Content for NMR-STAR saveframe, "chem_shifts_pH6.7_300K"
save_chem_shifts_pH6.7_300K
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shifts_pH6.7_300K
_Assigned_chem_shift_list.Entry_ID 19039
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Sample_condition_list_ID 4
_Assigned_chem_shift_list.Sample_condition_list_label $300K_d2o_pH6.7
_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
10 '2D 1H-1H NOESY' . . . 19039 3
14 '2D 1H-13C HSQC aromatic' . . . 19039 3
15 '2D 1H-13C HSQC aliphatic' . . . 19039 3
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 5.876 0.005 . 1 . . . A 1 G H1' . 19039 3
2 . 1 1 1 1 G H2' H 1 4.935 0.005 . 1 . . . A 1 G H2' . 19039 3
3 . 1 1 1 1 G H3' H 1 4.583 0.005 . 1 . . . A 1 G H3' . 19039 3
4 . 1 1 1 1 G H4' H 1 4.559 0.005 . 1 . . . A 1 G H4' . 19039 3
5 . 1 1 1 1 G H5' H 1 4.410 0.005 . 1 . . . A 1 G H5' . 19039 3
6 . 1 1 1 1 G H5'' H 1 4.284 0.005 . 1 . . . A 1 G H5'' . 19039 3
7 . 1 1 1 1 G H8 H 1 8.140 0.005 . 1 . . . A 1 G H8 . 19039 3
8 . 1 1 1 1 G C1' C 13 91.929 0.050 . 1 . . . A 1 G C1' . 19039 3
9 . 1 1 1 1 G C2' C 13 75.459 0.050 . 1 . . . A 1 G C2' . 19039 3
10 . 1 1 1 1 G C3' C 13 72.977 0.050 . 1 . . . A 1 G C3' . 19039 3
11 . 1 1 1 1 G C5' C 13 67.356 0.050 . 1 . . . A 1 G C5' . 19039 3
12 . 1 1 1 1 G C8 C 13 139.670 0.050 . 1 . . . A 1 G C8 . 19039 3
13 . 1 1 1 1 G N7 N 15 233.286 0.050 . 1 . . . A 1 G N7 . 19039 3
14 . 1 1 2 2 G H1' H 1 5.780 0.005 . 1 . . . A 2 G H1' . 19039 3
15 . 1 1 2 2 G H2' H 1 4.683 0.005 . 1 . . . A 2 G H2' . 19039 3
16 . 1 1 2 2 G H3' H 1 4.626 0.005 . 1 . . . A 2 G H3' . 19039 3
17 . 1 1 2 2 G H4' H 1 4.557 0.005 . 1 . . . A 2 G H4' . 19039 3
18 . 1 1 2 2 G H5'' H 1 4.243 0.005 . 1 . . . A 2 G H5'' . 19039 3
19 . 1 1 2 2 G H8 H 1 7.653 0.005 . 1 . . . A 2 G H8 . 19039 3
20 . 1 1 2 2 G C8 C 13 137.308 0.050 . 1 . . . A 2 G C8 . 19039 3
21 . 1 1 2 2 G N7 N 15 234.198 0.050 . 1 . . . A 2 G N7 . 19039 3
22 . 1 1 3 3 A H2 H 1 7.595 0.005 . 1 . . . A 3 A H2 . 19039 3
23 . 1 1 3 3 A C2 C 13 153.868 0.050 . 1 . . . A 3 A C2 . 19039 3
24 . 1 1 3 3 A C8 C 13 139.599 0.050 . 1 . . . A 3 A C8 . 19039 3
25 . 1 1 5 5 C H1' H 1 5.580 0.005 . 1 . . . A 5 C H1' . 19039 3
26 . 1 1 5 5 C H2' H 1 4.327 0.005 . 1 . . . A 5 C H2' . 19039 3
27 . 1 1 5 5 C H5 H 1 5.176 0.005 . 1 . . . A 5 C H5 . 19039 3
28 . 1 1 5 5 C H6 H 1 7.523 0.005 . 1 . . . A 5 C H6 . 19039 3
29 . 1 1 5 5 C C2' C 13 75.438 0.050 . 1 . . . A 5 C C2' . 19039 3
30 . 1 1 6 6 C H1' H 1 5.432 0.005 . 1 . . . A 6 C H1' . 19039 3
31 . 1 1 6 6 C H2' H 1 4.545 0.005 . 1 . . . A 6 C H2' . 19039 3
32 . 1 1 6 6 C H3' H 1 4.386 0.005 . 1 . . . A 6 C H3' . 19039 3
33 . 1 1 6 6 C H4' H 1 4.399 0.005 . 1 . . . A 6 C H4' . 19039 3
34 . 1 1 6 6 C H5 H 1 5.417 0.005 . 1 . . . A 6 C H5 . 19039 3
35 . 1 1 6 6 C H5' H 1 4.526 0.005 . 1 . . . A 6 C H5' . 19039 3
36 . 1 1 6 6 C H5'' H 1 4.084 0.005 . 1 . . . A 6 C H5'' . 19039 3
37 . 1 1 6 6 C H6 H 1 7.740 0.005 . 1 . . . A 6 C H6 . 19039 3
38 . 1 1 6 6 C C1' C 13 93.940 0.050 . 1 . . . A 6 C C1' . 19039 3
39 . 1 1 6 6 C C2' C 13 75.363 0.050 . 1 . . . A 6 C C2' . 19039 3
40 . 1 1 6 6 C C4' C 13 81.894 0.050 . 1 . . . A 6 C C4' . 19039 3
41 . 1 1 6 6 C C5 C 13 97.638 0.050 . 1 . . . A 6 C C5 . 19039 3
42 . 1 1 6 6 C C5' C 13 64.500 0.050 . 1 . . . A 6 C C5' . 19039 3
43 . 1 1 6 6 C C6 C 13 140.863 0.050 . 1 . . . A 6 C C6 . 19039 3
