Content for NMR-STAR saveframe, "chem_shift_set_1"
save_chem_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_set_1
_Assigned_chem_shift_list.Entry_ID 4406
_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 . 4406 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 3.88 . . 1 . . . . . . . . 4406 1
2 . 1 1 1 1 GLY HA3 H 1 3.88 . . 1 . . . . . . . . 4406 1
3 . 1 1 2 2 CYS H H 1 8.51 . . 1 . . . . . . . . 4406 1
4 . 1 1 2 2 CYS HA H 1 4.73 . . 1 . . . . . . . . 4406 1
5 . 1 1 2 2 CYS HB2 H 1 2.57 . . 1 . . . . . . . . 4406 1
6 . 1 1 2 2 CYS HB3 H 1 3.04 . . 1 . . . . . . . . 4406 1
7 . 1 1 3 3 HYP HA H 1 4.49 . . 1 . . . . . . . . 4406 1
8 . 1 1 3 3 HYP HB2 H 1 1.21 . . 1 . . . . . . . . 4406 1
9 . 1 1 3 3 HYP HB3 H 1 2.12 . . 1 . . . . . . . . 4406 1
10 . 1 1 3 3 HYP HG H 1 2.12 . . 1 . . . . . . . . 4406 1
11 . 1 1 3 3 HYP HD22 H 1 3.88 . . 1 . . . . . . . . 4406 1
12 . 1 1 3 3 HYP HD23 H 1 3.88 . . 1 . . . . . . . . 4406 1
13 . 1 1 4 4 DTR H H 1 8.85 . . 1 . . . . . . . . 4406 1
14 . 1 1 4 4 DTR HA H 1 5.05 . . 1 . . . . . . . . 4406 1
15 . 1 1 4 4 DTR HB2 H 1 3.06 . . 1 . . . . . . . . 4406 1
16 . 1 1 4 4 DTR HB3 H 1 3.32 . . 1 . . . . . . . . 4406 1
17 . 1 1 4 4 DTR HD1 H 1 7.18 . . 1 . . . . . . . . 4406 1
18 . 1 1 4 4 DTR HE1 H 1 10.15 . . 1 . . . . . . . . 4406 1
19 . 1 1 4 4 DTR HE3 H 1 7.50 . . 1 . . . . . . . . 4406 1
20 . 1 1 4 4 DTR HZ2 H 1 7.44 . . 1 . . . . . . . . 4406 1
21 . 1 1 4 4 DTR HZ3 H 1 7.04 . . 1 . . . . . . . . 4406 1
22 . 1 1 4 4 DTR HH2 H 1 7.17 . . 1 . . . . . . . . 4406 1
23 . 1 1 5 5 GLU H H 1 6.90 . . 1 . . . . . . . . 4406 1
24 . 1 1 5 5 GLU HA H 1 4.67 . . 1 . . . . . . . . 4406 1
25 . 1 1 5 5 GLU HB2 H 1 0.25 . . 1 . . . . . . . . 4406 1
26 . 1 1 5 5 GLU HB3 H 1 0.62 . . 1 . . . . . . . . 4406 1
27 . 1 1 5 5 GLU HG2 H 1 2.19 . . 1 . . . . . . . . 4406 1
28 . 1 1 5 5 GLU HG3 H 1 2.31 . . 1 . . . . . . . . 4406 1
29 . 1 1 6 6 PRO HA H 1 4.10 . . 1 . . . . . . . . 4406 1
30 . 1 1 6 6 PRO HB2 H 1 2.08 . . 1 . . . . . . . . 4406 1
31 . 1 1 6 6 PRO HB3 H 1 2.39 . . 1 . . . . . . . . 4406 1
32 . 1 1 6 6 PRO HG2 H 1 2.10 . . 1 . . . . . . . . 4406 1
33 . 1 1 6 6 PRO HG3 H 1 2.16 . . 1 . . . . . . . . 4406 1
34 . 1 1 6 6 PRO HD2 H 1 3.41 . . 1 . . . . . . . . 4406 1
35 . 1 1 6 6 PRO HD3 H 1 3.62 . . 1 . . . . . . . . 4406 1
36 . 1 1 7 7 TRP H H 1 6.29 . . 1 . . . . . . . . 4406 1
37 . 1 1 7 7 TRP HA H 1 4.75 . . 1 . . . . . . . . 4406 1
38 . 1 1 7 7 TRP HB2 H 1 3.25 . . 1 . . . . . . . . 4406 1
39 . 1 1 7 7 TRP HB3 H 1 3.56 . . 1 . . . . . . . . 4406 1
40 . 1 1 7 7 TRP HD1 H 1 7.10 . . 1 . . . . . . . . 4406 1
41 . 1 1 7 7 TRP HE1 H 1 10.35 . . 1 . . . . . . . . 4406 1
42 . 1 1 7 7 TRP HE3 H 1 7.61 . . 1 . . . . . . . . 4406 1
43 . 1 1 7 7 TRP HZ2 H 1 7.42 . . 1 . . . . . . . . 4406 1
44 . 1 1 7 7 TRP HZ3 H 1 7.20 . . 1 . . . . . . . . 4406 1
45 . 1 1 7 7 TRP HH2 H 1 7.17 . . 1 . . . . . . . . 4406 1
46 . 1 1 8 8 CYS H H 1 7.10 . . 1 . . . . . . . . 4406 1
47 . 1 1 8 8 CYS HA H 1 4.26 . . 1 . . . . . . . . 4406 1
48 . 1 1 8 8 CYS HB2 H 1 3.05 . . 1 . . . . . . . . 4406 1
49 . 1 1 8 8 CYS HB3 H 1 3.11 . . 1 . . . . . . . . 4406 1
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save_