Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 5089
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 '1H TOCSY' 1 $sample_1 . 5089 1
2 '1H NOESY' 1 $sample_1 . 5089 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 . 2 2 1 1 HEC HMB1 H 1 18.54 0.05 . 1 . . . . . . . . 5089 1
2 . 2 2 1 1 HEC HMB2 H 1 18.54 0.05 . 1 . . . . . . . . 5089 1
3 . 2 2 1 1 HEC HMB3 H 1 18.54 0.05 . 1 . . . . . . . . 5089 1
4 . 2 2 1 1 HEC HMC1 H 1 21.83 0.05 . 1 . . . . . . . . 5089 1
5 . 2 2 1 1 HEC HMC2 H 1 21.83 0.05 . 1 . . . . . . . . 5089 1
6 . 2 2 1 1 HEC HMC3 H 1 21.83 0.05 . 1 . . . . . . . . 5089 1
7 . 2 2 1 1 HEC HAC H 1 0.20 0.05 . 1 . . . . . . . . 5089 1
8 . 2 2 1 1 HEC HBC1 H 1 1.09 0.05 . 1 . . . . . . . . 5089 1
9 . 2 2 1 1 HEC HBC2 H 1 1.09 0.05 . 1 . . . . . . . . 5089 1
10 . 2 2 1 1 HEC HBC3 H 1 1.09 0.05 . 1 . . . . . . . . 5089 1
11 . 2 2 1 1 HEC HMD1 H 1 23.24 0.05 . 1 . . . . . . . . 5089 1
12 . 2 2 1 1 HEC HMD2 H 1 23.24 0.05 . 1 . . . . . . . . 5089 1
13 . 2 2 1 1 HEC HMD3 H 1 23.24 0.05 . 1 . . . . . . . . 5089 1
14 . 2 2 1 1 HEC HAD1 H 1 3.83 0.05 . 2 . . . . . . . . 5089 1
15 . 2 2 1 1 HEC HAA1 H 1 12.88 0.05 . 2 . . . . . . . . 5089 1
16 . 2 2 1 1 HEC HAA2 H 1 1.97 0.05 . 2 . . . . . . . . 5089 1
17 . 2 2 1 1 HEC HMA1 H 1 23.96 0.05 . 1 . . . . . . . . 5089 1
18 . 2 2 1 1 HEC HMA2 H 1 23.96 0.05 . 1 . . . . . . . . 5089 1
19 . 2 2 1 1 HEC HMA3 H 1 23.96 0.05 . 1 . . . . . . . . 5089 1
20 . 2 2 1 1 HEC HHC H 1 -0.42 0.05 . 1 . . . . . . . . 5089 1
21 . 2 2 1 1 HEC HHD H 1 9.28 0.05 . 1 . . . . . . . . 5089 1
22 . 2 2 1 1 HEC HHA H 1 -1.17 0.05 . 1 . . . . . . . . 5089 1
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save_