data_3roo_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 . ALA A ? 1 ? -51.227 59.444 64.234 1.0 24.5 1 E 1 ATOM 2 C CA . ALA A ? 1 ? -50.335 60.414 63.553 1.0 25.16 1 E 1 ATOM 3 C C . ALA A ? 1 ? -48.867 60.135 63.892 1.0 25.36 1 E 1 ATOM 4 O O . ALA A ? 1 ? -48.536 59.932 65.066 1.0 25.68 1 E 1 ATOM 5 C CB . ALA A ? 1 ? -50.709 61.836 63.957 1.0 24.52 1 E 1 ATOM 6 N N . VAL A ? 2 ? -48.003 60.131 62.876 1.0 25.62 2 E 1 ATOM 7 C CA . VAL A ? 2 ? -46.598 59.757 63.047 1.0 26.33 2 E 1 ATOM 8 C C . VAL A ? 2 ? -45.787 60.862 63.739 1.0 26.32 2 E 1 ATOM 9 O O . VAL A ? 2 ? -46.114 62.032 63.642 1.0 26.85 2 E 1 ATOM 10 C CB . VAL A ? 2 ? -45.936 59.346 61.692 1.0 26.43 2 E 1 ATOM 11 C CG1 . VAL A ? 2 ? -45.633 60.565 60.824 1.0 26.59 2 E 1 ATOM 12 C CG2 . VAL A ? 2 ? -44.682 58.510 61.936 1.0 26.91 2 E 1 ATOM 13 N N . TYR A ? 3 ? -44.747 60.469 64.474 1.0 27.06 3 E 1 ATOM 14 C CA . TYR A ? 3 ? -43.819 61.416 65.093 1.0 27.42 3 E 1 ATOM 15 C C . TYR A ? 3 ? -42.954 62.059 64.017 1.0 27.8 3 E 1 ATOM 16 O O . TYR A ? 3 ? -42.677 61.443 62.982 1.0 27.46 3 E 1 ATOM 17 C CB . TYR A ? 3 ? -42.903 60.659 66.074 1.0 27.59 3 E 1 ATOM 18 C CG . TYR A ? 3 ? -42.026 61.484 67.005 1.0 27.58 3 E 1 ATOM 19 C CD1 . TYR A ? 3 ? -42.579 62.395 67.889 1.0 28.15 3 E 1 ATOM 20 C CD2 . TYR A ? 3 ? -40.638 61.302 67.041 1.0 29.1 3 E 1 ATOM 21 C CE1 . TYR A ? 3 ? -41.790 63.129 68.750 1.0 27.81 3 E 1 ATOM 22 C CE2 . TYR A ? 3 ? -39.839 62.023 67.917 1.0 27.02 3 E 1 ATOM 23 C CZ . TYR A ? 3 ? -40.428 62.931 68.773 1.0 27.66 3 E 1 ATOM 24 O OH . TYR A ? 3 ? -39.665 63.659 69.659 1.0 26.15 3 E 1 ATOM 25 N N . ASN A ? 4 ? -42.540 63.296 64.272 1.0 28.74 4 E 1 ATOM 26 C CA . ASN A ? 4 ? -41.473 63.957 63.519 1.0 29.54 4 E 1 ATOM 27 C C . ASN A ? 4 ? -40.121 63.607 64.134 1.0 28.92 4 E 1 ATOM 28 O O . ASN A ? 4 ? -39.758 64.145 65.185 1.0 28.45 4 E 1 ATOM 29 C CB . ASN A ? 4 ? -41.661 65.477 63.560 1.0 30.48 4 E 1 ATOM 30 C CG . ASN A ? 4 ? -42.717 65.947 62.608 1.0 34.98 4 E 1 ATOM 31 N ND2 . ASN A ? 4 ? -43.909 66.221 63.130 1.0 39.45 4 E 1 ATOM 32 O OD1 . ASN A ? 