data_0 # _entry.id 0 # _struct_asym.id A _struct_asym.entity_id 0 # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.pdbx_strand_id A # _entity.id 0 _entity.type polymer # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id 0 1 MET 0 2 LYS 0 3 VAL 0 4 SER 0 5 ASN 0 6 GLU 0 7 THR 0 8 CYS 0 9 LEU 0 10 SER 0 11 ALA 0 12 SER 0 13 LYS 0 14 PRO 0 15 ASP 0 16 MET 0 17 GLU 0 18 CYS 0 19 HIS 0 20 TRP 0 21 CYS 0 22 SER 0 23 THR 0 24 ALA 0 25 ASN 0 26 LEU 0 27 CYS 0 28 SER 0 29 ASN 0 30 GLY 0 31 ARG 0 32 ASP 0 33 THR 0 34 LEU 0 35 SER 0 36 LYS 0 37 ALA 0 38 TRP 0 39 MET 0 40 ILE 0 41 ASN 0 42 ASN 0 43 CYS 0 44 THR 0 45 LYS 0 46 ASN 0 47 ASN 0 48 MET 0 49 GLN 0 50 LYS 0 51 ASP 0 52 LYS 0 53 LYS 0 54 SER 0 55 ASP 0 56 HIS 0 57 LYS 0 58 ASP 0 59 LYS 0 60 LYS 0 61 SER 0 62 GLU 0 63 HIS 0 64 MET 0 65 ASP 0 66 ASN 0 67 LYS 0 68 SER 0 69 ASP 0 70 GLN 0 71 LYS 0 72 ASP 0 73 LYS 0 74 LYS 0 75 SER 0 76 GLU 0 77 GLN 0 78 MET 0 79 ASP 0 80 ASN 0 81 LYS 0 82 SER 0 83 ASP 0 84 GLN 0 85 LYS 0 86 ASP 0 87 ASN 0 88 LYS 0 89 PRO 0 90 MET 0 91 PHE 0 92 ASN 0 93 TYR 0 94 LEU 0 95 TYR 0 96 VAL 0 97 LEU 0 98 ILE 0 99 PRO 0 100 SER 0 101 VAL 0 102 ILE 0 103 GLY 0 104 LEU 0 105 VAL 0 106 ILE 0 107 VAL 0 108 CYS 0 109 VAL 0 110 GLY 0 111 PHE 0 112 ILE 0 113 VAL 0 114 TRP 0 115 PHE 0 116 TRP 0 117 LEU 0 118 SER 0 119 LYS 0 120 ARG 0 121 GLN # loop_ _chem_comp.id _chem_comp.type _chem_comp.name ALA 'L-peptide linking' ALANINE ARG 'L-peptide linking' ARGININE ASN 'L-peptide linking' ASPARAGINE ASP 'L-peptide linking' 'ASPARTIC ACID' CYS 'L-peptide linking' CYSTEINE GLN 'L-peptide linking' GLUTAMINE GLU 'L-peptide linking' 'GLUTAMIC ACID' HIS 'L-peptide linking' HISTIDINE ILE 'L-peptide linking' ISOLEUCINE LEU 'L-peptide linking' LEUCINE LYS 'L-peptide linking' LYSINE MET 'L-peptide linking' METHIONINE PHE 'L-peptide linking' PHENYLALANINE PRO 'L-peptide linking' PROLINE SER 'L-peptide linking' SERINE THR 'L-peptide linking' THREONINE TRP 'L-peptide linking' TRYPTOPHAN TYR 'L-peptide linking' TYROSINE VAL 'L-peptide linking' VALINE GLY 'peptide linking' GLYCINE # 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.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 0 1 . 24.287 -6.361 -12.865 1.00 50.44 1 A 1 ATOM 2 C CA . MET A 0 1 . 24.780 -5.605 -14.037 1.00 50.44 1 A 1 ATOM 3 C C . MET A 0 1 . 24.402 -4.147 -13.832 1.00 50.44 1 A 1 ATOM 4 C CB . MET A 0 1 . 24.156 -6.162 -15.327 1.00 50.44 1 A 1 ATOM 5 O O . MET A 0 1 . 23.230 -3.885 -13.602 1.00 50.44 1 A 1 ATOM 6 C CG . MET A 0 1 . 24.680 -7.569 -15.648 1.00 50.44 1 A 1 ATOM 7 S SD . MET A 0 1 . 23.682 -8.439 -16.876 1.00 50.44 1 A 1 ATOM 8 C CE . MET A 0 1 . 24.674 -9.942 -17.106 1.00 50.44 1 A 1 ATOM 9 N N . LYS A 0 2 . 25.367 -3.221 -13.799 1.00 60.44 2 A 1 ATOM 10 C CA . LYS A 0 2 . 25.065 -1.781 -13.782 1.00 60.44 2 A 1 ATOM 11 C C . LYS A 0 2 . 24.843 -1.364 -15.235 1.00 60.44 2 A 1 ATOM 12 C CB . LYS A 0 2 . 26.213 -0.978 -13.137 1.00 60.44 2 A 1 ATOM 13 O O . LYS A 0 2 . 25.772 -1.472 -16.026 1.00 60.44 2 A 1 ATOM 14 C CG . LYS A 0 2 . 26.352 -1.210 -11.621 1.00 60.44 2 A 1 ATOM 15 C CD . LYS A 0 2 . 27.505 -0.372 -11.043 1.00 60.44 2 A 1 ATOM 16 C CE . LYS A 0 2 . 27.651 -0.590 -9.530 1.00 60.44 2 A 1 ATOM 17 N NZ . LYS A 0 2 . 28.758 0.225 -8.960 1.00 60.44 2 A 1 ATOM 18 N N . VAL A 0 3 . 23.622 -0.983 -15.591 1.00 73.77 3 A 1 ATOM 19 C CA . VAL A 0 3 . 23.316 -0.450 -16.928 1.00 73.77 3 A 1 ATOM 20 C C . VAL A 0 3 . 23.786 1.002 -16.946 1.00 73.77 3 A 1 ATOM 21 C CB . VAL A 0 3 . 21.810 -0.588 -17.237 1.00 73.77 3 A 1 ATOM 22 O O . VAL A 0 3 . 23.511 1.716 -15.988 1.00 73.77 3 A 1 ATOM 23 C CG1 . VAL A 0 3 . 21.447 -0.055 -18.626 1.00 73.77 3 A 1 ATOM 24 C CG2 . VAL A 0 3 . 21.376 -2.061 -17.177 1.00 73.77 3 A 1 ATOM 25 N N . SER A 0 4 . 24.531 1.436 -17.963 1.00 81.26 4 A 1 ATOM 26 C CA . SER A 0 4 . 24.880 2.854 -18.126 1.00 81.26 4 A 1 ATOM 27 C C . SER A 0 4 . 23.771 3.606 -18.865 1.00 81.26 4 A 1 ATOM 28 C CB . SER A 0 4 . 26.245 3.022 -18.805 1.00 81.26 4 A 1 ATOM 29 O O . SER A 0 4 . 22.958 2.999 -19.567 1.00 81.26 4 A 1 ATOM 30 O OG . SER A 0 4 . 26.242 2.513 -20.116 1.00 81.26 4 A 1 ATOM 31 N N . ASN A 0 5 . 23.734 4.934 -18.723 1.00 81.43 5 A 1 ATOM 32 C CA . ASN A 0 5 . 22.754 5.786 -19.406 1.00 81.43 5 A 1 ATOM 33 C C . ASN A 0 5 . 22.751 5.547 -20.928 1.00 81.43 5 A 1 ATOM 34 C CB . ASN A 0 5 . 23.076 7.252 -19.062 1.00 81.43 5 A 1 ATOM 35 O O . ASN A 0 5 . 21.702 5.324 -21.525 1.00 81.43 5 A 1 ATOM 36 C CG . ASN A 0 5 . 22.073 8.235 -19.646 1.00 81.43 5 A 1 ATOM 37 N ND2 . ASN A 0 5 . 22.391 9.508 -19.663 1.00 81.43 5 A 1 ATOM 38 O OD1 . ASN A 0 5 . 20.991 7.895 -20.072 1.00 81.43 5 A 1 ATOM 39 N N . GLU A 0 6 . 23.934 5.487 -21.544 1.00 81.09 6 A 1 ATOM 40 C CA . GLU A 0 6 . 24.070 5.255 -22.988 1.00 81.09 6 A 1 ATOM 41 C C . GLU A 0 6 . 23.528 3.880 -23.423 1.00 81.09 6 A 1 ATOM 42 C CB . GLU A 0 6 . 25.542 5.473 -23.388 1.00 81.09 6 A 1 ATOM 43 O O . GLU A 0 6 . 22.909 3.746 -24.478 1.00 81.09 6 A 1 ATOM 44 C CG . GLU A 0 6 . 26.511 4.365 -22.927 1.00 81.09 6 A 1 ATOM 45 C CD . GLU A 0 6 . 27.745 4.862 -22.172 1.00 81.09 6 A 1 ATOM 46 O OE1 . GLU A 0 6 . 28.069 4.188 -21.163 1.00 81.09 6 A 1 ATOM 47 O OE2 . GLU A 0 6 . 28.292 5.918 -22.545 1.00 81.09 6 A 1 ATOM 48 N N . THR A 0 7 . 23.671 2.865 -22.567 1.00 83.16 7 A 1 ATOM 49 C CA . THR A 0 7 . 23.169 1.510 -22.816 1.00 83.16 7 A 1 ATOM 50 C C . THR A 0 7 . 21.646 1.474 -22.697 1.00 83.16 7 A 1 ATOM 51 C CB . THR A 0 7 . 23.795 0.507 -21.838 1.00 83.16 7 A 1 ATOM 52 O O . THR A 0 7 . 20.970 0.801 -23.466 1.00 83.16 7 A 1 ATOM 53 C CG2 . THR A 0 7 . 23.439 -0.933 -22.202 1.00 83.16 7 A 1 ATOM 54 O OG1 . THR A 0 7 . 25.203 0.563 -21.855 1.00 83.16 7 A 1 ATOM 55 N N . CYS A 0 8 . 21.086 2.232 -21.753 1.00 83.67 8 A 1 ATOM 56 C CA . CYS A 0 8 . 19.643 2.358 -21.580 1.00 83.67 8 A 1 ATOM 57 C C . CYS A 0 8 . 18.975 3.012 -22.794 1.00 83.67 8 A 1 ATOM 58 C CB . CYS A 0 8 . 19.385 3.195 -20.326 1.00 83.67 8 A 1 ATOM 59 O O . CYS A 0 8 . 17.995 2.493 -23.324 1.00 83.67 8 A 1 ATOM 60 S SG . CYS A 0 8 . 17.637 3.429 -19.940 1.00 83.67 8 A 1 ATOM 61 N N . LEU A 0 9 . 19.534 4.138 -23.243 1.00 81.52 9 A 1 ATOM 62 C CA . LEU A 0 9 . 18.986 4.907 -24.357 1.00 81.52 9 A 1 ATOM 63 C C . LEU A 0 9 . 19.152 4.177 -25.692 1.00 81.52 9 A 1 ATOM 64 C CB . LEU A 0 9 . 19.650 6.292 -24.386 1.00 81.52 9 A 1 ATOM 65 O O . LEU A 0 9 . 18.243 4.207 -26.513 1.00 81.52 9 A 1 ATOM 66 C CG . LEU A 0 9 . 19.317 7.181 -23.172 1.00 81.52 9 A 1 ATOM 67 C CD1 . LEU A 0 9 . 20.129 8.473 -23.261 1.00 81.52 9 A 1 ATOM 68 C CD2 . LEU A 0 9 . 17.832 7.545 -23.099 1.00 81.52 9 A 1 ATOM 69 N N . SER A 0 10 . 20.263 3.465 -25.894 1.00 83.12 10 A 1 ATOM 70 C CA . SER A 0 10 . 20.465 2.648 -27.100 1.00 83.12 10 A 1 ATOM 71 C C . SER A 0 10 . 19.573 1.404 -27.152 1.00 83.12 10 A 1 ATOM 72 C CB . SER A 0 10 . 21.934 2.247 -27.244 1.00 83.12 10 A 1 ATOM 73 O O . SER A 0 10 . 19.263 0.923 -28.239 1.00 83.12 10 A 1 ATOM 74 O OG . SER A 0 10 . 22.393 1.571 -26.095 1.00 83.12 10 A 1 ATOM 75 N N . ALA A 0 11 . 19.117 0.900 -26.002 1.00 81.58 11 A 1 ATOM 76 C CA . ALA A 0 11 . 18.141 -0.186 -25.932 1.00 81.58 11 A 1 ATOM 77 C C . ALA A 0 11 . 16.695 0.270 -26.210 1.00 81.58 11 A 1 ATOM 78 C CB . ALA A 0 11 . 18.268 -0.862 -24.562 1.00 81.58 11 A 1 ATOM 79 O O . ALA A 0 11 . 15.815 -0.582 -26.360 1.00 81.58 11 A 1 ATOM 80 N N . SER A 0 12 . 16.446 1.583 -26.273 1.00 80.31 12 A 1 ATOM 81 C CA . SER A 0 12 . 15.132 2.153 -26.563 1.00 80.31 12 A 1 ATOM 82 C C . SER A 0 12 . 14.700 1.803 -27.989 1.00 80.31 12 A 1 ATOM 83 C CB . SER A 0 12 . 15.169 3.668 -26.363 1.00 80.31 12 A 1 ATOM 84 O O . SER A 0 12 . 15.411 2.066 -28.960 1.00 80.31 12 A 1 ATOM 85 O OG . SER A 0 12 . 13.854 4.170 -26.288 1.00 80.31 12 A 1 ATOM 86 N N . LYS A 0 13 . 13.530 1.180 -28.120 1.00 78.24 13 A 1 ATOM 87 C CA . LYS A 0 13 . 12.920 0.795 -29.400 1.00 78.24 13 A 1 ATOM 88 C C . LYS A 0 13 . 11.664 1.635 -29.630 1.00 78.24 13 A 1 ATOM 89 C CB . LYS A 0 13 . 12.616 -0.712 -29.394 1.00 78.24 13 A 1 ATOM 90 O O . LYS A 0 13 . 11.051 2.053 -28.654 1.00 78.24 13 A 1 ATOM 91 C CG . LYS A 0 13 . 13.903 -1.547 -29.451 1.00 78.24 13 A 1 ATOM 92 C CD . LYS A 0 13 . 13.573 -3.042 -29.485 1.00 78.24 13 A 1 ATOM 93 C CE . LYS A 0 13 . 14.870 -3.853 -29.445 1.00 78.24 13 A 1 ATOM 94 N NZ . LYS A 0 13 . 14.590 -5.309 -29.476 1.00 78.24 13 A 1 ATOM 95 N N . PRO A 0 14 . 11.205 1.815 -30.882 1.00 74.74 14 A 1 ATOM 96 C CA . PRO A 0 14 . 9.960 2.544 -31.154 1.00 74.74 14 A 1 ATOM 97 C C . PRO A 0 14 . 8.737 1.960 -30.423 1.00 74.74 14 A 1 ATOM 98 C CB . PRO A 0 14 . 9.791 2.494 -32.678 1.00 74.74 14 A 1 ATOM 99 O O . PRO A 0 14 . 7.801 2.688 -30.125 1.00 74.74 14 A 1 ATOM 100 C CG . PRO A 0 14 . 10.628 1.290 -33.113 1.00 74.74 14 A 1 ATOM 101 C CD . PRO A 0 14 . 11.784 1.310 -32.118 1.00 74.74 14 A 1 ATOM 102 N N . ASP A 0 15 . 8.762 0.664 -30.102 1.00 75.68 15 A 1 ATOM 103 C CA . ASP A 0 15 . 7.701 -0.018 -29.348 1.00 75.68 15 A 1 ATOM 104 C C . ASP A 0 15 . 7.923 0.003 -27.817 1.00 75.68 15 A 1 ATOM 105 C CB . ASP A 0 15 . 7.626 -1.449 -29.896 1.00 75.68 15 A 1 ATOM 106 O O . ASP A 0 15 . 6.992 -0.162 -27.027 1.00 75.68 15 A 1 ATOM 107 C CG . ASP A 0 15 . 