Content for NMR-STAR saveframe, assigned_chemical_shifts_2

    save_assigned_chemical_shifts_2
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chemical_shifts_2
   _Assigned_chem_shift_list.Entry_ID                      53619
   _Assigned_chem_shift_list.ID                            2
   _Assigned_chem_shift_list.Name                          chemical_shift_list_Pin1_250_uM_ligand
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $sample_conditions_1
   _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   250uM   .   .   .   53619   2
   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   .   .   53619   2
   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   23    23    ALA   H   H   1    8.537156736   .   .   .   .   .   .   .   .   7     ALA   H   .   53619   2
      2     .   1   .   1   23    23    ALA   N   N   15   122.5288204   .   .   .   .   .   .   .   .   7     ALA   N   .   53619   2
      3     .   1   .   1   24    24    ARG   H   H   1    7.635102998   .   .   .   .   .   .   .   .   8     ARG   H   .   53619   2
      4     .   1   .   1   24    24    ARG   N   N   15   115.4781647   .   .   .   .   .   .   .   .   8     ARG   N   .   53619   2
      5     .   1   .   1   25    25    VAL   H   H   1    7.788325269   .   .   .   .   .   .   .   .   9     VAL   H   .   53619   2
      6     .   1   .   1   25    25    VAL   N   N   15   113.8144485   .   .   .   .   .   .   .   .   9     VAL   N   .   53619   2
      7     .   1   .   1   26    26    ARG   H   H   1    8.131416394   .   .   .   .   .   .   .   .   10    ARG   H   .   53619   2
      8     .   1   .   1   26    26    ARG   N   N   15   120.8115699   .   .   .   .   .   .   .   .   10    ARG   N   .   53619   2
      9     .   1   .   1   27    27    CYS   H   H   1    7.160840313   .   .   .   .   .   .   .   .   11    CYS   H   .   53619   2
      10    .   1   .   1   27    27    CYS   N   N   15   117.5879368   .   .   .   .   .   .   .   .   11    CYS   N   .   53619   2
      11    .   1   .   1   28    28    SER   H   H   1    9.289794578   .   .   .   .   .   .   .   .   12    SER   H   .   53619   2
      12    .   1   .   1   28    28    SER   N   N   15   116.4875279   .   .   .   .   .   .   .   .   12    SER   N   .   53619   2
      13    .   1   .   1   29    29    HIS   H   H   1    9.725315818   .   .   .   .   .   .   .   .   13    HIS   H   .   53619   2
      14    .   1   .   1   29    29    HIS   N   N   15   120.0928705   .   .   .   .   .   .   .   .   13    HIS   N   .   53619   2
      15    .   1   .   1   30    30    LEU   H   H   1    8.83894232    .   .   .   .   .   .   .   .   14    LEU   H   .   53619   2
      16    .   1   .   1   30    30    LEU   N   N   15   125.2087654   .   .   .   .   .   .   .   .   14    LEU   N   .   53619   2
      17    .   1   .   1   31    31    LEU   H   H   1    8.02090905    .   .   .   .   .   .   .   .   15    LEU   H   .   53619   2
      18    .   1   .   1   31    31    LEU   N   N   15   127.1829008   .   .   .   .   .   .   .   .   15    LEU   N   .   53619   2
      19    .   1   .   1   32    32    VAL   H   H   1    9.45762878    .   .   .   .   .   .   .   .   16    VAL   H   .   53619   2
      20    .   1   .   1   32    32    VAL   N   N   15   128.2428674   .   .   .   .   .   .   .   .   16    VAL   N   .   53619   2
      21    .   1   .   1   33    33    LYS   H   H   1    9.059915047   .   .   .   .   .   .   .   .   17    LYS   H   .   53619   2
