C CG . HIS A 1 94 ? 4.296 14.958 30.146 1.00 10.75 ? 94 HIS A CG 1 94 UNP O57413 283 H ATOM 757 N ND1 . HIS A 1 94 ? 4.548 14.126 31.215 1.00 10.38 ? 94 HIS A ND1 1 94 UNP O57413 283 H ATOM 758 C CD2 . HIS A 1 94 ? 4.348 14.182 29.038 1.00 10.75 ? 94 HIS A CD2 1 94 UNP O57413 283 H ATOM 759 C CE1 . HIS A 1 94 ? 4.739 12.895 30.770 1.00 10.51 ? 94 HIS A CE1 1 94 UNP O57413 283 H ATOM 760 N NE2 . HIS A 1 94 ? 4.626 12.903 29.456 1.00 9.83 ? 94 HIS A NE2 1 94 UNP O57413 283 H ATOM 761 N N . ASP A 1 95 ? 1.573 16.796 28.400 1.00 9.02 ? 95 ASP A N 1 95 UNP O57413 284 D ATOM 762 C CA . ASP A 1 95 ? 0.603 16.484 27.353 1.00 9.20 ? 95 ASP A CA 1 95 UNP O57413 284 D ATOM 763 C C . ASP A 1 95 ? 1.073 15.565 26.265 1.00 8.69 ? 95 ASP A C 1 95 UNP O57413 284 D ATOM 764 O O . ASP A 1 95 ? 0.243 14.913 25.659 1.00 9.62 ? 95 ASP A O 1 95 UNP O57413 284 D ATOM 765 C CB . ASP A 1 95 ? 0.182 17.796 26.681 1.00 9.37 ? 95 ASP A CB 1 95 UNP O57413 284 D ATOM 766 C CG . ASP A 1 95 ? -0.363 18.807 27.681 1.00 11.31 ? 95 ASP A CG 1 95 UNP O57413 284 D ATOM 767 O OD1 . ASP A 1 95 ? -0.099 20.018 27.499 1.00 11.62 ? 95 ASP A OD1 1 95 UNP O57413 284 D ATOM 768 O OD2 . ASP A 1 95 ? -1.058 18.381 28.637 1.00 12.26 ? 95 ASP A OD2 1 95 UNP O57413 284 D ATOM 769 N N . HIS A 1 96 ? 2.377 15.546 26.018 1.00 8.10 ? 96 HIS A N 1 96 UNP O57413 285 H ATOM 770 C CA . HIS A 1 96 ? 2.936 14.788 24.905 1.00 7.74 ? 96 HIS A CA 1 96 UNP O57413 285 H ATOM 771 C C . HIS A 1 96 ? 4.369 14.524 25.236 1.00 7.17 ? 96 HIS A C 1 96 UNP O57413 285 H ATOM 772 O O . HIS A 1 96 ? 5.059 15.398 25.796 1.00 8.61 ? 96 HIS A O 1 96 UNP O57413 285 H ATOM 773 C CB . HIS A 1 96 ? 2.886 15.651 23.630 1.00 7.69 ? 96 HIS A CB 1 96 UNP O57413 285 H ATOM 774 C CG . HIS A 1 96 ? 3.342 14.961 22.378 1.00 7.44 ? 96 HIS A CG 1 96 UNP O57413 285 H ATOM 775 N ND1 . HIS A 1 96 ? 4.585 15.139 21.805 1.00 9.10 ? 96 HIS A ND1 1 96 UNP O57413 285 H ATOM 776 C CD2 . HIS A 1 96 ? 2.684 14.091 21.578 1.00 4.83 ? 96 HIS A CD2 1 96 UNP O57413 285 H ATOM 777 C CE1 . HIS A 1 96 ? 4.671 14.407 20.694 1.00 5.12 ? 96 HIS A CE1 1 96 UNP O57413 285 H ATOM 778 N NE2 . HIS A 1 96 ? 3.526 13.767 20.540 1.00 8.68 ? 96 HIS A NE2 1 96 UNP O57413 285 H ATOM 779 N N . ALA A 1 97 ? 4.831 13.331 24.901 1.00 7.26 ? 97 ALA A N 1 97 UNP O57413 286 A ATOM 780 C CA . ALA A 1 97 ? 6.243 12.989 25.174 1.00 7.07 ? 97 ALA A CA 1 97 UNP O57413 286 A ATOM 781 C C . ALA A 1 97 ? 6.934 12.473 23.923 1.00 6.00 ? 97 ALA A C 1 97 UNP O57413 286 A ATOM 782 O O . ALA A 1 97 ? 6.335 11.699 23.161 1.00 8.55 ? 97 ALA A O 1 97 UNP O57413 286 A ATOM 783 C CB . ALA A 1 97 ? 6.364 11.885 26.281 1.00 7.04 ? 97 ALA A CB 1 97 UNP O57413 286 A ATOM 784 N N . GLN A 1 98 ? 8.187 12.863 23.728 1.00 7.07 ? 98 GLN A N 1 98 UNP O57413 287 Q ATOM 785 C CA . GLN A 1 98 ? 8.959 12.354 22.608 1.00 6.83 ? 98 GLN A CA 1 98 UNP O57413 287 Q ATOM 786 C C . GLN A 1 98 ? 10.245 11.709 23.134 1.00 7.27 ? 98 GLN A C 1 98 UNP O57413 287 Q ATOM 787 O O . GLN A 1 98 ? 10.922 12.223 24.061 1.00 7.89 ? 98 GLN A O 1 98 UNP O57413 287 Q ATOM 788 C CB . GLN A 1 98 ? 9.338 13.480 21.605 1.00 8.01 ? 98 GLN A CB 1 98 UNP O57413 287 Q ATOM 789 C CG . GLN A 1 98 ? 8.106 14.201 21.107 1.00 7.34 ? 98 GLN A CG 1 98 UNP O57413 287 Q ATOM 790 C CD . GLN A 1 98 ? 8.303 14.846 19.758 1.00 8.91 ? 98 GLN A CD 1 98 UNP O57413 287 Q ATOM 791 O OE1 . GLN A 1 98 ? 9.434 15.084 19.324 1.00 8.67 ? 98 GLN A OE1 1 98 UNP O57413 287 Q ATOM 792 N NE2 . GLN A 1 98 ? 7.199 15.187 19.118 1.00 8.16 ? 98 GLN A NE2 1 98 UNP O57413 287 Q ATOM 793 N N . LEU A 1 99 ? 10.585 10.570 22.556 1.00 7.57 ? 99 LEU A N 1 99 UNP O57413 288 L ATOM 794 C CA . LEU A 1 99 ? 11.811 9.864 22.877 1.00 8.99 ? 99 LEU A CA 1 99 UNP O57413 288 L ATOM 795 C C . LEU A 1 99 ? 12.820 10.207 21.794 1.00 8.26 ? 99 LEU A C 1 99 UNP O57413 288 L ATOM 796 O O . LEU A 1 99 ? 12.533 10.030 20.599 1.00 8.94 ? 99 LEU A O 1 99 UNP O57413 288 L ATOM 797 C CB . LEU A 1 99 ? 11.587 8.349 22.823 1.00 9.11 ? 99 LEU A CB 1 99 UNP O57413 288 L ATOM 798 C CG . LEU A 1 99 ? 12.842 7.489 23.013 1.00 10.35 ? 99 LEU A CG 1 99 UNP O57413 288 L ATOM 799 C CD1 . LEU A 1 99 ? 13.346 7.598 24.465 1.00 11.19 ? 99 LEU A CD1 1 99 UNP O57413 288 L ATOM 800 C CD2 . LEU A 1 99 ? 12.462 6.024 22.707 1.00 11.95 ? 99 LEU A CD2 1 99 UNP O57413 288 L ATOM 801 N N . LEU A 1 100 ? 13.976 10.717 22.186 1.00 8.12 ? 100 LEU A N 1 100 UNP O57413 289 L ATOM 802 C CA . LEU A 1 100 ? 15.054 11.051 21.269 1.00 8.86 ? 100 LEU A CA 1 100 UNP O57413 289 L ATOM 803 C C . LEU A 1 100 ? 16.087 9.940 21.393 1.00 9.05 ? 100 LEU A C 1 100 UNP O57413 289 L ATOM 804 O O . LEU A 1 100 ? 16.482 9.570 22.504 1.00 9.51 ? 100 LEU A O 1 100 UNP O57413 289 L ATOM 805 C CB . LEU A 1 100 ? 15.675 12.395 21.652 1.00 9.85 ? 100 LEU A CB 1 100 UNP O57413 289 L ATOM 806 C CG . LEU A 1 100 ? 14.908 13.619 21.188 1.00 12.30 ? 100 LEU A CG 1 100 UNP O57413 289 L ATOM 807 C CD1 . LEU A 1 100 ? 15.482 14.887 21.811 1.00 13.72 ? 100 LEU A CD1 1 100 UNP O57413 289 L ATOM 808 C CD2 . LEU A 1 100 ? 15.015 13.696 19.669 1.00 13.03 ? 100 LEU A CD2 1 100 UNP O57413 289 L ATOM 809 N N . THR A 1 101 ? 16.577 9.450 20.260 1.00 8.47 ? 101 THR A N 1 101 UNP O57413 290 T ATOM 810 C CA . THR A 1 101 ? 17.512 8.325 20.269 1.00 9.28 ? 101 THR A CA 1 101 UNP O57413 290 T ATOM 811 C C . THR A 1 101 ? 18.482 8.384 19.118 1.00 9.23 ? 101 THR A C 1 101 UNP O57413 290 T ATOM 812 O O . THR A 1 101 ? 18.228 9.075 18.131 1.00 9.52 ? 101 THR A O 1 101 UNP O57413 290 T ATOM 813 C CB . THR A 1 101 ? 16.671 6.999 20.163 1.00 9.82 ? 101 THR A CB 1 101 UNP O57413 290 T ATOM 814 O OG1 . THR A 1 101 ? 17.553 5.870 20.154 1.00 10.46 ? 101 THR A OG1 1 101 UNP O57413 290 T ATOM 815 C CG2 . THR A 1 101 ? 15.850 6.963 18.848 1.00 11.01 ? 101 THR A CG2 1 101 UNP O57413 290 T ATOM 816 N N . ASP A 1 102 ? 19.587 7.663 19.231 1.00 9.34 ? 102 ASP A N 1 102 UNP O57413 291 D ATOM 817 C CA . ASP A 1 102 ? 20.521 7.578 18.111 1.00 9.64 ? 102 ASP A CA 1 102 UNP O57413 291 D ATOM 818 C C . ASP A 1 102 ? 20.335 6.261 17.341 1.00 8.98 ? 102 ASP A C 1 102 UNP O57413 291 D ATOM 819 O O . ASP A 1 102 ? 21.108 5.957 16.424 1.00 10.15 ? 102 ASP A O 1 102 UNP O57413 291 D ATOM 820 C CB . ASP A 1 102 ? 21.975 7.683 18.596 1.00 12.53 ? 102 ASP A CB 1 102 UNP O57413 291 D ATOM 821 C CG . ASP A 1 102 ? 22.472 6.437 19.333 1.00 15.42 ? 102 ASP A CG 1 102 UNP O57413 291 D ATOM 822 O OD1 . ASP A 1 102 ? 21.694 5.759 20.024 1.00 16.71 ? 102 ASP A OD1 1 102 UNP O57413 291 D ATOM 823 O OD2 . ASP A 1 102 ? 23.698 6.123 19.250 1.00 19.73 ? 102 ASP A OD2 1 102 UNP O57413 291 D ATOM 824 N N . THR A 1 103 ? 19.263 5.536 17.672 1.00 8.41 ? 103 THR A N 1 103 UNP O57413 292 T ATOM 825 C CA . THR A 1 103 ? 18.983 4.235 17.032 1.00 8.56 ? 103 THR A CA 1 103 UNP O57413 292 T ATOM 826 C C . THR A 1 103 ? 18.831 4.379 15.545 1.00 8.78 ? 103 THR A C 1 103 UNP O57413 292 T ATOM 827 O O . THR A 1 103 ? 18.165 5.297 15.059 1.00 8.52 ? 103 THR A O 1 103 UNP O57413 292 T ATOM 828 C CB . THR A 1 103 ? 17.690 3.633 17.611 1.00 9.12 ? 103 THR A CB 1 103 UNP O57413 292 T ATOM 829 O OG1 . THR A 1 103 ? 17.881 3.421 19.004 1.00 9.32 ? 103 THR A OG1 1 103 UNP O57413 292 T ATOM 830 C CG2 . THR A 1 103 ? 17.334 2.293 16.936 1.00 8.80 ? 103 THR A CG2 1 103 UNP O57413 292 T ATOM 831 N N . ASN A 1 104 ? 19.444 3.448 14.814 1.00 9.13 ? 104 ASN A N 1 104 UNP O57413 293 N ATOM 832 C CA . ASN A 1 104 ? 19.301 3.444 13.362 1.00 11.06 ? 104 ASN A CA 1 104 UNP O57413 293 N ATOM 833 C C . ASN A 1 104 ? 18.013 2.677 13.049 1.00 10.89 ? 104 ASN A C 1 104 UNP O57413 293 N ATOM 834 O O . ASN A 1 104 ? 18.020 1.485 12.726 1.00 10.08 ? 104 ASN A O 1 104 UNP O57413 293 N ATOM 835 C CB . ASN A 1 104 ? 20.551 2.775 12.753 1.00 11.24 ? 104 ASN A CB 1 104 UNP O57413 293 N ATOM 836 C CG . ASN A 1 104 ? 20.624 2.915 11.264 1.00 13.05 ? 104 ASN A CG 1 104 UNP O57413 293 N ATOM 837 O OD1 . ASN A 1 104 ? 21.582 2.432 10.620 1.00 16.50 ? 104 ASN A OD1 1 104 UNP O57413 293 N ATOM 838 N ND2 . ASN A 1 104 ? 19.643 3.578 10.692 1.00 12.62 ? 104 ASN A ND2 1 104 UNP O57413 293 N ATOM 839 N N . PHE A 1 105 ? 16.891 3.388 13.130 1.00 9.19 ? 105 PHE A N 1 105 UNP O57413 294 F ATOM 840 C CA . PHE A 1 105 ? 15.593 2.792 12.876 1.00 9.81 ? 105 PHE A CA 1 105 UNP O57413 294 F ATOM 841 C C . PHE A 1 105 ? 15.532 2.215 11.477 1.00 10.39 ? 105 PHE A C 1 105 UNP O57413 294 F ATOM 842 O O . PHE A 1 105 ? 16.103 2.750 10.526 1.00 10.09 ? 105 PHE A O 1 105 UNP O57413 294 F ATOM 843 C CB . PHE A 1 105 ? 14.467 3.818 13.005 1.00 10.15 ? 105 PHE A CB 1 105 UNP O57413 294 F ATOM 844 C CG . PHE A 1 105 ? 14.191 4.277 14.423 1.00 10.27 ? 105 PHE A CG 1 105 UNP O57413 294 F ATOM 845 C CD1 . PHE A 1 105 ? 14.041 5.641 14.682 1.00 11.14 ? 105 PHE A CD1 1 105 UNP O57413 294 F ATOM 846 C CD2 . PHE A 1 105 ? 13.948 3.368 15.443 1.00 10.97 ? 105 PHE A CD2 1 105 UNP O57413 294 F ATOM 847 C CE1 . PHE A 1 105 ? 13.629 6.087 15.946 1.00 9.95 ? 105 PHE A CE1 1 105 UNP O57413 294 F ATOM 848 C CE2 . PHE A 1 105 ? 13.537 3.814 16.708 1.00 9.90 ? 105 PHE A CE2 1 105 UNP O57413 294 F ATOM 849 C CZ . PHE A 1 105 ? 13.380 5.162 16.936 1.00 10.72 ? 105 PHE A CZ 1 105 UNP O57413 294 F ATOM 850 N N . ALA A 1 106 ? 14.778 1.132 11.394 1.00 10.66 ? 106 ALA A N 1 106 UNP O57413 295 A ATOM 851 C CA . ALA A 1 106 ? 14.560 0.404 10.159 1.00 11.26 ? 106 ALA A CA 1 106 UNP O57413 295 A ATOM 852 C C . ALA A 1 106 ? 13.858 1.299 9.131 1.00 12.68 ? 106 ALA A C 1 106 UNP O57413 295 A ATOM 853 O O . ALA A 1 106 ? 13.157 2.269 9.471 1.00 11.20 ? 106 ALA A O 1 106 UNP O57413 295 A ATOM 854 C CB . ALA A 1 106 ? 13.703 -0.782 10.443 1.00 11.55 ? 106 ALA A CB 1 106 UNP O57413 295 A ATOM 855 N N . ARG A 1 107 ? 14.048 0.929 7.881 1.00 13.13 ? 107 ARG A N 1 107 UNP O57413 296 R ATOM 856 C CA . ARG A 1 107 ? 13.426 1.600 6.746 1.00 14.26 ? 107 ARG A CA 1 107 UNP O57413 296 R ATOM 857 C C . ARG A 1 107 ? 13.813 3.047 6.603 1.00 14.14 ? 107 ARG A C 1 107 UNP O57413 296 R ATOM 858 O O . ARG A 1 107 ? 13.060 3.842 6.048 1.00 14.90 ? 107 ARG A O 1 107 UNP O57413 296 R ATOM 859 C CB . ARG A 1 107 ? 11.919 1.409 6.855 1.00 16.87 ? 107 ARG A CB 1 107 UNP O57413 296 R ATOM 860 C CG . ARG A 1 107 ? 11.563 -0.070 7.005 1.00 22.38 ? 107 ARG A CG 1 107 UNP O57413 296 R ATOM 861 C CD . ARG A 1 107 ? 10.309 -0.451 6.254 1.00 26.87 ? 107 ARG A CD 1 107 UNP O57413 296 R ATOM 862 N NE . ARG A 1 107 ? 9.210 0.482 6.454 1.00 30.88 ? 107 ARG A NE 1 107 UNP O57413 296 R ATOM 863 C CZ . ARG A 1 107 ? 8.011 0.354 5.890 1.00 32.18 ? 107 ARG A CZ 1 107 UNP O57413 296 R ATOM 864 N NH1 . ARG A 1 107 ? 7.761 -0.671 5.087 1.00 34.06 ? 107 ARG A NH1 1 107 UNP O57413 296 R ATOM 865 N NH2 . ARG A 1 107 ? 7.057 1.242 6.133 1.00 32.91 ? 107 ARG A NH2 1 107 UNP O57413 296 R ATOM 866 N N . ASN A 1 108 ? 15.012 3.373 7.073 1.00 12.87 ? 108 ASN A N 1 108 UNP O57413 297 N ATOM 867 C CA . ASN A 1 108 ? 15.569 4.703 7.007 1.00 13.58 ? 108 ASN A CA 1 108 UNP O57413 297 N ATOM 868 C C . ASN A 1 108 ? 14.642 5.680 7.682 1.00 12.49 ? 108 ASN A C 1 108 UNP O57413 297 N ATOM 869 O O . ASN A 1 108 ? 14.506 6.822 7.252 1.00 13.02 ? 108 ASN A O 1 108 UNP O57413 297 N ATOM 870 C CB . ASN A 1 108 ? 15.788 5.101 5.551 1.00 15.59 ? 108 ASN A CB 1 108 UNP O57413 297 N ATOM 871 C CG . ASN A 1 108 ? 16.934 6.025 5.395 1.00 18.35 ? 108 ASN A CG 1 108 UNP O57413 297 N ATOM 872 O OD1 . ASN A 1 108 ? 17.875 6.001 6.194 1.00 19.81 ? 108 ASN A OD1 1 108 UNP O57413 297 N ATOM 873 N ND2 . ASN A 1 108 ? 16.905 6.833 4.337 1.00 20.04 ? 108 ASN A ND2 1 108 UNP O57413 297 N ATOM 874 N N . THR A 1 109 ? 14.033 5.229 8.769 1.00 10.30 ? 109 THR A N 1 109 UNP O57413 298 T ATOM 875 C CA . THR A 1 109 ? 13.078 6.065 9.516 1.00 9.19 ? 109 THR A CA 1 109 UNP O57413 298 T ATOM 876 C C . THR A 1 109 ? 13.773 6.999 10.486 1.00 8.83 ? 109 THR A C 1 109 UNP O57413 298 T ATOM 877 O O . THR A 1 109 ? 14.705 6.588 11.197 1.00 9.19 ? 109 THR A O 1 109 UNP O57413 298 T ATOM 878 C CB . THR A 1 109 ? 12.085 5.175 10.291 1.00 9.29 ? 109 THR A CB 1 109 UNP O57413 298 T ATOM 879 O OG1 . THR A 1 109 ? 11.343 4.397 9.340 1.00 10.43 ? 109 THR A OG1 1 109 UNP O57413 298 T ATOM 880 C CG2 . THR A 1 109 ? 11.116 5.990 11.163 1.00 9.14 ? 109 THR A CG2 1 109 UNP O57413 298 T ATOM 881 N N . ILE A 1 110 ? 13.366 8.275 10.456 1.00 8.13 ? 110 ILE A N 1 110 UNP O57413 299 I ATOM 882 C CA . ILE A 1 110 ? 13.941 9.285 11.329 1.00 7.86 ? 110 ILE A CA 1 110 UNP O57413 299 I ATOM 883 C C . ILE A 1 110 ? 12.936 9.771 12.378 1.00 7.88 ? 110 ILE A C 1 110 UNP O57413 299 I ATOM 884 O O . ILE A 1 110 ? 13.321 10.469 13.290 1.00 8.48 ? 110 ILE A O 1 110 UNP O57413 299 I ATOM 885 C CB . ILE A 1 110 ? 14.493 10.509 10.531 1.00 7.89 ? 110 ILE A CB 1 110 UNP O57413 299 I ATOM 886 C CG1 . ILE A 1 110 ? 13.400 11.156 9.685 1.00 7.73 ? 110 ILE A CG1 1 110 UNP O57413 299 I ATOM 887 C CG2 . ILE A 1 110 ? 15.693 10.052 9.634 1.00 9.29 ? 110 ILE A CG2 1 110 UNP O57413 299 I ATOM 888 C CD1 . ILE A 1 110 ? 13.898 12.497 9.035 1.00 10.63 ? 110 ILE A CD1 1 110 UNP O57413 299 I ATOM 889 N N . GLY A 1 111 ? 11.669 9.376 12.249 1.00 6.41 ? 111 GLY A N 1 111 UNP O57413 300 G ATOM 890 C CA . GLY A 1 111 ? 10.647 9.780 13.214 1.00 7.38 ? 111 GLY A CA 1 111 UNP O57413 300 G ATOM 891 C C . GLY A 1 111 ? 9.352 9.039 12.994 1.00 7.36 ? 111 GLY A C 1 111 UNP O57413 300 G ATOM 892 O O . GLY A 1 111 ? 9.074 8.620 11.875 1.00 7.79 ? 111 GLY A O 1 111 UNP O57413 300 G ATOM 893 N N . TRP A 1 112 ? 8.525 8.955 14.024 1.00 7.40 ? 112 TRP A N 1 112 UNP O57413 301 W ATOM 894 C CA . TRP A 1 112 ? 7.259 8.239 13.909 1.00 7.69 ? 112 TRP A CA 1 112 UNP O57413 301 W ATOM 895 C C . TRP A 1 112 ? 6.374 8.654 15.077 1.00 7.71 ? 112 TRP A C 1 112 UNP O57413 301 W ATOM 896 O O . TRP A 1 112 ? 6.861 8.867 16.185 1.00 8.28 ? 112 TRP A O 1 112 UNP O57413 301 W ATOM 897 C CB . TRP A 1 112 ? 7.520 6.713 13.957 1.00 8.11 ? 112 TRP A CB 1 112 UNP O57413 301 W ATOM 898 C CG . TRP A 1 112 ? 6.329 5.900 13.529 1.00 9.73 ? 112 TRP A CG 1 112 UNP O57413 301 W ATOM 899 C CD1 . TRP A 1 112 ? 6.071 5.456 12.260 1.00 11.20 ? 112 TRP A CD1 1 112 UNP O57413 301 W ATOM 900 C CD2 . TRP A 1 112 ? 5.234 5.471 14.338 1.00 9.85 ? 112 TRP A CD2 1 112 UNP O57413 301 W ATOM 901 N NE1 . TRP A 1 112 ? 4.878 4.774 12.238 1.00 11.96 ? 112 TRP A NE1 1 112 UNP O57413 301 W ATOM 902 C CE2 . TRP A 1 112 ? 4.343 4.765 13.497 1.00 11.13 ? 112 TRP A CE2 1 112 UNP O57413 301 W ATOM 903 C CE3 . TRP A 1 112 ? 4.910 5.617 15.695 1.00 8.46 ? 112 TRP A CE3 1 112 UNP O57413 301 W ATOM 904 C CZ2 . TRP A 1 112 ? 3.161 4.204 13.973 1.00 11.50 ? 112 TRP A CZ2 1 112 UNP O57413 301 W ATOM 905 C CZ3 . TRP A 1 112 ? 3.725 5.062 16.169 1.00 9.67 ? 112 TRP A CZ3 1 112 UNP O57413 301 W ATOM 906 C CH2 . TRP A 1 112 ? 2.868 4.358 15.307 1.00 10.28 ? 112 TRP A CH2 1 112 UNP O57413 301 W ATOM 907 N N . ALA A 1 113 ? 5.066 8.767 14.837 1.00 7.79 ? 113 ALA A N 1 113 UNP O57413 302 A ATOM 908 C CA . ALA A 1 113 ? 4.135 9.107 15.910 1.00 7.92 ? 113 ALA A CA 1 113 UNP O57413 302 A ATOM 909 C C . ALA A 1 113 ? 2.745 8.598 15.548 1.00 8.68 ? 113 ALA A C 1 113 UNP O57413 302 A ATOM 910 O O . ALA A 1 113 ? 2.473 8.265 14.407 1.00 9.54 ? 113 ALA A O 1 113 UNP O57413 302 A ATOM 911 C CB . ALA A 1 113 ? 4.076 10.611 16.089 1.00 8.38 ? 113 ALA A CB 1 113 UNP O57413 302 A ATOM 912 N N . TYR A 1 114 ? 1.891 8.509 16.542 1.00 8.60 ? 114 TYR A N 1 114 UNP O57413 303 Y ATOM 913 C CA . TYR A 1 114 ? 0.514 8.114 16.318 1.00 8.81 ? 114 TYR A CA 1 114 UNP O57413 303 Y ATOM 914 C C . TYR A 1 114 ? -0.230 9.348 15.768 1.00 9.31 ? 114 TYR A C 1 114 UNP O57413 303 Y ATOM 915 O O . TYR A 1 114 ? 0.017 10.497 16.200 1.00 9.17 ? 114 TYR A O 1 114 UNP O57413 303 Y ATOM 916 C CB . TYR A 1 114 ? -0.117 7.697 17.640 1.00 9.12 ? 114 TYR A CB 1 114 UNP O57413 303 Y ATOM 917 C CG . TYR A 1 114 ? 0.517 6.477 18.226 1.00 10.31 ? 114 TYR A CG 1 114 UNP O57413 303 Y ATOM 918 C CD1 . TYR A 1 114 ? 0.185 5.206 17.752 1.00 10.25 ? 114 TYR A CD1 1 114 UNP O57413 303 Y ATOM 919 C CD2 . TYR A 1 114 ? 1.484 6.578 19.227 1.00 10.08 ? 114 TYR A CD2 1 114 UNP O57413 303 Y ATOM 920 C CE1 . TYR A 1 114 ? 0.800 4.060 18.271 1.00 10.53 ? 114 TYR A CE1 1 114 UNP O57413 303 Y ATOM 921 C CE2 . TYR A 1 114 ? 2.126 5.439 19.736 1.00 10.03 ? 114 TYR A CE2 1 114 UNP O57413 303 Y ATOM 922 C CZ . TYR A 1 114 ? 1.767 4.181 19.251 1.00 10.84 ? 114 TYR A CZ 1 114 UNP O57413 303 Y ATOM 923 O OH . TYR A 1 114 ? 2.419 3.100 19.763 1.00 12.86 ? 114 TYR A OH 1 114 UNP O57413 303 Y ATOM 924 N N . VAL A 1 115 ? -1.160 9.133 14.854 1.00 9.03 ? 115 VAL A N 1 115 UNP O57413 304 V ATOM 925 C CA . VAL A 1 115 ? -1.911 10.242 14.299 1.00 10.41 ? 115 VAL A CA 1 115 UNP O57413 304 V ATOM 926 C C . VAL A 1 115 ? -3.138 10.658 15.131 1.00 10.07 ? 115 VAL A C 1 115 UNP O57413 304 V ATOM 927 O O . VAL A 1 115 ? -4.016 9.826 15.478 1.00 11.68 ? 115 VAL A O 1 115 UNP O57413 304 V ATOM 928 C CB . VAL A 1 115 ? -2.377 9.921 12.837 1.00 11.18 ? 115 VAL A CB 1 115 UNP O57413 304 V ATOM 929 C CG1 . VAL A 1 115 ? -3.234 11.067 12.274 1.00 12.59 ? 115 VAL A CG1 1 115 UNP O57413 304 V ATOM 930 C CG2 . VAL A 1 115 ? -1.167 9.703 11.954 1.00 12.52 ? 115 VAL A CG2 1 115 UNP O57413 304 V ATOM 931 N N . GLY A 1 116 ? -3.178 11.943 15.468 1.00 10.21 ? 116 GLY A N 1 116 UNP O57413 305 G ATOM 932 C CA . GLY A 1 116 ? -4.334 12.530 16.135 1.00 10.80 ? 116 GLY A CA 1 116 UNP O57413 305 G ATOM 933 C C . GLY A 1 116 ? -4.646 12.113 17.541 1.00 11.21 ? 116 GLY A C 1 116 UNP O57413 305 G ATOM 934 O O . GLY A 1 116 ? -5.790 12.239 17.981 1.00 13.24 ? 116 GLY A O 1 116 UNP O57413 305 G ATOM 935 N N . ARG A 1 117 ? -3.637 11.651 18.251 1.00 10.64 ? 117 ARG A N 1 117 UNP O57413 306 R ATOM 936 C CA . ARG A 1 117 ? -3.832 11.202 19.607 1.00 10.89 ? 117 ARG A CA 1 117 UNP O57413 306 R ATOM 937 C C . ARG A 1 117 ? -3.272 12.119 20.691 1.00 9.35 ? 117 ARG A C 1 117 UNP O57413 306 R ATOM 938 O O . ARG A 1 117 ? -3.030 11.688 21.801 1.00 9.98 ? 117 ARG A O 1 117 UNP O57413 306 R ATOM 939 C CB . ARG A 1 117 ? -3.257 9.800 19.752 1.00 12.83 ? 117 ARG A CB 1 117 UNP O57413 306 R ATOM 940 C CG . ARG A 1 117 ? -4.011 8.741 18.954 1.00 16.44 ? 117 ARG A CG 1 117 UNP O57413 306 R ATOM 941 C CD . ARG A 1 117 ? -5.427 8.501 19.504 1.00 21.64 ? 117 ARG A CD 1 117 UNP O57413 306 R ATOM 942 N NE . ARG A 1 117 ? -5.872 7.156 19.147 1.00 26.87 ? 117 ARG A NE 1 117 UNP O57413 306 R ATOM 943 C CZ . ARG A 1 117 ? -6.220 6.224 20.026 1.00 26.98 ? 117 ARG A CZ 1 117 UNP O57413 306 R ATOM 944 N NH1 . ARG A 1 117 ? -6.186 6.476 21.327 1.00 28.85 ? 117 ARG A NH1 1 117 UNP O57413 306 R ATOM 945 N NH2 . ARG A 1 117 ? -6.595 5.025 19.599 1.00 30.14 ? 117 ARG A NH2 1 117 UNP O57413 306 R ATOM 946 N N . MET A 1 118 ? -3.067 13.381 20.370 1.00 9.68 ? 118 MET A N 1 118 UNP O57413 307 M ATOM 947 C CA . MET A 1 118 ? -2.622 14.351 21.366 1.00 9.63 ? 118 MET A CA 1 118 UNP O57413 307 M ATOM 948 C C . MET A 1 118 ? -3.489 14.254 22.627 1.00 9.97 ? 118 MET A C 1 118 UNP O57413 307 M ATOM 949 O O . MET A 1 118 ? -4.744 14.159 22.556 1.00 10.81 ? 118 MET A O 1 118 UNP O57413 307 M ATOM 950 C CB . MET A 1 118 ? -2.713 15.763 20.760 1.00 9.73 ? 118 MET A CB 1 118 UNP O57413 307 M ATOM 951 C CG . MET A 1 118 ? -2.422 16.921 21.728 1.00 10.22 ? 118 MET A CG 1 118 UNP O57413 307 M ATOM 952 S SD . MET A 1 118 ? -0.785 16.849 22.489 1.00 9.94 ? 118 MET A SD 1 118 UNP O57413 307 M ATOM 953 C CE . MET A 1 118 ? 0.244 16.806 20.993 1.00 9.77 ? 118 MET A CE 1 118 UNP O57413 307 M ATOM 954 N N . CYS A 1 119 ? -2.789 14.245 23.758 1.00 9.28 ? 119 CYS A N 1 119 UNP O57413 308 C ATOM 955 C CA . CYS A 1 119 ? -3.343 14.151 25.117 1.00 10.87 ? 119 CYS A CA 1 119 UNP O57413 308 C ATOM 956 C C . CYS A 1 119 ? -3.598 12.734 25.609 1.00 11.23 ? 119 CYS A C 1 119 UNP O57413 308 C ATOM 957 O O . CYS A 1 119 ? -3.699 12.530 26.831 1.00 12.66 ? 119 CYS A O 1 119 UNP O57413 308 C ATOM 958 C CB . CYS A 1 119 ? -4.639 14.958 25.269 1.00 11.92 ? 119 CYS A CB 1 119 UNP O57413 308 C ATOM 959 S SG . CYS A 1 119 ? -4.417 16.750 25.088 1.00 14.36 ? 119 CYS A SG 1 119 UNP O57413 308 C ATOM 960 N N . ASP A 1 120 ? -3.683 11.768 24.699 1.00 12.31 ? 120 ASP A N 1 120 UNP O57413 309 D ATOM 961 C CA . ASP A 1 120 ? -3.908 10.396 25.142 1.00 12.57 ? 120 ASP A CA 1 120 UNP O57413 309 D ATOM 962 C C . ASP A 1 120 ? -2.776 9.913 26.049 1.00 12.46 ? 120 ASP A C 1 120 UNP O57413 309 D ATOM 963 O O . ASP A 1 120 ? -1.602 10.136 25.761 1.00 12.18 ? 120 ASP A O 1 120 UNP O57413 309 D ATOM 964 C CB . ASP A 1 120 ? -4.036 9.459 23.960 1.00 14.30 ? 120 ASP A CB 1 120 UNP O57413 309 D ATOM 965 C CG . ASP A 1 120 ? -4.509 8.071 24.385 1.00 16.07 ? 120 ASP A CG 1 120 UNP O57413 309 D ATOM 966 O OD1 . ASP A 1 120 ? -3.683 7.215 24.749 1.00 15.81 ? 120 ASP A OD1 1 120 UNP O57413 309 D ATOM 967 O OD2 . ASP A 1 120 ? -5.743 7.871 24.377 1.00 18.75 ? 120 ASP A OD2 1 120 UNP O57413 309 D ATOM 968 N N . GLU A 1 121 ? -3.113 9.249 27.152 1.00 12.56 ? 121 GLU A N 1 121 UNP O57413 310 E ATOM 969 C CA . GLU A 1 121 ? -2.088 8.815 28.077 1.00 13.61 ? 121 GLU A CA 1 121 UNP O57413 310 E ATOM 970 C C . GLU A 1 121 ? -1.036 7.903 27.469 1.00 13.27 ? 121 GLU A C 1 121 UNP O57413 310 E ATOM 971 O O . GLU A 1 121 ? 0.125 7.982 27.828 1.00 13.81 ? 121 GLU A O 1 121 UNP O57413 310 E ATOM 972 C CB . GLU A 1 121 ? -2.726 8.156 29.322 1.00 16.61 ? 121 GLU A CB 1 121 UNP O57413 310 E ATOM 973 C CG . GLU A 1 121 ? -3.543 9.118 30.161 1.00 21.53 ? 121 GLU A CG 1 121 UNP O57413 310 E ATOM 974 C CD . GLU A 1 121 ? -3.942 8.536 31.510 1.00 24.64 ? 121 GLU A CD 1 121 UNP O57413 310 E ATOM 975 O OE1 . GLU A 1 121 ? -4.407 7.374 31.550 1.00 26.42 ? 121 GLU A OE1 1 121 UNP O57413 310 E ATOM 976 O OE2 . GLU A 1 121 ? -3.801 9.250 32.517 1.00 26.47 ? 