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 LEU 0 3 HIS 0 4 ILE 0 5 THR 0 6 THR 0 7 MET 0 8 THR 0 9 ASP 0 10 LYS 0 11 ALA 0 12 PRO 0 13 ILE 0 14 LYS 0 15 THR 0 16 ASN 0 17 LYS 0 18 ARG 0 19 LEU 0 20 GLN 0 21 GLN 0 22 THR 0 23 GLN 0 24 ALA 0 25 GLN 0 26 VAL 0 27 ASN 0 28 GLU 0 29 VAL 0 30 VAL 0 31 ASP 0 32 ILE 0 33 MET 0 34 ARG 0 35 VAL 0 36 ASN 0 37 VAL 0 38 ASP 0 39 LYS 0 40 VAL 0 41 LEU 0 42 GLU 0 43 ARG 0 44 ASP 0 45 LYS 0 46 ASN 0 47 LEU 0 48 SER 0 49 GLU 0 50 LEU 0 51 ASP 0 52 GLY 0 53 ARG 0 54 ALA 0 55 ASP 0 56 ALA 0 57 LEU 0 58 GLN 0 59 ALA 0 60 GLY 0 61 ALA 0 62 SER 0 63 GLN 0 64 PHE 0 65 GLU 0 66 ALA 0 67 SER 0 68 ALA 0 69 GLY 0 70 LYS 0 71 LEU 0 72 LYS 0 73 ARG 0 74 LYS 0 75 PHE 0 76 TRP 0 77 TRP 0 78 LYS 0 79 ASN 0 80 CYS 0 81 LYS 0 82 TYR 0 83 GLY 0 84 SER 0 85 PHE 0 86 LEU 0 87 ASN 0 88 LYS 0 89 LYS 0 90 ILE 0 91 LYS 0 92 LEU 0 93 ASN 0 94 LYS 0 95 VAL 0 96 ASN 0 97 ILE 0 98 HIS 0 99 LEU 0 100 ILE 0 101 ILE 0 102 LEU # 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 . -50.255 -21.173 79.796 1.00 56.61 1 A 1 ATOM 2 C CA . MET A 0 1 . -49.707 -21.192 78.424 1.00 56.61 1 A 1 ATOM 3 C C . MET A 0 1 . -48.778 -20.003 78.261 1.00 56.61 1 A 1 ATOM 4 C CB . MET A 0 1 . -50.814 -21.109 77.361 1.00 56.61 1 A 1 ATOM 5 O O . MET A 0 1 . -49.253 -18.876 78.273 1.00 56.61 1 A 1 ATOM 6 C CG . MET A 0 1 . -51.271 -22.469 76.834 1.00 56.61 1 A 1 ATOM 7 S SD . MET A 0 1 . -52.024 -22.272 75.200 1.00 56.61 1 A 1 ATOM 8 C CE . MET A 0 1 . -52.439 -23.983 74.782 1.00 56.61 1 A 1 ATOM 9 N N . LEU A 0 2 . -47.470 -20.237 78.179 1.00 44.64 2 A 1 ATOM 10 C CA . LEU A 0 2 . -46.509 -19.207 77.785 1.00 44.64 2 A 1 ATOM 11 C C . LEU A 0 2 . -46.595 -19.045 76.264 1.00 44.64 2 A 1 ATOM 12 C CB . LEU A 0 2 . -45.101 -19.628 78.254 1.00 44.64 2 A 1 ATOM 13 O O . LEU A 0 2 . -46.316 -19.989 75.527 1.00 44.64 2 A 1 ATOM 14 C CG . LEU A 0 2 . -44.816 -19.238 79.718 1.00 44.64 2 A 1 ATOM 15 C CD1 . LEU A 0 2 . -43.788 -20.176 80.346 1.00 44.64 2 A 1 ATOM 16 C CD2 . LEU A 0 2 . -44.282 -17.807 79.800 1.00 44.64 2 A 1 ATOM 17 N N . HIS A 0 3 . -47.022 -17.868 75.808 1.00 47.63 3 A 1 ATOM 18 C CA . HIS A 0 3 . -46.983 -17.490 74.400 1.00 47.63 3 A 1 ATOM 19 C C . HIS A 0 3 . -45.529 -17.237 74.003 1.00 47.63 3 A 1 ATOM 20 C CB . HIS A 0 3 . -47.855 -16.248 74.152 1.00 47.63 3 A 1 ATOM 21 O O . HIS A 0 3 . -44.976 -16.172 74.274 1.00 47.63 3 A 1 ATOM 22 C CG . HIS A 0 3 . -49.333 -16.536 74.140 1.00 47.63 3 A 1 ATOM 23 C CD2 . HIS A 0 3 . -50.034 -17.113 73.115 1.00 47.63 3 A 1 ATOM 24 N ND1 . HIS A 0 3 . -50.241 -16.226 75.128 1.00 47.63 3 A 1 ATOM 25 C CE1 . HIS A 0 3 . -51.459 -16.609 74.707 1.00 47.63 3 A 1 ATOM 26 N NE2 . HIS A 0 3 . -51.379 -17.163 73.490 1.00 47.63 3 A 1 ATOM 27 N N . ILE A 0 4 . -44.904 -18.222 73.363 1.00 51.17 4 A 1 ATOM 28 C CA . ILE A 0 4 . -43.652 -18.016 72.640 1.00 51.17 4 A 1 ATOM 29 C C . ILE A 0 4 . -44.036 -17.420 71.283 1.00 51.17 4 A 1 ATOM 30 C CB . ILE A 0 4 . -42.807 -19.310 72.527 1.00 51.17 4 A 1 ATOM 31 O O . ILE A 0 4 . -44.167 -18.129 70.290 1.00 51.17 4 A 1 ATOM 32 C CG1 . ILE A 0 4 . -42.747 -20.095 73.859 1.00 51.17 4 A 1 ATOM 33 C CG2 . ILE A 0 4 . -41.390 -18.924 72.055 1.00 51.17 4 A 1 ATOM 34 C CD1 . ILE A 0 4 . -42.022 -21.442 73.746 1.00 51.17 4 A 1 ATOM 35 N N . THR A 0 5 . -44.286 -16.111 71.244 1.00 54.98 5 A 1 ATOM 36 C CA . THR A 0 5 . -44.360 -15.390 69.970 1.00 54.98 5 A 1 ATOM 37 C C . THR A 0 5 . -42.934 -15.249 69.463 1.00 54.98 5 A 1 ATOM 38 C CB . THR A 0 5 . -45.068 -14.036 70.093 1.00 54.98 5 A 1 ATOM 39 O O . THR A 0 5 . -42.184 -14.370 69.884 1.00 54.98 5 A 1 ATOM 40 C CG2 . THR A 0 5 . -45.228 -13.349 68.734 1.00 54.98 5 A 1 ATOM 41 O OG1 . THR A 0 5 . -46.369 -14.241 70.594 1.00 54.98 5 A 1 ATOM 42 N N . THR A 0 6 . -42.533 -16.179 68.603 1.00 46.23 6 A 1 ATOM 43 C CA . THR A 0 6 . -41.248 -16.154 67.915 1.00 46.23 6 A 1 ATOM 44 C C . THR A 0 6 . -41.146 -14.908 67.039 1.00 46.23 6 A 1 ATOM 45 C CB . THR A 0 6 . -41.056 -17.418 67.068 1.00 46.23 6 A 1 ATOM 46 O O . THR A 0 6 . -42.014 -14.639 66.209 1.00 46.23 6 A 1 ATOM 47 C CG2 . THR A 0 6 . -40.871 -18.656 67.948 1.00 46.23 6 A 1 ATOM 48 O OG1 . THR A 0 6 . -42.193 -17.628 66.264 1.00 46.23 6 A 1 ATOM 49 N N . MET A 0 7 . -40.063 -14.171 67.263 1.00 50.92 7 A 1 ATOM 50 C CA . MET A 0 7 . -39.585 -12.978 66.569 1.00 50.92 7 A 1 ATOM 51 C C . MET A 0 7 . -39.900 -12.963 65.063 1.00 50.92 7 A 1 ATOM 52 C CB . MET A 0 7 . -38.055 -12.925 66.764 1.00 50.92 7 A 1 ATOM 53 O O . MET A 0 7 . -39.306 -13.698 64.276 1.00 50.92 7 A 1 ATOM 54 C CG . MET A 0 7 . -37.579 -13.003 68.223 1.00 50.92 7 A 1 ATOM 55 S SD . MET A 0 7 . -38.119 -11.640 69.285 1.00 50.92 7 A 1 ATOM 56 C CE . MET A 0 7 . -37.238 -12.081 70.807 1.00 50.92 7 A 1 ATOM 57 N N . THR A 0 8 . -40.788 -12.063 64.638 1.00 52.23 8 A 1 ATOM 58 C CA . THR A 0 8 . -40.889 -11.650 63.234 1.00 52.23 8 A 1 ATOM 59 C C . THR A 0 8 . -39.875 -10.534 62.988 1.00 52.23 8 A 1 ATOM 60 C CB . THR A 0 8 . -42.315 -11.218 62.847 1.00 52.23 8 A 1 ATOM 61 O O . THR A 0 8 . -40.220 -9.350 63.039 1.00 52.23 8 A 1 ATOM 62 C CG2 . THR A 0 8 . -43.339 -12.339 63.016 1.00 52.23 8 A 1 ATOM 63 O OG1 . THR A 0 8 . -42.738 -10.117 63.620 1.00 52.23 8 A 1 ATOM 64 N N . ASP A 0 9 . -38.615 -10.893 62.744 1.00 52.91 9 A 1 ATOM 65 C CA . ASP A 0 9 . -37.617 -9.938 62.260 1.00 52.91 9 A 1 ATOM 66 C C . ASP A 0 9 . -38.033 -9.440 60.866 1.00 52.91 9 A 1 ATOM 67 C CB . ASP A 0 9 . -36.199 -10.544 62.275 1.00 52.91 9 A 1 ATOM 68 O O . ASP A 0 9 . -37.903 -10.118 59.845 1.00 52.91 9 A 1 ATOM 69 C CG . ASP A 0 9 . -35.363 -10.077 63.473 1.00 52.91 9 A 1 ATOM 70 O OD1 . ASP A 0 9 . -35.522 -8.894 63.851 1.00 52.91 9 A 1 ATOM 71 O OD2 . ASP A 0 9 . -34.555 -10.892 63.960 1.00 52.91 9 A 1 ATOM 72 N N . LYS A 0 10 . -38.593 -8.227 60.819 1.00 53.39 10 A 1 ATOM 73 C CA . LYS A 0 10 . -39.115 -7.544 59.622 1.00 53.39 10 A 1 ATOM 74 C C . LYS A 0 10 . -38.016 -7.022 58.671 1.00 53.39 10 A 1 ATOM 75 C CB . LYS A 0 10 . -40.110 -6.438 60.045 1.00 53.39 10 A 1 ATOM 76 O O . LYS A 0 10 . -38.160 -5.948 58.087 1.00 53.39 10 A 1 ATOM 77 C CG . LYS A 0 10 . -41.551 -6.930 60.244 1.00 53.39 10 A 1 ATOM 78 C CD . LYS A 0 10 . -42.508 -5.730 60.139 1.00 53.39 10 A 1 ATOM 79 C CE . LYS A 0 10 . -43.966 -6.176 60.274 1.00 53.39 10 A 1 ATOM 80 N NZ . LYS A 0 10 . -44.909 -5.042 60.100 1.00 53.39 10 A 1 ATOM 81 N N . ALA A 0 11 . -36.944 -7.778 58.444 1.00 60.01 11 A 1 ATOM 82 C CA . ALA A 0 11 . -35.890 -7.420 57.488 1.00 60.01 11 A 1 ATOM 83 C C . ALA A 0 11 . -35.754 -8.248 56.173 1.00 60.01 11 A 1 ATOM 84 C CB . ALA A 0 11 . -34.578 -7.272 58.264 1.00 60.01 11 A 1 ATOM 85 O O . ALA A 0 11 . -34.816 -7.953 55.432 1.00 60.01 11 A 1 ATOM 86 N N . PRO A 0 12 . -36.642 -9.190 55.764 1.00 60.42 12 A 1 ATOM 87 C CA . PRO A 0 12 . -36.455 -9.929 54.500 1.00 60.42 12 A 1 ATOM 88 C C . PRO A 0 12 . -37.038 -9.251 53.240 1.00 60.42 12 A 1 ATOM 89 C CB . PRO A 0 12 . -37.073 -11.308 54.750 1.00 60.42 12 A 1 ATOM 90 O O . PRO A 0 12 . -36.620 -9.560 52.126 1.00 60.42 12 A 1 ATOM 91 C CG . PRO A 0 12 . -38.184 -11.029 55.756 1.00 60.42 12 A 1 ATOM 92 C CD . PRO A 0 12 . -37.630 -9.877 56.586 1.00 60.42 12 A 1 ATOM 