Content for NMR-STAR saveframe, "peak_list"

    save_peak_list
   _Spectral_peak_list.Sf_category                      spectral_peak_list
   _Spectral_peak_list.Sf_framecode                     peak_list
   _Spectral_peak_list.Entry_ID                         19178
   _Spectral_peak_list.ID                               1
   _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                    1
   _Spectral_peak_list.Experiment_name                  '2D 1H-15N HSQC/HMQC'
   _Spectral_peak_list.Experiment_class                 .
   _Spectral_peak_list.Experiment_type                  .
   _Spectral_peak_list.Number_of_spectral_dimensions    2
   _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   .   .   H   1    1H    .   .   3662.12109375   .   .   .   .   .   .   .   19178   1
      2   .   .   N   15   15N   .   .   1350.00000000   .   .   .   .   .   .   .   19178   1
   stop_

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

      1     1.0   .   .   19178   1
      2     1.0   .   .   19178   1
      3     1.0   .   .   19178   1
      4     1.0   .   .   19178   1
      5     1.0   .   .   19178   1
      6     1.0   .   .   19178   1
      7     1.0   .   .   19178   1
      8     1.0   .   .   19178   1
      9     1.0   .   .   19178   1
      10    1.0   .   .   19178   1
      11    1.0   .   .   19178   1
      12    1.0   .   .   19178   1
      13    1.0   .   .   19178   1
      14    1.0   .   .   19178   1
      15    1.0   .   .   19178   1
      16    1.0   .   .   19178   1
      17    1.0   .   .   19178   1
      18    1.0   .   .   19178   1
      19    1.0   .   .   19178   1
      20    1.0   .   .   19178   1
      21    1.0   .   .   19178   1
      22    1.0   .   .   19178   1
      23    1.0   .   .   19178   1
      24    1.0   .   .   19178   1
      25    1.0   .   .   19178   1
      26    1.0   .   .   19178   1
      27    1.0   .   .   19178   1
      28    1.0   .   .   19178   1
      29    1.0   .   .   19178   1
      30    1.0   .   .   19178   1
      31    1.0   .   .   19178   1
      32    1.0   .   .   19178   1
      33    1.0   .   .   19178   1
      34    1.0   .   .   19178   1
      35    1.0   .   .   19178   1
      36    1.0   .   .   19178   1
      37    1.0   .   .   19178   1
      38    1.0   .   .   19178   1
      39    1.0   .   .   19178   1
      40    1.0   .   .   19178   1
      41    1.0   .   .   19178   1
      42    1.0   .   .   19178   1
      43    1.0   .   .   19178   1
      44    1.0   .   .   19178   1
      45    1.0   .   .   19178   1
      46    1.0   .   .   19178   1
      47    1.0   .   .   19178   1
      48    1.0   .   .   19178   1
      49    1.0   .   .   19178   1
      50    1.0   .   .   19178   1
      51    1.0   .   .   19178   1
      52    1.0   .   .   19178   1
      53    1.0   .   .   19178   1
      54    1.0   .   .   19178   1
      55    1.0   .   .   19178   1
      56    1.0   .   .   19178   1
      57    1.0   .   .   19178   1
      58    1.0   .   .   19178   1
      59    1.0   .   .   19178   1
      60    1.0   .   .   19178   1
      61    1.0   .   .   19178   1
      62    1.0   .   .   19178   1
      63    1.0   .   .   19178   1
      64    1.0   .   .   19178   1
      65    1.0   .   .   19178   1
      66    1.0   .   .   19178   1
      67    1.0   .   .   19178   1
      68    1.0   .   .   19178   1
      69    1.0   .   .   19178   1
      70    1.0   .   .   19178   1
      71    1.0   .   .   19178   1
      72    1.0   .   .   19178   1
      73    1.0   .   .   19178   1
      74    1.0   .   .   19178   1
      75    1.0   .   .   19178   1
      76    1.0   .   .   19178   1
      77    1.0   .   .   19178   1
      78    1.0   .   .   19178   1
      79    1.0   .   .   19178   1
      80    1.0   .   .   19178   1
      81    1.0   .   .   19178   1
      82    1.0   .   .   19178   1
      83    1.0   .   .   19178   1
      84    1.0   .   .   19178   1
      85    1.0   .   .   19178   1
      86    1.0   .   .   19178   1
      87    1.0   .   .   19178   1
      88    1.0   .   .   19178   1
      89    1.0   .   .   19178   1
      90    1.0   .   .   19178   1
      91    1.0   .   .   19178   1
      92    1.0   .   .   19178   1
      93    1.0   .   .   19178   1
      94    1.0   .   .   19178   1
      95    1.0   .   .   19178   1
      96    1.0   .   .   19178   1
      97    1.0   .   .   19178   1
      98    1.0   .   .   19178   1
      99    1.0   .   .   19178   1
      100   1.0   .   .   19178   1
      101   1.0   .   .   19178   1
      102   1.0   .   .   19178   1
      103   1.0   .   .   19178   1
      104   1.0   .   .   19178   1
   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     8376.42968750      .   height   19178   1
      1     56659.34912110     .   volume   19178   1
      2     16715.02343750     .   height   19178   1
      2     115415.83691400    .   volume   19178   1
      3     14507.36328120     .   height   19178   1
      3     98948.59130860     .   volume   19178   1
      4     14318.01562500     .   height   19178   1
      4     100301.83544900    .   volume   19178   1
      5     12341.89453120     .   height   19178   1
      5     86080.62988280     .   volume   19178   1
      6     3846.24975586      .   height   19178   1
      6     29324.33105470     .   volume   19178   1
      7     23073.95507810     .   height   19178   1
      7     156322.13281200    .   volume   19178   1
      8     16184.68261720     .   height   19178   1
      8     108063.06738300    .   volume   19178   1
      9     18637.09960940     .   height   19178   1
      9     122682.47656200    .   volume   19178   1
      10    12196.79296880     .   height   19178   1
      10    85222.93896480     .   volume   19178   1
      11    5719.81298828      .   height   19178   1
      11    41124.97924800     .   volume   19178   1
      12    13081.96289060     .   height   19178   1
      12    89419.15429690     .   volume   19178   1
      13    15773.60937500     .   height   19178   1
      13    107950.51367200    .   volume   19178   1
      14    16066.59179690     .   height   19178   1
      14    110078.95800800    .   volume   19178   1
      15    10900.23144530     .   height   19178   1
      15    75739.02148440     .   volume   19178   1
      16    11919.26171880     .   height   19178   1
      16    81699.51269530     .   volume   19178   1
      17    9229.60644531      .   height   19178   1
      17    65667.09570310     .   volume   19178   1
      18    14562.24609380     .   height   19178   1
      18    99605.61865230     .   volume   19178   1
      19    9165.85156250      .   height   19178   1
      19    66378.34912110     .   volume   19178   1
      20    18856.98437500     .   height   19178   1
      20    124189.70312500    .   volume   19178   1
      21    16389.65039060     .   height   19178   1
      21    108689.67089800    .   volume   19178   1
      22    24260.33593750     .   height   19178   1
      22    160504.17675800    .   volume   19178   1
      23    13200.79980470     .   height   19178   1
      23    91390.70507810     .   volume   19178   1
      24    244753.62500000    .   height   19178   1
