Content for NMR-STAR saveframe, "peak_list_1"

    save_peak_list_1
   _Spectral_peak_list.Sf_category                      spectral_peak_list
   _Spectral_peak_list.Sf_framecode                     peak_list_1
   _Spectral_peak_list.Entry_ID                         26802
   _Spectral_peak_list.ID                               1
   _Spectral_peak_list.Name                             .
   _Spectral_peak_list.Sample_ID                        1
   _Spectral_peak_list.Sample_label                     $CspA
   _Spectral_peak_list.Sample_condition_list_ID         1
   _Spectral_peak_list.Sample_condition_list_label      $CspA_1
   _Spectral_peak_list.Chem_shift_reference_ID          .
   _Spectral_peak_list.Chem_shift_reference_label       .
   _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    .   .   7267.442   .   .   .   .   .   .   .   26802   1
      2   .   .   N   15   15N   .   .   3280.033   .   .   .   .   .   .   .   26802   1
   stop_

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

      1    1.0   .   .   26802   1
      2    1.0   .   .   26802   1
      3    1.0   .   .   26802   1
      4    1.0   .   .   26802   1
      5    1.0   .   .   26802   1
      6    1.0   .   .   26802   1
      7    1.0   .   .   26802   1
      8    1.0   .   .   26802   1
      9    1.0   .   .   26802   1
      10   1.0   .   .   26802   1
      11   1.0   .   .   26802   1
      12   1.0   .   .   26802   1
      13   1.0   .   .   26802   1
      14   1.0   .   .   26802   1
      15   1.0   .   .   26802   1
      16   1.0   .   .   26802   1
      17   1.0   .   .   26802   1
      18   1.0   .   .   26802   1
      19   1.0   .   .   26802   1
      20   1.0   .   .   26802   1
      21   1.0   .   .   26802   1
      22   1.0   .   .   26802   1
      23   1.0   .   .   26802   1
      24   1.0   .   .   26802   1
      25   1.0   .   .   26802   1
      26   1.0   .   .   26802   1
      27   1.0   .   .   26802   1
      28   1.0   .   .   26802   1
      29   1.0   .   .   26802   1
      30   1.0   .   .   26802   1
      31   1.0   .   .   26802   1
      32   1.0   .   .   26802   1
      33   1.0   .   .   26802   1
      34   1.0   .   .   26802   1
      35   1.0   .   .   26802   1
      36   1.0   .   .   26802   1
      37   1.0   .   .   26802   1
      38   1.0   .   .   26802   1
      39   1.0   .   .   26802   1
      40   1.0   .   .   26802   1
      41   1.0   .   .   26802   1
      42   1.0   .   .   26802   1
      43   1.0   .   .   26802   1
      44   1.0   .   .   26802   1
      45   1.0   .   .   26802   1
      46   1.0   .   .   26802   1
      47   1.0   .   .   26802   1
      48   1.0   .   .   26802   1
      49   1.0   .   .   26802   1
      50   1.0   .   .   26802   1
      51   1.0   .   .   26802   1
      52   1.0   .   .   26802   1
      53   1.0   .   .   26802   1
      54   1.0   .   .   26802   1
      55   1.0   .   .   26802   1
      56   1.0   .   .   26802   1
      57   1.0   .   .   26802   1
      58   1.0   .   .   26802   1
      59   1.0   .   .   26802   1
      60   1.0   .   .   26802   1
      61   1.0   .   .   26802   1
      62   1.0   .   .   26802   1
      63   1.0   .   .   26802   1
      64   1.0   .   .   26802   1
      65   1.0   .   .   26802   1
      66   1.0   .   .   26802   1
      67   1.0   .   .   26802   1
      68   1.0   .   .   26802   1
      69   1.0   .   .   26802   1
      70   1.0   .   .   26802   1
      71   1.0   .   .   26802   1
      72   1.0   .   .   26802   1
      73   1.0   .   .   26802   1
      74   1.0   .   .   26802   1
      75   1.0   .   .   26802   1
      76   1.0   .   .   26802   1
      77   1.0   .   .   26802   1
      78   1.0   .   .   26802   1
      79   1.0   .   .   26802   1
      80   1.0   .   .   26802   1
      81   1.0   .   .   26802   1
      82   1.0   .   .   26802   1
      83   1.0   .   .   26802   1
      84   1.0   .   .   26802   1
      85   1.0   .   .   26802   1
      86   1.0   .   .   26802   1
      87   1.0   .   .   26802   1
      88   1.0   .   .   26802   1
      89   1.0   .   .   26802   1
      90   1.0   .   .   26802   1
      91   1.0   .   .   26802   1
      92   1.0   .   .   26802   1
      93   1.0   .   .   26802   1
      94   1.0   .   .   26802   1
      95   1.0   .   .   26802   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    327045.21875000    .   height   26802   1
      1    2326316.37500000   .   volume   26802   1
      2    366019.00000000    .   height   26802   1
      2    2582355.95312000   .   volume   26802   1
      3    244809.70312500    .   height   26802   1
      3    1787245.31250000   .   volume   26802   1
      4    285866.43750000    .   height   26802   1
      4    2056161.68750000   .   volume   26802   1
      5    258319.92187500    .   height   26802   1
      5    1897431.37500000   .   volume   26802   1
      6    233821.29687500    .   height   26802   1
      6    1707915.60938000   .   volume   26802   1
      7    405861.00000000    .   height   26802   1
      7    2905113.09375000   .   volume   26802   1
      8    393255.84375000    .   height   26802   1
      8    2789370.26562000   .   volume   26802   1
      9    201641.48437500    .   height   26802   1
      9    1467057.42188000   .   volume   26802   1
      10   122236.49218800    .   height   26802   1
      10   903993.36718800    .   volume   26802   1
      11   222144.21875000    .   height   26802   1
      11   1621259.32812000   .   volume   26802   1
      12   315598.21875000    .   height   26802   1
      12   2286717.90625000   .   volume   26802   1
      13   199677.23437500    .   height   26802   1
      13   1478102.46094000   .   volume   26802   1
      14   374715.50000000    .   height   26802   1
      14   2705122.89062000   .   volume   26802   1
      15   461976.21875000    .   height   26802   1
      15   3305858.57812000   .   volume   26802   1
      16   404158.68750000    .   height   26802   1
      16   2886030.40625000   .   volume   26802   1
      17   597919.18750000    .   height   26802   1
      17   4250080.06250000   .   volume   26802   1
      18   566732.62500000    .   height   26802   1
      18   4005899.87500000   .   volume   26802   1
      19   368613.96875000    .   height   26802   1
      19   2684265.45312000   .   volume   26802   1
      20   326147.71875000    .   height   26802   1
      20   2325548.25000000   .   volume   26802   1
      21   339523.53125000    .   height   26802   1
      21   2419481.59375000   .   volume   26802   1
      22   209659.23437500    .   height   26802   1
      22   1537893.42188000   .   volume   26802   1
      23   368963.78125000    .   height   26802   1
      23   2630363.12500000   .   volume   26802   1
      24   419748.40625000    .   height   26802   1
      24   3077938.35938000   .   volume   26802   1
      25   408261.50000000    .   height   26802   1
      25   2874293.59375000   .   volume   26802   1
      26   446308.12500000    .   height   26802   1
      26   3202783.76562000   .   volume   26802   1
      27   365110.37500000    .   height   26802   1
      27   2574374.73438000   .   volume   26802   1
      28   159365.45312500    .   height   26802   1
      28   1200090.80469000   .   volume   26802   1
      29   543290.68750000    .   height   26802   1
      29   3892428.96875000   .   volume   26802   1
