Content for NMR-STAR saveframe, "chemical_shifts_set_2"
save_chemical_shifts_set_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shifts_set_2
_Assigned_chem_shift_list.Entry_ID 5543
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $Condition_2
_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 2 $sample_2 . 5543 2
2 TOCSY 2 $sample_2 . 5543 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 . 1 1 1 1 ARG HA H 1 4.15 0.01 . 1 . . . . . . . . 5543 2
2 . 1 1 2 2 GLN H H 1 8.54 0.01 . 1 . . . . . . . . 5543 2
3 . 1 1 2 2 GLN HA H 1 4.66 0.01 . 1 . . . . . . . . 5543 2
4 . 1 1 2 2 GLN HB2 H 1 2.03 0.01 . 2 . . . . . . . . 5543 2
5 . 1 1 2 2 GLN HB3 H 1 2.17 0.01 . 2 . . . . . . . . 5543 2
6 . 1 1 2 2 GLN HG2 H 1 2.38 0.01 . 2 . . . . . . . . 5543 2
7 . 1 1 3 3 ILE H H 1 8.01 0.01 . 1 . . . . . . . . 5543 2
8 . 1 1 3 3 ILE HA H 1 3.92 0.01 . 1 . . . . . . . . 5543 2
9 . 1 1 3 3 ILE HB H 1 1.98 0.01 . 1 . . . . . . . . 5543 2
10 . 1 1 3 3 ILE HG12 H 1 1.26 0.01 . 2 . . . . . . . . 5543 2
11 . 1 1 3 3 ILE HG21 H 1 1.62 0.01 . 1 . . . . . . . . 5543 2
12 . 1 1 3 3 ILE HG22 H 1 1.62 0.01 . 1 . . . . . . . . 5543 2
13 . 1 1 3 3 ILE HG23 H 1 1.62 0.01 . 1 . . . . . . . . 5543 2
14 . 1 1 3 3 ILE HD11 H 1 1 0.01 . 1 . . . . . . . . 5543 2
15 . 1 1 3 3 ILE HD12 H 1 1 0.01 . 1 . . . . . . . . 5543 2
16 . 1 1 3 3 ILE HD13 H 1 1 0.01 . 1 . . . . . . . . 5543 2
17 . 1 1 4 4 LYS H H 1 8 0.01 . 1 . . . . . . . . 5543 2
18 . 1 1 4 4 LYS HA H 1 4.07 0.01 . 1 . . . . . . . . 5543 2
19 . 1 1 4 4 LYS HB2 H 1 1.89 0.01 . 2 . . . . . . . . 5543 2
20 . 1 1 5 5 ILE H H 1 7.35 0.01 . 1 . . . . . . . . 5543 2
21 . 1 1 5 5 ILE HA H 1 3.85 0.01 . 1 . . . . . . . . 5543 2
22 . 1 1 5 5 ILE HB H 1 1.88 0.01 . 2 . . . . . . . . 5543 2
23 . 1 1 5 5 ILE HD11 H 1 0.85 0.01 . 1 . . . . . . . . 5543 2
24 . 1 1 5 5 ILE HD12 H 1 0.85 0.01 . 1 . . . . . . . . 5543 2
25 . 1 1 5 5 ILE HD13 H 1 0.85 0.01 . 1 . . . . . . . . 5543 2
26 . 1 1 6 6 PHE H H 1 7.74 0.01 . 1 . . . . . . . . 5543 2
27 . 1 1 6 6 PHE HA H 1 4.3 0.01 . 1 . . . . . . . . 5543 2
28 . 1 1 6 6 PHE HB2 H 1 3.09 0.01 . 2 . . . . . . . . 5543 2
29 . 1 1 7 7 PHE H H 1 7.84 0.01 . 1 . . . . . . . . 5543 2
30 . 1 1 7 7 PHE HA H 1 4.2 0.01 . 1 . . . . . . . . 5543 2
31 . 1 1 7 7 PHE HB2 H 1 3.29 0.01 . 2 . . . . . . . . 5543 2