6.347 -2.175 -29.483 1.00 75.68 15 A 1 ATOM 108 O OD1 . ASP A 0 15 . 5.261 -1.589 -29.683 1.00 75.68 15 A 1 ATOM 109 O OD2 . ASP A 0 15 . 6.479 -3.330 -29.019 1.00 75.68 15 A 1 ATOM 110 N N . MET A 0 16 . 9.164 0.238 -27.372 1.00 71.76 16 A 1 ATOM 111 C CA . MET A 0 16 . 9.557 0.249 -25.961 1.00 71.76 16 A 1 ATOM 112 C C . MET A 0 16 . 10.545 1.380 -25.685 1.00 71.76 16 A 1 ATOM 113 C CB . MET A 0 16 . 10.145 -1.104 -25.533 1.00 71.76 16 A 1 ATOM 114 O O . MET A 0 16 . 11.760 1.206 -25.796 1.00 71.76 16 A 1 ATOM 115 C CG . MET A 0 16 . 9.106 -2.226 -25.586 1.00 71.76 16 A 1 ATOM 116 S SD . MET A 0 16 . 9.432 -3.563 -24.409 1.00 71.76 16 A 1 ATOM 117 C CE . MET A 0 16 . 8.153 -4.725 -24.946 1.00 71.76 16 A 1 ATOM 118 N N . GLU A 0 17 . 10.001 2.535 -25.309 1.00 77.63 17 A 1 ATOM 119 C CA . GLU A 0 17 . 10.793 3.705 -24.950 1.00 77.63 17 A 1 ATOM 120 C C . GLU A 0 17 . 11.403 3.529 -23.557 1.00 77.63 17 A 1 ATOM 121 C CB . GLU A 0 17 . 9.941 4.974 -25.068 1.00 77.63 17 A 1 ATOM 122 O O . GLU A 0 17 . 10.693 3.481 -22.554 1.00 77.63 17 A 1 ATOM 123 C CG . GLU A 0 17 . 10.811 6.236 -24.951 1.00 77.63 17 A 1 ATOM 124 C CD . GLU A 0 17 . 10.036 7.536 -25.220 1.00 77.63 17 A 1 ATOM 125 O OE1 . GLU A 0 17 . 10.605 8.606 -24.902 1.00 77.63 17 A 1 ATOM 126 O OE2 . GLU A 0 17 . 8.909 7.466 -25.758 1.00 77.63 17 A 1 ATOM 127 N N . CYS A 0 18 . 12.727 3.400 -23.494 1.00 80.09 18 A 1 ATOM 128 C CA . CYS A 0 18 . 13.465 3.273 -22.243 1.00 80.09 18 A 1 ATOM 129 C C . CYS A 0 18 . 13.936 4.641 -21.751 1.00 80.09 18 A 1 ATOM 130 C CB . CYS A 0 18 . 14.643 2.312 -22.428 1.00 80.09 18 A 1 ATOM 131 O O . CYS A 0 18 . 14.450 5.459 -22.514 1.00 80.09 18 A 1 ATOM 132 S SG . CYS A 0 18 . 14.035 0.605 -22.529 1.00 80.09 18 A 1 ATOM 133 N N . HIS A 0 19 . 13.840 4.855 -20.444 1.00 82.39 19 A 1 ATOM 134 C CA . HIS A 0 19 . 14.259 6.083 -19.796 1.00 82.39 19 A 1 ATOM 135 C C . HIS A 0 19 . 15.302 5.817 -18.713 1.00 82.39 19 A 1 ATOM 136 C CB . HIS A 0 19 . 13.031 6.754 -19.206 1.00 82.39 19 A 1 ATOM 137 O O . HIS A 0 19 . 15.264 4.806 -18.005 1.00 82.39 19 A 1 ATOM 138 C CG . HIS A 0 19 . 12.006 7.199 -20.215 1.00 82.39 19 A 1 ATOM 139 C CD2 . HIS A 0 19 . 10.685 6.850 -20.199 1.00 82.39 19 A 1 ATOM 140 N ND1 . HIS A 0 19 . 12.179 8.089 -21.256 1.00 82.39 19 A 1 ATOM 141 C CE1 . HIS A 0 19 . 10.978 8.296 -21.822 1.00 82.39 19 A 1 ATOM 142 N NE2 . HIS A 0 19 . 10.038 7.579 -21.190 1.00 82.39 19 A 1 ATOM 143 N N . TRP A 0 20 . 16.220 6.767 -18.543 1.00 84.00 20 A 1 ATOM 144 C CA . TRP A 0 20 . 17.290 6.668 -17.561 1.00 84.00 20 A 1 ATOM 145 C C . TRP A 0 20 . 16.978 7.455 -16.289 1.00 84.00 20 A 1 ATOM 146 C CB . TRP A 0 20 . 18.607 7.128 -18.180 1.00 84.00 20 A 1 ATOM 147 O O . TRP A 0 20 . 16.879 8.682 -16.300 1.00 84.00 20 A 1 ATOM 148 C CG . TRP A 0 20 . 19.733 7.079 -17.200 1.00 84.00 20 A 1 ATOM 149 C CD1 . TRP A 0 20 . 20.306 8.145 -16.602 1.00 84.00 20 A 1 ATOM 150 C CD2 . TRP A 0 20 . 20.379 5.902 -16.642 1.00 84.00 20 A 1 ATOM 151 C CE2 . TRP A 0 20 . 21.341 6.335 -15.684 1.00 84.00 20 A 1 ATOM 152 C CE3 . TRP A 0 20 . 20.235 4.514 -16.844 1.00 84.00 20 A 1 ATOM 153 N NE1 . TRP A 0 20 . 21.258 7.711 -15.700 1.00 84.00 20 A 1 ATOM 154 C CH2 . TRP A 0 20 . 21.933 4.062 -15.150 1.00 84.00 20 A 1 ATOM 155 C CZ2 . TRP A 0 20 . 22.117 5.437 -14.944 1.00 84.00 20 A 1 ATOM 156 C CZ3 . TRP A 0 20 . 21.010 3.602 -16.108 1.00 84.00 20 A 1 ATOM 157 N N . CYS A 0 21 . 16.929 6.765 -15.151 1.00 82.06 21 A 1 ATOM 158 C CA . CYS A 0 21 . 16.810 7.418 -13.859 1.00 82.06 21 A 1 ATOM 159 C C . CYS A 0 21 . 18.168 7.594 -13.185 1.00 82.06 21 A 1 ATOM 160 C CB . CYS A 0 21 . 15.845 6.669 -12.961 1.00 82.06 21 A 1 ATOM 161 O O . CYS A 0 21 . 18.724 6.662 -12.602 1.00 82.06 21 A 1 ATOM 162 S SG . CYS A 0 21 . 15.552 7.638 -11.463 1.00 82.06 21 A 1 ATOM 163 N N . SER A 0 22 . 18.656 8.835 -13.170 1.00 81.21 22 A 1 ATOM 164 C CA . SER A 0 22 . 19.911 9.178 -12.488 1.00 81.21 22 A 1 ATOM 165 C C . SER A 0 22 . 19.835 9.039 -10.965 1.00 81.21 22 A 1 ATOM 166 C CB . SER A 0 22 . 20.330 10.600 -12.848 1.00 81.21 22 A 1 ATOM 167 O O . SER A 0 22 . 20.847 8.745 -10.341 1.00 81.21 22 A 1 ATOM 168 O OG . SER A 0 22 . 20.606 10.677 -14.237 1.00 81.21 22 A 1 ATOM 169 N N . THR A 0 23 . 18.652 9.213 -10.365 1.00 77.86 23 A 1 ATOM 170 C CA . THR A 0 23 . 18.453 9.088 -8.910 1.00 77.86 23 A 1 ATOM 171 C C . THR A 0 23 . 18.711 7.665 -8.422 1.00 77.86 23 A 1 ATOM 172 C CB . THR A 0 23 . 17.010 9.457 -8.526 1.00 77.86 23 A 1 ATOM 173 O O . THR A 0 23 . 19.309 7.459 -7.373 1.00 77.86 23 A 1 ATOM 174 C CG2 . THR A 0 23 . 16.841 9.676 -7.025 1.00 77.86 23 A 1 ATOM 175 O OG1 . THR A 0 23 . 16.577 10.628 -9.184 1.00 77.86 23 A 1 ATOM 176 N N . ALA A 0 24 . 18.264 6.679 -9.200 1.00 74.36 24 A 1 ATOM 177 C CA . ALA A 0 24 . 18.278 5.275 -8.812 1.00 74.36 24 A 1 ATOM 178 C C . ALA A 0 24 . 19.267 4.426 -9.624 1.00 74.36 24 A 1 ATOM 179 C CB . ALA A 0 24 . 16.838 4.789 -8.888 1.00 74.36 24 A 1 ATOM 180 O O . ALA A 0 24 . 19.357 3.221 -9.404 1.00 74.36 24 A 1 ATOM 181 N N . ASN A 0 25 . 20.008 5.050 -10.550 1.00 80.31 25 A 1 ATOM 182 C CA . ASN A 0 25 . 20.919 4.394 -11.492 1.00 80.31 25 A 1 ATOM 183 C C . ASN A 0 25 . 20.279 3.176 -12.176 1.00 80.31 25 A 1 ATOM 184 C CB . ASN A 0 25 . 22.261 4.095 -10.807 1.00 80.31 25 A 1 ATOM 185 O O . ASN A 0 25 . 20.881 2.104 -12.263 1.00 80.31 25 A 1 ATOM 186 C CG . ASN A 0 25 . 22.986 5.365 -10.427 1.00 80.31 25 A 1 ATOM 187 N ND2 . ASN A 0 25 . 23.123 5.648 -9.153 1.00 80.31 25 A 1 ATOM 188 O OD1 . ASN A 0 25 . 23.424 6.123 -11.274 1.00 80.31 25 A 1 ATOM 189 N N . LEU A 0 26 . 19.033 3.344 -12.621 1.00 79.07 26 A 1 ATOM 190 C CA . LEU A 0 26 . 18.245 2.296 -13.261 1.00 79.07 26 A 1 ATOM 191 C C . LEU A 0 26 . 17.679 2.779 -14.593 1.00 79.07 26 A 1 ATOM 192 C CB . LEU A 0 26 . 17.191 1.723 -12.288 1.00 79.07 26 A 1 ATOM 193 O O . LEU A 0 26 . 17.381 3.960 -14.773 1.00 79.07 26 A 1 ATOM 194 C CG . LEU A 0 26 . 16.084 2.689 -11.825 1.00 79.07 26 A 1 ATOM 195 C CD1 . LEU A 0 26 . 14.916 2.827 -12.796 1.00 79.07 26 A 1 ATOM 196 C CD2 . LEU A 0 26 . 15.463 2.196 -10.515 1.00 79.07 26 A 1 ATOM 197 N N . CYS A 0 27 . 17.519 1.831 -15.505 1.00 79.83 27 A 1 ATOM 198 C CA . CYS A 0 27 . 16.846 2.005 -16.780 1.00 79.83 27 A 1 ATOM 199 C C . CYS A 0 27 . 15.469 1.347 -16.690 1.00 79.83 27 A 1 ATOM 200 C CB . CYS A 0 27 . 17.692 1.326 -17.855 1.00 79.83 27 A 1 ATOM 201 O O . CYS A 0 27 . 15.379 0.206 -16.235 1.00 79.83 27 A 1 ATOM 202 S SG . CYS A 0 27 . 17.054 1.543 -19.525 1.00 79.83 27 A 1 ATOM 203 N N . SER A 0 28 . 14.409 2.038 -17.096 1.00 80.23 28 A 1 ATOM 204 C CA . SER A 0 28 . 13.084 1.425 -17.232 1.00 80.23 28 A 1 ATOM 205 C C . SER A 0 28 . 12.245 2.187 -18.245 1.00 80.23 28 A 1 ATOM 206 C CB . SER A 0 28 . 12.361 1.386 -15.883 1.00 80.23 28 A 1 ATOM 207 O O . SER A 0 28 . 12.417 3.390 -18.425 1.00 80.23 28 A 1 ATOM 208 O OG . SER A 0 28 . 11.122 0.707 -15.967 1.00 80.23 28 A 1 ATOM 209 N N . ASN A 0 29 . 11.306 1.493 -18.878 1.00 75.31 29 A 1 ATOM 210 C CA . ASN A 0 29 . 10.313 2.090 -19.772 1.00 75.31 29 A 1 ATOM 211 C C . ASN A 0 29 . 9.076 2.650 -19.032 1.00 75.31 29 A 1 ATOM 212 C CB . ASN A 0 29 . 9.958 1.035 -20.837 1.00 75.31 29 A 1 ATOM 213 O O . ASN A 0 29 . 8.070 2.989 -19.653 1.00 75.31 29 A 1 ATOM 214 C CG . ASN A 0 29 . 9.282 -0.182 -20.241 1.00 75.31 29 A 1 ATOM 215 N ND2 . ASN A 0 29 . 9.266 -1.295 -20.926 1.00 75.31 29 A 1 ATOM 216 O OD1 . ASN A 0 29 . 8.763 -0.144 -19.137 1.00 75.31 29 A 1 ATOM 217 N N . GLY A 0 30 . 9.087 2.666 -17.691 1.00 66.70 30 A 1 ATOM 218 C CA . GLY A 0 30 . 7.958 3.101 -16.857 1.00 66.70 30 A 1 ATOM 219 C C . GLY A 0 30 . 6.768 2.127 -16.798 1.00 66.70 30 A 1 ATOM 220 O O . GLY A 0 30 . 5.926 2.261 -15.907 1.00 66.70 30 A 1 ATOM 221 N N . ARG A 0 31 . 6.723 1.120 -17.682 1.00 64.06 31 A 1 ATOM 222 C CA . ARG A 0 31 . 5.732 0.030 -17.748 1.00 64.06 31 A 1 ATOM 223 C C . ARG A 0 31 . 6.243 -1.307 -17.192 1.00 64.06 31 A 1 ATOM 224 C CB . ARG A 0 31 . 5.237 -0.123 -19.201 1.00 64.06 31 A 1 ATOM 225 O O . ARG A 0 31 . 5.436 -2.201 -16.950 1.00 64.06 31 A 1 ATOM 226 C CG . ARG A 0 31 . 4.160 0.918 -19.550 1.00 64.06 31 A 1 ATOM 227 C CD . ARG A 0 31 . 3.541 0.693 -20.941 1.00 64.06 31 A 1 ATOM 228 N NE . ARG A 0 31 . 4.286 1.381 -22.016 1.00 64.06 31 A 1 ATOM 229 N NH1 . ARG A 0 31 . 3.409 0.246 -23.822 1.00 64.06 31 A 1 ATOM 230 N NH2 . ARG A 0 31 . 4.837 1.916 -24.164 1.00 64.06 31 A 1 ATOM 231 C CZ . ARG A 0 31 . 4.171 1.180 -23.321 1.00 64.06 31 A 1 ATOM 232 N N . ASP A 0 32 . 7.544 -1.444 -16.953 1.00 64.30 32 A 1 ATOM 233 C CA . ASP A 0 32 . 8.149 -2.658 -16.399 1.00 64.30 32 A 1 ATOM 234 C C . ASP A 0 32 . 7.774 -2.885 -14.923 1.00 64.30 32 A 1 ATOM 235 C CB . ASP A 0 32 . 9.681 -2.602 -16.513 1.00 64.30 32 A 1 ATOM 236 O O . ASP A 0 32 . 7.383 -1.968 -14.197 1.00 64.30 32 A 1 ATOM 237 C CG . ASP A 0 32 . 10.192 -2.385 -17.933 1.00 64.30 32 A 1 ATOM 238 O OD1 . ASP A 0 32 . 9.732 -3.126 -18.832 1.00 64.30 32 A 1 ATOM 239 O OD2 . ASP A 0 32 . 11.041 -1.467 -18.072 1.00 64.30 32 A 1 ATOM 240 N N . THR A 0 33 . 8.031 -4.095 -14.412 1.00 65.95 33 A 1 ATOM 241 C CA . THR A 0 33 . 