data_3mrl_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 . CYS A ? 1 ? -51.617 59.058 63.935 1.0 45.4 1 P 1 ATOM 2 C CA . CYS A ? 1 ? -51.208 60.470 63.686 1.0 46.72 1 P 1 ATOM 3 C C . CYS A ? 1 ? -49.716 60.622 63.941 1.0 46.0 1 P 1 ATOM 4 O O . CYS A ? 1 ? -49.258 60.465 65.074 1.0 46.22 1 P 1 ATOM 5 C CB . CYS A ? 1 ? -51.979 61.408 64.605 1.0 47.78 1 P 1 ATOM 6 S SG . CYS A ? 1 ? -51.502 63.135 64.453 1.0 50.97 1 P 1 ATOM 7 N N . ILE A ? 2 ? -48.961 60.927 62.893 1.0 45.21 2 P 1 ATOM 8 C CA . ILE A ? 2 ? -47.501 60.866 62.969 1.0 45.6 2 P 1 ATOM 9 C C . ILE A ? 2 ? -46.874 61.954 63.859 1.0 45.66 2 P 1 ATOM 10 O O . ILE A ? 2 ? -47.450 63.032 64.046 1.0 45.12 2 P 1 ATOM 11 C CB . ILE A ? 2 ? -46.867 60.798 61.546 1.0 45.03 2 P 1 ATOM 12 C CG1 . ILE A ? 2 ? -46.878 59.344 61.060 1.0 45.33 2 P 1 ATOM 13 C CG2 . ILE A ? 2 ? -45.462 61.349 61.536 1.0 45.7 2 P 1 ATOM 14 C CD1 . ILE A ? 2 ? -45.940 59.044 59.918 1.0 45.55 2 P 1 ATOM 15 N N . ASN A ? 3 ? -45.717 61.642 64.439 1.0 46.06 3 P 1 ATOM 16 C CA . ASN A ? 3 ? -44.963 62.614 65.228 1.0 47.39 3 P 1 ATOM 17 C C . ASN A ? 3 ? -44.441 63.761 64.358 1.0 48.16 3 P 1 ATOM 18 O O . ASN A ? 3 ? -43.883 63.536 63.285 1.0 48.17 3 P 1 ATOM 19 C CB . ASN A ? 3 ? -43.814 61.938 65.969 1.0 47.41 3 P 1 ATOM 20 C CG . ASN A ? 3 ? -43.136 62.862 66.973 1.0 48.16 3 P 1 ATOM 21 N ND2 . ASN A ? 3 ? -42.350 62.275 67.874 1.0 47.54 3 P 1 ATOM 22 O OD1 . ASN A ? 3 ? -43.316 64.088 66.943 1.0 48.52 3 P 1 ATOM 23 N N . GLY A ? 4 ? -44.620 64.988 64.837 1.0 49.24 4 P 1 ATOM 24 C CA . GLY A ? 4 ? -44.416 66.183 64.014 1.0 51.27 4 P 1 ATOM 25 C C . GLY A ? 4 ? -42.997 66.508 63.575 1.0 52.1 4 P 1 ATOM 26 O O . GLY A ? 4 ? -42.787 66.996 62.463 1.0 52.33 4 P 1 ATOM 27 N N . VAL A ? 5 ? -42.027 66.248 64.449 1.0 52.81 5 P 1 ATOM 28 C CA . VAL A ? 5 ? -40.631 66.611 64.197 1.0 53.56 5 P 1 ATOM 29 C C . VAL A ? 5 ? -39.662 65.475 64.559 1.0 54.11 5 P 1 ATOM 30 O O . VAL A ? 5 ? -39.930 64.679 65.465 1.0 54.06 5 P 1 ATOM 31 C CB . VAL A ? 5 ? -40.231 67.913 64.948 1.0 53.51 5 P 1 ATOM 32 C CG1 . VAL A ? 5 ? -40.355 69.129 64.028 1.0 53.31 5 P 1 ATOM 33 C CG2 . VAL A ? 5 ? -41.076 68.090 66.220 1.0 53.31 5 P 1 ATOM 34 N N . VAL A ? 6 ? -38.531 65.427 63.857 1.0 54.41 6 P 1 ATOM 35 C CA . VAL A ? 