Content for NMR-STAR saveframe, "peak_list_1_2_3_4_5"

    save_peak_list_1_2_3_4_5
   _Spectral_peak_list.Sf_category                      spectral_peak_list
   _Spectral_peak_list.Sf_framecode                     peak_list_1_2_3_4_5
   _Spectral_peak_list.Entry_ID                         18225
   _Spectral_peak_list.ID                               5
   _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                    5
   _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   .   .   H   1    1H    .   .   4000.00000000   .   .   .   .   .   .   .   18225   5
      2   .   .   C   13   13C   .   .   1256.75500488   .   .   .   .   .   .   .   18225   5
      3   .   .   N   15   15N   .   .   1417.78601074   .   .   .   .   .   .   .   18225   5
   stop_

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

      1    1.0   .   .   18225   5
      2    1.0   .   .   18225   5
      3    1.0   .   .   18225   5
      4    1.0   .   .   18225   5
      5    1.0   .   .   18225   5
      6    1.0   .   .   18225   5
      7    1.0   .   .   18225   5
      8    1.0   .   .   18225   5
      9    1.0   .   .   18225   5
      10   1.0   .   .   18225   5
      11   1.0   .   .   18225   5
      12   1.0   .   .   18225   5
      13   1.0   .   .   18225   5
      14   1.0   .   .   18225   5
      15   1.0   .   .   18225   5
      16   1.0   .   .   18225   5
      17   1.0   .   .   18225   5
      18   1.0   .   .   18225   5
      19   1.0   .   .   18225   5
      20   1.0   .   .   18225   5
      21   1.0   .   .   18225   5
      22   1.0   .   .   18225   5
      23   1.0   .   .   18225   5
      24   1.0   .   .   18225   5
      25   1.0   .   .   18225   5
      26   1.0   .   .   18225   5
      27   1.0   .   .   18225   5
      28   1.0   .   .   18225   5
      29   1.0   .   .   18225   5
      30   1.0   .   .   18225   5
      31   1.0   .   .   18225   5
      32   1.0   .   .   18225   5
      33   1.0   .   .   18225   5
      34   1.0   .   .   18225   5
      35   1.0   .   .   18225   5
      36   1.0   .   .   18225   5
      37   1.0   .   .   18225   5
      38   1.0   .   .   18225   5
      39   1.0   .   .   18225   5
      40   1.0   .   .   18225   5
      41   1.0   .   .   18225   5
      42   1.0   .   .   18225   5
      43   1.0   .   .   18225   5
      44   1.0   .   .   18225   5
      45   1.0   .   .   18225   5
      46   1.0   .   .   18225   5
      47   1.0   .   .   18225   5
      48   1.0   .   .   18225   5
      49   1.0   .   .   18225   5
      50   1.0   .   .   18225   5
      51   1.0   .   .   18225   5
      52   1.0   .   .   18225   5
      53   1.0   .   .   18225   5
      54   1.0   .   .   18225   5
      55   1.0   .   .   18225   5
      56   1.0   .   .   18225   5
      57   1.0   .   .   18225   5
      58   1.0   .   .   18225   5
      59   1.0   .   .   18225   5
      60   1.0   .   .   18225   5
      61   1.0   .   .   18225   5
      62   1.0   .   .   18225   5
      63   1.0   .   .   18225   5
      64   1.0   .   .   18225   5
      65   1.0   .   .   18225   5
   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    46777.6484375      .   height   18225   5
      1    536078.6198730     .   volume   18225   5
      2    285826.1250000     .   height   18225   5
      2    3081852.6108400    .   volume   18225   5
      3    85772.6718750      .   height   18225   5
      3    985306.8642580     .   volume   18225   5
      4    1119328.3750000    .   height   18225   5
      4    11108807.2891000   .   volume   18225   5
      5    36187.9843750      .   height   18225   5
      5    484333.3303220     .   volume   18225   5
      6    31240.8476562      .   height   18225   5
      6    327455.4838870     .   volume   18225   5
      7    50959.3359375      .   height   18225   5
      7    605170.4321900     .   volume   18225   5
      8    193919.3281250     .   height   18225   5
      8    1922824.1962900    .   volume   18225   5
      9    380334.5000000     .   height   18225   5
      9    4021104.8784200    .   volume   18225   5
      10   140659.6093750     .   height   18225   5
      10   1499191.3955100    .   volume   18225   5
      11   154334.1562500     .   height   18225   5
      11   1972604.4609400    .   volume   18225   5
      12   26444.5859375      .   height   18225   5
      12   225063.5288090     .   volume   18225   5
      13   1892692.5000000    .   height   18225   5
      13   17131405.2500000   .   volume   18225   5
      14   198855.1875000     .   height   18225   5
      14   2182226.9394500    .   volume   18225   5
      15   133723.2500000     .   height   18225   5
      15   1406039.5546900    .   volume   18225   5
      16   358023.1250000     .   height   18225   5
      16   3226804.6718800    .   volume   18225   5
      17   144825.0000000     .   height   18225   5
      17   1607881.1176800    .   volume   18225   5
      18   34393.6171875      .   height   18225   5
      18   393587.1181640     .   volume   18225   5
      19   39338.9375000      .   height   18225   5
      19   488647.5212400     .   volume   18225   5
      20   243314.3125000     .   height   18225   5
      20   3143991.4492200    .   volume   18225   5
      21   1187280.5000000    .   height   18225   5
      21   11713075.2578000   .   volume   18225   5
      22   158563.3437500     .   height   18225   5
      22   1666927.1870100    .   volume   18225   5
      23   474563.3437500     .   height   18225   5
      23   4920290.1796900    .   volume   18225   5
      24   29143.4667969      .   height   18225   5
      24   444967.0468750     .   volume   18225   5
      25   482387.4375000     .   height   18225   5
      25   4772909.7773400    .   volume   18225   5
      26   37978.5156250      .   height   18225   5
      26   608905.2529300     .   volume   18225   5
      27   75894.2109375      .   height   18225   5
      27   888430.1044920     .   volume   18225   5
      28   531232.0000000     .   height   18225   5
      28   5223452.2265600    .   volume   18225   5
      29   500274.3125000     .   height   18225   5
      29   5015723.4726600    .   volume   18225   5
      30   51309.2890625      .   height   18225   5
      30   588684.9846190     .   volume   18225   5
      31   100620.2265620     .   height   18225   5
      31   1081886.4155300    .   volume   18225   5
      32   74087.6953125      .   height   18225   5
      32   806104.5732420     .   volume   18225   5
      33   284648.4375000     .   height   18225   5
      33   3055800.3242200    .   volume   18225   5
      34   1022723.8750000    .   height   18225   5
      34   9170897.6953100    .   volume   18225   5
      35   57172.1250000      .   height   18225   5
      35   685516.4687500     .   volume   18225   5
      36   192917.9375000     .   height   18225   5
      36   2546412.5507800    .   volume   18225   5
