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                      27572
   _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             0.03
   _Assigned_chem_shift_list.Chem_shift_13C_err            0.3
   _Assigned_chem_shift_list.Chem_shift_15N_err            0.5
   _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       'FID resolution. On specific cases, line-broadening effects'
   _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 NH'         .   .   .   27572   1
      2   '2D CH'         .   .   .   27572   1
      3   '2D CC'         .   .   .   27572   1
      6   '3D HN(CO)CA'   .   .   .   27572   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   $SPARKY   .   .   27572   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.Ambiguity_set_ID
      _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    ILE   H     H   1    8.05     0.03   .   1   .   .   .   .   .   1    ILE    H     .   27572   1
      2     .   1   1   1    1    ILE   HA    H   1    4.59     0.03   .   1   .   .   .   .   .   1    ILE    HA    .   27572   1
      3     .   1   1   1    1    ILE   C     C   13   170.6    0.3    .   1   .   .   .   .   .   1    ILE    C     .   27572   1
      4     .   1   1   1    1    ILE   CA    C   13   61.12    0.3    .   1   .   .   .   .   .   1    ILE    CA    .   27572   1
      5     .   1   1   1    1    ILE   CB    C   13   35.68    0.3    .   1   .   .   .   .   .   1    ILE    CB    .   27572   1
      6     .   1   1   1    1    ILE   CG1   C   13   26.56    0.3    .   1   .   .   .   .   .   1    ILE    CG1   .   27572   1
      7     .   1   1   1    1    ILE   CG2   C   13   16.8     0.3    .   1   .   .   .   .   .   1    ILE    CG2   .   27572   1
      8     .   1   1   1    1    ILE   CD1   C   13   13.83    0.3    .   1   .   .   .   .   .   1    ILE    CD1   .   27572   1
      9     .   1   1   1    1    ILE   N     N   15   39.8     0.5    .   1   .   .   .   .   .   1    ILE    N     .   27572   1
      10    .   1   1   2    2    DBU   H     H   1    12.85    0.03   .   1   .   .   .   .   .   2    DHB    H     .   27572   1
      11    .   1   1   2    2    DBU   C     C   13   166.9    0.3    .   1   .   .   .   .   .   2    DHB    C     .   27572   1
      12    .   1   1   2    2    DBU   CA    C   13   131.1    0.3    .   1   .   .   .   .   .   2    DHB    CA    .   27572   1
      13    .   1   1   2    2    DBU   CB    C   13   134.5    0.3    .   1   .   .   .   .   .   2    DHB    CB    .   27572   1
      14    .   1   1   2    2    DBU   CG    C   13   16.03    0.3    .   1   .   .   .   .   .   2    DHB    CG    .   27572   1
      15    .   1   1   2    2    DBU   N     N   15   136.6    0.5    .   1   .   .   .   .   .   2    DHB    N     .   27572   1
      16    .   1   1   3    3    DAL   H     H   1    7.65     0.03   .   1   .   .   .   .   .   3    DALA   H     .   27572   1
      17    .   1   1   3    3    DAL   HA    H   1    5.8      0.03   .   1   .   .   .   .   .   3    DALA   HA    .   27572   1
      18    .   1   1   3    3    DAL   C     C   13   174.2    0.3    .   1   .   .   .   .   .   3    DALA   C     .   27572   1
      19    .   1   1   3    3    DAL   CA    C   13   56.13    0.3    .   1   .   .   .   .   .   3    DALA   CA    .   27572   1
      20    .   1   1   3    3    DAL   CB    C   13   37.2     0.3    .   1   .   .   .   .   .   3    DALA   CB    .   27572   1
      21    .   1   1   3    3    DAL   N     N   15   113.5    0.5    .   1   .   .   .   .   .   3    DALA   N     .   27572   1
      22    .   1   1   4    4    ILE   H     H   1    8.83     0.03   .   1   .   .   .   .   .   4    ILE    H     .   27572   1
      23    .   1   1   4    4    ILE   HA    H   1    4.16     0.03   .   1   .   .   .   .   .   4    ILE    HA    .   27572   1