93 N N . ILE A 0 13 . -38.003 -8.327 53.360 1.00 64.05 13 A 1 ATOM 94 C CA . ILE A 0 13 . -38.737 -7.802 52.183 1.00 64.05 13 A 1 ATOM 95 C C . ILE A 0 13 . -37.949 -6.691 51.459 1.00 64.05 13 A 1 ATOM 96 C CB . ILE A 0 13 . -40.164 -7.341 52.580 1.00 64.05 13 A 1 ATOM 97 O O . ILE A 0 13 . -37.897 -6.665 50.229 1.00 64.05 13 A 1 ATOM 98 C CG1 . ILE A 0 13 . -40.996 -8.464 53.266 1.00 64.05 13 A 1 ATOM 99 C CG2 . ILE A 0 13 . -40.903 -6.714 51.377 1.00 64.05 13 A 1 ATOM 100 C CD1 . ILE A 0 13 . -42.128 -9.115 52.457 1.00 64.05 13 A 1 ATOM 101 N N . LYS A 0 14 . -37.326 -5.753 52.197 1.00 73.83 14 A 1 ATOM 102 C CA . LYS A 0 14 . -36.561 -4.637 51.594 1.00 73.83 14 A 1 ATOM 103 C C . LYS A 0 14 . -35.279 -5.120 50.905 1.00 73.83 14 A 1 ATOM 104 C CB . LYS A 0 14 . -36.214 -3.551 52.633 1.00 73.83 14 A 1 ATOM 105 O O . LYS A 0 14 . -34.936 -4.606 49.842 1.00 73.83 14 A 1 ATOM 106 C CG . LYS A 0 14 . -37.409 -2.682 53.063 1.00 73.83 14 A 1 ATOM 107 C CD . LYS A 0 14 . -36.940 -1.505 53.941 1.00 73.83 14 A 1 ATOM 108 C CE . LYS A 0 14 . -38.119 -0.628 54.389 1.00 73.83 14 A 1 ATOM 109 N NZ . LYS A 0 14 . -37.673 0.559 55.170 1.00 73.83 14 A 1 ATOM 110 N N . THR A 0 15 . -34.596 -6.098 51.497 1.00 79.53 15 A 1 ATOM 111 C CA . THR A 0 15 . -33.387 -6.729 50.946 1.00 79.53 15 A 1 ATOM 112 C C . THR A 0 15 . -33.694 -7.477 49.648 1.00 79.53 15 A 1 ATOM 113 C CB . THR A 0 15 . -32.765 -7.682 51.980 1.00 79.53 15 A 1 ATOM 114 O O . THR A 0 15 . -32.996 -7.262 48.661 1.00 79.53 15 A 1 ATOM 115 C CG2 . THR A 0 15 . -32.127 -6.918 53.141 1.00 79.53 15 A 1 ATOM 116 O OG1 . THR A 0 15 . -33.783 -8.477 52.537 1.00 79.53 15 A 1 ATOM 117 N N . ASN A 0 16 . -34.796 -8.237 49.596 1.00 82.54 16 A 1 ATOM 118 C CA . ASN A 0 16 . -35.253 -8.918 48.378 1.00 82.54 16 A 1 ATOM 119 C C . ASN A 0 16 . -35.507 -7.957 47.207 1.00 82.54 16 A 1 ATOM 120 C CB . ASN A 0 16 . -36.519 -9.738 48.682 1.00 82.54 16 A 1 ATOM 121 O O . ASN A 0 16 . -35.065 -8.230 46.096 1.00 82.54 16 A 1 ATOM 122 C CG . ASN A 0 16 . -36.179 -11.187 48.955 1.00 82.54 16 A 1 ATOM 123 N ND2 . ASN A 0 16 . -36.225 -11.624 50.188 1.00 82.54 16 A 1 ATOM 124 O OD1 . ASN A 0 16 . -35.849 -11.928 48.052 1.00 82.54 16 A 1 ATOM 125 N N . LYS A 0 17 . -36.171 -6.812 47.436 1.00 87.46 17 A 1 ATOM 126 C CA . LYS A 0 17 . -36.420 -5.827 46.364 1.00 87.46 17 A 1 ATOM 127 C C . LYS A 0 17 . -35.128 -5.254 45.781 1.00 87.46 17 A 1 ATOM 128 C CB . LYS A 0 17 . -37.313 -4.679 46.852 1.00 87.46 17 A 1 ATOM 129 O O . LYS A 0 17 . -35.013 -5.149 44.565 1.00 87.46 17 A 1 ATOM 130 C CG . LYS A 0 17 . -38.768 -5.117 47.049 1.00 87.46 17 A 1 ATOM 131 C CD . LYS A 0 17 . -39.655 -3.902 47.347 1.00 87.46 17 A 1 ATOM 132 C CE . LYS A 0 17 . -41.105 -4.359 47.539 1.00 87.46 17 A 1 ATOM 133 N NZ . LYS A 0 17 . -42.035 -3.209 47.683 1.00 87.46 17 A 1 ATOM 134 N N . ARG A 0 18 . -34.159 -4.900 46.634 1.00 88.24 18 A 1 ATOM 135 C CA . ARG A 0 18 . -32.845 -4.417 46.175 1.00 88.24 18 A 1 ATOM 136 C C . ARG A 0 18 . -32.106 -5.492 45.383 1.00 88.24 18 A 1 ATOM 137 C CB . ARG A 0 18 . -31.987 -3.937 47.352 1.00 88.24 18 A 1 ATOM 138 O O . ARG A 0 18 . -31.600 -5.195 44.312 1.00 88.24 18 A 1 ATOM 139 C CG . ARG A 0 18 . -32.461 -2.587 47.902 1.00 88.24 18 A 1 ATOM 140 C CD . ARG A 0 18 . -31.467 -2.093 48.959 1.00 88.24 18 A 1 ATOM 141 N NE . ARG A 0 18 . -31.804 -0.740 49.440 1.00 88.24 18 A 1 ATOM 142 N NH1 . ARG A 0 18 . -30.126 -0.570 51.001 1.00 88.24 18 A 1 ATOM 143 N NH2 . ARG A 0 18 . -31.512 1.149 50.682 1.00 88.24 18 A 1 ATOM 144 C CZ . ARG A 0 18 . -31.150 -0.064 50.370 1.00 88.24 18 A 1 ATOM 145 N N . LEU A 0 19 . -32.112 -6.736 45.864 1.00 89.51 19 A 1 ATOM 146 C CA . LEU A 0 19 . -31.494 -7.859 45.159 1.00 89.51 19 A 1 ATOM 147 C C . LEU A 0 19 . -32.141 -8.105 43.787 1.00 89.51 19 A 1 ATOM 148 C CB . LEU A 0 19 . -31.564 -9.104 46.059 1.00 89.51 19 A 1 ATOM 149 O O . LEU A 0 19 . -31.427 -8.282 42.809 1.00 89.51 19 A 1 ATOM 150 C CG . LEU A 0 19 . -30.917 -10.360 45.445 1.00 89.51 19 A 1 ATOM 151 C CD1 . LEU A 0 19 . -29.424 -10.168 45.177 1.00 89.51 19 A 1 ATOM 152 C CD2 . LEU A 0 19 . -31.095 -11.537 46.404 1.00 89.51 19 A 1 ATOM 153 N N . GLN A 0 20 . -33.473 -8.055 43.692 1.00 90.83 20 A 1 ATOM 154 C CA . GLN A 0 20 . -34.196 -8.186 42.420 1.00 90.83 20 A 1 ATOM 155 C C . GLN A 0 20 . -33.855 -7.057 41.440 1.00 90.83 20 A 1 ATOM 156 C CB . GLN A 0 20 . -35.709 -8.205 42.677 1.00 90.83 20 A 1 ATOM 157 O O . GLN A 0 20 . -33.653 -7.322 40.258 1.00 90.83 20 A 1 ATOM 158 C CG . GLN A 0 20 . -36.190 -9.524 43.295 1.00 90.83 20 A 1 ATOM 159 C CD . GLN A 0 20 . -37.652 -9.463 43.726 1.00 90.83 20 A 1 ATOM 160 N NE2 . GLN A 0 20 . -38.052 -10.253 44.698 1.00 90.83 20 A 1 ATOM 161 O OE1 . GLN A 0 20 . -38.468 -8.710 43.220 1.00 90.83 20 A 1 ATOM 162 N N . GLN A 0 21 . -33.747 -5.812 41.919 1.00 91.46 21 A 1 ATOM 163 C CA . GLN A 0 21 . -33.301 -4.683 41.095 1.00 91.46 21 A 1 ATOM 164 C C . GLN A 0 21 . -31.872 -4.890 40.591 1.00 91.46 21 A 1 ATOM 165 C CB . GLN A 0 21 . -33.384 -3.376 41.892 1.00 91.46 21 A 1 ATOM 166 O O . GLN A 0 21 . -31.621 -4.735 39.401 1.00 91.46 21 A 1 ATOM 167 C CG . GLN A 0 21 . -34.828 -2.892 42.056 1.00 91.46 21 A 1 ATOM 168 C CD . GLN A 0 21 . -34.941 -1.659 42.946 1.00 91.46 21 A 1 ATOM 169 N NE2 . GLN A 0 21 . -36.001 -0.893 42.804 1.00 91.46 21 A 1 ATOM 170 O OE1 . GLN A 0 21 . -34.121 -1.357 43.801 1.00 91.46 21 A 1 ATOM 171 N N . THR A 0 22 . -30.950 -5.293 41.467 1.00 92.28 22 A 1 ATOM 172 C CA . THR A 0 22 . -29.570 -5.596 41.074 1.00 92.28 22 A 1 ATOM 173 C C . THR A 0 22 . -29.513 -6.759 40.084 1.00 92.28 22 A 1 ATOM 174 C CB . THR A 0 22 . -28.709 -5.885 42.311 1.00 92.28 22 A 1 ATOM 175 O O . THR A 0 22 . -28.778 -6.677 39.109 1.00 92.28 22 A 1 ATOM 176 C CG2 . THR A 0 22 . -27.244 -6.153 41.976 1.00 92.28 22 A 1 ATOM 177 O OG1 . THR A 0 22 . -28.728 -4.761 43.162 1.00 92.28 22 A 1 ATOM 178 N N . GLN A 0 23 . -30.325 -7.805 40.257 1.00 91.66 23 A 1 ATOM 179 C CA . GLN A 0 23 . -30.406 -8.909 39.300 1.00 91.66 23 A 1 ATOM 180 C C . GLN A 0 23 . -30.913 -8.443 37.929 1.00 91.66 23 A 1 ATOM 181 C CB . GLN A 0 23 . -31.304 -10.021 39.867 1.00 91.66 23 A 1 ATOM 182 O O . GLN A 0 23 . -30.371 -8.859 36.909 1.00 91.66 23 A 1 ATOM 183 C CG . GLN A 0 23 . -31.288 -11.285 38.991 1.00 91.66 23 A 1 ATOM 184 C CD . GLN A 0 23 . -29.899 -11.911 38.920 1.00 91.66 23 A 1 ATOM 185 N NE2 . GLN A 0 23 . -29.286 -12.003 37.761 1.00 91.66 23 A 1 ATOM 186 O OE1 . GLN A 0 23 . -29.333 -12.308 39.924 1.00 91.66 23 A 1 ATOM 187 N N . ALA A 0 24 . -31.920 -7.564 37.893 1.00 94.31 24 A 1 ATOM 188 C CA . ALA A 0 24 . -32.422 -6.983 36.651 1.00 94.31 24 A 1 ATOM 189 C C . ALA A 0 24 . -31.351 -6.133 35.946 1.00 94.31 24 A 1 ATOM 190 C CB . ALA A 0 24 . -33.690 -6.179 36.960 1.00 94.31 24 A 1 ATOM 191 O O . ALA A 0 24 . -31.145 -6.294 34.748 1.00 94.31 24 A 1 ATOM 192 N N . GLN A 0 25 . -30.618 -5.302 36.696 1.00 95.18 25 A 1 ATOM 193 C CA . GLN A 0 25 . -29.504 -4.505 36.169 1.00 95.18 25 A 1 ATOM 194 C C . GLN A 0 25 . -28.364 -5.382 35.638 1.00 95.18 25 A 1 ATOM 195 C CB . GLN A 0 25 . -28.957 -3.593 37.276 1.00 95.18 25 A 1 ATOM 196 O O . GLN A 0 25 . -27.814 -5.109 34.577 1.00 