data_3tie_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 ? -51.251 59.865 64.018 1.0 28.72 2 C 1 
ATOM 2  C CA  . ALA A ? 1 ? -50.297 60.652 63.257 1.0 29.88 2 C 1 
ATOM 3  C C   . ALA A ? 1 ? -48.900 60.433 63.827 1.0 33.06 2 C 1 
ATOM 4  O O   . ALA A ? 1 ? -48.688 60.524 65.046 1.0 30.93 2 C 1 
ATOM 5  C CB  . ALA A ? 1 ? -50.680 62.121 63.296 1.0 27.11 2 C 1 
ATOM 6  N N   . ILE A ? 2 ? -47.950 60.149 62.941 1.0 21.72 3 C 1 
ATOM 7  C CA  . ILE A ? 2 ? -46.593 59.795 63.343 1.0 20.58 3 C 1 
ATOM 8  C C   . ILE A ? 2 ? -45.846 60.993 63.948 1.0 27.65 3 C 1 
ATOM 9  O O   . ILE A ? 2 ? -46.194 62.144 63.696 1.0 22.84 3 C 1 
ATOM 10 C CB  . ILE A ? 2 ? -45.788 59.264 62.136 1.0 22.99 3 C 1 
ATOM 11 C CG1 . ILE A ? 2 ? -44.594 58.424 62.606 1.0 25.51 3 C 1 
ATOM 12 C CG2 . ILE A ? 2 ? -45.320 60.428 61.251 1.0 20.32 3 C 1 
ATOM 13 C CD1 . ILE A ? 2 ? -43.908 57.586 61.478 1.0 14.21 3 C 1 
ATOM 14 N N   . VAL A ? 3 ? -44.816 60.708 64.739 1.0 24.38 4 C 1 
ATOM 15 C CA  . VAL A ? 3 ? -43.985 61.741 65.335 1.0 27.86 4 C 1 
ATOM 16 C C   . VAL A ? 3 ? -42.993 62.265 64.311 1.0 30.2  4 C 1 
ATOM 17 O O   . VAL A ? 3 ? -42.657 61.562 63.349 1.0 25.12 4 C 1 
ATOM 18 C CB  . VAL A ? 3 ? -43.200 61.165 66.529 1.0 35.38 4 C 1 
ATOM 19 C CG1 . VAL A ? 3 ? -42.218 60.124 66.053 1.0 28.23 4 C 1 
ATOM 20 C CG2 . VAL A ? 3 ? -42.481 62.267 67.288 1.0 26.96 4 C 1 
ATOM 21 N N   . ASN A ? 4 ? -42.527 63.498 64.511 1.0 17.44 5 C 1 
ATOM 22 C CA  . ASN A ? 4 ? -41.440 64.047 63.687 1.0 25.18 5 C 1 
ATOM 23 C C   . ASN A ? 4 ? -40.095 63.633 64.266 1.0 28.8  5 C 1 
ATOM 24 O O   . ASN A ? 4 ? -39.785 63.943 65.420 1.0 30.39 5 C 1 
ATOM 25 C CB  . ASN A ? 4 ? -41.525 65.583 63.589 1.0 29.78 5 C 1 
ATOM 26 C CG  . ASN A ? 4 ? -42.798 66.053 62.911 1.0 30.47 5 C 1 
ATOM 27 N ND2 . ASN A ? 4 ? -43.718 66.617 63.687 1.0 26.83 5 C 1 
ATOM 28 O OD1 . ASN A ? 4 ? -42.952 65.906 61.703 1.0 35.09 5 C 1 
ATOM 29 N N   . TYR A ? 5 ? -39.293 62.923 63.482 1.0 25.56 6 C 1 
ATOM 30 C CA  . TYR A ? 5 ? -38.063 62.351 64.026 1.0 29.27 6 C 1 
ATOM 31 C C   . TYR A ? 5 ? -36.950 63.383 64.098 1.0 31.32 6 C 1 
