data_2pye_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 . SER A ? 1 ? -51.611 59.536 63.976 1.0 2.0 1 C 1 ATOM 2 C CA . SER A ? 1 ? -51.018 60.781 63.413 1.0 2.0 1 C 1 ATOM 3 C C . SER A ? 1 ? -49.541 60.902 63.803 1.0 2.0 1 C 1 ATOM 4 O O . SER A ? 1 ? -49.200 60.913 64.987 1.0 2.0 1 C 1 ATOM 5 C CB . SER A ? 1 ? -51.787 62.000 63.903 1.0 2.0 1 C 1 ATOM 6 O OG . SER A ? 1 ? -51.262 63.179 63.337 1.0 2.0 1 C 1 ATOM 7 N N . LEU A ? 2 ? -48.681 61.012 62.793 1.0 2.0 2 C 1 ATOM 8 C CA . LEU A ? 2 ? -47.224 61.108 62.985 1.0 2.0 2 C 1 ATOM 9 C C . LEU A ? 2 ? -46.676 62.225 63.885 1.0 2.0 2 C 1 ATOM 10 O O . LEU A ? 2 ? -47.290 63.277 64.100 1.0 2.0 2 C 1 ATOM 11 C CB . LEU A ? 2 ? -46.515 61.284 61.617 1.0 2.0 2 C 1 ATOM 12 C CG . LEU A ? 2 ? -46.411 60.173 60.577 1.0 2.0 2 C 1 ATOM 13 C CD1 . LEU A ? 2 ? -45.868 60.739 59.278 1.0 2.0 2 C 1 ATOM 14 C CD2 . LEU A ? 2 ? -45.529 59.038 61.065 1.0 2.0 2 C 1 ATOM 15 N N . LEU A ? 3 ? -45.476 61.955 64.379 1.0 2.84 3 C 1 ATOM 16 C CA . LEU A ? 3 ? -44.718 62.870 65.169 1.0 3.69 3 C 1 ATOM 17 C C . LEU A ? 3 ? -44.244 63.841 64.068 1.0 2.16 3 C 1 ATOM 18 O O . LEU A ? 3 ? -44.008 63.423 62.921 1.0 2.0 3 C 1 ATOM 19 C CB . LEU A ? 3 ? -43.558 62.114 65.826 1.0 2.0 3 C 1 ATOM 20 C CG . LEU A ? 3 ? -42.573 62.808 66.754 1.0 9.26 3 C 1 ATOM 21 C CD1 . LEU A ? 3 ? -43.250 63.441 67.959 1.0 2.0 3 C 1 ATOM 22 C CD2 . LEU A ? 3 ? -41.548 61.779 67.200 1.0 14.97 3 C 1 ATOM 23 N N . MET A ? 4 ? -44.128 65.122 64.391 1.0 3.96 4 C 1 ATOM 24 C CA . MET A ? 4 ? -43.738 66.130 63.387 1.0 2.0 4 C 1 ATOM 25 C C . MET A ? 4 ? -42.230 66.402 63.282 1.0 2.04 4 C 1 ATOM 26 O O . MET A ? 4 ? -41.674 66.413 62.181 1.0 2.0 4 C 1 ATOM 27 C CB . MET A ? 4 ? -44.521 67.437 63.649 1.0 2.0 4 C 1 ATOM 28 C CG . MET A ? 4 ? -44.298 68.553 62.652 1.0 2.0 4 C 1 ATOM 29 S SD . MET A ? 4 ? -45.487 69.909 62.878 1.0 2.0 4 C 1 ATOM 30 C CE . MET A ? 4 ? -44.933 71.122 61.681 1.0 2.0 4 C 1 ATOM 31 N N . TRP A ? 5 ? -41.575 66.589 64.419 1.0 2.0 5 C 1 ATOM 32 C CA . TRP A ? 5 ? -40.155 66.910 64.431 1.0 2.0 5 C 1 ATOM 33 C C . TRP A ? 5 ? -39.316 65.711 64.826 1.0 2.94 5 C 1 ATOM 34 O O . TRP A ? 5 ? -39.612 65.049 65.802 1.0 7.16 5 C 1 ATOM 35 C CB . TRP A ? 5 ? -39.923 68.079 65.395 1.0 2.0 5 C 1 ATOM 36 C CG . TRP A ? 5 ? -40.724 69.327 65.029 1.0 2.0 5 C 1 ATOM 37 C CD1 . TRP A ? 5 ? -42.025 69.585 65.351 1.0 2.0 5 C 1 ATOM 38 C CD2 . TRP A ? 