Content for NMR-STAR saveframe, "peak_list_1_2"

    save_peak_list_1_2
   _Spectral_peak_list.Sf_category                      spectral_peak_list
   _Spectral_peak_list.Sf_framecode                     peak_list_1_2
   _Spectral_peak_list.Entry_ID                         27674
   _Spectral_peak_list.ID                               2
   _Spectral_peak_list.Name                             .
   _Spectral_peak_list.Sample_ID                        1
   _Spectral_peak_list.Sample_label                     $sample_1
   _Spectral_peak_list.Sample_condition_list_ID         1
   _Spectral_peak_list.Sample_condition_list_label      $sample_conditions_1
   _Spectral_peak_list.Experiment_ID                    2
   _Spectral_peak_list.Experiment_name                  '3D HNCO'
   _Spectral_peak_list.Experiment_class                 .
   _Spectral_peak_list.Experiment_type                  .
   _Spectral_peak_list.Number_of_spectral_dimensions    3
   _Spectral_peak_list.Chemical_shift_list              .
   _Spectral_peak_list.Assigned_chem_shift_list_ID      .
   _Spectral_peak_list.Assigned_chem_shift_list_label   .
   _Spectral_peak_list.Details                          'Default list'
   _Spectral_peak_list.Text_data_format                 .
   _Spectral_peak_list.Text_data                        .

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Axis_code
      _Spectral_dim.Spectrometer_frequency
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Magnetization_linkage_ID
      _Spectral_dim.Under_sampling_type
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Value_first_point
      _Spectral_dim.Absolute_peak_positions
      _Spectral_dim.Acquisition
      _Spectral_dim.Center_frequency_offset
      _Spectral_dim.Encoding_code
      _Spectral_dim.Encoded_reduced_dimension_ID
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

      1   .   .   C   13   13C   .   .   1479.10095215   .   .   .   .   .   .   .   27674   2
      2   .   .   H   1    1H    .   .   4208.75390625   .   .   .   .   .   .   .   27674   2
      3   .   .   N   15   15N   .   .   1362.31396484   .   .   .   .   .   .   .   27674   2
   stop_

   loop_
      _Peak.ID
      _Peak.Figure_of_merit
      _Peak.Restraint
      _Peak.Details
      _Peak.Entry_ID
      _Peak.Spectral_peak_list_ID

      1    1.0   .   .   27674   2
      2    1.0   .   .   27674   2
      3    1.0   .   .   27674   2
      4    1.0   .   .   27674   2
      5    1.0   .   .   27674   2
      6    1.0   .   .   27674   2
      7    1.0   .   .   27674   2
      8    1.0   .   .   27674   2
      9    1.0   .   .   27674   2
      10   1.0   .   .   27674   2
      11   1.0   .   .   27674   2
      12   1.0   .   .   27674   2
      13   1.0   .   .   27674   2
      14   1.0   .   .   27674   2
      15   1.0   .   .   27674   2
      16   1.0   .   .   27674   2
      17   1.0   .   .   27674   2
      18   1.0   .   .   27674   2
      19   1.0   .   .   27674   2
      20   1.0   .   .   27674   2
      21   1.0   .   .   27674   2
      22   1.0   .   .   27674   2
      23   1.0   .   .   27674   2
      24   1.0   .   .   27674   2
      25   1.0   .   .   27674   2
      26   1.0   .   .   27674   2
      27   1.0   .   .   27674   2
      28   1.0   .   .   27674   2
      29   1.0   .   .   27674   2
      30   1.0   .   .   27674   2
      31   1.0   .   .   27674   2
      32   1.0   .   .   27674   2
      33   1.0   .   .   27674   2
      34   1.0   .   .   27674   2
      35   1.0   .   .   27674   2
      36   1.0   .   .   27674   2
      37   1.0   .   .   27674   2
      38   1.0   .   .   27674   2
      39   1.0   .   .   27674   2
      40   1.0   .   .   27674   2
      41   1.0   .   .   27674   2
      42   1.0   .   .   27674   2
      43   1.0   .   .   27674   2
      44   1.0   .   .   27674   2
      45   1.0   .   .   27674   2
      46   1.0   .   .   27674   2
      47   1.0   .   .   27674   2
      48   1.0   .   .   27674   2
      49   1.0   .   .   27674   2
      50   1.0   .   .   27674   2
      51   1.0   .   .   27674   2
      52   1.0   .   .   27674   2
      53   1.0   .   .   27674   2
      54   1.0   .   .   27674   2
      55   1.0   .   .   27674   2
      56   1.0   .   .   27674   2
      57   1.0   .   .   27674   2
      58   1.0   .   .   27674   2
      59   1.0   .   .   27674   2
      60   1.0   .   .   27674   2
      61   1.0   .   .   27674   2
      62   1.0   .   .   27674   2
      63   1.0   .   .   27674   2
      64   1.0   .   .   27674   2
      65   1.0   .   .   27674   2
      66   1.0   .   .   27674   2
      67   1.0   .   .   27674   2
      68   1.0   .   .   27674   2
      69   1.0   .   .   27674   2
   stop_

   loop_
      _Peak_general_char.Peak_ID
      _Peak_general_char.Intensity_val
      _Peak_general_char.Intensity_val_err
      _Peak_general_char.Measurement_method
      _Peak_general_char.Entry_ID
      _Peak_general_char.Spectral_peak_list_ID

      1    187132576.0000    .   height   27674   2
      1    2750661994.0000   .   volume   27674   2
      2    81463464.0000     .   height   27674   2
      2    1277847732.0000   .   volume   27674   2
      3    148114864.0000    .   height   27674   2
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      4    34896452.0000     .   height   27674   2
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      5    127382616.0000    .   height   27674   2
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      6    89762584.0000     .   height   27674   2
      6    1320853889.0000   .   volume   27674   2
      7    265393568.0000    .   height   27674   2
      7    3763035656.0000   .   volume   27674   2
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      53   633047738.5000    .   volume   27674   2
      54   54052944.0000     .   height   27674   2
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      58   3340227776.0000   .   volume   27674   2
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      59   4003018064.0000   .   volume   27674   2
      60   94144152.0000     .   height   27674   2
      60   1445248824.0000   .   volume   27674   2
      61   14275698.0000     .   height   27674   2
      61   239269786.0000    .   volume   27674   2
      62   108652840.0000    .   height   27674   2
      62   1591788132.0000   .   volume   27674   2
      63   107481552.0000    .   height   27674   2
      63   1568406942.0000   .   volume   27674   2
      64   18082916.0000     .   height   27674   2
      64   270944155.5000    .   volume   27674   2
      65   164582128.0000    .   height   27674   2
      65   2362799980.0000   .   volume   27674   2