4 ? -42.461 66.085 61.404 1.0 41.68 4 E 1 ATOM 33 N N . PHE A ? 5 ? -39.391 62.704 63.483 1.0 28.59 5 E 1 ATOM 34 C CA . PHE A ? 5 ? -38.154 62.133 64.040 1.0 28.98 5 E 1 ATOM 35 C C . PHE A ? 5 ? -36.962 63.089 63.995 1.0 29.64 5 E 1 ATOM 36 O O . PHE A ? 5 ? -36.868 63.942 63.117 1.0 28.65 5 E 1 ATOM 37 C CB . PHE A ? 5 ? -37.778 60.836 63.320 1.0 28.57 5 E 1 ATOM 38 C CG . PHE A ? 5 ? -38.792 59.753 63.490 1.0 27.32 5 E 1 ATOM 39 C CD1 . PHE A ? 5 ? -38.847 59.023 64.671 1.0 26.68 5 E 1 ATOM 40 C CD2 . PHE A ? 5 ? -39.707 59.476 62.487 1.0 25.66 5 E 1 ATOM 41 C CE1 . PHE A ? 5 ? -39.792 58.029 64.841 1.0 26.59 5 E 1 ATOM 42 C CE2 . PHE A ? 5 ? -40.658 58.490 62.647 1.0 25.9 5 E 1 ATOM 43 C CZ . PHE A ? 5 ? -40.710 57.762 63.826 1.0 26.26 5 E 1 ATOM 44 N N . ALA A ? 6 ? -36.062 62.918 64.965 1.0 30.62 6 E 1 ATOM 45 C CA . ALA A ? 6 ? -34.858 63.735 65.074 1.0 30.96 6 E 1 ATOM 46 C C . ALA A ? 6 ? -33.733 63.092 64.267 1.0 31.43 6 E 1 ATOM 47 O O . ALA A ? 6 ? -33.767 61.890 63.988 1.0 31.64 6 E 1 ATOM 48 C CB . ALA A ? 6 ? -34.464 63.863 66.528 1.0 31.21 6 E 1 ATOM 49 N N . THR A ? 7 ? -32.743 63.878 63.864 1.0 31.58 7 E 1 ATOM 50 C CA . THR A ? 7 ? -31.543 63.289 63.257 1.0 31.68 7 E 1 ATOM 51 C C . THR A ? 7 ? -30.688 62.642 64.354 1.0 31.06 7 E 1 ATOM 52 O O . THR A ? 7 ? -30.768 63.013 65.526 1.0 29.37 7 E 1 ATOM 53 C CB . THR A ? 7 ? -30.715 64.302 62.478 1.0 31.89 7 E 1 ATOM 54 C CG2 . THR A ? 7 ? -31.421 64.659 61.163 1.0 32.36 7 E 1 ATOM 55 O OG1 . THR A ? 7 ? -30.548 65.481 63.265 1.0 32.55 7 E 1 ATOM 56 N N . MET A ? 8 ? -29.901 61.651 63.950 1.0 30.92 8 E 1 ATOM 57 C CA . MET A ? 8 ? -29.129 60.828 64.876 1.0 31.62 8 E 1 ATOM 58 C C . MET A ? 8 ? -27.695 61.336 65.032 1.0 31.59 8 E 1 ATOM 59 O O . MET A ? 8 ? -27.280 62.310 64.393 1.0 31.22 8 E 1 ATOM 60 C CB . MET A ? 8 ? -29.113 59.384 64.383 1.0 32.0 8 E 1 ATOM 61 C CG . MET A ? 8 ? -30.482 58.722 64.444 1.0 33.64 8 E 1 ATOM 62 S SD . MET A ? 8 ? -30.520 57.171 63.554 1.0 36.55 8 E 1 ATOM 63 C CE . MET A ? 8 ? -29.619 56.070 64.623 1.0 37.7 8 E 1 ATOM 64 O OXT . MET A ? 8 ? -26.927 60.755 65.805 1.0 32.31 8 E 1 #