      24    1386327.77344000   .   volume   19178   1
      25    7265.94140625      .   height   19178   1
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      27    15760.77539060     .   height   19178   1
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      28    13254.92968750     .   height   19178   1
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      29    103318.13281200    .   height   19178   1
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      30    18118.57421880     .   height   19178   1
      30    123081.15234400    .   volume   19178   1
      31    21225.79101560     .   height   19178   1
      31    137724.76660200    .   volume   19178   1
      32    13520.24414060     .   height   19178   1
      32    93917.51953120     .   volume   19178   1
      33    17745.29101560     .   height   19178   1
      33    116407.53613300    .   volume   19178   1
      34    13082.11718750     .   height   19178   1
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      36    11856.00878910     .   height   19178   1
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      37    30456.82812500     .   height   19178   1
      37    201009.23828100    .   volume   19178   1
      38    14042.29589840     .   height   19178   1
      38    98997.97998050     .   volume   19178   1
      39    17506.74804690     .   height   19178   1
      39    118983.29101600    .   volume   19178   1
      40    19405.77734380     .   height   19178   1
      40    130105.05957000    .   volume   19178   1
      41    21138.60546880     .   height   19178   1
      41    160184.34668000    .   volume   19178   1
      42    17727.16406250     .   height   19178   1
      42    133852.96875000    .   volume   19178   1
      43    17460.59960940     .   height   19178   1
      43    138598.00781200    .   volume   19178   1
      44    14804.95117190     .   height   19178   1
      44    103551.83007800    .   volume   19178   1
      45    31633.04687500     .   height   19178   1
      45    207252.51855500    .   volume   19178   1
      46    10182.49023440     .   height   19178   1
      46    70954.49707030     .   volume   19178   1
      47    14289.59179690     .   height   19178   1
      47    97502.00390620     .   volume   19178   1
      48    96562.44531250     .   height   19178   1
      48    583275.37500000    .   volume   19178   1
      49    25287.29296880     .   height   19178   1
      49    172055.95312500    .   volume   19178   1
      50    12985.13574220     .   height   19178   1
      50    90703.69677730     .   volume   19178   1
      51    34696.23437500     .   height   19178   1
      51    230097.63281200    .   volume   19178   1
      52    18199.03515620     .   height   19178   1
      52    126148.67773400    .   volume   19178   1
      53    19067.87109380     .   height   19178   1
      53    130744.47753900    .   volume   19178   1
      54    5312.30664062      .   height   19178   1
      54    39453.11865230     .   volume   19178   1
      55    15658.58300780     .   height   19178   1
      55    107621.64941400    .   volume   19178   1
      56    20264.09375000     .   height   19178   1
      56    138163.47558600    .   volume   19178   1
      57    15178.55957030     .   height   19178   1
      57    105850.62011700    .   volume   19178   1
      58    16254.99609380     .   height   19178   1
      58    123084.62500000    .   volume   19178   1
      59    12643.38281250     .   height   19178   1
      59    92719.13330080     .   volume   19178   1
      60    13311.58789060     .   height   19178   1
      60    95908.46484380     .   volume   19178   1
      61    11509.90234380     .   height   19178   1
      61    83517.07080080     .   volume   19178   1
      62    11936.34277340     .   height   19178   1
      62    84680.54736330     .   volume   19178   1
      63    11609.64746090     .   height   19178   1
      63    85655.71337890     .   volume   19178   1
      64    17591.57617190     .   height   19178   1
      64    119297.84277300    .   volume   19178   1
      65    18651.59375000     .   height   19178   1
      65    126303.52734400    .   volume   19178   1
      66    29772.16796880     .   height   19178   1
      66    196080.32031200    .   volume   19178   1
      67    32749.54296880     .   height   19178   1
      67    234196.05468800    .   volume   19178   1
      68    13590.95214840     .   height   19178   1
      68    95196.77587890     .   volume   19178   1
      69    13126.54003910     .   height   19178   1
      69    90310.27343750     .   volume   19178   1
      70    55088.26562500     .   height   19178   1
      70    343511.39453100    .   volume   19178   1
      71    19478.12695310     .   height   19178   1
      71    139155.95703100    .   volume   19178   1
      72    18729.30468750     .   height   19178   1
      72    137930.29882800    .   volume   19178   1
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      73    146814.10644500    .   volume   19178   1
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      75    182710.76953100    .   volume   19178   1
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      76    159078.12793000    .   volume   19178   1
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      78    52720.55859380     .   volume   19178   1
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      80    110273.23437500    .   volume   19178   1
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      83    21025.03320310     .   height   19178   1
      83    133333.09765600    .   volume   19178   1
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      84    86763.53320310     .   volume   19178   1
      85    32363.42187500     .   height   19178   1
      85    193059.88378900    .   volume   19178   1
      86    36306.90234380     .   height   19178   1
      86    218333.17968800    .   volume   19178   1
      87    22680.49023440     .   height   19178   1
      87    145978.85888700    .   volume   19178   1
      88    22681.95507810     .   height   19178   1
      88    151396.47363300    .   volume   19178   1
      89    27268.86914060     .   height   19178   1
      89    164195.73242200    .   volume   19178   1
      90    22196.75390620     .   height   19178   1
      90    137661.71679700    .   volume   19178   1
      91    29588.55078120     .   height   19178   1
      91    189873.42968800    .   volume   19178   1
      92    21309.15429690     .   height   19178   1
      92    136047.63183600    .   volume   19178   1
      93    35490.04296880     .   height   19178   1
      93    209661.46875000    .   volume   19178   1
      94    20164.54296880     .   height   19178   1
      94    128383.63671900    .   volume   19178   1
      95    48867.54296880     .   height   19178   1
      95    274279.57226600    .   volume   19178   1
      96    47495.67968750     .   height   19178   1
      96    311026.32226600    .   volume   19178   1
      97    21728.68750000     .   height   19178   1
      97    138613.06933600    .   volume   19178   1
      98    17228.16992190     .   height   19178   1
