data_3ws3_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 . TYR A ? 1 ? -51.364 59.494 63.092 1.0 42.95 1 E 1 ATOM 2 C CA . TYR A ? 1 ? -50.724 60.797 63.216 1.0 42.53 1 E 1 ATOM 3 C C . TYR A ? 1 ? -49.249 60.614 63.587 1.0 45.24 1 E 1 ATOM 4 O O . TYR A ? 1 ? -48.878 60.300 64.728 1.0 39.42 1 E 1 ATOM 5 C CB . TYR A ? 1 ? -51.451 61.651 64.253 1.0 49.71 1 E 1 ATOM 6 C CG . TYR A ? 1 ? -50.981 63.087 64.332 1.0 55.02 1 E 1 ATOM 7 C CD1 . TYR A ? 1 ? -51.529 64.060 63.513 1.0 45.96 1 E 1 ATOM 8 C CD2 . TYR A ? 1 ? -49.994 63.471 65.244 1.0 62.61 1 E 1 ATOM 9 C CE1 . TYR A ? 1 ? -51.105 65.379 63.587 1.0 53.86 1 E 1 ATOM 10 C CE2 . TYR A ? 1 ? -49.559 64.792 65.326 1.0 57.81 1 E 1 ATOM 11 C CZ . TYR A ? 1 ? -50.121 65.736 64.495 1.0 58.01 1 E 1 ATOM 12 O OH . TYR A ? 1 ? -49.701 67.043 64.567 1.0 55.97 1 E 1 ATOM 13 N N . GLN A ? 2 ? -48.399 60.833 62.605 1.0 41.54 2 E 1 ATOM 14 C CA . GLN A ? 2 ? -47.020 60.410 62.700 1.0 43.59 2 E 1 ATOM 15 C C . GLN A ? 2 ? -46.196 61.270 63.653 1.0 44.31 2 E 1 ATOM 16 O O . GLN A ? 2 ? -46.462 62.474 63.813 1.0 52.68 2 E 1 ATOM 17 C CB . GLN A ? 2 ? -46.400 60.419 61.303 1.0 47.82 2 E 1 ATOM 18 C CG . GLN A ? 2 ? -45.062 59.748 61.267 1.0 60.82 2 E 1 ATOM 19 C CD . GLN A ? 2 ? -44.673 59.323 59.890 1.0 66.81 2 E 1 ATOM 20 N NE2 . GLN A ? 2 ? -43.456 58.822 59.755 1.0 71.2 2 E 1 ATOM 21 O OE1 . GLN A ? 2 ? -45.452 59.451 58.945 1.0 67.68 2 E 1 ATOM 22 N N . LEU A ? 3 ? -45.212 60.642 64.295 1.0 36.97 3 E 1 ATOM 23 C CA . LEU A ? 3 ? -44.222 61.350 65.113 1.0 43.17 3 E 1 ATOM 24 C C . LEU A ? 3 ? -43.241 62.090 64.210 1.0 43.11 3 E 1 ATOM 25 O O . LEU A ? 3 ? -42.884 61.586 63.137 1.0 45.77 3 E 1 ATOM 26 C CB . LEU A ? 3 ? -43.452 60.369 66.005 1.0 35.23 3 E 1 ATOM 27 C CG . LEU A ? 3 ? -42.204 61.001 66.618 1.0 36.22 3 E 1 ATOM 28 C CD1 . LEU A ? 3 ? -42.574 61.960 67.740 1.0 40.49 3 E 1 ATOM 29 C CD2 . LEU A ? 3 ? -41.242 59.974 67.117 1.0 43.17 3 E 1 ATOM 30 N N . GLU A ? 4 ? -42.794 63.270 64.610 1.0 43.14 4 E 1 ATOM 31 C CA . GLU A ? 4 ? -41.798 63.959 63.797 1.0 37.45 4 E 1 ATOM 32 C C . GLU A ? 4 ? -40.515 64.085 64.585 1.0 36.89 4 E 1 ATOM 33 O O . GLU A ? 4 ? -40.505 64.668 65.661 1.0 43.81 4 E 1 ATOM 34 C CB . GLU A ? 4 ? -42.301 65.312 63.364 1.0 38.98 4 E 1 ATOM 35 C CG . GLU A ? 4 ? -43.231 65.271 62.168 1.0 41.02 4 E 1 ATOM 36 C CD . GLU A ? 4 ? -43.752 66.665 61.815 1.0 53.9 4 E 1 ATOM 37 O OE1 . GLU A ? 4 ? -44.529 67.229 62.616 1.0 59.61 4 E 1 ATOM 38 O OE2 . GLU A ? 4 ? -43.353 67.208 60.763 1.0 43.0 4 E 1 ATOM 39 N N . ASN A ? 