      66   24124518.0000     .   height   27674   2
      66   364028113.5000    .   volume   27674   2
      67   6682165.5000      .   height   27674   2
      67   112711474.7500    .   volume   27674   2
      68   6538503.5000      .   height   27674   2
      68   108286593.7500    .   volume   27674   2
      69   549984128.0000    .   height   27674   2
      69   7827798728.0000   .   volume   27674   2
   stop_

   loop_
      _Peak_char.Peak_ID
      _Peak_char.Spectral_dim_ID
      _Peak_char.Chem_shift_val
      _Peak_char.Chem_shift_val_err
      _Peak_char.Line_width_val
      _Peak_char.Line_width_val_err
      _Peak_char.Phase_val
      _Peak_char.Phase_val_err
      _Peak_char.Decay_rate_val
      _Peak_char.Decay_rate_val_err
      _Peak_char.Coupling_pattern
      _Peak_char.Bounding_box_upper_val
      _Peak_char.Bounding_box_lower_val
      _Peak_char.Bounding_box_range_val
      _Peak_char.Details
      _Peak_char.Derivation_method_ID
      _Peak_char.Entry_ID
      _Peak_char.Spectral_peak_list_ID

      1    1   176.003   .   32.4449404602   .   .   .   .   .   .   .   .   .   .   .   27674   2
      1    2   8.213     .   17.6300291433   .   .   .   .   .   .   .   .   .   .   .   27674   2
      1    3   110.004   .   24.5349773010   .   .   .   .   .   .   .   .   .   .   .   27674   2
      2    1   177.251   .   32.8992796519   .   .   .   .   .   .   .   .   .   .   .   27674   2
      2    2   8.495     .   21.6613699375   .   .   .   .   .   .   .   .   .   .   .   27674   2
      2    3   109.929   .   26.6906812711   .   .   .   .   .   .   .   .   .   .   .   27674   2
      3    1   178.281   .   33.3520760211   .   .   .   .   .   .   .   .   .   .   .   27674   2
      3    2   8.309     .   18.6448884577   .   .   .   .   .   .   .   .   .   .   .   27674   2
      3    3   107.480   .   25.1392694867   .   .   .   .   .   .   .   .   .   .   .   27674   2
      4    1   177.939   .   37.7965068939   .   .   .   .   .   .   .   .   .   .   .   27674   2
      4    2   8.002     .   21.6983719765   .   .   .   .   .   .   .   .   .   .   .   27674   2
      4    3   118.544   .   26.7026177064   .   .   .   .   .   .   .   .   .   .   .   27674   2
      5    1   176.552   .   32.6530892584   .   .   .   .   .   .   .   .   .   .   .   27674   2
      5    2   8.299     .   18.2298384674   .   .   .   .   .   .   .   .   .   .   .   27674   2
      5    3   115.891   .   24.3808592455   .   .   .   .   .   .   .   .   .   .   .   27674   2
      6    1   174.472   .   33.9333674659   .   .   .   .   .   .   .   .   .   .   .   27674   2
      6    2   7.604     .   19.1101107043   .   .   .   .   .   .   .   .   .   .   .   27674   2
      6    3   117.181   .   23.5842036914   .   .   .   .   .   .   .   .   .   .   .   27674   2
      7    1   176.532   .   31.8667787411   .   .   .   .   .   .   .   .   .   .   .   27674   2
      7    2   8.086     .   17.5848741126   .   .   .   .   .   .   .   .   .   .   .   27674   2
      7    3   115.359   .   23.8057991462   .   .   .   .   .   .   .   .   .   .   .   27674   2
      8    1   174.761   .   32.6024846798   .   .   .   .   .   .   .   .   .   .   .   27674   2
      8    2   8.241     .   19.1181382653   .   .   .   .   .   .   .   .   .   .   .   27674   2
      8    3   108.738   .   23.7310949255   .   .   .   .   .   .   .   .   .   .   .   27674   2
      9    1   176.480   .   31.4598262410   .   .   .   .   .   .   .   .   .   .   .   27674   2
      9    2   8.032     .   15.0107865029   .   .   .   .   .   .   .   .   .   .   .   27674   2
      9    3   120.154   .   24.1602381936   .   .   .   .   .   .   .   .   .   .   .   27674   2
      10   1   175.194   .   34.5504964738   .   .   .   .   .   .   .   .   .   .   .   27674   2
      10   2   8.105     .   17.9926491258   .   .   .   .   .   .   .   .   .   .   .   27674   2
      10   3   119.094   .   24.0964960053   .   .   .   .   .   .   .   .   .   .   .   27674   2
      11   1   176.665   .   32.5539518914   .   .   .   .   .   .   .   .   .   .   .   27674   2
      11   2   8.370     .   18.8768097125   .   .   .   .   .   .   .   .   .   .   .   27674   2
      11   3   109.457   .   24.2493960571   .   .   .   .   .   .   .   .   .   .   .   27674   2
      12   1   176.656   .   32.9337947957   .   .   .   .   .   .   .   .   .   .   .   27674   2
      12   2   8.119     .   14.7768583578   .   .   .   .   .   .   .   .   .   .   .   27674   2
      12   3   122.371   .   13.8191034355   .   .   .   .   .   .   .   .   .   .   .   27674   2
      13   1   177.169   .   43.1308377961   .   .   .   .   .   .   .   .   .   .   .   27674   2
      13   2   8.091     .   19.8837668966   .   .   .   .   .   .   .   .   .   .   .   27674   2
      13   3   122.370   .   30.5461904641   .   .   .   .   .   .   .   .   .   .   .   27674   2
      14   1   175.960   .   31.4767532081   .   .   .   .   .   .   .   .   .   .   .   27674   2
      14   2   8.115     .   21.2058058502   .   .   .   .   .   .   .   .   .   .   .   27674   2
      14   3   116.962   .   25.0948529554   .   .   .   .   .   .   .   .   .   .   .   27674   2
      15   1   174.376   .   34.1812770045   .   .   .   .   .   .   .   .   .   .   .   27674   2
      15   2   8.434     .   20.9237123391   .   .   .   .   .   .   .   .   .   .   .   27674   2
      15   3   122.041   .   25.4985399483   .   .   .   .   .   .   .   .   .   .   .   27674   2
      16   1   174.786   .   31.3842720182   .   .   .   .   .   .   .   .   .   .   .   27674   2
      16   2   8.425     .   18.6440104432   .   .   .   .   .   .   .   .   .   .   .   27674   2
      16   3   122.092   .   24.9065495990   .   .   .   .   .   .   .   .   .   .   .   27674   2
      17   1   175.067   .   31.5201285612   .   .   .   .   .   .   .   .   .   .   .   27674   2
      17   2   8.309     .   21.4811261067   .   .   .   .   .   .   .   .   .   .   .   27674   2
      17   3   110.129   .   25.7181459972   .   .   .   .   .   .   .   .   .   .   .   27674   2
      18   1   174.850   .   33.4963519670   .   .   .   .   .   .   .   .   .   .   .   27674   2
      18   2   8.288     .   22.0538424124   .   .   .   .   .   .   .   .   .   .   .   27674   2
      18   3   117.701   .   25.1683797727   .   .   .   .   .   .   .   .   .   .   .   27674   2
      19   1   177.738   .   34.7751755133   .   .   .   .   .   .   .   .   .   .   .   27674   2
      19   2   8.623     .   25.7041249200   .   .   .   .   .   .   .   .   .   .   .   27674   2
      19   3   118.426   .   27.0418723089   .   .   .   .   .   .   .   .   .   .   .   27674   2
