Content for NMR-STAR saveframe, "chem_shifts_pH7.8_300K"
save_chem_shifts_pH7.8_300K
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shifts_pH7.8_300K
_Assigned_chem_shift_list.Entry_ID 19039
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $300K_d2o_pH7.8
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $DSS
_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' . . . 19039 1
6 '2D 1H-13C HSQC aromatic' . . . 19039 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 G H1' H 1 5.849 0.005 . 1 . . . A 1 G H1' . 19039 1
2 . 1 1 1 1 G H2' H 1 4.908 0.005 . 1 . . . A 1 G H2' . 19039 1
3 . 1 1 1 1 G H8 H 1 8.157 0.005 . 1 . . . A 1 G H8 . 19039 1
4 . 1 1 1 1 G C8 C 13 139.781 0.050 . 1 . . . A 1 G C8 . 19039 1
5 . 1 1 2 2 G H1' H 1 5.761 0.005 . 1 . . . A 2 G H1' . 19039 1
6 . 1 1 2 2 G H2' H 1 4.674 0.005 . 1 . . . A 2 G H2' . 19039 1
7 . 1 1 2 2 G H8 H 1 7.638 0.005 . 1 . . . A 2 G H8 . 19039 1
8 . 1 1 2 2 G C8 C 13 137.420 0.050 . 1 . . . A 2 G C8 . 19039 1
9 . 1 1 3 3 A H1' H 1 5.927 0.005 . 1 . . . A 3 A H1' . 19039 1
10 . 1 1 3 3 A H2 H 1 7.588 0.005 . 1 . . . A 3 A H2 . 19039 1
11 . 1 1 3 3 A H8 H 1 7.813 0.005 . 1 . . . A 3 A H8 . 19039 1
12 . 1 1 3 3 A C2 C 13 153.861 0.050 . 1 . . . A 3 A C2 . 19039 1
13 . 1 1 3 3 A C8 C 13 139.555 0.050 . 1 . . . A 3 A C8 . 19039 1
14 . 1 1 4 4 G H1' H 1 5.759 0.005 . 1 . . . A 4 G H1' . 19039 1
15 . 1 1 4 4 G H8 H 1 7.684 0.005 . 1 . . . A 4 G H8 . 19039 1
16 . 1 1 5 5 C H1' H 1 5.534 0.005 . 1 . . . A 5 C H1' . 19039 1
17 . 1 1 5 5 C H2' H 1 4.326 0.005 . 1 . . . A 5 C H2' . 19039 1
18 . 1 1 5 5 C H5 H 1 5.186 0.005 . 1 . . . A 5 C H5 . 19039 1
19 . 1 1 5 5 C H6 H 1 7.539 0.005 . 1 . . . A 5 C H6 . 19039 1
20 . 1 1 6 6 C H1' H 1 5.419 0.005 . 1 . . . A 6 C H1' . 19039 1
21 . 1 1 6 6 C H2' H 1 4.530 0.005 . 1 . . . A 6 C H2' . 19039 1
22 . 1 1 6 6 C H5 H 1 5.412 0.005 . 1 . . . A 6 C H5 . 19039 1
23 . 1 1 6 6 C H6 H 1 7.746 0.005 . 1 . . . A 6 C H6 . 19039 1
24 . 1 1 6 6 C C6 C 13 140.892 0.050 . 1 . . . A 6 C C6 . 19039 1
25 . 1 1 7 7 G H1' H 1 5.657 0.005 . 1 . . . A 7 G H1' . 19039 1
26 . 1 1 7 7 G H2' H 1 4.467 0.005 . 1 . . . A 7 G H2' . 19039 1
27 . 1 1 7 7 G H8 H 1 7.478 0.005 . 1 . . . A 7 G H8 . 19039 1
28 . 1 1 7 7 G C8 C 13 136.225 0.050 . 1 . . . A 7 G C8 . 19039 1
29 . 1 1 8 8 U H1' H 1 5.536 0.005 . 1 . . . A 8 U H1' . 19039 1
