Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"

    save_assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chem_shift_list_1
   _Assigned_chem_shift_list.Entry_ID                      25754
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $sample_conditions_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label    $chemical_shift_reference_1
   _Assigned_chem_shift_list.Chem_shift_1H_err             .
   _Assigned_chem_shift_list.Chem_shift_13C_err            .
   _Assigned_chem_shift_list.Chem_shift_15N_err            .
   _Assigned_chem_shift_list.Chem_shift_31P_err            .
   _Assigned_chem_shift_list.Chem_shift_2H_err             .
   _Assigned_chem_shift_list.Chem_shift_19F_err            .
   _Assigned_chem_shift_list.Error_derivation_method       .
   _Assigned_chem_shift_list.Details                       .
   _Assigned_chem_shift_list.Text_data_format              .
   _Assigned_chem_shift_list.Text_data                     .

   loop_
      _Chem_shift_experiment.Experiment_ID
      _Chem_shift_experiment.Experiment_name
      _Chem_shift_experiment.Sample_ID
      _Chem_shift_experiment.Sample_label
      _Chem_shift_experiment.Sample_state
      _Chem_shift_experiment.Entry_ID
      _Chem_shift_experiment.Assigned_chem_shift_list_ID

      1   '2D DQF-COSY'      .   .   .   25754   1
      2   '2D 1H-1H NOESY'   .   .   .   25754   1
      3   '2D 1H-1H TOCSY'   .   .   .   25754   1
      4   '2D 1H-13C HSQC'   .   .   .   25754   1
   stop_

   loop_
      _Chem_shift_software.Software_ID
      _Chem_shift_software.Software_label
      _Chem_shift_software.Method_ID
      _Chem_shift_software.Method_label
      _Chem_shift_software.Entry_ID
      _Chem_shift_software.Assigned_chem_shift_list_ID

      2   $Mestrenova   .   .   25754   1
   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_ID
      _Atom_chem_shift.Entity_ID
      _Atom_chem_shift.Comp_index_ID
      _Atom_chem_shift.Seq_ID
      _Atom_chem_shift.Comp_ID
      _Atom_chem_shift.Atom_ID
      _Atom_chem_shift.Atom_type
      _Atom_chem_shift.Atom_isotope_number
      _Atom_chem_shift.Val
      _Atom_chem_shift.Val_err
      _Atom_chem_shift.Assign_fig_of_merit
      _Atom_chem_shift.Ambiguity_code
      _Atom_chem_shift.Occupancy
      _Atom_chem_shift.Resonance_ID
      _Atom_chem_shift.Auth_entity_assembly_ID
      _Atom_chem_shift.Auth_asym_ID
      _Atom_chem_shift.Auth_seq_ID
      _Atom_chem_shift.Auth_comp_ID
      _Atom_chem_shift.Auth_atom_ID
      _Atom_chem_shift.Details
      _Atom_chem_shift.Entry_ID
      _Atom_chem_shift.Assigned_chem_shift_list_ID

      1     .   1   1   1    1    GLY   HA2    H   1    3.440     0.042   .   2   .   .   .   A   1    GLY   HA2    .   25754   1
      2     .   1   1   1    1    GLY   HA3    H   1    2.960     0.041   .   2   .   .   .   A   1    GLY   HA3    .   25754   1
      3     .   1   1   1    1    GLY   H      H   1    7.116     0.023   .   1   .   .   .   A   1    GLY   H1     .   25754   1
      4     .   1   1   1    1    GLY   CA     C   13   44.044    0.792   .   1   .   .   .   A   1    GLY   CA     .   25754   1
      5     .   1   1   2    2    LEU   H      H   1    8.432     0.023   .   1   .   .   .   A   2    LEU   H      .   25754   1
      6     .   1   1   2    2    LEU   HA     H   1    4.819     0.043   .   1   .   .   .   A   2    LEU   HA     .   25754   1
      7     .   1   1   2    2    LEU   HB2    H   1    1.755     0.030   .   2   .   .   .   A   2    LEU   HB2    .   25754   1
      8     .   1   1   2    2    LEU   HB3    H   1    1.356     0.038   .   2   .   .   .   A   2    LEU   HB3    .   25754   1
      9     .   1   1   2    2    LEU   HG     H   1    1.314     0.032   .   1   .   .   .   A   2    LEU   HG     .   25754   1
      10    .   1   1   2    2    LEU   HD11   H   1    0.756     0.021   .   2   .   .   .   A   2    LEU   HD11   .   25754   1
      11    .   1   1   2    2    LEU   HD12   H   1    0.756     0.021   .   2   .   .   .   A   2    LEU   HD12   .   25754   1