      37   98100.7500000      .   height   18225   5
      37   1113804.9668000    .   volume   18225   5
      38   214284.2812500     .   height   18225   5
      38   2361726.5527300    .   volume   18225   5
      39   106676.8828120     .   height   18225   5
      39   1131603.9956100    .   volume   18225   5
      40   1432187.0000000    .   height   18225   5
      40   13257456.8594000   .   volume   18225   5
      41   61723.3554688      .   height   18225   5
      41   664418.5468750     .   volume   18225   5
      42   70175.4062500      .   height   18225   5
      42   809784.0369870     .   volume   18225   5
      43   615075.6250000     .   height   18225   5
      43   5913036.9531200    .   volume   18225   5
      44   803524.3750000     .   height   18225   5
      44   8731822.5859400    .   volume   18225   5
      45   187495.5625000     .   height   18225   5
      45   2258333.1210900    .   volume   18225   5
      46   404479.5000000     .   height   18225   5
      46   4082603.5214800    .   volume   18225   5
      47   43277.9687500      .   height   18225   5
      47   493636.3400880     .   volume   18225   5
      48   388435.2500000     .   height   18225   5
      48   3926949.6953100    .   volume   18225   5
      49   138501.4062500     .   height   18225   5
      49   1476866.6938500    .   volume   18225   5
      50   77547.1562500      .   height   18225   5
      50   1122675.7324200    .   volume   18225   5
      51   53961.9609375      .   height   18225   5
      51   1009203.2324200    .   volume   18225   5
      52   184295.2343750     .   height   18225   5
      52   2315637.5781200    .   volume   18225   5
      53   251125.9843750     .   height   18225   5
      53   2434608.7734400    .   volume   18225   5
      54   602777.1250000     .   height   18225   5
      54   5253160.5468800    .   volume   18225   5
      55   127059.8906250     .   height   18225   5
      55   1768371.9277300    .   volume   18225   5
      56   44772.6250000      .   height   18225   5
      56   491281.1418460     .   volume   18225   5
      57   80968.6562500      .   height   18225   5
      57   1187433.5107400    .   volume   18225   5
      58   86066.6796875      .   height   18225   5
      58   1036927.1315900    .   volume   18225   5
      59   76164.0312500      .   height   18225   5
      59   933069.6430660     .   volume   18225   5
      60   45992.5664062      .   height   18225   5
      60   416648.7142940     .   volume   18225   5
      61   32178.0527344      .   height   18225   5
      61   399136.7165530     .   volume   18225   5
      62   133723.2500000     .   height   18225   5
      62   1406039.5546900    .   volume   18225   5
      63   47892.3281250      .   height   18225   5
      63   707355.2027590     .   volume   18225   5
      64   39951.2656250      .   height   18225   5
      64   398059.3055420     .   volume   18225   5
      65   26801.7890625      .   height   18225   5
      65   232919.9730220     .   volume   18225   5
   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   8.244     .   40.3304100037   .   .   .   .   .   .   .   .   .   .   .   18225   5
      1    2   175.543   .   29.0618137772   .   .   .   .   .   .   .   .   .   .   .   18225   5
      1    3   109.579   .   37.5904933605   .   .   .   .   .   .   .   .   .   .   .   18225   5
      2    1   7.897     .   26.9286632538   .   .   .   .   .   .   .   .   .   .   .   18225   5
      2    2   175.264   .   22.2246212230   .   .   .   .   .   .   .   .   .   .   .   18225   5
      2    3   119.007   .   44.7022756976   .   .   .   .   .   .   .   .   .   .   .   18225   5
      3    1   7.896     .   25.3233909607   .   .   .   .   .   .   .   .   .   .   .   18225   5
      3    2   176.798   .   27.7145481081   .   .   .   .   .   .   .   .   .   .   .   18225   5
      3    3   113.820   .   42.8867774789   .   .   .   .   .   .   .   .   .   .   .   18225   5
      4    1   8.221     .   23.0705738068   .   .   .   .   .   .   .   .   .   .   .   18225   5
      4    2   174.449   .   23.5564557544   .   .   .   .   .   .   .   .   .   .   .   18225   5
      4    3   108.231   .   36.3998794288   .   .   .   .   .   .   .   .   .   .   .   18225   5
      5    1   7.884     .   26.7176628113   .   .   .   .   .   .   .   .   .   .   .   18225   5
      5    2   174.814   .   31.9561633675   .   .   .   .   .   .   .   .   .   .   .   18225   5
      5    3   112.048   .   45.4600044092   .   .   .   .   .   .   .   .   .   .   .   18225   5
      6    1   8.284     .   36.1256599426   .   .   .   .   .   .   .   .   .   .   .   18225   5
      6    2   178.670   .   25.1667623952   .   .   .   .   .   .   .   .   .   .   .   18225   5
      6    3   105.186   .   42.2619354453   .   .   .   .   .   .   .   .   .   .   .   18225   5
      7    1   8.125     .   27.5723934174   .   .   .   .   .   .   .   .   .   .   .   18225   5
      7    2   178.085   .   24.8964740323   .   .   .   .   .   .   .   .   .   .   .   18225   5
      7    3   118.264   .   43.0888750882   .   .   .   .   .   .   .   .   .   .   .   18225   5
      8    1   8.505     .   23.9298343658   .   .   .   .   .   .   .   .   .   .   .   18225   5
      8    2   174.183   .   22.2929002621   .   .   .   .   .   .   .   .   .   .   .   18225   5
      8    3   118.825   .   40.1305514380   .   .   .   .   .   .   .   .   .   .   .   18225   5
      9    1   7.981     .   23.1258869171   .   .   .   .   .   .   .   .   .   .   .   18225   5
      9    2   173.934   .   22.2325989714   .   .   .   .   .   .   .   .   .   .   .   18225   5
      9    3   122.924   .   44.7956977787   .   .   .   .   .   .   .   .   .   .   .   18225   5
      10   1   8.138     .   26.2205600739   .   .   .   .   .   .   .   .   .   .   .   18225   5
      10   2   177.029   .   24.4741589993   .   .   .   .   .   .   .   .   .   .   .   18225   5
      10   3   107.781   .   38.2293634950   .   .   .   .   .   .   .   .   .   .   .   18225   5
      11   1   8.392     .   33.2767963409   .   .   .   .   .   .   .   .   .   .   .   18225   5
      11   2   173.457   .   28.6420643581   .   .   .   .   .   .   .   .   .   .   .   18225   5
      11   3   117.560   .   44.4257277458   .   .   .   .   .   .   .   .   .   .   .   18225   5
      12   1   8.262     .   23.8273143768   .   .   .   .   .   .   .   .   .   .   .   18225   5
      12   2   177.377   .   23.0098488995   .   .   .   .   .   .   .   .   .   .   .   18225   5
      12   3   116.495   .   30.8729767130   .   .   .   .   .   .   .   .   .   .   .   18225   5
      13   1   8.338     .   21.1620330811   .   .   .   .   .   .   .   .   .   .   .   18225   5
      13   2   173.437   .   20.9140606873   .   .   .   .   .   .   .   .   .   .   .   18225   5
      13   3   125.297   .   36.9582358700   .   .   .   .   .   .   .   .   .   .   .   18225   5