121 GLU A OE2 1 121 UNP O57413 310 E ATOM 977 N N . LYS A 1 122 ? -1.432 7.058 26.534 1.00 12.02 ? 122 LYS A N 1 122 UNP O57413 311 K ATOM 978 C CA . LYS A 1 122 ? -0.487 6.152 25.913 1.00 13.04 ? 122 LYS A CA 1 122 UNP O57413 311 K ATOM 979 C C . LYS A 1 122 ? -0.051 6.587 24.523 1.00 12.08 ? 122 LYS A C 1 122 UNP O57413 311 K ATOM 980 O O . LYS A 1 122 ? 1.106 6.377 24.153 1.00 13.37 ? 122 LYS A O 1 122 UNP O57413 311 K ATOM 981 C CB . LYS A 1 122 ? -1.093 4.757 25.776 1.00 15.32 ? 122 LYS A CB 1 122 UNP O57413 311 K ATOM 982 C CG . LYS A 1 122 ? -0.243 3.798 24.911 1.00 17.64 ? 122 LYS A CG 1 122 UNP O57413 311 K ATOM 983 C CD . LYS A 1 122 ? -0.807 2.379 24.971 1.00 21.25 ? 122 LYS A CD 1 122 UNP O57413 311 K ATOM 984 C CE . LYS A 1 122 ? -0.278 1.476 23.847 1.00 22.03 ? 122 LYS A CE 1 122 UNP O57413 311 K ATOM 985 N NZ . LYS A 1 122 ? 1.196 1.262 23.853 1.00 22.50 ? 122 LYS A NZ 1 122 UNP O57413 311 K ATOM 986 N N . TYR A 1 123 ? -0.952 7.218 23.773 1.00 11.26 ? 123 TYR A N 1 123 UNP O57413 312 Y ATOM 987 C CA . TYR A 1 123 ? -0.648 7.537 22.381 1.00 10.40 ? 123 TYR A CA 1 123 UNP O57413 312 Y ATOM 988 C C . TYR A 1 123 ? -0.197 8.949 22.063 1.00 8.51 ? 123 TYR A C 1 123 UNP O57413 312 Y ATOM 989 O O . TYR A 1 123 ? 0.038 9.270 20.896 1.00 8.78 ? 123 TYR A O 1 123 UNP O57413 312 Y ATOM 990 C CB . TYR A 1 123 ? -1.851 7.153 21.514 1.00 11.89 ? 123 TYR A CB 1 123 UNP O57413 312 Y ATOM 991 C CG . TYR A 1 123 ? -2.111 5.668 21.574 1.00 14.08 ? 123 TYR A CG 1 123 UNP O57413 312 Y ATOM 992 C CD1 . TYR A 1 123 ? -3.253 5.173 22.192 1.00 15.41 ? 123 TYR A CD1 1 123 UNP O57413 312 Y ATOM 993 C CD2 . TYR A 1 123 ? -1.208 4.772 21.029 1.00 14.50 ? 123 TYR A CD2 1 123 UNP O57413 312 Y ATOM 994 C CE1 . TYR A 1 123 ? -3.487 3.786 22.261 1.00 17.52 ? 123 TYR A CE1 1 123 UNP O57413 312 Y ATOM 995 C CE2 . TYR A 1 123 ? -1.428 3.388 21.094 1.00 16.58 ? 123 TYR A CE2 1 123 UNP O57413 312 Y ATOM 996 C CZ . TYR A 1 123 ? -2.569 2.922 21.710 1.00 17.30 ? 123 TYR A CZ 1 123 UNP O57413 312 Y ATOM 997 O OH . TYR A 1 123 ? -2.821 1.561 21.769 1.00 20.00 ? 123 TYR A OH 1 123 UNP O57413 312 Y ATOM 998 N N . SER A 1 124 ? -0.089 9.791 23.082 1.00 8.67 ? 124 SER A N 1 124 UNP O57413 313 S ATOM 999 C CA . SER A 1 124 ? 0.412 11.155 22.819 1.00 8.04 ? 124 SER A CA 1 124 UNP O57413 313 S ATOM 1000 C C . SER A 1 124 ? 1.939 11.096 22.900 1.00 8.09 ? 124 SER A C 1 124 UNP O57413 313 S ATOM 1001 O O . SER A 1 124 ? 2.562 11.675 23.799 1.00 7.34 ? 124 SER A O 1 124 UNP O57413 313 S ATOM 1002 C CB . SER A 1 124 ? -0.117 12.139 23.860 1.00 8.92 ? 124 SER A CB 1 124 UNP O57413 313 S ATOM 1003 O OG . SER A 1 124 ? 0.115 13.474 23.379 1.00 8.66 ? 124 SER A OG 1 124 UNP O57413 313 S ATOM 1004 N N . VAL A 1 125 ? 2.540 10.375 21.950 1.00 7.09 ? 125 VAL A N 1 125 UNP O57413 314 V ATOM 1005 C CA . VAL A 1 125 ? 3.996 10.204 21.946 1.00 7.46 ? 125 VAL A CA 1 125 UNP O57413 314 V ATOM 1006 C C . VAL A 1 125 ? 4.515 10.131 20.514 1.00 7.38 ? 125 VAL A C 1 125 UNP O57413 314 V ATOM 1007 O O . VAL A 1 125 ? 3.764 9.903 19.547 1.00 8.48 ? 125 VAL A O 1 125 UNP O57413 314 V ATOM 1008 C CB . VAL A 1 125 ? 4.481 8.872 22.682 1.00 8.20 ? 125 VAL A CB 1 125 UNP O57413 314 V ATOM 1009 C CG1 . VAL A 1 125 ? 4.078 8.899 24.148 1.00 7.81 ? 125 VAL A CG1 1 125 UNP O57413 314 V ATOM 1010 C CG2 . VAL A 1 125 ? 3.891 7.601 21.993 1.00 8.46 ? 125 VAL A CG2 1 125 UNP O57413 314 V ATOM 1011 N N . ALA A 1 126 ? 5.817 10.344 20.403 1.00 7.75 ? 126 ALA A N 1 126 UNP O57413 315 A ATOM 1012 C CA . ALA A 1 126 ? 6.543 10.226 19.144 1.00 7.39 ? 126 ALA A CA 1 126 UNP O57413 315 A ATOM 1013 C C . ALA A 1 126 ? 7.929 9.717 19.503 1.00 7.40 ? 126 ALA A C 1 126 UNP O57413 315 A ATOM 1014 O O . ALA A 1 126 ? 8.381 9.849 20.648 1.00 8.01 ? 126 ALA A O 1 126 UNP O57413 315 A ATOM 1015 C CB . ALA A 1 126 ? 6.679 11.584 18.436 1.00 8.32 ? 126 ALA A CB 1 126 UNP O57413 315 A ATOM 1016 N N . VAL A 1 127 ? 8.581 9.102 18.513 1.00 7.47 ? 127 VAL A N 1 127 UNP O57413 316 V ATOM 1017 C CA . VAL A 1 127 ? 9.963 8.650 18.650 1.00 7.04 ? 127 VAL A CA 1 127 UNP O57413 316 V ATOM 1018 C C . VAL A 1 127 ? 10.716 9.334 17.508 1.00 7.89 ? 127 VAL A C 1 127 UNP O57413 316 V ATOM 1019 O O . VAL A 1 127 ? 10.252 9.398 16.364 1.00 7.53 ? 127 VAL A O 1 127 UNP O57413 316 V ATOM 1020 C CB . VAL A 1 127 ? 10.140 7.105 18.602 1.00 8.20 ? 127 VAL A CB 1 127 UNP O57413 316 V ATOM 1021 C CG1 . VAL A 1 127 ? 9.314 6.487 19.751 1.00 8.26 ? 127 VAL A CG1 1 127 UNP O57413 316 V ATOM 1022 C CG2 . VAL A 1 127 ? 9.704 6.484 17.269 1.00 9.07 ? 127 VAL A CG2 1 127 UNP O57413 316 V ATOM 1023 N N . VAL A 1 128 ? 11.856 9.905 17.841 1.00 7.18 ? 128 VAL A N 1 128 UNP O57413 317 V ATOM 1024 C CA . VAL A 1 128 ? 12.645 10.683 16.880 1.00 7.34 ? 128 VAL A CA 1 128 UNP O57413 317 V ATOM 1025 C C . VAL A 1 128 ? 14.121 10.363 16.952 1.00 6.82 ? 128 VAL A C 1 128 UNP O57413 317 V ATOM 1026 O O . VAL A 1 128 ? 14.710 10.308 18.028 1.00 7.44 ? 128 VAL A O 1 128 UNP O57413 317 V ATOM 1027 C CB . VAL A 1 128 ? 12.466 12.186 17.175 1.00 6.62 ? 128 VAL A CB 1 128 UNP O57413 317 V ATOM 1028 C CG1 . VAL A 1 128 ? 13.336 13.024 16.257 1.00 7.75 ? 128 VAL A CG1 1 128 UNP O57413 317 V ATOM 1029 C CG2 . VAL A 1 128 ? 10.995 12.566 17.009 1.00 9.33 ? 128 VAL A CG2 1 128 UNP O57413 317 V ATOM 1030 N N . LYS A 1 129 ? 14.710 10.132 15.787 1.00 6.96 ? 129 LYS A N 1 129 UNP O57413 318 K ATOM 1031 C CA . LYS A 1 129 ? 16.134 9.864 15.711 1.00 6.35 ? 129 LYS A CA 1 129 UNP O57413 318 K ATOM 1032 C C . LYS A 1 129 ? 16.900 11.193 15.674 1.00 7.63 ? 129 LYS A C 1 129 UNP O57413 318 K ATOM 1033 O O . LYS A 1 129 ? 16.510 12.120 14.965 1.00 7.64 ? 129 LYS A O 1 129 UNP O57413 318 K ATOM 1034 C CB . LYS A 1 129 ? 16.417 9.050 14.424 1.00 7.97 ? 129 LYS A CB 1 129 UNP O57413 318 K ATOM 1035 C CG . LYS A 1 129 ? 17.887 8.637 14.237 1.00 8.50 ? 129 LYS A CG 1 129 UNP O57413 318 K ATOM 1036 C CD . LYS A 1 129 ? 18.074 7.939 12.881 1.00 9.94 ? 129 LYS A CD 1 129 UNP O57413 318 K ATOM 1037 C CE . LYS A 1 129 ? 19.458 7.321 12.737 1.00 11.51 ? 129 LYS A CE 1 129 UNP O57413 318 K ATOM 1038 N NZ . LYS A 1 129 ? 19.659 6.744 11.369 1.00 12.00 ? 129 LYS A NZ 1 129 UNP O57413 318 K ATOM 1039 N N . ASP A 1 130 ? 17.967 11.298 16.461 1.00 7.96 ? 130 ASP A N 1 130 UNP O57413 319 D ATOM 1040 C CA . ASP A 1 130 ? 18.838 12.489 16.471 1.00 8.87 ? 130 ASP A CA 1 130 UNP O57413 319 D ATOM 1041 C C . ASP A 1 130 ? 19.719 12.273 15.232 1.00 9.23 ? 130 ASP A C 1 130 UNP O57413 319 D ATOM 1042 O O . ASP A 1 130 ? 20.932 11.939 15.318 1.00 10.74 ? 130 ASP A O 1 130 UNP O57413 319 D ATOM 1043 C CB . ASP A 1 130 ? 19.663 12.444 17.754 1.00 10.28 ? 130 ASP A CB 1 130 UNP O57413 319 D ATOM 1044 C CG . ASP A 1 130 ? 20.486 13.671 17.948 1.00 11.10 ? 130 ASP A CG 1 130 UNP O57413 319 D ATOM 1045 O OD1 . ASP A 1 130 ? 21.730 13.531 18.132 1.00 12.35 ? 130 ASP A OD1 1 130 UNP O57413 319 D ATOM 1046 O OD2 . ASP A 1 130 ? 19.922 14.776 17.902 1.00 11.37 ? 130 ASP A OD2 1 130 UNP O57413 319 D ATOM 1047 N N . HIS A 1 131 ? 19.107 12.526 14.070 1.00 8.84 ? 131 HIS A N 1 131 UNP O57413 320 H ATOM 1048 C CA . HIS A 1 131 ? 19.681 12.177 12.769 1.00 9.50 ? 131 HIS A CA 1 131 UNP O57413 320 H ATOM 1049 C C . HIS A 1 131 ? 20.497 13.206 12.025 1.00 10.37 ? 131 HIS A C 1 131 UNP O57413 320 H ATOM 1050 O O . HIS A 1 131 ? 20.818 13.016 10.841 1.00 11.37 ? 131 HIS A O 1 131 UNP O57413 320 H ATOM 1051 C CB . HIS A 1 131 ? 18.525 11.649 11.880 1.00 8.82 ? 131 HIS A CB 1 131 UNP O57413 320 H ATOM 1052 C CG . HIS A 1 131 ? 17.571 12.716 11.447 1.00 8.55 ? 131 HIS A CG 1 131 UNP O57413 320 H ATOM 1053 N ND1 . HIS A 1 131 ? 17.804 13.509 10.333 1.00 8.51 ? 131 HIS A ND1 1 131 UNP O57413 320 H ATOM 1054 C CD2 . HIS A 1 131 ? 16.439 13.183 12.021 1.00 10.26 ? 131 HIS A CD2 1 131 UNP O57413 320 H ATOM 1055 C CE1 . HIS A 1 131 ? 16.850 14.430 10.261 1.00 9.96 ? 131 HIS A CE1 1 131 UNP O57413 320 H ATOM 1056 N NE2 . HIS A 1 131 ? 16.017 14.252 11.270 1.00 10.21 ? 131 HIS A NE2 1 131 UNP O57413 320 H ATOM 1057 N N . SER A 1 132 ? 20.845 14.292 12.693 1.00 10.14 ? 132 SER A N 1 132 UNP O57413 321 S ATOM 1058 C CA . SER A 1 132 ? 21.645 15.351 12.055 1.00 11.63 ? 132 SER A CA 1 132 UNP O57413 321 S ATOM 1059 C C . SER A 1 132 ? 22.374 16.112 13.134 1.00 12.28 ? 132 SER A C 1 132 UNP O57413 321 S ATOM 1060 O O . SER A 1 132 ? 21.877 16.218 14.267 1.00 12.15 ? 132 SER A O 1 132 UNP O57413 321 S ATOM 1061 C CB . SER A 1 132 ? 20.717 16.344 11.311 1.00 11.47 ? 132 SER A CB 1 132 UNP O57413 321 S ATOM 1062 O OG . SER A 1 132 ? 21.465 17.396 10.714 1.00 12.54 ? 132 SER A OG 1 132 UNP O57413 321 S ATOM 1063 N N . SER A 1 133 ? 23.551 16.645 12.798 1.00 12.91 ? 133 SER A N 1 133 UNP O57413 322 S ATOM 1064 C CA . SER A 1 133 ? 24.267 17.467 13.759 1.00 13.99 ? 133 SER A CA 1 133 UNP O57413 322 S ATOM 1065 C C . SER A 1 133 ? 23.501 18.802 13.836 1.00 14.07 ? 133 SER A C 1 133 UNP O57413 322 S ATOM 1066 O O . SER A 1 133 ? 23.578 19.498 14.868 1.00 15.07 ? 133 SER A O 1 133 UNP O57413 322 S ATOM 1067 C CB . SER A 1 133 ? 25.722 17.715 13.323 1.00 14.76 ? 133 SER A CB 1 133 UNP O57413 322 S ATOM 1068 O OG . SER A 1 133 ? 25.801 18.256 12.027 1.00 15.44 ? 133 SER A OG 1 133 UNP O57413 322 S ATOM 1069 N N . LYS A 1 134 ? 22.749 19.126 12.769 1.00 13.34 ? 134 LYS A N 1 134 UNP O57413 323 K ATOM 1070 C CA . LYS A 1 134 ? 21.978 20.372 12.721 1.00 13.05 ? 134 LYS A CA 1 134 UNP O57413 323 K ATOM 1071 C C . LYS A 1 134 ? 20.759 20.282 13.626 1.00 11.49 ? 134 LYS A C 1 134 UNP O57413 323 K ATOM 1072 O O . LYS A 1 134 ? 19.859 19.481 13.399 1.00 11.37 ? 134 LYS A O 1 134 UNP O57413 323 K ATOM 1073 C CB . LYS A 1 134 ? 21.510 20.687 11.303 1.00 15.17 ? 134 LYS A CB 1 134 UNP O57413 323 K ATOM 1074 C CG . LYS A 1 134 ? 22.631 20.980 10.311 1.00 18.75 ? 134 LYS A CG 1 134 UNP O57413 323 K ATOM 1075 C CD . LYS A 1 134 ? 22.039 21.353 8.947 1.00 22.06 ? 134 LYS A CD 1 134 UNP O57413 323 K ATOM 1076 C CE . LYS A 1 134 ? 23.139 21.706 7.955 1.00 24.74 ? 134 LYS A CE 1 134 UNP O57413 323 K ATOM 1077 N NZ . LYS A 1 134 ? 23.874 20.472 7.602 1.00 26.95 ? 134 LYS A NZ 1 134 UNP O57413 323 K ATOM 1078 N N . VAL A 1 135 ? 20.753 21.085 14.680 1.00 9.70 ? 135 VAL A N 1 135 UNP O57413 324 V ATOM 1079 C CA . VAL A 1 135 ? 19.640 21.067 15.613 1.00 9.07 ? 135 VAL A CA 1 135 UNP O57413 324 V ATOM 1080 C C . VAL A 1 135 ? 18.304 21.261 14.909 1.00 8.70 ? 135 VAL A C 1 135 UNP O57413 324 V ATOM 1081 O O . VAL A 1 135 ? 17.355 20.572 15.223 1.00 8.39 ? 135 VAL A O 1 135 UNP O57413 324 V ATOM 1082 C CB . VAL A 1 135 ? 19.787 22.144 16.705 1.00 9.96 ? 135 VAL A CB 1 135 UNP O57413 324 V ATOM 1083 C CG1 . VAL A 1 135 ? 18.506 22.277 17.495 1.00 11.19 ? 135 VAL A CG1 1 135 UNP O57413 324 V ATOM 1084 C CG2 . VAL A 1 135 ? 20.946 21.786 17.628 1.00 11.82 ? 135 VAL A CG2 1 135 UNP O57413 324 V ATOM 1085 N N . PHE A 1 136 ? 18.225 22.196 13.978 1.00 8.12 ? 136 PHE A N 1 136 UNP O57413 325 F ATOM 1086 C CA . PHE A 1 136 ? 16.963 22.422 13.292 1.00 6.82 ? 136 PHE A CA 1 136 UNP O57413 325 F ATOM 1087 C C . PHE A 1 136 ? 16.414 21.220 12.587 1.00 7.70 ? 136 PHE A C 1 136 UNP O57413 325 F ATOM 1088 O O . PHE A 1 136 ? 15.202 21.003 12.604 1.00 7.08 ? 136 PHE A O 1 136 UNP O57413 325 F ATOM 1089 C CB . PHE A 1 136 ? 17.094 23.587 12.298 1.00 8.83 ? 136 PHE A CB 1 136 UNP O57413 325 F ATOM 1090 C CG . PHE A 1 136 ? 15.808 23.857 11.548 1.00 8.52 ? 136 PHE A CG 1 136 UNP O57413 325 F ATOM 1091 C CD1 . PHE A 1 136 ? 14.737 24.541 12.158 1.00 9.35 ? 136 PHE A CD1 1 136 UNP O57413 325 F ATOM 1092 C CD2 . PHE A 1 136 ? 15.616 23.333 10.272 1.00 9.28 ? 136 PHE A CD2 1 136 UNP O57413 325 F ATOM 1093 C CE1 . PHE A 1 136 ? 13.501 24.684 11.470 1.00 10.06 ? 136 PHE A CE1 1 136 UNP O57413 325 F ATOM 1094 C CE2 . PHE A 1 136 ? 14.376 23.481 9.612 1.00 10.11 ? 136 PHE A CE2 1 136 UNP O57413 325 F ATOM 1095 C CZ . PHE A 1 136 ? 13.350 24.145 10.201 1.00 9.91 ? 136 PHE A CZ 1 136 UNP O57413 325 F ATOM 1096 N N . MET A 1 137 ? 17.290 20.437 11.952 1.00 7.15 ? 137 MET A N 1 137 UNP O57413 326 M ATOM 1097 C CA . MET A 1 137 ? 16.807 19.247 11.243 1.00 7.86 ? 137 MET A CA 1 137 UNP O57413 326 M ATOM 1098 C C . MET A 1 137 ? 16.162 18.229 12.184 1.00 7.84 ? 137 MET A C 1 137 UNP O57413 326 M ATOM 1099 O O . MET A 1 137 ? 15.178 17.564 11.810 1.00 8.21 ? 137 MET A O 1 137 UNP O57413 326 M ATOM 1100 C CB . MET A 1 137 ? 17.951 18.635 10.434 1.00 9.83 ? 137 MET A CB 1 137 UNP O57413 326 M ATOM 1101 C CG . MET A 1 137 ? 18.416 19.589 9.294 1.00 12.48 ? 137 MET A CG 1 137 UNP O57413 326 M ATOM 1102 S SD . MET A 1 137 ? 17.044 19.930 8.094 1.00 19.32 ? 137 MET A SD 1 137 UNP O57413 326 M ATOM 1103 C CE . MET A 1 137 ? 17.144 18.477 7.510 1.00 17.18 ? 137 MET A CE 1 137 UNP O57413 326 M ATOM 1104 N N . VAL A 1 138 ? 16.662 18.126 13.404 1.00 6.59 ? 138 VAL A N 1 138 UNP O57413 327 V ATOM 1105 C CA . VAL A 1 138 ? 16.050 17.219 14.347 1.00 7.09 ? 138 VAL A CA 1 138 UNP O57413 327 V ATOM 1106 C C . VAL A 1 138 ? 14.779 17.861 14.891 1.00 6.67 ? 138 VAL A C 1 138 UNP O57413 327 V ATOM 1107 O O . VAL A 1 138 ? 13.751 17.223 15.012 1.00 7.16 ? 138 VAL A O 1 138 UNP O57413 327 V ATOM 1108 C CB . VAL A 1 138 ? 17.017 16.852 15.477 1.00 6.98 ? 138 VAL A CB 1 138 UNP O57413 327 V ATOM 1109 C CG1 . VAL A 1 138 ? 16.350 15.822 16.412 1.00 8.45 ? 138 VAL A CG1 1 138 UNP O57413 327 V ATOM 1110 C CG2 . VAL A 1 138 ? 18.269 16.177 14.843 1.00 8.58 ? 138 VAL A CG2 1 138 UNP O57413 327 V ATOM 1111 N N . ALA A 1 139 ? 14.852 19.152 15.198 1.00 6.53 ? 139 ALA A N 1 139 UNP O57413 328 A ATOM 1112 C CA . ALA A 1 139 ? 13.679 19.833 15.713 1.00 6.52 ? 139 ALA A CA 1 139 UNP O57413 328 A ATOM 1113 C C . ALA A 1 139 ? 12.511 19.832 14.750 1.00 5.75 ? 139 ALA A C 1 139 UNP O57413 328 A ATOM 1114 O O . ALA A 1 139 ? 11.357 19.724 15.199 1.00 6.00 ? 139 ALA A O 1 139 UNP O57413 328 A ATOM 1115 C CB . ALA A 1 139 ? 14.017 21.299 16.092 1.00 6.84 ? 139 ALA A CB 1 139 UNP O57413 328 A ATOM 1116 N N . VAL A 1 140 ? 12.771 19.994 13.451 1.00 6.87 ? 140 VAL A N 1 140 UNP O57413 329 V ATOM 1117 C CA . VAL A 1 140 ? 11.645 19.987 12.530 1.00 6.88 ? 140 VAL A CA 1 140 UNP O57413 329 V ATOM 1118 C C . VAL A 1 140 ? 11.064 18.568 12.418 1.00 6.31 ? 140 VAL A C 1 140 UNP O57413 329 V ATOM 1119 O O . VAL A 1 140 ? 9.886 18.404 12.074 1.00 6.02 ? 140 VAL A O 1 140 UNP O57413 329 V ATOM 1120 C CB . VAL A 1 140 ? 12.071 20.605 11.148 1.00 6.79 ? 140 VAL A CB 1 140 UNP O57413 329 V ATOM 1121 C CG1 . VAL A 1 140 ? 13.018 19.692 10.388 1.00 7.52 ? 140 VAL A CG1 1 140 UNP O57413 329 V ATOM 1122 C CG2 . VAL A 1 140 ? 10.839 20.972 10.335 1.00 7.71 ? 140 VAL A CG2 1 140 UNP O57413 329 V ATOM 1123 N N . THR A 1 141 ? 11.874 17.547 12.697 1.00 6.42 ? 141 THR A N 1 141 UNP O57413 330 T ATOM 1124 C CA . THR A 1 141 ? 11.392 16.162 12.676 1.00 5.86 ? 141 THR A CA 1 141 UNP O57413 330 T ATOM 1125 C C . THR A 1 141 ? 10.467 15.983 13.901 1.00 5.33 ? 141 THR A C 1 141 UNP O57413 330 T ATOM 1126 O O . THR A 1 141 ? 9.372 15.413 13.800 1.00 5.54 ? 141 THR A O 1 141 UNP O57413 330 T ATOM 1127 C CB . THR A 1 141 ? 12.576 15.181 12.739 1.00 5.39 ? 141 THR A CB 1 141 UNP O57413 330 T ATOM 1128 O OG1 . THR A 1 141 ? 13.397 15.411 11.579 1.00 7.77 ? 141 THR A OG1 1 141 UNP O57413 330 T ATOM 1129 C CG2 . THR A 1 141 ? 12.072 13.750 12.732 1.00 6.22 ? 141 THR A CG2 1 141 UNP O57413 330 T ATOM 1130 N N . MET A 1 142 ? 10.896 16.495 15.060 1.00 6.08 ? 142 MET A N 1 142 UNP O57413 331 M ATOM 1131 C CA . MET A 1 142 ? 10.057 16.467 16.249 1.00 6.15 ? 142 MET A CA 1 142 UNP O57413 331 M ATOM 1132 C C . MET A 1 142 ? 8.735 17.204 15.991 1.00 5.85 ? 142 MET A C 1 142 UNP O57413 331 M ATOM 1133 O O . MET A 1 142 ? 7.656 16.746 16.420 1.00 6.34 ? 142 MET A O 1 142 UNP O57413 331 M ATOM 1134 C CB . MET A 1 142 ? 10.775 17.154 17.435 1.00 6.86 ? 142 MET A CB 1 142 UNP O57413 331 M ATOM 1135 C CG . MET A 1 142 ? 12.013 16.367 17.851 1.00 6.80 ? 142 MET A CG 1 142 UNP O57413 331 M ATOM 1136 S SD . MET A 1 142 ? 13.047 17.290 19.013 1.00 8.61 ? 142 MET A SD 1 142 UNP O57413 331 M ATOM 1137 C CE . MET A 1 142 ? 12.189 17.077 20.490 1.00 10.01 ? 142 MET A CE 1 142 UNP O57413 331 M ATOM 1138 N N . THR A 1 143 ? 8.809 18.309 15.256 1.00 6.40 ? 143 THR A N 1 143 UNP O57413 332 T ATOM 1139 C CA . THR A 1 143 ? 7.615 19.124 14.978 1.00 5.42 ? 143 THR A CA 1 143 UNP O57413 332 T ATOM 1140 C C . THR A 1 143 ? 6.691 18.398 13.997 1.00 5.80 ? 143 THR A C 1 143 UNP O57413 332 T ATOM 1141 O O . THR A 1 143 ? 5.479 18.436 14.180 1.00 5.97 ? 143 THR A O 1 143 UNP O57413 332 T ATOM 1142 C CB . THR A 1 143 ? 7.999 20.523 14.453 1.00 6.02 ? 143 THR A CB 1 143 UNP O57413 332 T ATOM 1143 O OG1 . THR A 1 143 ? 8.844 21.160 15.432 1.00 6.68 ? 143 THR A OG1 1 143 UNP O57413 332 T ATOM 1144 C CG2 . THR A 1 143 ? 6.762 21.411 14.299 1.00 6.55 ? 143 THR A CG2 1 143 UNP O57413 332 T ATOM 1145 N N . HIS A 1 144 ? 7.272 17.717 13.005 1.00 5.03 ? 144 HIS A N 1 144 UNP O57413 333 H ATOM 1146 C CA . HIS A 1 144 ? 6.513 16.929 12.026 1.00 5.81 ? 144 HIS A CA 1 144 UNP O57413 333 H ATOM 1147 C C . HIS A 1 144 ? 5.751 15.840 12.782 1.00 5.63 ? 144 HIS A C 1 144 UNP O57413 333 H ATOM 1148 O O . HIS A 1 144 ? 4.551 15.624 12.528 1.00 5.81 ? 144 HIS A O 1 144 UNP O57413 333 H ATOM 1149 C CB . HIS A 1 144 ? 7.500 16.324 11.028 1.00 5.83 ? 144 HIS A CB 1 144 UNP O57413 333 H ATOM 1150 C CG . HIS A 1 144 ? 6.870 15.412 10.015 1.00 5.29 ? 144 HIS A CG 1 144 UNP O57413 333 H ATOM 1151 N ND1 . HIS A 1 144 ? 6.625 15.811 8.716 1.00 6.07 ? 144 HIS A ND1 1 144 UNP O57413 333 H ATOM 1152 C CD2 . HIS A 1 144 ? 6.488 14.111 10.090 1.00 5.93 ? 144 HIS A CD2 1 144 UNP O57413 333 H ATOM 1153 C CE1 . HIS A 1 144 ? 6.102 14.800 8.036 1.00 5.25 ? 144 HIS A CE1 1 144 UNP O57413 333 H ATOM 1154 N NE2 . HIS A 1 144 ? 6.015 13.745 8.840 1.00 4.96 ? 144 HIS A NE2 1 144 UNP O57413 333 H ATOM 1155 N N . GLU A 1 145 ? 6.415 15.143 13.721 1.00 4.81 ? 145 GLU A N 1 145 UNP O57413 334 E ATOM 1156 C CA . GLU A 1 145 ? 5.705 14.100 14.471 1.00 5.90 ? 145 GLU A CA 1 145 UNP O57413 334 E ATOM 1157 C C . GLU A 1 145 ? 4.626 14.690 15.398 1.00 5.62 ? 145 GLU A C 1 145 UNP O57413 334 E ATOM 1158 O O . GLU A 1 145 ? 3.520 14.144 15.529 1.00 6.17 ? 145 GLU A O 1 145 UNP O57413 334 E ATOM 1159 C CB . GLU A 1 145 ? 6.710 13.223 15.237 1.00 6.60 ? 145 GLU A CB 1 145 UNP O57413 334 E ATOM 1160 C CG . GLU A 1 145 ? 7.811 12.578 14.354 1.00 6.27 ? 145 GLU A CG 1 145 UNP O57413 334 E ATOM 1161 C CD . GLU A 1 145 ? 7.314 11.823 13.134 1.00 5.16 ? 145 GLU A CD 1 145 UNP O57413 334 E ATOM 1162 O OE1 . GLU A 1 145 ? 8.121 11.701 12.163 1.00 6.61 ? 145 GLU A OE1 1 145 UNP O57413 334 E ATOM 1163 O OE2 . GLU A 1 145 ? 6.143 11.382 13.121 1.00 7.52 ? 145 GLU A OE2 1 145 UNP O57413 334 E ATOM 1164 N N . LEU A 1 146 ? 4.917 15.838 16.008 1.00 5.36 ? 146 LEU A N 1 146 UNP O57413 335 L ATOM 1165 C CA . LEU A 1 146 ? 3.935 16.519 16.821 1.00 7.41 ? 146 LEU A CA 1 146 UNP O57413 335 L ATOM 1166 C C . LEU A 1 146 ? 2.720 16.846 15.932 1.00 6.75 ? 146 LEU A C 1 146 UNP O57413 335 L ATOM 1167 O O . LEU A 1 146 ? 1.559 16.701 16.358 1.00 7.63 ? 146 LEU A O 1 146 UNP O57413 335 L ATOM 1168 C CB . LEU A 1 146 ? 4.564 17.823 17.387 1.00 6.27 ? 146 LEU A CB 1 146 UNP O57413 335 L ATOM 1169 C CG . LEU A 1 146 ? 3.639 18.658 18.264 1.00 8.53 ? 146 LEU A CG 1 146 UNP O57413 335 L ATOM 1170 C CD1 . LEU A 1 146 ? 3.286 17.859 19.516 1.00 10.30 ? 146 LEU A CD1 1 146 UNP O57413 335 L ATOM 1171 C CD2 . LEU A 1 146 ? 4.392 19.946 18.677 1.00 10.39 ? 146 LEU A CD2 1 146 UNP O57413 335 L ATOM 1172 N N . GLY A 1 147 ? 2.982 17.280 14.701 1.00 6.28 ? 147 GLY A N 1 147 UNP O57413 336 G ATOM 1173 C CA . GLY A 1 147 ? 1.911 17.631 13.761 1.00 6.87 ? 147 GLY A CA 1 147 UNP O57413 336 G ATOM 1174 C C . GLY A 1 147 ? 1.034 16.416 13.489 1.00 6.55 ? 147 GLY A C 1 147 UNP O57413 336 G ATOM 1175 O O . GLY A 1 147 ? -0.212 16.501 13.499 1.00 7.09 ? 147 GLY A O 1 147 UNP O57413 336 G ATOM 1176 N N . HIS A 1 148 ? 1.646 15.264 13.240 1.00 6.50 ? 148 HIS A N 1 148 UNP O57413 337 H ATOM 1177 C CA . HIS A 1 148 ? 0.824 14.053 13.080 1.00 7.63 ? 148 HIS A CA 1 148 UNP O57413 337 H ATOM 1178 C C . HIS A 1 148 ? -0.008 13.827 14.321 1.00 7.51 ? 148 HIS A C 1 148 UNP O57413 337 H ATOM 1179 O O . HIS A 1 148 ? -1.193 13.506 14.218 1.00 8.99 ? 148 HIS A O 1 148 UNP O57413 337 H ATOM 1180 C CB . HIS A 1 148 ? 1.715 12.810 12.881 1.00 6.81 ? 148 HIS A CB 1 148 UNP O57413 337 H ATOM 1181 C CG . HIS A 1 148 ? 2.241 12.636 11.487 1.00 6.39 ? 148 HIS A CG 1 148 UNP O57413 337 H ATOM 1182 N ND1 . HIS A 1 148 ? 1.440 12.680 10.363 1.00 7.17 ? 148 HIS A ND1 1 148 UNP O57413 337 H ATOM 1183 C CD2 . HIS A 1 148 ? 3.477 12.305 11.045 1.00 6.50 ? 148 HIS A CD2 1 148 UNP O57413 337 H ATOM 1184 C CE1 . HIS A 1 148 ? 2.157 12.369 9.295 1.00 7.12 ? 148 HIS A CE1 1 148 UNP O57413 337 H ATOM 1185 N NE2 . HIS A 1 148 ? 3.401 12.129 9.679 1.00 7.26 ? 148 HIS A NE2 1 148 UNP O57413 337 H ATOM 1186 N N . ASN A 1 149 ? 0.557 14.020 15.508 1.00 7.56 ? 149 ASN A N 1 149 UNP O57413 338 N ATOM 1187 C CA . ASN A 1 149 ? -0.218 13.747 16.730 1.00 8.06 ? 149 ASN A CA 1 149 UNP O57413 338 N ATOM 1188 C C . ASN A 1 149 ? -1.373 14.741 16.913 1.00 8.19 ? 149 ASN A C 1 149 UNP O57413 338 N ATOM 1189 O O . ASN A 1 149 ? -2.335 14.459 17.660 1.00 9.36 ? 149 ASN A O 1 149 UNP O57413 338 N ATOM 1190 C CB . ASN A 1 149 ? 0.741 13.745 17.927 1.00 6.92 ? 149 ASN A CB 1 149 UNP O57413 338 N ATOM 1191 C CG . ASN A 1 149 ? 0.277 12.880 19.074 1.00 7.18 ? 149 ASN A CG 1 149 UNP O57413 338 N ATOM 1192 O OD1 . ASN A 1 149 ? 0.216 13.350 20.200 1.00 8.01 ? 149 ASN A OD1 1 149 UNP O57413 338 N ATOM 1193 N ND2 . ASN A 1 149 ? -0.020 11.584 18.807 1.00 8.60 ? 149 ASN A ND2 1 149 UNP O57413 338 N ATOM 1194 N N . LEU A 1 150 ? -1.278 15.892 16.242 1.00 7.65 ? 