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 31106
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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
1 '2D 1H-13C HSQC aromatic' . . . 31106 1
2 '2D 1H-13C HSQC aromatic' . . . 31106 1
3 '2D 1H-13C HSQC sugar' . . . 31106 1
4 '2D 1H-13C HSQC sugar' . . . 31106 1
5 '2D 1H-15N HSQC' . . . 31106 1
6 '2D 1H-15N HSQC' . . . 31106 1
7 '2D 1H-1H NOESY' . . . 31106 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 2 2 G H1 H 1 13.315 . . . . . . . A 18 G H1 . 31106 1
2 . 1 . 1 2 2 G H1' H 1 5.946 . . . . . . . A 18 G H1' . 31106 1
3 . 1 . 1 2 2 G H4' H 1 4.55 . . . . . . . A 18 G H4' . 31106 1
4 . 1 . 1 2 2 G H8 H 1 7.649 . . . . . . . A 18 G H8 . 31106 1
5 . 1 . 1 2 2 G C1' C 13 93.042 . . . . . . . A 18 G C1' . 31106 1
6 . 1 . 1 2 2 G C4' C 13 82.524 . . . . . . . A 18 G C4' . 31106 1
7 . 1 . 1 2 2 G C8 C 13 136.94 . . . . . . . A 18 G C8 . 31106 1
8 . 1 . 1 2 2 G N1 N 15 148.512 . . . . . . . A 18 G N1 . 31106 1
9 . 1 . 1 3 3 C H1' H 1 5.541 . . . . . . . A 19 C H1' . 31106 1
10 . 1 . 1 3 3 C H4' H 1 4.425 . . . . . . . A 19 C H4' . 31106 1
11 . 1 . 1 3 3 C H5 H 1 5.288 . . . . . . . A 19 C H5 . 31106 1
12 . 1 . 1 3 3 C H6 H 1 7.63 . . . . . . . A 19 C H6 . 31106 1
13 . 1 . 1 3 3 C C1' C 13 93.861 . . . . . . . A 19 C C1' . 31106 1
14 . 1 . 1 3 3 C C4' C 13 81.792 . . . . . . . A 19 C C4' . 31106 1
15 . 1 . 1 3 3 C C5 C 13 94.566 . . . . . . . A 19 C C5 . 31106 1
16 . 1 . 1 3 3 C C6 C 13 140.697 . . . . . . . A 19 C C6 . 31106 1
17 . 1 . 1 4 4 A H1' H 1 5.97 . . . . . . . A 20 A H1' . 31106 1
18 . 1 . 1 4 4 A H2 H 1 7.003 . . . . . . . A 20 A H2 . 31106 1
19 . 1 . 1 4 4 A H4' H 1 4.478 . . . . . . . A 20 A H4' . 31106 1
20 . 1 . 1 4 4 A H8 H 1 7.962 . . . . . . . A 20 A H8 . 31106 1
21 . 1 . 1 4 4 A C1' C 13 93.028 . . . . . . . A 20 A C1' . 31106 1
22 . 1 . 1 4 4 A C2 C 13 152.386 . . . . . . . A 20 A C2 . 31106 1
23 . 1 . 1 4 4 A C4' C 13 81.916 . . . . . . . A 20 A C4' . 31106 1
24 . 1 . 1 4 4 A C8 C 13 139.42 . . . . . . . A 20 A C8 . 31106 1
25 . 1 . 1 5 5 G H1 H 1 12.794 . . . . . . . A 21 G H1 . 31106 1
26 . 1 . 1 5 5 G H1' H 1 5.423 . . . . . . . A 21 G H1' . 31106 1
27 . 1 . 1 5 5 G H4' H 1 4.422 . . . . . . . A 21 G H4' . 31106 1
28 . 1 . 1 5 5 G H8 H 1 7.075 . . . . . . . A 21 G H8 . 31106 1
29 . 1 . 1 5 5 G C1' C 13 93.169 . . . . . . . A 21 G C1' . 31106 1
30 . 1 . 1 5 5 G C4' C 13 82.334 . . . . . . . A 21 G C4' . 31106 1
31 . 1 . 1 5 5 G C8 C 13 136.04 . . . . . . . A 21 G C8 . 31106 1