      22    .   1   .   1   33    33    LYS   N   N   15   125.4933729   .   .   .   .   .   .   .   .   17    LYS   N   .   53619   2
      23    .   1   .   1   34    34    HIS   H   H   1    8.291588873   .   .   .   .   .   .   .   .   18    HIS   H   .   53619   2
      24    .   1   .   1   34    34    HIS   N   N   15   114.1000248   .   .   .   .   .   .   .   .   18    HIS   N   .   53619   2
      25    .   1   .   1   35    35    SER   H   H   1    9.436696136   .   .   .   .   .   .   .   .   19    SER   H   .   53619   2
      26    .   1   .   1   35    35    SER   N   N   15   113.7728465   .   .   .   .   .   .   .   .   19    SER   N   .   53619   2
      27    .   1   .   1   36    36    GLN   H   H   1    9.124087011   .   .   .   .   .   .   .   .   20    GLN   H   .   53619   2
      28    .   1   .   1   36    36    GLN   N   N   15   120.4673996   .   .   .   .   .   .   .   .   20    GLN   N   .   53619   2
      29    .   1   .   1   37    37    SER   H   H   1    7.783924826   .   .   .   .   .   .   .   .   21    SER   H   .   53619   2
      30    .   1   .   1   37    37    SER   N   N   15   121.277521    .   .   .   .   .   .   .   .   21    SER   N   .   53619   2
      31    .   1   .   1   38    38    ARG   H   H   1    8.020277999   .   .   .   .   .   .   .   .   22    ARG   H   .   53619   2
      32    .   1   .   1   38    38    ARG   N   N   15   123.0213332   .   .   .   .   .   .   .   .   22    ARG   N   .   53619   2
      33    .   1   .   1   41    41    SER   H   H   1    9.117576802   .   .   .   .   .   .   .   .   25    SER   H   .   53619   2
      34    .   1   .   1   41    41    SER   N   N   15   121.422756    .   .   .   .   .   .   .   .   25    SER   N   .   53619   2
      35    .   1   .   1   42    42    SER   H   H   1    8.892082904   .   .   .   .   .   .   .   .   26    SER   H   .   53619   2
      36    .   1   .   1   42    42    SER   N   N   15   118.9545301   .   .   .   .   .   .   .   .   26    SER   N   .   53619   2
      37    .   1   .   1   43    43    TRP   H   H   1    8.407070926   .   .   .   .   .   .   .   .   27    TRP   H   .   53619   2
      38    .   1   .   1   43    43    TRP   N   N   15   121.8549719   .   .   .   .   .   .   .   .   27    TRP   N   .   53619   2
      39    .   1   .   1   44    44    ARG   H   H   1    6.974310222   .   .   .   .   .   .   .   .   28    ARG   H   .   53619   2
      40    .   1   .   1   44    44    ARG   N   N   15   117.7897076   .   .   .   .   .   .   .   .   28    ARG   N   .   53619   2
      41    .   1   .   1   45    45    GLN   H   H   1    6.824492962   .   .   .   .   .   .   .   .   29    GLN   H   .   53619   2
      42    .   1   .   1   45    45    GLN   N   N   15   118.2598601   .   .   .   .   .   .   .   .   29    GLN   N   .   53619   2
      43    .   1   .   1   47    47    LYS   H   H   1    7.920232455   .   .   .   .   .   .   .   .   31    LYS   H   .   53619   2
      44    .   1   .   1   47    47    LYS   N   N   15   117.6466549   .   .   .   .   .   .   .   .   31    LYS   N   .   53619   2
      45    .   1   .   1   48    48    ILE   H   H   1    7.723082296   .   .   .   .   .   .   .   .   32    ILE   H   .   53619   2
      46    .   1   .   1   48    48    ILE   N   N   15   126.1275534   .   .   .   .   .   .   .   .   32    ILE   N   .   53619   2
      47    .   1   .   1   49    49    THR   H   H   1    8.10140432    .   .   .   .   .   .   .   .   33    THR   H   .   53619   2
      48    .   1   .   1   49    49    THR   N   N   15   116.3730369   .   .   .   .   .   .   .   .   33    THR   N   .   53619   2
