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 52280
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 20a-Frag3
_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 HMQC' . . . 52280 1
2 '2D 1H-1H TOCSY' . . . 52280 1
3 '2D 1H-1H NOESY' . . . 52280 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
1 $software_1 . . 52280 1
2 $software_2 . . 52280 1
3 $software_3 . . 52280 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 H3' H 1 4.8331 0.0000 . 1 . . . . . 1214 G H3' . 52280 1
2 . 1 . 1 1 1 G H2' H 1 5.0542 0.0000 . 1 . . . . . 1214 G H2' . 52280 1
3 . 1 . 1 1 1 G H1' H 1 5.9283 0.0000 . 1 . . . . . 1214 G H1' . 52280 1
4 . 1 . 1 1 1 G C8 C 13 139.3493 0.0000 . 1 . . . . . 1214 G C8 . 52280 1
5 . 1 . 1 1 1 G H8 H 1 8.2553 0.0000 . 1 . . . . . 1214 G H8 . 52280 1
6 . 1 . 1 2 2 G H3' H 1 4.5655 0.0000 . 1 . . . . . 1215 G H3' . 52280 1
7 . 1 . 1 2 2 G H2' H 1 4.5655 0.0000 . 1 . . . . . 1215 G H2' . 52280 1
8 . 1 . 1 2 2 G H1' H 1 6.0040 0.0000 . 1 . . . . . 1215 G H1' . 52280 1
9 . 1 . 1 2 2 G C8 C 13 137.4036 0.0000 . 1 . . . . . 1215 G C8 . 52280 1
10 . 1 . 1 2 2 G H8 H 1 7.6428 0.0000 . 1 . . . . . 1215 G H8 . 52280 1
11 . 1 . 1 3 3 U H3' H 1 4.7073 0.0000 . 1 . . . . . 499 U H3' . 52280 1
12 . 1 . 1 3 3 U H2' H 1 4.6416 0.0000 . 1 . . . . . 499 U H2' . 52280 1
13 . 1 . 1 3 3 U H1' H 1 5.6506 0.0000 . 1 . . . . . 499 U H1' . 52280 1
14 . 1 . 1 3 3 U H5 H 1 5.2691 0.0000 . 1 . . . . . 499 U H5 . 52280 1
15 . 1 . 1 3 3 U C6 C 13 141.2716 0.0000 . 1 . . . . . 499 U C6 . 52280 1
16 . 1 . 1 3 3 U H6 H 1 7.8622 0.0000 . 1 . . . . . 499 U H6 . 52280 1
17 . 1 . 1 4 4 A H3' H 1 4.6044 0.0000 . 1 . . . . . 500 A H3' . 52280 1
18 . 1 . 1 4 4 A H2' H 1 4.5671 0.0000 . 1 . . . . . 500 A H2' . 52280 1
19 . 1 . 1 4 4 A H1' H 1 6.1859 0.0000 . 1 . . . . . 500 A H1' . 52280 1
20 . 1 . 1 4 4 A C8 C 13 139.2974 0.0000 . 1 . . . . . 500 A C8 . 52280 1
21 . 1 . 1 4 4 A H8 H 1 8.2054 0.0000 . 1 . . . . . 500 A H8 . 52280 1
22 . 1 . 1 4 4 A C2 C 13 152.5671 0.0000 . 1 . . . . . 500 A C2 . 52280 1
23 . 1 . 1 4 4 A H2 H 1 6.7933 0.0000 . 1 . . . . . 500 A H2 . 52280 1
24 . 1 . 1 5 5 G H3' H 1 4.1755 0.0000 . 1 . . . . . 501 G H3' . 52280 1
25 . 1 . 1 5 5 G H2' H 1 4.4057 0.0000 . 1 . . . . . 501 G H2' . 52280 1
26 . 1 . 1 5 5 G H1' H 1 5.5939 0.0000 . 1 . . . . . 501 G H1' . 52280 1
27 . 1 . 1 5 5 G C8 C 13 136.1687 0.0000 . 1 . . . . . 501 G C8 . 52280 1