      98    119215.18554700    .   volume   19178   1
      99    18430.55664060     .   height   19178   1
      99    136804.60937500    .   volume   19178   1
      100   9895.35156250      .   height   19178   1
      100   69057.40429690     .   volume   19178   1
      101   16537.24414060     .   height   19178   1
      101   111705.73632800    .   volume   19178   1
      102   13626.61328120     .   height   19178   1
      102   95419.91650390     .   volume   19178   1
      103   17506.74804690     .   height   19178   1
      103   118983.29101600    .   volume   19178   1
      104   32049.83593750     .   height   19178   1
      104   207169.78320300    .   volume   19178   1
   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

      2     1   10.130    .   26.2417846918   .   .   .   .   .   .   .   .   .   .   .   19178   1
      2     2   128.878   .   17.3978336155   .   .   .   .   .   .   .   .   .   .   .   19178   1
      3     1   7.529     .   23.8138594627   .   .   .   .   .   .   .   .   .   .   .   19178   1
      3     2   110.105   .   17.2816604376   .   .   .   .   .   .   .   .   .   .   .   19178   1
      4     1   7.330     .   25.9514990648   .   .   .   .   .   .   .   .   .   .   .   19178   1
      4     2   109.970   .   18.8330501318   .   .   .   .   .   .   .   .   .   .   .   19178   1
      5     1   8.940     .   24.7450050513   .   .   .   .   .   .   .   .   .   .   .   19178   1
      5     2   110.755   .   17.8973078728   .   .   .   .   .   .   .   .   .   .   .   19178   1
      6     1   8.514     .   31.6308752696   .   .   .   .   .   .   .   .   .   .   .   19178   1
      6     2   110.601   .   21.8855381012   .   .   .   .   .   .   .   .   .   .   .   19178   1
      7     1   8.869     .   22.6167236964   .   .   .   .   .   .   .   .   .   .   .   19178   1
      7     2   112.673   .   17.0265018940   .   .   .   .   .   .   .   .   .   .   .   19178   1
      8     1   9.205     .   24.9498066902   .   .   .   .   .   .   .   .   .   .   .   19178   1
      8     2   112.184   .   16.7533189058   .   .   .   .   .   .   .   .   .   .   .   19178   1
      9     1   8.970     .   21.4513519804   .   .   .   .   .   .   .   .   .   .   .   19178   1
      9     2   115.463   .   16.7488127947   .   .   .   .   .   .   .   .   .   .   .   19178   1
      10    1   8.854     .   26.0927726030   .   .   .   .   .   .   .   .   .   .   .   19178   1
      10    2   116.630   .   17.6740139723   .   .   .   .   .   .   .   .   .   .   .   19178   1
      11    1   9.548     .   30.5321810643   .   .   .   .   .   .   .   .   .   .   .   19178   1
      11    2   120.775   .   17.6666915417   .   .   .   .   .   .   .   .   .   .   .   19178   1
      12    1   8.819     .   24.5466821988   .   .   .   .   .   .   .   .   .   .   .   19178   1
      12    2   122.759   .   17.6559090614   .   .   .   .   .   .   .   .   .   .   .   19178   1
      13    1   8.918     .   27.2096434037   .   .   .   .   .   .   .   .   .   .   .   19178   1
      13    2   122.502   .   16.2086427212   .   .   .   .   .   .   .   .   .   .   .   19178   1
      14    1   8.969     .   25.4914152424   .   .   .   .   .   .   .   .   .   .   .   19178   1
      14    2   122.034   .   17.1330794692   .   .   .   .   .   .   .   .   .   .   .   19178   1
      15    1   8.964     .   25.3913539847   .   .   .   .   .   .   .   .   .   .   .   19178   1
      15    2   120.667   .   17.9041475058   .   .   .   .   .   .   .   .   .   .   .   19178   1
      16    1   9.026     .   23.9357866247   .   .   .   .   .   .   .   .   .   .   .   19178   1
      16    2   118.882   .   19.5466250181   .   .   .   .   .   .   .   .   .   .   .   19178   1
      17    1   8.897     .   27.5672364235   .   .   .   .   .   .   .   .   .   .   .   19178   1
      17    2   118.703   .   18.3331936598   .   .   .   .   .   .   .   .   .   .   .   19178   1
      18    1   8.690     .   24.4453611771   .   .   .   .   .   .   .   .   .   .   .   19178   1
      18    2   117.474   .   17.1812385321   .   .   .   .   .   .   .   .   .   .   .   19178   1
      19    1   8.817     .   29.7502275308   .   .   .   .   .   .   .   .   .   .   .   19178   1
      19    2   124.924   .   18.7688782811   .   .   .   .   .   .   .   .   .   .   .   19178   1
      20    1   8.928     .   21.9470691284   .   .   .   .   .   .   .   .   .   .   .   19178   1
      20    2   126.238   .   16.4800956845   .   .   .   .   .   .   .   .   .   .   .   19178   1
      21    1   8.712     .   22.4709510008   .   .   .   .   .   .   .   .   .   .   .   19178   1
      21    2   126.587   .   16.6680850089   .   .   .   .   .   .   .   .   .   .   .   19178   1
      22    1   8.568     .   21.9422100385   .   .   .   .   .   .   .   .   .   .   .   19178   1
      22    2   128.053   .   16.5457963943   .   .   .   .   .   .   .   .   .   .   .   19178   1
      23    1   7.815     .   27.4759935141   .   .   .   .   .   .   .   .   .   .   .   19178   1
      23    2   128.130   .   17.1668149531   .   .   .   .   .   .   .   .   .   .   .   19178   1
      24    1   7.886     .   16.2945079009   .   .   .   .   .   .   .   .   .   .   .   19178   1
      24    2   126.602   .   13.8820007443   .   .   .   .   .   .   .   .   .   .   .   19178   1
      25    1   7.888     .   29.0247834126   .   .   .   .   .   .   .   .   .   .   .   19178   1
      25    2   125.735   .   19.2894145846   .   .   .   .   .   .   .   .   .   .   .   19178   1
      26    1   7.609     .   24.9798610608   .   .   .   .   .   .   .   .   .   .   .   19178   1
      26    2   125.787   .   17.8377024829   .   .   .   .   .   .   .   .   .   .   .   19178   1
      27    1   6.778     .   23.0977735917   .   .   .   .   .   .   .   .   .   .   .   19178   1
      27    2   123.400   .   17.6584437490   .   .   .   .   .   .   .   .   .   .   .   19178   1
      28    1   8.311     .   25.0205334425   .   .   .   .   .   .   .   .   .   .   .   19178   1
      28    2   125.750   .   18.2431720197   .   .   .   .   .   .   .   .   .   .   .   19178   1
      29    1   8.236     .   17.9933896859   .   .   .   .   .   .   .   .   .   .   .   19178   1
      29    2   125.070   .   14.8867025971   .   .   .   .   .   .   .   .   .   .   .   19178   1
      30    1   8.114     .   22.4952464501   .   .   .   .   .   .   .   .   .   .   .   19178   1
      30    2   125.059   .   17.5373017788   .   .   .   .   .   .   .   .   .   .   .   19178   1
      31    1   8.239     .   23.5277130604   .   .   .   .   .   .   .   .   .   .   .   19178   1
      31    2   124.385   .   15.4340341687   .   .   .   .   .   .   .   .   .   .   .   19178   1
      32    1   7.686     .   23.6295739810   .   .   .   .   .   .   .   .   .   .   .   19178   1
      32    2   114.041   .   18.9108610153   .   .   .   .   .   .   .   .   .   .   .   19178   1
      33    1   7.555     .   22.1308147113   .   .   .   .   .   .   .   .   .   .   .   19178   1
      33    2   114.004   .   16.6307687759   .   .   .   .   .   .   .   .   .   .   .   19178   1
      34    1   7.095     .   26.8869638443   .   .   .   .   .   .   .   .   .   .   .   19178   1