7.938 -4.463 -12.980 1.00 65.95 33 A 1 ATOM 242 C C . THR A 0 33 . 8.712 -3.502 -12.057 1.00 65.95 33 A 1 ATOM 243 C CB . THR A 0 33 . 8.478 -5.894 -12.778 1.00 65.95 33 A 1 ATOM 244 O O . THR A 0 33 . 8.430 -3.403 -10.861 1.00 65.95 33 A 1 ATOM 245 C CG2 . THR A 0 33 . 7.983 -6.555 -11.492 1.00 65.95 33 A 1 ATOM 246 O OG1 . THR A 0 33 . 8.064 -6.727 -13.837 1.00 65.95 33 A 1 ATOM 247 N N . LEU A 0 34 . 9.668 -2.751 -12.616 1.00 65.66 34 A 1 ATOM 248 C CA . LEU A 0 34 . 10.465 -1.724 -11.946 1.00 65.66 34 A 1 ATOM 249 C C . LEU A 0 34 . 9.744 -0.373 -11.763 1.00 65.66 34 A 1 ATOM 250 C CB . LEU A 0 34 . 11.799 -1.566 -12.707 1.00 65.66 34 A 1 ATOM 251 O O . LEU A 0 34 . 10.299 0.522 -11.124 1.00 65.66 34 A 1 ATOM 252 C CG . LEU A 0 34 . 13.025 -1.661 -11.784 1.00 65.66 34 A 1 ATOM 253 C CD1 . LEU A 0 34 . 13.230 -3.084 -11.251 1.00 65.66 34 A 1 ATOM 254 C CD2 . LEU A 0 34 . 14.287 -1.270 -12.548 1.00 65.66 34 A 1 ATOM 255 N N . SER A 0 35 . 8.503 -0.232 -12.242 1.00 65.75 35 A 1 ATOM 256 C CA . SER A 0 35 . 7.691 0.990 -12.131 1.00 65.75 35 A 1 ATOM 257 C C . SER A 0 35 . 7.542 1.475 -10.679 1.00 65.75 35 A 1 ATOM 258 C CB . SER A 0 35 . 6.323 0.735 -12.778 1.00 65.75 35 A 1 ATOM 259 O O . SER A 0 35 . 7.576 2.674 -10.405 1.00 65.75 35 A 1 ATOM 260 O OG . SER A 0 35 . 5.576 1.927 -12.845 1.00 65.75 35 A 1 ATOM 261 N N . LYS A 0 36 . 7.517 0.559 -9.697 1.00 69.17 36 A 1 ATOM 262 C CA . LYS A 0 36 . 7.537 0.926 -8.267 1.00 69.17 36 A 1 ATOM 263 C C . LYS A 0 36 . 8.806 1.689 -7.879 1.00 69.17 36 A 1 ATOM 264 C CB . LYS A 0 36 . 7.373 -0.316 -7.379 1.00 69.17 36 A 1 ATOM 265 O O . LYS A 0 36 . 8.714 2.755 -7.279 1.00 69.17 36 A 1 ATOM 266 C CG . LYS A 0 36 . 5.952 -0.893 -7.435 1.00 69.17 36 A 1 ATOM 267 C CD . LYS A 0 36 . 5.829 -2.095 -6.490 1.00 69.17 36 A 1 ATOM 268 C CE . LYS A 0 36 . 4.417 -2.686 -6.565 1.00 69.17 36 A 1 ATOM 269 N NZ . LYS A 0 36 . 4.277 -3.882 -5.694 1.00 69.17 36 A 1 ATOM 270 N N . ALA A 0 37 . 9.982 1.171 -8.235 1.00 67.75 37 A 1 ATOM 271 C CA . ALA A 0 37 . 11.255 1.832 -7.943 1.00 67.75 37 A 1 ATOM 272 C C . ALA A 0 37 . 11.408 3.137 -8.741 1.00 67.75 37 A 1 ATOM 273 C CB . ALA A 0 37 . 12.400 0.856 -8.233 1.00 67.75 37 A 1 ATOM 274 O O . ALA A 0 37 . 11.969 4.103 -8.226 1.00 67.75 37 A 1 ATOM 275 N N . TRP A 0 38 . 10.860 3.184 -9.959 1.00 73.05 38 A 1 ATOM 276 C CA . TRP A 0 38 . 10.797 4.387 -10.788 1.00 73.05 38 A 1 ATOM 277 C C . TRP A 0 38 . 10.011 5.516 -10.106 1.00 73.05 38 A 1 ATOM 278 C CB . TRP A 0 38 . 10.168 4.020 -12.138 1.00 73.05 38 A 1 ATOM 279 O O . TRP A 0 38 . 10.496 6.643 -9.997 1.00 73.05 38 A 1 ATOM 280 C CG . TRP A 0 38 . 10.258 5.098 -13.160 1.00 73.05 38 A 1 ATOM 281 C CD1 . TRP A 0 38 . 9.379 6.108 -13.344 1.00 73.05 38 A 1 ATOM 282 C CD2 . TRP A 0 38 . 11.326 5.319 -14.120 1.00 73.05 38 A 1 ATOM 283 C CE2 . TRP A 0 38 . 11.062 6.527 -14.825 1.00 73.05 38 A 1 ATOM 284 C CE3 . TRP A 0 38 . 12.515 4.634 -14.421 1.00 73.05 38 A 1 ATOM 285 N NE1 . TRP A 0 38 . 9.838 6.939 -14.346 1.00 73.05 38 A 1 ATOM 286 C CH2 . TRP A 0 38 . 13.187 6.393 -15.959 1.00 73.05 38 A 1 ATOM 287 C CZ2 . TRP A 0 38 . 11.978 7.072 -15.733 1.00 73.05 38 A 1 ATOM 288 C CZ3 . TRP A 0 38 . 13.437 5.157 -15.341 1.00 73.05 38 A 1 ATOM 289 N N . MET A 0 39 . 8.822 5.202 -9.582 1.00 71.58 39 A 1 ATOM 290 C CA . MET A 0 39 . 7.977 6.164 -8.869 1.00 71.58 39 A 1 ATOM 291 C C . MET A 0 39 . 8.589 6.600 -7.536 1.00 71.58 39 A 1 ATOM 292 C CB . MET A 0 39 . 6.583 5.570 -8.633 1.00 71.58 39 A 1 ATOM 293 O O . MET A 0 39 . 8.637 7.796 -7.257 1.00 71.58 39 A 1 ATOM 294 C CG . MET A 0 39 . 5.762 5.481 -9.922 1.00 71.58 39 A 1 ATOM 295 S SD . MET A 0 39 . 4.035 5.000 -9.648 1.00 71.58 39 A 1 ATOM 296 C CE . MET A 0 39 . 4.248 3.272 -9.149 1.00 71.58 39 A 1 ATOM 297 N N . ILE A 0 40 . 9.104 5.657 -6.737 1.00 74.92 40 A 1 ATOM 298 C CA . ILE A 0 40 . 9.709 5.949 -5.424 1.00 74.92 40 A 1 ATOM 299 C C . ILE A 0 40 . 10.885 6.924 -5.560 1.00 74.92 40 A 1 ATOM 300 C CB . ILE A 0 40 . 10.133 4.631 -4.730 1.00 74.92 40 A 1 ATOM 301 O O . ILE A 0 40 . 11.044 7.825 -4.741 1.00 74.92 40 A 1 ATOM 302 C CG1 . ILE A 0 40 . 8.883 3.829 -4.296 1.00 74.92 40 A 1 ATOM 303 C CG2 . ILE A 0 40 . 11.026 4.886 -3.499 1.00 74.92 40 A 1 ATOM 304 C CD1 . ILE A 0 40 . 9.177 2.360 -3.960 1.00 74.92 40 A 1 ATOM 305 N N . ASN A 0 41 . 11.684 6.787 -6.619 1.00 68.80 41 A 1 ATOM 306 C CA . ASN A 0 41 . 12.856 7.629 -6.854 1.00 68.80 41 A 1 ATOM 307 C C . ASN A 0 41 . 12.556 8.900 -7.676 1.00 68.80 41 A 1 ATOM 308 C CB . ASN A 0 41 . 13.965 6.750 -7.439 1.00 68.80 41 A 1 ATOM 309 O O . ASN A 0 41 . 13.487 9.558 -8.146 1.00 68.80 41 A 1 ATOM 310 C CG . ASN A 0 41 . 14.485 5.758 -6.419 1.00 68.80 41 A 1 ATOM 311 N ND2 . ASN A 0 41 . 14.262 4.483 -6.619 1.00 68.80 41 A 1 ATOM 312 O OD1 . ASN A 0 41 . 15.109 6.114 -5.441 1.00 68.80 41 A 1 ATOM 313 N N . ASN A 0 42 . 11.273 9.258 -7.849 1.00 70.22 42 A 1 ATOM 314 C CA . ASN A 0 42 . 10.811 10.428 -8.612 1.00 70.22 42 A 1 ATOM 315 C C . ASN A 0 42 . 11.378 10.505 -10.043 1.00 70.22 42 A 1 ATOM 316 C CB . ASN A 0 42 . 11.020 11.712 -7.786 1.00 70.22 42 A 1 ATOM 317 O O . ASN A 0 42 . 11.535 11.586 -10.616 1.00 70.22 42 A 1 ATOM 318 C CG . ASN A 0 42 . 10.016 11.836 -6.662 1.00 70.22 42 A 1 ATOM 319 N ND2 . ASN A 0 42 . 10.459 11.936 -5.432 1.00 70.22 42 A 1 ATOM 320 O OD1 . ASN A 0 42 . 8.818 11.882 -6.885 1.00 70.22 42 A 1 ATOM 321 N N . CYS A 0 43 . 11.661 9.352 -10.648 1.00 75.07 43 A 1 ATOM 322 C CA . CYS A 0 43 . 12.303 9.259 -11.954 1.00 75.07 43 A 1 ATOM 323 C C . CYS A 0 43 . 11.428 9.812 -13.093 1.00 75.07 43 A 1 ATOM 324 C CB . CYS A 0 43 . 12.648 7.793 -12.190 1.00 75.07 43 A 1 ATOM 325 O O . CYS A 0 43 . 11.957 10.254 -14.106 1.00 75.07 43 A 1 ATOM 326 S SG . CYS A 0 43 . 13.719 7.022 -10.949 1.00 75.07 43 A 1 ATOM 327 N N . THR A 0 44 . 10.104 9.880 -12.908 1.00 67.00 44 A 1 ATOM 328 C CA . THR A 0 44 . 9.144 10.433 -13.884 1.00 67.00 44 A 1 ATOM 329 C C . THR A 0 44 . 9.378 11.916 -14.192 1.00 67.00 44 A 1 ATOM 330 C CB . THR A 0 44 . 7.703 10.243 -13.372 1.00 67.00 44 A 1 ATOM 331 O O . THR A 0 44 . 9.015 12.381 -15.265 1.00 67.00 44 A 1 ATOM 332 C CG2 . THR A 0 44 . 6.647 10.334 -14.470 1.00 67.00 44 A 1 ATOM 333 O OG1 . THR A 0 44 . 7.558 8.967 -12.785 1.00 67.00 44 A 1 ATOM 334 N N . LYS A 0 45 . 10.000 12.672 -13.275 1.00 57.55 45 A 1 ATOM 335 C CA . LYS A 0 45 . 10.277 14.109 -13.453 1.00 57.55 45 A 1 ATOM 336 C C . LYS A 0 45 . 11.677 14.400 -14.001 1.00 57.55 45 A 1 ATOM 337 C CB . LYS A 0 45 . 10.045 14.841 -12.121 1.00 57.55 45 A 1 ATOM 338 O O . LYS A 0 45 . 11.921 15.495 -14.502 1.00 57.55 45 A 1 ATOM 339 C CG . LYS A 0 45 . 8.557 14.880 -11.740 1.00 57.55 45 A 1 ATOM 340 C CD . LYS A 0 45 . 8.348 15.649 -10.430 1.00 57.55 45 A 1 ATOM 341 C CE . LYS A 0 45 . 6.854 15.712 -10.093 1.00 57.55 45 A 1 ATOM 342 N NZ . LYS A 0 45 . 6.613 16.423 -8.812 1.00 57.55 45 A 1 ATOM 343 N N . ASN A 0 46 . 12.596 13.437 -13.925 1.00 53.64 46 A 1 ATOM 344 C CA . ASN A 0 46 . 14.029 13.706 -14.084 1.00 53.64 46 A 1 ATOM 345 C C . ASN A 0 46 . 14.563 13.524 -15.513 1.00 53.64 46 A 1 ATOM 346 C CB . ASN A 0 46 . 14.816 12.934 -13.008 1.00 53.64 46 A 1 ATOM 347 O O . ASN A 0 46 . 15.733 13.816 -15.752 1.00 53.64 46 A 1 ATOM 348 C CG . ASN A 0 46 . 14.667 13.548 -11.622 1.00 53.64 46 A 1 ATOM 349 N ND2 . ASN A 0 46 . 15.338 13.016 -10.628 1.00 53.64 46 A 1 ATOM 350 O OD1 . ASN A 0 46 . 13.967 14.520 -11.398 1.00 53.64 46 A 1 ATOM 351 N N . ASN A 0 47 . 13.721 13.148 -16.478 1.00 53.30 47 A 1 ATOM 352 C CA . ASN A 0 47 . 14.111 13.100 -17.893 1.00 53.30 47 A 1 ATOM 353 C C . ASN A 0 47 . 14.227 14.481 -18.568 1.00 53.30 47 A 1 ATOM 354 C CB . ASN A 0 47 . 13.138 12.198 -18.660 1.00 53.30 47 A 1 ATOM 355 O O . ASN A 0 47 . 14.630 14.546 -19.722 1.00 53.30 47 A 1 ATOM 356 C CG . ASN A 0 47 . 13.366 10.720 -18.444 1.00 53.30 47 A 1 ATOM 357 N ND2 . ASN A 0 47 . 12.423 9.948 -18.912 1.00 53.30 47 A 1 ATOM 358 O OD1 . ASN A 0 47 . 14.345 10.255 -17.883 1.00 53.30 47 A 1 ATOM 359 N N . MET A 0 48 . 13.900 15.586 -17.884 1.00 49.18 48 A 1 ATOM 360 C CA . MET A 0 48 . 13.964 16.940 -18.468 1.00 49.18 48 A 1 ATOM 361 C C . MET A 0 48 . 15.115 17.817 -17.952 1.00 49.18 48 A 1 ATOM 362 C CB . MET A 0 48 . 12.609 17.647 -18.317 1.00 49.18 48 A 1 ATOM 363 O O . MET A 0 48 . 15.223 18.977 -18.347 1.00 49.18 48 A 1 ATOM 364 C CG . MET A 0 48 . 11.539 17.045 -19.231 1.00 49.18 48 A 1 ATOM 365 S SD . MET A 0 48 . 10.045 18.066 -19.356 1.00 49.18 48 A 1 ATOM 366 C CE . MET A 0 48 . 10.599 19.323 -20.544 1.00 49.18 48 A 1 ATOM 367 N N . GLN A 0 49 . 15.990 17.316 -17.075 1.00 47.92 49 A 1 ATOM 368 C CA . GLN A 0 49 . 17.057 18.134 -16.484 1.00 47.92 49 A 1 ATOM 369 C C . GLN A 0 49 . 18.397 17.407 -16.464 1.00 47.92 49 A 1 ATOM 370 C CB . GLN A 0 49 . 16.662 18.621 -15.078 1.00 47.92 49 A 1 ATOM 371 O O . GLN A 0 49 . 18.874 16.995 -15.408 1.00 47.92 49 A 1 ATOM 372 C CG . GLN A 0 49 . 15.648 19.769 -15.102 1.00 47.92 49 A 1 ATOM 373 C CD . GLN A 0 49 . 15.366 20.332 -13.712 1.00 47.92 49 A 1 ATOM 374 N NE2 . GLN A 0 49 . 14.478 21.295 -13.606 1.00 47.92 49 A 1 ATOM 375 O OE1 . GLN A 0 49 . 15.927 19.944 -12.701 1.00 47.92 49 A 1 ATOM 376 N N . LYS A 0 50 . 