Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"

    save_assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Entry_ID                      50382
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Name                          barr1_5C
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $sample_conditions_2
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label    $chem_shift_reference_1
   _Assigned_chem_shift_list.Chem_shift_1H_err             .
   _Assigned_chem_shift_list.Chem_shift_13C_err            .
   _Assigned_chem_shift_list.Chem_shift_15N_err            .
   _Assigned_chem_shift_list.Chem_shift_31P_err            .
   _Assigned_chem_shift_list.Chem_shift_2H_err             .
   _Assigned_chem_shift_list.Chem_shift_19F_err            .
   _Assigned_chem_shift_list.Error_derivation_method       .
   _Assigned_chem_shift_list.Details                       .
   _Assigned_chem_shift_list.Text_data_format              .
   _Assigned_chem_shift_list.Text_data                     .

   loop_
      _Chem_shift_experiment.Experiment_ID
      _Chem_shift_experiment.Experiment_name
      _Chem_shift_experiment.Sample_ID
      _Chem_shift_experiment.Sample_label
      _Chem_shift_experiment.Sample_state
      _Chem_shift_experiment.Entry_ID
      _Chem_shift_experiment.Assigned_chem_shift_list_ID

      2   '2D 1H-1H COSY'              .   .   .   50382   1
      3   '2D 1H-1H TOCSY'             .   .   .   50382   1
      4   '2D 1H-1H NOESY'             .   .   .   50382   1
      5   '2D 1H-13C HSQC aliphatic'   .   .   .   50382   1
      6   '2D 1H-13C HSQC aromatic'    .   .   .   50382   1
   stop_

   loop_
      _Chem_shift_software.Software_ID
      _Chem_shift_software.Software_label
      _Chem_shift_software.Method_ID
      _Chem_shift_software.Method_label
      _Chem_shift_software.Entry_ID
      _Chem_shift_software.Assigned_chem_shift_list_ID

      2   $software_2   .   .   50382   1
   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_ID
      _Atom_chem_shift.Entity_assembly_asym_ID
      _Atom_chem_shift.Entity_ID
      _Atom_chem_shift.Comp_index_ID
      _Atom_chem_shift.Seq_ID
      _Atom_chem_shift.Comp_ID
      _Atom_chem_shift.Atom_ID
      _Atom_chem_shift.Atom_type
      _Atom_chem_shift.Atom_isotope_number
      _Atom_chem_shift.Val
      _Atom_chem_shift.Val_err
      _Atom_chem_shift.Assign_fig_of_merit
      _Atom_chem_shift.Ambiguity_code
      _Atom_chem_shift.Ambiguity_set_ID
      _Atom_chem_shift.Occupancy
      _Atom_chem_shift.Resonance_ID
      _Atom_chem_shift.Auth_entity_assembly_ID
      _Atom_chem_shift.Auth_asym_ID
      _Atom_chem_shift.Auth_seq_ID
      _Atom_chem_shift.Auth_comp_ID
      _Atom_chem_shift.Auth_atom_ID
      _Atom_chem_shift.Details
      _Atom_chem_shift.Entry_ID
      _Atom_chem_shift.Assigned_chem_shift_list_ID

      1     .   1   .   1   1    1    ACE   H1     H   1    1.948     0.008   .   1   .   .   .   .   .   0    ACE   H1    .   50382   1
      2     .   1   .   1   1    1    ACE   H2     H   1    1.948     0.008   .   1   .   .   .   .   .   0    ACE   H2    .   50382   1
      3     .   1   .   1   1    1    ACE   H3     H   1    1.948     0.008   .   1   .   .   .   .   .   0    ACE   H3    .   50382   1
      4     .   1   .   1   2    2    TYR   H      H   1    8.427     0.002   .   1   .   .   .   .   .   1    TYR   H     .   50382   1
      5     .   1   .   1   2    2    TYR   HA     H   1    4.500     0.003   .   1   .   .   .   .   .   1    TYR   HA    .   50382   1
