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 290
_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 . 290 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 ASP H H 1 8.64 . . 1 . . . . . . . . 290 1
2 . 1 1 1 1 ASP HA H 1 4.43 . . 1 . . . . . . . . 290 1
3 . 1 1 1 1 ASP HB2 H 1 2.58 . . 2 . . . . . . . . 290 1
4 . 1 1 1 1 ASP HB3 H 1 2.34 . . 2 . . . . . . . . 290 1
5 . 1 1 2 2 ARG H H 1 8.63 . . 1 . . . . . . . . 290 1
6 . 1 1 2 2 ARG HA H 1 4.49 . . 1 . . . . . . . . 290 1
7 . 1 1 2 2 ARG HB2 H 1 2.03 . . 2 . . . . . . . . 290 1
8 . 1 1 2 2 ARG HB3 H 1 1.83 . . 2 . . . . . . . . 290 1
9 . 1 1 2 2 ARG HG2 H 1 1.8 . . 2 . . . . . . . . 290 1
10 . 1 1 2 2 ARG HG3 H 1 1.7 . . 2 . . . . . . . . 290 1
11 . 1 1 2 2 ARG HD2 H 1 3.25 . . 1 . . . . . . . . 290 1
12 . 1 1 2 2 ARG HD3 H 1 3.25 . . 1 . . . . . . . . 290 1
13 . 1 1 2 2 ARG HE H 1 7.42 . . 1 . . . . . . . . 290 1
14 . 1 1 3 3 ASP H H 1 8.17 . . 1 . . . . . . . . 290 1
15 . 1 1 3 3 ASP HA H 1 4.73 . . 1 . . . . . . . . 290 1
16 . 1 1 3 3 ASP HB2 H 1 3.06 . . 2 . . . . . . . . 290 1
17 . 1 1 3 3 ASP HB3 H 1 2.55 . . 2 . . . . . . . . 290 1
18 . 1 1 4 4 ALA H H 1 8.23 . . 1 . . . . . . . . 290 1
19 . 1 1 4 4 ALA HA H 1 3.97 . . 1 . . . . . . . . 290 1
20 . 1 1 4 4 ALA HB1 H 1 1.34 . . 1 . . . . . . . . 290 1
21 . 1 1 4 4 ALA HB2 H 1 1.34 . . 1 . . . . . . . . 290 1
22 . 1 1 4 4 ALA HB3 H 1 1.34 . . 1 . . . . . . . . 290 1
23 . 1 1 5 5 ASP H H 1 8.18 . . 1 . . . . . . . . 290 1
24 . 1 1 5 5 ASP HA H 1 4.77 . . 1 . . . . . . . . 290 1
25 . 1 1 5 5 ASP HB2 H 1 3.21 . . 2 . . . . . . . . 290 1
26 . 1 1 5 5 ASP HB3 H 1 2.7 . . 2 . . . . . . . . 290 1
27 . 1 1 6 6 GLY H H 1 8.81 . . 1 . . . . . . . . 290 1
28 . 1 1 6 6 GLY HA2 H 1 4.03 . . 2 . . . . . . . . 290 1
29 . 1 1 6 6 GLY HA3 H 1 3.48 . . 2 . . . . . . . . 290 1
30 . 1 1 7 7 TYR H H 1 8.48 . . 1 . . . . . . . . 290 1
31 . 1 1 7 7 TYR HA H 1 4.79 . . 1 . . . . . . . . 290 1
32 . 1 1 7 7 TYR HB2 H 1 2.86 . . 2 . . . . . . . . 290 1
33 . 1 1 7 7 TYR HB3 H 1 2.78 . . 2 . . . . . . . . 290 1
34 . 1 1 7 7 TYR HD1 H 1 6.99 . . 1 . . . . . . . . 290 1
35 . 1 1 7 7 TYR HD2 H 1 6.99 . . 1 . . . . . . . . 290 1
36 . 1 1 7 7 TYR HE1 H 1 6.8 . . 1 . . . . . . . . 290 1
