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                      50451
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Name                          PDZ2_assign
   _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

      1   '2D 1H-15N TROSY'   .   .   .   50451   1
      2   '3D HNCA'           .   .   .   50451   1
      3   '3D HNCO'           .   .   .   50451   1
      4   '3D HNCACB'         .   .   .   50451   1
   stop_

   loop_
      _Systematic_chem_shift_offset.Type
      _Systematic_chem_shift_offset.Atom_type
      _Systematic_chem_shift_offset.Atom_isotope_number
      _Systematic_chem_shift_offset.Val
      _Systematic_chem_shift_offset.Val_err
      _Systematic_chem_shift_offset.Entry_ID
      _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID

      'TROSY offset'   'all nitrogens'   15   45   .   50451   1
      'TROSY offset'   'all 1H'          1    45   .   50451   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

      1   $software_1   .   .   50451   1
      2   $software_2   .   .   50451   1
      3   $software_3   .   .   50451   1
      4   $software_4   .   .   50451   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   9    9    ILE   H    H   1    7.673     0.020   .   1   .   .   .   .   .   367   ILE   H    .   50451   1
      2     .   1   .   1   9    9    ILE   CA   C   13   60.794    0.3     .   1   .   .   .   .   .   367   ILE   CA   .   50451   1
      3     .   1   .   1   9    9    ILE   CB   C   13   37.696    0.3     .   1   .   .   .   .   .   367   ILE   CB   .   50451   1
      4     .   1   .   1   9    9    ILE   N    N   15   120.066   0.3     .   1   .   .   .   .   .   367   ILE   N    .   50451   1
      5     .   1   .   1   14   14   GLU   H    H   1    8.691     0.020   .   1   .   .   .   .   .   372   GLU   H    .   50451   1
      6     .   1   .   1   14   14   GLU   CA   C   13   59.121    0.3     .   1   .   .   .   .   .   372   GLU   CA   .   50451   1
      7     .   1   .   1   14   14   GLU   CB   C   13   29.767    0.3     .   1   .   .   .   .   .   372   GLU   CB   .   50451   1
      8     .   1   .   1   14   14   GLU   N    N   15   128.350   0.3     .   1   .   .   .   .   .   372   GLU   N    .   50451   1
      9     .   1   .   1   15   15   GLY   H    H   1    8.819     0.020   .   1   .   .   .   .   .   373   GLY   H    .   50451   1
      10    .   1   .   1   15   15   GLY   CA   C   13   45.134    0.3     .   1   .   .   .   .   .   373   GLY   CA   .   50451   1
      11    .   1   .   1   15   15   GLY   N    N   15   113.718   0.3     .   1   .   .   .   .   .   373   GLY   N    .   50451   1
      12    .   1   .   1   16   16   ALA   H    H   1    8.522     0.020   .   1   .   .   .   .   .   374   ALA   H    .   50451   1
      13    .   1   .   1   16   16   ALA   CA   C   13   49.767    0.3     .   1   .   .   .   .   .   374   ALA   CA   .   50451   1
      14    .   1   .   1   16   16   ALA   CB   C   13   21.482    0.3     .   1   .   .   .   .   .   374   ALA   CB   .   50451   1
      15    .   1   .   1   16   16   ALA   N    N   15   123.028   0.3     .   1   .   .   .   .   .   374   ALA   N    .   50451   1
      16    .   1   .   1   17   17   GLU   H    H   1    8.325     0.020   .   1   .   .   .   .   .   375   GLU   H    .   50451   1
      17    .   1   .   1   17   17   GLU   CA   C   13   55.736    0.3     .   1   .   .   .   .   .   375   GLU   CA   .   50451   1
      18    .   1   .   1   17   17   GLU   CB   C   13   32.172    0.3     .   1   .   .   .   .   .   375   GLU   CB   .   50451   1
      19    .   1   .   1   17   17   GLU   N    N   15   122.559   0.3     .   1   .   .   .   .   .   375   GLU   N    .   50451   1
      20    .   1   .   1   18   18   MET   H    H   1    8.888     0.020   .   1   .   .   .   .   .   376   MET   H    .   50451   1
      21    .   1   .   1   18   18   MET   CA   C   13   54.845    0.3     .   1   .   .   .   .   .   376   MET   CA   .   50451   1
      22    .   1   .   1   18   18   MET   CB   C   13   37.161    0.3     .   1   .   .   .   .   .   376   MET   CB   .   50451   1
      23    .   1   .   1   18   18   MET   N    N   15   123.889   0.3     .   1   .   .   .   .   .   376   MET   N    .   50451   1