      6     .   1   .   1   2    2    TYR   HB2    H   1    3.059     0.007   .   2   .   .   .   .   .   1    TYR   HB2   .   50382   1
      7     .   1   .   1   2    2    TYR   HB3    H   1    2.917     0.007   .   2   .   .   .   .   .   1    TYR   HB3   .   50382   1
      8     .   1   .   1   2    2    TYR   HD1    H   1    7.137     0.003   .   1   .   .   .   .   .   1    TYR   HD1   .   50382   1
      9     .   1   .   1   2    2    TYR   HD2    H   1    7.137     0.003   .   1   .   .   .   .   .   1    TYR   HD2   .   50382   1
      10    .   1   .   1   2    2    TYR   HE1    H   1    6.837     0.003   .   1   .   .   .   .   .   1    TYR   HE1   .   50382   1
      11    .   1   .   1   2    2    TYR   HE2    H   1    6.837     0.003   .   1   .   .   .   .   .   1    TYR   HE2   .   50382   1
      12    .   1   .   1   2    2    TYR   CA     C   13   58.470    0.000   .   1   .   .   .   .   .   1    TYR   CA    .   50382   1
      13    .   1   .   1   2    2    TYR   CB     C   13   38.824    0.013   .   1   .   .   .   .   .   1    TYR   CB    .   50382   1
      14    .   1   .   1   2    2    TYR   CD1    C   13   133.217   0.000   .   1   .   .   .   .   .   1    TYR   CD1   .   50382   1
      15    .   1   .   1   2    2    TYR   CD2    C   13   133.217   0.000   .   1   .   .   .   .   .   1    TYR   CD2   .   50382   1
      16    .   1   .   1   2    2    TYR   CE1    C   13   118.231   0.000   .   1   .   .   .   .   .   1    TYR   CE1   .   50382   1
      17    .   1   .   1   2    2    TYR   CE2    C   13   118.231   0.000   .   1   .   .   .   .   .   1    TYR   CE2   .   50382   1
      18    .   1   .   1   3    3    GLY   H      H   1    8.690     0.001   .   1   .   .   .   .   .   2    GLY   H     .   50382   1
      19    .   1   .   1   3    3    GLY   HA2    H   1    3.892     0.008   .   2   .   .   .   .   .   2    GLY   HA2   .   50382   1
      20    .   1   .   1   3    3    GLY   HA3    H   1    3.892     0.008   .   2   .   .   .   .   .   2    GLY   HA3   .   50382   1
      21    .   1   .   1   3    3    GLY   CA     C   13   45.306    0.000   .   1   .   .   .   .   .   2    GLY   CA    .   50382   1
      22    .   1   .   1   4    4    ARG   H      H   1    8.220     0.004   .   1   .   .   .   .   .   3    ARG   H     .   50382   1
      23    .   1   .   1   4    4    ARG   HA     H   1    4.331     0.006   .   1   .   .   .   .   .   3    ARG   HA    .   50382   1
      24    .   1   .   1   4    4    ARG   HB2    H   1    1.898     0.004   .   2   .   .   .   .   .   3    ARG   HB2   .   50382   1
      25    .   1   .   1   4    4    ARG   HB3    H   1    1.756     0.005   .   2   .   .   .   .   .   3    ARG   HB3   .   50382   1
      26    .   1   .   1   4    4    ARG   HG2    H   1    1.602     0.006   .   2   .   .   .   .   .   3    ARG   HG2   .   50382   1
      27    .   1   .   1   4    4    ARG   HG3    H   1    1.602     0.006   .   2   .   .   .   .   .   3    ARG   HG3   .   50382   1
      28    .   1   .   1   4    4    ARG   HD2    H   1    3.194     0.004   .   2   .   .   .   .   .   3    ARG   HD2   .   50382   1
      29    .   1   .   1   4    4    ARG   HD3    H   1    3.194     0.004   .   2   .   .   .   .   .   3    ARG   HD3   .   50382   1
      30    .   1   .   1   4    4    ARG   HE     H   1    7.529     0.001   .   1   .   .   .   .   .   3    ARG   HE    .   50382   1
      31    .   1   .   1   4    4    ARG   CA     C   13   56.240    0.000   .   1   .   .   .   .   .   3    ARG   CA    .   50382   1