      34    2   115.594   .   19.2670047283   .   .   .   .   .   .   .   .   .   .   .   19178   1
      35    1   7.745     .   22.2269167105   .   .   .   .   .   .   .   .   .   .   .   19178   1
      35    2   113.467   .   16.4970338345   .   .   .   .   .   .   .   .   .   .   .   19178   1
      36    1   7.325     .   25.1738647223   .   .   .   .   .   .   .   .   .   .   .   19178   1
      36    2   117.323   .   17.4883782864   .   .   .   .   .   .   .   .   .   .   .   19178   1
      37    1   7.614     .   22.7160650889   .   .   .   .   .   .   .   .   .   .   .   19178   1
      37    2   117.971   .   15.9584730864   .   .   .   .   .   .   .   .   .   .   .   19178   1
      38    1   7.743     .   24.6413444678   .   .   .   .   .   .   .   .   .   .   .   19178   1
      38    2   117.049   .   18.4713542461   .   .   .   .   .   .   .   .   .   .   .   19178   1
      39    1   7.639     .   51.4568616947   .   .   .   .   .   .   .   .   .   .   .   19178   1
      39    2   118.762   .   17.0052587986   .   .   .   .   .   .   .   .   .   .   .   19178   1
      40    1   7.658     .   21.6098122994   .   .   .   .   .   .   .   .   .   .   .   19178   1
      40    2   122.773   .   18.1241422892   .   .   .   .   .   .   .   .   .   .   .   19178   1
      41    1   7.719     .   56.4955579042   .   .   .   .   .   .   .   .   .   .   .   19178   1
      41    2   122.370   .   19.9634805322   .   .   .   .   .   .   .   .   .   .   .   19178   1
      42    1   7.675     .   60.3396378756   .   .   .   .   .   .   .   .   .   .   .   19178   1
      42    2   122.294   .   19.3117037416   .   .   .   .   .   .   .   .   .   .   .   19178   1
      43    1   7.695     .   54.3667366505   .   .   .   .   .   .   .   .   .   .   .   19178   1
      43    2   122.284   .   20.3476667404   .   .   .   .   .   .   .   .   .   .   .   19178   1
      44    1   7.730     .   25.5784289440   .   .   .   .   .   .   .   .   .   .   .   19178   1
      44    2   121.444   .   18.0665686727   .   .   .   .   .   .   .   .   .   .   .   19178   1
      45    1   7.510     .   22.1423325539   .   .   .   .   .   .   .   .   .   .   .   19178   1
      45    2   121.369   .   16.0325825214   .   .   .   .   .   .   .   .   .   .   .   19178   1
      46    1   7.718     .   25.8930100203   .   .   .   .   .   .   .   .   .   .   .   19178   1
      46    2   120.254   .   17.8961813450   .   .   .   .   .   .   .   .   .   .   .   19178   1
      47    1   7.508     .   23.8131395976   .   .   .   .   .   .   .   .   .   .   .   19178   1
      47    2   120.141   .   18.0163979530   .   .   .   .   .   .   .   .   .   .   .   19178   1
      48    1   7.824     .   18.2052100102   .   .   .   .   .   .   .   .   .   .   .   19178   1
      48    2   123.003   .   14.5242422819   .   .   .   .   .   .   .   .   .   .   .   19178   1
      49    1   8.207     .   24.2286817630   .   .   .   .   .   .   .   .   .   .   .   19178   1
      49    2   118.606   .   16.4281547070   .   .   .   .   .   .   .   .   .   .   .   19178   1
      50    1   8.116     .   25.1508290370   .   .   .   .   .   .   .   .   .   .   .   19178   1
      50    2   117.961   .   18.5910880566   .   .   .   .   .   .   .   .   .   .   .   19178   1
      51    1   8.028     .   22.0138366222   .   .   .   .   .   .   .   .   .   .   .   19178   1
      51    2   119.058   .   17.0308470726   .   .   .   .   .   .   .   .   .   .   .   19178   1
      52    1   8.244     .   25.5341572364   .   .   .   .   .   .   .   .   .   .   .   19178   1
      52    2   119.365   .   17.4060612917   .   .   .   .   .   .   .   .   .   .   .   19178   1
      53    1   8.536     .   22.6941092014   .   .   .   .   .   .   .   .   .   .   .   19178   1
      53    2   118.165   .   18.1277632713   .   .   .   .   .   .   .   .   .   .   .   19178   1
      54    1   8.475     .   31.7663898865   .   .   .   .   .   .   .   .   .   .   .   19178   1
      54    2   117.557   .   19.9511289597   .   .   .   .   .   .   .   .   .   .   .   19178   1
      55    1   8.615     .   25.5364967982   .   .   .   .   .   .   .   .   .   .   .   19178   1
      55    2   118.622   .   17.5960421562   .   .   .   .   .   .   .   .   .   .   .   19178   1
      56    1   8.585     .   23.1002931197   .   .   .   .   .   .   .   .   .   .   .   19178   1
      56    2   120.487   .   18.0184096098   .   .   .   .   .   .   .   .   .   .   .   19178   1
      57    1   8.733     .   26.7001588345   .   .   .   .   .   .   .   .   .   .   .   19178   1
      57    2   120.450   .   18.0262148380   .   .   .   .   .   .   .   .   .   .   .   19178   1
      58    1   8.723     .   32.2711953322   .   .   .   .   .   .   .   .   .   .   .   19178   1
      58    2   119.247   .   21.6474384069   .   .   .   .   .   .   .   .   .   .   .   19178   1
      59    1   8.612     .   77.6869485776   .   .   .   .   .   .   .   .   .   .   .   19178   1
      59    2   122.013   .   20.1648876071   .   .   .   .   .   .   .   .   .   .   .   19178   1
      61    1   8.660     .   83.1426266829   .   .   .   .   .   .   .   .   .   .   .   19178   1
      61    2   121.865   .   18.3526664972   .   .   .   .   .   .   .   .   .   .   .   19178   1
      62    1   8.464     .   26.8291946650   .   .   .   .   .   .   .   .   .   .   .   19178   1
      62    2   122.260   .   18.6476960778   .   .   .   .   .   .   .   .   .   .   .   19178   1
      63    1   8.429     .   30.7780150175   .   .   .   .   .   .   .   .   .   .   .   19178   1
      63    2   123.344   .   20.3973546624   .   .   .   .   .   .   .   .   .   .   .   19178   1
      64    1   8.554     .   25.7639741898   .   .   .   .   .   .   .   .   .   .   .   19178   1
      64    2   125.530   .   16.3297846913   .   .   .   .   .   .   .   .   .   .   .   19178   1
      65    1   8.574     .   23.9544131358   .   .   .   .   .   .   .   .   .   .   .   19178   1
      65    2   124.725   .   16.7669579387   .   .   .   .   .   .   .   .   .   .   .   19178   1
      66    1   8.576     .   21.1410001119   .   .   .   .   .   .   .   .   .   .   .   19178   1
      66    2   124.028   .   17.0069083571   .   .   .   .   .   .   .   .   .   .   .   19178   1
      67    1   8.169     .   24.8240102530   .   .   .   .   .   .   .   .   .   .   .   19178   1
      67    2   121.943   .   19.7607859969   .   .   .   .   .   .   .   .   .   .   .   19178   1
      68    1   8.062     .   26.3776592414   .   .   .   .   .   .   .   .   .   .   .   19178   1
      68    2   121.974   .   18.6634272337   .   .   .   .   .   .   .   .   .   .   .   19178   1
      69    1   8.085     .   26.2846166690   .   .   .   .   .   .   .   .   .   .   .   19178   1
      69    2   122.743   .   17.1908542514   .   .   .   .   .   .   .   .   .   .   .   19178   1
      70    1   7.995     .   19.1826069355   .   .   .   .   .   .   .   .   .   .   .   19178   1
      70    2   121.000   .   15.4456615448   .   .   .   .   .   .   .   .   .   .   .   19178   1
      71    1   8.354     .   41.9807366530   .   .   .   .   .   .   .   .   .   .   .   19178   1
      71    2   121.533   .   19.0988302231   .   .   .   .   .   .   .   .   .   .   .   19178   1