30 . 1 1 8 8 U H2' H 1 4.537 0.005 . 1 . . . A 8 U H2' . 19039 1
31 . 1 1 8 8 U H5 H 1 5.087 0.005 . 1 . . . A 8 U H5 . 19039 1
32 . 1 1 8 8 U H6 H 1 7.705 0.005 . 1 . . . A 8 U H6 . 19039 1
33 . 1 1 8 8 U C6 C 13 141.451 0.050 . 1 . . . A 8 U C6 . 19039 1
34 . 1 1 9 9 A H1' H 1 6.009 0.005 . 1 . . . A 9 A H1' . 19039 1
35 . 1 1 9 9 A H2 H 1 7.283 0.005 . 1 . . . A 9 A H2 . 19039 1
36 . 1 1 9 9 A H2' H 1 4.504 0.005 . 1 . . . A 9 A H2' . 19039 1
37 . 1 1 9 9 A H8 H 1 8.049 0.005 . 1 . . . A 9 A H8 . 19039 1
38 . 1 1 9 9 A C2 C 13 153.789 0.050 . 1 . . . A 9 A C2 . 19039 1
39 . 1 1 9 9 A C8 C 13 139.688 0.050 . 1 . . . A 9 A C8 . 19039 1
40 . 1 1 10 10 U H1' H 1 5.543 0.005 . 1 . . . A 10 U H1' . 19039 1
41 . 1 1 10 10 U H2' H 1 4.254 0.005 . 1 . . . A 10 U H2' . 19039 1
42 . 1 1 10 10 U H5 H 1 5.387 0.005 . 1 . . . A 10 U H5 . 19039 1
43 . 1 1 10 10 U H6 H 1 7.520 0.005 . 1 . . . A 10 U H6 . 19039 1
44 . 1 1 10 10 U C6 C 13 141.153 0.050 . 1 . . . A 10 U C6 . 19039 1
45 . 1 1 11 11 G H1' H 1 5.723 0.005 . 1 . . . A 11 G H1' . 19039 1
46 . 1 1 11 11 G H2' H 1 4.605 0.005 . 1 . . . A 11 G H2' . 19039 1
47 . 1 1 11 11 G H8 H 1 7.861 0.005 . 1 . . . A 11 G H8 . 19039 1
48 . 1 1 11 11 G C8 C 13 137.797 0.050 . 1 . . . A 11 G C8 . 19039 1
49 . 1 1 12 12 C H1' H 1 5.478 0.005 . 1 . . . A 12 C H1' . 19039 1
50 . 1 1 12 12 C H2' H 1 4.489 0.005 . 1 . . . A 12 C H2' . 19039 1
51 . 1 1 12 12 C H5 H 1 5.177 0.005 . 1 . . . A 12 C H5 . 19039 1
52 . 1 1 12 12 C H6 H 1 7.637 0.005 . 1 . . . A 12 C H6 . 19039 1
53 . 1 1 12 12 C C6 C 13 140.924 0.050 . 1 . . . A 12 C C6 . 19039 1
54 . 1 1 13 13 G H1' H 1 5.703 0.005 . 1 . . . A 13 G H1' . 19039 1
55 . 1 1 13 13 G H2' H 1 4.594 0.005 . 1 . . . A 13 G H2' . 19039 1
56 . 1 1 13 13 G H8 H 1 7.517 0.005 . 1 . . . A 13 G H8 . 19039 1
57 . 1 1 13 13 G C8 C 13 136.182 0.050 . 1 . . . A 13 G C8 . 19039 1
58 . 1 1 14 14 G H1' H 1 5.664 0.005 . 1 . . . A 14 G H1' . 19039 1
59 . 1 1 14 14 G H2' H 1 4.520 0.005 . 1 . . . A 14 G H2' . 19039 1
60 . 1 1 14 14 G H8 H 1 7.062 0.005 . 1 . . . A 14 G H8 . 19039 1
61 . 1 1 14 14 G C8 C 13 135.674 0.050 . 1 . . . A 14 G C8 . 19039 1
62 . 1 1 15 15 U H1' H 1 5.452 0.005 . 1 . . . A 15 U H1' . 19039 1
63 . 1 1 15 15 U H2' H 1 4.356 0.005 . 1 . . . A 15 U H2' . 19039 1
