Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 20114
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_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 '2D DQF-COSY' . . . 20114 1
2 '2D 1H-1H TOCSY' . . . 20114 1
3 '2D 1H-1H NOESY' . . . 20114 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 2 2 CYS HA H 1 4.432 . . 1 . . . . 2 CYS HA . 20114 1
2 . 1 1 2 2 CYS HB2 H 1 3.401 . . 2 . . . . 2 CYS HB2 . 20114 1
3 . 1 1 2 2 CYS HB3 H 1 2.873 . . 2 . . . . 2 CYS HB3 . 20114 1
4 . 1 1 3 3 CYS H H 1 8.721 . . 1 . . . . 3 CYS HN . 20114 1
5 . 1 1 3 3 CYS HA H 1 4.725 . . 1 . . . . 3 CYS HA . 20114 1
6 . 1 1 3 3 CYS HB2 H 1 3.471 . . 2 . . . . 3 CYS HB2 . 20114 1
7 . 1 1 3 3 CYS HB3 H 1 2.875 . . 2 . . . . 3 CYS HB3 . 20114 1
8 . 1 1 4 4 GLU H H 1 7.986 . . 1 . . . . 4 GLU HN . 20114 1
9 . 1 1 4 4 GLU HA H 1 4.569 . . 1 . . . . 4 GLU HA . 20114 1
10 . 1 1 4 4 GLU HB2 H 1 2.238 . . 2 . . . . 4 GLU HB2 . 20114 1
11 . 1 1 4 4 GLU HB3 H 1 2.383 . . 2 . . . . 4 GLU HB3 . 20114 1
12 . 1 1 4 4 GLU HG2 H 1 2.496 . . . . . . . 4 GLU HG . 20114 1
13 . 1 1 4 4 GLU HG3 H 1 2.496 . . . . . . . 4 GLU HG . 20114 1
14 . 1 1 5 5 ILE H H 1 8.244 . . 1 . . . . 5 ILE HN . 20114 1
15 . 1 1 5 5 ILE HA H 1 4.775 . . 1 . . . . 5 ILE HA . 20114 1
16 . 1 1 5 5 ILE HB H 1 2.247 . . 1 . . . . 5 ILE HB . 20114 1
17 . 1 1 5 5 ILE HD11 H 1 0.926 . . 1 . . . . 5 ILE HD . 20114 1
18 . 1 1 5 5 ILE HD12 H 1 0.926 . . 1 . . . . 5 ILE HD . 20114 1
19 . 1 1 5 5 ILE HD13 H 1 0.926 . . 1 . . . . 5 ILE HD . 20114 1
20 . 1 1 5 5 ILE HG12 H 1 1.219 . . 2 . . . . 5 ILE HG12 . 20114 1
21 . 1 1 5 5 ILE HG13 H 1 1.122 . . 2 . . . . 5 ILE HG13 . 20114 1
22 . 1 1 5 5 ILE HG21 H 1 1.772 . . 1 . . . . 5 ILE HG2 . 20114 1
23 . 1 1 5 5 ILE HG22 H 1 1.772 . . 1 . . . . 5 ILE HG2 . 20114 1
24 . 1 1 5 5 ILE HG23 H 1 1.772 . . 1 . . . . 5 ILE HG2 . 20114 1
25 . 1 1 6 6 PRO HA H 1 4.259 . . 1 . . . . 6 PRO HA . 20114 1
26 . 1 1 6 6 PRO HB2 H 1 2.263 . . 2 . . . . 6 PRO HB2 . 20114 1
27 . 1 1 6 6 PRO HB3 H 1 2.094 . . 2 . . . . 6 PRO HB3 . 20114 1
28 . 1 1 6 6 PRO HD2 H 1 4.175 . . 2 . . . . 6 PRO HD2 . 20114 1
29 . 1 1 6 6 PRO HD3 H 1 4.025 . . 2 . . . . 6 PRO HD3 . 20114 1
30 . 1 1 6 6 PRO HG2 H 1 2.295 . . . . . . . 6 PRO HG . 20114 1
31 . 1 1 6 6 PRO HG3 H 1 2.295 . . . . . . . 6 PRO HG . 20114 1
32 . 1 1 7 7 ALA H H 1 8.629 . . 1 . . . . 7 ALA HN . 20114 1
33 . 1 1 7 7 ALA HA H 1 4.201 . . 1 . . . . 7 ALA HA . 20114 1
34 . 1 1 7 7 ALA HB1 H 1 1.460 . . 1 . . . . 7 ALA HB . 20114 1
35 . 1 1 7 7 ALA HB2 H 1 1.460 . . 1 . . . . 7 ALA HB . 20114 1
36 . 1 1 7 7 ALA HB3 H 1 1.460 . . 1 . . . . 7 ALA HB . 20114 1
37 . 1 1 8 8 CYS H H 1 7.785 . . 1 . . . . 8 CYS HN . 20114 1
38 . 1 1 8 8 CYS HA H 1 4.398 . . 1 . . . . 8 CYS HA . 20114 1
39 . 1 1 8 8 CYS HB2 H 1 4.523 . . 2 . . . . 8 CYS HB2 . 20114 1
40 . 1 1 8 8 CYS HB3 H 1 3.358 . . 2 . . . . 8 CYS HB3 . 20114 1
41 . 1 1 9 9 ILE H H 1 8.309 . . 1 . . . . 9 ILE HN . 20114 1
42 . 1 1 9 9 ILE HA H 1 3.684 . . 1 . . . . 9 ILE HA . 20114 1
43 . 1 1 9 9 ILE HB H 1 1.989 . . 1 . . . . 9 ILE HB . 20114 1
44 . 1 1 9 9 ILE HG12 H 1 0.918 . . 2 . . . . 9 ILE HG12 . 20114 1