95.18 25 A 1 ATOM 197 C CG . GLN A 0 25 . -29.914 -2.447 37.617 1.00 95.18 25 A 1 ATOM 198 C CD . GLN A 0 25 . -29.383 -1.575 38.750 1.00 95.18 25 A 1 ATOM 199 N NE2 . GLN A 0 25 . -29.502 -0.271 38.630 1.00 95.18 25 A 1 ATOM 200 O OE1 . GLN A 0 25 . -28.867 -2.030 39.762 1.00 95.18 25 A 1 ATOM 201 N N . VAL A 0 26 . -28.008 -6.452 36.355 1.00 95.70 26 A 1 ATOM 202 C CA . VAL A 0 26 . -26.983 -7.399 35.898 1.00 95.70 26 A 1 ATOM 203 C C . VAL A 0 26 . -27.436 -8.097 34.618 1.00 95.70 26 A 1 ATOM 204 C CB . VAL A 0 26 . -26.622 -8.410 37.003 1.00 95.70 26 A 1 ATOM 205 O O . VAL A 0 26 . -26.644 -8.190 33.687 1.00 95.70 26 A 1 ATOM 206 C CG1 . VAL A 0 26 . -25.732 -9.552 36.493 1.00 95.70 26 A 1 ATOM 207 C CG2 . VAL A 0 26 . -25.848 -7.715 38.133 1.00 95.70 26 A 1 ATOM 208 N N . ASN A 0 27 . -28.695 -8.537 34.535 1.00 95.82 27 A 1 ATOM 209 C CA . ASN A 0 27 . -29.234 -9.157 33.323 1.00 95.82 27 A 1 ATOM 210 C C . ASN A 0 27 . -29.188 -8.192 32.127 1.00 95.82 27 A 1 ATOM 211 C CB . ASN A 0 27 . -30.666 -9.651 33.580 1.00 95.82 27 A 1 ATOM 212 O O . ASN A 0 27 . -28.715 -8.579 31.065 1.00 95.82 27 A 1 ATOM 213 C CG . ASN A 0 27 . -30.767 -10.826 34.536 1.00 95.82 27 A 1 ATOM 214 N ND2 . ASN A 0 27 . -31.971 -11.176 34.927 1.00 95.82 27 A 1 ATOM 215 O OD1 . ASN A 0 27 . -29.809 -11.465 34.945 1.00 95.82 27 A 1 ATOM 216 N N . GLU A 0 28 . -29.582 -6.930 32.318 1.00 96.80 28 A 1 ATOM 217 C CA . GLU A 0 28 . -29.500 -5.892 31.283 1.00 96.80 28 A 1 ATOM 218 C C . GLU A 0 28 . -28.058 -5.683 30.794 1.00 96.80 28 A 1 ATOM 219 C CB . GLU A 0 28 . -30.085 -4.589 31.853 1.00 96.80 28 A 1 ATOM 220 O O . GLU A 0 28 . -27.795 -5.677 29.592 1.00 96.80 28 A 1 ATOM 221 C CG . GLU A 0 28 . -30.064 -3.426 30.849 1.00 96.80 28 A 1 ATOM 222 C CD . GLU A 0 28 . -30.641 -2.122 31.427 1.00 96.80 28 A 1 ATOM 223 O OE1 . GLU A 0 28 . -31.027 -1.257 30.609 1.00 96.80 28 A 1 ATOM 224 O OE2 . GLU A 0 28 . -30.674 -1.973 32.673 1.00 96.80 28 A 1 ATOM 225 N N . VAL A 0 29 . -27.093 -5.569 31.712 1.00 96.27 29 A 1 ATOM 226 C CA . VAL A 0 29 . -25.676 -5.420 31.350 1.00 96.27 29 A 1 ATOM 227 C C . VAL A 0 29 . -25.147 -6.670 30.644 1.00 96.27 29 A 1 ATOM 228 C CB . VAL A 0 29 . -24.826 -5.073 32.586 1.00 96.27 29 A 1 ATOM 229 O O . VAL A 0 29 . -24.382 -6.547 29.688 1.00 96.27 29 A 1 ATOM 230 C CG1 . VAL A 0 29 . -23.320 -5.056 32.277 1.00 96.27 29 A 1 ATOM 231 C CG2 . VAL A 0 29 . -25.183 -3.677 33.115 1.00 96.27 29 A 1 ATOM 232 N N . VAL A 0 30 . -25.556 -7.869 31.068 1.00 97.22 30 A 1 ATOM 233 C CA . VAL A 0 30 . -25.206 -9.127 30.390 1.00 97.22 30 A 1 ATOM 234 C C . VAL A 0 30 . -25.748 -9.134 28.963 1.00 97.22 30 A 1 ATOM 235 C CB . VAL A 0 30 . -25.700 -10.348 31.193 1.00 97.22 30 A 1 ATOM 236 O O . VAL A 0 30 . -25.011 -9.495 28.046 1.00 97.22 30 A 1 ATOM 237 C CG1 . VAL A 0 30 . -25.636 -11.661 30.396 1.00 97.22 30 A 1 ATOM 238 C CG2 . VAL A 0 30 . -24.834 -10.551 32.444 1.00 97.22 30 A 1 ATOM 239 N N . ASP A 0 31 . -26.985 -8.690 28.751 1.00 97.24 31 A 1 ATOM 240 C CA . ASP A 0 31 . -27.586 -8.603 27.420 1.00 97.24 31 A 1 ATOM 241 C C . ASP A 0 31 . -26.854 -7.577 26.535 1.00 97.24 31 A 1 ATOM 242 C CB . ASP A 0 31 . -29.089 -8.301 27.545 1.00 97.24 31 A 1 ATOM 243 O O . ASP A 0 31 . -26.525 -7.879 25.385 1.00 97.24 31 A 1 ATOM 244 C CG . ASP A 0 31 . -29.905 -9.473 28.120 1.00 97.24 31 A 1 ATOM 245 O OD1 . ASP A 0 31 . -29.484 -10.646 27.933 1.00 97.24 31 A 1 ATOM 246 O OD2 . ASP A 0 31 . -30.987 -9.199 28.686 1.00 97.24 31 A 1 ATOM 247 N N . ILE A 0 32 . -26.483 -6.411 27.080 1.00 97.41 32 A 1 ATOM 248 C CA . ILE A 0 32 . -25.640 -5.420 26.384 1.00 97.41 32 A 1 ATOM 249 C C . ILE A 0 32 . -24.281 -6.026 26.013 1.00 97.41 32 A 1 ATOM 250 C CB . ILE A 0 32 . -25.461 -4.149 27.251 1.00 97.41 32 A 1 ATOM 251 O O . ILE A 0 32 . -23.793 -5.843 24.895 1.00 97.41 32 A 1 ATOM 252 C CG1 . ILE A 0 32 . -26.798 -3.385 27.371 1.00 97.41 32 A 1 ATOM 253 C CG2 . ILE A 0 32 . -24.377 -3.216 26.669 1.00 97.41 32 A 1 ATOM 254 C CD1 . ILE A 0 32 . -26.804 -2.314 28.470 1.00 97.41 32 A 1 ATOM 255 N N . MET A 0 33 . -23.656 -6.758 26.935 1.00 97.83 33 A 1 ATOM 256 C CA . MET A 0 33 . -22.351 -7.367 26.701 1.00 97.83 33 A 1 ATOM 257 C C . MET A 0 33 . -22.407 -8.494 25.673 1.00 97.83 33 A 1 ATOM 258 C CB . MET A 0 33 . -21.718 -7.835 28.016 1.00 97.83 33 A 1 ATOM 259 O O . MET A 0 33 . -21.462 -8.612 24.901 1.00 97.83 33 A 1 ATOM 260 C CG . MET A 0 33 . -21.183 -6.653 28.837 1.00 97.83 33 A 1 ATOM 261 S SD . MET A 0 33 . -19.918 -5.621 28.026 1.00 97.83 33 A 1 ATOM 262 C CE . MET A 0 33 . -18.567 -6.818 27.846 1.00 97.83 33 A 1 ATOM 263 N N . ARG A 0 34 . -23.502 -9.260 25.580 1.00 98.11 34 A 1 ATOM 264 C CA . ARG A 0 34 . -23.697 -10.227 24.483 1.00 98.11 34 A 1 ATOM 265 C C . ARG A 0 34 . -23.667 -9.533 23.125 1.00 98.11 34 A 1 ATOM 266 C CB . ARG A 0 34 . -25.017 -10.987 24.645 1.00 98.11 34 A 1 ATOM 267 O O . ARG A 0 34 . -22.882 -9.914 22.265 1.00 98.11 34 A 1 ATOM 268 C CG . ARG A 0 34 . -24.963 -12.033 25.761 1.00 98.11 34 A 1 ATOM 269 C CD . ARG A 0 34 . -26.348 -12.667 25.891 1.00 98.11 34 A 1 ATOM 270 N NE . ARG A 0 34 . -26.452 -13.516 27.088 1.00 98.11 34 A 1 ATOM 271 N NH1 . ARG A 0 34 . -28.706 -13.890 26.918 1.00 98.11 34 A 1 ATOM 272 N NH2 . ARG A 0 34 . -27.586 -14.702 28.667 1.00 98.11 34 A 1 ATOM 273 C CZ . ARG A 0 34 . -27.576 -14.035 27.548 1.00 98.11 34 A 1 ATOM 274 N N . VAL A 0 35 . -24.422 -8.444 22.977 1.00 97.96 35 A 1 ATOM 275 C CA . VAL A 0 35 . -24.420 -7.644 21.742 1.00 97.96 35 A 1 ATOM 276 C C . VAL A 0 35 . -23.032 -7.060 21.456 1.00 97.96 35 A 1 ATOM 277 C CB . VAL A 0 35 . -25.472 -6.522 21.834 1.00 97.96 35 A 1 ATOM 278 O O . VAL A 0 35 . -22.606 -6.988 20.305 1.00 97.96 35 A 1 ATOM 279 C CG1 . VAL A 0 35 . -25.442 -5.594 20.612 1.00 97.96 35 A 1 ATOM 280 C CG2 . VAL A 0 35 . -26.889 -7.096 21.946 1.00 97.96 35 A 1 ATOM 281 N N . ASN A 0 36 . -22.304 -6.629 22.487 1.00 97.72 36 A 1 ATOM 282 C CA . ASN A 0 36 . -20.941 -6.126 22.317 1.00 97.72 36 A 1 ATOM 283 C C . ASN A 0 36 . -19.956 -7.230 21.913 1.00 97.72 36 A 1 ATOM 284 C CB . ASN A 0 36 . -20.483 -5.413 23.593 1.00 97.72 36 A 1 ATOM 285 O O . ASN A 0 36 . -19.055 -6.947 21.126 1.00 97.72 36 A 1 ATOM 286 C CG . ASN A 0 36 . -21.201 -4.100 23.846 1.00 97.72 36 A 1 ATOM 287 N ND2 . ASN A 0 36 . -21.059 -3.570 25.038 1.00 97.72 36 A 1 ATOM 288 O OD1 . ASN A 0 36 . -21.841 -3.509 22.984 1.00 97.72 36 A 1 ATOM 289 N N . VAL A 0 37 . -20.133 -8.461 22.406 1.00 98.51 37 A 1 ATOM 290 C CA . VAL A 0 37 . -19.354 -9.632 21.979 1.00 98.51 37 A 1 ATOM 291 C C . VAL A 0 37 . -19.574 -9.898 20.486 1.00 98.51 37 A 1 ATOM 292 C CB . VAL A 0 37 . -19.629 -10.871 22.850 1.00 98.51 37 A 1 ATOM 293 O O . VAL A 0 37 . -18.606 -10.010 19.739 1.00 98.51 37 A 1 ATOM 294 C CG1 . VAL A 0 37 . -19.033 -12.150 22.247 1.00 98.51 37 A 1 ATOM 295 C CG2 . VAL A 0 37 . -18.983 -10.694 24.234 1.00 98.51 37 A 1 ATOM 296 N N . ASP A 0 38 . -20.817 -9.883 20.010 1.00 98.22 38 A 1 ATOM 297 C CA . ASP A 0 38 . -21.099 -10.055 18.578 1.00 98.22 38 A 1 ATOM 298 C C . ASP A 0 38 . -20.461 -8.935 17.738 1.00 98.22 38 A 1 ATOM 299 C CB . ASP A 0 38 . -22.617 -10.091 18.348 1.00 98.22 38 A 1 ATOM 300 O O . ASP