Content for NMR-STAR saveframe, "chemical_shift_assignment_data_set_one"

    save_chemical_shift_assignment_data_set_one
   _Assigned_chem_shift_list.Sf_category                   assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                  chemical_shift_assignment_data_set_one
   _Assigned_chem_shift_list.Entry_ID                      1147
   _Assigned_chem_shift_list.ID                            1
   _Assigned_chem_shift_list.Sample_condition_list_ID      1
   _Assigned_chem_shift_list.Sample_condition_list_label   $sample_condition_set_one
   _Assigned_chem_shift_list.Chem_shift_reference_ID       1
   _Assigned_chem_shift_list.Chem_shift_reference_label    $chem_shift_reference_par_set_one
   _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   $sample_one   .   1147   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   41   41   MET   HE1   H   1   2.14    .   .   1   .   .   .   .   .   .   .   .   1147   1
      2    .   1   1   41   41   MET   HE2   H   1   2.14    .   .   1   .   .   .   .   .   .   .   .   1147   1
      3    .   1   1   41   41   MET   HE3   H   1   2.14    .   .   1   .   .   .   .   .   .   .   .   1147   1
      4    .   1   1   53   53   HIS   HD2   H   1   6.99    .   .   1   .   .   .   .   .   .   .   .   1147   1
      5    .   1   1   53   53   HIS   HE1   H   1   7.73    .   .   1   .   .   .   .   .   .   .   .   1147   1
      6    .   1   1   58   58   MET   HE1   H   1   -2.89   .   .   1   .   .   .   .   .   .   .   .   1147   1
      7    .   1   1   58   58   MET   HE2   H   1   -2.89   .   .   1   .   .   .   .   .   .   .   .   1147   1
      8    .   1   1   58   58   MET   HE3   H   1   -2.89   .   .   1   .   .   .   .   .   .   .   .   1147   1
      9    .   1   1   76   76   TYR   HD1   H   1   7.66    .   .   1   .   .   .   .   .   .   .   .   1147   1
      10   .   1   1   76   76   TYR   HD2   H   1   7.66    .   .   1   .   .   .   .   .   .   .   .   1147   1
      11   .   1   1   76   76   TYR   HE1   H   1   6.96    .   .   1   .   .   .   .   .   .   .   .   1147   1
      12   .   1   1   76   76   TYR   HE2   H   1   6.96    .   .   1   .   .   .   .   .   .   .   .   1147   1
   stop_
save_