TCEIII NMR Structure
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 1 | G | H1 | H | 13.2664 | 0.0000 | 1 |
2 | 1 | 1 | G | H1' | H | 5.7298 | 0.0000 | 1 |
3 | 1 | 1 | G | H2' | H | 4.4821 | 0.0000 | 1 |
4 | 1 | 1 | G | H3' | H | 4.2209 | 0.0000 | 1 |
5 | 1 | 1 | G | H4' | H | 4.0748 | 0.0000 | 1 |
6 | 1 | 1 | G | H8 | H | 8.1468 | 0.0000 | 1 |
7 | 1 | 1 | G | C1' | C | 90.8432 | 0.0000 | 1 |
8 | 1 | 1 | G | C8 | C | 139.1591 | 0.0000 | 1 |
9 | 1 | 1 | G | N1 | N | 148.0834 | 0.0000 | 1 |
10 | 1 | 2 | C | H1' | H | 5.6969 | 0.0000 | 1 |
11 | 1 | 2 | C | H5 | H | 5.3703 | 0.0000 | 1 |
12 | 1 | 2 | C | H6 | H | 7.8016 | 0.0000 | 1 |
13 | 1 | 2 | C | H41 | H | 6.8078 | 0.0000 | 2 |
14 | 1 | 2 | C | H42 | H | 8.5761 | 0.0000 | 2 |
15 | 1 | 2 | C | C1' | C | 93.9417 | 0.0000 | 1 |
16 | 1 | 2 | C | C5 | C | 97.6063 | 0.0000 | 1 |
17 | 1 | 2 | C | C6 | C | 141.5921 | 0.0000 | 1 |
18 | 1 | 3 | G | H1 | H | 13.1741 | 0.0000 | 1 |
19 | 1 | 3 | G | H1' | H | 5.7940 | 0.0000 | 1 |
20 | 1 | 3 | G | H2' | H | 4.5934 | 0.0000 | 1 |
21 | 1 | 3 | G | H3' | H | 4.5192 | 0.0000 | 1 |
22 | 1 | 3 | G | H8 | H | 7.5951 | 0.0000 | 1 |
23 | 1 | 3 | G | C1' | C | 92.9157 | 0.0000 | 1 |
24 | 1 | 3 | G | C8 | C | 136.1983 | 0.0000 | 1 |
25 | 1 | 3 | G | N1 | N | 147.7495 | 0.0000 | 1 |
26 | 1 | 4 | U | H1' | H | 5.4985 | 0.0000 | 1 |
27 | 1 | 4 | U | H2' | H | 4.4303 | 0.0000 | 1 |
28 | 1 | 4 | U | H3 | H | 14.2854 | 0.0000 | 1 |
29 | 1 | 4 | U | H3' | H | 4.0893 | 0.0000 | 1 |
30 | 1 | 4 | U | H4' | H | 3.9982 | 0.0000 | 1 |
31 | 1 | 4 | U | H5 | H | 5.2350 | 0.0000 | 1 |
32 | 1 | 4 | U | H6 | H | 7.5734 | 0.0000 | 1 |
33 | 1 | 4 | U | C1' | C | 93.4703 | 0.0000 | 1 |
34 | 1 | 4 | U | C5 | C | 103.2290 | 0.0000 | 1 |
35 | 1 | 4 | U | C6 | C | 140.9843 | 0.0000 | 1 |
36 | 1 | 4 | U | N3 | N | 162.9014 | 0.0000 | 1 |
37 | 1 | 5 | U | H1' | H | 5.4345 | 0.0000 | 1 |
38 | 1 | 5 | U | H2' | H | 4.4242 | 0.0000 | 1 |
39 | 1 | 5 | U | H3 | H | 10.1536 | 0.0000 | 1 |
40 | 1 | 5 | U | H3' | H | 4.2525 | 0.0000 | 1 |
41 | 1 | 5 | U | H4' | H | 4.0982 | 0.0000 | 1 |
42 | 1 | 5 | U | H5 | H | 5.5830 | 0.0000 | 1 |
43 | 1 | 5 | U | H6 | H | 7.7098 | 0.0000 | 1 |
44 | 1 | 5 | U | C1' | C | 94.6923 | 0.0000 | 1 |
45 | 1 | 5 | U | C5 | C | 104.1808 | 0.0000 | 1 |
46 | 1 | 5 | U | C6 | C | 141.9923 | 0.0000 | 1 |
47 | 1 | 5 | U | N3 | N | 156.3644 | 0.0000 | 1 |
48 | 1 | 6 | U | H1' | H | 5.6109 | 0.0000 | 1 |
49 | 1 | 6 | U | H2' | H | 4.5340 | 0.0000 | 1 |
50 | 1 | 6 | U | H3 | H | 13.8708 | 0.0000 | 1 |
51 | 1 | 6 | U | H3' | H | 4.2282 | 0.0000 | 1 |
52 | 1 | 6 | U | H4' | H | 4.2523 | 0.0000 | 1 |
53 | 1 | 6 | U | H5 | H | 5.7022 | 0.0000 | 1 |
54 | 1 | 6 | U | H6 | H | 8.0485 | 0.0000 | 1 |
55 | 1 | 6 | U | C1' | C | 92.4493 | 0.0000 | 1 |
56 | 1 | 6 | U | C5 | C | 103.6437 | 0.0000 | 1 |
57 | 1 | 6 | U | C6 | C | 142.6064 | 0.0000 | 1 |