5 ? -40.263 70.479 64.286 1.0 2.0 5 C 1 ATOM 39 C CE2 . TRP A ? 5 ? -41.344 71.378 64.206 1.0 2.0 5 C 1 ATOM 40 C CE3 . TRP A ? 5 ? -39.040 70.834 63.692 1.0 2.0 5 C 1 ATOM 41 N NE1 . TRP A ? 5 ? -42.401 70.801 64.864 1.0 2.0 5 C 1 ATOM 42 C CZ2 . TRP A ? 5 ? -41.250 72.621 63.541 1.0 2.0 5 C 1 ATOM 43 C CZ3 . TRP A ? 5 ? -38.945 72.073 63.033 1.0 2.0 5 C 1 ATOM 44 C CH2 . TRP A ? 5 ? -40.045 72.947 62.966 1.0 2.0 5 C 1 ATOM 45 N N . ILE A ? 6 ? -38.261 65.446 64.053 1.0 5.55 6 C 1 ATOM 46 C CA . ILE A ? 6 ? -37.353 64.314 64.298 1.0 2.44 6 C 1 ATOM 47 C C . ILE A ? 6 ? -35.905 64.809 64.242 1.0 2.0 6 C 1 ATOM 48 O O . ILE A ? 6 ? -35.473 65.351 63.232 1.0 2.91 6 C 1 ATOM 49 C CB . ILE A ? 6 ? -37.564 63.172 63.247 1.0 2.77 6 C 1 ATOM 50 C CG1 . ILE A ? 6 ? -39.021 62.674 63.248 1.0 13.22 6 C 1 ATOM 51 C CG2 . ILE A ? 6 ? -36.627 61.998 63.529 1.0 16.75 6 C 1 ATOM 52 C CD1 . ILE A ? 6 ? -39.498 62.055 64.594 1.0 15.47 6 C 1 ATOM 53 N N . THR A ? 7 ? -35.155 64.615 65.333 1.0 6.22 7 C 1 ATOM 54 C CA . THR A ? 7 ? -33.754 65.068 65.410 1.0 2.44 7 C 1 ATOM 55 C C . THR A ? 7 ? -32.796 64.016 64.833 1.0 4.98 7 C 1 ATOM 56 O O . THR A ? 7 ? -32.935 62.823 65.109 1.0 9.56 7 C 1 ATOM 57 C CB . THR A ? 7 ? -33.360 65.403 66.879 1.0 2.0 7 C 1 ATOM 58 C CG2 . THR A ? 7 ? -31.964 65.999 66.962 1.0 2.0 7 C 1 ATOM 59 O OG1 . THR A ? 7 ? -34.301 66.330 67.424 1.0 5.19 7 C 1 ATOM 60 N N . GLN A ? 8 ? -31.818 64.472 64.047 1.0 4.19 8 C 1 ATOM 61 C CA . GLN A ? 8 ? -30.837 63.581 63.418 1.0 2.0 8 C 1 ATOM 62 C C . GLN A ? 8 ? -29.977 62.873 64.477 1.0 2.0 8 C 1 ATOM 63 O O . GLN A ? 8 ? -29.772 63.409 65.559 1.0 5.8 8 C 1 ATOM 64 C CB . GLN A ? 8 ? -29.962 64.374 62.425 1.0 2.0 8 C 1 ATOM 65 C CG . GLN A ? 8 ? -30.762 65.041 61.269 1.0 2.0 8 C 1 ATOM 66 C CD . GLN A ? 8 ? -29.883 65.814 60.294 1.0 2.0 8 C 1 ATOM 67 N NE2 . GLN A ? 8 ? -30.465 66.229 59.194 1.0 2.0 8 C 1 ATOM 68 O OE1 . GLN A ? 8 ? -28.691 66.037 60.541 1.0 8.55 8 C 1 ATOM 69 N N . CYS A ? 9 ? -29.484 61.668 64.168 1.0 2.69 9 C 1 ATOM 70 C CA . CYS A ? 9 ? -28.661 60.909 65.136 1.0 6.72 9 C 1 ATOM 71 C C . CYS A ? 9 ? -27.188 61.316 65.062 1.0 5.56 9 C 1 ATOM 72 O O . CYS A ? 9 ? -26.768 61.983 64.111 1.0 6.62 9 C 1 ATOM 73 C CB . CYS A ? 9 ? -28.799 59.383 64.930 1.0 6.72 9 C 1 ATOM 74 S SG . CYS A ? 9 ? -28.027 58.704 63.448 1.0 15.81 9 C 1 ATOM 75 O OXT . CYS A ? 9 ? -26.390 60.988 65.951 1.0 2.0 9 C 1 #