      12    .   1   1   2    2    LEU   HD13   H   1    0.756     0.021   .   2   .   .   .   A   2    LEU   HD13   .   25754   1
      13    .   1   1   2    2    LEU   HD21   H   1    0.658     0.030   .   2   .   .   .   A   2    LEU   HD21   .   25754   1
      14    .   1   1   2    2    LEU   HD22   H   1    0.658     0.030   .   2   .   .   .   A   2    LEU   HD22   .   25754   1
      15    .   1   1   2    2    LEU   HD23   H   1    0.658     0.030   .   2   .   .   .   A   2    LEU   HD23   .   25754   1
      16    .   1   1   2    2    LEU   CA     C   13   51.361    0.593   .   1   .   .   .   A   2    LEU   CA     .   25754   1
      17    .   1   1   2    2    LEU   CB     C   13   40.525    0.648   .   1   .   .   .   A   2    LEU   CB     .   25754   1
      18    .   1   1   2    2    LEU   CG     C   13   24.341    1.097   .   1   .   .   .   A   2    LEU   CG     .   25754   1
      19    .   1   1   2    2    LEU   CD1    C   13   22.596    0.731   .   2   .   .   .   A   2    LEU   CD1    .   25754   1
      20    .   1   1   2    2    LEU   CD2    C   13   20.238    0.907   .   2   .   .   .   A   2    LEU   CD2    .   25754   1
      21    .   1   1   3    3    SER   H      H   1    8.665     0.018   .   1   .   .   .   A   3    SER   H      .   25754   1
      22    .   1   1   3    3    SER   HA     H   1    4.747     0.035   .   1   .   .   .   A   3    SER   HA     .   25754   1
      23    .   1   1   3    3    SER   HB2    H   1    3.947     0.021   .   2   .   .   .   A   3    SER   HB2    .   25754   1
      24    .   1   1   3    3    SER   HB3    H   1    3.492     0.049   .   2   .   .   .   A   3    SER   HB3    .   25754   1
      25    .   1   1   3    3    SER   CA     C   13   57.051    0.433   .   1   .   .   .   A   3    SER   CA     .   25754   1
      26    .   1   1   3    3    SER   CB     C   13   62.680    0.790   .   1   .   .   .   A   3    SER   CB     .   25754   1
      27    .   1   1   4    4    GLN   H      H   1    8.242     0.016   .   1   .   .   .   A   4    GLN   H      .   25754   1
      28    .   1   1   4    4    GLN   HA     H   1    4.483     0.035   .   1   .   .   .   A   4    GLN   HA     .   25754   1
      29    .   1   1   4    4    GLN   HB2    H   1    1.948     0.025   .   2   .   .   .   A   4    GLN   HB2    .   25754   1
      30    .   1   1   4    4    GLN   HB3    H   1    1.851     0.032   .   2   .   .   .   A   4    GLN   HB3    .   25754   1
      31    .   1   1   4    4    GLN   HG2    H   1    2.320     0.047   .   1   .   .   .   A   4    GLN   HG2    .   25754   1
      32    .   1   1   4    4    GLN   HG3    H   1    2.320     0.047   .   1   .   .   .   A   4    GLN   HG3    .   25754   1
      33    .   1   1   4    4    GLN   HE21   H   1    6.933     0.016   .   2   .   .   .   A   4    GLN   HE21   .   25754   1
      34    .   1   1   4    4    GLN   HE22   H   1    7.530     0.010   .   2   .   .   .   A   4    GLN   HE22   .   25754   1
      35    .   1   1   4    4    GLN   CA     C   13   53.175    0.571   .   1   .   .   .   A   4    GLN   CA     .   25754   1
      36    .   1   1   4    4    GLN   CB     C   13   26.441    0.737   .   1   .   .   .   A   4    GLN   CB     .   25754   1
      37    .   1   1   4    4    GLN   CG     C   13   31.237    0.879   .   1   .   .   .   A   4    GLN   CG     .   25754   1
      38    .   1   1   5    5    GLY   H      H   1    7.057     0.015   .   1   .   .   .   A   5    GLY   H      .   25754   1
      39    .   1   1   5    5    GLY   HA2    H   1    4.004     0.039   .   2   .   .   .   A   5    GLY   HA2    .   25754   1
      40    .   1   1   5    5    GLY   HA3    H   1    3.744     0.042   .   2   .   .   .   A   5    GLY   HA3    .   25754   1
      41    .   1   1   5    5    GLY   CA     C   13   43.142    0.668   .   1   .   .   .   A   5    GLY   CA     .   25754   1
      42    .   1   1   6    6    VAL   H      H   1    8.325     0.013   .   1   .   .   .   A   6    VAL   H      .   25754   1