      24    .   1   .   1   19   19   SER   H    H   1    9.214     0.020   .   1   .   .   .   .   .   377   SER   H    .   50451   1
      25    .   1   .   1   19   19   SER   CA   C   13   57.606    0.3     .   1   .   .   .   .   .   377   SER   CA   .   50451   1
      26    .   1   .   1   19   19   SER   CB   C   13   66.381    0.3     .   1   .   .   .   .   .   377   SER   CB   .   50451   1
      27    .   1   .   1   19   19   SER   N    N   15   114.423   0.3     .   1   .   .   .   .   .   377   SER   N    .   50451   1
      28    .   1   .   1   21   21   LYS   H    H   1    8.971     0.020   .   1   .   .   .   .   .   379   LYS   H    .   50451   1
      29    .   1   .   1   21   21   LYS   CA   C   13   57.339    0.3     .   1   .   .   .   .   .   379   LYS   CA   .   50451   1
      30    .   1   .   1   21   21   LYS   CB   C   13   38.015    0.3     .   1   .   .   .   .   .   379   LYS   CB   .   50451   1
      31    .   1   .   1   21   21   LYS   N    N   15   126.181   0.3     .   1   .   .   .   .   .   379   LYS   N    .   50451   1
      32    .   1   .   1   24   24   ASP   H    H   1    8.783     0.020   .   1   .   .   .   .   .   382   ASP   H    .   50451   1
      33    .   1   .   1   24   24   ASP   CA   C   13   55.914    0.3     .   1   .   .   .   .   .   382   ASP   CA   .   50451   1
      34    .   1   .   1   24   24   ASP   CB   C   13   39.032    0.3     .   1   .   .   .   .   .   382   ASP   CB   .   50451   1
      35    .   1   .   1   24   24   ASP   N    N   15   118.886   0.3     .   1   .   .   .   .   .   382   ASP   N    .   50451   1
      36    .   1   .   1   25   25   GLN   H    H   1    7.746     0.020   .   1   .   .   .   .   .   383   GLN   H    .   50451   1
      37    .   1   .   1   25   25   GLN   CA   C   13   55.513    0.3     .   1   .   .   .   .   .   383   GLN   CA   .   50451   1
      38    .   1   .   1   25   25   GLN   CB   C   13   29.926    0.3     .   1   .   .   .   .   .   383   GLN   CB   .   50451   1
      39    .   1   .   1   25   25   GLN   N    N   15   114.515   0.3     .   1   .   .   .   .   .   383   GLN   N    .   50451   1
      40    .   1   .   1   26   26   GLY   H    H   1    8.295     0.020   .   1   .   .   .   .   .   384   GLY   H    .   50451   1
      41    .   1   .   1   26   26   GLY   CA   C   13   43.442    0.3     .   1   .   .   .   .   .   384   GLY   CA   .   50451   1
      42    .   1   .   1   26   26   GLY   N    N   15   106.619   0.3     .   1   .   .   .   .   .   384   GLY   N    .   50451   1
      43    .   1   .   1   28   28   VAL   H    H   1    9.544     0.020   .   1   .   .   .   .   .   386   VAL   H    .   50451   1
      44    .   1   .   1   28   28   VAL   CA   C   13   59.993    0.3     .   1   .   .   .   .   .   386   VAL   CA   .   50451   1
      45    .   1   .   1   28   28   VAL   CB   C   13   34.884    0.3     .   1   .   .   .   .   .   386   VAL   CB   .   50451   1
      46    .   1   .   1   28   28   VAL   N    N   15   128.025   0.3     .   1   .   .   .   .   .   386   VAL   N    .   50451   1
      47    .   1   .   1   29   29   VAL   H    H   1    9.048     0.020   .   1   .   .   .   .   .   387   VAL   H    .   50451   1
      48    .   1   .   1   29   29   VAL   CA   C   13   62.239    0.3     .   1   .   .   .   .   .   387   VAL   CA   .   50451   1
      49    .   1   .   1   29   29   VAL   CB   C   13   31.014    0.3     .   1   .   .   .   .   .   387   VAL   CB   .   50451   1
      50    .   1   .   1   29   29   VAL   N    N   15   126.747   0.3     .   1   .   .   .   .   .   387   VAL   N    .   50451   1
      51    .   1   .   1   30   30   ASN   H    H   1    9.477     0.020   .   1   .   .   .   .   .   388   ASN   H    .   50451   1
      52    .   1   .   1   30   30   ASN   CA   C   13   55.290    0.3     .   1   .   .   .   .   .   388   ASN   CA   .   50451   1
      53    .   1   .   1   30   30   ASN   CB   C   13   40.171    0.3     .   1   .   .   .   .   .   388   ASN   CB   .   50451   1
      54    .   1   .   1   30   30   ASN   N    N   15   128.705   0.3     .   1   .   .   .   .   .   388   ASN   N    .   50451   1
      55    .   1   .   1   31   31   ASN   H    H   1    7.840     0.020   .   1   .   .   .   .   .   389   ASN   H    .   50451   1