28 . 1 . 1 5 5 G H8 H 1 7.0313 0.0000 . 1 . . . . . 501 G H8 . 52280 1
29 . 1 . 1 6 6 U H3' H 1 4.5050 0.0000 . 1 . . . . . 502 U H3' . 52280 1
30 . 1 . 1 6 6 U H2' H 1 4.6009 0.0000 . 1 . . . . . 502 U H2' . 52280 1
31 . 1 . 1 6 6 U H1' H 1 5.5514 0.0000 . 1 . . . . . 502 U H1' . 52280 1
32 . 1 . 1 6 6 U H5 H 1 5.1802 0.0000 . 1 . . . . . 502 U H5 . 52280 1
33 . 1 . 1 6 6 U C6 C 13 140.4794 0.0000 . 1 . . . . . 502 U C6 . 52280 1
34 . 1 . 1 6 6 U H6 H 1 7.6672 0.0000 . 1 . . . . . 502 U H6 . 52280 1
35 . 1 . 1 7 7 G H3' H 1 4.6595 0.0000 . 1 . . . . . 503 G H3' . 52280 1
36 . 1 . 1 7 7 G H2' H 1 4.6044 0.0000 . 1 . . . . . 503 G H2' . 52280 1
37 . 1 . 1 7 7 G H1' H 1 5.8484 0.0000 . 1 . . . . . 503 G H1' . 52280 1
38 . 1 . 1 7 7 G C8 C 13 135.8053 0.0000 . 1 . . . . . 503 G C8 . 52280 1
39 . 1 . 1 7 7 G H8 H 1 7.7406 0.0000 . 1 . . . . . 503 G H8 . 52280 1
40 . 1 . 1 8 8 C H3' H 1 4.5081 0.0000 . 1 . . . . . 504 C H3' . 52280 1
41 . 1 . 1 8 8 C H2' H 1 4.5915 0.0000 . 1 . . . . . 504 C H2' . 52280 1
42 . 1 . 1 8 8 C H1' H 1 5.5489 0.0000 . 1 . . . . . 504 C H1' . 52280 1
43 . 1 . 1 8 8 C H5 H 1 5.3041 0.0000 . 1 . . . . . 504 C H5 . 52280 1
44 . 1 . 1 8 8 C C6 C 13 140.4682 0.0000 . 1 . . . . . 504 C C6 . 52280 1
45 . 1 . 1 8 8 C H6 H 1 7.6789 0.0000 . 1 . . . . . 504 C H6 . 52280 1
46 . 1 . 1 9 9 A H3' H 1 4.7626 0.0000 . 1 . . . . . 505 A H3' . 52280 1
47 . 1 . 1 9 9 A H2' H 1 4.6071 0.0000 . 1 . . . . . 505 A H2' . 52280 1
48 . 1 . 1 9 9 A H1' H 1 5.9802 0.0000 . 1 . . . . . 505 A H1' . 52280 1
49 . 1 . 1 9 9 A C8 C 13 139.7275 0.0000 . 1 . . . . . 505 A C8 . 52280 1
50 . 1 . 1 9 9 A H8 H 1 8.0428 0.0000 . 1 . . . . . 505 A H8 . 52280 1
51 . 1 . 1 9 9 A C2 C 13 152.9726 0.0000 . 1 . . . . . 505 A C2 . 52280 1
52 . 1 . 1 9 9 A H2 H 1 7.1298 0.0000 . 1 . . . . . 505 A H2 . 52280 1
53 . 1 . 1 10 10 G H3' H 1 4.4118 0.0000 . 1 . . . . . 506 G H3' . 52280 1
54 . 1 . 1 10 10 G H2' H 1 4.4118 0.0000 . 1 . . . . . 506 G H2' . 52280 1
55 . 1 . 1 10 10 G H1' H 1 5.7986 0.0000 . 1 . . . . . 506 G H1' . 52280 1
56 . 1 . 1 10 10 G C8 C 13 137.7096 0.0000 . 1 . . . . . 506 G C8 . 52280 1
57 . 1 . 1 10 10 G H8 H 1 7.6540 0.0000 . 1 . . . . . 506 G H8 . 52280 1
58 . 1 . 1 11 11 G H3' H 1 4.4626 0.0000 . 1 . . . . . 507 G H3' . 52280 1
59 . 1 . 1 11 11 G H2' H 1 4.5469 0.0000 . 1 . . . . . 507 G H2' . 52280 1
