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 30224
_Assigned_chem_shift_list.ID 1
_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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.08
_Assigned_chem_shift_list.Chem_shift_15N_err 0.06
_Assigned_chem_shift_list.Chem_shift_31P_err 0.03
_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' . . . 30224 1
2 '3D 1H-13C NOESY' . . . 30224 1
3 '2D 1H-13C HSQC' . . . 30224 1
4 '3D HCCH-TOCSY' . . . 30224 1
5 '2D 1H-15N HSQC' . . . 30224 1
6 '2D 1H-31P HetCor' . . . 30224 1
7 '2D 1H-13C CTEP' . . . 30224 1
8 '2D 1H-13C HSQC' . . . 30224 1
9 '2D 1H-13C HSQC' . . . 30224 1
10 '3D 1H-15N NOESY' . . . 30224 1
11 '2D 1H-13C H(N)CO' . . . 30224 1
12 '2D 1H-15N HSQC' . . . 30224 1
13 '2D 1H-13C H(CN)CO' . . . 30224 1
14 '2D 1H-13C C(C)H-COSY' . . . 30224 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.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 H1 H 1 12.63 0.015 . . . . . . A 1 G H1 . 30224 1
2 . 1 1 1 1 G H1' H 1 5.77 0.015 . . . . . . A 1 G H1' . 30224 1
3 . 1 1 1 1 G H2' H 1 4.85 0.015 . . . . . . A 1 G H2' . 30224 1
4 . 1 1 1 1 G H3' H 1 4.68 0.015 . . . . . . A 1 G H3' . 30224 1
5 . 1 1 1 1 G H4' H 1 4.50 0.015 . . . . . . A 1 G H4' . 30224 1
6 . 1 1 1 1 G H8 H 1 8.16 0.015 . . . . . . A 1 G H8 . 30224 1
7 . 1 1 1 1 G C8 C 13 138.91 0.04 . . . . . . A 1 G C8 . 30224 1
8 . 1 1 1 1 G N1 N 15 146.11 0.03 . . . . . . A 1 G N1 . 30224 1
9 . 1 1 1 1 G N9 N 15 166.32 0.03 . . . . . . A 1 G N9 . 30224 1
10 . 1 1 1 1 G P P 31 -3.46 0.015 . . . . . . A 1 G P . 30224 1
11 . 1 1 2 2 G H1 H 1 12.43 0.015 . . . . . . A 2 G H1 . 30224 1
12 . 1 1 2 2 G H1' H 1 5.77 0.015 . . . . . . A 2 G H1' . 30224 1
13 . 1 1 2 2 G H2' H 1 4.65 0.015 . . . . . . A 2 G H2' . 30224 1
14 . 1 1 2 2 G H3' H 1 4.48 0.015 . . . . . . A 2 G H3' . 30224 1
15 . 1 1 2 2 G H4' H 1 4.54 0.015 . . . . . . A 2 G H4' . 30224 1
16 . 1 1 2 2 G H5' H 1 4.41 0.015 . . . . . . A 2 G H5' . 30224 1
17 . 1 1 2 2 G H5'' H 1 4.24 0.015 . . . . . . A 2 G H5'' . 30224 1
18 . 1 1 2 2 G H8 H 1 7.59 0.015 . . . . . . A 2 G H8 . 30224 1
19 . 1 1 2 2 G C1' C 13 92.79 0.015 . . . . . . A 2 G C1' . 30224 1
20 . 1 1 2 2 G C2' C 13 75.35 0.015 . . . . . . A 2 G C2' . 30224 1
21 . 1 1 2 2 G C3' C 13 73.08 0.015 . . . . . . A 2 G C3' . 30224 1
22 . 1 1 2 2 G C4' C 13 82.56 0.015 . . . . . . A 2 G C4' . 30224 1
23 . 1 1 2 2 G C5' C 13 66.72 0.015 . . . . . . A 2 G C5' . 30224 1
24 . 1 1 2 2 G C8 C 13 136.78 0.04 . . . . . . A 2 G C8 . 30224 1
25 . 1 1 2 2 G N1 N 15 146.40 0.015 . . . . . . A 2 G N1 . 30224 1
26 . 1 1 2 2 G N7 N 15 234.69 0.03 . . . . . . A 2 G N7 . 30224 1
27 . 1 1 2 2 G N9 N 15 169.67 0.03 . . . . . . A 2 G N9 . 30224 1
28 . 1 1 2 2 G P P 31 -3.99 0.015 . . . . . . A 2 G P . 30224 1
29 . 1 1 3 3 A H1' H 1 6.06 0.015 . . . . . . A 3 A H1' . 30224 1
30 . 1 1 3 3 A H2 H 1 7.77 0.015 . . . . . . A 3 A H2 . 30224 1
31 . 1 1 3 3 A H2' H 1 4.52 0.015 . . . . . . A 3 A H2' . 30224 1
32 . 1 1 3 3 A H3' H 1 4.62 0.015 . . . . . . A 3 A H3' . 30224 1
33 . 1 1 3 3 A H4' H 1 4.46 0.015 . . . . . . A 3 A H4' . 30224 1
34 . 1 1 3 3 A H5' H 1 4.55 0.015 . . . . . . A 3 A H5' . 30224 1
35 . 1 1 3 3 A H5'' H 1 4.12 0.015 . . . . . . A 3 A H5'' . 30224 1
36 . 1 1 3 3 A H8 H 1 7.91 0.015 . . . . . . A 3 A H8 . 30224 1
37 . 1 1 3 3 A H61 H 1 7.90 0.015 . . . . . . A 3 A H61 . 30224 1
38 . 1 1 3 3 A H62 H 1 6.98 0.015 . . . . . . A 3 A H62 . 30224 1
39 . 1 1 3 3 A C1' C 13 92.79 0.04 . . . . . . A 3 A C1' . 30224 1
40 . 1 1 3 3 A C2 C 13 153.77 0.04 . . . . . . A 3 A C2 . 30224 1
41 . 1 1 3 3 A C2' C 13 75.62 0.04 . . . . . . A 3 A C2' . 30224 1
42 . 1 1 3 3 A C3' C 13 72.56 0.04 . . . . . . A 3 A C3' . 30224 1
43 . 1 1 3 3 A C4' C 13 82.25 0.04 . . . . . . A 3 A C4' . 30224 1