150 LEU A N 1 150 UNP O57413 339 L ATOM 1195 C CA . LEU A 1 150 ? -2.333 16.920 16.222 1.00 8.37 ? 150 LEU A CA 1 150 UNP O57413 339 L ATOM 1196 C C . LEU A 1 150 ? -3.285 16.708 15.046 1.00 8.84 ? 150 LEU A C 1 150 UNP O57413 339 L ATOM 1197 O O . LEU A 1 150 ? -3.979 17.656 14.634 1.00 9.61 ? 150 LEU A O 1 150 UNP O57413 339 L ATOM 1198 C CB . LEU A 1 150 ? -1.685 18.317 16.115 1.00 7.82 ? 150 LEU A CB 1 150 UNP O57413 339 L ATOM 1199 C CG . LEU A 1 150 ? -0.979 18.781 17.393 1.00 8.13 ? 150 LEU A CG 1 150 UNP O57413 339 L ATOM 1200 C CD1 . LEU A 1 150 ? -0.121 20.039 17.097 1.00 9.61 ? 150 LEU A CD1 1 150 UNP O57413 339 L ATOM 1201 C CD2 . LEU A 1 150 ? -2.021 19.065 18.499 1.00 9.02 ? 150 LEU A CD2 1 150 UNP O57413 339 L ATOM 1202 N N . GLY A 1 151 ? -3.288 15.498 14.468 1.00 8.87 ? 151 GLY A N 1 151 UNP O57413 340 G ATOM 1203 C CA . GLY A 1 151 ? -4.193 15.205 13.356 1.00 9.00 ? 151 GLY A CA 1 151 UNP O57413 340 G ATOM 1204 C C . GLY A 1 151 ? -3.812 15.569 11.944 1.00 8.62 ? 151 GLY A C 1 151 UNP O57413 340 G ATOM 1205 O O . GLY A 1 151 ? -4.640 15.516 11.027 1.00 9.49 ? 151 GLY A O 1 151 UNP O57413 340 G ATOM 1206 N N . MET A 1 152 ? -2.557 15.923 11.735 1.00 8.38 ? 152 MET A N 1 152 UNP O57413 341 M ATOM 1207 C CA . MET A 1 152 ? -2.105 16.301 10.395 1.00 8.03 ? 152 MET A CA 1 152 UNP O57413 341 M ATOM 1208 C C . MET A 1 152 ? -1.583 15.100 9.603 1.00 8.52 ? 152 MET A C 1 152 UNP O57413 341 M ATOM 1209 O O . MET A 1 152 ? -0.931 14.224 10.151 1.00 10.19 ? 152 MET A O 1 152 UNP O57413 341 M ATOM 1210 C CB . MET A 1 152 ? -0.933 17.313 10.496 1.00 7.21 ? 152 MET A CB 1 152 UNP O57413 341 M ATOM 1211 C CG . MET A 1 152 ? -1.317 18.597 11.219 1.00 7.38 ? 152 MET A CG 1 152 UNP O57413 341 M ATOM 1212 S SD . MET A 1 152 ? 0.150 19.635 11.327 1.00 7.73 ? 152 MET A SD 1 152 UNP O57413 341 M ATOM 1213 C CE . MET A 1 152 ? -0.491 21.059 12.175 1.00 10.70 ? 152 MET A CE 1 152 UNP O57413 341 M ATOM 1214 N N . GLU A 1 153 ? -1.909 15.054 8.311 1.00 9.24 ? 153 GLU A N 1 153 UNP O57413 342 E ATOM 1215 C CA . GLU A 1 153 ? -1.361 14.054 7.407 1.00 9.09 ? 153 GLU A CA 1 153 UNP O57413 342 E ATOM 1216 C C . GLU A 1 153 ? -0.324 14.793 6.587 1.00 8.42 ? 153 GLU A C 1 153 UNP O57413 342 E ATOM 1217 O O . GLU A 1 153 ? -0.115 16.014 6.744 1.00 9.03 ? 153 GLU A O 1 153 UNP O57413 342 E ATOM 1218 C CB . GLU A 1 153 ? -2.436 13.518 6.456 1.00 10.70 ? 153 GLU A CB 1 153 UNP O57413 342 E ATOM 1219 C CG . GLU A 1 153 ? -3.601 12.857 7.161 1.00 15.73 ? 153 GLU A CG 1 153 UNP O57413 342 E ATOM 1220 C CD . GLU A 1 153 ? -3.234 11.606 7.895 1.00 19.65 ? 153 GLU A CD 1 153 UNP O57413 342 E ATOM 1221 O OE1 . GLU A 1 153 ? -2.229 10.961 7.529 1.00 22.95 ? 153 GLU A OE1 1 153 UNP O57413 342 E ATOM 1222 O OE2 . GLU A 1 153 ? -3.968 11.234 8.850 1.00 22.30 ? 153 GLU A OE2 1 153 UNP O57413 342 E ATOM 1223 N N . HIS A 1 154 ? 0.352 14.094 5.685 1.00 7.96 ? 154 HIS A N 1 154 UNP O57413 343 H ATOM 1224 C CA . HIS A 1 154 ? 1.323 14.772 4.848 1.00 7.62 ? 154 HIS A CA 1 154 UNP O57413 343 H ATOM 1225 C C . HIS A 1 154 ? 0.682 15.742 3.866 1.00 7.70 ? 154 HIS A C 1 154 UNP O57413 343 H ATOM 1226 O O . HIS A 1 154 ? -0.470 15.580 3.426 1.00 9.53 ? 154 HIS A O 1 154 UNP O57413 343 H ATOM 1227 C CB . HIS A 1 154 ? 2.129 13.774 4.021 1.00 7.61 ? 154 HIS A CB 1 154 UNP O57413 343 H ATOM 1228 C CG . HIS A 1 154 ? 3.003 12.908 4.851 1.00 8.26 ? 154 HIS A CG 1 154 UNP O57413 343 H ATOM 1229 N ND1 . HIS A 1 154 ? 3.553 11.729 4.391 1.00 9.02 ? 154 HIS A ND1 1 154 UNP O57413 343 H ATOM 1230 C CD2 . HIS A 1 154 ? 3.468 13.088 6.107 1.00 8.77 ? 154 HIS A CD2 1 154 UNP O57413 343 H ATOM 1231 C CE1 . HIS A 1 154 ? 4.327 11.228 5.338 1.00 8.70 ? 154 HIS A CE1 1 154 UNP O57413 343 H ATOM 1232 N NE2 . HIS A 1 154 ? 4.294 12.032 6.392 1.00 8.12 ? 154 HIS A NE2 1 154 UNP O57413 343 H ATOM 1233 N N . ASP A 1 155 ? 1.446 16.760 3.542 1.00 7.39 ? 155 ASP A N 1 155 UNP O57413 344 D ATOM 1234 C CA . ASP A 1 155 ? 1.018 17.735 2.538 1.00 7.56 ? 155 ASP A CA 1 155 UNP O57413 344 D ATOM 1235 C C . ASP A 1 155 ? 0.738 17.005 1.218 1.00 8.07 ? 155 ASP A C 1 155 UNP O57413 344 D ATOM 1236 O O . ASP A 1 155 ? 1.446 16.050 0.836 1.00 9.16 ? 155 ASP A O 1 155 UNP O57413 344 D ATOM 1237 C CB . ASP A 1 155 ? 2.131 18.762 2.381 1.00 7.72 ? 155 ASP A CB 1 155 UNP O57413 344 D ATOM 1238 C CG . ASP A 1 155 ? 2.203 19.717 3.557 1.00 7.58 ? 155 ASP A CG 1 155 UNP O57413 344 D ATOM 1239 O OD1 . ASP A 1 155 ? 1.213 19.849 4.286 1.00 8.36 ? 155 ASP A OD1 1 155 UNP O57413 344 D ATOM 1240 O OD2 . ASP A 1 155 ? 3.270 20.332 3.733 1.00 9.10 ? 155 ASP A OD2 1 155 UNP O57413 344 D ATOM 1241 N N . ASP A 1 156 ? -0.262 17.496 0.488 1.00 7.87 ? 156 ASP A N 1 156 UNP O57413 345 D ATOM 1242 C CA . ASP A 1 156 ? -0.668 16.907 -0.798 1.00 7.59 ? 156 ASP A CA 1 156 UNP O57413 345 D ATOM 1243 C C . ASP A 1 156 ? -0.776 18.092 -1.752 1.00 8.21 ? 156 ASP A C 1 156 UNP O57413 345 D ATOM 1244 O O . ASP A 1 156 ? -1.436 19.080 -1.425 1.00 7.82 ? 156 ASP A O 1 156 UNP O57413 345 D ATOM 1245 C CB . ASP A 1 156 ? -2.032 16.191 -0.603 1.00 8.06 ? 156 ASP A CB 1 156 UNP O57413 345 D ATOM 1246 C CG . ASP A 1 156 ? -2.616 15.646 -1.915 1.00 8.92 ? 156 ASP A CG 1 156 UNP O57413 345 D ATOM 1247 O OD1 . ASP A 1 156 ? -3.184 16.461 -2.644 1.00 9.22 ? 156 ASP A OD1 1 156 UNP O57413 345 D ATOM 1248 O OD2 . ASP A 1 156 ? -2.520 14.438 -2.187 1.00 8.15 ? 156 ASP A OD2 1 156 UNP O57413 345 D ATOM 1249 N N . LYS A 1 157 ? -0.126 17.993 -2.906 1.00 8.26 ? 157 LYS A N 1 157 UNP O57413 346 K ATOM 1250 C CA . LYS A 1 157 ? -0.115 19.082 -3.881 1.00 9.08 ? 157 LYS A CA 1 157 UNP O57413 346 K ATOM 1251 C C . LYS A 1 157 ? -1.487 19.495 -4.381 1.00 9.15 ? 157 LYS A C 1 157 UNP O57413 346 K ATOM 1252 O O . LYS A 1 157 ? -1.666 20.670 -4.733 1.00 10.00 ? 157 LYS A O 1 157 UNP O57413 346 K ATOM 1253 C CB . LYS A 1 157 ? 0.788 18.741 -5.050 1.00 10.29 ? 157 LYS A CB 1 157 UNP O57413 346 K ATOM 1254 C CG . LYS A 1 157 ? 2.266 18.694 -4.670 1.00 13.62 ? 157 LYS A CG 1 157 UNP O57413 346 K ATOM 1255 C CD . LYS A 1 157 ? 2.691 20.047 -4.086 1.00 17.96 ? 157 LYS A CD 1 157 UNP O57413 346 K ATOM 1256 C CE . LYS A 1 157 ? 3.126 20.948 -5.181 1.00 21.97 ? 157 LYS A CE 1 157 UNP O57413 346 K ATOM 1257 N NZ . LYS A 1 157 ? 4.518 20.572 -5.582 1.00 25.07 ? 157 LYS A NZ 1 157 UNP O57413 346 K ATOM 1258 N N . ASP A 1 158 ? -2.453 18.587 -4.416 1.00 8.84 ? 158 ASP A N 1 158 UNP O57413 347 D ATOM 1259 C CA . ASP A 1 158 ? -3.777 19.015 -4.863 1.00 8.81 ? 158 ASP A CA 1 158 UNP O57413 347 D ATOM 1260 C C . ASP A 1 158 ? -4.429 19.899 -3.837 1.00 9.32 ? 158 ASP A C 1 158 UNP O57413 347 D ATOM 1261 O O . ASP A 1 158 ? -5.215 20.781 -4.173 1.00 10.80 ? 158 ASP A O 1 158 UNP O57413 347 D ATOM 1262 C CB . ASP A 1 158 ? -4.666 17.804 -5.145 1.00 9.05 ? 158 ASP A CB 1 158 UNP O57413 347 D ATOM 1263 C CG . ASP A 1 158 ? -4.157 16.993 -6.308 1.00 10.32 ? 158 ASP A CG 1 158 UNP O57413 347 D ATOM 1264 O OD1 . ASP A 1 158 ? -4.068 17.594 -7.414 1.00 12.13 ? 158 ASP A OD1 1 158 UNP O57413 347 D ATOM 1265 O OD2 . ASP A 1 158 ? -3.833 15.780 -6.115 1.00 8.74 ? 158 ASP A OD2 1 158 UNP O57413 347 D ATOM 1266 N N . LYS A 1 159 ? -4.087 19.701 -2.575 1.00 8.19 ? 159 LYS A N 1 159 UNP O57413 348 K ATOM 1267 C CA . LYS A 1 159 ? -4.700 20.478 -1.485 1.00 9.30 ? 159 LYS A CA 1 159 UNP O57413 348 K ATOM 1268 C C . LYS A 1 159 ? -3.975 21.759 -1.136 1.00 9.05 ? 159 LYS A C 1 159 UNP O57413 348 K ATOM 1269 O O . LYS A 1 159 ? -4.608 22.743 -0.702 1.00 10.10 ? 159 LYS A O 1 159 UNP O57413 348 K ATOM 1270 C CB . LYS A 1 159 ? -4.876 19.603 -0.238 1.00 9.59 ? 159 LYS A CB 1 159 UNP O57413 348 K ATOM 1271 C CG . LYS A 1 159 ? -5.860 18.443 -0.428 1.00 11.05 ? 159 LYS A CG 1 159 UNP O57413 348 K ATOM 1272 C CD . LYS A 1 159 ? -5.859 17.430 0.750 1.00 15.22 ? 159 LYS A CD 1 159 UNP O57413 348 K ATOM 1273 C CE . LYS A 1 159 ? -7.128 17.533 1.594 1.00 19.96 ? 159 LYS A CE 1 159 UNP O57413 348 K ATOM 1274 N NZ . LYS A 1 159 ? -7.074 18.683 2.566 1.00 21.48 ? 159 LYS A NZ 1 159 UNP O57413 348 K ATOM 1275 N N . CYS A 1 160 ? -2.667 21.770 -1.309 1.00 8.30 ? 160 CYS A N 1 160 UNP O57413 349 C ATOM 1276 C CA . CYS A 1 160 ? -1.895 22.980 -1.002 1.00 9.33 ? 160 CYS A CA 1 160 UNP O57413 349 C ATOM 1277 C C . CYS A 1 160 ? -0.589 22.922 -1.784 1.00 9.48 ? 160 CYS A C 1 160 UNP O57413 349 C ATOM 1278 O O . CYS A 1 160 ? -0.111 21.854 -2.129 1.00 8.46 ? 160 CYS A O 1 160 UNP O57413 349 C ATOM 1279 C CB . CYS A 1 160 ? -1.652 23.128 0.530 1.00 8.75 ? 160 CYS A CB 1 160 UNP O57413 349 C ATOM 1280 S SG . CYS A 1 160 ? -0.620 21.819 1.272 1.00 12.68 ? 160 CYS A SG 1 160 UNP O57413 349 C ATOM 1281 N N . LYS A 1 161 ? -0.012 24.081 -2.069 1.00 10.37 ? 161 LYS A N 1 161 UNP O57413 350 K ATOM 1282 C CA . LYS A 1 161 ? 1.183 24.126 -2.887 1.00 11.10 ? 161 LYS A CA 1 161 UNP O57413 350 K ATOM 1283 C C . LYS A 1 161 ? 2.561 24.128 -2.265 1.00 11.61 ? 161 LYS A C 1 161 UNP O57413 350 K ATOM 1284 O O . LYS A 1 161 ? 3.543 23.950 -2.971 1.00 12.66 ? 161 LYS A O 1 161 UNP O57413 350 K ATOM 1285 C CB . LYS A 1 161 ? 1.047 25.290 -3.889 1.00 12.75 ? 161 LYS A CB 1 161 UNP O57413 350 K ATOM 1286 C CG . LYS A 1 161 ? -0.235 25.202 -4.729 1.00 13.68 ? 161 LYS A CG 1 161 UNP O57413 350 K ATOM 1287 C CD . LYS A 1 161 ? -0.449 23.815 -5.387 1.00 13.77 ? 161 LYS A CD 1 161 UNP O57413 350 K ATOM 1288 C CE . LYS A 1 161 ? -1.710 23.871 -6.325 1.00 13.97 ? 161 LYS A CE 1 161 UNP O57413 350 K ATOM 1289 N NZ . LYS A 1 161 ? -2.074 22.470 -6.859 1.00 12.58 ? 161 LYS A NZ 1 161 UNP O57413 350 K ATOM 1290 N N . CYS A 1 162 ? 2.647 24.237 -0.945 1.00 11.25 ? 162 CYS A N 1 162 UNP O57413 351 C ATOM 1291 C CA . CYS A 1 162 ? 3.956 24.272 -0.312 1.00 12.35 ? 162 CYS A CA 1 162 UNP O57413 351 C ATOM 1292 C C . CYS A 1 162 ? 4.783 23.036 -0.583 1.00 13.14 ? 162 CYS A C 1 162 UNP O57413 351 C ATOM 1293 O O . CYS A 1 162 ? 4.294 21.914 -0.426 1.00 13.59 ? 162 CYS A O 1 162 UNP O57413 351 C ATOM 1294 C CB . CYS A 1 162 ? 3.799 24.452 1.185 1.00 11.65 ? 162 CYS A CB 1 162 UNP O57413 351 C ATOM 1295 S SG . CYS A 1 162 ? 5.421 24.782 1.920 1.00 11.67 ? 162 CYS A SG 1 162 UNP O57413 351 C ATOM 1296 N N . ASP A 1 163 ? 6.048 23.233 -0.960 1.00 13.73 ? 163 ASP A N 1 163 UNP O57413 352 D ATOM 1297 C CA . ASP A 1 163 ? 6.897 22.096 -1.282 1.00 15.89 ? 163 ASP A CA 1 163 UNP O57413 352 D ATOM 1298 C C . ASP A 1 163 ? 7.826 21.615 -0.195 1.00 14.83 ? 163 ASP A C 1 163 UNP O57413 352 D ATOM 1299 O O . ASP A 1 163 ? 8.207 20.446 -0.191 1.00 16.37 ? 163 ASP A O 1 163 UNP O57413 352 D ATOM 1300 C CB . ASP A 1 163 ? 7.741 22.399 -2.523 1.00 19.48 ? 163 ASP A CB 1 163 UNP O57413 352 D ATOM 1301 C CG . ASP A 1 163 ? 7.263 21.657 -3.740 1.00 23.92 ? 163 ASP A CG 1 163 UNP O57413 352 D ATOM 1302 O OD1 . ASP A 1 163 ? 7.434 20.409 -3.808 1.00 27.75 ? 163 ASP A OD1 1 163 UNP O57413 352 D ATOM 1303 O OD2 . ASP A 1 163 ? 6.716 22.322 -4.630 1.00 27.23 ? 163 ASP A OD2 1 163 UNP O57413 352 D ATOM 1304 N N . THR A 1 164 ? 8.150 22.501 0.735 1.00 13.29 ? 164 THR A N 1 164 UNP O57413 353 T ATOM 1305 C CA . THR A 1 164 ? 9.102 22.167 1.791 1.00 13.04 ? 164 THR A CA 1 164 UNP O57413 353 T ATOM 1306 C C . THR A 1 164 ? 8.615 22.470 3.197 1.00 12.48 ? 164 THR A C 1 164 UNP O57413 353 T ATOM 1307 O O . THR A 1 164 ? 9.415 22.729 4.113 1.00 12.11 ? 164 THR A O 1 164 UNP O57413 353 T ATOM 1308 C CB . THR A 1 164 ? 10.425 22.939 1.563 1.00 14.34 ? 164 THR A CB 1 164 UNP O57413 353 T ATOM 1309 O OG1 . THR A 1 164 ? 10.162 24.341 1.618 1.00 17.04 ? 164 THR A OG1 1 164 UNP O57413 353 T ATOM 1310 C CG2 . THR A 1 164 ? 11.026 22.578 0.202 1.00 15.21 ? 164 THR A CG2 1 164 UNP O57413 353 T ATOM 1311 N N . CYS A 1 165 ? 7.302 22.464 3.371 1.00 9.72 ? 165 CYS A N 1 165 UNP O57413 354 C ATOM 1312 C CA . CYS A 1 165 ? 6.716 22.740 4.667 1.00 8.02 ? 165 CYS A CA 1 165 UNP O57413 354 C ATOM 1313 C C . CYS A 1 165 ? 6.903 21.571 5.627 1.00 7.71 ? 165 CYS A C 1 165 UNP O57413 354 C ATOM 1314 O O . CYS A 1 165 ? 7.286 20.470 5.242 1.00 8.54 ? 165 CYS A O 1 165 UNP O57413 354 C ATOM 1315 C CB . CYS A 1 165 ? 5.240 23.128 4.514 1.00 7.50 ? 165 CYS A CB 1 165 UNP O57413 354 C ATOM 1316 S SG . CYS A 1 165 ? 5.056 24.859 3.911 1.00 9.07 ? 165 CYS A SG 1 165 UNP O57413 354 C ATOM 1317 N N . ILE A 1 166 ? 6.643 21.833 6.903 1.00 7.70 ? 166 ILE A N 1 166 UNP O57413 355 I ATOM 1318 C CA . ILE A 1 166 ? 6.872 20.834 7.955 1.00 7.35 ? 166 ILE A CA 1 166 UNP O57413 355 I ATOM 1319 C C . ILE A 1 166 ? 6.280 19.457 7.690 1.00 7.22 ? 166 ILE A C 1 166 UNP O57413 355 I ATOM 1320 O O . ILE A 1 166 ? 6.983 18.464 7.892 1.00 7.43 ? 166 ILE A O 1 166 UNP O57413 355 I ATOM 1321 C CB . ILE A 1 166 ? 6.383 21.394 9.319 1.00 7.17 ? 166 ILE A CB 1 166 UNP O57413 355 I ATOM 1322 C CG1 . ILE A 1 166 ? 7.260 22.620 9.699 1.00 8.29 ? 166 ILE A CG1 1 166 UNP O57413 355 I ATOM 1323 C CG2 . ILE A 1 166 ? 6.453 20.321 10.435 1.00 8.33 ? 166 ILE A CG2 1 166 UNP O57413 355 I ATOM 1324 C CD1 . ILE A 1 166 ? 6.691 23.422 10.854 1.00 8.04 ? 166 ILE A CD1 1 166 UNP O57413 355 I ATOM 1325 N N . MET A 1 167 ? 5.047 19.390 7.191 1.00 6.61 ? 167 MET A N 1 167 UNP O57413 356 M ATOM 1326 C CA . MET A 1 167 ? 4.447 18.095 6.906 1.00 6.32 ? 167 MET A CA 1 167 UNP O57413 356 M ATOM 1327 C C . MET A 1 167 ? 4.682 17.556 5.492 1.00 7.48 ? 167 MET A C 1 167 UNP O57413 356 M ATOM 1328 O O . MET A 1 167 ? 3.881 16.738 5.019 1.00 8.40 ? 167 MET A O 1 167 UNP O57413 356 M ATOM 1329 C CB . MET A 1 167 ? 2.940 18.079 7.221 1.00 5.57 ? 167 MET A CB 1 167 UNP O57413 356 M ATOM 1330 C CG . MET A 1 167 ? 2.572 18.499 8.651 1.00 6.36 ? 167 MET A CG 1 167 UNP O57413 356 M ATOM 1331 S SD . MET A 1 167 ? 3.469 17.495 9.921 1.00 7.30 ? 167 MET A SD 1 167 UNP O57413 356 M ATOM 1332 C CE . MET A 1 167 ? 2.849 15.850 9.577 1.00 7.80 ? 167 MET A CE 1 167 UNP O57413 356 M ATOM 1333 N N . SER A 1 168 ? 5.754 18.027 4.830 1.00 7.37 ? 168 SER A N 1 168 UNP O57413 357 S ATOM 1334 C CA . SER A 1 168 ? 6.118 17.455 3.536 1.00 8.22 ? 168 SER A CA 1 168 UNP O57413 357 S ATOM 1335 C C . SER A 1 168 ? 6.304 15.932 3.746 1.00 8.75 ? 168 SER A C 1 168 UNP O57413 357 S ATOM 1336 O O . SER A 1 168 ? 6.745 15.459 4.809 1.00 8.66 ? 168 SER A O 1 168 UNP O57413 357 S ATOM 1337 C CB . SER A 1 168 ? 7.398 18.113 3.020 1.00 10.86 ? 168 SER A CB 1 168 UNP O57413 357 S ATOM 1338 O OG . SER A 1 168 ? 7.853 17.424 1.880 1.00 17.41 ? 168 SER A OG 1 168 UNP O57413 357 S ATOM 1339 N N . ALA A 1 169 ? 5.984 15.144 2.727 1.00 9.12 ? 169 ALA A N 1 169 UNP O57413 358 A ATOM 1340 C CA . ALA A 1 169 ? 6.092 13.693 2.850 1.00 9.34 ? 169 ALA A CA 1 169 UNP O57413 358 A ATOM 1341 C C . ALA A 1 169 ? 7.514 13.234 3.174 1.00 9.75 ? 169 ALA A C 1 169 UNP O57413 358 A ATOM 1342 O O . ALA A 1 169 ? 7.697 12.206 3.810 1.00 10.94 ? 169 ALA A O 1 169 UNP O57413 358 A ATOM 1343 C CB . ALA A 1 169 ? 5.599 13.038 1.539 1.00 10.12 ? 169 ALA A CB 1 169 UNP O57413 358 A ATOM 1344 N N . VAL A 1 170 ? 8.506 13.997 2.733 1.00 10.38 ? 170 VAL A N 1 170 UNP O57413 359 V ATOM 1345 C CA . VAL A 1 170 ? 9.904 13.675 2.982 1.00 10.40 ? 170 VAL A CA 1 170 UNP O57413 359 V ATOM 1346 C C . VAL A 1 170 ? 10.643 14.962 3.364 1.00 9.22 ? 170 VAL A C 1 170 UNP O57413 359 V ATOM 1347 O O . VAL A 1 170 ? 10.383 16.020 2.819 1.00 10.27 ? 170 VAL A O 1 170 UNP O57413 359 V ATOM 1348 C CB . VAL A 1 170 ? 10.557 13.087 1.722 1.00 11.60 ? 170 VAL A CB 1 170 UNP O57413 359 V ATOM 1349 C CG1 . VAL A 1 170 ? 11.945 12.550 2.063 1.00 11.77 ? 170 VAL A CG1 1 170 UNP O57413 359 V ATOM 1350 C CG2 . VAL A 1 170 ? 9.630 12.024 1.114 1.00 14.65 ? 170 VAL A CG2 1 170 UNP O57413 359 V ATOM 1351 N N . ILE A 1 171 ? 11.535 14.858 4.326 1.00 8.24 ? 171 ILE A N 1 171 UNP O57413 360 I ATOM 1352 C CA . ILE A 1 171 ? 12.347 15.996 4.768 1.00 8.90 ? 171 ILE A CA 1 171 UNP O57413 360 I ATOM 1353 C C . ILE A 1 171 ? 13.355 16.315 3.651 1.00 10.51 ? 171 ILE A C 1 171 UNP O57413 360 I ATOM 1354 O O . ILE A 1 171 ? 13.628 15.470 2.801 1.00 11.69 ? 171 ILE A O 1 171 UNP O57413 360 I ATOM 1355 C CB . ILE A 1 171 ? 13.099 15.597 6.077 1.00 8.45 ? 171 ILE A CB 1 171 UNP O57413 360 I ATOM 1356 C CG1 . ILE A 1 171 ? 13.681 16.844 6.766 1.00 9.69 ? 171 ILE A CG1 1 171 UNP O57413 360 I ATOM 1357 C CG2 . ILE A 1 171 ? 14.265 14.644 5.759 1.00 9.81 ? 171 ILE A CG2 1 171 UNP O57413 360 I ATOM 1358 C CD1 . ILE A 1 171 ? 14.309 16.517 8.138 1.00 9.62 ? 171 ILE A CD1 1 171 UNP O57413 360 I ATOM 1359 N N . SER A 1 172 ? 13.872 17.545 3.628 1.00 11.70 ? 172 SER A N 1 172 UNP O57413 361 S ATOM 1360 C CA . SER A 1 172 ? 14.897 17.869 2.645 1.00 14.89 ? 172 SER A CA 1 172 UNP O57413 361 S ATOM 1361 C C . SER A 1 172 ? 15.862 18.875 3.232 1.00 16.16 ? 172 SER A C 1 172 UNP O57413 361 S ATOM 1362 O O . SER A 1 172 ? 15.606 19.472 4.271 1.00 14.61 ? 172 SER A O 1 172 UNP O57413 361 S ATOM 1363 C CB . SER A 1 172 ? 14.298 18.444 1.372 1.00 15.86 ? 172 SER A CB 1 172 UNP O57413 361 S ATOM 1364 O OG . SER A 1 172 ? 14.104 19.837 1.500 1.00 16.38 ? 172 SER A OG 1 172 UNP O57413 361 S ATOM 1365 N N . ASP A 1 173 ? 16.994 19.045 2.553 1.00 18.46 ? 173 ASP A N 1 173 UNP O57413 362 D ATOM 1366 C CA . ASP A 1 173 ? 18.014 19.983 2.973 1.00 20.87 ? 173 ASP A CA 1 173 UNP O57413 362 D ATOM 1367 C C . ASP A 1 173 ? 17.475 21.412 3.059 1.00 19.60 ? 173 ASP A C 1 173 UNP O57413 362 D ATOM 1368 O O . ASP A 1 173 ? 17.963 22.209 3.847 1.00 21.29 ? 173 ASP A O 1 173 UNP O57413 362 D ATOM 1369 C CB . ASP A 1 173 ? 19.187 19.944 1.974 1.00 24.33 ? 173 ASP A CB 1 173 UNP O57413 362 D ATOM 1370 C CG . ASP A 1 173 ? 19.924 18.611 1.979 1.00 27.90 ? 173 ASP A CG 1 173 UNP O57413 362 D ATOM 1371 O OD1 . ASP A 1 173 ? 19.272 17.546 1.886 1.00 29.89 ? 173 ASP A OD1 1 173 UNP O57413 362 D ATOM 1372 O OD2 . ASP A 1 173 ? 21.172 18.619 2.067 1.00 29.42 ? 173 ASP A OD2 1 173 UNP O57413 362 D ATOM 1373 N N . LYS A 1 174 ? 16.489 21.724 2.230 1.00 18.26 ? 174 LYS A N 1 174 UNP O57413 363 K ATOM 1374 C CA . LYS A 1 174 ? 15.868 23.051 2.180 1.00 17.97 ? 174 LYS A CA 1 174 UNP O57413 363 K ATOM 1375 C C . LYS A 1 174 ? 14.609 23.138 3.043 1.00 15.87 ? 174 LYS A C 1 174 UNP O57413 363 K ATOM 1376 O O . LYS A 1 174 ? 13.786 24.026 2.865 1.00 17.00 ? 174 LYS A O 1 174 UNP O57413 363 K ATOM 1377 C CB . LYS A 1 174 ? 15.516 23.384 0.724 1.00 19.60 ? 174 LYS A CB 1 174 UNP O57413 363 K ATOM 1378 C CG . LYS A 1 174 ? 16.742 23.667 -0.169 1.00 23.46 ? 174 LYS A CG 1 174 UNP O57413 363 K ATOM 1379 C CD . LYS A 1 174 ? 17.603 24.752 0.471 1.00 26.75 ? 174 LYS A CD 1 174 UNP O57413 363 K ATOM 1380 C CE . LYS A 1 174 ? 18.611 25.386 -0.487 1.00 28.97 ? 174 LYS A CE 1 174 UNP O57413 363 K ATOM 1381 N NZ . LYS A 1 174 ? 19.251 26.598 0.140 1.00 30.42 ? 174 LYS A NZ 1 174 UNP O57413 363 K ATOM 1382 N N . GLN A 1 175 ? 14.482 22.226 3.994 1.00 13.47 ? 175 GLN A N 1 175 UNP O57413 364 Q ATOM 1383 C CA . GLN A 1 175 ? 13.287 22.194 4.852 1.00 12.25 ? 175 GLN A CA 1 175 UNP O57413 364 Q ATOM 1384 C C . GLN A 1 175 ? 12.921 23.550 5.433 1.00 11.98 ? 175 GLN A C 1 175 UNP O57413 364 Q ATOM 1385 O O . GLN A 1 175 ? 13.756 24.260 6.017 1.00 12.34 ? 175 GLN A O 1 175 UNP O57413 364 Q ATOM 1386 C CB . GLN A 1 175 ? 13.509 21.193 5.998 1.00 11.11 ? 175 GLN A CB 1 175 UNP O57413 364 Q ATOM 1387 C CG . GLN A 1 175 ? 12.262 20.861 6.756 1.00 12.43 ? 175 GLN A CG 1 175 UNP O57413 364 Q ATOM 1388 C CD . GLN A 1 175 ? 11.287 20.155 5.877 1.00 12.34 ? 175 GLN A CD 1 175 UNP O57413 364 Q ATOM 1389 O OE1 . GLN A 1 175 ? 11.659 19.308 5.072 1.00 10.89 ? 175 GLN A OE1 1 175 UNP O57413 364 Q ATOM 1390 N NE2 . GLN A 1 175 ? 9.998 20.512 6.020 1.00 16.27 ? 175 GLN A NE2 1 175 UNP O57413 364 Q ATOM 1391 N N . SER A 1 176 ? 11.648 23.899 5.260 1.00 11.31 ? 176 SER A N 1 176 UNP O57413 365 S ATOM 1392 C CA . SER A 1 176 ? 11.095 25.136 5.750 1.00 11.10 ? 176 SER A CA 1 176 UNP O57413 365 S ATOM 1393 C C . SER A 1 176 ? 10.608 24.967 7.189 1.00 10.75 ? 176 SER A C 1 176 UNP O57413 365 S ATOM 1394 O O . SER A 1 176 ? 10.301 23.848 7.597 1.00 11.10 ? 176 SER A O 1 176 UNP O57413 365 S ATOM 1395 C CB . SER A 1 176 ? 9.893 25.494 4.856 1.00 13.07 ? 176 SER A CB 1 176 UNP O57413 365 S ATOM 1396 O OG . SER A 1 176 ? 9.125 26.533 5.397 1.00 14.77 ? 176 SER A OG 1 176 UNP O57413 365 S ATOM 1397 N N . LYS A 1 177 ? 10.528 26.060 7.933 1.00 9.01 ? 177 LYS A N 1 177 UNP O57413 366 K ATOM 1398 C CA . LYS A 1 177 ? 10.008 26.044 9.293 1.00 9.20 ? 177 LYS A CA 1 177 UNP O57413 366 K ATOM 1399 C C . LYS A 1 177 ? 8.520 26.339 9.329 1.00 8.08 ? 177 LYS A C 1 177 UNP O57413 366 K ATOM 1400 O O . LYS A 1 177 ? 7.961 26.507 10.408 1.00 9.15 ? 177 LYS A O 1 177 UNP O57413 366 K ATOM 1401 C CB . LYS A 1 177 ? 10.710 27.073 10.172 1.00 9.67 ? 177 LYS A CB 1 177 UNP O57413 366 K ATOM 1402 C CG . LYS A 1 177 ? 10.384 28.537 9.810 1.00 9.82 ? 177 LYS A CG 1 177 UNP O57413 366 K ATOM 1403 C CD . LYS A 1 177 ? 11.040 29.427 10.847 1.00 12.23 ? 177 LYS A CD 1 177 UNP O57413 366 K ATOM 1404 C CE . LYS A 1 177 ? 10.861 30.897 10.490 1.00 13.14 ? 177 LYS A CE 1 177 UNP O57413 366 K ATOM 1405 N NZ . LYS A 1 177 ? 11.317 31.744 11.651 1.00 12.19 ? 177 LYS A NZ 1 177 UNP O57413 366 K ATOM 1406 N N . LEU A 1 178 ? 7.885 26.404 8.158 1.00 7.56 ? 178 LEU A N 1 178 UNP O57413 367 L ATOM 1407 C CA . LEU A 1 178 ? 6.450 26.720 8.105 1.00 7.73 ? 178 LEU A CA 1 178 UNP O57413 367 L ATOM 1408 C C . LEU A 1 178 ? 5.511 25.533 7.899 1.00 7.29 ? 178 LEU A C 1 178 UNP O57413 367 L ATOM 1409 O O . LEU A 1 178 ? 5.849 24.576 7.234 1.00 7.81 ? 178 LEU A O 1 178 UNP O57413 367 L ATOM 1410 C CB . LEU A 1 178 ? 6.179 27.676 6.931 1.00 8.00 ? 178 LEU A CB 1 178 UNP O57413 367 L ATOM 1411 C CG . LEU A 1 178 ? 6.927 29.012 6.953 1.00 9.07 ? 178 LEU A CG 1 178 UNP O57413 367 L ATOM 1412 C CD1 . LEU A 1 178 ? 6.593 29.796 5.657 1.00 10.01 ? 