5 ? -39.436 63.510 64.070 1.0 38.08 5 E 1 ATOM 40 C CA . ASN A ? 5 ? -38.234 63.335 64.882 1.0 43.93 5 E 1 ATOM 41 C C . ASN A ? 5 ? -37.571 64.672 65.195 1.0 37.69 5 E 1 ATOM 42 O O . ASN A ? 5 ? -37.801 65.674 64.522 1.0 49.61 5 E 1 ATOM 43 C CB . ASN A ? 5 ? -37.230 62.395 64.186 1.0 45.22 5 E 1 ATOM 44 C CG . ASN A ? 5 ? -37.670 60.926 64.197 1.0 44.29 5 E 1 ATOM 45 N ND2 . ASN A ? 5 ? -36.801 60.039 63.704 1.0 41.87 5 E 1 ATOM 46 O OD1 . ASN A ? 5 ? -38.781 60.599 64.617 1.0 51.49 5 E 1 ATOM 47 N N . TYR A ? 6 ? -36.759 64.671 66.238 1.0 36.95 6 E 1 ATOM 48 C CA . TYR A ? 6 ? -35.990 65.843 66.627 1.0 52.56 6 E 1 ATOM 49 C C . TYR A ? 6 ? -34.551 65.719 66.113 1.0 50.66 6 E 1 ATOM 50 O O . TYR A ? 6 ? -34.313 65.812 64.908 1.0 58.56 6 E 1 ATOM 51 C CB . TYR A ? 6 ? -36.027 66.000 68.147 1.0 45.34 6 E 1 ATOM 52 C CG . TYR A ? 6 ? -35.664 67.365 68.658 1.0 63.42 6 E 1 ATOM 53 C CD1 . TYR A ? 6 ? -36.204 68.518 68.086 1.0 73.83 6 E 1 ATOM 54 C CD2 . TYR A ? 6 ? -34.826 67.512 69.752 1.0 66.56 6 E 1 ATOM 55 C CE1 . TYR A ? 6 ? -35.884 69.780 68.571 1.0 71.24 6 E 1 ATOM 56 C CE2 . TYR A ? 6 ? -34.505 68.774 70.242 1.0 69.63 6 E 1 ATOM 57 C CZ . TYR A ? 6 ? -35.039 69.896 69.649 1.0 66.53 6 E 1 ATOM 58 O OH . TYR A ? 6 ? -34.716 71.130 70.141 1.0 78.36 6 E 1 ATOM 59 N N . CYS A ? 7 ? -33.605 65.480 67.019 1.0 43.23 7 E 1 ATOM 60 C CA . CYS A ? 7 ? -32.196 65.331 66.641 1.0 48.05 7 E 1 ATOM 61 C C . CYS A ? 7 ? -31.964 64.032 65.881 1.0 50.44 7 E 1 ATOM 62 O O . CYS A ? 7 ? -32.451 62.972 66.273 1.0 49.83 7 E 1 ATOM 63 C CB . CYS A ? 7 ? -31.285 65.362 67.876 1.0 51.52 7 E 1 ATOM 64 S SG . CYS A ? 7 ? -31.548 66.784 69.004 1.0 64.99 7 E 1 ATOM 65 N N . GLY A ? 8 ? -31.210 64.110 64.794 1.0 46.51 8 E 1 ATOM 66 C CA . GLY A ? 8 ? -30.848 62.920 64.053 1.0 52.4 8 E 1 ATOM 67 C C . GLY A ? 8 ? -29.913 62.034 64.848 1.0 51.91 8 E 1 ATOM 68 O O . GLY A ? 8 ? -29.339 62.469 65.850 1.0 57.1 8 E 1 ATOM 69 N N . LEU A ? 9 ? -29.758 60.788 64.411 1.0 48.86 9 E 1 ATOM 70 C CA . LEU A ? 9 ? -28.869 59.868 65.105 1.0 51.18 9 E 1 ATOM 71 C C . LEU A ? 9 ? -27.443 60.413 65.086 1.0 57.76 9 E 1 ATOM 72 O O . LEU A ? 9 ? -26.934 60.815 64.036 1.0 71.77 9 E 1 ATOM 73 C CB . LEU A ? 9 ? -28.925 58.480 64.470 1.0 45.88 9 E 1 ATOM 74 C CG . LEU A ? 9 ? -30.264 57.745 64.585 1.0 49.52 9 E 1 ATOM 75 C CD1 . LEU A ? 9 ? -30.120 56.279 64.222 1.0 54.88 9 E 1 ATOM 76 C CD2 . LEU A ? 9 ? -30.797 57.872 65.968 1.0 51.88 9 E 1 ATOM 77 O OXT . LEU A ? 9 ? -26.775 60.485 66.115 1.0 47.16 9 E 1 #