44 . 1 1 3 3 A C5' C 13 64.40 0.04 . . . . . . A 3 A C5' . 30224 1
45 . 1 1 3 3 A C8 C 13 139.14 0.04 . . . . . . A 3 A C8 . 30224 1
46 . 1 1 3 3 A N1 N 15 223.55 0.03 . . . . . . A 3 A N1 . 30224 1
47 . 1 1 3 3 A N3 N 15 212.57 0.03 . . . . . . A 3 A N3 . 30224 1
48 . 1 1 3 3 A N7 N 15 230.23 0.03 . . . . . . A 3 A N7 . 30224 1
49 . 1 1 3 3 A N9 N 15 171.31 0.03 . . . . . . A 3 A N9 . 30224 1
50 . 1 1 3 3 A P P 31 -3.97 0.015 . . . . . . A 3 A P . 30224 1
51 . 1 1 4 4 C H1' H 1 5.38 0.015 . . . . . . A 4 C H1' . 30224 1
52 . 1 1 4 4 C H2' H 1 4.39 0.015 . . . . . . A 4 C H2' . 30224 1
53 . 1 1 4 4 C H3' H 1 4.37 0.015 . . . . . . A 4 C H3' . 30224 1
54 . 1 1 4 4 C H4' H 1 4.36 0.015 . . . . . . A 4 C H4' . 30224 1
55 . 1 1 4 4 C H5 H 1 5.33 0.015 . . . . . . A 4 C H5 . 30224 1
56 . 1 1 4 4 C H5' H 1 4.44 0.015 . . . . . . A 4 C H5' . 30224 1
57 . 1 1 4 4 C H5'' H 1 4.02 0.015 . . . . . . A 4 C H5'' . 30224 1
58 . 1 1 4 4 C H6 H 1 7.40 0.015 . . . . . . A 4 C H6 . 30224 1
59 . 1 1 4 4 C H41 H 1 8.21 0.015 . . . . . . A 4 C H41 . 30224 1
60 . 1 1 4 4 C H42 H 1 7.11 0.015 . . . . . . A 4 C H42 . 30224 1
61 . 1 1 4 4 C C1' C 13 93.55 0.04 . . . . . . A 4 C C1' . 30224 1
62 . 1 1 4 4 C C2 C 13 158.41 0.04 . . . . . . A 4 C C2 . 30224 1
63 . 1 1 4 4 C C2' C 13 75.47 0.04 . . . . . . A 4 C C2' . 30224 1
64 . 1 1 4 4 C C3' C 13 72.47 0.04 . . . . . . A 4 C C3' . 30224 1
65 . 1 1 4 4 C C4 C 13 168.18 0.04 . . . . . . A 4 C C4 . 30224 1
66 . 1 1 4 4 C C4' C 13 82.08 0.04 . . . . . . A 4 C C4' . 30224 1
67 . 1 1 4 4 C C5 C 13 97.63 0.04 . . . . . . A 4 C C5 . 30224 1
68 . 1 1 4 4 C C5' C 13 64.68 0.04 . . . . . . A 4 C C5' . 30224 1
69 . 1 1 4 4 C C6 C 13 140.14 0.04 . . . . . . A 4 C C6 . 30224 1
70 . 1 1 4 4 C N1 N 15 148.12 0.03 . . . . . . A 4 C N1 . 30224 1
71 . 1 1 4 4 C N4 N 15 95.35 0.03 . . . . . . A 4 C N4 . 30224 1
72 . 1 1 4 4 C P P 31 -3.96 0.015 . . . . . . A 4 C P . 30224 1
73 . 1 1 5 5 A H1' H 1 6.00 0.015 . . . . . . A 5 A H1' . 30224 1
74 . 1 1 5 5 A H2 H 1 7.31 0.015 . . . . . . A 5 A H2 . 30224 1
75 . 1 1 5 5 A H2' H 1 4.46 0.015 . . . . . . A 5 A H2' . 30224 1
76 . 1 1 5 5 A H3' H 1 4.54 0.015 . . . . . . A 5 A H3' . 30224 1
77 . 1 1 5 5 A H4' H 1 4.54 0.015 . . . . . . A 5 A H4' . 30224 1
78 . 1 1 5 5 A H5' H 1 4.48 0.015 . . . . . . A 5 A H5' . 30224 1
79 . 1 1 5 5 A H5'' H 1 4.08 0.015 . . . . . . A 5 A H5'' . 30224 1
80 . 1 1 5 5 A H8 H 1 8.03 0.015 . . . . . . A 5 A H8 . 30224 1
81 . 1 1 5 5 A H61 H 1 7.78 0.015 . . . . . . A 5 A H61 . 30224 1
82 . 1 1 5 5 A H62 H 1 6.47 0.015 . . . . . . A 5 A H62 . 30224 1
83 . 1 1 5 5 A C1' C 13 93.14 0.04 . . . . . . A 5 A C1' . 30224 1
84 . 1 1 5 5 A C2 C 13 152.92 0.04 . . . . . . A 5 A C2 . 30224 1
85 . 1 1 5 5 A C2' C 13 75.53 0.04 . . . . . . A 5 A C2' . 30224 1
86 . 1 1 5 5 A C3' C 13 72.85 0.04 . . . . . . A 5 A C3' . 30224 1
87 . 1 1 5 5 A C4' C 13 82.22 0.04 . . . . . . A 5 A C4' . 30224 1
88 . 1 1 5 5 A C5' C 13 65.10 0.04 . . . . . . A 5 A C5' . 30224 1
89 . 1 1 5 5 A C8 C 13 139.50 0.04 . . . . . . A 5 A C8 . 30224 1
90 . 1 1 5 5 A N1 N 15 222.36 0.03 . . . . . . A 5 A N1 . 30224 1
91 . 1 1 5 5 A N3 N 15 214.65 0.03 . . . . . . A 5 A N3 . 30224 1
92 . 1 1 5 5 A N7 N 15 231.42 0.03 . . . . . . A 5 A N7 . 30224 1
93 . 1 1 5 5 A N9 N 15 171.01 0.03 . . . . . . A 5 A N9 . 30224 1
94 . 1 1 5 5 A P P 31 -4.28 0.015 . . . . . . A 5 A P . 30224 1
95 . 1 1 6 6 U H1' H 1 5.53 0.015 . . . . . . A 6 U H1' . 30224 1
96 . 1 1 6 6 U H2' H 1 4.22 0.015 . . . . . . A 6 U H2' . 30224 1
97 . 1 1 6 6 U H3 H 1 13.06 0.015 . . . . . . A 6 U H3 . 30224 1
98 . 1 1 6 6 U H3' H 1 4.47 0.015 . . . . . . A 6 U H3' . 30224 1
99 . 1 1 6 6 U H4' H 1 4.36 0.015 . . . . . . A 6 U H4' . 30224 1
100 . 1 1 6 6 U H5 H 1 5.16 0.015 . . . . . . A 6 U H5 . 30224 1