      14   1   8.116     .   35.0091457367   .   .   .   .   .   .   .   .   .   .   .   18225   5
      14   2   174.666   .   25.2860166248   .   .   .   .   .   .   .   .   .   .   .   18225   5
      14   3   120.531   .   38.0620826178   .   .   .   .   .   .   .   .   .   .   .   18225   5
      15   1   7.744     .   25.3171920776   .   .   .   .   .   .   .   .   .   .   .   18225   5
      15   2   175.881   .   24.3973403986   .   .   .   .   .   .   .   .   .   .   .   18225   5
      15   3   112.126   .   38.3965176121   .   .   .   .   .   .   .   .   .   .   .   18225   5
      16   1   8.162     .   23.7765312195   .   .   .   .   .   .   .   .   .   .   .   18225   5
      16   2   173.543   .   20.4827379149   .   .   .   .   .   .   .   .   .   .   .   18225   5
      16   3   117.014   .   37.0331298722   .   .   .   .   .   .   .   .   .   .   .   18225   5
      17   1   8.140     .   29.8066139221   .   .   .   .   .   .   .   .   .   .   .   18225   5
      17   2   174.957   .   24.3056899276   .   .   .   .   .   .   .   .   .   .   .   18225   5
      17   3   116.666   .   44.2688834377   .   .   .   .   .   .   .   .   .   .   .   18225   5
      18   1   8.418     .   31.4767360687   .   .   .   .   .   .   .   .   .   .   .   18225   5
      18   2   178.393   .   22.8625414609   .   .   .   .   .   .   .   .   .   .   .   18225   5
      18   3   117.974   .   41.8054306218   .   .   .   .   .   .   .   .   .   .   .   18225   5
      19   1   7.878     .   27.1975994110   .   .   .   .   .   .   .   .   .   .   .   18225   5
      19   2   176.578   .   35.8223750018   .   .   .   .   .   .   .   .   .   .   .   18225   5
      19   3   119.491   .   41.6479947672   .   .   .   .   .   .   .   .   .   .   .   18225   5
      20   1   8.686     .   37.4019145966   .   .   .   .   .   .   .   .   .   .   .   18225   5
      20   2   174.095   .   23.0116467020   .   .   .   .   .   .   .   .   .   .   .   18225   5
      20   3   120.360   .   47.2237423161   .   .   .   .   .   .   .   .   .   .   .   18225   5
      21   1   8.462     .   22.7353572845   .   .   .   .   .   .   .   .   .   .   .   18225   5
      21   2   176.299   .   22.9816084193   .   .   .   .   .   .   .   .   .   .   .   18225   5
      21   3   109.587   .   37.9108580007   .   .   .   .   .   .   .   .   .   .   .   18225   5
      22   1   7.977     .   23.9984989166   .   .   .   .   .   .   .   .   .   .   .   18225   5
      22   2   176.100   .   23.2743505858   .   .   .   .   .   .   .   .   .   .   .   18225   5
      22   3   118.442   .   42.0358802060   .   .   .   .   .   .   .   .   .   .   .   18225   5
      23   1   8.293     .   21.4190483093   .   .   .   .   .   .   .   .   .   .   .   18225   5
      23   2   175.467   .   22.6610752232   .   .   .   .   .   .   .   .   .   .   .   18225   5
      23   3   119.733   .   41.6270371226   .   .   .   .   .   .   .   .   .   .   .   18225   5
      24   1   8.343     .   40.0645732880   .   .   .   .   .   .   .   .   .   .   .   18225   5
      24   2   176.732   .   33.6972226828   .   .   .   .   .   .   .   .   .   .   .   18225   5
      24   3   109.523   .   40.9907021871   .   .   .   .   .   .   .   .   .   .   .   18225   5
      25   1   8.540     .   25.9320735931   .   .   .   .   .   .   .   .   .   .   .   18225   5
      25   2   173.928   .   20.2045279850   .   .   .   .   .   .   .   .   .   .   .   18225   5
      25   3   120.419   .   41.9789227363   .   .   .   .   .   .   .   .   .   .   .   18225   5
      26   1   8.475     .   24.8484611511   .   .   .   .   .   .   .   .   .   .   .   18225   5
      26   2   173.815   .   28.6738255348   .   .   .   .   .   .   .   .   .   .   .   18225   5
      26   3   119.419   .   53.9884136640   .   .   .   .   .   .   .   .   .   .   .   18225   5
      27   1   8.080     .   26.5252590179   .   .   .   .   .   .   .   .   .   .   .   18225   5
      27   2   177.377   .   26.6188624200   .   .   .   .   .   .   .   .   .   .   .   18225   5
      27   3   113.139   .   43.1852549015   .   .   .   .   .   .   .   .   .   .   .   18225   5
      28   1   8.206     .   21.0509300232   .   .   .   .   .   .   .   .   .   .   .   18225   5
      28   2   175.428   .   20.9841000746   .   .   .   .   .   .   .   .   .   .   .   18225   5
      28   3   118.442   .   43.6318301959   .   .   .   .   .   .   .   .   .   .   .   18225   5
      29   1   8.344     .   25.1455307007   .   .   .   .   .   .   .   .   .   .   .   18225   5
      29   2   175.801   .   24.0354952003   .   .   .   .   .   .   .   .   .   .   .   18225   5
      29   3   119.578   .   37.2761709445   .   .   .   .   .   .   .   .   .   .   .   18225   5
      30   1   8.255     .   28.4340381622   .   .   .   .   .   .   .   .   .   .   .   18225   5
      30   2   178.814   .   26.6459699102   .   .   .   .   .   .   .   .   .   .   .   18225   5
      30   3   117.734   .   40.8580267756   .   .   .   .   .   .   .   .   .   .   .   18225   5
      31   1   8.171     .   28.5983085632   .   .   .   .   .   .   .   .   .   .   .   18225   5
      31   2   174.928   .   28.7295574109   .   .   .   .   .   .   .   .   .   .   .   18225   5
      31   3   117.834   .   33.5321468876   .   .   .   .   .   .   .   .   .   .   .   18225   5
      32   1   8.568     .   22.1168994904   .   .   .   .   .   .   .   .   .   .   .   18225   5
      32   2   176.142   .   30.0281700511   .   .   .   .   .   .   .   .   .   .   .   18225   5
      32   3   110.432   .   35.1181673483   .   .   .   .   .   .   .   .   .   .   .   18225   5
      33   1   7.861     .   23.9827632904   .   .   .   .   .   .   .   .   .   .   .   18225   5
      33   2   175.765   .   24.6464858555   .   .   .   .   .   .   .   .   .   .   .   18225   5
      33   3   108.584   .   41.7241352422   .   .   .   .   .   .   .   .   .   .   .   18225   5
      34   1   8.824     .   24.5465040207   .   .   .   .   .   .   .   .   .   .   .   18225   5
      34   2   172.134   .   18.0207223609   .   .   .   .   .   .   .   .   .   .   .   18225   5
      34   3   123.450   .   41.3179963710   .   .   .   .   .   .   .   .   .   .   .   18225   5
      35   1   7.876     .   28.6655426025   .   .   .   .   .   .   .   .   .   .   .   18225   5
      35   2   177.330   .   29.8883534560   .   .   .   .   .   .   .   .   .   .   .   18225   5
      35   3   117.275   .   43.7232241179   .   .   .   .   .   .   .   .   .   .   .   18225   5
      36   1   8.613     .   32.0544242859   .   .   .   .   .   .   .   .   .   .   .   18225   5
      36   2   174.157   .   31.6859686402   .   .   .   .   .   .   .   .   .   .   .   18225   5
      36   3   119.624   .   42.4657231873   .   .   .   .   .   .   .   .   .   .   .   18225   5
      37   1   8.476     .   28.6881923676   .   .   .   .   .   .   .   .   .   .   .   18225   5