      49    .   1   .   1   50    50    ARG   H   H   1    7.506074996   .   .   .   .   .   .   .   .   34    ARG   H   .   53619   2
      50    .   1   .   1   50    50    ARG   N   N   15   123.8250167   .   .   .   .   .   .   .   .   34    ARG   N   .   53619   2
      51    .   1   .   1   51    51    THR   H   H   1    8.939229778   .   .   .   .   .   .   .   .   35    THR   H   .   53619   2
      52    .   1   .   1   51    51    THR   N   N   15   113.5471404   .   .   .   .   .   .   .   .   35    THR   N   .   53619   2
      53    .   1   .   1   52    52    LYS   H   H   1    8.783335509   .   .   .   .   .   .   .   .   36    LYS   H   .   53619   2
      54    .   1   .   1   52    52    LYS   N   N   15   122.3690103   .   .   .   .   .   .   .   .   36    LYS   N   .   53619   2
      55    .   1   .   1   53    53    GLU   H   H   1    8.485843005   .   .   .   .   .   .   .   .   37    GLU   H   .   53619   2
      56    .   1   .   1   53    53    GLU   N   N   15   118.3529035   .   .   .   .   .   .   .   .   37    GLU   N   .   53619   2
      57    .   1   .   1   54    54    GLU   H   H   1    7.869929539   .   .   .   .   .   .   .   .   38    GLU   H   .   53619   2
      58    .   1   .   1   54    54    GLU   N   N   15   121.7396511   .   .   .   .   .   .   .   .   38    GLU   N   .   53619   2
      59    .   1   .   1   55    55    ALA   H   H   1    8.568070764   .   .   .   .   .   .   .   .   39    ALA   H   .   53619   2
      60    .   1   .   1   55    55    ALA   N   N   15   121.9320391   .   .   .   .   .   .   .   .   39    ALA   N   .   53619   2
      61    .   1   .   1   56    56    LEU   H   H   1    8.312985042   .   .   .   .   .   .   .   .   40    LEU   H   .   53619   2
      62    .   1   .   1   56    56    LEU   N   N   15   119.2248052   .   .   .   .   .   .   .   .   40    LEU   N   .   53619   2
      63    .   1   .   1   57    57    GLU   H   H   1    7.601905827   .   .   .   .   .   .   .   .   41    GLU   H   .   53619   2
      64    .   1   .   1   57    57    GLU   N   N   15   119.2471007   .   .   .   .   .   .   .   .   41    GLU   N   .   53619   2
      65    .   1   .   1   58    58    LEU   H   H   1    7.671839117   .   .   .   .   .   .   .   .   42    LEU   H   .   53619   2
      66    .   1   .   1   58    58    LEU   N   N   15   121.1184272   .   .   .   .   .   .   .   .   42    LEU   N   .   53619   2
      67    .   1   .   1   59    59    ILE   H   H   1    7.924888867   .   .   .   .   .   .   .   .   43    ILE   H   .   53619   2
      68    .   1   .   1   59    59    ILE   N   N   15   119.6798663   .   .   .   .   .   .   .   .   43    ILE   N   .   53619   2
      69    .   1   .   1   60    60    ASN   H   H   1    8.644976181   .   .   .   .   .   .   .   .   44    ASN   H   .   53619   2
      70    .   1   .   1   60    60    ASN   N   N   15   118.8655556   .   .   .   .   .   .   .   .   44    ASN   N   .   53619   2
      71    .   1   .   1   61    61    GLY   H   H   1    7.882672215   .   .   .   .   .   .   .   .   45    GLY   H   .   53619   2
      72    .   1   .   1   61    61    GLY   N   N   15   110.1384476   .   .   .   .   .   .   .   .   45    GLY   N   .   53619   2
      73    .   1   .   1   62    62    TYR   H   H   1    8.01404191    .   .   .   .   .   .   .   .   46    TYR   H   .   53619   2
      74    .   1   .   1   62    62    TYR   N   N   15   122.6626118   .   .   .   .   .   .   .   .   46    TYR   N   .   53619   2