19.046 17.279 -17.625 1.00 48.00 50 A 1 ATOM 377 C CA . LYS A 0 50 . 20.471 16.935 -17.639 1.00 48.00 50 A 1 ATOM 378 C C . LYS A 0 50 . 21.297 17.556 -18.766 1.00 48.00 50 A 1 ATOM 379 C CB . LYS A 0 50 . 20.669 15.409 -17.462 1.00 48.00 50 A 1 ATOM 380 O O . LYS A 0 50 . 22.254 16.936 -19.175 1.00 48.00 50 A 1 ATOM 381 C CG . LYS A 0 50 . 21.533 15.159 -16.216 1.00 48.00 50 A 1 ATOM 382 C CD . LYS A 0 50 . 21.871 13.680 -16.038 1.00 48.00 50 A 1 ATOM 383 C CE . LYS A 0 50 . 22.542 13.501 -14.674 1.00 48.00 50 A 1 ATOM 384 N NZ . LYS A 0 50 . 22.996 12.107 -14.485 1.00 48.00 50 A 1 ATOM 385 N N . ASP A 0 51 . 21.002 18.798 -19.171 1.00 51.66 51 A 1 ATOM 386 C CA . ASP A 0 51 . 21.862 19.531 -20.131 1.00 51.66 51 A 1 ATOM 387 C C . ASP A 0 51 . 22.109 21.021 -19.805 1.00 51.66 51 A 1 ATOM 388 C CB . ASP A 0 51 . 21.324 19.355 -21.562 1.00 51.66 51 A 1 ATOM 389 O O . ASP A 0 51 . 22.588 21.767 -20.653 1.00 51.66 51 A 1 ATOM 390 C CG . ASP A 0 51 . 21.534 17.935 -22.087 1.00 51.66 51 A 1 ATOM 391 O OD1 . ASP A 0 51 . 22.686 17.460 -22.030 1.00 51.66 51 A 1 ATOM 392 O OD2 . ASP A 0 51 . 20.520 17.354 -22.529 1.00 51.66 51 A 1 ATOM 393 N N . LYS A 0 52 . 21.788 21.526 -18.600 1.00 47.97 52 A 1 ATOM 394 C CA . LYS A 0 52 . 21.911 22.981 -18.321 1.00 47.97 52 A 1 ATOM 395 C C . LYS A 0 52 . 22.475 23.373 -16.958 1.00 47.97 52 A 1 ATOM 396 C CB . LYS A 0 52 . 20.596 23.719 -18.644 1.00 47.97 52 A 1 ATOM 397 O O . LYS A 0 52 . 22.005 24.343 -16.362 1.00 47.97 52 A 1 ATOM 398 C CG . LYS A 0 52 . 20.299 23.748 -20.146 1.00 47.97 52 A 1 ATOM 399 C CD . LYS A 0 52 . 19.162 24.722 -20.454 1.00 47.97 52 A 1 ATOM 400 C CE . LYS A 0 52 . 18.910 24.692 -21.961 1.00 47.97 52 A 1 ATOM 401 N NZ . LYS A 0 52 . 17.801 25.596 -22.344 1.00 47.97 52 A 1 ATOM 402 N N . LYS A 0 53 . 23.477 22.660 -16.433 1.00 41.57 53 A 1 ATOM 403 C CA . LYS A 0 53 . 24.168 23.144 -15.227 1.00 41.57 53 A 1 ATOM 404 C C . LYS A 0 53 . 25.583 22.599 -15.048 1.00 41.57 53 A 1 ATOM 405 C CB . LYS A 0 53 . 23.281 22.898 -13.981 1.00 41.57 53 A 1 ATOM 406 O O . LYS A 0 53 . 25.785 21.785 -14.161 1.00 41.57 53 A 1 ATOM 407 C CG . LYS A 0 53 . 23.678 23.834 -12.829 1.00 41.57 53 A 1 ATOM 408 C CD . LYS A 0 53 . 22.590 23.856 -11.750 1.00 41.57 53 A 1 ATOM 409 C CE . LYS A 0 53 . 22.955 24.874 -10.665 1.00 41.57 53 A 1 ATOM 410 N NZ . LYS A 0 53 . 21.859 25.032 -9.676 1.00 41.57 53 A 1 ATOM 411 N N . SER A 0 54 . 26.539 23.098 -15.831 1.00 43.54 54 A 1 ATOM 412 C CA . SER A 0 54 . 27.922 23.322 -15.372 1.00 43.54 54 A 1 ATOM 413 C C . SER A 0 54 . 28.814 23.807 -16.516 1.00 43.54 54 A 1 ATOM 414 C CB . SER A 0 54 . 28.584 22.077 -14.734 1.00 43.54 54 A 1 ATOM 415 O O . SER A 0 54 . 29.714 23.085 -16.907 1.00 43.54 54 A 1 ATOM 416 O OG . SER A 0 54 . 28.566 20.979 -15.618 1.00 43.54 54 A 1 ATOM 417 N N . ASP A 0 55 . 28.609 25.019 -17.029 1.00 47.39 55 A 1 ATOM 418 C CA . ASP A 0 55 . 29.720 25.723 -17.675 1.00 47.39 55 A 1 ATOM 419 C C . ASP A 0 55 . 29.783 27.145 -17.141 1.00 47.39 55 A 1 ATOM 420 C CB . ASP A 0 55 . 29.737 25.599 -19.199 1.00 47.39 55 A 1 ATOM 421 O O . ASP A 0 55 . 28.997 28.043 -17.443 1.00 47.39 55 A 1 ATOM 422 C CG . ASP A 0 55 . 30.332 24.251 -19.630 1.00 47.39 55 A 1 ATOM 423 O OD1 . ASP A 0 55 . 31.441 23.923 -19.146 1.00 47.39 55 A 1 ATOM 424 O OD2 . ASP A 0 55 . 29.664 23.576 -20.442 1.00 47.39 55 A 1 ATOM 425 N N . HIS A 0 56 . 30.712 27.260 -16.209 1.00 47.66 56 A 1 ATOM 426 C CA . HIS A 0 56 . 31.301 28.479 -15.724 1.00 47.66 56 A 1 ATOM 427 C C . HIS A 0 56 . 31.838 29.288 -16.920 1.00 47.66 56 A 1 ATOM 428 C CB . HIS A 0 56 . 32.452 28.039 -14.783 1.00 47.66 56 A 1 ATOM 429 O O . HIS A 0 56 . 32.569 28.751 -17.744 1.00 47.66 56 A 1 ATOM 430 C CG . HIS A 0 56 . 32.394 28.569 -13.377 1.00 47.66 56 A 1 ATOM 431 C CD2 . HIS A 0 56 . 32.107 27.850 -12.247 1.00 47.66 56 A 1 ATOM 432 N ND1 . HIS A 0 56 . 32.737 29.838 -12.975 1.00 47.66 56 A 1 ATOM 433 C CE1 . HIS A 0 56 . 32.651 29.885 -11.635 1.00 47.66 56 A 1 ATOM 434 N NE2 . HIS A 0 56 . 32.268 28.697 -11.148 1.00 47.66 56 A 1 ATOM 435 N N . LYS A 0 57 . 31.637 30.609 -16.857 1.00 44.38 57 A 1 ATOM 436 C CA . LYS A 0 57 . 32.670 31.606 -17.185 1.00 44.38 57 A 1 ATOM 437 C C . LYS A 0 57 . 32.787 32.071 -18.653 1.00 44.38 57 A 1 ATOM 438 C CB . LYS A 0 57 . 34.002 31.120 -16.567 1.00 44.38 57 A 1 ATOM 439 O O . LYS A 0 57 . 33.473 31.489 -19.477 1.00 44.38 57 A 1 ATOM 440 C CG . LYS A 0 57 . 34.873 32.240 -16.027 1.00 44.38 57 A 1 ATOM 441 C CD . LYS A 0 57 . 35.969 31.691 -15.112 1.00 44.38 57 A 1 ATOM 442 C CE . LYS A 0 57 . 36.538 32.845 -14.289 1.00 44.38 57 A 1 ATOM 443 N NZ . LYS A 0 57 . 37.597 32.368 -13.368 1.00 44.38 57 A 1 ATOM 444 N N . ASP A 0 58 . 32.217 33.262 -18.843 1.00 48.03 58 A 1 ATOM 445 C CA . ASP A 0 58 . 32.820 34.427 -19.502 1.00 48.03 58 A 1 ATOM 446 C C . ASP A 0 58 . 32.934 34.499 -21.041 1.00 48.03 58 A 1 ATOM 447 C CB . ASP A 0 58 . 34.133 34.820 -18.788 1.00 48.03 58 A 1 ATOM 448 O O . ASP A 0 58 . 33.650 33.753 -21.696 1.00 48.03 58 A 1 ATOM 449 C CG . ASP A 0 58 . 33.946 35.173 -17.304 1.00 48.03 58 A 1 ATOM 450 O OD1 . ASP A 0 58 . 32.799 35.478 -16.913 1.00 48.03 58 A 1 ATOM 451 O OD2 . ASP A 0 58 . 34.952 35.131 -16.558 1.00 48.03 58 A 1 ATOM 452 N N . LYS A 0 59 . 32.350 35.604 -21.542 1.00 46.64 59 A 1 ATOM 453 C CA . LYS A 0 59 . 32.661 36.365 -22.769 1.00 46.64 59 A 1 ATOM 454 C C . LYS A 0 59 . 32.169 35.800 -24.106 1.00 46.64 59 A 1 ATOM 455 C CB . LYS A 0 59 . 34.165 36.702 -22.827 1.00 46.64 59 A 1 ATOM 456 O O . LYS A 0 59 . 32.860 35.048 -24.782 1.00 46.64 59 A 1 ATOM 457 C CG . LYS A 0 59 . 34.608 37.674 -21.726 1.00 46.64 59 A 1 ATOM 458 C CD . LYS A 0 59 . 36.136 37.778 -21.700 1.00 46.64 59 A 1 ATOM 459 C CE . LYS A 0 59 . 36.574 38.757 -20.608 1.00 46.64 59 A 1 ATOM 460 N NZ . LYS A 0 59 . 38.052 38.866 -20.548 1.00 46.64 59 A 1 ATOM 461 N N . LYS A 0 60 . 31.057 36.362 -24.596 1.00 39.99 60 A 1 ATOM 462 C CA . LYS A 0 60 . 30.838 36.531 -26.038 1.00 39.99 60 A 1 ATOM 463 C C . LYS A 0 60 . 30.523 37.993 -26.348 1.00 39.99 60 A 1 ATOM 464 C CB . LYS A 0 60 . 29.799 35.528 -26.561 1.00 39.99 60 A 1 ATOM 465 O O . LYS A 0 60 . 29.449 38.483 -26.015 1.00 39.99 60 A 1 ATOM 466 C CG . LYS A 0 60 . 29.733 35.571 -28.098 1.00 39.99 60 A 1 ATOM 467 C CD . LYS A 0 60 . 29.254 34.242 -28.694 1.00 39.99 60 A 1 ATOM 468 C CE . LYS A 0 60 . 29.271 34.346 -30.225 1.00 39.99 60 A 1 ATOM 469 N NZ . LYS A 0 60 . 29.001 33.040 -30.878 1.00 39.99 60 A 1 ATOM 470 N N . SER A 0 61 . 31.520 38.662 -26.927 1.00 44.19 61 A 1 ATOM 471 C CA . SER A 0 61 . 31.402 39.941 -27.618 1.00 44.19 61 A 1 ATOM 472 C C . SER A 0 61 . 30.743 39.753 -28.986 1.00 44.19 61 A 1 ATOM 473 C CB . SER A 0 61 . 32.787 40.583 -27.778 1.00 44.19 61 A 1 ATOM 474 O O . SER A 0 61 . 30.593 38.639 -29.491 1.00 44.19 61 A 1 ATOM 475 O OG . SER A 0 61 . 33.623 39.773 -28.582 1.00 44.19 61 A 1 ATOM 476 N N . GLU A 0 62 . 30.349 40.885 -29.540 1.00 40.06 62 A 1 ATOM 477 C CA . GLU A 0 62 . 29.460 41.095 -30.669 1.00 40.06 62 A 1 ATOM 478 C C . GLU A 0 62 . 30.041 40.698 -32.037 1.00 40.06 62 A 1 ATOM 479 C CB . GLU A 0 62 . 29.130 42.601 -30.653 1.00 40.06 62 A 1 ATOM 480 O O . GLU A 0 62 . 31.252 40.646 -32.237 1.00 40.06 62 A 1 ATOM 481 C CG . GLU A 0 62 . 28.357 43.025 -29.382 1.00 40.06 62 A 1 ATOM 482 C CD . GLU A 0 62 . 28.476 44.516 -29.030 1.00 40.06 62 A 1 ATOM 483 O OE1 . GLU A 0 62 . 27.590 44.982 -28.282 1.00 40.06 62 A 1 ATOM 484 O OE2 . GLU A 0 62 . 29.478 45.145 -29.433 1.00 40.06 62 A 1 ATOM 485 N N . HIS A 0 63 . 29.100 40.557 -32.978 1.00 41.27 63 A 1 ATOM 486 C CA . HIS A 0 63 . 29.219 40.823 -34.414 1.00 41.27 63 A 1 ATOM 487 C C . HIS A 0 63 . 29.833 39.739 -35.320 1.00 41.27 63 A 1 ATOM 488 C CB . HIS A 0 63 . 29.845 42.218 -34.629 1.00 41.27 63 A 1 ATOM 489 O O . HIS A 0 63 . 31.030 39.480 -35.309 1.00 41.27 63 A 1 ATOM 490 C CG . HIS A 0 63 . 29.142 43.107 -35.621 1.00 41.27 63 A 1 ATOM 491 C CD2 . HIS A 0 63 . 29.465 44.415 -35.863 1.00 41.27 63 A 1 ATOM 492 N ND1 . HIS A 0 63 . 28.034 42.821 -36.395 1.00 41.27 63 A 1 ATOM 493 C CE1 . HIS A 0 63 . 27.720 43.920 -37.096 1.00 41.27 63 A 1 ATOM 494 N NE2 . HIS A 0 63 . 28.566 44.920 -36.804 1.00 41.27 63 A 1 ATOM 495 N N . MET A 0 64 . 29.002 39.149 -36.187 1.00 43.51 64 A 1 ATOM 496 C CA . MET A 0 64 . 28.992 39.441 -37.631 1.00 43.51 64 A 1 ATOM 497 C C . MET A 0 64 . 28.080 38.458 -38.371 1.00 43.51 64 A 1 ATOM 498 C CB . MET A 0 64 . 30.384 39.455 -38.294 1.00 43.51 64 A 1 ATOM 499 O O . MET A 0 64 . 28.046 37.260 -38.092 1.00 43.51 64 A 1 ATOM 500 C CG . MET A 0 64 . 31.062 40.833 -38.198 1.00 43.51 64 A 1 ATOM 501 S SD . MET A 0 64 . 30.215 42.171 -39.085 1.00 43.51 64 A 1 ATOM 502 C CE . MET A 0 64 . 31.318 43.552 -38.687 1.00 43.51 64 A 1 ATOM 503 N N . ASP A 0 65 . 27.320 39.025 -39.296 1.00 44.52 65 A 1 ATOM 504 C CA . ASP A 0 65 . 26.308 38.391 -40.118 1.00 44.52 65 A 1 ATOM 505 C C . ASP A 0 65 . 26.864 37.410 -41.162 1.00 44.52 65 A 1 ATOM 506 C CB . ASP A 0 65 . 25.528 39.515 -40.819 1.00 44.52 65 A 1 ATOM 507 O O . ASP A 0 65 . 27.977 37.541 -41.667 1.00 44.52 65 A 1 ATOM 508 C CG . ASP A 0 65 . 