      24    .   1   1   4    4    ILE   C     C   13   174.3    0.3    .   1   .   .   .   .   .   4    ILE    C     .   27572   1
      25    .   1   1   4    4    ILE   CA    C   13   63.3     0.3    .   1   .   .   .   .   .   4    ILE    CA    .   27572   1
      26    .   1   1   4    4    ILE   CB    C   13   38.34    0.3    .   1   .   .   .   .   .   4    ILE    CB    .   27572   1
      27    .   1   1   4    4    ILE   CG1   C   13   27.65    0.3    .   1   .   .   .   .   .   4    ILE    CG1   .   27572   1
      28    .   1   1   4    4    ILE   CG2   C   13   18.16    0.3    .   1   .   .   .   .   .   4    ILE    CG2   .   27572   1
      29    .   1   1   4    4    ILE   CD1   C   13   12.67    0.3    .   1   .   .   .   .   .   4    ILE    CD1   .   27572   1
      30    .   1   1   4    4    ILE   N     N   15   119.1    0.5    .   1   .   .   .   .   .   4    ILE    N     .   27572   1
      31    .   1   1   5    5    DHA   H     H   1    8.28     0.03   .   1   .   .   .   .   .   5    DHA    H     .   27572   1
      32    .   1   1   5    5    DHA   C     C   13   167.3    0.3    .   1   .   .   .   .   .   5    DHA    C     .   27572   1
      33    .   1   1   5    5    DHA   CA    C   13   134.6    0.3    .   1   .   .   .   .   .   5    DHA    CA    .   27572   1
      34    .   1   1   5    5    DHA   CB    C   13   107.8    0.3    .   1   .   .   .   .   .   5    DHA    CB    .   27572   1
      35    .   1   1   5    5    DHA   N     N   15   120.73   0.5    .   1   .   .   .   .   .   5    DHA    N     .   27572   1
      36    .   1   1   6    6    LEU   H     H   1    10.85    0.03   .   1   .   .   .   .   .   6    LEU    H     .   27572   1
      37    .   1   1   6    6    LEU   HA    H   1    4.15     0.15   .   1   .   .   .   .   .   6    LEU    HA    .   27572   1
      38    .   1   1   6    6    LEU   C     C   13   175.8    0.3    .   1   .   .   .   .   .   6    LEU    C     .   27572   1
      39    .   1   1   6    6    LEU   CA    C   13   55.01    0.3    .   1   .   .   .   .   .   6    LEU    CA    .   27572   1
      40    .   1   1   6    6    LEU   CB    C   13   38.68    0.3    .   1   .   .   .   .   .   6    LEU    CB    .   27572   1
      41    .   1   1   6    6    LEU   CG    C   13   27.2     0.3    .   1   .   .   .   .   .   6    LEU    CG    .   27572   1
      42    .   1   1   6    6    LEU   CD1   C   13   26.37    0.3    .   2   .   .   .   .   .   6    LEU    CD1   .   27572   1
      43    .   1   1   6    6    LEU   CD2   C   13   24.11    0.3    .   2   .   .   .   .   .   6    LEU    CD2   .   27572   1
      44    .   1   1   6    6    LEU   N     N   15   116.7    0.5    .   1   .   .   .   .   .   6    LEU    N     .   27572   1
      45    .   1   1   7    7    CYS   H     H   1    7.95     0.03   .   1   .   .   .   .   .   7    ALAS   H     .   27572   1
      46    .   1   1   7    7    CYS   HA    H   1    5.43     0.03   .   1   .   .   .   .   .   7    ALAS   HA    .   27572   1
      47    .   1   1   7    7    CYS   C     C   13   172.9    0.3    .   1   .   .   .   .   .   7    ALAS   C     .   27572   1
      48    .   1   1   7    7    CYS   CA    C   13   53.9     0.3    .   1   .   .   .   .   .   7    ALAS   CA    .   27572   1
      49    .   1   1   7    7    CYS   CB    C   13   38.63    0.3    .   1   .   .   .   .   .   7    ALAS   CB    .   27572   1
      50    .   1   1   7    7    CYS   N     N   15   116.5    0.5    .   1   .   .   .   .   .   7    ALAS   N     .   27572   1
      51    .   1   1   8    8    ABU   H     H   1    9.55     0.03   .   1   .   .   .   .   .   8    ABU    H     .   27572   1