      32    .   1   .   1   4    4    ARG   CB     C   13   30.761    0.000   .   1   .   .   .   .   .   3    ARG   CB    .   50382   1
      33    .   1   .   1   4    4    ARG   CG     C   13   27.006    0.000   .   1   .   .   .   .   .   3    ARG   CG    .   50382   1
      34    .   1   .   1   4    4    ARG   CD     C   13   43.230    0.000   .   1   .   .   .   .   .   3    ARG   CD    .   50382   1
      35    .   1   .   1   5    5    GLU   H      H   1    8.850     0.004   .   1   .   .   .   .   .   4    GLU   H     .   50382   1
      36    .   1   .   1   5    5    GLU   HA     H   1    4.265     0.004   .   1   .   .   .   .   .   4    GLU   HA    .   50382   1
      37    .   1   .   1   5    5    GLU   HB2    H   1    2.062     0.007   .   2   .   .   .   .   .   4    GLU   HB2   .   50382   1
      38    .   1   .   1   5    5    GLU   HB3    H   1    1.932     0.004   .   2   .   .   .   .   .   4    GLU   HB3   .   50382   1
      39    .   1   .   1   5    5    GLU   HG2    H   1    2.277     0.005   .   2   .   .   .   .   .   4    GLU   HG2   .   50382   1
      40    .   1   .   1   5    5    GLU   HG3    H   1    2.277     0.005   .   2   .   .   .   .   .   4    GLU   HG3   .   50382   1
      41    .   1   .   1   5    5    GLU   CA     C   13   57.057    0.000   .   1   .   .   .   .   .   4    GLU   CA    .   50382   1
      42    .   1   .   1   5    5    GLU   CB     C   13   29.978    0.001   .   1   .   .   .   .   .   4    GLU   CB    .   50382   1
      43    .   1   .   1   5    5    GLU   CG     C   13   36.364    0.000   .   1   .   .   .   .   .   4    GLU   CG    .   50382   1
      44    .   1   .   1   6    6    ASP   H      H   1    8.483     0.003   .   1   .   .   .   .   .   5    ASP   H     .   50382   1
      45    .   1   .   1   6    6    ASP   HA     H   1    4.568     0.004   .   1   .   .   .   .   .   5    ASP   HA    .   50382   1
      46    .   1   .   1   6    6    ASP   HB2    H   1    2.721     0.002   .   2   .   .   .   .   .   5    ASP   HB2   .   50382   1
      47    .   1   .   1   6    6    ASP   HB3    H   1    2.617     0.002   .   2   .   .   .   .   .   5    ASP   HB3   .   50382   1
      48    .   1   .   1   6    6    ASP   CA     C   13   54.392    0.000   .   1   .   .   .   .   .   5    ASP   CA    .   50382   1
      49    .   1   .   1   6    6    ASP   CB     C   13   40.793    0.013   .   1   .   .   .   .   .   5    ASP   CB    .   50382   1
      50    .   1   .   1   7    7    LEU   H      H   1    8.154     0.007   .   1   .   .   .   .   .   6    LEU   H     .   50382   1
      51    .   1   .   1   7    7    LEU   HA     H   1    4.283     0.003   .   1   .   .   .   .   .   6    LEU   HA    .   50382   1
      52    .   1   .   1   7    7    LEU   HB2    H   1    1.550     0.009   .   2   .   .   .   .   .   6    LEU   HB2   .   50382   1
      53    .   1   .   1   7    7    LEU   HB3    H   1    1.673     0.004   .   2   .   .   .   .   .   6    LEU   HB3   .   50382   1
      54    .   1   .   1   7    7    LEU   HG     H   1    1.607     0.013   .   1   .   .   .   .   .   6    LEU   HG    .   50382   1
      55    .   1   .   1   7    7    LEU   HD11   H   1    0.902     0.002   .   2   .   .   .   .   .   6    LEU   QD1   .   50382   1
      56    .   1   .   1   7    7    LEU   HD12   H   1    0.902     0.002   .   2   .   .   .   .   .   6    LEU   QD1   .   50382   1
      57    .   1   .   1   7    7    LEU   HD13   H   1    0.902     0.002   .   2   .   .   .   .   .   6    LEU   QD1   .   50382   1