      56    .   1   .   1   31   31   ASN   CA   C   13   53.687    0.3     .   1   .   .   .   .   .   389   ASN   CA   .   50451   1
      57    .   1   .   1   31   31   ASN   CB   C   13   42.150    0.3     .   1   .   .   .   .   .   389   ASN   CB   .   50451   1
      58    .   1   .   1   31   31   ASN   N    N   15   113.511   0.3     .   1   .   .   .   .   .   389   ASN   N    .   50451   1
      59    .   1   .   1   35   35   GLY   H    H   1    9.159     0.020   .   1   .   .   .   .   .   393   GLY   H    .   50451   1
      60    .   1   .   1   35   35   GLY   CA   C   13   46.203    0.3     .   1   .   .   .   .   .   393   GLY   CA   .   50451   1
      61    .   1   .   1   36   36   THR   H    H   1    7.317     0.020   .   1   .   .   .   .   .   394   THR   H    .   50451   1
      62    .   1   .   1   36   36   THR   CA   C   13   59.920    0.3     .   1   .   .   .   .   .   394   THR   CA   .   50451   1
      63    .   1   .   1   36   36   THR   CB   C   13   69.787    0.3     .   1   .   .   .   .   .   394   THR   CB   .   50451   1
      64    .   1   .   1   36   36   THR   N    N   15   108.876   0.3     .   1   .   .   .   .   .   394   THR   N    .   50451   1
      65    .   1   .   1   38   38   ALA   H    H   1    8.519     0.020   .   1   .   .   .   .   .   396   ALA   H    .   50451   1
      66    .   1   .   1   38   38   ALA   CA   C   13   55.290    0.3     .   1   .   .   .   .   .   396   ALA   CA   .   50451   1
      67    .   1   .   1   38   38   ALA   CB   C   13   20.235    0.3     .   1   .   .   .   .   .   396   ALA   CB   .   50451   1
      68    .   1   .   1   38   38   ALA   N    N   15   116.319   0.3     .   1   .   .   .   .   .   396   ALA   N    .   50451   1
      69    .   1   .   1   39   39   ALA   H    H   1    7.450     0.020   .   1   .   .   .   .   .   397   ALA   H    .   50451   1
      70    .   1   .   1   39   39   ALA   CA   C   13   54.488    0.3     .   1   .   .   .   .   .   397   ALA   CA   .   50451   1
      71    .   1   .   1   39   39   ALA   CB   C   13   18.720    0.3     .   1   .   .   .   .   .   397   ALA   CB   .   50451   1
      72    .   1   .   1   39   39   ALA   N    N   15   118.818   0.3     .   1   .   .   .   .   .   397   ALA   N    .   50451   1
      73    .   1   .   1   40   40   GLN   H    H   1    8.671     0.020   .   1   .   .   .   .   .   398   GLN   H    .   50451   1
      74    .   1   .   1   40   40   GLN   CA   C   13   58.943    0.3     .   1   .   .   .   .   .   398   GLN   CA   .   50451   1
      75    .   1   .   1   40   40   GLN   CB   C   13   28.639    0.3     .   1   .   .   .   .   .   398   GLN   CB   .   50451   1
      76    .   1   .   1   40   40   GLN   N    N   15   120.860   0.3     .   1   .   .   .   .   .   398   GLN   N    .   50451   1
      77    .   1   .   1   41   41   ILE   H    H   1    8.345     0.020   .   1   .   .   .   .   .   399   ILE   H    .   50451   1
      78    .   1   .   1   41   41   ILE   CA   C   13   63.041    0.3     .   1   .   .   .   .   .   399   ILE   CA   .   50451   1
      79    .   1   .   1   41   41   ILE   CB   C   13   38.854    0.3     .   1   .   .   .   .   .   399   ILE   CB   .   50451   1
      80    .   1   .   1   41   41   ILE   N    N   15   115.056   0.3     .   1   .   .   .   .   .   399   ILE   N    .   50451   1
      81    .   1   .   1   42   42   GLY   H    H   1    7.550     0.020   .   1   .   .   .   .   .   400   GLY   H    .   50451   1
      82    .   1   .   1   42   42   GLY   CA   C   13   45.134    0.3     .   1   .   .   .   .   .   400   GLY   CA   .   50451   1
      83    .   1   .   1   42   42   GLY   N    N   15   104.829   0.3     .   1   .   .   .   .   .   400   GLY   N    .   50451   1
      84    .   1   .   1   43   43   LEU   H    H   1    7.481     0.020   .   1   .   .   .   .   .   401   LEU   H    .   50451   1
      85    .   1   .   1   43   43   LEU   CA   C   13   55.825    0.3     .   1   .   .   .   .   .   401   LEU   CA   .   50451   1
      86    .   1   .   1   43   43   LEU   CB   C   13   43.754    0.3     .   1   .   .   .   .   .   401   LEU   CB   .   50451   1