ATOM 32 O O   . TYR A ? 5 ? -36.825 64.235 63.225 1.0 33.74 6 C 1 
ATOM 33 C CB  . TYR A ? 5 ? -37.642 61.098 63.245 1.0 18.18 6 C 1 
ATOM 34 C CG  . TYR A ? 5 ? -38.628 59.961 63.455 1.0 26.23 6 C 1 
ATOM 35 C CD1 . TYR A ? 5 ? -38.605 59.194 64.620 1.0 18.95 6 C 1 
ATOM 36 C CD2 . TYR A ? 5 ? -39.600 59.679 62.504 1.0 20.62 6 C 1 
ATOM 37 C CE1 . TYR A ? 5 ? -39.520 58.166 64.820 1.0 25.46 6 C 1 
ATOM 38 C CE2 . TYR A ? 5 ? -40.507 58.670 62.692 1.0 21.71 6 C 1 
ATOM 39 C CZ  . TYR A ? 5 ? -40.469 57.921 63.850 1.0 22.89 6 C 1 
ATOM 40 O OH  . TYR A ? 5 ? -41.387 56.919 64.016 1.0 32.09 6 C 1 
ATOM 41 N N   . ALA A ? 6 ? -36.164 63.304 65.164 1.0 32.78 7 C 1 
ATOM 42 C CA  . ALA A ? 6 ? -34.985 64.134 65.340 1.0 31.4  7 C 1 
ATOM 43 C C   . ALA A ? 6 ? -33.782 63.411 64.750 1.0 37.72 7 C 1 
ATOM 44 O O   . ALA A ? 6 ? -33.780 62.187 64.646 1.0 32.93 7 C 1 
ATOM 45 C CB  . ALA A ? 6 ? -34.748 64.397 66.825 1.0 27.95 7 C 1 
ATOM 46 N N   . ASN A ? 7 ? -32.742 64.160 64.400 1.0 32.42 8 C 1 
ATOM 47 C CA  . ASN A ? 7 ? -31.529 63.533 63.873 1.0 33.3  8 C 1 
ATOM 48 C C   . ASN A ? 7 ? -30.716 62.730 64.886 1.0 35.2  8 C 1 
ATOM 49 O O   . ASN A ? 7 ? -30.585 63.114 66.060 1.0 32.06 8 C 1 
ATOM 50 C CB  . ASN A ? 7 ? -30.644 64.564 63.173 1.0 39.68 8 C 1 
ATOM 51 C CG  . ASN A ? 7 ? -31.316 65.157 61.954 1.0 43.77 8 C 1 
ATOM 52 N ND2 . ASN A ? 7 ? -31.848 64.301 61.097 1.0 46.42 8 C 1 
ATOM 53 O OD1 . ASN A ? 7 ? -31.336 66.378 61.773 1.0 56.54 8 C 1 
ATOM 54 N N   . LEU A ? 8 ? -30.194 61.603 64.409 1.0 28.34 9 C 1 
ATOM 55 C CA  . LEU A ? 8 ? -29.243 60.781 65.146 1.0 39.93 9 C 1 
ATOM 56 C C   . LEU A ? 8 ? -27.894 61.488 65.240 1.0 28.21 9 C 1 
ATOM 57 O O   . LEU A ? 8 ? -27.019 61.037 65.983 1.0 34.89 9 C 1 
ATOM 58 C CB  . LEU A ? 8 ? -29.060 59.418 64.459 1.0 36.19 9 C 1 
ATOM 59 C CG  . LEU A ? 8 ? -30.299 58.533 64.388 1.0 41.93 9 C 1 
ATOM 60 C CD1 . LEU A ? 8 ? -29.988 57.211 63.723 1.0 36.02 9 C 1 
ATOM 61 C CD2 . LEU A ? 8 ? -30.851 58.301 65.775 1.0 56.47 9 C 1 
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