Content for NMR-STAR saveframe, "set_1"
save_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode set_1
_Assigned_chem_shift_list.Entry_ID 5542
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Conditions
_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 NOESY 1 $sample_1 . 5542 1
2 TOCSY 1 $sample_1 . 5542 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.Ambiguity_set_ID
_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 GLN H H 1 8.52 0.01 . 1 . . . . . . . . . 5542 1
2 . 1 1 2 2 GLN HA H 1 4.48 0.01 . 1 . . . . . . . . . 5542 1
3 . 1 1 2 2 GLN HB2 H 1 2.07 0.01 . 2 . . . . . . . . . 5542 1
4 . 1 1 2 2 GLN HB3 H 1 2.15 0.01 . 2 . . . . . . . . . 5542 1
5 . 1 1 2 2 GLN HG2 H 1 2.42 0.01 . 1 . . . . . . . . . 5542 1
6 . 1 1 2 2 GLN HG3 H 1 2.42 0.01 . 1 . . . . . . . . . 5542 1
7 . 1 1 3 3 ILE H H 1 8.57 0.01 . 1 . . . . . . . . . 5542 1
8 . 1 1 3 3 ILE HA H 1 4.13 0.01 . 1 . . . . . . . . . 5542 1
9 . 1 1 3 3 ILE HB H 1 1.95 0.01 . 1 . . . . . . . . . 5542 1
10 . 1 1 3 3 ILE HG12 H 1 1.24 0.01 . 2 . . . . . . . . . 5542 1
11 . 1 1 3 3 ILE HG21 H 1 0.96 0.01 . 1 . . . . . . . . . 5542 1
12 . 1 1 3 3 ILE HG22 H 1 0.96 0.01 . 1 . . . . . . . . . 5542 1
13 . 1 1 3 3 ILE HG23 H 1 0.96 0.01 . 1 . . . . . . . . . 5542 1
14 . 1 1 3 3 ILE HD11 H 1 0.90 0.01 . 1 . . . . . . . . . 5542 1
15 . 1 1 3 3 ILE HD12 H 1 0.90 0.01 . 1 . . . . . . . . . 5542 1
16 . 1 1 3 3 ILE HD13 H 1 0.90 0.01 . 1 . . . . . . . . . 5542 1
17 . 1 1 4 4 LYS H H 1 8.39 0.01 . 1 . . . . . . . . . 5542 1
18 . 1 1 4 4 LYS HA H 1 4.27 0.01 . 1 . . . . . . . . . 5542 1
19 . 1 1 4 4 LYS HG2 H 1 1.39 0.01 . 4 . . . . . . . . . 5542 1
20 . 1 1 5 5 ILE H H 1 7.79 0.01 . 1 . . . . . . . . . 5542 1
21 . 1 1 5 5 ILE HA H 1 4.09 0.01 . 1 . . . . . . . . . 5542 1
22 . 1 1 5 5 ILE HB H 1 1.88 0.01 . 1 . . . . . . . . . 5542 1
23 . 1 1 5 5 ILE HG12 H 1 1.21 0.01 . 2 . . . . . . . . . 5542 1
24 . 1 1 5 5 ILE HG21 H 1 0.85 0.01 . 4 . . . . . . . . . 5542 1
25 . 1 1 5 5 ILE HG22 H 1 0.85 0.01 . 4 . . . . . . . . . 5542 1
26 . 1 1 5 5 ILE HG23 H 1 0.85 0.01 . 4 . . . . . . . . . 5542 1
27 . 1 1 5 5 ILE HD11 H 1 0.85 0.01 . 4 . . . . . . . . . 5542 1
28 . 1 1 5 5 ILE HD12 H 1 0.85 0.01 . 4 . . . . . . . . . 5542 1
29 . 1 1 5 5 ILE HD13 H 1 0.85 0.01 . 4 . . . . . . . . . 5542 1
30 . 1 1 6 6 TRP H H 1 8.03 0.01 . 1 . . . . . . . . . 5542 1
31 . 1 1 6 6 TRP HA H 1 4.40 0.01 . 1 . . . . . . . . . 5542 1
32 . 1 1 6 6 TRP HB2 H 1 3.30 0.01 . 2 . . . . . . . . . 5542 1
33 . 1 1 6 6 TRP HB3 H 1 3.26 0.01 . 2 . . . . . . . . . 5542 1
34 . 1 1 6 6 TRP HD1 H 1 7.45 0.01 . 4 . . . . . . . . . 5542 1
35 . 1 1 7 7 PHE H H 1 8.01 0.01 . 1 . . . . . . . . . 5542 1
36 . 1 1 7 7 PHE HA H 1 4.09 0.01 . 1 . . . . . . . . . 5542 1
37 . 1 1 7 7 PHE HB2 H 1 3.15 0.01 . 1 . . . . . . . . . 5542 1