      87    .   1   .   1   43   43   LEU   N    N   15   121.069   0.3     .   1   .   .   .   .   .   401   LEU   N    .   50451   1
      88    .   1   .   1   44   44   LYS   H    H   1    8.949     0.020   .   1   .   .   .   .   .   402   LYS   H    .   50451   1
      89    .   1   .   1   44   44   LYS   CA   C   13   54.399    0.3     .   1   .   .   .   .   .   402   LYS   CA   .   50451   1
      90    .   1   .   1   44   44   LYS   CB   C   13   36.894    0.3     .   1   .   .   .   .   .   402   LYS   CB   .   50451   1
      91    .   1   .   1   44   44   LYS   N    N   15   121.223   0.3     .   1   .   .   .   .   .   402   LYS   N    .   50451   1
      92    .   1   .   1   45   45   LYS   H    H   1    8.659     0.020   .   1   .   .   .   .   .   403   LYS   H    .   50451   1
      93    .   1   .   1   45   45   LYS   CA   C   13   58.497    0.3     .   1   .   .   .   .   .   403   LYS   CA   .   50451   1
      94    .   1   .   1   45   45   LYS   CB   C   13   32.440    0.3     .   1   .   .   .   .   .   403   LYS   CB   .   50451   1
      95    .   1   .   1   45   45   LYS   N    N   15   121.475   0.3     .   1   .   .   .   .   .   403   LYS   N    .   50451   1
      96    .   1   .   1   46   46   GLY   H    H   1    9.628     0.020   .   1   .   .   .   .   .   404   GLY   H    .   50451   1
      97    .   1   .   1   46   46   GLY   CA   C   13   44.867    0.3     .   1   .   .   .   .   .   404   GLY   CA   .   50451   1
      98    .   1   .   1   46   46   GLY   N    N   15   117.509   0.3     .   1   .   .   .   .   .   404   GLY   N    .   50451   1
      99    .   1   .   1   47   47   ASP   H    H   1    8.290     0.020   .   1   .   .   .   .   .   405   ASP   H    .   50451   1
      100   .   1   .   1   47   47   ASP   CA   C   13   56.003    0.3     .   1   .   .   .   .   .   405   ASP   CA   .   50451   1
      101   .   1   .   1   47   47   ASP   CB   C   13   42.150    0.3     .   1   .   .   .   .   .   405   ASP   CB   .   50451   1
      102   .   1   .   1   47   47   ASP   N    N   15   124.553   0.3     .   1   .   .   .   .   .   405   ASP   N    .   50451   1
      103   .   1   .   1   48   48   VAL   H    H   1    8.370     0.020   .   1   .   .   .   .   .   406   VAL   H    .   50451   1
      104   .   1   .   1   48   48   VAL   CA   C   13   60.635    0.3     .   1   .   .   .   .   .   406   VAL   CA   .   50451   1
      105   .   1   .   1   48   48   VAL   CB   C   13   34.043    0.3     .   1   .   .   .   .   .   406   VAL   CB   .   50451   1
      106   .   1   .   1   48   48   VAL   N    N   15   119.537   0.3     .   1   .   .   .   .   .   406   VAL   N    .   50451   1
      107   .   1   .   1   49   49   ILE   H    H   1    10.266    0.020   .   1   .   .   .   .   .   407   ILE   H    .   50451   1
      108   .   1   .   1   49   49   ILE   CA   C   13   62.595    0.3     .   1   .   .   .   .   .   407   ILE   CA   .   50451   1
      109   .   1   .   1   49   49   ILE   CB   C   13   39.299    0.3     .   1   .   .   .   .   .   407   ILE   CB   .   50451   1
      110   .   1   .   1   49   49   ILE   N    N   15   129.753   0.3     .   1   .   .   .   .   .   407   ILE   N    .   50451   1
      111   .   1   .   1   50   50   ILE   H    H   1    8.710     0.020   .   1   .   .   .   .   .   408   ILE   H    .   50451   1
      112   .   1   .   1   50   50   ILE   CA   C   13   60.814    0.3     .   1   .   .   .   .   .   408   ILE   CA   .   50451   1
      113   .   1   .   1   50   50   ILE   CB   C   13   39.566    0.3     .   1   .   .   .   .   .   408   ILE   CB   .   50451   1
      114   .   1   .   1   50   50   ILE   N    N   15   118.636   0.3     .   1   .   .   .   .   .   408   ILE   N    .   50451   1
      115   .   1   .   1   51   51   GLY   H    H   1    8.322     0.020   .   1   .   .   .   .   .   409   GLY   H    .   50451   1
      116   .   1   .   1   51   51   GLY   CA   C   13   46.292    0.3     .   1   .   .   .   .   .   409   GLY   CA   .   50451   1
      117   .   1   .   1   51   51   GLY   N    N   15   112.478   0.3     .   1   .   .   .   .   .   409   GLY   N    .   50451   1
      118   .   1   .   1   53   53   ASN   H    H   1    9.848     0.020   .   1   .   .   .   .   .   411   ASN   H    .   50451   1