64 . 1 1 15 15 U H5 H 1 5.332 0.005 . 1 . . . A 15 U H5 . 19039 1
65 . 1 1 15 15 U H6 H 1 7.497 0.005 . 1 . . . A 15 U H6 . 19039 1
66 . 1 1 15 15 U C6 C 13 140.479 0.050 . 1 . . . A 15 U C6 . 19039 1
67 . 1 1 16 16 A H1' H 1 5.687 0.005 . 1 . . . A 16 A H1' . 19039 1
68 . 1 1 16 16 A H2 H 1 7.839 0.005 . 1 . . . A 16 A H2 . 19039 1
69 . 1 1 16 16 A H2' H 1 4.579 0.005 . 1 . . . A 16 A H2' . 19039 1
70 . 1 1 16 16 A H8 H 1 8.106 0.005 . 1 . . . A 16 A H8 . 19039 1
71 . 1 1 16 16 A C2 C 13 155.363 0.050 . 1 . . . A 16 A C2 . 19039 1
72 . 1 1 16 16 A C8 C 13 140.700 0.050 . 1 . . . A 16 A C8 . 19039 1
73 . 1 1 17 17 G H1' H 1 5.557 0.005 . 1 . . . A 17 G H1' . 19039 1
74 . 1 1 17 17 G H2' H 1 4.585 0.005 . 1 . . . A 17 G H2' . 19039 1
75 . 1 1 17 17 G H8 H 1 7.749 0.005 . 1 . . . A 17 G H8 . 19039 1
76 . 1 1 17 17 G C8 C 13 139.820 0.050 . 1 . . . A 17 G C8 . 19039 1
77 . 1 1 18 18 U H1' H 1 6.058 0.005 . 1 . . . A 18 U H1' . 19039 1
78 . 1 1 18 18 U H2' H 1 4.437 0.005 . 1 . . . A 18 U H2' . 19039 1
79 . 1 1 18 18 U H5 H 1 5.924 0.005 . 1 . . . A 18 U H5 . 19039 1
80 . 1 1 18 18 U H6 H 1 7.819 0.005 . 1 . . . A 18 U H6 . 19039 1
81 . 1 1 18 18 U C6 C 13 143.752 0.050 . 1 . . . A 18 U C6 . 19039 1
82 . 1 1 19 19 U H1' H 1 5.743 0.005 . 1 . . . A 19 U H1' . 19039 1
83 . 1 1 19 19 U H2' H 1 4.455 0.005 . 1 . . . A 19 U H2' . 19039 1
84 . 1 1 19 19 U H5 H 1 5.844 0.005 . 1 . . . A 19 U H5 . 19039 1
85 . 1 1 19 19 U H6 H 1 7.843 0.005 . 1 . . . A 19 U H6 . 19039 1
86 . 1 1 19 19 U C6 C 13 143.801 0.050 . 1 . . . A 19 U C6 . 19039 1
87 . 1 1 20 20 C H1' H 1 5.596 0.005 . 1 . . . A 20 C H1' . 19039 1
88 . 1 1 20 20 C H2' H 1 4.439 0.005 . 1 . . . A 20 C H2' . 19039 1
89 . 1 1 20 20 C H5 H 1 5.854 0.005 . 1 . . . A 20 C H5 . 19039 1
90 . 1 1 20 20 C H6 H 1 7.950 0.005 . 1 . . . A 20 C H6 . 19039 1
91 . 1 1 20 20 C C6 C 13 142.447 0.050 . 1 . . . A 20 C C6 . 19039 1
92 . 1 1 21 21 C H1' H 1 5.509 0.005 . 1 . . . A 21 C H1' . 19039 1
93 . 1 1 21 21 C H2' H 1 4.581 0.005 . 1 . . . A 21 C H2' . 19039 1
94 . 1 1 21 21 C H5 H 1 5.588 0.005 . 1 . . . A 21 C H5 . 19039 1
95 . 1 1 21 21 C H6 H 1 7.705 0.005 . 1 . . . A 21 C H6 . 19039 1
96 . 1 1 21 21 C C6 C 13 141.088 0.050 . 1 . . . A 21 C C6 . 19039 1
97 . 1 1 22 22 G H1' H 1 5.677 0.005 . 1 . . . A 22 G H1' . 19039 1
98 . 1 1 22 22 G H2' H 1 4.495 0.005 . 1 . . . A 22 G H2' . 19039 1