      20   1   172.956   .   32.2037311794   .   .   .   .   .   .   .   .   .   .   .   27674   2
      20   2   7.836     .   16.6916825197   .   .   .   .   .   .   .   .   .   .   .   27674   2
      20   3   121.027   .   24.4176429542   .   .   .   .   .   .   .   .   .   .   .   27674   2
      21   1   175.976   .   32.1007587964   .   .   .   .   .   .   .   .   .   .   .   27674   2
      21   2   8.253     .   18.4156012464   .   .   .   .   .   .   .   .   .   .   .   27674   2
      21   3   120.817   .   26.9590074640   .   .   .   .   .   .   .   .   .   .   .   27674   2
      22   1   174.259   .   31.4509219511   .   .   .   .   .   .   .   .   .   .   .   27674   2
      22   2   8.221     .   17.2627682271   .   .   .   .   .   .   .   .   .   .   .   27674   2
      22   3   120.758   .   23.9584149972   .   .   .   .   .   .   .   .   .   .   .   27674   2
      23   1   174.802   .   31.8838820307   .   .   .   .   .   .   .   .   .   .   .   27674   2
      23   2   8.353     .   25.2825525363   .   .   .   .   .   .   .   .   .   .   .   27674   2
      23   3   117.519   .   26.3857337700   .   .   .   .   .   .   .   .   .   .   .   27674   2
      24   1   175.556   .   35.2189353506   .   .   .   .   .   .   .   .   .   .   .   27674   2
      24   2   8.030     .   19.8576773233   .   .   .   .   .   .   .   .   .   .   .   27674   2
      24   3   114.552   .   25.3731261777   .   .   .   .   .   .   .   .   .   .   .   27674   2
      25   1   175.794   .   31.7391211978   .   .   .   .   .   .   .   .   .   .   .   27674   2
      25   2   8.183     .   18.4835846537   .   .   .   .   .   .   .   .   .   .   .   27674   2
      25   3   124.303   .   23.9468744131   .   .   .   .   .   .   .   .   .   .   .   27674   2
      26   1   176.936   .   32.9318111668   .   .   .   .   .   .   .   .   .   .   .   27674   2
      26   2   8.514     .   20.0766792221   .   .   .   .   .   .   .   .   .   .   .   27674   2
      26   3   118.213   .   24.2847181614   .   .   .   .   .   .   .   .   .   .   .   27674   2
      27   1   176.807   .   31.8481326289   .   .   .   .   .   .   .   .   .   .   .   27674   2
      27   2   8.340     .   17.4667184490   .   .   .   .   .   .   .   .   .   .   .   27674   2
      27   3   122.110   .   24.1263776936   .   .   .   .   .   .   .   .   .   .   .   27674   2
      28   1   176.607   .   32.9021008131   .   .   .   .   .   .   .   .   .   .   .   27674   2
      28   2   8.176     .   17.9923982645   .   .   .   .   .   .   .   .   .   .   .   27674   2
      28   3   115.643   .   23.8368176379   .   .   .   .   .   .   .   .   .   .   .   27674   2
      29   1   174.472   .   32.4430890732   .   .   .   .   .   .   .   .   .   .   .   27674   2
      29   2   8.277     .   18.4760588153   .   .   .   .   .   .   .   .   .   .   .   27674   2
      29   3   125.834   .   23.8912573238   .   .   .   .   .   .   .   .   .   .   .   27674   2
      30   1   173.955   .   35.1931040936   .   .   .   .   .   .   .   .   .   .   .   27674   2
      30   2   7.637     .   19.9055918281   .   .   .   .   .   .   .   .   .   .   .   27674   2
      30   3   123.281   .   24.7090097152   .   .   .   .   .   .   .   .   .   .   .   27674   2
      31   1   176.409   .   32.3901041398   .   .   .   .   .   .   .   .   .   .   .   27674   2
      31   2   8.245     .   19.0241907154   .   .   .   .   .   .   .   .   .   .   .   27674   2
      31   3   116.920   .   25.5141709945   .   .   .   .   .   .   .   .   .   .   .   27674   2
      32   1   174.585   .   32.1361996337   .   .   .   .   .   .   .   .   .   .   .   27674   2
      32   2   7.975     .   18.6140325201   .   .   .   .   .   .   .   .   .   .   .   27674   2
      32   3   112.825   .   23.5285815271   .   .   .   .   .   .   .   .   .   .   .   27674   2
      33   1   174.253   .   32.3471695931   .   .   .   .   .   .   .   .   .   .   .   27674   2
      33   2   8.319     .   18.4705398671   .   .   .   .   .   .   .   .   .   .   .   27674   2
      33   3   122.239   .   24.7978833779   .   .   .   .   .   .   .   .   .   .   .   27674   2
      34   1   176.363   .   30.8328231690   .   .   .   .   .   .   .   .   .   .   .   27674   2
      34   2   8.352     .   17.3779135554   .   .   .   .   .   .   .   .   .   .   .   27674   2
      34   3   122.007   .   24.7557810534   .   .   .   .   .   .   .   .   .   .   .   27674   2
      35   1   177.191   .   34.9157927658   .   .   .   .   .   .   .   .   .   .   .   27674   2
      35   2   7.879     .   20.4571103555   .   .   .   .   .   .   .   .   .   .   .   27674   2
      35   3   115.791   .   25.3844942113   .   .   .   .   .   .   .   .   .   .   .   27674   2
      36   1   176.655   .   32.1942097604   .   .   .   .   .   .   .   .   .   .   .   27674   2
      36   2   8.111     .   17.3900803275   .   .   .   .   .   .   .   .   .   .   .   27674   2
      36   3   122.951   .   24.2551612741   .   .   .   .   .   .   .   .   .   .   .   27674   2
      37   1   177.188   .   39.5557212922   .   .   .   .   .   .   .   .   .   .   .   27674   2
      37   2   8.039     .   18.3517570503   .   .   .   .   .   .   .   .   .   .   .   27674   2
      37   3   119.653   .   31.0966062906   .   .   .   .   .   .   .   .   .   .   .   27674   2
      38   1   174.534   .   33.6514276706   .   .   .   .   .   .   .   .   .   .   .   27674   2
      38   2   8.232     .   20.8707806087   .   .   .   .   .   .   .   .   .   .   .   27674   2
      38   3   117.606   .   32.2028377595   .   .   .   .   .   .   .   .   .   .   .   27674   2
      39   1   176.249   .   34.6606099210   .   .   .   .   .   .   .   .   .   .   .   27674   2
      39   2   8.199     .   15.1146430734   .   .   .   .   .   .   .   .   .   .   .   27674   2
      39   3   117.082   .   35.1161399683   .   .   .   .   .   .   .   .   .   .   .   27674   2
      40   1   174.796   .   32.8957972811   .   .   .   .   .   .   .   .   .   .   .   27674   2
      40   2   7.892     .   14.3741005703   .   .   .   .   .   .   .   .   .   .   .   27674   2
      40   3   109.615   .   11.0658874997   .   .   .   .   .   .   .   .   .   .   .   27674   2
      41   1   174.785   .   34.4211638660   .   .   .   .   .   .   .   .   .   .   .   27674   2
      41   2   7.892     .   13.7465710746   .   .   .   .   .   .   .   .   .   .   .   27674   2
      41   3   109.200   .   12.6936275097   .   .   .   .   .   .   .   .   .   .   .   27674   2
      42   1   175.310   .   32.6559985809   .   .   .   .   .   .   .   .   .   .   .   27674   2
