Content for NMR-STAR saveframe, "chemical_shift_set_3"
save_chemical_shift_set_3
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_3
_Assigned_chem_shift_list.Entry_ID 5279
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_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 $sample_1 . 5279 3
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 . 3 2 1 1 HEC HHC H 1 -1.402 . . . . . . . . . . . 5279 3
2 . 3 2 1 1 HEC HAD1 H 1 17.774 . . . . . . . . . . . 5279 3
3 . 3 2 1 1 HEC HAA1 H 1 4.686 . . . . . . . . . . . 5279 3
4 . 3 2 1 1 HEC HAA2 H 1 3.105 . . . . . . . . . . . 5279 3
5 . 3 2 1 1 HEC HHD H 1 10.259 . . . . . . . . . . . 5279 3
6 . 3 2 1 1 HEC HBD2 H 1 -1.075 . . . . . . . . . . . 5279 3
7 . 3 2 1 1 HEC HBA1 H 1 -1.195 . . . . . . . . . . . 5279 3
8 . 3 2 1 1 HEC HBA2 H 1 -1.318 . . . . . . . . . . . 5279 3
9 . 3 2 1 1 HEC HAB H 1 -1.721 . . . . . . . . . . . 5279 3
10 . 3 2 1 1 HEC HAC H 1 -0.778 . . . . . . . . . . . 5279 3
11 . 3 2 1 1 HEC HMB1 H 1 14.63 . . . . . . . . . . . 5279 3
12 . 3 2 1 1 HEC HMB2 H 1 14.63 . . . . . . . . . . . 5279 3
13 . 3 2 1 1 HEC HMB3 H 1 14.63 . . . . . . . . . . . 5279 3
14 . 3 2 1 1 HEC HMC1 H 1 14.375 . . . . . . . . . . . 5279 3
15 . 3 2 1 1 HEC HMC2 H 1 14.375 . . . . . . . . . . . 5279 3
16 . 3 2 1 1 HEC HMC3 H 1 14.375 . . . . . . . . . . . 5279 3
17 . 3 2 1 1 HEC HMD1 H 1 18.124 . . . . . . . . . . . 5279 3
18 . 3 2 1 1 HEC HMD2 H 1 18.124 . . . . . . . . . . . 5279 3
19 . 3 2 1 1 HEC HMD3 H 1 18.124 . . . . . . . . . . . 5279 3
20 . 3 2 1 1 HEC HMA1 H 1 -0.841 . . . . . . . . . . . 5279 3
21 . 3 2 1 1 HEC HMA2 H 1 -0.841 . . . . . . . . . . . 5279 3
22 . 3 2 1 1 HEC HMA3 H 1 -0.841 . . . . . . . . . . . 5279 3
23 . 3 2 1 1 HEC HBB1 H 1 -1.37 . . . . . . . . . . . 5279 3
24 . 3 2 1 1 HEC HBB2 H 1 -1.37 . . . . . . . . . . . 5279 3
25 . 3 2 1 1 HEC HBB3 H 1 -1.37 . . . . . . . . . . . 5279 3
26 . 3 2 1 1 HEC HBC1 H 1 -0.789 . . . . . . . . . . . 5279 3
27 . 3 2 1 1 HEC HBC2 H 1 -0.789 . . . . . . . . . . . 5279 3
28 . 3 2 1 1 HEC HBC3 H 1 -0.789 . . . . . . . . . . . 5279 3
stop_
save_