99 . 1 1 22 22 G H8 H 1 7.554 0.005 . 1 . . . A 22 G H8 . 19039 1
100 . 1 1 22 22 G C8 C 13 136.021 0.050 . 1 . . . A 22 G C8 . 19039 1
101 . 1 1 23 23 C H1' H 1 5.402 0.005 . 1 . . . A 23 C H1' . 19039 1
102 . 1 1 23 23 C H2' H 1 4.381 0.005 . 1 . . . A 23 C H2' . 19039 1
103 . 1 1 23 23 C H5 H 1 5.171 0.005 . 1 . . . A 23 C H5 . 19039 1
104 . 1 1 23 23 C H6 H 1 7.465 0.005 . 1 . . . A 23 C H6 . 19039 1
105 . 1 1 23 23 C C6 C 13 140.349 0.050 . 1 . . . A 23 C C6 . 19039 1
106 . 1 1 24 24 A H1' H 1 5.848 0.005 . 1 . . . A 24 A H1' . 19039 1
107 . 1 1 24 24 A H2 H 1 7.146 0.005 . 1 . . . A 24 A H2 . 19039 1
108 . 1 1 24 24 A H2' H 1 4.193 0.005 . 1 . . . A 24 A H2' . 19039 1
109 . 1 1 24 24 A H8 H 1 7.919 0.005 . 1 . . . A 24 A H8 . 19039 1
110 . 1 1 24 24 A C2 C 13 154.033 0.050 . 1 . . . A 24 A C2 . 19039 1
111 . 1 1 24 24 A C8 C 13 139.584 0.050 . 1 . . . A 24 A C8 . 19039 1
112 . 1 1 25 25 C H1' H 1 5.551 0.005 . 1 . . . A 25 C H1' . 19039 1
113 . 1 1 25 25 C H2' H 1 4.083 0.005 . 1 . . . A 25 C H2' . 19039 1
114 . 1 1 25 25 C H5 H 1 5.381 0.005 . 1 . . . A 25 C H5 . 19039 1
115 . 1 1 25 25 C H6 H 1 7.403 0.005 . 1 . . . A 25 C H6 . 19039 1
116 . 1 1 25 25 C C6 C 13 141.839 0.050 . 1 . . . A 25 C C6 . 19039 1
117 . 1 1 26 26 G H1' H 1 5.627 0.005 . 1 . . . A 26 G H1' . 19039 1
118 . 1 1 26 26 G H2' H 1 4.711 0.005 . 1 . . . A 26 G H2' . 19039 1
119 . 1 1 26 26 G H8 H 1 7.836 0.005 . 1 . . . A 26 G H8 . 19039 1
120 . 1 1 26 26 G C8 C 13 139.066 0.050 . 1 . . . A 26 G C8 . 19039 1
121 . 1 1 27 27 U H1' H 1 5.665 0.005 . 1 . . . A 27 U H1' . 19039 1
122 . 1 1 27 27 U H2' H 1 4.519 0.005 . 1 . . . A 27 U H2' . 19039 1
123 . 1 1 27 27 U H5 H 1 5.582 0.005 . 1 . . . A 27 U H5 . 19039 1
124 . 1 1 27 27 U H6 H 1 7.846 0.005 . 1 . . . A 27 U H6 . 19039 1
125 . 1 1 27 27 U C6 C 13 142.162 0.050 . 1 . . . A 27 U C6 . 19039 1
126 . 1 1 28 28 A H1' H 1 6.021 0.005 . 1 . . . A 28 A H1' . 19039 1
127 . 1 1 28 28 A H2 H 1 7.233 0.005 . 1 . . . A 28 A H2 . 19039 1
128 . 1 1 28 28 A H2' H 1 4.567 0.005 . 1 . . . A 28 A H2' . 19039 1
129 . 1 1 28 28 A H8 H 1 8.254 0.005 . 1 . . . A 28 A H8 . 19039 1
130 . 1 1 28 28 A C2 C 13 153.394 0.050 . 1 . . . A 28 A C2 . 19039 1
131 . 1 1 28 28 A C8 C 13 140.061 0.050 . 1 . . . A 28 A C8 . 19039 1