      42   2   8.241     .   18.7716988355   .   .   .   .   .   .   .   .   .   .   .   27674   2
      42   3   120.506   .   28.7032698183   .   .   .   .   .   .   .   .   .   .   .   27674   2
      43   1   174.037   .   31.4108085656   .   .   .   .   .   .   .   .   .   .   .   27674   2
      43   2   8.145     .   16.7749684652   .   .   .   .   .   .   .   .   .   .   .   27674   2
      43   3   125.408   .   23.4847435475   .   .   .   .   .   .   .   .   .   .   .   27674   2
      44   1   175.822   .   35.3249052174   .   .   .   .   .   .   .   .   .   .   .   27674   2
      44   2   7.962     .   19.4369829542   .   .   .   .   .   .   .   .   .   .   .   27674   2
      44   3   119.870   .   24.1694544208   .   .   .   .   .   .   .   .   .   .   .   27674   2
      45   1   176.275   .   35.1601317723   .   .   .   .   .   .   .   .   .   .   .   27674   2
      45   2   8.062     .   18.7365782561   .   .   .   .   .   .   .   .   .   .   .   27674   2
      45   3   117.205   .   24.0664925166   .   .   .   .   .   .   .   .   .   .   .   27674   2
      46   1   175.769   .   31.9474463186   .   .   .   .   .   .   .   .   .   .   .   27674   2
      46   2   8.059     .   17.9986697965   .   .   .   .   .   .   .   .   .   .   .   27674   2
      46   3   117.131   .   24.6212525559   .   .   .   .   .   .   .   .   .   .   .   27674   2
      47   1   175.912   .   31.5182771742   .   .   .   .   .   .   .   .   .   .   .   27674   2
      47   2   8.396     .   16.2756290843   .   .   .   .   .   .   .   .   .   .   .   27674   2
      47   3   121.595   .   24.7794306233   .   .   .   .   .   .   .   .   .   .   .   27674   2
      48   1   174.252   .   31.9299022225   .   .   .   .   .   .   .   .   .   .   .   27674   2
      48   2   8.189     .   44.7389772398   .   .   .   .   .   .   .   .   .   .   .   27674   2
      48   3   120.752   .   23.7421381581   .   .   .   .   .   .   .   .   .   .   .   27674   2
      49   1   174.538   .   32.7934420271   .   .   .   .   .   .   .   .   .   .   .   27674   2
      49   2   8.227     .   17.2396889892   .   .   .   .   .   .   .   .   .   .   .   27674   2
      49   3   125.577   .   24.0883455312   .   .   .   .   .   .   .   .   .   .   .   27674   2
      50   1   175.134   .   33.2729512662   .   .   .   .   .   .   .   .   .   .   .   27674   2
      50   2   8.253     .   18.5291159763   .   .   .   .   .   .   .   .   .   .   .   27674   2
      50   3   122.305   .   24.6126656305   .   .   .   .   .   .   .   .   .   .   .   27674   2
      51   1   174.387   .   31.6197508154   .   .   .   .   .   .   .   .   .   .   .   27674   2
      51   2   8.040     .   18.6924266706   .   .   .   .   .   .   .   .   .   .   .   27674   2
      51   3   121.838   .   24.0352304242   .   .   .   .   .   .   .   .   .   .   .   27674   2
      52   1   177.286   .   32.1725220839   .   .   .   .   .   .   .   .   .   .   .   27674   2
      52   2   8.202     .   16.6578162467   .   .   .   .   .   .   .   .   .   .   .   27674   2
      52   3   108.932   .   23.8456684641   .   .   .   .   .   .   .   .   .   .   .   27674   2
      53   1   177.525   .   35.6036712064   .   .   .   .   .   .   .   .   .   .   .   27674   2
      53   2   8.141     .   19.9202672130   .   .   .   .   .   .   .   .   .   .   .   27674   2
      53   3   119.030   .   25.8115668733   .   .   .   .   .   .   .   .   .   .   .   27674   2
      54   1   176.679   .   34.5374486033   .   .   .   .   .   .   .   .   .   .   .   27674   2
      54   2   7.793     .   21.2513371728   .   .   .   .   .   .   .   .   .   .   .   27674   2
      54   3   117.836   .   25.0084153000   .   .   .   .   .   .   .   .   .   .   .   27674   2
      55   1   175.153   .   32.1447512785   .   .   .   .   .   .   .   .   .   .   .   27674   2
      55   2   8.340     .   19.6478318613   .   .   .   .   .   .   .   .   .   .   .   27674   2
      55   3   110.582   .   25.9429082614   .   .   .   .   .   .   .   .   .   .   .   27674   2
      56   1   178.539   .   37.1424823875   .   .   .   .   .   .   .   .   .   .   .   27674   2
      56   2   8.018     .   19.6889731114   .   .   .   .   .   .   .   .   .   .   .   27674   2
      56   3   112.936   .   24.9140200210   .   .   .   .   .   .   .   .   .   .   .   27674   2
      57   1   176.716   .   32.8690403305   .   .   .   .   .   .   .   .   .   .   .   27674   2
      57   2   8.390     .   17.4313470083   .   .   .   .   .   .   .   .   .   .   .   27674   2
      57   3   120.704   .   24.3750128283   .   .   .   .   .   .   .   .   .   .   .   27674   2
      58   1   174.438   .   32.7492732224   .   .   .   .   .   .   .   .   .   .   .   27674   2
      58   2   8.393     .   16.5730251336   .   .   .   .   .   .   .   .   .   .   .   27674   2
      58   3   120.700   .   24.1282452991   .   .   .   .   .   .   .   .   .   .   .   27674   2
      59   1   173.980   .   31.7429121331   .   .   .   .   .   .   .   .   .   .   .   27674   2
      59   2   8.064     .   17.5984206218   .   .   .   .   .   .   .   .   .   .   .   27674   2
      59   3   123.706   .   23.8999102243   .   .   .   .   .   .   .   .   .   .   .   27674   2
      60   1   175.377   .   33.5672336417   .   .   .   .   .   .   .   .   .   .   .   27674   2
      60   2   8.496     .   18.5476797111   .   .   .   .   .   .   .   .   .   .   .   27674   2
      60   3   109.659   .   26.6099682326   .   .   .   .   .   .   .   .   .   .   .   27674   2
      61   1   175.961   .   30.8895990378   .   .   .   .   .   .   .   .   .   .   .   27674   2
      61   2   8.161     .   17.7742743802   .   .   .   .   .   .   .   .   .   .   .   27674   2
      61   3   117.174   .   36.0582657523   .   .   .   .   .   .   .   .   .   .   .   27674   2
      62   1   177.749   .   32.7921196078   .   .   .   .   .   .   .   .   .   .   .   27674   2
      62   2   8.125     .   19.7884396096   .   .   .   .   .   .   .   .   .   .   .   27674   2
      62   3   114.415   .   24.2101763412   .   .   .   .   .   .   .   .   .   .   .   27674   2
      63   1   176.761   .   31.8164827270   .   .   .   .   .   .   .   .   .   .   .   27674   2
      63   2   8.210     .   17.7447981796   .   .   .   .   .   .   .   .   .   .   .   27674   2
      63   3   116.487   .   24.8863713393   .   .   .   .   .   .   .   .   .   .   .   27674   2
      64   1   176.877   .   30.6458330797   .   .   .   .   .   .   .   .   .   .   .   27674   2
      64   2   8.395     .   18.5011449434   .   .   .   .   .   .   .   .   .   .   .   27674   2
      64   3   110.008   .   27.0473127249   .   .   .   .   .   .   .   .   .   .   .   27674   2
