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 142
_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 . 142 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 7 7 CYS HA H 1 4.35 . . 1 . . . . . . . . 142 1
2 . 1 1 7 7 CYS HB2 H 1 3.26 . . 1 . . . . . . . . 142 1
3 . 1 1 7 7 CYS HB3 H 1 3.26 . . 1 . . . . . . . . 142 1
4 . 1 1 8 8 PHE H H 1 8.83 . . 1 . . . . . . . . 142 1
5 . 1 1 8 8 PHE HA H 1 4.67 . . 1 . . . . . . . . 142 1
6 . 1 1 8 8 PHE HB2 H 1 3.11 . . 1 . . . . . . . . 142 1
7 . 1 1 8 8 PHE HB3 H 1 3.11 . . 1 . . . . . . . . 142 1
8 . 1 1 8 8 PHE HD1 H 1 7.26 . . 1 . . . . . . . . 142 1
9 . 1 1 8 8 PHE HD2 H 1 7.26 . . 1 . . . . . . . . 142 1
10 . 1 1 8 8 PHE HE1 H 1 7.26 . . 1 . . . . . . . . 142 1
11 . 1 1 8 8 PHE HE2 H 1 7.26 . . 1 . . . . . . . . 142 1
12 . 1 1 8 8 PHE HZ H 1 7.16 . . 1 . . . . . . . . 142 1
13 . 1 1 9 9 GLY H H 1 8.41 . . 1 . . . . . . . . 142 1
14 . 1 1 9 9 GLY HA2 H 1 3.67 . . 2 . . . . . . . . 142 1
15 . 1 1 9 9 GLY HA3 H 1 3.97 . . 2 . . . . . . . . 142 1
16 . 1 1 10 10 GLY H H 1 8.08 . . 1 . . . . . . . . 142 1
17 . 1 1 10 10 GLY HA2 H 1 3.87 . . 2 . . . . . . . . 142 1
18 . 1 1 10 10 GLY HA3 H 1 3.91 . . 2 . . . . . . . . 142 1
19 . 1 1 11 11 ARG H H 1 8.07 . . 1 . . . . . . . . 142 1
20 . 1 1 11 11 ARG HA H 1 4.22 . . 1 . . . . . . . . 142 1
21 . 1 1 11 11 ARG HB2 H 1 1.85 . . 1 . . . . . . . . 142 1
22 . 1 1 11 11 ARG HB3 H 1 1.85 . . 1 . . . . . . . . 142 1
23 . 1 1 11 11 ARG HG2 H 1 1.71 . . 1 . . . . . . . . 142 1
24 . 1 1 11 11 ARG HG3 H 1 1.64 . . 1 . . . . . . . . 142 1
25 . 1 1 11 11 ARG HD2 H 1 3.16 . . 1 . . . . . . . . 142 1
26 . 1 1 11 11 ARG HD3 H 1 3.16 . . 1 . . . . . . . . 142 1
27 . 1 1 12 12 ILE H H 1 7.56 . . 1 . . . . . . . . 142 1
28 . 1 1 12 12 ILE HA H 1 4.18 . . 1 . . . . . . . . 142 1
29 . 1 1 12 12 ILE HB H 1 1.98 . . 1 . . . . . . . . 142 1
30 . 1 1 12 12 ILE HG12 H 1 1.16 . . 2 . . . . . . . . 142 1
31 . 1 1 12 12 ILE HG13 H 1 1.48 . . 2 . . . . . . . . 142 1
32 . 1 1 12 12 ILE HG21 H 1 .82 . . 1 . . . . . . . . 142 1
33 . 1 1 12 12 ILE HG22 H 1 .82 . . 1 . . . . . . . . 142 1
34 . 1 1 12 12 ILE HG23 H 1 .82 . . 1 . . . . . . . . 142 1
35 . 1 1 12 12 ILE HD11 H 1 .92 . . 1 . . . . . . . . 142 1
36 . 1 1 12 12 ILE HD12 H 1 .92 . . 1 . . . . . . . . 142 1
37 . 1 1 12 12 ILE HD13 H 1 .92 . . 1 . . . . . . . . 142 1
38 . 1 1 13 13 ASP H H 1 8.22 . . 1 . . . . . . . . 142 1
39 . 1 1 13 13 ASP HA H 1 4.5 . . 1 . . . . . . . . 142 1
40 . 1 1 13 13 ASP HB2 H 1 2.81 . . 1 . . . . . . . . 142 1
41 . 1 1 13 13 ASP HB3 H 1 2.81 . . 1 . . . . . . . . 142 1
42 . 1 1 14 14 ARG H H 1 7.86 . . 1 . . . . . . . . 142 1
43 . 1 1 14 14 ARG HA H 1 4.2 . . 1 . . . . . . . . 142 1
44 . 1 1 14 14 ARG HB2 H 1 1.83 . . 2 . . . . . . . . 142 1
45 . 1 1 14 14 ARG HB3 H 1 1.87 . . 2 . . . . . . . . 142 1
46 . 1 1 14 14 ARG HG2 H 1 1.68 . . 1 . . . . . . . . 142 1
47 . 1 1 14 14 ARG HG3 H 1 1.68 . . 1 . . . . . . . . 142 1