44 . 1 1 7 7 G H1' H 1 5.668 0.005 . 1 . . . A 7 G H1' . 19039 3
45 . 1 1 7 7 G H2' H 1 4.479 0.005 . 1 . . . A 7 G H2' . 19039 3
46 . 1 1 7 7 G H3' H 1 4.507 0.005 . 1 . . . A 7 G H3' . 19039 3
47 . 1 1 7 7 G H4' H 1 4.446 0.005 . 1 . . . A 7 G H4' . 19039 3
48 . 1 1 7 7 G H5'' H 1 4.088 0.005 . 1 . . . A 7 G H5'' . 19039 3
49 . 1 1 7 7 G H8 H 1 7.501 0.005 . 1 . . . A 7 G H8 . 19039 3
50 . 1 1 7 7 G C1' C 13 93.034 0.050 . 1 . . . A 7 G C1' . 19039 3
51 . 1 1 7 7 G C8 C 13 136.263 0.050 . 1 . . . A 7 G C8 . 19039 3
52 . 1 1 7 7 G N7 N 15 235.183 0.050 . 1 . . . A 7 G N7 . 19039 3
53 . 1 1 8 8 U H1' H 1 5.564 0.005 . 1 . . . A 8 U H1' . 19039 3
54 . 1 1 8 8 U H2' H 1 4.541 0.005 . 1 . . . A 8 U H2' . 19039 3
55 . 1 1 8 8 U H3' H 1 4.585 0.005 . 1 . . . A 8 U H3' . 19039 3
56 . 1 1 8 8 U H4' H 1 4.456 0.005 . 1 . . . A 8 U H4' . 19039 3
57 . 1 1 8 8 U H5 H 1 5.097 0.005 . 1 . . . A 8 U H5 . 19039 3
58 . 1 1 8 8 U H5'' H 1 4.119 0.005 . 1 . . . A 8 U H5'' . 19039 3
59 . 1 1 8 8 U H6 H 1 7.710 0.005 . 1 . . . A 8 U H6 . 19039 3
60 . 1 1 8 8 U C1' C 13 93.314 0.050 . 1 . . . A 8 U C1' . 19039 3
61 . 1 1 8 8 U C5 C 13 102.854 0.050 . 1 . . . A 8 U C5 . 19039 3
62 . 1 1 8 8 U C5' C 13 64.568 0.050 . 1 . . . A 8 U C5' . 19039 3
63 . 1 1 8 8 U C6 C 13 141.500 0.050 . 1 . . . A 8 U C6 . 19039 3
64 . 1 1 9 9 A H1' H 1 6.019 0.005 . 1 . . . A 9 A H1' . 19039 3
65 . 1 1 9 9 A H2 H 1 7.334 0.005 . 1 . . . A 9 A H2 . 19039 3
66 . 1 1 9 9 A H2' H 1 4.533 0.005 . 1 . . . A 9 A H2' . 19039 3
67 . 1 1 9 9 A H3' H 1 4.562 0.005 . 1 . . . A 9 A H3' . 19039 3
68 . 1 1 9 9 A H4' H 1 4.527 0.005 . 1 . . . A 9 A H4' . 19039 3
69 . 1 1 9 9 A H5' H 1 4.557 0.005 . 1 . . . A 9 A H5' . 19039 3
70 . 1 1 9 9 A H5'' H 1 4.179 0.005 . 1 . . . A 9 A H5'' . 19039 3
71 . 1 1 9 9 A H8 H 1 8.099 0.005 . 1 . . . A 9 A H8 . 19039 3
72 . 1 1 9 9 A C1' C 13 92.928 0.050 . 1 . . . A 9 A C1' . 19039 3
73 . 1 1 9 9 A C2 C 13 153.263 0.050 . 1 . . . A 9 A C2 . 19039 3
74 . 1 1 9 9 A C5' C 13 65.413 0.050 . 1 . . . A 9 A C5' . 19039 3
75 . 1 1 9 9 A C8 C 13 139.936 0.050 . 1 . . . A 9 A C8 . 19039 3
76 . 1 1 9 9 A N7 N 15 232.122 0.050 . 1 . . . A 9 A N7 . 19039 3
77 . 1 1 10 10 U H1' H 1 5.479 0.005 . 1 . . . A 10 U H1' . 19039 3
78 . 1 1 10 10 U H2' H 1 4.293 0.005 . 1 . . . A 10 U H2' . 19039 3
79 . 1 1 10 10 U H3' H 1 4.588 0.005 . 1 . . . A 10 U H3' . 19039 3
80 . 1 1 10 10 U H4' H 1 4.403 0.005 . 1 . . . A 10 U H4' . 19039 3
81 . 1 1 10 10 U H5 H 1 5.393 0.005 . 1 . . . A 10 U H5 . 19039 3
82 . 1 1 10 10 U H5'' H 1 4.106 0.005 . 1 . . . A 10 U H5'' . 19039 3
83 . 1 1 10 10 U H6 H 1 7.544 0.005 . 1 . . . A 10 U H6 . 19039 3
84 . 1 1 10 10 U C1' C 13 92.529 0.050 . 1 . . . A 10 U C1' . 19039 3
85 . 1 1 10 10 U C2' C 13 75.609 0.050 . 1 . . . A 10 U C2' . 19039 3
86 . 1 1 10 10 U C3' C 13 73.210 0.050 . 1 . . . A 10 U C3' . 19039 3
87 . 1 1 10 10 U C4' C 13 82.879 0.050 . 1 . . . A 10 U C4' . 19039 3
88 . 1 1 10 10 U C5 C 13 104.298 0.050 . 1 . . . A 10 U C5 . 19039 3
89 . 1 1 10 10 U C5' C 13 64.904 0.050 . 1 . . . A 10 U C5' . 19039 3
90 . 1 1 10 10 U C6 C 13 141.004 0.050 . 1 . . . A 10 U C6 . 19039 3
91 . 1 1 11 11 G H1' H 1 5.733 0.005 . 1 . . . A 11 G H1' . 19039 3
92 . 1 1 11 11 G H2' H 1 4.578 0.005 . 1 . . . A 11 G H2' . 19039 3
93 . 1 1 11 11 G H3' H 1 4.521 0.005 . 1 . . . A 11 G H3' . 19039 3
94 . 1 1 11 11 G H4' H 1 4.476 0.005 . 1 . . . A 11 G H4' . 19039 3