      119   .   1   .   1   53   53   ASN   CA   C   13   54.733    0.3     .   1   .   .   .   .   .   411   ASN   CA   .   50451   1
      120   .   1   .   1   53   53   ASN   CB   C   13   36.411    0.3     .   1   .   .   .   .   .   411   ASN   CB   .   50451   1
      121   .   1   .   1   53   53   ASN   N    N   15   123.454   0.3     .   1   .   .   .   .   .   411   ASN   N    .   50451   1
      122   .   1   .   1   56   56   ALA   H    H   1    8.795     0.020   .   1   .   .   .   .   .   414   ALA   H    .   50451   1
      123   .   1   .   1   56   56   ALA   CA   C   13   53.059    0.3     .   1   .   .   .   .   .   414   ALA   CA   .   50451   1
      124   .   1   .   1   56   56   ALA   CB   C   13   18.879    0.3     .   1   .   .   .   .   .   414   ALA   CB   .   50451   1
      125   .   1   .   1   56   56   ALA   N    N   15   127.702   0.3     .   1   .   .   .   .   .   414   ALA   N    .   50451   1
      126   .   1   .   1   57   57   VAL   H    H   1    7.805     0.020   .   1   .   .   .   .   .   415   VAL   H    .   50451   1
      127   .   1   .   1   57   57   VAL   CA   C   13   61.170    0.3     .   1   .   .   .   .   .   415   VAL   CA   .   50451   1
      128   .   1   .   1   57   57   VAL   CB   C   13   34.845    0.3     .   1   .   .   .   .   .   415   VAL   CB   .   50451   1
      129   .   1   .   1   57   57   VAL   N    N   15   120.998   0.3     .   1   .   .   .   .   .   415   VAL   N    .   50451   1
      130   .   1   .   1   58   58   LYS   H    H   1    9.218     0.020   .   1   .   .   .   .   .   416   LYS   H    .   50451   1
      131   .   1   .   1   58   58   LYS   CA   C   13   56.716    0.3     .   1   .   .   .   .   .   416   LYS   CA   .   50451   1
      132   .   1   .   1   58   58   LYS   CB   C   13   34.221    0.3     .   1   .   .   .   .   .   416   LYS   CB   .   50451   1
      133   .   1   .   1   58   58   LYS   N    N   15   122.867   0.3     .   1   .   .   .   .   .   416   LYS   N    .   50451   1
      134   .   1   .   1   59   59   ASN   H    H   1    7.594     0.020   .   1   .   .   .   .   .   417   ASN   H    .   50451   1
      135   .   1   .   1   59   59   ASN   CA   C   13   52.384    0.3     .   1   .   .   .   .   .   417   ASN   CA   .   50451   1
      136   .   1   .   1   59   59   ASN   CB   C   13   39.824    0.3     .   1   .   .   .   .   .   417   ASN   CB   .   50451   1
      137   .   1   .   1   59   59   ASN   N    N   15   110.728   0.3     .   1   .   .   .   .   .   417   ASN   N    .   50451   1
      138   .   1   .   1   60   60   ILE   H    H   1    9.972     0.020   .   1   .   .   .   .   .   418   ILE   H    .   50451   1
      139   .   1   .   1   60   60   ILE   CA   C   13   65.090    0.3     .   1   .   .   .   .   .   418   ILE   CA   .   50451   1
      140   .   1   .   1   60   60   ILE   CB   C   13   39.923    0.3     .   1   .   .   .   .   .   418   ILE   CB   .   50451   1
      141   .   1   .   1   60   60   ILE   N    N   15   119.501   0.3     .   1   .   .   .   .   .   418   ILE   N    .   50451   1
      142   .   1   .   1   61   61   ALA   H    H   1    8.420     0.020   .   1   .   .   .   .   .   419   ALA   H    .   50451   1
      143   .   1   .   1   61   61   ALA   CA   C   13   55.736    0.3     .   1   .   .   .   .   .   419   ALA   CA   .   50451   1
      144   .   1   .   1   61   61   ALA   CB   C   13   17.562    0.3     .   1   .   .   .   .   .   419   ALA   CB   .   50451   1
      145   .   1   .   1   61   61   ALA   N    N   15   125.637   0.3     .   1   .   .   .   .   .   419   ALA   N    .   50451   1
      146   .   1   .   1   62   62   GLU   H    H   1    8.416     0.020   .   1   .   .   .   .   .   420   GLU   H    .   50451   1
      147   .   1   .   1   62   62   GLU   CA   C   13   59.638    0.3     .   1   .   .   .   .   .   420   GLU   CA   .   50451   1
      148   .   1   .   1   62   62   GLU   CB   C   13   30.282    0.3     .   1   .   .   .   .   .   420   GLU   CB   .   50451   1
      149   .   1   .   1   62   62   GLU   N    N   15   118.697   0.3     .   1   .   .   .   .   .   420   GLU   N    .   50451   1
      150   .   1   .   1   63   63   LEU   H    H   1    8.005     0.020   .   1   .   .   .   .   .   421   LEU   H    .   50451   1