      58    .   1   .   1   7    7    LEU   HD21   H   1    0.823     0.002   .   2   .   .   .   .   .   6    LEU   QD2   .   50382   1
      59    .   1   .   1   7    7    LEU   HD22   H   1    0.823     0.002   .   2   .   .   .   .   .   6    LEU   QD2   .   50382   1
      60    .   1   .   1   7    7    LEU   HD23   H   1    0.823     0.002   .   2   .   .   .   .   .   6    LEU   QD2   .   50382   1
      61    .   1   .   1   7    7    LEU   CA     C   13   55.539    0.000   .   1   .   .   .   .   .   6    LEU   CA    .   50382   1
      62    .   1   .   1   7    7    LEU   CB     C   13   42.386    0.027   .   1   .   .   .   .   .   6    LEU   CB    .   50382   1
      63    .   1   .   1   7    7    LEU   CG     C   13   26.944    0.000   .   1   .   .   .   .   .   6    LEU   CG    .   50382   1
      64    .   1   .   1   7    7    LEU   CD1    C   13   25.050    0.000   .   1   .   .   .   .   .   6    LEU   CD1   .   50382   1
      65    .   1   .   1   7    7    LEU   CD2    C   13   23.204    0.000   .   1   .   .   .   .   .   6    LEU   CD2   .   50382   1
      66    .   1   .   1   8    8    ASP   H      H   1    8.422     0.005   .   1   .   .   .   .   .   7    ASP   H     .   50382   1
      67    .   1   .   1   8    8    ASP   HA     H   1    4.601     0.002   .   1   .   .   .   .   .   7    ASP   HA    .   50382   1
      68    .   1   .   1   8    8    ASP   HB2    H   1    2.727     0.006   .   2   .   .   .   .   .   7    ASP   HB2   .   50382   1
      69    .   1   .   1   8    8    ASP   HB3    H   1    2.673     0.004   .   2   .   .   .   .   .   7    ASP   HB3   .   50382   1
      70    .   1   .   1   8    8    ASP   CA     C   13   54.502    0.000   .   1   .   .   .   .   .   7    ASP   CA    .   50382   1
      71    .   1   .   1   8    8    ASP   CB     C   13   40.812    0.004   .   1   .   .   .   .   .   7    ASP   CB    .   50382   1
      72    .   1   .   1   9    9    VAL   H      H   1    8.054     0.005   .   1   .   .   .   .   .   8    VAL   H     .   50382   1
      73    .   1   .   1   9    9    VAL   HA     H   1    3.992     0.003   .   1   .   .   .   .   .   8    VAL   HA    .   50382   1
      74    .   1   .   1   9    9    VAL   HB     H   1    2.155     0.007   .   1   .   .   .   .   .   8    VAL   HB    .   50382   1
      75    .   1   .   1   9    9    VAL   HG11   H   1    0.952     0.008   .   2   .   .   .   .   .   8    VAL   QG1   .   50382   1
      76    .   1   .   1   9    9    VAL   HG12   H   1    0.952     0.008   .   2   .   .   .   .   .   8    VAL   QG1   .   50382   1
      77    .   1   .   1   9    9    VAL   HG13   H   1    0.952     0.008   .   2   .   .   .   .   .   8    VAL   QG1   .   50382   1
      78    .   1   .   1   9    9    VAL   HG21   H   1    0.930     0.005   .   2   .   .   .   .   .   8    VAL   QG2   .   50382   1
      79    .   1   .   1   9    9    VAL   HG22   H   1    0.930     0.005   .   2   .   .   .   .   .   8    VAL   QG2   .   50382   1
      80    .   1   .   1   9    9    VAL   HG23   H   1    0.930     0.005   .   2   .   .   .   .   .   8    VAL   QG2   .   50382   1
      81    .   1   .   1   9    9    VAL   CA     C   13   63.388    0.000   .   1   .   .   .   .   .   8    VAL   CA    .   50382   1
      82    .   1   .   1   9    9    VAL   CB     C   13   32.275    0.000   .   1   .   .   .   .   .   8    VAL   CB    .   50382   1
      83    .   1   .   1   9    9    VAL   CG1    C   13   20.512    0.000   .   1   .   .   .   .   .   8    VAL   CG1   .   50382   1