95 . 1 1 11 11 G H5' H 1 4.419 0.005 . 1 . . . A 11 G H5' . 19039 3
96 . 1 1 11 11 G H5'' H 1 4.162 0.005 . 1 . . . A 11 G H5'' . 19039 3
97 . 1 1 11 11 G H8 H 1 7.829 0.005 . 1 . . . A 11 G H8 . 19039 3
98 . 1 1 11 11 G C1' C 13 92.883 0.050 . 1 . . . A 11 G C1' . 19039 3
99 . 1 1 11 11 G C5' C 13 66.116 0.050 . 1 . . . A 11 G C5' . 19039 3
100 . 1 1 11 11 G C8 C 13 137.551 0.050 . 1 . . . A 11 G C8 . 19039 3
101 . 1 1 11 11 G N7 N 15 232.687 0.050 . 1 . . . A 11 G N7 . 19039 3
102 . 1 1 12 12 C H1' H 1 5.476 0.005 . 1 . . . A 12 C H1' . 19039 3
103 . 1 1 12 12 C H2' H 1 4.495 0.005 . 1 . . . A 12 C H2' . 19039 3
104 . 1 1 12 12 C H3' H 1 4.509 0.005 . 1 . . . A 12 C H3' . 19039 3
105 . 1 1 12 12 C H4' H 1 4.417 0.005 . 1 . . . A 12 C H4' . 19039 3
106 . 1 1 12 12 C H5 H 1 5.187 0.005 . 1 . . . A 12 C H5 . 19039 3
107 . 1 1 12 12 C H5' H 1 4.485 0.005 . 1 . . . A 12 C H5' . 19039 3
108 . 1 1 12 12 C H5'' H 1 4.116 0.005 . 1 . . . A 12 C H5'' . 19039 3
109 . 1 1 12 12 C H6 H 1 7.645 0.005 . 1 . . . A 12 C H6 . 19039 3
110 . 1 1 12 12 C C1' C 13 93.599 0.050 . 1 . . . A 12 C C1' . 19039 3
111 . 1 1 12 12 C C2' C 13 75.471 0.050 . 1 . . . A 12 C C2' . 19039 3
112 . 1 1 12 12 C C5 C 13 97.444 0.050 . 1 . . . A 12 C C5 . 19039 3
113 . 1 1 12 12 C C5' C 13 64.665 0.050 . 1 . . . A 12 C C5' . 19039 3
114 . 1 1 12 12 C C6 C 13 140.886 0.050 . 1 . . . A 12 C C6 . 19039 3
115 . 1 1 13 13 G H1' H 1 5.706 0.005 . 1 . . . A 13 G H1' . 19039 3
116 . 1 1 13 13 G H2' H 1 4.596 0.005 . 1 . . . A 13 G H2' . 19039 3
117 . 1 1 13 13 G H3' H 1 4.562 0.005 . 1 . . . A 13 G H3' . 19039 3
118 . 1 1 13 13 G H4' H 1 4.439 0.005 . 1 . . . A 13 G H4' . 19039 3
119 . 1 1 13 13 G H5'' H 1 4.105 0.005 . 1 . . . A 13 G H5'' . 19039 3
120 . 1 1 13 13 G H8 H 1 7.521 0.005 . 1 . . . A 13 G H8 . 19039 3
121 . 1 1 13 13 G C1' C 13 92.721 0.050 . 1 . . . A 13 G C1' . 19039 3
122 . 1 1 13 13 G C8 C 13 136.171 0.050 . 1 . . . A 13 G C8 . 19039 3
123 . 1 1 13 13 G N7 N 15 235.001 0.050 . 1 . . . A 13 G N7 . 19039 3
124 . 1 1 14 14 G H1' H 1 5.673 0.005 . 1 . . . A 14 G H1' . 19039 3
125 . 1 1 14 14 G H2' H 1 4.523 0.005 . 1 . . . A 14 G H2' . 19039 3
126 . 1 1 14 14 G H3' H 1 4.276 0.005 . 1 . . . A 14 G H3' . 19039 3
127 . 1 1 14 14 G H4' H 1 4.438 0.005 . 1 . . . A 14 G H4' . 19039 3
128 . 1 1 14 14 G H5' H 1 4.431 0.005 . 1 . . . A 14 G H5' . 19039 3
129 . 1 1 14 14 G H5'' H 1 4.034 0.005 . 1 . . . A 14 G H5'' . 19039 3
130 . 1 1 14 14 G H8 H 1 7.072 0.005 . 1 . . . A 14 G H8 . 19039 3
131 . 1 1 14 14 G C1' C 13 92.832 0.050 . 1 . . . A 14 G C1' . 19039 3
132 . 1 1 14 14 G C3' C 13 73.042 0.050 . 1 . . . A 14 G C3' . 19039 3
133 . 1 1 14 14 G C5' C 13 65.657 0.050 . 1 . . . A 14 G C5' . 19039 3
134 . 1 1 14 14 G C8 C 13 135.714 0.050 . 1 . . . A 14 G C8 . 19039 3
135 . 1 1 14 14 G N7 N 15 236.279 0.050 . 1 . . . A 14 G N7 . 19039 3
136 . 1 1 15 15 U H1' H 1 5.473 0.005 . 1 . . . A 15 U H1' . 19039 3
137 . 1 1 15 15 U H2' H 1 4.366 0.005 . 1 . . . A 15 U H2' . 19039 3
138 . 1 1 15 15 U H3' H 1 4.449 0.005 . 1 . . . A 15 U H3' . 19039 3
139 . 1 1 15 15 U H4' H 1 4.354 0.005 . 1 . . . A 15 U H4' . 19039 3
140 . 1 1 15 15 U H5 H 1 5.353 0.005 . 1 . . . A 15 U H5 . 19039 3
141 . 1 1 15 15 U H5' H 1 4.357 0.005 . 1 . . . A 15 U H5' . 19039 3
142 . 1 1 15 15 U H5'' H 1 4.047 0.005 . 1 . . . A 15 U H5'' . 19039 3
