Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"

    save_assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Entry_ID                      51963
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Name                          'assigned chem shift list'
   _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    $chem_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 1H-1H TOCSY'   .   .   .   51963   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

      1   $software_1   .   .   51963   1
   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_ID
      _Atom_chem_shift.Entity_assembly_asym_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   2    2    LEU   H      H   1   8.632   0.002   .   1   .   .   10    .   .   87    LEU   H      .   51963   1
      2     .   1   .   1   2    2    LEU   HA     H   1   4.227   0.001   .   1   .   .   14    .   .   87    LEU   HA     .   51963   1
      3     .   1   .   1   2    2    LEU   HB2    H   1   1.542   0.007   .   1   .   .   13    .   .   87    LEU   HB2    .   51963   1
      4     .   1   .   1   2    2    LEU   HD11   H   1   0.827   .       .   1   .   .   11    .   .   87    LEU   HD11   .   51963   1
      5     .   1   .   1   2    2    LEU   HD12   H   1   0.827   .       .   1   .   .   11    .   .   87    LEU   HD12   .   51963   1
      6     .   1   .   1   2    2    LEU   HD13   H   1   0.827   .       .   1   .   .   11    .   .   87    LEU   HD13   .   51963   1
      7     .   1   .   1   3    3    ASN   H      H   1   8.369   0.003   .   1   .   .   48    .   .   88    ASN   H      .   51963   1
      8     .   1   .   1   3    3    ASN   HA     H   1   4.501   0.013   .   1   .   .   50    .   .   88    ASN   HA     .   51963   1
      9     .   1   .   1   3    3    ASN   HB2    H   1   2.698   0.003   .   1   .   .   49    .   .   88    ASN   HB2    .   51963   1
      10    .   1   .   1   4    4    ALA   H      H   1   8.032   0.001   .   1   .   .   63    .   .   89    ALA   H      .   51963   1
      11    .   1   .   1   4    4    ALA   HA     H   1   4.138   0.003   .   1   .   .   65    .   .   89    ALA   HA     .   51963   1
      12    .   1   .   1   4    4    ALA   HB1    H   1   1.287   0.001   .   1   .   .   64    .   .   89    ALA   HB1    .   51963   1
      13    .   1   .   1   4    4    ALA   HB2    H   1   1.287   0.001   .   1   .   .   64    .   .   89    ALA   HB2    .   51963   1
      14    .   1   .   1   4    4    ALA   HB3    H   1   1.287   0.001   .   1   .   .   64    .   .   89    ALA   HB3    .   51963   1
      15    .   1   .   1   5    5    LEU   H      H   1   7.920   0.002   .   1   .   .   5     .   .   90    LEU   H      .   51963   1
      16    .   1   .   1   5    5    LEU   HA     H   1   4.142   0.003   .   1   .   .   6     .   .   90    LEU   HA     .   51963   1
      17    .   1   .   1   5    5    LEU   HB2    H   1   1.510   0.004   .   2   .   .   8     .   .   90    LEU   HB2    .   51963   1
      18    .   1   .   1   5    5    LEU   HB3    H   1   1.466   .       .   2   .   .   129   .   .   90    LEU   HB3    .   51963   1
      19    .   1   .   1   5    5    LEU   HG     H   1   1.390   0.001   .   1   .   .   7     .   .   90    LEU   HG     .   51963   1
      20    .   1   .   1   5    5    LEU   HD11   H   1   0.753   .       .   2   .   .   9     .   .   90    LEU   HD11   .   51963   1
      21    .   1   .   1   5    5    LEU   HD12   H   1   0.753   .       .   2   .   .   9     .   .   90    LEU   HD12   .   51963   1
