Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 17450
_Assigned_chem_shift_list.ID 1
_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 $chemical_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 .
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 '2D 1H-1H NOESY' . . . 17450 1
2 '2D 1H-1H TOCSY' . . . 17450 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.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 3.848 0.02 . 1 . . . A 1 ARG HA . 17450 1
2 . 1 1 1 1 ARG HB2 H 1 1.957 0.02 . 2 . . . A 1 ARG HB2 . 17450 1
3 . 1 1 1 1 ARG HB3 H 1 1.76 0.02 . 2 . . . A 1 ARG HB3 . 17450 1
4 . 1 1 1 1 ARG HG2 H 1 1.624 0.02 . 2 . . . A 1 ARG HG2 . 17450 1
5 . 1 1 1 1 ARG HG3 H 1 1.581 0.02 . 2 . . . A 1 ARG HG3 . 17450 1
6 . 1 1 1 1 ARG H H 1 8.695 0.02 . 1 . . . A 1 ARG H1 . 17450 1
7 . 1 1 2 2 MET H H 1 8.626 0.02 . 1 . . . A 2 MET H . 17450 1
8 . 1 1 2 2 MET HA H 1 4.287 0.02 . 1 . . . A 2 MET HA . 17450 1
9 . 1 1 2 2 MET HB2 H 1 2.026 0.02 . 2 . . . A 2 MET HB2 . 17450 1
10 . 1 1 2 2 MET HG2 H 1 2.507 0.02 . 2 . . . A 2 MET HG2 . 17450 1
11 . 1 1 2 2 MET HG3 H 1 2.418 0.02 . 2 . . . A 2 MET HG3 . 17450 1
12 . 1 1 3 3 LEU H H 1 7.861 0.02 . 1 . . . A 3 LEU H . 17450 1
13 . 1 1 3 3 LEU HA H 1 4.203 0.02 . 1 . . . A 3 LEU HA . 17450 1
14 . 1 1 3 3 LEU HB2 H 1 1.582 0.02 . 2 . . . A 3 LEU HB2 . 17450 1
15 . 1 1 3 3 LEU HG H 1 1.461 0.02 . 1 . . . A 3 LEU HG . 17450 1
16 . 1 1 3 3 LEU HD11 H 1 0.832 0.02 . 1 . . . A 3 LEU HD11 . 17450 1
17 . 1 1 3 3 LEU HD12 H 1 0.832 0.02 . 1 . . . A 3 LEU HD12 . 17450 1
18 . 1 1 3 3 LEU HD13 H 1 0.832 0.02 . 1 . . . A 3 LEU HD13 . 17450 1
19 . 1 1 3 3 LEU HD21 H 1 0.755 0.02 . 1 . . . A 3 LEU HD21 . 17450 1
20 . 1 1 3 3 LEU HD22 H 1 0.755 0.02 . 1 . . . A 3 LEU HD22 . 17450 1
21 . 1 1 3 3 LEU HD23 H 1 0.755 0.02 . 1 . . . A 3 LEU HD23 . 17450 1
22 . 1 1 4 4 LEU H H 1 7.706 0.02 . 1 . . . A 4 LEU H . 17450 1
23 . 1 1 4 4 LEU HA H 1 4.011 0.02 . 1 . . . A 4 LEU HA . 17450 1
24 . 1 1 4 4 LEU HB2 H 1 1.728 0.02 . 2 . . . A 4 LEU HB2 . 17450 1
25 . 1 1 4 4 LEU HG H 1 1.516 0.02 . 1 . . . A 4 LEU HG . 17450 1
