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 1640
_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 . 1640 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 VAL CA C 13 60.8 . . 1 . . . . . . . . 1640 1
2 . 1 1 1 1 VAL CB C 13 32.8 . . 1 . . . . . . . . 1640 1
3 . 1 1 1 1 VAL CG1 C 13 20.1 . . 2 . . . . . . . . 1640 1
4 . 1 1 1 1 VAL CG2 C 13 18.9 . . 2 . . . . . . . . 1640 1
5 . 1 1 2 2 LYS CA C 13 55.2 . . 1 . . . . . . . . 1640 1
6 . 1 1 2 2 LYS CB C 13 35 . . 1 . . . . . . . . 1640 1
7 . 1 1 2 2 LYS CG C 13 24.8 . . 1 . . . . . . . . 1640 1
8 . 1 1 2 2 LYS CD C 13 29 . . 1 . . . . . . . . 1640 1
9 . 1 1 2 2 LYS CE C 13 41.7 . . 1 . . . . . . . . 1640 1
10 . 1 1 3 3 CYS CA C 13 59.4 . . 1 . . . . . . . . 1640 1
11 . 1 1 3 3 CYS CB C 13 30.2 . . 1 . . . . . . . . 1640 1
12 . 1 1 4 4 PHE CA C 13 59 . . 1 . . . . . . . . 1640 1
13 . 1 1 4 4 PHE CB C 13 38.8 . . 1 . . . . . . . . 1640 1
14 . 1 1 5 5 ASN CA C 13 56.2 . . 1 . . . . . . . . 1640 1
15 . 1 1 5 5 ASN CB C 13 39.8 . . 1 . . . . . . . . 1640 1
16 . 1 1 6 6 CYS CA C 13 58.6 . . 1 . . . . . . . . 1640 1
17 . 1 1 6 6 CYS CB C 13 32.1 . . 1 . . . . . . . . 1640 1
18 . 1 1 7 7 GLY CA C 13 46 . . 1 . . . . . . . . 1640 1
19 . 1 1 8 8 LYS CA C 13 56 . . 1 . . . . . . . . 1640 1
20 . 1 1 8 8 LYS CB C 13 33.9 . . 1 . . . . . . . . 1640 1
21 . 1 1 8 8 LYS CD C 13 28.9 . . 1 . . . . . . . . 1640 1
22 . 1 1 8 8 LYS CE C 13 42.1 . . 1 . . . . . . . . 1640 1
23 . 1 1 9 9 GLU CA C 13 56 . . 1 . . . . . . . . 1640 1
24 . 1 1 9 9 GLU CB C 13 30.9 . . 1 . . . . . . . . 1640 1
25 . 1 1 9 9 GLU CG C 13 36.4 . . 1 . . . . . . . . 1640 1
26 . 1 1 10 10 GLY CA C 13 45.8 . . 1 . . . . . . . . 1640 1
27 . 1 1 11 11 HIS CA C 13 56 . . 1 . . . . . . . . 1640 1
28 . 1 1 11 11 HIS CB C 13 30.1 . . 1 . . . . . . . . 1640 1
29 . 1 1 12 12 ILE CA C 13 59.2 . . 1 . . . . . . . . 1640 1
30 . 1 1 12 12 ILE CB C 13 40.9 . . 1 . . . . . . . . 1640 1
31 . 1 1 12 12 ILE CG1 C 13 26 . . 1 . . . . . . . . 1640 1
32 . 1 1 12 12 ILE CG2 C 13 18.2 . . 1 . . . . . . . . 1640 1
33 . 1 1 12 12 ILE CD1 C 13 13.8 . . 1 . . . . . . . . 1640 1
34 . 1 1 13 13 ALA CA C 13 55.1 . . 1 . . . . . . . . 1640 1
35 . 1 1 13 13 ALA CB C 13 18.7 . . 1 . . . . . . . . 1640 1
36 . 1 1 14 14 ARG CA C 13 58.2 . . 1 . . . . . . . . 1640 1
37 . 1 1 14 14 ARG CB C 13 30 . . 1 . . . . . . . . 1640 1
38 . 1 1 14 14 ARG CD C 13 43.2 . . 1 . . . . . . . . 1640 1
39 . 1 1 15 15 ASN CA C 13 51.7 . . 1 . . . . . . . . 1640 1
40 . 1 1 15 15 ASN CB C 13 39.8 . . 1 . . . . . . . . 1640 1
41 . 1 1 16 16 CYS CA C 13 62.2 . . 1 . . . . . . . . 1640 1
42 . 1 1 16 16 CYS CB C 13 30.5 . . 1 . . . . . . . . 1640 1
43 . 1 1 17 17 ARG CA C 13 55.1 . . 1 . . . . . . . . 1640 1
44 . 1 1 17 17 ARG CB C 13 30.4 . . 1 . . . . . . . . 1640 1
45 . 1 1 17 17 ARG CD C 13 43.1 . . 1 . . . . . . . . 1640 1
46 . 1 1 18 18 ALA CA C 13 54.2 . . 1 . . . . . . . . 1640 1
47 . 1 1 18 18 ALA CB C 13 20 . . 1 . . . . . . . . 1640 1
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save_