Content for NMR-STAR saveframe, assigned_chemical_shifts_1
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 53494
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name L50-free-pH65_310K
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_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 .
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_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 '2D 1H-15N HSQC' . . . 53494 1
3 '2D 1H-1H ROESY' . . . 53494 1
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loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 53494 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_assembly_asym_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 1 1 ARG H H 1 8.38 0.01 . 1 . . . . . 1 ARG H . 53494 1
2 . 1 . 1 1 1 ARG HA H 1 4.56 0.01 . 1 . . . . . 1 ARG HA . 53494 1
3 . 1 . 1 2 2 VAL H H 1 8.77 0.01 . 1 . . . . . 2 VAL H . 53494 1
4 . 1 . 1 2 2 VAL HA H 1 4.65 0.01 . 1 . . . . . 2 VAL HA . 53494 1
5 . 1 . 1 2 2 VAL HB H 1 1.91 0.01 . 1 . . . . . 2 VAL HB . 53494 1
6 . 1 . 1 2 2 VAL HG11 H 1 0.85 0.01 . 2 . . . . . 2 VAL HG11 . 53494 1
7 . 1 . 1 2 2 VAL HG12 H 1 0.85 0.01 . 2 . . . . . 2 VAL HG12 . 53494 1
8 . 1 . 1 2 2 VAL HG13 H 1 0.85 0.01 . 2 . . . . . 2 VAL HG13 . 53494 1
9 . 1 . 1 2 2 VAL HG21 H 1 0.80 0.01 . 2 . . . . . 2 VAL HG21 . 53494 1
10 . 1 . 1 2 2 VAL HG22 H 1 0.80 0.01 . 2 . . . . . 2 VAL HG22 . 53494 1
11 . 1 . 1 2 2 VAL HG23 H 1 0.80 0.01 . 2 . . . . . 2 VAL HG23 . 53494 1
12 . 1 . 1 2 2 VAL CB C 13 33.9 0.2 . 1 . . . . . 2 VAL CB . 53494 1
13 . 1 . 1 2 2 VAL CG1 C 13 21.1 0.2 . 2 . . . . . 2 VAL CG1 . 53494 1
14 . 1 . 1 2 2 VAL CG2 C 13 21.3 0.2 . 2 . . . . . 2 VAL CG2 . 53494 1
15 . 1 . 1 3 3 ARG H H 1 8.77 0.01 . 1 . . . . . 3 ARG H . 53494 1
16 . 1 . 1 3 3 ARG HA H 1 4.76 0.01 . 1 . . . . . 3 ARG HA . 53494 1
17 . 1 . 1 4 4 THR H H 1 8.60 0.01 . 1 . . . . . 4 THR H . 53494 1
18 . 1 . 1 4 4 THR HA H 1 4.51 0.01 . 1 . . . . . 4 THR HA . 53494 1
19 . 1 . 1 4 4 THR HB H 1 4.07 0.01 . 1 . . . . . 4 THR HB . 53494 1
20 . 1 . 1 4 4 THR HG21 H 1 1.09 0.01 . 1 . . . . . 4 THR HG21 . 53494 1
21 . 1 . 1 4 4 THR HG22 H 1 1.09 0.01 . 1 . . . . . 4 THR HG22 . 53494 1
22 . 1 . 1 4 4 THR HG23 H 1 1.09 0.01 . 1 . . . . . 4 THR HG23 . 53494 1
23 . 1 . 1 4 4 THR CB C 13 70.1 0.2 . 1 . . . . . 4 THR CB . 53494 1
