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 490
_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 . 490 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 ASN HA H 1 4.38 . . 1 . . . . . . . . 490 1
2 . 1 1 1 1 ASN HB2 H 1 2.96 . . 2 . . . . . . . . 490 1
3 . 1 1 1 1 ASN HB3 H 1 3 . . 2 . . . . . . . . 490 1
4 . 1 1 1 1 ASN HD21 H 1 7 . . 2 . . . . . . . . 490 1
5 . 1 1 1 1 ASN HD22 H 1 7.73 . . 2 . . . . . . . . 490 1
6 . 1 1 2 2 ASP H H 1 8.86 . . 1 . . . . . . . . 490 1
7 . 1 1 2 2 ASP HA H 1 4.63 . . 1 . . . . . . . . 490 1
8 . 1 1 2 2 ASP HB2 H 1 2.64 . . 2 . . . . . . . . 490 1
9 . 1 1 2 2 ASP HB3 H 1 2.76 . . 2 . . . . . . . . 490 1
10 . 1 1 3 3 GLY H H 1 8.48 . . 1 . . . . . . . . 490 1
11 . 1 1 3 3 GLY HA2 H 1 3.87 . . 2 . . . . . . . . 490 1
12 . 1 1 3 3 GLY HA3 H 1 3.99 . . 2 . . . . . . . . 490 1
13 . 1 1 4 4 ASP H H 1 8.03 . . 1 . . . . . . . . 490 1
14 . 1 1 4 4 ASP HA H 1 4.57 . . 1 . . . . . . . . 490 1
15 . 1 1 4 4 ASP HB2 H 1 2.61 . . 1 . . . . . . . . 490 1
16 . 1 1 4 4 ASP HB3 H 1 2.61 . . 1 . . . . . . . . 490 1
17 . 1 1 5 5 PHE H H 1 8.19 . . 1 . . . . . . . . 490 1
18 . 1 1 5 5 PHE HA H 1 4.61 . . 1 . . . . . . . . 490 1
19 . 1 1 5 5 PHE HB2 H 1 3.04 . . 2 . . . . . . . . 490 1
20 . 1 1 5 5 PHE HB3 H 1 3.16 . . 2 . . . . . . . . 490 1
21 . 1 1 5 5 PHE HD1 H 1 7.25 . . 1 . . . . . . . . 490 1
22 . 1 1 5 5 PHE HD2 H 1 7.25 . . 1 . . . . . . . . 490 1
23 . 1 1 5 5 PHE HE1 H 1 7.36 . . 1 . . . . . . . . 490 1
24 . 1 1 5 5 PHE HE2 H 1 7.36 . . 1 . . . . . . . . 490 1
25 . 1 1 5 5 PHE HZ H 1 7.31 . . 1 . . . . . . . . 490 1
26 . 1 1 6 6 GLU H H 1 8.18 . . 1 . . . . . . . . 490 1
27 . 1 1 6 6 GLU HA H 1 4.27 . . 1 . . . . . . . . 490 1
28 . 1 1 6 6 GLU HB2 H 1 1.89 . . 2 . . . . . . . . 490 1
29 . 1 1 6 6 GLU HB3 H 1 2 . . 2 . . . . . . . . 490 1
30 . 1 1 6 6 GLU HG2 H 1 2.26 . . 1 . . . . . . . . 490 1
31 . 1 1 6 6 GLU HG3 H 1 2.26 . . 1 . . . . . . . . 490 1
32 . 1 1 7 7 GLU H H 1 8.32 . . 1 . . . . . . . . 490 1
33 . 1 1 7 7 GLU HA H 1 4.28 . . 1 . . . . . . . . 490 1
34 . 1 1 7 7 GLU HB2 H 1 1.93 . . 2 . . . . . . . . 490 1
35 . 1 1 7 7 GLU HB3 H 1 2.02 . . 2 . . . . . . . . 490 1
36 . 1 1 7 7 GLU HG2 H 1 2.28 . . 1 . . . . . . . . 490 1
37 . 1 1 7 7 GLU HG3 H 1 2.28 . . 1 . . . . . . . . 490 1
38 . 1 1 8 8 ILE H H 1 8.26 . . 1 . . . . . . . . 490 1
39 . 1 1 8 8 ILE HA H 1 4.45 . . 1 . . . . . . . . 490 1
40 . 1 1 8 8 ILE HB H 1 1.86 . . 1 . . . . . . . . 490 1
41 . 1 1 8 8 ILE HG12 H 1 1.16 . . 2 . . . . . . . . 490 1
42 . 1 1 8 8 ILE HG13 H 1 1.51 . . 2 . . . . . . . . 490 1
43 . 1 1 8 8 ILE HG21 H 1 .94 . . 1 . . . . . . . . 490 1
44 . 1 1 8 8 ILE HG22 H 1 .94 . . 1 . . . . . . . . 490 1
45 . 1 1 8 8 ILE HG23 H 1 .94 . . 1 . . . . . . . . 490 1
46 . 1 1 8 8 ILE HD11 H 1 .84 . . 1 . . . . . . . . 490 1
47 . 1 1 8 8 ILE HD12 H 1 .84 . . 1 . . . . . . . . 490 1