      52    .   1   1   8    8    ABU   HA    H   1    5.05     0.03   .   1   .   .   .   .   .   8    ABU    HA    .   27572   1
      53    .   1   1   8    8    ABU   C     C   13   175.6    0.3    .   1   .   .   .   .   .   8    ABU    C     .   27572   1
      54    .   1   1   8    8    ABU   CA    C   13   59       0.3    .   1   .   .   .   .   .   8    ABU    CA    .   27572   1
      55    .   1   1   8    8    ABU   CB    C   13   49.1     0.3    .   1   .   .   .   .   .   8    ABU    CB    .   27572   1
      56    .   1   1   8    8    ABU   CG    C   13   24       0.3    .   1   .   .   .   .   .   8    ABU    CG    .   27572   1
      57    .   1   1   8    8    ABU   N     N   15   104.5    0.5    .   1   .   .   .   .   .   8    ABU    N     .   27572   1
      58    .   1   1   9    9    PRO   HA    H   1    4.61     0.03   .   1   .   .   .   .   .   9    PRO    HA    .   27572   1
      59    .   1   1   9    9    PRO   C     C   13   177.3    0.3    .   1   .   .   .   .   .   9    PRO    C     .   27572   1
      60    .   1   1   9    9    PRO   CA    C   13   66.61    0.3    .   1   .   .   .   .   .   9    PRO    CA    .   27572   1
      61    .   1   1   9    9    PRO   CB    C   13   31.66    0.3    .   1   .   .   .   .   .   9    PRO    CB    .   27572   1
      62    .   1   1   9    9    PRO   CG    C   13   27.58    0.3    .   1   .   .   .   .   .   9    PRO    CG    .   27572   1
      63    .   1   1   9    9    PRO   CD    C   13   50.75    0.3    .   1   .   .   .   .   .   9    PRO    CD    .   27572   1
      64    .   1   1   9    9    PRO   N     N   15   138.3    0.5    .   1   .   .   .   .   .   9    PRO    N     .   27572   1
      65    .   1   1   10   10   GLY   H     H   1    9.49     0.03   .   1   .   .   .   .   .   10   GLY    H     .   27572   1
      66    .   1   1   10   10   GLY   HA2   H   1    4.25     0.25   .   2   .   .   .   .   .   10   GLY    HA2   .   27572   1
      67    .   1   1   10   10   GLY   HA3   H   1    4.25     0.25   .   2   .   .   .   .   .   10   GLY    HA3   .   27572   1
      68    .   1   1   10   10   GLY   C     C   13   171.6    0.3    .   1   .   .   .   .   .   10   GLY    C     .   27572   1
      69    .   1   1   10   10   GLY   CA    C   13   44.7     0.3    .   1   .   .   .   .   .   10   GLY    CA    .   27572   1
      70    .   1   1   10   10   GLY   N     N   15   104.6    0.5    .   1   .   .   .   .   .   10   GLY    N     .   27572   1
      71    .   1   1   11   11   CYS   H     H   1    7.05     0.03   .   1   .   .   .   .   .   11   ALAS   H     .   27572   1
      72    .   1   1   11   11   CYS   HA    H   1    4.15     0.03   .   1   .   .   .   .   .   11   ALAS   HA    .   27572   1
      73    .   1   1   11   11   CYS   C     C   13   177.5    0.3    .   1   .   .   .   .   .   11   ALAS   C     .   27572   1
      74    .   1   1   11   11   CYS   CA    C   13   55.1     0.3    .   1   .   .   .   .   .   11   ALAS   CA    .   27572   1
      75    .   1   1   11   11   CYS   CB    C   13   38.8     0.3    .   1   .   .   .   .   .   11   ALAS   CB    .   27572   1
      76    .   1   1   11   11   CYS   N     N   15   113.8    0.5    .   1   .   .   .   .   .   11   ALAS   N     .   27572   1
      77    .   1   1   12   12   LYS   H     H   1    9.05     0.03   .   1   .   .   .   .   .   12   LYS    H     .   27572   1
      78    .   1   1   12   12   LYS   HA    H   1    4.5      0.1    .   1   .   .   .   .   .   12   LYS    HA    .   27572   1
      79    .   1   1   12   12   LYS   C     C   13   177.7    0.3    .   1   .   .   .   .   .   12   LYS    C     .   27572   1
      80    .   1   1   12   12   LYS   CA    C   13   58.73    0.3    .   1   .   .   .   .   .   12   LYS    CA    .   27572   1