      65   1   174.490   .   33.6907476045   .   .   .   .   .   .   .   .   .   .   .   27674   2
      65   2   8.210     .   16.8041938045   .   .   .   .   .   .   .   .   .   .   .   27674   2
      65   3   119.551   .   24.1858162692   .   .   .   .   .   .   .   .   .   .   .   27674   2
      66   1   175.907   .   31.9543228989   .   .   .   .   .   .   .   .   .   .   .   27674   2
      66   2   8.316     .   14.4561322094   .   .   .   .   .   .   .   .   .   .   .   27674   2
      66   3   121.969   .   29.4194762347   .   .   .   .   .   .   .   .   .   .   .   27674   2
      67   1   174.350   .   37.7664438951   .   .   .   .   .   .   .   .   .   .   .   27674   2
      67   2   7.368     .   17.4461478239   .   .   .   .   .   .   .   .   .   .   .   27674   2
      67   3   117.535   .   30.8504883633   .   .   .   .   .   .   .   .   .   .   .   27674   2
      68   1   173.852   .   33.4465408400   .   .   .   .   .   .   .   .   .   .   .   27674   2
      68   2   8.677     .   28.6629083049   .   .   .   .   .   .   .   .   .   .   .   27674   2
      68   3   119.626   .   28.5461473540   .   .   .   .   .   .   .   .   .   .   .   27674   2
      69   1   174.794   .   31.4358463710   .   .   .   .   .   .   .   .   .   .   .   27674   2
      69   2   7.885     .   16.0109704323   .   .   .   .   .   .   .   .   .   .   .   27674   2
      69   3   110.194   .   24.1217492799   .   .   .   .   .   .   .   .   .   .   .   27674   2
   stop_

   loop_
      _Assigned_peak_chem_shift.Peak_ID
      _Assigned_peak_chem_shift.Spectral_dim_ID
      _Assigned_peak_chem_shift.Set_ID
      _Assigned_peak_chem_shift.Magnetization_linkage_ID
      _Assigned_peak_chem_shift.Assembly_atom_ID
      _Assigned_peak_chem_shift.Val
      _Assigned_peak_chem_shift.Contribution_fractional_val
      _Assigned_peak_chem_shift.Figure_of_merit
      _Assigned_peak_chem_shift.Assigned_chem_shift_list_ID
      _Assigned_peak_chem_shift.Atom_chem_shift_ID
      _Assigned_peak_chem_shift.Entity_assembly_ID
      _Assigned_peak_chem_shift.Entity_ID
      _Assigned_peak_chem_shift.Comp_index_ID
      _Assigned_peak_chem_shift.Comp_ID
      _Assigned_peak_chem_shift.Atom_ID
      _Assigned_peak_chem_shift.Ambiguity_code
      _Assigned_peak_chem_shift.Ambiguity_set_ID
      _Assigned_peak_chem_shift.Auth_atom_peak_num
      _Assigned_peak_chem_shift.Auth_entity_ID
      _Assigned_peak_chem_shift.Auth_seq_ID
      _Assigned_peak_chem_shift.Auth_comp_ID
      _Assigned_peak_chem_shift.Auth_atom_ID
      _Assigned_peak_chem_shift.Auth_ambiguity_code
      _Assigned_peak_chem_shift.Auth_ambiguity_set_ID
      _Assigned_peak_chem_shift.Auth_amb_atom_grp_ID
      _Assigned_peak_chem_shift.Resonance_ID
      _Assigned_peak_chem_shift.Details
      _Assigned_peak_chem_shift.Entry_ID
      _Assigned_peak_chem_shift.Spectral_peak_list_ID

      1    1   1   .   .   176.003   .   .   1   .   1   1   43   GLN   C   .   .   .   .   .   .   .   .   .   .   280   .   27674   2
      1    2   1   .   .   8.213     .   .   1   .   1   1   44   GLY   H   .   .   .   .   .   .   .   .   .   .   2     .   27674   2
      1    3   1   .   .   110.004   .   .   1   .   1   1   44   GLY   N   .   .   .   .   .   .   .   .   .   .   1     .   27674   2
      2    1   1   .   .   177.251   .   .   1   .   1   1   51   LYS   C   .   .   .   .   .   .   .   .   .   .   291   .   27674   2
      2    2   1   .   .   8.495     .   .   1   .   1   1   52   GLY   H   .   .   .   .   .   .   .   .   .   .   4     .   27674   2
      2    3   1   .   .   109.929   .   .   1   .   1   1   52   GLY   N   .   .   .   .   .   .   .   .   .   .   3     .   27674   2
      3    1   1   .   .   178.281   .   .   1   .   1   1   23   ALA   C   .   .   .   .   .   .   .   .   .   .   203   .   27674   2
      3    2   1   .   .   8.309     .   .   1   .   1   1   24   GLY   H   .   .   .   .   .   .   .   .   .   .   6     .   27674   2
      3    3   1   .   .   107.480   .   .   1   .   1   1   24   GLY   N   .   .   .   .   .   .   .   .   .   .   5     .   27674   2
      4    1   1   .   .   177.939   .   .   1   .   1   1   6    ARG   C   .   .   .   .   .   .   .   .   .   .   219   .   27674   2
      4    2   1   .   .   8.002     .   .   1   .   1   1   7    PHE   H   .   .   .   .   .   .   .   .   .   .   8     .   27674   2
      4    3   1   .   .   118.544   .   .   1   .   1   1   7    PHE   N   .   .   .   .   .   .   .   .   .   .   7     .   27674   2
      5    1   1   .   .   176.552   .   .   1   .   1   1   19   GLN   C   .   .   .   .   .   .   .   .   .   .   161   .   27674   2
      5    2   1   .   .   8.299     .   .   1   .   1   1   20   SER   H   .   .   .   .   .   .   .   .   .   .   10    .   27674   2
      5    3   1   .   .   115.891   .   .   1   .   1   1   20   SER   N   .   .   .   .   .   .   .   .   .   .   9     .   27674   2
      6    1   1   .   .   174.472   .   .   1   .   1   1   2    PHE   C   .   .   .   .   .   .   .   .   .   .   254   .   27674   2
      6    2   1   .   .   7.604     .   .   1   .   1   1   3    PHE   H   .   .   .   .   .   .   .   .   .   .   12    .   27674   2
      6    3   1   .   .   117.181   .   .   1   .   1   1   3    PHE   N   .   .   .   .   .   .   .   .   .   .   11    .   27674   2
      7    1   1   .   .   176.532   .   .   1   .   1   1   66   GLU   C   .   .   .   .   .   .   .   .   .   .   238   .   27674   2
      7    2   1   .   .   8.086     .   .   1   .   1   1   67   THR   H   .   .   .   .   .   .   .   .   .   .   14    .   27674   2
      7    3   1   .   .   115.359   .   .   1   .   1   1   67   THR   N   .   .   .   .   .   .   .   .   .   .   13    .   27674   2
      8    1   1   .   .   174.761   .   .   1   .   1   1   52   GLY   C   .   .   .   .   .   .   .   .   .   .   282   .   27674   2
      8    2   1   .   .   8.241     .   .   1   .   1   1   53   GLY   H   .   .   .   .   .   .   .   .   .   .   16    .   27674   2
      8    3   1   .   .   108.738   .   .   1   .   1   1   53   GLY   N   .   .   .   .   .   .   .   .   .   .   15    .   27674   2
      9    1   1   .   .   176.480   .   .   1   .   1   1   62   PRO   C   .   .   .   .   .   .   .   .   .   .   273   .   27674   2
      9    2   1   .   .   8.032     .   .   1   .   1   1   63   TYR   H   .   .   .   .   .   .   .   .   .   .   18    .   27674   2
      9    3   1   .   .   120.154   .   .   1   .   1   1   63   TYR   N   .   .   .   .   .   .   .   .   .   .   17    .   27674   2
      10   1   1   .   .   175.194   .   .   1   .   1   1   16   CYS   C   .   .   .   .   .   .   .   .   .   .   187   .   27674   2
