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 36
_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 . 36 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 16 16 LEU HA H 1 4.264 . . 1 . . . . . . . . 36 1
2 . 1 1 16 16 LEU HD11 H 1 1.038 . . 2 . . . . . . . . 36 1
3 . 1 1 16 16 LEU HD12 H 1 1.038 . . 2 . . . . . . . . 36 1
4 . 1 1 16 16 LEU HD13 H 1 1.038 . . 2 . . . . . . . . 36 1
5 . 1 1 16 16 LEU HD21 H 1 .937 . . 2 . . . . . . . . 36 1
6 . 1 1 16 16 LEU HD22 H 1 .937 . . 2 . . . . . . . . 36 1
7 . 1 1 16 16 LEU HD23 H 1 .937 . . 2 . . . . . . . . 36 1
8 . 1 1 17 17 ILE HA H 1 3.692 . . 1 . . . . . . . . 36 1
9 . 1 1 17 17 ILE HG21 H 1 .921 . . 1 . . . . . . . . 36 1
10 . 1 1 17 17 ILE HG22 H 1 .921 . . 1 . . . . . . . . 36 1
11 . 1 1 17 17 ILE HG23 H 1 .921 . . 1 . . . . . . . . 36 1
12 . 1 1 18 18 SER HA H 1 4.206 . . 1 . . . . . . . . 36 1
13 . 1 1 19 19 TRP HA H 1 4.254 . . 1 . . . . . . . . 36 1
14 . 1 1 19 19 TRP HD1 H 1 7.372 . . 1 . . . . . . . . 36 1
15 . 1 1 19 19 TRP HE3 H 1 7.56 . . 1 . . . . . . . . 36 1
16 . 1 1 19 19 TRP HZ2 H 1 7.49 . . 1 . . . . . . . . 36 1
17 . 1 1 19 19 TRP HZ3 H 1 6.851 . . 1 . . . . . . . . 36 1
18 . 1 1 19 19 TRP HH2 H 1 7.028 . . 1 . . . . . . . . 36 1
19 . 1 1 20 20 ILE HB H 1 2.12 . . 1 . . . . . . . . 36 1
20 . 1 1 20 20 ILE HG12 H 1 2.24 . . 1 . . . . . . . . 36 1
21 . 1 1 20 20 ILE HG13 H 1 2.24 . . 1 . . . . . . . . 36 1
22 . 1 1 20 20 ILE HG21 H 1 .921 . . 1 . . . . . . . . 36 1
23 . 1 1 20 20 ILE HG22 H 1 .921 . . 1 . . . . . . . . 36 1
24 . 1 1 20 20 ILE HG23 H 1 .921 . . 1 . . . . . . . . 36 1
stop_
save_