      81    .   1   1   12   12   LYS   CB    C   13   31.14    0.3    .   1   .   .   .   .   .   12   LYS    CB    .   27572   1
      82    .   1   1   12   12   LYS   CG    C   13   26.02    0.3    .   1   .   .   .   .   .   12   LYS    CG    .   27572   1
      83    .   1   1   12   12   LYS   CD    C   13   29.56    0.3    .   1   .   .   .   .   .   12   LYS    CD    .   27572   1
      84    .   1   1   12   12   LYS   CE    C   13   41.59    0.3    .   1   .   .   .   .   .   12   LYS    CE    .   27572   1
      85    .   1   1   12   12   LYS   N     N   15   123.8    0.5    .   1   .   .   .   .   .   12   LYS    N     .   27572   1
      86    .   1   1   13   13   ABU   H     H   1    8.32     0.03   .   1   .   .   .   .   .   13   ABU    H     .   27572   1
      87    .   1   1   13   13   ABU   HA    H   1    4.72     0.03   .   1   .   .   .   .   .   13   ABU    HA    .   27572   1
      88    .   1   1   13   13   ABU   C     C   13   174.3    0.3    .   1   .   .   .   .   .   13   ABU    C     .   27572   1
      89    .   1   1   13   13   ABU   CA    C   13   61.87    0.3    .   1   .   .   .   .   .   13   ABU    CA    .   27572   1
      90    .   1   1   13   13   ABU   CB    C   13   43.93    0.3    .   1   .   .   .   .   .   13   ABU    CB    .   27572   1
      91    .   1   1   13   13   ABU   CG    C   13   22.96    0.3    .   1   .   .   .   .   .   13   ABU    CG    .   27572   1
      92    .   1   1   13   13   ABU   N     N   15   115.9    0.5    .   1   .   .   .   .   .   13   ABU    N     .   27572   1
      93    .   1   1   14   14   GLY   H     H   1    7.64     0.03   .   1   .   .   .   .   .   14   GLY    H     .   27572   1
      94    .   1   1   14   14   GLY   HA2   H   1    4.25     0.25   .   2   .   .   .   .   .   14   GLY    HA2   .   27572   1
      95    .   1   1   14   14   GLY   HA3   H   1    4.25     0.25   .   2   .   .   .   .   .   14   GLY    HA3   .   27572   1
      96    .   1   1   14   14   GLY   C     C   13   176.15   0.3    .   1   .   .   .   .   .   14   GLY    C     .   27572   1
      97    .   1   1   14   14   GLY   CA    C   13   45.15    0.3    .   1   .   .   .   .   .   14   GLY    CA    .   27572   1
      98    .   1   1   14   14   GLY   N     N   15   105.4    0.5    .   1   .   .   .   .   .   14   GLY    N     .   27572   1
      99    .   1   1   15   15   ALA   H     H   1    7.97     0.03   .   1   .   .   .   .   .   15   ALA    H     .   27572   1
      100   .   1   1   15   15   ALA   HA    H   1    4.15     0.03   .   1   .   .   .   .   .   15   ALA    HA    .   27572   1
      101   .   1   1   15   15   ALA   C     C   13   180      0.3    .   1   .   .   .   .   .   15   ALA    C     .   27572   1
      102   .   1   1   15   15   ALA   CA    C   13   55.01    0.3    .   1   .   .   .   .   .   15   ALA    CA    .   27572   1
      103   .   1   1   15   15   ALA   CB    C   13   19.66    0.3    .   1   .   .   .   .   .   15   ALA    CB    .   27572   1
      104   .   1   1   15   15   ALA   N     N   15   117.3    0.5    .   1   .   .   .   .   .   15   ALA    N     .   27572   1
      105   .   1   1   16   16   LEU   H     H   1    8.49     0.03   .   1   .   .   .   .   .   16   LEU    H     .   27572   1
      106   .   1   1   16   16   LEU   HA    H   1    4.2      0.03   .   1   .   .   .   .   .   16   LEU    HA    .   27572   1
      107   .   1   1   16   16   LEU   C     C   13   176.1    0.3    .   1   .   .   .   .   .   16   LEU    C     .   27572   1
      108   .   1   1   16   16   LEU   CA    C   13   57.8     0.3    .   1   .   .   .   .   .   16   LEU    CA    .   27572   1
      109   .   1   1   16   16   LEU   CB    C   13   40.76    0.3    .   1   .   .   .   .   .   16   LEU    CB    .   27572   1
