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 676
_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 . 676 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 23 23 PHE H H 1 8.34 . . 1 . . . . . . . . 676 1
2 . 1 1 31 31 GLY H H 1 8.6 . . 1 . . . . . . . . 676 1
3 . 1 1 32 32 GLY H H 1 10.32 . . 1 . . . . . . . . 676 1
4 . 1 1 33 33 ASP H H 1 7.84 . . 1 . . . . . . . . 676 1
5 . 1 1 34 34 ILE H H 1 8.53 . . 1 . . . . . . . . 676 1
6 . 1 1 35 35 SER H H 1 8.64 . . 1 . . . . . . . . 676 1
7 . 1 1 68 68 GLY H H 1 10.22 . . 1 . . . . . . . . 676 1
8 . 1 1 69 69 THR H H 1 7.88 . . 1 . . . . . . . . 676 1
9 . 1 1 70 70 ILE H H 1 9 . . 1 . . . . . . . . 676 1
10 . 1 1 71 71 ASP H H 1 8.78 . . 1 . . . . . . . . 676 1
11 . 1 1 72 72 PHE H H 1 8.4 . . 1 . . . . . . . . 676 1
12 . 1 1 107 107 ASP H H 1 8.54 . . 1 . . . . . . . . 676 1
13 . 1 1 108 108 GLY H H 1 10.48 . . 1 . . . . . . . . 676 1
14 . 1 1 109 109 TYR H H 1 8.18 . . 1 . . . . . . . . 676 1
15 . 1 1 110 110 ILE H H 1 9.24 . . 1 . . . . . . . . 676 1
16 . 1 1 111 111 ASP H H 1 8.18 . . 1 . . . . . . . . 676 1
17 . 1 1 144 144 GLY H H 1 9.18 . . 1 . . . . . . . . 676 1
18 . 1 1 145 145 ARG H H 1 7.72 . . 1 . . . . . . . . 676 1
19 . 1 1 146 146 ILE H H 1 9.34 . . 1 . . . . . . . . 676 1
20 . 1 1 147 147 ASP H H 1 8.4 . . 1 . . . . . . . . 676 1
21 . 1 1 148 148 PHE H H 1 8.26 . . 1 . . . . . . . . 676 1
stop_
save_