Content for NMR-STAR saveframe, "chemical_shift_set_1"
save_chemical_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1
_Assigned_chem_shift_list.Entry_ID 6954
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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_1 . 6954 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 3.938 0.001 . 2 . . . . . . . . 6954 1
2 . 1 1 1 1 GLY HA3 H 1 4.014 0.001 . 2 . . . . . . . . 6954 1
3 . 1 1 2 2 LEU HA H 1 4.101 0.004 . 1 . . . . . . . . 6954 1
4 . 1 1 2 2 LEU HG H 1 1.576 0.007 . 1 . . . . . . . . 6954 1
5 . 1 1 2 2 LEU H H 1 9.392 0.016 . 1 . . . . . . . . 6954 1
6 . 1 1 2 2 LEU HB2 H 1 1.702 0.001 . 1 . . . . . . . . 6954 1
7 . 1 1 2 2 LEU HD11 H 1 0.857 0.003 . 1 . . . . . . . . 6954 1
8 . 1 1 2 2 LEU HD12 H 1 0.857 0.003 . 1 . . . . . . . . 6954 1
9 . 1 1 2 2 LEU HD13 H 1 0.857 0.003 . 1 . . . . . . . . 6954 1
10 . 1 1 2 2 LEU HD21 H 1 0.943 0.001 . 1 . . . . . . . . 6954 1
11 . 1 1 2 2 LEU HD22 H 1 0.943 0.001 . 1 . . . . . . . . 6954 1
12 . 1 1 2 2 LEU HD23 H 1 0.943 0.001 . 1 . . . . . . . . 6954 1
13 . 1 1 3 3 PHE HA H 1 4.235 0.003 . 1 . . . . . . . . 6954 1
14 . 1 1 3 3 PHE HB2 H 1 3.209 0.003 . 2 . . . . . . . . 6954 1
15 . 1 1 3 3 PHE HB3 H 1 3.155 0.003 . 2 . . . . . . . . 6954 1
16 . 1 1 3 3 PHE H H 1 8.981 0.002 . 1 . . . . . . . . 6954 1
17 . 1 1 3 3 PHE HD1 H 1 7.275 0.003 . 1 . . . . . . . . 6954 1
18 . 1 1 3 3 PHE HE1 H 1 7.275 0.003 . 1 . . . . . . . . 6954 1
19 . 1 1 4 4 GLY HA2 H 1 3.771 0.003 . 2 . . . . . . . . 6954 1
20 . 1 1 4 4 GLY HA3 H 1 3.788 0.002 . 2 . . . . . . . . 6954 1
21 . 1 1 4 4 GLY H H 1 8.531 0.001 . 1 . . . . . . . . 6954 1
22 . 1 1 5 5 ALA HA H 1 4.267 0.006 . 1 . . . . . . . . 6954 1
23 . 1 1 5 5 ALA H H 1 8.195 0.002 . 1 . . . . . . . . 6954 1
24 . 1 1 5 5 ALA HB1 H 1 1.550 0.001 . 1 . . . . . . . . 6954 1
25 . 1 1 5 5 ALA HB2 H 1 1.550 0.001 . 1 . . . . . . . . 6954 1
26 . 1 1 5 5 ALA HB3 H 1 1.550 0.001 . 1 . . . . . . . . 6954 1
27 . 1 1 6 6 ILE HA H 1 3.778 0.002 . 1 . . . . . . . . 6954 1
28 . 1 1 6 6 ILE HB H 1 1.986 0.002 . 1 . . . . . . . . 6954 1
29 . 1 1 6 6 ILE HG12 H 1 1.898 0.002 . 2 . . . . . . . . 6954 1
30 . 1 1 6 6 ILE HG13 H 1 1.078 0.002 . 2 . . . . . . . . 6954 1
31 . 1 1 6 6 ILE H H 1 8.155 0.004 . 1 . . . . . . . . 6954 1
32 . 1 1 6 6 ILE HD11 H 1 0.845 0.002 . 1 . . . . . . . . 6954 1
33 . 1 1 6 6 ILE HD12 H 1 0.845 0.002 . 1 . . . . . . . . 6954 1
34 . 1 1 6 6 ILE HD13 H 1 0.845 0.002 . 1 . . . . . . . . 6954 1
35 . 1 1 6 6 ILE HG21 H 1 0.947 0.004 . 1 . . . . . . . . 6954 1