      84    .   1   .   1   9    9    VAL   CG2    C   13   21.125    0.000   .   1   .   .   .   .   .   8    VAL   CG2   .   50382   1
      85    .   1   .   1   10   10   LEU   H      H   1    8.278     0.003   .   1   .   .   .   .   .   9    LEU   H     .   50382   1
      86    .   1   .   1   10   10   LEU   HA     H   1    4.293     0.003   .   1   .   .   .   .   .   9    LEU   HA    .   50382   1
      87    .   1   .   1   10   10   LEU   HB2    H   1    1.756     0.003   .   2   .   .   .   .   .   9    LEU   HB2   .   50382   1
      88    .   1   .   1   10   10   LEU   HB3    H   1    1.569     0.004   .   2   .   .   .   .   .   9    LEU   HB3   .   50382   1
      89    .   1   .   1   10   10   LEU   HG     H   1    1.639     0.005   .   1   .   .   .   .   .   9    LEU   HG    .   50382   1
      90    .   1   .   1   10   10   LEU   HD11   H   1    0.910     0.000   .   2   .   .   .   .   .   9    LEU   QD1   .   50382   1
      91    .   1   .   1   10   10   LEU   HD12   H   1    0.910     0.000   .   2   .   .   .   .   .   9    LEU   QD1   .   50382   1
      92    .   1   .   1   10   10   LEU   HD13   H   1    0.910     0.000   .   2   .   .   .   .   .   9    LEU   QD1   .   50382   1
      93    .   1   .   1   10   10   LEU   HD21   H   1    0.853     0.001   .   2   .   .   .   .   .   9    LEU   QD2   .   50382   1
      94    .   1   .   1   10   10   LEU   HD22   H   1    0.853     0.001   .   2   .   .   .   .   .   9    LEU   QD2   .   50382   1
      95    .   1   .   1   10   10   LEU   HD23   H   1    0.853     0.001   .   2   .   .   .   .   .   9    LEU   QD2   .   50382   1
      96    .   1   .   1   10   10   LEU   CA     C   13   55.727    0.000   .   1   .   .   .   .   .   9    LEU   CA    .   50382   1
      97    .   1   .   1   10   10   LEU   CB     C   13   41.966    0.006   .   1   .   .   .   .   .   9    LEU   CB    .   50382   1
      98    .   1   .   1   10   10   LEU   CG     C   13   26.960    0.000   .   1   .   .   .   .   .   9    LEU   CG    .   50382   1
      99    .   1   .   1   10   10   LEU   CD1    C   13   25.071    0.000   .   1   .   .   .   .   .   9    LEU   CD1   .   50382   1
      100   .   1   .   1   10   10   LEU   CD2    C   13   23.043    0.000   .   1   .   .   .   .   .   9    LEU   CD2   .   50382   1
      101   .   1   .   1   11   11   GLY   H      H   1    8.303     0.001   .   1   .   .   .   .   .   10   GLY   H     .   50382   1
      102   .   1   .   1   11   11   GLY   HA2    H   1    3.939     0.006   .   2   .   .   .   .   .   10   GLY   HA2   .   50382   1
      103   .   1   .   1   11   11   GLY   HA3    H   1    3.939     0.006   .   2   .   .   .   .   .   10   GLY   HA3   .   50382   1
      104   .   1   .   1   11   11   GLY   CA     C   13   45.788    0.000   .   1   .   .   .   .   .   10   GLY   CA    .   50382   1
      105   .   1   .   1   12   12   LEU   H      H   1    8.221     0.006   .   1   .   .   .   .   .   11   LEU   H     .   50382   1
      106   .   1   .   1   12   12   LEU   HA     H   1    4.339     0.005   .   1   .   .   .   .   .   11   LEU   HA    .   50382   1
      107   .   1   .   1   12   12   LEU   HB2    H   1    1.704     0.004   .   2   .   .   .   .   .   11   LEU   HB2   .   50382   1
      108   .   1   .   1   12   12   LEU   HB3    H   1    1.565     0.003   .   2   .   .   .   .   .   11   LEU   HB3   .   50382   1