      30   313271.40625000    .   height   26802   1
      30   2268499.89062000   .   volume   26802   1
      31   250717.37500000    .   height   26802   1
      31   1836319.90625000   .   volume   26802   1
      32   500838.78125000    .   height   26802   1
      32   3517775.65625000   .   volume   26802   1
      33   953009.43750000    .   height   26802   1
      33   6498267.18750000   .   volume   26802   1
      34   576375.62500000    .   height   26802   1
      34   4048867.59375000   .   volume   26802   1
      35   260273.81250000    .   height   26802   1
      35   1885099.09375000   .   volume   26802   1
      36   832561.06250000    .   height   26802   1
      36   5741651.59375000   .   volume   26802   1
      37   694486.06250000    .   height   26802   1
      37   4887552.34375000   .   volume   26802   1
      38   213263.04687500    .   height   26802   1
      38   1549821.23438000   .   volume   26802   1
      39   382718.28125000    .   height   26802   1
      39   2768354.17188000   .   volume   26802   1
      40   793106.56250000    .   height   26802   1
      40   5457549.37500000   .   volume   26802   1
      41   639669.06250000    .   height   26802   1
      41   4535577.43750000   .   volume   26802   1
      42   325372.68750000    .   height   26802   1
      42   2335197.26562000   .   volume   26802   1
      43   747913.93750000    .   height   26802   1
      43   5133856.71875000   .   volume   26802   1
      44   233670.51562500    .   height   26802   1
      44   1729194.18750000   .   volume   26802   1
      45   279684.56250000    .   height   26802   1
      45   2033332.29688000   .   volume   26802   1
      46   803878.75000000    .   height   26802   1
      46   5529623.53125000   .   volume   26802   1
      47   982224.81250000    .   height   26802   1
      47   6772496.31250000   .   volume   26802   1
      48   402272.03125000    .   height   26802   1
      48   2873527.21875000   .   volume   26802   1
      49   319977.56250000    .   height   26802   1
      49   2314871.85938000   .   volume   26802   1
      50   354911.00000000    .   height   26802   1
      50   2550910.59375000   .   volume   26802   1
      51   405847.09375000    .   height   26802   1
      51   2955753.67188000   .   volume   26802   1
      52   436714.53125000    .   height   26802   1
      52   3136250.90625000   .   volume   26802   1
      53   433788.87500000    .   height   26802   1
      53   3130742.87500000   .   volume   26802   1
      54   174936.04687500    .   height   26802   1
      54   1385273.14062000   .   volume   26802   1
      55   697491.00000000    .   height   26802   1
      55   4883279.03125000   .   volume   26802   1
      56   696604.75000000    .   height   26802   1
      56   4852648.53125000   .   volume   26802   1
      57   390880.81250000    .   height   26802   1
      57   2798496.18750000   .   volume   26802   1
      58   539587.18750000    .   height   26802   1
      58   3915246.62500000   .   volume   26802   1
      59   433038.87500000    .   height   26802   1
      59   3052841.98438000   .   volume   26802   1
      60   614548.87500000    .   height   26802   1
      60   4288334.12500000   .   volume   26802   1
      61   477260.75000000    .   height   26802   1
      61   3410339.50000000   .   volume   26802   1
      62   299630.46875000    .   height   26802   1
      62   2197471.68750000   .   volume   26802   1
      63   230684.76562500    .   height   26802   1
      63   1698050.90625000   .   volume   26802   1
      64   258518.60937500    .   height   26802   1
      64   1954480.89062000   .   volume   26802   1
      65   423201.71875000    .   height   26802   1
      65   3061444.75000000   .   volume   26802   1
      66   345060.15625000    .   height   26802   1
      66   2513563.73438000   .   volume   26802   1
      67   245639.70312500    .   height   26802   1
      67   1785401.67188000   .   volume   26802   1
      68   628517.31250000    .   height   26802   1
      68   4348612.03125000   .   volume   26802   1
      69   430206.21875000    .   height   26802   1
      69   3036891.25000000   .   volume   26802   1
      70   608610.25000000    .   height   26802   1
      70   4284733.62500000   .   volume   26802   1
      71   303047.46875000    .   height   26802   1
      71   2174717.23438000   .   volume   26802   1
      72   623148.62500000    .   height   26802   1
      72   4376449.87500000   .   volume   26802   1
      73   8963.21289062      .   height   26802   1
      73   65884.52001950     .   volume   26802   1
      74   539986.68750000    .   height   26802   1
      74   3766969.06250000   .   volume   26802   1
      75   537242.62500000    .   height   26802   1
      75   3726970.65625000   .   volume   26802   1
      76   677049.93750000    .   height   26802   1
      76   4563016.53125000   .   volume   26802   1
      77   732662.50000000    .   height   26802   1
      77   4914261.12500000   .   volume   26802   1
      78   250391.09375000    .   height   26802   1
      78   1772141.54688000   .   volume   26802   1
      79   667020.68750000    .   height   26802   1
      79   4512354.62500000   .   volume   26802   1
      80   632466.68750000    .   height   26802   1
      80   4219319.81250000   .   volume   26802   1
      81   264302.65625000    .   height   26802   1
      81   1869756.92188000   .   volume   26802   1
      82   1167310.75000000   .   height   26802   1
      82   7605436.87500000   .   volume   26802   1
      83   619061.37500000    .   height   26802   1
      83   4221472.96875000   .   volume   26802   1
      84   712556.93750000    .   height   26802   1
      84   4845870.25000000   .   volume   26802   1
      85   1061456.87500000   .   height   26802   1
      85   7126840.09375000   .   volume   26802   1
      86   520975.06250000    .   height   26802   1
      86   3512984.21875000   .   volume   26802   1
      87   764828.81250000    .   height   26802   1
      87   5212751.62500000   .   volume   26802   1
      88   592294.06250000    .   height   26802   1
      88   4511011.96875000   .   volume   26802   1
      89   545373.25000000    .   height   26802   1
      89   4117852.92188000   .   volume   26802   1
      90   655454.18750000    .   height   26802   1
      90   5184368.61719000   .   volume   26802   1
      91   612336.75000000    .   height   26802   1
      91   4342687.42188000   .   volume   26802   1
      92   1298652.50000000   .   height   26802   1
      92   8850130.12500000   .   volume   26802   1
      93   387852.25000000    .   height   26802   1
      93   2684364.62500000   .   volume   26802   1
      94   322858.28125000    .   height   26802   1
      94   2302692.15625000   .   volume   26802   1
      95   539356.18750000    .   height   26802   1
      95   4336578.82812000   .   volume   26802   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

      1    1   9.215     .   22.8288826086   .   .   .   .   .   .   .   .   .   .   1   26802   1
      1    2   131.139   .   19.3520824018   .   .   .   .   .   .   .   .   .   .   1   26802   1
      2    1   10.351    .   22.6060149463   .   .   .   .   .   .   .   .   .   .   1   26802   1
      2    2   129.934   .   18.7318421490   .   .   .   .   .   .   .   .   .   .   1   26802   1