      75    .   1   .   1   63    63    ILE   H   H   1    8.549154598   .   .   .   .   .   .   .   .   47    ILE   H   .   53619   2
      76    .   1   .   1   63    63    ILE   N   N   15   118.7926506   .   .   .   .   .   .   .   .   47    ILE   N   .   53619   2
      77    .   1   .   1   64    64    GLN   H   H   1    7.705837719   .   .   .   .   .   .   .   .   48    GLN   H   .   53619   2
      78    .   1   .   1   64    64    GLN   N   N   15   117.4587599   .   .   .   .   .   .   .   .   48    GLN   N   .   53619   2
      79    .   1   .   1   65    65    LYS   H   H   1    7.969575046   .   .   .   .   .   .   .   .   49    LYS   H   .   53619   2
      80    .   1   .   1   65    65    LYS   N   N   15   120.1500023   .   .   .   .   .   .   .   .   49    LYS   N   .   53619   2
      81    .   1   .   1   66    66    ILE   H   H   1    8.092291063   .   .   .   .   .   .   .   .   50    ILE   H   .   53619   2
      82    .   1   .   1   66    66    ILE   N   N   15   120.0290426   .   .   .   .   .   .   .   .   50    ILE   N   .   53619   2
      83    .   1   .   1   67    67    LYS   H   H   1    8.948337042   .   .   .   .   .   .   .   .   51    LYS   H   .   53619   2
      84    .   1   .   1   67    67    LYS   N   N   15   120.8776797   .   .   .   .   .   .   .   .   51    LYS   N   .   53619   2
      85    .   1   .   1   68    68    SER   H   H   1    8.067153534   .   .   .   .   .   .   .   .   52    SER   H   .   53619   2
      86    .   1   .   1   68    68    SER   N   N   15   111.5219301   .   .   .   .   .   .   .   .   52    SER   N   .   53619   2
      87    .   1   .   1   69    69    GLY   H   H   1    7.742201294   .   .   .   .   .   .   .   .   53    GLY   H   .   53619   2
      88    .   1   .   1   69    69    GLY   N   N   15   110.2580641   .   .   .   .   .   .   .   .   53    GLY   N   .   53619   2
      89    .   1   .   1   70    70    GLU   H   H   1    8.183908498   .   .   .   .   .   .   .   .   54    GLU   H   .   53619   2
      90    .   1   .   1   70    70    GLU   N   N   15   121.6378953   .   .   .   .   .   .   .   .   54    GLU   N   .   53619   2
      91    .   1   .   1   71    71    GLU   H   H   1    7.303257155   .   .   .   .   .   .   .   .   55    GLU   H   .   53619   2
      92    .   1   .   1   71    71    GLU   N   N   15   114.3357647   .   .   .   .   .   .   .   .   55    GLU   N   .   53619   2
      93    .   1   .   1   72    72    ASP   H   H   1    8.269744834   .   .   .   .   .   .   .   .   56    ASP   H   .   53619   2
      94    .   1   .   1   72    72    ASP   N   N   15   118.5783525   .   .   .   .   .   .   .   .   56    ASP   N   .   53619   2
      95    .   1   .   1   73    73    PHE   H   H   1    9.014020392   .   .   .   .   .   .   .   .   57    PHE   H   .   53619   2
      96    .   1   .   1   73    73    PHE   N   N   15   122.2106393   .   .   .   .   .   .   .   .   57    PHE   N   .   53619   2
      97    .   1   .   1   74    74    GLU   H   H   1    8.891395279   .   .   .   .   .   .   .   .   58    GLU   H   .   53619   2
      98    .   1   .   1   74    74    GLU   N   N   15   116.6460513   .   .   .   .   .   .   .   .   58    GLU   N   .   53619   2
      99    .   1   .   1   75    75    SER   H   H   1    8.02085137    .   .   .   .   .   .   .   .   59    SER   H   .   53619   2
      100   .   1   .   1   75    75    SER   N   N   15   115.9959007   .   .   .   .   .   .   .   .   59    SER   N   .   53619   2
      101   .   1   .   1   76    76    LEU   H   H   1    7.641265357   .   .   .   .   .   .   .   .   60    LEU   H   .   53619   2