      22    .   1   .   1   5    5    LEU   HD13   H   1   0.753   .       .   2   .   .   9     .   .   90    LEU   HD13   .   51963   1
      23    .   1   .   1   5    5    LEU   HD21   H   1   0.815   .       .   2   .   .   104   .   .   90    LEU   HD21   .   51963   1
      24    .   1   .   1   5    5    LEU   HD22   H   1   0.815   .       .   2   .   .   104   .   .   90    LEU   HD22   .   51963   1
      25    .   1   .   1   5    5    LEU   HD23   H   1   0.815   .       .   2   .   .   104   .   .   90    LEU   HD23   .   51963   1
      26    .   1   .   1   6    6    HIS   H      H   1   8.204   0.006   .   1   .   .   60    .   .   91    HIS   H      .   51963   1
      27    .   1   .   1   6    6    HIS   HA     H   1   4.610   0.002   .   1   .   .   89    .   .   91    HIS   HA     .   51963   1
      28    .   1   .   1   6    6    HIS   HB2    H   1   3.082   0.002   .   2   .   .   61    .   .   91    HIS   HB2    .   51963   1
      29    .   1   .   1   6    6    HIS   HB3    H   1   3.185   0.004   .   2   .   .   62    .   .   91    HIS   HB3    .   51963   1
      30    .   1   .   1   7    7    LYS   H      H   1   8.334   0.003   .   1   .   .   30    .   .   92    LYS   H      .   51963   1
      31    .   1   .   1   7    7    LYS   HA     H   1   4.263   .       .   1   .   .   113   .   .   92    LYS   HA     .   51963   1
      32    .   1   .   1   7    7    LYS   HB2    H   1   1.674   0.002   .   2   .   .   78    .   .   92    LYS   HB2    .   51963   1
      33    .   1   .   1   7    7    LYS   HB3    H   1   1.759   .       .   2   .   .   126   .   .   92    LYS   HB3    .   51963   1
      34    .   1   .   1   7    7    LYS   HG2    H   1   1.354   0.013   .   1   .   .   31    .   .   92    LYS   HG2    .   51963   1
      35    .   1   .   1   7    7    LYS   HD2    H   1   1.587   .       .   1   .   .   127   .   .   92    LYS   HD2    .   51963   1
      36    .   1   .   1   7    7    LYS   HE2    H   1   2.897   .       .   1   .   .   57    .   .   92    LYS   HE2    .   51963   1
      37    .   1   .   1   8    8    THR   H      H   1   8.189   0.0     .   1   .   .   97    .   .   93    THR   H      .   51963   1
      38    .   1   .   1   8    8    THR   HA     H   1   4.284   .       .   1   .   .   120   .   .   93    THR   HA     .   51963   1
      39    .   1   .   1   8    8    THR   HB     H   1   4.138   .       .   1   .   .   98    .   .   93    THR   HB     .   51963   1
      40    .   1   .   1   8    8    THR   HG21   H   1   1.120   .       .   1   .   .   99    .   .   93    THR   HG21   .   51963   1
      41    .   1   .   1   8    8    THR   HG22   H   1   1.120   .       .   1   .   .   99    .   .   93    THR   HG22   .   51963   1
      42    .   1   .   1   8    8    THR   HG23   H   1   1.120   .       .   1   .   .   99    .   .   93    THR   HG23   .   51963   1
      43    .   1   .   1   9    9    THR   H      H   1   8.212   0.0     .   1   .   .   116   .   .   94    THR   H      .   51963   1
      44    .   1   .   1   9    9    THR   HA     H   1   4.366   .       .   1   .   .   117   .   .   94    THR   HA     .   51963   1
      45    .   1   .   1   9    9    THR   HB     H   1   4.146   .       .   1   .   .   118   .   .   94    THR   HB     .   51963   1
      46    .   1   .   1   9    9    THR   HG21   H   1   1.122   .       .   1   .   .   119   .   .   94    THR   HG21   .   51963   1
