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 1183
_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 . 1183 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 28 28 LEU HG H 1 .63 0.01 . 1 . . . . . . . . 1183 1
2 . 1 1 28 28 LEU HD11 H 1 .03 0.01 . 2 . . . . . . . . 1183 1
3 . 1 1 28 28 LEU HD12 H 1 .03 0.01 . 2 . . . . . . . . 1183 1
4 . 1 1 28 28 LEU HD13 H 1 .03 0.01 . 2 . . . . . . . . 1183 1
5 . 1 1 28 28 LEU HD21 H 1 .61 0.01 . 2 . . . . . . . . 1183 1
6 . 1 1 28 28 LEU HD22 H 1 .61 0.01 . 2 . . . . . . . . 1183 1
7 . 1 1 28 28 LEU HD23 H 1 .61 0.01 . 2 . . . . . . . . 1183 1
8 . 1 1 42 42 PHE HD1 H 1 6.33 0.01 . 1 . . . . . . . . 1183 1
9 . 1 1 42 42 PHE HD2 H 1 6.33 0.01 . 1 . . . . . . . . 1183 1
10 . 1 1 42 42 PHE HE1 H 1 6.03 0.01 . 1 . . . . . . . . 1183 1
11 . 1 1 42 42 PHE HE2 H 1 6.03 0.01 . 1 . . . . . . . . 1183 1
12 . 1 1 42 42 PHE HZ H 1 4.86 0.01 . 1 . . . . . . . . 1183 1
13 . 1 1 45 45 PHE HD1 H 1 6.93 0.01 . 1 . . . . . . . . 1183 1
14 . 1 1 45 45 PHE HD2 H 1 6.93 0.01 . 1 . . . . . . . . 1183 1
15 . 1 1 45 45 PHE HE1 H 1 6.82 0.01 . 1 . . . . . . . . 1183 1
16 . 1 1 45 45 PHE HE2 H 1 6.82 0.01 . 1 . . . . . . . . 1183 1
17 . 1 1 45 45 PHE HZ H 1 6.24 0.01 . 1 . . . . . . . . 1183 1
18 . 1 1 63 63 HIS HE1 H 1 8.21 0.01 . 1 . . . . . . . . 1183 1
19 . 1 1 67 67 VAL H H 1 7.2 0.01 . 1 . . . . . . . . 1183 1
20 . 1 1 67 67 VAL HA H 1 3.58 0.01 . 1 . . . . . . . . 1183 1
21 . 1 1 67 67 VAL HG11 H 1 .16 0.01 . 2 . . . . . . . . 1183 1
22 . 1 1 67 67 VAL HG12 H 1 .16 0.01 . 2 . . . . . . . . 1183 1
23 . 1 1 67 67 VAL HG13 H 1 .16 0.01 . 2 . . . . . . . . 1183 1
24 . 1 1 67 67 VAL HG21 H 1 1.87 0.01 . 2 . . . . . . . . 1183 1
25 . 1 1 67 67 VAL HG22 H 1 1.87 0.01 . 2 . . . . . . . . 1183 1
26 . 1 1 67 67 VAL HG23 H 1 1.87 0.01 . 2 . . . . . . . . 1183 1
27 . 1 1 70 70 ALA HA H 1 4.9 0.01 . 1 . . . . . . . . 1183 1
28 . 1 1 70 70 ALA HB1 H 1 2.5 0.01 . 1 . . . . . . . . 1183 1
29 . 1 1 70 70 ALA HB2 H 1 2.5 0.01 . 1 . . . . . . . . 1183 1
30 . 1 1 70 70 ALA HB3 H 1 2.5 0.01 . 1 . . . . . . . . 1183 1
31 . 1 1 77 77 HIS HD2 H 1 7.44 0.01 . 1 . . . . . . . . 1183 1
32 . 1 1 77 77 HIS HE1 H 1 8.61 0.01 . 1 . . . . . . . . 1183 1
33 . 1 1 88 88 LEU HD11 H 1 .7 0.01 . 2 . . . . . . . . 1183 1
34 . 1 1 88 88 LEU HD12 H 1 .7 0.01 . 2 . . . . . . . . 1183 1
35 . 1 1 88 88 LEU HD13 H 1 .7 0.01 . 2 . . . . . . . . 1183 1
36 . 1 1 88 88 LEU HD21 H 1 1.05 0.01 . 2 . . . . . . . . 1183 1
37 . 1 1 88 88 LEU HD22 H 1 1.05 0.01 . 2 . . . . . . . . 1183 1
38 . 1 1 88 88 LEU HD23 H 1 1.05 0.01 . 2 . . . . . . . . 1183 1
39 . 1 1 103 103 PHE HD1 H 1 7.5 0.01 . 1 . . . . . . . . 1183 1
40 . 1 1 103 103 PHE HD2 H 1 7.5 0.01 . 1 . . . . . . . . 1183 1
41 . 1 1 103 103 PHE HE1 H 1 6.03 0.01 . 1 . . . . . . . . 1183 1
42 . 1 1 103 103 PHE HE2 H 1 6.03 0.01 . 1 . . . . . . . . 1183 1
43 . 1 1 103 103 PHE HZ H 1 6.58 0.01 . 1 . . . . . . . . 1183 1
44 . 1 1 106 106 LEU HD11 H 1 .5 0.01 . 1 . . . . . . . . 1183 1
45 . 1 1 106 106 LEU HD12 H 1 .5 0.01 . 1 . . . . . . . . 1183 1
46 . 1 1 106 106 LEU HD13 H 1 .5 0.01 . 1 . . . . . . . . 1183 1
47 . 1 1 106 106 LEU HD21 H 1 .5 0.01 . 1 . . . . . . . . 1183 1
48 . 1 1 106 106 LEU HD22 H 1 .5 0.01 . 1 . . . . . . . . 1183 1
49 . 1 1 106 106 LEU HD23 H 1 .5 0.01 . 1 . . . . . . . . 1183 1
50 . 1 1 116 116 HIS HE1 H 1 8.18 0.01 . 1 . . . . . . . . 1183 1
51 . 1 1 117 117 HIS HE1 H 1 8.11 0.01 . 1 . . . . . . . . 1183 1
52 . 1 1 141 141 LEU HG H 1 .54 0.01 . 1 . . . . . . . . 1183 1
53 . 1 1 141 141 LEU HD11 H 1 -.64 0.01 . 1 . . . . . . . . 1183 1
54 . 1 1 141 141 LEU HD12 H 1 -.64 0.01 . 1 . . . . . . . . 1183 1
55 . 1 1 141 141 LEU HD13 H 1 -.64 0.01 . 1 . . . . . . . . 1183 1
56 . 1 1 141 141 LEU HD21 H 1 -.64 0.01 . 1 . . . . . . . . 1183 1
57 . 1 1 141 141 LEU HD22 H 1 -.64 0.01 . 1 . . . . . . . . 1183 1
58 . 1 1 141 141 LEU HD23 H 1 -.64 0.01 . 1 . . . . . . . . 1183 1
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