178 LEU A CD1 1 178 UNP O57413 367 L ATOM 1413 C CD2 . LEU A 1 178 ? 6.484 29.818 8.196 1.00 9.83 ? 178 LEU A CD2 1 178 UNP O57413 367 L ATOM 1414 N N . PHE A 1 179 ? 4.324 25.644 8.496 1.00 7.59 ? 179 PHE A N 1 179 UNP O57413 368 F ATOM 1415 C CA . PHE A 1 179 ? 3.262 24.680 8.243 1.00 7.17 ? 179 PHE A CA 1 179 UNP O57413 368 F ATOM 1416 C C . PHE A 1 179 ? 2.499 25.183 7.022 1.00 8.22 ? 179 PHE A C 1 179 UNP O57413 368 F ATOM 1417 O O . PHE A 1 179 ? 2.211 26.403 6.882 1.00 9.11 ? 179 PHE A O 1 179 UNP O57413 368 F ATOM 1418 C CB . PHE A 1 179 ? 2.298 24.631 9.408 1.00 7.50 ? 179 PHE A CB 1 179 UNP O57413 368 F ATOM 1419 C CG . PHE A 1 179 ? 2.776 23.831 10.568 1.00 7.25 ? 179 PHE A CG 1 179 UNP O57413 368 F ATOM 1420 C CD1 . PHE A 1 179 ? 2.806 22.436 10.520 1.00 7.32 ? 179 PHE A CD1 1 179 UNP O57413 368 F ATOM 1421 C CD2 . PHE A 1 179 ? 3.160 24.489 11.737 1.00 7.64 ? 179 PHE A CD2 1 179 UNP O57413 368 F ATOM 1422 C CE1 . PHE A 1 179 ? 3.203 21.698 11.621 1.00 8.41 ? 179 PHE A CE1 1 179 UNP O57413 368 F ATOM 1423 C CE2 . PHE A 1 179 ? 3.572 23.763 12.854 1.00 8.19 ? 179 PHE A CE2 1 179 UNP O57413 368 F ATOM 1424 C CZ . PHE A 1 179 ? 3.593 22.347 12.794 1.00 8.21 ? 179 PHE A CZ 1 179 UNP O57413 368 F ATOM 1425 N N . SER A 1 180 ? 2.176 24.248 6.132 1.00 8.06 ? 180 SER A N 1 180 UNP O57413 369 S ATOM 1426 C CA . SER A 1 180 ? 1.394 24.533 4.923 1.00 7.48 ? 180 SER A CA 1 180 UNP O57413 369 S ATOM 1427 C C . SER A 1 180 ? -0.077 24.808 5.250 1.00 7.77 ? 180 SER A C 1 180 UNP O57413 369 S ATOM 1428 O O . SER A 1 180 ? -0.545 24.617 6.383 1.00 7.84 ? 180 SER A O 1 180 UNP O57413 369 S ATOM 1429 C CB . SER A 1 180 ? 1.380 23.318 4.022 1.00 6.82 ? 180 SER A CB 1 180 UNP O57413 369 S ATOM 1430 O OG . SER A 1 180 ? 0.545 22.328 4.652 1.00 6.55 ? 180 SER A OG 1 180 UNP O57413 369 S ATOM 1431 N N . ASP A 1 181 ? -0.826 25.214 4.221 1.00 7.80 ? 181 ASP A N 1 181 UNP O57413 370 D ATOM 1432 C CA . ASP A 1 181 ? -2.262 25.409 4.427 1.00 9.35 ? 181 ASP A CA 1 181 UNP O57413 370 D ATOM 1433 C C . ASP A 1 181 ? -2.949 24.050 4.641 1.00 8.60 ? 181 ASP A C 1 181 UNP O57413 370 D ATOM 1434 O O . ASP A 1 181 ? -3.983 23.983 5.300 1.00 9.23 ? 181 ASP A O 1 181 UNP O57413 370 D ATOM 1435 C CB . ASP A 1 181 ? -2.919 26.113 3.234 1.00 10.98 ? 181 ASP A CB 1 181 UNP O57413 370 D ATOM 1436 C CG . ASP A 1 181 ? -4.422 26.318 3.444 1.00 14.98 ? 181 ASP A CG 1 181 UNP O57413 370 D ATOM 1437 O OD1 . ASP A 1 181 ? -4.779 27.054 4.376 1.00 17.61 ? 181 ASP A OD1 1 181 UNP O57413 370 D ATOM 1438 O OD2 . ASP A 1 181 ? -5.250 25.743 2.699 1.00 16.60 ? 181 ASP A OD2 1 181 UNP O57413 370 D ATOM 1439 N N . CYS A 1 182 ? -2.381 22.976 4.062 1.00 8.78 ? 182 CYS A N 1 182 UNP O57413 371 C ATOM 1440 C CA . CYS A 1 182 ? -2.921 21.624 4.288 1.00 8.39 ? 182 CYS A CA 1 182 UNP O57413 371 C ATOM 1441 C C . CYS A 1 182 ? -2.879 21.356 5.789 1.00 7.73 ? 182 CYS A C 1 182 UNP O57413 371 C ATOM 1442 O O . CYS A 1 182 ? -3.839 20.885 6.400 1.00 8.75 ? 182 CYS A O 1 182 UNP O57413 371 C ATOM 1443 C CB . CYS A 1 182 ? -2.030 20.563 3.652 1.00 10.36 ? 182 CYS A CB 1 182 UNP O57413 371 C ATOM 1444 S SG . CYS A 1 182 ? -1.998 20.357 1.832 1.00 14.68 ? 182 CYS A SG 1 182 UNP O57413 371 C ATOM 1445 N N . SER A 1 183 ? -1.736 21.668 6.392 1.00 6.65 ? 183 SER A N 1 183 UNP O57413 372 S ATOM 1446 C CA . SER A 1 183 ? -1.525 21.413 7.816 1.00 7.32 ? 183 SER A CA 1 183 UNP O57413 372 S ATOM 1447 C C . SER A 1 183 ? -2.414 22.246 8.708 1.00 7.27 ? 183 SER A C 1 183 UNP O57413 372 S ATOM 1448 O O . SER A 1 183 ? -2.970 21.748 9.662 1.00 8.09 ? 183 SER A O 1 183 UNP O57413 372 S ATOM 1449 C CB . SER A 1 183 ? -0.080 21.695 8.186 1.00 6.47 ? 183 SER A CB 1 183 UNP O57413 372 S ATOM 1450 O OG . SER A 1 183 ? 0.757 20.781 7.522 1.00 8.62 ? 183 SER A OG 1 183 UNP O57413 372 S ATOM 1451 N N . LYS A 1 184 ? -2.532 23.523 8.386 1.00 7.45 ? 184 LYS A N 1 184 UNP O57413 373 K ATOM 1452 C CA . LYS A 1 184 ? -3.403 24.375 9.171 1.00 7.87 ? 184 LYS A CA 1 184 UNP O57413 373 K ATOM 1453 C C . LYS A 1 184 ? -4.877 23.894 9.058 1.00 7.81 ? 184 LYS A C 1 184 UNP O57413 373 K ATOM 1454 O O . LYS A 1 184 ? -5.613 23.880 10.052 1.00 8.49 ? 184 LYS A O 1 184 UNP O57413 373 K ATOM 1455 C CB . LYS A 1 184 ? -3.225 25.830 8.720 1.00 8.44 ? 184 LYS A CB 1 184 UNP O57413 373 K ATOM 1456 C CG . LYS A 1 184 ? -1.804 26.363 9.026 1.00 9.45 ? 184 LYS A CG 1 184 UNP O57413 373 K ATOM 1457 C CD . LYS A 1 184 ? -1.630 27.783 8.530 1.00 11.32 ? 184 LYS A CD 1 184 UNP O57413 373 K ATOM 1458 C CE . LYS A 1 184 ? -0.199 28.208 8.712 1.00 13.06 ? 184 LYS A CE 1 184 UNP O57413 373 K ATOM 1459 N NZ . LYS A 1 184 ? -0.045 29.616 8.255 1.00 15.41 ? 184 LYS A NZ 1 184 UNP O57413 373 K ATOM 1460 N N . ASP A 1 185 ? -5.271 23.465 7.861 1.00 8.13 ? 185 ASP A N 1 185 UNP O57413 374 D ATOM 1461 C CA . ASP A 1 185 ? -6.641 22.974 7.676 1.00 9.17 ? 185 ASP A CA 1 185 UNP O57413 374 D ATOM 1462 C C . ASP A 1 185 ? -6.840 21.681 8.502 1.00 9.13 ? 185 ASP A C 1 185 UNP O57413 374 D ATOM 1463 O O . ASP A 1 185 ? -7.883 21.484 9.117 1.00 9.90 ? 185 ASP A O 1 185 UNP O57413 374 D ATOM 1464 C CB . ASP A 1 185 ? -6.909 22.738 6.180 1.00 9.97 ? 185 ASP A CB 1 185 UNP O57413 374 D ATOM 1465 C CG . ASP A 1 185 ? -7.088 24.047 5.375 1.00 11.69 ? 185 ASP A CG 1 185 UNP O57413 374 D ATOM 1466 O OD1 . ASP A 1 185 ? -6.988 25.149 5.920 1.00 13.98 ? 185 ASP A OD1 1 185 UNP O57413 374 D ATOM 1467 O OD2 . ASP A 1 185 ? -7.331 23.952 4.162 1.00 12.27 ? 185 ASP A OD2 1 185 UNP O57413 374 D ATOM 1468 N N . TYR A 1 186 ? -5.857 20.783 8.526 1.00 8.15 ? 186 TYR A N 1 186 UNP O57413 375 Y ATOM 1469 C CA . TYR A 1 186 ? -5.989 19.588 9.365 1.00 9.05 ? 186 TYR A CA 1 186 UNP O57413 375 Y ATOM 1470 C C . TYR A 1 186 ? -6.085 19.962 10.846 1.00 9.09 ? 186 TYR A C 1 186 UNP O57413 375 Y ATOM 1471 O O . TYR A 1 186 ? -6.802 19.319 11.587 1.00 9.59 ? 186 TYR A O 1 186 UNP O57413 375 Y ATOM 1472 C CB . TYR A 1 186 ? -4.771 18.681 9.211 1.00 8.89 ? 186 TYR A CB 1 186 UNP O57413 375 Y ATOM 1473 C CG . TYR A 1 186 ? -4.762 17.813 7.978 1.00 8.48 ? 186 TYR A CG 1 186 UNP O57413 375 Y ATOM 1474 C CD1 . TYR A 1 186 ? -3.692 17.851 7.116 1.00 8.05 ? 186 TYR A CD1 1 186 UNP O57413 375 Y ATOM 1475 C CD2 . TYR A 1 186 ? -5.825 16.946 7.701 1.00 9.42 ? 186 TYR A CD2 1 186 UNP O57413 375 Y ATOM 1476 C CE1 . TYR A 1 186 ? -3.657 17.034 5.954 1.00 8.99 ? 186 TYR A CE1 1 186 UNP O57413 375 Y ATOM 1477 C CE2 . TYR A 1 186 ? -5.806 16.131 6.543 1.00 10.20 ? 186 TYR A CE2 1 186 UNP O57413 375 Y ATOM 1478 C CZ . TYR A 1 186 ? -4.719 16.192 5.694 1.00 10.22 ? 186 TYR A CZ 1 186 UNP O57413 375 Y ATOM 1479 O OH . TYR A 1 186 ? -4.677 15.365 4.586 1.00 12.89 ? 186 TYR A OH 1 186 UNP O57413 375 Y ATOM 1480 N N . TYR A 1 187 ? -5.319 20.965 11.269 1.00 8.86 ? 187 TYR A N 1 187 UNP O57413 376 Y ATOM 1481 C CA . TYR A 1 187 ? -5.355 21.371 12.676 1.00 8.85 ? 187 TYR A CA 1 187 UNP O57413 376 Y ATOM 1482 C C . TYR A 1 187 ? -6.752 21.954 13.000 1.00 9.91 ? 187 TYR A C 1 187 UNP O57413 376 Y ATOM 1483 O O . TYR A 1 187 ? -7.287 21.690 14.067 1.00 10.14 ? 187 TYR A O 1 187 UNP O57413 376 Y ATOM 1484 C CB . TYR A 1 187 ? -4.217 22.368 12.956 1.00 9.16 ? 187 TYR A CB 1 187 UNP O57413 376 Y ATOM 1485 C CG . TYR A 1 187 ? -4.153 22.814 14.403 1.00 9.31 ? 187 TYR A CG 1 187 UNP O57413 376 Y ATOM 1486 C CD1 . TYR A 1 187 ? -4.088 21.880 15.430 1.00 9.18 ? 187 TYR A CD1 1 187 UNP O57413 376 Y ATOM 1487 C CD2 . TYR A 1 187 ? -4.147 24.159 14.730 1.00 9.55 ? 187 TYR A CD2 1 187 UNP O57413 376 Y ATOM 1488 C CE1 . TYR A 1 187 ? -4.014 22.282 16.776 1.00 8.46 ? 187 TYR A CE1 1 187 UNP O57413 376 Y ATOM 1489 C CE2 . TYR A 1 187 ? -4.076 24.574 16.053 1.00 9.00 ? 187 TYR A CE2 1 187 UNP O57413 376 Y ATOM 1490 C CZ . TYR A 1 187 ? -4.010 23.634 17.070 1.00 9.57 ? 187 TYR A CZ 1 187 UNP O57413 376 Y ATOM 1491 O OH . TYR A 1 187 ? -3.960 24.015 18.400 1.00 9.90 ? 187 TYR A OH 1 187 UNP O57413 376 Y ATOM 1492 N N . GLN A 1 188 ? -7.315 22.736 12.092 1.00 10.20 ? 188 GLN A N 1 188 UNP O57413 377 Q ATOM 1493 C CA . GLN A 1 188 ? -8.663 23.277 12.312 1.00 11.70 ? 188 GLN A CA 1 188 UNP O57413 377 Q ATOM 1494 C C . GLN A 1 188 ? -9.639 22.113 12.478 1.00 11.88 ? 188 GLN A C 1 188 UNP O57413 377 Q ATOM 1495 O O . GLN A 1 188 ? -10.462 22.113 13.388 1.00 11.15 ? 188 GLN A O 1 188 UNP O57413 377 Q ATOM 1496 C CB . GLN A 1 188 ? -9.104 24.158 11.147 1.00 13.09 ? 188 GLN A CB 1 188 UNP O57413 377 Q ATOM 1497 C CG . GLN A 1 188 ? -10.510 24.713 11.360 1.00 17.12 ? 188 GLN A CG 1 188 UNP O57413 377 Q ATOM 1498 C CD . GLN A 1 188 ? -10.616 25.509 12.646 1.00 18.37 ? 188 GLN A CD 1 188 UNP O57413 377 Q ATOM 1499 O OE1 . GLN A 1 188 ? -11.323 25.125 13.596 1.00 23.03 ? 188 GLN A OE1 1 188 UNP O57413 377 Q ATOM 1500 N NE2 . GLN A 1 188 ? -9.902 26.599 12.705 1.00 17.83 ? 188 GLN A NE2 1 188 UNP O57413 377 Q ATOM 1501 N N . THR A 1 189 ? -9.534 21.107 11.615 1.00 11.94 ? 189 THR A N 1 189 UNP O57413 378 T ATOM 1502 C CA . THR A 1 189 ? -10.393 19.938 11.723 1.00 12.05 ? 189 THR A CA 1 189 UNP O57413 378 T ATOM 1503 C C . THR A 1 189 ? -10.209 19.243 13.074 1.00 12.71 ? 189 THR A C 1 189 UNP O57413 378 T ATOM 1504 O O . THR A 1 189 ? -11.178 18.804 13.680 1.00 13.89 ? 189 THR A O 1 189 UNP O57413 378 T ATOM 1505 C CB . THR A 1 189 ? -10.099 18.967 10.557 1.00 12.29 ? 189 THR A CB 1 189 UNP O57413 378 T ATOM 1506 O OG1 . THR A 1 189 ? -10.466 19.608 9.331 1.00 14.24 ? 189 THR A OG1 1 189 UNP O57413 378 T ATOM 1507 C CG2 . THR A 1 189 ? -10.907 17.666 10.686 1.00 14.28 ? 189 THR A CG2 1 189 UNP O57413 378 T ATOM 1508 N N . PHE A 1 190 ? -8.964 19.125 13.538 1.00 11.64 ? 190 PHE A N 1 190 UNP O57413 379 F ATOM 1509 C CA . PHE A 1 190 ? -8.683 18.519 14.823 1.00 12.11 ? 190 PHE A CA 1 190 UNP O57413 379 F ATOM 1510 C C . PHE A 1 190 ? -9.309 19.321 15.972 1.00 12.30 ? 190 PHE A C 1 190 UNP O57413 379 F ATOM 1511 O O . PHE A 1 190 ? -9.887 18.740 16.881 1.00 12.46 ? 190 PHE A O 1 190 UNP O57413 379 F ATOM 1512 C CB . PHE A 1 190 ? -7.167 18.416 14.991 1.00 11.14 ? 190 PHE A CB 1 190 UNP O57413 379 F ATOM 1513 C CG . PHE A 1 190 ? -6.736 17.715 16.245 1.00 11.98 ? 190 PHE A CG 1 190 UNP O57413 379 F ATOM 1514 C CD1 . PHE A 1 190 ? -6.886 16.344 16.376 1.00 12.39 ? 190 PHE A CD1 1 190 UNP O57413 379 F ATOM 1515 C CD2 . PHE A 1 190 ? -6.175 18.443 17.286 1.00 13.13 ? 190 PHE A CD2 1 190 UNP O57413 379 F ATOM 1516 C CE1 . PHE A 1 190 ? -6.487 15.685 17.536 1.00 13.98 ? 190 PHE A CE1 1 190 UNP O57413 379 F ATOM 1517 C CE2 . PHE A 1 190 ? -5.763 17.791 18.461 1.00 14.14 ? 190 PHE A CE2 1 190 UNP O57413 379 F ATOM 1518 C CZ . PHE A 1 190 ? -5.927 16.412 18.571 1.00 14.29 ? 190 PHE A CZ 1 190 UNP O57413 379 F ATOM 1519 N N . LEU A 1 191 ? -9.174 20.643 15.957 1.00 12.35 ? 191 LEU A N 1 191 UNP O57413 380 L ATOM 1520 C CA . LEU A 1 191 ? -9.764 21.467 17.016 1.00 14.23 ? 191 LEU A CA 1 191 UNP O57413 380 L ATOM 1521 C C . LEU A 1 191 ? -11.285 21.402 16.997 1.00 15.53 ? 191 LEU A C 1 191 UNP O57413 380 L ATOM 1522 O O . LEU A 1 191 ? -11.915 21.444 18.054 1.00 16.37 ? 191 LEU A O 1 191 UNP O57413 380 L ATOM 1523 C CB . LEU A 1 191 ? -9.317 22.920 16.890 1.00 13.81 ? 191 LEU A CB 1 191 UNP O57413 380 L ATOM 1524 C CG . LEU A 1 191 ? -7.847 23.197 17.218 1.00 13.72 ? 191 LEU A CG 1 191 UNP O57413 380 L ATOM 1525 C CD1 . LEU A 1 191 ? -7.620 24.689 17.112 1.00 14.76 ? 191 LEU A CD1 1 191 UNP O57413 380 L ATOM 1526 C CD2 . LEU A 1 191 ? -7.497 22.700 18.606 1.00 15.19 ? 191 LEU A CD2 1 191 UNP O57413 380 L ATOM 1527 N N . THR A 1 192 ? -11.871 21.264 15.817 1.00 16.18 ? 192 THR A N 1 192 UNP O57413 381 T ATOM 1528 C CA . THR A 1 192 ? -13.322 21.196 15.713 1.00 18.24 ? 192 THR A CA 1 192 UNP O57413 381 T ATOM 1529 C C . THR A 1 192 ? -13.875 19.832 16.111 1.00 18.77 ? 192 THR A C 1 192 UNP O57413 381 T ATOM 1530 O O . THR A 1 192 ? -14.860 19.755 16.856 1.00 20.40 ? 192 THR A O 1 192 UNP O57413 381 T ATOM 1531 C CB . THR A 1 192 ? -13.782 21.481 14.279 1.00 18.20 ? 192 THR A CB 1 192 UNP O57413 381 T ATOM 1532 O OG1 . THR A 1 192 ? -13.380 22.803 13.900 1.00 19.28 ? 192 THR A OG1 1 192 UNP O57413 381 T ATOM 1533 C CG2 . THR A 1 192 ? -15.313 21.348 14.169 1.00 19.07 ? 192 THR A CG2 1 192 UNP O57413 381 T ATOM 1534 N N . ASN A 1 193 ? -13.241 18.762 15.647 1.00 19.05 ? 193 ASN A N 1 193 UNP O57413 382 N ATOM 1535 C CA . ASN A 1 193 ? -13.757 17.418 15.928 1.00 19.64 ? 193 ASN A CA 1 193 UNP O57413 382 N ATOM 1536 C C . ASN A 1 193 ? -13.244 16.674 17.159 1.00 19.88 ? 193 ASN A C 1 193 UNP O57413 382 N ATOM 1537 O O . ASN A 1 193 ? -13.968 15.858 17.728 1.00 20.76 ? 193 ASN A O 1 193 UNP O57413 382 N ATOM 1538 C CB . ASN A 1 193 ? -13.561 16.514 14.717 1.00 20.70 ? 193 ASN A CB 1 193 UNP O57413 382 N ATOM 1539 C CG . ASN A 1 193 ? -14.252 17.039 13.468 1.00 21.32 ? 193 ASN A CG 1 193 UNP O57413 382 N ATOM 1540 O OD1 . ASN A 1 193 ? -15.190 17.841 13.544 1.00 22.95 ? 193 ASN A OD1 1 193 UNP O57413 382 N ATOM 1541 N ND2 . ASN A 1 193 ? -13.800 16.582 12.322 1.00 22.14 ? 193 ASN A ND2 1 193 UNP O57413 382 N ATOM 1542 N N . ASP A 1 194 ? -11.999 16.921 17.557 1.00 19.13 ? 194 ASP A N 1 194 UNP O57413 383 D ATOM 1543 C CA . ASP A 1 194 ? -11.416 16.232 18.703 1.00 20.00 ? 194 ASP A CA 1 194 UNP O57413 383 D ATOM 1544 C C . ASP A 1 194 ? -11.316 17.192 19.885 1.00 19.35 ? 194 ASP A C 1 194 UNP O57413 383 D ATOM 1545 O O . ASP A 1 194 ? -11.785 16.879 20.966 1.00 19.16 ? 194 ASP A O 1 194 UNP O57413 383 D ATOM 1546 C CB . ASP A 1 194 ? -10.034 15.666 18.319 1.00 21.31 ? 194 ASP A CB 1 194 UNP O57413 383 D ATOM 1547 C CG . ASP A 1 194 ? -9.480 14.664 19.345 1.00 23.50 ? 194 ASP A CG 1 194 UNP O57413 383 D ATOM 1548 O OD1 . ASP A 1 194 ? -9.044 13.558 18.936 1.00 24.57 ? 194 ASP A OD1 1 194 UNP O57413 383 D ATOM 1549 O OD2 . ASP A 1 194 ? -9.451 14.975 20.556 1.00 24.20 ? 194 ASP A OD2 1 194 UNP O57413 383 D ATOM 1550 N N . ASN A 1 195 ? -10.697 18.352 19.676 1.00 19.47 ? 195 ASN A N 1 195 UNP O57413 384 N ATOM 1551 C CA . ASN A 1 195 ? -10.552 19.381 20.702 1.00 18.93 ? 195 ASN A CA 1 195 UNP O57413 384 N ATOM 1552 C C . ASN A 1 195 ? -10.187 18.815 22.072 1.00 18.64 ? 195 ASN A C 1 195 UNP O57413 384 N ATOM 1553 O O . ASN A 1 195 ? -10.901 19.004 23.056 1.00 18.58 ? 195 ASN A O 1 195 UNP O57413 384 N ATOM 1554 C CB . ASN A 1 195 ? -11.851 20.183 20.779 1.00 20.39 ? 195 ASN A CB 1 195 UNP O57413 384 N ATOM 1555 C CG . ASN A 1 195 ? -11.696 21.472 21.535 1.00 21.69 ? 195 ASN A CG 1 195 UNP O57413 384 N ATOM 1556 O OD1 . ASN A 1 195 ? -10.639 22.093 21.508 1.00 22.10 ? 195 ASN A OD1 1 195 UNP O57413 384 N ATOM 1557 N ND2 . ASN A 1 195 ? -12.764 21.906 22.190 1.00 23.06 ? 195 ASN A ND2 1 195 UNP O57413 384 N ATOM 1558 N N . PRO A 1 196 ? -9.045 18.134 22.162 1.00 17.90 ? 196 PRO A N 1 196 UNP O57413 385 P ATOM 1559 C CA . PRO A 1 196 ? -8.616 17.545 23.437 1.00 17.26 ? 196 PRO A CA 1 196 UNP O57413 385 P ATOM 1560 C C . PRO A 1 196 ? -8.465 18.569 24.555 1.00 17.36 ? 196 PRO A C 1 196 UNP O57413 385 P ATOM 1561 O O . PRO A 1 196 ? -7.940 19.659 24.360 1.00 15.76 ? 196 PRO A O 1 196 UNP O57413 385 P ATOM 1562 C CB . PRO A 1 196 ? -7.297 16.859 23.074 1.00 18.25 ? 196 PRO A CB 1 196 UNP O57413 385 P ATOM 1563 C CG . PRO A 1 196 ? -6.788 17.683 21.972 1.00 17.50 ? 196 PRO A CG 1 196 UNP O57413 385 P ATOM 1564 C CD . PRO A 1 196 ? -8.009 17.973 21.133 1.00 18.24 ? 196 PRO A CD 1 196 UNP O57413 385 P ATOM 1565 N N . GLN A 1 197 ? -8.925 18.213 25.743 1.00 17.30 ? 197 GLN A N 1 197 UNP O57413 386 Q ATOM 1566 C CA . GLN A 1 197 ? -8.880 19.146 26.846 1.00 18.13 ? 197 GLN A CA 1 197 UNP O57413 386 Q ATOM 1567 C C . GLN A 1 197 ? -7.524 19.512 27.426 1.00 17.06 ? 197 GLN A C 1 197 UNP O57413 386 Q ATOM 1568 O O . GLN A 1 197 ? -7.351 20.631 27.924 1.00 17.20 ? 197 GLN A O 1 197 UNP O57413 386 Q ATOM 1569 C CB . GLN A 1 197 ? -9.776 18.634 27.982 1.00 21.34 ? 197 GLN A CB 1 197 UNP O57413 386 Q ATOM 1570 C CG . GLN A 1 197 ? -9.736 19.451 29.270 1.00 26.13 ? 197 GLN A CG 1 197 UNP O57413 386 Q ATOM 1571 C CD . GLN A 1 197 ? -10.460 20.769 29.147 1.00 28.22 ? 197 GLN A CD 1 197 UNP O57413 386 Q ATOM 1572 O OE1 . GLN A 1 197 ? -11.558 20.842 28.569 1.00 30.50 ? 197 GLN A OE1 1 197 UNP O57413 386 Q ATOM 1573 N NE2 . GLN A 1 197 ? -9.863 21.822 29.700 1.00 29.74 ? 197 GLN A NE2 1 197 UNP O57413 386 Q ATOM 1574 N N . CYS A 1 198 ? -6.542 18.620 27.350 1.00 15.89 ? 198 CYS A N 1 198 UNP O57413 387 C ATOM 1575 C CA . CYS A 1 198 ? -5.268 18.931 27.990 1.00 15.37 ? 198 CYS A CA 1 198 UNP O57413 387 C ATOM 1576 C C . CYS A 1 198 ? -4.510 20.107 27.425 1.00 15.44 ? 198 CYS A C 1 198 UNP O57413 387 C ATOM 1577 O O . CYS A 1 198 ? -3.747 20.753 28.150 1.00 15.93 ? 198 CYS A O 1 198 UNP O57413 387 C ATOM 1578 C CB . CYS A 1 198 ? -4.363 17.685 28.039 1.00 15.50 ? 198 CYS A CB 1 198 UNP O57413 387 C ATOM 1579 S SG . CYS A 1 198 ? -3.239 17.321 26.645 1.00 16.32 ? 198 CYS A SG 1 198 UNP O57413 387 C ATOM 1580 N N . ILE A 1 199 ? -4.715 20.388 26.146 1.00 14.26 ? 199 ILE A N 1 199 UNP O57413 388 I ATOM 1581 C CA . ILE A 1 199 ? -4.002 21.505 25.547 1.00 14.10 ? 199 ILE A CA 1 199 UNP O57413 388 I ATOM 1582 C C . ILE A 1 199 ? -4.769 22.812 25.668 1.00 14.85 ? 199 ILE A C 1 199 UNP O57413 388 I ATOM 1583 O O . ILE A 1 199 ? -4.334 23.839 25.176 1.00 12.77 ? 199 ILE A O 1 199 UNP O57413 388 I ATOM 1584 C CB . ILE A 1 199 ? -3.645 21.221 24.076 1.00 14.11 ? 199 ILE A CB 1 199 UNP O57413 388 I ATOM 1585 C CG1 . ILE A 1 199 ? -4.908 20.991 23.256 1.00 14.55 ? 199 ILE A CG1 1 199 UNP O57413 388 I ATOM 1586 C CG2 . ILE A 1 199 ? -2.704 19.978 24.003 1.00 14.74 ? 199 ILE A CG2 1 199 UNP O57413 388 I ATOM 1587 C CD1 . ILE A 1 199 ? -4.670 20.936 21.747 1.00 15.57 ? 199 ILE A CD1 1 199 UNP O57413 388 I ATOM 1588 N N . LEU A 1 200 ? -5.893 22.778 26.364 1.00 17.13 ? 200 LEU A N 1 200 UNP O57413 389 L ATOM 1589 C CA . LEU A 1 200 ? -6.651 24.005 26.578 1.00 20.31 ? 200 LEU A CA 1 200 UNP O57413 389 L ATOM 1590 C C . LEU A 1 200 ? -6.117 24.617 27.858 1.00 22.22 ? 200 LEU A C 1 200 UNP O57413 389 L ATOM 1591 O O . LEU A 1 200 ? -6.262 25.811 28.089 1.00 23.49 ? 200 LEU A O 1 200 UNP O57413 389 L ATOM 1592 C CB . LEU A 1 200 ? -8.149 23.693 26.732 1.00 21.75 ? 200 LEU A CB 1 200 UNP O57413 389 L ATOM 1593 C CG . LEU A 1 200 ? -8.929 23.839 25.421 1.00 23.43 ? 200 LEU A CG 1 200 UNP O57413 389 L ATOM 1594 C CD1 . LEU A 1 200 ? -9.929 22.700 25.186 1.00 26.00 ? 200 LEU A CD1 1 200 UNP O57413 389 L ATOM 1595 C CD2 . LEU A 1 200 ? -9.635 25.176 25.469 1.00 25.41 ? 200 LEU A CD2 1 200 UNP O57413 389 L ATOM 1596 N N . ASN A 1 201 ? -5.458 23.779 28.654 1.00 23.59 ? 201 ASN A N 1 201 UNP O57413 390 N ATOM 1597 C CA . ASN A 1 201 ? -4.905 24.165 29.950 1.00 24.95 ? 201 ASN A CA 1 201 UNP O57413 390 N ATOM 1598 C C . ASN A 1 201 ? -3.506 24.780 29.948 1.00 24.73 ? 201 ASN A C 1 201 UNP O57413 390 N ATOM 1599 O O . ASN A 1 201 ? -2.533 24.123 29.614 1.00 24.13 ? 201 ASN A O 1 201 UNP O57413 390 N ATOM 1600 C CB . ASN A 1 201 ? -4.898 22.951 30.875 1.00 26.61 ? 201 ASN A CB 1 201 UNP O57413 390 N ATOM 1601 C CG . ASN A 1 201 ? -6.277 22.321 31.029 1.00 28.47 ? 201 ASN A CG 1 201 UNP O57413 390 N ATOM 1602 O OD1 . ASN A 1 201 ? -7.294 23.025 31.109 1.00 29.66 ? 201 ASN A OD1 1 201 UNP O57413 390 N ATOM 1603 N ND2 . ASN A 1 201 ? -6.315 20.996 31.088 1.00 28.89 ? 201 ASN A ND2 1 201 UNP O57413 390 N ATOM 1604 N N . ALA A 1 202 ? -3.415 26.046 30.326 1.00 24.33 ? 202 ALA A N 1 202 UNP O57413 391 A ATOM 1605 C CA . ALA A 1 202 ? -2.118 26.706 30.410 1.00 24.45 ? 202 ALA A CA 1 202 UNP O57413 391 A ATOM 1606 C C . ALA A 1 202 ? -1.375 26.137 31.626 1.00 23.88 ? 202 ALA A C 1 202 UNP O57413 391 A ATOM 1607 O O . ALA A 1 202 ? -1.996 25.657 32.583 1.00 23.81 ? 202 ALA A O 1 202 UNP O57413 391 A ATOM 1608 C CB . ALA A 1 202 ? -2.321 28.186 30.561 1.00 24.70 ? 202 ALA A CB 1 202 UNP O57413 391 A ATOM 1609 N N . PRO A 1 203 ? -0.036 26.158 31.603 1.00 23.07 ? 203 PRO A N 1 203 UNP O57413 392 P ATOM 1610 C CA . PRO A 1 203 ? 0.724 25.629 32.744 1.00 22.73 ? 203 PRO A CA 1 203 UNP O57413 392 P ATOM 1611 C C . PRO A 1 203 ? 0.447 26.424 34.023 1.00 22.60 ? 203 PRO A C 1 203 UNP O57413 392 P ATOM 1612 O O . PRO A 1 203 ? 0.246 27.658 33.914 1.00 22.09 ? 203 PRO A O 1 203 UNP O57413 392 P ATOM 1613 C CB . PRO A 1 203 ? 2.171 25.765 32.290 1.00 23.06 ? 203 PRO A CB 1 203 UNP O57413 392 P ATOM 1614 C CG . PRO A 1 203 ? 2.062 25.656 30.752 1.00 22.50 ? 203 PRO A CG 1 203 UNP O57413 392 P ATOM 1615 C CD . PRO A 1 203 ? 0.855 26.514 30.481 1.00 22.66 ? 203 PRO A CD 1 203 UNP O57413 392 P ATOM 1616 O OXT . PRO A 1 203 ? 0.456 25.800 35.097 1.00 20.94 ? 203 PRO A OXT 1 203 UNP O57413 392 P HETATM 1617 N N . PCA B 2 1 ? 14.466 8.947 3.574 1.00 16.79 ? 251 PCA B N 1 1 ? ? ? ? HETATM 1618 C CA . PCA B 2 1 ? 14.234 9.157 5.014 1.00 14.54 ? 251 PCA B CA 1 1 ? ? ? ? HETATM 1619 C CB . PCA B 2 1 ? 14.762 10.540 5.375 1.00 15.77 ? 251 PCA B CB 1 1 ? ? ? ? HETATM 1620 C CG . PCA B 2 1 ? 14.968 11.206 4.072 1.00 16.14 ? 251 PCA B CG 1 1 ? ? ? ? HETATM 1621 C CD . PCA B 2 1 ? 14.805 10.124 3.049 1.00 17.21 ? 251 PCA B CD 1 1 ? ? ? ? HETATM 1622 O OE . PCA B 2 1 ? 14.981 10.306 1.832 1.00 19.27 ? 251 PCA B OE 1 1 ? ? ? ? HETATM 1623 C C . PCA B 2 1 ? 12.731 9.111 5.197 1.00 14.13 ? 251 PCA B C 1 1 ? ? ? ? HETATM 1624 O O . PCA B 2 1 ? 12.011 9.810 4.496 1.00 13.74 ? 251 PCA B O 1 1 ? ? ? ? ATOM 1625 N N . LYS B 2 2 ? 12.250 8.304 6.138 1.00 11.96 ? 252 LYS B N 1 2 ? ? ? ? ATOM 1626 C CA . LYS B 2 2 ? 10.827 8.210 6.391 1.00 11.55 ? 252 LYS B CA 1 2 ? ? ? ? ATOM 1627 C C . LYS B 2 2 ? 10.510 8.911 7.695 1.00 10.93 ? 252 LYS B C 1 2 ? ? ? ? ATOM 1628 O O . LYS B 2 2 ? 11.190 8.732 8.700 1.00 9.61 ? 252 LYS B O 1 2 ? ? ? ? ATOM 1629 C CB . LYS B 2 2 ? 10.346 6.739 6.471 1.00 12.53 ? 