      102   .   1   .   1   76    76    LEU   N   N   15   120.7826721   .   .   .   .   .   .   .   .   60    LEU   N   .   53619   2
      103   .   1   .   1   77    77    ALA   H   H   1    8.721988723   .   .   .   .   .   .   .   .   61    ALA   H   .   53619   2
      104   .   1   .   1   77    77    ALA   N   N   15   122.5488466   .   .   .   .   .   .   .   .   61    ALA   N   .   53619   2
      105   .   1   .   1   78    78    SER   H   H   1    7.626827967   .   .   .   .   .   .   .   .   62    SER   H   .   53619   2
      106   .   1   .   1   78    78    SER   N   N   15   108.4580146   .   .   .   .   .   .   .   .   62    SER   N   .   53619   2
      107   .   1   .   1   79    79    GLN   H   H   1    6.786852829   .   .   .   .   .   .   .   .   63    GLN   H   .   53619   2
      108   .   1   .   1   79    79    GLN   N   N   15   115.0304981   .   .   .   .   .   .   .   .   63    GLN   N   .   53619   2
      109   .   1   .   1   80    80    PHE   H   H   1    8.061811024   .   .   .   .   .   .   .   .   64    PHE   H   .   53619   2
      110   .   1   .   1   80    80    PHE   N   N   15   112.6001324   .   .   .   .   .   .   .   .   64    PHE   N   .   53619   2
      111   .   1   .   1   81    81    SER   H   H   1    7.777649101   .   .   .   .   .   .   .   .   65    SER   H   .   53619   2
      112   .   1   .   1   81    81    SER   N   N   15   111.3612323   .   .   .   .   .   .   .   .   65    SER   N   .   53619   2
      113   .   1   .   1   82    82    ASP   H   H   1    9.853368246   .   .   .   .   .   .   .   .   66    ASP   H   .   53619   2
      114   .   1   .   1   82    82    ASP   N   N   15   124.6123953   .   .   .   .   .   .   .   .   66    ASP   N   .   53619   2
      115   .   1   .   1   83    83    CYS   H   H   1    8.045616692   .   .   .   .   .   .   .   .   67    CYS   H   .   53619   2
      116   .   1   .   1   83    83    CYS   N   N   15   123.1054109   .   .   .   .   .   .   .   .   67    CYS   N   .   53619   2
      117   .   1   .   1   84    84    SER   H   H   1    8.737637635   .   .   .   .   .   .   .   .   68    SER   H   .   53619   2
      118   .   1   .   1   84    84    SER   N   N   15   127.224283    .   .   .   .   .   .   .   .   68    SER   N   .   53619   2
      119   .   1   .   1   85    85    SER   H   H   1    9.780988069   .   .   .   .   .   .   .   .   69    SER   H   .   53619   2
      120   .   1   .   1   85    85    SER   N   N   15   123.4049824   .   .   .   .   .   .   .   .   69    SER   N   .   53619   2
      121   .   1   .   1   86    86    ALA   H   H   1    8.472804115   .   .   .   .   .   .   .   .   70    ALA   H   .   53619   2
      122   .   1   .   1   86    86    ALA   N   N   15   132.1672754   .   .   .   .   .   .   .   .   70    ALA   N   .   53619   2
      123   .   1   .   1   87    87    LYS   H   H   1    6.972801329   .   .   .   .   .   .   .   .   71    LYS   H   .   53619   2
      124   .   1   .   1   87    87    LYS   N   N   15   113.8318173   .   .   .   .   .   .   .   .   71    LYS   N   .   53619   2
      125   .   1   .   1   88    88    ALA   H   H   1    7.66683542    .   .   .   .   .   .   .   .   72    ALA   H   .   53619   2
      126   .   1   .   1   88    88    ALA   N   N   15   124.2393631   .   .   .   .   .   .   .   .   72    ALA   N   .   53619   2
      127   .   1   .   1   89    89    ARG   H   H   1    7.99983088    .   .   .   .   .   .   .   .   73    ARG   H   .   53619   2