37 . 1 1 7 7 TYR HE2 H 1 6.8 . . 1 . . . . . . . . 290 1
38 . 1 1 8 8 ILE H H 1 9.3 . . 1 . . . . . . . . 290 1
39 . 1 1 8 8 ILE HA H 1 4.21 . . 1 . . . . . . . . 290 1
40 . 1 1 8 8 ILE HB H 1 1.81 . . 1 . . . . . . . . 290 1
41 . 1 1 8 8 ILE HG12 H 1 1.41 . . 2 . . . . . . . . 290 1
42 . 1 1 8 8 ILE HG13 H 1 .9 . . 2 . . . . . . . . 290 1
43 . 1 1 8 8 ILE HG21 H 1 .78 . . 1 . . . . . . . . 290 1
44 . 1 1 8 8 ILE HG22 H 1 .78 . . 1 . . . . . . . . 290 1
45 . 1 1 8 8 ILE HG23 H 1 .78 . . 1 . . . . . . . . 290 1
46 . 1 1 8 8 ILE HD11 H 1 .87 . . 1 . . . . . . . . 290 1
47 . 1 1 8 8 ILE HD12 H 1 .87 . . 1 . . . . . . . . 290 1
48 . 1 1 8 8 ILE HD13 H 1 .87 . . 1 . . . . . . . . 290 1
49 . 1 1 9 9 ASP H H 1 9.3 . . 1 . . . . . . . . 290 1
50 . 1 1 9 9 ASP HB2 H 1 2.79 . . 2 . . . . . . . . 290 1
51 . 1 1 9 9 ASP HB3 H 1 2.66 . . 2 . . . . . . . . 290 1
52 . 1 1 10 10 ALA H H 1 8.83 . . 1 . . . . . . . . 290 1
53 . 1 1 10 10 ALA HA H 1 4.05 . . 1 . . . . . . . . 290 1
54 . 1 1 10 10 ALA HB1 H 1 1.47 . . 1 . . . . . . . . 290 1
55 . 1 1 10 10 ALA HB2 H 1 1.47 . . 1 . . . . . . . . 290 1
56 . 1 1 10 10 ALA HB3 H 1 1.47 . . 1 . . . . . . . . 290 1
57 . 1 1 11 11 GLU H H 1 8.95 . . 1 . . . . . . . . 290 1
58 . 1 1 11 11 GLU HA H 1 4.23 . . 1 . . . . . . . . 290 1
59 . 1 1 12 12 GLU H H 1 8.04 . . 1 . . . . . . . . 290 1
60 . 1 1 12 12 GLU HA H 1 4.25 . . 1 . . . . . . . . 290 1
61 . 1 1 12 12 GLU HB2 H 1 2.3 . . 2 . . . . . . . . 290 1
62 . 1 1 12 12 GLU HB3 H 1 2.06 . . 2 . . . . . . . . 290 1
63 . 1 1 13 13 LEU H H 1 7.68 . . 1 . . . . . . . . 290 1
64 . 1 1 13 13 LEU HA H 1 4.19 . . 1 . . . . . . . . 290 1
65 . 1 1 13 13 LEU HB2 H 1 1.72 . . 2 . . . . . . . . 290 1
66 . 1 1 13 13 LEU HB3 H 1 1.6 . . 2 . . . . . . . . 290 1
67 . 1 1 13 13 LEU HG H 1 1.62 . . 1 . . . . . . . . 290 1
68 . 1 1 13 13 LEU HD11 H 1 .87 . . 2 . . . . . . . . 290 1
69 . 1 1 13 13 LEU HD12 H 1 .87 . . 2 . . . . . . . . 290 1
70 . 1 1 13 13 LEU HD13 H 1 .87 . . 2 . . . . . . . . 290 1
71 . 1 1 13 13 LEU HD21 H 1 .83 . . 2 . . . . . . . . 290 1
72 . 1 1 13 13 LEU HD22 H 1 .83 . . 2 . . . . . . . . 290 1
73 . 1 1 13 13 LEU HD23 H 1 .83 . . 2 . . . . . . . . 290 1
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