      151   .   1   .   1   63   63   LEU   CA   C   13   57.874    0.3     .   1   .   .   .   .   .   421   LEU   CA   .   50451   1
      152   .   1   .   1   63   63   LEU   CB   C   13   41.705    0.3     .   1   .   .   .   .   .   421   LEU   CB   .   50451   1
      153   .   1   .   1   63   63   LEU   N    N   15   121.258   0.3     .   1   .   .   .   .   .   421   LEU   N    .   50451   1
      154   .   1   .   1   64   64   ARG   H    H   1    8.980     0.020   .   1   .   .   .   .   .   422   ARG   H    .   50451   1
      155   .   1   .   1   64   64   ARG   CA   C   13   60.012    0.3     .   1   .   .   .   .   .   422   ARG   CA   .   50451   1
      156   .   1   .   1   64   64   ARG   CB   C   13   29.945    0.3     .   1   .   .   .   .   .   422   ARG   CB   .   50451   1
      157   .   1   .   1   64   64   ARG   N    N   15   119.309   0.3     .   1   .   .   .   .   .   422   ARG   N    .   50451   1
      158   .   1   .   1   65   65   LYS   H    H   1    7.646     0.020   .   1   .   .   .   .   .   423   LYS   H    .   50451   1
      159   .   1   .   1   65   65   LYS   CA   C   13   59.744    0.3     .   1   .   .   .   .   .   423   LYS   CA   .   50451   1
      160   .   1   .   1   65   65   LYS   CB   C   13   32.351    0.3     .   1   .   .   .   .   .   423   LYS   CB   .   50451   1
      161   .   1   .   1   65   65   LYS   N    N   15   118.111   0.3     .   1   .   .   .   .   .   423   LYS   N    .   50451   1
      162   .   1   .   1   66   66   VAL   H    H   1    7.697     0.020   .   1   .   .   .   .   .   424   VAL   H    .   50451   1
      163   .   1   .   1   66   66   VAL   CA   C   13   66.159    0.3     .   1   .   .   .   .   .   424   VAL   CA   .   50451   1
      164   .   1   .   1   66   66   VAL   CB   C   13   31.905    0.3     .   1   .   .   .   .   .   424   VAL   CB   .   50451   1
      165   .   1   .   1   66   66   VAL   N    N   15   119.006   0.3     .   1   .   .   .   .   .   424   VAL   N    .   50451   1
      166   .   1   .   1   67   67   LEU   H    H   1    8.427     0.020   .   1   .   .   .   .   .   425   LEU   H    .   50451   1
      167   .   1   .   1   67   67   LEU   CA   C   13   58.230    0.3     .   1   .   .   .   .   .   425   LEU   CA   .   50451   1
      168   .   1   .   1   67   67   LEU   CB   C   13   40.903    0.3     .   1   .   .   .   .   .   425   LEU   CB   .   50451   1
      169   .   1   .   1   67   67   LEU   N    N   15   121.050   0.3     .   1   .   .   .   .   .   425   LEU   N    .   50451   1
      170   .   1   .   1   68   68   ASP   H    H   1    9.032     0.020   .   1   .   .   .   .   .   426   ASP   H    .   50451   1
      171   .   1   .   1   68   68   ASP   CA   C   13   56.805    0.3     .   1   .   .   .   .   .   426   ASP   CA   .   50451   1
      172   .   1   .   1   68   68   ASP   CB   C   13   40.636    0.3     .   1   .   .   .   .   .   426   ASP   CB   .   50451   1
      173   .   1   .   1   68   68   ASP   N    N   15   120.943   0.3     .   1   .   .   .   .   .   426   ASP   N    .   50451   1
      174   .   1   .   1   69   69   SER   H    H   1    7.744     0.020   .   1   .   .   .   .   .   427   SER   H    .   50451   1
      175   .   1   .   1   69   69   SER   CA   C   13   59.438    0.3     .   1   .   .   .   .   .   427   SER   CA   .   50451   1
      176   .   1   .   1   69   69   SER   CB   C   13   63.831    0.3     .   1   .   .   .   .   .   427   SER   CB   .   50451   1
      177   .   1   .   1   69   69   SER   N    N   15   114.855   0.3     .   1   .   .   .   .   .   427   SER   N    .   50451   1
      178   .   1   .   1   70   70   LYS   H    H   1    8.175     0.020   .   1   .   .   .   .   .   428   LYS   H    .   50451   1
      179   .   1   .   1   70   70   LYS   CA   C   13   56.368    0.3     .   1   .   .   .   .   .   428   LYS   CA   .   50451   1
      180   .   1   .   1   70   70   LYS   CB   C   13   30.567    0.3     .   1   .   .   .   .   .   428   LYS   CB   .   50451   1
      181   .   1   .   1   70   70   LYS   N    N   15   118.763   0.3     .   1   .   .   .   .   .   428   LYS   N    .   50451   1
      182   .   1   .   1   73   73   VAL   H    H   1    7.642     0.020   .   1   .   .   .   .   .   431   VAL   H    .   50451   1