143 . 1 1 15 15 U H6 H 1 7.510 0.005 . 1 . . . A 15 U H6 . 19039 3
144 . 1 1 15 15 U C1' C 13 93.291 0.050 . 1 . . . A 15 U C1' . 19039 3
145 . 1 1 15 15 U C2' C 13 75.412 0.050 . 1 . . . A 15 U C2' . 19039 3
146 . 1 1 15 15 U C3' C 13 73.041 0.050 . 1 . . . A 15 U C3' . 19039 3
147 . 1 1 15 15 U C4' C 13 82.971 0.050 . 1 . . . A 15 U C4' . 19039 3
148 . 1 1 15 15 U C5 C 13 104.195 0.050 . 1 . . . A 15 U C5 . 19039 3
149 . 1 1 15 15 U C5' C 13 64.802 0.050 . 1 . . . A 15 U C5' . 19039 3
150 . 1 1 15 15 U C6 C 13 140.576 0.050 . 1 . . . A 15 U C6 . 19039 3
151 . 1 1 16 16 A H1' H 1 5.704 0.005 . 1 . . . A 16 A H1' . 19039 3
152 . 1 1 16 16 A H2 H 1 7.856 0.005 . 1 . . . A 16 A H2 . 19039 3
153 . 1 1 16 16 A H2' H 1 4.591 0.005 . 1 . . . A 16 A H2' . 19039 3
154 . 1 1 16 16 A H3' H 1 4.560 0.005 . 1 . . . A 16 A H3' . 19039 3
155 . 1 1 16 16 A H4' H 1 4.391 0.005 . 1 . . . A 16 A H4' . 19039 3
156 . 1 1 16 16 A H5' H 1 4.296 0.005 . 1 . . . A 16 A H5' . 19039 3
157 . 1 1 16 16 A H5'' H 1 4.047 0.005 . 1 . . . A 16 A H5'' . 19039 3
158 . 1 1 16 16 A H8 H 1 8.120 0.005 . 1 . . . A 16 A H8 . 19039 3
159 . 1 1 16 16 A C1' C 13 91.776 0.050 . 1 . . . A 16 A C1' . 19039 3
160 . 1 1 16 16 A C2 C 13 155.299 0.050 . 1 . . . A 16 A C2 . 19039 3
161 . 1 1 16 16 A C2' C 13 75.467 0.050 . 1 . . . A 16 A C2' . 19039 3
162 . 1 1 16 16 A C3' C 13 73.809 0.050 . 1 . . . A 16 A C3' . 19039 3
163 . 1 1 16 16 A C4' C 13 83.705 0.050 . 1 . . . A 16 A C4' . 19039 3
164 . 1 1 16 16 A C5' C 13 66.362 0.050 . 1 . . . A 16 A C5' . 19039 3
165 . 1 1 16 16 A C8 C 13 140.774 0.050 . 1 . . . A 16 A C8 . 19039 3
166 . 1 1 16 16 A N1 N 15 225.185 0.050 . 1 . . . A 16 A N1 . 19039 3
167 . 1 1 16 16 A N7 N 15 231.661 0.050 . 1 . . . A 16 A N7 . 19039 3
168 . 1 1 17 17 G H1' H 1 5.568 0.005 . 1 . . . A 17 G H1' . 19039 3
169 . 1 1 17 17 G H2' H 1 4.595 0.005 . 1 . . . A 17 G H2' . 19039 3
170 . 1 1 17 17 G H3' H 1 4.682 0.005 . 1 . . . A 17 G H3' . 19039 3
171 . 1 1 17 17 G H4' H 1 4.436 0.005 . 1 . . . A 17 G H4' . 19039 3
172 . 1 1 17 17 G H5' H 1 4.192 0.005 . 1 . . . A 17 G H5' . 19039 3
173 . 1 1 17 17 G H5'' H 1 4.044 0.005 . 1 . . . A 17 G H5'' . 19039 3
174 . 1 1 17 17 G H8 H 1 7.759 0.005 . 1 . . . A 17 G H8 . 19039 3
175 . 1 1 17 17 G C1' C 13 89.631 0.050 . 1 . . . A 17 G C1' . 19039 3
176 . 1 1 17 17 G C2' C 13 76.266 0.050 . 1 . . . A 17 G C2' . 19039 3
177 . 1 1 17 17 G C3' C 13 78.288 0.050 . 1 . . . A 17 G C3' . 19039 3
178 . 1 1 17 17 G C4' C 13 85.705 0.050 . 1 . . . A 17 G C4' . 19039 3
179 . 1 1 17 17 G C5' C 13 67.710 0.050 . 1 . . . A 17 G C5' . 19039 3
180 . 1 1 17 17 G C8 C 13 139.860 0.050 . 1 . . . A 17 G C8 . 19039 3
181 . 1 1 17 17 G N7 N 15 236.088 0.050 . 1 . . . A 17 G N7 . 19039 3
182 . 1 1 18 18 U H1' H 1 6.063 0.005 . 1 . . . A 18 U H1' . 19039 3
183 . 1 1 18 18 U H2' H 1 4.445 0.005 . 1 . . . A 18 U H2' . 19039 3
184 . 1 1 18 18 U H4' H 1 4.551 0.005 . 1 . . . A 18 U H4' . 19039 3
185 . 1 1 18 18 U H5 H 1 5.931 0.005 . 1 . . . A 18 U H5 . 19039 3
186 . 1 1 18 18 U H5' H 1 4.214 0.005 . 1 . . . A 18 U H5' . 19039 3
187 . 1 1 18 18 U H5'' H 1 4.168 0.005 . 1 . . . A 18 U H5'' . 19039 3
188 . 1 1 18 18 U H6 H 1 7.829 0.005 . 1 . . . A 18 U H6 . 19039 3
189 . 1 1 18 18 U C1' C 13 90.127 0.050 . 1 . . . A 18 U C1' . 19039 3
190 . 1 1 18 18 U C2' C 13 75.951 0.050 . 1 . . . A 18 U C2' . 19039 3