101 . 1 1 6 6 U H5' H 1 4.46 0.015 . . . . . . A 6 U H5' . 30224 1
102 . 1 1 6 6 U H5'' H 1 4.04 0.015 . . . . . . A 6 U H5'' . 30224 1
103 . 1 1 6 6 U H6 H 1 7.60 0.015 . . . . . . A 6 U H6 . 30224 1
104 . 1 1 6 6 U C1' C 13 92.79 0.04 . . . . . . A 6 U C1' . 30224 1
105 . 1 1 6 6 U C2 C 13 152.16 0.04 . . . . . . A 6 U C2 . 30224 1
106 . 1 1 6 6 U C2' C 13 75.50 0.04 . . . . . . A 6 U C2' . 30224 1
107 . 1 1 6 6 U C3' C 13 72.76 0.04 . . . . . . A 6 U C3' . 30224 1
108 . 1 1 6 6 U C4 C 13 168.71 0.04 . . . . . . A 6 U C4 . 30224 1
109 . 1 1 6 6 U C4' C 13 82.45 0.04 . . . . . . A 6 U C4' . 30224 1
110 . 1 1 6 6 U C5 C 13 103.18 0.04 . . . . . . A 6 U C5 . 30224 1
111 . 1 1 6 6 U C5' C 13 64.76 0.04 . . . . . . A 6 U C5' . 30224 1
112 . 1 1 6 6 U C6 C 13 141.22 0.04 . . . . . . A 6 U C6 . 30224 1
113 . 1 1 6 6 U N1 N 15 142.95 0.03 . . . . . . A 6 U N1 . 30224 1
114 . 1 1 6 6 U N3 N 15 160.81 0.03 . . . . . . A 6 U N3 . 30224 1
115 . 1 1 6 6 U P P 31 -3.83 0.015 . . . . . . A 6 U P . 30224 1
116 . 1 1 7 7 A H1' H 1 6.04 0.015 . . . . . . A 7 A H1' . 30224 1
117 . 1 1 7 7 A H2 H 1 7.80 0.015 . . . . . . A 7 A H2 . 30224 1
118 . 1 1 7 7 A H2' H 1 4.46 0.015 . . . . . . A 7 A H2' . 30224 1
119 . 1 1 7 7 A H3' H 1 4.67 0.015 . . . . . . A 7 A H3' . 30224 1
120 . 1 1 7 7 A H4' H 1 4.44 0.015 . . . . . . A 7 A H4' . 30224 1
121 . 1 1 7 7 A H5' H 1 4.37 0.015 . . . . . . A 7 A H5' . 30224 1
122 . 1 1 7 7 A H5'' H 1 4.10 0.015 . . . . . . A 7 A H5'' . 30224 1
123 . 1 1 7 7 A H8 H 1 8.14 0.015 . . . . . . A 7 A H8 . 30224 1
124 . 1 1 7 7 A C1' C 13 91.25 0.04 . . . . . . A 7 A C1' . 30224 1
125 . 1 1 7 7 A C2' C 13 76.28 0.04 . . . . . . A 7 A C2' . 30224 1
126 . 1 1 7 7 A C3' C 13 74.56 0.04 . . . . . . A 7 A C3' . 30224 1
127 . 1 1 7 7 A C4' C 13 83.48 0.04 . . . . . . A 7 A C4' . 30224 1
128 . 1 1 7 7 A C5' C 13 66.29 0.04 . . . . . . A 7 A C5' . 30224 1
129 . 1 1 7 7 A C8 C 13 140.36 0.04 . . . . . . A 7 A C8 . 30224 1
130 . 1 1 7 7 A N7 N 15 232.61 0.03 . . . . . . A 7 A N7 . 30224 1
131 . 1 1 7 7 A N9 N 15 169.97 0.03 . . . . . . A 7 A N9 . 30224 1
132 . 1 1 7 7 A P P 31 -3.64 0.015 . . . . . . A 7 A P . 30224 1
133 . 1 1 8 8 A H1' H 1 6.02 0.015 . . . . . . A 8 A H1' . 30224 1
134 . 1 1 8 8 A H2' H 1 4.60 0.015 . . . . . . A 8 A H2' . 30224 1
135 . 1 1 8 8 A H3' H 1 4.53 0.015 . . . . . . A 8 A H3' . 30224 1
136 . 1 1 8 8 A H4' H 1 4.46 0.015 . . . . . . A 8 A H4' . 30224 1
137 . 1 1 8 8 A H5' H 1 4.35 0.015 . . . . . . A 8 A H5' . 30224 1
138 . 1 1 8 8 A H5'' H 1 4.12 0.015 . . . . . . A 8 A H5'' . 30224 1
139 . 1 1 8 8 A H8 H 1 7.98 0.015 . . . . . . A 8 A H8 . 30224 1
140 . 1 1 8 8 A C1' C 13 92.01 0.04 . . . . . . A 8 A C1' . 30224 1
141 . 1 1 8 8 A C2' C 13 75.62 0.04 . . . . . . A 8 A C2' . 30224 1
142 . 1 1 8 8 A C3' C 13 75.33 0.04 . . . . . . A 8 A C3' . 30224 1
143 . 1 1 8 8 A C4' C 13 83.25 0.04 . . . . . . A 8 A C4' . 30224 1
144 . 1 1 8 8 A C5' C 13 66.32 0.04 . . . . . . A 8 A C5' . 30224 1
145 . 1 1 8 8 A C8 C 13 140.86 0.04 . . . . . . A 8 A C8 . 30224 1
146 . 1 1 8 8 A P P 31 -3.71 0.015 . . . . . . A 8 A P . 30224 1
147 . 1 1 9 9 G H1 H 1 12.22 0.015 . . . . . . A 9 G H1 . 30224 1
148 . 1 1 9 9 G H1' H 1 5.62 0.015 . . . . . . A 9 G H1' . 30224 1
149 . 1 1 9 9 G H2' H 1 4.48 0.015 . . . . . . A 9 G H2' . 30224 1
150 . 1 1 9 9 G H3' H 1 4.34 0.015 . . . . . . A 9 G H3' . 30224 1
151 . 1 1 9 9 G H4' H 1 4.37 0.015 . . . . . . A 9 G H4' . 30224 1
152 . 1 1 9 9 G H5' H 1 4.30 0.015 . . . . . . A 9 G H5' . 30224 1
153 . 1 1 9 9 G H5'' H 1 4.04 0.015 . . . . . . A 9 G H5'' . 30224 1
154 . 1 1 9 9 G H8 H 1 7.11 0.015 . . . . . . A 9 G H8 . 30224 1
155 . 1 1 9 9 G C1' C 13 92.53 0.04 . . . . . . A 9 G C1' . 30224 1
156 . 1 1 9 9 G C2' C 13 74.25 0.04 . . . . . . A 9 G C2' . 30224 1