60 . 1 . 1 11 11 G H1' H 1 5.9453 0.0000 . 1 . . . . . 507 G H1' . 52280 1
61 . 1 . 1 11 11 G C8 C 13 138.5116 0.0000 . 1 . . . . . 507 G C8 . 52280 1
62 . 1 . 1 11 11 G H8 H 1 7.8753 0.0000 . 1 . . . . . 507 G H8 . 52280 1
63 . 1 . 1 12 12 U H3' H 1 4.7623 0.0000 . 1 . . . . . 508 U H3' . 52280 1
64 . 1 . 1 12 12 U H2' H 1 4.6352 0.0000 . 1 . . . . . 508 U H2' . 52280 1
65 . 1 . 1 12 12 U H1' H 1 5.7816 0.0000 . 1 . . . . . 508 U H1' . 52280 1
66 . 1 . 1 12 12 U H5 H 1 5.4461 0.0000 . 1 . . . . . 508 U H5 . 52280 1
67 . 1 . 1 12 12 U C6 C 13 142.7046 0.0000 . 1 . . . . . 508 U C6 . 52280 1
68 . 1 . 1 12 12 U H6 H 1 7.9164 0.0000 . 1 . . . . . 508 U H6 . 52280 1
69 . 1 . 1 13 13 A H3' H 1 4.8168 0.0000 . 1 . . . . . 509 A H3' . 52280 1
70 . 1 . 1 13 13 A H2' H 1 4.6851 0.0000 . 1 . . . . . 509 A H2' . 52280 1
71 . 1 . 1 13 13 A H1' H 1 6.1072 0.0000 . 1 . . . . . 509 A H1' . 52280 1
72 . 1 . 1 13 13 A C8 C 13 140.0658 0.0000 . 1 . . . . . 509 A C8 . 52280 1
73 . 1 . 1 13 13 A H8 H 1 8.2257 0.0000 . 1 . . . . . 509 A H8 . 52280 1
74 . 1 . 1 13 13 A C2 C 13 152.7048 0.0000 . 1 . . . . . 509 A C2 . 52280 1
75 . 1 . 1 13 13 A H2 H 1 6.9479 0.0000 . 1 . . . . . 509 A H2 . 52280 1
76 . 1 . 1 14 14 G H3' H 1 4.5981 0.0000 . 1 . . . . . 510 G H3' . 52280 1
77 . 1 . 1 14 14 G H2' H 1 4.5068 0.0000 . 1 . . . . . 510 G H2' . 52280 1
78 . 1 . 1 14 14 G H1' H 1 5.7563 0.0000 . 1 . . . . . 510 G H1' . 52280 1
79 . 1 . 1 14 14 G C8 C 13 135.3764 0.0000 . 1 . . . . . 510 G C8 . 52280 1
80 . 1 . 1 14 14 G H8 H 1 7.2686 0.0000 . 1 . . . . . 510 G H8 . 52280 1
81 . 1 . 1 15 15 G H3' H 1 4.6243 0.0000 . 1 . . . . . 1216 G H3' . 52280 1
82 . 1 . 1 15 15 G H2' H 1 4.3776 0.0000 . 1 . . . . . 1216 G H2' . 52280 1
83 . 1 . 1 15 15 G H1' H 1 5.7283 0.0000 . 1 . . . . . 1216 G H1' . 52280 1
84 . 1 . 1 15 15 G C8 C 13 135.8134 0.0000 . 1 . . . . . 1216 G C8 . 52280 1
85 . 1 . 1 15 15 G H8 H 1 7.1997 0.0000 . 1 . . . . . 1216 G H8 . 52280 1
86 . 1 . 1 16 16 A H3' H 1 4.4868 0.0000 . 1 . . . . . 1217 A H3' . 52280 1
87 . 1 . 1 16 16 A H2' H 1 4.7303 0.0000 . 1 . . . . . 1217 A H2' . 52280 1
88 . 1 . 1 16 16 A H1' H 1 5.8008 0.0000 . 1 . . . . . 1217 A H1' . 52280 1
89 . 1 . 1 16 16 A C8 C 13 141.6735 0.0000 . 1 . . . . . 1217 A C8 . 52280 1
90 . 1 . 1 16 16 A H8 H 1 8.2891 0.0000 . 1 . . . . . 1217 A H8 . 52280 1