191 . 1 1 18 18 U C3' C 13 77.927 0.050 . 1 . . . A 18 U C3' . 19039 3
192 . 1 1 18 18 U C4' C 13 85.296 0.050 . 1 . . . A 18 U C4' . 19039 3
193 . 1 1 18 18 U C5 C 13 106.003 0.050 . 1 . . . A 18 U C5 . 19039 3
194 . 1 1 18 18 U C5' C 13 68.299 0.050 . 1 . . . A 18 U C5' . 19039 3
195 . 1 1 18 18 U C6 C 13 143.775 0.050 . 1 . . . A 18 U C6 . 19039 3
196 . 1 1 19 19 U H1' H 1 5.763 0.005 . 1 . . . A 19 U H1' . 19039 3
197 . 1 1 19 19 U H2' H 1 4.469 0.005 . 1 . . . A 19 U H2' . 19039 3
198 . 1 1 19 19 U H3' H 1 4.545 0.005 . 1 . . . A 19 U H3' . 19039 3
199 . 1 1 19 19 U H4' H 1 4.533 0.005 . 1 . . . A 19 U H4' . 19039 3
200 . 1 1 19 19 U H5 H 1 5.859 0.005 . 1 . . . A 19 U H5 . 19039 3
201 . 1 1 19 19 U H5' H 1 4.303 0.005 . 1 . . . A 19 U H5' . 19039 3
202 . 1 1 19 19 U H5'' H 1 4.252 0.005 . 1 . . . A 19 U H5'' . 19039 3
203 . 1 1 19 19 U H6 H 1 7.855 0.005 . 1 . . . A 19 U H6 . 19039 3
204 . 1 1 19 19 U C1' C 13 92.809 0.050 . 1 . . . A 19 U C1' . 19039 3
205 . 1 1 19 19 U C2' C 13 75.128 0.050 . 1 . . . A 19 U C2' . 19039 3
206 . 1 1 19 19 U C3' C 13 72.517 0.050 . 1 . . . A 19 U C3' . 19039 3
207 . 1 1 19 19 U C4' C 13 83.888 0.050 . 1 . . . A 19 U C4' . 19039 3
208 . 1 1 19 19 U C5 C 13 104.508 0.050 . 1 . . . A 19 U C5 . 19039 3
209 . 1 1 19 19 U C5' C 13 68.135 0.050 . 1 . . . A 19 U C5' . 19039 3
210 . 1 1 19 19 U C6 C 13 143.849 0.050 . 1 . . . A 19 U C6 . 19039 3
211 . 1 1 20 20 C H1' H 1 5.605 0.005 . 1 . . . A 20 C H1' . 19039 3
212 . 1 1 20 20 C H2' H 1 4.449 0.005 . 1 . . . A 20 C H2' . 19039 3
213 . 1 1 20 20 C H3' H 1 4.485 0.005 . 1 . . . A 20 C H3' . 19039 3
214 . 1 1 20 20 C H4' H 1 4.471 0.005 . 1 . . . A 20 C H4' . 19039 3
215 . 1 1 20 20 C H5 H 1 5.868 0.005 . 1 . . . A 20 C H5 . 19039 3
216 . 1 1 20 20 C H5' H 1 4.530 0.005 . 1 . . . A 20 C H5' . 19039 3
217 . 1 1 20 20 C H5'' H 1 4.215 0.005 . 1 . . . A 20 C H5'' . 19039 3
218 . 1 1 20 20 C H6 H 1 7.963 0.005 . 1 . . . A 20 C H6 . 19039 3
219 . 1 1 20 20 C C1' C 13 93.668 0.050 . 1 . . . A 20 C C1' . 19039 3
220 . 1 1 20 20 C C2' C 13 75.624 0.050 . 1 . . . A 20 C C2' . 19039 3
221 . 1 1 20 20 C C5 C 13 98.100 0.050 . 1 . . . A 20 C C5 . 19039 3
222 . 1 1 20 20 C C5' C 13 66.123 0.050 . 1 . . . A 20 C C5' . 19039 3
223 . 1 1 20 20 C C6 C 13 142.456 0.050 . 1 . . . A 20 C C6 . 19039 3
224 . 1 1 21 21 C H1' H 1 5.520 0.005 . 1 . . . A 21 C H1' . 19039 3
225 . 1 1 21 21 C H2' H 1 4.587 0.005 . 1 . . . A 21 C H2' . 19039 3
226 . 1 1 21 21 C H3' H 1 4.466 0.005 . 1 . . . A 21 C H3' . 19039 3
227 . 1 1 21 21 C H4' H 1 4.467 0.005 . 1 . . . A 21 C H4' . 19039 3
228 . 1 1 21 21 C H5 H 1 5.598 0.005 . 1 . . . A 21 C H5 . 19039 3
229 . 1 1 21 21 C H5' H 1 4.496 0.005 . 1 . . . A 21 C H5' . 19039 3
230 . 1 1 21 21 C H5'' H 1 4.158 0.005 . 1 . . . A 21 C H5'' . 19039 3
231 . 1 1 21 21 C H6 H 1 7.717 0.005 . 1 . . . A 21 C H6 . 19039 3
232 . 1 1 21 21 C C1' C 13 94.090 0.050 . 1 . . . A 21 C C1' . 19039 3
233 . 1 1 21 21 C C2' C 13 75.385 0.050 . 1 . . . A 21 C C2' . 19039 3
234 . 1 1 21 21 C C5 C 13 98.371 0.050 . 1 . . . A 21 C C5 . 19039 3
235 . 1 1 21 21 C C5' C 13 65.698 0.050 . 1 . . . A 21 C C5' . 19039 3
236 . 1 1 21 21 C C6 C 13 141.144 0.050 . 1 . . . A 21 C C6 . 19039 3
237 . 1 1 22 22 G H1' H 1 5.690 0.005 . 1 . . . A 22 G H1' . 19039 3
238 . 1 1 22 22 G H2' H 1 4.499 0.005 . 1 . . . A 22 G H2' . 19039 3
239 . 1 1 22 22 G H3' H 1 4.510 0.005 . 1 . . . A 22 G H3' . 19039 3
