data_3roo_2
#
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 ? -51.379 59.402 64.117 1.0 28.48 1 F 1 
ATOM 2  C CA  . ALA A ? 1 ? -50.500 60.465 63.582 1.0 28.97 1 F 1 
ATOM 3  C C   . ALA A ? 1 ? -49.039 60.176 63.946 1.0 28.73 1 F 1 
ATOM 4  O O   . ALA A ? 1 ? -48.720 59.971 65.111 1.0 28.3  1 F 1 
ATOM 5  C CB  . ALA A ? 1 ? -50.943 61.837 64.120 1.0 28.68 1 F 1 
ATOM 6  N N   . VAL A ? 2 ? -48.173 60.133 62.936 1.0 28.75 2 F 1 
ATOM 7  C CA  . VAL A ? 2 ? -46.765 59.778 63.121 1.0 28.96 2 F 1 
ATOM 8  C C   . VAL A ? 2 ? -45.948 60.905 63.759 1.0 28.44 2 F 1 
ATOM 9  O O   . VAL A ? 2 ? -46.244 62.082 63.577 1.0 29.19 2 F 1 
ATOM 10 C CB  . VAL A ? 2 ? -46.082 59.376 61.760 1.0 29.09 2 F 1 
ATOM 11 C CG1 . VAL A ? 2 ? -45.909 60.603 60.828 1.0 29.09 2 F 1 
ATOM 12 C CG2 . VAL A ? 2 ? -44.739 58.690 62.023 1.0 28.75 2 F 1 
ATOM 13 N N   . TYR A ? 3 ? -44.915 60.530 64.503 1.0 28.09 3 F 1 
ATOM 14 C CA  . TYR A ? 3 ? -43.985 61.482 65.117 1.0 27.39 3 F 1 
ATOM 15 C C   . TYR A ? 3 ? -43.097 62.131 64.047 1.0 27.98 3 F 1 
ATOM 16 O O   . TYR A ? 3 ? -42.851 61.522 63.013 1.0 27.86 3 F 1 
ATOM 17 C CB  . TYR A ? 3 ? -43.107 60.721 66.106 1.0 27.31 3 F 1 
ATOM 18 C CG  . TYR A ? 3 ? -42.162 61.535 66.994 1.0 25.08 3 F 1 
ATOM 19 C CD1 . TYR A ? 3 ? -42.656 62.480 67.891 1.0 25.7  3 F 1 
ATOM 20 C CD2 . TYR A ? 3 ? -40.793 61.292 66.987 1.0 26.15 3 F 1 
ATOM 21 C CE1 . TYR A ? 3 ? -41.810 63.196 68.721 1.0 26.28 3 F 1 
ATOM 22 C CE2 . TYR A ? 3 ? -39.921 61.996 67.835 1.0 27.55 3 F 1 
ATOM 23 C CZ  . TYR A ? 3 ? -40.439 62.943 68.703 1.0 26.67 3 F 1 
ATOM 24 O OH  . TYR A ? 3 ? -39.597 63.651 69.531 1.0 27.72 3 F 1 
ATOM 25 N N   . ASN A ? 4 ? -42.641 63.359 64.309 1.0 28.54 4 F 1 
ATOM 26 C CA  . ASN A ? 4 ? -41.578 64.007 63.537 1.0 29.58 4 F 1 
ATOM 27 C C   . ASN A ? 4 ? -40.217 63.621 64.127 1.0 28.91 4 F 1 
ATOM 28 O O   . ASN A ? 4 ? -39.846 64.130 65.182 1.0 28.72 4 F 1 
ATOM 29 C CB  . ASN A ? 4 ? -41.715 65.542 63.581 1.0 30.3  4 F 1 
ATOM 30 C CG  . ASN A ? 4 ? -42.879 66.062 62.748 1.0 34.39 4 F 1 
ATOM 31 N ND2 . ASN A ? 4 ? -43.895 66.615 63.417 1.0 37.99 4 F 1 
ATOM 32 O OD1 . ASN A ? 4 ? -42.852 66.000 61.516 1.0 40.69 4 F 1 