      47    .   1   .   1   9    9    THR   HG22   H   1   1.122   .       .   1   .   .   119   .   .   94    THR   HG22   .   51963   1
      48    .   1   .   1   9    9    THR   HG23   H   1   1.122   .       .   1   .   .   119   .   .   94    THR   HG23   .   51963   1
      49    .   1   .   1   10   10   LYS   H      H   1   8.198   0.004   .   1   .   .   55    .   .   95    LYS   H      .   51963   1
      50    .   1   .   1   10   10   LYS   HA     H   1   4.294   .       .   1   .   .   121   .   .   95    LYS   HA     .   51963   1
      51    .   1   .   1   10   10   LYS   HB2    H   1   1.755   0.001   .   2   .   .   73    .   .   95    LYS   HB2    .   51963   1
      52    .   1   .   1   10   10   LYS   HB3    H   1   1.672   .       .   2   .   .   122   .   .   95    LYS   HB3    .   51963   1
      53    .   1   .   1   10   10   LYS   HG2    H   1   1.301   .       .   2   .   .   125   .   .   95    LYS   HG2    .   51963   1
      54    .   1   .   1   10   10   LYS   HG3    H   1   1.362   .       .   2   .   .   130   .   .   95    LYS   HG3    .   51963   1
      55    .   1   .   1   10   10   LYS   HD2    H   1   1.592   .       .   1   .   .   74    .   .   95    LYS   HD2    .   51963   1
      56    .   1   .   1   10   10   LYS   HE2    H   1   2.900   .       .   1   .   .   128   .   .   95    LYS   HE2    .   51963   1
      57    .   1   .   1   11   11   SER   H      H   1   8.257   0.002   .   1   .   .   123   .   .   96    SER   H      .   51963   1
      58    .   1   .   1   11   11   SER   HA     H   1   4.338   .       .   1   .   .   124   .   .   96    SER   HA     .   51963   1
      59    .   1   .   1   11   11   SER   HB2    H   1   3.776   .       .   1   .   .   131   .   .   96    SER   HB2    .   51963   1
      60    .   1   .   1   12   12   GLN   H      H   1   8.335   0.0     .   1   .   .   109   .   .   97    GLN   H      .   51963   1
      61    .   1   .   1   12   12   GLN   HA     H   1   4.285   .       .   1   .   .   114   .   .   97    GLN   HA     .   51963   1
      62    .   1   .   1   12   12   GLN   HB2    H   1   1.865   .       .   2   .   .   110   .   .   97    GLN   HB2    .   51963   1
      63    .   1   .   1   12   12   GLN   HB3    H   1   2.005   .       .   2   .   .   111   .   .   97    GLN   HB3    .   51963   1
      64    .   1   .   1   12   12   GLN   HG2    H   1   2.261   .       .   1   .   .   112   .   .   97    GLN   HG2    .   51963   1
      65    .   1   .   1   13   13   ARG   H      H   1   8.226   0.003   .   1   .   .   75    .   .   98    ARG   H      .   51963   1
      66    .   1   .   1   13   13   ARG   HA     H   1   4.181   .       .   1   .   .   133   .   .   98    ARG   HA     .   51963   1
      67    .   1   .   1   13   13   ARG   HB2    H   1   1.654   0.018   .   2   .   .   69    .   .   98    ARG   HB2    .   51963   1
      68    .   1   .   1   13   13   ARG   HB3    H   1   1.676   0.001   .   2   .   .   132   .   .   98    ARG   HB3    .   51963   1
      69    .   1   .   1   13   13   ARG   HG2    H   1   1.468   0.0     .   1   .   .   68    .   .   98    ARG   HG2    .   51963   1
      70    .   1   .   1   13   13   ARG   HD2    H   1   3.084   0.0     .   1   .   .   70    .   .   98    ARG   HD2    .   51963   1
      71    .   1   .   1   13   13   ARG   HE     H   1   7.087   0.001   .   1   .   .   67    .   .   98    ARG   HE     .   51963   1