      72    1   8.322     .   46.8533239762   .   .   .   .   .   .   .   .   .   .   .   19178   1
      72    2   121.441   .   19.1744282842   .   .   .   .   .   .   .   .   .   .   .   19178   1
      73    1   8.488     .   43.3283242385   .   .   .   .   .   .   .   .   .   .   .   19178   1
      73    2   119.777   .   17.6890611649   .   .   .   .   .   .   .   .   .   .   .   19178   1
      74    1   8.379     .   23.1096513669   .   .   .   .   .   .   .   .   .   .   .   19178   1
      74    2   120.223   .   17.9344832897   .   .   .   .   .   .   .   .   .   .   .   19178   1
      75    1   8.389     .   26.1588202318   .   .   .   .   .   .   .   .   .   .   .   19178   1
      75    2   119.436   .   21.3252514601   .   .   .   .   .   .   .   .   .   .   .   19178   1
      76    1   8.372     .   32.3645978371   .   .   .   .   .   .   .   .   .   .   .   19178   1
      76    2   119.323   .   23.3402073383   .   .   .   .   .   .   .   .   .   .   .   19178   1
      77    1   8.440     .   79.9692810774   .   .   .   .   .   .   .   .   .   .   .   19178   1
      77    2   119.165   .   31.1093866825   .   .   .   .   .   .   .   .   .   .   .   19178   1
      81    1   8.139     .   24.2943694592   .   .   .   .   .   .   .   .   .   .   .   19178   1
      81    2   116.272   .   18.0706322193   .   .   .   .   .   .   .   .   .   .   .   19178   1
      82    1   8.200     .   19.1410347223   .   .   .   .   .   .   .   .   .   .   .   19178   1
      82    2   116.003   .   15.9891307354   .   .   .   .   .   .   .   .   .   .   .   19178   1
      83    1   7.031     .   20.0414060752   .   .   .   .   .   .   .   .   .   .   .   19178   1
      83    2   116.005   .   15.7993912697   .   .   .   .   .   .   .   .   .   .   .   19178   1
      85    1   7.793     .   16.4357814391   .   .   .   .   .   .   .   .   .   .   .   19178   1
      85    2   113.007   .   15.3952091932   .   .   .   .   .   .   .   .   .   .   .   19178   1
      86    1   6.848     .   17.3815042973   .   .   .   .   .   .   .   .   .   .   .   19178   1
      86    2   113.009   .   15.7009810209   .   .   .   .   .   .   .   .   .   .   .   19178   1
      87    1   7.677     .   20.6973832051   .   .   .   .   .   .   .   .   .   .   .   19178   1
      87    2   112.643   .   15.9915447235   .   .   .   .   .   .   .   .   .   .   .   19178   1
      88    1   6.816     .   38.3761918147   .   .   .   .   .   .   .   .   .   .   .   19178   1
      88    2   112.640   .   16.1514312029   .   .   .   .   .   .   .   .   .   .   .   19178   1
      91    1   7.455     .   22.7349615494   .   .   .   .   .   .   .   .   .   .   .   19178   1
      91    2   111.836   .   16.2399441004   .   .   .   .   .   .   .   .   .   .   .   19178   1
      92    1   6.935     .   21.4838358959   .   .   .   .   .   .   .   .   .   .   .   19178   1
      92    2   111.833   .   15.5917882919   .   .   .   .   .   .   .   .   .   .   .   19178   1
      95    1   7.239     .   15.5769822995   .   .   .   .   .   .   .   .   .   .   .   19178   1
      95    2   112.571   .   14.6797835827   .   .   .   .   .   .   .   .   .   .   .   19178   1
      96    1   6.976     .   19.4061250687   .   .   .   .   .   .   .   .   .   .   .   19178   1
      96    2   112.598   .   17.6972687244   .   .   .   .   .   .   .   .   .   .   .   19178   1
      98    1   7.392     .   24.8501053651   .   .   .   .   .   .   .   .   .   .   .   19178   1
      98    2   117.562   .   17.8621441126   .   .   .   .   .   .   .   .   .   .   .   19178   1
      99    1   8.515     .   46.8182305495   .   .   .   .   .   .   .   .   .   .   .   19178   1
      99    2   119.738   .   17.7925407887   .   .   .   .   .   .   .   .   .   .   .   19178   1
      100   1   9.009     .   27.3035858075   .   .   .   .   .   .   .   .   .   .   .   19178   1
      100   2   127.824   .   17.2969490290   .   .   .   .   .   .   .   .   .   .   .   19178   1
      101   1   7.230     .   23.6729458570   .   .   .   .   .   .   .   .   .   .   .   19178   1
      101   2   127.965   .   16.8206289411   .   .   .   .   .   .   .   .   .   .   .   19178   1
   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

      2     1   1   .   .   10.130    .   .   1   .   1   1   19   TRP   HE1    .   .   .   .   .   .   .   .   .   .   1     .   19178   1
      2     2   1   .   .   128.878   .   .   1   .   1   1   19   TRP   NE1    .   .   .   .   .   .   .   .   .   .   2     .   19178   1
      3     1   1   .   .   7.529     .   .   1   .   1   1   28   GLY   H      .   .   .   .   .   .   .   .   .   .   65    .   19178   1
      3     2   1   .   .   110.105   .   .   1   .   1   1   28   GLY   N      .   .   .   .   .   .   .   .   .   .   66    .   19178   1
      4     1   1   .   .   7.330     .   .   1   .   1   1   27   SER   H      .   .   .   .   .   .   .   .   .   .   68    .   19178   1
      4     2   1   .   .   109.970   .   .   1   .   1   1   27   SER   N      .   .   .   .   .   .   .   .   .   .   67    .   19178   1
      5     1   1   .   .   8.940     .   .   1   .   1   1   26   GLY   H      .   .   .   .   .   .   .   .   .   .   9     .   19178   1
      5     2   1   .   .   110.755   .   .   1   .   1   1   26   GLY   N      .   .   .   .   .   .   .   .   .   .   10    .   19178   1
      6     1   1   .   .   8.514     .   .   1   .   1   1   4    GLY   H      .   .   .   .   .   .   .   .   .   .   12    .   19178   1
      6     2   1   .   .   110.601   .   .   1   .   1   1   4    GLY   N      .   .   .   .   .   .   .   .   .   .   11    .   19178   1
      7     1   1   .   .   8.869     .   .   1   .   1   1   38   ASP   H      .   .   .   .   .   .   .   .   .   .   8     .   19178   1
      7     2   1   .   .   112.673   .   .   1   .   1   1   38   ASP   N      .   .   .   .   .   .   .   .   .   .   7     .   19178   1
      8     1   1   .   .   9.205     .   .   1   .   1   1   44   GLY   H      .   .   .   .   .   .   .   .   .   .   5     .   19178   1
      8     2   1   .   .   112.184   .   .   1   .   1   1   44   GLY   N      .   .   .   .   .   .   .   .   .   .   6     .   19178   1
      9     1   1   .   .   8.970     .   .   1   .   1   1   48   SER   H      .   .   .   .   .   .   .   .   .   .   14    .   19178   1
      9     2   1   .   .   115.463   .   .   1   .   1   1   48   SER   N      .   .   .   .   .   .   .   .   .   .   13    .   19178   1
      10    1   1   .   .   8.854     .   .   1   .   1   1   82   GLU   H      .   .   .   .   .   .   .   .   .   .   15    .   19178   1
      10    2   1   .   .   116.630   .   .   1   .   1   1   82   GLU   N      .   .   .   .   .   .   .   .   .   .   16    .   19178   1
      11    1   1   .   .   9.548     .   .   1   .   1   1   68   ASN   H      .   .   .   .   .   .   .   .   .   .   3     .   19178   1
      11    2   1   .   .   120.775   .   .   1   .   1   1   68   ASN   N      .   .   .   .   .   .   .   .   .   .   4     .   19178   1
      12    1   1   .   .   8.819     .   .   1   .   1   1   20   ALA   H      .   .   .   .   .   .   .   .   .   .   30    .   19178   1
