Content for NMR-STAR saveframe, "set_1"

    save_set_1
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  set_1
   _Assigned_chem_shift_list.Entry_ID                      5542
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Name                          .
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $Conditions
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label    $chemical_shift_reference
   _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   NOESY   1   $sample_1   .   5542   1
      2   TOCSY   1   $sample_1   .   5542   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   2    2    GLN   H      H   1   8.52   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      2    .   1   1   2    2    GLN   HA     H   1   4.48   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      3    .   1   1   2    2    GLN   HB2    H   1   2.07   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      4    .   1   1   2    2    GLN   HB3    H   1   2.15   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      5    .   1   1   2    2    GLN   HG2    H   1   2.42   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      6    .   1   1   2    2    GLN   HG3    H   1   2.42   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      7    .   1   1   3    3    ILE   H      H   1   8.57   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      8    .   1   1   3    3    ILE   HA     H   1   4.13   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      9    .   1   1   3    3    ILE   HB     H   1   1.95   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      10   .   1   1   3    3    ILE   HG12   H   1   1.24   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      11   .   1   1   3    3    ILE   HG21   H   1   0.96   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      12   .   1   1   3    3    ILE   HG22   H   1   0.96   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      13   .   1   1   3    3    ILE   HG23   H   1   0.96   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      14   .   1   1   3    3    ILE   HD11   H   1   0.90   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      15   .   1   1   3    3    ILE   HD12   H   1   0.90   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      16   .   1   1   3    3    ILE   HD13   H   1   0.90   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      17   .   1   1   4    4    LYS   H      H   1   8.39   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      18   .   1   1   4    4    LYS   HA     H   1   4.27   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      19   .   1   1   4    4    LYS   HG2    H   1   1.39   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      20   .   1   1   5    5    ILE   H      H   1   7.79   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      21   .   1   1   5    5    ILE   HA     H   1   4.09   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      22   .   1   1   5    5    ILE   HB     H   1   1.88   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      23   .   1   1   5    5    ILE   HG12   H   1   1.21   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      24   .   1   1   5    5    ILE   HG21   H   1   0.85   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      25   .   1   1   5    5    ILE   HG22   H   1   0.85   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      26   .   1   1   5    5    ILE   HG23   H   1   0.85   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      27   .   1   1   5    5    ILE   HD11   H   1   0.85   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      28   .   1   1   5    5    ILE   HD12   H   1   0.85   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      29   .   1   1   5    5    ILE   HD13   H   1   0.85   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      30   .   1   1   6    6    TRP   H      H   1   8.03   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      31   .   1   1   6    6    TRP   HA     H   1   4.40   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      32   .   1   1   6    6    TRP   HB2    H   1   3.30   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      33   .   1   1   6    6    TRP   HB3    H   1   3.26   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      34   .   1   1   6    6    TRP   HD1    H   1   7.45   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      35   .   1   1   7    7    PHE   H      H   1   8.01   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      36   .   1   1   7    7    PHE   HA     H   1   4.09   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      37   .   1   1   7    7    PHE   HB2    H   1   3.15   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      38   .   1   1   7    7    PHE   HB3    H   1   3.15   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      39   .   1   1   8    8    GLN   H      H   1   8.27   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      40   .   1   1   8    8    GLN   HA     H   1   4.14   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      41   .   1   1   8    8    GLN   HB2    H   1   2.11   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      42   .   1   1   8    8    GLN   HG2    H   1   2.40   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      43   .   1   1   8    8    GLN   HG3    H   1   2.44   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      44   .   1   1   9    9    ASN   H      H   1   8.40   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      45   .   1   1   9    9    ASN   HA     H   1   4.59   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      46   .   1   1   9    9    ASN   HB2    H   1   2.75   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      47   .   1   1   9    9    ASN   HB3    H   1   2.83   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      48   .   1   1   10   10   ARG   H      H   1   8.00   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      49   .   1   1   10   10   ARG   HA     H   1   4.23   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      50   .   1   1   10   10   ARG   HB2    H   1   1.73   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      51   .   1   1   10   10   ARG   HB3    H   1   1.83   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      52   .   1   1   11   11   ARG   H      H   1   8.10   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      53   .   1   1   11   11   ARG   HA     H   1   4.13   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      54   .   1   1   11   11   ARG   HB2    H   1   1.77   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      55   .   1   1   11   11   ARG   HB3    H   1   1.84   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      56   .   1   1   12   12   MET   H      H   1   8.05   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      57   .   1   1   12   12   MET   HA     H   1   4.30   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      58   .   1   1   12   12   MET   HB2    H   1   1.98   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      59   .   1   1   12   12   MET   HG2    H   1   2.50   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      60   .   1   1   12   12   MET   HG3    H   1   2.53   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      61   .   1   1   13   13   LYS   H      H   1   7.97   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      62   .   1   1   13   13   LYS   HA     H   1   4.24   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      63   .   1   1   13   13   LYS   HB2    H   1   1.63   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      64   .   1   1   13   13   LYS   HB3    H   1   1.73   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      65   .   1   1   13   13   LYS   HG2    H   1   1.36   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      66   .   1   1   14   14   TRP   H      H   1   7.98   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      67   .   1   1   14   14   TRP   HA     H   1   4.71   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      68   .   1   1   14   14   TRP   HB2    H   1   3.22   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      69   .   1   1   14   14   TRP   HB3    H   1   3.33   0.01   .   2   .   .   .   .   .   .   .   .   .   5542   1
      70   .   1   1   14   14   TRP   HD1    H   1   7.47   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      71   .   1   1   15   15   LYS   H      H   1   8.11   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      72   .   1   1   15   15   LYS   HA     H   1   4.20   0.01   .   1   .   .   .   .   .   .   .   .   .   5542   1
      73   .   1   1   15   15   LYS   HG2    H   1   1.45   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
      74   .   1   1   15   15   LYS   HG3    H   1   1.50   0.01   .   4   .   .   .   .   .   .   .   .   .   5542   1
   stop_

   loop_
      _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID
      _Ambiguous_atom_chem_shift.Atom_chem_shift_ID
      _Ambiguous_atom_chem_shift.Entry_ID
      _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID

      1   19   5542   1
      2   24   5542   1
      2   25   5542   1
      2   26   5542   1
      2   27   5542   1
      2   28   5542   1
      2   29   5542   1
      3   34   5542   1
      4   65   5542   1
      5   70   5542   1
      6   73   5542   1
      6   74   5542   1
   stop_
save_