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 6422
_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 . 6422 1
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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 TYR HA H 1 3.986 0.001 . . . . . . . . . . 6422 1
2 . 1 1 1 1 TYR HB2 H 1 3.029 0.000 . . . . . . . . . . 6422 1
3 . 1 1 1 1 TYR HB3 H 1 2.763 0.000 . . . . . . . . . . 6422 1
4 . 1 1 1 1 TYR HD1 H 1 7.026 0.000 . . . . . . . . . . 6422 1
5 . 1 1 1 1 TYR HE1 H 1 6.667 0.000 . . . . . . . . . . 6422 1
6 . 1 1 2 2 CYS H H 1 8.815 0.000 . . . . . . . . . . 6422 1
7 . 1 1 2 2 CYS HA H 1 4.744 0.000 . . . . . . . . . . 6422 1
8 . 1 1 2 2 CYS HB2 H 1 3.021 0.001 . . . . . . . . . . 6422 1
9 . 1 1 2 2 CYS HB3 H 1 2.947 0.001 . . . . . . . . . . 6422 1
10 . 1 1 3 3 LYS H H 1 8.578 0.001 . . . . . . . . . . 6422 1
11 . 1 1 3 3 LYS HA H 1 4.269 0.002 . . . . . . . . . . 6422 1
12 . 1 1 3 3 LYS HB2 H 1 1.521 0.000 . . . . . . . . . . 6422 1
13 . 1 1 3 3 LYS HG2 H 1 1.252 0.002 . . . . . . . . . . 6422 1
14 . 1 1 3 3 LYS HG3 H 1 1.175 0.003 . . . . . . . . . . 6422 1
15 . 1 1 3 3 LYS HD2 H 1 1.462 0.000 . . . . . . . . . . 6422 1
16 . 1 1 3 3 LYS HE2 H 1 2.663 0.000 . . . . . . . . . . 6422 1
17 . 1 1 4 4 AA4 H H 1 8.089 0.001 . . . . . . . . . . 6422 1
18 . 1 1 4 4 AA4 HA H 1 4.314 0.002 . . . . . . . . . . 6422 1
19 . 1 1 4 4 AA4 HB2 H 1 1.980 0.001 . . . . . . . . . . 6422 1
20 . 1 1 4 4 AA4 HB3 H 1 1.874 0.001 . . . . . . . . . . 6422 1
21 . 1 1 4 4 AA4 HG1 H 1 1.593 0.001 . . . . . . . . . . 6422 1
22 . 1 1 5 5 PHE H H 1 7.994 0.003 . . . . . . . . . . 6422 1
23 . 1 1 5 5 PHE HA H 1 4.496 0.004 . . . . . . . . . . 6422 1
24 . 1 1 5 5 PHE HB2 H 1 2.678 0.003 . . . . . . . . . . 6422 1
25 . 1 1 5 5 PHE HB3 H 1 2.552 0.001 . . . . . . . . . . 6422 1
26 . 1 1 5 5 PHE HD1 H 1 6.726 0.003 . . . . . . . . . . 6422 1
27 . 1 1 5 5 PHE HE1 H 1 6.922 0.003 . . . . . . . . . . 6422 1
28 . 1 1 5 5 PHE HZ H 1 7.013 0.003 . . . . . . . . . . 6422 1
29 . 1 1 6 6 DTR H H 1 8.104 0.002 . . . . . . . . . . 6422 1
30 . 1 1 6 6 DTR HA H 1 4.352 0.001 . . . . . . . . . . 6422 1
31 . 1 1 6 6 DTR HB2 H 1 2.722 0.001 . . . . . . . . . . 6422 1
32 . 1 1 6 6 DTR HB3 H 1 2.673 0.001 . . . . . . . . . . 6422 1
33 . 1 1 6 6 DTR HD1 H 1 7.011 0.003 . . . . . . . . . . 6422 1
34 . 1 1 6 6 DTR HE3 H 1 7.539 0.001 . . . . . . . . . . 6422 1
35 . 1 1 6 6 DTR HE1 H 1 10.758 0.003 . . . . . . . . . . 6422 1
36 . 1 1 6 6 DTR HZ2 H 1 7.314 0.001 . . . . . . . . . . 6422 1
37 . 1 1 6 6 DTR HZ3 H 1 7.008 0.001 . . . . . . . . . . 6422 1