      12    2   1   .   .   122.759   .   .   1   .   1   1   20   ALA   N      .   .   .   .   .   .   .   .   .   .   29    .   19178   1
      13    1   1   .   .   8.918     .   .   1   .   1   1   35   ILE   H      .   .   .   .   .   .   .   .   .   .   28    .   19178   1
      13    2   1   .   .   122.502   .   .   1   .   1   1   35   ILE   N      .   .   .   .   .   .   .   .   .   .   27    .   19178   1
      14    1   1   .   .   8.969     .   .   1   .   1   1   31   ALA   H      .   .   .   .   .   .   .   .   .   .   26    .   19178   1
      14    2   1   .   .   122.034   .   .   1   .   1   1   31   ALA   N      .   .   .   .   .   .   .   .   .   .   25    .   19178   1
      15    1   1   .   .   8.964     .   .   1   .   1   1   58   TYR   H      .   .   .   .   .   .   .   .   .   .   24    .   19178   1
      15    2   1   .   .   120.667   .   .   1   .   1   1   58   TYR   N      .   .   .   .   .   .   .   .   .   .   23    .   19178   1
      16    1   1   .   .   9.026     .   .   1   .   1   1   81   TYR   H      .   .   .   .   .   .   .   .   .   .   19    .   19178   1
      16    2   1   .   .   118.882   .   .   1   .   1   1   81   TYR   N      .   .   .   .   .   .   .   .   .   .   20    .   19178   1
      17    1   1   .   .   8.897     .   .   1   .   1   1   57   LEU   H      .   .   .   .   .   .   .   .   .   .   17    .   19178   1
      17    2   1   .   .   118.703   .   .   1   .   1   1   57   LEU   N      .   .   .   .   .   .   .   .   .   .   18    .   19178   1
      18    1   1   .   .   8.690     .   .   1   .   1   1   21   MET   H      .   .   .   .   .   .   .   .   .   .   22    .   19178   1
      18    2   1   .   .   117.474   .   .   1   .   1   1   21   MET   N      .   .   .   .   .   .   .   .   .   .   21    .   19178   1
      19    1   1   .   .   8.817     .   .   1   .   1   1   41   LEU   H      .   .   .   .   .   .   .   .   .   .   32    .   19178   1
      19    2   1   .   .   124.924   .   .   1   .   1   1   41   LEU   N      .   .   .   .   .   .   .   .   .   .   31    .   19178   1
      20    1   1   .   .   8.928     .   .   1   .   1   1   90   CYS   H      .   .   .   .   .   .   .   .   .   .   34    .   19178   1
      20    2   1   .   .   126.238   .   .   1   .   1   1   90   CYS   N      .   .   .   .   .   .   .   .   .   .   33    .   19178   1
      21    1   1   .   .   8.712     .   .   1   .   1   1   47   ALA   H      .   .   .   .   .   .   .   .   .   .   35    .   19178   1
      21    2   1   .   .   126.587   .   .   1   .   1   1   47   ALA   N      .   .   .   .   .   .   .   .   .   .   36    .   19178   1
      22    1   1   .   .   8.568     .   .   1   .   1   1   34   ARG   H      .   .   .   .   .   .   .   .   .   .   38    .   19178   1
      22    2   1   .   .   128.053   .   .   1   .   1   1   34   ARG   N      .   .   .   .   .   .   .   .   .   .   37    .   19178   1
      23    1   1   .   .   7.815     .   .   1   .   1   1   40   ILE   H      .   .   .   .   .   .   .   .   .   .   42    .   19178   1
      23    2   1   .   .   128.130   .   .   1   .   1   1   40   ILE   N      .   .   .   .   .   .   .   .   .   .   41    .   19178   1
      24    1   1   .   .   7.886     .   .   1   .   1   1   99   ASP   H      .   .   .   .   .   .   .   .   .   .   45    .   19178   1
      24    2   1   .   .   126.602   .   .   1   .   1   1   99   ASP   N      .   .   .   .   .   .   .   .   .   .   46    .   19178   1
      25    1   1   .   .   7.888     .   .   1   .   1   1   24   LEU   H      .   .   .   .   .   .   .   .   .   .   47    .   19178   1
      25    2   1   .   .   125.735   .   .   1   .   1   1   24   LEU   N      .   .   .   .   .   .   .   .   .   .   48    .   19178   1
      26    1   1   .   .   7.609     .   .   1   .   1   1   50   ALA   H      .   .   .   .   .   .   .   .   .   .   50    .   19178   1
      26    2   1   .   .   125.787   .   .   1   .   1   1   50   ALA   N      .   .   .   .   .   .   .   .   .   .   49    .   19178   1
      27    1   1   .   .   6.778     .   .   1   .   1   1   73   ALA   H      .   .   .   .   .   .   .   .   .   .   40    .   19178   1
      27    2   1   .   .   123.400   .   .   1   .   1   1   73   ALA   N      .   .   .   .   .   .   .   .   .   .   39    .   19178   1
      28    1   1   .   .   8.311     .   .   1   .   1   1   33   CYS   H      .   .   .   .   .   .   .   .   .   .   58    .   19178   1
      28    2   1   .   .   125.750   .   .   1   .   1   1   33   CYS   N      .   .   .   .   .   .   .   .   .   .   57    .   19178   1
      29    1   1   .   .   8.236     .   .   1   .   1   1   98   ASP   H      .   .   .   .   .   .   .   .   .   .   56    .   19178   1
      29    2   1   .   .   125.070   .   .   1   .   1   1   98   ASP   N      .   .   .   .   .   .   .   .   .   .   55    .   19178   1
      30    1   1   .   .   8.114     .   .   1   .   1   1   88   ASP   H      .   .   .   .   .   .   .   .   .   .   51    .   19178   1
      30    2   1   .   .   125.059   .   .   1   .   1   1   88   ASP   N      .   .   .   .   .   .   .   .   .   .   52    .   19178   1
      31    1   1   .   .   8.239     .   .   1   .   1   1   39   VAL   H      .   .   .   .   .   .   .   .   .   .   54    .   19178   1
      31    2   1   .   .   124.385   .   .   1   .   1   1   39   VAL   N      .   .   .   .   .   .   .   .   .   .   53    .   19178   1
      32    1   1   .   .   7.686     .   .   1   .   1   1   71   THR   H      .   .   .   .   .   .   .   .   .   .   59    .   19178   1
      32    2   1   .   .   114.041   .   .   1   .   1   1   71   THR   N      .   .   .   .   .   .   .   .   .   .   60    .   19178   1
      33    1   1   .   .   7.555     .   .   1   .   1   1   83   SER   H      .   .   .   .   .   .   .   .   .   .   62    .   19178   1
      33    2   1   .   .   114.004   .   .   1   .   1   1   83   SER   N      .   .   .   .   .   .   .   .   .   .   61    .   19178   1
      34    1   2   .   .   7.095     .   .   1   .   1   1   30   LEU   H      .   .   .   .   .   .   .   .   .   .   681   .   19178   1
      34    2   2   .   .   115.594   .   .   1   .   1   1   30   LEU   N      .   .   .   .   .   .   .   .   .   .   682   .   19178   1
      35    1   1   .   .   7.745     .   .   1   .   1   1   94   SER   H      .   .   .   .   .   .   .   .   .   .   63    .   19178   1
      35    2   1   .   .   113.467   .   .   1   .   1   1   94   SER   N      .   .   .   .   .   .   .   .   .   .   64    .   19178   1
      36    1   1   .   .   7.325     .   .   1   .   1   1   84   TYR   H      .   .   .   .   .   .   .   .   .   .   70    .   19178   1
      36    2   1   .   .   117.323   .   .   1   .   1   1   84   TYR   N      .   .   .   .   .   .   .   .   .   .   69    .   19178   1
      37    1   1   .   .   7.614     .   .   1   .   1   1   89   ASP   H      .   .   .   .   .   .   .   .   .   .   74    .   19178   1
      37    2   1   .   .   117.971   .   .   1   .   1   1   89   ASP   N      .   .   .   .   .   .   .   .   .   .   73    .   19178   1
      38    1   1   .   .   7.743     .   .   1   .   1   1   23   THR   H      .   .   .   .   .   .   .   .   .   .   71    .   19178   1