      109   .   1   .   1   12   12   LEU   HG     H   1    1.619     0.004   .   1   .   .   .   .   .   11   LEU   HG    .   50382   1
      110   .   1   .   1   12   12   LEU   HD11   H   1    0.931     0.003   .   2   .   .   .   .   .   11   LEU   QD1   .   50382   1
      111   .   1   .   1   12   12   LEU   HD12   H   1    0.931     0.003   .   2   .   .   .   .   .   11   LEU   QD1   .   50382   1
      112   .   1   .   1   12   12   LEU   HD13   H   1    0.931     0.003   .   2   .   .   .   .   .   11   LEU   QD1   .   50382   1
      113   .   1   .   1   12   12   LEU   HD21   H   1    0.869     0.002   .   2   .   .   .   .   .   11   LEU   QD2   .   50382   1
      114   .   1   .   1   12   12   LEU   HD22   H   1    0.869     0.002   .   2   .   .   .   .   .   11   LEU   QD2   .   50382   1
      115   .   1   .   1   12   12   LEU   HD23   H   1    0.869     0.002   .   2   .   .   .   .   .   11   LEU   QD2   .   50382   1
      116   .   1   .   1   12   12   LEU   CA     C   13   55.699    0.000   .   1   .   .   .   .   .   11   LEU   CA    .   50382   1
      117   .   1   .   1   12   12   LEU   CB     C   13   42.395    0.012   .   1   .   .   .   .   .   11   LEU   CB    .   50382   1
      118   .   1   .   1   12   12   LEU   CG     C   13   26.929    0.000   .   1   .   .   .   .   .   11   LEU   CG    .   50382   1
      119   .   1   .   1   12   12   LEU   CD1    C   13   25.063    0.000   .   1   .   .   .   .   .   11   LEU   CD1   .   50382   1
      120   .   1   .   1   12   12   LEU   CD2    C   13   23.148    0.000   .   1   .   .   .   .   .   11   LEU   CD2   .   50382   1
      121   .   1   .   1   13   13   THR   H      H   1    8.203     0.005   .   1   .   .   .   .   .   12   THR   H     .   50382   1
      122   .   1   .   1   13   13   THR   HA     H   1    4.262     0.005   .   1   .   .   .   .   .   12   THR   HA    .   50382   1
      123   .   1   .   1   13   13   THR   HB     H   1    4.140     0.004   .   1   .   .   .   .   .   12   THR   HB    .   50382   1
      124   .   1   .   1   13   13   THR   HG21   H   1    1.146     0.006   .   1   .   .   .   .   .   12   THR   QG2   .   50382   1
      125   .   1   .   1   13   13   THR   HG22   H   1    1.146     0.006   .   1   .   .   .   .   .   12   THR   QG2   .   50382   1
      126   .   1   .   1   13   13   THR   HG23   H   1    1.146     0.006   .   1   .   .   .   .   .   12   THR   QG2   .   50382   1
      127   .   1   .   1   13   13   THR   CA     C   13   62.370    0.000   .   1   .   .   .   .   .   12   THR   CA    .   50382   1
      128   .   1   .   1   13   13   THR   CB     C   13   69.858    0.000   .   1   .   .   .   .   .   12   THR   CB    .   50382   1
      129   .   1   .   1   13   13   THR   CG2    C   13   21.573    0.000   .   1   .   .   .   .   .   12   THR   CG2   .   50382   1
      130   .   1   .   1   14   14   PHE   H      H   1    8.330     0.001   .   1   .   .   .   .   .   13   PHE   H     .   50382   1
      131   .   1   .   1   14   14   PHE   HA     H   1    4.571     0.002   .   1   .   .   .   .   .   13   PHE   HA    .   50382   1
      132   .   1   .   1   14   14   PHE   HB2    H   1    3.096     0.007   .   2   .   .   .   .   .   13   PHE   HB2   .   50382   1
      133   .   1   .   1   14   14   PHE   HB3    H   1    3.096     0.007   .   2   .   .   .   .   .   13   PHE   HB3   .   50382   1
      134   .   1   .   1   14   14   PHE   HD1    H   1    7.256     0.009   .   1   .   .   .   .   .   13   PHE   HD1   .   50382   1