      183   .   1   .   1   73   73   VAL   CA   C   13   61.259    0.3     .   1   .   .   .   .   .   431   VAL   CA   .   50451   1
      184   .   1   .   1   73   73   VAL   CB   C   13   34.667    0.3     .   1   .   .   .   .   .   431   VAL   CB   .   50451   1
      185   .   1   .   1   73   73   VAL   N    N   15   118.585   0.3     .   1   .   .   .   .   .   431   VAL   N    .   50451   1
      186   .   1   .   1   74   74   LEU   H    H   1    8.879     0.020   .   1   .   .   .   .   .   432   LEU   H    .   50451   1
      187   .   1   .   1   74   74   LEU   CA   C   13   54.043    0.3     .   1   .   .   .   .   .   432   LEU   CA   .   50451   1
      188   .   1   .   1   74   74   LEU   CB   C   13   44.555    0.3     .   1   .   .   .   .   .   432   LEU   CB   .   50451   1
      189   .   1   .   1   74   74   LEU   N    N   15   128.321   0.3     .   1   .   .   .   .   .   432   LEU   N    .   50451   1
      190   .   1   .   1   75   75   ALA   H    H   1    9.028     0.020   .   1   .   .   .   .   .   433   ALA   H    .   50451   1
      191   .   1   .   1   75   75   ALA   CA   C   13   50.301    0.3     .   1   .   .   .   .   .   433   ALA   CA   .   50451   1
      192   .   1   .   1   75   75   ALA   CB   C   13   20.235    0.3     .   1   .   .   .   .   .   433   ALA   CB   .   50451   1
      193   .   1   .   1   75   75   ALA   N    N   15   130.142   0.3     .   1   .   .   .   .   .   433   ALA   N    .   50451   1
      194   .   1   .   1   76   76   LEU   H    H   1    9.434     0.020   .   1   .   .   .   .   .   434   LEU   H    .   50451   1
      195   .   1   .   1   76   76   LEU   CA   C   13   53.886    0.3     .   1   .   .   .   .   .   434   LEU   CA   .   50451   1
      196   .   1   .   1   76   76   LEU   CB   C   13   44.794    0.3     .   1   .   .   .   .   .   434   LEU   CB   .   50451   1
      197   .   1   .   1   76   76   LEU   N    N   15   124.460   0.3     .   1   .   .   .   .   .   434   LEU   N    .   50451   1
      198   .   1   .   1   77   77   ASN   H    H   1    8.711     0.020   .   1   .   .   .   .   .   435   ASN   H    .   50451   1
      199   .   1   .   1   77   77   ASN   CA   C   13   52.350    0.3     .   1   .   .   .   .   .   435   ASN   CA   .   50451   1
      200   .   1   .   1   77   77   ASN   CB   C   13   39.923    0.3     .   1   .   .   .   .   .   435   ASN   CB   .   50451   1
      201   .   1   .   1   77   77   ASN   N    N   15   122.795   0.3     .   1   .   .   .   .   .   435   ASN   N    .   50451   1
      202   .   1   .   1   78   78   ILE   H    H   1    9.169     0.020   .   1   .   .   .   .   .   436   ILE   H    .   50451   1
      203   .   1   .   1   78   78   ILE   CA   C   13   58.408    0.3     .   1   .   .   .   .   .   436   ILE   CA   .   50451   1
      204   .   1   .   1   78   78   ILE   CB   C   13   42.255    0.3     .   1   .   .   .   .   .   436   ILE   CB   .   50451   1
      205   .   1   .   1   78   78   ILE   N    N   15   126.765   0.3     .   1   .   .   .   .   .   436   ILE   N    .   50451   1
      206   .   1   .   1   79   79   GLN   H    H   1    10.008    0.020   .   1   .   .   .   .   .   437   GLN   H    .   50451   1
      207   .   1   .   1   79   79   GLN   CA   C   13   55.043    0.3     .   1   .   .   .   .   .   437   GLN   CA   .   50451   1
      208   .   1   .   1   79   79   GLN   CB   C   13   29.777    0.3     .   1   .   .   .   .   .   437   GLN   CB   .   50451   1
      209   .   1   .   1   79   79   GLN   N    N   15   126.606   0.3     .   1   .   .   .   .   .   437   GLN   N    .   50451   1
      210   .   1   .   1   80   80   ARG   H    H   1    8.956     0.020   .   1   .   .   .   .   .   438   ARG   H    .   50451   1
      211   .   1   .   1   80   80   ARG   CA   C   13   54.934    0.3     .   1   .   .   .   .   .   438   ARG   CA   .   50451   1
      212   .   1   .   1   80   80   ARG   CB   C   13   32.261    0.3     .   1   .   .   .   .   .   438   ARG   CB   .   50451   1
      213   .   1   .   1   80   80   ARG   N    N   15   132.400   0.3     .   1   .   .   .   .   .   438   ARG   N    .   50451   1