157 . 1 1 9 9 G C3' C 13 72.92 0.04 . . . . . . A 9 G C3' . 30224 1
158 . 1 1 9 9 G C4' C 13 82.35 0.04 . . . . . . A 9 G C4' . 30224 1
159 . 1 1 9 9 G C5' C 13 66.43 0.04 . . . . . . A 9 G C5' . 30224 1
160 . 1 1 9 9 G C8 C 13 135.78 0.04 . . . . . . A 9 G C8 . 30224 1
161 . 1 1 9 9 G N1 N 15 146.50 0.03 . . . . . . A 9 G N1 . 30224 1
162 . 1 1 9 9 G P P 31 -3.88 0.015 . . . . . . A 9 G P . 30224 1
163 . 1 1 10 10 G H1' H 1 5.70 0.015 . . . . . . A 10 G H1' . 30224 1
164 . 1 1 10 10 G H2' H 1 4.46 0.015 . . . . . . A 10 G H2' . 30224 1
165 . 1 1 10 10 G H3' H 1 4.50 0.015 . . . . . . A 10 G H3' . 30224 1
166 . 1 1 10 10 G H4' H 1 4.36 0.015 . . . . . . A 10 G H4' . 30224 1
167 . 1 1 10 10 G H5' H 1 4.34 0.015 . . . . . . A 10 G H5' . 30224 1
168 . 1 1 10 10 G H5'' H 1 4.03 0.015 . . . . . . A 10 G H5'' . 30224 1
169 . 1 1 10 10 G H8 H 1 7.30 0.015 . . . . . . A 10 G H8 . 30224 1
170 . 1 1 10 10 G C1' C 13 92.36 0.04 . . . . . . A 10 G C1' . 30224 1
171 . 1 1 10 10 G C2' C 13 75.79 0.04 . . . . . . A 10 G C2' . 30224 1
172 . 1 1 10 10 G C3' C 13 73.23 0.04 . . . . . . A 10 G C3' . 30224 1
173 . 1 1 10 10 G C4' C 13 82.91 0.04 . . . . . . A 10 G C4' . 30224 1
174 . 1 1 10 10 G C5' C 13 65.79 0.04 . . . . . . A 10 G C5' . 30224 1
175 . 1 1 10 10 G C8 C 13 136.28 0.04 . . . . . . A 10 G C8 . 30224 1
176 . 1 1 10 10 G P P 31 -3.47 0.015 . . . . . . A 10 G P . 30224 1
177 . 1 1 11 11 A H1' H 1 5.78 0.015 . . . . . . A 11 A H1' . 30224 1
178 . 1 1 11 11 A H2 H 1 7.90 0.015 . . . . . . A 11 A H2 . 30224 1
179 . 1 1 11 11 A H2' H 1 4.44 0.015 . . . . . . A 11 A H2' . 30224 1
180 . 1 1 11 11 A H3' H 1 4.49 0.015 . . . . . . A 11 A H3' . 30224 1
181 . 1 1 11 11 A H4' H 1 4.34 0.015 . . . . . . A 11 A H4' . 30224 1
182 . 1 1 11 11 A H5' H 1 4.25 0.015 . . . . . . A 11 A H5' . 30224 1
183 . 1 1 11 11 A H5'' H 1 4.03 0.015 . . . . . . A 11 A H5'' . 30224 1
184 . 1 1 11 11 A H8 H 1 7.81 0.015 . . . . . . A 11 A H8 . 30224 1
185 . 1 1 11 11 A C1' C 13 92.02 0.04 . . . . . . A 11 A C1' . 30224 1
186 . 1 1 11 11 A C2 C 13 153.87 0.04 . . . . . . A 11 A C2 . 30224 1
187 . 1 1 11 11 A C2' C 13 75.71 0.04 . . . . . . A 11 A C2' . 30224 1
188 . 1 1 11 11 A C3' C 13 75.35 0.04 . . . . . . A 11 A C3' . 30224 1
189 . 1 1 11 11 A C4' C 13 84.47 0.04 . . . . . . A 11 A C4' . 30224 1
190 . 1 1 11 11 A C5' C 13 66.30 0.04 . . . . . . A 11 A C5' . 30224 1
191 . 1 1 11 11 A P P 31 -3.74 0.015 . . . . . . A 11 A P . 30224 1
192 . 1 1 12 12 A H1' H 1 5.84 0.015 . . . . . . A 12 A H1' . 30224 1
193 . 1 1 12 12 A H2 H 1 7.86 0.015 . . . . . . A 12 A H2 . 30224 1
194 . 1 1 12 12 A H2' H 1 4.49 0.015 . . . . . . A 12 A H2' . 30224 1
195 . 1 1 12 12 A H3' H 1 4.55 0.015 . . . . . . A 12 A H3' . 30224 1
196 . 1 1 12 12 A H4' H 1 4.25 0.015 . . . . . . A 12 A H4' . 30224 1
197 . 1 1 12 12 A H5' H 1 4.02 0.015 . . . . . . A 12 A H5' . 30224 1
198 . 1 1 12 12 A H5'' H 1 4.08 0.015 . . . . . . A 12 A H5'' . 30224 1
199 . 1 1 12 12 A H8 H 1 8.22 0.015 . . . . . . A 12 A H8 . 30224 1
200 . 1 1 12 12 A C1' C 13 89.68 0.04 . . . . . . A 12 A C1' . 30224 1
201 . 1 1 12 12 A C2 C 13 154.77 0.04 . . . . . . A 12 A C2 . 30224 1
202 . 1 1 12 12 A C2' C 13 76.78 0.04 . . . . . . A 12 A C2' . 30224 1
203 . 1 1 12 12 A C3' C 13 75.41 0.04 . . . . . . A 12 A C3' . 30224 1
204 . 1 1 12 12 A C4' C 13 85.41 0.04 . . . . . . A 12 A C4' . 30224 1
205 . 1 1 12 12 A C5' C 13 67.46 0.04 . . . . . . A 12 A C5' . 30224 1
206 . 1 1 12 12 A C8 C 13 141.59 0.04 . . . . . . A 12 A C8 . 30224 1
207 . 1 1 12 12 A N7 N 15 232.31 0.03 . . . . . . A 12 A N7 . 30224 1
208 . 1 1 12 12 A N9 N 15 168.63 0.03 . . . . . . A 12 A N9 . 30224 1
209 . 1 1 12 12 A P P 31 -3.79 0.015 . . . . . . A 12 A P . 30224 1
210 . 1 1 13 13 A H1' H 1 5.80 0.015 . . . . . . A 13 A H1' . 30224 1