A 0 38 . -19.834 -9.180 16.705 1.00 98.22 38 A 1 ATOM 301 C CG . ASP A 0 38 . -23.314 -11.277 19.021 1.00 98.22 38 A 1 ATOM 302 O OD1 . ASP A 0 38 . -22.656 -12.324 19.214 1.00 98.22 38 A 1 ATOM 303 O OD2 . ASP A 0 38 . -24.517 -11.116 19.329 1.00 98.22 38 A 1 ATOM 304 N N . LYS A 0 39 . -20.544 -7.688 18.220 1.00 98.53 39 A 1 ATOM 305 C CA . LYS A 0 39 . -19.924 -6.528 17.561 1.00 98.53 39 A 1 ATOM 306 C C . LYS A 0 39 . -18.398 -6.599 17.532 1.00 98.53 39 A 1 ATOM 307 C CB . LYS A 0 39 . -20.357 -5.232 18.251 1.00 98.53 39 A 1 ATOM 308 O O . LYS A 0 39 . -17.807 -6.174 16.542 1.00 98.53 39 A 1 ATOM 309 C CG . LYS A 0 39 . -21.806 -4.849 17.936 1.00 98.53 39 A 1 ATOM 310 C CD . LYS A 0 39 . -22.209 -3.664 18.816 1.00 98.53 39 A 1 ATOM 311 C CE . LYS A 0 39 . -23.656 -3.264 18.535 1.00 98.53 39 A 1 ATOM 312 N NZ . LYS A 0 39 . -24.109 -2.244 19.510 1.00 98.53 39 A 1 ATOM 313 N N . VAL A 0 40 . -17.743 -7.074 18.595 1.00 98.33 40 A 1 ATOM 314 C CA . VAL A 0 40 . -16.275 -7.190 18.608 1.00 98.33 40 A 1 ATOM 315 C C . VAL A 0 40 . -15.801 -8.325 17.705 1.00 98.33 40 A 1 ATOM 316 C CB . VAL A 0 40 . -15.674 -7.265 20.026 1.00 98.33 40 A 1 ATOM 317 O O . VAL A 0 40 . -14.779 -8.154 17.051 1.00 98.33 40 A 1 ATOM 318 C CG1 . VAL A 0 40 . -15.977 -8.560 20.762 1.00 98.33 40 A 1 ATOM 319 C CG2 . VAL A 0 40 . -14.154 -7.094 20.016 1.00 98.33 40 A 1 ATOM 320 N N . LEU A 0 41 . -16.561 -9.417 17.582 1.00 98.28 41 A 1 ATOM 321 C CA . LEU A 0 41 . -16.263 -10.491 16.628 1.00 98.28 41 A 1 ATOM 322 C C . LEU A 0 41 . -16.396 -10.014 15.175 1.00 98.28 41 A 1 ATOM 323 C CB . LEU A 0 41 . -17.194 -11.685 16.897 1.00 98.28 41 A 1 ATOM 324 O O . LEU A 0 41 . -15.525 -10.276 14.350 1.00 98.28 41 A 1 ATOM 325 C CG . LEU A 0 41 . -16.916 -12.432 18.213 1.00 98.28 41 A 1 ATOM 326 C CD1 . LEU A 0 41 . -18.006 -13.480 18.441 1.00 98.28 41 A 1 ATOM 327 C CD2 . LEU A 0 41 . -15.559 -13.140 18.202 1.00 98.28 41 A 1 ATOM 328 N N . GLU A 0 42 . -17.440 -9.246 14.865 1.00 98.47 42 A 1 ATOM 329 C CA . GLU A 0 42 . -17.579 -8.639 13.538 1.00 98.47 42 A 1 ATOM 330 C C . GLU A 0 42 . -16.465 -7.612 13.273 1.00 98.47 42 A 1 ATOM 331 C CB . GLU A 0 42 . -18.978 -8.017 13.428 1.00 98.47 42 A 1 ATOM 332 O O . GLU A 0 42 . -15.911 -7.537 12.175 1.00 98.47 42 A 1 ATOM 333 C CG . GLU A 0 42 . -19.290 -7.420 12.049 1.00 98.47 42 A 1 ATOM 334 C CD . GLU A 0 42 . -19.089 -8.399 10.878 1.00 98.47 42 A 1 ATOM 335 O OE1 . GLU A 0 42 . -18.709 -7.908 9.791 1.00 98.47 42 A 1 ATOM 336 O OE2 . GLU A 0 42 . -19.305 -9.620 11.055 1.00 98.47 42 A 1 ATOM 337 N N . ARG A 0 43 . -16.072 -6.835 14.289 1.00 98.49 43 A 1 ATOM 338 C CA . ARG A 0 43 . -14.926 -5.925 14.185 1.00 98.49 43 A 1 ATOM 339 C C . ARG A 0 43 . -13.625 -6.680 13.915 1.00 98.49 43 A 1 ATOM 340 C CB . ARG A 0 43 . -14.829 -5.064 15.447 1.00 98.49 43 A 1 ATOM 341 O O . ARG A 0 43 . -12.846 -6.205 13.098 1.00 98.49 43 A 1 ATOM 342 C CG . ARG A 0 43 . -13.654 -4.083 15.368 1.00 98.49 43 A 1 ATOM 343 C CD . ARG A 0 43 . -13.593 -3.231 16.632 1.00 98.49 43 A 1 ATOM 344 N NE . ARG A 0 43 . -12.419 -2.340 16.591 1.00 98.49 43 A 1 ATOM 345 N NH1 . ARG A 0 43 . -13.397 -0.438 17.427 1.00 98.49 43 A 1 ATOM 346 N NH2 . ARG A 0 43 . -11.244 -0.411 16.836 1.00 98.49 43 A 1 ATOM 347 C CZ . ARG A 0 43 . -12.361 -1.072 16.950 1.00 98.49 43 A 1 ATOM 348 N N . ASP A 0 44 . -13.390 -7.809 14.575 1.00 98.52 44 A 1 ATOM 349 C CA . ASP A 0 44 . -12.195 -8.638 14.383 1.00 98.52 44 A 1 ATOM 350 C C . ASP A 0 44 . -12.077 -9.115 12.930 1.00 98.52 44 A 1 ATOM 351 C CB . ASP A 0 44 . -12.248 -9.816 15.363 1.00 98.52 44 A 1 ATOM 352 O O . ASP A 0 44 . -11.056 -8.896 12.277 1.00 98.52 44 A 1 ATOM 353 C CG . ASP A 0 44 . -10.960 -10.631 15.312 1.00 98.52 44 A 1 ATOM 354 O OD1 . ASP A 0 44 . -9.943 -10.092 15.801 1.00 98.52 44 A 1 ATOM 355 O OD2 . ASP A 0 44 . -11.018 -11.769 14.799 1.00 98.52 44 A 1 ATOM 356 N N . LYS A 0 45 . -13.180 -9.619 12.364 1.00 98.36 45 A 1 ATOM 357 C CA . LYS A 0 45 . -13.255 -9.995 10.948 1.00 98.36 45 A 1 ATOM 358 C C . LYS A 0 45 . -12.944 -8.824 10.011 1.00 98.36 45 A 1 ATOM 359 C CB . LYS A 0 45 . -14.645 -10.577 10.683 1.00 98.36 45 A 1 ATOM 360 O O . LYS A 0 45 . -12.134 -8.966 9.096 1.00 98.36 45 A 1 ATOM 361 C CG . LYS A 0 45 . -14.781 -11.049 9.234 1.00 98.36 45 A 1 ATOM 362 C CD . LYS A 0 45 . -16.184 -11.601 9.015 1.00 98.36 45 A 1 ATOM 363 C CE . LYS A 0 45 . -16.334 -12.001 7.551 1.00 98.36 45 A 1 ATOM 364 N NZ . LYS A 0 45 . -17.675 -12.576 7.333 1.00 98.36 45 A 1 ATOM 365 N N . ASN A 0 46 . -13.563 -7.667 10.245 1.00 98.49 46 A 1 ATOM 366 C CA . ASN A 0 46 . -13.331 -6.471 9.432 1.00 98.49 46 A 1 ATOM 367 C C . ASN A 0 46 . -11.887 -5.960 9.547 1.00 98.49 46 A 1 ATOM 368 C CB . ASN A 0 46 . -14.337 -5.383 9.841 1.00 98.49 46 A 1 ATOM 369 O O . ASN A 0 46 . -11.327 -5.478 8.564 1.00 98.49 46 A 1 ATOM 370 C CG . ASN A 0 46 . -15.728 -5.679 9.313 1.00 98.49 46 A 1 ATOM 371 N ND2 . ASN A 0 46 . -16.721 -5.777 10.154 1.00 98.49 46 A 1 ATOM 372 O OD1 . ASN A 0 46 . -15.935 -5.834 8.129 1.00 98.49 46 A 1 ATOM 373 N N . LEU A 0 47 . -11.270 -6.068 10.728 1.00 98.67 47 A 1 ATOM 374 C CA . LEU A 0 47 . -9.869 -5.704 10.934 1.00 98.67 47 A 1 ATOM 375 C C . LEU A 0 47 . -8.922 -6.672 10.229 1.00 98.67 47 A 1 ATOM 376 C CB . LEU A 0 47 . -9.546 -5.629 12.434 1.00 98.67 47 A 1 ATOM 377 O O . LEU A 0 47 . -7.982 -6.205 9.603 1.00 98.67 47 A 1 ATOM 378 C CG . LEU A 0 47 . -10.096 -4.384 13.148 1.00 98.67 47 A 1 ATOM 379 C CD1 . LEU A 0 47 . -9.793 -4.486 14.645 1.00 98.67 47 A 1 ATOM 380 C CD2 . LEU A 0 47 . -9.473 -3.082 12.634 1.00 98.67 47 A 1 ATOM 381 N N . SER A 0 48 . -9.185 -7.979 10.263 1.00 98.49 48 A 1 ATOM 382 C CA . SER A 0 48 . -8.388 -8.966 9.526 1.00 98.49 48 A 1 ATOM 383 C C . SER A 0 48 . -8.459 -8.742 8.010 1.00 98.49 48 A 1 ATOM 384 C CB . SER A 0 48 . -8.866 -10.374 9.890 1.00 98.49 48 A 1 ATOM 385 O O . SER A 0 48 . -7.440 -8.799 7.321 1.00 98.49 48 A 1 ATOM 386 O OG . SER A 0 48 . -8.116 -11.349 9.191 1.00 98.49 48 A 1 ATOM 387 N N . GLU A 0 49 . -9.640 -8.410 7.480 1.00 98.52 49 A 1 ATOM 388 C CA . GLU A 0 49 . -9.774 -8.035 6.071 1.00 98.52 49 A 1 ATOM 389 C C . GLU A 0 49 . -9.035 -6.725 5.756 1.00 98.52 49 A 1 ATOM 390 C CB . GLU A 0 49 . -11.262 -7.937 5.699 1.00 98.52 49 A 1 ATOM 391 O O . GLU A 0 49 . -8.361 -6.621 4.727 1.00 98.52 49 A 1 ATOM 392 C CG . GLU A 0 49 . -11.416 -7.625 4.203 1.00 98.52 49 A 1 ATOM 393 C CD . GLU A 0 49 . -12.859 -7.567 3.698 1.00 98.52 49 A 1 ATOM 394 O OE1 . GLU A 0 49 . -12.990 -7.338 2.470 1.00 98.52 49 A 1 ATOM 395 O OE2 . GLU A 0 49 . -13.813 -7.698 4.488 1.00 98.52 49 A 1 ATOM 396 N N . LEU A 0 50 . -9.150 -5.720 6.629 1.00 98.58 50 A 1 ATOM 397 C CA . LEU A 0 50 . -8.456 -4.445 6.467 1.00 98.58 50 A 1 ATOM 398 C C . LEU A 0 50 . -6.933 -4.610 6.514 1.00 98.58 50 A 1 ATOM 399 C CB . LEU A 0 50 . -8.951 -3.457 7.535 1.00 98.58 50 A 1 ATOM 400 O O . LEU A 0 50 . -6.252 -3.977 5.715 1.00 98.58 50 A 1 ATOM 401 C CG . LEU A 0 50 . -8.302 -2.063 7.447 1.00 98.58 50 A 1 ATOM 402 C CD1 . LEU A 0 50 . -8.635 -1.353 6.130 1.00 98.58 50 A 1 ATOM 403 C CD2 . LEU A 0 50 . -8.806 -1.193 8.599 1.00 98.58 50 A 1 ATOM 404 N N . ASP A 0 51 . -6.418 -5.459 7.400 