      37   2   175.563   .   24.5843867624   .   .   .   .   .   .   .   .   .   .   .   18225   5
      37   3   110.725   .   44.8568805800   .   .   .   .   .   .   .   .   .   .   .   18225   5
      38   1   7.882     .   23.9329338074   .   .   .   .   .   .   .   .   .   .   .   18225   5
      38   2   175.387   .   23.5626731545   .   .   .   .   .   .   .   .   .   .   .   18225   5
      38   3   117.968   .   44.2914044550   .   .   .   .   .   .   .   .   .   .   .   18225   5
      39   1   8.193     .   26.2372493744   .   .   .   .   .   .   .   .   .   .   .   18225   5
      39   2   174.314   .   24.2134027349   .   .   .   .   .   .   .   .   .   .   .   18225   5
      39   3   121.693   .   41.7428534611   .   .   .   .   .   .   .   .   .   .   .   18225   5
      40   1   8.543     .   26.0164737701   .   .   .   .   .   .   .   .   .   .   .   18225   5
      40   2   175.510   .   19.9399139361   .   .   .   .   .   .   .   .   .   .   .   18225   5
      40   3   121.780   .   37.7328447814   .   .   .   .   .   .   .   .   .   .   .   18225   5
      41   1   8.666     .   25.8092880249   .   .   .   .   .   .   .   .   .   .   .   18225   5
      41   2   176.127   .   25.6902225435   .   .   .   .   .   .   .   .   .   .   .   18225   5
      41   3   108.282   .   40.7550131917   .   .   .   .   .   .   .   .   .   .   .   18225   5
      42   1   7.907     .   27.9488563538   .   .   .   .   .   .   .   .   .   .   .   18225   5
      42   2   176.309   .   29.1214408920   .   .   .   .   .   .   .   .   .   .   .   18225   5
      42   3   119.948   .   39.6054694829   .   .   .   .   .   .   .   .   .   .   .   18225   5
      43   1   8.329     .   22.6900577545   .   .   .   .   .   .   .   .   .   .   .   18225   5
      43   2   177.457   .   20.6737731529   .   .   .   .   .   .   .   .   .   .   .   18225   5
      43   3   117.383   .   41.2592642621   .   .   .   .   .   .   .   .   .   .   .   18225   5
      44   1   8.329     .   25.7549285889   .   .   .   .   .   .   .   .   .   .   .   18225   5
      44   2   173.965   .   25.0493059682   .   .   .   .   .   .   .   .   .   .   .   18225   5
      44   3   119.150   .   37.4919163749   .   .   .   .   .   .   .   .   .   .   .   18225   5
      45   1   8.352     .   26.8676280975   .   .   .   .   .   .   .   .   .   .   .   18225   5
      45   2   174.698   .   26.9372232715   .   .   .   .   .   .   .   .   .   .   .   18225   5
      45   3   121.816   .   41.1727294714   .   .   .   .   .   .   .   .   .   .   .   18225   5
      46   1   8.285     .   21.8546390533   .   .   .   .   .   .   .   .   .   .   .   18225   5
      46   2   174.799   .   23.0174895600   .   .   .   .   .   .   .   .   .   .   .   18225   5
      46   3   121.230   .   42.7898061192   .   .   .   .   .   .   .   .   .   .   .   18225   5
      47   1   7.963     .   23.5853195190   .   .   .   .   .   .   .   .   .   .   .   18225   5
      47   2   179.407   .   28.2469176784   .   .   .   .   .   .   .   .   .   .   .   18225   5
      47   3   120.009   .   40.7988721335   .   .   .   .   .   .   .   .   .   .   .   18225   5
      48   1   8.067     .   24.4805812836   .   .   .   .   .   .   .   .   .   .   .   18225   5
      48   2   175.642   .   22.4505076106   .   .   .   .   .   .   .   .   .   .   .   18225   5
      48   3   117.060   .   40.2678324609   .   .   .   .   .   .   .   .   .   .   .   18225   5
      49   1   8.035     .   24.3246555328   .   .   .   .   .   .   .   .   .   .   .   18225   5
      49   2   176.119   .   25.7092492861   .   .   .   .   .   .   .   .   .   .   .   18225   5
      49   3   121.462   .   41.7410788218   .   .   .   .   .   .   .   .   .   .   .   18225   5
      50   1   7.811     .   29.5269489288   .   .   .   .   .   .   .   .   .   .   .   18225   5
      50   2   177.444   .   25.6388540837   .   .   .   .   .   .   .   .   .   .   .   18225   5
      50   3   119.185   .   64.0948152495   .   .   .   .   .   .   .   .   .   .   .   18225   5
      51   1   7.800     .   30.4694175720   .   .   .   .   .   .   .   .   .   .   .   18225   5
      51   2   177.443   .   26.7910769136   .   .   .   .   .   .   .   .   .   .   .   18225   5
      51   3   118.637   .   79.4644166072   .   .   .   .   .   .   .   .   .   .   .   18225   5
      52   1   8.223     .   22.6309299469   .   .   .   .   .   .   .   .   .   .   .   18225   5
      52   2   175.881   .   32.5310481568   .   .   .   .   .   .   .   .   .   .   .   18225   5
      52   3   118.413   .   45.0528937118   .   .   .   .   .   .   .   .   .   .   .   18225   5
      53   1   8.203     .   23.1266021729   .   .   .   .   .   .   .   .   .   .   .   18225   5
      53   2   176.201   .   22.9770764589   .   .   .   .   .   .   .   .   .   .   .   18225   5
      53   3   118.669   .   39.0955564682   .   .   .   .   .   .   .   .   .   .   .   18225   5
      54   1   8.222     .   21.0928916931   .   .   .   .   .   .   .   .   .   .   .   18225   5
      54   2   176.350   .   20.3253552917   .   .   .   .   .   .   .   .   .   .   .   18225   5
      54   3   115.738   .   39.6863423293   .   .   .   .   .   .   .   .   .   .   .   18225   5
      55   1   8.146     .   47.0316410065   .   .   .   .   .   .   .   .   .   .   .   18225   5
      55   2   174.612   .   28.6948748052   .   .   .   .   .   .   .   .   .   .   .   18225   5
      55   3   120.478   .   36.6793851126   .   .   .   .   .   .   .   .   .   .   .   18225   5
      56   1   7.974     .   25.8169174194   .   .   .   .   .   .   .   .   .   .   .   18225   5
      56   2   177.418   .   27.6756331758   .   .   .   .   .   .   .   .   .   .   .   18225   5
      56   3   118.860   .   39.8109473575   .   .   .   .   .   .   .   .   .   .   .   18225   5
      57   1   8.035     .   26.6957283020   .   .   .   .   .   .   .   .   .   .   .   18225   5
      57   2   177.144   .   34.5023760032   .   .   .   .   .   .   .   .   .   .   .   18225   5
      57   3   117.740   .   49.8405324149   .   .   .   .   .   .   .   .   .   .   .   18225   5
      58   1   8.025     .   30.3750038147   .   .   .   .   .   .   .   .   .   .   .   18225   5
      58   2   177.252   .   27.3179453956   .   .   .   .   .   .   .   .   .   .   .   18225   5
      58   3   118.220   .   42.5029483585   .   .   .   .   .   .   .   .   .   .   .   18225   5
      59   1   8.307     .   44.4507598877   .   .   .   .   .   .   .   .   .   .   .   18225   5
      59   2   177.903   .   28.4971352623   .   .   .   .   .   .   .   .   .   .   .   18225   5
      59   3   120.003   .   37.4800009398   .   .   .   .   .   .   .   .   .   .   .   18225   5
      60   1   8.348     .   32.6068401337   .   .   .   .   .   .   .   .   .   .   .   18225   5
      60   2   177.826   .   22.4435036719   .   .   .   .   .   .   .   .   .   .   .   18225   5