211 . 1 1 13 13 A H2 H 1 7.97 0.015 . . . . . . A 13 A H2 . 30224 1
212 . 1 1 13 13 A H2' H 1 4.56 0.015 . . . . . . A 13 A H2' . 30224 1
213 . 1 1 13 13 A H3' H 1 4.63 0.015 . . . . . . A 13 A H3' . 30224 1
214 . 1 1 13 13 A H4' H 1 4.39 0.015 . . . . . . A 13 A H4' . 30224 1
215 . 1 1 13 13 A H5' H 1 4.08 0.015 . . . . . . A 13 A H5' . 30224 1
216 . 1 1 13 13 A H5'' H 1 4.00 0.015 . . . . . . A 13 A H5'' . 30224 1
217 . 1 1 13 13 A H8 H 1 8.09 0.015 . . . . . . A 13 A H8 . 30224 1
218 . 1 1 13 13 A C1' C 13 91.13 0.04 . . . . . . A 13 A C1' . 30224 1
219 . 1 1 13 13 A C2 C 13 154.64 0.04 . . . . . . A 13 A C2 . 30224 1
220 . 1 1 13 13 A C2' C 13 76.08 0.04 . . . . . . A 13 A C2' . 30224 1
221 . 1 1 13 13 A C3' C 13 76.55 0.04 . . . . . . A 13 A C3' . 30224 1
222 . 1 1 13 13 A C4' C 13 84.77 0.04 . . . . . . A 13 A C4' . 30224 1
223 . 1 1 13 13 A C5' C 13 68.13 0.04 . . . . . . A 13 A C5' . 30224 1
224 . 1 1 13 13 A C8 C 13 141.27 0.04 . . . . . . A 13 A C8 . 30224 1
225 . 1 1 13 13 A N1 N 15 225.78 0.03 . . . . . . A 13 A N1 . 30224 1
226 . 1 1 13 13 A N3 N 15 217.32 0.03 . . . . . . A 13 A N3 . 30224 1
227 . 1 1 13 13 A N7 N 15 230.98 0.03 . . . . . . A 13 A N7 . 30224 1
228 . 1 1 13 13 A N9 N 15 169.38 0.03 . . . . . . A 13 A N9 . 30224 1
229 . 1 1 13 13 A P P 31 -3.76 0.015 . . . . . . A 13 A P . 30224 1
230 . 1 1 14 14 A H1' H 1 6.08 0.015 . . . . . . A 14 A H1' . 30224 1
231 . 1 1 14 14 A H2 H 1 8.19 0.015 . . . . . . A 14 A H2 . 30224 1
232 . 1 1 14 14 A H2' H 1 4.67 0.015 . . . . . . A 14 A H2' . 30224 1
233 . 1 1 14 14 A H3' H 1 4.76 0.015 . . . . . . A 14 A H3' . 30224 1
234 . 1 1 14 14 A H4' H 1 4.56 0.015 . . . . . . A 14 A H4' . 30224 1
235 . 1 1 14 14 A H5' H 1 4.33 0.015 . . . . . . A 14 A H5' . 30224 1
236 . 1 1 14 14 A H5'' H 1 4.23 0.015 . . . . . . A 14 A H5'' . 30224 1
237 . 1 1 14 14 A H8 H 1 8.35 0.015 . . . . . . A 14 A H8 . 30224 1
238 . 1 1 14 14 A H61 H 1 8.40 0.015 . . . . . . A 14 A H61 . 30224 1
239 . 1 1 14 14 A H62 H 1 7.14 0.015 . . . . . . A 14 A H62 . 30224 1
240 . 1 1 14 14 A C1' C 13 90.64 0.04 . . . . . . A 14 A C1' . 30224 1
241 . 1 1 14 14 A C2 C 13 155.18 0.04 . . . . . . A 14 A C2 . 30224 1
242 . 1 1 14 14 A C2' C 13 76.25 0.04 . . . . . . A 14 A C2' . 30224 1
243 . 1 1 14 14 A C3' C 13 76.34 0.04 . . . . . . A 14 A C3' . 30224 1
244 . 1 1 14 14 A C4' C 13 84.53 0.04 . . . . . . A 14 A C4' . 30224 1
245 . 1 1 14 14 A C5' C 13 67.84 0.04 . . . . . . A 14 A C5' . 30224 1
246 . 1 1 14 14 A C8 C 13 141.59 0.04 . . . . . . A 14 A C8 . 30224 1
247 . 1 1 14 14 A N1 N 15 226.08 0.03 . . . . . . A 14 A N1 . 30224 1
248 . 1 1 14 14 A N3 N 15 217.61 0.03 . . . . . . A 14 A N3 . 30224 1
249 . 1 1 14 14 A N7 N 15 233.20 0.03 . . . . . . A 14 A N7 . 30224 1
250 . 1 1 14 14 A N9 N 15 170.27 0.03 . . . . . . A 14 A N9 . 30224 1
251 . 1 1 14 14 A P P 31 -3.21 0.015 . . . . . . A 14 A P . 30224 1
252 . 1 1 15 15 C H1' H 1 5.64 0.015 . . . . . . A 15 C H1' . 30224 1
253 . 1 1 15 15 C H2' H 1 4.28 0.015 . . . . . . A 15 C H2' . 30224 1
254 . 1 1 15 15 C H3' H 1 4.13 0.015 . . . . . . A 15 C H3' . 30224 1
255 . 1 1 15 15 C H4' H 1 4.25 0.015 . . . . . . A 15 C H4' . 30224 1
256 . 1 1 15 15 C H5 H 1 6.00 0.015 . . . . . . A 15 C H5 . 30224 1
257 . 1 1 15 15 C H5' H 1 4.28 0.015 . . . . . . A 15 C H5' . 30224 1
258 . 1 1 15 15 C H5'' H 1 4.20 0.015 . . . . . . A 15 C H5'' . 30224 1
259 . 1 1 15 15 C H6 H 1 7.79 0.015 . . . . . . A 15 C H6 . 30224 1
260 . 1 1 15 15 C H41 H 1 8.40 0.015 . . . . . . A 15 C H41 . 30224 1
261 . 1 1 15 15 C H42 H 1 7.14 0.015 . . . . . . A 15 C H42 . 30224 1
262 . 1 1 15 15 C C1' C 13 92.56 0.04 . . . . . . A 15 C C1' . 30224 1
263 . 1 1 15 15 C C2 C 13 158.80 0.04 . . . . . . A 15 C C2 . 30224 1
264 . 1 1 15 15 C C2' C 13 75.21 0.04 . . . . . . A 15 C C2' . 30224 1