      3    1   9.061     .   22.2165921507   .   .   .   .   .   .   .   .   .   .   1   26802   1
      3    2   133.707   .   21.1672993244   .   .   .   .   .   .   .   .   .   .   1   26802   1
      4    1   8.383     .   21.8436299404   .   .   .   .   .   .   .   .   .   .   1   26802   1
      4    2   129.893   .   20.3778004431   .   .   .   .   .   .   .   .   .   .   1   26802   1
      5    1   8.089     .   23.8739131920   .   .   .   .   .   .   .   .   .   .   1   26802   1
      5    2   105.684   .   20.9206206360   .   .   .   .   .   .   .   .   .   .   1   26802   1
      6    1   6.070     .   25.4108120563   .   .   .   .   .   .   .   .   .   .   1   26802   1
      6    2   119.121   .   20.3778981957   .   .   .   .   .   .   .   .   .   .   1   26802   1
      7    1   7.475     .   22.0740781354   .   .   .   .   .   .   .   .   .   .   1   26802   1
      7    2   121.461   .   19.9762327586   .   .   .   .   .   .   .   .   .   .   1   26802   1
      8    1   8.289     .   21.5031557275   .   .   .   .   .   .   .   .   .   .   1   26802   1
      8    2   119.143   .   19.5583403897   .   .   .   .   .   .   .   .   .   .   1   26802   1
      9    1   8.789     .   24.2676677207   .   .   .   .   .   .   .   .   .   .   1   26802   1
      9    2   127.627   .   20.4915355943   .   .   .   .   .   .   .   .   .   .   1   26802   1
      10   1   8.629     .   25.8483170881   .   .   .   .   .   .   .   .   .   .   1   26802   1
      10   2   123.692   .   21.4485824335   .   .   .   .   .   .   .   .   .   .   1   26802   1
      11   1   9.445     .   24.0426341919   .   .   .   .   .   .   .   .   .   .   1   26802   1
      11   2   118.783   .   20.8056635773   .   .   .   .   .   .   .   .   .   .   1   26802   1
      12   1   7.704     .   24.1468123703   .   .   .   .   .   .   .   .   .   .   1   26802   1
      12   2   124.218   .   20.0403584648   .   .   .   .   .   .   .   .   .   .   1   26802   1
      13   1   8.198     .   26.5491914856   .   .   .   .   .   .   .   .   .   .   1   26802   1
      13   2   127.244   .   21.0186176184   .   .   .   .   .   .   .   .   .   .   1   26802   1
      14   1   6.655     .   21.4784648495   .   .   .   .   .   .   .   .   .   .   1   26802   1
      14   2   112.689   .   20.6111359015   .   .   .   .   .   .   .   .   .   .   1   26802   1
      15   1   8.810     .   20.0580896026   .   .   .   .   .   .   .   .   .   .   1   26802   1
      15   2   108.201   .   20.2560984550   .   .   .   .   .   .   .   .   .   .   1   26802   1
      16   1   8.634     .   22.0528526437   .   .   .   .   .   .   .   .   .   .   1   26802   1
      16   2   110.691   .   19.6686053236   .   .   .   .   .   .   .   .   .   .   1   26802   1
      17   1   7.954     .   20.6168831581   .   .   .   .   .   .   .   .   .   .   1   26802   1
      17   2   112.627   .   19.6062391642   .   .   .   .   .   .   .   .   .   .   1   26802   1
      18   1   7.820     .   20.1811108195   .   .   .   .   .   .   .   .   .   .   1   26802   1
      18   2   107.453   .   19.4508125287   .   .   .   .   .   .   .   .   .   .   1   26802   1
      19   1   8.647     .   23.3419763811   .   .   .   .   .   .   .   .   .   .   1   26802   1
      19   2   114.952   .   20.5522888358   .   .   .   .   .   .   .   .   .   .   1   26802   1
      20   1   7.578     .   24.4786231172   .   .   .   .   .   .   .   .   .   .   1   26802   1
      20   2   116.119   .   19.2699702170   .   .   .   .   .   .   .   .   .   .   1   26802   1
      21   1   8.975     .   20.6712464071   .   .   .   .   .   .   .   .   .   .   1   26802   1
      21   2   128.678   .   19.9104941345   .   .   .   .   .   .   .   .   .   .   1   26802   1
      22   1   8.965     .   24.7036566460   .   .   .   .   .   .   .   .   .   .   1   26802   1
      22   2   127.770   .   20.7419777578   .   .   .   .   .   .   .   .   .   .   1   26802   1
      23   1   9.133     .   21.2228926032   .   .   .   .   .   .   .   .   .   .   1   26802   1
      23   2   127.215   .   19.8754987034   .   .   .   .   .   .   .   .   .   .   1   26802   1
      24   1   8.843     .   20.8685568447   .   .   .   .   .   .   .   .   .   .   1   26802   1
      24   2   125.429   .   22.1237596480   .   .   .   .   .   .   .   .   .   .   1   26802   1
      25   1   9.196     .   19.7503199738   .   .   .   .   .   .   .   .   .   .   1   26802   1
      25   2   125.241   .   19.5039899436   .   .   .   .   .   .   .   .   .   .   1   26802   1
      26   1   8.865     .   21.9718492368   .   .   .   .   .   .   .   .   .   .   1   26802   1
      26   2   125.236   .   20.0508179931   .   .   .   .   .   .   .   .   .   .   1   26802   1
      27   1   9.011     .   21.6428541164   .   .   .   .   .   .   .   .   .   .   1   26802   1
      27   2   124.757   .   19.1689917803   .   .   .   .   .   .   .   .   .   .   1   26802   1
      28   1   8.137     .   25.3939182977   .   .   .   .   .   .   .   .   .   .   1   26802   1
      28   2   123.559   .   22.8954186795   .   .   .   .   .   .   .   .   .   .   1   26802   1
      29   1   8.203     .   20.5090230067   .   .   .   .   .   .   .   .   .   .   1   26802   1
      29   2   123.370   .   20.2109367534   .   .   .   .   .   .   .   .   .   .   1   26802   1
      30   1   9.099     .   23.5031168482   .   .   .   .   .   .   .   .   .   .   1   26802   1
      30   2   123.198   .   20.2021390193   .   .   .   .   .   .   .   .   .   .   1   26802   1
      31   1   8.255     .   23.2718023067   .   .   .   .   .   .   .   .   .   .   1   26802   1
      31   2   123.106   .   20.9921755398   .   .   .   .   .   .   .   .   .   .   1   26802   1
      32   1   8.866     .   21.4271338136   .   .   .   .   .   .   .   .   .   .   1   26802   1
      32   2   122.656   .   18.9546203265   .   .   .   .   .   .   .   .   .   .   1   26802   1
      33   1   8.068     .   18.6186547306   .   .   .   .   .   .   .   .   .   .   1   26802   1
      33   2   122.083   .   18.2338904000   .   .   .   .   .   .   .   .   .   .   1   26802   1
      34   1   8.248     .   19.9818511020   .   .   .   .   .   .   .   .   .   .   1   26802   1
      34   2   122.007   .   19.2704589801   .   .   .   .   .   .   .   .   .   .   1   26802   1
      35   1   9.385     .   23.9605478518   .   .   .   .   .   .   .   .   .   .   1   26802   1
      35   2   121.865   .   20.0688044717   .   .   .   .   .   .   .   .   .   .   1   26802   1
      36   1   8.019     .   18.9959486738   .   .   .   .   .   .   .   .   .   .   1   26802   1
      36   2   121.310   .   18.7137579179   .   .   .   .   .   .   .   .   .   .   1   26802   1
      37   1   8.682     .   18.3669810439   .   .   .   .   .   .   .   .   .   .   1   26802   1
      37   2   121.223   .   19.8769161161   .   .   .   .   .   .   .   .   .   .   1   26802   1
      38   1   8.164     .   23.6685890484   .   .   .   .   .   .   .   .   .   .   1   26802   1
      38   2   121.249   .   20.4998934417   .   .   .   .   .   .   .   .   .   .   1   26802   1
      39   1   8.721     .   24.8732439924   .   .   .   .   .   .   .   .   .   .   1   26802   1
      39   2   121.182   .   19.9907978961   .   .   .   .   .   .   .   .   .   .   1   26802   1
      40   1   8.547     .   18.8876553491   .   .   .   .   .   .   .   .   .   .   1   26802   1
      40   2   121.169   .   18.5562784778   .   .   .   .   .   .   .   .   .   .   1   26802   1