      110   .   1   1   16   16   LEU   CG    C   13   27.52    0.3    .   1   .   .   .   .   .   16   LEU    CG    .   27572   1
      111   .   1   1   16   16   LEU   CD1   C   13   25.85    0.3    .   2   .   .   .   .   .   16   LEU    CD1   .   27572   1
      112   .   1   1   16   16   LEU   CD2   C   13   23.51    0.3    .   2   .   .   .   .   .   16   LEU    CD2   .   27572   1
      113   .   1   1   16   16   LEU   N     N   15   114.6    0.5    .   1   .   .   .   .   .   16   LEU    N     .   27572   1
      114   .   1   1   17   17   MET   H     H   1    8.25     0.03   .   1   .   .   .   .   .   17   MET    H     .   27572   1
      115   .   1   1   17   17   MET   HA    H   1    4.2      0.03   .   1   .   .   .   .   .   17   MET    HA    .   27572   1
      116   .   1   1   17   17   MET   C     C   13   176.5    0.3    .   1   .   .   .   .   .   17   MET    C     .   27572   1
      117   .   1   1   17   17   MET   CA    C   13   57.8     0.3    .   1   .   .   .   .   .   17   MET    CA    .   27572   1
      118   .   1   1   17   17   MET   CB    C   13   36.34    0.3    .   1   .   .   .   .   .   17   MET    CB    .   27572   1
      119   .   1   1   17   17   MET   CG    C   13   31.43    0.3    .   1   .   .   .   .   .   17   MET    CG    .   27572   1
      120   .   1   1   17   17   MET   CE    C   13   18.2     0.3    .   1   .   .   .   .   .   17   MET    CE    .   27572   1
      121   .   1   1   17   17   MET   N     N   15   115.3    0.5    .   1   .   .   .   .   .   17   MET    N     .   27572   1
      122   .   1   1   18   18   GLY   H     H   1    8.14     0.03   .   1   .   .   .   .   .   18   GLY    H     .   27572   1
      123   .   1   1   18   18   GLY   HA2   H   1    4.12     0.03   .   2   .   .   .   .   .   18   GLY    HA2   .   27572   1
      124   .   1   1   18   18   GLY   HA3   H   1    4.12     0.03   .   2   .   .   .   .   .   18   GLY    HA3   .   27572   1
      125   .   1   1   18   18   GLY   C     C   13   174.26   0.3    .   1   .   .   .   .   .   18   GLY    C     .   27572   1
      126   .   1   1   18   18   GLY   CA    C   13   44.8     0.3    .   1   .   .   .   .   .   18   GLY    CA    .   27572   1
      127   .   1   1   18   18   GLY   N     N   15   101.2    0.5    .   1   .   .   .   .   .   18   GLY    N     .   27572   1
      128   .   1   1   19   19   CYS   H     H   1    7.05     0.03   .   1   .   .   .   .   .   19   ALAS   H     .   27572   1
      129   .   1   1   19   19   CYS   HA    H   1    5.35     0.15   .   1   .   .   .   .   .   19   ALAS   HA    .   27572   1
      130   .   1   1   19   19   CYS   C     C   13   173.7    0.3    .   1   .   .   .   .   .   19   ALAS   C     .   27572   1
      131   .   1   1   19   19   CYS   CA    C   13   54.06    0.3    .   1   .   .   .   .   .   19   ALAS   CA    .   27572   1
      132   .   1   1   19   19   CYS   CB    C   13   36.5     0.3    .   1   .   .   .   .   .   19   ALAS   CB    .   27572   1
      133   .   1   1   19   19   CYS   N     N   15   117.9    0.5    .   1   .   .   .   .   .   19   ALAS   N     .   27572   1
      134   .   1   1   20   20   ASN   H     H   1    9.3      0.03   .   1   .   .   .   .   .   20   ASN    H     .   27572   1
      135   .   1   1   20   20   ASN   HA    H   1    4.75     0.25   .   1   .   .   .   .   .   20   ASN    HA    .   27572   1
      136   .   1   1   20   20   ASN   C     C   13   173.6    0.3    .   1   .   .   .   .   .   20   ASN    C     .   27572   1
      137   .   1   1   20   20   ASN   CA    C   13   56.59    0.3    .   1   .   .   .   .   .   20   ASN    CA    .   27572   1
      138   .   1   1   20   20   ASN   CB    C   13   34.63    0.3    .   1   .   .   .   .   .   20   ASN    CB    .   27572   1