265 . 1 1 15 15 C C3' C 13 74.05 0.04 . . . . . . A 15 C C3' . 30224 1
266 . 1 1 15 15 C C4 C 13 168.66 0.04 . . . . . . A 15 C C4 . 30224 1
267 . 1 1 15 15 C C4' C 13 82.40 0.04 . . . . . . A 15 C C4' . 30224 1
268 . 1 1 15 15 C C5 C 13 98.59 0.04 . . . . . . A 15 C C5 . 30224 1
269 . 1 1 15 15 C C5' C 13 68.92 0.04 . . . . . . A 15 C C5' . 30224 1
270 . 1 1 15 15 C C6 C 13 141.95 0.04 . . . . . . A 15 C C6 . 30224 1
271 . 1 1 15 15 C N1 N 15 151.59 0.03 . . . . . . A 15 C N1 . 30224 1
272 . 1 1 15 15 C N4 N 15 95.26 0.03 . . . . . . A 15 C N4 . 30224 1
273 . 1 1 15 15 C P P 31 -4.38 0.015 . . . . . . A 15 C P . 30224 1
274 . 1 1 16 16 C H2' H 1 4.25 0.015 . . . . . . A 16 C H2' . 30224 1
275 . 1 1 16 16 C H3' H 1 4.43 0.015 . . . . . . A 16 C H3' . 30224 1
276 . 1 1 16 16 C H5 H 1 5.73 0.015 . . . . . . A 16 C H5 . 30224 1
277 . 1 1 16 16 C H6 H 1 7.88 0.015 . . . . . . A 16 C H6 . 30224 1
278 . 1 1 16 16 C C5 C 13 98.04 0.04 . . . . . . A 16 C C5 . 30224 1
279 . 1 1 16 16 C C6 C 13 141.50 0.04 . . . . . . A 16 C C6 . 30224 1
280 . 1 1 16 16 C N1 N 15 150.12 0.03 . . . . . . A 16 C N1 . 30224 1
281 . 1 1 16 16 C N4 N 15 95.26 0.03 . . . . . . A 16 C N4 . 30224 1
282 . 1 1 17 17 U H1' H 1 5.66 0.015 . . . . . . A 17 U H1' . 30224 1
283 . 1 1 17 17 U H2' H 1 4.46 0.015 . . . . . . A 17 U H2' . 30224 1
284 . 1 1 17 17 U H3 H 1 14.05 0.015 . . . . . . A 17 U H3 . 30224 1
285 . 1 1 17 17 U H3' H 1 4.47 0.015 . . . . . . A 17 U H3' . 30224 1
286 . 1 1 17 17 U H4' H 1 4.37 0.015 . . . . . . A 17 U H4' . 30224 1
287 . 1 1 17 17 U H5 H 1 5.60 0.015 . . . . . . A 17 U H5 . 30224 1
288 . 1 1 17 17 U H5' H 1 4.46 0.015 . . . . . . A 17 U H5' . 30224 1
289 . 1 1 17 17 U H5'' H 1 4.03 0.015 . . . . . . A 17 U H5'' . 30224 1
290 . 1 1 17 17 U H6 H 1 7.92 0.015 . . . . . . A 17 U H6 . 30224 1
291 . 1 1 17 17 U C1' C 13 93.93 0.04 . . . . . . A 17 U C1' . 30224 1
292 . 1 1 17 17 U C2' C 13 75.25 0.04 . . . . . . A 17 U C2' . 30224 1
293 . 1 1 17 17 U C3' C 13 72.68 0.04 . . . . . . A 17 U C3' . 30224 1
294 . 1 1 17 17 U C4 C 13 169.24 0.04 . . . . . . A 17 U C4 . 30224 1
295 . 1 1 17 17 U C4' C 13 82.55 0.04 . . . . . . A 17 U C4' . 30224 1
296 . 1 1 17 17 U C5 C 13 104.15 0.04 . . . . . . A 17 U C5 . 30224 1
297 . 1 1 17 17 U C5' C 13 64.38 0.04 . . . . . . A 17 U C5' . 30224 1
298 . 1 1 17 17 U C6 C 13 142.13 0.04 . . . . . . A 17 U C6 . 30224 1
299 . 1 1 17 17 U N1 N 15 143.87 0.03 . . . . . . A 17 U N1 . 30224 1
300 . 1 1 17 17 U P P 31 -3.81 0.015 . . . . . . A 17 U P . 30224 1
301 . 1 1 18 18 A H1' H 1 5.92 0.015 . . . . . . A 18 A H1' . 30224 1
302 . 1 1 18 18 A H2 H 1 7.10 0.015 . . . . . . A 18 A H2 . 30224 1
303 . 1 1 18 18 A H2' H 1 4.39 0.015 . . . . . . A 18 A H2' . 30224 1
304 . 1 1 18 18 A H3' H 1 4.50 0.015 . . . . . . A 18 A H3' . 30224 1
305 . 1 1 18 18 A H4' H 1 4.45 0.015 . . . . . . A 18 A H4' . 30224 1
306 . 1 1 18 18 A H5' H 1 4.45 0.015 . . . . . . A 18 A H5' . 30224 1
307 . 1 1 18 18 A H5'' H 1 4.14 0.015 . . . . . . A 18 A H5'' . 30224 1
308 . 1 1 18 18 A H8 H 1 8.23 0.015 . . . . . . A 18 A H8 . 30224 1
309 . 1 1 18 18 A H61 H 1 7.67 0.015 . . . . . . A 18 A H61 . 30224 1
310 . 1 1 18 18 A H62 H 1 6.56 0.015 . . . . . . A 18 A H62 . 30224 1
311 . 1 1 18 18 A C1' C 13 92.82 0.04 . . . . . . A 18 A C1' . 30224 1
312 . 1 1 18 18 A C2 C 13 152.96 0.04 . . . . . . A 18 A C2 . 30224 1
313 . 1 1 18 18 A C2' C 13 75.41 0.04 . . . . . . A 18 A C2' . 30224 1
314 . 1 1 18 18 A C3' C 13 73.02 0.04 . . . . . . A 18 A C3' . 30224 1
315 . 1 1 18 18 A C4' C 13 82.56 0.04 . . . . . . A 18 A C4' . 30224 1
316 . 1 1 18 18 A C5' C 13 65.55 0.04 . . . . . . A 18 A C5' . 30224 1
317 . 1 1 18 18 A C8 C 13 140.14 0.04 . . . . . . A 18 A C8 . 30224 1