1.00 98.41 51 A 1 ATOM 405 C CA . ASP A 0 51 . -4.996 -5.783 7.531 1.00 98.41 51 A 1 ATOM 406 C C . ASP A 0 51 . -4.462 -6.419 6.240 1.00 98.41 51 A 1 ATOM 407 C CB . ASP A 0 51 . -4.831 -6.704 8.748 1.00 98.41 51 A 1 ATOM 408 O O . ASP A 0 51 . -3.538 -5.896 5.619 1.00 98.41 51 A 1 ATOM 409 C CG . ASP A 0 51 . -3.374 -6.888 9.162 1.00 98.41 51 A 1 ATOM 410 O OD1 . ASP A 0 51 . -2.750 -5.850 9.481 1.00 98.41 51 A 1 ATOM 411 O OD2 . ASP A 0 51 . -2.951 -8.061 9.247 1.00 98.41 51 A 1 ATOM 412 N N . GLY A 0 52 . -5.160 -7.433 5.713 1.00 98.21 52 A 1 ATOM 413 C CA . GLY A 0 52 . -4.807 -8.031 4.422 1.00 98.21 52 A 1 ATOM 414 C C . GLY A 0 52 . -4.870 -7.038 3.251 1.00 98.21 52 A 1 ATOM 415 O O . GLY A 0 52 . -4.030 -7.067 2.347 1.00 98.21 52 A 1 ATOM 416 N N . ARG A 0 53 . -5.839 -6.111 3.257 1.00 98.49 53 A 1 ATOM 417 C CA . ARG A 0 53 . -5.910 -5.021 2.266 1.00 98.49 53 A 1 ATOM 418 C C . ARG A 0 53 . -4.772 -4.011 2.438 1.00 98.49 53 A 1 ATOM 419 C CB . ARG A 0 53 . -7.266 -4.307 2.353 1.00 98.49 53 A 1 ATOM 420 O O . ARG A 0 53 . -4.283 -3.495 1.432 1.00 98.49 53 A 1 ATOM 421 C CG . ARG A 0 53 . -8.435 -5.131 1.792 1.00 98.49 53 A 1 ATOM 422 C CD . ARG A 0 53 . -9.739 -4.370 2.061 1.00 98.49 53 A 1 ATOM 423 N NE . ARG A 0 53 . -10.934 -5.069 1.547 1.00 98.49 53 A 1 ATOM 424 N NH1 . ARG A 0 53 . -12.311 -3.238 1.408 1.00 98.49 53 A 1 ATOM 425 N NH2 . ARG A 0 53 . -13.108 -5.239 0.887 1.00 98.49 53 A 1 ATOM 426 C CZ . ARG A 0 53 . -12.104 -4.518 1.276 1.00 98.49 53 A 1 ATOM 427 N N . ALA A 0 54 . -4.362 -3.717 3.669 1.00 98.73 54 A 1 ATOM 428 C CA . ALA A 0 54 . -3.266 -2.804 3.971 1.00 98.73 54 A 1 ATOM 429 C C . ALA A 0 54 . -1.923 -3.375 3.496 1.00 98.73 54 A 1 ATOM 430 C CB . ALA A 0 54 . -3.263 -2.490 5.472 1.00 98.73 54 A 1 ATOM 431 O O . ALA A 0 54 . -1.175 -2.660 2.828 1.00 98.73 54 A 1 ATOM 432 N N . ASP A 0 55 . -1.674 -4.667 3.717 1.00 98.52 55 A 1 ATOM 433 C CA . ASP A 0 55 . -0.499 -5.373 3.197 1.00 98.52 55 A 1 ATOM 434 C C . ASP A 0 55 . -0.444 -5.336 1.665 1.00 98.52 55 A 1 ATOM 435 C CB . ASP A 0 55 . -0.533 -6.838 3.660 1.00 98.52 55 A 1 ATOM 436 O O . ASP A 0 55 . 0.577 -4.978 1.065 1.00 98.52 55 A 1 ATOM 437 C CG . ASP A 0 55 . -0.004 -7.068 5.075 1.00 98.52 55 A 1 ATOM 438 O OD1 . ASP A 0 55 . 0.628 -6.137 5.623 1.00 98.52 55 A 1 ATOM 439 O OD2 . ASP A 0 55 . -0.126 -8.230 5.516 1.00 98.52 55 A 1 ATOM 440 N N . ALA A 0 56 . -1.567 -5.646 1.008 1.00 98.45 56 A 1 ATOM 441 C CA . ALA A 0 56 . -1.667 -5.585 -0.448 1.00 98.45 56 A 1 ATOM 442 C C . ALA A 0 56 . -1.428 -4.160 -0.980 1.00 98.45 56 A 1 ATOM 443 C CB . ALA A 0 56 . -3.040 -6.121 -0.865 1.00 98.45 56 A 1 ATOM 444 O O . ALA A 0 56 . -0.725 -3.973 -1.980 1.00 98.45 56 A 1 ATOM 445 N N . LEU A 0 57 . -1.973 -3.146 -0.301 1.00 98.56 57 A 1 ATOM 446 C CA . LEU A 0 57 . -1.770 -1.742 -0.646 1.00 98.56 57 A 1 ATOM 447 C C . LEU A 0 57 . -0.309 -1.324 -0.465 1.00 98.56 57 A 1 ATOM 448 C CB . LEU A 0 57 . -2.714 -0.873 0.202 1.00 98.56 57 A 1 ATOM 449 O O . LEU A 0 57 . 0.239 -0.662 -1.345 1.00 98.56 57 A 1 ATOM 450 C CG . LEU A 0 57 . -2.570 0.640 -0.049 1.00 98.56 57 A 1 ATOM 451 C CD1 . LEU A 0 57 . -2.929 1.024 -1.487 1.00 98.56 57 A 1 ATOM 452 C CD2 . LEU A 0 57 . -3.492 1.408 0.897 1.00 98.56 57 A 1 ATOM 453 N N . GLN A 0 58 . 0.337 -1.720 0.631 1.00 98.66 58 A 1 ATOM 454 C CA . GLN A 0 58 . 1.741 -1.419 0.895 1.00 98.66 58 A 1 ATOM 455 C C . GLN A 0 58 . 2.651 -2.048 -0.166 1.00 98.66 58 A 1 ATOM 456 C CB . GLN A 0 58 . 2.096 -1.902 2.308 1.00 98.66 58 A 1 ATOM 457 O O . GLN A 0 58 . 3.528 -1.371 -0.711 1.00 98.66 58 A 1 ATOM 458 C CG . GLN A 0 58 . 3.572 -1.639 2.648 1.00 98.66 58 A 1 ATOM 459 C CD . GLN A 0 58 . 3.928 -2.015 4.081 1.00 98.66 58 A 1 ATOM 460 N NE2 . GLN A 0 58 . 5.195 -2.138 4.406 1.00 98.66 58 A 1 ATOM 461 O OE1 . GLN A 0 58 . 3.099 -2.168 4.952 1.00 98.66 58 A 1 ATOM 462 N N . ALA A 0 59 . 2.417 -3.316 -0.511 1.00 98.33 59 A 1 ATOM 463 C CA . ALA A 0 59 . 3.153 -3.997 -1.570 1.00 98.33 59 A 1 ATOM 464 C C . ALA A 0 59 . 2.949 -3.310 -2.933 1.00 98.33 59 A 1 ATOM 465 C CB . ALA A 0 59 . 2.711 -5.464 -1.595 1.00 98.33 59 A 1 ATOM 466 O O . ALA A 0 59 . 3.918 -3.037 -3.650 1.00 98.33 59 A 1 ATOM 467 N N . GLY A 0 60 . 1.701 -2.964 -3.268 1.00 98.38 60 A 1 ATOM 468 C CA . GLY A 0 60 . 1.360 -2.225 -4.484 1.00 98.38 60 A 1 ATOM 469 C C . GLY A 0 60 . 2.014 -0.841 -4.541 1.00 98.38 60 A 1 ATOM 470 O O . GLY A 0 60 . 2.581 -0.465 -5.568 1.00 98.38 60 A 1 ATOM 471 N N . ALA A 0 61 . 2.007 -0.102 -3.430 1.00 98.65 61 A 1 ATOM 472 C CA . ALA A 0 61 . 2.629 1.213 -3.312 1.00 98.65 61 A 1 ATOM 473 C C . ALA A 0 61 . 4.154 1.143 -3.476 1.00 98.65 61 A 1 ATOM 474 C CB . ALA A 0 61 . 2.236 1.829 -1.964 1.00 98.65 61 A 1 ATOM 475 O O . ALA A 0 61 . 4.723 1.937 -4.226 1.00 98.65 61 A 1 ATOM 476 N N . SER A 0 62 . 4.812 0.157 -2.858 1.00 98.52 62 A 1 ATOM 477 C CA . SER A 0 62 . 6.257 -0.061 -3.008 1.00 98.52 62 A 1 ATOM 478 C C . SER A 0 62 . 6.638 -0.399 -4.456 1.00 98.52 62 A 1 ATOM 479 C CB . SER A 0 62 . 6.701 -1.183 -2.064 1.00 98.52 62 A 1 ATOM 480 O O . SER A 0 62 . 7.578 0.170 -5.022 1.00 98.52 62 A 1 ATOM 481 O OG . SER A 0 62 . 8.104 -1.334 -2.129 1.00 98.52 62 A 1 ATOM 482 N N . GLN A 0 63 . 5.863 -1.265 -5.117 1.00 98.49 63 A 1 ATOM 483 C CA . GLN A 0 63 . 6.077 -1.588 -6.529 1.00 98.49 63 A 1 ATOM 484 C C . GLN A 0 63 . 5.852 -0.372 -7.441 1.00 98.49 63 A 1 ATOM 485 C CB . GLN A 0 63 . 5.164 -2.757 -6.920 1.00 98.49 63 A 1 ATOM 486 O O . GLN A 0 63 . 6.609 -0.161 -8.401 1.00 98.49 63 A 1 ATOM 487 C CG . GLN A 0 63 . 5.434 -3.212 -8.361 1.00 98.49 63 A 1 ATOM 488 C CD . GLN A 0 63 . 4.603 -4.429 -8.733 1.00 98.49 63 A 1 ATOM 489 N NE2 . GLN A 0 63 . 5.195 -5.596 -8.855 1.00 98.49 63 A 1 ATOM 490 O OE1 . GLN A 0 63 . 3.408 -4.351 -8.941 1.00 98.49 63 A 1 ATOM 491 N N . PHE A 0 64 . 4.834 0.438 -7.147 1.00 98.20 64 A 1 ATOM 492 C CA . PHE A 0 64 . 4.564 1.679 -7.862 1.00 98.20 64 A 1 ATOM 493 C C . PHE A 0 64 . 5.710 2.681 -7.696 1.00 98.20 64 A 1 ATOM 494 C CB . PHE A 0 64 . 3.231 2.273 -7.397 1.00 98.20 64 A 1 ATOM 495 O O . PHE A 0 64 . 6.196 3.207 -8.696 1.00 98.20 64 A 1 ATOM 496 C CG . PHE A 0 64 . 2.913 3.591 -8.073 1.00 98.20 64 A 1 ATOM 497 C CD1 . PHE A 0 64 . 3.187 4.807 -7.420 1.00 98.20 64 A 1 ATOM 498 C CD2 . PHE A 0 64 . 2.376 3.600 -9.373 1.00 98.20 64 A 1 ATOM 499 C CE1 . PHE A 0 64 . 2.918 6.028 -8.063 1.00 98.20 64 A 1 ATOM 500 C CE2 . PHE A 0 64 . 2.107 4.821 -10.017 1.00 98.20 64 A 1 ATOM 501 C CZ . PHE A 0 64 . 2.376 6.035 -9.360 1.00 98.20 64 A 1 ATOM 502 N N . GLU A 0 65 . 6.207 2.892 -6.475 1.00 98.55 65 A 1 ATOM 503 C CA . GLU A 0 65 . 7.346 3.770 -6.193 1.00 98.55 65 A 1 ATOM 504 C C . GLU A 0 65 . 8.595 3.337 -6.974 1.00 98.55 65 A 1 ATOM 505 C CB . GLU A 0 65 . 7.628 3.769 -4.684 1.00 98.55 65 A 1 ATOM 506 O O . GLU A 0 65 . 9.214 4.142 -7.682 1.00 98.55 65 A 1 ATOM 507 C CG . GLU A 0 65 . 8.733 4.777 -4.330 1.00 98.55 65 A 1 ATOM 508 C CD . GLU A 0 65 . 9.234 4.676 -2.885 1.00 98.55 65 A 1 ATOM 509 O OE1 . GLU A 0 65 . 10.011 5.587 -2.519 1.00 98.55 65 A 1 ATOM 510 O OE2 . GLU A 0 65 . 8.911 3.679 -2.205 1.00 98.55 65 A 1 ATOM 511 N N . ALA A 0 66 . 8.937 2.046 -6.926 1.00 98.52 66 A 1 ATOM 512 C CA . ALA A 0 66 . 