252 LYS B CB 1 2 ? ? ? ? ATOM 1630 C CG . LYS B 2 2 ? 10.451 5.929 5.168 1.00 15.88 ? 252 LYS B CG 1 2 ? ? ? ? ATOM 1631 C CD . LYS B 2 2 ? 9.791 4.547 5.353 1.00 18.57 ? 252 LYS B CD 1 2 ? ? ? ? ATOM 1632 C CE . LYS B 2 2 ? 10.004 3.689 4.093 1.00 20.90 ? 252 LYS B CE 1 2 ? ? ? ? ATOM 1633 N NZ . LYS B 2 2 ? 11.462 3.657 3.752 1.00 22.00 ? 252 LYS B NZ 1 2 ? ? ? ? ATOM 1634 N N . TRP B 2 3 ? 9.474 9.737 7.678 1.00 8.65 ? 253 TRP B N 1 3 ? ? ? ? ATOM 1635 C CA . TRP B 2 3 ? 9.023 10.440 8.900 1.00 8.22 ? 253 TRP B CA 1 3 ? ? ? ? ATOM 1636 C C . TRP B 2 3 ? 7.494 10.666 8.911 1.00 8.40 ? 253 TRP B C 1 3 ? ? ? ? ATOM 1637 O O . TRP B 2 3 ? 6.919 11.010 9.943 1.00 8.00 ? 253 TRP B O 1 3 ? ? ? ? ATOM 1638 C CB . TRP B 2 3 ? 9.759 11.787 9.059 1.00 7.17 ? 253 TRP B CB 1 3 ? ? ? ? ATOM 1639 C CG . TRP B 2 3 ? 9.431 12.917 8.085 1.00 7.06 ? 253 TRP B CG 1 3 ? ? ? ? ATOM 1640 C CD1 . TRP B 2 3 ? 8.708 12.848 6.926 1.00 6.60 ? 253 TRP B CD1 1 3 ? ? ? ? ATOM 1641 C CD2 . TRP B 2 3 ? 9.854 14.276 8.215 1.00 6.72 ? 253 TRP B CD2 1 3 ? ? ? ? ATOM 1642 N NE1 . TRP B 2 3 ? 8.661 14.094 6.328 1.00 7.36 ? 253 TRP B NE1 1 3 ? ? ? ? ATOM 1643 C CE2 . TRP B 2 3 ? 9.355 14.985 7.100 1.00 7.16 ? 253 TRP B CE2 1 3 ? ? ? ? ATOM 1644 C CE3 . TRP B 2 3 ? 10.610 14.963 9.178 1.00 7.54 ? 253 TRP B CE3 1 3 ? ? ? ? ATOM 1645 C CZ2 . TRP B 2 3 ? 9.575 16.362 6.920 1.00 7.33 ? 253 TRP B CZ2 1 3 ? ? ? ? ATOM 1646 C CZ3 . TRP B 2 3 ? 10.838 16.331 9.013 1.00 8.46 ? 253 TRP B CZ3 1 3 ? ? ? ? ATOM 1647 C CH2 . TRP B 2 3 ? 10.318 17.027 7.889 1.00 7.67 ? 253 TRP B CH2 1 3 ? ? ? ? ATOM 1648 O OXT . TRP B 2 3 ? 6.858 10.545 7.822 1.00 8.44 ? 253 TRP B OXT 1 3 ? ? ? ? HETATM 1649 CD CD . CD C 3 . ? 5.131 11.666 8.380 1.00 9.06 ? 801 CD A CD 1 801 ? ? ? ? HETATM 1650 CD CD . CD D 3 . ? 15.976 27.162 27.780 1.00 10.22 ? 802 CD A CD 1 802 ? ? ? ? HETATM 1651 CD CD . CD E 3 . ? -7.259 26.180 3.658 1.00 16.05 ? 803 CD A CD 1 803 ? ? ? ? HETATM 1652 CD CD . CD F 3 . ? 26.610 3.041 29.228 1.00 34.74 ? 804 CD A CD 1 804 ? ? ? ? HETATM 1653 CD CD . CD G 3 . ? -0.969 33.263 21.691 1.00 30.16 ? 805 CD A CD 1 805 ? ? ? ? HETATM 1654 CD CD . CD H 3 . ? -8.526 12.956 21.015 1.00 30.18 ? 806 CD A CD 1 806 ? ? ? ? HETATM 1655 CD CD . CD I 3 . ? 0.241 27.764 36.334 1.00 41.24 ? 807 CD A CD 1 807 ? ? ? ? HETATM 1656 CD CD . CD J 3 . ? 19.348 13.237 8.727 1.00 14.91 ? 808 CD A CD 1 808 ? ? ? ? HETATM 1657 CD CD . CD K 3 . ? -0.387 27.862 0.581 1.00 31.65 ? 809 CD A CD 1 809 ? ? ? ? HETATM 1658 CD CD . CD L 3 . ? -4.172 3.137 29.767 1.00 31.57 ? 810 CD A CD 1 810 ? ? ? ? HETATM 1659 O O . HOH M 4 . ? 22.804 23.135 14.522 1.00 20.20 ? 301 HOH A O 1 301 ? ? ? ? HETATM 1660 O O . HOH M 4 . ? 20.420 23.866 13.086 1.00 10.82 ? 302 HOH A O 1 302 ? ? ? ? HETATM 1661 O O . HOH M 4 . ? 20.824 24.715 10.245 1.00 23.48 ? 303 HOH A O 1 303 ? ? ? ? HETATM 1662 O O . HOH M 4 . ? 12.137 -4.101 15.971 1.00 9.80 ? 304 HOH A O 1 304 ? ? ? ? HETATM 1663 O O . HOH M 4 . ? 11.004 1.804 11.556 1.00 13.10 ? 305 HOH A O 1 305 ? ? ? ? HETATM 1664 O O . HOH M 4 . ? 20.528 25.347 6.636 1.00 26.76 ? 306 HOH A O 1 306 ? ? ? ? HETATM 1665 O O . HOH M 4 . ? 12.175 28.221 6.695 1.00 19.66 ? 307 HOH A O 1 307 ? ? ? ? HETATM 1666 O O . HOH M 4 . ? 13.271 30.387 7.808 1.00 18.70 ? 308 HOH A O 1 308 ? ? ? ? HETATM 1667 O O . HOH M 4 . ? 21.328 1.326 25.398 1.00 28.26 ? 309 HOH A O 1 309 ? ? ? ? HETATM 1668 O O . HOH M 4 . ? 10.059 -0.863 10.281 1.00 24.17 ? 310 HOH A O 1 310 ? ? ? ? HETATM 1669 O O . HOH M 4 . ? 13.456 -3.267 8.071 1.00 14.49 ? 311 HOH A O 1 311 ? ? ? ? HETATM 1670 O O . HOH M 4 . ? 16.186 -0.889 7.371 1.00 9.31 ? 312 HOH A O 1 312 ? ? ? ? HETATM 1671 O O . HOH M 4 . ? 7.945 15.475 -0.159 1.00 24.17 ? 313 HOH A O 1 313 ? ? ? ? HETATM 1672 O O . HOH M 4 . ? 19.556 -0.545 11.712 1.00 14.32 ? 314 HOH A O 1 314 ? ? ? ? HETATM 1673 O O . HOH M 4 . ? 4.470 29.298 19.772 1.00 14.79 ? 315 HOH A O 1 315 ? ? ? ? HETATM 1674 O O . HOH M 4 . ? -10.445 28.312 22.751 1.00 32.17 ? 316 HOH A O 1 316 ? ? ? ? HETATM 1675 O O . HOH M 4 . ? 6.235 32.379 20.700 1.00 23.58 ? 317 HOH A O 1 317 ? ? ? ? HETATM 1676 O O . HOH M 4 . ? 5.360 32.462 23.268 1.00 18.12 ? 318 HOH A O 1 318 ? ? ? ? HETATM 1677 O O . HOH M 4 . ? -8.138 21.601 22.123 1.00 17.08 ? 319 HOH A O 1 319 ? ? ? ? HETATM 1678 O O . HOH M 4 . ? -3.041 34.644 21.416 1.00 29.20 ? 320 HOH A O 1 320 ? ? ? ? HETATM 1679 O O . HOH M 4 . ? 0.809 31.596 21.935 1.00 21.70 ? 321 HOH A O 1 321 ? ? ? ? HETATM 1680 O O . HOH M 4 . ? 19.974 -2.700 8.260 1.00 13.26 ? 322 HOH A O 1 322 ? ? ? ? HETATM 1681 O O . HOH M 4 . ? 2.916 28.093 28.152 1.00 18.31 ? 323 HOH A O 1 323 ? ? ? ? HETATM 1682 O O . HOH M 4 . ? -6.544 6.189 26.116 1.00 14.39 ? 324 HOH A O 1 324 ? ? ? ? HETATM 1683 O O . HOH M 4 . ? -1.272 12.591 28.496 1.00 16.76 ? 325 HOH A O 1 325 ? ? ? ? HETATM 1684 O O . HOH M 4 . ? 4.839 22.078 33.654 1.00 7.51 ? 326 HOH A O 1 326 ? ? ? ? HETATM 1685 O O . HOH M 4 . ? 15.389 21.390 31.736 1.00 18.37 ? 327 HOH A O 1 327 ? ? ? ? HETATM 1686 O O . HOH M 4 . ? 25.405 3.224 25.067 1.00 35.07 ? 328 HOH A O 1 328 ? ? ? ? HETATM 1687 O O . HOH M 4 . ? 18.927 5.421 32.968 1.00 19.85 ? 329 HOH A O 1 329 ? ? ? ? HETATM 1688 O O . HOH M 4 . ? 13.580 7.576 34.362 1.00 39.59 ? 330 HOH A O 1 330 ? ? ? ? HETATM 1689 O O . HOH M 4 . ? -6.925 33.154 26.685 1.00 47.28 ? 331 HOH A O 1 331 ? ? ? ? HETATM 1690 O O . HOH M 4 . ? 19.628 3.691 23.441 1.00 17.37 ? 332 HOH A O 1 332 ? ? ? ? HETATM 1691 O O . HOH M 4 . ? 21.064 3.296 20.945 1.00 19.83 ? 333 HOH A O 1 333 ? ? ? ? HETATM 1692 O O . HOH M 4 . ? 29.990 8.786 26.183 1.00 26.49 ? 334 HOH A O 1 334 ? ? ? ? HETATM 1693 O O . HOH M 4 . ? 1.626 13.243 38.039 1.00 41.23 ? 335 HOH A O 1 335 ? ? ? ? HETATM 1694 O O . HOH M 4 . ? 2.530 17.377 37.683 1.00 19.69 ? 336 HOH A O 1 336 ? ? ? ? HETATM 1695 O O . HOH M 4 . ? 4.088 18.209 39.694 1.00 25.58 ? 337 HOH A O 1 337 ? ? ? ? HETATM 1696 O O . HOH M 4 . ? 7.537 13.544 43.236 1.00 47.87 ? 338 HOH A O 1 338 ? ? ? ? HETATM 1697 O O . HOH M 4 . ? 6.287 16.480 39.793 1.00 32.16 ? 339 HOH A O 1 339 ? ? ? ? HETATM 1698 O O . HOH M 4 . ? 5.126 10.359 44.009 1.00 42.62 ? 340 HOH A O 1 340 ? ? ? ? HETATM 1699 O O . HOH M 4 . ? -1.902 16.464 30.308 1.00 29.59 ? 341 HOH A O 1 341 ? ? ? ? HETATM 1700 O O . HOH M 4 . ? -1.392 21.603 29.180 1.00 30.18 ? 342 HOH A O 1 342 ? ? ? ? HETATM 1701 O O . HOH M 4 . ? -2.162 19.668 30.022 1.00 16.54 ? 343 HOH A O 1 343 ? ? ? ? HETATM 1702 O O . HOH M 4 . ? 27.446 3.341 18.178 1.00 33.45 ? 344 HOH A O 1 344 ? ? ? ? HETATM 1703 O O . HOH M 4 . ? 24.183 13.587 14.633 1.00 33.97 ? 345 HOH A O 1 345 ? ? ? ? HETATM 1704 O O . HOH M 4 . ? 17.162 5.437 10.537 1.00 10.71 ? 346 HOH A O 1 346 ? ? ? ? HETATM 1705 O O . HOH M 4 . ? 17.433 1.941 8.357 1.00 13.80 ? 347 HOH A O 1 347 ? ? ? ? HETATM 1706 O O . HOH M 4 . ? -7.300 15.631 27.453 1.00 18.47 ? 348 HOH A O 1 348 ? ? ? ? HETATM 1707 O O . HOH M 4 . ? 12.374 -3.162 5.036 1.00 3.28 ? 349 HOH A O 1 349 ? ? ? ? HETATM 1708 O O . HOH M 4 . ? -1.441 15.546 -4.849 1.00 14.37 ? 350 HOH A O 1 350 ? ? ? ? HETATM 1709 O O . HOH M 4 . ? 14.280 19.941 34.214 1.00 31.57 ? 351 HOH A O 1 351 ? ? ? ? HETATM 1710 O O . HOH M 4 . ? 12.920 18.124 34.062 1.00 18.94 ? 352 HOH A O 1 352 ? ? ? ? HETATM 1711 O O . HOH M 4 . ? 24.724 21.048 23.357 1.00 32.41 ? 353 HOH A O 1 353 ? ? ? ? HETATM 1712 O O . HOH M 4 . ? 20.836 15.884 6.536 1.00 19.76 ? 354 HOH A O 1 354 ? ? ? ? HETATM 1713 O O . HOH M 4 . ? 19.347 11.041 8.603 1.00 22.25 ? 355 HOH A O 1 355 ? ? ? ? HETATM 1714 O O . HOH M 4 . ? 18.966 15.631 7.968 1.00 10.97 ? 356 HOH A O 1 356 ? ? ? ? HETATM 1715 O O . HOH M 4 . ? 17.922 12.477 6.908 1.00 25.47 ? 357 HOH A O 1 357 ? ? ? ? HETATM 1716 O O . HOH M 4 . ? 8.414 2.672 10.488 1.00 40.19 ? 358 HOH A O 1 358 ? ? ? ? HETATM 1717 O O . HOH M 4 . ? 5.293 20.717 1.865 1.00 9.63 ? 359 HOH A O 1 359 ? ? ? ? HETATM 1718 O O . HOH M 4 . ? 5.665 18.549 0.103 1.00 18.13 ? 360 HOH A O 1 360 ? ? ? ? HETATM 1719 O O . HOH M 4 . ? -7.255 16.550 11.253 1.00 12.90 ? 361 HOH A O 1 361 ? ? ? ? HETATM 1720 O O . HOH M 4 . ? -8.674 15.315 13.273 1.00 23.00 ? 362 HOH A O 1 362 ? ? ? ? HETATM 1721 O O . HOH M 4 . ? -2.772 16.844 2.676 1.00 14.25 ? 363 HOH A O 1 363 ? ? ? ? HETATM 1722 O O . HOH M 4 . ? 1.117 13.281 0.339 1.00 19.86 ? 364 HOH A O 1 364 ? ? ? ? HETATM 1723 O O . HOH M 4 . ? -1.207 11.853 3.080 1.00 43.55 ? 365 HOH A O 1 365 ? ? ? ? HETATM 1724 O O . HOH M 4 . ? -0.394 18.670 6.242 1.00 9.15 ? 366 HOH A O 1 366 ? ? ? ? HETATM 1725 O O . HOH M 4 . ? 0.264 11.203 6.102 1.00 15.55 ? 367 HOH A O 1 367 ? ? ? ? HETATM 1726 O O . HOH M 4 . ? -2.429 8.646 8.526 1.00 33.62 ? 368 HOH A O 1 368 ? ? ? ? HETATM 1727 O O . HOH M 4 . ? 3.123 21.456 6.343 1.00 7.22 ? 369 HOH A O 1 369 ? ? ? ? HETATM 1728 O O . HOH M 4 . ? 4.286 16.217 0.662 1.00 13.73 ? 370 HOH A O 1 370 ? ? ? ? HETATM 1729 O O . HOH M 4 . ? 1.353 15.163 -3.459 1.00 6.46 ? 371 HOH A O 1 371 ? ? ? ? HETATM 1730 O O . HOH M 4 . ? -8.797 16.426 3.504 1.00 30.53 ? 372 HOH A O 1 372 ? ? ? ? HETATM 1731 O O . HOH M 4 . ? -9.169 14.606 5.179 1.00 39.40 ? 373 HOH A O 1 373 ? ? ? ? HETATM 1732 O O . HOH M 4 . ? -13.939 12.251 7.207 1.00 50.84 ? 374 HOH A O 1 374 ? ? ? ? HETATM 1733 O O . HOH M 4 . ? -6.142 19.553 5.127 1.00 14.98 ? 375 HOH A O 1 375 ? ? ? ? HETATM 1734 O O . HOH M 4 . ? 2.036 20.406 -0.786 1.00 11.35 ? 376 HOH A O 1 376 ? ? ? ? HETATM 1735 O O . HOH M 4 . ? 6.175 24.421 -6.084 1.00 23.03 ? 377 HOH A O 1 377 ? ? ? ? HETATM 1736 O O . HOH M 4 . ? 7.963 24.654 -4.293 1.00 46.95 ? 378 HOH A O 1 378 ? ? ? ? HETATM 1737 O O . HOH M 4 . ? 0.848 -1.968 25.780 1.00 31.98 ? 379 HOH A O 1 379 ? ? ? ? HETATM 1738 O O . HOH M 4 . ? 6.512 0.097 31.020 1.00 36.66 ? 380 HOH A O 1 380 ? ? ? ? HETATM 1739 O O . HOH M 4 . ? -1.921 26.594 -1.002 1.00 9.00 ? 381 HOH A O 1 381 ? ? ? ? HETATM 1740 O O . HOH M 4 . ? 12.181 15.867 -0.274 1.00 28.25 ? 382 HOH A O 1 382 ? ? ? ? HETATM 1741 O O . HOH M 4 . ? 1.816 32.867 18.688 1.00 35.01 ? 383 HOH A O 1 383 ? ? ? ? HETATM 1742 O O . HOH M 4 . ? 5.840 27.919 11.527 1.00 10.88 ? 384 HOH A O 1 384 ? ? ? ? HETATM 1743 O O . HOH M 4 . ? 3.634 27.880 10.050 1.00 11.08 ? 385 HOH A O 1 385 ? ? ? ? HETATM 1744 O O . HOH M 4 . ? 2.599 30.226 8.628 1.00 15.50 ? 386 HOH A O 1 386 ? ? ? ? HETATM 1745 O O . HOH M 4 . ? 0.568 25.886 1.375 1.00 1.28 ? 387 HOH A O 1 387 ? ? ? ? HETATM 1746 O O . HOH M 4 . ? 11.610 19.760 2.279 1.00 22.70 ? 388 HOH A O 1 388 ? ? ? ? HETATM 1747 O O . HOH M 4 . ? 2.760 30.628 5.707 1.00 28.73 ? 389 HOH A O 1 389 ? ? ? ? HETATM 1748 O O . HOH M 4 . ? -10.223 22.566 7.742 1.00 19.02 ? 390 HOH A O 1 390 ? ? ? ? HETATM 1749 O O . HOH M 4 . ? -10.254 20.531 5.025 1.00 29.84 ? 391 HOH A O 1 391 ? ? ? ? HETATM 1750 O O . HOH M 4 . ? -5.707 22.238 2.299 1.00 23.36 ? 392 HOH A O 1 392 ? ? ? ? HETATM 1751 O O . HOH M 4 . ? -3.890 30.477 7.079 1.00 22.34 ? 393 HOH A O 1 393 ? ? ? ? HETATM 1752 O O . HOH M 4 . ? -10.856 13.785 9.864 1.00 42.15 ? 394 HOH A O 1 394 ? ? ? ? HETATM 1753 O O . HOH M 4 . ? -11.547 14.677 12.404 1.00 37.15 ? 395 HOH A O 1 395 ? ? ? ? HETATM 1754 O O . HOH M 4 . ? -9.668 28.699 14.498 1.00 25.75 ? 396 HOH A O 1 396 ? ? ? ? HETATM 1755 O O . HOH M 4 . ? -9.033 27.644 10.441 1.00 20.93 ? 397 HOH A O 1 397 ? ? ? ? HETATM 1756 O O . HOH M 4 . ? -13.924 22.486 33.181 1.00 46.14 ? 398 HOH A O 1 398 ? ? ? ? HETATM 1757 O O . HOH M 4 . ? -14.915 17.524 21.193 1.00 46.58 ? 399 HOH A O 1 399 ? ? ? ? HETATM 1758 O O . HOH M 4 . ? -13.129 24.111 18.944 1.00 41.29 ? 400 HOH A O 1 400 ? ? ? ? HETATM 1759 O O . HOH M 4 . ? 4.583 34.760 20.329 1.00 43.74 ? 401 HOH A O 1 401 ? ? ? ? HETATM 1760 O O . HOH M 4 . ? -2.936 33.678 11.683 1.00 40.13 ? 402 HOH A O 1 402 ? ? ? ? HETATM 1761 O O . HOH M 4 . ? -9.447 32.772 16.881 1.00 41.64 ? 403 HOH A O 1 403 ? ? ? ? HETATM 1762 O O . HOH M 4 . ? -11.792 26.442 16.966 1.00 36.46 ? 404 HOH A O 1 404 ? ? ? ? HETATM 1763 O O . HOH M 4 . ? -7.780 32.165 22.362 1.00 26.75 ? 405 HOH A O 1 405 ? ? ? ? HETATM 1764 O O . HOH M 4 . ? 2.851 25.338 27.171 1.00 12.08 ? 406 HOH A O 1 406 ? ? ? ? HETATM 1765 O O . HOH M 4 . ? 4.917 23.546 31.100 1.00 28.08 ? 407 HOH A O 1 407 ? ? ? ? HETATM 1766 O O . HOH M 4 . ? 5.355 26.191 32.169 1.00 20.01 ? 408 HOH A O 1 408 ? ? ? ? HETATM 1767 O O . HOH M 4 . ? 17.116 12.942 33.959 1.00 26.22 ? 409 HOH A O 1 409 ? ? ? ? HETATM 1768 O O . HOH M 4 . ? 25.438 5.754 21.186 1.00 19.42 ? 410 HOH A O 1 410 ? ? ? ? HETATM 1769 O O . HOH M 4 . ? 22.526 9.132 16.196 1.00 30.44 ? 411 HOH A O 1 411 ? ? ? ? HETATM 1770 O O . HOH M 4 . ? 21.218 0.741 28.038 1.00 24.70 ? 412 HOH A O 1 412 ? ? ? ? HETATM 1771 O O . HOH M 4 . ? 14.691 15.708 -1.323 1.00 29.12 ? 415 HOH A O 1 415 ? ? ? ? HETATM 1772 O O . HOH M 4 . ? 18.511 14.631 2.825 1.00 38.96 ? 416 HOH A O 1 416 ? ? ? ? HETATM 1773 O O . HOH M 4 . ? 4.712 9.182 11.719 1.00 23.37 ? 417 HOH A O 1 417 ? ? ? ? HETATM 1774 O O . HOH M 4 . ? 3.549 18.612 -1.852 1.00 33.07 ? 418 HOH A O 1 418 ? ? ? ? HETATM 1775 O O . HOH M 4 . ? -6.868 13.512 4.334 1.00 34.92 ? 419 HOH A O 1 419 ? ? ? ? HETATM 1776 O O . HOH M 4 . ? -1.589 6.305 13.808 1.00 18.97 ? 420 HOH A O 1 420 ? ? ? ? HETATM 1777 O O . HOH M 4 . ? 4.086 23.346 -5.654 1.00 43.12 ? 421 HOH A O 1 421 ? ? ? ? HETATM 1778 O O . HOH M 4 . ? 17.926 26.772 2.918 1.00 42.58 ? 422 HOH A O 1 422 ? ? ? ? HETATM 1779 O O . HOH M 4 . ? 18.975 -0.174 8.996 1.00 18.47 ? 423 HOH A O 1 423 ? ? ? ? HETATM 1780 O O . HOH M 4 . ? 23.807 20.591 19.525 1.00 29.87 ? 424 HOH A O 1 424 ? ? ? ? HETATM 1781 O O . HOH M 4 . ? 21.335 12.945 7.660 1.00 22.05 ? 425 HOH A O 1 425 ? ? ? ? HETATM 1782 O O . HOH M 4 . ? 23.678 0.563 29.760 1.00 28.75 ? 426 HOH A O 1 426 ? ? ? ? HETATM 1783 O O . HOH M 4 . ? 12.346 4.039 44.713 1.00 48.57 ? 427 HOH A O 1 427 ? ? ? ? HETATM 1784 O O . HOH M 4 . ? 25.487 -2.275 32.378 1.00 39.81 ? 428 HOH A O 1 428 ? ? ? ? HETATM 1785 O O . HOH M 4 . ? 16.577 19.481 33.618 1.00 37.60 ? 429 HOH A O 1 429 ? ? ? ? HETATM 1786 O O . HOH M 4 . ? 19.628 24.857 29.640 1.00 39.51 ? 430 HOH A O 1 430 ? ? ? ? HETATM 1787 O O . HOH M 4 . ? 9.745 22.537 33.347 1.00 20.33 ? 431 HOH A O 1 431 ? ? ? ? HETATM 1788 O O . HOH M 4 . ? -9.034 26.800 4.907 1.00 21.65 ? 432 HOH A O 1 432 ? ? ? ? HETATM 1789 O O . HOH M 4 . ? -9.982 25.342 7.348 1.00 19.17 ? 433 HOH A O 1 433 ? ? ? ? HETATM 1790 O O . HOH M 4 . ? -7.155 28.417 3.456 1.00 26.67 ? 434 HOH A O 1 434 ? ? ? ? HETATM 1791 O O . HOH M 4 . ? -8.681 19.109 6.925 1.00 19.82 ? 435 HOH A O 1 435 ? ? ? ? HETATM 1792 O O . HOH M 4 . ? -11.809 16.482 6.130 1.00 42.02 ? 436 HOH A O 1 436 ? ? ? ? HETATM 1793 O O . HOH M 4 . ? -2.865 31.436 14.740 1.00 13.56 ? 437 HOH A O 1 437 ? ? ? ? HETATM 1794 O O . HOH M 4 . ? -4.986 33.714 8.836 1.00 47.88 ? 438 HOH A O 1 438 ? ? ? ? HETATM 1795 O O . HOH M 4 . ? 0.075 34.369 23.421 1.00 30.24 ? 439 HOH A O 1 439 ? ? ? ? HETATM 1796 O O . HOH M 4 . ? -3.911 26.605 18.780 1.00 12.14 ? 440 HOH A O 1 440 ? ? ? ? HETATM 1797 O O . HOH M 4 . ? 2.656 32.290 25.253 1.00 40.22 ? 441 HOH A O 1 441 ? ? ? ? HETATM 1798 O O . HOH M 4 . ? -1.832 30.772 10.851 1.00 21.02 ? 442 HOH A O 1 442 ? ? ? ? HETATM 1799 O O . HOH M 4 . ? -7.353 10.516 21.504 1.00 41.32 ? 443 HOH A O 1 443 ? ? ? ? HETATM 1800 O O . HOH M 4 . ? -12.470 19.786 26.260 1.00 40.23 ? 444 HOH A O 1 444 ? ? ? ? HETATM 1801 O O . HOH M 4 . ? -10.357 15.780 26.204 1.00 33.90 ? 445 HOH A O 1 445 ? ? ? ? HETATM 1802 O O . HOH M 4 . ? -6.080 8.945 27.735 1.00 21.11 ? 446 HOH A O 1 446 ? ? ? ? HETATM 1803 O O . HOH M 4 . ? 1.427 0.736 15.667 1.00 42.16 ? 447 HOH A O 1 447 ? ? ? ? HETATM 1804 O O . HOH M 4 . ? 3.597 -1.991 23.219 1.00 39.18 ? 448 HOH A O 1 448 ? ? ? ? HETATM 1805 O O . HOH M 4 . ? -13.142 19.623 8.848 1.00 39.13 ? 449 HOH A O 1 449 ? ? ? ? HETATM 1806 O O . HOH M 4 . ? -5.874 13.072 10.121 1.00 29.64 ? 450 HOH A O 1 450 ? ? ? ? HETATM 1807 O O . HOH M 4 . ? 7.212 -0.514 27.699 1.00 20.20 ? 451 HOH A O 1 451 ? ? ? ? HETATM 1808 O O . HOH M 4 . ? 5.174 -2.026 21.016 1.00 19.88 ? 452 HOH A O 1 452 ? ? ? ? HETATM 1809 O O . HOH M 4 . ? 7.619 27.207 3.077 1.00 37.32 ? 453 HOH A O 1 453 ? ? ? ? HETATM 1810 O O . HOH M 4 . ? -4.414 3.089 27.406 1.00 33.14 ? 454 HOH A O 1 454 ? ? ? ? HETATM 1811 O O . HOH M 4 . ? -3.453 0.874 29.764 1.00 11.52 ? 455 HOH A O 1 455 ? ? ? ? HETATM 1812 O O . HOH M 4 . ? -5.346 4.835 29.620 1.00 29.01 ? 456 HOH A O 1 456 ? ? ? ? HETATM 1813 O O . HOH M 4 . ? 10.713 -2.814 26.639 1.00 32.54 ? 457 HOH A O 1 457 ? ? ? ? HETATM 1814 O O . HOH M 4 . ? 26.851 17.592 33.007 1.00 32.68 ? 458 HOH A O 1 458 ? ? ? ? HETATM 1815 O O . HOH M 4 . ? 18.598 25.388 31.750 1.00 36.82 ? 459 HOH A O 1 459 ? ? ? ? HETATM 1816 O O . HOH M 4 . ? 22.514 25.142 16.269 1.00 17.95 ? 460 HOH A O 1 460 ? ? ? ? HETATM 1817 O O . HOH M 4 . ? 24.788 15.634 10.253 1.00 27.07 ? 461 HOH A O 1 461 ? ? ? ? HETATM 1818 O O . HOH M 4 . ? 2.881 19.399 35.257 1.00 27.89 ? 462 HOH A O 1 462 ? ? ? ? HETATM 1819 O O . HOH M 4 . ? 23.270 2.608 24.160 1.00 23.74 ? 463 HOH A O 1 463 ? ? ? ? HETATM 1820 O O . HOH M 4 . ? 23.330 1.936 21.269 1.00 15.30 ? 464 HOH A O 1 464 ? ? ? ? HETATM 1821 O O . HOH M 4 . ? 23.141 -0.444 19.861 1.00 17.77 ? 465 HOH A O 1 465 ? ? ? ? HETATM 1822 O O . HOH M 4 . ? 25.896 -2.438 29.234 1.00 42.25 ? 466 HOH A O 1 466 ? ? ? ? HETATM 1823 O O . HOH M 4 . ? -0.005 35.816 5.165 1.00 40.10 ? 467 HOH A O 1 467 ? ? ? ? HETATM 1824 O O . HOH M 4 . ? 26.678 2.097 27.386 1.00 40.57 ? 468 HOH A O 1 468 ? ? ? ? HETATM 1825 O O . HOH M 4 . ? 27.600 2.181 22.685 1.00 24.64 ? 469 HOH A O 1 469 ? ? ? ? HETATM 1826 O O . HOH M 4 . ? 28.543 13.987 18.674 1.00 49.83 ? 470 HOH A O 1 470 ? ? ? ? HETATM 1827 O O . HOH M 4 . ? 31.137 9.158 22.494 1.00 49.75 ? 471 HOH A O 1 471 ? ? ? ? HETATM 1828 O O . HOH M 4 . ? 32.534 14.906 28.361 1.00 45.37 ? 472 HOH A O 1 472 ? ? ? ? HETATM 1829 O O . HOH M 4 . ? 16.394 16.232 33.886 1.00 33.97 ? 473 HOH A O 1 473 ? ? ? ? HETATM 1830 O O . HOH M 4 . ? 22.329 22.745 30.584 1.00 40.22 ? 474 HOH A O 1 474 ? ? ? ? HETATM 1831 O O . HOH M 4 . ? 18.042 27.212 33.829 1.00 40.23 ? 475 HOH A O 1 475 ? ? ? ? HETATM 1832 O O . HOH M 4 . ? 12.296 -1.011 32.848 1.00 44.66 ? 476 HOH A O 1 476 ? ? ? ? HETATM 1833 O O . HOH M 4 . ? 16.918 8.871 34.006 1.00 38.48 ? 477 HOH A O 1 477 ? ? ? ? HETATM 1834 O O . HOH M 4 . ? 17.318 -4.344 32.781 1.00 43.62 ? 478 HOH A O 1 478 ? ? ? ? HETATM 1835 O O . HOH M 4 . ? 7.231 4.704 38.781 1.00 44.91 ? 479 HOH A O 1 479 ? ? ? ? HETATM 1836 O O . HOH M 4 . ? 0.166 12.901 35.341 1.00 30.74 ? 480 HOH A O 1 480 ? ? ? ? HETATM 1837 O O . HOH M 4 . ? 0.478 11.496 42.821 1.00 43.52 ? 481 HOH A O 1 481 ? ? ? ? HETATM 1838 O O . HOH M 4 . ? 25.664 3.386 20.900 1.00 33.55 ? 482 HOH A O 1 482 ? ? ? ? HETATM 1839 O O . HOH M 4 . ? 29.232 10.671 14.932 1.00 47.09 ? 483 HOH A O 1 483 ? ? ? ? HETATM 1840 O O . HOH M 4 . ? 20.041 8.625 9.673 1.00 31.00 ? 484 HOH A O 1 484 ? ? ? ? HETATM 1841 O O . HOH M 4 . ? 22.295 5.616 12.117 1.00 22.69 ? 485 HOH A O 1 485 ? ? ? ? HETATM 1842 O O . HOH M 4 . ? 25.148 16.179 16.693 1.00 42.38 ? 486 HOH A O 1 486 ? ? ? ? HETATM 1843 O O . HOH M 4 . ? 21.915 10.698 6.256 1.00 45.72 ? 487 HOH A O 1 487 ? ? ? ? HETATM 1844 O O . HOH M 4 . ? 19.332 3.958 8.095 1.00 22.89 ? 488 HOH A O 1 488 ? ? ? ? HETATM 1845 O O . HOH M 4 . ? 27.185 18.116 17.286 1.00 44.13 ? 489 HOH A O 1 489 ? ? ? ? HETATM 1846 O O . HOH M 4 . ? 30.807 13.678 15.835 1.00 45.44 ? 490 HOH A O 1 490 ? ? ? ? HETATM 1847 O O . HOH M 4 . ? 11.230 -3.353 9.595 1.00 30.41 ? 491 HOH A O 1 491 ? ? ? ? HETATM 1848 O O . HOH M 4 . ? 7.449 11.241 -1.828 1.00 38.37 ? 492 HOH A O 1 492 ? ? ? ? HETATM 1849 O O . HOH M 4 . ? 7.791 7.400 9.737 1.00 11.96 ? 493 HOH A O 1 493 ? ? ? ? HETATM 1850 O O . HOH M 4 . ? 22.499 7.728 7.607 1.00 48.55 ? 494 HOH A O 1 494 ? ? ? ? HETATM 1851 O O . HOH M 4 . ? -8.567 15.365 9.233 1.00 32.01 ? 496 HOH A O 1 496 ? ? ? ? HETATM 1852 O O . HOH M 4 . ? -11.428 12.905 14.928 1.00 46.75 ? 497 HOH A O 1 497 ? ? ? ? HETATM 1853 O O . HOH M 4 . ? -10.723 27.424 27.399 1.00 45.33 ? 498 HOH A O 1 498 ? ? ? ? HETATM 1854 O O . HOH M 4 . ? -3.443 4.003 17.811 1.00 43.82 ? 499 HOH A O 1 499 ? ? ? ? HETATM 1855 O O . HOH M 4 . ? -15.079 17.748 23.565 1.00 47.95 ? 500 HOH A O 1 500 ? ? ? ? HETATM 1856 O O . HOH M 4 . ? 1.416 -1.069 21.985 1.00 37.68 ? 501 HOH A O 1 501 ? ? ? ? HETATM 1857 O O . HOH M 4 . ? 5.257 -2.336 27.422 1.00 41.54 ? 502 HOH A O 1 502 ? ? ? ? HETATM 1858 O O . HOH M 4 . ? 26.951 27.544 12.724 1.00 45.38 ? 503 HOH A O 1 503 ? ? ? ? HETATM 1859 O O . HOH M 4 . ? 2.495 11.033 1.789 1.00 25.70 ? 504 HOH A O 1 504 ? ? ? ? HETATM 1860 O O . HOH M 4 . ? 6.753 26.170 -1.364 1.00 34.88 ? 505 HOH A O 1 505 ? ? ? ? HETATM 1861 O O . HOH M 4 . ? 16.370 23.670 6.536 1.00 18.88 ? 506 HOH A O 1 506 ? ? ? ? HETATM 1862 O O . HOH M 4 . ? 1.762 30.472 27.675 1.00 35.50 ? 507 HOH A O 1 507 ? ? ? ? HETATM 1863 O O . HOH M 4 . ? -7.368 28.816 25.046 1.00 36.62 ? 508 HOH A O 1 508 ? ? ? ? HETATM 1864 O O . HOH M 4 . ? 9.512 6.747 38.863 1.00 40.64 ? 509 HOH A O 1 509 ? ? ? ? HETATM 1865 O O . HOH M 4 . ? -8.338 33.913 19.326 1.00 46.55 ? 510 HOH A O 1 510 ? ? ? ? HETATM 1866 O O . HOH M 4 . ? 28.051 6.845 20.480 1.00 34.34 ? 512 HOH A O 1 512 ? ? ? ? HETATM 1867 O O . HOH M 4 . ? 28.246 12.342 16.765 1.00 48.56 ? 513 HOH A O 1 513 ? ? ? ? HETATM 1868 O O . HOH M 4 . ? 11.585 20.602 34.662 1.00 34.24 ? 514 HOH A O 1 514 ? ? ? ? HETATM 1869 O O . HOH M 4 . ? 2.419 2.863 37.158 1.00 41.87 ? 515 HOH A O 1 515 ? ? ? ? HETATM 1870 O O . HOH M 4 . ? -17.757 18.561 7.162 1.00 48.68 ? 516 HOH A O 1 516 ? ? ? ? HETATM 1871 O O . HOH M 4 . ? -8.201 12.513 16.715 1.00 36.23 ? 517 HOH A O 1 517 ? ? ? ? HETATM 1872 O O . HOH M 4 . ? -13.983 14.869 9.614 1.00 51.07 ? 