91 . 1 . 1 16 16 A C2 C 13 154.7500 0.0000 . 1 . . . . . 1217 A C2 . 52280 1
92 . 1 . 1 16 16 A H2 H 1 8.0079 0.0000 . 1 . . . . . 1217 A H2 . 52280 1
93 . 1 . 1 17 17 G H3' H 1 4.6372 0.0000 . 1 . . . . . 1218 G H3' . 52280 1
94 . 1 . 1 17 17 G H2' H 1 4.3553 0.0000 . 1 . . . . . 1218 G H2' . 52280 1
95 . 1 . 1 17 17 G H1' H 1 5.2685 0.0000 . 1 . . . . . 1218 G H1' . 52280 1
96 . 1 . 1 17 17 G C8 C 13 137.2728 0.0000 . 1 . . . . . 1218 G C8 . 52280 1
97 . 1 . 1 17 17 G H8 H 1 7.6524 0.0000 . 1 . . . . . 1218 G H8 . 52280 1
98 . 1 . 1 18 18 A H3' H 1 4.9927 0.0000 . 1 . . . . . 1219 A H3' . 52280 1
99 . 1 . 1 18 18 A H2' H 1 4.5873 0.0000 . 1 . . . . . 1219 A H2' . 52280 1
100 . 1 . 1 18 18 A H1' H 1 6.1859 0.0000 . 1 . . . . . 1219 A H1' . 52280 1
101 . 1 . 1 18 18 A C8 C 13 140.3104 0.0000 . 1 . . . . . 1219 A C8 . 52280 1
102 . 1 . 1 18 18 A H8 H 1 8.2319 0.0000 . 1 . . . . . 1219 A H8 . 52280 1
103 . 1 . 1 18 18 A C2 C 13 155.7526 0.0000 . 1 . . . . . 1219 A C2 . 52280 1
104 . 1 . 1 18 18 A H2 H 1 8.3104 0.0000 . 1 . . . . . 1219 A H2 . 52280 1
105 . 1 . 1 19 19 C H3' H 1 4.2633 0.0000 . 1 . . . . . 522 C H3' . 52280 1
106 . 1 . 1 19 19 C H2' H 1 4.3928 0.0000 . 1 . . . . . 522 C H2' . 52280 1
107 . 1 . 1 19 19 C H1' H 1 4.3927 0.0000 . 1 . . . . . 522 C H1' . 52280 1
108 . 1 . 1 19 19 C H5 H 1 6.0929 0.0000 . 1 . . . . . 522 C H5 . 52280 1
109 . 1 . 1 19 19 C C6 C 13 142.0056 0.0000 . 1 . . . . . 522 C C6 . 52280 1
110 . 1 . 1 19 19 C H6 H 1 7.9556 0.0000 . 1 . . . . . 522 C H6 . 52280 1
111 . 1 . 1 20 20 U H3' H 1 4.6711 0.0000 . 1 . . . . . 523 U H3' . 52280 1
112 . 1 . 1 20 20 U H2' H 1 4.4865 0.0000 . 1 . . . . . 523 U H2' . 52280 1
113 . 1 . 1 20 20 U H1' H 1 5.6068 0.0000 . 1 . . . . . 523 U H1' . 52280 1
114 . 1 . 1 20 20 U H5 H 1 5.5721 0.0000 . 1 . . . . . 523 U H5 . 52280 1
115 . 1 . 1 20 20 U C6 C 13 142.0056 0.0000 . 1 . . . . . 523 U C6 . 52280 1
116 . 1 . 1 20 20 U H6 H 1 7.9456 0.0000 . 1 . . . . . 523 U H6 . 52280 1
117 . 1 . 1 21 21 A H3' H 1 4.6106 0.0000 . 1 . . . . . 524 A H3' . 52280 1
118 . 1 . 1 21 21 A H2' H 1 4.4485 0.0000 . 1 . . . . . 524 A H2' . 52280 1
119 . 1 . 1 21 21 A H1' H 1 5.9987 0.0000 . 1 . . . . . 524 A H1' . 52280 1
120 . 1 . 1 21 21 A C8 C 13 139.2794 0.0000 . 1 . . . . . 524 A C8 . 52280 1
121 . 1 . 1 21 21 A H8 H 1 8.1852 0.0000 . 1 . . . . . 524 A H8 . 52280 1
122 . 1 . 1 21 21 A C2 C 13 153.0262 0.0000 . 1 . . . . . 524 A C2 . 52280 1
