Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34566
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_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 '2D 1H-1H NOESY' . . . 34566 1
2 '2D 1H-13C HSQC aliphatic' . . . 34566 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 30 30 VAL HG11 H 1 0.579 0.002 . 1 . . 20 . A 33 VAL HG11 . 34566 1
2 . 1 . 1 30 30 VAL HG12 H 1 0.579 0.002 . 1 . . 20 . A 33 VAL HG12 . 34566 1
3 . 1 . 1 30 30 VAL HG13 H 1 0.579 0.002 . 1 . . 20 . A 33 VAL HG13 . 34566 1
4 . 1 . 1 30 30 VAL HG21 H 1 -0.536 0.001 . 1 . . 16 . A 33 VAL HG21 . 34566 1
5 . 1 . 1 30 30 VAL HG22 H 1 -0.536 0.001 . 1 . . 16 . A 33 VAL HG22 . 34566 1
6 . 1 . 1 30 30 VAL HG23 H 1 -0.536 0.001 . 1 . . 16 . A 33 VAL HG23 . 34566 1
7 . 1 . 1 30 30 VAL CG1 C 13 19.438 0.001 . 1 . . 21 . A 33 VAL CG1 . 34566 1
8 . 1 . 1 30 30 VAL CG2 C 13 17.720 0.001 . 1 . . 17 . A 33 VAL CG2 . 34566 1
9 . 1 . 1 35 35 LEU HD11 H 1 -0.047 0.001 . 1 . . 24 . A 38 LEU HD11 . 34566 1
10 . 1 . 1 35 35 LEU HD12 H 1 -0.047 0.001 . 1 . . 24 . A 38 LEU HD12 . 34566 1
11 . 1 . 1 35 35 LEU HD13 H 1 -0.047 0.001 . 1 . . 24 . A 38 LEU HD13 . 34566 1
12 . 1 . 1 35 35 LEU HD21 H 1 0.471 0.001 . 1 . . 14 . A 38 LEU HD21 . 34566 1
13 . 1 . 1 35 35 LEU HD22 H 1 0.471 0.001 . 1 . . 14 . A 38 LEU HD22 . 34566 1
14 . 1 . 1 35 35 LEU HD23 H 1 0.471 0.001 . 1 . . 14 . A 38 LEU HD23 . 34566 1
15 . 1 . 1 35 35 LEU CD1 C 13 22.576 0.001 . 1 . . 25 . A 38 LEU CD1 . 34566 1
16 . 1 . 1 35 35 LEU CD2 C 13 18.769 0.001 . 1 . . 15 . A 38 LEU CD2 . 34566 1
17 . 1 . 1 37 37 LEU HD11 H 1 0.189 0.003 . 1 . . 26 . A 40 LEU HD11 . 34566 1
18 . 1 . 1 37 37 LEU HD12 H 1 0.189 0.003 . 1 . . 26 . A 40 LEU HD12 . 34566 1
19 . 1 . 1 37 37 LEU HD13 H 1 0.189 0.003 . 1 . . 26 . A 40 LEU HD13 . 34566 1
20 . 1 . 1 37 37 LEU HD21 H 1 0.750 0.004 . 1 . . 18 . A 40 LEU HD21 . 34566 1
21 . 1 . 1 37 37 LEU HD22 H 1 0.750 0.004 . 1 . . 18 . A 40 LEU HD22 . 34566 1
22 . 1 . 1 37 37 LEU HD23 H 1 0.750 0.004 . 1 . . 18 . A 40 LEU HD23 . 34566 1
23 . 1 . 1 37 37 LEU CD1 C 13 22.769 0.001 . 1 . . 27 . A 40 LEU CD1 . 34566 1
24 . 1 . 1 37 37 LEU CD2 C 13 18.038 0.001 . 1 . . 19 . A 40 LEU CD2 . 34566 1
25 . 1 . 1 89 89 VAL HG11 H 1 -0.268 0.001 . 1 . . 12 . A 92 VAL HG11 . 34566 1
26 . 1 . 1 89 89 VAL HG12 H 1 -0.268 0.001 . 1 . . 12 . A 92 VAL HG12 . 34566 1
27 . 1 . 1 89 89 VAL HG13 H 1 -0.268 0.001 . 1 . . 12 . A 92 VAL HG13 . 34566 1
28 . 1 . 1 89 89 VAL HG21 H 1 0.243 0.002 . 1 . . 22 . A 92 VAL HG21 . 34566 1
29 . 1 . 1 89 89 VAL HG22 H 1 0.243 0.002 . 1 . . 22 . A 92 VAL HG22 . 34566 1
30 . 1 . 1 89 89 VAL HG23 H 1 0.243 0.002 . 1 . . 22 . A 92 VAL HG23 . 34566 1
31 . 1 . 1 89 89 VAL CG1 C 13 20.056 0.001 . 1 . . 13 . A 92 VAL CG1 . 34566 1
32 . 1 . 1 89 89 VAL CG2 C 13 18.302 0.001 . 1 . . 23 . A 92 VAL CG2 . 34566 1
33 . 2 . 2 1 1 EAM H1 H 1 1.252 0.001 . 1 . . 1 . A 201 EAM H1 . 34566 1
34 . 2 . 2 1 1 EAM H1A H 1 1.252 0.001 . 1 . . 1 . A 201 EAM H1A . 34566 1
35 . 2 . 2 1 1 EAM H1B H 1 1.252 0.001 . 1 . . 1 . A 201 EAM H1B . 34566 1
36 . 2 . 2 1 1 EAM H21 H 1 2.004 0.001 . 1 . . 2 . A 201 EAM H21 . 34566 1
37 . 2 . 2 1 1 EAM H21A H 1 2.004 0.001 . 1 . . 2 . A 201 EAM H21A . 34566 1
38 . 2 . 2 1 1 EAM H21B H 1 2.004 0.001 . 1 . . 2 . A 201 EAM H21B . 34566 1
39 . 2 . 2 1 1 EAM H4 H 1 2.862 0.001 . 2 . . 3 . A 201 EAM H4 . 34566 1
40 . 2 . 2 1 1 EAM H2 H 1 3.318 0.001 . 2 . . 4 . A 201 EAM H2 . 34566 1
41 . 2 . 2 1 1 EAM H2A H 1 3.502 0.001 . 2 . . 5 . A 201 EAM H2A . 34566 1
42 . 2 . 2 1 1 EAM H4A H 1 4.470 0.002 . 2 . . 6 . A 201 EAM H4A . 34566 1
43 . 2 . 2 1 1 EAM H16 H 1 4.033 0.001 . 1 . . 7 . A 201 EAM H16 . 34566 1
44 . 2 . 2 1 1 EAM H16A H 1 4.033 0.001 . 1 . . 7 . A 201 EAM H16A . 34566 1
45 . 2 . 2 1 1 EAM H16B H 1 4.033 0.001 . 1 . . 7 . A 201 EAM H16B . 34566 1
46 . 2 . 2 1 1 EAM H5 H 1 4.245 0.001 . 1 . . 8 . A 201 EAM H5 . 34566 1
47 . 2 . 2 1 1 EAM H17 H 1 7.688 0.001 . 1 . . 9 . A 201 EAM H17 . 34566 1
48 . 2 . 2 1 1 EAM H18 H 1 7.358 0.002 . 1 . . 10 . A 201 EAM H18 . 34566 1
49 . 2 . 2 1 1 EAM H14 H 1 7.101 0.002 . 1 . . 11 . A 201 EAM H14 . 34566 1
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