32 . 1 . 1 5 5 G N1 N 15 147.109 . . . . . . . A 21 G N1 . 31106 1
33 . 1 . 1 6 6 A H1' H 1 6.08 . . . . . . . A 22 A H1' . 31106 1
34 . 1 . 1 6 6 A H2 H 1 7.785 . . . . . . . A 22 A H2 . 31106 1
35 . 1 . 1 6 6 A H4' H 1 4.551 . . . . . . . A 22 A H4' . 31106 1
36 . 1 . 1 6 6 A H8 H 1 7.886 . . . . . . . A 22 A H8 . 31106 1
37 . 1 . 1 6 6 A C1' C 13 90.574 . . . . . . . A 22 A C1' . 31106 1
38 . 1 . 1 6 6 A C2 C 13 154.396 . . . . . . . A 22 A C2 . 31106 1
39 . 1 . 1 6 6 A C4' C 13 82.536 . . . . . . . A 22 A C4' . 31106 1
40 . 1 . 1 6 6 A C8 C 13 140.301 . . . . . . . A 22 A C8 . 31106 1
41 . 1 . 1 7 7 U H1' H 1 5.923 . . . . . . . A 23 U H1' . 31106 1
42 . 1 . 1 7 7 U H4' H 1 4.37 . . . . . . . A 23 U H4' . 31106 1
43 . 1 . 1 7 7 U H5 H 1 5.862 . . . . . . . A 23 U H5 . 31106 1
44 . 1 . 1 7 7 U H6 H 1 7.916 . . . . . . . A 23 U H6 . 31106 1
45 . 1 . 1 7 7 U C1' C 13 91.798 . . . . . . . A 23 U C1' . 31106 1
46 . 1 . 1 7 7 U C4' C 13 84.568 . . . . . . . A 23 U C4' . 31106 1
47 . 1 . 1 7 7 U C5 C 13 102.007 . . . . . . . A 23 U C5 . 31106 1
48 . 1 . 1 7 7 U C6 C 13 144.105 . . . . . . . A 23 U C6 . 31106 1
49 . 1 . 1 8 8 C H1' H 1 5.61 . . . . . . . A 24 C H1' . 31106 1
50 . 1 . 1 8 8 C H4' H 1 4.442 . . . . . . . A 24 C H4' . 31106 1
51 . 1 . 1 8 8 C H6 H 1 7.603 . . . . . . . A 24 C H6 . 31106 1
52 . 1 . 1 8 8 C C1' C 13 94.638 . . . . . . . A 24 C C1' . 31106 1
53 . 1 . 1 8 8 C C4' C 13 82.078 . . . . . . . A 24 C C4' . 31106 1
54 . 1 . 1 8 8 C C6 C 13 142.959 . . . . . . . A 24 C C6 . 31106 1
55 . 1 . 1 9 9 U H1' H 1 5.506 . . . . . . . A 25 U H1' . 31106 1
56 . 1 . 1 9 9 U H3 H 1 10.306 . . . . . . . A 25 U H3 . 31106 1
57 . 1 . 1 9 9 U H4' H 1 4.333 . . . . . . . A 25 U H4' . 31106 1
58 . 1 . 1 9 9 U H6 H 1 7.807 . . . . . . . A 25 U H6 . 31106 1
59 . 1 . 1 9 9 U C1' C 13 94.004 . . . . . . . A 25 U C1' . 31106 1
60 . 1 . 1 9 9 U C4' C 13 82.313 . . . . . . . A 25 U C4' . 31106 1
61 . 1 . 1 9 9 U C6 C 13 141.66 . . . . . . . A 25 U C6 . 31106 1
62 . 1 . 1 9 9 U N3 N 15 156.291 . . . . . . . A 25 U N3 . 31106 1
63 . 1 . 1 10 10 G H1 H 1 12.948 . . . . . . . A 26 G H1 . 31106 1
64 . 1 . 1 10 10 G H4' H 1 4.526 . . . . . . . A 26 G H4' . 31106 1
65 . 1 . 1 10 10 G H8 H 1 7.973 . . . . . . . A 26 G H8 . 31106 1
66 . 1 . 1 10 10 G C4' C 13 82.29 . . . . . . . A 26 G C4' . 31106 1
67 . 1 . 1 10 10 G C8 C 13 137.907 . . . . . . . A 26 G C8 . 31106 1
68 . 1 . 1 10 10 G N1 N 15 148.405 . . . . . . . A 26 G N1 . 31106 1
69 . 1 . 1 11 11 A H1' H 1 6.13 . . . . . . . A 27 A H1' . 31106 1