26 . 1 1 4 4 LEU HD11 H 1 0.846 0.02 . 1 . . . A 4 LEU HD11 . 17450 1
27 . 1 1 4 4 LEU HD12 H 1 0.846 0.02 . 1 . . . A 4 LEU HD12 . 17450 1
28 . 1 1 4 4 LEU HD13 H 1 0.846 0.02 . 1 . . . A 4 LEU HD13 . 17450 1
29 . 1 1 4 4 LEU HD21 H 1 0.75 0.02 . 2 . . . A 4 LEU HD21 . 17450 1
30 . 1 1 4 4 LEU HD22 H 1 0.75 0.02 . 2 . . . A 4 LEU HD21 . 17450 1
31 . 1 1 4 4 LEU HD23 H 1 0.75 0.02 . 2 . . . A 4 LEU HD21 . 17450 1
32 . 1 1 5 5 THR H H 1 8.072 0.02 . 1 . . . A 5 THR H . 17450 1
33 . 1 1 5 5 THR HA H 1 4.301 0.02 . 1 . . . A 5 THR HA . 17450 1
34 . 1 1 5 5 THR HB H 1 4.106 0.02 . 1 . . . A 5 THR HB . 17450 1
35 . 1 1 5 5 THR HG21 H 1 1.167 0.02 . 1 . . . A 5 THR HG21 . 17450 1
36 . 1 1 5 5 THR HG22 H 1 1.167 0.02 . 1 . . . A 5 THR HG22 . 17450 1
37 . 1 1 5 5 THR HG23 H 1 1.167 0.02 . 1 . . . A 5 THR HG23 . 17450 1
38 . 1 1 6 6 PRO HB3 H 1 2.074 0.02 . 2 . . . A 6 PRO HB3 . 17450 1
39 . 1 1 6 6 PRO HD2 H 1 3.701 0.02 . 2 . . . A 6 PRO HD2 . 17450 1
40 . 1 1 7 7 LEU H H 1 7.482 0.02 . 1 . . . A 7 LEU H . 17450 1
41 . 1 1 7 7 LEU HA H 1 3.989 0.02 . 1 . . . A 7 LEU HA . 17450 1
42 . 1 1 7 7 LEU HB2 H 1 1.683 0.02 . 2 . . . A 7 LEU HB2 . 17450 1
43 . 1 1 7 7 LEU HD11 H 1 0.794 0.02 . 1 . . . A 7 LEU HD11 . 17450 1
44 . 1 1 7 7 LEU HD12 H 1 0.794 0.02 . 1 . . . A 7 LEU HD12 . 17450 1
45 . 1 1 7 7 LEU HD13 H 1 0.794 0.02 . 1 . . . A 7 LEU HD13 . 17450 1
46 . 1 1 7 7 LEU HD21 H 1 0.753 0.02 . 1 . . . A 7 LEU HD21 . 17450 1
47 . 1 1 7 7 LEU HD22 H 1 0.753 0.02 . 1 . . . A 7 LEU HD22 . 17450 1
48 . 1 1 7 7 LEU HD23 H 1 0.753 0.02 . 1 . . . A 7 LEU HD23 . 17450 1
49 . 1 1 8 8 ALA H H 1 8.24 0.02 . 1 . . . A 8 ALA H . 17450 1
50 . 1 1 8 8 ALA HA H 1 3.808 0.02 . 1 . . . A 8 ALA HA . 17450 1
51 . 1 1 8 8 ALA HB1 H 1 1.464 0.02 . 1 . . . A 8 ALA HB1 . 17450 1
52 . 1 1 8 8 ALA HB2 H 1 1.464 0.02 . 1 . . . A 8 ALA HB2 . 17450 1
53 . 1 1 8 8 ALA HB3 H 1 1.464 0.02 . 1 . . . A 8 ALA HB3 . 17450 1
54 . 1 1 9 9 LYS H H 1 7.809 0.02 . 1 . . . A 9 LYS H . 17450 1
55 . 1 1 9 9 LYS HA H 1 3.982 0.02 . 1 . . . A 9 LYS HA . 17450 1
56 . 1 1 9 9 LYS HB2 H 1 1.889 0.02 . 2 . . . A 9 LYS HB2 . 17450 1
57 . 1 1 9 9 LYS HG2 H 1 1.539 0.02 . 2 . . . A 9 LYS HG2 . 17450 1