      43    .   1   1   6    6    VAL   HA     H   1    3.977     0.016   .   1   .   .   .   A   6    VAL   HA     .   25754   1
      44    .   1   1   6    6    VAL   HB     H   1    1.939     0.022   .   1   .   .   .   A   6    VAL   HB     .   25754   1
      45    .   1   1   6    6    VAL   HG11   H   1    0.712     0.025   .   2   .   .   .   A   6    VAL   HG11   .   25754   1
      46    .   1   1   6    6    VAL   HG12   H   1    0.712     0.025   .   2   .   .   .   A   6    VAL   HG12   .   25754   1
      47    .   1   1   6    6    VAL   HG13   H   1    0.712     0.025   .   2   .   .   .   A   6    VAL   HG13   .   25754   1
      48    .   1   1   6    6    VAL   HG21   H   1    0.688     0.023   .   2   .   .   .   A   6    VAL   HG21   .   25754   1
      49    .   1   1   6    6    VAL   HG22   H   1    0.688     0.023   .   2   .   .   .   A   6    VAL   HG22   .   25754   1
      50    .   1   1   6    6    VAL   HG23   H   1    0.688     0.023   .   2   .   .   .   A   6    VAL   HG23   .   25754   1
      51    .   1   1   6    6    VAL   CA     C   13   59.052    0.805   .   1   .   .   .   A   6    VAL   CA     .   25754   1
      52    .   1   1   6    6    VAL   CB     C   13   31.843    0.877   .   1   .   .   .   A   6    VAL   CB     .   25754   1
      53    .   1   1   6    6    VAL   CG1    C   13   16.612    0.825   .   2   .   .   .   A   6    VAL   CG1    .   25754   1
      54    .   1   1   6    6    VAL   CG2    C   13   18.359    0.846   .   2   .   .   .   A   6    VAL   CG2    .   25754   1
      55    .   1   1   7    7    GLU   H      H   1    8.970     0.018   .   1   .   .   .   A   7    GLU   H      .   25754   1
      56    .   1   1   7    7    GLU   HA     H   1    5.031     0.034   .   1   .   .   .   A   7    GLU   HA     .   25754   1
      57    .   1   1   7    7    GLU   HB2    H   1    2.358     0.030   .   2   .   .   .   A   7    GLU   HB2    .   25754   1
      58    .   1   1   7    7    GLU   HB3    H   1    2.171     0.034   .   2   .   .   .   A   7    GLU   HB3    .   25754   1
      59    .   1   1   7    7    GLU   HG2    H   1    2.564     0.016   .   2   .   .   .   A   7    GLU   HG2    .   25754   1
      60    .   1   1   7    7    GLU   HG3    H   1    2.494     0.016   .   2   .   .   .   A   7    GLU   HG3    .   25754   1
      61    .   1   1   7    7    GLU   CA     C   13   50.017    0.672   .   1   .   .   .   A   7    GLU   CA     .   25754   1
      62    .   1   1   7    7    GLU   CB     C   13   26.395    0.715   .   1   .   .   .   A   7    GLU   CB     .   25754   1
      63    .   1   1   7    7    GLU   CG     C   13   29.801    0.789   .   1   .   .   .   A   7    GLU   CG     .   25754   1
      64    .   1   1   8    8    PRO   HA     H   1    3.657     0.021   .   1   .   .   .   A   8    PRO   HA     .   25754   1
      65    .   1   1   8    8    PRO   HB2    H   1    1.754     0.022   .   2   .   .   .   A   8    PRO   HB2    .   25754   1
      66    .   1   1   8    8    PRO   HB3    H   1    2.136     0.030   .   2   .   .   .   A   8    PRO   HB3    .   25754   1
      67    .   1   1   8    8    PRO   HG2    H   1    1.863     0.028   .   2   .   .   .   A   8    PRO   HG2    .   25754   1
      68    .   1   1   8    8    PRO   HG3    H   1    2.068     0.017   .   2   .   .   .   A   8    PRO   HG3    .   25754   1
      69    .   1   1   8    8    PRO   HD2    H   1    3.786     0.020   .   2   .   .   .   A   8    PRO   HD2    .   25754   1
      70    .   1   1   8    8    PRO   HD3    H   1    4.355     0.016   .   2   .   .   .   A   8    PRO   HD3    .   25754   1
      71    .   1   1   8    8    PRO   CA     C   13   61.427    1.022   .   1   .   .   .   A   8    PRO   CA     .   25754   1
      72    .   1   1   8    8    PRO   CB     C   13   29.987    0.589   .   1   .   .   .   A   8    PRO   CB     .   25754   1
      73    .   1   1   8    8    PRO   CG     C   13   25.059    0.712   .   1   .   .   .   A   8    PRO   CG     .   25754   1
