Content for NMR-STAR saveframe, "assigned_chem_shift_list"

    save_assigned_chem_shift_list
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  assigned_chem_shift_list
   _Assigned_chem_shift_list.Entry_ID                      19157
   _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                       'Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/3zpk/ebi/shifts.mr.txt.csh'
   _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   '1D DQ-DRAWS'   1   $sample_1   solid   19157   1
      2   REDOR           1   $sample_1   solid   19157   1
      3   ZF-TEDOR        1   $sample_1   solid   19157   1
      4   '2D PDSD'       1   $sample_1   solid   19157   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    TYR   C     C   13   172.0   0.02   .   1   .   1    .   .   1    TYR   C     .   19157   1
      2    .   1   1   1    1    TYR   CA    C   13   56.3    0.02   .   1   .   2    .   .   1    TYR   CA    .   19157   1
      3    .   1   1   1    1    TYR   CB    C   13   36.5    0.02   .   1   .   3    .   .   1    TYR   CB    .   19157   1
      4    .   1   1   1    1    TYR   CG    C   13   124.5   0.02   .   1   .   4    .   .   1    TYR   CG    .   19157   1
      5    .   1   1   1    1    TYR   CZ    C   13   160.0   0.02   .   1   .   9    .   .   1    TYR   CZ    .   19157   1
      6    .   1   1   2    2    THR   C     C   13   173.5   0.02   .   1   .   11   .   .   2    THR   C     .   19157   1
      7    .   1   1   2    2    THR   CA    C   13   62.6    0.02   .   1   .   12   .   .   2    THR   CA    .   19157   1
      8    .   1   1   2    2    THR   CB    C   13   72.5    0.02   .   1   .   13   .   .   2    THR   CB    .   19157   1
      9    .   1   1   2    2    THR   CG2   C   13   20.0    0.02   .   1   .   14   .   .   2    THR   CG2   .   19157   1
      10   .   1   1   2    2    THR   N     N   15   117.0   0.02   .   1   .   15   .   .   2    THR   N     .   19157   1
      11   .   1   1   3    3    ILE   C     C   13   174.1   0.02   .   1   .   16   .   .   3    ILE   C     .   19157   1
      12   .   1   1   3    3    ILE   CA    C   13   60.2    0.02   .   1   .   17   .   .   3    ILE   CA    .   19157   1
      13   .   1   1   3    3    ILE   CB    C   13   41.8    0.02   .   1   .   18   .   .   3    ILE   CB    .   19157   1
      14   .   1   1   3    3    ILE   CG1   C   13   28.2    0.02   .   1   .   19   .   .   3    ILE   CG1   .   19157   1
      15   .   1   1   3    3    ILE   CG2   C   13   17.0    0.02   .   1   .   20   .   .   3    ILE   CG2   .   19157   1
      16   .   1   1   3    3    ILE   CD1   C   13   14.6    0.02   .   1   .   21   .   .   3    ILE   CD1   .   19157   1
      17   .   1   1   3    3    ILE   N     N   15   127.0   0.02   .   1   .   22   .   .   3    ILE   N     .   19157   1
      18   .   1   1   4    4    ALA   C     C   13   174.5   0.02   .   1   .   23   .   .   4    ALA   C     .   19157   1
      19   .   1   1   4    4    ALA   CA    C   13   49.9    0.02   .   1   .   24   .   .   4    ALA   CA    .   19157   1
      20   .   1   1   4    4    ALA   CB    C   13   22.1    0.02   .   1   .   25   .   .   4    ALA   CB    .   19157   1
      21   .   1   1   4    4    ALA   N     N   15   128.0   0.02   .   1   .   26   .   .   4    ALA   N     .   19157   1
      22   .   1   1   5    5    ALA   C     C   13   173.3   0.02   .   1   .   27   .   .   5    ALA   C     .   19157   1
      23   .   1   1   5    5    ALA   CA    C   13   50.3    0.02   .   1   .   28   .   .   5    ALA   CA    .   19157   1
      24   .   1   1   5    5    ALA   CB    C   13   22.9    0.02   .   1   .   29   .   .   5    ALA   CB    .   19157   1
      25   .   1   1   5    5    ALA   N     N   15   125.1   0.02   .   1   .   30   .   .   5    ALA   N     .   19157   1
      26   .   1   1   6    6    LEU   C     C   13   174.2   0.02   .   1   .   31   .   .   6    LEU   C     .   19157   1
      27   .   1   1   6    6    LEU   CA    C   13   54.4    0.02   .   1   .   32   .   .   6    LEU   CA    .   19157   1
      28   .   1   1   6    6    LEU   CB    C   13   45.5    0.02   .   1   .   33   .   .   6    LEU   CB    .   19157   1