58 . 1 1 9 9 LYS HD2 H 1 1.784 0.02 . 2 . . . A 9 LYS HD2 . 17450 1
59 . 1 1 10 10 ILE H H 1 7.854 0.02 . 1 . . . A 10 ILE H . 17450 1
60 . 1 1 10 10 ILE HA H 1 3.733 0.02 . 1 . . . A 10 ILE HA . 17450 1
61 . 1 1 10 10 ILE HG13 H 1 1.016 0.02 . 2 . . . A 10 ILE HG13 . 17450 1
62 . 1 1 10 10 ILE HG21 H 1 0.831 0.02 . 1 . . . A 10 ILE HG21 . 17450 1
63 . 1 1 10 10 ILE HG22 H 1 0.831 0.02 . 1 . . . A 10 ILE HG21 . 17450 1
64 . 1 1 10 10 ILE HG23 H 1 0.831 0.02 . 1 . . . A 10 ILE HG21 . 17450 1
65 . 1 1 10 10 ILE HD11 H 1 0.755 0.02 . 1 . . . A 10 ILE HD11 . 17450 1
66 . 1 1 10 10 ILE HD12 H 1 0.755 0.02 . 1 . . . A 10 ILE HD11 . 17450 1
67 . 1 1 10 10 ILE HD13 H 1 0.755 0.02 . 1 . . . A 10 ILE HD11 . 17450 1
68 . 1 1 11 11 ILE H H 1 8.206 0.02 . 1 . . . A 11 ILE H . 17450 1
69 . 1 1 11 11 ILE HA H 1 3.805 0.02 . 1 . . . A 11 ILE HA . 17450 1
70 . 1 1 11 11 ILE HG13 H 1 1.012 0.02 . 2 . . . A 11 ILE HG13 . 17450 1
71 . 1 1 11 11 ILE HG21 H 1 0.787 0.02 . 1 . . . A 11 ILE HG21 . 17450 1
72 . 1 1 11 11 ILE HG22 H 1 0.787 0.02 . 1 . . . A 11 ILE HG21 . 17450 1
73 . 1 1 11 11 ILE HG23 H 1 0.787 0.02 . 1 . . . A 11 ILE HG21 . 17450 1
74 . 1 1 11 11 ILE HD11 H 1 0.711 0.02 . 1 . . . A 11 ILE HD11 . 17450 1
75 . 1 1 11 11 ILE HD12 H 1 0.711 0.02 . 1 . . . A 11 ILE HD11 . 17450 1
76 . 1 1 11 11 ILE HD13 H 1 0.711 0.02 . 1 . . . A 11 ILE HD11 . 17450 1
77 . 1 1 12 12 ALA H H 1 8.016 0.02 . 1 . . . A 12 ALA H . 17450 1
78 . 1 1 12 12 ALA HA H 1 3.978 0.02 . 1 . . . A 12 ALA HA . 17450 1
79 . 1 1 12 12 ALA HB1 H 1 1.4 0.02 . 1 . . . A 12 ALA HB1 . 17450 1
80 . 1 1 12 12 ALA HB2 H 1 1.4 0.02 . 1 . . . A 12 ALA HB2 . 17450 1
81 . 1 1 12 12 ALA HB3 H 1 1.4 0.02 . 1 . . . A 12 ALA HB3 . 17450 1
82 . 1 1 13 13 HIS H H 1 7.85 0.02 . 1 . . . A 13 HIS H . 17450 1
83 . 1 1 13 13 HIS HA H 1 4.494 0.02 . 1 . . . A 13 HIS HA . 17450 1
84 . 1 1 14 14 ILE H H 1 8.206 0.02 . 1 . . . A 14 ILE H . 17450 1
85 . 1 1 14 14 ILE HA H 1 3.804 0.02 . 1 . . . A 14 ILE HA . 17450 1
86 . 1 1 14 14 ILE HG13 H 1 1.012 0.02 . 2 . . . A 14 ILE HG13 . 17450 1
87 . 1 1 14 14 ILE HG21 H 1 0.787 0.02 . 1 . . . A 14 ILE HG21 . 17450 1