ATOM 33 N N   . PHE A ? 5 ? -39.486 62.726 63.460 1.0 28.13 5 F 1 
ATOM 34 C CA  . PHE A ? 5 ? -38.254 62.151 64.036 1.0 28.17 5 F 1 
ATOM 35 C C   . PHE A ? 5 ? -37.071 63.120 64.045 1.0 28.51 5 F 1 
ATOM 36 O O   . PHE A ? 5 ? -36.951 63.968 63.170 1.0 28.25 5 F 1 
ATOM 37 C CB  . PHE A ? 5 ? -37.872 60.846 63.315 1.0 28.29 5 F 1 
ATOM 38 C CG  . PHE A ? 5 ? -38.888 59.754 63.482 1.0 27.86 5 F 1 
ATOM 39 C CD1 . PHE A ? 5 ? -38.911 58.975 64.630 1.0 27.86 5 F 1 
ATOM 40 C CD2 . PHE A ? 5 ? -39.860 59.541 62.519 1.0 27.67 5 F 1 
ATOM 41 C CE1 . PHE A ? 5 ? -39.874 57.974 64.796 1.0 28.52 5 F 1 
ATOM 42 C CE2 . PHE A ? 5 ? -40.818 58.551 62.677 1.0 28.61 5 F 1 
ATOM 43 C CZ  . PHE A ? 5 ? -40.824 57.763 63.820 1.0 29.12 5 F 1 
ATOM 44 N N   . ALA A ? 6 ? -36.226 63.012 65.065 1.0 28.65 6 F 1 
ATOM 45 C CA  . ALA A ? 6 ? -35.016 63.847 65.176 1.0 29.24 6 F 1 
ATOM 46 C C   . ALA A ? 6 ? -33.875 63.161 64.453 1.0 29.24 6 F 1 
ATOM 47 O O   . ALA A ? 6 ? -33.905 61.946 64.280 1.0 29.62 6 F 1 
ATOM 48 C CB  . ALA A ? 6 ? -34.659 64.070 66.649 1.0 29.26 6 F 1 
ATOM 49 N N   . THR A ? 7 ? -32.887 63.929 63.990 1.0 29.91 7 F 1 
ATOM 50 C CA  . THR A ? 7 ? -31.684 63.336 63.379 1.0 29.74 7 F 1 
ATOM 51 C C   . THR A ? 7 ? -30.805 62.718 64.468 1.0 29.97 7 F 1 
ATOM 52 O O   . THR A ? 7 ? -30.822 63.154 65.624 1.0 29.47 7 F 1 
ATOM 53 C CB  . THR A ? 7 ? -30.843 64.363 62.561 1.0 30.14 7 F 1 
ATOM 54 C CG2 . THR A ? 7 ? -31.539 64.710 61.223 1.0 29.24 7 F 1 
ATOM 55 O OG1 . THR A ? 7 ? -30.649 65.555 63.328 1.0 28.77 7 F 1 
ATOM 56 N N   . MET A ? 8 ? -30.038 61.707 64.092 1.0 30.3  8 F 1 
ATOM 57 C CA  . MET A ? 8 ? -29.280 60.903 65.048 1.0 31.08 8 F 1 
ATOM 58 C C   . MET A ? 8 ? -27.856 61.446 65.235 1.0 31.13 8 F 1 
ATOM 59 O O   . MET A ? 8 ? -27.440 62.425 64.587 1.0 30.99 8 F 1 
ATOM 60 C CB  . MET A ? 8 ? -29.256 59.448 64.572 1.0 31.36 8 F 1 
ATOM 61 C CG  . MET A ? 8 ? -30.668 58.856 64.357 1.0 33.19 8 F 1 
ATOM 62 S SD  . MET A ? 8 ? -30.733 57.265 63.500 1.0 37.22 8 F 1 
ATOM 63 C CE  . MET A ? 8 ? -29.692 56.258 64.533 1.0 37.79 8 F 1 
ATOM 64 O OXT . MET A ? 8 ? -27.090 60.915 66.045 1.0 31.27 8 F 1 
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