      72    .   1   .   1   14   14   HIS   H      H   1   8.539   0.006   .   1   .   .   16    .   .   99    HIS   H      .   51963   1
      73    .   1   .   1   14   14   HIS   HA     H   1   4.628   0.011   .   1   .   .   91    .   .   99    HIS   HA     .   51963   1
      74    .   1   .   1   14   14   HIS   HB2    H   1   3.062   0.006   .   2   .   .   17    .   .   99    HIS   HB2    .   51963   1
      75    .   1   .   1   14   14   HIS   HB3    H   1   3.149   0.004   .   2   .   .   18    .   .   99    HIS   HB3    .   51963   1
      76    .   1   .   1   15   15   LEU   H      H   1   8.347   0.002   .   1   .   .   28    .   .   100   LEU   H      .   51963   1
      77    .   1   .   1   15   15   LEU   HA     H   1   4.292   0.006   .   1   .   .   87    .   .   100   LEU   HA     .   51963   1
      78    .   1   .   1   15   15   LEU   HB2    H   1   1.540   .       .   1   .   .   29    .   .   100   LEU   HB2    .   51963   1
      79    .   1   .   1   15   15   LEU   HG     H   1   1.478   .       .   1   .   .   106   .   .   100   LEU   HG     .   51963   1
      80    .   1   .   1   15   15   LEU   HD11   H   1   0.759   .       .   2   .   .   12    .   .   100   LEU   HD11   .   51963   1
      81    .   1   .   1   15   15   LEU   HD12   H   1   0.759   .       .   2   .   .   12    .   .   100   LEU   HD12   .   51963   1
      82    .   1   .   1   15   15   LEU   HD13   H   1   0.759   .       .   2   .   .   12    .   .   100   LEU   HD13   .   51963   1
      83    .   1   .   1   15   15   LEU   HD21   H   1   0.815   .       .   2   .   .   134   .   .   100   LEU   HD21   .   51963   1
      84    .   1   .   1   15   15   LEU   HD22   H   1   0.815   .       .   2   .   .   134   .   .   100   LEU   HD22   .   51963   1
      85    .   1   .   1   15   15   LEU   HD23   H   1   0.815   .       .   2   .   .   134   .   .   100   LEU   HD23   .   51963   1
      86    .   1   .   1   16   16   GLY   H      H   1   8.400   0.01    .   1   .   .   46    .   .   101   GLY   H      .   51963   1
      87    .   1   .   1   16   16   GLY   HA2    H   1   3.894   0.006   .   1   .   .   47    .   .   101   GLY   HA2    .   51963   1
      88    .   1   .   1   17   17   GLY   H      H   1   8.245   0.005   .   1   .   .   82    .   .   102   GLY   H      .   51963   1
      89    .   1   .   1   17   17   GLY   HA2    H   1   3.927   0.003   .   1   .   .   83    .   .   102   GLY   HA2    .   51963   1
      90    .   1   .   1   18   18   SER   H      H   1   8.263   0.011   .   1   .   .   51    .   .   103   SER   H      .   51963   1
      91    .   1   .   1   18   18   SER   HA     H   1   4.364   0.008   .   1   .   .   54    .   .   103   SER   HA     .   51963   1
      92    .   1   .   1   18   18   SER   HB2    H   1   3.786   0.022   .   1   .   .   53    .   .   103   SER   HB2    .   51963   1
      93    .   1   .   1   19   19   GLN   H      H   1   8.385   0.003   .   1   .   .   23    .   .   104   GLN   H      .   51963   1
      94    .   1   .   1   19   19   GLN   HA     H   1   4.233   0.005   .   1   .   .   27    .   .   104   GLN   HA     .   51963   1
      95    .   1   .   1   19   19   GLN   HB2    H   1   1.895   0.002   .   2   .   .   24    .   .   104   GLN   HB2    .   51963   1
      96    .   1   .   1   19   19   GLN   HB3    H   1   2.028   0.003   .   2   .   .   25    .   .   104   GLN   HB3    .   51963   1
      97    .   1   .   1   19   19   GLN   HG2    H   1   2.252   0.005   .   1   .   .   26    .   .   104   GLN   HG2    .   51963   1