36 . 1 1 6 6 ILE HG22 H 1 0.947 0.004 . 1 . . . . . . . . 6954 1
37 . 1 1 6 6 ILE HG23 H 1 0.947 0.004 . 1 . . . . . . . . 6954 1
38 . 1 1 7 7 ALA HA H 1 3.923 0.003 . 1 . . . . . . . . 6954 1
39 . 1 1 7 7 ALA H H 1 8.536 0.003 . 1 . . . . . . . . 6954 1
40 . 1 1 7 7 ALA HB1 H 1 1.373 0.003 . 1 . . . . . . . . 6954 1
41 . 1 1 7 7 ALA HB2 H 1 1.373 0.003 . 1 . . . . . . . . 6954 1
42 . 1 1 7 7 ALA HB3 H 1 1.373 0.003 . 1 . . . . . . . . 6954 1
43 . 1 1 8 8 GLY H H 1 8.202 0.002 . 1 . . . . . . . . 6954 1
44 . 1 1 8 8 GLY HA2 H 1 3.918 0.003 . 1 . . . . . . . . 6954 1
45 . 1 1 8 8 GLY HA3 H 1 3.918 0.003 . 1 . . . . . . . . 6954 1
46 . 1 1 9 9 PHE HA H 1 4.450 0.015 . 1 . . . . . . . . 6954 1
47 . 1 1 9 9 PHE H H 1 7.909 0.002 . 1 . . . . . . . . 6954 1
48 . 1 1 9 9 PHE HB2 H 1 3.303 0.002 . 1 . . . . . . . . 6954 1
49 . 1 1 9 9 PHE HB3 H 1 3.303 0.002 . 1 . . . . . . . . 6954 1
50 . 1 1 9 9 PHE HD1 H 1 7.256 0.001 . 1 . . . . . . . . 6954 1
51 . 1 1 9 9 PHE HE1 H 1 7.256 0.001 . 1 . . . . . . . . 6954 1
52 . 1 1 10 10 ILE HA H 1 3.650 0.003 . 1 . . . . . . . . 6954 1
53 . 1 1 10 10 ILE HB H 1 2.047 0.003 . 1 . . . . . . . . 6954 1
54 . 1 1 10 10 ILE H H 1 8.172 0.004 . 1 . . . . . . . . 6954 1
55 . 1 1 10 10 ILE HD11 H 1 0.886 0.004 . 1 . . . . . . . . 6954 1
56 . 1 1 10 10 ILE HD12 H 1 0.886 0.004 . 1 . . . . . . . . 6954 1
57 . 1 1 10 10 ILE HD13 H 1 0.886 0.004 . 1 . . . . . . . . 6954 1
58 . 1 1 10 10 ILE HG12 H 1 1.281 0.004 . 1 . . . . . . . . 6954 1
59 . 1 1 10 10 ILE HG13 H 1 1.281 0.004 . 1 . . . . . . . . 6954 1
60 . 1 1 10 10 ILE HG21 H 1 0.931 0.005 . 1 . . . . . . . . 6954 1
61 . 1 1 10 10 ILE HG22 H 1 0.931 0.005 . 1 . . . . . . . . 6954 1
62 . 1 1 10 10 ILE HG23 H 1 0.931 0.005 . 1 . . . . . . . . 6954 1
63 . 1 1 11 11 GLU HA H 1 3.991 0.005 . 1 . . . . . . . . 6954 1
64 . 1 1 11 11 GLU HG2 H 1 2.477 0.005 . 2 . . . . . . . . 6954 1
65 . 1 1 11 11 GLU HG3 H 1 2.352 0.003 . 2 . . . . . . . . 6954 1
66 . 1 1 11 11 GLU H H 1 8.395 0.003 . 1 . . . . . . . . 6954 1
67 . 1 1 11 11 GLU HB2 H 1 2.121 0.002 . 1 . . . . . . . . 6954 1
68 . 1 1 11 11 GLU HB3 H 1 2.121 0.002 . 1 . . . . . . . . 6954 1
69 . 1 1 12 12 ASN HA H 1 4.657 0.004 . 1 . . . . . . . . 6954 1
70 . 1 1 12 12 ASN HD21 H 1 6.901 0.001 . 2 . . . . . . . . 6954 1
71 . 1 1 12 12 ASN HD22 H 1 7.659 0.002 . 2 . . . . . . . . 6954 1
72 . 1 1 12 12 ASN H H 1 8.084 0.002 . 1 . . . . . . . . 6954 1
73 . 1 1 12 12 ASN HB2 H 1 2.814 0.003 . 1 . . . . . . . . 6954 1
74 . 1 1 13 13 GLY H H 1 8.178 0.002 . 1 . . . . . . . . 6954 1
75 . 1 1 13 13 GLY HA2 H 1 3.784 0.004 . 1 . . . . . . . . 6954 1