      60   3   118.754   .   33.3417111934   .   .   .   .   .   .   .   .   .   .   .   18225   5
      61   1   8.609     .   27.6267528534   .   .   .   .   .   .   .   .   .   .   .   18225   5
      61   2   178.233   .   26.8273513235   .   .   .   .   .   .   .   .   .   .   .   18225   5
      61   3   119.940   .   43.5398024741   .   .   .   .   .   .   .   .   .   .   .   18225   5
      62   1   7.734     .   25.3171920776   .   .   .   .   .   .   .   .   .   .   .   18225   5
      62   2   175.888   .   24.3973403986   .   .   .   .   .   .   .   .   .   .   .   18225   5
      62   3   111.960   .   38.3965176121   .   .   .   .   .   .   .   .   .   .   .   18225   5
      63   1   8.341     .   45.2396869659   .   .   .   .   .   .   .   .   .   .   .   18225   5
      63   2   177.962   .   26.2874113195   .   .   .   .   .   .   .   .   .   .   .   18225   5
      63   3   119.829   .   46.4808022649   .   .   .   .   .   .   .   .   .   .   .   18225   5
      64   1   8.242     .   29.4988155365   .   .   .   .   .   .   .   .   .   .   .   18225   5
      64   2   177.885   .   28.4135749023   .   .   .   .   .   .   .   .   .   .   .   18225   5
      64   3   117.376   .   32.8192489439   .   .   .   .   .   .   .   .   .   .   .   18225   5
      65   1   8.488     .   25.1100063324   .   .   .   .   .   .   .   .   .   .   .   18225   5
      65   2   179.279   .   25.1880785269   .   .   .   .   .   .   .   .   .   .   .   18225   5
      65   3   118.652   .   36.5160337939   .   .   .   .   .   .   .   .   .   .   .   18225   5
   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   .   .   8.244     .   .   1   .   1   1   45   GLY   H   .   .   .   .   .   .   .   .   .   .   1     .   18225   5
      1    2   1   .   .   175.543   .   .   1   .   1   1   44   THR   C   .   .   .   .   .   .   .   .   .   .   156   .   18225   5
      1    3   1   .   .   109.579   .   .   1   .   1   1   45   GLY   N   .   .   .   .   .   .   .   .   .   .   2     .   18225   5
      2    1   1   .   .   7.897     .   .   1   .   1   1   10   TYR   H   .   .   .   .   .   .   .   .   .   .   3     .   18225   5
      2    2   1   .   .   175.264   .   .   1   .   1   1   9    ASN   C   .   .   .   .   .   .   .   .   .   .   157   .   18225   5
      2    3   1   .   .   119.007   .   .   1   .   1   1   10   TYR   N   .   .   .   .   .   .   .   .   .   .   4     .   18225   5
      3    1   1   .   .   7.896     .   .   1   .   1   1   26   SER   H   .   .   .   .   .   .   .   .   .   .   5     .   18225   5
      3    2   1   .   .   176.798   .   .   1   .   1   1   25   LYS   C   .   .   .   .   .   .   .   .   .   .   158   .   18225   5
      3    3   1   .   .   113.820   .   .   1   .   1   1   26   SER   N   .   .   .   .   .   .   .   .   .   .   6     .   18225   5
      4    1   1   .   .   8.221     .   .   1   .   1   1   5    GLY   H   .   .   .   .   .   .   .   .   .   .   7     .   18225   5
      4    2   1   .   .   174.449   .   .   1   .   1   1   4    GLY   C   .   .   .   .   .   .   .   .   .   .   159   .   18225   5
      4    3   1   .   .   108.231   .   .   1   .   1   1   5    GLY   N   .   .   .   .   .   .   .   .   .   .   8     .   18225   5
      5    1   1   .   .   7.884     .   .   1   .   1   1   43   THR   H   .   .   .   .   .   .   .   .   .   .   9     .   18225   5
      5    2   1   .   .   174.814   .   .   1   .   1   1   42   GLY   C   .   .   .   .   .   .   .   .   .   .   160   .   18225   5
      5    3   1   .   .   112.048   .   .   1   .   1   1   43   THR   N   .   .   .   .   .   .   .   .   .   .   10    .   18225   5
      6    1   1   .   .   8.284     .   .   1   .   1   1   42   GLY   H   .   .   .   .   .   .   .   .   .   .   17    .   18225   5
      6    2   2   .   .   178.670   .   .   1   .   1   1   41   LEU   C   .   .   .   .   .   .   .   .   .   .   335   .   18225   5
      6    3   1   .   .   105.186   .   .   1   .   1   1   42   GLY   N   .   .   .   .   .   .   .   .   .   .   18    .   18225   5
      7    1   1   .   .   8.125     .   .   1   .   1   1   51   TRP   H   .   .   .   .   .   .   .   .   .   .   19    .   18225   5
      7    2   1   .   .   178.085   .   .   1   .   1   1   50   LEU   C   .   .   .   .   .   .   .   .   .   .   162   .   18225   5
      7    3   1   .   .   118.264   .   .   1   .   1   1   51   TRP   N   .   .   .   .   .   .   .   .   .   .   20    .   18225   5
      8    1   1   .   .   8.505     .   .   1   .   1   1   60   HIS   H   .   .   .   .   .   .   .   .   .   .   66    .   18225   5
      8    2   1   .   .   174.183   .   .   1   .   1   1   59   HIS   C   .   .   .   .   .   .   .   .   .   .   180   .   18225   5
      8    3   1   .   .   118.825   .   .   1   .   1   1   60   HIS   N   .   .   .   .   .   .   .   .   .   .   67    .   18225   5
      9    1   1   .   .   7.981     .   .   1   .   1   1   13   ALA   H   .   .   .   .   .   .   .   .   .   .   21    .   18225   5
      9    2   1   .   .   173.934   .   .   1   .   1   1   12   GLY   C   .   .   .   .   .   .   .   .   .   .   163   .   18225   5
      9    3   1   .   .   122.924   .   .   1   .   1   1   13   ALA   N   .   .   .   .   .   .   .   .   .   .   22    .   18225   5
      10   1   1   .   .   8.138     .   .   1   .   1   1   58   GLY   H   .   .   .   .   .   .   .   .   .   .   23    .   18225   5
      10   2   1   .   .   177.029   .   .   1   .   1   1   57   LYS   C   .   .   .   .   .   .   .   .   .   .   164   .   18225   5
      10   3   1   .   .   107.781   .   .   1   .   1   1   58   GLY   N   .   .   .   .   .   .   .   .   .   .   24    .   18225   5
      11   1   1   .   .   8.392     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   25    .   18225   5
      11   2   1   .   .   173.457   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   165   .   18225   5
      11   3   1   .   .   117.560   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   26    .   18225   5
      12   1   1   .   .   8.262     .   .   1   .   1   1   31   ILE   H   .   .   .   .   .   .   .   .   .   .   27    .   18225   5
      12   2   1   .   .   177.377   .   .   1   .   1   1   30   LEU   C   .   .   .   .   .   .   .   .   .   .   166   .   18225   5
      12   3   1   .   .   116.495   .   .   1   .   1   1   31   ILE   N   .   .   .   .   .   .   .   .   .   .   28    .   18225   5
      13   1   1   .   .   8.338     .   .   1   .   1   1   64   HIS   H   .   .   .   .   .   .   .   .   .   .   29    .   18225   5
      13   2   1   .   .   173.437   .   .   1   .   1   1   63   HIS   C   .   .   .   .   .   .   .   .   .   .   167   .   18225   5
      13   3   1   .   .   125.297   .   .   1   .   1   1   64   HIS   N   .   .   .   .   .   .   .   .   .   .   30    .   18225   5
      14   1   1   .   .   8.116     .   .   1   .   1   1   23   ASP   H   .   .   .   .   .   .   .   .   .   .   31    .   18225   5