      135   .   1   .   1   14   14   PHE   HD2    H   1    7.256     0.009   .   1   .   .   .   .   .   13   PHE   HD2   .   50382   1
      136   .   1   .   1   14   14   PHE   HE1    H   1    7.347     0.003   .   1   .   .   .   .   .   13   PHE   HE1   .   50382   1
      137   .   1   .   1   14   14   PHE   HE2    H   1    7.347     0.003   .   1   .   .   .   .   .   13   PHE   HE2   .   50382   1
      138   .   1   .   1   14   14   PHE   HZ     H   1    7.298     0.006   .   1   .   .   .   .   .   13   PHE   HZ    .   50382   1
      139   .   1   .   1   14   14   PHE   CA     C   13   58.310    0.000   .   1   .   .   .   .   .   13   PHE   CA    .   50382   1
      140   .   1   .   1   14   14   PHE   CB     C   13   39.533    0.000   .   1   .   .   .   .   .   13   PHE   CB    .   50382   1
      141   .   1   .   1   14   14   PHE   CD1    C   13   131.984   0.000   .   1   .   .   .   .   .   13   PHE   CD1   .   50382   1
      142   .   1   .   1   14   14   PHE   CD2    C   13   131.984   0.000   .   1   .   .   .   .   .   13   PHE   CD2   .   50382   1
      143   .   1   .   1   14   14   PHE   CE1    C   13   131.652   0.000   .   1   .   .   .   .   .   13   PHE   CE1   .   50382   1
      144   .   1   .   1   14   14   PHE   CE2    C   13   131.652   0.000   .   1   .   .   .   .   .   13   PHE   CE2   .   50382   1
      145   .   1   .   1   14   14   PHE   CZ     C   13   130.137   0.000   .   1   .   .   .   .   .   13   PHE   CZ    .   50382   1
      146   .   1   .   1   15   15   ARG   H      H   1    8.311     0.007   .   1   .   .   .   .   .   14   ARG   H     .   50382   1
      147   .   1   .   1   15   15   ARG   HA     H   1    4.204     0.005   .   1   .   .   .   .   .   14   ARG   HA    .   50382   1
      148   .   1   .   1   15   15   ARG   HB2    H   1    1.812     0.002   .   2   .   .   .   .   .   14   ARG   HB2   .   50382   1
      149   .   1   .   1   15   15   ARG   HB3    H   1    1.640     0.004   .   2   .   .   .   .   .   14   ARG   HB3   .   50382   1
      150   .   1   .   1   15   15   ARG   HG2    H   1    1.558     0.007   .   2   .   .   .   .   .   14   ARG   HG2   .   50382   1
      151   .   1   .   1   15   15   ARG   HG3    H   1    1.558     0.007   .   2   .   .   .   .   .   14   ARG   HG3   .   50382   1
      152   .   1   .   1   15   15   ARG   HD2    H   1    3.149     0.003   .   2   .   .   .   .   .   14   ARG   HD2   .   50382   1
      153   .   1   .   1   15   15   ARG   HD3    H   1    3.149     0.003   .   2   .   .   .   .   .   14   ARG   HD3   .   50382   1
      154   .   1   .   1   15   15   ARG   HE     H   1    7.229     0.001   .   1   .   .   .   .   .   14   ARG   HE    .   50382   1
      155   .   1   .   1   15   15   ARG   CA     C   13   55.751    0.000   .   1   .   .   .   .   .   14   ARG   CA    .   50382   1
      156   .   1   .   1   15   15   ARG   CB     C   13   30.758    0.012   .   1   .   .   .   .   .   14   ARG   CB    .   50382   1
      157   .   1   .   1   15   15   ARG   CG     C   13   27.096    0.000   .   1   .   .   .   .   .   14   ARG   CG    .   50382   1
      158   .   1   .   1   15   15   ARG   CD     C   13   43.260    0.000   .   1   .   .   .   .   .   14   ARG   CD    .   50382   1
      159   .   1   .   1   16   16   NH2   HN1    H   1    6.848     0.000   .   2   .   .   .   .   .   15   NH2   HN1   .   50382   1
      160   .   1   .   1   16   16   NH2   HN2    H   1    7.139     0.006   .   2   .   .   .   .   .   15   NH2   HN2   .   50382   1
   stop_
save_