240 . 1 1 22 22 G H4' H 1 4.458 0.005 . 1 . . . A 22 G H4' . 19039 3
241 . 1 1 22 22 G H5' H 1 4.473 0.005 . 1 . . . A 22 G H5' . 19039 3
242 . 1 1 22 22 G H5'' H 1 4.103 0.005 . 1 . . . A 22 G H5'' . 19039 3
243 . 1 1 22 22 G H8 H 1 7.573 0.005 . 1 . . . A 22 G H8 . 19039 3
244 . 1 1 22 22 G C1' C 13 92.693 0.050 . 1 . . . A 22 G C1' . 19039 3
245 . 1 1 22 22 G C8 C 13 136.075 0.050 . 1 . . . A 22 G C8 . 19039 3
246 . 1 1 22 22 G N7 N 15 234.590 0.050 . 1 . . . A 22 G N7 . 19039 3
247 . 1 1 23 23 C H1' H 1 5.425 0.005 . 1 . . . A 23 C H1' . 19039 3
248 . 1 1 23 23 C H2' H 1 4.387 0.005 . 1 . . . A 23 C H2' . 19039 3
249 . 1 1 23 23 C H3' H 1 4.422 0.005 . 1 . . . A 23 C H3' . 19039 3
250 . 1 1 23 23 C H5 H 1 5.177 0.005 . 1 . . . A 23 C H5 . 19039 3
251 . 1 1 23 23 C H5'' H 1 4.062 0.005 . 1 . . . A 23 C H5'' . 19039 3
252 . 1 1 23 23 C H6 H 1 7.509 0.005 . 1 . . . A 23 C H6 . 19039 3
253 . 1 1 23 23 C C1' C 13 93.399 0.050 . 1 . . . A 23 C C1' . 19039 3
254 . 1 1 23 23 C C2' C 13 75.421 0.050 . 1 . . . A 23 C C2' . 19039 3
255 . 1 1 23 23 C C3' C 13 72.381 0.050 . 1 . . . A 23 C C3' . 19039 3
256 . 1 1 23 23 C C5 C 13 97.091 0.050 . 1 . . . A 23 C C5 . 19039 3
257 . 1 1 23 23 C C5' C 13 64.612 0.050 . 1 . . . A 23 C C5' . 19039 3
258 . 1 1 23 23 C C6 C 13 140.392 0.050 . 1 . . . A 23 C C6 . 19039 3
259 . 1 1 24 24 A H1' H 1 5.879 0.005 . 1 . . . A 24 A H1' . 19039 3
260 . 1 1 24 24 A H2 H 1 7.195 0.005 . 1 . . . A 24 A H2 . 19039 3
261 . 1 1 24 24 A H2' H 1 4.249 0.005 . 1 . . . A 24 A H2' . 19039 3
262 . 1 1 24 24 A H3' H 1 4.532 0.005 . 1 . . . A 24 A H3' . 19039 3
263 . 1 1 24 24 A H4' H 1 4.420 0.005 . 1 . . . A 24 A H4' . 19039 3
264 . 1 1 24 24 A H5'' H 1 4.074 0.005 . 1 . . . A 24 A H5'' . 19039 3
265 . 1 1 24 24 A H8 H 1 7.934 0.005 . 1 . . . A 24 A H8 . 19039 3
266 . 1 1 24 24 A C1' C 13 92.213 0.050 . 1 . . . A 24 A C1' . 19039 3
267 . 1 1 24 24 A C2 C 13 153.926 0.050 . 1 . . . A 24 A C2 . 19039 3
268 . 1 1 24 24 A C2' C 13 76.241 0.050 . 1 . . . A 24 A C2' . 19039 3
269 . 1 1 24 24 A C3' C 13 73.330 0.050 . 1 . . . A 24 A C3' . 19039 3
270 . 1 1 24 24 A C4' C 13 82.198 0.050 . 1 . . . A 24 A C4' . 19039 3
271 . 1 1 24 24 A C5' C 13 65.402 0.050 . 1 . . . A 24 A C5' . 19039 3
272 . 1 1 24 24 A C8 C 13 139.648 0.050 . 1 . . . A 24 A C8 . 19039 3
273 . 1 1 25 25 C H1' H 1 5.576 0.005 . 1 . . . A 25 C H1' . 19039 3
274 . 1 1 25 25 C H2' H 1 4.114 0.005 . 1 . . . A 25 C H2' . 19039 3
275 . 1 1 25 25 C H3' H 1 4.488 0.005 . 1 . . . A 25 C H3' . 19039 3
276 . 1 1 25 25 C H4' H 1 4.364 0.005 . 1 . . . A 25 C H4' . 19039 3
277 . 1 1 25 25 C H5 H 1 5.418 0.005 . 1 . . . A 25 C H5 . 19039 3
278 . 1 1 25 25 C H5' H 1 4.522 0.005 . 1 . . . A 25 C H5' . 19039 3
279 . 1 1 25 25 C H5'' H 1 4.072 0.005 . 1 . . . A 25 C H5'' . 19039 3
280 . 1 1 25 25 C H6 H 1 7.470 0.005 . 1 . . . A 25 C H6 . 19039 3
281 . 1 1 25 25 C C1' C 13 91.616 0.050 . 1 . . . A 25 C C1' . 19039 3
282 . 1 1 25 25 C C2' C 13 75.847 0.050 . 1 . . . A 25 C C2' . 19039 3
283 . 1 1 25 25 C C3' C 13 72.284 0.050 . 1 . . . A 25 C C3' . 19039 3
284 . 1 1 25 25 C C5 C 13 98.140 0.050 . 1 . . . A 25 C C5 . 19039 3
285 . 1 1 25 25 C C5' C 13 66.434 0.050 . 1 . . . A 25 C C5' . 19039 3
286 . 1 1 25 25 C C6 C 13 141.944 0.050 . 1 . . . A 25 C C6 . 19039 3
287 . 1 1 26 26 G H1' H 1 5.624 0.005 . 1 . . . A 26 G H1' . 19039 3
