Content for NMR-STAR saveframe, "shift_set_2"
save_shift_set_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_2
_Assigned_chem_shift_list.Entry_ID 5172
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Ex-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 . 5172 2
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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.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 HEM_ox 1HMB H 1 14.25 0.02 . 1 . . . . . . . . 5172 2
2 . 2 2 1 1 HEM_ox 2HMB H 1 14.25 0.02 . 1 . . . . . . . . 5172 2
3 . 2 2 1 1 HEM_ox 3HMB H 1 14.25 0.02 . 1 . . . . . . . . 5172 2
4 . 2 2 1 1 HEM_ox 1HMC H 1 29.18 0.02 . 1 . . . . . . . . 5172 2
5 . 2 2 1 1 HEM_ox 2HMC H 1 29.18 0.02 . 1 . . . . . . . . 5172 2
6 . 2 2 1 1 HEM_ox 3HMC H 1 29.18 0.02 . 1 . . . . . . . . 5172 2
7 . 2 2 1 1 HEM_ox 1HMD H 1 20.11 0.02 . 1 . . . . . . . . 5172 2
8 . 2 2 1 1 HEM_ox 2HMD H 1 20.11 0.02 . 1 . . . . . . . . 5172 2
9 . 2 2 1 1 HEM_ox 3HMD H 1 20.11 0.02 . 1 . . . . . . . . 5172 2
10 . 2 2 1 1 HEM_ox 1HMA H 1 29.75 0.02 . 1 . . . . . . . . 5172 2
11 . 2 2 1 1 HEM_ox 2HMA H 1 29.75 0.02 . 1 . . . . . . . . 5172 2
12 . 2 2 1 1 HEM_ox 3HMA H 1 29.75 0.02 . 1 . . . . . . . . 5172 2
13 . 2 2 1 1 HEM_ox HHA H 1 4.62 0.02 . 1 . . . . . . . . 5172 2
14 . 2 2 1 1 HEM_ox HHB H 1 1.46 0.02 . 1 . . . . . . . . 5172 2
15 . 2 2 1 1 HEM_ox HHC H 1 7.28 0.02 . 1 . . . . . . . . 5172 2
16 . 2 2 1 1 HEM_ox HHD H 1 -0.31 0.02 . 1 . . . . . . . . 5172 2
17 . 2 2 1 1 HEM_ox HAB H 1 -0.21 0.02 . 1 . . . . . . . . 5172 2
18 . 2 2 1 1 HEM_ox 1HBB H 1 -0.71 0.02 . 1 . . . . . . . . 5172 2
19 . 2 2 1 1 HEM_ox 2HBB H 1 -0.71 0.02 . 1 . . . . . . . . 5172 2
20 . 2 2 1 1 HEM_ox 3HBB H 1 -0.71 0.02 . 1 . . . . . . . . 5172 2
21 . 2 2 1 1 HEM_ox HAC H 1 0.83 0.02 . 1 . . . . . . . . 5172 2
22 . 2 2 1 1 HEM_ox 1HBC H 1 1.78 0.02 . 1 . . . . . . . . 5172 2
23 . 2 2 1 1 HEM_ox 2HBC H 1 1.78 0.02 . 1 . . . . . . . . 5172 2
24 . 2 2 1 1 HEM_ox 3HBC H 1 1.78 0.02 . 1 . . . . . . . . 5172 2
25 . 2 2 1 1 HEM_ox 1HAD H 1 5.00 0.02 . 1 . . . . . . . . 5172 2
26 . 2 2 1 1 HEM_ox 2HAD H 1 4.32 0.02 . 1 . . . . . . . . 5172 2
27 . 2 2 1 1 HEM_ox 1HBD H 1 0.76 0.02 . 1 . . . . . . . . 5172 2
28 . 2 2 1 1 HEM_ox 2HBD H 1 0.27 0.02 . 1 . . . . . . . . 5172 2
29 . 2 2 1 1 HEM_ox 1HAA H 1 15.72 0.02 . 1 . . . . . . . . 5172 2
30 . 2 2 1 1 HEM_ox 2HAA H 1 4.45 0.02 . 1 . . . . . . . . 5172 2
31 . 2 2 1 1 HEM_ox 1HBA H 1 -1.72 0.02 . 2 . . . . . . . . 5172 2
32 . 2 2 1 1 HEM_ox 2HBA H 1 -0116 0.02 . 2 . . . . . . . . 5172 2
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