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 236
_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 . 236 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 18 18 ILE H H 1 8.12 . . 1 . . . . . . . . 236 1
2 . 1 1 18 18 ILE HA H 1 4.25 . . 1 . . . . . . . . 236 1
3 . 1 1 18 18 ILE HB H 1 1.86 . . 1 . . . . . . . . 236 1
4 . 1 1 20 20 ARG H H 1 8.39 . . 1 . . . . . . . . 236 1
5 . 1 1 20 20 ARG HA H 1 4.7 . . 1 . . . . . . . . 236 1
6 . 1 1 20 20 ARG HB2 H 1 1.62 . . 1 . . . . . . . . 236 1
7 . 1 1 20 20 ARG HB3 H 1 1.62 . . 1 . . . . . . . . 236 1
8 . 1 1 21 21 TYR H H 1 9.18 . . 1 . . . . . . . . 236 1
9 . 1 1 21 21 TYR HA H 1 5.7 . . 1 . . . . . . . . 236 1
10 . 1 1 21 21 TYR HB2 H 1 2.69 . . 1 . . . . . . . . 236 1
11 . 1 1 21 21 TYR HB3 H 1 2.69 . . 1 . . . . . . . . 236 1
12 . 1 1 22 22 PHE H H 1 9.79 . . 1 . . . . . . . . 236 1
13 . 1 1 22 22 PHE HA H 1 5.25 . . 1 . . . . . . . . 236 1
14 . 1 1 22 22 PHE HB2 H 1 2.81 . . 2 . . . . . . . . 236 1
15 . 1 1 22 22 PHE HB3 H 1 2.87 . . 2 . . . . . . . . 236 1
16 . 1 1 23 23 TYR H H 1 10.55 . . 1 . . . . . . . . 236 1
17 . 1 1 23 23 TYR HA H 1 4.31 . . 1 . . . . . . . . 236 1
18 . 1 1 23 23 TYR HB2 H 1 2.72 . . 2 . . . . . . . . 236 1
19 . 1 1 23 23 TYR HB3 H 1 3.45 . . 2 . . . . . . . . 236 1
20 . 1 1 24 24 ASN H H 1 7.78 . . 1 . . . . . . . . 236 1
21 . 1 1 24 24 ASN HA H 1 4.41 . . 1 . . . . . . . . 236 1
22 . 1 1 24 24 ASN HB2 H 1 2.69 . . 1 . . . . . . . . 236 1
23 . 1 1 24 24 ASN HB3 H 1 2.69 . . 1 . . . . . . . . 236 1
24 . 1 1 30 30 CYS H H 1 8.4 . . 1 . . . . . . . . 236 1
25 . 1 1 30 30 CYS HA H 1 5.6 . . 1 . . . . . . . . 236 1
26 . 1 1 30 30 CYS HB2 H 1 2.67 . . 2 . . . . . . . . 236 1
27 . 1 1 30 30 CYS HB3 H 1 3.69 . . 2 . . . . . . . . 236 1
28 . 1 1 31 31 GLN H H 1 8.77 . . 1 . . . . . . . . 236 1
29 . 1 1 31 31 GLN HA H 1 4.87 . . 1 . . . . . . . . 236 1
30 . 1 1 32 32 THR H H 1 8.07 . . 1 . . . . . . . . 236 1
31 . 1 1 32 32 THR HA H 1 5.28 . . 1 . . . . . . . . 236 1
32 . 1 1 32 32 THR HB H 1 4 . . 1 . . . . . . . . 236 1
33 . 1 1 33 33 PHE H H 1 9.37 . . 1 . . . . . . . . 236 1
34 . 1 1 33 33 PHE HA H 1 4.89 . . 1 . . . . . . . . 236 1
35 . 1 1 35 35 TYR H H 1 9.39 . . 1 . . . . . . . . 236 1
36 . 1 1 35 35 TYR HA H 1 4.89 . . 1 . . . . . . . . 236 1
37 . 1 1 35 35 TYR HB2 H 1 2.52 . . 2 . . . . . . . . 236 1
38 . 1 1 35 35 TYR HB3 H 1 2.69 . . 2 . . . . . . . . 236 1
39 . 1 1 36 36 GLY H H 1 8.61 . . 1 . . . . . . . . 236 1
40 . 1 1 45 45 PHE H H 1 9.94 . . 1 . . . . . . . . 236 1
41 . 1 1 45 45 PHE HA H 1 5.12 . . 1 . . . . . . . . 236 1
42 . 1 1 45 45 PHE HB2 H 1 2.79 . . 1 . . . . . . . . 236 1
43 . 1 1 45 45 PHE HB3 H 1 2.79 . . 1 . . . . . . . . 236 1
44 . 1 1 52 52 MET H H 1 8.58 . . 1 . . . . . . . . 236 1
45 . 1 1 55 55 CYS H H 1 8.25 . . 1 . . . . . . . . 236 1
46 . 1 1 55 55 CYS HA H 1 4.31 . . 1 . . . . . . . . 236 1
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save_