      14   2   1   .   .   174.666   .   .   1   .   1   1   22   THR   C   .   .   .   .   .   .   .   .   .   .   168   .   18225   5
      14   3   1   .   .   120.531   .   .   1   .   1   1   23   ASP   N   .   .   .   .   .   .   .   .   .   .   32    .   18225   5
      15   1   1   .   .   7.744     .   .   1   .   1   1   22   THR   H   .   .   .   .   .   .   .   .   .   .   33    .   18225   5
      15   2   1   .   .   175.881   .   .   1   .   1   1   21   TYR   C   .   .   .   .   .   .   .   .   .   .   169   .   18225   5
      15   3   1   .   .   112.126   .   .   1   .   1   1   22   THR   N   .   .   .   .   .   .   .   .   .   .   34    .   18225   5
      16   1   1   .   .   8.162     .   .   1   .   1   1   59   HIS   H   .   .   .   .   .   .   .   .   .   .   74    .   18225   5
      16   2   1   .   .   173.543   .   .   1   .   1   1   58   GLY   C   .   .   .   .   .   .   .   .   .   .   184   .   18225   5
      16   3   1   .   .   117.014   .   .   1   .   1   1   59   HIS   N   .   .   .   .   .   .   .   .   .   .   75    .   18225   5
      17   1   1   .   .   8.140     .   .   1   .   1   1   27   SER   H   .   .   .   .   .   .   .   .   .   .   38    .   18225   5
      17   2   1   .   .   174.957   .   .   1   .   1   1   26   SER   C   .   .   .   .   .   .   .   .   .   .   170   .   18225   5
      17   3   1   .   .   116.666   .   .   1   .   1   1   27   SER   N   .   .   .   .   .   .   .   .   .   .   39    .   18225   5
      18   1   1   .   .   8.418     .   .   1   .   1   1   38   VAL   H   .   .   .   .   .   .   .   .   .   .   40    .   18225   5
      18   2   1   .   .   178.393   .   .   1   .   1   1   37   LEU   C   .   .   .   .   .   .   .   .   .   .   171   .   18225   5
      18   3   1   .   .   117.974   .   .   1   .   1   1   38   VAL   N   .   .   .   .   .   .   .   .   .   .   41    .   18225   5
      19   1   1   .   .   7.878     .   .   1   .   1   1   25   LYS   H   .   .   .   .   .   .   .   .   .   .   42    .   18225   5
      19   2   1   .   .   176.578   .   .   1   .   1   1   24   TRP   C   .   .   .   .   .   .   .   .   .   .   172   .   18225   5
      19   3   1   .   .   119.491   .   .   1   .   1   1   25   LYS   N   .   .   .   .   .   .   .   .   .   .   43    .   18225   5
      20   1   1   .   .   8.686     .   .   1   .   1   1   62   HIS   H   .   .   .   .   .   .   .   .   .   .   46    .   18225   5
      20   2   1   .   .   174.095   .   .   1   .   1   1   61   HIS   C   .   .   .   .   .   .   .   .   .   .   173   .   18225   5
      20   3   1   .   .   120.360   .   .   1   .   1   1   62   HIS   N   .   .   .   .   .   .   .   .   .   .   47    .   18225   5
      21   1   1   .   .   8.462     .   .   1   .   1   1   4    GLY   H   .   .   .   .   .   .   .   .   .   .   50    .   18225   5
      21   2   1   .   .   176.299   .   .   1   .   1   1   3    GLU   C   .   .   .   .   .   .   .   .   .   .   174   .   18225   5
      21   3   1   .   .   109.587   .   .   1   .   1   1   4    GLY   N   .   .   .   .   .   .   .   .   .   .   51    .   18225   5
      22   1   1   .   .   7.977     .   .   1   .   1   1   21   TYR   H   .   .   .   .   .   .   .   .   .   .   52    .   18225   5
      22   2   1   .   .   176.100   .   .   1   .   1   1   20   GLU   C   .   .   .   .   .   .   .   .   .   .   175   .   18225   5
      22   3   1   .   .   118.442   .   .   1   .   1   1   21   TYR   N   .   .   .   .   .   .   .   .   .   .   53    .   18225   5
      23   1   1   .   .   8.293     .   .   1   .   1   1   16   GLN   H   .   .   .   .   .   .   .   .   .   .   54    .   18225   5
      23   2   1   .   .   175.467   .   .   1   .   1   1   15   ASN   C   .   .   .   .   .   .   .   .   .   .   176   .   18225   5
      23   3   1   .   .   119.733   .   .   1   .   1   1   16   GLN   N   .   .   .   .   .   .   .   .   .   .   55    .   18225   5
      24   1   1   .   .   8.343     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   56    .   18225   5
      24   2   1   .   .   176.732   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   177   .   18225   5
      24   3   1   .   .   109.523   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   57    .   18225   5
      25   1   1   .   .   8.540     .   .   1   .   1   1   63   HIS   H   .   .   .   .   .   .   .   .   .   .   59    .   18225   5
      25   2   1   .   .   173.928   .   .   1   .   1   1   62   HIS   C   .   .   .   .   .   .   .   .   .   .   178   .   18225   5
      25   3   1   .   .   120.419   .   .   1   .   1   1   63   HIS   N   .   .   .   .   .   .   .   .   .   .   60    .   18225   5
      26   1   1   .   .   8.475     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   63    .   18225   5
      26   2   1   .   .   173.815   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   179   .   18225   5
      26   3   1   .   .   119.419   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   64    .   18225   5
      27   1   1   .   .   8.080     .   .   1   .   1   1   52   THR   H   .   .   .   .   .   .   .   .   .   .   68    .   18225   5
      27   2   1   .   .   177.377   .   .   1   .   1   1   51   TRP   C   .   .   .   .   .   .   .   .   .   .   181   .   18225   5
      27   3   1   .   .   113.139   .   .   1   .   1   1   52   THR   N   .   .   .   .   .   .   .   .   .   .   69    .   18225   5
      28   1   1   .   .   8.206     .   .   1   .   1   1   15   ASN   H   .   .   .   .   .   .   .   .   .   .   70    .   18225   5
      28   2   1   .   .   175.428   .   .   1   .   1   1   14   ASP   C   .   .   .   .   .   .   .   .   .   .   182   .   18225   5
      28   3   1   .   .   118.442   .   .   1   .   1   1   15   ASN   N   .   .   .   .   .   .   .   .   .   .   71    .   18225   5
      29   1   1   .   .   8.344     .   .   1   .   1   1   7    PHE   H   .   .   .   .   .   .   .   .   .   .   72    .   18225   5
      29   2   1   .   .   175.801   .   .   1   .   1   1   6    ASP   C   .   .   .   .   .   .   .   .   .   .   183   .   18225   5
      29   3   1   .   .   119.578   .   .   1   .   1   1   7    PHE   N   .   .   .   .   .   .   .   .   .   .   73    .   18225   5
      30   1   2   .   .   8.255     .   .   1   .   1   1   34   ILE   H   .   .   .   .   .   .   .   .   .   .   310   .   18225   5
      30   2   1   .   .   178.814   .   .   1   .   1   1   33   ALA   C   .   .   .   .   .   .   .   .   .   .   185   .   18225   5
      30   3   2   .   .   117.734   .   .   1   .   1   1   34   ILE   N   .   .   .   .   .   .   .   .   .   .   311   .   18225   5
      31   1   1   .   .   8.171     .   .   1   .   1   1   46   ASN   H   .   .   .   .   .   .   .   .   .   .   78    .   18225   5
      31   2   1   .   .   174.928   .   .   1   .   1   1   45   GLY   C   .   .   .   .   .   .   .   .   .   .   186   .   18225   5