      128   .   1   .   1   89    89    ARG   N   N   15   115.2415406   .   .   .   .   .   .   .   .   73    ARG   N   .   53619   2
      129   .   1   .   1   91    91    ASP   H   H   1    7.098362924   .   .   .   .   .   .   .   .   75    ASP   H   .   53619   2
      130   .   1   .   1   91    91    ASP   N   N   15   118.6664444   .   .   .   .   .   .   .   .   75    ASP   N   .   53619   2
      131   .   1   .   1   92    92    LEU   H   H   1    8.70957893    .   .   .   .   .   .   .   .   76    LEU   H   .   53619   2
      132   .   1   .   1   92    92    LEU   N   N   15   125.582519    .   .   .   .   .   .   .   .   76    LEU   N   .   53619   2
      133   .   1   .   1   93    93    GLY   H   H   1    8.234809393   .   .   .   .   .   .   .   .   77    GLY   H   .   53619   2
      134   .   1   .   1   93    93    GLY   N   N   15   108.8681461   .   .   .   .   .   .   .   .   77    GLY   N   .   53619   2
      135   .   1   .   1   94    94    ALA   H   H   1    8.041039938   .   .   .   .   .   .   .   .   78    ALA   H   .   53619   2
      136   .   1   .   1   94    94    ALA   N   N   15   119.2058273   .   .   .   .   .   .   .   .   78    ALA   N   .   53619   2
      137   .   1   .   1   95    95    PHE   H   H   1    8.850542906   .   .   .   .   .   .   .   .   79    PHE   H   .   53619   2
      138   .   1   .   1   95    95    PHE   N   N   15   117.7220634   .   .   .   .   .   .   .   .   79    PHE   N   .   53619   2
      139   .   1   .   1   96    96    SER   H   H   1    8.407490711   .   .   .   .   .   .   .   .   80    SER   H   .   53619   2
      140   .   1   .   1   96    96    SER   N   N   15   113.8451522   .   .   .   .   .   .   .   .   80    SER   N   .   53619   2
      141   .   1   .   1   97    97    ARG   H   H   1    8.837250784   .   .   .   .   .   .   .   .   81    ARG   H   .   53619   2
      142   .   1   .   1   97    97    ARG   N   N   15   121.3872951   .   .   .   .   .   .   .   .   81    ARG   N   .   53619   2
      143   .   1   .   1   98    98    GLY   H   H   1    10.23184839   .   .   .   .   .   .   .   .   82    GLY   H   .   53619   2
      144   .   1   .   1   98    98    GLY   N   N   15   112.5535274   .   .   .   .   .   .   .   .   82    GLY   N   .   53619   2
      145   .   1   .   1   99    99    GLN   H   H   1    7.786408828   .   .   .   .   .   .   .   .   83    GLN   H   .   53619   2
      146   .   1   .   1   99    99    GLN   N   N   15   118.892907    .   .   .   .   .   .   .   .   83    GLN   N   .   53619   2
      147   .   1   .   1   100   100   MET   H   H   1    9.040917854   .   .   .   .   .   .   .   .   84    MET   H   .   53619   2
      148   .   1   .   1   100   100   MET   N   N   15   118.1829978   .   .   .   .   .   .   .   .   84    MET   N   .   53619   2
      149   .   1   .   1   104   104   PHE   H   H   1    6.918037743   .   .   .   .   .   .   .   .   88    PHE   H   .   53619   2
      150   .   1   .   1   104   104   PHE   N   N   15   116.3255741   .   .   .   .   .   .   .   .   88    PHE   N   .   53619   2
      151   .   1   .   1   105   105   GLU   H   H   1    8.637966115   .   .   .   .   .   .   .   .   89    GLU   H   .   53619   2
      152   .   1   .   1   105   105   GLU   N   N   15   123.0452055   .   .   .   .   .   .   .   .   89    GLU   N   .   53619   2
      153   .   1   .   1   106   106   ASP   H   H   1    9.098705469   .   .   .   .   .   .   .   .   90    ASP   H   .   53619   2
