Content for NMR-STAR saveframe, "shift_set_2"
save_shift_set_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_2
_Assigned_chem_shift_list.Entry_ID 5544
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Ex-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
. . 2 $sample_2 . 5544 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 . 3 2 1 1 THR HA H 1 4.15 . . . . . . . . . . . 5544 2
2 . 3 2 1 1 THR HB H 1 3.87 . . . . . . . . . . . 5544 2
3 . 3 2 1 1 THR HG21 H 1 1.29 . . . . . . . . . . . 5544 2
4 . 3 2 1 1 THR HG22 H 1 1.29 . . . . . . . . . . . 5544 2
5 . 3 2 1 1 THR HG23 H 1 1.29 . . . . . . . . . . . 5544 2
6 . 3 2 2 2 ARG H H 1 8.15 . . . . . . . . . . . 5544 2
7 . 3 2 2 2 ARG HA H 1 4.42 . . . . . . . . . . . 5544 2
8 . 3 2 2 2 ARG HB2 H 1 1.81 . . . . . . . . . . . 5544 2
9 . 3 2 2 2 ARG HB3 H 1 1.77 . . . . . . . . . . . 5544 2
10 . 3 2 2 2 ARG HG2 H 1 1.59 . . . . . . . . . . . 5544 2
11 . 3 2 2 2 ARG HD2 H 1 3.09 . . . . . . . . . . . 5544 2
12 . 3 2 3 3 THR H H 1 8.17 . . . . . . . . . . . 5544 2
13 . 3 2 3 3 THR HA H 1 4.28 . . . . . . . . . . . 5544 2
14 . 3 2 3 3 THR HB H 1 4.14 . . . . . . . . . . . 5544 2
15 . 3 2 3 3 THR HG21 H 1 1.15 . . . . . . . . . . . 5544 2
16 . 3 2 3 3 THR HG22 H 1 1.15 . . . . . . . . . . . 5544 2
17 . 3 2 3 3 THR HG23 H 1 1.15 . . . . . . . . . . . 5544 2
18 . 3 2 4 4 LYS H H 1 7.89 . . . . . . . . . . . 5544 2
19 . 3 2 4 4 LYS HA H 1 4.34 . . . . . . . . . . . 5544 2
20 . 3 2 4 4 LYS HB2 H 1 1.58 . . . . . . . . . . . 5544 2
21 . 3 2 4 4 LYS HG2 H 1 1.21 . . . . . . . . . . . 5544 2
22 . 3 2 4 4 LYS HD2 H 1 1.37 . . . . . . . . . . . 5544 2
23 . 3 2 4 4 LYS HE2 H 1 2.92 . . . . . . . . . . . 5544 2
24 . 3 2 5 5 ILE H H 1 8.39 . . . . . . . . . . . 5544 2
25 . 3 2 5 5 ILE HA H 1 3.75 . . . . . . . . . . . 5544 2
26 . 3 2 5 5 ILE HB H 1 1.55 . . . . . . . . . . . 5544 2
27 . 3 2 5 5 ILE HG12 H 1 1.46 . . . . . . . . . . . 5544 2
28 . 3 2 5 5 ILE HG13 H 1 1.35 . . . . . . . . . . . 5544 2
29 . 3 2 5 5 ILE HG21 H 1 0.74 . . . . . . . . . . . 5544 2
30 . 3 2 5 5 ILE HG22 H 1 0.74 . . . . . . . . . . . 5544 2
31 . 3 2 5 5 ILE HG23 H 1 0.74 . . . . . . . . . . . 5544 2
32 . 3 2 5 5 ILE HD11 H 1 0.57 . . . . . . . . . . . 5544 2
33 . 3 2 5 5 ILE HD12 H 1 0.57 . . . . . . . . . . . 5544 2
34 . 3 2 5 5 ILE HD13 H 1 0.57 . . . . . . . . . . . 5544 2
35 . 3 2 6 6 ASP H H 1 7.98 . . . . . . . . . . . 5544 2
36 . 3 2 6 6 ASP HA H 1 4.58 . . . . . . . . . . . 5544 2
37 . 3 2 6 6 ASP HB2 H 1 2.74 . . . . . . . . . . . 5544 2
38 . 3 2 6 6 ASP HB3 H 1 2.69 . . . . . . . . . . . 5544 2
