Content for NMR-STAR saveframe, "chemical_shift_set_2"
save_chemical_shift_set_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_2
_Assigned_chem_shift_list.Entry_ID 5211
_Assigned_chem_shift_list.ID 2
_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 . 5211 2
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 . 2 2 3 3 SER H H 1 8.498 . . . . . . . . . . . 5211 2
2 . 2 2 3 3 SER HA H 1 4.613 . . . . . . . . . . . 5211 2
3 . 2 2 3 3 SER HB3 H 1 3.835 . . . . . . . . . . . 5211 2
4 . 2 2 3 3 SER HB2 H 1 4.041 . . . . . . . . . . . 5211 2
5 . 2 2 4 4 LEU H H 1 8.782 . . . . . . . . . . . 5211 2
6 . 2 2 4 4 LEU HA H 1 4.613 . . . . . . . . . . . 5211 2
7 . 2 2 4 4 LEU HB3 H 1 1.750 . . . . . . . . . . . 5211 2
8 . 2 2 4 4 LEU HB2 H 1 1.570 . . . . . . . . . . . 5211 2
9 . 2 2 4 4 LEU HG H 1 1.381 . . . . . . . . . . . 5211 2
10 . 2 2 4 4 LEU HD11 H 1 0.790 . . . . . . . . . . . 5211 2
11 . 2 2 4 4 LEU HD12 H 1 0.790 . . . . . . . . . . . 5211 2
12 . 2 2 4 4 LEU HD13 H 1 0.790 . . . . . . . . . . . 5211 2
13 . 2 2 4 4 LEU HD21 H 1 0.790 . . . . . . . . . . . 5211 2
14 . 2 2 4 4 LEU HD22 H 1 0.790 . . . . . . . . . . . 5211 2
15 . 2 2 4 4 LEU HD23 H 1 0.790 . . . . . . . . . . . 5211 2
16 . 2 2 5 5 THR H H 1 7.676 . . . . . . . . . . . 5211 2
17 . 2 2 5 5 THR HA H 1 4.592 . . . . . . . . . . . 5211 2
18 . 2 2 5 5 THR HB H 1 3.738 . . . . . . . . . . . 5211 2
19 . 2 2 5 5 THR HG21 H 1 0.442 . . . . . . . . . . . 5211 2
20 . 2 2 5 5 THR HG22 H 1 0.442 . . . . . . . . . . . 5211 2
21 . 2 2 5 5 THR HG23 H 1 0.442 . . . . . . . . . . . 5211 2
22 . 2 2 6 6 ILE H H 1 8.103 . . . . . . . . . . . 5211 2
23 . 2 2 6 6 ILE HA H 1 3.921 . . . . . . . . . . . 5211 2
24 . 2 2 6 6 ILE HB H 1 0.724 . . . . . . . . . . . 5211 2
25 . 2 2 6 6 ILE HG13 H 1 0.444 . . . . . . . . . . . 5211 2
26 . 2 2 6 6 ILE HG12 H 1 0.529 . . . . . . . . . . . 5211 2
27 . 2 2 6 6 ILE HD11 H 1 0.127 . . . . . . . . . . . 5211 2
28 . 2 2 6 6 ILE HD12 H 1 0.127 . . . . . . . . . . . 5211 2
29 . 2 2 6 6 ILE HD13 H 1 0.127 . . . . . . . . . . . 5211 2
30 . 2 2 6 6 ILE HG21 H 1 0.127 . . . . . . . . . . . 5211 2
31 . 2 2 6 6 ILE HG22 H 1 0.127 . . . . . . . . . . . 5211 2
32 . 2 2 6 6 ILE HG23 H 1 0.127 . . . . . . . . . . . 5211 2
33 . 2 2 7 7 TYR H H 1 8.591 . . . . . . . . . . . 5211 2
34 . 2 2 7 7 TYR HA H 1 4.800 . . . . . . . . . . . 5211 2
35 . 2 2 7 7 TYR HB3 H 1 2.709 . . . . . . . . . . . 5211 2
36 . 2 2 7 7 TYR HB2 H 1 2.975 . . . . . . . . . . . 5211 2
37 . 2 2 7 7 TYR HD1 H 1 7.003 . . . . . . . . . . . 5211 2
38 . 2 2 7 7 TYR HE1 H 1 6.768 . . . . . . . . . . . 5211 2