      214   .   1   .   1   83   83   SER   H    H   1    8.177     0.020   .   1   .   .   .   .   .   441   SER   H    .   50451   1
      215   .   1   .   1   83   83   SER   CA   C   13   57.963    0.3     .   1   .   .   .   .   .   441   SER   CA   .   50451   1
      216   .   1   .   1   83   83   SER   CB   C   13   65.847    0.3     .   1   .   .   .   .   .   441   SER   CB   .   50451   1
      217   .   1   .   1   83   83   SER   N    N   15   116.186   0.3     .   1   .   .   .   .   .   441   SER   N    .   50451   1
      218   .   1   .   1   84   84   THR   H    H   1    8.550     0.020   .   1   .   .   .   .   .   442   THR   H    .   50451   1
      219   .   1   .   1   84   84   THR   CA   C   13   61.090    0.3     .   1   .   .   .   .   .   442   THR   CA   .   50451   1
      220   .   1   .   1   84   84   THR   CB   C   13   70.367    0.3     .   1   .   .   .   .   .   442   THR   CB   .   50451   1
      221   .   1   .   1   84   84   THR   N    N   15   117.974   0.3     .   1   .   .   .   .   .   442   THR   N    .   50451   1
      222   .   1   .   1   85   85   ILE   H    H   1    9.523     0.020   .   1   .   .   .   .   .   443   ILE   H    .   50451   1
      223   .   1   .   1   85   85   ILE   CA   C   13   59.445    0.3     .   1   .   .   .   .   .   443   ILE   CA   .   50451   1
      224   .   1   .   1   85   85   ILE   CB   C   13   42.081    0.3     .   1   .   .   .   .   .   443   ILE   CB   .   50451   1
      225   .   1   .   1   85   85   ILE   N    N   15   123.417   0.3     .   1   .   .   .   .   .   443   ILE   N    .   50451   1
      226   .   1   .   1   86   86   TYR   H    H   1    8.510     0.020   .   1   .   .   .   .   .   444   TYR   H    .   50451   1
      227   .   1   .   1   86   86   TYR   CA   C   13   56.537    0.3     .   1   .   .   .   .   .   444   TYR   CA   .   50451   1
      228   .   1   .   1   86   86   TYR   CB   C   13   40.546    0.3     .   1   .   .   .   .   .   444   TYR   CB   .   50451   1
      229   .   1   .   1   86   86   TYR   N    N   15   123.575   0.3     .   1   .   .   .   .   .   444   TYR   N    .   50451   1
      230   .   1   .   1   87   87   LEU   H    H   1    8.988     0.020   .   1   .   .   .   .   .   445   LEU   H    .   50451   1
      231   .   1   .   1   87   87   LEU   CA   C   13   53.623    0.3     .   1   .   .   .   .   .   445   LEU   CA   .   50451   1
      232   .   1   .   1   87   87   LEU   CB   C   13   45.042    0.3     .   1   .   .   .   .   .   445   LEU   CB   .   50451   1
      233   .   1   .   1   87   87   LEU   N    N   15   124.471   0.3     .   1   .   .   .   .   .   445   LEU   N    .   50451   1
      234   .   1   .   1   88   88   LEU   H    H   1    8.644     0.020   .   1   .   .   .   .   .   446   LEU   H    .   50451   1
      235   .   1   .   1   88   88   LEU   CA   C   13   54.455    0.3     .   1   .   .   .   .   .   446   LEU   CA   .   50451   1
      236   .   1   .   1   88   88   LEU   CB   C   13   44.343    0.3     .   1   .   .   .   .   .   446   LEU   CB   .   50451   1
      237   .   1   .   1   88   88   LEU   N    N   15   124.562   0.3     .   1   .   .   .   .   .   446   LEU   N    .   50451   1
      238   .   1   .   1   89   89   MET   H    H   1    9.113     0.020   .   1   .   .   .   .   .   447   MET   H    .   50451   1
      239   .   1   .   1   89   89   MET   CA   C   13   55.825    0.3     .   1   .   .   .   .   .   447   MET   CA   .   50451   1
      240   .   1   .   1   89   89   MET   CB   C   13   34.578    0.3     .   1   .   .   .   .   .   447   MET   CB   .   50451   1
      241   .   1   .   1   89   89   MET   N    N   15   125.025   0.3     .   1   .   .   .   .   .   447   MET   N    .   50451   1
      242   .   1   .   1   90   90   GLN   H    H   1    8.072     0.020   .   1   .   .   .   .   .   448   GLN   H    .   50451   1
      243   .   1   .   1   90   90   GLN   CA   C   13   57.256    0.3     .   1   .   .   .   .   .   448   GLN   CA   .   50451   1
      244   .   1   .   1   90   90   GLN   CB   C   13   31.192    0.3     .   1   .   .   .   .   .   448   GLN   CB   .   50451   1
      245   .   1   .   1   90   90   GLN   N    N   15   128.734   0.3     .   1   .   .   .   .   .   448   GLN   N    .   50451   1
   stop_
save_