      139   .   1   1   20   20   ASN   CG    C   13   177      0.3    .   1   .   .   .   .   .   20   ASN    CG    .   27572   1
      140   .   1   1   20   20   ASN   N     N   15   120.8    0.5    .   1   .   .   .   .   .   20   ASN    N     .   27572   1
      141   .   1   1   21   21   MET   H     H   1    8.36     0.03   .   1   .   .   .   .   .   21   MET    H     .   27572   1
      142   .   1   1   21   21   MET   HA    H   1    5.2      0.03   .   1   .   .   .   .   .   21   MET    HA    .   27572   1
      143   .   1   1   21   21   MET   C     C   13   176.9    0.3    .   1   .   .   .   .   .   21   MET    C     .   27572   1
      144   .   1   1   21   21   MET   CA    C   13   52       0.3    .   1   .   .   .   .   .   21   MET    CA    .   27572   1
      145   .   1   1   21   21   MET   CB    C   13   30       0.3    .   1   .   .   .   .   .   21   MET    CB    .   27572   1
      146   .   1   1   21   21   MET   CG    C   13   32.3     0.3    .   1   .   .   .   .   .   21   MET    CG    .   27572   1
      147   .   1   1   21   21   MET   CE    C   13   17.25    0.3    .   1   .   .   .   .   .   21   MET    CE    .   27572   1
      148   .   1   1   21   21   MET   N     N   15   111.85   0.5    .   1   .   .   .   .   .   21   MET    N     .   27572   1
      149   .   1   1   22   22   LYS   H     H   1    7.33     0.03   .   1   .   .   .   .   .   22   LYS    H     .   27572   1
      150   .   1   1   22   22   LYS   HA    H   1    4.5      0.1    .   1   .   .   .   .   .   22   LYS    HA    .   27572   1
      151   .   1   1   22   22   LYS   C     C   13   176.6    0.3    .   1   .   .   .   .   .   22   LYS    C     .   27572   1
      152   .   1   1   22   22   LYS   CA    C   13   58.73    0.3    .   1   .   .   .   .   .   22   LYS    CA    .   27572   1
      153   .   1   1   22   22   LYS   CB    C   13   32.73    0.3    .   1   .   .   .   .   .   22   LYS    CB    .   27572   1
      154   .   1   1   22   22   LYS   CG    C   13   24.53    0.3    .   1   .   .   .   .   .   22   LYS    CG    .   27572   1
      155   .   1   1   22   22   LYS   CD    C   13   30.08    0.3    .   1   .   .   .   .   .   22   LYS    CD    .   27572   1
      156   .   1   1   22   22   LYS   CE    C   13   42.01    0.3    .   1   .   .   .   .   .   22   LYS    CE    .   27572   1
      157   .   1   1   22   22   LYS   N     N   15   124.8    0.5    .   1   .   .   .   .   .   22   LYS    N     .   27572   1
      158   .   1   1   23   23   ABU   H     H   1    9.4      0.03   .   1   .   .   .   .   .   23   ABU    H     .   27572   1
      159   .   1   1   23   23   ABU   HA    H   1    5.11     0.03   .   1   .   .   .   .   .   23   ABU    HA    .   27572   1
      160   .   1   1   23   23   ABU   C     C   13   176.8    0.3    .   1   .   .   .   .   .   23   ABU    C     .   27572   1
      161   .   1   1   23   23   ABU   CA    C   13   60.8     0.3    .   1   .   .   .   .   .   23   ABU    CA    .   27572   1
      162   .   1   1   23   23   ABU   CB    C   13   50.5     0.3    .   1   .   .   .   .   .   23   ABU    CB    .   27572   1
      163   .   1   1   23   23   ABU   CG    C   13   23.35    0.3    .   1   .   .   .   .   .   23   ABU    CG    .   27572   1
      164   .   1   1   23   23   ABU   N     N   15   121      0.5    .   1   .   .   .   .   .   23   ABU    N     .   27572   1
      165   .   1   1   24   24   ALA   H     H   1    8.41     0.03   .   1   .   .   .   .   .   24   ALA    H     .   27572   1
      166   .   1   1   24   24   ALA   HA    H   1    3.9      0.03   .   1   .   .   .   .   .   24   ALA    HA    .   27572   1
      167   .   1   1   24   24   ALA   C     C   13   179      0.3    .   1   .   .   .   .   .   24   ALA    C     .   27572   1
