data_3kww_1 # 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 . LEU A ? 1 ? -52.101 59.260 64.130 1.0 9.82 1 C 1 ATOM 2 C CA . LEU A ? 1 ? -51.310 60.423 63.641 1.0 9.52 1 C 1 ATOM 3 C C . LEU A ? 1 ? -49.846 60.280 64.063 1.0 10.23 1 C 1 ATOM 4 O O . LEU A ? 1 ? -49.566 60.068 65.248 1.0 11.04 1 C 1 ATOM 5 C CB . LEU A ? 1 ? -51.892 61.730 64.181 1.0 9.31 1 C 1 ATOM 6 C CG . LEU A ? 1 ? -51.234 63.024 63.688 1.0 12.59 1 C 1 ATOM 7 C CD1 . LEU A ? 1 ? -51.725 63.398 62.280 1.0 9.48 1 C 1 ATOM 8 C CD2 . LEU A ? 1 ? -51.465 64.158 64.683 1.0 14.2 1 C 1 ATOM 9 N N . PRO A ? 2 ? -48.905 60.411 63.102 1.0 10.3 2 C 1 ATOM 10 C CA . PRO A ? 2 ? -47.479 60.288 63.421 1.0 11.92 2 C 1 ATOM 11 C C . PRO A ? 2 ? -46.988 61.501 64.212 1.0 13.88 2 C 1 ATOM 12 O O . PRO A ? 2 ? -47.737 62.476 64.368 1.0 14.71 2 C 1 ATOM 13 C CB . PRO A ? 2 ? -46.808 60.245 62.036 1.0 12.65 2 C 1 ATOM 14 C CG . PRO A ? 2 ? -47.749 60.979 61.135 1.0 9.87 2 C 1 ATOM 15 C CD . PRO A ? 2 ? -49.130 60.704 61.675 1.0 9.75 2 C 1 ATOM 16 N N . GLU A ? 3 ? -45.749 61.432 64.701 1.0 14.56 3 C 1 ATOM 17 C CA A GLU A ? 3 ? -45.132 62.533 65.442 0.5 15.5 3 C 1 ATOM 18 C CA B GLU A ? 3 ? -45.161 62.528 65.455 0.5 16.31 3 C 1 ATOM 19 C C . GLU A ? 3 ? -45.025 63.774 64.571 1.0 16.6 3 C 1 ATOM 20 O O . GLU A ? 3 ? -44.412 63.724 63.509 1.0 16.48 3 C 1 ATOM 21 C CB A GLU A ? 3 ? -43.727 62.160 65.899 0.5 14.51 3 C 1 ATOM 22 C CB B GLU A ? 3 ? -43.814 62.115 66.063 0.5 15.95 3 C 1 ATOM 23 C CG A GLU A ? 3 ? -43.667 61.125 66.976 0.5 12.47 3 C 1 ATOM 24 C CG B GLU A ? 3 ? -43.357 63.005 67.217 0.5 19.24 3 C 1 ATOM 25 C CD A GLU A ? 3 ? -42.272 60.602 67.176 0.5 11.41 3 C 1 ATOM 26 C CD B GLU A ? 3 ? -42.315 62.349 68.112 0.5 23.3 3 C 1 ATOM 27 O OE1 A GLU A ? 3 ? -41.509 60.571 66.191 0.5 11.13 3 C 1 ATOM 28 O OE1 B GLU A ? 3 ? -42.043 62.906 69.195 0.5 25.43 3 C 1 ATOM 29 O OE2 A GLU A ? 3 ? -41.935 60.220 68.313 0.5 15.48 3 C 1 ATOM 30 O OE2 B GLU A ? 3 ? -41.772 61.283 67.745 0.5 23.95 3 C 1 ATOM 31 N N . PRO A ? 4 ? -45.612 64.902 65.019 1.0 19.04 4 C 1 ATOM 32 C CA . PRO A ? 4 ? -45.537 66.111 64.203 1.0 19.8 4 C 1 ATOM 33 C C . PRO A ? 4 ? -44.115 66.645 64.149 1.0 19.7 4 C 1 ATOM 34 O O . PRO A ? 4 ? -43.309 66.333 65.023 1.0 18.52 4 C 1 ATOM 35 C CB . PRO A ? 4 ? -46.430 67.096 64.960 1.0 20.87 4 C 1 ATOM 36 C CG . PRO A ? 