6 ? -37.581 64.318 63.974 1.0 54.08 6 P 1 ATOM 36 C C . VAL A ? 6 ? -36.117 64.792 64.014 1.0 54.01 6 P 1 ATOM 37 O O . VAL A ? 6 ? -35.727 65.705 63.272 1.0 54.34 6 P 1 ATOM 38 C CB . VAL A ? 6 ? -37.760 63.350 62.788 1.0 54.43 6 P 1 ATOM 39 C CG1 . VAL A ? 6 ? -38.797 62.272 63.118 1.0 54.16 6 P 1 ATOM 40 C CG2 . VAL A ? 6 ? -38.153 64.134 61.533 1.0 53.18 6 P 1 ATOM 41 N N . TRP A ? 7 ? -35.312 64.156 64.869 1.0 53.08 7 P 1 ATOM 42 C CA . TRP A ? 7 ? -33.893 64.513 65.043 1.0 51.5 7 P 1 ATOM 43 C C . TRP A ? 7 ? -32.942 63.480 64.445 1.0 49.8 7 P 1 ATOM 44 O O . TRP A ? 7 ? -33.195 62.280 64.524 1.0 49.19 7 P 1 ATOM 45 C CB . TRP A ? 7 ? -33.574 64.677 66.522 1.0 52.06 7 P 1 ATOM 46 C CG . TRP A ? 7 ? -34.288 65.818 67.131 1.0 53.9 7 P 1 ATOM 47 C CD1 . TRP A ? 7 ? -35.547 65.809 67.671 1.0 53.87 7 P 1 ATOM 48 C CD2 . TRP A ? 7 ? -33.801 67.156 67.255 1.0 54.54 7 P 1 ATOM 49 C CE2 . TRP A ? 7 ? -34.817 67.913 67.889 1.0 54.75 7 P 1 ATOM 50 C CE3 . TRP A ? 7 ? -32.607 67.794 66.892 1.0 55.51 7 P 1 ATOM 51 N NE1 . TRP A ? 7 ? -35.869 67.066 68.132 1.0 54.38 7 P 1 ATOM 52 C CZ2 . TRP A ? 7 ? -34.670 69.277 68.173 1.0 54.72 7 P 1 ATOM 53 C CZ3 . TRP A ? 7 ? -32.465 69.159 67.167 1.0 55.95 7 P 1 ATOM 54 C CH2 . TRP A ? 7 ? -33.494 69.881 67.804 1.0 55.24 7 P 1 ATOM 55 N N . THR A ? 8 ? -31.840 63.945 63.864 1.0 47.96 8 P 1 ATOM 56 C CA . THR A ? 8 ? -30.872 63.025 63.269 1.0 46.89 8 P 1 ATOM 57 C C . THR A ? 8 ? -30.004 62.385 64.353 1.0 46.05 8 P 1 ATOM 58 O O . THR A ? 8 ? -29.880 62.926 65.455 1.0 46.18 8 P 1 ATOM 59 C CB . THR A ? 8 ? -30.019 63.703 62.141 1.0 47.03 8 P 1 ATOM 60 C CG2 . THR A ? 8 ? -29.236 64.915 62.665 1.0 45.84 8 P 1 ATOM 61 O OG1 . THR A ? 8 ? -29.110 62.747 61.571 1.0 47.35 8 P 1 ATOM 62 N N . VAL A ? 9 ? -29.428 61.226 64.050 1.0 45.09 9 P 1 ATOM 63 C CA . VAL A ? 9 ? -28.619 60.499 65.024 1.0 45.24 9 P 1 ATOM 64 C C . VAL A ? 9 ? -27.247 61.153 65.265 1.0 45.41 9 P 1 ATOM 65 O O . VAL A ? 9 ? -26.572 60.922 66.282 1.0 44.83 9 P 1 ATOM 66 C CB . VAL A ? 9 ? -28.423 59.014 64.622 1.0 45.38 9 P 1 ATOM 67 C CG1 . VAL A ? 9 ? -29.769 58.281 64.548 1.0 44.44 9 P 1 ATOM 68 C CG2 . VAL A ? 9 ? -27.672 58.918 63.311 1.0 43.98 9 P 1 ATOM 69 O OXT . VAL A ? 9 ? -26.785 61.944 64.440 1.0 45.74 9 P 1 #