      41   1   7.862     .   19.8007846631   .   .   .   .   .   .   .   .   .   .   1   26802   1
      41   2   120.876   .   19.8345892399   .   .   .   .   .   .   .   .   .   .   1   26802   1
      42   1   9.097     .   21.6242276645   .   .   .   .   .   .   .   .   .   .   1   26802   1
      42   2   120.837   .   20.1620604529   .   .   .   .   .   .   .   .   .   .   1   26802   1
      43   1   8.578     .   18.3955704817   .   .   .   .   .   .   .   .   .   .   1   26802   1
      43   2   120.738   .   18.4139506909   .   .   .   .   .   .   .   .   .   .   1   26802   1
      44   1   7.786     .   26.4577919196   .   .   .   .   .   .   .   .   .   .   1   26802   1
      44   2   120.171   .   20.9735047931   .   .   .   .   .   .   .   .   .   .   1   26802   1
      45   1   9.339     .   23.9161475887   .   .   .   .   .   .   .   .   .   .   1   26802   1
      45   2   119.924   .   20.3933431067   .   .   .   .   .   .   .   .   .   .   1   26802   1
      46   1   7.856     .   17.8497721251   .   .   .   .   .   .   .   .   .   .   1   26802   1
      46   2   119.689   .   18.8633193973   .   .   .   .   .   .   .   .   .   .   1   26802   1
      47   1   8.021     .   18.8486697522   .   .   .   .   .   .   .   .   .   .   1   26802   1
      47   2   119.652   .   18.3607732760   .   .   .   .   .   .   .   .   .   .   1   26802   1
      48   1   8.833     .   22.6677421414   .   .   .   .   .   .   .   .   .   .   1   26802   1
      48   2   119.566   .   19.5683111550   .   .   .   .   .   .   .   .   .   .   1   26802   1
      49   1   9.293     .   23.1004822670   .   .   .   .   .   .   .   .   .   .   1   26802   1
      49   2   118.747   .   19.9441699055   .   .   .   .   .   .   .   .   .   .   1   26802   1
      50   1   8.787     .   23.4481038393   .   .   .   .   .   .   .   .   .   .   1   26802   1
      50   2   118.356   .   19.7349793396   .   .   .   .   .   .   .   .   .   .   1   26802   1
      51   1   8.387     .   22.4925235420   .   .   .   .   .   .   .   .   .   .   1   26802   1
      51   2   118.094   .   20.9501419215   .   .   .   .   .   .   .   .   .   .   1   26802   1
      52   1   8.059     .   23.3658009125   .   .   .   .   .   .   .   .   .   .   1   26802   1
      52   2   118.076   .   19.7670421927   .   .   .   .   .   .   .   .   .   .   1   26802   1
      53   1   8.124     .   21.1440550628   .   .   .   .   .   .   .   .   .   .   1   26802   1
      53   2   118.035   .   20.6690054412   .   .   .   .   .   .   .   .   .   .   1   26802   1
      54   1   8.368     .   24.8758430322   .   .   .   .   .   .   .   .   .   .   1   26802   1
      54   2   117.861   .   37.0596727985   .   .   .   .   .   .   .   .   .   .   1   26802   1
      55   1   8.019     .   18.2482915601   .   .   .   .   .   .   .   .   .   .   1   26802   1
      55   2   117.552   .   19.4850259390   .   .   .   .   .   .   .   .   .   .   1   26802   1
      56   1   8.040     .   19.2957045966   .   .   .   .   .   .   .   .   .   .   1   26802   1
      56   2   116.689   .   19.0482673182   .   .   .   .   .   .   .   .   .   .   1   26802   1
      57   1   8.986     .   21.7829856786   .   .   .   .   .   .   .   .   .   .   1   26802   1
      57   2   116.481   .   19.8009623452   .   .   .   .   .   .   .   .   .   .   1   26802   1
      58   1   8.405     .   21.2649104131   .   .   .   .   .   .   .   .   .   .   1   26802   1
      58   2   116.432   .   20.3761386489   .   .   .   .   .   .   .   .   .   .   1   26802   1
      59   1   8.986     .   21.4888610086   .   .   .   .   .   .   .   .   .   .   1   26802   1
      59   2   116.052   .   19.1788647930   .   .   .   .   .   .   .   .   .   .   1   26802   1
      60   1   7.973     .   19.8016510097   .   .   .   .   .   .   .   .   .   .   1   26802   1
      60   2   115.827   .   19.0523729274   .   .   .   .   .   .   .   .   .   .   1   26802   1
      61   1   8.334     .   22.7740861863   .   .   .   .   .   .   .   .   .   .   1   26802   1
      61   2   115.630   .   19.5677246394   .   .   .   .   .   .   .   .   .   .   1   26802   1
      62   1   8.362     .   23.8613511664   .   .   .   .   .   .   .   .   .   .   1   26802   1
      62   2   114.804   .   20.9030251678   .   .   .   .   .   .   .   .   .   .   1   26802   1
      63   1   7.667     .   25.6798126749   .   .   .   .   .   .   .   .   .   .   1   26802   1
      63   2   114.684   .   20.6242347500   .   .   .   .   .   .   .   .   .   .   1   26802   1
      64   1   7.561     .   22.5778586819   .   .   .   .   .   .   .   .   .   .   1   26802   1
      64   2   112.096   .   24.1357036799   .   .   .   .   .   .   .   .   .   .   1   26802   1
      65   1   7.373     .   20.3023993431   .   .   .   .   .   .   .   .   .   .   1   26802   1
      65   2   112.062   .   21.0107485340   .   .   .   .   .   .   .   .   .   .   1   26802   1
      66   1   8.334     .   21.3861989368   .   .   .   .   .   .   .   .   .   .   1   26802   1
      66   2   109.832   .   20.8967690014   .   .   .   .   .   .   .   .   .   .   1   26802   1
      67   1   8.418     .   22.8009429308   .   .   .   .   .   .   .   .   .   .   1   26802   1
      67   2   109.394   .   20.5303922532   .   .   .   .   .   .   .   .   .   .   1   26802   1
      68   1   8.315     .   20.2300594022   .   .   .   .   .   .   .   .   .   .   1   26802   1
      68   2   108.664   .   18.5116055392   .   .   .   .   .   .   .   .   .   .   1   26802   1
      69   1   7.817     .   21.5204826595   .   .   .   .   .   .   .   .   .   .   1   26802   1
      69   2   108.661   .   19.2660601130   .   .   .   .   .   .   .   .   .   .   1   26802   1
      70   1   7.427     .   20.3006666499   .   .   .   .   .   .   .   .   .   .   1   26802   1
      70   2   108.787   .   19.0736829944   .   .   .   .   .   .   .   .   .   .   1   26802   1
      71   1   8.192     .   23.7747165066   .   .   .   .   .   .   .   .   .   .   1   26802   1
      71   2   107.888   .   19.7370321442   .   .   .   .   .   .   .   .   .   .   1   26802   1
      72   1   8.476     .   20.1529545550   .   .   .   .   .   .   .   .   .   .   1   26802   1
      72   2   119.046   .   19.0176707541   .   .   .   .   .   .   .   .   .   .   1   26802   1
      73   1   7.806     .   22.0428896579   .   .   .   .   .   .   .   .   .   .   1   26802   1
      73   2   117.360   .   21.1176898794   .   .   .   .   .   .   .   .   .   .   1   26802   1
      74   1   7.041     .   18.7598692260   .   .   .   .   .   .   .   .   .   .   1   26802   1
      74   2   114.250   .   18.7888319154   .   .   .   .   .   .   .   .   .   .   1   26802   1
      75   1   7.646     .   17.1991458303   .   .   .   .   .   .   .   .   .   .   1   26802   1
      75   2   114.252   .   18.9837506016   .   .   .   .   .   .   .   .   .   .   1   26802   1
      76   1   7.807     .   16.7573090655   .   .   .   .   .   .   .   .   .   .   1   26802   1
      76   2   113.318   .   18.1802242221   .   .   .   .   .   .   .   .   .   .   1   26802   1
      77   1   7.721     .   16.6559465135   .   .   .   .   .   .   .   .   .   .   1   26802   1
      77   2   111.553   .   18.1796377065   .   .   .   .   .   .   .   .   .   .   1   26802   1
      78   1   7.527     .   21.8332337812   .   .   .   .   .   .   .   .   .   .   1   26802   1