4 ? -47.266 66.248 65.860 1.0 21.52 4 C 1 ATOM 37 C CD . PRO A ? 4 ? -46.360 65.149 66.262 1.0 19.87 4 C 1 ATOM 38 N N . LEU A ? 5 ? -43.819 67.437 63.123 1.0 20.85 5 C 1 ATOM 39 C CA . LEU A ? 5 ? -42.510 68.066 62.983 1.0 21.4 5 C 1 ATOM 40 C C . LEU A ? 5 ? -42.300 69.101 64.081 1.0 22.74 5 C 1 ATOM 41 O O . LEU A ? 5 ? -43.241 69.818 64.440 1.0 23.68 5 C 1 ATOM 42 C CB . LEU A ? 5 ? -42.365 68.719 61.600 1.0 21.94 5 C 1 ATOM 43 C CG . LEU A ? 5 ? -42.457 67.791 60.378 1.0 18.68 5 C 1 ATOM 44 C CD1 . LEU A ? 5 ? -42.190 68.579 59.110 1.0 19.58 5 C 1 ATOM 45 C CD2 . LEU A ? 5 ? -41.492 66.635 60.495 1.0 15.3 5 C 1 ATOM 46 N N . PRO A ? 6 ? -41.066 69.187 64.616 1.0 23.95 6 C 1 ATOM 47 C CA . PRO A ? 6 ? -40.750 70.194 65.626 1.0 26.72 6 C 1 ATOM 48 C C . PRO A ? 6 ? -40.671 71.574 64.976 1.0 28.99 6 C 1 ATOM 49 O O . PRO A ? 6 ? -40.709 71.672 63.745 1.0 28.68 6 C 1 ATOM 50 C CB . PRO A ? 6 ? -39.373 69.758 66.128 1.0 27.24 6 C 1 ATOM 51 C CG . PRO A ? 6 ? -38.754 69.075 64.951 1.0 25.62 6 C 1 ATOM 52 C CD . PRO A ? 6 ? -39.888 68.365 64.273 1.0 22.66 6 C 1 ATOM 53 N N . GLN A ? 7 ? -40.568 72.624 65.790 1.0 31.72 7 C 1 ATOM 54 C CA . GLN A ? 7 ? -40.467 73.990 65.277 1.0 34.66 7 C 1 ATOM 55 C C . GLN A ? 7 ? -39.280 74.160 64.331 1.0 35.65 7 C 1 ATOM 56 O O . GLN A ? 7 ? -39.447 74.612 63.192 1.0 36.55 7 C 1 ATOM 57 C CB . GLN A ? 7 ? -40.400 75.000 66.427 1.0 37.82 7 C 1 ATOM 58 C CG . GLN A ? 7 ? -41.762 75.388 66.990 1.0 39.9 7 C 1 ATOM 59 C CD . GLN A ? 7 ? -42.514 76.347 66.086 0.5 42.53 7 C 1 ATOM 60 N NE2 . GLN A ? 7 ? -43.547 75.844 65.420 0.5 41.79 7 C 1 ATOM 61 O OE1 . GLN A ? 7 ? -42.174 77.527 65.993 0.5 45.23 7 C 1 ATOM 62 N N . GLY A ? 8 ? -38.092 73.779 64.797 1.0 35.53 8 C 1 ATOM 63 C CA . GLY A ? 8 ? -36.886 73.834 63.975 1.0 35.69 8 C 1 ATOM 64 C C . GLY A ? 8 ? -36.820 72.662 63.013 1.0 34.24 8 C 1 ATOM 65 O O . GLY A ? 8 ? -37.822 72.302 62.388 1.0 34.79 8 C 1 ATOM 66 N N . GLN A ? 9 ? -35.637 72.065 62.891 1.0 32.29 9 C 1 ATOM 67 C CA . GLN A ? 9 ? -35.456 70.897 62.033 1.0 29.6 9 C 1 ATOM 68 C C . GLN A ? 9 ? -35.451 69.610 62.858 1.0 26.65 9 C 1 ATOM 69 O O . GLN A ? 9 ? -35.143 69.627 64.054 1.0 26.51 9 C 1 ATOM 70 C CB . GLN A ? 9 ? -34.163 71.013 61.212 1.0 30.06 9 C 1 ATOM 71 C CG . GLN A ? 9 ? -34.102 72.225 60.267 1.0 32.17 9 C 1 ATOM 72 C CD . GLN A ? 9 ? -35.175 72.203 59.188 0.5 31.37 9 C 1 ATOM 73 N NE2 . GLN A ? 