123 . 1 . 1 21 21 A H2 H 1 7.0708 0.0000 . 1 . . . . . 524 A H2 . 52280 1
124 . 1 . 1 22 22 C H3' H 1 4.4512 0.0000 . 1 . . . . . 525 C H3' . 52280 1
125 . 1 . 1 22 22 C H2' H 1 4.3078 0.0000 . 1 . . . . . 525 C H2' . 52280 1
126 . 1 . 1 22 22 C H1' H 1 5.2396 0.0000 . 1 . . . . . 525 C H1' . 52280 1
127 . 1 . 1 22 22 C H5 H 1 5.3427 0.0000 . 1 . . . . . 525 C H5 . 52280 1
128 . 1 . 1 22 22 C C6 C 13 140.1066 0.0000 . 1 . . . . . 525 C C6 . 52280 1
129 . 1 . 1 22 22 C H6 H 1 7.3904 0.0000 . 1 . . . . . 525 C H6 . 52280 1
130 . 1 . 1 23 23 U H3' H 1 4.5729 0.0000 . 1 . . . . . 526 U H3' . 52280 1
131 . 1 . 1 23 23 U H2' H 1 4.6680 0.0000 . 1 . . . . . 526 U H2' . 52280 1
132 . 1 . 1 23 23 U H1' H 1 5.6025 0.0000 . 1 . . . . . 526 U H1' . 52280 1
133 . 1 . 1 23 23 U H5 H 1 5.5180 0.0000 . 1 . . . . . 526 U H5 . 52280 1
134 . 1 . 1 23 23 U C6 C 13 141.5163 0.0000 . 1 . . . . . 526 U C6 . 52280 1
135 . 1 . 1 23 23 U H6 H 1 7.9340 0.0000 . 1 . . . . . 526 U H6 . 52280 1
136 . 1 . 1 24 24 G H3' H 1 4.6537 0.0000 . 1 . . . . . 527 G H3' . 52280 1
137 . 1 . 1 24 24 G H2' H 1 4.5380 0.0000 . 1 . . . . . 527 G H2' . 52280 1
138 . 1 . 1 24 24 G H1' H 1 5.8036 0.0000 . 1 . . . . . 527 G H1' . 52280 1
139 . 1 . 1 24 24 G C8 C 13 136.1687 0.0000 . 1 . . . . . 527 G C8 . 52280 1
140 . 1 . 1 24 24 G H8 H 1 7.8061 0.0000 . 1 . . . . . 527 G H8 . 52280 1
141 . 1 . 1 25 25 C H3' H 1 4.5913 0.0000 . 1 . . . . . 528 C H3' . 52280 1
142 . 1 . 1 25 25 C H2' H 1 4.6518 0.0000 . 1 . . . . . 528 C H2' . 52280 1
143 . 1 . 1 25 25 C H1' H 1 5.5174 0.0000 . 1 . . . . . 528 C H1' . 52280 1
144 . 1 . 1 25 25 C H5 H 1 5.3128 0.0000 . 1 . . . . . 528 C H5 . 52280 1
145 . 1 . 1 25 25 C C6 C 13 140.5551 0.0000 . 1 . . . . . 528 C C6 . 52280 1
146 . 1 . 1 25 25 C H6 H 1 7.7454 0.0000 . 1 . . . . . 528 C H6 . 52280 1
147 . 1 . 1 26 26 A H3' H 1 4.5847 0.0000 . 1 . . . . . 529 A H3' . 52280 1
148 . 1 . 1 26 26 A H2' H 1 4.6530 0.0000 . 1 . . . . . 529 A H2' . 52280 1
149 . 1 . 1 26 26 A H1' H 1 6.0043 0.0000 . 1 . . . . . 529 A H1' . 52280 1
150 . 1 . 1 26 26 A C8 C 13 139.2794 0.0000 . 1 . . . . . 529 A C8 . 52280 1
151 . 1 . 1 26 26 A H8 H 1 7.9674 0.0000 . 1 . . . . . 529 A H8 . 52280 1
152 . 1 . 1 26 26 A C2 C 13 153.3347 0.0000 . 1 . . . . . 529 A C2 . 52280 1
153 . 1 . 1 26 26 A H2 H 1 7.4406 0.0000 . 1 . . . . . 529 A H2 . 52280 1
