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 405
_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 . 405 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 4 4 VAL HG11 H 1 1.1 . . 1 . . . . . . . . 405 1
2 . 1 1 4 4 VAL HG12 H 1 1.1 . . 1 . . . . . . . . 405 1
3 . 1 1 4 4 VAL HG13 H 1 1.1 . . 1 . . . . . . . . 405 1
4 . 1 1 13 13 PHE HD1 H 1 6.97 . . 1 . . . . . . . . 405 1
5 . 1 1 13 13 PHE HD2 H 1 6.97 . . 1 . . . . . . . . 405 1
6 . 1 1 13 13 PHE HE1 H 1 7.31 . . 1 . . . . . . . . 405 1
7 . 1 1 13 13 PHE HE2 H 1 7.31 . . 1 . . . . . . . . 405 1
8 . 1 1 13 13 PHE HZ H 1 7.31 . . 1 . . . . . . . . 405 1
9 . 1 1 26 26 TYR HD1 H 1 6.91 . . 1 . . . . . . . . 405 1
10 . 1 1 26 26 TYR HD2 H 1 6.91 . . 1 . . . . . . . . 405 1
11 . 1 1 26 26 TYR HE1 H 1 6.5 . . 1 . . . . . . . . 405 1
12 . 1 1 26 26 TYR HE2 H 1 6.5 . . 1 . . . . . . . . 405 1
13 . 1 1 28 28 LEU HD11 H 1 .88 . . 2 . . . . . . . . 405 1
14 . 1 1 28 28 LEU HD12 H 1 .88 . . 2 . . . . . . . . 405 1
15 . 1 1 28 28 LEU HD13 H 1 .88 . . 2 . . . . . . . . 405 1
16 . 1 1 28 28 LEU HD21 H 1 .93 . . 2 . . . . . . . . 405 1
17 . 1 1 28 28 LEU HD22 H 1 .93 . . 2 . . . . . . . . 405 1
18 . 1 1 28 28 LEU HD23 H 1 .93 . . 2 . . . . . . . . 405 1
19 . 1 1 34 34 TYR HD1 H 1 7.03 . . 1 . . . . . . . . 405 1
20 . 1 1 34 34 TYR HD2 H 1 6.75 . . 1 . . . . . . . . 405 1
21 . 1 1 34 34 TYR HE1 H 1 6.87 . . 1 . . . . . . . . 405 1
22 . 1 1 34 34 TYR HE2 H 1 6.91 . . 1 . . . . . . . . 405 1
23 . 1 1 35 35 VAL HG11 H 1 1.25 . . 1 . . . . . . . . 405 1
24 . 1 1 35 35 VAL HG12 H 1 1.25 . . 1 . . . . . . . . 405 1
25 . 1 1 35 35 VAL HG13 H 1 1.25 . . 1 . . . . . . . . 405 1
26 . 1 1 35 35 VAL HG21 H 1 1.25 . . 1 . . . . . . . . 405 1
27 . 1 1 35 35 VAL HG22 H 1 1.25 . . 1 . . . . . . . . 405 1
28 . 1 1 35 35 VAL HG23 H 1 1.25 . . 1 . . . . . . . . 405 1
29 . 1 1 41 41 TYR HD1 H 1 6.89 . . 1 . . . . . . . . 405 1
30 . 1 1 41 41 TYR HD2 H 1 6.89 . . 1 . . . . . . . . 405 1
31 . 1 1 41 41 TYR HE1 H 1 6.74 . . 1 . . . . . . . . 405 1
32 . 1 1 41 41 TYR HE2 H 1 6.74 . . 1 . . . . . . . . 405 1
33 . 1 1 56 56 TYR HD1 H 1 7.16 . . 1 . . . . . . . . 405 1
34 . 1 1 56 56 TYR HD2 H 1 7.16 . . 1 . . . . . . . . 405 1
35 . 1 1 56 56 TYR HE1 H 1 6.84 . . 1 . . . . . . . . 405 1
36 . 1 1 56 56 TYR HE2 H 1 6.84 . . 1 . . . . . . . . 405 1
37 . 1 1 61 61 TYR HD1 H 1 6.64 . . 1 . . . . . . . . 405 1
38 . 1 1 61 61 TYR HD2 H 1 6.64 . . 1 . . . . . . . . 405 1
39 . 1 1 61 61 TYR HE1 H 1 6.81 . . 1 . . . . . . . . 405 1
40 . 1 1 61 61 TYR HE2 H 1 6.81 . . 1 . . . . . . . . 405 1
41 . 1 1 64 64 HIS HD2 H 1 7.24 . . 1 . . . . . . . . 405 1
42 . 1 1 64 64 HIS HE1 H 1 8.03 . . 1 . . . . . . . . 405 1
43 . 1 1 68 68 PHE HD1 H 1 7.44 . . 1 . . . . . . . . 405 1
44 . 1 1 68 68 PHE HD2 H 1 7.44 . . 1 . . . . . . . . 405 1
45 . 1 1 68 68 PHE HE1 H 1 7.23 . . 1 . . . . . . . . 405 1
46 . 1 1 68 68 PHE HE2 H 1 7.23 . . 1 . . . . . . . . 405 1
47 . 1 1 68 68 PHE HZ H 1 7.02 . . 1 . . . . . . . . 405 1
48 . 1 1 73 73 PHE HD1 H 1 7.42 . . 1 . . . . . . . . 405 1
49 . 1 1 73 73 PHE HD2 H 1 7.42 . . 1 . . . . . . . . 405 1
50 . 1 1 73 73 PHE HE1 H 1 7.35 . . 1 . . . . . . . . 405 1
51 . 1 1 73 73 PHE HE2 H 1 7.35 . . 1 . . . . . . . . 405 1
52 . 1 1 73 73 PHE HZ H 1 7.35 . . 1 . . . . . . . . 405 1
53 . 1 1 83 83 LEU HD11 H 1 .37 . . 1 . . . . . . . . 405 1
54 . 1 1 83 83 LEU HD12 H 1 .37 . . 1 . . . . . . . . 405 1
55 . 1 1 83 83 LEU HD13 H 1 .37 . . 1 . . . . . . . . 405 1
56 . 1 1 83 83 LEU HD21 H 1 -.52 . . 1 . . . . . . . . 405 1
57 . 1 1 83 83 LEU HD22 H 1 -.52 . . 1 . . . . . . . . 405 1
58 . 1 1 83 83 LEU HD23 H 1 -.52 . . 1 . . . . . . . . 405 1
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save_