      74    .   1   1   8    8    PRO   CD     C   13   48.997    0.671   .   1   .   .   .   A   8    PRO   CD     .   25754   1
      75    .   1   1   9    9    ASP   H      H   1    7.742     0.019   .   1   .   .   .   A   9    ASP   H      .   25754   1
      76    .   1   1   9    9    ASP   HA     H   1    4.490     0.034   .   1   .   .   .   A   9    ASP   HA     .   25754   1
      77    .   1   1   9    9    ASP   HB2    H   1    2.182     0.061   .   2   .   .   .   A   9    ASP   HB2    .   25754   1
      78    .   1   1   9    9    ASP   HB3    H   1    0.849     0.037   .   2   .   .   .   A   9    ASP   HB3    .   25754   1
      79    .   1   1   9    9    ASP   CB     C   13   32.778    0.661   .   1   .   .   .   A   9    ASP   CB     .   25754   1
      80    .   1   1   10   10   ILE   H      H   1    6.912     0.018   .   1   .   .   .   A   10   ILE   H      .   25754   1
      81    .   1   1   10   10   ILE   HA     H   1    3.980     0.036   .   1   .   .   .   A   10   ILE   HA     .   25754   1
      82    .   1   1   10   10   ILE   HB     H   1    1.418     0.035   .   1   .   .   .   A   10   ILE   HB     .   25754   1
      83    .   1   1   10   10   ILE   HG12   H   1    0.735     0.036   .   2   .   .   .   A   10   ILE   HG12   .   25754   1
      84    .   1   1   10   10   ILE   HG13   H   1    1.088     0.030   .   2   .   .   .   A   10   ILE   HG13   .   25754   1
      85    .   1   1   10   10   ILE   HG21   H   1    0.600     0.032   .   1   .   .   .   A   10   ILE   HG21   .   25754   1
      86    .   1   1   10   10   ILE   HG22   H   1    0.600     0.032   .   1   .   .   .   A   10   ILE   HG22   .   25754   1
      87    .   1   1   10   10   ILE   HG23   H   1    0.600     0.032   .   1   .   .   .   A   10   ILE   HG23   .   25754   1
      88    .   1   1   10   10   ILE   HD11   H   1    0.572     0.048   .   1   .   .   .   A   10   ILE   HD11   .   25754   1
      89    .   1   1   10   10   ILE   HD12   H   1    0.572     0.048   .   1   .   .   .   A   10   ILE   HD12   .   25754   1
      90    .   1   1   10   10   ILE   HD13   H   1    0.572     0.048   .   1   .   .   .   A   10   ILE   HD13   .   25754   1
      91    .   1   1   10   10   ILE   CA     C   13   56.694    0.832   .   1   .   .   .   A   10   ILE   CA     .   25754   1
      92    .   1   1   10   10   ILE   CB     C   13   37.376    0.773   .   1   .   .   .   A   10   ILE   CB     .   25754   1
      93    .   1   1   10   10   ILE   CG1    C   13   23.979    0.841   .   1   .   .   .   A   10   ILE   CG1    .   25754   1
      94    .   1   1   10   10   ILE   CG2    C   13   14.367    0.919   .   1   .   .   .   A   10   ILE   CG2    .   25754   1
      95    .   1   1   10   10   ILE   CD1    C   13   10.262    0.913   .   1   .   .   .   A   10   ILE   CD1    .   25754   1
      96    .   1   1   11   11   GLY   H      H   1    8.381     0.023   .   1   .   .   .   A   11   GLY   H      .   25754   1
      97    .   1   1   11   11   GLY   HA2    H   1    3.613     0.037   .   2   .   .   .   A   11   GLY   HA2    .   25754   1
      98    .   1   1   11   11   GLY   HA3    H   1    3.484     0.049   .   2   .   .   .   A   11   GLY   HA3    .   25754   1
      99    .   1   1   11   11   GLY   CA     C   13   44.374    0.708   .   1   .   .   .   A   11   GLY   CA     .   25754   1
      100   .   1   1   12   12   GLN   H      H   1    8.824     0.012   .   1   .   .   .   A   12   GLN   H      .   25754   1
      101   .   1   1   12   12   GLN   HA     H   1    4.305     0.023   .   1   .   .   .   A   12   GLN   HA     .   25754   1
      102   .   1   1   12   12   GLN   HB2    H   1    2.252     0.023   .   2   .   .   .   A   12   GLN   HB2    .   25754   1
      103   .   1   1   12   12   GLN   HB3    H   1    1.742     0.039   .   2   .   .   .   A   12   GLN   HB3    .   25754   1