76 . 1 1 13 13 GLY HA3 H 1 3.784 0.004 . 1 . . . . . . . . 6954 1
77 . 1 1 14 14 ALA HA H 1 3.936 0.006 . 1 . . . . . . . . 6954 1
78 . 1 1 14 14 ALA H H 1 8.424 0.002 . 1 . . . . . . . . 6954 1
79 . 1 1 14 14 ALA HB1 H 1 1.379 0.003 . 1 . . . . . . . . 6954 1
80 . 1 1 14 14 ALA HB2 H 1 1.379 0.003 . 1 . . . . . . . . 6954 1
81 . 1 1 14 14 ALA HB3 H 1 1.379 0.003 . 1 . . . . . . . . 6954 1
82 . 1 1 15 15 GLU HA H 1 4.033 0.004 . 1 . . . . . . . . 6954 1
83 . 1 1 15 15 GLU HG2 H 1 2.428 0.004 . 2 . . . . . . . . 6954 1
84 . 1 1 15 15 GLU HG3 H 1 2.345 0.004 . 2 . . . . . . . . 6954 1
85 . 1 1 15 15 GLU H H 1 8.233 0.001 . 1 . . . . . . . . 6954 1
86 . 1 1 15 15 GLU HB2 H 1 2.106 0.012 . 1 . . . . . . . . 6954 1
87 . 1 1 15 15 GLU HB3 H 1 2.106 0.012 . 1 . . . . . . . . 6954 1
88 . 1 1 16 16 GLY H H 1 8.182 0.003 . 1 . . . . . . . . 6954 1
89 . 1 1 16 16 GLY HA2 H 1 3.962 0.003 . 1 . . . . . . . . 6954 1
90 . 1 1 16 16 GLY HA3 H 1 3.962 0.003 . 1 . . . . . . . . 6954 1
91 . 1 1 17 17 MET HA H 1 4.392 0.007 . 1 . . . . . . . . 6954 1
92 . 1 1 17 17 MET HB2 H 1 2.163 0.006 . 2 . . . . . . . . 6954 1
93 . 1 1 17 17 MET HB3 H 1 2.113 0.003 . 2 . . . . . . . . 6954 1
94 . 1 1 17 17 MET HG2 H 1 2.570 0.003 . 2 . . . . . . . . 6954 1
95 . 1 1 17 17 MET HG3 H 1 2.646 0.004 . 2 . . . . . . . . 6954 1
96 . 1 1 17 17 MET H H 1 7.933 0.002 . 1 . . . . . . . . 6954 1
97 . 1 1 18 18 ILE HA H 1 4.146 0.005 . 1 . . . . . . . . 6954 1
98 . 1 1 18 18 ILE HB H 1 1.920 0.004 . 1 . . . . . . . . 6954 1
99 . 1 1 18 18 ILE HG12 H 1 1.542 0.002 . 2 . . . . . . . . 6954 1
100 . 1 1 18 18 ILE HG13 H 1 1.174 0.004 . 2 . . . . . . . . 6954 1
101 . 1 1 18 18 ILE H H 1 7.849 0.002 . 1 . . . . . . . . 6954 1
102 . 1 1 18 18 ILE HD11 H 1 0.861 0.004 . 1 . . . . . . . . 6954 1
103 . 1 1 18 18 ILE HD12 H 1 0.861 0.004 . 1 . . . . . . . . 6954 1
104 . 1 1 18 18 ILE HD13 H 1 0.861 0.004 . 1 . . . . . . . . 6954 1
105 . 1 1 18 18 ILE HG21 H 1 0.921 0.002 . 1 . . . . . . . . 6954 1
106 . 1 1 18 18 ILE HG22 H 1 0.921 0.002 . 1 . . . . . . . . 6954 1
107 . 1 1 18 18 ILE HG23 H 1 0.921 0.002 . 1 . . . . . . . . 6954 1
108 . 1 1 19 19 ASP HA H 1 4.607 0.002 . 1 . . . . . . . . 6954 1
109 . 1 1 19 19 ASP H H 1 8.362 0.003 . 1 . . . . . . . . 6954 1
110 . 1 1 19 19 ASP HB2 H 1 2.735 0.002 . 1 . . . . . . . . 6954 1
111 . 1 1 20 20 GLY H H 1 8.331 0.001 . 1 . . . . . . . . 6954 1
112 . 1 1 20 20 GLY HA2 H 1 3.987 0.003 . 1 . . . . . . . . 6954 1
113 . 1 1 20 20 GLY HA3 H 1 3.987 0.003 . 1 . . . . . . . . 6954 1
stop_
save_