      98    .   1   .   1   20   20   GLN   H      H   1   8.252   0.001   .   1   .   .   37    .   .   105   GLN   H      .   51963   1
      99    .   1   .   1   20   20   GLN   HA     H   1   4.225   .       .   1   .   .   42    .   .   105   GLN   HA     .   51963   1
      100   .   1   .   1   20   20   GLN   HB2    H   1   1.870   0.002   .   2   .   .   39    .   .   105   GLN   HB2    .   51963   1
      101   .   1   .   1   20   20   GLN   HB3    H   1   1.977   0.0     .   2   .   .   40    .   .   105   GLN   HB3    .   51963   1
      102   .   1   .   1   20   20   GLN   HG2    H   1   2.242   0.003   .   1   .   .   41    .   .   105   GLN   HG2    .   51963   1
      103   .   1   .   1   21   21   LEU   H      H   1   8.213   0.004   .   1   .   .   43    .   .   106   LEU   H      .   51963   1
      104   .   1   .   1   21   21   LEU   HA     H   1   4.290   .       .   1   .   .   115   .   .   106   LEU   HA     .   51963   1
      105   .   1   .   1   21   21   LEU   HB2    H   1   1.521   0.001   .   1   .   .   45    .   .   106   LEU   HB2    .   51963   1
      106   .   1   .   1   21   21   LEU   HG     H   1   1.522   .       .   1   .   .   136   .   .   106   LEU   HG     .   51963   1
      107   .   1   .   1   21   21   LEU   HD11   H   1   0.759   .       .   2   .   .   105   .   .   106   LEU   HD11   .   51963   1
      108   .   1   .   1   21   21   LEU   HD12   H   1   0.759   .       .   2   .   .   105   .   .   106   LEU   HD12   .   51963   1
      109   .   1   .   1   21   21   LEU   HD13   H   1   0.759   .       .   2   .   .   105   .   .   106   LEU   HD13   .   51963   1
      110   .   1   .   1   21   21   LEU   HD21   H   1   0.823   .       .   2   .   .   135   .   .   106   LEU   HD21   .   51963   1
      111   .   1   .   1   21   21   LEU   HD22   H   1   0.823   .       .   2   .   .   135   .   .   106   LEU   HD22   .   51963   1
      112   .   1   .   1   21   21   LEU   HD23   H   1   0.823   .       .   2   .   .   135   .   .   106   LEU   HD23   .   51963   1
      113   .   1   .   1   22   22   LEU   H      H   1   7.718   0.003   .   1   .   .   1     .   .   107   LEU   H      .   51963   1
      114   .   1   .   1   22   22   LEU   HA     H   1   4.109   0.005   .   1   .   .   4     .   .   107   LEU   HA     .   51963   1
      115   .   1   .   1   22   22   LEU   HB2    H   1   1.477   0.003   .   1   .   .   3     .   .   107   LEU   HB2    .   51963   1
      116   .   1   .   1   22   22   LEU   HG     H   1   1.486   .       .   1   .   .   96    .   .   107   LEU   HG     .   51963   1
      117   .   1   .   1   22   22   LEU   HD11   H   1   0.759   .       .   2   .   .   2     .   .   107   LEU   HD11   .   51963   1
      118   .   1   .   1   22   22   LEU   HD12   H   1   0.759   .       .   2   .   .   2     .   .   107   LEU   HD12   .   51963   1
      119   .   1   .   1   22   22   LEU   HD13   H   1   0.759   .       .   2   .   .   2     .   .   107   LEU   HD13   .   51963   1
      120   .   1   .   1   22   22   LEU   HD21   H   1   0.801   .       .   2   .   .   103   .   .   107   LEU   HD21   .   51963   1
      121   .   1   .   1   22   22   LEU   HD22   H   1   0.801   .       .   2   .   .   103   .   .   107   LEU   HD22   .   51963   1
      122   .   1   .   1   22   22   LEU   HD23   H   1   0.801   .       .   2   .   .   103   .   .   107   LEU   HD23   .   51963   1
   stop_
save_