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                      262
   _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 . 262 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 ARG C  C 13 168.67 . . 1 . . . . . . . . 262 1 
       2 . 1 1  3  3 ASP C  C 13 176.85 . . 1 . . . . . . . . 262 1 
       3 . 1 1  3  3 ASP CG C 13 174.39 . . 1 . . . . . . . . 262 1 
       4 . 1 1  4  4 PHE C  C 13 176.35 . . 1 . . . . . . . . 262 1 
       5 . 1 1  5  5 CYS C  C 13 171.21 . . 1 . . . . . . . . 262 1 
       6 . 1 1  6  6 LEU C  C 13 176.47 . . 1 . . . . . . . . 262 1 
       7 . 1 1  7  7 GLU C  C 13 172.87 . . 1 . . . . . . . . 262 1 
       8 . 1 1  7  7 GLU CD C 13 177.98 . . 1 . . . . . . . . 262 1 
       9 . 1 1  8  8 PRO C  C 13 172.9  . . 1 . . . . . . . . 262 1 
      10 . 1 1 11 11 THR C  C 13 175.04 . . 1 . . . . . . . . 262 1 
      11 . 1 1 12 12 GLY C  C 13 170    . . 1 . . . . . . . . 262 1 
      12 . 1 1 13 13 PRO C  C 13 173.96 . . 1 . . . . . . . . 262 1 
      13 . 1 1 15 15 LYS C  C 13 175.69 . . 1 . . . . . . . . 262 1 
      14 . 1 1 17 17 ARG C  C 13 172.76 . . 1 . . . . . . . . 262 1 
      15 . 1 1 19 19 ILE C  C 13 174.67 . . 1 . . . . . . . . 262 1 
      16 . 1 1 20 20 ARG C  C 13 171.67 . . 1 . . . . . . . . 262 1 
      17 . 1 1 21 21 TYR C  C 13 173.92 . . 1 . . . . . . . . 262 1 
      18 . 1 1 22 22 PHE C  C 13 171.1  . . 1 . . . . . . . . 262 1 
      19 . 1 1 23 23 TYR C  C 13 171.87 . . 1 . . . . . . . . 262 1 
      20 . 1 1 24 24 ASN C  C 13 172.99 . . 1 . . . . . . . . 262 1 
      21 . 1 1 24 24 ASN CG C 13 175.76 . . 1 . . . . . . . . 262 1 
      22 . 1 1 27 27 ALA C  C 13 176.29 . . 1 . . . . . . . . 262 1 
      23 . 1 1 28 28 GLY C  C 13 171.62 . . 1 . . . . . . . . 262 1 
      24 . 1 1 29 29 LEU C  C 13 173.82 . . 1 . . . . . . . . 262 1 
      25 . 1 1 30 30 CYS C  C 13 172.02 . . 1 . . . . . . . . 262 1 
      26 . 1 1 31 31 GLN C  C 13 172.45 . . 1 . . . . . . . . 262 1 
      27 . 1 1 31 31 GLN CD C 13 178.59 . . 1 . . . . . . . . 262 1 
      28 . 1 1 32 32 THR C  C 13 173.56 . . 1 . . . . . . . . 262 1 
      29 . 1 1 33 33 PHE C  C 13 169.75 . . 1 . . . . . . . . 262 1 
      30 . 1 1 34 34 VAL C  C 13 172.78 . . 1 . . . . . . . . 262 1 
      31 . 1 1 35 35 TYR C  C 13 173.15 . . 1 . . . . . . . . 262 1 
      32 . 1 1 37 37 GLY C  C 13 175.75 . . 1 . . . . . . . . 262 1 
      33 . 1 1 40 40 ALA C  C 13 176.89 . . 1 . . . . . . . . 262 1 
      34 . 1 1 44 44 ASN C  C 13 172.42 . . 1 . . . . . . . . 262 1 
      35 . 1 1 44 44 ASN CG C 13 174.24 . . 1 . . . . . . . . 262 1 
      36 . 1 1 45 45 PHE C  C 13 174.9  . . 1 . . . . . . . . 262 1 
      37 . 1 1 47 47 SER C  C 13 171.93 . . 1 . . . . . . . . 262 1 
      38 . 1 1 48 48 ALA C  C 13 177.88 . . 1 . . . . . . . . 262 1 
      39 . 1 1 49 49 GLU C  C 13 176.6  . . 1 . . . . . . . . 262 1 
      40 . 1 1 49 49 GLU CD C 13 177.76 . . 1 . . . . . . . . 262 1 
      41 . 1 1 50 50 ASP C  C 13 174.9  . . 1 . . . . . . . . 262 1 
      42 . 1 1 50 50 ASP CG C 13 173.49 . . 1 . . . . . . . . 262 1 
      43 . 1 1 51 51 CYS C  C 13 173.44 . . 1 . . . . . . . . 262 1 
      44 . 1 1 52 52 MET C  C 13 178.22 . . 1 . . . . . . . . 262 1 
      45 . 1 1 53 53 ARG C  C 13 178.37 . . 1 . . . . . . . . 262 1 
      46 . 1 1 54 54 THR C  C 13 174.44 . . 1 . . . . . . . . 262 1 
      47 . 1 1 55 55 CYS C  C 13 172.21 . . 1 . . . . . . . . 262 1 
      48 . 1 1 57 57 GLY C  C 13 172.13 . . 1 . . . . . . . . 262 1 
      49 . 1 1 58 58 ALA C  C 13 177.47 . . 1 . . . . . . . . 262 1 

   stop_

save_