38 . 1 1 6 6 DTR HH2 H 1 7.083 0.001 . . . . . . . . . . 6422 1
39 . 1 1 7 7 IAM H H 1 8.694 0.002 . . . . . . . . . . 6422 1
40 . 1 1 7 7 IAM HA H 1 4.442 0.001 . . . . . . . . . . 6422 1
41 . 1 1 7 7 IAM HB2 H 1 3.054 0.002 . . . . . . . . . . 6422 1
42 . 1 1 7 7 IAM HB3 H 1 2.756 0.003 . . . . . . . . . . 6422 1
43 . 1 1 7 7 IAM HD1 H 1 7.261 0.003 . . . . . . . . . . 6422 1
44 . 1 1 7 7 IAM HE1 H 1 7.306 0.001 . . . . . . . . . . 6422 1
45 . 1 1 7 7 IAM HK H 1 1.130 0.001 . . . . . . . . . . 6422 1
46 . 1 1 7 7 IAM HI H 1 3.124 0.002 . . . . . . . . . . 6422 1
47 . 1 1 7 7 IAM HT H 1 3.996 0.002 . . . . . . . . . . 6422 1
48 . 1 1 8 8 THR H H 1 7.651 0.003 . . . . . . . . . . 6422 1
49 . 1 1 8 8 THR HA H 1 4.188 0.002 . . . . . . . . . . 6422 1
50 . 1 1 8 8 THR HB H 1 3.930 0.001 . . . . . . . . . . 6422 1
51 . 1 1 8 8 THR HG21 H 1 0.897 0.002 . . . . . . . . . . 6422 1
52 . 1 1 8 8 THR HG22 H 1 0.897 0.002 . . . . . . . . . . 6422 1
53 . 1 1 8 8 THR HG23 H 1 0.897 0.002 . . . . . . . . . . 6422 1
54 . 1 1 9 9 PHE H H 1 7.681 0.000 . . . . . . . . . . 6422 1
55 . 1 1 9 9 PHE HA H 1 4.597 0.001 . . . . . . . . . . 6422 1
56 . 1 1 9 9 PHE HB2 H 1 2.961 0.000 . . . . . . . . . . 6422 1
57 . 1 1 9 9 PHE HB3 H 1 2.771 0.002 . . . . . . . . . . 6422 1
58 . 1 1 9 9 PHE HD1 H 1 7.109 0.002 . . . . . . . . . . 6422 1
59 . 1 1 9 9 PHE HE1 H 1 7.137 0.001 . . . . . . . . . . 6422 1
60 . 1 1 10 10 LYS H H 1 7.972 0.001 . . . . . . . . . . 6422 1
61 . 1 1 10 10 LYS HA H 1 4.531 0.001 . . . . . . . . . . 6422 1
62 . 1 1 10 10 LYS HB2 H 1 1.613 0.001 . . . . . . . . . . 6422 1
63 . 1 1 10 10 LYS HB3 H 1 1.437 0.001 . . . . . . . . . . 6422 1
64 . 1 1 10 10 LYS HG2 H 1 1.260 0.001 . . . . . . . . . . 6422 1
65 . 1 1 10 10 LYS HD2 H 1 1.112 0.001 . . . . . . . . . . 6422 1
66 . 1 1 10 10 LYS HE2 H 1 3.064 0.003 . . . . . . . . . . 6422 1
67 . 1 1 10 10 LYS HE3 H 1 2.990 0.004 . . . . . . . . . . 6422 1
68 . 1 1 10 10 LYS HZ1 H 1 7.576 0.001 . . . . . . . . . . 6422 1
69 . 1 1 10 10 LYS HZ2 H 1 7.576 0.001 . . . . . . . . . . 6422 1
70 . 1 1 10 10 LYS HZ3 H 1 7.576 0.001 . . . . . . . . . . 6422 1
71 . 1 1 11 11 SER H H 1 8.237 0.001 . . . . . . . . . . 6422 1
72 . 1 1 11 11 SER HA H 1 4.409 0.001 . . . . . . . . . . 6422 1
73 . 1 1 11 11 SER HB2 H 1 3.595 0.001 . . . . . . . . . . 6422 1
74 . 1 1 12 12 CYS H H 1 8.236 0.003 . . . . . . . . . . 6422 1
75 . 1 1 12 12 CYS HA H 1 4.558 0.001 . . . . . . . . . . 6422 1
76 . 1 1 12 12 CYS HB2 H 1 3.005 0.001 . . . . . . . . . . 6422 1
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