      10   2   1   .   .   8.105     .   .   1   .   1   1   17   CYS   H   .   .   .   .   .   .   .   .   .   .   20    .   27674   2
      10   3   1   .   .   119.094   .   .   1   .   1   1   17   CYS   N   .   .   .   .   .   .   .   .   .   .   19    .   27674   2
      11   1   1   .   .   176.665   .   .   1   .   1   1   49   MET   C   .   .   .   .   .   .   .   .   .   .   288   .   27674   2
      11   2   2   .   .   8.370     .   .   1   .   1   1   50   GLY   H   .   .   .   .   .   .   .   .   .   .   285   .   27674   2
      11   3   2   .   .   109.457   .   .   1   .   1   1   50   GLY   N   .   .   .   .   .   .   .   .   .   .   286   .   27674   2
      12   2   2   .   .   8.119     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   177   .   27674   2
      12   3   2   .   .   122.371   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   178   .   27674   2
      13   1   1   .   .   177.169   .   .   1   .   1   1   9    GLN   C   .   .   .   .   .   .   .   .   .   .   215   .   27674   2
      13   2   1   .   .   8.091     .   .   1   .   1   1   10   ALA   H   .   .   .   .   .   .   .   .   .   .   24    .   27674   2
      13   3   1   .   .   122.370   .   .   1   .   1   1   10   ALA   N   .   .   .   .   .   .   .   .   .   .   23    .   27674   2
      14   1   1   .   .   175.960   .   .   1   .   1   1   63   TYR   C   .   .   .   .   .   .   .   .   .   .   274   .   27674   2
      14   2   1   .   .   8.115     .   .   1   .   1   1   64   SER   H   .   .   .   .   .   .   .   .   .   .   26    .   27674   2
      14   3   1   .   .   116.962   .   .   1   .   1   1   64   SER   N   .   .   .   .   .   .   .   .   .   .   25    .   27674   2
      15   2   1   .   .   8.434     .   .   1   .   1   1   27   HIS   H   .   .   .   .   .   .   .   .   .   .   28    .   27674   2
      15   3   1   .   .   122.041   .   .   1   .   1   1   27   HIS   N   .   .   .   .   .   .   .   .   .   .   27    .   27674   2
      16   2   1   .   .   8.425     .   .   1   .   1   1   27   HIS   H   .   .   .   .   .   .   .   .   .   .   28    .   27674   2
      16   3   1   .   .   122.092   .   .   1   .   1   1   27   HIS   N   .   .   .   .   .   .   .   .   .   .   27    .   27674   2
      17   2   1   .   .   8.309     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   32    .   27674   2
      17   3   1   .   .   110.129   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   31    .   27674   2
      18   1   1   .   .   174.850   .   .   1   .   1   1   25   THR   C   .   .   .   .   .   .   .   .   .   .   241   .   27674   2
      18   2   1   .   .   8.288     .   .   1   .   1   1   26   SER   H   .   .   .   .   .   .   .   .   .   .   36    .   27674   2
      18   3   1   .   .   117.701   .   .   1   .   1   1   26   SER   N   .   .   .   .   .   .   .   .   .   .   35    .   27674   2
      19   1   1   .   .   177.738   .   .   1   .   1   1   5    PRO   C   .   .   .   .   .   .   .   .   .   .   220   .   27674   2
      19   2   1   .   .   8.623     .   .   1   .   1   1   6    ARG   H   .   .   .   .   .   .   .   .   .   .   38    .   27674   2
      19   3   1   .   .   118.426   .   .   1   .   1   1   6    ARG   N   .   .   .   .   .   .   .   .   .   .   37    .   27674   2
      20   2   1   .   .   7.836     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   40    .   27674   2
      20   3   1   .   .   121.027   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   39    .   27674   2
      21   2   1   .   .   8.253     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   42    .   27674   2
      21   3   1   .   .   120.817   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   41    .   27674   2
      22   1   1   .   .   174.259   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   156   .   27674   2
      22   2   2   .   .   8.221     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   116   .   27674   2
      22   3   2   .   .   120.758   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   115   .   27674   2
      23   2   1   .   .   8.353     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   44    .   27674   2
      23   3   1   .   .   117.519   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   43    .   27674   2
      24   1   1   .   .   175.556   .   .   1   .   1   1   11   SER   C   .   .   .   .   .   .   .   .   .   .   214   .   27674   2
      24   2   1   .   .   8.030     .   .   1   .   1   1   12   THR   H   .   .   .   .   .   .   .   .   .   .   46    .   27674   2
      24   3   1   .   .   114.552   .   .   1   .   1   1   12   THR   N   .   .   .   .   .   .   .   .   .   .   45    .   27674   2
      25   1   1   .   .   175.794   .   .   1   .   1   1   69   VAL   C   .   .   .   .   .   .   .   .   .   .   230   .   27674   2
      25   2   1   .   .   8.183     .   .   1   .   1   1   70   VAL   H   .   .   .   .   .   .   .   .   .   .   48    .   27674   2
      25   3   1   .   .   124.303   .   .   1   .   1   1   70   VAL   N   .   .   .   .   .   .   .   .   .   .   47    .   27674   2
      26   1   1   .   .   176.936   .   .   1   .   1   1   47   PRO   C   .   .   .   .   .   .   .   .   .   .   304   .   27674   2
      26   2   1   .   .   8.514     .   .   1   .   1   1   48   ASN   H   .   .   .   .   .   .   .   .   .   .   52    .   27674   2
      26   3   1   .   .   118.213   .   .   1   .   1   1   48   ASN   N   .   .   .   .   .   .   .   .   .   .   51    .   27674   2
      27   1   1   .   .   176.807   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   155   .   27674   2
      27   2   2   .   .   8.340     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   88    .   27674   2
      27   3   2   .   .   122.110   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   87    .   27674   2
      28   1   1   .   .   176.607   .   .   1   .   1   1   21   ARG   C   .   .   .   .   .   .   .   .   .   .   139   .   27674   2
      28   2   1   .   .   8.176     .   .   1   .   1   1   22   SER   H   .   .   .   .   .   .   .   .   .   .   56    .   27674   2
      28   3   1   .   .   115.643   .   .   1   .   1   1   22   SER   N   .   .   .   .   .   .   .   .   .   .   55    .   27674   2
      29   1   1   .   .   174.472   .   .   1   .   1   1   34   SER   C   .   .   .   .   .   .   .   .   .   .   264   .   27674   2
      29   2   1   .   .   8.277     .   .   1   .   1   1   35   ALA   H   .   .   .   .   .   .   .   .   .   .   58    .   27674   2
      29   3   1   .   .   125.834   .   .   1   .   1   1   35   ALA   N   .   .   .   .   .   .   .   .   .   .   57    .   27674   2
