Content for NMR-STAR saveframe, "shift_set_1"
save_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_1
_Assigned_chem_shift_list.Entry_ID 5811
_Assigned_chem_shift_list.ID 1
_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 . 5811 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 . 1 1 1 1 GLY HA2 H 1 3.89 0.02 . 1 . . . . . . . . 5811 1
2 . 1 1 1 1 GLY HA3 H 1 3.89 0.02 . 1 . . . . . . . . 5811 1
3 . 1 1 2 2 GLY H H 1 8.67 0.02 . 1 . . . . . . . . 5811 1
4 . 1 1 2 2 GLY HA2 H 1 4.03 0.02 . 1 . . . . . . . . 5811 1
5 . 1 1 2 2 GLY HA3 H 1 4.03 0.02 . 1 . . . . . . . . 5811 1
6 . 1 1 3 3 ARG H H 1 8.55 0.02 . 1 . . . . . . . . 5811 1
7 . 1 1 3 3 ARG HA H 1 4.31 0.02 . 1 . . . . . . . . 5811 1
8 . 1 1 3 3 ARG HB2 H 1 1.75 0.02 . 2 . . . . . . . . 5811 1
9 . 1 1 3 3 ARG HB3 H 1 1.83 0.02 . 2 . . . . . . . . 5811 1
10 . 1 1 3 3 ARG HG2 H 1 1.62 0.02 . 1 . . . . . . . . 5811 1
11 . 1 1 3 3 ARG HG3 H 1 1.62 0.02 . 1 . . . . . . . . 5811 1
12 . 1 1 3 3 ARG HD2 H 1 3.17 0.02 . 1 . . . . . . . . 5811 1
13 . 1 1 3 3 ARG HD3 H 1 3.17 0.02 . 1 . . . . . . . . 5811 1
14 . 1 1 3 3 ARG HE H 1 7.41 0.02 . 1 . . . . . . . . 5811 1
15 . 1 1 4 4 ARG H H 1 8.75 0.02 . 1 . . . . . . . . 5811 1
16 . 1 1 4 4 ARG HA H 1 4.36 0.02 . 1 . . . . . . . . 5811 1
17 . 1 1 4 4 ARG HB2 H 1 1.77 0.02 . 2 . . . . . . . . 5811 1
18 . 1 1 4 4 ARG HB3 H 1 1.86 0.02 . 2 . . . . . . . . 5811 1
19 . 1 1 4 4 ARG HG2 H 1 1.61 0.02 . 1 . . . . . . . . 5811 1
20 . 1 1 4 4 ARG HG3 H 1 1.61 0.02 . 1 . . . . . . . . 5811 1
21 . 1 1 4 4 ARG HD2 H 1 3.17 0.02 . 1 . . . . . . . . 5811 1
22 . 1 1 4 4 ARG HD3 H 1 3.17 0.02 . 1 . . . . . . . . 5811 1
23 . 1 1 4 4 ARG HE H 1 7.22 0.02 . 1 . . . . . . . . 5811 1
24 . 1 1 5 5 ASP H H 1 8.52 0.02 . 1 . . . . . . . . 5811 1
25 . 1 1 5 5 ASP HA H 1 4.63 0.02 . 1 . . . . . . . . 5811 1
26 . 1 1 5 5 ASP HB2 H 1 2.75 0.02 . 1 . . . . . . . . 5811 1
27 . 1 1 5 5 ASP HB3 H 1 2.75 0.02 . 1 . . . . . . . . 5811 1
28 . 1 1 6 6 GLY H H 1 8.51 0.02 . 1 . . . . . . . . 5811 1
29 . 1 1 6 6 GLY HA2 H 1 3.93 0.02 . 2 . . . . . . . . 5811 1
30 . 1 1 6 6 GLY HA3 H 1 3.98 0.02 . 2 . . . . . . . . 5811 1
31 . 1 1 7 7 GLY H H 1 8.35 0.02 . 1 . . . . . . . . 5811 1
32 . 1 1 7 7 GLY HA2 H 1 3.9 0.02 . 1 . . . . . . . . 5811 1
33 . 1 1 7 7 GLY HA3 H 1 3.9 0.02 . 1 . . . . . . . . 5811 1
34 . 1 1 8 8 TYR H H 1 8.29 0.02 . 1 . . . . . . . . 5811 1
35 . 1 1 8 8 TYR HA H 1 4.55 0.02 . 1 . . . . . . . . 5811 1
36 . 1 1 8 8 TYR HB2 H 1 2.98 0.02 . 2 . . . . . . . . 5811 1
37 . 1 1 8 8 TYR HB3 H 1 3.06 0.02 . 2 . . . . . . . . 5811 1
38 . 1 1 8 8 TYR HD1 H 1 7.15 0.02 . 1 . . . . . . . . 5811 1
39 . 1 1 8 8 TYR HD2 H 1 7.15 0.02 . 1 . . . . . . . . 5811 1
40 . 1 1 8 8 TYR HE1 H 1 6.84 0.02 . 1 . . . . . . . . 5811 1
41 . 1 1 8 8 TYR HE2 H 1 6.84 0.02 . 1 . . . . . . . . 5811 1
42 . 1 1 9 9 GLY H H 1 8.56 0.02 . 1 . . . . . . . . 5811 1
43 . 1 1 9 9 GLY HA2 H 1 3.9 0.02 . 1 . . . . . . . . 5811 1
44 . 1 1 9 9 GLY HA3 H 1 3.9 0.02 . 1 . . . . . . . . 5811 1
45 . 1 1 10 10 GLY H H 1 7.69 0.02 . 1 . . . . . . . . 5811 1
46 . 1 1 10 10 GLY HA2 H 1 3.76 0.02 . 1 . . . . . . . . 5811 1
47 . 1 1 10 10 GLY HA3 H 1 3.76 0.02 . 1 . . . . . . . . 5811 1
stop_
save_