10.075 1.499 -7.659 1.00 98.52 66 A 1 ATOM 513 C C . ALA A 0 66 . 9.934 1.716 -9.179 1.00 98.52 66 A 1 ATOM 514 C CB . ALA A 0 66 . 10.200 0.013 -7.307 1.00 98.52 66 A 1 ATOM 515 O O . ALA A 0 66 . 10.887 2.124 -9.862 1.00 98.52 66 A 1 ATOM 516 N N . SER A 0 67 . 8.729 1.492 -9.710 1.00 98.16 67 A 1 ATOM 517 C CA . SER A 0 67 . 8.401 1.675 -11.127 1.00 98.16 67 A 1 ATOM 518 C C . SER A 0 67 . 8.450 3.147 -11.543 1.00 98.16 67 A 1 ATOM 519 C CB . SER A 0 67 . 7.022 1.083 -11.428 1.00 98.16 67 A 1 ATOM 520 O O . SER A 0 67 . 9.065 3.475 -12.562 1.00 98.16 67 A 1 ATOM 521 O OG . SER A 0 67 . 7.045 -0.303 -11.165 1.00 98.16 67 A 1 ATOM 522 N N . ALA A 0 68 . 7.891 4.048 -10.735 1.00 98.49 68 A 1 ATOM 523 C CA . ALA A 0 68 . 7.939 5.492 -10.936 1.00 98.49 68 A 1 ATOM 524 C C . ALA A 0 68 . 9.385 6.009 -10.903 1.00 98.49 68 A 1 ATOM 525 C CB . ALA A 0 68 . 7.072 6.161 -9.862 1.00 98.49 68 A 1 ATOM 526 O O . ALA A 0 68 . 9.796 6.774 -11.779 1.00 98.49 68 A 1 ATOM 527 N N . GLY A 0 69 . 10.207 5.517 -9.970 1.00 98.42 69 A 1 ATOM 528 C CA . GLY A 0 69 . 11.636 5.817 -9.908 1.00 98.42 69 A 1 ATOM 529 C C . GLY A 0 69 . 12.388 5.365 -11.164 1.00 98.42 69 A 1 ATOM 530 O O . GLY A 0 69 . 13.184 6.122 -11.730 1.00 98.42 69 A 1 ATOM 531 N N . LYS A 0 70 . 12.109 4.153 -11.662 1.00 98.24 70 A 1 ATOM 532 C CA . LYS A 0 70 . 12.679 3.645 -12.923 1.00 98.24 70 A 1 ATOM 533 C C . LYS A 0 70 . 12.236 4.486 -14.122 1.00 98.24 70 A 1 ATOM 534 C CB . LYS A 0 70 . 12.294 2.165 -13.083 1.00 98.24 70 A 1 ATOM 535 O O . LYS A 0 70 . 13.064 4.804 -14.979 1.00 98.24 70 A 1 ATOM 536 C CG . LYS A 0 70 . 12.965 1.484 -14.289 1.00 98.24 70 A 1 ATOM 537 C CD . LYS A 0 70 . 12.566 -0.000 -14.344 1.00 98.24 70 A 1 ATOM 538 C CE . LYS A 0 70 . 13.238 -0.747 -15.506 1.00 98.24 70 A 1 ATOM 539 N NZ . LYS A 0 70 . 12.874 -2.191 -15.502 1.00 98.24 70 A 1 ATOM 540 N N . LEU A 0 71 . 10.964 4.879 -14.171 1.00 98.45 71 A 1 ATOM 541 C CA . LEU A 0 71 . 10.407 5.720 -15.227 1.00 98.45 71 A 1 ATOM 542 C C . LEU A 0 71 . 11.059 7.108 -15.236 1.00 98.45 71 A 1 ATOM 543 C CB . LEU A 0 71 . 8.882 5.802 -15.040 1.00 98.45 71 A 1 ATOM 544 O O . LEU A 0 71 . 11.551 7.543 -16.279 1.00 98.45 71 A 1 ATOM 545 C CG . LEU A 0 71 . 8.141 6.436 -16.229 1.00 98.45 71 A 1 ATOM 546 C CD1 . LEU A 0 71 . 8.312 5.579 -17.489 1.00 98.45 71 A 1 ATOM 547 C CD2 . LEU A 0 71 . 6.654 6.546 -15.910 1.00 98.45 71 A 1 ATOM 548 N N . LYS A 0 72 . 11.165 7.752 -14.068 1.00 98.40 72 A 1 ATOM 549 C CA . LYS A 0 72 . 11.859 9.034 -13.891 1.00 98.40 72 A 1 ATOM 550 C C . LYS A 0 72 . 13.293 8.957 -14.406 1.00 98.40 72 A 1 ATOM 551 C CB . LYS A 0 72 . 11.798 9.443 -12.408 1.00 98.40 72 A 1 ATOM 552 O O . LYS A 0 72 . 13.688 9.784 -15.222 1.00 98.40 72 A 1 ATOM 553 C CG . LYS A 0 72 . 12.469 10.801 -12.134 1.00 98.40 72 A 1 ATOM 554 C CD . LYS A 0 72 . 12.337 11.192 -10.653 1.00 98.40 72 A 1 ATOM 555 C CE . LYS A 0 72 . 13.033 12.532 -10.369 1.00 98.40 72 A 1 ATOM 556 N NZ . LYS A 0 72 . 12.878 12.947 -8.948 1.00 98.40 72 A 1 ATOM 557 N N . ARG A 0 73 . 14.058 7.931 -14.009 1.00 98.37 73 A 1 ATOM 558 C CA . ARG A 0 73 . 15.438 7.725 -14.489 1.00 98.37 73 A 1 ATOM 559 C C . ARG A 0 73 . 15.504 7.516 -16.003 1.00 98.37 73 A 1 ATOM 560 C CB . ARG A 0 73 . 16.097 6.548 -13.753 1.00 98.37 73 A 1 ATOM 561 O O . ARG A 0 73 . 16.370 8.092 -16.656 1.00 98.37 73 A 1 ATOM 562 C CG . ARG A 0 73 . 16.454 6.897 -12.299 1.00 98.37 73 A 1 ATOM 563 C CD . ARG A 0 73 . 17.252 5.778 -11.612 1.00 98.37 73 A 1 ATOM 564 N NE . ARG A 0 73 . 16.479 4.526 -11.443 1.00 98.37 73 A 1 ATOM 565 N NH1 . ARG A 0 73 . 15.493 5.003 -9.413 1.00 98.37 73 A 1 ATOM 566 N NH2 . ARG A 0 73 . 15.150 3.022 -10.355 1.00 98.37 73 A 1 ATOM 567 C CZ . ARG A 0 73 . 15.713 4.197 -10.412 1.00 98.37 73 A 1 ATOM 568 N N . LYS A 0 74 . 14.587 6.732 -16.580 1.00 98.40 74 A 1 ATOM 569 C CA . LYS A 0 74 . 14.514 6.503 -18.035 1.00 98.40 74 A 1 ATOM 570 C C . LYS A 0 74 . 14.346 7.818 -18.796 1.00 98.40 74 A 1 ATOM 571 C CB . LYS A 0 74 . 13.373 5.515 -18.338 1.00 98.40 74 A 1 ATOM 572 O O . LYS A 0 74 . 15.062 8.049 -19.770 1.00 98.40 74 A 1 ATOM 573 C CG . LYS A 0 74 . 13.211 5.186 -19.833 1.00 98.40 74 A 1 ATOM 574 C CD . LYS A 0 74 . 12.032 4.220 -20.034 1.00 98.40 74 A 1 ATOM 575 C CE . LYS A 0 74 . 11.838 3.843 -21.510 1.00 98.40 74 A 1 ATOM 576 N NZ . LYS A 0 74 . 10.697 2.901 -21.693 1.00 98.40 74 A 1 ATOM 577 N N . PHE A 0 75 . 13.420 8.672 -18.364 1.00 98.07 75 A 1 ATOM 578 C CA . PHE A 0 75 . 13.188 9.963 -19.010 1.00 98.07 75 A 1 ATOM 579 C C . PHE A 0 75 . 14.291 10.978 -18.725 1.00 98.07 75 A 1 ATOM 580 C CB . PHE A 0 75 . 11.807 10.498 -18.637 1.00 98.07 75 A 1 ATOM 581 O O . PHE A 0 75 . 14.683 11.697 -19.638 1.00 98.07 75 A 1 ATOM 582 C CG . PHE A 0 75 . 10.719 9.873 -19.483 1.00 98.07 75 A 1 ATOM 583 C CD1 . PHE A 0 75 . 10.497 10.350 -20.789 1.00 98.07 75 A 1 ATOM 584 C CD2 . PHE A 0 75 . 9.922 8.833 -18.974 1.00 98.07 75 A 1 ATOM 585 C CE1 . PHE A 0 75 . 9.474 9.797 -21.578 1.00 98.07 75 A 1 ATOM 586 C CE2 . PHE A 0 75 . 8.899 8.284 -19.766 1.00 98.07 75 A 1 ATOM 587 C CZ . PHE A 0 75 . 8.673 8.764 -21.065 1.00 98.07 75 A 1 ATOM 588 N N . TRP A 0 76 . 14.869 10.975 -17.524 1.00 98.30 76 A 1 ATOM 589 C CA . TRP A 0 76 . 16.037 11.795 -17.210 1.00 98.30 76 A 1 ATOM 590 C C . TRP A 0 76 . 17.200 11.499 -18.165 1.00 98.30 76 A 1 ATOM 591 C CB . TRP A 0 76 . 16.422 11.580 -15.746 1.00 98.30 76 A 1 ATOM 592 O O . TRP A 0 76 . 17.693 12.404 -18.831 1.00 98.30 76 A 1 ATOM 593 C CG . TRP A 0 76 . 17.558 12.432 -15.293 1.00 98.30 76 A 1 ATOM 594 C CD1 . TRP A 0 76 . 17.477 13.745 -14.980 1.00 98.30 76 A 1 ATOM 595 C CD2 . TRP A 0 76 . 18.963 12.066 -15.131 1.00 98.30 76 A 1 ATOM 596 C CE2 . TRP A 0 76 . 19.678 13.224 -14.703 1.00 98.30 76 A 1 ATOM 597 C CE3 . TRP A 0 76 . 19.703 10.875 -15.296 1.00 98.30 76 A 1 ATOM 598 N NE1 . TRP A 0 76 . 18.725 14.214 -14.628 1.00 98.30 76 A 1 ATOM 599 C CH2 . TRP A 0 76 . 21.762 12.011 -14.610 1.00 98.30 76 A 1 ATOM 600 C CZ2 . TRP A 0 76 . 21.055 13.211 -14.447 1.00 98.30 76 A 1 ATOM 601 C CZ3 . TRP A 0 76 . 21.085 10.853 -15.025 1.00 98.30 76 A 1 ATOM 602 N N . TRP A 0 77 . 17.546 10.222 -18.363 1.00 98.15 77 A 1 ATOM 603 C CA . TRP A 0 77 . 18.586 9.829 -19.317 1.00 98.15 77 A 1 ATOM 604 C C . TRP A 0 77 . 18.244 10.163 -20.770 1.00 98.15 77 A 1 ATOM 605 C CB . TRP A 0 77 . 18.866 8.330 -19.193 1.00 98.15 77 A 1 ATOM 606 O O . TRP A 0 77 . 19.130 10.567 -21.523 1.00 98.15 77 A 1 ATOM 607 C CG . TRP A 0 77 . 19.732 7.961 -18.037 1.00 98.15 77 A 1 ATOM 608 C CD1 . TRP A 0 77 . 19.390 7.155 -17.007 1.00 98.15 77 A 1 ATOM 609 C CD2 . TRP A 0 77 . 21.111 8.373 -17.787 1.00 98.15 77 A 1 ATOM 610 C CE2 . TRP A 0 77 . 21.555 7.738 -16.590 1.00 98.15 77 A 1 ATOM 611 C CE3 . TRP A 0 77 . 22.031 9.213 -18.454 1.00 98.15 77 A 1 ATOM 612 N NE1 . TRP A 0 77 . 20.462 7.027 -16.147 1.00 98.15 77 A 1 ATOM 613 C CH2 . TRP A 0 77 . 23.738 8.760 -16.764 1.00 98.15 77 A 1 ATOM 614 C CZ2 . TRP A 0 77 . 22.851 7.907 -16.086 1.00 98.15 77 A 1 ATOM 615 C CZ3 . TRP A 0 77 . 23.327 9.412 -17.941 1.00 98.15 77 A 1 ATOM 616 N N . LYS A 0 78 . 16.980 9.999 -21.185 1.00 97.86 78 A 1 ATOM 617 C CA . LYS A 0 78 . 