48 . 1 1 8 8 ILE HD13 H 1 .84 . . 1 . . . . . . . . 490 1
49 . 1 1 9 9 PRO HA H 1 4.39 . . 1 . . . . . . . . 490 1
50 . 1 1 9 9 PRO HB2 H 1 1.87 . . 2 . . . . . . . . 490 1
51 . 1 1 9 9 PRO HB3 H 1 2.31 . . 2 . . . . . . . . 490 1
52 . 1 1 9 9 PRO HG2 H 1 1.97 . . 2 . . . . . . . . 490 1
53 . 1 1 9 9 PRO HG3 H 1 2.02 . . 2 . . . . . . . . 490 1
54 . 1 1 9 9 PRO HD2 H 1 3.65 . . 2 . . . . . . . . 490 1
55 . 1 1 9 9 PRO HD3 H 1 3.89 . . 2 . . . . . . . . 490 1
56 . 1 1 10 10 GLU H H 1 8.46 . . 1 . . . . . . . . 490 1
57 . 1 1 10 10 GLU HA H 1 4.16 . . 1 . . . . . . . . 490 1
58 . 1 1 10 10 GLU HB2 H 1 1.97 . . 1 . . . . . . . . 490 1
59 . 1 1 10 10 GLU HB3 H 1 1.97 . . 1 . . . . . . . . 490 1
60 . 1 1 10 10 GLU HG2 H 1 2.34 . . 1 . . . . . . . . 490 1
61 . 1 1 10 10 GLU HG3 H 1 2.34 . . 1 . . . . . . . . 490 1
62 . 1 1 11 11 GLU H H 1 8.45 . . 1 . . . . . . . . 490 1
63 . 1 1 11 11 GLU HA H 1 4.22 . . 1 . . . . . . . . 490 1
64 . 1 1 11 11 GLU HB2 H 1 1.92 . . 1 . . . . . . . . 490 1
65 . 1 1 11 11 GLU HB3 H 1 1.92 . . 1 . . . . . . . . 490 1
66 . 1 1 11 11 GLU HG2 H 1 2.16 . . 1 . . . . . . . . 490 1
67 . 1 1 11 11 GLU HG3 H 1 2.16 . . 1 . . . . . . . . 490 1
68 . 1 1 12 12 TYR H H 1 8.13 . . 1 . . . . . . . . 490 1
69 . 1 1 12 12 TYR HA H 1 4.63 . . 1 . . . . . . . . 490 1
70 . 1 1 12 12 TYR HB2 H 1 2.94 . . 2 . . . . . . . . 490 1
71 . 1 1 12 12 TYR HB3 H 1 3.12 . . 2 . . . . . . . . 490 1
72 . 1 1 12 12 TYR HD1 H 1 7.12 . . 1 . . . . . . . . 490 1
73 . 1 1 12 12 TYR HD2 H 1 7.12 . . 1 . . . . . . . . 490 1
74 . 1 1 12 12 TYR HE1 H 1 6.83 . . 1 . . . . . . . . 490 1
75 . 1 1 12 12 TYR HE2 H 1 6.83 . . 1 . . . . . . . . 490 1
76 . 1 1 13 13 LEU H H 1 8.04 . . 1 . . . . . . . . 490 1
77 . 1 1 13 13 LEU HA H 1 4.36 . . 1 . . . . . . . . 490 1
78 . 1 1 13 13 LEU HB2 H 1 1.62 . . 1 . . . . . . . . 490 1
79 . 1 1 13 13 LEU HB3 H 1 1.62 . . 1 . . . . . . . . 490 1
80 . 1 1 13 13 LEU HG H 1 1.53 . . 1 . . . . . . . . 490 1
81 . 1 1 13 13 LEU HD11 H 1 .84 . . 2 . . . . . . . . 490 1
82 . 1 1 13 13 LEU HD12 H 1 .84 . . 2 . . . . . . . . 490 1
83 . 1 1 13 13 LEU HD13 H 1 .84 . . 2 . . . . . . . . 490 1
84 . 1 1 13 13 LEU HD21 H 1 .9 . . 2 . . . . . . . . 490 1
85 . 1 1 13 13 LEU HD22 H 1 .9 . . 2 . . . . . . . . 490 1
86 . 1 1 13 13 LEU HD23 H 1 .9 . . 2 . . . . . . . . 490 1
87 . 1 1 14 14 GLN H H 1 7.76 . . 1 . . . . . . . . 490 1
88 . 1 1 14 14 GLN HA H 1 4.15 . . 1 . . . . . . . . 490 1
89 . 1 1 14 14 GLN HB2 H 1 2.13 . . 2 . . . . . . . . 490 1
90 . 1 1 14 14 GLN HB3 H 1 1.93 . . 2 . . . . . . . . 490 1
91 . 1 1 14 14 GLN HG2 H 1 2.29 . . 1 . . . . . . . . 490 1
92 . 1 1 14 14 GLN HG3 H 1 2.29 . . 1 . . . . . . . . 490 1
93 . 1 1 14 14 GLN HE21 H 1 6.8 . . 2 . . . . . . . . 490 1
94 . 1 1 14 14 GLN HE22 H 1 7.5 . . 2 . . . . . . . . 490 1
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save_