48 . 1 1 14 14 ARG HD2 H 1 3.19 . . 1 . . . . . . . . 142 1
49 . 1 1 14 14 ARG HD3 H 1 3.19 . . 1 . . . . . . . . 142 1
50 . 1 1 15 15 ILE H H 1 7.48 . . 1 . . . . . . . . 142 1
51 . 1 1 15 15 ILE HA H 1 4.14 . . 1 . . . . . . . . 142 1
52 . 1 1 15 15 ILE HB H 1 1.96 . . 1 . . . . . . . . 142 1
53 . 1 1 15 15 ILE HG12 H 1 1.16 . . 2 . . . . . . . . 142 1
54 . 1 1 15 15 ILE HG13 H 1 1.51 . . 2 . . . . . . . . 142 1
55 . 1 1 15 15 ILE HG21 H 1 .87 . . 1 . . . . . . . . 142 1
56 . 1 1 15 15 ILE HG22 H 1 .87 . . 1 . . . . . . . . 142 1
57 . 1 1 15 15 ILE HG23 H 1 .87 . . 1 . . . . . . . . 142 1
58 . 1 1 15 15 ILE HD11 H 1 .92 . . 1 . . . . . . . . 142 1
59 . 1 1 15 15 ILE HD12 H 1 .92 . . 1 . . . . . . . . 142 1
60 . 1 1 15 15 ILE HD13 H 1 .92 . . 1 . . . . . . . . 142 1
61 . 1 1 16 16 GLY H H 1 8.11 . . 1 . . . . . . . . 142 1
62 . 1 1 16 16 GLY HA2 H 1 3.9 . . 2 . . . . . . . . 142 1
63 . 1 1 16 16 GLY HA3 H 1 3.95 . . 2 . . . . . . . . 142 1
64 . 1 1 17 17 ALA H H 1 7.91 . . 1 . . . . . . . . 142 1
65 . 1 1 17 17 ALA HA H 1 4.25 . . 1 . . . . . . . . 142 1
66 . 1 1 17 17 ALA HB1 H 1 1.41 . . 1 . . . . . . . . 142 1
67 . 1 1 17 17 ALA HB2 H 1 1.41 . . 1 . . . . . . . . 142 1
68 . 1 1 17 17 ALA HB3 H 1 1.41 . . 1 . . . . . . . . 142 1
69 . 1 1 18 18 GLN H H 1 8.16 . . 1 . . . . . . . . 142 1
70 . 1 1 18 18 GLN HA H 1 4.31 . . 1 . . . . . . . . 142 1
71 . 1 1 18 18 GLN HB2 H 1 2.05 . . 2 . . . . . . . . 142 1
72 . 1 1 18 18 GLN HB3 H 1 2.19 . . 2 . . . . . . . . 142 1
73 . 1 1 19 19 SER H H 1 7.98 . . 1 . . . . . . . . 142 1
74 . 1 1 19 19 SER HA H 1 4.4 . . 1 . . . . . . . . 142 1
75 . 1 1 19 19 SER HB2 H 1 3.89 . . 1 . . . . . . . . 142 1
76 . 1 1 19 19 SER HB3 H 1 3.89 . . 1 . . . . . . . . 142 1
77 . 1 1 20 20 GLY H H 1 8.16 . . 1 . . . . . . . . 142 1
78 . 1 1 20 20 GLY HA2 H 1 3.91 . . 2 . . . . . . . . 142 1
79 . 1 1 20 20 GLY HA3 H 1 3.99 . . 2 . . . . . . . . 142 1
80 . 1 1 21 21 LEU H H 1 7.92 . . 1 . . . . . . . . 142 1
81 . 1 1 21 21 LEU HA H 1 4.36 . . 1 . . . . . . . . 142 1
82 . 1 1 21 21 LEU HB2 H 1 1.65 . . 1 . . . . . . . . 142 1
83 . 1 1 21 21 LEU HB3 H 1 1.65 . . 1 . . . . . . . . 142 1
84 . 1 1 21 21 LEU HG H 1 1.86 . . 1 . . . . . . . . 142 1
85 . 1 1 21 21 LEU HD11 H 1 .9 . . 1 . . . . . . . . 142 1
86 . 1 1 21 21 LEU HD12 H 1 .9 . . 1 . . . . . . . . 142 1
87 . 1 1 21 21 LEU HD13 H 1 .9 . . 1 . . . . . . . . 142 1
88 . 1 1 21 21 LEU HD21 H 1 .9 . . 1 . . . . . . . . 142 1
89 . 1 1 21 21 LEU HD22 H 1 .9 . . 1 . . . . . . . . 142 1
90 . 1 1 21 21 LEU HD23 H 1 .9 . . 1 . . . . . . . . 142 1
91 . 1 1 22 22 GLY H H 1 8.24 . . 1 . . . . . . . . 142 1
92 . 1 1 22 22 GLY HA2 H 1 3.94 . . 1 . . . . . . . . 142 1
93 . 1 1 23 23 CYS H H 1 7.84 . . 1 . . . . . . . . 142 1
94 . 1 1 23 23 CYS HA H 1 4.44 . . 1 . . . . . . . . 142 1
95 . 1 1 23 23 CYS HB2 H 1 3.04 . . 1 . . . . . . . . 142 1
96 . 1 1 23 23 CYS HB3 H 1 3.04 . . 1 . . . . . . . . 142 1
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save_