45 . 1 1 9 9 ILE HG13 H 1 1.002 . . 2 . . . . 9 ILE HG13 . 20114 1
46 . 1 1 9 9 ILE HG21 H 1 1.141 . . 1 . . . . 9 ILE HG2 . 20114 1
47 . 1 1 9 9 ILE HG22 H 1 1.141 . . 1 . . . . 9 ILE HG2 . 20114 1
48 . 1 1 9 9 ILE HG23 H 1 1.141 . . 1 . . . . 9 ILE HG2 . 20114 1
49 . 1 1 10 10 MET H H 1 7.775 . . 1 . . . . 10 MET HN . 20114 1
50 . 1 1 10 10 MET HA H 1 4.208 . . 1 . . . . 10 MET HA . 20114 1
51 . 1 1 10 10 MET HB2 H 1 2.157 . . . . . . . 10 MET HB . 20114 1
52 . 1 1 10 10 MET HB3 H 1 2.157 . . . . . . . 10 MET HB . 20114 1
53 . 1 1 10 10 MET HG2 H 1 2.673 . . . . . . . 10 MET HG . 20114 1
54 . 1 1 10 10 MET HG3 H 1 2.673 . . . . . . . 10 MET HG . 20114 1
55 . 1 1 11 11 ASN H H 1 7.383 . . 1 . . . . 11 ASN HN . 20114 1
56 . 1 1 11 11 ASN HA H 1 4.859 . . 1 . . . . 11 ASN HA . 20114 1
57 . 1 1 11 11 ASN HB2 H 1 2.847 . . 2 . . . . 11 ASN HB2 . 20114 1
58 . 1 1 11 11 ASN HB3 H 1 3.010 . . 2 . . . . 11 ASN HB3 . 20114 1
59 . 1 1 11 11 ASN HD21 H 1 7.006 . . 2 . . . . 11 ASN HD21 . 20114 1
60 . 1 1 11 11 ASN HD22 H 1 7.681 . . 2 . . . . 11 ASN HD22 . 20114 1
61 . 1 1 12 12 ASN H H 1 7.802 . . 1 . . . . 12 ASN HN . 20114 1
62 . 1 1 12 12 ASN HA H 1 5.318 . . 1 . . . . 12 ASN HA . 20114 1
63 . 1 1 12 12 ASN HB2 H 1 2.702 . . 2 . . . . 12 ASN HB2 . 20114 1
64 . 1 1 12 12 ASN HB3 H 1 2.804 . . 2 . . . . 12 ASN HB3 . 20114 1
65 . 1 1 12 12 ASN HD21 H 1 7.754 . . 2 . . . . 12 ASN HD21 . 20114 1
66 . 1 1 12 12 ASN HD22 H 1 7.262 . . 2 . . . . 12 ASN HD22 . 20114 1
67 . 1 1 13 13 PRO HA H 1 4.491 . . 1 . . . . 13 PRO HA . 20114 1
68 . 1 1 13 13 PRO HB2 H 1 2.407 . . 2 . . . . 13 PRO HB2 . 20114 1
69 . 1 1 13 13 PRO HB3 H 1 2.076 . . 2 . . . . 13 PRO HB3 . 20114 1
70 . 1 1 13 13 PRO HD2 H 1 3.783 . . 2 . . . . 13 PRO HD2 . 20114 1
71 . 1 1 13 13 PRO HD3 H 1 3.559 . . 2 . . . . 13 PRO HD3 . 20114 1
72 . 1 1 13 13 PRO HG2 H 1 2.141 . . . . . . . 13 PRO HG . 20114 1
73 . 1 1 13 13 PRO HG3 H 1 2.141 . . . . . . . 13 PRO HG . 20114 1
74 . 1 1 14 14 ASP H H 1 8.547 . . 1 . . . . 14 ASP HN . 20114 1
75 . 1 1 14 14 ASP HA H 1 4.588 . . 1 . . . . 14 ASP HA . 20114 1
76 . 1 1 14 14 ASP HB2 H 1 2.778 . . 2 . . . . 14 ASP HB2 . 20114 1
77 . 1 1 14 14 ASP HB3 H 1 2.772 . . 2 . . . . 14 ASP HB3 . 20114 1
78 . 1 1 15 15 TYR H H 1 7.903 . . 1 . . . . 15 TYR HN . 20114 1
79 . 1 1 15 15 TYR HA H 1 4.487 . . 1 . . . . 15 TYR HA . 20114 1
80 . 1 1 15 15 TYR HB2 H 1 3.117 . . 2 . . . . 15 TYR HB2 . 20114 1
81 . 1 1 15 15 TYR HB3 H 1 3.256 . . 2 . . . . 15 TYR HB3 . 20114 1
82 . 1 1 15 15 TYR HD1 H 1 7.175 . . 3 . . . . 15 TYR HD . 20114 1
83 . 1 1 15 15 TYR HD2 H 1 7.175 . . 3 . . . . 15 TYR HD . 20114 1
84 . 1 1 15 15 TYR HE1 H 1 6.886 . . 3 . . . . 15 TYR HE . 20114 1
85 . 1 1 15 15 TYR HE2 H 1 6.886 . . 3 . . . . 15 TYR HE . 20114 1
86 . 1 1 16 16 CYS H H 1 7.928 . . 1 . . . . 16 CYS HN . 20114 1
87 . 1 1 16 16 CYS HA H 1 4.828 . . 1 . . . . 16 CYS HA . 20114 1
88 . 1 1 16 16 CYS HB2 H 1 3.424 . . 2 . . . . 16 CYS HB2 . 20114 1
89 . 1 1 16 16 CYS HB3 H 1 2.804 . . 2 . . . . 16 CYS HB3 . 20114 1
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