70 . 1 . 1 11 11 A H2 H 1 7.772 . . . . . . . A 27 A H2 . 31106 1
71 . 1 . 1 11 11 A H8 H 1 8.298 . . . . . . . A 27 A H8 . 31106 1
72 . 1 . 1 11 11 A C1' C 13 90.361 . . . . . . . A 27 A C1' . 31106 1
73 . 1 . 1 11 11 A C2 C 13 153.799 . . . . . . . A 27 A C2 . 31106 1
74 . 1 . 1 11 11 A C8 C 13 140.857 . . . . . . . A 27 A C8 . 31106 1
75 . 1 . 1 12 12 G H1 H 1 12.898 . . . . . . . A 28 G H1 . 31106 1
76 . 1 . 1 12 12 G H1' H 1 5.807 . . . . . . . A 28 G H1' . 31106 1
77 . 1 . 1 12 12 G H8 H 1 7.358 . . . . . . . A 28 G H8 . 31106 1
78 . 1 . 1 12 12 G C1' C 13 93.339 . . . . . . . A 28 G C1' . 31106 1
79 . 1 . 1 12 12 G C8 C 13 137.041 . . . . . . . A 28 G C8 . 31106 1
80 . 1 . 1 13 13 C H5 H 1 5.155 . . . . . . . A 29 C H5 . 31106 1
81 . 1 . 1 13 13 C H6 H 1 7.542 . . . . . . . A 29 C H6 . 31106 1
82 . 1 . 1 13 13 C C5 C 13 94.46 . . . . . . . A 29 C C5 . 31106 1
83 . 1 . 1 13 13 C C6 C 13 140.844 . . . . . . . A 29 C C6 . 31106 1
84 . 1 . 1 14 14 C H1' H 1 5.423 . . . . . . . A 30 C H1' . 31106 1
85 . 1 . 1 14 14 C H5 H 1 5.467 . . . . . . . A 30 C H5 . 31106 1
86 . 1 . 1 14 14 C C1' C 13 93.816 . . . . . . . A 30 C C1' . 31106 1
87 . 1 . 1 14 14 C C5 C 13 94.56 . . . . . . . A 30 C C5 . 31106 1
88 . 1 . 1 15 15 U H1' H 1 5.581 . . . . . . . A 51 U H1' . 31106 1
89 . 1 . 1 15 15 U H4' H 1 4.334 . . . . . . . A 51 U H4' . 31106 1
90 . 1 . 1 15 15 U H5 H 1 5.831 . . . . . . . A 51 U H5 . 31106 1
91 . 1 . 1 15 15 U H6 H 1 7.741 . . . . . . . A 51 U H6 . 31106 1
92 . 1 . 1 15 15 U C1' C 13 94.486 . . . . . . . A 51 U C1' . 31106 1
93 . 1 . 1 15 15 U C4' C 13 82.315 . . . . . . . A 51 U C4' . 31106 1
94 . 1 . 1 15 15 U C5 C 13 102.199 . . . . . . . A 51 U C5 . 31106 1
95 . 1 . 1 15 15 U C6 C 13 140.538 . . . . . . . A 51 U C6 . 31106 1
96 . 1 . 1 16 16 U H1' H 1 6.117 . . . . . . . A 52 U H1' . 31106 1
97 . 1 . 1 16 16 U H4' H 1 4.471 . . . . . . . A 52 U H4' . 31106 1
98 . 1 . 1 16 16 U H5 H 1 5.864 . . . . . . . A 52 U H5 . 31106 1
99 . 1 . 1 16 16 U H6 H 1 8.038 . . . . . . . A 52 U H6 . 31106 1
100 . 1 . 1 16 16 U C1' C 13 89.265 . . . . . . . A 52 U C1' . 31106 1
101 . 1 . 1 16 16 U C4' C 13 86.972 . . . . . . . A 52 U C4' . 31106 1
102 . 1 . 1 16 16 U C5 C 13 102.433 . . . . . . . A 52 U C5 . 31106 1
103 . 1 . 1 16 16 U C6 C 13 144.765 . . . . . . . A 52 U C6 . 31106 1
104 . 1 . 1 17 17 C H1' H 1 5.96 . . . . . . . A 53 C H1' . 31106 1
105 . 1 . 1 17 17 C H4' H 1 3.771 . . . . . . . A 53 C H4' . 31106 1
106 . 1 . 1 17 17 C H5 H 1 6.123 . . . . . . . A 53 C H5 . 31106 1