      78   2   112.948   .   19.4242238213   .   .   .   .   .   .   .   .   .   .   1   26802   1
      79   1   7.317     .   16.5060685521   .   .   .   .   .   .   .   .   .   .   1   26802   1
      79   2   110.282   .   18.6406389724   .   .   .   .   .   .   .   .   .   .   1   26802   1
      80   1   7.219     .   16.4826771940   .   .   .   .   .   .   .   .   .   .   1   26802   1
      80   2   112.459   .   17.9952763012   .   .   .   .   .   .   .   .   .   .   1   26802   1
      81   1   7.242     .   21.6885538994   .   .   .   .   .   .   .   .   .   .   1   26802   1
      81   2   112.944   .   19.3125903510   .   .   .   .   .   .   .   .   .   .   1   26802   1
      82   1   7.443     .   14.6027050771   .   .   .   .   .   .   .   .   .   .   1   26802   1
      82   2   112.300   .   17.4392595072   .   .   .   .   .   .   .   .   .   .   1   26802   1
      83   1   6.829     .   17.6297200893   .   .   .   .   .   .   .   .   .   .   1   26802   1
      83   2   110.282   .   18.4771966237   .   .   .   .   .   .   .   .   .   .   1   26802   1
      84   1   6.743     .   17.7427783203   .   .   .   .   .   .   .   .   .   .   1   26802   1
      84   2   111.555   .   18.4081832874   .   .   .   .   .   .   .   .   .   .   1   26802   1
      85   1   6.841     .   16.7906634095   .   .   .   .   .   .   .   .   .   .   1   26802   1
      85   2   112.301   .   17.6996724361   .   .   .   .   .   .   .   .   .   .   1   26802   1
      86   1   7.614     .   17.4144329598   .   .   .   .   .   .   .   .   .   .   1   26802   1
      86   2   112.319   .   18.1901949874   .   .   .   .   .   .   .   .   .   .   1   26802   1
      87   1   6.788     .   17.2740848110   .   .   .   .   .   .   .   .   .   .   1   26802   1
      87   2   113.320   .   18.5503155692   .   .   .   .   .   .   .   .   .   .   1   26802   1
      88   1   6.901     .   20.0910107733   .   .   .   .   .   .   .   .   .   .   1   26802   1
      88   2   112.459   .   25.6717880505   .   .   .   .   .   .   .   .   .   .   1   26802   1
      89   1   7.564     .   27.7893666402   .   .   .   .   .   .   .   .   .   .   1   26802   1
      89   2   112.974   .   20.3030197034   .   .   .   .   .   .   .   .   .   .   1   26802   1
      90   1   6.925     .   21.5871913475   .   .   .   .   .   .   .   .   .   .   1   26802   1
      90   2   112.974   .   22.6944393321   .   .   .   .   .   .   .   .   .   .   1   26802   1
      91   1   7.583     .   29.9015196453   .   .   .   .   .   .   .   .   .   .   1   26802   1
      91   2   113.053   .   18.4799336965   .   .   .   .   .   .   .   .   .   .   1   26802   1
      92   1   6.918     .   17.8181504743   .   .   .   .   .   .   .   .   .   .   1   26802   1
      92   2   113.050   .   18.4199135995   .   .   .   .   .   .   .   .   .   .   1   26802   1
      93   1   7.363     .   17.9164808131   .   .   .   .   .   .   .   .   .   .   1   26802   1
      93   2   109.880   .   19.2302826611   .   .   .   .   .   .   .   .   .   .   1   26802   1
      94   1   6.646     .   20.0199703523   .   .   .   .   .   .   .   .   .   .   1   26802   1
      94   2   109.877   .   20.0991077780   .   .   .   .   .   .   .   .   .   .   1   26802   1
      95   1   6.896     .   19.4295551460   .   .   .   .   .   .   .   .   .   .   1   26802   1
      95   2   112.318   .   28.2186343146   .   .   .   .   .   .   .   .   .   .   1   26802   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

      1    1   1   .   .   9.215     .   .   1   .   1   1   19   ALA   H      .   .   .   .   .   .   .   .   .   .   25    .   26802   1
      1    2   1   .   .   131.139   .   .   1   .   1   1   19   ALA   N      .   .   .   .   .   .   .   .   .   .   26    .   26802   1
      2    1   1   .   .   10.351    .   .   1   .   1   1   8    TRP   HE1    .   .   .   .   .   .   .   .   .   .   285   .   26802   1
      2    2   1   .   .   129.934   .   .   1   .   1   1   8    TRP   NE1    .   .   .   .   .   .   .   .   .   .   286   .   26802   1
      3    1   1   .   .   9.061     .   .   1   .   1   1   7    LYS   H      .   .   .   .   .   .   .   .   .   .   89    .   26802   1
      3    2   1   .   .   133.707   .   .   1   .   1   1   7    LYS   N      .   .   .   .   .   .   .   .   .   .   90    .   26802   1
      4    1   1   .   .   8.383     .   .   1   .   1   1   28   PHE   H      .   .   .   .   .   .   .   .   .   .   95    .   26802   1
      4    2   1   .   .   129.893   .   .   1   .   1   1   28   PHE   N      .   .   .   .   .   .   .   .   .   .   96    .   26802   1
      5    1   1   .   .   8.089     .   .   1   .   1   1   16   GLY   H      .   .   .   .   .   .   .   .   .   .   147   .   26802   1
      5    2   1   .   .   105.684   .   .   1   .   1   1   16   GLY   N      .   .   .   .   .   .   .   .   .   .   148   .   26802   1
      6    1   1   .   .   6.070     .   .   1   .   1   1   42   LEU   H      .   .   .   .   .   .   .   .   .   .   83    .   26802   1
      6    2   1   .   .   119.121   .   .   1   .   1   1   42   LEU   N      .   .   .   .   .   .   .   .   .   .   84    .   26802   1
      7    1   1   .   .   7.475     .   .   1   .   1   1   34   ILE   H      .   .   .   .   .   .   .   .   .   .   53    .   26802   1
      7    2   1   .   .   121.461   .   .   1   .   1   1   34   ILE   N      .   .   .   .   .   .   .   .   .   .   54    .   26802   1
      8    1   1   .   .   8.289     .   .   1   .   1   1   64   VAL   H      .   .   .   .   .   .   .   .   .   .   77    .   26802   1
      8    2   1   .   .   119.143   .   .   1   .   1   1   64   VAL   N      .   .   .   .   .   .   .   .   .   .   78    .   26802   1
      9    1   1   .   .   8.789     .   .   1   .   1   1   35   GLN   H      .   .   .   .   .   .   .   .   .   .   75    .   26802   1
      9    2   1   .   .   127.627   .   .   1   .   1   1   35   GLN   N      .   .   .   .   .   .   .   .   .   .   76    .   26802   1
      10   1   1   .   .   8.629     .   .   1   .   1   1   56   ALA   H      .   .   .   .   .   .   .   .   .   .   181   .   26802   1
      10   2   1   .   .   123.692   .   .   1   .   1   1   56   ALA   N      .   .   .   .   .   .   .   .   .   .   182   .   26802   1
      11   1   1   .   .   9.445     .   .   1   .   1   1   63   GLN   H      .   .   .   .   .   .   .   .   .   .   3     .   26802   1
      11   2   1   .   .   118.783   .   .   1   .   1   1   63   GLN   N      .   .   .   .   .   .   .   .   .   .   4     .   26802   1
      12   1   1   .   .   7.704     .   .   1   .   1   1   29   VAL   H      .   .   .   .   .   .   .   .   .   .   157   .   26802   1
      12   2   1   .   .   124.218   .   .   1   .   1   1   29   VAL   N      .   .   .   .   .   .   .   .   .   .   158   .   26802   1
      13   1   1   .   .   8.198     .   .   1   .   1   1   10   ASN   H      .   .   .   .   .   .   .   .   .   .   101   .   26802   1
      13   2   1   .   .   127.244   .   .   1   .   1   1   10   ASN   N      .   .   .   .   .   .   .   .   .   .   102   .   26802   1
      14   1   1   .   .   6.655     .   .   1   .   1   1   15   PHE   H      .   .   .   .   .   .   .   .   .   .   17    .   26802   1
      14   2   1   .   .   112.689   .   .   1   .   1   1   15   PHE   N      .   .   .   .   .   .   .   .   .   .   18    .   26802   1
      15   1   1   .   .   8.810     .   .   1   .   1   1   4    GLY   H      .   .   .   .   .   .   .   .   .   .   179   .   26802   1
