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 50760
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Chemical shift list 283 K'
_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 .
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 HSQC[15N]-Imino . . . 50760 1
3 HSQC[15N]-Amino . . . 50760 1
4 NOESY[15N]CPMG . . . 50760 1
9 H(N)CO . . . 50760 1
stop_
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
2 $software_2 . . 50760 1
stop_
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 G H1 H 1 12.989 0.020 . 1 . . . . . -2 G H1 . 50760 1
2 . 1 . 1 1 1 G C2 C 13 156.348 0.3 . 1 . . . . . -2 G C2 . 50760 1
3 . 1 . 1 1 1 G C6 C 13 162.511 0.3 . 1 . . . . . -2 G C6 . 50760 1
4 . 1 . 1 1 1 G N1 N 15 147.323 0.3 . 1 . . . . . -2 G N1 . 50760 1
5 . 1 . 1 2 2 G H1 H 1 13.424 0.020 . 1 . . . . . -1 G H1 . 50760 1
6 . 1 . 1 2 2 G H21 H 1 6.266 0.020 . 1 . . . . . -1 G H21 . 50760 1
7 . 1 . 1 2 2 G H22 H 1 8.550 0.020 . 1 . . . . . -1 G H22 . 50760 1
8 . 1 . 1 2 2 G C2 C 13 157.090 0.3 . 1 . . . . . -1 G C2 . 50760 1
9 . 1 . 1 2 2 G C6 C 13 161.784 0.3 . 1 . . . . . -1 G C6 . 50760 1
10 . 1 . 1 2 2 G N1 N 15 148.449 0.3 . 1 . . . . . -1 G N1 . 50760 1
11 . 1 . 1 2 2 G N2 N 15 74.675 0.3 . 1 . . . . . -1 G N2 . 50760 1
12 . 1 . 1 3 3 C H41 H 1 7.003 0.020 . 1 . . . . . 96 C H41 . 50760 1
13 . 1 . 1 3 3 C H42 H 1 8.631 0.020 . 1 . . . . . 96 C H42 . 50760 1
14 . 1 . 1 3 3 C N4 N 15 98.521 0.3 . 1 . . . . . 96 C N4 . 50760 1
15 . 1 . 1 4 4 A H61 H 1 6.486 0.020 . 1 . . . . . 97 A H61 . 50760 1
16 . 1 . 1 4 4 A H62 H 1 8.060 0.020 . 1 . . . . . 97 A H62 . 50760 1
17 . 1 . 1 4 4 A N6 N 15 84.475 0.3 . 1 . . . . . 97 A N6 . 50760 1
18 . 1 . 1 5 5 C H41 H 1 7.143 0.020 . 1 . . . . . 98 C H41 . 50760 1
19 . 1 . 1 5 5 C H42 H 1 8.426 0.020 . 1 . . . . . 98 C H42 . 50760 1
20 . 1 . 1 5 5 C N4 N 15 98.565 0.3 . 1 . . . . . 98 C N4 . 50760 1
21 . 1 . 1 6 6 U H3 H 1 13.694 0.020 . 1 . . . . . 99 U H3 . 50760 1
22 . 1 . 1 6 6 U N3 N 15 161.680 0.3 . 1 . . . . . 99 U N3 . 50760 1
23 . 1 . 1 7 7 C H41 H 1 6.049 0.020 . 1 . . . . . 100 C H41 . 50760 1
24 . 1 . 1 7 7 C H42 H 1 6.049 0.020 . 1 . . . . . 100 C H42 . 50760 1
25 . 1 . 1 7 7 C N4 N 15 96.521 0.3 . 1 . . . . . 100 C N4 . 50760 1
26 . 1 . 1 8 8 G H1 H 1 10.731 0.020 . 1 . . . . . 101 G H1 . 50760 1
27 . 1 . 1 8 8 G H21 H 1 6.175 0.020 . 1 . . . . . 101 G H21 . 50760 1
28 . 1 . 1 8 8 G H22 H 1 6.175 0.020 . 1 . . . . . 101 G H22 . 50760 1
29 . 1 . 1 8 8 G C2 C 13 154.186 0.3 . 1 . . . . . 101 G C2 . 50760 1
30 . 1 . 1 8 8 G C6 C 13 161.287 0.3 . 1 . . . . . 101 G C6 . 50760 1
31 . 1 . 1 8 8 G N1 N 15 143.565 0.3 . 1 . . . . . 101 G N1 . 50760 1
32 . 1 . 1 8 8 G N2 N 15 72.109 0.3 . 1 . . . . . 101 G N2 . 50760 1
33 . 1 . 1 9 9 G H1 H 1 13.528 0.020 . 1 . . . . . 102 G H1 . 50760 1
34 . 1 . 1 9 9 G H21 H 1 6.650 0.020 . 1 . . . . . 102 G H21 . 50760 1
35 . 1 . 1 9 9 G H22 H 1 9.058 0.020 . 1 . . . . . 102 G H22 . 50760 1
36 . 1 . 1 9 9 G C2 C 13 157.252 0.3 . 1 . . . . . 102 G C2 . 50760 1
37 . 1 . 1 9 9 G C6 C 13 161.824 0.3 . 1 . . . . . 102 G C6 . 50760 1
38 . 1 . 1 9 9 G N1 N 15 148.542 0.3 . 1 . . . . . 102 G N1 . 50760 1