      168   .   1   1   24   24   ALA   CA    C   13   53.5     0.3    .   1   .   .   .   .   .   24   ALA    CA    .   27572   1
      169   .   1   1   24   24   ALA   CB    C   13   17.97    0.3    .   1   .   .   .   .   .   24   ALA    CB    .   27572   1
      170   .   1   1   24   24   ALA   N     N   15   126.1    0.5    .   1   .   .   .   .   .   24   ALA    N     .   27572   1
      171   .   1   1   25   25   ABU   H     H   1    9.05     0.03   .   1   .   .   .   .   .   25   ABU    H     .   27572   1
      172   .   1   1   25   25   ABU   HA    H   1    4.76     0.03   .   1   .   .   .   .   .   25   ABU    HA    .   27572   1
      173   .   1   1   25   25   ABU   C     C   13   176.7    0.3    .   1   .   .   .   .   .   25   ABU    C     .   27572   1
      174   .   1   1   25   25   ABU   CA    C   13   63.5     0.3    .   1   .   .   .   .   .   25   ABU    CA    .   27572   1
      175   .   1   1   25   25   ABU   CB    C   13   46.85    0.3    .   1   .   .   .   .   .   25   ABU    CB    .   27572   1
      176   .   1   1   25   25   ABU   CG    C   13   23.35    0.3    .   1   .   .   .   .   .   25   ABU    CG    .   27572   1
      177   .   1   1   25   25   ABU   N     N   15   114.7    0.5    .   1   .   .   .   .   .   25   ABU    N     .   27572   1
      178   .   1   1   26   26   CYS   H     H   1    9        0.03   .   1   .   .   .   .   .   26   ALAS   H     .   27572   1
      179   .   1   1   26   26   CYS   HA    H   1    5.32     0.03   .   1   .   .   .   .   .   26   ALAS   HA    .   27572   1
      180   .   1   1   26   26   CYS   C     C   13   173.9    0.3    .   1   .   .   .   .   .   26   ALAS   C     .   27572   1
      181   .   1   1   26   26   CYS   CA    C   13   59.7     0.3    .   1   .   .   .   .   .   26   ALAS   CA    .   27572   1
      182   .   1   1   26   26   CYS   CB    C   13   41.5     0.3    .   1   .   .   .   .   .   26   ALAS   CB    .   27572   1
      183   .   1   1   26   26   CYS   N     N   15   123.6    0.5    .   1   .   .   .   .   .   26   ALAS   N     .   27572   1
      184   .   1   1   27   27   ASN   H     H   1    8        0.03   .   1   .   .   .   .   .   27   ASN    H     .   27572   1
      185   .   1   1   27   27   ASN   HA    H   1    5.25     0.03   .   1   .   .   .   .   .   27   ASN    HA    .   27572   1
      186   .   1   1   27   27   ASN   C     C   13   175.1    0.3    .   1   .   .   .   .   .   27   ASN    C     .   27572   1
      187   .   1   1   27   27   ASN   CA    C   13   50.73    0.3    .   1   .   .   .   .   .   27   ASN    CA    .   27572   1
      188   .   1   1   27   27   ASN   CB    C   13   38.5     0.3    .   1   .   .   .   .   .   27   ASN    CB    .   27572   1
      189   .   1   1   27   27   ASN   CG    C   13   178.4    0.3    .   1   .   .   .   .   .   27   ASN    CG    .   27572   1
      190   .   1   1   27   27   ASN   N     N   15   115.6    0.5    .   1   .   .   .   .   .   27   ASN    N     .   27572   1
      191   .   1   1   27   27   ASN   ND2   N   15   113.3    0.5    .   1   .   .   .   .   .   27   ASN    ND2   .   27572   1
      192   .   1   1   28   28   CYS   H     H   1    6.55     0.03   .   1   .   .   .   .   .   28   ALAS   H     .   27572   1
      193   .   1   1   28   28   CYS   HA    H   1    4.75     0.25   .   1   .   .   .   .   .   28   ALAS   HA    .   27572   1
      194   .   1   1   28   28   CYS   C     C   13   173      0.3    .   1   .   .   .   .   .   28   ALAS   C     .   27572   1
      195   .   1   1   28   28   CYS   CA    C   13   55.95    0.3    .   1   .   .   .   .   .   28   ALAS   CA    .   27572   1