288 . 1 1 26 26 G H2' H 1 4.696 0.005 . 1 . . . A 26 G H2' . 19039 3
289 . 1 1 26 26 G H3' H 1 4.585 0.005 . 1 . . . A 26 G H3' . 19039 3
290 . 1 1 26 26 G H4' H 1 4.456 0.005 . 1 . . . A 26 G H4' . 19039 3
291 . 1 1 26 26 G H5' H 1 4.263 0.005 . 1 . . . A 26 G H5' . 19039 3
292 . 1 1 26 26 G H5'' H 1 4.145 0.005 . 1 . . . A 26 G H5'' . 19039 3
293 . 1 1 26 26 G H8 H 1 7.842 0.005 . 1 . . . A 26 G H8 . 19039 3
294 . 1 1 26 26 G C1' C 13 91.066 0.050 . 1 . . . A 26 G C1' . 19039 3
295 . 1 1 26 26 G C2' C 13 75.138 0.050 . 1 . . . A 26 G C2' . 19039 3
296 . 1 1 26 26 G C8 C 13 139.071 0.050 . 1 . . . A 26 G C8 . 19039 3
297 . 1 1 26 26 G N7 N 15 235.699 0.050 . 1 . . . A 26 G N7 . 19039 3
298 . 1 1 27 27 U H1' H 1 5.702 0.005 . 1 . . . A 27 U H1' . 19039 3
299 . 1 1 27 27 U H2' H 1 4.516 0.005 . 1 . . . A 27 U H2' . 19039 3
300 . 1 1 27 27 U H3' H 1 4.612 0.005 . 1 . . . A 27 U H3' . 19039 3
301 . 1 1 27 27 U H4' H 1 4.445 0.005 . 1 . . . A 27 U H4' . 19039 3
302 . 1 1 27 27 U H5 H 1 5.582 0.005 . 1 . . . A 27 U H5 . 19039 3
303 . 1 1 27 27 U H5'' H 1 4.202 0.005 . 1 . . . A 27 U H5'' . 19039 3
304 . 1 1 27 27 U H6 H 1 7.851 0.005 . 1 . . . A 27 U H6 . 19039 3
305 . 1 1 27 27 U C1' C 13 92.790 0.050 . 1 . . . A 27 U C1' . 19039 3
306 . 1 1 27 27 U C5 C 13 104.147 0.050 . 1 . . . A 27 U C5 . 19039 3
307 . 1 1 27 27 U C5' C 13 65.874 0.050 . 1 . . . A 27 U C5' . 19039 3
308 . 1 1 27 27 U C6 C 13 142.304 0.050 . 1 . . . A 27 U C6 . 19039 3
309 . 1 1 28 28 A H1' H 1 6.009 0.005 . 1 . . . A 28 A H1' . 19039 3
310 . 1 1 28 28 A H2 H 1 7.271 0.005 . 1 . . . A 28 A H2 . 19039 3
311 . 1 1 28 28 A H2' H 1 4.580 0.005 . 1 . . . A 28 A H2' . 19039 3
312 . 1 1 28 28 A H3' H 1 4.707 0.005 . 1 . . . A 28 A H3' . 19039 3
313 . 1 1 28 28 A H4' H 1 4.535 0.005 . 1 . . . A 28 A H4' . 19039 3
314 . 1 1 28 28 A H5' H 1 4.552 0.005 . 1 . . . A 28 A H5' . 19039 3
315 . 1 1 28 28 A H5'' H 1 4.219 0.005 . 1 . . . A 28 A H5'' . 19039 3
316 . 1 1 28 28 A H8 H 1 8.267 0.005 . 1 . . . A 28 A H8 . 19039 3
317 . 1 1 28 28 A C1' C 13 92.724 0.050 . 1 . . . A 28 A C1' . 19039 3
318 . 1 1 28 28 A C2 C 13 153.461 0.050 . 1 . . . A 28 A C2 . 19039 3
319 . 1 1 28 28 A C2' C 13 75.501 0.050 . 1 . . . A 28 A C2' . 19039 3
320 . 1 1 28 28 A C3' C 13 73.286 0.050 . 1 . . . A 28 A C3' . 19039 3
321 . 1 1 28 28 A C4' C 13 82.246 0.050 . 1 . . . A 28 A C4' . 19039 3
322 . 1 1 28 28 A C5' C 13 65.221 0.050 . 1 . . . A 28 A C5' . 19039 3
323 . 1 1 28 28 A C8 C 13 140.173 0.050 . 1 . . . A 28 A C8 . 19039 3
324 . 1 1 28 28 A N7 N 15 229.165 0.050 . 1 . . . A 28 A N7 . 19039 3
325 . 1 1 29 29 C H1' H 1 5.436 0.005 . 1 . . . A 29 C H1' . 19039 3
326 . 1 1 29 29 C H2' H 1 4.433 0.005 . 1 . . . A 29 C H2' . 19039 3
327 . 1 1 29 29 C H3' H 1 4.415 0.005 . 1 . . . A 29 C H3' . 19039 3
328 . 1 1 29 29 C H4' H 1 4.428 0.005 . 1 . . . A 29 C H4' . 19039 3
329 . 1 1 29 29 C H5 H 1 5.178 0.005 . 1 . . . A 29 C H5 . 19039 3
330 . 1 1 29 29 C H5' H 1 4.499 0.005 . 1 . . . A 29 C H5' . 19039 3
331 . 1 1 29 29 C H5'' H 1 4.099 0.005 . 1 . . . A 29 C H5'' . 19039 3
332 . 1 1 29 29 C H6 H 1 7.474 0.005 . 1 . . . A 29 C H6 . 19039 3
333 . 1 1 29 29 C C1' C 13 93.641 0.050 . 1 . . . A 29 C C1' . 19039 3
334 . 1 1 29 29 C C2' C 13 75.601 0.050 . 1 . . . A 29 C C2' . 19039 3
335 . 1 1 29 29 C C3' C 13 72.262 0.050 . 1 . . . A 29 C C3' . 19039 3