      31   3   1   .   .   117.834   .   .   1   .   1   1   46   ASN   N   .   .   .   .   .   .   .   .   .   .   79    .   18225   5
      32   1   1   .   .   8.568     .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   80    .   18225   5
      32   2   1   .   .   176.142   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   187   .   18225   5
      32   3   1   .   .   110.432   .   .   1   .   .   .   .    .     .   .   .   .   .   .   .   .   .   .   .   81    .   18225   5
      33   1   1   .   .   7.861     .   .   1   .   1   1   12   GLY   H   .   .   .   .   .   .   .   .   .   .   82    .   18225   5
      33   2   1   .   .   175.765   .   .   1   .   1   1   11   TYR   C   .   .   .   .   .   .   .   .   .   .   188   .   18225   5
      33   3   1   .   .   108.584   .   .   1   .   1   1   12   GLY   N   .   .   .   .   .   .   .   .   .   .   83    .   18225   5
      34   1   1   .   .   8.824     .   .   1   .   1   1   2    GLU   H   .   .   .   .   .   .   .   .   .   .   84    .   18225   5
      34   2   1   .   .   172.134   .   .   1   .   1   1   1    MET   C   .   .   .   .   .   .   .   .   .   .   189   .   18225   5
      34   3   1   .   .   123.450   .   .   1   .   1   1   2    GLU   N   .   .   .   .   .   .   .   .   .   .   85    .   18225   5
      35   1   1   .   .   7.876     .   .   1   .   1   1   30   LEU   H   .   .   .   .   .   .   .   .   .   .   86    .   18225   5
      35   2   1   .   .   177.330   .   .   1   .   1   1   29   ALA   C   .   .   .   .   .   .   .   .   .   .   190   .   18225   5
      35   3   1   .   .   117.275   .   .   1   .   1   1   30   LEU   N   .   .   .   .   .   .   .   .   .   .   87    .   18225   5
      36   1   1   .   .   8.613     .   .   1   .   1   1   61   HIS   H   .   .   .   .   .   .   .   .   .   .   88    .   18225   5
      36   2   1   .   .   174.157   .   .   1   .   1   1   60   HIS   C   .   .   .   .   .   .   .   .   .   .   191   .   18225   5
      36   3   1   .   .   119.624   .   .   1   .   1   1   61   HIS   N   .   .   .   .   .   .   .   .   .   .   89    .   18225   5
      37   1   1   .   .   8.476     .   .   1   .   1   1   28   GLY   H   .   .   .   .   .   .   .   .   .   .   94    .   18225   5
      37   2   1   .   .   175.563   .   .   1   .   1   1   27   SER   C   .   .   .   .   .   .   .   .   .   .   193   .   18225   5
      37   3   1   .   .   110.725   .   .   1   .   1   1   28   GLY   N   .   .   .   .   .   .   .   .   .   .   95    .   18225   5
      38   1   1   .   .   7.882     .   .   1   .   1   1   11   TYR   H   .   .   .   .   .   .   .   .   .   .   96    .   18225   5
      38   2   1   .   .   175.387   .   .   1   .   1   1   10   TYR   C   .   .   .   .   .   .   .   .   .   .   194   .   18225   5
      38   3   1   .   .   117.968   .   .   1   .   1   1   11   TYR   N   .   .   .   .   .   .   .   .   .   .   97    .   18225   5
      39   1   1   .   .   8.193     .   .   1   .   1   1   29   ALA   H   .   .   .   .   .   .   .   .   .   .   102   .   18225   5
      39   2   1   .   .   174.314   .   .   1   .   1   1   28   GLY   C   .   .   .   .   .   .   .   .   .   .   195   .   18225   5
      39   3   1   .   .   121.693   .   .   1   .   1   1   29   ALA   N   .   .   .   .   .   .   .   .   .   .   103   .   18225   5
      40   1   1   .   .   8.543     .   .   1   .   1   1   3    GLU   H   .   .   .   .   .   .   .   .   .   .   104   .   18225   5
      40   2   1   .   .   175.510   .   .   1   .   1   1   2    GLU   C   .   .   .   .   .   .   .   .   .   .   196   .   18225   5
      40   3   1   .   .   121.780   .   .   1   .   1   1   3    GLU   N   .   .   .   .   .   .   .   .   .   .   105   .   18225   5
      41   1   1   .   .   8.666     .   .   1   .   1   1   47   GLY   H   .   .   .   .   .   .   .   .   .   .   106   .   18225   5
      41   2   1   .   .   176.127   .   .   1   .   1   1   46   ASN   C   .   .   .   .   .   .   .   .   .   .   197   .   18225   5
      41   3   1   .   .   108.282   .   .   1   .   1   1   47   GLY   N   .   .   .   .   .   .   .   .   .   .   107   .   18225   5
      42   1   1   .   .   7.907     .   .   1   .   1   1   53   VAL   H   .   .   .   .   .   .   .   .   .   .   110   .   18225   5
      42   2   1   .   .   176.309   .   .   1   .   1   1   52   THR   C   .   .   .   .   .   .   .   .   .   .   198   .   18225   5
      42   3   1   .   .   119.948   .   .   1   .   1   1   53   VAL   N   .   .   .   .   .   .   .   .   .   .   111   .   18225   5
      43   1   1   .   .   8.329     .   .   1   .   1   1   14   ASP   H   .   .   .   .   .   .   .   .   .   .   112   .   18225   5
      43   2   1   .   .   177.457   .   .   1   .   1   1   13   ALA   C   .   .   .   .   .   .   .   .   .   .   199   .   18225   5
      43   3   1   .   .   117.383   .   .   1   .   1   1   14   ASP   N   .   .   .   .   .   .   .   .   .   .   113   .   18225   5
      44   1   1   .   .   8.329     .   .   1   .   1   1   6    ASP   H   .   .   .   .   .   .   .   .   .   .   114   .   18225   5
      44   2   1   .   .   173.965   .   .   1   .   1   1   5    GLY   C   .   .   .   .   .   .   .   .   .   .   200   .   18225   5
      44   3   1   .   .   119.150   .   .   1   .   1   1   6    ASP   N   .   .   .   .   .   .   .   .   .   .   115   .   18225   5
      45   1   1   .   .   8.352     .   .   1   .   1   1   20   GLU   H   .   .   .   .   .   .   .   .   .   .   116   .   18225   5
      45   2   1   .   .   174.698   .   .   1   .   1   1   19   CYS   C   .   .   .   .   .   .   .   .   .   .   201   .   18225   5
      45   3   1   .   .   121.816   .   .   1   .   1   1   20   GLU   N   .   .   .   .   .   .   .   .   .   .   117   .   18225   5
      46   1   1   .   .   8.285     .   .   1   .   1   1   18   GLU   H   .   .   .   .   .   .   .   .   .   .   118   .   18225   5
      46   2   1   .   .   174.799   .   .   1   .   1   1   17   SER   C   .   .   .   .   .   .   .   .   .   .   202   .   18225   5
      46   3   1   .   .   121.230   .   .   1   .   1   1   18   GLU   N   .   .   .   .   .   .   .   .   .   .   119   .   18225   5
      47   1   1   .   .   7.963     .   .   1   .   1   1   49   VAL   H   .   .   .   .   .   .   .   .   .   .   120   .   18225   5
      47   2   1   .   .   179.407   .   .   1   .   1   1   48   LEU   C   .   .   .   .   .   .   .   .   .   .   203   .   18225   5
      47   3   1   .   .   120.009   .   .   1   .   1   1   49   VAL   N   .   .   .   .   .   .   .   .   .   .   121   .   18225   5
      48   1   1   .   .   8.067     .   .   1   .   1   1   9    ASN   H   .   .   .   .   .   .   .   .   .   .   122   .   18225   5
      48   2   2   .   .   175.642   .   .   1   .   1   1   8    ASP   C   .   .   .   .   .   .   .   .   .   .   281   .   18225   5
      48   3   1   .   .   117.060   .   .   1   .   1   1   9    ASN   N   .   .   .   .   .   .   .   .   .   .   123   .   18225   5