      196   .   1   1   28   28   CYS   CB    C   13   42.42    0.3    .   1   .   .   .   .   .   28   ALAS   CB    .   27572   1
      197   .   1   1   28   28   CYS   N     N   15   118.2    0.5    .   1   .   .   .   .   .   28   ALAS   N     .   27572   1
      198   .   1   1   29   29   SER   H     H   1    8.78     0.03   .   1   .   .   .   .   .   29   SER    H     .   27572   1
      199   .   1   1   29   29   SER   HA    H   1    4.75     0.25   .   1   .   .   .   .   .   29   SER    HA    .   27572   1
      200   .   1   1   29   29   SER   C     C   13   172.8    0.3    .   1   .   .   .   .   .   29   SER    C     .   27572   1
      201   .   1   1   29   29   SER   CA    C   13   56.1     0.3    .   1   .   .   .   .   .   29   SER    CA    .   27572   1
      202   .   1   1   29   29   SER   CB    C   13   64.95    0.3    .   1   .   .   .   .   .   29   SER    CB    .   27572   1
      203   .   1   1   29   29   SER   N     N   15   114.4    0.5    .   1   .   .   .   .   .   29   SER    N     .   27572   1
      204   .   1   1   30   30   ILE   H     H   1    9.3      0.03   .   1   .   .   .   .   .   30   ILE    H     .   27572   1
      205   .   1   1   30   30   ILE   C     C   13   174.2    0.3    .   1   .   .   .   .   .   30   ILE    C     .   27572   1
      206   .   1   1   30   30   ILE   CA    C   13   59.4     0.3    .   1   .   .   .   .   .   30   ILE    CA    .   27572   1
      207   .   1   1   30   30   ILE   CB    C   13   38.2     0.3    .   1   .   .   .   .   .   30   ILE    CB    .   27572   1
      208   .   1   1   30   30   ILE   CG1   C   13   27.78    0.3    .   1   .   .   .   .   .   30   ILE    CG1   .   27572   1
      209   .   1   1   30   30   ILE   CG2   C   13   17.68    0.3    .   1   .   .   .   .   .   30   ILE    CG2   .   27572   1
      210   .   1   1   30   30   ILE   CD1   C   13   17.68    0.3    .   1   .   .   .   .   .   30   ILE    CD1   .   27572   1
      211   .   1   1   30   30   ILE   N     N   15   124.5    0.5    .   1   .   .   .   .   .   30   ILE    N     .   27572   1
      212   .   1   1   31   31   HIS   H     H   1    9.1      0.03   .   1   .   .   .   .   .   31   HIS    H     .   27572   1
      213   .   1   1   31   31   HIS   C     C   13   174.4    0.3    .   1   .   .   .   .   .   31   HIS    C     .   27572   1
      214   .   1   1   31   31   HIS   CA    C   13   54.72    0.3    .   1   .   .   .   .   .   31   HIS    CA    .   27572   1
      215   .   1   1   31   31   HIS   CB    C   13   30.79    0.3    .   1   .   .   .   .   .   31   HIS    CB    .   27572   1
      216   .   1   1   31   31   HIS   CG    C   13   129.9    0.3    .   1   .   .   .   .   .   31   HIS    CG    .   27572   1
      217   .   1   1   31   31   HIS   CD2   C   13   115.9    0.3    .   1   .   .   .   .   .   31   HIS    CD2   .   27572   1
      218   .   1   1   31   31   HIS   CE1   C   13   137.5    0.3    .   1   .   .   .   .   .   31   HIS    CE1   .   27572   1
      219   .   1   1   31   31   HIS   N     N   15   126.4    0.5    .   1   .   .   .   .   .   31   HIS    N     .   27572   1
      220   .   1   1   32   32   VAL   H     H   1    8.37     0.03   .   1   .   .   .   .   .   32   VAL    H     .   27572   1
      221   .   1   1   32   32   VAL   CA    C   13   60.89    0.7    .   1   .   .   .   .   .   32   VAL    CA    .   27572   1
      222   .   1   1   32   32   VAL   CB    C   13   33.3     0.3    .   1   .   .   .   .   .   32   VAL    CB    .   27572   1
      223   .   1   1   32   32   VAL   CG1   C   13   20.3     0.3    .   2   .   .   .   .   .   32   VAL    CG1   .   27572   1
      224   .   1   1   32   32   VAL   N     N   15   111.8    0.5    .   1   .   .   .   .   .   32   VAL    N     .   27572   1
   stop_
save_