38 . 1 1 7 7 PHE HB3 H 1 3.15 0.01 . 1 . . . . . . . . . 5542 1
39 . 1 1 8 8 GLN H H 1 8.27 0.01 . 1 . . . . . . . . . 5542 1
40 . 1 1 8 8 GLN HA H 1 4.14 0.01 . 1 . . . . . . . . . 5542 1
41 . 1 1 8 8 GLN HB2 H 1 2.11 0.01 . 2 . . . . . . . . . 5542 1
42 . 1 1 8 8 GLN HG2 H 1 2.40 0.01 . 2 . . . . . . . . . 5542 1
43 . 1 1 8 8 GLN HG3 H 1 2.44 0.01 . 2 . . . . . . . . . 5542 1
44 . 1 1 9 9 ASN H H 1 8.40 0.01 . 1 . . . . . . . . . 5542 1
45 . 1 1 9 9 ASN HA H 1 4.59 0.01 . 1 . . . . . . . . . 5542 1
46 . 1 1 9 9 ASN HB2 H 1 2.75 0.01 . 2 . . . . . . . . . 5542 1
47 . 1 1 9 9 ASN HB3 H 1 2.83 0.01 . 2 . . . . . . . . . 5542 1
48 . 1 1 10 10 ARG H H 1 8.00 0.01 . 1 . . . . . . . . . 5542 1
49 . 1 1 10 10 ARG HA H 1 4.23 0.01 . 1 . . . . . . . . . 5542 1
50 . 1 1 10 10 ARG HB2 H 1 1.73 0.01 . 2 . . . . . . . . . 5542 1
51 . 1 1 10 10 ARG HB3 H 1 1.83 0.01 . 2 . . . . . . . . . 5542 1
52 . 1 1 11 11 ARG H H 1 8.10 0.01 . 1 . . . . . . . . . 5542 1
53 . 1 1 11 11 ARG HA H 1 4.13 0.01 . 1 . . . . . . . . . 5542 1
54 . 1 1 11 11 ARG HB2 H 1 1.77 0.01 . 2 . . . . . . . . . 5542 1
55 . 1 1 11 11 ARG HB3 H 1 1.84 0.01 . 2 . . . . . . . . . 5542 1
56 . 1 1 12 12 MET H H 1 8.05 0.01 . 1 . . . . . . . . . 5542 1
57 . 1 1 12 12 MET HA H 1 4.30 0.01 . 1 . . . . . . . . . 5542 1
58 . 1 1 12 12 MET HB2 H 1 1.98 0.01 . 2 . . . . . . . . . 5542 1
59 . 1 1 12 12 MET HG2 H 1 2.50 0.01 . 2 . . . . . . . . . 5542 1
60 . 1 1 12 12 MET HG3 H 1 2.53 0.01 . 2 . . . . . . . . . 5542 1
61 . 1 1 13 13 LYS H H 1 7.97 0.01 . 1 . . . . . . . . . 5542 1
62 . 1 1 13 13 LYS HA H 1 4.24 0.01 . 1 . . . . . . . . . 5542 1
63 . 1 1 13 13 LYS HB2 H 1 1.63 0.01 . 2 . . . . . . . . . 5542 1
64 . 1 1 13 13 LYS HB3 H 1 1.73 0.01 . 2 . . . . . . . . . 5542 1
65 . 1 1 13 13 LYS HG2 H 1 1.36 0.01 . 4 . . . . . . . . . 5542 1
66 . 1 1 14 14 TRP H H 1 7.98 0.01 . 1 . . . . . . . . . 5542 1
67 . 1 1 14 14 TRP HA H 1 4.71 0.01 . 1 . . . . . . . . . 5542 1
68 . 1 1 14 14 TRP HB2 H 1 3.22 0.01 . 2 . . . . . . . . . 5542 1
69 . 1 1 14 14 TRP HB3 H 1 3.33 0.01 . 2 . . . . . . . . . 5542 1
70 . 1 1 14 14 TRP HD1 H 1 7.47 0.01 . 4 . . . . . . . . . 5542 1
71 . 1 1 15 15 LYS H H 1 8.11 0.01 . 1 . . . . . . . . . 5542 1
72 . 1 1 15 15 LYS HA H 1 4.20 0.01 . 1 . . . . . . . . . 5542 1
73 . 1 1 15 15 LYS HG2 H 1 1.45 0.01 . 4 . . . . . . . . . 5542 1
74 . 1 1 15 15 LYS HG3 H 1 1.50 0.01 . 4 . . . . . . . . . 5542 1
stop_
loop_
_Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID
_Ambiguous_atom_chem_shift.Atom_chem_shift_ID
_Ambiguous_atom_chem_shift.Entry_ID
_Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID
1 19 5542 1
2 24 5542 1
2 25 5542 1
2 26 5542 1
2 27 5542 1
2 28 5542 1
2 29 5542 1
3 34 5542 1
4 65 5542 1
5 70 5542 1
6 73 5542 1
6 74 5542 1
stop_
save_