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 488
_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 . 488 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 GLY HA2 H 1 3.73 . . 2 . . . . . . . . 488 1
2 . 1 1 1 1 GLY HA3 H 1 3.53 . . 2 . . . . . . . . 488 1
3 . 1 1 2 2 VAL H H 1 8.59 . . 1 . . . . . . . . 488 1
4 . 1 1 2 2 VAL HA H 1 4.17 . . 1 . . . . . . . . 488 1
5 . 1 1 2 2 VAL HB H 1 2 . . 1 . . . . . . . . 488 1
6 . 1 1 3 3 SER H H 1 8.35 . . 1 . . . . . . . . 488 1
7 . 1 1 3 3 SER HA H 1 5.09 . . 1 . . . . . . . . 488 1
8 . 1 1 3 3 SER HB2 H 1 3.78 . . 1 . . . . . . . . 488 1
9 . 1 1 3 3 SER HB3 H 1 3.78 . . 1 . . . . . . . . 488 1
10 . 1 1 4 4 CYS HA H 1 4.79 . . 1 . . . . . . . . 488 1
11 . 1 1 4 4 CYS HB2 H 1 3.11 . . 1 . . . . . . . . 488 1
12 . 1 1 4 4 CYS HB3 H 1 3.11 . . 1 . . . . . . . . 488 1
13 . 1 1 5 5 LEU H H 1 8.31 . . 1 . . . . . . . . 488 1
14 . 1 1 5 5 LEU HA H 1 4.58 . . 1 . . . . . . . . 488 1
15 . 1 1 5 5 LEU HB2 H 1 1.75 . . 2 . . . . . . . . 488 1
16 . 1 1 5 5 LEU HB3 H 1 1.45 . . 2 . . . . . . . . 488 1
17 . 1 1 6 6 CYS HA H 1 4.66 . . 1 . . . . . . . . 488 1
18 . 1 1 6 6 CYS HB2 H 1 3.45 . . 2 . . . . . . . . 488 1
19 . 1 1 6 6 CYS HB3 H 1 2.66 . . 2 . . . . . . . . 488 1
20 . 1 1 7 7 ASP H H 1 8.61 . . 1 . . . . . . . . 488 1
21 . 1 1 7 7 ASP HA H 1 4.56 . . 1 . . . . . . . . 488 1
22 . 1 1 7 7 ASP HB2 H 1 2.79 . . 1 . . . . . . . . 488 1
23 . 1 1 7 7 ASP HB3 H 1 2.79 . . 1 . . . . . . . . 488 1
24 . 1 1 9 9 ASP HA H 1 4.68 . . 1 . . . . . . . . 488 1
25 . 1 1 9 9 ASP HB2 H 1 3.01 . . 1 . . . . . . . . 488 1
26 . 1 1 9 9 ASP HB3 H 1 3.01 . . 1 . . . . . . . . 488 1
27 . 1 1 11 11 PRO HA H 1 4.51 . . 1 . . . . . . . . 488 1
28 . 1 1 11 11 PRO HB2 H 1 2.3 . . 2 . . . . . . . . 488 1
29 . 1 1 11 11 PRO HB3 H 1 1.97 . . 2 . . . . . . . . 488 1
30 . 1 1 12 12 SER H H 1 8.41 . . 1 . . . . . . . . 488 1
31 . 1 1 12 12 SER HA H 1 4.47 . . 1 . . . . . . . . 488 1
32 . 1 1 12 12 SER HB2 H 1 3.85 . . 1 . . . . . . . . 488 1
33 . 1 1 12 12 SER HB3 H 1 3.85 . . 1 . . . . . . . . 488 1
34 . 1 1 13 13 VAL H H 1 8.12 . . 1 . . . . . . . . 488 1
35 . 1 1 13 13 VAL HA H 1 4.17 . . 1 . . . . . . . . 488 1
36 . 1 1 13 13 VAL HB H 1 2.09 . . 1 . . . . . . . . 488 1
37 . 1 1 14 14 ARG H H 1 7.97 . . 1 . . . . . . . . 488 1
38 . 1 1 14 14 ARG HA H 1 4.2 . . 1 . . . . . . . . 488 1
39 . 1 1 14 14 ARG HB2 H 1 1.84 . . 2 . . . . . . . . 488 1
40 . 1 1 14 14 ARG HB3 H 1 1.72 . . 2 . . . . . . . . 488 1
41 . 1 1 14 14 ARG HG2 H 1 1.58 . . 1 . . . . . . . . 488 1
42 . 1 1 14 14 ARG HG3 H 1 1.58 . . 1 . . . . . . . . 488 1
43 . 1 1 14 14 ARG HD2 H 1 3.18 . . 1 . . . . . . . . 488 1
44 . 1 1 14 14 ARG HD3 H 1 3.18 . . 1 . . . . . . . . 488 1
45 . 1 1 14 14 ARG HE H 1 7.16 . . 1 . . . . . . . . 488 1
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save_