39 . 1 . 1 9 9 G N2 N 15 76.257 0.3 . 1 . . . . . 102 G N2 . 50760 1
40 . 1 . 1 10 10 C H41 H 1 7.152 0.020 . 1 . . . . . 103 C H41 . 50760 1
41 . 1 . 1 10 10 C H42 H 1 8.610 0.020 . 1 . . . . . 103 C H42 . 50760 1
42 . 1 . 1 10 10 C N4 N 15 98.869 0.3 . 1 . . . . . 103 C N4 . 50760 1
43 . 1 . 1 13 13 C H41 H 1 6.699 0.020 . 1 . . . . . 106 C H41 . 50760 1
44 . 1 . 1 13 13 C H42 H 1 7.216 0.020 . 1 . . . . . 106 C H42 . 50760 1
45 . 1 . 1 13 13 C N4 N 15 94.847 0.3 . 1 . . . . . 106 C N4 . 50760 1
46 . 1 . 1 14 14 A H61 H 1 6.834 0.020 . 1 . . . . . 107 A H61 . 50760 1
47 . 1 . 1 14 14 A H62 H 1 6.834 0.020 . 1 . . . . . 107 A H62 . 50760 1
48 . 1 . 1 14 14 A N6 N 15 80.080 0.3 . 1 . . . . . 107 A N6 . 50760 1
49 . 1 . 1 16 16 G H1 H 1 13.287 0.020 . 1 . . . . . 109 G H1 . 50760 1
50 . 1 . 1 16 16 G C2 C 13 156.920 0.3 . 1 . . . . . 109 G C2 . 50760 1
51 . 1 . 1 16 16 G C6 C 13 162.073 0.3 . 1 . . . . . 109 G C6 . 50760 1
52 . 1 . 1 16 16 G N1 N 15 148.545 0.3 . 1 . . . . . 109 G N1 . 50760 1
53 . 1 . 1 17 17 C H41 H 1 7.039 0.020 . 1 . . . . . 110 C H41 . 50760 1
54 . 1 . 1 17 17 C H42 H 1 8.659 0.020 . 1 . . . . . 110 C H42 . 50760 1
55 . 1 . 1 17 17 C N4 N 15 98.826 0.3 . 1 . . . . . 110 C N4 . 50760 1
56 . 1 . 1 18 18 U H3 H 1 12.044 0.020 . 1 . . . . . 111 U H3 . 50760 1
57 . 1 . 1 18 18 U N3 N 15 158.377 0.3 . 1 . . . . . 111 U N3 . 50760 1
58 . 1 . 1 20 20 A H61 H 1 6.529 0.020 . 1 . . . . . 113 A H61 . 50760 1
59 . 1 . 1 20 20 A H62 H 1 8.004 0.020 . 1 . . . . . 113 A H62 . 50760 1
60 . 1 . 1 20 20 A N6 N 15 82.130 0.3 . 1 . . . . . 113 A N6 . 50760 1
61 . 1 . 1 21 21 G H1 H 1 13.582 0.020 . 1 . . . . . 114 G H1 . 50760 1
62 . 1 . 1 21 21 G H21 H 1 6.193 0.020 . 1 . . . . . 114 G H21 . 50760 1
63 . 1 . 1 21 21 G H22 H 1 8.475 0.020 . 1 . . . . . 114 G H22 . 50760 1
64 . 1 . 1 21 21 G C2 C 13 156.936 0.3 . 1 . . . . . 114 G C2 . 50760 1
65 . 1 . 1 21 21 G C6 C 13 161.740 0.3 . 1 . . . . . 114 G C6 . 50760 1
66 . 1 . 1 21 21 G N1 N 15 148.189 0.3 . 1 . . . . . 114 G N1 . 50760 1
67 . 1 . 1 21 21 G N2 N 15 74.637 0.3 . 1 . . . . . 114 G N2 . 50760 1
68 . 1 . 1 22 22 U H3 H 1 13.813 0.020 . 1 . . . . . 115 U H3 . 50760 1
69 . 1 . 1 22 22 U N3 N 15 162.309 0.3 . 1 . . . . . 115 U N3 . 50760 1
70 . 1 . 1 23 23 G H1 H 1 12.662 0.020 . 1 . . . . . 116 G H1 . 50760 1
71 . 1 . 1 23 23 G C2 C 13 156.508 0.3 . 1 . . . . . 116 G C2 . 50760 1
72 . 1 . 1 23 23 G C6 C 13 161.496 0.3 . 1 . . . . . 116 G C6 . 50760 1
73 . 1 . 1 23 23 G N1 N 15 147.845 0.3 . 1 . . . . . 116 G N1 . 50760 1
74 . 1 . 1 23 23 G N2 N 15 74.964 0.3 . 1 . . . . . 116 G N2 . 50760 1
75 . 1 . 1 24 24 C H41 H 1 7.036 0.020 . 1 . . . . . +1 C H41 . 50760 1
76 . 1 . 1 24 24 C H42 H 1 8.608 0.020 . 1 . . . . . +1 C H42 . 50760 1
77 . 1 . 1 24 24 C N4 N 15 99.532 0.3 . 1 . . . . . +1 C N4 . 50760 1
78 . 1 . 1 25 25 C H41 H 1 7.207 0.020 . 1 . . . . . +2 C H41 . 50760 1
79 . 1 . 1 25 25 C H42 H 1 8.662 0.020 . 1 . . . . . +2 C H42 . 50760 1
80 . 1 . 1 25 25 C N4 N 15 99.513 0.3 . 1 . . . . . +2 C N4 . 50760 1
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save_