Content for NMR-STAR saveframe, "chemical_shift_set_1"
save_chemical_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1
_Assigned_chem_shift_list.Entry_ID 5531
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_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
. . 1 $sample_1 . 5531 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 C H5'' H 1 3.953 . . 2 . . . . . . . . 5531 1
2 . 1 1 1 1 C H6 H 1 8.170 . . 1 . . . . . . . . 5531 1
3 . 1 1 1 1 C H5' H 1 4.100 . . 2 . . . . . . . . 5531 1
4 . 1 1 1 1 C H2' H 1 4.482 . . 1 . . . . . . . . 5531 1
5 . 1 1 1 1 C H3' H 1 4.524 . . 1 . . . . . . . . 5531 1
6 . 1 1 1 1 C H4' H 1 4.370 . . 1 . . . . . . . . 5531 1
7 . 1 1 1 1 C H1' H 1 5.616 . . 1 . . . . . . . . 5531 1
8 . 1 1 1 1 C H5 H 1 6.075 . . 1 . . . . . . . . 5531 1
9 . 1 1 2 2 C H41 H 1 7.11 . . 1 . . . . . . . . 5531 1
10 . 1 1 2 2 C H42 H 1 8.47 . . 1 . . . . . . . . 5531 1
11 . 1 1 2 2 C H3' H 1 4.703 . . 1 . . . . . . . . 5531 1
12 . 1 1 2 2 C H6 H 1 7.983 . . 1 . . . . . . . . 5531 1
13 . 1 1 2 2 C H2' H 1 4.600 . . 1 . . . . . . . . 5531 1
14 . 1 1 2 2 C H1' H 1 5.589 . . 1 . . . . . . . . 5531 1
15 . 1 1 2 2 C H5 H 1 5.703 . . 1 . . . . . . . . 5531 1
16 . 1 1 3 3 A H61 H 1 7.70 . . 1 . . . . . . . . 5531 1
17 . 1 1 3 3 A H62 H 1 6.31 . . 1 . . . . . . . . 5531 1
18 . 1 1 3 3 A H2' H 1 4.716 . . 1 . . . . . . . . 5531 1
19 . 1 1 3 3 A H3' H 1 4.765 . . 1 . . . . . . . . 5531 1
20 . 1 1 3 3 A H8 H 1 8.045 . . 1 . . . . . . . . 5531 1
21 . 1 1 3 3 A H4' H 1 4.542 . . 1 . . . . . . . . 5531 1
22 . 1 1 3 3 A H5' H 1 4.218 . . 2 . . . . . . . . 5531 1
23 . 1 1 3 3 A H1' H 1 5.936 . . 1 . . . . . . . . 5531 1
24 . 1 1 3 3 A H2 H 1 7.015 . . 1 . . . . . . . . 5531 1
25 . 1 1 4 4 G H1 H 1 12.62 . . 1 . . . . . . . . 5531 1
26 . 1 1 4 4 G H21 H 1 6.19 . . 1 . . . . . . . . 5531 1
27 . 1 1 4 4 G H22 H 1 8.21 . . 1 . . . . . . . . 5531 1
28 . 1 1 4 4 G H5' H 1 4.110 . . 2 . . . . . . . . 5531 1
29 . 1 1 4 4 G H8 H 1 7.190 . . 1 . . . . . . . . 5531 1
30 . 1 1 4 4 G H4' H 1 4.465 . . 1 . . . . . . . . 5531 1
31 . 1 1 4 4 G H3' H 1 4.440 . . 1 . . . . . . . . 5531 1
32 . 1 1 4 4 G H2' H 1 4.574 . . 1 . . . . . . . . 5531 1
33 . 1 1 4 4 G H1' H 1 5.564 . . 1 . . . . . . . . 5531 1
34 . 1 1 5 5 A H61 H 1 7.73 . . 1 . . . . . . . . 5531 1
35 . 1 1 5 5 A H62 H 1 6.79 . . 1 . . . . . . . . 5531 1
36 . 1 1 5 5 A H2 H 1 7.878 . . 1 . . . . . . . . 5531 1
37 . 1 1 5 5 A H5' H 1 4.080 . . 2 . . . . . . . . 5531 1
38 . 1 1 5 5 A H8 H 1 7.506 . . 1 . . . . . . . . 5531 1