      104   .   1   1   12   12   GLN   HG2    H   1    2.204     0.013   .   1   .   .   .   A   12   GLN   HG2    .   25754   1
      105   .   1   1   12   12   GLN   HG3    H   1    2.204     0.013   .   1   .   .   .   A   12   GLN   HG3    .   25754   1
      106   .   1   1   12   12   GLN   HE21   H   1    6.714     0.018   .   2   .   .   .   A   12   GLN   HE21   .   25754   1
      107   .   1   1   12   12   GLN   HE22   H   1    7.424     0.023   .   2   .   .   .   A   12   GLN   HE22   .   25754   1
      108   .   1   1   12   12   GLN   CA     C   13   52.464    0.668   .   1   .   .   .   A   12   GLN   CA     .   25754   1
      109   .   1   1   12   12   GLN   CB     C   13   26.459    0.656   .   1   .   .   .   A   12   GLN   CB     .   25754   1
      110   .   1   1   12   12   GLN   CG     C   13   31.725    0.811   .   1   .   .   .   A   12   GLN   CG     .   25754   1
      111   .   1   1   13   13   THR   H      H   1    8.353     0.012   .   1   .   .   .   A   13   THR   H      .   25754   1
      112   .   1   1   13   13   THR   HA     H   1    4.473     0.026   .   1   .   .   .   A   13   THR   HA     .   25754   1
      113   .   1   1   13   13   THR   HB     H   1    4.394     0.028   .   1   .   .   .   A   13   THR   HB     .   25754   1
      114   .   1   1   13   13   THR   HG21   H   1    0.849     0.039   .   1   .   .   .   A   13   THR   HG21   .   25754   1
      115   .   1   1   13   13   THR   HG22   H   1    0.849     0.039   .   1   .   .   .   A   13   THR   HG22   .   25754   1
      116   .   1   1   13   13   THR   HG23   H   1    0.849     0.039   .   1   .   .   .   A   13   THR   HG23   .   25754   1
      117   .   1   1   13   13   THR   CA     C   13   58.097    0.650   .   1   .   .   .   A   13   THR   CA     .   25754   1
      118   .   1   1   13   13   THR   CB     C   13   67.244    0.712   .   1   .   .   .   A   13   THR   CB     .   25754   1
      119   .   1   1   13   13   THR   CG2    C   13   19.073    0.710   .   1   .   .   .   A   13   THR   CG2    .   25754   1
      120   .   1   1   14   14   TYR   H      H   1    8.730     0.023   .   1   .   .   .   A   14   TYR   H      .   25754   1
      121   .   1   1   14   14   TYR   HA     H   1    4.637     0.053   .   1   .   .   .   A   14   TYR   HA     .   25754   1
      122   .   1   1   14   14   TYR   HB2    H   1    2.675     0.033   .   2   .   .   .   A   14   TYR   HB2    .   25754   1
      123   .   1   1   14   14   TYR   HB3    H   1    2.035     0.039   .   2   .   .   .   A   14   TYR   HB3    .   25754   1
      124   .   1   1   14   14   TYR   HD1    H   1    6.636     0.016   .   1   .   .   .   A   14   TYR   HD1    .   25754   1
      125   .   1   1   14   14   TYR   HD2    H   1    6.636     0.016   .   1   .   .   .   A   14   TYR   HD2    .   25754   1
      126   .   1   1   14   14   TYR   HE1    H   1    6.564     0.019   .   1   .   .   .   A   14   TYR   HE1    .   25754   1
      127   .   1   1   14   14   TYR   HE2    H   1    6.564     0.019   .   1   .   .   .   A   14   TYR   HE2    .   25754   1
      128   .   1   1   14   14   TYR   CA     C   13   48.837    0.700   .   1   .   .   .   A   14   TYR   CA     .   25754   1
      129   .   1   1   14   14   TYR   CB     C   13   38.846    0.743   .   1   .   .   .   A   14   TYR   CB     .   25754   1
      130   .   1   1   14   14   TYR   CD1    C   13   129.840   1.010   .   3   .   .   .   A   14   TYR   CD1    .   25754   1
      131   .   1   1   14   14   TYR   CD2    C   13   129.840   1.010   .   3   .   .   .   A   14   TYR   CD2    .   25754   1
      132   .   1   1   14   14   TYR   CE1    C   13   115.779   0.868   .   3   .   .   .   A   14   TYR   CE1    .   25754   1
      133   .   1   1   14   14   TYR   CE2    C   13   115.779   0.868   .   3   .   .   .   A   14   TYR   CE2    .   25754   1
      134   .   1   1   15   15   PHE   H      H   1    8.338     0.016   .   1   .   .   .   A   15   PHE   H      .   25754   1