16.537 10.418 -22.524 1.00 97.86 78 A 1 ATOM 618 C C . LYS A 0 78 . 16.734 11.921 -22.723 1.00 97.86 78 A 1 ATOM 619 C CB . LYS A 0 78 . 15.068 10.046 -22.763 1.00 97.86 78 A 1 ATOM 620 O O . LYS A 0 78 . 17.309 12.315 -23.733 1.00 97.86 78 A 1 ATOM 621 C CG . LYS A 0 78 . 14.873 8.568 -23.132 1.00 97.86 78 A 1 ATOM 622 C CD . LYS A 0 78 . 13.395 8.325 -23.464 1.00 97.86 78 A 1 ATOM 623 C CE . LYS A 0 78 . 13.164 6.924 -24.038 1.00 97.86 78 A 1 ATOM 624 N NZ . LYS A 0 78 . 11.818 6.834 -24.665 1.00 97.86 78 A 1 ATOM 625 N N . ASN A 0 79 . 16.330 12.730 -21.749 1.00 97.72 79 A 1 ATOM 626 C CA . ASN A 0 79 . 16.456 14.183 -21.802 1.00 97.72 79 A 1 ATOM 627 C C . ASN A 0 79 . 17.926 14.621 -21.788 1.00 97.72 79 A 1 ATOM 628 C CB . ASN A 0 79 . 15.651 14.802 -20.647 1.00 97.72 79 A 1 ATOM 629 O O . ASN A 0 79 . 18.311 15.455 -22.602 1.00 97.72 79 A 1 ATOM 630 C CG . ASN A 0 79 . 14.147 14.636 -20.807 1.00 97.72 79 A 1 ATOM 631 N ND2 . ASN A 0 79 . 13.382 15.031 -19.817 1.00 97.72 79 A 1 ATOM 632 O OD1 . ASN A 0 79 . 13.638 14.165 -21.811 1.00 97.72 79 A 1 ATOM 633 N N . CYS A 0 80 . 18.773 14.008 -20.953 1.00 97.59 80 A 1 ATOM 634 C CA . CYS A 0 80 . 20.215 14.264 -20.952 1.00 97.59 80 A 1 ATOM 635 C C . CYS A 0 80 . 20.855 13.943 -22.312 1.00 97.59 80 A 1 ATOM 636 C CB . CYS A 0 80 . 20.880 13.450 -19.832 1.00 97.59 80 A 1 ATOM 637 O O . CYS A 0 80 . 21.565 14.779 -22.870 1.00 97.59 80 A 1 ATOM 638 S SG . CYS A 0 80 . 20.436 14.125 -18.209 1.00 97.59 80 A 1 ATOM 639 N N . LYS A 0 81 . 20.563 12.767 -22.890 1.00 98.02 81 A 1 ATOM 640 C CA . LYS A 0 81 . 21.076 12.373 -24.215 1.00 98.02 81 A 1 ATOM 641 C C . LYS A 0 81 . 20.597 13.317 -25.317 1.00 98.02 81 A 1 ATOM 642 C CB . LYS A 0 81 . 20.662 10.928 -24.539 1.00 98.02 81 A 1 ATOM 643 O O . LYS A 0 81 . 21.396 13.716 -26.165 1.00 98.02 81 A 1 ATOM 644 C CG . LYS A 0 81 . 21.465 9.895 -23.736 1.00 98.02 81 A 1 ATOM 645 C CD . LYS A 0 81 . 20.989 8.469 -24.049 1.00 98.02 81 A 1 ATOM 646 C CE . LYS A 0 81 . 21.796 7.463 -23.220 1.00 98.02 81 A 1 ATOM 647 N NZ . LYS A 0 81 . 21.457 6.056 -23.553 1.00 98.02 81 A 1 ATOM 648 N N . TYR A 0 82 . 19.319 13.694 -25.294 1.00 98.29 82 A 1 ATOM 649 C CA . TYR A 0 82 . 18.747 14.636 -26.252 1.00 98.29 82 A 1 ATOM 650 C C . TYR A 0 82 . 19.397 16.019 -26.132 1.00 98.29 82 A 1 ATOM 651 C CB . TYR A 0 82 . 17.228 14.695 -26.060 1.00 98.29 82 A 1 ATOM 652 O O . TYR A 0 82 . 19.794 16.598 -27.140 1.00 98.29 82 A 1 ATOM 653 C CG . TYR A 0 82 . 16.518 15.445 -27.166 1.00 98.29 82 A 1 ATOM 654 C CD1 . TYR A 0 82 . 15.930 16.699 -26.916 1.00 98.29 82 A 1 ATOM 655 C CD2 . TYR A 0 82 . 16.436 14.875 -28.451 1.00 98.29 82 A 1 ATOM 656 C CE1 . TYR A 0 82 . 15.268 17.385 -27.953 1.00 98.29 82 A 1 ATOM 657 C CE2 . TYR A 0 82 . 15.803 15.575 -29.495 1.00 98.29 82 A 1 ATOM 658 O OH . TYR A 0 82 . 14.647 17.519 -30.271 1.00 98.29 82 A 1 ATOM 659 C CZ . TYR A 0 82 . 15.232 16.840 -29.252 1.00 98.29 82 A 1 ATOM 660 N N . GLY A 0 83 . 19.625 16.498 -24.905 1.00 98.17 83 A 1 ATOM 661 C CA . GLY A 0 83 . 20.365 17.731 -24.637 1.00 98.17 83 A 1 ATOM 662 C C . GLY A 0 83 . 21.784 17.703 -25.210 1.00 98.17 83 A 1 ATOM 663 O O . GLY A 0 83 . 22.205 18.652 -25.872 1.00 98.17 83 A 1 ATOM 664 N N . SER A 0 84 . 22.524 16.603 -25.040 1.00 98.03 84 A 1 ATOM 665 C CA . SER A 0 84 . 23.854 16.454 -25.649 1.00 98.03 84 A 1 ATOM 666 C C . SER A 0 84 . 23.807 16.424 -27.183 1.00 98.03 84 A 1 ATOM 667 C CB . SER A 0 84 . 24.540 15.179 -25.155 1.00 98.03 84 A 1 ATOM 668 O O . SER A 0 84 . 24.670 17.016 -27.833 1.00 98.03 84 A 1 ATOM 669 O OG . SER A 0 84 . 24.636 15.148 -23.748 1.00 98.03 84 A 1 ATOM 670 N N . PHE A 0 85 . 22.811 15.758 -27.775 1.00 97.79 85 A 1 ATOM 671 C CA . PHE A 0 85 . 22.620 15.707 -29.228 1.00 97.79 85 A 1 ATOM 672 C C . PHE A 0 85 . 22.306 17.089 -29.820 1.00 97.79 85 A 1 ATOM 673 C CB . PHE A 0 85 . 21.515 14.694 -29.553 1.00 97.79 85 A 1 ATOM 674 O O . PHE A 0 85 . 22.956 17.506 -30.781 1.00 97.79 85 A 1 ATOM 675 C CG . PHE A 0 85 . 21.161 14.641 -31.025 1.00 97.79 85 A 1 ATOM 676 C CD1 . PHE A 0 85 . 20.034 15.335 -31.506 1.00 97.79 85 A 1 ATOM 677 C CD2 . PHE A 0 85 . 21.966 13.910 -31.918 1.00 97.79 85 A 1 ATOM 678 C CE1 . PHE A 0 85 . 19.705 15.283 -32.872 1.00 97.79 85 A 1 ATOM 679 C CE2 . PHE A 0 85 . 21.637 13.857 -33.284 1.00 97.79 85 A 1 ATOM 680 C CZ . PHE A 0 85 . 20.501 14.536 -33.758 1.00 97.79 85 A 1 ATOM 681 N N . LEU A 0 86 . 21.376 17.828 -29.207 1.00 98.37 86 A 1 ATOM 682 C CA . LEU A 0 86 . 21.030 19.204 -29.575 1.00 98.37 86 A 1 ATOM 683 C C . LEU A 0 86 . 22.256 20.122 -29.556 1.00 98.37 86 A 1 ATOM 684 C CB . LEU A 0 86 . 19.994 19.733 -28.574 1.00 98.37 86 A 1 ATOM 685 O O . LEU A 0 86 . 22.520 20.816 -30.534 1.00 98.37 86 A 1 ATOM 686 C CG . LEU A 0 86 . 18.547 19.303 -28.853 1.00 98.37 86 A 1 ATOM 687 C CD1 . LEU A 0 86 . 17.782 19.419 -27.541 1.00 98.37 86 A 1 ATOM 688 C CD2 . LEU A 0 86 . 17.884 20.227 -29.876 1.00 98.37 86 A 1 ATOM 689 N N . ASN A 0 87 . 23.051 20.079 -28.484 1.00 98.36 87 A 1 ATOM 690 C CA . ASN A 0 87 . 24.266 20.890 -28.372 1.00 98.36 87 A 1 ATOM 691 C C . ASN A 0 87 . 25.271 20.597 -29.499 1.00 98.36 87 A 1 ATOM 692 C CB . ASN A 0 87 . 24.902 20.653 -26.995 1.00 98.36 87 A 1 ATOM 693 O O . ASN A 0 87 . 25.864 21.522 -30.058 1.00 98.36 87 A 1 ATOM 694 C CG . ASN A 0 87 . 24.290 21.546 -25.937 1.00 98.36 87 A 1 ATOM 695 N ND2 . ASN A 0 87 . 23.458 21.031 -25.067 1.00 98.36 87 A 1 ATOM 696 O OD1 . ASN A 0 87 . 24.558 22.728 -25.893 1.00 98.36 87 A 1 ATOM 697 N N . LYS A 0 88 . 25.448 19.322 -29.873 1.00 98.20 88 A 1 ATOM 698 C CA . LYS A 0 88 . 26.299 18.941 -31.014 1.00 98.20 88 A 1 ATOM 699 C C . LYS A 0 88 . 25.753 19.488 -32.336 1.00 98.20 88 A 1 ATOM 700 C CB . LYS A 0 88 . 26.462 17.415 -31.088 1.00 98.20 88 A 1 ATOM 701 O O . LYS A 0 88 . 26.521 20.053 -33.110 1.00 98.20 88 A 1 ATOM 702 C CG . LYS A 0 88 . 27.377 16.858 -29.989 1.00 98.20 88 A 1 ATOM 703 C CD . LYS A 0 88 . 27.489 15.332 -30.113 1.00 98.20 88 A 1 ATOM 704 C CE . LYS A 0 88 . 28.407 14.767 -29.022 1.00 98.20 88 A 1 ATOM 705 N NZ . LYS A 0 88 . 28.621 13.304 -29.180 1.00 98.20 88 A 1 ATOM 706 N N . LYS A 0 89 . 24.442 19.369 -32.577 1.00 98.13 89 A 1 ATOM 707 C CA . LYS A 0 89 . 23.777 19.920 -33.772 1.00 98.13 89 A 1 ATOM 708 C C . LYS A 0 89 . 23.937 21.438 -33.873 1.00 98.13 89 A 1 ATOM 709 C CB . LYS A 0 89 . 22.288 19.529 -33.768 1.00 98.13 89 A 1 ATOM 710 O O . LYS A 0 89 . 24.260 21.927 -34.948 1.00 98.13 89 A 1 ATOM 711 C CG . LYS A 0 89 . 22.018 18.125 -34.335 1.00 98.13 89 A 1 ATOM 712 C CD . LYS A 0 89 . 22.074 18.109 -35.873 1.00 98.13 89 A 1 ATOM 713 C CE . LYS A 0 89 . 21.618 16.751 -36.423 1.00 98.13 89 A 1 ATOM 714 N NZ . LYS A 0 89 . 21.418 16.790 -37.897 1.00 98.13 89 A 1 ATOM 715 N N . ILE A 0 90 . 23.784 22.164 -32.765 1.00 98.44 90 A 1 ATOM 716 C CA . ILE A 0 90 . 23.969 23.622 -32.716 1.00 98.44 90 A 1 ATOM 717 C C . ILE A 0 90 . 25.410 24.003 -33.073 1.00 98.44 90 A 1 ATOM 718 C CB . ILE A 0 90 . 23.553 24.167 -31.329 1.00 98.44 90 A 1 ATOM 719 O O . ILE A 0 90 . 25.620 24.872 -33.917 1.00 98.44 90 A 1 ATOM 720 C CG1 . ILE A 0 90 . 22.023 24.038 -31.141 1.00 98.44 90 A 1 ATOM 721 C CG2 . ILE A 0 90 . 