39 . 1 1 5 5 A H2' H 1 4.595 . . 1 . . . . . . . . 5531 1
40 . 1 1 5 5 A H3' H 1 4.413 . . 1 . . . . . . . . 5531 1
41 . 1 1 5 5 A H4' H 1 4.464 . . 1 . . . . . . . . 5531 1
42 . 1 1 5 5 A H1' H 1 5.847 . . 1 . . . . . . . . 5531 1
43 . 1 1 6 6 OMC HM21 H 1 3.653 . . 2 . . . . . . . . 5531 1
44 . 1 1 6 6 OMC H6 H 1 7.558 . . 1 . . . . . . . . 5531 1
45 . 1 1 6 6 OMC H4' H 1 3.826 . . 1 . . . . . . . . 5531 1
46 . 1 1 6 6 OMC H2' H 1 4.291 . . 1 . . . . . . . . 5531 1
47 . 1 1 6 6 OMC H3' H 1 4.429 . . 1 . . . . . . . . 5531 1
48 . 1 1 6 6 OMC H1' H 1 5.610 . . 1 . . . . . . . . 5531 1
49 . 1 1 6 6 OMC H5 H 1 5.391 . . 1 . . . . . . . . 5531 1
50 . 1 1 7 7 U H6 H 1 7.634 . . 1 . . . . . . . . 5531 1
51 . 1 1 7 7 U H5'' H 1 4.073 . . 2 . . . . . . . . 5531 1
52 . 1 1 7 7 U H2' H 1 4.404 . . 1 . . . . . . . . 5531 1
53 . 1 1 7 7 U H3' H 1 4.529 . . 1 . . . . . . . . 5531 1
54 . 1 1 7 7 U H5' H 1 4.198 . . 2 . . . . . . . . 5531 1
55 . 1 1 7 7 U H4' H 1 4.376 . . 1 . . . . . . . . 5531 1
56 . 1 1 7 7 U H1' H 1 5.662 . . 1 . . . . . . . . 5531 1
57 . 1 1 7 7 U H5 H 1 5.509 . . 1 . . . . . . . . 5531 1
58 . 1 1 8 8 OMG HM21 H 1 3.390 . . 2 . . . . . . . . 5531 1
59 . 1 1 8 8 OMG H8 H 1 8.082 . . 1 . . . . . . . . 5531 1
60 . 1 1 8 8 OMG H2' H 1 4.485 . . 1 . . . . . . . . 5531 1
61 . 1 1 8 8 OMG H3' H 1 4.819 . . 1 . . . . . . . . 5531 1
62 . 1 1 8 8 OMG H1' H 1 5.724 . . 1 . . . . . . . . 5531 1
63 . 1 1 8 8 OMG H4' H 1 4.297 . . 1 . . . . . . . . 5531 1
64 . 1 1 8 8 OMG H5' H 1 4.063 . . 2 . . . . . . . . 5531 1
65 . 1 1 8 8 OMG H5'' H 1 4.000 . . 2 . . . . . . . . 5531 1
66 . 1 1 9 9 A H8 H 1 7.854 . . 1 . . . . . . . . 5531 1
67 . 1 1 9 9 A H2' H 1 4.448 . . 1 . . . . . . . . 5531 1
68 . 1 1 9 9 A H3' H 1 4.719 . . 1 . . . . . . . . 5531 1
69 . 1 1 9 9 A H1' H 1 5.583 . . 1 . . . . . . . . 5531 1
70 . 1 1 9 9 A H4' H 1 4.218 . . 1 . . . . . . . . 5531 1
71 . 1 1 9 9 A H2 H 1 7.944 . . 1 . . . . . . . . 5531 1
72 . 1 1 10 10 A H2' H 1 4.807 . . 1 . . . . . . . . 5531 1
73 . 1 1 10 10 A H8 H 1 8.000 . . 1 . . . . . . . . 5531 1
74 . 1 1 10 10 A H4' H 1 4.456 . . 1 . . . . . . . . 5531 1
75 . 1 1 10 10 A H3' H 1 4.920 . . 1 . . . . . . . . 5531 1
76 . 1 1 10 10 A H1' H 1 5.906 . . 1 . . . . . . . . 5531 1
77 . 1 1 10 10 A H2 H 1 7.994 . . 1 . . . . . . . . 5531 1
78 . 1 1 11 11 1MG H4' H 1 4.587 . . 1 . . . . . . . . 5531 1
79 . 1 1 11 11 1MG H3' H 1 4.913 . . 1 . . . . . . . . 5531 1
80 . 1 1 11 11 1MG H2' H 1 4.948 . . 1 . . . . . . . . 5531 1