      135   .   1   1   15   15   PHE   HA     H   1    4.526     0.028   .   1   .   .   .   A   15   PHE   HA     .   25754   1
      136   .   1   1   15   15   PHE   HB2    H   1    3.170     0.028   .   2   .   .   .   A   15   PHE   HB2    .   25754   1
      137   .   1   1   15   15   PHE   HB3    H   1    2.603     0.035   .   2   .   .   .   A   15   PHE   HB3    .   25754   1
      138   .   1   1   15   15   PHE   HD1    H   1    7.107     0.019   .   1   .   .   .   A   15   PHE   HD1    .   25754   1
      139   .   1   1   15   15   PHE   HD2    H   1    7.107     0.019   .   1   .   .   .   A   15   PHE   HD2    .   25754   1
      140   .   1   1   15   15   PHE   HE1    H   1    7.214     0.012   .   1   .   .   .   A   15   PHE   HE1    .   25754   1
      141   .   1   1   15   15   PHE   HE2    H   1    7.214     0.012   .   1   .   .   .   A   15   PHE   HE2    .   25754   1
      142   .   1   1   15   15   PHE   HZ     H   1    7.092     0.051   .   1   .   .   .   A   15   PHE   HZ     .   25754   1
      143   .   1   1   15   15   PHE   CA     C   13   57.055    0.650   .   1   .   .   .   A   15   PHE   CA     .   25754   1
      144   .   1   1   15   15   PHE   CB     C   13   37.131    0.699   .   1   .   .   .   A   15   PHE   CB     .   25754   1
      145   .   1   1   15   15   PHE   CD1    C   13   128.621   1.016   .   3   .   .   .   A   15   PHE   CD1    .   25754   1
      146   .   1   1   15   15   PHE   CD2    C   13   128.621   1.016   .   3   .   .   .   A   15   PHE   CD2    .   25754   1
      147   .   1   1   15   15   PHE   CE1    C   13   129.126   1.037   .   3   .   .   .   A   15   PHE   CE1    .   25754   1
      148   .   1   1   15   15   PHE   CE2    C   13   129.126   1.037   .   3   .   .   .   A   15   PHE   CE2    .   25754   1
      149   .   1   1   15   15   PHE   CZ     C   13   127.871   0.876   .   1   .   .   .   A   15   PHE   CZ     .   25754   1
      150   .   1   1   16   16   GLU   H      H   1    8.965     0.013   .   1   .   .   .   A   16   GLU   H      .   25754   1
      151   .   1   1   16   16   GLU   HA     H   1    4.259     0.028   .   1   .   .   .   A   16   GLU   HA     .   25754   1
      152   .   1   1   16   16   GLU   HB2    H   1    2.086     0.035   .   2   .   .   .   A   16   GLU   HB2    .   25754   1
      153   .   1   1   16   16   GLU   HB3    H   1    2.022     0.034   .   2   .   .   .   A   16   GLU   HB3    .   25754   1
      154   .   1   1   16   16   GLU   HG2    H   1    2.508     0.038   .   1   .   .   .   A   16   GLU   HG2    .   25754   1
      155   .   1   1   16   16   GLU   HG3    H   1    2.508     0.038   .   1   .   .   .   A   16   GLU   HG3    .   25754   1
      156   .   1   1   16   16   GLU   CA     C   13   53.525    0.907   .   1   .   .   .   A   16   GLU   CA     .   25754   1
      157   .   1   1   16   16   GLU   CB     C   13   25.722    0.697   .   1   .   .   .   A   16   GLU   CB     .   25754   1
      158   .   1   1   16   16   GLU   CG     C   13   29.987    0.725   .   1   .   .   .   A   16   GLU   CG     .   25754   1
      159   .   1   1   17   17   GLU   H      H   1    8.830     0.015   .   1   .   .   .   A   17   GLU   H      .   25754   1
      160   .   1   1   17   17   GLU   HA     H   1    4.322     0.013   .   1   .   .   .   A   17   GLU   HA     .   25754   1
      161   .   1   1   17   17   GLU   HB2    H   1    2.025     0.042   .   2   .   .   .   A   17   GLU   HB2    .   25754   1
      162   .   1   1   17   17   GLU   HB3    H   1    1.927     0.016   .   2   .   .   .   A   17   GLU   HB3    .   25754   1
      163   .   1   1   17   17   GLU   HG2    H   1    2.464     0.022   .   2   .   .   .   A   17   GLU   HG2    .   25754   1
      164   .   1   1   17   17   GLU   HG3    H   1    2.417     0.017   .   2   .   .   .   A   17   GLU   HG3    .   25754   1
      165   .   1   1   17   17   GLU   CA     C   13   53.193    0.712   .   1   .   .   .   A   17   GLU   CA     .   25754   1
