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 36166
_Assigned_chem_shift_list.ID 1
_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 .
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_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' 1 $sample_1 isotropic 36166 1
2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36166 1
3 '2D 1H-13C HSQC aliphatic' 1 $sample_1 isotropic 36166 1
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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.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 5 5 LYS HE2 H 1 2.728 0.030 . 2 . . . . A 5 LYS HE2 . 36166 1
2 . 1 1 5 5 LYS HE3 H 1 2.728 0.030 . 2 . . . . A 5 LYS HE3 . 36166 1
3 . 1 1 5 5 LYS CE C 13 41.651 0.000 . 1 . . . . A 5 LYS CE . 36166 1
4 . 1 1 7 7 VAL HG21 H 1 0.998 0.010 . 2 . . . . A 7 VAL HG21 . 36166 1
5 . 1 1 7 7 VAL HG22 H 1 0.998 0.010 . 2 . . . . A 7 VAL HG22 . 36166 1
6 . 1 1 7 7 VAL HG23 H 1 0.998 0.010 . 2 . . . . A 7 VAL HG23 . 36166 1
7 . 1 1 7 7 VAL CG2 C 13 22.315 0.000 . 1 . . . . A 7 VAL CG2 . 36166 1
8 . 1 1 56 56 LEU HD21 H 1 0.543 0.010 . 2 . . . . A 56 LEU HD21 . 36166 1
9 . 1 1 56 56 LEU HD22 H 1 0.543 0.010 . 2 . . . . A 56 LEU HD22 . 36166 1
10 . 1 1 56 56 LEU HD23 H 1 0.543 0.010 . 2 . . . . A 56 LEU HD23 . 36166 1
11 . 1 1 56 56 LEU CD2 C 13 24.120 0.000 . 1 . . . . A 56 LEU CD2 . 36166 1
12 . 1 1 67 67 MET HE1 H 1 2.026 0.002 . 1 . . . . A 67 MET HE1 . 36166 1
13 . 1 1 67 67 MET HE2 H 1 2.026 0.002 . 1 . . . . A 67 MET HE2 . 36166 1
14 . 1 1 67 67 MET HE3 H 1 2.026 0.002 . 1 . . . . A 67 MET HE3 . 36166 1
15 . 1 1 67 67 MET CE C 13 17.159 0.000 . 1 . . . . A 67 MET CE . 36166 1
16 . 1 1 74 74 THR HG21 H 1 1.209 0.006 . 1 . . . . A 74 THR HG21 . 36166 1
17 . 1 1 74 74 THR HG22 H 1 1.209 0.006 . 1 . . . . A 74 THR HG22 . 36166 1
18 . 1 1 74 74 THR HG23 H 1 1.209 0.006 . 1 . . . . A 74 THR HG23 . 36166 1
19 . 1 1 74 74 THR CG2 C 13 55.057 0.000 . 1 . . . . A 74 THR CG2 . 36166 1
20 . 3 3 1 1 KBF H1 H 1 7.330 0.000 . 1 . . . . A 202 KBF H1 . 36166 1
21 . 3 3 1 1 KBF H2 H 1 7.757 0.000 . 1 . . . . A 202 KBF H2 . 36166 1
22 . 3 3 1 1 KBF H3 H 1 7.553 0.000 . 1 . . . . A 202 KBF H3 . 36166 1
23 . 3 3 1 1 KBF H4 H 1 7.397 0.000 . 1 . . . . A 202 KBF H4 . 36166 1
24 . 3 3 1 1 KBF H5 H 1 7.923 0.000 . 1 . . . . A 202 KBF H5 . 36166 1
25 . 3 3 1 1 KBF H6 H 1 8.403 0.000 . 1 . . . . A 202 KBF H6 . 36166 1
26 . 3 3 1 1 KBF H11 H 1 1.670 0.000 . 1 . . . . A 202 KBF H11 . 36166 1
27 . 3 3 1 1 KBF H12 H 1 1.974 0.000 . 2 . . . . A 202 KBF H12 . 36166 1
28 . 3 3 1 1 KBF H13 H 1 1.974 0.000 . 2 . . . . A 202 KBF H13 . 36166 1
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save_