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 4490
_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_one
_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 NOESY 1 $sample_1 . 4490 1
2 COSY 1 $sample_1 . 4490 1
3 TOCSY 1 $sample_1 . 4490 1
4 DQF-COSY 1 $sample_1 . 4490 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.Ambiguity_set_ID
_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 CYS HA H 1 4.31 . . 1 . . . . . . . . . 4490 1
2 . 1 1 2 2 ILE H H 1 9.02 . . 1 . . . . . . . . . 4490 1
3 . 1 1 2 2 ILE HA H 1 4.46 . . 1 . . . . . . . . . 4490 1
4 . 1 1 2 2 ILE HB H 1 1.76 . . 1 . . . . . . . . . 4490 1
5 . 1 1 3 3 PRO HA H 1 4.39 . . 1 . . . . . . . . . 4490 1
6 . 1 1 4 4 LYS H H 1 7.65 . . 1 . . . . . . . . . 4490 1
7 . 1 1 4 4 LYS HA H 1 2.88 . . 1 . . . . . . . . . 4490 1
8 . 1 1 5 5 TRP H H 1 9.36 . . 1 . . . . . . . . . 4490 1
9 . 1 1 5 5 TRP HA H 1 4.40 . . 1 . . . . . . . . . 4490 1
10 . 1 1 6 6 ASN H H 1 7.88 . . 1 . . . . . . . . . 4490 1
11 . 1 1 6 6 ASN HA H 1 4.88 . . 1 . . . . . . . . . 4490 1
12 . 1 1 7 7 ARG H H 1 8.38 . . 1 . . . . . . . . . 4490 1
13 . 1 1 7 7 ARG HA H 1 5.06 . . 1 . . . . . . . . . 4490 1
14 . 1 1 8 8 CYS H H 1 8.31 . . 1 . . . . . . . . . 4490 1
15 . 1 1 8 8 CYS HA H 1 4.87 . . 1 . . . . . . . . . 4490 1
16 . 1 1 9 9 GLY H H 1 9.60 . . 1 . . . . . . . . . 4490 1
17 . 1 1 10 10 PRO HA H 1 4.22 . . 1 . . . . . . . . . 4490 1
18 . 1 1 11 11 LYS H H 1 8.58 . . 1 . . . . . . . . . 4490 1
19 . 1 1 11 11 LYS HA H 1 4.13 . . 1 . . . . . . . . . 4490 1
20 . 1 1 12 12 MET H H 1 8.16 . . 1 . . . . . . . . . 4490 1
21 . 1 1 12 12 MET HA H 1 4.63 . . 1 . . . . . . . . . 4490 1
22 . 1 1 13 13 ASP H H 1 7.50 . . 1 . . . . . . . . . 4490 1
23 . 1 1 14 14 GLY H H 1 8.22 . . 1 . . . . . . . . . 4490 1
24 . 1 1 15 15 VAL H H 1 8.03 . . 1 . . . . . . . . . 4490 1
25 . 1 1 15 15 VAL HA H 1 4.33 . . 1 . . . . . . . . . 4490 1
26 . 1 1 15 15 VAL HB H 1 2.04 . . 1 . . . . . . . . . 4490 1
27 . 1 1 16 16 PRO HA H 1 4.69 . . 1 . . . . . . . . . 4490 1
28 . 1 1 17 17 CYS H H 1 8.58 . . 1 . . . . . . . . . 4490 1
29 . 1 1 17 17 CYS HA H 1 4.95 . . 1 . . . . . . . . . 4490 1
30 . 1 1 18 18 CYS H H 1 9.82 . . 1 . . . . . . . . . 4490 1
31 . 1 1 18 18 CYS HA H 1 4.54 . . 1 . . . . . . . . . 4490 1
32 . 1 1 19 19 GLU H H 1 8.87 . . 1 . . . . . . . . . 4490 1
33 . 1 1 19 19 GLU HA H 1 4.29 . . 1 . . . . . . . . . 4490 1
34 . 1 1 20 20 PRO HA H 1 4.63 . . 1 . . . . . . . . . 4490 1
35 . 1 1 21 21 TYR H H 1 8.26 . . 1 . . . . . . . . . 4490 1
36 . 1 1 21 21 TYR HA H 1 4.56 . . 1 . . . . . . . . . 4490 1
37 . 1 1 22 22 THR H H 1 9.22 . . 1 . . . . . . . . . 4490 1
38 . 1 1 22 22 THR HA H 1 4.13 . . 1 . . . . . . . . . 4490 1
39 . 1 1 22 22 THR HG21 H 1 1.17 . . 1 . . . . . . . . . 4490 1
40 . 1 1 22 22 THR HG22 H 1 1.17 . . 1 . . . . . . . . . 4490 1
41 . 1 1 22 22 THR HG23 H 1 1.17 . . 1 . . . . . . . . . 4490 1
42 . 1 1 23 23 CYS H H 1 9.06 . . 1 . . . . . . . . . 4490 1
43 . 1 1 23 23 CYS HA H 1 4.84 . . 1 . . . . . . . . . 4490 1
44 . 1 1 24 24 THR H H 1 8.73 . . 1 . . . . . . . . . 4490 1
45 . 1 1 24 24 THR HA H 1 4.13 . . 1 . . . . . . . . . 4490 1
46 . 1 1 24 24 THR HG21 H 1 1.53 . . 1 . . . . . . . . . 4490 1
47 . 1 1 24 24 THR HG22 H 1 1.53 . . 1 . . . . . . . . . 4490 1
48 . 1 1 24 24 THR HG23 H 1 1.53 . . 1 . . . . . . . . . 4490 1
49 . 1 1 25 25 SER H H 1 7.19 . . 1 . . . . . . . . . 4490 1
50 . 1 1 25 25 SER HA H 1 4.59 . . 1 . . . . . . . . . 4490 1
51 . 1 1 26 26 ASP H H 1 8.50 . . 1 . . . . . . . . . 4490 1
52 . 1 1 26 26 ASP HA H 1 4.45 . . 1 . . . . . . . . . 4490 1
53 . 1 1 27 27 TYR H H 1 8.06 . . 1 . . . . . . . . . 4490 1
54 . 1 1 27 27 TYR HA H 1 4.38 . . 1 . . . . . . . . . 4490 1
55 . 1 1 28 28 TYR H H 1 7.83 . . 1 . . . . . . . . . 4490 1
56 . 1 1 29 29 GLY H H 1 8.81 . . 1 . . . . . . . . . 4490 1
57 . 1 1 30 30 ASN H H 1 8.66 . . 1 . . . . . . . . . 4490 1
58 . 1 1 30 30 ASN HA H 1 5.60 . . 1 . . . . . . . . . 4490 1
59 . 1 1 31 31 CYS H H 1 8.09 . . 1 . . . . . . . . . 4490 1
60 . 1 1 31 31 CYS HA H 1 4.96 . . 1 . . . . . . . . . 4490 1
61 . 1 1 32 32 SER H H 1 9.22 . . 1 . . . . . . . . . 4490 1
62 . 1 1 32 32 SER HA H 1 4.08 . . 1 . . . . . . . . . 4490 1
stop_
save_