24.821 40.406 -39.800 1.00 44.52 65 A 1 ATOM 509 O OD1 . ASP A 0 65 . 23.778 39.946 -39.290 1.00 44.52 65 A 1 ATOM 510 O OD2 . ASP A 0 65 . 25.372 41.486 -39.490 1.00 44.52 65 A 1 ATOM 511 N N . ASN A 0 66 . 25.945 36.536 -41.575 1.00 42.48 66 A 1 ATOM 512 C CA . ASN A 0 66 . 25.814 35.897 -42.882 1.00 42.48 66 A 1 ATOM 513 C C . ASN A 0 66 . 26.471 34.532 -43.153 1.00 42.48 66 A 1 ATOM 514 C CB . ASN A 0 66 . 25.993 36.910 -44.033 1.00 42.48 66 A 1 ATOM 515 O O . ASN A 0 66 . 27.672 34.387 -43.352 1.00 42.48 66 A 1 ATOM 516 C CG . ASN A 0 66 . 24.857 37.913 -44.099 1.00 42.48 66 A 1 ATOM 517 N ND2 . ASN A 0 66 . 25.105 39.100 -44.595 1.00 42.48 66 A 1 ATOM 518 O OD1 . ASN A 0 66 . 23.725 37.626 -43.752 1.00 42.48 66 A 1 ATOM 519 N N . LYS A 0 67 . 25.536 33.605 -43.426 1.00 37.27 67 A 1 ATOM 520 C CA . LYS A 0 67 . 25.583 32.504 -44.399 1.00 37.27 67 A 1 ATOM 521 C C . LYS A 0 67 . 26.013 31.139 -43.856 1.00 37.27 67 A 1 ATOM 522 C CB . LYS A 0 67 . 26.324 32.959 -45.673 1.00 37.27 67 A 1 ATOM 523 O O . LYS A 0 67 . 27.142 30.709 -44.037 1.00 37.27 67 A 1 ATOM 524 C CG . LYS A 0 67 . 25.852 32.225 -46.933 1.00 37.27 67 A 1 ATOM 525 C CD . LYS A 0 67 . 26.469 32.888 -48.171 1.00 37.27 67 A 1 ATOM 526 C CE . LYS A 0 67 . 25.844 32.313 -49.445 1.00 37.27 67 A 1 ATOM 527 N NZ . LYS A 0 67 . 26.320 33.037 -50.650 1.00 37.27 67 A 1 ATOM 528 N N . SER A 0 68 . 25.047 30.414 -43.292 1.00 46.05 68 A 1 ATOM 529 C CA . SER A 0 68 . 24.967 28.956 -43.428 1.00 46.05 68 A 1 ATOM 530 C C . SER A 0 68 . 23.544 28.481 -43.152 1.00 46.05 68 A 1 ATOM 531 C CB . SER A 0 68 . 25.951 28.220 -42.517 1.00 46.05 68 A 1 ATOM 532 O O . SER A 0 68 . 22.853 28.994 -42.276 1.00 46.05 68 A 1 ATOM 533 O OG . SER A 0 68 . 25.941 26.835 -42.810 1.00 46.05 68 A 1 ATOM 534 N N . ASP A 0 69 . 23.137 27.524 -43.966 1.00 47.22 69 A 1 ATOM 535 C CA . ASP A 0 69 . 21.831 26.907 -44.109 1.00 47.22 69 A 1 ATOM 536 C C . ASP A 0 69 . 21.219 26.334 -42.828 1.00 47.22 69 A 1 ATOM 537 C CB . ASP A 0 69 . 22.021 25.779 -45.130 1.00 47.22 69 A 1 ATOM 538 O O . ASP A 0 69 . 21.928 25.860 -41.948 1.00 47.22 69 A 1 ATOM 539 C CG . ASP A 0 69 . 22.511 26.353 -46.457 1.00 47.22 69 A 1 ATOM 540 O OD1 . ASP A 0 69 . 21.629 26.784 -47.228 1.00 47.22 69 A 1 ATOM 541 O OD2 . ASP A 0 69 . 23.746 26.461 -46.630 1.00 47.22 69 A 1 ATOM 542 N N . GLN A 0 70 . 19.878 26.311 -42.835 1.00 43.15 70 A 1 ATOM 543 C CA . GLN A 0 70 . 18.983 25.450 -42.057 1.00 43.15 70 A 1 ATOM 544 C C . GLN A 0 70 . 19.192 25.418 -40.536 1.00 43.15 70 A 1 ATOM 545 C CB . GLN A 0 70 . 19.020 24.015 -42.619 1.00 43.15 70 A 1 ATOM 546 O O . GLN A 0 70 . 20.174 24.893 -40.028 1.00 43.15 70 A 1 ATOM 547 C CG . GLN A 0 70 . 18.315 23.854 -43.975 1.00 43.15 70 A 1 ATOM 548 C CD . GLN A 0 70 . 18.384 22.426 -44.516 1.00 43.15 70 A 1 ATOM 549 N NE2 . GLN A 0 70 . 17.656 22.119 -45.567 1.00 43.15 70 A 1 ATOM 550 O OE1 . GLN A 0 70 . 19.074 21.554 -44.018 1.00 43.15 70 A 1 ATOM 551 N N . LYS A 0 71 . 18.144 25.801 -39.796 1.00 43.93 71 A 1 ATOM 552 C CA . LYS A 0 71 . 17.346 24.857 -38.989 1.00 43.93 71 A 1 ATOM 553 C C . LYS A 0 71 . 16.568 25.596 -37.893 1.00 43.93 71 A 1 ATOM 554 C CB . LYS A 0 71 . 18.200 23.696 -38.425 1.00 43.93 71 A 1 ATOM 555 O O . LYS A 0 71 . 17.130 26.181 -36.977 1.00 43.93 71 A 1 ATOM 556 C CG . LYS A 0 71 . 17.373 22.559 -37.857 1.00 43.93 71 A 1 ATOM 557 C CD . LYS A 0 71 . 18.186 21.267 -37.746 1.00 43.93 71 A 1 ATOM 558 C CE . LYS A 0 71 . 17.238 20.132 -37.357 1.00 43.93 71 A 1 ATOM 559 N NZ . LYS A 0 71 . 17.933 18.823 -37.383 1.00 43.93 71 A 1 ATOM 560 N N . ASP A 0 72 . 15.254 25.508 -38.053 1.00 48.37 72 A 1 ATOM 561 C CA . ASP A 0 72 . 14.211 25.498 -37.031 1.00 48.37 72 A 1 ATOM 562 C C . ASP A 0 72 . 13.928 26.775 -36.221 1.00 48.37 72 A 1 ATOM 563 C CB . ASP A 0 72 . 14.280 24.184 -36.240 1.00 48.37 72 A 1 ATOM 564 O O . ASP A 0 72 . 14.578 27.152 -35.246 1.00 48.37 72 A 1 ATOM 565 C CG . ASP A 0 72 . 14.220 22.964 -37.181 1.00 48.37 72 A 1 ATOM 566 O OD1 . ASP A 0 72 . 13.697 23.118 -38.311 1.00 48.37 72 A 1 ATOM 567 O OD2 . ASP A 0 72 . 14.764 21.899 -36.810 1.00 48.37 72 A 1 ATOM 568 N N . LYS A 0 73 . 12.817 27.389 -36.648 1.00 44.88 73 A 1 ATOM 569 C CA . LYS A 0 73 . 12.020 28.402 -35.963 1.00 44.88 73 A 1 ATOM 570 C C . LYS A 0 73 . 11.713 27.980 -34.525 1.00 44.88 73 A 1 ATOM 571 C CB . LYS A 0 73 . 10.701 28.592 -36.732 1.00 44.88 73 A 1 ATOM 572 O O . LYS A 0 73 . 11.020 27.000 -34.268 1.00 44.88 73 A 1 ATOM 573 C CG . LYS A 0 73 . 10.867 29.402 -38.025 1.00 44.88 73 A 1 ATOM 574 C CD . LYS A 0 73 . 9.561 29.391 -38.832 1.00 44.88 73 A 1 ATOM 575 C CE . LYS A 0 73 . 9.651 30.354 -40.021 1.00 44.88 73 A 1 ATOM 576 N NZ . LYS A 0 73 . 8.418 30.307 -40.847 1.00 44.88 73 A 1 ATOM 577 N N . LYS A 0 74 . 12.212 28.798 -33.607 1.00 37.49 74 A 1 ATOM 578 C CA . LYS A 0 74 . 11.832 28.880 -32.202 1.00 37.49 74 A 1 ATOM 579 C C . LYS A 0 74 . 10.552 29.707 -32.055 1.00 37.49 74 A 1 ATOM 580 C CB . LYS A 0 74 . 13.027 29.509 -31.468 1.00 37.49 74 A 1 ATOM 581 O O . LYS A 0 74 . 10.367 30.673 -32.786 1.00 37.49 74 A 1 ATOM 582 C CG . LYS A 0 74 . 12.807 29.807 -29.980 1.00 37.49 74 A 1 ATOM 583 C CD . LYS A 0 74 . 14.127 30.270 -29.358 1.00 37.49 74 A 1 ATOM 584 C CE . LYS A 0 74 . 13.916 30.663 -27.896 1.00 37.49 74 A 1 ATOM 585 N NZ . LYS A 0 74 . 15.172 31.191 -27.311 1.00 37.49 74 A 1 ATOM 586 N N . SER A 0 75 . 9.807 29.369 -31.004 1.00 34.59 75 A 1 ATOM 587 C CA . SER A 0 75 . 8.697 30.110 -30.397 1.00 34.59 75 A 1 ATOM 588 C C . SER A 0 75 . 7.383 30.084 -31.166 1.00 34.59 75 A 1 ATOM 589 C CB . SER A 0 75 . 9.083 31.555 -30.047 1.00 34.59 75 A 1 ATOM 590 O O . SER A 0 75 . 7.222 30.796 -32.144 1.00 34.59 75 A 1 ATOM 591 O OG . SER A 0 75 . 9.775 31.607 -28.811 1.00 34.59 75 A 1 ATOM 592 N N . GLU A 0 76 . 6.434 29.298 -30.654 1.00 37.89 76 A 1 ATOM 593 C CA . GLU A 0 76 . 5.169 29.784 -30.072 1.00 37.89 76 A 1 ATOM 594 C C . GLU A 0 76 . 4.232 28.590 -29.821 1.00 37.89 76 A 1 ATOM 595 C CB . GLU A 0 76 . 4.458 30.837 -30.947 1.00 37.89 76 A 1 ATOM 596 O O . GLU A 0 76 . 3.730 27.972 -30.750 1.00 37.89 76 A 1 ATOM 597 C CG . GLU A 0 76 . 4.943 32.257 -30.597 1.00 37.89 76 A 1 ATOM 598 C CD . GLU A 0 76 . 4.526 33.338 -31.604 1.00 37.89 76 A 1 ATOM 599 O OE1 . GLU A 0 76 . 5.026 34.474 -31.429 1.00 37.89 76 A 1 ATOM 600 O OE2 . GLU A 0 76 . 3.703 33.049 -32.501 1.00 37.89 76 A 1 ATOM 601 N N . GLN A 0 77 . 3.999 28.252 -28.554 1.00 38.30 77 A 1 ATOM 602 C CA . GLN A 0 77 . 2.766 27.592 -28.107 1.00 38.30 77 A 1 ATOM 603 C C . GLN A 0 77 . 2.655 27.914 -26.611 1.00 38.30 77 A 1 ATOM 604 C CB . GLN A 0 77 . 2.771 26.075 -28.410 1.00 38.30 77 A 1 ATOM 605 O O . GLN A 0 77 . 3.452 27.429 -25.813 1.00 38.30 77 A 1 ATOM 606 C CG . GLN A 0 77 . 1.601 25.724 -29.345 1.00 38.30 77 A 1 ATOM 607 C CD . GLN A 0 77 . 1.484 24.231 -29.631 1.00 38.30 77 A 1 ATOM 608 N NE2 . GLN A 0 77 . 0.298 23.668 -29.538 1.00 38.30 77 A 1 ATOM 609 O OE1 . GLN A 0 77 . 2.437 23.538 -29.943 1.00 38.30 77 A 1 ATOM 610 N N . MET A 0 78 . 1.916 28.952 -26.209 1.00 39.91 78 A 1 ATOM 611 C CA . MET A 0 78 . 0.448 29.004 -26.166 1.00 39.91 78 A 1 ATOM 612 C C . MET A 0 78 . -0.151 27.710 -25.616 1.00 39.91 78 A 1 ATOM 613 C CB . MET A 0 78 . -0.259 29.473 -27.451 1.00 39.91 78 A 1 ATOM 614 O O . MET A 0 78 . -0.126 26.666 -26.263 1.00 39.91 78 A 1 ATOM 615 C CG . MET A 0 78 . -0.153 30.988 -27.653 1.00 39.91 78 A 1 ATOM 616 S SD . MET A 0 78 . -1.274 31.621 -28.932 1.00 39.91 78 A 1 ATOM 617 C CE . MET A 0 78 . -0.887 33.388 -28.838 1.00 39.91 78 A 1 ATOM 618 N N . ASP A 0 79 . -0.641 27.828 -24.383 1.00 37.31 79 A 1 ATOM 619 C CA . ASP A 0 79 . -1.992 27.445 -23.983 1.00 37.31 79 A 1 ATOM 620 C C . ASP A 0 79 . -2.602 26.274 -24.759 1.00 37.31 79 A 1 ATOM 621 C CB . ASP A 0 79 . -2.889 28.694 -24.112 1.00 37.31 79 A 1 ATOM 622 O O . ASP A 0 79 . -3.009 26.442 -25.902 1.00 37.31 79 A 1 ATOM 623 C CG . ASP A 0 79 . -2.292 29.880 -23.359 1.00 37.31 79 A 1 ATOM 624 O OD1 . ASP A 0 79 . -2.245 29.785 -22.113 1.00 37.31 79 A 1 ATOM 625 O OD2 . ASP A 0 79 . -1.768 30.796 -24.031 1.00 37.31 79 A 1 ATOM 626 N N . ASN A 0 80 . -2.722 25.105 -24.121 1.00 41.48 80 A 1 ATOM 627 C CA . ASN A 0 80 . -3.940 24.287 -24.159 1.00 41.48 80 A 1 ATOM 628 C C . ASN A 0 80 . -3.803 23.026 -23.290 1.00 41.48 80 A 1 ATOM 629 C CB . ASN A 0 80 . -4.398 23.935 -25.592 1.00 41.48 80 A 1 ATOM 630 O O . ASN A 0 80 . -3.139 22.050 -23.617 1.00 41.48 80 A 1 ATOM 631 C CG . ASN A 0 80 . -5.342 24.991 -26.165 1.00 41.48 80 A 1 ATOM 632 N ND2 . ASN A 0 80 . -5.296 25.237 -27.452 1.00 41.48 80 A 1 ATOM 633 O OD1 . ASN A 0 80 . -6.141 25.595 -25.463 1.00 41.48 80 A 1 ATOM 634 N N . LYS A 0 81 . -4.501 23.081 -22.157 1.00 34.29 81 A 1 ATOM 635 C CA . LYS A 0 81 . -5.310 22.014 -21.558 1.00 34.29 81 A 1 ATOM 636 C C . LYS A 0 81 . -5.566 20.802 -22.474 1.00 34.29 81 A 1 ATOM 637 C CB . LYS A 0 81 . -6.635 22.750 -21.273 1.00 34.29 81 A 1 ATOM 638 O O . LYS A 0 81 . -6.257 20.954 -23.474 1.00 34.29 81 A 1 ATOM 639 C CG . LYS A 0 81 . -7.732 21.993 -20.522 1.00 34.29 81 A 1 ATOM 640 C CD . LYS A 0 81 . -8.873 22.991 -20.264 1.00 34.29 81 A 1 ATOM 641 C CE . LYS A 