39 . 2 2 7 7 TYR HE2 H 1 6.768 . . . . . . . . . . . 5211 2
40 . 2 2 7 7 TYR HD2 H 1 7.003 . . . . . . . . . . . 5211 2
41 . 2 2 8 8 ALA H H 1 8.438 . . . . . . . . . . . 5211 2
42 . 2 2 8 8 ALA HA H 1 4.726 . . . . . . . . . . . 5211 2
43 . 2 2 8 8 ALA HB1 H 1 0.943 . . . . . . . . . . . 5211 2
44 . 2 2 8 8 ALA HB2 H 1 0.943 . . . . . . . . . . . 5211 2
45 . 2 2 8 8 ALA HB3 H 1 0.943 . . . . . . . . . . . 5211 2
46 . 2 2 9 9 GLN H H 1 8.356 . . . . . . . . . . . 5211 2
47 . 2 2 9 9 GLN HA H 1 4.908 . . . . . . . . . . . 5211 2
48 . 2 2 9 9 GLN HB3 H 1 1.686 . . . . . . . . . . . 5211 2
49 . 2 2 9 9 GLN HB2 H 1 1.860 . . . . . . . . . . . 5211 2
50 . 2 2 9 9 GLN HG3 H 1 2.132 . . . . . . . . . . . 5211 2
51 . 2 2 9 9 GLN HG2 H 1 2.334 . . . . . . . . . . . 5211 2
52 . 2 2 9 9 GLN HE21 H 1 6.673 . . . . . . . . . . . 5211 2
53 . 2 2 9 9 GLN HE22 H 1 7.914 . . . . . . . . . . . 5211 2
54 . 2 2 10 10 VAL H H 1 9.625 . . . . . . . . . . . 5211 2
55 . 2 2 10 10 VAL HA H 1 3.963 . . . . . . . . . . . 5211 2
56 . 2 2 10 10 VAL HB H 1 2.242 . . . . . . . . . . . 5211 2
57 . 2 2 10 10 VAL HG21 H 1 1.419 . . . . . . . . . . . 5211 2
58 . 2 2 10 10 VAL HG22 H 1 1.419 . . . . . . . . . . . 5211 2
59 . 2 2 10 10 VAL HG23 H 1 1.419 . . . . . . . . . . . 5211 2
60 . 2 2 10 10 VAL HG11 H 1 0.776 . . . . . . . . . . . 5211 2
61 . 2 2 10 10 VAL HG12 H 1 0.776 . . . . . . . . . . . 5211 2
62 . 2 2 10 10 VAL HG13 H 1 0.776 . . . . . . . . . . . 5211 2
63 . 2 2 11 11 GLN H H 1 9.417 . . . . . . . . . . . 5211 2
64 . 2 2 11 11 GLN HA H 1 4.273 . . . . . . . . . . . 5211 2
65 . 2 2 11 11 GLN HB3 H 1 1.689 . . . . . . . . . . . 5211 2
66 . 2 2 11 11 GLN HB2 H 1 1.831 . . . . . . . . . . . 5211 2
67 . 2 2 11 11 GLN HG3 H 1 2.510 . . . . . . . . . . . 5211 2
68 . 2 2 11 11 GLN HG2 H 1 2.698 . . . . . . . . . . . 5211 2
69 . 2 2 11 11 GLN HE21 H 1 7.228 . . . . . . . . . . . 5211 2
70 . 2 2 12 12 LYS H H 1 7.576 . . . . . . . . . . . 5211 2
71 . 2 2 12 12 LYS HA H 1 4.192 . . . . . . . . . . . 5211 2
72 . 2 2 12 12 LYS HB3 H 1 1.691 . . . . . . . . . . . 5211 2
73 . 2 2 12 12 LYS HB2 H 1 1.789 . . . . . . . . . . . 5211 2
74 . 2 2 12 12 LYS HG3 H 1 1.243 . . . . . . . . . . . 5211 2
75 . 2 2 12 12 LYS HG2 H 1 1.114 . . . . . . . . . . . 5211 2
76 . 2 2 12 12 LYS HD3 H 1 1.445 . . . . . . . . . . . 5211 2
77 . 2 2 12 12 LYS HD2 H 1 1.445 . . . . . . . . . . . 5211 2
78 . 2 2 12 12 LYS HE3 H 1 2.893 . . . . . . . . . . . 5211 2
79 . 2 2 12 12 LYS HE2 H 1 3.036 . . . . . . . . . . . 5211 2
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