336 . 1 1 29 29 C C5 C 13 97.232 0.050 . 1 . . . A 29 C C5 . 19039 3
337 . 1 1 29 29 C C5' C 13 64.496 0.050 . 1 . . . A 29 C C5' . 19039 3
338 . 1 1 29 29 C C6 C 13 140.392 0.050 . 1 . . . A 29 C C6 . 19039 3
339 . 1 1 30 30 G H1' H 1 5.691 0.005 . 1 . . . A 30 G H1' . 19039 3
340 . 1 1 30 30 G H2' H 1 4.611 0.005 . 1 . . . A 30 G H2' . 19039 3
341 . 1 1 30 30 G H3' H 1 4.494 0.005 . 1 . . . A 30 G H3' . 19039 3
342 . 1 1 30 30 G H4' H 1 4.475 0.005 . 1 . . . A 30 G H4' . 19039 3
343 . 1 1 30 30 G H5' H 1 4.475 0.005 . 1 . . . A 30 G H5' . 19039 3
344 . 1 1 30 30 G H5'' H 1 4.101 0.005 . 1 . . . A 30 G H5'' . 19039 3
345 . 1 1 30 30 G H8 H 1 7.449 0.005 . 1 . . . A 30 G H8 . 19039 3
346 . 1 1 30 30 G C1' C 13 92.873 0.050 . 1 . . . A 30 G C1' . 19039 3
347 . 1 1 30 30 G C8 C 13 136.069 0.050 . 1 . . . A 30 G C8 . 19039 3
348 . 1 1 30 30 G N7 N 15 234.916 0.050 . 1 . . . A 30 G N7 . 19039 3
349 . 1 1 31 31 G H1' H 1 5.688 0.005 . 1 . . . A 31 G H1' . 19039 3
350 . 1 1 31 31 G H3' H 1 4.603 0.005 . 1 . . . A 31 G H3' . 19039 3
351 . 1 1 31 31 G H4' H 1 4.440 0.005 . 1 . . . A 31 G H4' . 19039 3
352 . 1 1 31 31 G H5' H 1 4.511 0.005 . 1 . . . A 31 G H5' . 19039 3
353 . 1 1 31 31 G H5'' H 1 4.100 0.005 . 1 . . . A 31 G H5'' . 19039 3
354 . 1 1 31 31 G H8 H 1 7.261 0.005 . 1 . . . A 31 G H8 . 19039 3
355 . 1 1 31 31 G C1' C 13 92.799 0.050 . 1 . . . A 31 G C1' . 19039 3
356 . 1 1 31 31 G C4' C 13 82.555 0.050 . 1 . . . A 31 G C4' . 19039 3
357 . 1 1 31 31 G C8 C 13 136.498 0.050 . 1 . . . A 31 G C8 . 19039 3
358 . 1 1 31 31 G N7 N 15 233.898 0.050 . 1 . . . A 31 G N7 . 19039 3
359 . 1 1 32 32 A H1' H 1 6.057 0.005 . 1 . . . A 32 A H1' . 19039 3
360 . 1 1 32 32 A H8 H 1 7.978 0.005 . 1 . . . A 32 A H8 . 19039 3
361 . 1 1 32 32 A C2 C 13 154.612 0.050 . 1 . . . A 32 A C2 . 19039 3
362 . 1 1 33 33 U C1' C 13 94.106 0.050 . 1 . . . A 33 U C1' . 19039 3
363 . 1 1 33 33 U C5 C 13 104.186 0.050 . 1 . . . A 33 U C5 . 19039 3
364 . 1 1 34 34 C H1' H 1 5.661 0.005 . 1 . . . A 34 C H1' . 19039 3
365 . 1 1 34 34 C H2' H 1 4.339 0.005 . 1 . . . A 34 C H2' . 19039 3
366 . 1 1 34 34 C H3' H 1 4.352 0.005 . 1 . . . A 34 C H3' . 19039 3
367 . 1 1 34 34 C H5 H 1 5.578 0.005 . 1 . . . A 34 C H5 . 19039 3
368 . 1 1 34 34 C H5'' H 1 4.011 0.005 . 1 . . . A 34 C H5'' . 19039 3
369 . 1 1 34 34 C H6 H 1 7.808 0.005 . 1 . . . A 34 C H6 . 19039 3
370 . 1 1 34 34 C C1' C 13 93.084 0.050 . 1 . . . A 34 C C1' . 19039 3
371 . 1 1 34 34 C C2' C 13 75.322 0.050 . 1 . . . A 34 C C2' . 19039 3
372 . 1 1 34 34 C C5 C 13 97.421 0.050 . 1 . . . A 34 C C5 . 19039 3
373 . 1 1 34 34 C C5' C 13 64.534 0.050 . 1 . . . A 34 C C5' . 19039 3
374 . 1 1 34 34 C C6 C 13 141.613 0.050 . 1 . . . A 34 C C6 . 19039 3
375 . 1 1 35 35 U H1' H 1 5.725 0.005 . 1 . . . A 35 U H1' . 19039 3
376 . 1 1 35 35 U H2' H 1 4.004 0.005 . 1 . . . A 35 U H2' . 19039 3
377 . 1 1 35 35 U H3' H 1 4.170 0.005 . 1 . . . A 35 U H3' . 19039 3
378 . 1 1 35 35 U H4' H 1 4.163 0.005 . 1 . . . A 35 U H4' . 19039 3
379 . 1 1 35 35 U H5 H 1 5.625 0.005 . 1 . . . A 35 U H5 . 19039 3
380 . 1 1 35 35 U H5' H 1 4.527 0.005 . 1 . . . A 35 U H5' . 19039 3
381 . 1 1 35 35 U H6 H 1 7.774 0.005 . 1 . . . A 35 U H6 . 19039 3
382 . 1 1 35 35 U C5 C 13 104.633 0.050 . 1 . . . A 35 U C5 . 19039 3
383 . 1 1 35 35 U C6 C 13 142.147 0.050 . 1 . . . A 35 U C6 . 19039 3
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