      29   .   1   1   6    6    LEU   CG    C   13   29.4    0.02   .   1   .   34   .   .   6    LEU   CG    .   19157   1
      30   .   1   1   6    6    LEU   CD1   C   13   23.9    0.02   .   2   .   35   .   .   6    LEU   CD1   .   19157   1
      31   .   1   1   6    6    LEU   CD2   C   13   28.2    0.02   .   2   .   36   .   .   6    LEU   CD2   .   19157   1
      32   .   1   1   6    6    LEU   N     N   15   127.0   0.02   .   1   .   37   .   .   6    LEU   N     .   19157   1
      33   .   1   1   7    7    LEU   C     C   13   173.9   0.02   .   1   .   38   .   .   7    LEU   C     .   19157   1
      34   .   1   1   7    7    LEU   CA    C   13   54.1    0.02   .   1   .   39   .   .   7    LEU   CA    .   19157   1
      35   .   1   1   7    7    LEU   CB    C   13   44.3    0.02   .   1   .   40   .   .   7    LEU   CB    .   19157   1
      36   .   1   1   7    7    LEU   CG    C   13   29.9    0.02   .   1   .   41   .   .   7    LEU   CG    .   19157   1
      37   .   1   1   7    7    LEU   CD1   C   13   27.7    0.02   .   2   .   42   .   .   7    LEU   CD1   .   19157   1
      38   .   1   1   7    7    LEU   CD2   C   13   25.3    0.02   .   2   .   43   .   .   7    LEU   CD2   .   19157   1
      39   .   1   1   7    7    LEU   N     N   15   127.5   0.02   .   1   .   44   .   .   7    LEU   N     .   19157   1
      40   .   1   1   8    8    SER   C     C   13   173.6   0.02   .   1   .   45   .   .   8    SER   C     .   19157   1
      41   .   1   1   8    8    SER   CA    C   13   55.4    0.02   .   1   .   46   .   .   8    SER   CA    .   19157   1
      42   .   1   1   8    8    SER   CB    C   13   63.2    0.02   .   1   .   47   .   .   8    SER   CB    .   19157   1
      43   .   1   1   8    8    SER   N     N   15   117.2   0.02   .   1   .   48   .   .   8    SER   N     .   19157   1
      44   .   1   1   9    9    PRO   C     C   13   174.8   0.02   .   1   .   49   .   .   9    PRO   C     .   19157   1
      45   .   1   1   9    9    PRO   CA    C   13   62.6    0.02   .   1   .   50   .   .   9    PRO   CA    .   19157   1
      46   .   1   1   9    9    PRO   CB    C   13   32.6    0.02   .   1   .   51   .   .   9    PRO   CB    .   19157   1
      47   .   1   1   9    9    PRO   CG    C   13   28.0    0.02   .   1   .   52   .   .   9    PRO   CG    .   19157   1
      48   .   1   1   9    9    PRO   CD    C   13   49.6    0.02   .   1   .   53   .   .   9    PRO   CD    .   19157   1
      49   .   1   1   9    9    PRO   N     N   15   135.8   0.02   .   1   .   54   .   .   9    PRO   N     .   19157   1
      50   .   1   1   10   10   TYR   C     C   13   173.6   0.02   .   1   .   55   .   .   10   TYR   C     .   19157   1
      51   .   1   1   10   10   TYR   CA    C   13   57.7    0.02   .   1   .   56   .   .   10   TYR   CA    .   19157   1
      52   .   1   1   10   10   TYR   CB    C   13   43.8    0.02   .   1   .   57   .   .   10   TYR   CB    .   19157   1
      53   .   1   1   10   10   TYR   CG    C   13   128.7   0.02   .   1   .   58   .   .   10   TYR   CG    .   19157   1
      54   .   1   1   10   10   TYR   CD1   C   13   133.6   0.02   .   3   .   59   .   .   10   TYR   CD1   .   19157   1
      55   .   1   1   10   10   TYR   CD2   C   13   133.6   0.02   .   3   .   60   .   .   10   TYR   CD2   .   19157   1
      56   .   1   1   10   10   TYR   CE1   C   13   118.3   0.02   .   3   .   61   .   .   10   TYR   CE1   .   19157   1
      57   .   1   1   10   10   TYR   CE2   C   13   118.3   0.02   .   3   .   62   .   .   10   TYR   CE2   .   19157   1
      58   .   1   1   10   10   TYR   CZ    C   13   157.4   0.02   .   1   .   63   .   .   10   TYR   CZ    .   19157   1
      59   .   1   1   10   10   TYR   N     N   15   127.3   0.02   .   1   .   64   .   .   10   TYR   N     .   19157   1
      60   .   1   1   11   11   SER   C     C   13   181.9   0.02   .   1   .   65   .   .   11   SER   C     .   19157   1
      61   .   1   1   11   11   SER   CA    C   13   57.8    0.02   .   1   .   66   .   .   11   SER   CA    .   19157   1
   stop_
save_