      166   .   1   1   17   17   GLU   CB     C   13   26.465    0.630   .   1   .   .   .   A   17   GLU   CB     .   25754   1
      167   .   1   1   17   17   GLU   CG     C   13   30.334    0.726   .   1   .   .   .   A   17   GLU   CG     .   25754   1
      168   .   1   1   18   18   SER   H      H   1    8.367     0.016   .   1   .   .   .   A   18   SER   H      .   25754   1
      169   .   1   1   18   18   SER   HA     H   1    4.326     0.026   .   1   .   .   .   A   18   SER   HA     .   25754   1
      170   .   1   1   18   18   SER   HB2    H   1    3.740     0.029   .   1   .   .   .   A   18   SER   HB2    .   25754   1
      171   .   1   1   18   18   SER   HB3    H   1    3.740     0.029   .   1   .   .   .   A   18   SER   HB3    .   25754   1
      172   .   1   1   18   18   SER   CA     C   13   55.566    0.690   .   1   .   .   .   A   18   SER   CA     .   25754   1
      173   .   1   1   18   18   SER   CB     C   13   61.011    0.956   .   1   .   .   .   A   18   SER   CB     .   25754   1
      174   .   1   1   19   19   ARG   H      H   1    8.301     0.012   .   1   .   .   .   A   19   ARG   H      .   25754   1
      175   .   1   1   19   19   ARG   HA     H   1    4.253     0.021   .   1   .   .   .   A   19   ARG   HA     .   25754   1
      176   .   1   1   19   19   ARG   HB2    H   1    1.732     0.026   .   2   .   .   .   A   19   ARG   HB2    .   25754   1
      177   .   1   1   19   19   ARG   HB3    H   1    1.620     0.021   .   2   .   .   .   A   19   ARG   HB3    .   25754   1
      178   .   1   1   19   19   ARG   HG2    H   1    1.466     0.042   .   1   .   .   .   A   19   ARG   HG2    .   25754   1
      179   .   1   1   19   19   ARG   HG3    H   1    1.466     0.042   .   1   .   .   .   A   19   ARG   HG3    .   25754   1
      180   .   1   1   19   19   ARG   HD2    H   1    3.054     0.013   .   1   .   .   .   A   19   ARG   HD2    .   25754   1
      181   .   1   1   19   19   ARG   HD3    H   1    3.054     0.013   .   1   .   .   .   A   19   ARG   HD3    .   25754   1
      182   .   1   1   19   19   ARG   HE     H   1    7.028     0.023   .   1   .   .   .   A   19   ARG   HE     .   25754   1
      183   .   1   1   19   19   ARG   CA     C   13   59.143    0.668   .   1   .   .   .   A   19   ARG   CA     .   25754   1
      184   .   1   1   19   19   ARG   CB     C   13   28.021    0.748   .   1   .   .   .   A   19   ARG   CB     .   25754   1
      185   .   1   1   19   19   ARG   CG     C   13   24.354    0.771   .   1   .   .   .   A   19   ARG   CG     .   25754   1
      186   .   1   1   19   19   ARG   CD     C   13   40.540    1.045   .   1   .   .   .   A   19   ARG   CD     .   25754   1
      187   .   1   1   20   20   ILE   H      H   1    8.014     0.017   .   1   .   .   .   A   20   ILE   H      .   25754   1
      188   .   1   1   20   20   ILE   HA     H   1    4.017     0.024   .   1   .   .   .   A   20   ILE   HA     .   25754   1
      189   .   1   1   20   20   ILE   HB     H   1    1.704     0.038   .   1   .   .   .   A   20   ILE   HB     .   25754   1
      190   .   1   1   20   20   ILE   HG12   H   1    1.035     0.034   .   2   .   .   .   A   20   ILE   HG12   .   25754   1
      191   .   1   1   20   20   ILE   HG13   H   1    1.309     0.025   .   2   .   .   .   A   20   ILE   HG13   .   25754   1
      192   .   1   1   20   20   ILE   HG21   H   1    0.750     0.024   .   1   .   .   .   A   20   ILE   HG21   .   25754   1
      193   .   1   1   20   20   ILE   HG22   H   1    0.750     0.024   .   1   .   .   .   A   20   ILE   HG22   .   25754   1
      194   .   1   1   20   20   ILE   HG23   H   1    0.750     0.024   .   1   .   .   .   A   20   ILE   HG23   .   25754   1
      195   .   1   1   20   20   ILE   HD11   H   1    0.714     0.016   .   1   .   .   .   A   20   ILE   HD11   .   25754   1
      196   .   1   1   20   20   ILE   HD12   H   1    0.714     0.016   .   1   .   .   .   A   20   ILE   HD12   .   25754   1