518 HOH A O 1 518 ? ? ? ? HETATM 1873 O O . HOH M 4 . ? -4.122 6.764 15.612 1.00 41.08 ? 519 HOH A O 1 519 ? ? ? ? HETATM 1874 O O . HOH M 4 . ? 3.958 -2.963 15.561 1.00 48.00 ? 520 HOH A O 1 520 ? ? ? ? HETATM 1875 O O . HOH M 4 . ? 1.442 4.741 10.370 1.00 42.29 ? 521 HOH A O 1 521 ? ? ? ? HETATM 1876 O O . HOH M 4 . ? 5.388 -2.470 13.263 1.00 33.36 ? 522 HOH A O 1 522 ? ? ? ? HETATM 1877 O O . HOH M 4 . ? 23.948 24.751 18.587 1.00 37.42 ? 523 HOH A O 1 523 ? ? ? ? HETATM 1878 O O . HOH M 4 . ? -7.241 13.178 14.089 1.00 34.34 ? 524 HOH A O 1 524 ? ? ? ? HETATM 1879 O O . HOH M 4 . ? -10.774 10.245 13.796 1.00 46.70 ? 525 HOH A O 1 525 ? ? ? ? HETATM 1880 O O . HOH M 4 . ? -15.446 19.994 20.624 1.00 41.55 ? 526 HOH A O 1 526 ? ? ? ? HETATM 1881 O O . HOH M 4 . ? -10.911 2.974 18.503 1.00 49.12 ? 527 HOH A O 1 527 ? ? ? ? HETATM 1882 O O . HOH M 4 . ? 3.897 5.350 8.775 1.00 29.68 ? 528 HOH A O 1 528 ? ? ? ? HETATM 1883 O O . HOH M 4 . ? -7.938 18.785 32.769 1.00 48.25 ? 529 HOH A O 1 529 ? ? ? ? HETATM 1884 O O . HOH M 4 . ? -13.394 20.016 5.786 1.00 43.24 ? 530 HOH A O 1 530 ? ? ? ? HETATM 1885 O O . HOH M 4 . ? 26.717 14.048 32.812 1.00 40.26 ? 531 HOH A O 1 531 ? ? ? ? HETATM 1886 O O . HOH M 4 . ? 24.561 10.366 36.132 1.00 49.77 ? 532 HOH A O 1 532 ? ? ? ? HETATM 1887 O O . HOH M 4 . ? 23.171 22.765 21.662 1.00 43.32 ? 533 HOH A O 1 533 ? ? ? ? HETATM 1888 O O . HOH M 4 . ? 20.030 23.914 38.074 1.00 37.47 ? 534 HOH A O 1 534 ? ? ? ? HETATM 1889 O O . HOH M 4 . ? 26.518 23.764 31.711 1.00 51.01 ? 535 HOH A O 1 535 ? ? ? ? HETATM 1890 O O . HOH M 4 . ? 31.414 23.155 28.125 1.00 45.60 ? 536 HOH A O 1 536 ? ? ? ? HETATM 1891 O O . HOH M 4 . ? 26.067 20.917 12.075 1.00 38.14 ? 537 HOH A O 1 537 ? ? ? ? HETATM 1892 O O . HOH M 4 . ? 27.102 14.794 10.921 1.00 50.79 ? 538 HOH A O 1 538 ? ? ? ? HETATM 1893 O O . HOH M 4 . ? 25.140 21.269 4.671 1.00 47.18 ? 539 HOH A O 1 539 ? ? ? ? HETATM 1894 O O . HOH M 4 . ? 19.914 17.511 4.351 1.00 34.46 ? 540 HOH A O 1 540 ? ? ? ? HETATM 1895 O O . HOH M 4 . ? 12.109 28.698 2.482 1.00 29.83 ? 541 HOH A O 1 541 ? ? ? ? HETATM 1896 O O . HOH M 4 . ? 12.463 26.045 1.844 1.00 28.33 ? 542 HOH A O 1 542 ? ? ? ? HETATM 1897 O O . HOH M 4 . ? 14.540 26.928 5.594 1.00 21.50 ? 543 HOH A O 1 543 ? ? ? ? HETATM 1898 O O . HOH M 4 . ? 23.864 25.043 10.296 1.00 37.14 ? 544 HOH A O 1 544 ? ? ? ? HETATM 1899 O O . HOH M 4 . ? -0.690 36.134 8.552 1.00 45.28 ? 545 HOH A O 1 545 ? ? ? ? HETATM 1900 O O . HOH M 4 . ? 10.549 28.905 4.604 1.00 28.49 ? 546 HOH A O 1 546 ? ? ? ? HETATM 1901 O O . HOH M 4 . ? -8.638 31.759 8.366 1.00 45.91 ? 547 HOH A O 1 547 ? ? ? ? HETATM 1902 O O . HOH M 4 . ? 8.390 9.861 4.806 1.00 15.57 ? 548 HOH A O 1 548 ? ? ? ? HETATM 1903 O O . HOH M 4 . ? 21.361 -1.773 32.833 1.00 41.79 ? 549 HOH A O 1 549 ? ? ? ? HETATM 1904 O O . HOH M 4 . ? 10.162 -1.443 30.191 1.00 44.25 ? 550 HOH A O 1 550 ? ? ? ? HETATM 1905 O O . HOH M 4 . ? 6.226 14.395 -2.218 1.00 31.33 ? 551 HOH A O 1 551 ? ? ? ? HETATM 1906 O O . HOH M 4 . ? 10.472 17.885 0.620 1.00 31.37 ? 552 HOH A O 1 552 ? ? ? ? HETATM 1907 O O . HOH M 4 . ? 7.955 17.893 -0.475 1.00 20.23 ? 553 HOH A O 1 553 ? ? ? ? HETATM 1908 O O . HOH M 4 . ? 0.548 21.559 -7.901 1.00 26.39 ? 554 HOH A O 1 554 ? ? ? ? HETATM 1909 O O . HOH M 4 . ? 1.947 27.932 -1.096 1.00 30.02 ? 555 HOH A O 1 555 ? ? ? ? HETATM 1910 O O . HOH M 4 . ? 0.707 28.976 2.739 1.00 31.96 ? 556 HOH A O 1 556 ? ? ? ? HETATM 1911 O O . HOH M 4 . ? -1.010 29.861 0.088 1.00 29.47 ? 557 HOH A O 1 557 ? ? ? ? HETATM 1912 O O . HOH M 4 . ? 25.751 8.391 16.126 1.00 32.84 ? 558 HOH A O 1 558 ? ? ? ? HETATM 1913 O O . HOH M 4 . ? 25.822 7.423 18.169 1.00 35.77 ? 559 HOH A O 1 559 ? ? ? ? HETATM 1914 O O . HOH M 4 . ? 26.176 3.152 35.373 1.00 40.90 ? 560 HOH A O 1 560 ? ? ? ? HETATM 1915 O O . HOH M 4 . ? 30.353 20.067 20.759 1.00 47.83 ? 561 HOH A O 1 561 ? ? ? ? HETATM 1916 O O . HOH M 4 . ? 18.438 24.368 6.836 1.00 16.86 ? 562 HOH A O 1 562 ? ? ? ? HETATM 1917 O O . HOH M 4 . ? 19.311 6.103 39.597 1.00 47.59 ? 563 HOH A O 1 563 ? ? ? ? HETATM 1918 O O . HOH M 4 . ? 31.093 14.241 30.244 1.00 39.84 ? 564 HOH A O 1 564 ? ? ? ? HETATM 1919 O O . HOH M 4 . ? 29.533 21.394 27.917 1.00 43.75 ? 565 HOH A O 1 565 ? ? ? ? HETATM 1920 O O . HOH M 4 . ? 13.397 13.449 35.046 1.00 42.60 ? 566 HOH A O 1 566 ? ? ? ? HETATM 1921 O O . HOH M 4 . ? 18.655 6.819 35.064 1.00 40.87 ? 567 HOH A O 1 567 ? ? ? ? HETATM 1922 O O . HOH M 4 . ? 12.568 20.758 32.190 1.00 42.41 ? 568 HOH A O 1 568 ? ? ? ? HETATM 1923 O O . HOH M 4 . ? 24.981 19.152 40.565 1.00 45.47 ? 569 HOH A O 1 569 ? ? ? ? HETATM 1924 O O . HOH M 4 . ? 24.442 12.343 33.999 1.00 45.70 ? 570 HOH A O 1 570 ? ? ? ? HETATM 1925 O O . HOH M 4 . ? 31.836 16.819 26.880 1.00 47.71 ? 571 HOH A O 1 571 ? ? ? ? HETATM 1926 O O . HOH M 4 . ? 31.651 14.650 35.109 1.00 45.21 ? 572 HOH A O 1 572 ? ? ? ? HETATM 1927 O O . HOH M 4 . ? 29.939 13.744 33.171 1.00 47.10 ? 573 HOH A O 1 573 ? ? ? ? HETATM 1928 O O . HOH M 4 . ? 24.431 2.889 39.163 1.00 48.19 ? 574 HOH A O 1 574 ? ? ? ? HETATM 1929 O O . HOH M 4 . ? 8.483 -1.926 2.906 1.00 42.13 ? 575 HOH A O 1 575 ? ? ? ? HETATM 1930 O O . HOH M 4 . ? 21.783 25.699 29.626 1.00 39.63 ? 576 HOH A O 1 576 ? ? ? ? HETATM 1931 O O . HOH M 4 . ? -3.526 5.965 11.741 1.00 44.45 ? 577 HOH A O 1 577 ? ? ? ? HETATM 1932 O O . HOH M 4 . ? -6.512 13.667 20.612 1.00 17.52 ? 578 HOH A O 1 578 ? ? ? ? HETATM 1933 O O . HOH M 4 . ? -15.131 19.964 10.304 1.00 43.74 ? 579 HOH A O 1 579 ? ? ? ? HETATM 1934 O O . HOH M 4 . ? -14.850 24.932 15.259 1.00 42.40 ? 580 HOH A O 1 580 ? ? ? ? HETATM 1935 O O . HOH M 4 . ? -10.991 35.513 19.688 1.00 48.27 ? 581 HOH A O 1 581 ? ? ? ? HETATM 1936 O O . HOH M 4 . ? -1.845 13.584 30.922 1.00 37.79 ? 582 HOH A O 1 582 ? ? ? ? HETATM 1937 O O . HOH M 4 . ? -2.064 -0.013 26.958 1.00 45.32 ? 583 HOH A O 1 583 ? ? ? ? HETATM 1938 O O . HOH M 4 . ? 1.181 -3.842 18.667 1.00 45.40 ? 584 HOH A O 1 584 ? ? ? ? HETATM 1939 O O . HOH M 4 . ? 2.761 0.952 18.138 1.00 35.63 ? 585 HOH A O 1 585 ? ? ? ? HETATM 1940 O O . HOH M 4 . ? -8.487 -3.237 13.450 1.00 46.85 ? 586 HOH A O 1 586 ? ? ? ? HETATM 1941 O O . HOH M 4 . ? -0.818 7.583 33.828 1.00 37.61 ? 587 HOH A O 1 587 ? ? ? ? HETATM 1942 O O . HOH M 4 . ? -12.686 30.159 18.747 1.00 46.55 ? 588 HOH A O 1 588 ? ? ? ? HETATM 1943 O O . HOH M 4 . ? -18.110 33.348 8.700 1.00 44.74 ? 589 HOH A O 1 589 ? ? ? ? HETATM 1944 O O . HOH M 4 . ? -8.637 30.156 6.519 1.00 45.86 ? 590 HOH A O 1 590 ? ? ? ? HETATM 1945 O O . HOH M 4 . ? -14.597 17.169 9.142 1.00 47.54 ? 591 HOH A O 1 591 ? ? ? ? HETATM 1946 O O . HOH M 4 . ? 27.639 5.529 30.655 1.00 42.01 ? 592 HOH A O 1 592 ? ? ? ? HETATM 1947 O O . HOH M 4 . ? 23.861 -0.553 33.909 1.00 39.30 ? 593 HOH A O 1 593 ? ? ? ? HETATM 1948 O O . HOH M 4 . ? 28.283 -0.119 31.271 1.00 41.74 ? 594 HOH A O 1 594 ? ? ? ? HETATM 1949 O O . HOH M 4 . ? -9.598 30.552 24.502 1.00 38.97 ? 595 HOH A O 1 595 ? ? ? ? HETATM 1950 O O . HOH M 4 . ? 2.700 14.146 40.026 1.00 43.59 ? 596 HOH A O 1 596 ? ? ? ? HETATM 1951 O O . HOH M 4 . ? -9.955 5.420 19.464 1.00 45.11 ? 597 HOH A O 1 597 ? ? ? ? HETATM 1952 O O . HOH M 4 . ? -4.317 0.661 13.878 1.00 47.59 ? 598 HOH A O 1 598 ? ? ? ? HETATM 1953 O O . HOH M 4 . ? -5.347 2.726 19.144 1.00 40.34 ? 599 HOH A O 1 599 ? ? ? ? HETATM 1954 O O . HOH M 4 . ? -11.142 14.490 22.751 1.00 43.02 ? 600 HOH A O 1 600 ? ? ? ? HETATM 1955 O O . HOH M 4 . ? -13.391 13.418 32.027 0.50 44.63 ? 601 HOH A O 1 601 ? ? ? ? HETATM 1956 O O . HOH M 4 . ? 11.343 2.662 34.813 1.00 40.85 ? 602 HOH A O 1 602 ? ? ? ? HETATM 1957 O O . HOH M 4 . ? 20.029 -1.096 40.418 1.00 46.75 ? 603 HOH A O 1 603 ? ? ? ? HETATM 1958 O O . HOH M 4 . ? 14.467 -2.114 32.632 1.00 46.67 ? 604 HOH A O 1 604 ? ? ? ? HETATM 1959 O O . HOH M 4 . ? 4.182 2.756 10.055 1.00 37.80 ? 605 HOH A O 1 605 ? ? ? ? HETATM 1960 O O . HOH M 4 . ? -19.510 20.185 18.783 1.00 46.21 ? 606 HOH A O 1 606 ? ? ? ? HETATM 1961 O O . HOH M 4 . ? -18.395 18.154 16.875 1.00 45.87 ? 607 HOH A O 1 607 ? ? ? ? HETATM 1962 O O . HOH M 4 . ? -10.522 26.523 29.729 1.00 42.37 ? 608 HOH A O 1 608 ? ? ? ? HETATM 1963 O O . HOH M 4 . ? 29.220 14.841 36.131 1.00 47.16 ? 609 HOH A O 1 609 ? ? ? ? HETATM 1964 O O . HOH M 4 . ? 1.023 36.421 26.156 1.00 47.62 ? 610 HOH A O 1 610 ? ? ? ? HETATM 1965 O O . HOH M 4 . ? 24.084 6.253 40.552 1.00 44.07 ? 611 HOH A O 1 611 ? ? ? ? HETATM 1966 O O . HOH M 4 . ? 23.890 7.099 38.152 1.00 44.80 ? 612 HOH A O 1 612 ? ? ? ? HETATM 1967 O O . HOH M 4 . ? 0.486 33.579 12.230 1.00 41.35 ? 613 HOH A O 1 613 ? ? ? ? HETATM 1968 O O . HOH M 4 . ? 11.522 22.453 -3.825 1.00 46.66 ? 614 HOH A O 1 614 ? ? ? ? HETATM 1969 O O . HOH M 4 . ? 25.687 26.559 14.567 1.00 45.91 ? 615 HOH A O 1 615 ? ? ? ? HETATM 1970 O O . HOH M 4 . ? 27.760 22.093 20.430 1.00 41.86 ? 616 HOH A O 1 616 ? ? ? ? HETATM 1971 O O . HOH M 4 . ? 29.391 25.490 24.730 1.00 42.94 ? 617 HOH A O 1 617 ? ? ? ? HETATM 1972 O O . HOH M 4 . ? 28.305 21.572 13.768 1.00 39.74 ? 618 HOH A O 1 618 ? ? ? ? HETATM 1973 O O . HOH M 4 . ? 24.942 23.399 13.035 1.00 38.05 ? 619 HOH A O 1 619 ? ? ? ? HETATM 1974 O O . HOH M 4 . ? -0.402 -4.438 20.579 1.00 40.74 ? 620 HOH A O 1 620 ? ? ? ? HETATM 1975 O O . HOH M 4 . ? 17.513 16.253 5.134 1.00 35.73 ? 621 HOH A O 1 621 ? ? ? ? HETATM 1976 O O . HOH M 4 . ? 8.311 25.749 0.488 1.00 30.87 ? 622 HOH A O 1 622 ? ? ? ? HETATM 1977 O O . HOH M 4 . ? 21.690 25.661 22.921 1.00 36.52 ? 623 HOH A O 1 623 ? ? ? ? HETATM 1978 O O . HOH M 4 . ? 22.533 16.844 8.344 1.00 35.34 ? 624 HOH A O 1 624 ? ? ? ? HETATM 1979 O O . HOH M 4 . ? 3.082 22.159 -7.690 1.00 33.95 ? 625 HOH A O 1 625 ? ? ? ? HETATM 1980 O O . HOH M 4 . ? 28.861 2.435 29.891 1.00 34.40 ? 626 HOH A O 1 626 ? ? ? ? HETATM 1981 O O . HOH M 4 . ? 21.712 4.285 40.052 1.00 36.49 ? 627 HOH A O 1 627 ? ? ? ? HETATM 1982 O O . HOH M 4 . ? 6.914 -1.449 10.637 1.00 37.61 ? 628 HOH A O 1 628 ? ? ? ? HETATM 1983 O O . HOH M 4 . ? 12.558 6.425 36.084 1.00 32.64 ? 629 HOH A O 1 629 ? ? ? ? HETATM 1984 O O . HOH M 4 . ? 15.086 9.552 35.193 1.00 20.57 ? 630 HOH A O 1 630 ? ? ? ? HETATM 1985 O O . HOH M 4 . ? -5.770 30.925 26.834 1.00 30.74 ? 631 HOH A O 1 631 ? ? ? ? HETATM 1986 O O . HOH M 4 . ? 8.157 17.736 40.791 1.00 30.90 ? 632 HOH A O 1 632 ? ? ? ? HETATM 1987 O O . HOH M 4 . ? -0.563 18.185 31.436 1.00 36.18 ? 633 HOH A O 1 633 ? ? ? ? HETATM 1988 O O . HOH M 4 . ? 21.017 14.507 4.801 1.00 33.68 ? 634 HOH A O 1 634 ? ? ? ? HETATM 1989 O O . HOH M 4 . ? 8.499 4.799 9.005 1.00 18.96 ? 635 HOH A O 1 635 ? ? ? ? HETATM 1990 O O . HOH M 4 . ? 6.404 5.359 6.984 1.00 31.86 ? 636 HOH A O 1 636 ? ? ? ? HETATM 1991 O O . HOH M 4 . ? 4.893 7.687 9.923 1.00 21.50 ? 637 HOH A O 1 637 ? ? ? ? HETATM 1992 O O . HOH M 4 . ? 3.942 16.375 -2.412 1.00 25.40 ? 638 HOH A O 1 638 ? ? ? ? HETATM 1993 O O . HOH M 4 . ? 2.320 13.291 -2.224 1.00 31.56 ? 639 HOH A O 1 639 ? ? ? ? HETATM 1994 O O . HOH M 4 . ? 7.260 -4.278 28.328 1.00 32.37 ? 640 HOH A O 1 640 ? ? ? ? HETATM 1995 O O . HOH M 4 . ? 0.140 34.478 20.008 1.00 31.10 ? 641 HOH A O 1 641 ? ? ? ? HETATM 1996 O O . HOH M 4 . ? 1.674 36.783 20.280 1.00 35.85 ? 642 HOH A O 1 642 ? ? ? ? HETATM 1997 O O . HOH M 4 . ? 2.864 35.465 15.973 1.00 32.61 ? 643 HOH A O 1 643 ? ? ? ? HETATM 1998 O O . HOH M 4 . ? 2.870 27.955 4.587 1.00 25.17 ? 644 HOH A O 1 644 ? ? ? ? HETATM 1999 O O . HOH M 4 . ? -1.592 32.163 12.710 1.00 24.15 ? 645 HOH A O 1 645 ? ? ? ? HETATM 2000 O O . HOH M 4 . ? 0.699 33.507 9.503 1.00 35.85 ? 646 HOH A O 1 646 ? ? ? ? HETATM 2001 O O . HOH M 4 . ? 4.273 31.060 21.572 1.00 32.59 ? 647 HOH A O 1 647 ? ? ? ? HETATM 2002 O O . HOH M 4 . ? -10.228 32.645 20.742 1.00 33.49 ? 648 HOH A O 1 648 ? ? ? ? HETATM 2003 O O . HOH M 4 . ? -14.616 33.126 18.758 1.00 38.07 ? 649 HOH A O 1 649 ? ? ? ? HETATM 2004 O O . HOH M 4 . ? -13.771 34.171 15.518 1.00 35.42 ? 650 HOH A O 1 650 ? ? ? ? HETATM 2005 O O . HOH M 4 . ? -15.786 32.554 16.253 1.00 37.01 ? 651 HOH A O 1 651 ? ? ? ? HETATM 2006 O O . HOH M 4 . ? -10.105 31.902 12.121 1.00 31.19 ? 652 HOH A O 1 652 ? ? ? ? HETATM 2007 O O . HOH M 4 . ? -9.334 34.517 13.197 1.00 34.35 ? 653 HOH A O 1 653 ? ? ? ? HETATM 2008 O O . HOH M 4 . ? -0.242 18.476 41.364 1.00 33.78 ? 654 HOH A O 1 654 ? ? ? ? HETATM 2009 O O . HOH M 4 . ? 20.876 10.943 20.035 1.00 34.01 ? 655 HOH A O 1 655 ? ? ? ? HETATM 2010 O O . HOH M 4 . ? 25.078 23.926 27.012 1.00 35.07 ? 656 HOH A O 1 656 ? ? ? ? HETATM 2011 O O . HOH M 4 . ? 26.975 24.951 27.925 1.00 36.08 ? 657 HOH A O 1 657 ? ? ? ? HETATM 2012 O O . HOH M 4 . ? 8.082 4.946 41.251 1.00 38.28 ? 658 HOH A O 1 658 ? ? ? ? HETATM 2013 O O . HOH M 4 . ? 8.949 5.234 43.422 1.00 39.28 ? 659 HOH A O 1 659 ? ? ? ? HETATM 2014 O O . HOH M 4 . ? 6.612 3.269 44.734 1.00 34.50 ? 660 HOH A O 1 660 ? ? ? ? HETATM 2015 O O . HOH M 4 . ? 11.575 3.803 40.206 1.00 33.11 ? 661 HOH A O 1 661 ? ? ? ? HETATM 2016 O O . HOH M 4 . ? 29.198 1.075 34.019 1.00 37.17 ? 662 HOH A O 1 662 ? ? ? ? HETATM 2017 O O . HOH M 4 . ? 16.163 26.119 32.926 1.00 29.94 ? 663 HOH A O 1 663 ? ? ? ? HETATM 2018 O O . HOH M 4 . ? 20.891 26.205 33.559 1.00 31.39 ? 664 HOH A O 1 664 ? ? ? ? HETATM 2019 O O . HOH M 4 . ? -1.540 12.467 -0.451 1.00 27.52 ? 665 HOH A O 1 665 ? ? ? ? HETATM 2020 O O . HOH M 4 . ? 25.754 22.601 36.839 1.00 35.56 ? 666 HOH A O 1 666 ? ? ? ? HETATM 2021 O O . HOH M 4 . ? 29.715 23.739 31.566 1.00 34.80 ? 667 HOH A O 1 667 ? ? ? ? HETATM 2022 O O . HOH M 4 . ? 29.957 24.974 27.494 1.00 37.55 ? 668 HOH A O 1 668 ? ? ? ? HETATM 2023 O O . HOH M 4 . ? 31.502 20.526 25.098 1.00 36.26 ? 669 HOH A O 1 669 ? ? ? ? HETATM 2024 O O . HOH M 4 . ? 36.400 16.698 26.770 1.00 32.10 ? 670 HOH A O 1 670 ? ? ? ? HETATM 2025 O O . HOH M 4 . ? 33.180 18.530 23.721 1.00 34.91 ? 671 HOH A O 1 671 ? ? ? ? HETATM 2026 O O . HOH M 4 . ? 33.055 16.710 22.124 1.00 35.83 ? 672 HOH A O 1 672 ? ? ? ? HETATM 2027 O O . HOH M 4 . ? 26.022 24.174 16.427 1.00 33.17 ? 673 HOH A O 1 673 ? ? ? ? HETATM 2028 O O . HOH M 4 . ? 3.770 -4.695 23.419 1.00 33.95 ? 674 HOH A O 1 674 ? ? ? ? HETATM 2029 O O . HOH M 4 . ? -11.075 30.007 5.173 1.00 35.32 ? 675 HOH A O 1 675 ? ? ? ? HETATM 2030 O O . HOH M 4 . ? -9.087 34.163 6.458 1.00 35.68 ? 676 HOH A O 1 676 ? ? ? ? HETATM 2031 O O . HOH M 4 . ? -1.084 19.647 35.365 1.00 31.62 ? 677 HOH A O 1 677 ? ? ? ? HETATM 2032 O O . HOH M 4 . ? 0.687 21.453 33.686 1.00 29.72 ? 678 HOH A O 1 678 ? ? ? ? HETATM 2033 O O . HOH M 4 . ? -1.536 22.730 33.937 1.00 32.42 ? 679 HOH A O 1 679 ? ? ? ? HETATM 2034 O O . HOH M 4 . ? -4.433 8.512 10.004 1.00 34.67 ? 680 HOH A O 1 680 ? ? ? ? HETATM 2035 O O . HOH M 4 . ? -6.449 9.008 11.533 1.00 34.44 ? 681 HOH A O 1 681 ? ? ? ? HETATM 2036 O O . HOH M 4 . ? -1.121 3.778 14.292 1.00 31.85 ? 682 HOH A O 1 682 ? ? ? ? HETATM 2037 O O . HOH M 4 . ? -3.624 3.092 11.863 1.00 37.98 ? 683 HOH A O 1 683 ? ? ? ? HETATM 2038 O O . HOH M 4 . ? -5.268 6.257 7.917 1.00 35.60 ? 684 HOH A O 1 684 ? ? ? ? HETATM 2039 O O . HOH M 4 . ? 1.462 6.801 11.807 1.00 34.91 ? 685 HOH A O 1 685 ? ? ? ? HETATM 2040 O O . HOH M 4 . ? 1.936 9.459 11.919 1.00 24.49 ? 686 HOH A O 1 686 ? ? ? ? HETATM 2041 O O . HOH M 4 . ? 1.051 9.143 9.441 1.00 30.55 ? 687 HOH A O 1 687 ? ? ? ? HETATM 2042 O O . HOH M 4 . ? -16.132 14.553 15.702 1.00 36.47 ? 688 HOH A O 1 688 ? ? ? ? HETATM 2043 O O . HOH M 4 . ? -14.631 12.590 14.448 1.00 33.45 ? 689 HOH A O 1 689 ? ? ? ? HETATM 2044 O O . HOH M 4 . ? -15.175 12.705 12.212 1.00 36.63 ? 690 HOH A O 1 690 ? ? ? ? HETATM 2045 O O . HOH M 4 . ? -20.112 12.004 15.228 1.00 34.23 ? 691 HOH A O 1 691 ? ? ? ? HETATM 2046 O O . HOH M 4 . ? -17.156 7.566 10.733 1.00 36.23 ? 692 HOH A O 1 692 ? ? ? ? HETATM 2047 O O . HOH M 4 . ? -14.337 5.904 9.942 1.00 38.48 ? 693 HOH A O 1 693 ? ? ? ? HETATM 2048 O O . HOH M 4 . ? -12.976 5.386 12.060 1.00 35.10 ? 694 HOH A O 1 694 ? ? ? ? HETATM 2049 O O . HOH M 4 . ? -13.998 12.022 10.305 1.00 35.52 ? 695 HOH A O 1 695 ? ? ? ? HETATM 2050 O O . HOH M 4 . ? -12.779 9.819 11.398 1.00 39.27 ? 696 HOH A O 1 696 ? ? ? ? HETATM 2051 O O . HOH M 4 . ? -12.404 8.997 8.988 1.00 34.54 ? 697 HOH A O 1 697 ? ? ? ? HETATM 2052 O O . HOH M 4 . ? -14.800 8.523 8.054 1.00 35.05 ? 698 HOH A O 1 698 ? ? ? ? HETATM 2053 O O . HOH M 4 . ? -16.600 10.256 8.397 1.00 36.38 ? 699 HOH A O 1 699 ? ? ? ? HETATM 2054 O O . HOH M 4 . ? -18.498 10.072 6.947 1.00 34.89 ? 700 HOH A O 1 700 ? ? ? ? HETATM 2055 O O . HOH M 4 . ? -3.197 -1.702 23.941 1.00 35.31 ? 701 HOH A O 1 701 ? ? ? ? HETATM 2056 O O . HOH M 4 . ? -4.412 0.552 23.843 1.00 32.72 ? 702 HOH A O 1 702 ? ? ? ? HETATM 2057 O O . HOH M 4 . ? -1.480 1.448 31.347 1.00 32.39 ? 703 HOH A O 1 703 ? ? ? ? HETATM 2058 O O . HOH M 4 . ? 1.835 3.795 22.700 1.00 20.88 ? 704 HOH A O 1 704 ? ? ? ? HETATM 2059 O O . HOH M 4 . ? 2.839 15.457 42.123 1.00 34.57 ? 705 HOH A O 1 705 ? ? ? ? HETATM 2060 O O . HOH M 4 . ? 22.752 7.085 14.685 1.00 28.88 ? 706 HOH A O 1 706 ? ? ? ? HETATM 2061 O O . HOH M 4 . ? 22.011 9.871 11.674 1.00 29.53 ? 707 HOH A O 1 707 ? ? ? ? HETATM 2062 O O . HOH M 4 . ? 18.304 9.776 6.920 1.00 30.48 ? 708 HOH A O 1 708 ? ? ? ? HETATM 2063 O O . HOH M 4 . ? 6.264 35.979 16.938 1.00 31.80 ? 709 HOH A O 1 709 ? ? ? ? HETATM 2064 O O . HOH M 4 . ? 2.106 -1.066 19.532 1.00 33.19 ? 710 HOH A O 1 710 ? ? ? ? HETATM 2065 O O . HOH M 4 . ? 19.838 22.010 5.945 1.00 27.44 ? 711 HOH A O 1 711 ? ? ? ? HETATM 2066 O O . HOH M 4 . ? 18.749 22.984 8.678 1.00 31.31 ? 712 HOH A O 1 712 ? ? ? ? HETATM 2067 O O . HOH M 4 . ? -1.101 9.585 36.213 1.00 34.66 ? 713 HOH A O 1 713 ? ? ? ? HETATM 2068 O O . HOH M 4 . ? -0.531 9.082 39.073 1.00 34.25 ? 714 HOH A O 1 714 ? ? ? ? HETATM 2069 O O . HOH M 4 . ? -5.445 12.626 40.937 1.00 37.54 ? 715 HOH A O 1 715 ? ? ? ? HETATM 2070 O O . HOH M 4 . ? -0.179 17.764 38.664 1.00 32.76 ? 716 HOH A O 1 716 ? ? ? ? HETATM 2071 O O . HOH M 4 . ? -11.408 21.740 33.051 1.00 38.87 ? 717 HOH A O 1 717 ? ? ? ? HETATM 2072 O O . HOH M 4 . ? -12.933 21.414 35.665 1.00 36.64 ? 718 HOH A O 1 718 ? ? ? ? HETATM 2073 O O . HOH M 4 . ? 34.092 15.180 35.632 1.00 37.39 ? 719 HOH A O 1 719 ? ? ? ? HETATM 2074 O O . HOH M 4 . ? -14.136 22.014 28.540 1.00 35.75 ? 720 HOH A O 1 720 ? ? ? ? HETATM 2075 O O . HOH M 4 . ? -14.838 25.902 32.095 1.00 37.87 ? 721 HOH A O 1 721 ? ? ? ? HETATM 2076 O O . HOH M 4 . ? -10.945 24.836 33.792 1.00 35.79 ? 722 HOH A O 1 722 ? ? ? ? HETATM 2077 O O . HOH M 4 . ? -12.519 24.452 31.479 1.00 35.30 ? 723 HOH A O 1 723 ? ? ? ? HETATM 2078 O O . HOH M 4 . ? -14.507 24.003 30.051 1.00 37.00 ? 724 HOH A O 1 724 ? ? ? ? HETATM 2079 O O . HOH M 4 . ? -16.462 23.713 32.450 1.00 34.19 ? 725 HOH A O 1 725 ? ? ? ? HETATM 2080 O O . HOH M 4 . ? -18.023 24.324 30.238 1.00 37.30 ? 726 HOH A O 1 726 ? ? ? ? HETATM 2081 O O . HOH M 4 . ? -16.487 20.821 30.027 1.00 37.13 ? 727 HOH A O 1 727 ? ? ? ? HETATM 2082 O O . HOH M 4 . ? -23.063 28.336 24.240 1.00 34.23 ? 728 HOH A O 1 728 ? ? ? ? HETATM 2083 O O . HOH M 4 . ? -25.513 29.419 25.680 1.00 35.72 ? 729 HOH A O 1 729 ? ? ? ? HETATM 2084 O O . HOH M 4 . ? -21.021 24.264 27.878 1.00 35.07 ? 730 HOH A O 1 730 ? ? ? ? HETATM 2085 O O . HOH M 4 . ? -23.792 25.306 31.247 1.00 35.55 ? 731 HOH A O 1 731 ? ? ? ? HETATM 2086 O O . HOH M 4 . ? 21.847 22.495 37.104 1.00 34.24 ? 732 HOH A O 1 732 ? ? ? ? HETATM 2087 O O . HOH M 4 . ? 19.981 24.756 35.853 1.00 36.38 ? 733 HOH A O 1 733 ? ? ? ? HETATM 2088 O O . HOH M 4 . ? 25.626 11.891 6.175 1.00 35.51 ? 734 HOH A O 1 734 ? ? ? ? HETATM 2089 O O . HOH M 4 . ? 23.398 12.395 9.876 1.00 33.92 ? 735 HOH A O 1 735 ? ? ? ? HETATM 2090 O O . HOH M 4 . ? 22.290 25.980 -0.558 1.00 35.77 ? 736 HOH A O 1 736 ? ? ? ? HETATM 2091 O O . HOH M 4 . ? 25.634 25.601 -0.022 0.50 31.07 ? 737 HOH A O 1 737 ? ? ? ? HETATM 2092 O O . HOH M 4 . ? 23.191 21.145 3.228 1.00 32.11 ? 739 HOH A O 1 739 ? ? ? ? HETATM 2093 O O . HOH M 4 . ? 17.602 16.626 0.822 1.00 27.79 ? 740 HOH A O 1 740 ? ? ? ? HETATM 2094 O O . HOH M 4 . ? -0.872 28.948 5.035 1.00 26.13 ? 741 HOH A O 1 741 ? ? ? ? HETATM 2095 O O . HOH M 4 . ? -3.116 33.937 24.654 1.00 35.21 ? 742 HOH A O 1 742 ? ? ? ? HETATM 2096 O O . HOH M 4 . ? 27.850 19.070 38.990 1.00 33.16 ? 743 HOH A O 1 743 ? ? ? ? HETATM 2097 O O . HOH M 4 . ? 9.401 1.469 1.480 1.00 32.77 ? 744 HOH A O 1 744 ? ? ? ? HETATM 2098 O O . HOH M 4 . ? 7.480 2.941 1.348 1.00 37.02 ? 745 HOH A O 1 745 ? ? ? ? HETATM 2099 O O . HOH M 4 . ? 6.807 1.945 -0.779 1.00 39.37 ? 746 HOH A O 1 746 ? ? ? ? HETATM 2100 O O . HOH M 4 . ? 6.554 5.128 0.191 1.00 31.82 ? 747 HOH A O 1 747 ? ? ? ? HETATM 2101 O O . HOH M 4 . ? 13.131 -0.536 2.380 1.00 37.10 ? 748 HOH A O 1 748 ? ? ? ? HETATM 2102 O O . HOH M 4 . ? 11.034 -0.339 3.523 1.00 35.83 ? 749 HOH A O 1 749 ? ? ? ? HETATM 2103 O O . HOH M 4 . ? 3.048 11.533 -0.568 1.00 30.29 ? 750 HOH A O 1 750 ? ? ? ? HETATM 2104 O O . HOH M 4 . ? -8.959 -5.852 14.216 1.00 34.31 ? 751 HOH A O 1 751 ? ? ? ? HETATM 2105 O O . HOH M 4 . ? 16.006 3.884 42.686 1.00 36.45 ? 752 HOH A O 1 752 ? ? ? ? HETATM 2106 O O . HOH M 4 . ? 22.662 4.575 43.510 1.00 38.79 ? 753 HOH A O 1 753 ? ? ? ? HETATM 2107 O O . HOH M 4 . ? 12.978 24.229 -2.063 1.00 35.80 ? 754 HOH A O 1 754 ? ? ? ? HETATM 2108 O O . HOH M 4 . ? 13.483 20.489 -1.059 1.00 35.62 ? 755 HOH A O 1 755 ? ? ? ? HETATM 2109 O O . HOH N 4 . ? 6.254 8.179 5.992 1.00 19.65 ? 413 HOH B O 1 413 ? ? ? ? HETATM 2110 O O . HOH N 4 . ? 4.224 9.482 8.236 1.00 17.56 ? 414 HOH B O 1 414 ? ? ? ? HETATM 2111 O O . HOH N 4 . ? 11.685 12.269 5.784 1.00 9.53 ? 495 HOH B O 1 495 ? ? ? ? HETATM 2112 O O . HOH N 4 . ? 1.953 9.330 6.904 1.00 36.24 ? 