      38    2   1   .   .   117.049   .   .   1   .   1   1   23   THR   N      .   .   .   .   .   .   .   .   .   .   72    .   19178   1
      39    1   1   .   .   7.639     .   .   1   .   1   1   85   CYS   H      .   .   .   .   .   .   .   .   .   .   76    .   19178   1
      39    2   1   .   .   118.762   .   .   1   .   1   1   85   CYS   N      .   .   .   .   .   .   .   .   .   .   75    .   19178   1
      40    1   1   .   .   7.658     .   .   1   .   1   1   76   ALA   H      .   .   .   .   .   .   .   .   .   .   90    .   19178   1
      40    2   1   .   .   122.773   .   .   1   .   1   1   76   ALA   N      .   .   .   .   .   .   .   .   .   .   89    .   19178   1
      41    1   1   .   .   7.719     .   .   1   .   1   1   80   ALA   H      .   .   .   .   .   .   .   .   .   .   85    .   19178   1
      41    2   1   .   .   122.370   .   .   1   .   1   1   80   ALA   N      .   .   .   .   .   .   .   .   .   .   86    .   19178   1
      42    1   1   .   .   7.675     .   .   1   .   1   1   56   TYR   H      .   .   .   .   .   .   .   .   .   .   87    .   19178   1
      42    2   1   .   .   122.294   .   .   1   .   1   1   56   TYR   N      .   .   .   .   .   .   .   .   .   .   88    .   19178   1
      43    1   1   .   .   7.695     .   .   1   .   1   1   53   LEU   H      .   .   .   .   .   .   .   .   .   .   687   .   19178   1
      43    2   1   .   .   122.284   .   .   1   .   1   1   53   LEU   N      .   .   .   .   .   .   .   .   .   .   688   .   19178   1
      44    1   1   .   .   7.730     .   .   1   .   1   1   29   VAL   H      .   .   .   .   .   .   .   .   .   .   82    .   19178   1
      44    2   1   .   .   121.444   .   .   1   .   1   1   29   VAL   N      .   .   .   .   .   .   .   .   .   .   81    .   19178   1
      45    1   1   .   .   7.510     .   .   1   .   1   1   95   LYS   H      .   .   .   .   .   .   .   .   .   .   83    .   19178   1
      45    2   1   .   .   121.369   .   .   1   .   1   1   95   LYS   N      .   .   .   .   .   .   .   .   .   .   84    .   19178   1
      46    1   1   .   .   7.718     .   .   1   .   1   1   77   ILE   H      .   .   .   .   .   .   .   .   .   .   78    .   19178   1
      46    2   1   .   .   120.254   .   .   1   .   1   1   77   ILE   N      .   .   .   .   .   .   .   .   .   .   77    .   19178   1
      47    1   1   .   .   7.508     .   .   1   .   1   1   72   GLU   H      .   .   .   .   .   .   .   .   .   .   79    .   19178   1
      47    2   1   .   .   120.141   .   .   1   .   1   1   72   GLU   N      .   .   .   .   .   .   .   .   .   .   80    .   19178   1
      48    1   1   .   .   7.824     .   .   1   .   1   1   97   ILE   H      .   .   .   .   .   .   .   .   .   .   92    .   19178   1
      48    2   1   .   .   123.003   .   .   1   .   1   1   97   ILE   N      .   .   .   .   .   .   .   .   .   .   91    .   19178   1
      49    1   1   .   .   8.207     .   .   1   .   1   1   32   ARG   H      .   .   .   .   .   .   .   .   .   .   96    .   19178   1
      49    2   1   .   .   118.606   .   .   1   .   1   1   32   ARG   N      .   .   .   .   .   .   .   .   .   .   95    .   19178   1
      50    1   1   .   .   8.116     .   .   1   .   1   1   55   THR   H      .   .   .   .   .   .   .   .   .   .   94    .   19178   1
      50    2   1   .   .   117.961   .   .   1   .   1   1   55   THR   N      .   .   .   .   .   .   .   .   .   .   93    .   19178   1
      51    1   1   .   .   8.028     .   .   1   .   1   1   5    VAL   H      .   .   .   .   .   .   .   .   .   .   98    .   19178   1
      51    2   1   .   .   119.058   .   .   1   .   1   1   5    VAL   N      .   .   .   .   .   .   .   .   .   .   97    .   19178   1
      52    1   1   .   .   8.244     .   .   1   .   1   1   92   GLN   H      .   .   .   .   .   .   .   .   .   .   100   .   19178   1
      52    2   1   .   .   119.365   .   .   1   .   1   1   92   GLN   N      .   .   .   .   .   .   .   .   .   .   99    .   19178   1
      53    1   1   .   .   8.536     .   .   1   .   1   1   79   ASP   H      .   .   .   .   .   .   .   .   .   .   107   .   19178   1
      53    2   1   .   .   118.165   .   .   1   .   1   1   79   ASP   N      .   .   .   .   .   .   .   .   .   .   108   .   19178   1
      54    1   1   .   .   8.475     .   .   1   .   1   1   8    SER   H      .   .   .   .   .   .   .   .   .   .   101   .   19178   1
      54    2   1   .   .   117.557   .   .   1   .   1   1   8    SER   N      .   .   .   .   .   .   .   .   .   .   102   .   19178   1
      55    1   1   .   .   8.615     .   .   1   .   1   1   25   MET   H      .   .   .   .   .   .   .   .   .   .   106   .   19178   1
      55    2   1   .   .   118.622   .   .   1   .   1   1   25   MET   N      .   .   .   .   .   .   .   .   .   .   105   .   19178   1
      56    1   1   .   .   8.585     .   .   1   .   1   1   75   ASP   H      .   .   .   .   .   .   .   .   .   .   111   .   19178   1
      56    2   1   .   .   120.487   .   .   1   .   1   1   75   ASP   N      .   .   .   .   .   .   .   .   .   .   112   .   19178   1
      57    1   1   .   .   8.733     .   .   1   .   1   1   18   GLN   H      .   .   .   .   .   .   .   .   .   .   110   .   19178   1
      57    2   1   .   .   120.450   .   .   1   .   1   1   18   GLN   N      .   .   .   .   .   .   .   .   .   .   109   .   19178   1
      58    1   1   .   .   8.723     .   .   1   .   1   1   42   ASP   H      .   .   .   .   .   .   .   .   .   .   104   .   19178   1
      58    2   1   .   .   119.247   .   .   1   .   1   1   42   ASP   N      .   .   .   .   .   .   .   .   .   .   103   .   19178   1
      59    1   1   .   .   8.612     .   .   1   .   1   1   70   LEU   H      .   .   .   .   .   .   .   .   .   .   115   .   19178   1
      59    2   1   .   .   122.013   .   .   1   .   1   1   70   LEU   N      .   .   .   .   .   .   .   .   .   .   114   .   19178   1
      61    2   1   .   .   121.865   .   .   1   .   1   1   19   TRP   N      .   .   .   .   .   .   .   .   .   .   113   .   19178   1
      62    1   1   .   .   8.464     .   .   1   .   1   1   78   LYS   H      .   .   .   .   .   .   .   .   .   .   117   .   19178   1
      62    2   1   .   .   122.260   .   .   1   .   .   .   .    .     .      .   .   .   .   .   .   .   .   .   .   116   .   19178   1
      63    1   1   .   .   8.429     .   .   1   .   1   1   43   SER   H      .   .   .   .   .   .   .   .   .   .   119   .   19178   1
      63    2   1   .   .   123.344   .   .   1   .   1   1   43   SER   N      .   .   .   .   .   .   .   .   .   .   118   .   19178   1
      64    1   1   .   .   8.554     .   .   1   .   1   1   10   HIS   H      .   .   .   .   .   .   .   .   .   .   124   .   19178   1
      64    2   1   .   .   125.530   .   .   1   .   1   1   10   HIS   N      .   .   .   .   .   .   .   .   .   .   125   .   19178   1
      65    1   1   .   .   8.574     .   .   1   .   1   1   93   CYS   H      .   .   .   .   .   .   .   .   .   .   123   .   19178   1
      65    2   1   .   .   124.725   .   .   1   .   1   1   93   CYS   N      .   .   .   .   .   .   .   .   .   .   122   .   19178   1