      15   2   1   .   .   108.201   .   .   1   .   1   1   4    GLY   N      .   .   .   .   .   .   .   .   .   .   180   .   26802   1
      16   1   1   .   .   8.634     .   .   1   .   1   1   68   GLY   H      .   .   .   .   .   .   .   .   .   .   167   .   26802   1
      16   2   1   .   .   110.691   .   .   1   .   1   1   68   GLY   N      .   .   .   .   .   .   .   .   .   .   168   .   26802   1
      17   1   1   .   .   7.954     .   .   1   .   1   1   55   GLY   H      .   .   .   .   .   .   .   .   .   .   254   .   26802   1
      17   2   1   .   .   112.627   .   .   1   .   1   1   55   GLY   N      .   .   .   .   .   .   .   .   .   .   253   .   26802   1
      18   1   1   .   .   7.820     .   .   1   .   1   1   23   GLY   H      .   .   .   .   .   .   .   .   .   .   21    .   26802   1
      18   2   1   .   .   107.453   .   .   1   .   1   1   23   GLY   N      .   .   .   .   .   .   .   .   .   .   22    .   26802   1
      19   1   1   .   .   8.647     .   .   1   .   1   1   48   VAL   H      .   .   .   .   .   .   .   .   .   .   151   .   26802   1
      19   2   1   .   .   114.952   .   .   1   .   1   1   48   VAL   N      .   .   .   .   .   .   .   .   .   .   152   .   26802   1
      20   1   1   .   .   7.578     .   .   1   .   1   1   13   LYS   H      .   .   .   .   .   .   .   .   .   .   119   .   26802   1
      20   2   1   .   .   116.119   .   .   1   .   1   1   13   LYS   N      .   .   .   .   .   .   .   .   .   .   120   .   26802   1
      21   1   1   .   .   8.975     .   .   1   .   1   1   11   ALA   H      .   .   .   .   .   .   .   .   .   .   123   .   26802   1
      21   2   1   .   .   128.678   .   .   1   .   1   1   11   ALA   N      .   .   .   .   .   .   .   .   .   .   124   .   26802   1
      22   1   1   .   .   8.965     .   .   1   .   1   1   30   HIS   H      .   .   .   .   .   .   .   .   .   .   85    .   26802   1
      22   2   1   .   .   127.770   .   .   1   .   1   1   30   HIS   N      .   .   .   .   .   .   .   .   .   .   86    .   26802   1
      23   1   1   .   .   9.133     .   .   1   .   1   1   6    VAL   H      .   .   .   .   .   .   .   .   .   .   63    .   26802   1
      23   2   1   .   .   127.215   .   .   1   .   1   1   6    VAL   N      .   .   .   .   .   .   .   .   .   .   64    .   26802   1
      24   1   1   .   .   8.843     .   .   1   .   1   1   47   LYS   H      .   .   .   .   .   .   .   .   .   .   227   .   26802   1
      24   2   1   .   .   125.429   .   .   1   .   1   1   47   LYS   N      .   .   .   .   .   .   .   .   .   .   226   .   26802   1
      25   1   1   .   .   9.196     .   .   1   .   1   1   21   ASP   H      .   .   .   .   .   .   .   .   .   .   29    .   26802   1
      25   2   1   .   .   125.241   .   .   1   .   1   1   21   ASP   N      .   .   .   .   .   .   .   .   .   .   30    .   26802   1
      26   1   1   .   .   8.865     .   .   1   .   1   1   66   ALA   H      .   .   .   .   .   .   .   .   .   .   43    .   26802   1
      26   2   1   .   .   125.236   .   .   1   .   1   1   66   ALA   N      .   .   .   .   .   .   .   .   .   .   44    .   26802   1
      27   1   1   .   .   9.011     .   .   1   .   1   1   61   ALA   H      .   .   .   .   .   .   .   .   .   .   31    .   26802   1
      27   2   1   .   .   124.757   .   .   1   .   1   1   61   ALA   N      .   .   .   .   .   .   .   .   .   .   32    .   26802   1
      28   1   1   .   .   8.137     .   .   1   .   1   1   40   ARG   H      .   .   .   .   .   .   .   .   .   .   33    .   26802   1
      28   2   1   .   .   123.559   .   .   1   .   1   1   40   ARG   N      .   .   .   .   .   .   .   .   .   .   34    .   26802   1
      29   1   1   .   .   8.203     .   .   1   .   1   1   67   LEU   H      .   .   .   .   .   .   .   .   .   .   177   .   26802   1
      29   2   1   .   .   123.370   .   .   1   .   1   1   67   LEU   N      .   .   .   .   .   .   .   .   .   .   178   .   26802   1
      30   1   1   .   .   9.099     .   .   1   .   1   1   65   HIS   H      .   .   .   .   .   .   .   .   .   .   135   .   26802   1
      30   2   1   .   .   123.198   .   .   1   .   1   1   65   HIS   N      .   .   .   .   .   .   .   .   .   .   136   .   26802   1
      31   1   1   .   .   8.255     .   .   1   .   1   1   31   TYR   H      .   .   .   .   .   .   .   .   .   .   145   .   26802   1
      31   2   1   .   .   123.106   .   .   1   .   1   1   31   TYR   N      .   .   .   .   .   .   .   .   .   .   146   .   26802   1
      32   1   1   .   .   8.866     .   .   1   .   1   1   52   ILE   H      .   .   .   .   .   .   .   .   .   .   159   .   26802   1
      32   2   1   .   .   122.656   .   .   1   .   1   1   52   ILE   N      .   .   .   .   .   .   .   .   .   .   160   .   26802   1
      33   1   1   .   .   8.068     .   .   1   .   1   1   72   LEU   H      .   .   .   .   .   .   .   .   .   .   163   .   26802   1
      33   2   1   .   .   122.083   .   .   1   .   1   1   72   LEU   N      .   .   .   .   .   .   .   .   .   .   164   .   26802   1
      34   1   1   .   .   8.248     .   .   1   .   1   1   75   GLN   H      .   .   .   .   .   .   .   .   .   .   175   .   26802   1
      34   2   1   .   .   122.007   .   .   1   .   1   1   75   GLN   N      .   .   .   .   .   .   .   .   .   .   176   .   26802   1
      35   1   1   .   .   9.385     .   .   1   .   1   1   18   ILE   H      .   .   .   .   .   .   .   .   .   .   183   .   26802   1
      35   2   1   .   .   121.865   .   .   1   .   1   1   18   ILE   N      .   .   .   .   .   .   .   .   .   .   184   .   26802   1
      36   1   1   .   .   8.019     .   .   1   .   1   1   74   PHE   H      .   .   .   .   .   .   .   .   .   .   143   .   26802   1
      36   2   1   .   .   121.310   .   .   1   .   1   1   74   PHE   N      .   .   .   .   .   .   .   .   .   .   144   .   26802   1
      37   1   1   .   .   8.682     .   .   1   .   1   1   44   GLU   H      .   .   .   .   .   .   .   .   .   .   234   .   26802   1
      37   2   1   .   .   121.223   .   .   1   .   1   1   44   GLU   N      .   .   .   .   .   .   .   .   .   .   233   .   26802   1
      38   1   1   .   .   8.164     .   .   1   .   1   1   39   PHE   H      .   .   .   .   .   .   .   .   .   .   79    .   26802   1
      38   2   1   .   .   121.249   .   .   1   .   1   1   39   PHE   N      .   .   .   .   .   .   .   .   .   .   80    .   26802   1
      39   1   1   .   .   8.721     .   .   1   .   1   1   49   GLU   H      .   .   .   .   .   .   .   .   .   .   69    .   26802   1
      39   2   1   .   .   121.182   .   .   1   .   1   1   49   GLU   N      .   .   .   .   .   .   .   .   .   .   70    .   26802   1
      40   1   1   .   .   8.547     .   .   1   .   1   1   54   GLU   H      .   .   .   .   .   .   .   .   .   .   251   .   26802   1
      40   2   1   .   .   121.169   .   .   1   .   1   1   54   GLU   N      .   .   .   .   .   .   .   .   .   .   250   .   26802   1
      41   1   1   .   .   7.862     .   .   1   .   1   1   46   GLN   H      .   .   .   .   .   .   .   .   .   .   1     .   26802   1
      41   2   1   .   .   120.876   .   .   1   .   1   1   46   GLN   N      .   .   .   .   .   .   .   .   .   .   2     .   26802   1
      42   1   1   .   .   9.097     .   .   1   .   1   1   9    PHE   H      .   .   .   .   .   .   .   .   .   .   129   .   26802   1