154 . 1 . 1 27 27 U H3' H 1 4.4926 0.0000 . 1 . . . . . 530 U H3' . 52280 1
155 . 1 . 1 27 27 U H2' H 1 4.1116 0.0000 . 1 . . . . . 530 U H2' . 52280 1
156 . 1 . 1 27 27 U H1' H 1 5.3704 0.0000 . 1 . . . . . 530 U H1' . 52280 1
157 . 1 . 1 27 27 U H5 H 1 5.4523 0.0000 . 1 . . . . . 530 U H5 . 52280 1
158 . 1 . 1 27 27 U C6 C 13 140.4794 0.0000 . 1 . . . . . 530 U C6 . 52280 1
159 . 1 . 1 27 27 U H6 H 1 7.6627 0.0000 . 1 . . . . . 530 U H6 . 52280 1
160 . 1 . 1 28 28 U H3' H 1 4.5913 0.0000 . 1 . . . . . 531 U H3' . 52280 1
161 . 1 . 1 28 28 U H2' H 1 4.4977 0.0000 . 1 . . . . . 531 U H2' . 52280 1
162 . 1 . 1 28 28 U H1' H 1 5.6227 0.0000 . 1 . . . . . 531 U H1' . 52280 1
163 . 1 . 1 28 28 U H5 H 1 5.6535 0.0000 . 1 . . . . . 531 U H5 . 52280 1
164 . 1 . 1 28 28 U C6 C 13 143.0192 0.0000 . 1 . . . . . 531 U C6 . 52280 1
165 . 1 . 1 28 28 U H6 H 1 8.1102 0.0000 . 1 . . . . . 531 U H6 . 52280 1
166 . 1 . 1 29 29 A H3' H 1 4.7730 0.0000 . 1 . . . . . 532 A H3' . 52280 1
167 . 1 . 1 29 29 A H2' H 1 4.5816 0.0000 . 1 . . . . . 532 A H2' . 52280 1
168 . 1 . 1 29 29 A H1' H 1 6.0828 0.0000 . 1 . . . . . 532 A H1' . 52280 1
169 . 1 . 1 29 29 A C8 C 13 139.6813 0.0000 . 1 . . . . . 532 A C8 . 52280 1
170 . 1 . 1 29 29 A H8 H 1 8.2989 0.0000 . 1 . . . . . 532 A H8 . 52280 1
171 . 1 . 1 29 29 A C2 C 13 153.6690 0.0000 . 1 . . . . . 532 A C2 . 52280 1
172 . 1 . 1 29 29 A H2 H 1 7.2366 0.0000 . 1 . . . . . 532 A H2 . 52280 1
173 . 1 . 1 30 30 C H3' H 1 4.4487 0.0000 . 1 . . . . . 1220 C H3' . 52280 1
174 . 1 . 1 30 30 C H2' H 1 4.1534 0.0000 . 1 . . . . . 1220 C H2' . 52280 1
175 . 1 . 1 30 30 C H1' H 1 5.4706 0.0000 . 1 . . . . . 1220 C H1' . 52280 1
176 . 1 . 1 30 30 C H5 H 1 5.2915 0.0000 . 1 . . . . . 1220 C H5 . 52280 1
177 . 1 . 1 30 30 C C6 C 13 140.8522 0.0000 . 1 . . . . . 1220 C C6 . 52280 1
178 . 1 . 1 30 30 C H6 H 1 7.6377 0.0000 . 1 . . . . . 1220 C H6 . 52280 1
179 . 1 . 1 31 31 C H3' H 1 4.2389 0.0000 . 1 . . . . . 1221 C H3' . 52280 1
180 . 1 . 1 31 31 C H2' H 1 4.0755 0.0000 . 1 . . . . . 1221 C H2' . 52280 1
181 . 1 . 1 31 31 C H1' H 1 5.8291 0.0000 . 1 . . . . . 1221 C H1' . 52280 1
182 . 1 . 1 31 31 C H5 H 1 5.5026 0.0000 . 1 . . . . . 1221 C H5 . 52280 1
183 . 1 . 1 31 31 C C6 C 13 141.6736 0.0000 . 1 . . . . . 1221 C C6 . 52280 1
184 . 1 . 1 31 31 C H6 H 1 7.7089 0.0000 . 1 . . . . . 1221 C H6 . 52280 1
stop_
save_