23.978 25.638 -31.153 1.00 98.44 90 A 1 ATOM 722 C CD1 . ILE A 0 90 . 21.567 24.201 -29.685 1.00 98.44 90 A 1 ATOM 723 N N . LYS A 0 91 . 26.410 23.332 -32.482 1.00 97.95 91 A 1 ATOM 724 C CA . LYS A 0 91 . 27.828 23.578 -32.800 1.00 97.95 91 A 1 ATOM 725 C C . LYS A 0 91 . 28.137 23.319 -34.274 1.00 97.95 91 A 1 ATOM 726 C CB . LYS A 0 91 . 28.744 22.728 -31.908 1.00 97.95 91 A 1 ATOM 727 O O . LYS A 0 91 . 28.777 24.153 -34.902 1.00 97.95 91 A 1 ATOM 728 C CG . LYS A 0 91 . 28.831 23.269 -30.474 1.00 97.95 91 A 1 ATOM 729 C CD . LYS A 0 91 . 29.808 22.428 -29.640 1.00 97.95 91 A 1 ATOM 730 C CE . LYS A 0 91 . 29.916 23.005 -28.223 1.00 97.95 91 A 1 ATOM 731 N NZ . LYS A 0 91 . 30.952 22.314 -27.412 1.00 97.95 91 A 1 ATOM 732 N N . LEU A 0 92 . 27.651 22.206 -34.827 1.00 97.98 92 A 1 ATOM 733 C CA . LEU A 0 92 . 27.841 21.877 -36.241 1.00 97.98 92 A 1 ATOM 734 C C . LEU A 0 92 . 27.181 22.916 -37.156 1.00 97.98 92 A 1 ATOM 735 C CB . LEU A 0 92 . 27.285 20.468 -36.500 1.00 97.98 92 A 1 ATOM 736 O O . LEU A 0 92 . 27.802 23.377 -38.105 1.00 97.98 92 A 1 ATOM 737 C CG . LEU A 0 92 . 27.535 19.962 -37.934 1.00 97.98 92 A 1 ATOM 738 C CD1 . LEU A 0 92 . 29.023 19.768 -38.226 1.00 97.98 92 A 1 ATOM 739 C CD2 . LEU A 0 92 . 26.822 18.622 -38.113 1.00 97.98 92 A 1 ATOM 740 N N . ASN A 0 93 . 25.952 23.333 -36.838 1.00 98.24 93 A 1 ATOM 741 C CA . ASN A 0 93 . 25.254 24.357 -37.610 1.00 98.24 93 A 1 ATOM 742 C C . ASN A 0 93 . 26.002 25.699 -37.584 1.00 98.24 93 A 1 ATOM 743 C CB . ASN A 0 93 . 23.816 24.495 -37.083 1.00 98.24 93 A 1 ATOM 744 O O . ASN A 0 93 . 26.121 26.353 -38.613 1.00 98.24 93 A 1 ATOM 745 C CG . ASN A 0 93 . 22.957 25.279 -38.058 1.00 98.24 93 A 1 ATOM 746 N ND2 . ASN A 0 93 . 22.167 26.221 -37.600 1.00 98.24 93 A 1 ATOM 747 O OD1 . ASN A 0 93 . 22.964 25.022 -39.245 1.00 98.24 93 A 1 ATOM 748 N N . LYS A 0 94 . 26.574 26.081 -36.432 1.00 97.82 94 A 1 ATOM 749 C CA . LYS A 0 94 . 27.401 27.291 -36.312 1.00 97.82 94 A 1 ATOM 750 C C . LYS A 0 94 . 28.653 27.225 -37.195 1.00 97.82 94 A 1 ATOM 751 C CB . LYS A 0 94 . 27.747 27.533 -34.833 1.00 97.82 94 A 1 ATOM 752 O O . LYS A 0 94 . 28.976 28.213 -37.844 1.00 97.82 94 A 1 ATOM 753 C CG . LYS A 0 94 . 28.433 28.893 -34.630 1.00 97.82 94 A 1 ATOM 754 C CD . LYS A 0 94 . 28.707 29.190 -33.149 1.00 97.82 94 A 1 ATOM 755 C CE . LYS A 0 94 . 29.349 30.580 -33.042 1.00 97.82 94 A 1 ATOM 756 N NZ . LYS A 0 94 . 29.620 30.987 -31.640 1.00 97.82 94 A 1 ATOM 757 N N . VAL A 0 95 . 29.332 26.075 -37.234 1.00 98.04 95 A 1 ATOM 758 C CA . VAL A 0 95 . 30.498 25.856 -38.111 1.00 98.04 95 A 1 ATOM 759 C C . VAL A 0 95 . 30.100 25.926 -39.588 1.00 98.04 95 A 1 ATOM 760 C CB . VAL A 0 95 . 31.196 24.521 -37.780 1.00 98.04 95 A 1 ATOM 761 O O . VAL A 0 95 . 30.773 26.599 -40.359 1.00 98.04 95 A 1 ATOM 762 C CG1 . VAL A 0 95 . 32.312 24.173 -38.771 1.00 98.04 95 A 1 ATOM 763 C CG2 . VAL A 0 95 . 31.834 24.573 -36.384 1.00 98.04 95 A 1 ATOM 764 N N . ASN A 0 96 . 28.980 25.309 -39.974 1.00 97.56 96 A 1 ATOM 765 C CA . ASN A 0 96 . 28.493 25.348 -41.356 1.00 97.56 96 A 1 ATOM 766 C C . ASN A 0 96 . 28.136 26.770 -41.813 1.00 97.56 96 A 1 ATOM 767 C CB . ASN A 0 96 . 27.276 24.421 -41.494 1.00 97.56 96 A 1 ATOM 768 O O . ASN A 0 96 . 28.500 27.159 -42.914 1.00 97.56 96 A 1 ATOM 769 C CG . ASN A 0 96 . 27.619 22.944 -41.455 1.00 97.56 96 A 1 ATOM 770 N ND2 . ASN A 0 96 . 26.623 22.097 -41.350 1.00 97.56 96 A 1 ATOM 771 O OD1 . ASN A 0 96 . 28.752 22.511 -41.539 1.00 97.56 96 A 1 ATOM 772 N N . ILE A 0 97 . 27.463 27.560 -40.969 1.00 97.84 97 A 1 ATOM 773 C CA . ILE A 0 97 . 27.148 28.965 -41.280 1.00 97.84 97 A 1 ATOM 774 C C . ILE A 0 97 . 28.433 29.779 -41.452 1.00 97.84 97 A 1 ATOM 775 C CB . ILE A 0 97 . 26.236 29.572 -40.190 1.00 97.84 97 A 1 ATOM 776 O O . ILE A 0 97 . 28.531 30.570 -42.383 1.00 97.84 97 A 1 ATOM 777 C CG1 . ILE A 0 97 . 24.831 28.934 -40.259 1.00 97.84 97 A 1 ATOM 778 C CG2 . ILE A 0 97 . 26.121 31.102 -40.336 1.00 97.84 97 A 1 ATOM 779 C CD1 . ILE A 0 97 . 23.974 29.200 -39.015 1.00 97.84 97 A 1 ATOM 780 N N . HIS A 0 98 . 29.425 29.572 -40.582 1.00 96.64 98 A 1 ATOM 781 C CA . HIS A 0 98 . 30.710 30.256 -40.699 1.00 96.64 98 A 1 ATOM 782 C C . HIS A 0 98 . 31.413 29.929 -42.021 1.00 96.64 98 A 1 ATOM 783 C CB . HIS A 0 98 . 31.584 29.894 -39.497 1.00 96.64 98 A 1 ATOM 784 O O . HIS A 0 98 . 31.911 30.838 -42.669 1.00 96.64 98 A 1 ATOM 785 C CG . HIS A 0 98 . 32.897 30.631 -39.469 1.00 96.64 98 A 1 ATOM 786 C CD2 . HIS A 0 98 . 34.142 30.072 -39.382 1.00 96.64 98 A 1 ATOM 787 N ND1 . HIS A 0 98 . 33.068 31.997 -39.502 1.00 96.64 98 A 1 ATOM 788 C CE1 . HIS A 0 98 . 34.384 32.251 -39.420 1.00 96.64 98 A 1 ATOM 789 N NE2 . HIS A 0 98 . 35.074 31.108 -39.303 1.00 96.64 98 A 1 ATOM 790 N N . LEU A 0 99 . 31.386 28.663 -42.447 1.00 96.27 99 A 1 ATOM 791 C CA . LEU A 0 99 . 31.971 28.232 -43.716 1.00 96.27 99 A 1 ATOM 792 C C . LEU A 0 99 . 31.268 28.831 -44.947 1.00 96.27 99 A 1 ATOM 793 C CB . LEU A 0 99 . 31.951 26.693 -43.747 1.00 96.27 99 A 1 ATOM 794 O O . LEU A 0 99 . 31.918 29.022 -45.959 1.00 96.27 99 A 1 ATOM 795 C CG . LEU A 0 99 . 32.593 26.067 -45.001 1.00 96.27 99 A 1 ATOM 796 C CD1 . LEU A 0 99 . 34.074 26.426 -45.133 1.00 96.27 99 A 1 ATOM 797 C CD2 . LEU A 0 99 . 32.475 24.544 -44.914 1.00 96.27 99 A 1 ATOM 798 N N . ILE A 0 100 . 29.963 29.114 -44.874 1.00 96.66 100 A 1 ATOM 799 C CA . ILE A 0 100 . 29.199 29.724 -45.981 1.00 96.66 100 A 1 ATOM 800 C C . ILE A 0 100 . 29.470 31.234 -46.105 1.00 96.66 100 A 1 ATOM 801 C CB . ILE A 0 100 . 27.690 29.419 -45.790 1.00 96.66 100 A 1 ATOM 802 O O . ILE A 0 100 . 29.302 31.800 -47.180 1.00 96.66 100 A 1 ATOM 803 C CG1 . ILE A 0 100 . 27.415 27.910 -45.991 1.00 96.66 100 A 1 ATOM 804 C CG2 . ILE A 0 100 . 26.787 30.227 -46.744 1.00 96.66 100 A 1 ATOM 805 C CD1 . ILE A 0 100 . 26.051 27.448 -45.457 1.00 96.66 100 A 1 ATOM 806 N N . ILE A 0 101 . 29.827 31.894 -44.999 1.00 96.61 101 A 1 ATOM 807 C CA . ILE A 0 101 . 30.084 33.345 -44.950 1.00 96.61 101 A 1 ATOM 808 C C . ILE A 0 101 . 31.543 33.685 -45.314 1.00 96.61 101 A 1 ATOM 809 C CB . ILE A 0 101 . 29.651 33.893 -43.564 1.00 96.61 101 A 1 ATOM 810 O O . ILE A 0 101 . 31.822 34.836 -45.650 1.00 96.61 101 A 1 ATOM 811 C CG1 . ILE A 0 101 . 28.113 33.784 -43.407 1.00 96.61 101 A 1 ATOM 812 C CG2 . ILE A 0 101 . 30.085 35.353 -43.327 1.00 96.61 101 A 1 ATOM 813 C CD1 . ILE A 0 101 . 27.597 34.073 -41.990 1.00 96.61 101 A 1 ATOM 814 N N . LEU A 0 102 . 32.458 32.715 -45.225 1.00 92.31 102 A 1 ATOM 815 C CA . LEU A 0 102 . 33.857 32.834 -45.658 1.00 92.31 102 A 1 ATOM 816 C C . LEU A 0 102 . 33.992 32.622 -47.168 1.00 92.31 102 A 1 ATOM 817 C CB . LEU A 0 102 . 34.713 31.810 -44.886 1.00 92.31 102 A 1 ATOM 818 O O . LEU A 0 102 . 34.818 33.347 -47.763 1.00 92.31 102 A 1 ATOM 819 C CG . LEU A 0 102 . 34.940 32.117 -43.402 1.00 92.31 102 A 1 ATOM 820 C CD1 . LEU A 0 102 . 35.556 30.880 -42.751 1.00 92.31 102 A 1 ATOM 821 C CD2 . LEU A 0 102 . 35.895 33.295 -43.205 1.00 92.31 102 A 1 ATOM 822 O OXT . LEU A 0 102 . 33.323 31.691 -47.662 1.00 92.31 102 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 91.28 # loop_ _atom_type.symbol C N O S #