132 . 1 1 29 29 C H1' H 1 5.411 0.005 . 1 . . . A 29 C H1' . 19039 1
133 . 1 1 29 29 C H2' H 1 4.434 0.005 . 1 . . . A 29 C H2' . 19039 1
134 . 1 1 29 29 C H5 H 1 5.173 0.005 . 1 . . . A 29 C H5 . 19039 1
135 . 1 1 29 29 C H6 H 1 7.454 0.005 . 1 . . . A 29 C H6 . 19039 1
136 . 1 1 29 29 C C6 C 13 140.344 0.050 . 1 . . . A 29 C C6 . 19039 1
137 . 1 1 30 30 G H1' H 1 5.668 0.005 . 1 . . . A 30 G H1' . 19039 1
138 . 1 1 30 30 G H2' H 1 4.592 0.005 . 1 . . . A 30 G H2' . 19039 1
139 . 1 1 30 30 G H8 H 1 7.425 0.005 . 1 . . . A 30 G H8 . 19039 1
140 . 1 1 30 30 G C8 C 13 136.026 0.050 . 1 . . . A 30 G C8 . 19039 1
141 . 1 1 31 31 G H1' H 1 5.660 0.005 . 1 . . . A 31 G H1' . 19039 1
142 . 1 1 31 31 G H2' H 1 4.312 0.005 . 1 . . . A 31 G H2' . 19039 1
143 . 1 1 31 31 G H8 H 1 7.255 0.005 . 1 . . . A 31 G H8 . 19039 1
144 . 1 1 31 31 G C8 C 13 136.416 0.050 . 1 . . . A 31 G C8 . 19039 1
145 . 1 1 32 32 A H1' H 1 6.054 0.005 . 1 . . . A 32 A H1' . 19039 1
146 . 1 1 32 32 A H2 H 1 8.098 0.005 . 1 . . . A 32 A H2 . 19039 1
147 . 1 1 32 32 A H2' H 1 4.662 0.005 . 1 . . . A 32 A H2' . 19039 1
148 . 1 1 32 32 A H8 H 1 7.956 0.005 . 1 . . . A 32 A H8 . 19039 1
149 . 1 1 32 32 A C2 C 13 154.619 0.050 . 1 . . . A 32 A C2 . 19039 1
150 . 1 1 32 32 A C8 C 13 139.689 0.050 . 1 . . . A 32 A C8 . 19039 1
151 . 1 1 33 33 U H1' H 1 5.280 0.005 . 1 . . . A 33 U H1' . 19039 1
152 . 1 1 33 33 U H2' H 1 4.283 0.005 . 1 . . . A 33 U H2' . 19039 1
153 . 1 1 33 33 U H5 H 1 5.296 0.005 . 1 . . . A 33 U H5 . 19039 1
154 . 1 1 33 33 U H6 H 1 7.266 0.005 . 1 . . . A 33 U H6 . 19039 1
155 . 1 1 33 33 U C6 C 13 141.056 0.050 . 1 . . . A 33 U C6 . 19039 1
156 . 1 1 34 34 C H1' H 1 5.652 0.005 . 1 . . . A 34 C H1' . 19039 1
157 . 1 1 34 34 C H2' H 1 4.333 0.005 . 1 . . . A 34 C H2' . 19039 1
158 . 1 1 34 34 C H5 H 1 5.573 0.005 . 1 . . . A 34 C H5 . 19039 1
159 . 1 1 34 34 C H6 H 1 7.787 0.005 . 1 . . . A 34 C H6 . 19039 1
160 . 1 1 34 34 C C6 C 13 141.585 0.050 . 1 . . . A 34 C C6 . 19039 1
161 . 1 1 35 35 U H1' H 1 5.721 0.005 . 1 . . . A 35 U H1' . 19039 1
162 . 1 1 35 35 U H2' H 1 3.999 0.005 . 1 . . . A 35 U H2' . 19039 1
163 . 1 1 35 35 U H5 H 1 5.623 0.005 . 1 . . . A 35 U H5 . 19039 1
164 . 1 1 35 35 U H6 H 1 7.760 0.005 . 1 . . . A 35 U H6 . 19039 1
165 . 1 1 35 35 U C6 C 13 142.110 0.050 . 1 . . . A 35 U C6 . 19039 1
stop_
save_