      42   2   1   .   .   120.837   .   .   1   .   1   1   9    PHE   N      .   .   .   .   .   .   .   .   .   .   130   .   26802   1
      43   1   1   .   .   8.578     .   .   1   .   1   1   70   GLU   H      .   .   .   .   .   .   .   .   .   .   11    .   26802   1
      43   2   1   .   .   120.738   .   .   1   .   1   1   70   GLU   N      .   .   .   .   .   .   .   .   .   .   12    .   26802   1
      44   1   1   .   .   7.786     .   .   1   .   1   1   33   GLU   H      .   .   .   .   .   .   .   .   .   .   23    .   26802   1
      44   2   1   .   .   120.171   .   .   1   .   1   1   33   GLU   N      .   .   .   .   .   .   .   .   .   .   24    .   26802   1
      45   1   1   .   .   9.339     .   .   1   .   1   1   27   VAL   H      .   .   .   .   .   .   .   .   .   .   217   .   26802   1
      45   2   1   .   .   119.924   .   .   1   .   1   1   27   VAL   N      .   .   .   .   .   .   .   .   .   .   216   .   26802   1
      46   1   1   .   .   7.856     .   .   1   .   1   1   25   ALA   H      .   .   .   .   .   .   .   .   .   .   41    .   26802   1
      46   2   1   .   .   119.689   .   .   1   .   1   1   25   ALA   N      .   .   .   .   .   .   .   .   .   .   42    .   26802   1
      47   1   1   .   .   8.021     .   .   1   .   1   1   73   TYR   H      .   .   .   .   .   .   .   .   .   .   65    .   26802   1
      47   2   1   .   .   119.652   .   .   1   .   1   1   73   TYR   N      .   .   .   .   .   .   .   .   .   .   66    .   26802   1
      48   1   1   .   .   8.833     .   .   1   .   1   1   60   GLN   H      .   .   .   .   .   .   .   .   .   .   49    .   26802   1
      48   2   1   .   .   119.566   .   .   1   .   1   1   60   GLN   N      .   .   .   .   .   .   .   .   .   .   50    .   26802   1
      49   1   1   .   .   9.293     .   .   1   .   1   1   62   GLN   H      .   .   .   .   .   .   .   .   .   .   5     .   26802   1
      49   2   1   .   .   118.747   .   .   1   .   1   1   62   GLN   N      .   .   .   .   .   .   .   .   .   .   6     .   26802   1
      50   1   1   .   .   8.787     .   .   1   .   1   1   51   GLU   H      .   .   .   .   .   .   .   .   .   .   27    .   26802   1
      50   2   1   .   .   118.356   .   .   1   .   1   1   51   GLU   N      .   .   .   .   .   .   .   .   .   .   28    .   26802   1
      51   1   1   .   .   8.387     .   .   1   .   1   1   50   PHE   H      .   .   .   .   .   .   .   .   .   .   55    .   26802   1
      51   2   1   .   .   118.094   .   .   1   .   1   1   50   PHE   N      .   .   .   .   .   .   .   .   .   .   56    .   26802   1
      52   1   1   .   .   8.059     .   .   1   .   1   1   43   GLU   H      .   .   .   .   .   .   .   .   .   .   236   .   26802   1
      52   2   1   .   .   118.076   .   .   1   .   1   1   43   GLU   N      .   .   .   .   .   .   .   .   .   .   237   .   26802   1
      53   1   1   .   .   8.124     .   .   1   .   1   1   12   GLU   H      .   .   .   .   .   .   .   .   .   .   51    .   26802   1
      53   2   1   .   .   118.035   .   .   1   .   1   1   12   GLU   N      .   .   .   .   .   .   .   .   .   .   52    .   26802   1
      54   1   1   .   .   8.368     .   .   1   .   1   1   37   ASN   H      .   .   .   .   .   .   .   .   .   .   244   .   26802   1
      54   2   1   .   .   117.861   .   .   1   .   1   1   37   ASN   N      .   .   .   .   .   .   .   .   .   .   245   .   26802   1
      55   1   1   .   .   8.019     .   .   1   .   1   1   26   ASP   H      .   .   .   .   .   .   .   .   .   .   59    .   26802   1
      55   2   1   .   .   117.552   .   .   1   .   1   1   26   ASP   N      .   .   .   .   .   .   .   .   .   .   60    .   26802   1
      56   1   1   .   .   8.040     .   .   1   .   1   1   22   ASP   H      .   .   .   .   .   .   .   .   .   .   61    .   26802   1
      56   2   1   .   .   116.689   .   .   1   .   1   1   22   ASP   N      .   .   .   .   .   .   .   .   .   .   62    .   26802   1
      57   1   1   .   .   8.986     .   .   1   .   1   1   45   ASN   H      .   .   .   .   .   .   .   .   .   .   231   .   26802   1
      57   2   1   .   .   116.481   .   .   1   .   1   1   45   ASN   N      .   .   .   .   .   .   .   .   .   .   230   .   26802   1
      58   1   1   .   .   8.405     .   .   1   .   1   1   3    GLN   H      .   .   .   .   .   .   .   .   .   .   87    .   26802   1
      58   2   1   .   .   116.432   .   .   1   .   1   1   3    GLN   N      .   .   .   .   .   .   .   .   .   .   88    .   26802   1
      59   1   1   .   .   8.986     .   .   1   .   1   1   53   GLY   H      .   .   .   .   .   .   .   .   .   .   248   .   26802   1
      59   2   1   .   .   116.052   .   .   1   .   1   1   53   GLY   N      .   .   .   .   .   .   .   .   .   .   247   .   26802   1
      60   1   1   .   .   7.973     .   .   1   .   1   1   24   SER   H      .   .   .   .   .   .   .   .   .   .   127   .   26802   1
      60   2   1   .   .   115.827   .   .   1   .   1   1   24   SER   N      .   .   .   .   .   .   .   .   .   .   128   .   26802   1
      61   1   1   .   .   8.334     .   .   1   .   1   1   5    THR   H      .   .   .   .   .   .   .   .   .   .   45    .   26802   1
      61   2   1   .   .   115.630   .   .   1   .   1   1   5    THR   N      .   .   .   .   .   .   .   .   .   .   46    .   26802   1
      62   1   1   .   .   8.362     .   .   1   .   1   1   57   LYS   H      .   .   .   .   .   .   .   .   .   .   171   .   26802   1
      62   2   1   .   .   114.804   .   .   1   .   1   1   57   LYS   N      .   .   .   .   .   .   .   .   .   .   172   .   26802   1
      63   1   1   .   .   7.667     .   .   1   .   1   1   17   PHE   H      .   .   .   .   .   .   .   .   .   .   165   .   26802   1
      63   2   1   .   .   114.684   .   .   1   .   1   1   17   PHE   N      .   .   .   .   .   .   .   .   .   .   166   .   26802   1
      64   1   1   .   .   7.561     .   .   1   .   1   1   41   THR   H      .   .   .   .   .   .   .   .   .   .   113   .   26802   1
      64   2   1   .   .   112.096   .   .   1   .   1   1   41   THR   N      .   .   .   .   .   .   .   .   .   .   114   .   26802   1
      65   1   1   .   .   7.373     .   .   1   .   1   1   8    TRP   H      .   .   .   .   .   .   .   .   .   .   131   .   26802   1
      65   2   1   .   .   112.062   .   .   1   .   1   1   8    TRP   N      .   .   .   .   .   .   .   .   .   .   132   .   26802   1
      66   1   1   .   .   8.334     .   .   1   .   1   1   36   GLY   H      .   .   .   .   .   .   .   .   .   .   125   .   26802   1
      66   2   1   .   .   109.832   .   .   1   .   1   1   36   GLY   N      .   .   .   .   .   .   .   .   .   .   126   .   26802   1
      67   1   1   .   .   8.418     .   .   1   .   1   1   38   GLY   H      .   .   .   .   .   .   .   .   .   .   155   .   26802   1
      67   2   1   .   .   109.394   .   .   1   .   1   1   38   GLY   N      .   .   .   .   .   .   .   .   .   .   156   .   26802   1
      68   1   1   .   .   8.315     .   .   1   .   1   1   69   GLY   H      .   .   .   .   .   .   .   .   .   .   169   .   26802   1
      68   2   1   .   .   108.664   .   .   1   .   1   1   69   GLY   N      .   .   .   .   .   .   .   .   .   .   170   .   26802   1