318 . 1 1 18 18 A N1 N 15 223.26 0.03 . . . . . . A 18 A N1 . 30224 1
319 . 1 1 18 18 A N3 N 15 214.05 0.03 . . . . . . A 18 A N3 . 30224 1
320 . 1 1 18 18 A N7 N 15 231.12 0.03 . . . . . . A 18 A N7 . 30224 1
321 . 1 1 18 18 A N9 N 15 171.46 0.03 . . . . . . A 18 A N9 . 30224 1
322 . 1 1 18 18 A P P 31 -4.29 0.015 . . . . . . A 18 A P . 30224 1
323 . 1 1 19 19 U H1' H 1 5.39 0.015 . . . . . . A 19 U H1' . 30224 1
324 . 1 1 19 19 U H2' H 1 4.41 0.015 . . . . . . A 19 U H2' . 30224 1
325 . 1 1 19 19 U H3 H 1 13.24 0.015 . . . . . . A 19 U H3 . 30224 1
326 . 1 1 19 19 U H3' H 1 4.39 0.015 . . . . . . A 19 U H3' . 30224 1
327 . 1 1 19 19 U H4' H 1 4.31 0.015 . . . . . . A 19 U H4' . 30224 1
328 . 1 1 19 19 U H5 H 1 5.10 0.015 . . . . . . A 19 U H5 . 30224 1
329 . 1 1 19 19 U H5' H 1 4.42 0.015 . . . . . . A 19 U H5' . 30224 1
330 . 1 1 19 19 U H5'' H 1 4.01 0.015 . . . . . . A 19 U H5'' . 30224 1
331 . 1 1 19 19 U H6 H 1 7.58 0.015 . . . . . . A 19 U H6 . 30224 1
332 . 1 1 19 19 U C1' C 13 92.88 0.04 . . . . . . A 19 U C1' . 30224 1
333 . 1 1 19 19 U C2 C 13 152.16 0.04 . . . . . . A 19 U C2 . 30224 1
334 . 1 1 19 19 U C2' C 13 75.27 0.04 . . . . . . A 19 U C2' . 30224 1
335 . 1 1 19 19 U C3' C 13 72.41 0.04 . . . . . . A 19 U C3' . 30224 1
336 . 1 1 19 19 U C4 C 13 168.76 0.04 . . . . . . A 19 U C4 . 30224 1
337 . 1 1 19 19 U C4' C 13 82.11 0.04 . . . . . . A 19 U C4' . 30224 1
338 . 1 1 19 19 U C5 C 13 102.60 0.04 . . . . . . A 19 U C5 . 30224 1
339 . 1 1 19 19 U C5' C 13 64.56 0.04 . . . . . . A 19 U C5' . 30224 1
340 . 1 1 19 19 U C6 C 13 140.82 0.04 . . . . . . A 19 U C6 . 30224 1
341 . 1 1 19 19 U N1 N 15 142.56 0.03 . . . . . . A 19 U N1 . 30224 1
342 . 1 1 19 19 U N3 N 15 161.25 0.03 . . . . . . A 19 U N3 . 30224 1
343 . 1 1 19 19 U P P 31 -3.94 0.015 . . . . . . A 19 U P . 30224 1
344 . 1 1 20 20 G H1 H 1 12.42 0.015 . . . . . . A 20 G H1 . 30224 1
345 . 1 1 20 20 G H1' H 1 5.82 0.015 . . . . . . A 20 G H1' . 30224 1
346 . 1 1 20 20 G H2' H 1 4.46 0.015 . . . . . . A 20 G H2' . 30224 1
347 . 1 1 20 20 G H3' H 1 4.42 0.015 . . . . . . A 20 G H3' . 30224 1
348 . 1 1 20 20 G H4' H 1 4.41 0.015 . . . . . . A 20 G H4' . 30224 1
349 . 1 1 20 20 G H5' H 1 4.37 0.015 . . . . . . A 20 G H5' . 30224 1
350 . 1 1 20 20 G H5'' H 1 4.04 0.015 . . . . . . A 20 G H5'' . 30224 1
351 . 1 1 20 20 G H8 H 1 7.69 0.015 . . . . . . A 20 G H8 . 30224 1
352 . 1 1 20 20 G C1' C 13 92.65 0.04 . . . . . . A 20 G C1' . 30224 1
353 . 1 1 20 20 G C2' C 13 75.21 0.04 . . . . . . A 20 G C2' . 30224 1
354 . 1 1 20 20 G C3' C 13 73.02 0.04 . . . . . . A 20 G C3' . 30224 1
355 . 1 1 20 20 G C4' C 13 82.62 0.04 . . . . . . A 20 G C4' . 30224 1
356 . 1 1 20 20 G C5' C 13 65.97 0.04 . . . . . . A 20 G C5' . 30224 1
357 . 1 1 20 20 G C8 C 13 136.33 0.04 . . . . . . A 20 G C8 . 30224 1
358 . 1 1 20 20 G N1 N 15 146.83 0.03 . . . . . . A 20 G N1 . 30224 1
359 . 1 1 20 20 G N7 N 15 235.87 0.03 . . . . . . A 20 G N7 . 30224 1
360 . 1 1 20 20 G N9 N 15 169.67 0.03 . . . . . . A 20 G N9 . 30224 1
361 . 1 1 20 20 G P P 31 -4.57 0.015 . . . . . . A 20 G P . 30224 1
362 . 1 1 21 21 U H1' H 1 5.59 0.015 . . . . . . A 21 U H1' . 30224 1
363 . 1 1 21 21 U H2' H 1 4.45 0.015 . . . . . . A 21 U H2' . 30224 1
364 . 1 1 21 21 U H3 H 1 14.12 0.015 . . . . . . A 21 U H3 . 30224 1
365 . 1 1 21 21 U H3' H 1 4.29 0.015 . . . . . . A 21 U H3' . 30224 1
366 . 1 1 21 21 U H4' H 1 4.39 0.015 . . . . . . A 21 U H4' . 30224 1
367 . 1 1 21 21 U H5 H 1 5.09 0.015 . . . . . . A 21 U H5 . 30224 1
368 . 1 1 21 21 U H5' H 1 4.47 0.015 . . . . . . A 21 U H5' . 30224 1
369 . 1 1 21 21 U H5'' H 1 4.02 0.015 . . . . . . A 21 U H5'' . 30224 1
370 . 1 1 21 21 U H6 H 1 7.84 0.015 . . . . . . A 21 U H6 . 30224 1
371 . 1 1 21 21 U C1' C 13 93.64 0.04 . . . . . . A 21 U C1' . 30224 1