0 81 . -9.894 22.437 -19.271 1.00 34.29 81 A 1 ATOM 642 N NZ . LYS A 0 81 . -10.720 23.534 -18.705 1.00 34.29 81 A 1 ATOM 643 N N . SER A 0 82 . -5.123 19.608 -22.076 1.00 40.37 82 A 1 ATOM 644 C CA . SER A 0 82 . -5.886 18.337 -22.119 1.00 40.37 82 A 1 ATOM 645 C C . SER A 0 82 . -4.984 17.130 -21.826 1.00 40.37 82 A 1 ATOM 646 C CB . SER A 0 82 . -6.651 18.068 -23.432 1.00 40.37 82 A 1 ATOM 647 O O . SER A 0 82 . -3.902 17.017 -22.381 1.00 40.37 82 A 1 ATOM 648 O OG . SER A 0 82 . -5.971 18.496 -24.586 1.00 40.37 82 A 1 ATOM 649 N N . ASP A 0 83 . -5.466 16.286 -20.905 1.00 43.65 83 A 1 ATOM 650 C CA . ASP A 0 83 . -5.414 14.811 -20.901 1.00 43.65 83 A 1 ATOM 651 C C . ASP A 0 83 . -4.044 14.120 -21.081 1.00 43.65 83 A 1 ATOM 652 C CB . ASP A 0 83 . -6.500 14.338 -21.883 1.00 43.65 83 A 1 ATOM 653 O O . ASP A 0 83 . -3.381 14.249 -22.097 1.00 43.65 83 A 1 ATOM 654 C CG . ASP A 0 83 . -7.860 14.921 -21.466 1.00 43.65 83 A 1 ATOM 655 O OD1 . ASP A 0 83 . -8.332 14.520 -20.375 1.00 43.65 83 A 1 ATOM 656 O OD2 . ASP A 0 83 . -8.367 15.847 -22.135 1.00 43.65 83 A 1 ATOM 657 N N . GLN A 0 84 . -3.545 13.345 -20.106 1.00 42.71 84 A 1 ATOM 658 C CA . GLN A 0 84 . -3.863 11.908 -19.972 1.00 42.71 84 A 1 ATOM 659 C C . GLN A 0 84 . -3.252 11.383 -18.641 1.00 42.71 84 A 1 ATOM 660 C CB . GLN A 0 84 . -3.222 11.243 -21.216 1.00 42.71 84 A 1 ATOM 661 O O . GLN A 0 84 . -2.038 11.410 -18.466 1.00 42.71 84 A 1 ATOM 662 C CG . GLN A 0 84 . -3.446 9.746 -21.426 1.00 42.71 84 A 1 ATOM 663 C CD . GLN A 0 84 . -2.939 9.282 -22.796 1.00 42.71 84 A 1 ATOM 664 N NE2 . GLN A 0 84 . -3.194 8.049 -23.169 1.00 42.71 84 A 1 ATOM 665 O OE1 . GLN A 0 84 . -2.311 9.992 -23.562 1.00 42.71 84 A 1 ATOM 666 N N . LYS A 0 85 . -4.034 11.199 -17.558 1.00 42.34 85 A 1 ATOM 667 C CA . LYS A 0 85 . -4.534 9.906 -17.006 1.00 42.34 85 A 1 ATOM 668 C C . LYS A 0 85 . -3.527 8.757 -17.155 1.00 42.34 85 A 1 ATOM 669 C CB . LYS A 0 85 . -5.906 9.541 -17.604 1.00 42.34 85 A 1 ATOM 670 O O . LYS A 0 85 . -3.202 8.399 -18.269 1.00 42.34 85 A 1 ATOM 671 C CG . LYS A 0 85 . -7.061 10.043 -16.724 1.00 42.34 85 A 1 ATOM 672 C CD . LYS A 0 85 . -8.406 9.802 -17.418 1.00 42.34 85 A 1 ATOM 673 C CE . LYS A 0 85 . -9.575 10.219 -16.518 1.00 42.34 85 A 1 ATOM 674 N NZ . LYS A 0 85 . -10.815 10.396 -17.314 1.00 42.34 85 A 1 ATOM 675 N N . ASP A 0 86 . -2.992 8.215 -16.057 1.00 44.12 86 A 1 ATOM 676 C CA . ASP A 0 86 . -3.595 7.043 -15.398 1.00 44.12 86 A 1 ATOM 677 C C . ASP A 0 86 . -3.591 7.106 -13.855 1.00 44.12 86 A 1 ATOM 678 C CB . ASP A 0 86 . -2.866 5.771 -15.865 1.00 44.12 86 A 1 ATOM 679 O O . ASP A 0 86 . -2.939 6.326 -13.162 1.00 44.12 86 A 1 ATOM 680 C CG . ASP A 0 86 . -3.055 5.494 -17.350 1.00 44.12 86 A 1 ATOM 681 O OD1 . ASP A 0 86 . -4.225 5.614 -17.785 1.00 44.12 86 A 1 ATOM 682 O OD2 . ASP A 0 86 . -2.051 5.109 -17.985 1.00 44.12 86 A 1 ATOM 683 N N . ASN A 0 87 . -4.404 7.991 -13.280 1.00 47.17 87 A 1 ATOM 684 C CA . ASN A 0 87 . -4.756 7.941 -11.858 1.00 47.17 87 A 1 ATOM 685 C C . ASN A 0 87 . -6.124 7.249 -11.760 1.00 47.17 87 A 1 ATOM 686 C CB . ASN A 0 87 . -4.685 9.325 -11.164 1.00 47.17 87 A 1 ATOM 687 O O . ASN A 0 87 . -7.172 7.898 -11.753 1.00 47.17 87 A 1 ATOM 688 C CG . ASN A 0 87 . -4.009 10.435 -11.951 1.00 47.17 87 A 1 ATOM 689 N ND2 . ASN A 0 87 . -4.602 11.604 -11.996 1.00 47.17 87 A 1 ATOM 690 O OD1 . ASN A 0 87 . -2.954 10.293 -12.535 1.00 47.17 87 A 1 ATOM 691 N N . LYS A 0 88 . -6.139 5.911 -11.760 1.00 49.87 88 A 1 ATOM 692 C CA . LYS A 0 88 . -7.366 5.134 -11.503 1.00 49.87 88 A 1 ATOM 693 C C . LYS A 0 88 . -7.847 5.443 -10.067 1.00 49.87 88 A 1 ATOM 694 C CB . LYS A 0 88 . -7.113 3.637 -11.782 1.00 49.87 88 A 1 ATOM 695 O O . LYS A 0 88 . -7.013 5.562 -9.168 1.00 49.87 88 A 1 ATOM 696 C CG . LYS A 0 88 . -8.254 2.968 -12.572 1.00 49.87 88 A 1 ATOM 697 C CD . LYS A 0 88 . -7.869 1.561 -13.049 1.00 49.87 88 A 1 ATOM 698 C CE . LYS A 0 88 . -8.889 1.013 -14.063 1.00 49.87 88 A 1 ATOM 699 N NZ . LYS A 0 88 . -9.667 -0.144 -13.546 1.00 49.87 88 A 1 ATOM 700 N N . PRO A 0 89 . -9.157 5.633 -9.823 1.00 55.04 89 A 1 ATOM 701 C CA . PRO A 0 89 . -9.643 6.391 -8.673 1.00 55.04 89 A 1 ATOM 702 C C . PRO A 0 89 . -9.547 5.578 -7.377 1.00 55.04 89 A 1 ATOM 703 C CB . PRO A 0 89 . -11.086 6.777 -9.035 1.00 55.04 89 A 1 ATOM 704 O O . PRO A 0 89 . -10.481 4.861 -7.020 1.00 55.04 89 A 1 ATOM 705 C CG . PRO A 0 89 . -11.543 5.623 -9.924 1.00 55.04 89 A 1 ATOM 706 C CD . PRO A 0 89 . -10.269 5.252 -10.678 1.00 55.04 89 A 1 ATOM 707 N N . MET A 0 90 . -8.454 5.737 -6.622 1.00 60.04 90 A 1 ATOM 708 C CA . MET A 0 90 . -8.380 5.222 -5.244 1.00 60.04 90 A 1 ATOM 709 C C . MET A 0 90 . -9.528 5.761 -4.374 1.00 60.04 90 A 1 ATOM 710 C CB . MET A 0 90 . -7.020 5.546 -4.596 1.00 60.04 90 A 1 ATOM 711 O O . MET A 0 90 . -9.991 5.072 -3.470 1.00 60.04 90 A 1 ATOM 712 C CG . MET A 0 90 . -6.178 4.281 -4.409 1.00 60.04 90 A 1 ATOM 713 S SD . MET A 0 90 . -4.789 4.499 -3.269 1.00 60.04 90 A 1 ATOM 714 C CE . MET A 0 90 . -4.211 2.786 -3.147 1.00 60.04 90 A 1 ATOM 715 N N . PHE A 0 91 . -10.053 6.947 -4.700 1.00 67.27 91 A 1 ATOM 716 C CA . PHE A 0 91 . -11.181 7.550 -3.992 1.00 67.27 91 A 1 ATOM 717 C C . PHE A 0 91 . -12.463 6.712 -4.054 1.00 67.27 91 A 1 ATOM 718 C CB . PHE A 0 91 . -11.418 8.961 -4.543 1.00 67.27 91 A 1 ATOM 719 O O . PHE A 0 91 . -13.181 6.657 -3.061 1.00 67.27 91 A 1 ATOM 720 C CG . PHE A 0 91 . -10.256 9.898 -4.280 1.00 67.27 91 A 1 ATOM 721 C CD1 . PHE A 0 91 . -9.998 10.327 -2.965 1.00 67.27 91 A 1 ATOM 722 C CD2 . PHE A 0 91 . -9.420 10.322 -5.332 1.00 67.27 91 A 1 ATOM 723 C CE1 . PHE A 0 91 . -8.907 11.171 -2.699 1.00 67.27 91 A 1 ATOM 724 C CE2 . PHE A 0 91 . -8.329 11.168 -5.063 1.00 67.27 91 A 1 ATOM 725 C CZ . PHE A 0 91 . -8.072 11.592 -3.748 1.00 67.27 91 A 1 ATOM 726 N N . ASN A 0 92 . -12.732 6.010 -5.163 1.00 74.98 92 A 1 ATOM 727 C CA . ASN A 0 92 . -13.944 5.192 -5.265 1.00 74.98 92 A 1 ATOM 728 C C . ASN A 0 92 . -13.838 3.931 -4.395 1.00 74.98 92 A 1 ATOM 729 C CB . ASN A 0 92 . -14.226 4.865 -6.744 1.00 74.98 92 A 1 ATOM 730 O O . ASN A 0 92 . -14.781 3.560 -3.707 1.00 74.98 92 A 1 ATOM 731 C CG . ASN A 0 92 . -15.663 4.416 -6.967 1.00 74.98 92 A 1 ATOM 732 N ND2 . ASN A 0 92 . -15.962 3.820 -8.096 1.00 74.98 92 A 1 ATOM 733 O OD1 . ASN A 0 92 . -16.546 4.627 -6.163 1.00 74.98 92 A 1 ATOM 734 N N . TYR A 0 93 . -12.656 3.308 -4.354 1.00 80.84 93 A 1 ATOM 735 C CA . TYR A 0 93 . -12.419 2.169 -3.467 1.00 80.84 93 A 1 ATOM 736 C C . TYR A 0 93 . -12.520 2.576 -1.996 1.00 80.84 93 A 1 ATOM 737 C CB . TYR A 0 93 . -11.051 1.552 -3.764 1.00 80.84 93 A 1 ATOM 738 O O . TYR A 0 93 . -13.158 1.883 -1.212 1.00 80.84 93 A 1 ATOM 739 C CG . TYR A 0 93 . -10.769 0.324 -2.923 1.00 80.84 93 A 1 ATOM 740 C CD1 . TYR A 0 93 . -9.928 0.410 -1.797 1.00 80.84 93 A 1 ATOM 741 C CD2 . TYR A 0 93 . -11.370 -0.903 -3.261 1.00 80.84 93 A 1 ATOM 742 C CE1 . TYR A 0 93 . -9.669 -0.736 -1.022 1.00 80.84 93 A 1 ATOM 743 C CE2 . TYR A 0 93 . -11.130 -2.046 -2.475 1.00 80.84 93 A 1 ATOM 744 O OH . TYR A 0 93 . -10.054 -3.073 -0.602 1.00 80.84 93 A 1 ATOM 745 C CZ . TYR A 0 93 . -10.282 -1.965 -1.353 1.00 80.84 93 A 1 ATOM 746 N N . LEU A 0 94 . -11.949 3.726 -1.630 1.00 83.85 94 A 1 ATOM 747 C CA . LEU A 0 94 . -12.020 4.242 -0.266 1.00 83.85 94 A 1 ATOM 748 C C . LEU A 0 94 . -13.471 4.551 0.148 1.00 83.85 94 A 1 ATOM 749 C CB . LEU A 0 94 . -11.098 5.472 -0.176 1.00 83.85 94 A 1 ATOM 750 O O . LEU A 0 94 . -13.881 4.192 1.250 1.00 83.85 94 A 1 ATOM 751 C CG . LEU A 0 94 . -10.772 5.875 1.269 1.00 83.85 94 A 1 ATOM 752 C CD1 . LEU A 0 94 . -9.820 4.881 1.943 1.00 83.85 94 A 1 ATOM 753 C CD2 . LEU A 0 94 . -10.122 7.257 1.301 1.00 83.85 94 A 1 ATOM 754 N N . TYR A 0 95 . -14.264 5.139 -0.754 1.00 86.03 95 A 1 ATOM 755 C CA . TYR A 0 95 . -15.686 5.417 -0.532 1.00 86.03 95 A 1 ATOM 756 C C . TYR A 0 95 . -16.545 4.152 -0.416 1.00 86.03 95 A 1 ATOM 757 C CB . TYR A 0 95 . -16.211 6.313 -1.661 1.00 86.03 95 A 1 ATOM 758 O O . TYR A 0 95 . -17.547 4.178 0.282 1.00 86.03 95 A 1 ATOM 759 C CG . TYR A 0 95 . -17.652 6.748 -1.465 1.00 86.03 95 A 1 ATOM 760 C CD1 . TYR A 0 95 . -18.696 6.068 -2.123 1.00 86.03 95 A 1 ATOM 761 C CD2 . TYR A 0 95 . -17.949 7.811 -0.589 1.00 86.03 95 A 1 ATOM 762 C CE1 . TYR A 0 95 . -20.034 6.452 -1.908 1.00 86.03 95 A 1 ATOM 763 C CE2 . TYR A 0 95 . -19.285 8.200 -0.374 1.00 86.03 95 A 1 ATOM 764 O OH . TYR A 0 95 . -21.622 7.887 -0.835 1.00 86.03 95 A 1 ATOM 765 C CZ . TYR A 0 95 . -20.330 7.518 -1.034 1.00 86.03 95 A 1 ATOM 766 N N . VAL A 0 96 . -16.167 3.041 -1.054 1.00 88.72 96 A 1 ATOM 767 C CA . VAL A 0 96 . -16.874 1.754 -0.917 1.00 88.72 96 A 1 ATOM 768 C C . VAL A 0 96 . -16.409 0.986 0.326 1.00 88.72 96 A 1 ATOM 769 C CB . VAL A 0 96 . -16.719 0.923 -2.206 1.00 88.72 96 A 1 ATOM 770 O O . VAL A 0 96 . -17.224 0.420 1.054 1.00 88.72 96 A 1 ATOM 771 C CG1 . VAL A 0 96 . -17.303 -0.490 -2.075 1.00 88.72 96 A 1 ATOM 772 C CG2 . VAL A 0 96 . -17.444 1.600 -3.379 1.00 88.72 96 A 1 ATOM 773 N N . LEU A 0 97 . -15.107 0.990 0.612 1.00 90.22 97 A 1 ATOM 774 C CA . LEU A 0 97 . -14.519 0.240 1.719 1.00 90.22 97 A 1 ATOM 775 C C . LEU A 