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 335
_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 . 335 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 PHE CA C 13 55.48 . . 1 . . . . . . . . 335 1
2 . 1 1 1 1 PHE CB C 13 38.19 . . 1 . . . . . . . . 335 1
3 . 1 1 1 1 PHE CD1 C 13 130.32 . . 1 . . . . . . . . 335 1
4 . 1 1 1 1 PHE CD2 C 13 130.32 . . 1 . . . . . . . . 335 1
5 . 1 1 1 1 PHE CE1 C 13 130.59 . . 1 . . . . . . . . 335 1
6 . 1 1 1 1 PHE CE2 C 13 130.59 . . 1 . . . . . . . . 335 1
7 . 1 1 1 1 PHE CZ C 13 129.18 . . 1 . . . . . . . . 335 1
8 . 1 1 2 2 LYS CA C 13 54.55 . . 1 . . . . . . . . 335 1
9 . 1 1 2 2 LYS CB C 13 30.73 . . 1 . . . . . . . . 335 1
10 . 1 1 2 2 LYS CG C 13 23.23 . . 1 . . . . . . . . 335 1
11 . 1 1 2 2 LYS CD C 13 27.7 . . 1 . . . . . . . . 335 1
12 . 1 1 2 2 LYS CE C 13 40.57 . . 1 . . . . . . . . 335 1
13 . 1 1 3 3 LEU CA C 13 53.91 . . 1 . . . . . . . . 335 1
14 . 1 1 3 3 LEU CB C 13 41.14 . . 1 . . . . . . . . 335 1
15 . 1 1 3 3 LEU CG C 13 27.7 . . 1 . . . . . . . . 335 1
16 . 1 1 3 3 LEU CD1 C 13 22.43 . . 1 . . . . . . . . 335 1
17 . 1 1 3 3 LEU CD2 C 13 23.5 . . 1 . . . . . . . . 335 1
18 . 1 1 6 6 ARG CA C 13 54.95 . . 1 . . . . . . . . 335 1
19 . 1 1 6 6 ARG CB C 13 29.3 . . 1 . . . . . . . . 335 1
20 . 1 1 6 6 ARG CG C 13 25.72 . . 1 . . . . . . . . 335 1
21 . 1 1 6 6 ARG CD C 13 41.89 . . 1 . . . . . . . . 335 1
22 . 1 1 7 7 ASP CA C 13 51.55 . . 1 . . . . . . . . 335 1
23 . 1 1 7 7 ASP CB C 13 36.79 . . 1 . . . . . . . . 335 1
24 . 1 1 8 8 SER CA C 13 57.01 . . 1 . . . . . . . . 335 1
25 . 1 1 8 8 SER CB C 13 62.36 . . 1 . . . . . . . . 335 1
26 . 1 1 9 9 ARG CA C 13 54.06 . . 1 . . . . . . . . 335 1
27 . 1 1 9 9 ARG CB C 13 29.3 . . 1 . . . . . . . . 335 1
28 . 1 1 9 9 ARG CG C 13 25.72 . . 1 . . . . . . . . 335 1
29 . 1 1 9 9 ARG CD C 13 41.89 . . 1 . . . . . . . . 335 1
30 . 1 1 10 10 SER CA C 13 57.01 . . 1 . . . . . . . . 335 1
31 . 1 1 10 10 SER CB C 13 62 . . 1 . . . . . . . . 335 1
32 . 1 1 12 12 SER CA C 13 54.95 . . 1 . . . . . . . . 335 1
33 . 1 1 12 12 SER CB C 13 62.36 . . 1 . . . . . . . . 335 1
34 . 1 1 13 13 PRO CA C 13 62.17 . . 1 . . . . . . . . 335 1
35 . 1 1 13 13 PRO CB C 13 32.22 . . 1 . . . . . . . . 335 1
36 . 1 1 13 13 PRO CG C 13 26.45 . . 1 . . . . . . . . 335 1
37 . 1 1 13 13 PRO CD C 13 49.43 . . 1 . . . . . . . . 335 1
38 . 1 1 14 14 MET CA C 13 54.76 . . 1 . . . . . . . . 335 1
39 . 1 1 14 14 MET CB C 13 31.53 . . 1 . . . . . . . . 335 1
40 . 1 1 14 14 MET CG C 13 30.73 . . 1 . . . . . . . . 335 1
41 . 1 1 14 14 MET CE C 13 15.62 . . 1 . . . . . . . . 335 1
42 . 1 1 15 15 ALA CA C 13 50.98 . . 1 . . . . . . . . 335 1
43 . 1 1 15 15 ALA CB C 13 17.88 . . 1 . . . . . . . . 335 1
44 . 1 1 16 16 ARG CA C 13 54.55 . . 1 . . . . . . . . 335 1
45 . 1 1 16 16 ARG CB C 13 29.3 . . 1 . . . . . . . . 335 1
46 . 1 1 16 16 ARG CG C 13 25.72 . . 1 . . . . . . . . 335 1
47 . 1 1 16 16 ARG CD C 13 41.89 . . 1 . . . . . . . . 335 1
48 . 1 1 17 17 ARG CA C 13 53.82 . . 1 . . . . . . . . 335 1
49 . 1 1 17 17 ARG CB C 13 29.47 . . 1 . . . . . . . . 335 1
50 . 1 1 17 17 ARG CG C 13 25.72 . . 1 . . . . . . . . 335 1
51 . 1 1 17 17 ARG CD C 13 41.89 . . 1 . . . . . . . . 335 1
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save_