      66    1   1   .   .   8.576     .   .   1   .   1   1   6    GLU   H      .   .   .   .   .   .   .   .   .   .   121   .   19178   1
      66    2   1   .   .   124.028   .   .   1   .   1   1   6    GLU   N      .   .   .   .   .   .   .   .   .   .   120   .   19178   1
      67    1   1   .   .   8.169     .   .   1   .   1   1   9    ILE   H      .   .   .   .   .   .   .   .   .   .   128   .   19178   1
      67    2   1   .   .   121.943   .   .   1   .   1   1   9    ILE   N      .   .   .   .   .   .   .   .   .   .   129   .   19178   1
      68    1   1   .   .   8.062     .   .   1   .   1   1   36   HIS   H      .   .   .   .   .   .   .   .   .   .   131   .   19178   1
      68    2   1   .   .   121.974   .   .   1   .   1   1   36   HIS   N      .   .   .   .   .   .   .   .   .   .   130   .   19178   1
      69    2   1   .   .   122.743   .   .   1   .   1   1   87   ILE   N      .   .   .   .   .   .   .   .   .   .   132   .   19178   1
      70    1   1   .   .   7.995     .   .   1   .   1   1   96   TYR   H      .   .   .   .   .   .   .   .   .   .   127   .   19178   1
      70    2   1   .   .   121.000   .   .   1   .   1   1   96   TYR   N      .   .   .   .   .   .   .   .   .   .   126   .   19178   1
      71    1   1   .   .   8.354     .   .   1   .   1   1   7    MET   H      .   .   .   .   .   .   .   .   .   .   134   .   19178   1
      71    2   1   .   .   121.533   .   .   1   .   1   1   7    MET   N      .   .   .   .   .   .   .   .   .   .   133   .   19178   1
      72    1   1   .   .   8.322     .   .   1   .   1   1   52   LYS   H      .   .   .   .   .   .   .   .   .   .   135   .   19178   1
      72    2   1   .   .   121.441   .   .   1   .   1   1   52   LYS   N      .   .   .   .   .   .   .   .   .   .   136   .   19178   1
      73    1   1   .   .   8.488     .   .   1   .   1   1   45   ASN   H      .   .   .   .   .   .   .   .   .   .   138   .   19178   1
      73    2   1   .   .   119.777   .   .   1   .   1   1   45   ASN   N      .   .   .   .   .   .   .   .   .   .   137   .   19178   1
      74    1   1   .   .   8.379     .   .   1   .   1   1   46   ASP   H      .   .   .   .   .   .   .   .   .   .   140   .   19178   1
      74    2   1   .   .   120.223   .   .   1   .   1   1   46   ASP   N      .   .   .   .   .   .   .   .   .   .   139   .   19178   1
      75    1   1   .   .   8.389     .   .   1   .   1   1   37   ASN   H      .   .   .   .   .   .   .   .   .   .   144   .   19178   1
      75    2   1   .   .   119.436   .   .   1   .   1   1   37   ASN   N      .   .   .   .   .   .   .   .   .   .   143   .   19178   1
      76    1   1   .   .   8.372     .   .   1   .   1   1   59   GLN   H      .   .   .   .   .   .   .   .   .   .   145   .   19178   1
      76    2   1   .   .   119.323   .   .   1   .   1   1   59   GLN   N      .   .   .   .   .   .   .   .   .   .   146   .   19178   1
      77    1   1   .   .   8.440     .   .   1   .   1   1   17   GLU   H      .   .   .   .   .   .   .   .   .   .   142   .   19178   1
      77    2   1   .   .   119.165   .   .   1   .   1   1   17   GLU   N      .   .   .   .   .   .   .   .   .   .   141   .   19178   1
      81    1   1   .   .   8.139     .   .   1   .   1   1   74   ARG   H      .   .   .   .   .   .   .   .   .   .   147   .   19178   1
      81    2   1   .   .   116.272   .   .   1   .   1   1   74   ARG   N      .   .   .   .   .   .   .   .   .   .   148   .   19178   1
      82    1   1   .   .   8.200     .   .   1   .   1   1   68   ASN   HD22   .   .   .   .   .   .   .   .   .   .   149   .   19178   1
      82    2   1   .   .   116.003   .   .   1   .   1   1   68   ASN   ND2    .   .   .   .   .   .   .   .   .   .   150   .   19178   1
      83    1   1   .   .   7.031     .   .   1   .   1   1   68   ASN   HD21   .   .   .   .   .   .   .   .   .   .   151   .   19178   1
      85    1   1   .   .   7.793     .   .   1   .   1   1   37   ASN   HD22   .   .   .   .   .   .   .   .   .   .   152   .   19178   1
      85    2   1   .   .   113.007   .   .   1   .   1   1   37   ASN   ND2    .   .   .   .   .   .   .   .   .   .   154   .   19178   1
      86    1   1   .   .   6.848     .   .   1   .   1   1   37   ASN   HD21   .   .   .   .   .   .   .   .   .   .   153   .   19178   1
      86    2   1   .   .   113.009   .   .   1   .   1   1   37   ASN   ND2    .   .   .   .   .   .   .   .   .   .   154   .   19178   1
      87    1   1   .   .   7.677     .   .   1   .   1   1   45   ASN   HD22   .   .   .   .   .   .   .   .   .   .   155   .   19178   1
      87    2   1   .   .   112.643   .   .   1   .   1   1   45   ASN   ND2    .   .   .   .   .   .   .   .   .   .   162   .   19178   1
      88    1   1   .   .   6.816     .   .   1   .   1   1   45   ASN   HD21   .   .   .   .   .   .   .   .   .   .   163   .   19178   1
      88    2   1   .   .   112.640   .   .   1   .   1   1   45   ASN   ND2    .   .   .   .   .   .   .   .   .   .   162   .   19178   1
      91    1   1   .   .   7.455     .   .   1   .   1   1   22   GLN   HE21   .   .   .   .   .   .   .   .   .   .   157   .   19178   1
      91    2   1   .   .   111.836   .   .   1   .   1   1   22   GLN   NE2    .   .   .   .   .   .   .   .   .   .   156   .   19178   1
      92    1   1   .   .   6.935     .   .   1   .   1   1   22   GLN   HE22   .   .   .   .   .   .   .   .   .   .   158   .   19178   1
      92    2   1   .   .   111.833   .   .   1   .   1   1   22   GLN   NE2    .   .   .   .   .   .   .   .   .   .   156   .   19178   1
      95    1   1   .   .   7.239     .   .   1   .   1   1   92   GLN   HE22   .   .   .   .   .   .   .   .   .   .   159   .   19178   1
      95    2   1   .   .   112.571   .   .   1   .   1   1   92   GLN   NE2    .   .   .   .   .   .   .   .   .   .   160   .   19178   1
      96    1   1   .   .   6.976     .   .   1   .   1   1   92   GLN   HE21   .   .   .   .   .   .   .   .   .   .   161   .   19178   1
      96    2   1   .   .   112.598   .   .   1   .   1   1   92   GLN   NE2    .   .   .   .   .   .   .   .   .   .   160   .   19178   1
      98    1   1   .   .   7.392     .   .   1   .   1   1   51   TYR   H      .   .   .   .   .   .   .   .   .   .   165   .   19178   1
      98    2   1   .   .   117.562   .   .   1   .   1   1   51   TYR   N      .   .   .   .   .   .   .   .   .   .   164   .   19178   1
      99    1   1   .   .   8.515     .   .   1   .   1   1   22   GLN   H      .   .   .   .   .   .   .   .   .   .   167   .   19178   1
      99    2   1   .   .   119.738   .   .   1   .   1   1   22   GLN   N      .   .   .   .   .   .   .   .   .   .   166   .   19178   1
      100   1   1   .   .   9.009     .   .   1   .   1   1   54   GLY   H      .   .   .   .   .   .   .   .   .   .   168   .   19178   1
      100   2   1   .   .   127.824   .   .   1   .   1   1   54   GLY   N      .   .   .   .   .   .   .   .   .   .   272   .   19178   1
      101   1   1   .   .   7.230     .   .   1   .   1   1   69   THR   H      .   .   .   .   .   .   .   .   .   .   44    .   19178   1
      101   2   1   .   .   127.965   .   .   1   .   1   1   69   THR   N      .   .   .   .   .   .   .   .   .   .   43    .   19178   1
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