      197   .   1   1   20   20   ILE   HD13   H   1    0.714     0.016   .   1   .   .   .   A   20   ILE   HD13   .   25754   1
      198   .   1   1   20   20   ILE   CA     C   13   58.457    0.748   .   1   .   .   .   A   20   ILE   CA     .   25754   1
      199   .   1   1   20   20   ILE   CB     C   13   35.948    0.731   .   1   .   .   .   A   20   ILE   CB     .   25754   1
      200   .   1   1   20   20   ILE   CG1    C   13   24.369    0.970   .   1   .   .   .   A   20   ILE   CG1    .   25754   1
      201   .   1   1   20   20   ILE   CG2    C   13   14.557    0.898   .   1   .   .   .   A   20   ILE   CG2    .   25754   1
      202   .   1   1   20   20   ILE   CD1    C   13   10.059    1.141   .   1   .   .   .   A   20   ILE   CD1    .   25754   1
      203   .   1   1   21   21   ASN   H      H   1    8.383     0.014   .   1   .   .   .   A   21   ASN   H      .   25754   1
      204   .   1   1   21   21   ASN   HA     H   1    4.557     0.034   .   1   .   .   .   A   21   ASN   HA     .   25754   1
      205   .   1   1   21   21   ASN   HB2    H   1    2.698     0.023   .   2   .   .   .   A   21   ASN   HB2    .   25754   1
      206   .   1   1   21   21   ASN   HB3    H   1    2.612     0.025   .   2   .   .   .   A   21   ASN   HB3    .   25754   1
      207   .   1   1   21   21   ASN   HD21   H   1    6.771     0.033   .   2   .   .   .   A   21   ASN   HD21   .   25754   1
      208   .   1   1   21   21   ASN   HD22   H   1    7.472     0.011   .   2   .   .   .   A   21   ASN   HD22   .   25754   1
      209   .   1   1   21   21   ASN   CA     C   13   50.547    0.615   .   1   .   .   .   A   21   ASN   CA     .   25754   1
      210   .   1   1   21   21   ASN   CB     C   13   35.964    0.814   .   1   .   .   .   A   21   ASN   CB     .   25754   1
      211   .   1   1   22   22   GLN   H      H   1    8.219     0.015   .   1   .   .   .   A   22   GLN   H      .   25754   1
      212   .   1   1   22   22   GLN   HA     H   1    4.220     0.037   .   1   .   .   .   A   22   GLN   HA     .   25754   1
      213   .   1   1   22   22   GLN   HB2    H   1    2.004     0.027   .   2   .   .   .   A   22   GLN   HB2    .   25754   1
      214   .   1   1   22   22   GLN   HB3    H   1    1.836     0.033   .   2   .   .   .   A   22   GLN   HB3    .   25754   1
      215   .   1   1   22   22   GLN   HG2    H   1    2.226     0.025   .   1   .   .   .   A   22   GLN   HG2    .   25754   1
      216   .   1   1   22   22   GLN   HG3    H   1    2.226     0.025   .   1   .   .   .   A   22   GLN   HG3    .   25754   1
      217   .   1   1   22   22   GLN   HE21   H   1    6.735     0.014   .   2   .   .   .   A   22   GLN   HE21   .   25754   1
      218   .   1   1   22   22   GLN   HE22   H   1    7.377     0.021   .   2   .   .   .   A   22   GLN   HE22   .   25754   1
      219   .   1   1   22   22   GLN   CA     C   13   53.030    0.907   .   1   .   .   .   A   22   GLN   CA     .   25754   1
      220   .   1   1   22   22   GLN   CB     C   13   26.808    0.654   .   1   .   .   .   A   22   GLN   CB     .   25754   1
      221   .   1   1   22   22   GLN   CG     C   13   31.023    0.595   .   1   .   .   .   A   22   GLN   CG     .   25754   1
      222   .   1   1   23   23   ASP   H      H   1    8.312     0.013   .   1   .   .   .   A   23   ASP   H      .   25754   1
      223   .   1   1   23   23   ASP   HA     H   1    4.593     0.027   .   1   .   .   .   A   23   ASP   HA     .   25754   1
      224   .   1   1   23   23   ASP   HB2    H   1    2.809     0.035   .   1   .   .   .   A   23   ASP   HB2    .   25754   1
      225   .   1   1   23   23   ASP   HB3    H   1    2.809     0.035   .   1   .   .   .   A   23   ASP   HB3    .   25754   1
      226   .   1   1   23   23   ASP   CA     C   13   49.692    0.690   .   1   .   .   .   A   23   ASP   CA     .   25754   1
      227   .   1   1   23   23   ASP   CB     C   13   35.609    0.942   .   1   .   .   .   A   23   ASP   CB     .   25754   1
   stop_
save_