9 ? -36.018 73.229 59.173 0.5 31.13 9 C 1 ATOM 74 O OE1 . GLN A ? 9 ? -35.241 71.280 58.375 0.5 30.6 9 C 1 ATOM 75 N N . LEU A ? 10 ? -35.815 68.506 62.209 1.0 23.62 10 C 1 ATOM 76 C CA . LEU A ? 10 ? -35.702 67.172 62.793 1.0 20.93 10 C 1 ATOM 77 C C . LEU A ? 10 ? -34.246 66.879 63.134 1.0 20.09 10 C 1 ATOM 78 O O . LEU A ? 10 ? -33.340 67.222 62.368 1.0 20.5 10 C 1 ATOM 79 C CB . LEU A ? 10 ? -36.219 66.111 61.814 1.0 19.93 10 C 1 ATOM 80 C CG . LEU A ? 10 ? -37.718 66.026 61.518 1.0 17.95 10 C 1 ATOM 81 C CD1 . LEU A ? 10 ? -37.958 65.258 60.226 1.0 18.1 10 C 1 ATOM 82 C CD2 . LEU A ? 10 ? -38.451 65.373 62.669 1.0 18.87 10 C 1 ATOM 83 N N . THR A ? 11 ? -34.024 66.249 64.280 1.0 18.25 11 C 1 ATOM 84 C CA . THR A ? 11 ? -32.674 65.897 64.712 1.0 18.01 11 C 1 ATOM 85 C C . THR A ? 11 ? -32.309 64.536 64.149 1.0 17.18 11 C 1 ATOM 86 O O . THR A ? 11 ? -32.940 63.532 64.481 1.0 17.36 11 C 1 ATOM 87 C CB . THR A ? 11 ? -32.564 65.867 66.249 1.0 17.71 11 C 1 ATOM 88 C CG2 . THR A ? 11 ? -31.107 65.895 66.694 1.0 19.16 11 C 1 ATOM 89 O OG1 . THR A ? 11 ? -33.240 67.002 66.791 1.0 18.45 11 C 1 ATOM 90 N N . ALA A ? 12 ? -31.291 64.511 63.291 1.0 17.03 12 C 1 ATOM 91 C CA . ALA A ? 12 ? -30.782 63.273 62.711 1.0 15.99 12 C 1 ATOM 92 C C . ALA A ? 12 ? -30.163 62.389 63.784 1.0 16.46 12 C 1 ATOM 93 O O . ALA A ? 12 ? -29.859 62.854 64.885 1.0 17.83 12 C 1 ATOM 94 C CB . ALA A ? 12 ? -29.764 63.582 61.624 1.0 16.13 12 C 1 ATOM 95 N N . TYR A ? 13 ? -29.993 61.109 63.469 1.0 16.1 13 C 1 ATOM 96 C CA . TYR A ? 13 ? -29.274 60.194 64.350 1.0 15.82 13 C 1 ATOM 97 C C . TYR A ? 13 ? -27.816 60.619 64.422 1.0 15.7 13 C 1 ATOM 98 O O . TYR A ? 13 ? -27.340 61.302 63.518 1.0 16.71 13 C 1 ATOM 99 C CB . TYR A ? 13 ? -29.361 58.759 63.828 1.0 14.24 13 C 1 ATOM 100 C CG . TYR A ? 13 ? -30.701 58.081 64.010 1.0 13.9 13 C 1 ATOM 101 C CD1 . TYR A ? 13 ? -31.873 58.634 63.479 1.0 13.05 13 C 1 ATOM 102 C CD2 . TYR A ? 13 ? -30.795 56.865 64.686 1.0 12.53 13 C 1 ATOM 103 C CE1 . TYR A ? 13 ? -33.100 58.008 63.638 1.0 9.78 13 C 1 ATOM 104 C CE2 . TYR A ? 13 ? -32.023 56.229 64.848 1.0 11.63 13 C 1 ATOM 105 C CZ . TYR A ? 13 ? -33.171 56.810 64.325 1.0 10.39 13 C 1 ATOM 106 O OH . TYR A ? 13 ? -34.387 56.189 64.475 1.0 13.27 13 C 1 ATOM 107 O OXT . TYR A ? 13 ? -27.087 60.300 65.359 1.0 16.18 13 C 1 #