88 . 1 1 14 14 ILE HG22 H 1 0.787 0.02 . 1 . . . A 14 ILE HG21 . 17450 1
89 . 1 1 14 14 ILE HG23 H 1 0.787 0.02 . 1 . . . A 14 ILE HG21 . 17450 1
90 . 1 1 14 14 ILE HD11 H 1 0.71 0.02 . 1 . . . A 14 ILE HD11 . 17450 1
91 . 1 1 14 14 ILE HD12 H 1 0.71 0.02 . 1 . . . A 14 ILE HD11 . 17450 1
92 . 1 1 14 14 ILE HD13 H 1 0.71 0.02 . 1 . . . A 14 ILE HD11 . 17450 1
93 . 1 1 16 16 GLU H H 1 7.672 0.02 . 1 . . . A 16 GLU H . 17450 1
94 . 1 1 16 16 GLU HA H 1 3.965 0.02 . 1 . . . A 16 GLU HA . 17450 1
95 . 1 1 16 16 GLU HB2 H 1 2.107 0.02 . 2 . . . A 16 GLU HB2 . 17450 1
96 . 1 1 16 16 GLU HB3 H 1 2.051 0.02 . 2 . . . A 16 GLU HB3 . 17450 1
97 . 1 1 16 16 GLU HG2 H 1 2.302 0.02 . 2 . . . A 16 GLU HG2 . 17450 1
98 . 1 1 17 17 ILE H H 1 7.692 0.02 . 1 . . . A 17 ILE H . 17450 1
99 . 1 1 17 17 ILE HA H 1 3.838 0.02 . 1 . . . A 17 ILE HA . 17450 1
100 . 1 1 17 17 ILE HB H 1 1.82 0.02 . 1 . . . A 17 ILE HB . 17450 1
101 . 1 1 17 17 ILE HG12 H 1 1.414 0.02 . 2 . . . A 17 ILE HG12 . 17450 1
102 . 1 1 17 17 ILE HG13 H 1 1.122 0.02 . 2 . . . A 17 ILE HG13 . 17450 1
103 . 1 1 17 17 ILE HG21 H 1 0.751 0.02 . 1 . . . A 17 ILE HG21 . 17450 1
104 . 1 1 17 17 ILE HG22 H 1 0.751 0.02 . 1 . . . A 17 ILE HG21 . 17450 1
105 . 1 1 17 17 ILE HG23 H 1 0.751 0.02 . 1 . . . A 17 ILE HG21 . 17450 1
106 . 1 1 17 17 ILE HD11 H 1 0.651 0.02 . 1 . . . A 17 ILE HD11 . 17450 1
107 . 1 1 17 17 ILE HD12 H 1 0.651 0.02 . 1 . . . A 17 ILE HD11 . 17450 1
108 . 1 1 17 17 ILE HD13 H 1 0.651 0.02 . 1 . . . A 17 ILE HD11 . 17450 1
109 . 1 1 18 18 ALA H H 1 8.041 0.02 . 1 . . . A 18 ALA H . 17450 1
110 . 1 1 18 18 ALA HA H 1 4.098 0.02 . 1 . . . A 18 ALA HA . 17450 1
111 . 1 1 18 18 ALA HB1 H 1 1.301 0.02 . 1 . . . A 18 ALA HB1 . 17450 1
112 . 1 1 18 18 ALA HB2 H 1 1.301 0.02 . 1 . . . A 18 ALA HB2 . 17450 1
113 . 1 1 18 18 ALA HB3 H 1 1.301 0.02 . 1 . . . A 18 ALA HB3 . 17450 1
114 . 1 1 19 19 GLY H H 1 7.646 0.02 . 1 . . . A 19 GLY H . 17450 1
115 . 1 1 19 19 GLY HA2 H 1 3.803 0.02 . 2 . . . A 19 GLY HA2 . 17450 1
116 . 1 1 19 19 GLY HA3 H 1 3.769 0.02 . 2 . . . A 19 GLY HA3 . 17450 1
stop_
save_