24 . 1 . 1 4 4 THR CG2 C 13 21.8 0.2 . 1 . . . . . 4 THR CG2 . 53494 1
25 . 1 . 1 6 6 GLY HA2 H 1 3.72 0.01 . 2 . . . . . 6 GLY HA2 . 53494 1
26 . 1 . 1 6 6 GLY HA3 H 1 4.03 0.01 . 2 . . . . . 6 GLY HA3 . 53494 1
27 . 1 . 1 6 6 GLY CA C 13 46.9 0.2 . 1 . . . . . 6 GLY CA . 53494 1
28 . 1 . 1 7 7 LYS HA H 1 4.24 0.01 . 1 . . . . . 7 LYS HA . 53494 1
29 . 1 . 1 7 7 LYS HB2 H 1 1.99 0.01 . 1 . . . . . 7 LYS HB2 . 53494 1
30 . 1 . 1 7 7 LYS HB3 H 1 1.99 0.01 . 1 . . . . . 7 LYS HB3 . 53494 1
31 . 1 . 1 7 7 LYS HG2 H 1 1.45 0.01 . 1 . . . . . 7 LYS HG2 . 53494 1
32 . 1 . 1 7 7 LYS HG3 H 1 1.45 0.01 . 1 . . . . . 7 LYS HG3 . 53494 1
33 . 1 . 1 7 7 LYS HD2 H 1 1.68 0.01 . 1 . . . . . 7 LYS HD2 . 53494 1
34 . 1 . 1 7 7 LYS HD3 H 1 1.68 0.01 . 1 . . . . . 7 LYS HD3 . 53494 1
35 . 1 . 1 7 7 LYS HE2 H 1 3.00 0.01 . 1 . . . . . 7 LYS HE2 . 53494 1
36 . 1 . 1 7 7 LYS HE3 H 1 3.00 0.01 . 1 . . . . . 7 LYS HE3 . 53494 1
37 . 1 . 1 7 7 LYS CA C 13 56.7 0.2 . 1 . . . . . 7 LYS CA . 53494 1
38 . 1 . 1 7 7 LYS CB C 13 32.6 0.2 . 1 . . . . . 7 LYS CB . 53494 1
39 . 1 . 1 7 7 LYS CG C 13 25.1 0.2 . 1 . . . . . 7 LYS CG . 53494 1
40 . 1 . 1 7 7 LYS CD C 13 29.1 0.2 . 1 . . . . . 7 LYS CD . 53494 1
41 . 1 . 1 7 7 LYS CE C 13 42.2 0.2 . 1 . . . . . 7 LYS CE . 53494 1
42 . 1 . 1 8 8 ARG H H 1 7.93 0.01 . 1 . . . . . 8 ARG H . 53494 1
43 . 1 . 1 8 8 ARG HA H 1 4.51 0.01 . 1 . . . . . 8 ARG HA . 53494 1
44 . 1 . 1 9 9 ARG H H 1 8.49 0.01 . 1 . . . . . 9 ARG H . 53494 1
45 . 1 . 1 9 9 ARG HA H 1 4.74 0.01 . 1 . . . . . 9 ARG HA . 53494 1
46 . 1 . 1 10 10 ILE H H 1 8.79 0.01 . 1 . . . . . 10 ILE H . 53494 1
47 . 1 . 1 10 10 ILE HA H 1 4.34 0.01 . 1 . . . . . 10 ILE HA . 53494 1
48 . 1 . 1 10 10 ILE HB H 1 1.78 0.01 . 1 . . . . . 10 ILE HB . 53494 1
49 . 1 . 1 10 10 ILE HG12 H 1 1.09 0.01 . 1 . . . . . 10 ILE HG12 . 53494 1
50 . 1 . 1 10 10 ILE HG13 H 1 1.32 0.01 . 1 . . . . . 10 ILE HG13 . 53494 1
51 . 1 . 1 10 10 ILE HG21 H 1 0.85 0.01 . 1 . . . . . 10 ILE HG21 . 53494 1
52 . 1 . 1 10 10 ILE HG22 H 1 0.85 0.01 . 1 . . . . . 10 ILE HG22 . 53494 1
53 . 1 . 1 10 10 ILE HG23 H 1 0.85 0.01 . 1 . . . . . 10 ILE HG23 . 53494 1
54 . 1 . 1 10 10 ILE HD11 H 1 0.79 0.01 . 1 . . . . . 10 ILE HD11 . 53494 1
55 . 1 . 1 10 10 ILE HD12 H 1 0.79 0.01 . 1 . . . . . 10 ILE HD12 . 53494 1