0 97 . -14.926 0.815 3.081 1.00 90.22 97 A 1 ATOM 776 C CB . LEU A 0 97 . -12.989 0.221 1.548 1.00 90.22 97 A 1 ATOM 777 O O . LEU A 0 97 . -15.276 0.049 3.976 1.00 90.22 97 A 1 ATOM 778 C CG . LEU A 0 97 . -12.271 -0.702 2.551 1.00 90.22 97 A 1 ATOM 779 C CD1 . LEU A 0 97 . -12.495 -2.179 2.218 1.00 90.22 97 A 1 ATOM 780 C CD2 . LEU A 0 97 . -10.769 -0.428 2.530 1.00 90.22 97 A 1 ATOM 781 N N . ILE A 0 98 . -14.908 2.144 3.245 1.00 91.26 98 A 1 ATOM 782 C CA . ILE A 0 98 . -15.196 2.783 4.539 1.00 91.26 98 A 1 ATOM 783 C C . ILE A 0 98 . -16.623 2.448 5.028 1.00 91.26 98 A 1 ATOM 784 C CB . ILE A 0 98 . -14.859 4.298 4.519 1.00 91.26 98 A 1 ATOM 785 O O . ILE A 0 98 . -16.740 1.890 6.121 1.00 91.26 98 A 1 ATOM 786 C CG1 . ILE A 0 98 . -13.335 4.524 4.425 1.00 91.26 98 A 1 ATOM 787 C CG2 . ILE A 0 98 . -15.421 4.995 5.773 1.00 91.26 98 A 1 ATOM 788 C CD1 . ILE A 0 98 . -12.958 5.992 4.176 1.00 91.26 98 A 1 ATOM 789 N N . PRO A 0 99 . -17.708 2.681 4.259 1.00 94.73 99 A 1 ATOM 790 C CA . PRO A 0 99 . -19.060 2.306 4.672 1.00 94.73 99 A 1 ATOM 791 C C . PRO A 0 99 . -19.239 0.797 4.842 1.00 94.73 99 A 1 ATOM 792 C CB . PRO A 0 99 . -20.007 2.844 3.593 1.00 94.73 99 A 1 ATOM 793 O O . PRO A 0 99 . -19.947 0.378 5.753 1.00 94.73 99 A 1 ATOM 794 C CG . PRO A 0 99 . -19.205 3.966 2.949 1.00 94.73 99 A 1 ATOM 795 C CD . PRO A 0 99 . -17.789 3.402 3.005 1.00 94.73 99 A 1 ATOM 796 N N . SER A 0 100 . -18.577 -0.027 4.019 1.00 93.98 100 A 1 ATOM 797 C CA . SER A 0 100 . -18.639 -1.486 4.163 1.00 93.98 100 A 1 ATOM 798 C C . SER A 0 100 . -18.075 -1.948 5.508 1.00 93.98 100 A 1 ATOM 799 C CB . SER A 0 100 . -17.881 -2.171 3.023 1.00 93.98 100 A 1 ATOM 800 O O . SER A 0 100 . -18.686 -2.785 6.170 1.00 93.98 100 A 1 ATOM 801 O OG . SER A 0 100 . -18.059 -3.574 3.090 1.00 93.98 100 A 1 ATOM 802 N N . VAL A 0 101 . -16.934 -1.403 5.939 1.00 96.14 101 A 1 ATOM 803 C CA . VAL A 0 101 . -16.326 -1.742 7.235 1.00 96.14 101 A 1 ATOM 804 C C . VAL A 0 101 . -17.190 -1.230 8.388 1.00 96.14 101 A 1 ATOM 805 C CB . VAL A 0 101 . -14.883 -1.208 7.321 1.00 96.14 101 A 1 ATOM 806 O O . VAL A 0 101 . -17.441 -1.975 9.333 1.00 96.14 101 A 1 ATOM 807 C CG1 . VAL A 0 101 . -14.266 -1.414 8.712 1.00 96.14 101 A 1 ATOM 808 C CG2 . VAL A 0 101 . -13.975 -1.935 6.318 1.00 96.14 101 A 1 ATOM 809 N N . ILE A 0 102 . -17.705 0.000 8.297 1.00 96.04 102 A 1 ATOM 810 C CA . ILE A 0 102 . -18.601 0.571 9.317 1.00 96.04 102 A 1 ATOM 811 C C . ILE A 0 102 . -19.870 -0.284 9.466 1.00 96.04 102 A 1 ATOM 812 C CB . ILE A 0 102 . -18.927 2.045 8.981 1.00 96.04 102 A 1 ATOM 813 O O . ILE A 0 102 . -20.253 -0.623 10.585 1.00 96.04 102 A 1 ATOM 814 C CG1 . ILE A 0 102 . -17.655 2.921 9.090 1.00 96.04 102 A 1 ATOM 815 C CG2 . ILE A 0 102 . -20.018 2.602 9.917 1.00 96.04 102 A 1 ATOM 816 C CD1 . ILE A 0 102 . -17.811 4.307 8.451 1.00 96.04 102 A 1 ATOM 817 N N . GLY A 0 103 . -20.489 -0.687 8.352 1.00 95.69 103 A 1 ATOM 818 C CA . GLY A 0 103 . -21.672 -1.548 8.353 1.00 95.69 103 A 1 ATOM 819 C C . GLY A 0 103 . -21.415 -2.902 9.017 1.00 95.69 103 A 1 ATOM 820 O O . GLY A 0 103 . -22.196 -3.322 9.869 1.00 95.69 103 A 1 ATOM 821 N N . LEU A 0 104 . -20.290 -3.552 8.701 1.00 96.18 104 A 1 ATOM 822 C CA . LEU A 0 104 . -19.903 -4.820 9.330 1.00 96.18 104 A 1 ATOM 823 C C . LEU A 0 104 . -19.713 -4.683 10.845 1.00 96.18 104 A 1 ATOM 824 C CB . LEU A 0 104 . -18.619 -5.358 8.675 1.00 96.18 104 A 1 ATOM 825 O O . LEU A 0 104 . -20.175 -5.541 11.592 1.00 96.18 104 A 1 ATOM 826 C CG . LEU A 0 104 . -18.816 -5.937 7.263 1.00 96.18 104 A 1 ATOM 827 C CD1 . LEU A 0 104 . -17.449 -6.269 6.661 1.00 96.18 104 A 1 ATOM 828 C CD2 . LEU A 0 104 . -19.658 -7.215 7.272 1.00 96.18 104 A 1 ATOM 829 N N . VAL A 0 105 . -19.089 -3.600 11.318 1.00 96.69 105 A 1 ATOM 830 C CA . VAL A 0 105 . -18.904 -3.360 12.759 1.00 96.69 105 A 1 ATOM 831 C C . VAL A 0 105 . -20.249 -3.201 13.470 1.00 96.69 105 A 1 ATOM 832 C CB . VAL A 0 105 . -17.984 -2.149 13.008 1.00 96.69 105 A 1 ATOM 833 O O . VAL A 0 105 . -20.452 -3.815 14.516 1.00 96.69 105 A 1 ATOM 834 C CG1 . VAL A 0 105 . -17.900 -1.773 14.494 1.00 96.69 105 A 1 ATOM 835 C CG2 . VAL A 0 105 . -16.552 -2.453 12.545 1.00 96.69 105 A 1 ATOM 836 N N . ILE A 0 106 . -21.190 -2.440 12.900 1.00 96.95 106 A 1 ATOM 837 C CA . ILE A 0 106 . -22.528 -2.244 13.485 1.00 96.95 106 A 1 ATOM 838 C C . ILE A 0 106 . -23.285 -3.574 13.570 1.00 96.95 106 A 1 ATOM 839 C CB . ILE A 0 106 . -23.321 -1.187 12.683 1.00 96.95 106 A 1 ATOM 840 O O . ILE A 0 106 . -23.850 -3.890 14.618 1.00 96.95 106 A 1 ATOM 841 C CG1 . ILE A 0 106 . -22.653 0.201 12.821 1.00 96.95 106 A 1 ATOM 842 C CG2 . ILE A 0 106 . -24.786 -1.108 13.161 1.00 96.95 106 A 1 ATOM 843 C CD1 . ILE A 0 106 . -23.177 1.239 11.821 1.00 96.95 106 A 1 ATOM 844 N N . VAL A 0 107 . -23.257 -4.375 12.500 1.00 96.95 107 A 1 ATOM 845 C CA . VAL A 0 107 . -23.882 -5.705 12.475 1.00 96.95 107 A 1 ATOM 846 C C . VAL A 0 107 . -23.254 -6.606 13.540 1.00 96.95 107 A 1 ATOM 847 C CB . VAL A 0 107 . -23.800 -6.326 11.066 1.00 96.95 107 A 1 ATOM 848 O O . VAL A 0 107 . -23.983 -7.186 14.339 1.00 96.95 107 A 1 ATOM 849 C CG1 . VAL A 0 107 . -24.283 -7.780 11.030 1.00 96.95 107 A 1 ATOM 850 C CG2 . VAL A 0 107 . -24.684 -5.546 10.082 1.00 96.95 107 A 1 ATOM 851 N N . CYS A 0 108 . -21.923 -6.672 13.626 1.00 96.42 108 A 1 ATOM 852 C CA . CYS A 0 108 . -21.224 -7.464 14.641 1.00 96.42 108 A 1 ATOM 853 C C . CYS A 0 108 . -21.603 -7.051 16.069 1.00 96.42 108 A 1 ATOM 854 C CB . CYS A 0 108 . -19.711 -7.332 14.429 1.00 96.42 108 A 1 ATOM 855 O O . CYS A 0 108 . -21.917 -7.912 16.887 1.00 96.42 108 A 1 ATOM 856 S SG . CYS A 0 108 . -19.208 -8.284 12.967 1.00 96.42 108 A 1 ATOM 857 N N . VAL A 0 109 . -21.621 -5.749 16.374 1.00 96.68 109 A 1 ATOM 858 C CA . VAL A 0 109 . -22.022 -5.248 17.699 1.00 96.68 109 A 1 ATOM 859 C C . VAL A 0 109 . -23.480 -5.603 17.997 1.00 96.68 109 A 1 ATOM 860 C CB . VAL A 0 109 . -21.771 -3.731 17.816 1.00 96.68 109 A 1 ATOM 861 O O . VAL A 0 109 . -23.771 -6.089 19.089 1.00 96.68 109 A 1 ATOM 862 C CG1 . VAL A 0 109 . -22.331 -3.145 19.120 1.00 96.68 109 A 1 ATOM 863 C CG2 . VAL A 0 109 . -20.265 -3.428 17.804 1.00 96.68 109 A 1 ATOM 864 N N . GLY A 0 110 . -24.384 -5.439 17.027 1.00 95.95 110 A 1 ATOM 865 C CA . GLY A 0 110 . -25.791 -5.822 17.162 1.00 95.95 110 A 1 ATOM 866 C C . GLY A 0 110 . -25.977 -7.316 17.435 1.00 95.95 110 A 1 ATOM 867 O O . GLY A 0 110 . -26.699 -7.681 18.359 1.00 95.95 110 A 1 ATOM 868 N N . PHE A 0 111 . -25.270 -8.179 16.698 1.00 96.30 111 A 1 ATOM 869 C CA . PHE A 0 111 . -25.274 -9.630 16.914 1.00 96.30 111 A 1 ATOM 870 C C . PHE A 0 111 . -24.732 -10.014 18.288 1.00 96.30 111 A 1 ATOM 871 C CB . PHE A 0 111 . -24.456 -10.337 15.824 1.00 96.30 111 A 1 ATOM 872 O O . PHE A 0 111 . -25.317 -10.867 18.951 1.00 96.30 111 A 1 ATOM 873 C CG . PHE A 0 111 . -25.301 -10.853 14.681 1.00 96.30 111 A 1 ATOM 874 C CD1 . PHE A 0 111 . -25.889 -12.128 14.767 1.00 96.30 111 A 1 ATOM 875 C CD2 . PHE A 0 111 . -25.516 -10.066 13.538 1.00 96.30 111 A 1 ATOM 876 C CE1 . PHE A 0 111 . -26.677 -12.613 13.709 1.00 96.30 111 A 1 ATOM 877 C CE2 . PHE A 0 111 . -26.302 -10.548 12.479 1.00 96.30 111 A 1 ATOM 878 C CZ . PHE A 0 111 . -26.882 -11.824 12.564 1.00 96.30 111 A 1 ATOM 879 N N . ILE A 0 112 . -23.646 -9.377 18.735 1.00 96.27 112 A 1 ATOM 880 C CA . ILE A 0 112 . -23.089 -9.603 20.070 1.00 96.27 112 A 1 ATOM 881 C C . ILE A 0 112 . -24.147 -9.246 21.117 1.00 96.27 112 A 1 ATOM 882 C CB . ILE A 0 112 . -21.754 -8.838 20.240 1.00 96.27 112 A 1 ATOM 883 O O . ILE A 0 112 . -24.512 -10.102 21.917 1.00 96.27 112 A 1 ATOM 884 C CG1 . ILE A 0 112 . -20.653 -9.484 19.366 1.00 96.27 112 A 1 ATOM 885 C CG2 . ILE A 0 112 . -21.283 -8.828 21.706 1.00 96.27 112 A 1 ATOM 886 C CD1 . ILE A 0 112 . -19.418 -8.593 19.171 1.00 96.27 112 A 1 ATOM 887 N N . VAL A 0 113 . -24.705 -8.033 21.087 1.00 96.00 113 A 1 ATOM 888 C CA . VAL A 0 113 . -25.731 -7.599 22.053 1.00 96.00 113 A 1 ATOM 889 C C . VAL A 0 113 . -26.953 -8.523 22.029 1.00 96.00 113 A 1 ATOM 890 C CB . VAL A 0 113 . -26.137 -6.135 21.797 1.00 96.00 113 A 1 ATOM 891 O O . VAL A 0 113 . -27.401 -8.963 23.087 1.00 96.00 113 A 1 ATOM 892 C CG1 . VAL A 0 113 . -27.307 -5.690 22.687 1.00 96.00 113 A 1 ATOM 893 C CG2 . VAL A 0 113 . -24.963 -5.190 22.093 1.00 96.00 113 A 1 ATOM 894 N N . TRP A 0 114 . -27.452 -8.880 20.844 1.00 95.07 114 A 1 ATOM 895 C CA . TRP A 0 114 . -28.568 -9.814 20.681 1.00 95.07 114 A 1 ATOM 896 C C . TRP A 0 114 . -28.273 -11.185 21.293 1.00 95.07 114 A 1 ATOM 897 C CB . TRP A 0 114 . -28.883 -9.975 19.191 1.00 95.07 114 A 1 ATOM 898 O O . TRP A 0 114 . -29.105 -11.739 22.010 1.00 95.07 114 A 1 ATOM 899 C CG . TRP A 0 114 . -29.975 -10.960 18.924 1.00 95.07 114 A 1 ATOM 900 C CD1 . TRP A 0 114 . -29.812 -12.287 18.715 1.00 95.07 114 A 1 ATOM 901 C CD2 . TRP A 0 114 . -31.414 -10.727 18.922 1.00 95.07 114 A 1 ATOM 902 C CE2 . TRP A 0 114 . -32.071 -11.974 18.708 1.00 95.07 114 A 1 ATOM 903 C CE3 . TRP A 0 114 . -32.228 -9.588 19.097 1.00 95.07 114 A 1 ATOM 904 N NE1 . TRP A 0 114 . -31.049 -12.890 18.596 1.00 95.07 114 A 1 ATOM 905 C CH2 . TRP A 0 114 . -34.250 -10.935 18.832 1.00 95.07 114 A 1 ATOM 906 C CZ2 . TRP A 0 114 . -33.466 -12.089 18.663 1.00 95.07 114 A 1 ATOM 907 C CZ3 . TRP A 0 114 . -33.632 -9.690 19.049 1.00 95.07 114 A 1 ATOM 908 N N . PHE A 0 115 . -27.080 -11.726 21.044 1.00 95.47 115 A 1 ATOM 909 C CA . PHE A 0 115 . -26.644 -13.008 21.590 1.00 95.47 115 A 1 ATOM 910 C C . PHE A 0 115 . -26.543 -12.967 23.120 1.00 95.47 115 A 1 ATOM 911 C CB . PHE A 0 115 . -25.306 -13.381 20.941 1.00 95.47 115 A 1 ATOM 912 O O . PHE A 0 115 . -26.998 -13.889 23.795 1.00 95.47 115 A 1 ATOM 913 C CG . PHE A 0 115 . -24.781 -14.732 21.370 1.00 95.47 115 A 1 ATOM 914 C CD1 . PHE A 0 115 . -23.784 -14.827 22.359 1.00 95.47 115 A 1 ATOM 915 C CD2 . PHE A 0 115 . -25.302 -15.899 20.784 1.00 95.47 115 A 1 ATOM 916 C CE1 . PHE A 0 115 . -23.302 -16.089 22.752 1.00 95.47 115 A 1 ATOM 917 C CE2 . PHE A 0 115 . -24.824 -17.159 21.179 1.00 95.47 115 A 1 ATOM 918 C CZ . PHE A 0 115 . -23.821 -17.255 22.160 1.00 95.47 115 A 1 ATOM 919 N N . TRP A 0 116 . -26.014 -11.876 23.685 1.00 94.65 116 A 1 ATOM 920 C CA . TRP A 0 116 . -25.961 -11.670 25.135 1.00 94.65 116 A 1 ATOM 921 C C . TRP A 0 116 . -27.354 -11.566 25.768 1.00 94.65 116 A 1 ATOM 922 C CB . TRP A 0 116 . -25.121 -10.426 25.458 1.00 94.65 116 A 1 ATOM 923 O O . TRP A 0 116 . -27.558 -12.105 26.856 1.00 94.65 116 A 1 ATOM 924 C CG . TRP A 0 116 . -23.638 -10.646 25.467 1.00 94.65 116 A 1 ATOM 925 C CD1 . TRP A 0 116 . -22.776 -10.346 24.474 1.00 94.65 116 A 1 ATOM 926 C CD2 . TRP A 0 116 . -22.801 -11.142 26.553 1.00 94.65 116 A 1 ATOM 927 C CE2 . TRP A 0 116 . -21.442 -11.151 26.114 1.00 94.65 116 A 1 ATOM 928 C CE3 . TRP A 0 116 . -23.051 -11.551 27.880 1.00 94.65 116 A 1 ATOM 929 N NE1 . TRP A 0 116 . -21.491 -10.686 24.825 1.00 94.65 116 A 1 ATOM 930 C CH2 . TRP A 0 116 . -20.665 -11.936 28.259 1.00 94.65 116 A 1 ATOM 931 C CZ2 . TRP A 0 116 . -20.383 -11.545 26.940 1.00 94.65 116 A 1 ATOM 932 C CZ3 . TRP A 0 116 . -21.993 -11.937 28.725 1.00 94.65 116 A 1 ATOM 933 N N . LEU A 0 117 . -28.312 -10.911 25.104 1.00 93.88 117 A 1 ATOM 934 C CA . LEU A 0 117 . -29.698 -10.817 25.577 1.00 93.88 117 A 1 ATOM 935 C C . LEU A 0 117 . -30.436 -12.154 25.461 1.00 93.88 117 A 1 ATOM 936 C CB . LEU A 0 117 . -30.444 -9.713 24.807 1.00 93.88 117 A 1 ATOM 937 O O . LEU A 0 117 . -31.086 -12.568 26.415 1.00 93.88 117 A 1 ATOM 938 C CG . LEU A 0 117 . -29.995 -8.279 25.140 1.00 93.88 117 A 1 ATOM 939 C CD1 . LEU A 0 117 . -30.740 -7.295 24.238 1.00 93.88 117 A 1 ATOM 940 C CD2 . LEU A 0 117 . -30.274 -7.901 26.598 1.00 93.88 117 A 1 ATOM 941 N N . SER A 0 118 . -30.272 -12.858 24.340 1.00 92.06 118 A 1 ATOM 942 C CA . SER A 0 118 . -30.895 -14.168 24.101 1.00 92.06 118 A 1 ATOM 943 C C . SER A 0 118 . -30.386 -15.240 25.059 1.00 92.06 118 A 1 ATOM 944 C CB . SER A 0 118 . -30.618 -14.656 22.678 1.00 92.06 118 A 1 ATOM 945 O O . SER A 0 118 . -31.101 -16.183 25.346 1.00 92.06 118 A 1 ATOM 946 O OG . SER A 0 118 . -31.093 -13.741 21.712 1.00 92.06 118 A 1 ATOM 947 N N . LYS A 0 119 . -29.148 -15.108 25.552 1.00 91.84 119 A 1 ATOM 948 C CA . LYS A 0 119 . -28.586 -16.015 26.560 1.00 91.84 119 A 1 ATOM 949 C C . LYS A 0 119 . -29.039 -15.680 27.989 1.00 91.84 119 A 1 ATOM 950 C CB . LYS A 0 119 . -27.058 -16.019 26.401 1.00 91.84 119 A 1 ATOM 951 O O . LYS A 0 119 . -28.843 -16.495 28.886 1.00 91.84 119 A 1 ATOM 952 C CG . LYS A 0 119 . -26.393 -17.154 27.190 1.00 91.84 119 A 1 ATOM 953 C CD . LYS A 0 119 . -24.900 -17.250 26.880 1.00 91.84 119 A 1 ATOM 954 C CE . LYS A 0 119 . -24.320 -18.412 27.692 1.00 91.84 119 A 1 ATOM 955 N NZ . LYS A 0 119 . -22.889 -18.635 27.378 1.00 91.84 119 A 1 ATOM 956 N N . ARG A 0 120 . -29.559 -14.468 28.227 1.00 88.08 120 A 1 ATOM 957 C CA . ARG A 0 120 . -30.088 -14.055 29.538 1.00 88.08 120 A 1 ATOM 958 C C . ARG A 0 120 . -31.565 -14.405 29.736 1.00 88.08 120 A 1 ATOM 959 C CB . ARG A 0 120 . -29.884 -12.550 29.774 1.00 88.08 120 A 1 ATOM 960 O O . ARG A 0 120 . -31.963 -14.478 30.895 1.00 88.08 120 A 1 ATOM 961 C CG . ARG A 0 120 . -28.531 -12.198 30.404 1.00 88.08 120 A 1 ATOM 962 C CD . ARG A 0 120 . -28.625 -10.768 30.952 1.00 88.08 120 A 1 ATOM 963 N NE . ARG A 0 120 . -27.330 -10.255 31.435 1.00 88.08 120 A 1 ATOM 964 N NH1 . ARG A 0 120 . -28.124 -8.262 32.254 1.00 88.08 120 A 1 ATOM 965 N NH2 . ARG A 0 120 . -25.934 -8.682 32.315 1.00 88.08 120 A 1 ATOM 966 C CZ . ARG A 0 120 . -27.136 -9.075 31.998 1.00 88.08 120 A 1 ATOM 967 N N . GLN A 0 121 . -32.348 -14.541 28.662 1.00 76.00 121 A 1 ATOM 968 C CA . GLN A 0 121 . -33.700 -15.116 28.716 1.00 76.00 121 A 1 ATOM 969 C C . GLN A 0 121 . -33.639 -16.640 28.681 1.00 76.00 121 A 1 ATOM 970 C CB . GLN A 0 121 . -34.585 -14.585 27.578 1.00 76.00 121 A 1 ATOM 971 O O . GLN A 0 121 . -34.509 -17.250 29.337 1.00 76.00 121 A 1 ATOM 972 C CG . GLN A 0 121 . -35.028 -13.134 27.814 1.00 76.00 121 A 1 ATOM 973 C CD . GLN A 0 121 . -36.316 -12.761 27.074 1.00 76.00 121 A 1 ATOM 974 N NE2 . GLN A 0 121 . -36.944 -11.661 27.431 1.00 76.00 121 A 1 ATOM 975 O OE1 . GLN A 0 121 . -36.803 -13.418 26.171 1.00 76.00 121 A 1 ATOM 976 O OXT . GLN A 0 121 . -32.713 -17.143 28.011 1.00 76.00 121 A 1 # _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.3.9 _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic # loop_ _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.details _pdbx_data_usage.url _pdbx_data_usage.name 1 license 'Data in this file is available under a CC-BY-4.0 license.' https://creativecommons.org/licenses/by/4.0/ CC-BY-4.0 2 disclaimer ;ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD PARTY. DISCLAIMER: THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE. ; ? ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Jumper, John' 1 'Evans, Richard' 2 'Pritzel, Alexander' 3 'Green, Tim' 4 'Figurnov, Michael' 5 'Ronneberger, Olaf' 6 'Tunyasuvunakool, Kathryn' 7 'Bates, Russ' 8 'Zidek, Augustin' 9 'Potapenko, Anna' 10 'Bridgland, Alex' 11 'Meyer, Clemens' 12 'Kohl, Simon A. A.' 13 'Ballard, Andrew J.' 14 'Cowie, Andrew' 15 'Romera-Paredes, Bernardino' 16 'Nikolov, Stanislav' 17 'Jain, Rishub' 18 'Adler, Jonas' 19 'Back, Trevor' 20 'Petersen, Stig' 21 'Reiman, David' 22 'Clancy, Ellen' 23 'Zielinski, Michal' 24 'Steinegger, Martin' 25 'Pacholska, Michalina' 26 'Berghammer, Tamas' 27 'Silver, David' 28 'Vinyals, Oriol' 29 'Senior, Andrew W.' 30 'Kavukcuoglu, Koray' 31 'Kohli, Pushmeet' 32 'Hassabis, Demis' 33 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Jumper, John' 1 primary 'Evans, Richard' 2 primary 'Pritzel, Alexander' 3 primary 'Green, Tim' 4 primary 'Figurnov, Michael' 5 primary 'Ronneberger, Olaf' 6 primary 'Tunyasuvunakool, Kathryn' 7 primary 'Bates, Russ' 8 primary 'Zidek, Augustin' 9 primary 'Potapenko, Anna' 10 primary 'Bridgland, Alex' 11 primary 'Meyer, Clemens' 12 primary 'Kohl, Simon A. A.' 13 primary 'Ballard, Andrew J.' 14 primary 'Cowie, Andrew' 15 primary 'Romera-Paredes, Bernardino' 16 primary 'Nikolov, Stanislav' 17 primary 'Jain, Rishub' 18 primary 'Adler, Jonas' 19 primary 'Back, Trevor' 20 primary 'Petersen, Stig' 21 primary 'Reiman, David' 22 primary 'Clancy, Ellen' 23 primary 'Zielinski, Michal' 24 primary 'Steinegger, Martin' 25 primary 'Pacholska, Michalina' 26 primary 'Berghammer, Tamas' 27 primary 'Silver, David' 28 primary 'Vinyals, Oriol' 29 primary 'Senior, Andrew W.' 30 primary 'Kavukcuoglu, Koray' 31 primary 'Kohli, Pushmeet' 32 primary 'Hassabis, Demis' 33 # _citation.id primary _citation.title 'Highly accurate protein structure prediction with AlphaFold' _citation.journal_full Nature _citation.journal_volume 596 _citation.page_first 583 _citation.page_last 589 _citation.year 2021 _citation.journal_id_ASTM NATUAS _citation.country UK _citation.journal_id_ISSN 0028-0836 _citation.journal_id_CSD 0006 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 34265844 _citation.pdbx_database_id_DOI 10.1038/s41586-021-03819-2 # _ma_data.id 1 _ma_data.name Model _ma_data.content_type 'model coordinates' # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.entity_id 0 _ma_target_entity_instance.details . # _ma_target_entity.entity_id 0 _ma_target_entity.data_id 1 _ma_target_entity.origin . # _ma_model_list.ordinal_id 1 _ma_model_list.model_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_name 'Top ranked model' _ma_model_list.model_group_name 'AlphaFold Monomer v2.3.2 model' _ma_model_list.data_id 1 _ma_model_list.model_type 'Ab initio model' # _software.pdbx_ordinal 1 _software.name AlphaFold _software.version v2.3.2 _software.type package _software.description 'Structure prediction' _software.classification other _software.date ? # _ma_software_group.ordinal_id 1 _ma_software_group.group_id 1 _ma_software_group.software_id 1 # loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type 1 1 1 'coevolution MSA' 2 1 2 'template search' 3 1 3 modeling # loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.software_group_id 1 pLDDT pLDDT global 1 2 pLDDT pLDDT local 1 # _ma_qa_metric_global.ordinal_id 1 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 67.26 # loop_ _atom_type.symbol C N O S #