Content for NMR-STAR saveframe, "chemical_shift_assignment_data_set_one"
save_chemical_shift_assignment_data_set_one
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode 'chemical_shift_assignment_data_set_one'
_Assigned_chem_shift_list.Entry_ID 516
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_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 $sample_one . 516 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 TYR HA H 1 4.24 . . 1 . . . . . . . . 516 1
2 . 1 1 2 2 ALA H H 1 8.45 . . 1 . . . . . . . . 516 1
3 . 1 1 2 2 ALA HA H 1 4.37 . . 1 . . . . . . . . 516 1
4 . 1 1 3 3 ASP H H 1 8.33 . . 1 . . . . . . . . 516 1
5 . 1 1 3 3 ASP HA H 1 4.66 . . 1 . . . . . . . . 516 1
6 . 1 1 4 4 ALA H H 1 8.29 . . 1 . . . . . . . . 516 1
7 . 1 1 4 4 ALA HA H 1 4.29 . . 1 . . . . . . . . 516 1
8 . 1 1 5 5 ILE H H 1 7.75 . . 1 . . . . . . . . 516 1
9 . 1 1 5 5 ILE HA H 1 3.95 . . 1 . . . . . . . . 516 1
10 . 1 1 6 6 PHE H H 1 7.9 . . 1 . . . . . . . . 516 1
11 . 1 1 6 6 PHE HA H 1 4.51 . . 1 . . . . . . . . 516 1
12 . 1 1 7 7 THR H H 1 8.14 . . 1 . . . . . . . . 516 1
13 . 1 1 7 7 THR HA H 1 4.1 . . 1 . . . . . . . . 516 1
14 . 1 1 8 8 ASN H H 1 8.29 . . 1 . . . . . . . . 516 1
15 . 1 1 8 8 ASN HA H 1 4.63 . . 1 . . . . . . . . 516 1
16 . 1 1 9 9 SER H H 1 8.08 . . 1 . . . . . . . . 516 1
17 . 1 1 9 9 SER HA H 1 4.32 . . 1 . . . . . . . . 516 1
18 . 1 1 10 10 TYR H H 1 8.2 . . 1 . . . . . . . . 516 1
19 . 1 1 10 10 TYR HA H 1 4.29 . . 1 . . . . . . . . 516 1
20 . 1 1 11 11 ARG H H 1 8.02 . . 1 . . . . . . . . 516 1
21 . 1 1 11 11 ARG HA H 1 3.91 . . 1 . . . . . . . . 516 1
22 . 1 1 12 12 LYS H H 1 7.79 . . 1 . . . . . . . . 516 1
23 . 1 1 12 12 LYS HA H 1 4.14 . . 1 . . . . . . . . 516 1
24 . 1 1 13 13 VAL H H 1 7.85 . . 1 . . . . . . . . 516 1
25 . 1 1 13 13 VAL HA H 1 3.73 . . 1 . . . . . . . . 516 1
26 . 1 1 14 14 LEU H H 1 8.35 . . 1 . . . . . . . . 516 1
27 . 1 1 14 14 LEU HA H 1 4.09 . . 1 . . . . . . . . 516 1
28 . 1 1 15 15 GLY H H 1 8.34 . . 1 . . . . . . . . 516 1
29 . 1 1 15 15 GLY HA2 H 1 3.92 . . 1 . . . . . . . . 516 1
30 . 1 1 15 15 GLY HA3 H 1 3.92 . . 1 . . . . . . . . 516 1
31 . 1 1 16 16 GLN H H 1 7.93 . . 1 . . . . . . . . 516 1
32 . 1 1 16 16 GLN HA H 1 4.21 . . 1 . . . . . . . . 516 1
33 . 1 1 17 17 LEU H H 1 8.61 . . 1 . . . . . . . . 516 1
34 . 1 1 17 17 LEU HA H 1 4.15 . . 1 . . . . . . . . 516 1
35 . 1 1 18 18 SER H H 1 8.37 . . 1 . . . . . . . . 516 1
36 . 1 1 18 18 SER HA H 1 4.2 . . 1 . . . . . . . . 516 1
37 . 1 1 19 19 ALA H H 1 7.88 . . 1 . . . . . . . . 516 1
38 . 1 1 19 19 ALA HA H 1 4.18 . . 1 . . . . . . . . 516 1
39 . 1 1 20 20 ARG H H 1 8.09 . . 1 . . . . . . . . 516 1
40 . 1 1 20 20 ARG HA H 1 4.1 . . 1 . . . . . . . . 516 1
41 . 1 1 21 21 LYS H H 1 7.96 . . 1 . . . . . . . . 516 1
42 . 1 1 21 21 LYS HA H 1 4.05 . . 1 . . . . . . . . 516 1
43 . 1 1 22 22 LEU H H 1 8.02 . . 1 . . . . . . . . 516 1
44 . 1 1 22 22 LEU HA H 1 4.23 . . 1 . . . . . . . . 516 1
45 . 1 1 23 23 LEU H H 1 8.28 . . 1 . . . . . . . . 516 1
46 . 1 1 23 23 LEU HA H 1 4.12 . . 1 . . . . . . . . 516 1
47 . 1 1 24 24 GLN H H 1 8.22 . . 1 . . . . . . . . 516 1
48 . 1 1 24 24 GLN HA H 1 4.02 . . 1 . . . . . . . . 516 1
49 . 1 1 25 25 ASP H H 1 8.37 . . 1 . . . . . . . . 516 1
50 . 1 1 25 25 ASP HA H 1 4.47 . . 1 . . . . . . . . 516 1
51 . 1 1 26 26 ILE H H 1 8.59 . . 1 . . . . . . . . 516 1
52 . 1 1 26 26 ILE HA H 1 3.76 . . 1 . . . . . . . . 516 1
53 . 1 1 27 27 MET H H 1 8.65 . . 1 . . . . . . . . 516 1
54 . 1 1 27 27 MET HA H 1 4.31 . . 1 . . . . . . . . 516 1
55 . 1 1 28 28 SER H H 1 8.02 . . 1 . . . . . . . . 516 1
56 . 1 1 28 28 SER HA H 1 4.42 . . 1 . . . . . . . . 516 1
57 . 1 1 29 29 ARG H H 1 7.65 . . 1 . . . . . . . . 516 1
58 . 1 1 29 29 ARG HA H 1 4.33 . . 1 . . . . . . . . 516 1
stop_
save_