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 1375
_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 . 1375 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 GLU CA C 13 56 . . 1 . . . . . . . . 1375 1
2 . 1 1 1 1 GLU CG C 13 32.7 . . 1 . . . . . . . . 1375 1
3 . 1 1 2 2 TYR CA C 13 56.2 . . 1 . . . . . . . . 1375 1
4 . 1 1 2 2 TYR CB C 13 37.2 . . 1 . . . . . . . . 1375 1
5 . 1 1 3 3 ARG CA C 13 56.2 . . 1 . . . . . . . . 1375 1
6 . 1 1 3 3 ARG CD C 13 42.1 . . 1 . . . . . . . . 1375 1
7 . 1 1 4 4 PRO CA C 13 61.2 . . 1 . . . . . . . . 1375 1
8 . 1 1 4 4 PRO CD C 13 48.3 . . 1 . . . . . . . . 1375 1
9 . 1 1 5 5 LEU CA C 13 53.8 . . 1 . . . . . . . . 1375 1
10 . 1 1 5 5 LEU CD1 C 13 24 . . 2 . . . . . . . . 1375 1
11 . 1 1 5 5 LEU CD2 C 13 24.4 . . 2 . . . . . . . . 1375 1
12 . 1 1 6 6 CYS CA C 13 53 . . 1 . . . . . . . . 1375 1
13 . 1 1 8 8 SER CA C 13 59.4 . . 1 . . . . . . . . 1375 1
14 . 1 1 8 8 SER CB C 13 60.6 . . 1 . . . . . . . . 1375 1
15 . 1 1 9 9 ASP CA C 13 51.7 . . 1 . . . . . . . . 1375 1
16 . 1 1 10 10 ASN CA C 13 53.3 . . 1 . . . . . . . . 1375 1
17 . 1 1 10 10 ASN CB C 13 36.3 . . 1 . . . . . . . . 1375 1
18 . 1 1 11 11 LYS CA C 13 54.2 . . 1 . . . . . . . . 1375 1
19 . 1 1 11 11 LYS CE C 13 40.7 . . 1 . . . . . . . . 1375 1
20 . 1 1 12 12 THR CA C 13 61.1 . . 1 . . . . . . . . 1375 1
21 . 1 1 12 12 THR CB C 13 67.6 . . 1 . . . . . . . . 1375 1
22 . 1 1 12 12 THR CG2 C 13 22 . . 1 . . . . . . . . 1375 1
23 . 1 1 14 14 GLY CA C 13 45.8 . . 1 . . . . . . . . 1375 1
24 . 1 1 15 15 ASN CA C 13 50.4 . . 1 . . . . . . . . 1375 1
25 . 1 1 16 16 LYS CA C 13 58.7 . . 1 . . . . . . . . 1375 1
26 . 1 1 16 16 LYS CE C 13 40.9 . . 1 . . . . . . . . 1375 1
27 . 1 1 20 20 CYS CA C 13 54 . . 1 . . . . . . . . 1375 1
28 . 1 1 21 21 ASN CA C 13 54.3 . . 1 . . . . . . . . 1375 1
29 . 1 1 22 22 ALA CA C 13 53.6 . . 1 . . . . . . . . 1375 1
30 . 1 1 22 22 ALA CB C 13 16.9 . . 1 . . . . . . . . 1375 1
31 . 1 1 23 23 VAL CA C 13 65.3 . . 1 . . . . . . . . 1375 1
32 . 1 1 23 23 VAL CG1 C 13 19.4 . . 2 . . . . . . . . 1375 1
33 . 1 1 23 23 VAL CG2 C 13 21 . . 2 . . . . . . . . 1375 1
34 . 1 1 24 24 VAL CA C 13 64.5 . . 1 . . . . . . . . 1375 1
35 . 1 1 24 24 VAL CG1 C 13 19.8 . . 1 . . . . . . . . 1375 1
36 . 1 1 24 24 VAL CG2 C 13 19.8 . . 1 . . . . . . . . 1375 1
37 . 1 1 25 25 GLU CA C 13 56.1 . . 1 . . . . . . . . 1375 1
38 . 1 1 25 25 GLU CG C 13 31.8 . . 1 . . . . . . . . 1375 1
39 . 1 1 26 26 SER CA C 13 57.6 . . 1 . . . . . . . . 1375 1
40 . 1 1 26 26 SER CB C 13 63 . . 1 . . . . . . . . 1375 1
41 . 1 1 27 27 ASN CA C 13 52.8 . . 1 . . . . . . . . 1375 1
42 . 1 1 27 27 ASN CB C 13 35.7 . . 1 . . . . . . . . 1375 1
43 . 1 1 28 28 GLY CA C 13 44.2 . . 1 . . . . . . . . 1375 1
44 . 1 1 29 29 THR CA C 13 61.7 . . 1 . . . . . . . . 1375 1
45 . 1 1 29 29 THR CB C 13 68.4 . . 1 . . . . . . . . 1375 1
46 . 1 1 29 29 THR CG2 C 13 19.9 . . 1 . . . . . . . . 1375 1
47 . 1 1 30 30 LEU CA C 13 53.6 . . 1 . . . . . . . . 1375 1
48 . 1 1 30 30 LEU CD1 C 13 21.7 . . 2 . . . . . . . . 1375 1
49 . 1 1 30 30 LEU CD2 C 13 24.7 . . 2 . . . . . . . . 1375 1
50 . 1 1 31 31 THR CA C 13 57.7 . . 1 . . . . . . . . 1375 1
51 . 1 1 31 31 THR CB C 13 70.2 . . 1 . . . . . . . . 1375 1
52 . 1 1 31 31 THR CG2 C 13 19.9 . . 1 . . . . . . . . 1375 1
53 . 1 1 32 32 LEU CA C 13 58.6 . . 1 . . . . . . . . 1375 1
54 . 1 1 32 32 LEU CD1 C 13 22.9 . . 2 . . . . . . . . 1375 1
55 . 1 1 32 32 LEU CD2 C 13 24.6 . . 2 . . . . . . . . 1375 1
56 . 1 1 33 33 SER CA C 13 58.7 . . 1 . . . . . . . . 1375 1
57 . 1 1 33 33 SER CB C 13 61.9 . . 1 . . . . . . . . 1375 1
58 . 1 1 34 34 HIS CA C 13 53.2 . . 1 . . . . . . . . 1375 1
59 . 1 1 35 35 PHE CA C 13 58.9 . . 1 . . . . . . . . 1375 1
60 . 1 1 35 35 PHE CB C 13 38.2 . . 1 . . . . . . . . 1375 1
61 . 1 1 36 36 GLY CA C 13 42.8 . . 1 . . . . . . . . 1375 1
62 . 1 1 37 37 LYS CA C 13 54.7 . . 1 . . . . . . . . 1375 1
63 . 1 1 37 37 LYS CE C 13 40.3 . . 1 . . . . . . . . 1375 1
64 . 1 1 38 38 CYS CA C 13 53.3 . . 1 . . . . . . . . 1375 1
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