      30   1   1   .   .   173.955   .   .   1   .   1   1   3    PHE   C   .   .   .   .   .   .   .   .   .   .   251   .   27674   2
      30   2   1   .   .   7.637     .   .   1   .   1   1   4    ASP   H   .   .   .   .   .   .   .   .   .   .   60    .   27674   2
      30   3   1   .   .   123.281   .   .   1   .   1   1   4    ASP   N   .   .   .   .   .   .   .   .   .   .   59    .   27674   2
      31   2   1   .   .   8.245     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   62    .   27674   2
      31   3   1   .   .   116.920   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   61    .   27674   2
      32   1   1   .   .   174.585   .   .   1   .   1   1   24   GLY   C   .   .   .   .   .   .   .   .   .   .   204   .   27674   2
      32   2   1   .   .   7.975     .   .   1   .   1   1   25   THR   H   .   .   .   .   .   .   .   .   .   .   64    .   27674   2
      32   3   1   .   .   112.825   .   .   1   .   1   1   25   THR   N   .   .   .   .   .   .   .   .   .   .   63    .   27674   2
      33   2   2   .   .   8.319     .   .   1   .   1   1   65   GLN   H   .   .   .   .   .   .   .   .   .   .   128   .   27674   2
      33   3   2   .   .   122.239   .   .   1   .   1   1   65   GLN   N   .   .   .   .   .   .   .   .   .   .   127   .   27674   2
      34   2   1   .   .   8.352     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   66    .   27674   2
      34   3   1   .   .   122.007   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   65    .   27674   2
      35   1   1   .   .   177.191   .   .   1   .   1   1   15   LEU   C   .   .   .   .   .   .   .   .   .   .   165   .   27674   2
      35   2   1   .   .   7.879     .   .   1   .   1   1   16   CYS   H   .   .   .   .   .   .   .   .   .   .   68    .   27674   2
      35   3   1   .   .   115.791   .   .   1   .   1   1   16   CYS   N   .   .   .   .   .   .   .   .   .   .   67    .   27674   2
      36   1   1   .   .   176.655   .   .   1   .   1   1   68   LEU   C   .   .   .   .   .   .   .   .   .   .   233   .   27674   2
      36   2   1   .   .   8.111     .   .   1   .   1   1   69   VAL   H   .   .   .   .   .   .   .   .   .   .   70    .   27674   2
      36   3   1   .   .   122.951   .   .   1   .   1   1   69   VAL   N   .   .   .   .   .   .   .   .   .   .   69    .   27674   2
      37   1   1   .   .   177.188   .   .   1   .   1   1   7    PHE   C   .   .   .   .   .   .   .   .   .   .   218   .   27674   2
      37   2   1   .   .   8.039     .   .   1   .   1   1   8    ARG   H   .   .   .   .   .   .   .   .   .   .   72    .   27674   2
      37   3   1   .   .   119.653   .   .   1   .   1   1   8    ARG   N   .   .   .   .   .   .   .   .   .   .   71    .   27674   2
      38   2   1   .   .   8.232     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   74    .   27674   2
      38   3   1   .   .   117.606   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   73    .   27674   2
      39   2   1   .   .   8.199     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   76    .   27674   2
      39   3   1   .   .   117.082   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   75    .   27674   2
      40   2   1   .   .   7.892     .   .   1   .   1   1   71   ASP   H   .   .   .   .   .   .   .   .   .   .   78    .   27674   2
      40   3   1   .   .   109.615   .   .   1   .   1   1   71   ASP   N   .   .   .   .   .   .   .   .   .   .   77    .   27674   2
      41   2   1   .   .   7.892     .   .   1   .   1   1   71   ASP   H   .   .   .   .   .   .   .   .   .   .   78    .   27674   2
      41   3   1   .   .   109.200   .   .   1   .   1   1   71   ASP   N   .   .   .   .   .   .   .   .   .   .   77    .   27674   2
      42   2   1   .   .   8.241     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   82    .   27674   2
      42   3   1   .   .   120.506   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   81    .   27674   2
      43   1   1   .   .   174.037   .   .   1   .   1   1   67   THR   C   .   .   .   .   .   .   .   .   .   .   235   .   27674   2
      43   2   1   .   .   8.145     .   .   1   .   1   1   68   LEU   H   .   .   .   .   .   .   .   .   .   .   84    .   27674   2
      43   3   1   .   .   125.408   .   .   1   .   1   1   68   LEU   N   .   .   .   .   .   .   .   .   .   .   83    .   27674   2
      44   1   1   .   .   175.822   .   .   1   .   1   1   13   SER   C   .   .   .   .   .   .   .   .   .   .   209   .   27674   2
      44   2   1   .   .   7.962     .   .   1   .   1   1   14   MET   H   .   .   .   .   .   .   .   .   .   .   86    .   27674   2
      44   3   1   .   .   119.870   .   .   1   .   1   1   14   MET   N   .   .   .   .   .   .   .   .   .   .   85    .   27674   2
      45   1   1   .   .   176.275   .   .   1   .   1   1   12   THR   C   .   .   .   .   .   .   .   .   .   .   213   .   27674   2
      45   2   3   .   .   8.062     .   .   1   .   1   1   13   SER   H   .   .   .   .   .   .   .   .   .   .   90    .   27674   2
      45   3   3   .   .   117.205   .   .   1   .   1   1   13   SER   N   .   .   .   .   .   .   .   .   .   .   89    .   27674   2
      46   2   2   .   .   8.059     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   167   .   27674   2
      46   3   2   .   .   117.131   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   166   .   27674   2
      47   1   1   .   .   175.912   .   .   1   .   1   1   65   GLN   C   .   .   .   .   .   .   .   .   .   .   310   .   27674   2
      47   2   1   .   .   8.396     .   .   1   .   1   1   66   GLU   H   .   .   .   .   .   .   .   .   .   .   92    .   27674   2
      47   3   1   .   .   121.595   .   .   1   .   1   1   66   GLU   N   .   .   .   .   .   .   .   .   .   .   91    .   27674   2
      48   2   1   .   .   8.189     .   .   1   .   1   1   51   LYS   H   .   .   .   .   .   .   .   .   .   .   94    .   27674   2
      48   3   1   .   .   120.752   .   .   1   .   1   1   51   LYS   N   .   .   .   .   .   .   .   .   .   .   93    .   27674   2
      49   1   1   .   .   174.538   .   .   1   .   1   1   22   SER   C   .   .   .   .   .   .   .   .   .   .   182   .   27674   2
      49   2   1   .   .   8.227     .   .   1   .   1   1   23   ALA   H   .   .   .   .   .   .   .   .   .   .   96    .   27674   2
      49   3   1   .   .   125.577   .   .   1   .   1   1   23   ALA   N   .   .   .   .   .   .   .   .   .   .   95    .   27674   2
      50   1   1   .   .   175.134   .   .   1   .   1   1   20   SER   C   .   .   .   .   .   .   .   .   .   .   159   .   27674   2