81 . 1 1 11 11 1MG H8 H 1 7.995 . . 1 . . . . . . . . 5531 1
82 . 1 1 11 11 1MG HM11 H 1 3.354 . . 2 . . . . . . . . 5531 1
83 . 1 1 11 11 1MG H1' H 1 5.897 . . 1 . . . . . . . . 5531 1
84 . 1 1 12 12 A H8 H 1 8.128 . . 1 . . . . . . . . 5531 1
85 . 1 1 12 12 A H2 H 1 8.128 . . 1 . . . . . . . . 5531 1
86 . 1 1 12 12 A H4' H 1 4.524 . . 1 . . . . . . . . 5531 1
87 . 1 1 12 12 A H3' H 1 4.466 . . 1 . . . . . . . . 5531 1
88 . 1 1 12 12 A H2' H 1 4.647 . . 1 . . . . . . . . 5531 1
89 . 1 1 12 12 A H1' H 1 5.558 . . 1 . . . . . . . . 5531 1
90 . 1 1 13 13 U H3 H 1 14.58 . . 1 . . . . . . . . 5531 1
91 . 1 1 13 13 U H6 H 1 7.671 . . 1 . . . . . . . . 5531 1
92 . 1 1 13 13 U H2' H 1 4.362 . . 1 . . . . . . . . 5531 1
93 . 1 1 13 13 U H3' H 1 4.443 . . 1 . . . . . . . . 5531 1
94 . 1 1 13 13 U H5 H 1 5.345 . . 1 . . . . . . . . 5531 1
95 . 1 1 13 13 U H1' H 1 5.393 . . 1 . . . . . . . . 5531 1
96 . 1 1 14 14 5MC HN41 H 1 6.74 . . 1 . . . . . . . . 5531 1
97 . 1 1 14 14 5MC HN42 H 1 8.47 . . 1 . . . . . . . . 5531 1
98 . 1 1 14 14 5MC H2' H 1 4.270 . . 1 . . . . . . . . 5531 1
99 . 1 1 14 14 5MC H6 H 1 7.788 . . 1 . . . . . . . . 5531 1
100 . 1 1 14 14 5MC H3' H 1 4.533 . . 1 . . . . . . . . 5531 1
101 . 1 1 14 14 5MC H1' H 1 5.603 . . 1 . . . . . . . . 5531 1
102 . 1 1 14 14 5MC HM51 H 1 1.683 . . 2 . . . . . . . . 5531 1
103 . 1 1 15 15 U H3 H 1 13.33 . . 1 . . . . . . . . 5531 1
104 . 1 1 15 15 U H6 H 1 7.801 . . 1 . . . . . . . . 5531 1
105 . 1 1 15 15 U H4' H 1 4.423 . . 1 . . . . . . . . 5531 1
106 . 1 1 15 15 U H3' H 1 4.626 . . 1 . . . . . . . . 5531 1
107 . 1 1 15 15 U H2' H 1 4.599 . . 1 . . . . . . . . 5531 1
108 . 1 1 15 15 U H1' H 1 5.514 . . 1 . . . . . . . . 5531 1
109 . 1 1 15 15 U H5 H 1 5.309 . . 1 . . . . . . . . 5531 1
110 . 1 1 16 16 G H1 H 1 12.39 . . 1 . . . . . . . . 5531 1
111 . 1 1 16 16 G H21 H 1 5.93 . . 1 . . . . . . . . 5531 1
112 . 1 1 16 16 G H22 H 1 7.99 . . 1 . . . . . . . . 5531 1
113 . 1 1 16 16 G H2' H 1 4.506 . . 1 . . . . . . . . 5531 1
114 . 1 1 16 16 G H3' H 1 4.539 . . 1 . . . . . . . . 5531 1
115 . 1 1 16 16 G H8 H 1 7.674 . . 1 . . . . . . . . 5531 1
116 . 1 1 16 16 G H1' H 1 5.747 . . 1 . . . . . . . . 5531 1
117 . 1 1 17 17 G H1 H 1 13.12 . . 1 . . . . . . . . 5531 1
118 . 1 1 17 17 G H2' H 1 4.038 . . 1 . . . . . . . . 5531 1
119 . 1 1 17 17 G H8 H 1 7.369 . . 1 . . . . . . . . 5531 1
120 . 1 1 17 17 G H3' H 1 4.206 . . 1 . . . . . . . . 5531 1
121 . 1 1 17 17 G H1' H 1 5.774 . . 1 . . . . . . . . 5531 1
stop_
save_