      154   .   1   .   1   106   106   ASP   N   N   15   118.8058578   .   .   .   .   .   .   .   .   90    ASP   N   .   53619   2
      155   .   1   .   1   107   107   ALA   H   H   1    7.058323743   .   .   .   .   .   .   .   .   91    ALA   H   .   53619   2
      156   .   1   .   1   107   107   ALA   N   N   15   118.9835706   .   .   .   .   .   .   .   .   91    ALA   N   .   53619   2
      157   .   1   .   1   108   108   SER   H   H   1    7.846152516   .   .   .   .   .   .   .   .   92    SER   H   .   53619   2
      158   .   1   .   1   108   108   SER   N   N   15   113.8011388   .   .   .   .   .   .   .   .   92    SER   N   .   53619   2
      159   .   1   .   1   109   109   PHE   H   H   1    8.176244614   .   .   .   .   .   .   .   .   93    PHE   H   .   53619   2
      160   .   1   .   1   109   109   PHE   N   N   15   115.1115975   .   .   .   .   .   .   .   .   93    PHE   N   .   53619   2
      161   .   1   .   1   110   110   ALA   H   H   1    6.908344753   .   .   .   .   .   .   .   .   94    ALA   H   .   53619   2
      162   .   1   .   1   110   110   ALA   N   N   15   118.9723507   .   .   .   .   .   .   .   .   94    ALA   N   .   53619   2
      163   .   1   .   1   111   111   LEU   H   H   1    6.862026629   .   .   .   .   .   .   .   .   95    LEU   H   .   53619   2
      164   .   1   .   1   111   111   LEU   N   N   15   120.016809    .   .   .   .   .   .   .   .   95    LEU   N   .   53619   2
      165   .   1   .   1   112   112   ARG   H   H   1    8.793351773   .   .   .   .   .   .   .   .   96    ARG   H   .   53619   2
      166   .   1   .   1   112   112   ARG   N   N   15   122.0369536   .   .   .   .   .   .   .   .   96    ARG   N   .   53619   2
      167   .   1   .   1   113   113   THR   H   H   1    8.412453701   .   .   .   .   .   .   .   .   97    THR   H   .   53619   2
      168   .   1   .   1   113   113   THR   N   N   15   116.9436219   .   .   .   .   .   .   .   .   97    THR   N   .   53619   2
      169   .   1   .   1   114   114   GLY   H   H   1    8.866187024   .   .   .   .   .   .   .   .   98    GLY   H   .   53619   2
      170   .   1   .   1   114   114   GLY   N   N   15   115.5594377   .   .   .   .   .   .   .   .   98    GLY   N   .   53619   2
      171   .   1   .   1   115   115   GLU   H   H   1    8.087158164   .   .   .   .   .   .   .   .   99    GLU   H   .   53619   2
      172   .   1   .   1   115   115   GLU   N   N   15   122.1126525   .   .   .   .   .   .   .   .   99    GLU   N   .   53619   2
      173   .   1   .   1   116   116   MET   H   H   1    8.161125157   .   .   .   .   .   .   .   .   100   MET   H   .   53619   2
      174   .   1   .   1   116   116   MET   N   N   15   123.035403    .   .   .   .   .   .   .   .   100   MET   N   .   53619   2
      175   .   1   .   1   117   117   SER   H   H   1    9.623256525   .   .   .   .   .   .   .   .   101   SER   H   .   53619   2
      176   .   1   .   1   117   117   SER   N   N   15   123.5654637   .   .   .   .   .   .   .   .   101   SER   N   .   53619   2
      177   .   1   .   1   118   118   GLY   H   H   1    7.707539192   .   .   .   .   .   .   .   .   102   GLY   H   .   53619   2
      178   .   1   .   1   118   118   GLY   N   N   15   103.1260719   .   .   .   .   .   .   .   .   102   GLY   N   .   53619   2
      179   .   1   .   1   120   120   VAL   H   H   1    9.145498891   .   .   .   .   .   .   .   .   104   VAL   H   .   53619   2
      180   .   1   .   1   120   120   VAL   N   N   15   127.3363347   .   .   .   .   .   .   .   .   104   VAL   N   .   53619   2