372 . 1 1 21 21 U C2 C 13 152.65 0.04 . . . . . . A 21 U C2 . 30224 1
373 . 1 1 21 21 U C2' C 13 75.12 0.04 . . . . . . A 21 U C2' . 30224 1
374 . 1 1 21 21 U C3' C 13 72.06 0.04 . . . . . . A 21 U C3' . 30224 1
375 . 1 1 21 21 U C4 C 13 168.42 0.04 . . . . . . A 21 U C4 . 30224 1
376 . 1 1 21 21 U C4' C 13 82.44 0.04 . . . . . . A 21 U C4' . 30224 1
377 . 1 1 21 21 U C5 C 13 103.04 0.04 . . . . . . A 21 U C5 . 30224 1
378 . 1 1 21 21 U C5' C 13 64.63 0.04 . . . . . . A 21 U C5' . 30224 1
379 . 1 1 21 21 U C6 C 13 141.86 0.04 . . . . . . A 21 U C6 . 30224 1
380 . 1 1 21 21 U N3 N 15 162.13 0.03 . . . . . . A 21 U N3 . 30224 1
381 . 1 1 21 21 U P P 31 -4.26 0.015 . . . . . . A 21 U P . 30224 1
382 . 1 1 22 22 C H1' H 1 5.65 0.015 . . . . . . A 22 C H1' . 30224 1
383 . 1 1 22 22 C H2' H 1 4.19 0.015 . . . . . . A 22 C H2' . 30224 1
384 . 1 1 22 22 C H3' H 1 4.49 0.015 . . . . . . A 22 C H3' . 30224 1
385 . 1 1 22 22 C H4' H 1 4.37 0.015 . . . . . . A 22 C H4' . 30224 1
386 . 1 1 22 22 C H5 H 1 5.68 0.015 . . . . . . A 22 C H5 . 30224 1
387 . 1 1 22 22 C H5' H 1 4.46 0.015 . . . . . . A 22 C H5' . 30224 1
388 . 1 1 22 22 C H5'' H 1 4.03 0.015 . . . . . . A 22 C H5'' . 30224 1
389 . 1 1 22 22 C H6 H 1 7.94 0.015 . . . . . . A 22 C H6 . 30224 1
390 . 1 1 22 22 C H41 H 1 8.42 0.015 . . . . . . A 22 C H41 . 30224 1
391 . 1 1 22 22 C H42 H 1 6.78 0.015 . . . . . . A 22 C H42 . 30224 1
392 . 1 1 22 22 C C1' C 13 94.16 0.04 . . . . . . A 22 C C1' . 30224 1
393 . 1 1 22 22 C C2 C 13 158.60 0.04 . . . . . . A 22 C C2 . 30224 1
394 . 1 1 22 22 C C2' C 13 75.59 0.04 . . . . . . A 22 C C2' . 30224 1
395 . 1 1 22 22 C C3' C 13 72.15 0.04 . . . . . . A 22 C C3' . 30224 1
396 . 1 1 22 22 C C4 C 13 168.27 0.04 . . . . . . A 22 C C4 . 30224 1
397 . 1 1 22 22 C C4' C 13 82.18 0.04 . . . . . . A 22 C C4' . 30224 1
398 . 1 1 22 22 C C5 C 13 97.31 0.04 . . . . . . A 22 C C5 . 30224 1
399 . 1 1 22 22 C C5' C 13 64.68 0.04 . . . . . . A 22 C C5' . 30224 1
400 . 1 1 22 22 C C6 C 13 141.63 0.04 . . . . . . A 22 C C6 . 30224 1
401 . 1 1 22 22 C N1 N 15 149.81 0.03 . . . . . . A 22 C N1 . 30224 1
402 . 1 1 22 22 C N4 N 15 95.65 0.03 . . . . . . A 22 C N4 . 30224 1
403 . 1 1 22 22 C P P 31 -4.17 0.015 . . . . . . A 22 C P . 30224 1
404 . 1 1 23 23 C H1' H 1 5.79 0.015 . . . . . . A 23 C H1' . 30224 1
405 . 1 1 23 23 C H2' H 1 3.95 0.015 . . . . . . A 23 C H2' . 30224 1
406 . 1 1 23 23 C H3' H 1 4.10 0.015 . . . . . . A 23 C H3' . 30224 1
407 . 1 1 23 23 C H4' H 1 4.13 0.015 . . . . . . A 23 C H4' . 30224 1
408 . 1 1 23 23 C H5 H 1 5.57 0.015 . . . . . . A 23 C H5 . 30224 1
409 . 1 1 23 23 C H5' H 1 4.45 0.015 . . . . . . A 23 C H5' . 30224 1
410 . 1 1 23 23 C H5'' H 1 3.96 0.015 . . . . . . A 23 C H5'' . 30224 1
411 . 1 1 23 23 C H6 H 1 7.70 0.015 . . . . . . A 23 C H6 . 30224 1
412 . 1 1 23 23 C H41 H 1 8.29 0.015 . . . . . . A 23 C H41 . 30224 1
413 . 1 1 23 23 C H42 H 1 6.98 0.015 . . . . . . A 23 C H42 . 30224 1
414 . 1 1 23 23 C C1' C 13 92.71 0.04 . . . . . . A 23 C C1' . 30224 1
415 . 1 1 23 23 C C2 C 13 159.70 0.04 . . . . . . A 23 C C2 . 30224 1
416 . 1 1 23 23 C C2' C 13 77.47 0.04 . . . . . . A 23 C C2' . 30224 1
417 . 1 1 23 23 C C3' C 13 70.22 0.04 . . . . . . A 23 C C3' . 30224 1
418 . 1 1 23 23 C C4 C 13 168.71 0.04 . . . . . . A 23 C C4 . 30224 1
419 . 1 1 23 23 C C4' C 13 83.78 0.04 . . . . . . A 23 C C4' . 30224 1
420 . 1 1 23 23 C C5 C 13 98.04 0.04 . . . . . . A 23 C C5 . 30224 1
421 . 1 1 23 23 C C5' C 13 65.15 0.04 . . . . . . A 23 C C5' . 30224 1
422 . 1 1 23 23 C C6 C 13 141.68 0.04 . . . . . . A 23 C C6 . 30224 1
423 . 1 1 23 23 C N1 N 15 150.50 0.03 . . . . . . A 23 C N1 . 30224 1
424 . 1 1 23 23 C N4 N 15 94.00 0.03 . . . . . . A 23 C N4 . 30224 1
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