56 . 1 . 1 10 10 ILE HD13 H 1 0.79 0.01 . 1 . . . . . 10 ILE HD13 . 53494 1
57 . 1 . 1 10 10 ILE CA C 13 60.2 0.2 . 1 . . . . . 10 ILE CA . 53494 1
58 . 1 . 1 10 10 ILE CB C 13 40.3 0.2 . 1 . . . . . 10 ILE CB . 53494 1
59 . 1 . 1 10 10 ILE CG1 C 13 27.3 0.2 . 1 . . . . . 10 ILE CG1 . 53494 1
60 . 1 . 1 10 10 ILE CG2 C 13 17.8 0.2 . 1 . . . . . 10 ILE CG2 . 53494 1
61 . 1 . 1 10 10 ILE CD1 C 13 13.3 0.2 . 1 . . . . . 10 ILE CD . 53494 1
62 . 1 . 1 11 11 ARG H H 1 8.72 0.01 . 1 . . . . . 11 ARG H . 53494 1
63 . 1 . 1 11 11 ARG HA H 1 4.74 0.01 . 1 . . . . . 11 ARG HA . 53494 1
64 . 1 . 1 12 12 ARG H H 1 8.62 0.01 . 1 . . . . . 12 ARG H . 53494 1
65 . 1 . 1 12 12 ARG HA H 1 4.87 0.01 . 1 . . . . . 12 ARG HA . 53494 1
66 . 1 . 1 13 13 DPR HA H 1 4.78 0.01 . 1 . . . . . 13 DPR HA . 53494 1
67 . 1 . 1 13 13 DPR HB2 H 1 1.92 0.01 . 2 . . . . . 13 DPR HB2 . 53494 1
68 . 1 . 1 13 13 DPR HB3 H 1 2.30 0.01 . 2 . . . . . 13 DPR HB3 . 53494 1
69 . 1 . 1 13 13 DPR HG2 H 1 2.12 0.01 . 2 . . . . . 13 DPR HG2 . 53494 1
70 . 1 . 1 13 13 DPR HG3 H 1 2.01 0.01 . 2 . . . . . 13 DPR HG3 . 53494 1
71 . 1 . 1 13 13 DPR HD2 H 1 3.80 0.01 . 2 . . . . . 13 DPR HD2 . 53494 1
72 . 1 . 1 13 13 DPR HD3 H 1 3.50 0.01 . 2 . . . . . 13 DPR HD3 . 53494 1
73 . 1 . 1 13 13 DPR CB C 13 30.7 0.2 . 1 . . . . . 13 DPR CB . 53494 1
74 . 1 . 1 13 13 DPR CG C 13 27.8 0.2 . 1 . . . . . 13 DPR CG . 53494 1
75 . 1 . 1 13 13 DPR CD C 13 51.0 0.2 . 1 . . . . . 13 DPR CD . 53494 1
76 . 1 . 1 14 14 PRO HA H 1 4.53 0.01 . 1 . . . . . 14 PRO HA . 53494 1
77 . 1 . 1 14 14 PRO HB2 H 1 2.27 0.01 . 2 . . . . . 14 PRO HB2 . 53494 1
78 . 1 . 1 14 14 PRO HB3 H 1 2.09 0.01 . 2 . . . . . 14 PRO HB3 . 53494 1
79 . 1 . 1 14 14 PRO HG2 H 1 1.92 0.01 . 2 . . . . . 14 PRO HG2 . 53494 1
80 . 1 . 1 14 14 PRO HG3 H 1 2.09 0.01 . 2 . . . . . 14 PRO HG3 . 53494 1
81 . 1 . 1 14 14 PRO HD2 H 1 3.73 0.01 . 2 . . . . . 14 PRO HD2 . 53494 1
82 . 1 . 1 14 14 PRO HD3 H 1 3.96 0.01 . 2 . . . . . 14 PRO HD3 . 53494 1
83 . 1 . 1 14 14 PRO CB C 13 32.5 0.2 . 1 . . . . . 14 PRO CB . 53494 1
84 . 1 . 1 14 14 PRO CG C 13 26.6 0.2 . 1 . . . . . 14 PRO CG . 53494 1
85 . 1 . 1 14 14 PRO CD C 13 50.5 0.2 . 1 . . . . . 14 PRO CD . 53494 1
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save_