511 HOH B O 1 511 ? ? ? ? # _pdbx_sifts_unp_segments.entity_id 1 _pdbx_sifts_unp_segments.asym_id A _pdbx_sifts_unp_segments.unp_acc O57413 _pdbx_sifts_unp_segments.segment_id 1 _pdbx_sifts_unp_segments.instance_id 1 _pdbx_sifts_unp_segments.unp_start 190 _pdbx_sifts_unp_segments.unp_end 392 _pdbx_sifts_unp_segments.seq_id_start 1 _pdbx_sifts_unp_segments.seq_id_end 203 _pdbx_sifts_unp_segments.best_mapping y _pdbx_sifts_unp_segments.identity 1.0 # loop_ _pdbx_sifts_xref_db_segments.entity_id _pdbx_sifts_xref_db_segments.asym_id _pdbx_sifts_xref_db_segments.xref_db _pdbx_sifts_xref_db_segments.xref_db_acc _pdbx_sifts_xref_db_segments.domain_name _pdbx_sifts_xref_db_segments.segment_id _pdbx_sifts_xref_db_segments.instance_id _pdbx_sifts_xref_db_segments.seq_id_start _pdbx_sifts_xref_db_segments.seq_id_end 1 A CATH 3.40.390.10 1kukA00 1 1 3 203 1 A SCOP2B 8040594 SF 1 1 3 203 1 A Pfam PF01421 ? 1 1 8 203 # loop_ _pdbx_sifts_xref_db.entity_id _pdbx_sifts_xref_db.asym_id _pdbx_sifts_xref_db.seq_id_ordinal _pdbx_sifts_xref_db.seq_id _pdbx_sifts_xref_db.mon_id _pdbx_sifts_xref_db.mon_id_one_letter_code _pdbx_sifts_xref_db.unp_res _pdbx_sifts_xref_db.unp_num _pdbx_sifts_xref_db.unp_acc _pdbx_sifts_xref_db.unp_segment_id _pdbx_sifts_xref_db.unp_instance_id _pdbx_sifts_xref_db.res_type _pdbx_sifts_xref_db.observed _pdbx_sifts_xref_db.mh_id _pdbx_sifts_xref_db.xref_db_name _pdbx_sifts_xref_db.xref_db_acc _pdbx_sifts_xref_db.xref_domain_name _pdbx_sifts_xref_db.xref_db_segment_id _pdbx_sifts_xref_db.xref_db_instance_id 1 A 1 1 GLU E E 190 O57413 1 1 ? n 1 ? ? ? ? ? 1 A 1 2 GLN Q Q 191 O57413 1 1 ? n 1 ? ? ? ? ? 1 A 1 3 GLN Q Q 192 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 2 3 GLN Q Q 192 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 4 ARG R R 193 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 2 4 ARG R R 193 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 5 PHE F F 194 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 2 5 PHE F F 194 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 6 PRO P P 195 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 2 6 PRO P P 195 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 7 GLN Q Q 196 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 2 7 GLN Q Q 196 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 8 ARG R R 197 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 8 ARG R R 197 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 8 ARG R R 197 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 9 TYR Y Y 198 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 9 TYR Y Y 198 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 9 TYR Y Y 198 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 10 ILE I I 199 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 10 ILE I I 199 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 10 ILE I I 199 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 11 GLU E K 200 O57413 1 1 Conflict y 1 Pfam PF01421 ? 1 1 1 A 2 11 GLU E K 200 O57413 1 1 Conflict y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 11 GLU E K 200 O57413 1 1 Conflict y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 12 LEU L L 201 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 12 LEU L L 201 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 12 LEU L L 201 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 13 ALA A A 202 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 13 ALA A A 202 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 13 ALA A A 202 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 14 ILE I I 203 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 14 ILE I I 203 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 14 ILE I I 203 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 15 VAL V V 204 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 15 VAL V V 204 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 15 VAL V V 204 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 16 VAL V V 205 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 16 VAL V V 205 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 16 VAL V V 205 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 17 ASP D D 206 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 17 ASP D D 206 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 17 ASP D D 206 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 18 HIS H H 207 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 18 HIS H H 207 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 18 HIS H H 207 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 19 GLY G G 208 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 19 GLY G G 208 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 19 GLY G G 208 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 20 MET M M 209 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 20 MET M M 209 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 20 MET M M 209 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 21 TYR Y Y 210 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 21 TYR Y Y 210 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 21 TYR Y Y 210 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 22 THR T T 211 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 22 THR T T 211 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 22 THR T T 211 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 23 LYS K K 212 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 23 LYS K K 212 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 23 LYS K K 212 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 24 TYR Y Y 213 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 24 TYR Y Y 213 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 24 TYR Y Y 213 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 25 SER S S 214 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 25 SER S S 214 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 25 SER S S 214 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 26 SER S S 215 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 26 SER S S 215 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 26 SER S S 215 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 27 ASN N N 216 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 27 ASN N N 216 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 27 ASN N N 216 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 28 PHE F F 217 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 28 PHE F F 217 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 28 PHE F F 217 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 29 LYS K K 218 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 29 LYS K K 218 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 29 LYS K K 218 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 30 LYS K K 219 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 30 LYS K K 219 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 30 LYS K K 219 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 31 ILE I I 220 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 31 ILE I I 220 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 31 ILE I I 220 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 32 ARG R R 221 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 32 ARG R R 221 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 32 ARG R R 221 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 33 LYS K K 222 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 33 LYS K K 222 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 33 LYS K K 222 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 34 ARG R R 223 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 34 ARG R R 223 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 34 ARG R R 223 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 35 VAL V V 224 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 35 VAL V V 224 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 35 VAL V V 224 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 36 HIS H H 225 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 36 HIS H H 225 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 36 HIS H H 225 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 37 GLN Q Q 226 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 37 GLN Q Q 226 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 37 GLN Q Q 226 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 38 MET M M 227 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 38 MET M M 227 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 38 MET M M 227 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 39 VAL V V 228 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 39 VAL V V 228 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 39 VAL V V 228 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 40 SER S S 229 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 40 SER S S 229 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 40 SER S S 229 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 41 ASN N N 230 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 41 ASN N N 230 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 41 ASN N N 230 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 42 ILE I I 231 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 42 ILE I I 231 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 42 ILE I I 231 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 43 ASN N N 232 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 43 ASN N N 232 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 43 ASN N N 232 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 44 GLU E E 233 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 44 GLU E E 233 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 44 GLU E E 233 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 45 MET M M 234 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 45 MET M M 234 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 45 MET M M 234 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 46 CYS C C 235 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 46 CYS C C 235 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 46 CYS C C 235 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 47 ARG R R 236 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 47 ARG R R 236 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 47 ARG R R 236 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 48 PRO P P 237 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 48 PRO P P 237 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 48 PRO P P 237 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 49 LEU L L 238 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 49 LEU L L 238 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 49 LEU L L 238 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 50 ASN N N 239 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 50 ASN N N 239 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 50 ASN N N 239 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 51 ILE I I 240 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 51 ILE I I 240 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 51 ILE I I 240 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 52 ALA A A 241 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 52 ALA A A 241 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 52 ALA A A 241 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 53 ILE I I 242 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 53 ILE I I 242 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 53 ILE I I 242 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 54 THR T T 243 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 54 THR T T 243 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 54 THR T T 243 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 55 LEU L L 244 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 55 LEU L L 244 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 55 LEU L L 244 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 56 ALA A A 245 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 56 ALA A A 245 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 56 ALA A A 245 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 57 LEU L L 246 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 57 LEU L L 246 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 57 LEU L L 246 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 58 LEU L L 247 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 58 LEU L L 247 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 58 LEU L L 247 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 59 ASP D D 248 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 59 ASP D D 248 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 59 ASP D D 248 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 60 VAL V V 249 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 60 VAL V V 249 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 60 VAL V V 249 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 61 TRP W W 250 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 61 TRP W W 250 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 61 TRP W W 250 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 62 SER S S 251 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 62 SER S S 251 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 62 SER S S 251 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 63 GLU E E 252 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 63 GLU E E 252 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 63 GLU E E 252 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 64 LYS K K 253 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 64 LYS K K 253 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 64 LYS K K 253 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 65 ASP D D 254 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 65 ASP D D 254 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 65 ASP D D 254 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 66 PHE F F 255 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 66 PHE F F 255 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 66 PHE F F 255 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 67 ILE I I 256 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 67 ILE I I 256 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 67 ILE I I 256 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 68 THR T T 257 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 68 THR T T 257 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 68 THR T T 257 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 69 VAL V V 258 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 69 VAL V V 258 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 69 VAL V V 258 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 70 GLN Q Q 259 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 70 GLN Q Q 259 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 70 GLN Q Q 259 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 71 ALA A A 260 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 71 ALA A A 260 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 71 ALA A A 260 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 72 ASP D D 261 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 72 ASP D D 261 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 72 ASP D D 261 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 73 ALA A A 262 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 73 ALA A A 262 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 73 ALA A A 262 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 74 PRO P P 263 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 74 PRO P P 263 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 74 PRO P P 263 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 75 THR T T 264 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 75 THR T T 264 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 75 THR T T 264 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 76 THR T T 265 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 76 THR T T 265 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 76 THR T T 265 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 77 ALA A A 266 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 77 ALA A A 266 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 77 ALA A A 266 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 78 GLY G G 267 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 78 GLY G G 267 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 78 GLY G G 267 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 79 LEU L L 268 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 79 LEU L L 268 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 79 LEU L L 268 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 80 PHE F F 269 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 80 PHE F F 269 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 80 PHE F F 269 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 81 GLY G G 270 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 81 GLY G G 270 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 81 GLY G G 270 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 82 ASP D D 271 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 82 ASP D D 271 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 82 ASP D D 271 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 83 TRP W W 272 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 83 TRP W W 272 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 83 TRP W W 272 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 84 ARG R R 273 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 84 ARG R R 273 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 84 ARG R R 273 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 85 GLU E E 274 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 85 GLU E E 274 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 85 GLU E E 274 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 86 ARG R R 275 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 86 ARG R R 275 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 86 ARG R R 275 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 87 VAL V V 276 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 87 VAL V V 276 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 87 VAL V V 276 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 88 LEU L L 277 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 88 LEU L L 277 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 88 LEU L L 277 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 89 LEU L L 278 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 89 LEU L L 278 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 89 LEU L L 278 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 90 LYS K K 279 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 90 LYS K K 279 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 90 LYS K K 279 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 91 LYS K K 280 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 91 LYS K K 280 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 91 LYS K K 280 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 92 LYS K K 281 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 92 LYS K K 281 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 92 LYS K K 281 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 93 ASN N N 282 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 93 ASN N N 282 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 93 ASN N N 282 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 94 HIS H H 283 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 94 HIS H H 283 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 94 HIS H H 283 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 95 ASP D D 284 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 95 ASP D D 284 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 95 ASP D D 284 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 96 HIS H H 285 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 96 HIS H H 285 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 96 HIS H H 285 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 97 ALA A A 286 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 97 ALA A A 286 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 97 ALA A A 286 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 98 GLN Q Q 287 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 98 GLN Q Q 287 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 98 GLN Q Q 287 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 99 LEU L L 288 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 99 LEU L L 288 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 99 LEU L L 288 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 100 LEU L L 289 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 100 LEU L L 289 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 100 LEU L L 289 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 101 THR T T 290 