107 . 1 . 1 17 17 C H6 H 1 7.694 . . . . . . . A 53 C H6 . 31106 1
108 . 1 . 1 17 17 C C1' C 13 89.092 . . . . . . . A 53 C C1' . 31106 1
109 . 1 . 1 17 17 C C4' C 13 84.416 . . . . . . . A 53 C C4' . 31106 1
110 . 1 . 1 17 17 C C5 C 13 95.608 . . . . . . . A 53 C C5 . 31106 1
111 . 1 . 1 17 17 C C6 C 13 142.872 . . . . . . . A 53 C C6 . 31106 1
112 . 1 . 1 18 18 G H1 H 1 12.502 . . . . . . . A 54 G H1 . 31106 1
113 . 1 . 1 18 18 G H1' H 1 5.727 . . . . . . . A 54 G H1' . 31106 1
114 . 1 . 1 18 18 G H8 H 1 7.358 . . . . . . . A 54 G H8 . 31106 1
115 . 1 . 1 18 18 G C1' C 13 93.078 . . . . . . . A 54 G C1' . 31106 1
116 . 1 . 1 18 18 G C8 C 13 136.881 . . . . . . . A 54 G C8 . 31106 1
117 . 1 . 1 18 18 G N1 N 15 147.73 . . . . . . . A 54 G N1 . 31106 1
118 . 1 . 1 19 19 G H1 H 1 12.885 . . . . . . . A 33 G H1 . 31106 1
119 . 1 . 1 19 19 G N1 N 15 147.239 . . . . . . . A 33 G N1 . 31106 1
120 . 1 . 1 20 20 G H1 H 1 12.537 . . . . . . . A 34 G H1 . 31106 1
121 . 1 . 1 20 20 G H1' H 1 5.646 . . . . . . . A 34 G H1' . 31106 1
122 . 1 . 1 20 20 G H8 H 1 7.132 . . . . . . . A 34 G H8 . 31106 1
123 . 1 . 1 20 20 G C1' C 13 93.103 . . . . . . . A 34 G C1' . 31106 1
124 . 1 . 1 20 20 G C8 C 13 136.782 . . . . . . . A 34 G C8 . 31106 1
125 . 1 . 1 20 20 G N1 N 15 147.8 . . . . . . . A 34 G N1 . 31106 1
126 . 1 . 1 21 21 A H1' H 1 6.164 . . . . . . . A 35 A H1' . 31106 1
127 . 1 . 1 21 21 A H2 H 1 7.894 . . . . . . . A 35 A H2 . 31106 1
128 . 1 . 1 21 21 A H8 H 1 8.164 . . . . . . . A 35 A H8 . 31106 1
129 . 1 . 1 21 21 A C1' C 13 91.583 . . . . . . . A 35 A C1' . 31106 1
130 . 1 . 1 21 21 A C2 C 13 153.972 . . . . . . . A 35 A C2 . 31106 1
131 . 1 . 1 21 21 A C8 C 13 139.96 . . . . . . . A 35 A C8 . 31106 1
132 . 1 . 1 23 23 C H1' H 1 5.623 . . . . . . . A 37 C H1' . 31106 1
133 . 1 . 1 23 23 C H5 H 1 5.264 . . . . . . . A 37 C H5 . 31106 1
134 . 1 . 1 23 23 C H6 H 1 7.367 . . . . . . . A 37 C H6 . 31106 1
135 . 1 . 1 23 23 C C1' C 13 94.3 . . . . . . . A 37 C C1' . 31106 1
136 . 1 . 1 23 23 C C5 C 13 94.957 . . . . . . . A 37 C C5 . 31106 1
137 . 1 . 1 23 23 C C6 C 13 140.637 . . . . . . . A 37 C C6 . 31106 1
138 . 1 . 1 24 24 U H1' H 1 5.584 . . . . . . . A 38 U H1' . 31106 1
139 . 1 . 1 24 24 U H3 H 1 11.243 . . . . . . . A 38 U H3 . 31106 1
140 . 1 . 1 24 24 U H4' H 1 4.388 . . . . . . . A 38 U H4' . 31106 1
141 . 1 . 1 24 24 U H5 H 1 5.727 . . . . . . . A 38 U H5 . 31106 1
142 . 1 . 1 24 24 U H6 H 1 7.851 . . . . . . . A 38 U H6 . 31106 1
143 . 1 . 1 24 24 U C1' C 13 93.874 . . . . . . . A 38 U C1' . 31106 1