32 . 1 1 7 7 PHE HB3 H 1 3.1 0.01 . 2 . . . . . . . . 5543 2
33 . 1 1 8 8 GLN H H 1 8.23 0.01 . 1 . . . . . . . . 5543 2
34 . 1 1 8 8 GLN HA H 1 4.07 0.01 . 1 . . . . . . . . 5543 2
35 . 1 1 8 8 GLN HB2 H 1 2.16 0.01 . 2 . . . . . . . . 5543 2
36 . 1 1 9 9 ASN H H 1 8.05 0.01 . 1 . . . . . . . . 5543 2
37 . 1 1 9 9 ASN HA H 1 4.61 0.01 . 1 . . . . . . . . 5543 2
38 . 1 1 9 9 ASN HB2 H 1 2.81 0.01 . 2 . . . . . . . . 5543 2
39 . 1 1 9 9 ASN HB3 H 1 2.74 0.01 . 2 . . . . . . . . 5543 2
40 . 1 1 10 10 ARG H H 1 7.6 0.01 . 1 . . . . . . . . 5543 2
41 . 1 1 10 10 ARG HA H 1 4.21 0.01 . 1 . . . . . . . . 5543 2
42 . 1 1 10 10 ARG HB2 H 1 1.82 0.01 . 2 . . . . . . . . 5543 2
43 . 1 1 10 10 ARG HB3 H 1 1.7 0.01 . 2 . . . . . . . . 5543 2
44 . 1 1 11 11 ARG H H 1 7.7 0.01 . 1 . . . . . . . . 5543 2
45 . 1 1 11 11 ARG HA H 1 4.2 0.01 . 1 . . . . . . . . 5543 2
46 . 1 1 11 11 ARG HB2 H 1 1.67 0.01 . 2 . . . . . . . . 5543 2
47 . 1 1 11 11 ARG HG2 H 1 1.28 0.01 . 2 . . . . . . . . 5543 2
48 . 1 1 12 12 MET H H 1 8.02 0.01 . 1 . . . . . . . . 5543 2
49 . 1 1 12 12 MET HA H 1 4.1 0.01 . 1 . . . . . . . . 5543 2
50 . 1 1 12 12 MET HB2 H 1 1.84 0.01 . 2 . . . . . . . . 5543 2
51 . 1 1 13 13 LYS H H 1 7.8 0.01 . 1 . . . . . . . . 5543 2
52 . 1 1 13 13 LYS HA H 1 4.32 0.01 . 1 . . . . . . . . 5543 2
53 . 1 1 13 13 LYS HB2 H 1 2.01 0.01 . 2 . . . . . . . . 5543 2
54 . 1 1 13 13 LYS HG2 H 1 2.54 0.01 . 2 . . . . . . . . 5543 2
55 . 1 1 14 14 PHE H H 1 7.69 0.01 . 1 . . . . . . . . 5543 2
56 . 1 1 14 14 PHE HA H 1 4.57 0.01 . 1 . . . . . . . . 5543 2
57 . 1 1 14 14 PHE HB2 H 1 3.2 0.01 . 2 . . . . . . . . 5543 2
58 . 1 1 14 14 PHE HB3 H 1 3 0.01 . 2 . . . . . . . . 5543 2
59 . 1 1 15 15 LYS H H 1 7.73 0.01 . 1 . . . . . . . . 5543 2
60 . 1 1 15 15 LYS HA H 1 4.3 0.01 . 1 . . . . . . . . 5543 2
61 . 1 1 15 15 LYS HB2 H 1 1.78 0.01 . 2 . . . . . . . . 5543 2
62 . 1 1 15 15 LYS HG2 H 1 1.44 0.01 . 2 . . . . . . . . 5543 2
63 . 1 1 16 16 LYS H H 1 7.77 0.01 . 1 . . . . . . . . 5543 2
64 . 1 1 16 16 LYS HA H 1 4.28 0.01 . 1 . . . . . . . . 5543 2
65 . 1 1 16 16 LYS HB2 H 1 1.84 0.01 . 1 . . . . . . . . 5543 2
66 . 1 1 16 16 LYS HG2 H 1 1.46 0.01 . 1 . . . . . . . . 5543 2
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save_