      181   .   1   .   1   121   121   PHE   H   H   1    9.03374917    .   .   .   .   .   .   .   .   105   PHE   H   .   53619   2
      182   .   1   .   1   121   121   PHE   N   N   15   127.9032053   .   .   .   .   .   .   .   .   105   PHE   N   .   53619   2
      183   .   1   .   1   122   122   THR   H   H   1    8.98545195    .   .   .   .   .   .   .   .   106   THR   H   .   53619   2
      184   .   1   .   1   122   122   THR   N   N   15   112.7670752   .   .   .   .   .   .   .   .   106   THR   N   .   53619   2
      185   .   1   .   1   123   123   ASP   H   H   1    8.943326939   .   .   .   .   .   .   .   .   107   ASP   H   .   53619   2
      186   .   1   .   1   123   123   ASP   N   N   15   117.6787691   .   .   .   .   .   .   .   .   107   ASP   N   .   53619   2
      187   .   1   .   1   124   124   SER   H   H   1    9.012821274   .   .   .   .   .   .   .   .   108   SER   H   .   53619   2
      188   .   1   .   1   124   124   SER   N   N   15   114.8180964   .   .   .   .   .   .   .   .   108   SER   N   .   53619   2
      189   .   1   .   1   125   125   GLY   H   H   1    7.607199065   .   .   .   .   .   .   .   .   109   GLY   H   .   53619   2
      190   .   1   .   1   125   125   GLY   N   N   15   110.4380106   .   .   .   .   .   .   .   .   109   GLY   N   .   53619   2
      191   .   1   .   1   126   126   ILE   H   H   1    8.242366953   .   .   .   .   .   .   .   .   110   ILE   H   .   53619   2
      192   .   1   .   1   126   126   ILE   N   N   15   123.2768054   .   .   .   .   .   .   .   .   110   ILE   N   .   53619   2
      193   .   1   .   1   127   127   HIS   H   H   1    9.838538468   .   .   .   .   .   .   .   .   111   HIS   H   .   53619   2
      194   .   1   .   1   127   127   HIS   N   N   15   124.3646257   .   .   .   .   .   .   .   .   111   HIS   N   .   53619   2
      195   .   1   .   1   128   128   ILE   H   H   1    8.462249237   .   .   .   .   .   .   .   .   112   ILE   H   .   53619   2
      196   .   1   .   1   128   128   ILE   N   N   15   115.7546999   .   .   .   .   .   .   .   .   112   ILE   N   .   53619   2
      197   .   1   .   1   129   129   ILE   H   H   1    8.72383128    .   .   .   .   .   .   .   .   113   ILE   H   .   53619   2
      198   .   1   .   1   129   129   ILE   N   N   15   125.5059264   .   .   .   .   .   .   .   .   113   ILE   N   .   53619   2
      199   .   1   .   1   130   130   LEU   H   H   1    8.741860552   .   .   .   .   .   .   .   .   114   LEU   H   .   53619   2
      200   .   1   .   1   130   130   LEU   N   N   15   128.7439705   .   .   .   .   .   .   .   .   114   LEU   N   .   53619   2
      201   .   1   .   1   131   131   ARG   H   H   1    8.007514463   .   .   .   .   .   .   .   .   115   ARG   H   .   53619   2
      202   .   1   .   1   131   131   ARG   N   N   15   127.3915153   .   .   .   .   .   .   .   .   115   ARG   N   .   53619   2
      203   .   1   .   1   132   132   THR   H   H   1    9.002961153   .   .   .   .   .   .   .   .   116   THR   H   .   53619   2
      204   .   1   .   1   132   132   THR   N   N   15   120.9577025   .   .   .   .   .   .   .   .   116   THR   N   .   53619   2
      205   .   1   .   1   133   133   GLU   H   H   1    7.892026603   .   .   .   .   .   .   .   .   117   GLU   H   .   53619   2
      206   .   1   .   1   133   133   GLU   N   N   15   126.1333101   .   .   .   .   .   .   .   .   117   GLU   N   .   53619   2
   stop_
save_