144 . 1 . 1 24 24 U C4' C 13 82.279 . . . . . . . A 38 U C4' . 31106 1
145 . 1 . 1 24 24 U C5 C 13 99.967 . . . . . . . A 38 U C5 . 31106 1
146 . 1 . 1 24 24 U C6 C 13 142.808 . . . . . . . A 38 U C6 . 31106 1
147 . 1 . 1 24 24 U N3 N 15 157.425 . . . . . . . A 38 U N3 . 31106 1
148 . 1 . 1 25 25 C H1' H 1 5.737 . . . . . . . A 39 C H1' . 31106 1
149 . 1 . 1 25 25 C H4' H 1 4.337 . . . . . . . A 39 C H4' . 31106 1
150 . 1 . 1 25 25 C H5 H 1 5.812 . . . . . . . A 39 C H5 . 31106 1
151 . 1 . 1 25 25 C H6 H 1 8.018 . . . . . . . A 39 C H6 . 31106 1
152 . 1 . 1 25 25 C C1' C 13 93.926 . . . . . . . A 39 C C1' . 31106 1
153 . 1 . 1 25 25 C C4' C 13 81.833 . . . . . . . A 39 C C4' . 31106 1
154 . 1 . 1 25 25 C C5 C 13 94.774 . . . . . . . A 39 C C5 . 31106 1
155 . 1 . 1 25 25 C C6 C 13 142.037 . . . . . . . A 39 C C6 . 31106 1
156 . 1 . 1 26 26 U H1' H 1 5.502 . . . . . . . A 40 U H1' . 31106 1
157 . 1 . 1 26 26 U H3 H 1 13.358 . . . . . . . A 40 U H3 . 31106 1
158 . 1 . 1 26 26 U H4' H 1 4.443 . . . . . . . A 40 U H4' . 31106 1
159 . 1 . 1 26 26 U H5 H 1 5.449 . . . . . . . A 40 U H5 . 31106 1
160 . 1 . 1 26 26 U H6 H 1 7.907 . . . . . . . A 40 U H6 . 31106 1
161 . 1 . 1 26 26 U C1' C 13 93.663 . . . . . . . A 40 U C1' . 31106 1
162 . 1 . 1 26 26 U C4' C 13 82.053 . . . . . . . A 40 U C4' . 31106 1
163 . 1 . 1 26 26 U C5 C 13 100.69 . . . . . . . A 40 U C5 . 31106 1
164 . 1 . 1 26 26 U C6 C 13 141.929 . . . . . . . A 40 U C6 . 31106 1
165 . 1 . 1 26 26 U N3 N 15 162.111 . . . . . . . A 40 U N3 . 31106 1
166 . 1 . 1 29 29 G H1 H 1 12.551 . . . . . . . A 43 G H1 . 31106 1
167 . 1 . 1 29 29 G H1' H 1 5.825 . . . . . . . A 43 G H1' . 31106 1
168 . 1 . 1 29 29 G H4' H 1 4.478 . . . . . . . A 43 G H4' . 31106 1
169 . 1 . 1 29 29 G C1' C 13 92.683 . . . . . . . A 43 G C1' . 31106 1
170 . 1 . 1 29 29 G C4' C 13 81.916 . . . . . . . A 43 G C4' . 31106 1
171 . 1 . 1 29 29 G N1 N 15 147.817 . . . . . . . A 43 G N1 . 31106 1
172 . 1 . 1 30 30 C H1' H 1 5.501 . . . . . . . A 44 C H1' . 31106 1
173 . 1 . 1 30 30 C H4' H 1 4.368 . . . . . . . A 44 C H4' . 31106 1
174 . 1 . 1 30 30 C H5 H 1 5.241 . . . . . . . A 44 C H5 . 31106 1
175 . 1 . 1 30 30 C H6 H 1 7.694 . . . . . . . A 44 C H6 . 31106 1
176 . 1 . 1 30 30 C C1' C 13 94.149 . . . . . . . A 44 C C1' . 31106 1
177 . 1 . 1 30 30 C C4' C 13 81.839 . . . . . . . A 44 C C4' . 31106 1
178 . 1 . 1 30 30 C C5 C 13 94.005 . . . . . . . A 44 C C5 . 31106 1
179 . 1 . 1 30 30 C C6 C 13 140.994 . . . . . . . A 44 C C6 . 31106 1
stop_
save_