39 . 3 2 7 7 TRP H H 1 8.49 . . . . . . . . . . . 5544 2
40 . 3 2 7 7 TRP HA H 1 4.15 . . . . . . . . . . . 5544 2
41 . 3 2 7 7 TRP HB2 H 1 3.33 . . . . . . . . . . . 5544 2
42 . 3 2 7 7 TRP HB3 H 1 3.12 . . . . . . . . . . . 5544 2
43 . 3 2 7 7 TRP HD1 H 1 7.45 . . . . . . . . . . . 5544 2
44 . 3 2 7 7 TRP HE3 H 1 7.51 . . . . . . . . . . . 5544 2
45 . 3 2 7 7 TRP HZ2 H 1 7.14 . . . . . . . . . . . 5544 2
46 . 3 2 7 7 TRP HZ3 H 1 6.98 . . . . . . . . . . . 5544 2
47 . 3 2 7 7 TRP HH2 H 1 7.44 . . . . . . . . . . . 5544 2
48 . 3 2 7 7 TRP HE1 H 1 10.34 . . . . . . . . . . . 5544 2
49 . 3 2 8 8 ASN H H 1 8.76 . . . . . . . . . . . 5544 2
50 . 3 2 8 8 ASN HA H 1 4.57 . . . . . . . . . . . 5544 2
51 . 3 2 8 8 ASN HB2 H 1 2.96 . . . . . . . . . . . 5544 2
52 . 3 2 8 8 ASN HB3 H 1 2.81 . . . . . . . . . . . 5544 2
53 . 3 2 8 8 ASN HD21 H 1 7.75 . . . . . . . . . . . 5544 2
54 . 3 2 8 8 ASN HD22 H 1 6.9 . . . . . . . . . . . 5544 2
55 . 3 2 9 9 LYS H H 1 7.75 . . . . . . . . . . . 5544 2
56 . 3 2 9 9 LYS HA H 1 4.26 . . . . . . . . . . . 5544 2
57 . 3 2 9 9 LYS HB2 H 1 1.92 . . . . . . . . . . . 5544 2
58 . 3 2 9 9 LYS HE2 H 1 3.0 . . . . . . . . . . . 5544 2
59 . 3 2 10 10 ILE H H 1 7.33 . . . . . . . . . . . 5544 2
60 . 3 2 10 10 ILE HA H 1 4.12 . . . . . . . . . . . 5544 2
61 . 3 2 10 10 ILE HB H 1 2.09 . . . . . . . . . . . 5544 2
62 . 3 2 10 10 ILE HG12 H 1 1.33 . . . . . . . . . . . 5544 2
63 . 3 2 10 10 ILE HG13 H 1 1.07 . . . . . . . . . . . 5544 2
64 . 3 2 10 10 ILE HG21 H 1 0.98 . . . . . . . . . . . 5544 2
65 . 3 2 10 10 ILE HG22 H 1 0.98 . . . . . . . . . . . 5544 2
66 . 3 2 10 10 ILE HG23 H 1 0.98 . . . . . . . . . . . 5544 2
67 . 3 2 10 10 ILE HD11 H 1 0.45 . . . . . . . . . . . 5544 2
68 . 3 2 10 10 ILE HD12 H 1 0.45 . . . . . . . . . . . 5544 2
69 . 3 2 10 10 ILE HD13 H 1 0.45 . . . . . . . . . . . 5544 2
70 . 3 2 11 11 LEU H H 1 7.9 . . . . . . . . . . . 5544 2
71 . 3 2 11 11 LEU HA H 1 4.58 . . . . . . . . . . . 5544 2
72 . 3 2 11 11 LEU HD11 H 1 1.01 . . . . . . . . . . . 5544 2
73 . 3 2 11 11 LEU HD12 H 1 1.01 . . . . . . . . . . . 5544 2
74 . 3 2 11 11 LEU HD13 H 1 1.01 . . . . . . . . . . . 5544 2
75 . 3 2 11 11 LEU HD21 H 1 0.96 . . . . . . . . . . . 5544 2
76 . 3 2 11 11 LEU HD22 H 1 0.96 . . . . . . . . . . . 5544 2
77 . 3 2 11 11 LEU HD23 H 1 0.96 . . . . . . . . . . . 5544 2
78 . 3 2 12 12 SER H H 1 7.58 . . . . . . . . . . . 5544 2
79 . 3 2 12 12 SER HA H 1 4.32 . . . . . . . . . . . 5544 2
80 . 3 2 12 12 SER HB2 H 1 3.93 . . . . . . . . . . . 5544 2
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