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 101 THR T T 290 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 101 THR T T 290 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 102 ASP D D 291 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 102 ASP D D 291 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 102 ASP D D 291 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 103 THR T T 292 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 103 THR T T 292 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 103 THR T T 292 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 104 ASN N N 293 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 104 ASN N N 293 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 104 ASN N N 293 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 105 PHE F F 294 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 105 PHE F F 294 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 105 PHE F F 294 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 106 ALA A A 295 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 106 ALA A A 295 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 106 ALA A A 295 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 107 ARG R R 296 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 107 ARG R R 296 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 107 ARG R R 296 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 108 ASN N N 297 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 108 ASN N N 297 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 108 ASN N N 297 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 109 THR T T 298 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 109 THR T T 298 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 109 THR T T 298 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 110 ILE I I 299 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 110 ILE I I 299 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 110 ILE I I 299 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 111 GLY G G 300 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 111 GLY G G 300 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 111 GLY G G 300 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 112 TRP W W 301 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 112 TRP W W 301 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 112 TRP W W 301 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 113 ALA A A 302 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 113 ALA A A 302 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 113 ALA A A 302 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 114 TYR Y Y 303 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 114 TYR Y Y 303 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 114 TYR Y Y 303 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 115 VAL V V 304 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 115 VAL V V 304 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 115 VAL V V 304 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 116 GLY G G 305 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 116 GLY G G 305 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 116 GLY G G 305 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 117 ARG R R 306 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 117 ARG R R 306 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 117 ARG R R 306 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 118 MET M M 307 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 118 MET M M 307 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 118 MET M M 307 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 119 CYS C C 308 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 119 CYS C C 308 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 119 CYS C C 308 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 120 ASP D D 309 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 120 ASP D D 309 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 120 ASP D D 309 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 121 GLU E E 310 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 121 GLU E E 310 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 121 GLU E E 310 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 122 LYS K K 311 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 122 LYS K K 311 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 122 LYS K K 311 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 123 TYR Y Y 312 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 123 TYR Y Y 312 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 123 TYR Y Y 312 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 124 SER S S 313 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 124 SER S S 313 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 124 SER S S 313 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 125 VAL V V 314 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 125 VAL V V 314 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 125 VAL V V 314 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 126 ALA A A 315 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 126 ALA A A 315 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 126 ALA A A 315 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 127 VAL V V 316 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 127 VAL V V 316 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 127 VAL V V 316 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 128 VAL V V 317 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 128 VAL V V 317 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 128 VAL V V 317 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 129 LYS K K 318 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 129 LYS K K 318 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 129 LYS K K 318 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 130 ASP D D 319 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 130 ASP D D 319 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 130 ASP D D 319 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 131 HIS H H 320 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 131 HIS H H 320 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 131 HIS H H 320 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 132 SER S S 321 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 132 SER S S 321 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 132 SER S S 321 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 133 SER S S 322 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 133 SER S S 322 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 133 SER S S 322 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 134 LYS K K 323 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 134 LYS K K 323 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 134 LYS K K 323 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 135 VAL V V 324 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 135 VAL V V 324 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 135 VAL V V 324 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 136 PHE F F 325 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 136 PHE F F 325 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 136 PHE F F 325 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 137 MET M M 326 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 137 MET M M 326 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 137 MET M M 326 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 138 VAL V V 327 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 138 VAL V V 327 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 138 VAL V V 327 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 139 ALA A A 328 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 139 ALA A A 328 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 139 ALA A A 328 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 140 VAL V V 329 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 140 VAL V V 329 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 140 VAL V V 329 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 141 THR T T 330 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 141 THR T T 330 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 141 THR T T 330 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 142 MET M M 331 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 142 MET M M 331 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 142 MET M M 331 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 143 THR T T 332 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 143 THR T T 332 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 143 THR T T 332 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 144 HIS H H 333 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 144 HIS H H 333 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 144 HIS H H 333 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 145 GLU E E 334 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 145 GLU E E 334 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 145 GLU E E 334 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 146 LEU L L 335 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 146 LEU L L 335 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 146 LEU L L 335 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 147 GLY G G 336 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 147 GLY G G 336 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 147 GLY G G 336 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 148 HIS H H 337 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 148 HIS H H 337 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 148 HIS H H 337 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 149 ASN N N 338 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 149 ASN N N 338 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 149 ASN N N 338 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 150 LEU L L 339 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 150 LEU L L 339 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 150 LEU L L 339 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 151 GLY G G 340 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 151 GLY G G 340 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 151 GLY G G 340 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 152 MET M M 341 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 152 MET M M 341 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 152 MET M M 341 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 153 GLU E E 342 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 153 GLU E E 342 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 153 GLU E E 342 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 154 HIS H H 343 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 154 HIS H H 343 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 154 HIS H H 343 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 155 ASP D D 344 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 155 ASP D D 344 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 155 ASP D D 344 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 156 ASP D D 345 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 156 ASP D D 345 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 156 ASP D D 345 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 157 LYS K K 346 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 157 LYS K K 346 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 157 LYS K K 346 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 158 ASP D D 347 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 158 ASP D D 347 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 158 ASP D D 347 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 159 LYS K K 348 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 159 LYS K K 348 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 159 LYS K K 348 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 160 CYS C C 349 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 160 CYS C C 349 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 160 CYS C C 349 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 161 LYS K K 350 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 161 LYS K K 350 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 161 LYS K K 350 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 162 CYS C C 351 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 162 CYS C C 351 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 162 CYS C C 351 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 163 ASP D D 352 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 163 ASP D D 352 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 163 ASP D D 352 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 164 THR T T 353 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 164 THR T T 353 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 164 THR T T 353 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 165 CYS C C 354 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 165 CYS C C 354 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 165 CYS C C 354 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 166 ILE I I 355 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 166 ILE I I 355 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 166 ILE I I 355 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 167 MET M M 356 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 167 MET M M 356 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 167 MET M M 356 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 168 SER S S 357 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 168 SER S S 357 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 168 SER S S 357 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 169 ALA A A 358 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 169 ALA A A 358 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 169 ALA A A 358 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 170 VAL V V 359 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 170 VAL V V 359 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 170 VAL V V 359 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 171 ILE I I 360 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 171 ILE I I 360 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 171 ILE I I 360 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 172 SER S S 361 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 172 SER S S 361 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 172 SER S S 361 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 173 ASP D D 362 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 173 ASP D D 362 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 173 ASP D D 362 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 174 LYS K K 363 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 174 LYS K K 363 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 174 LYS K K 363 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 175 GLN Q Q 364 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 175 GLN Q Q 364 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 175 GLN Q Q 364 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 176 SER S S 365 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 176 SER S S 365 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 176 SER S S 365 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 177 LYS K K 366 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 177 LYS K K 366 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 177 LYS K K 366 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 178 LEU L L 367 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 178 LEU L L 367 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 178 LEU L L 367 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 179 PHE F F 368 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 179 PHE F F 368 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 179 PHE F F 368 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 180 SER S S 369 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 180 SER S S 369 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 180 SER S S 369 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 181 ASP D D 370 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 181 ASP D D 370 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 181 ASP D D 370 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 182 CYS C C 371 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 182 CYS C C 371 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 182 CYS C C 371 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 183 SER S S 372 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 183 SER S S 372 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 183 SER S S 372 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 184 LYS K K 373 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 184 LYS K K 373 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 184 LYS K K 373 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 185 ASP D D 374 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 185 ASP D D 374 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 185 ASP D D 374 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 186 TYR Y Y 375 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 186 TYR Y Y 375 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 186 TYR Y Y 375 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 187 TYR Y Y 376 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 187 TYR Y Y 376 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 187 TYR Y Y 376 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 188 GLN Q Q 377 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 188 GLN Q Q 377 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 188 GLN Q Q 377 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 189 THR T T 378 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 189 THR T T 378 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 189 THR T T 378 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 190 PHE F F 379 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 190 PHE F F 379 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 190 PHE F F 379 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 191 LEU L L 380 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 191 LEU L L 380 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 191 LEU L L 380 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 192 THR T T 381 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 192 THR T T 381 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 192 THR T T 381 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 193 ASN N N 382 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 193 ASN N N 382 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 193 ASN N N 382 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 194 ASP D D 383 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 194 ASP D D 383 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 194 ASP D D 383 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 195 ASN N N 384 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 195 ASN N N 384 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 195 ASN N N 384 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 196 PRO P P 385 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 196 PRO P P 385 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 196 PRO P P 385 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 197 GLN Q Q 386 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 197 GLN Q Q 386 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 197 GLN Q Q 386 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 198 CYS C C 387 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 198 CYS C C 387 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 198 CYS C C 387 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 199 ILE I I 388 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 199 ILE I I 388 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 199 ILE I I 388 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 200 LEU L L 389 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 200 LEU L L 389 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 200 LEU L L 389 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 201 ASN N N 390 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 201 ASN N N 390 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 201 ASN N N 390 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 202 ALA A A 391 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 202 ALA A A 391 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 202 ALA A A 391 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 1 A 1 203 PRO P P 392 O57413 1 1 ? y 1 Pfam PF01421 ? 1 1 1 A 2 203 PRO P P 392 O57413 1 1 ? y 1 CATH 3.40.390.10 1kukA00 1 1 1 A 3 203 PRO P P 392 O57413 1 1 ? y 1 SCOP2 8040594 SCOP2B-SF 1 1 #