      49   1   1   .   .   8.035     .   .   1   .   1   1   24   TRP   H   .   .   .   .   .   .   .   .   .   .   124   .   18225   5
      49   2   1   .   .   176.119   .   .   1   .   1   1   23   ASP   C   .   .   .   .   .   .   .   .   .   .   204   .   18225   5
      49   3   1   .   .   121.462   .   .   1   .   1   1   24   TRP   N   .   .   .   .   .   .   .   .   .   .   125   .   18225   5
      50   1   1   .   .   7.811     .   .   1   .   1   1   50   LEU   H   .   .   .   .   .   .   .   .   .   .   126   .   18225   5
      50   2   1   .   .   177.444   .   .   1   .   1   1   49   VAL   C   .   .   .   .   .   .   .   .   .   .   205   .   18225   5
      50   3   1   .   .   119.185   .   .   1   .   1   1   50   LEU   N   .   .   .   .   .   .   .   .   .   .   127   .   18225   5
      51   1   1   .   .   7.800     .   .   1   .   1   1   56   LYS   H   .   .   .   .   .   .   .   .   .   .   13    .   18225   5
      51   2   1   .   .   177.443   .   .   1   .   1   1   55   ARG   C   .   .   .   .   .   .   .   .   .   .   236   .   18225   5
      51   3   1   .   .   118.637   .   .   1   .   1   1   56   LYS   N   .   .   .   .   .   .   .   .   .   .   14    .   18225   5
      52   1   1   .   .   8.223     .   .   1   .   1   1   8    ASP   H   .   .   .   .   .   .   .   .   .   .   240   .   18225   5
      52   2   2   .   .   175.881   .   .   1   .   1   1   7    PHE   C   .   .   .   .   .   .   .   .   .   .   242   .   18225   5
      52   3   1   .   .   118.413   .   .   1   .   1   1   8    ASP   N   .   .   .   .   .   .   .   .   .   .   241   .   18225   5
      53   1   2   .   .   8.203     .   .   1   .   1   1   19   CYS   H   .   .   .   .   .   .   .   .   .   .   288   .   18225   5
      53   2   1   .   .   176.201   .   .   1   .   1   1   18   GLU   C   .   .   .   .   .   .   .   .   .   .   243   .   18225   5
      53   3   2   .   .   118.669   .   .   1   .   1   1   19   CYS   N   .   .   .   .   .   .   .   .   .   .   289   .   18225   5
      54   1   1   .   .   8.222     .   .   1   .   1   1   17   SER   H   .   .   .   .   .   .   .   .   .   .   15    .   18225   5
      54   2   1   .   .   176.350   .   .   1   .   1   1   16   GLN   C   .   .   .   .   .   .   .   .   .   .   286   .   18225   5
      54   3   1   .   .   115.738   .   .   1   .   1   1   17   SER   N   .   .   .   .   .   .   .   .   .   .   16    .   18225   5
      55   1   1   .   .   8.146     .   .   1   .   1   1   48   LEU   H   .   .   .   .   .   .   .   .   .   .   302   .   18225   5
      55   2   1   .   .   174.612   .   .   1   .   1   1   47   GLY   C   .   .   .   .   .   .   .   .   .   .   305   .   18225   5
      55   3   1   .   .   120.478   .   .   1   .   1   1   48   LEU   N   .   .   .   .   .   .   .   .   .   .   303   .   18225   5
      56   1   1   .   .   7.974     .   .   1   .   1   1   57   LYS   H   .   .   .   .   .   .   .   .   .   .   90    .   18225   5
      56   2   1   .   .   177.418   .   .   1   .   1   1   56   LYS   C   .   .   .   .   .   .   .   .   .   .   161   .   18225   5
      56   3   1   .   .   118.860   .   .   1   .   1   1   57   LYS   N   .   .   .   .   .   .   .   .   .   .   91    .   18225   5
      57   1   1   .   .   8.035     .   .   1   .   1   1   55   ARG   H   .   .   .   .   .   .   .   .   .   .   44    .   18225   5
      57   2   1   .   .   177.144   .   .   1   .   1   1   54   PHE   C   .   .   .   .   .   .   .   .   .   .   318   .   18225   5
      57   3   1   .   .   117.740   .   .   1   .   1   1   55   ARG   N   .   .   .   .   .   .   .   .   .   .   45    .   18225   5
      58   1   1   .   .   8.025     .   .   1   .   1   1   54   PHE   H   .   .   .   .   .   .   .   .   .   .   307   .   18225   5
      58   2   1   .   .   177.252   .   .   1   .   1   1   53   VAL   C   .   .   .   .   .   .   .   .   .   .   319   .   18225   5
      58   3   1   .   .   118.220   .   .   1   .   1   1   54   PHE   N   .   .   .   .   .   .   .   .   .   .   308   .   18225   5
      59   1   1   .   .   8.307     .   .   1   .   1   1   37   LEU   H   .   .   .   .   .   .   .   .   .   .   322   .   18225   5
      59   2   1   .   .   177.903   .   .   1   .   1   1   36   MET   C   .   .   .   .   .   .   .   .   .   .   350   .   18225   5
      59   3   1   .   .   120.003   .   .   1   .   1   1   37   LEU   N   .   .   .   .   .   .   .   .   .   .   321   .   18225   5
      60   1   1   .   .   8.348     .   .   1   .   1   1   35   TYR   H   .   .   .   .   .   .   .   .   .   .   312   .   18225   5
      60   2   1   .   .   177.826   .   .   1   .   1   1   34   ILE   C   .   .   .   .   .   .   .   .   .   .   325   .   18225   5
      60   3   1   .   .   118.754   .   .   1   .   1   1   35   TYR   N   .   .   .   .   .   .   .   .   .   .   313   .   18225   5
      61   1   1   .   .   8.609     .   .   1   .   1   1   40   LEU   H   .   .   .   .   .   .   .   .   .   .   326   .   18225   5
      61   2   1   .   .   178.233   .   .   1   .   1   1   39   PHE   C   .   .   .   .   .   .   .   .   .   .   328   .   18225   5
      61   3   1   .   .   119.940   .   .   1   .   1   1   40   LEU   N   .   .   .   .   .   .   .   .   .   .   327   .   18225   5
      62   1   1   .   .   7.734     .   .   1   .   1   1   44   THR   H   .   .   .   .   .   .   .   .   .   .   331   .   18225   5
      62   2   1   .   .   175.888   .   .   1   .   1   1   43   THR   C   .   .   .   .   .   .   .   .   .   .   333   .   18225   5
      62   3   1   .   .   111.960   .   .   1   .   1   1   44   THR   N   .   .   .   .   .   .   .   .   .   .   332   .   18225   5
      63   1   1   .   .   8.341     .   .   1   .   1   1   39   PHE   H   .   .   .   .   .   .   .   .   .   .   314   .   18225   5
      63   2   1   .   .   177.962   .   .   1   .   1   1   38   VAL   C   .   .   .   .   .   .   .   .   .   .   336   .   18225   5
      63   3   1   .   .   119.829   .   .   1   .   1   1   39   PHE   N   .   .   .   .   .   .   .   .   .   .   315   .   18225   5
      64   1   1   .   .   8.242     .   .   1   .   1   1   36   MET   H   .   .   .   .   .   .   .   .   .   .   76    .   18225   5
      64   2   1   .   .   177.885   .   .   1   .   1   1   35   TYR   C   .   .   .   .   .   .   .   .   .   .   349   .   18225   5
      64   3   1   .   .   117.376   .   .   1   .   1   1   36   MET   N   .   .   .   .   .   .   .   .   .   .   77    .   18225   5
      65   1   1   .   .   8.488     .   .   1   .   1   1   41   LEU   H   .   .   .   .   .   .   .   .   .   .   351   .   18225   5
      65   2   1   .   .   179.279   .   .   1   .   1   1   40   LEU   C   .   .   .   .   .   .   .   .   .   .   353   .   18225   5
      65   3   1   .   .   118.652   .   .   1   .   1   1   41   LEU   N   .   .   .   .   .   .   .   .   .   .   352   .   18225   5
   stop_
save_