      69   1   1   .   .   7.817     .   .   1   .   1   1   76   GLY   H      .   .   .   .   .   .   .   .   .   .   173   .   26802   1
      69   2   1   .   .   108.661   .   .   1   .   1   1   76   GLY   N      .   .   .   .   .   .   .   .   .   .   174   .   26802   1
      70   1   1   .   .   7.427     .   .   1   .   1   1   58   GLY   H      .   .   .   .   .   .   .   .   .   .   161   .   26802   1
      70   2   1   .   .   108.787   .   .   1   .   1   1   58   GLY   N      .   .   .   .   .   .   .   .   .   .   162   .   26802   1
      71   1   1   .   .   8.192     .   .   1   .   1   1   14   GLY   H      .   .   .   .   .   .   .   .   .   .   9     .   26802   1
      71   2   1   .   .   107.888   .   .   1   .   1   1   14   GLY   N      .   .   .   .   .   .   .   .   .   .   10    .   26802   1
      72   1   1   .   .   8.476     .   .   1   .   1   1   71   ASN   H      .   .   .   .   .   .   .   .   .   .   91    .   26802   1
      72   2   1   .   .   119.046   .   .   1   .   1   1   71   ASN   N      .   .   .   .   .   .   .   .   .   .   92    .   26802   1
      73   1   1   .   .   7.806     .   .   1   .   1   1   32   SER   H      .   .   .   .   .   .   .   .   .   .   857   .   26802   1
      73   2   1   .   .   117.360   .   .   1   .   1   1   32   SER   N      .   .   .   .   .   .   .   .   .   .   856   .   26802   1
      74   1   1   .   .   7.041     .   .   1   .   1   1   45   ASN   HD22   .   .   .   .   .   .   .   .   .   .   823   .   26802   1
      74   2   1   .   .   114.250   .   .   1   .   1   1   45   ASN   ND2    .   .   .   .   .   .   .   .   .   .   821   .   26802   1
      75   1   1   .   .   7.646     .   .   1   .   1   1   45   ASN   HD21   .   .   .   .   .   .   .   .   .   .   822   .   26802   1
      75   2   1   .   .   114.252   .   .   1   .   1   1   45   ASN   ND2    .   .   .   .   .   .   .   .   .   .   821   .   26802   1
      76   1   1   .   .   7.807     .   .   1   .   1   1   63   GLN   HE21   .   .   .   .   .   .   .   .   .   .   921   .   26802   1
      76   2   1   .   .   113.318   .   .   1   .   1   1   63   GLN   NE2    .   .   .   .   .   .   .   .   .   .   920   .   26802   1
      77   1   2   .   .   7.721     .   .   1   .   1   1   3    GLN   HE21   .   .   .   .   .   .   .   .   .   .   827   .   26802   1
      77   2   1   .   .   111.553   .   .   1   .   1   1   3    GLN   NE2    .   .   .   .   .   .   .   .   .   .   828   .   26802   1
      78   1   1   .   .   7.527     .   .   1   .   1   1   10   ASN   HD22   .   .   .   .   .   .   .   .   .   .   839   .   26802   1
      78   2   2   .   .   112.948   .   .   1   .   1   1   10   ASN   ND2    .   .   .   .   .   .   .   .   .   .   838   .   26802   1
      79   1   2   .   .   7.317     .   .   1   .   1   1   62   GLN   HE21   .   .   .   .   .   .   .   .   .   .   824   .   26802   1
      79   2   2   .   .   110.282   .   .   1   .   1   1   62   GLN   NE2    .   .   .   .   .   .   .   .   .   .   825   .   26802   1
      80   1   1   .   .   7.219     .   .   1   .   1   1   35   GLN   HE21   .   .   .   .   .   .   .   .   .   .   843   .   26802   1
      80   2   2   .   .   112.459   .   .   1   .   1   1   35   GLN   NE2    .   .   .   .   .   .   .   .   .   .   844   .   26802   1
      81   1   1   .   .   7.242     .   .   1   .   1   1   10   ASN   HD21   .   .   .   .   .   .   .   .   .   .   837   .   26802   1
      81   2   1   .   .   112.944   .   .   1   .   1   1   10   ASN   ND2    .   .   .   .   .   .   .   .   .   .   838   .   26802   1
      82   1   2   .   .   7.443     .   .   1   .   1   1   75   GLN   HE21   .   .   .   .   .   .   .   .   .   .   840   .   26802   1
      82   2   3   .   .   112.300   .   .   1   .   1   1   75   GLN   NE2    .   .   .   .   .   .   .   .   .   .   841   .   26802   1
      83   1   2   .   .   6.829     .   .   1   .   1   1   62   GLN   HE22   .   .   .   .   .   .   .   .   .   .   826   .   26802   1
      83   2   3   .   .   110.282   .   .   1   .   1   1   62   GLN   NE2    .   .   .   .   .   .   .   .   .   .   825   .   26802   1
      84   1   1   .   .   6.743     .   .   1   .   1   1   3    GLN   HE22   .   .   .   .   .   .   .   .   .   .   829   .   26802   1
      84   2   1   .   .   111.555   .   .   1   .   1   1   3    GLN   NE2    .   .   .   .   .   .   .   .   .   .   828   .   26802   1
      85   1   2   .   .   6.841     .   .   1   .   1   1   75   GLN   HE22   .   .   .   .   .   .   .   .   .   .   842   .   26802   1
      85   2   3   .   .   112.301   .   .   1   .   1   1   75   GLN   NE2    .   .   .   .   .   .   .   .   .   .   841   .   26802   1
      86   1   1   .   .   7.614     .   .   1   .   1   1   60   GLN   HE21   .   .   .   .   .   .   .   .   .   .   923   .   26802   1
      86   2   1   .   .   112.319   .   .   1   .   1   1   60   GLN   NE2    .   .   .   .   .   .   .   .   .   .   924   .   26802   1
      87   1   1   .   .   6.788     .   .   1   .   1   1   63   GLN   HE22   .   .   .   .   .   .   .   .   .   .   922   .   26802   1
      87   2   1   .   .   113.320   .   .   1   .   1   1   63   GLN   NE2    .   .   .   .   .   .   .   .   .   .   920   .   26802   1
      88   1   1   .   .   6.901     .   .   1   .   1   1   35   GLN   HE22   .   .   .   .   .   .   .   .   .   .   845   .   26802   1
      88   2   2   .   .   112.459   .   .   1   .   1   1   35   GLN   NE2    .   .   .   .   .   .   .   .   .   .   844   .   26802   1
      89   1   1   .   .   7.564     .   .   1   .   1   1   37   ASN   HD21   .   .   .   .   .   .   .   .   .   .   849   .   26802   1
      89   2   1   .   .   112.974   .   .   1   .   1   1   37   ASN   ND2    .   .   .   .   .   .   .   .   .   .   850   .   26802   1
      90   1   1   .   .   6.925     .   .   1   .   1   1   37   ASN   HD22   .   .   .   .   .   .   .   .   .   .   851   .   26802   1
      90   2   2   .   .   112.974   .   .   1   .   1   1   37   ASN   ND2    .   .   .   .   .   .   .   .   .   .   850   .   26802   1
      91   1   1   .   .   7.583     .   .   1   .   1   1   71   ASN   HD21   .   .   .   .   .   .   .   .   .   .   846   .   26802   1
      91   2   1   .   .   113.053   .   .   1   .   1   1   71   ASN   ND2    .   .   .   .   .   .   .   .   .   .   847   .   26802   1
      92   1   1   .   .   6.918     .   .   1   .   1   1   71   ASN   HD22   .   .   .   .   .   .   .   .   .   .   848   .   26802   1
      92   2   2   .   .   113.050   .   .   1   .   1   1   71   ASN   ND2    .   .   .   .   .   .   .   .   .   .   847   .   26802   1
      93   1   1   .   .   7.363     .   .   1   .   1   1   46   GLN   HE21   .   .   .   .   .   .   .   .   .   .   890   .   26802   1
      93   2   1   .   .   109.880   .   .   1   .   1   1   46   GLN   NE2    .   .   .   .   .   .   .   .   .   .   889   .   26802   1
      94   1   1   .   .   6.646     .   .   1   .   1   1   46   GLN   HE22   .   .   .   .   .   .   .   .   .   .   891   .   26802   1
      94   2   1   .   .   109.877   .   .   1   .   1   1   46   GLN   NE2    .   .   .   .   .   .   .   .   .   .   889   .   26802   1
      95   1   1   .   .   6.896     .   .   1   .   1   1   60   GLN   HE22   .   .   .   .   .   .   .   .   .   .   925   .   26802   1
      95   2   2   .   .   112.318   .   .   1   .   1   1   60   GLN   NE2    .   .   .   .   .   .   .   .   .   .   924   .   26802   1
   stop_
save_