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 258
_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 . 258 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 HA H 1 4.05 . . 1 . . . . . . . . 258 1
2 . 1 1 23 23 PHE HB2 H 1 3.3 . . 2 . . . . . . . . 258 1
3 . 1 1 23 23 PHE HB3 H 1 3.14 . . 2 . . . . . . . . 258 1
4 . 1 1 23 23 PHE HD1 H 1 6.66 . . 1 . . . . . . . . 258 1
5 . 1 1 23 23 PHE HD2 H 1 6.66 . . 1 . . . . . . . . 258 1
6 . 1 1 23 23 PHE HE1 H 1 6.97 . . 1 . . . . . . . . 258 1
7 . 1 1 23 23 PHE HE2 H 1 6.97 . . 1 . . . . . . . . 258 1
8 . 1 1 23 23 PHE HZ H 1 7.49 . . 1 . . . . . . . . 258 1
9 . 1 1 34 34 ILE HB H 1 1.46 . . 1 . . . . . . . . 258 1
10 . 1 1 34 34 ILE HG12 H 1 .74 . . 2 . . . . . . . . 258 1
11 . 1 1 34 34 ILE HG13 H 1 .98 . . 2 . . . . . . . . 258 1
12 . 1 1 34 34 ILE HG21 H 1 .2 . . 1 . . . . . . . . 258 1
13 . 1 1 34 34 ILE HG22 H 1 .2 . . 1 . . . . . . . . 258 1
14 . 1 1 34 34 ILE HG23 H 1 .2 . . 1 . . . . . . . . 258 1
15 . 1 1 34 34 ILE HD11 H 1 -.1 . . 1 . . . . . . . . 258 1
16 . 1 1 34 34 ILE HD12 H 1 -.1 . . 1 . . . . . . . . 258 1
17 . 1 1 34 34 ILE HD13 H 1 -.1 . . 1 . . . . . . . . 258 1
18 . 1 1 62 62 VAL HB H 1 1.77 . . 1 . . . . . . . . 258 1
19 . 1 1 62 62 VAL HG11 H 1 .56 . . 1 . . . . . . . . 258 1
20 . 1 1 62 62 VAL HG12 H 1 .56 . . 1 . . . . . . . . 258 1
21 . 1 1 62 62 VAL HG13 H 1 .56 . . 1 . . . . . . . . 258 1
22 . 1 1 62 62 VAL HG21 H 1 .56 . . 1 . . . . . . . . 258 1
23 . 1 1 62 62 VAL HG22 H 1 .56 . . 1 . . . . . . . . 258 1
24 . 1 1 62 62 VAL HG23 H 1 .56 . . 1 . . . . . . . . 258 1
25 . 1 1 69 69 THR HA H 1 5.39 . . 1 . . . . . . . . 258 1
26 . 1 1 69 69 THR HB H 1 4.02 . . 1 . . . . . . . . 258 1
27 . 1 1 69 69 THR HG21 H 1 1.02 . . 1 . . . . . . . . 258 1
28 . 1 1 69 69 THR HG22 H 1 1.02 . . 1 . . . . . . . . 258 1
29 . 1 1 69 69 THR HG23 H 1 1.02 . . 1 . . . . . . . . 258 1
30 . 1 1 70 70 ILE HA H 1 4.84 . . 1 . . . . . . . . 258 1
31 . 1 1 70 70 ILE HB H 1 1.85 . . 1 . . . . . . . . 258 1
32 . 1 1 70 70 ILE HG21 H 1 .98 . . 1 . . . . . . . . 258 1
33 . 1 1 70 70 ILE HG22 H 1 .98 . . 1 . . . . . . . . 258 1
34 . 1 1 70 70 ILE HG23 H 1 .98 . . 1 . . . . . . . . 258 1
35 . 1 1 71 71 ASP HA H 1 5.66 . . 1 . . . . . . . . 258 1
36 . 1 1 71 71 ASP HB2 H 1 2.82 . . 2 . . . . . . . . 258 1
37 . 1 1 71 71 ASP HB3 H 1 3.26 . . 2 . . . . . . . . 258 1
38 . 1 1 72 72 PHE HA H 1 3.54 . . 1 . . . . . . . . 258 1
39 . 1 1 72 72 PHE HB2 H 1 2.51 . . 2 . . . . . . . . 258 1
40 . 1 1 72 72 PHE HB3 H 1 2.7 . . 2 . . . . . . . . 258 1
41 . 1 1 72 72 PHE HD1 H 1 6.46 . . 1 . . . . . . . . 258 1
42 . 1 1 72 72 PHE HD2 H 1 6.46 . . 1 . . . . . . . . 258 1
43 . 1 1 72 72 PHE HE1 H 1 7.08 . . 1 . . . . . . . . 258 1
44 . 1 1 72 72 PHE HE2 H 1 7.08 . . 1 . . . . . . . . 258 1
45 . 1 1 72 72 PHE HZ H 1 7.41 . . 1 . . . . . . . . 258 1
46 . 1 1 125 125 HIS HD2 H 1 7.06 . . 1 . . . . . . . . 258 1
47 . 1 1 125 125 HIS HE1 H 1 8.01 . . 1 . . . . . . . . 258 1
stop_
save_