      50   2   1   .   .   8.253     .   .   1   .   1   1   21   ARG   H   .   .   .   .   .   .   .   .   .   .   98    .   27674   2
      50   3   1   .   .   122.305   .   .   1   .   1   1   21   ARG   N   .   .   .   .   .   .   .   .   .   .   97    .   27674   2
      51   1   1   .   .   174.387   .   .   1   .   1   1   36   SER   C   .   .   .   .   .   .   .   .   .   .   263   .   27674   2
      51   2   1   .   .   8.040     .   .   1   .   1   1   37   TYR   H   .   .   .   .   .   .   .   .   .   .   100   .   27674   2
      51   3   1   .   .   121.838   .   .   1   .   1   1   37   TYR   N   .   .   .   .   .   .   .   .   .   .   99    .   27674   2
      52   1   1   .   .   177.286   .   .   1   .   1   1   45   PRO   C   .   .   .   .   .   .   .   .   .   .   269   .   27674   2
      52   2   1   .   .   8.202     .   .   1   .   1   1   46   GLY   H   .   .   .   .   .   .   .   .   .   .   102   .   27674   2
      52   3   1   .   .   108.932   .   .   1   .   1   1   46   GLY   N   .   .   .   .   .   .   .   .   .   .   101   .   27674   2
      53   1   1   .   .   177.525   .   .   1   .   1   1   8    ARG   C   .   .   .   .   .   .   .   .   .   .   217   .   27674   2
      53   2   1   .   .   8.141     .   .   1   .   1   1   9    GLN   H   .   .   .   .   .   .   .   .   .   .   104   .   27674   2
      53   3   1   .   .   119.030   .   .   1   .   1   1   9    GLN   N   .   .   .   .   .   .   .   .   .   .   103   .   27674   2
      54   1   1   .   .   176.679   .   .   1   .   1   1   14   MET   C   .   .   .   .   .   .   .   .   .   .   150   .   27674   2
      54   2   1   .   .   7.793     .   .   1   .   1   1   15   LEU   H   .   .   .   .   .   .   .   .   .   .   106   .   27674   2
      54   3   1   .   .   117.836   .   .   1   .   1   1   15   LEU   N   .   .   .   .   .   .   .   .   .   .   105   .   27674   2
      55   2   1   .   .   8.340     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   108   .   27674   2
      55   3   1   .   .   110.582   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   107   .   27674   2
      56   1   1   .   .   178.539   .   .   1   .   1   1   10   ALA   C   .   .   .   .   .   .   .   .   .   .   216   .   27674   2
      56   2   1   .   .   8.018     .   .   1   .   1   1   11   SER   H   .   .   .   .   .   .   .   .   .   .   112   .   27674   2
      56   3   1   .   .   112.936   .   .   1   .   1   1   11   SER   N   .   .   .   .   .   .   .   .   .   .   111   .   27674   2
      57   2   1   .   .   8.390     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   114   .   27674   2
      57   3   1   .   .   120.704   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   113   .   27674   2
      58   2   2   .   .   8.393     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   145   .   27674   2
      58   3   2   .   .   120.700   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   144   .   27674   2
      59   1   1   .   .   173.980   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   297   .   27674   2
      59   2   1   .   .   8.064     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   118   .   27674   2
      59   3   1   .   .   123.706   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   117   .   27674   2
      60   1   1   .   .   175.377   .   .   1   .   1   1   17   CYS   C   .   .   .   .   .   .   .   .   .   .   185   .   27674   2
      60   2   1   .   .   8.496     .   .   1   .   1   1   18   GLY   H   .   .   .   .   .   .   .   .   .   .   120   .   27674   2
      60   3   1   .   .   109.659   .   .   1   .   1   1   18   GLY   N   .   .   .   .   .   .   .   .   .   .   119   .   27674   2
      61   2   1   .   .   8.161     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   122   .   27674   2
      61   3   1   .   .   117.174   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   121   .   27674   2
      62   1   1   .   .   177.749   .   .   1   .   1   1   35   ALA   C   .   .   .   .   .   .   .   .   .   .   265   .   27674   2
      62   2   1   .   .   8.125     .   .   1   .   1   1   36   SER   H   .   .   .   .   .   .   .   .   .   .   124   .   27674   2
      62   3   1   .   .   114.415   .   .   1   .   1   1   36   SER   N   .   .   .   .   .   .   .   .   .   .   123   .   27674   2
      63   1   1   .   .   176.761   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   153   .   27674   2
      63   2   1   .   .   8.210     .   .   1   .   1   1   34   SER   H   .   .   .   .   .   .   .   .   .   .   126   .   27674   2
      63   3   1   .   .   116.487   .   .   1   .   1   1   34   SER   N   .   .   .   .   .   .   .   .   .   .   125   .   27674   2
      64   2   1   .   .   8.395     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   130   .   27674   2
      64   3   1   .   .   110.008   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   129   .   27674   2
      65   1   1   .   .   174.490   .   .   1   .   1   1   18   GLY   C   .   .   .   .   .   .   .   .   .   .   163   .   27674   2
      65   2   1   .   .   8.210     .   .   1   .   1   1   19   GLN   H   .   .   .   .   .   .   .   .   .   .   132   .   27674   2
      65   3   1   .   .   119.551   .   .   1   .   1   1   19   GLN   N   .   .   .   .   .   .   .   .   .   .   131   .   27674   2
      66   2   1   .   .   8.316     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   54    .   27674   2
      66   3   1   .   .   121.969   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   53    .   27674   2
      67   2   1   .   .   7.368     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   30    .   27674   2
      67   3   1   .   .   117.535   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   29    .   27674   2
      68   1   1   .   .   173.852   .   .   1   .   1   1   1    ALA   C   .   .   .   .   .   .   .   .   .   .   258   .   27674   2
      68   2   1   .   .   8.677     .   .   1   .   1   1   2    PHE   H   .   .   .   .   .   .   .   .   .   .   180   .   27674   2
      68   3   1   .   .   119.626   .   .   1   .   1   1   2    PHE   N   .   .   .   .   .   .   .   .   .   .   179   .   27674   2
      69   1   1   .   .   174.794   .   .   1   .   1   1   70   VAL   C   .   .   .   .   .   .   .   .   .   .   227   .   27674   2
      69   2   1   .   .   7.885     .   .   1   .   1   1   71   ASP   H   .   .   .   .   .   .   .   .   .   .   78    .   27674   2
      69   3   1   .   .   110.194   .   .   1   .   1   1   71   ASP   N   .   .   .   .   .   .   .   .   .   .   223   .   27674   2
   stop_
save_