58 | 1 | 6 | U | N3 | N | 162.3996 | 0.0000 | 1 |
59 | 1 | 7 | A | H1' | H | 5.9760 | 0.0000 | 1 |
60 | 1 | 7 | A | H2 | H | 7.1826 | 0.0000 | 1 |
61 | 1 | 7 | A | H2' | H | 4.5307 | 0.0000 | 1 |
62 | 1 | 7 | A | H8 | H | 8.2016 | 0.0000 | 1 |
63 | 1 | 7 | A | H61 | H | 6.4950 | 0.0000 | 2 |
64 | 1 | 7 | A | H62 | H | 7.6739 | 0.0000 | 2 |
65 | 1 | 7 | A | C1' | C | 92.7802 | 0.0000 | 1 |
66 | 1 | 7 | A | C2 | C | 153.4202 | 0.0000 | 1 |
67 | 1 | 7 | A | C8 | C | 140.4006 | 0.0000 | 1 |
68 | 1 | 8 | U | H1' | H | 5.4480 | 0.0000 | 1 |
69 | 1 | 8 | U | H2' | H | 4.4451 | 0.0000 | 1 |
70 | 1 | 8 | U | H3 | H | 13.2078 | 0.0000 | 1 |
71 | 1 | 8 | U | H3' | H | 4.1560 | 0.0000 | 1 |
72 | 1 | 8 | U | H5 | H | 5.0310 | 0.0000 | 1 |
73 | 1 | 8 | U | H6 | H | 7.6345 | 0.0000 | 1 |
74 | 1 | 8 | U | C1' | C | 93.1666 | 0.0000 | 1 |
75 | 1 | 8 | U | C5 | C | 102.9371 | 0.0000 | 1 |
76 | 1 | 8 | U | C6 | C | 141.4830 | 0.0000 | 1 |
77 | 1 | 8 | U | N3 | N | 161.5438 | 0.0000 | 1 |
78 | 1 | 9 | A | H1' | H | 5.9575 | 0.0000 | 1 |
79 | 1 | 9 | A | H2 | H | 7.0012 | 0.0000 | 1 |
80 | 1 | 9 | A | H2' | H | 4.4208 | 0.0000 | 1 |
81 | 1 | 9 | A | H3' | H | 4.5602 | 0.0000 | 1 |
82 | 1 | 9 | A | H8 | H | 8.0885 | 0.0000 | 1 |
83 | 1 | 9 | A | C1' | C | 92.7845 | 0.0000 | 1 |
84 | 1 | 9 | A | C2 | C | 153.1260 | 0.0000 | 1 |
85 | 1 | 9 | A | C8 | C | 139.7655 | 0.0000 | 1 |
86 | 1 | 10 | U | H1' | H | 5.3805 | 0.0000 | 1 |
87 | 1 | 10 | U | H2' | H | 4.2921 | 0.0000 | 1 |
88 | 1 | 10 | U | H3 | H | 13.1863 | 0.0000 | 1 |
89 | 1 | 10 | U | H5 | H | 5.0310 | 0.0000 | 1 |
90 | 1 | 10 | U | H6 | H | 7.5204 | 0.0000 | 1 |
91 | 1 | 10 | U | C1' | C | 93.0114 | 0.0000 | 1 |
92 | 1 | 10 | U | C5 | C | 102.9371 | 0.0000 | 1 |
93 | 1 | 10 | U | C6 | C | 141.0452 | 0.0000 | 1 |
94 | 1 | 10 | U | N3 | N | 161.5438 | 0.0000 | 1 |
95 | 1 | 11 | A | H1' | H | 5.8282 | 0.0000 | 1 |
96 | 1 | 11 | A | H2 | H | 6.7912 | 0.0000 | 1 |
97 | 1 | 11 | A | H2' | H | 4.4396 | 0.0000 | 1 |
98 | 1 | 11 | A | H8 | H | 7.9042 | 0.0000 | 1 |
99 | 1 | 11 | A | C1' | C | 92.2642 | 0.0000 | 1 |
100 | 1 | 11 | A | C2 | C | 153.0136 | 0.0000 | 1 |
101 | 1 | 11 | A | C8 | C | 139.6819 | 0.0000 | 1 |
102 | 1 | 12 | A | H1' | H | 5.6335 | 0.0000 | 1 |
103 | 1 | 12 | A | H2 | H | 7.7470 | 0.0000 | 1 |
104 | 1 | 12 | A | H2' | H | 4.4673 | 0.0000 | 1 |
105 | 1 | 12 | A | H3' | H | 4.2227 | 0.0000 | 1 |
106 | 1 | 12 | A | H8 | H | 7.7869 | 0.0000 | 1 |
107 | 1 | 12 | A | C1' | C | 90.9706 | 0.0000 | 1 |
108 | 1 | 12 | A | C2 | C | 154.8314 | 0.0000 | 1 |
109 | 1 | 12 | A | C8 | C | 139.6865 | 0.0000 | 1 |
110 | 1 | 13 | C | H1' | H | 5.4981 | 0.0000 | 1 |
111 | 1 | 13 | C | H2' | H | 4.1332 | 0.0000 | 1 |
112 | 1 | 13 | C | H3' | H | 4.4239 | 0.0000 | 1 |
113 | 1 | 13 | C | H5 | H | 5.4787 | 0.0000 | 1 |
114 | 1 | 13 | C | H6 | H | 7.4384 | 0.0000 | 1 |
115 | 1 | 13 | C | C1' | C | 92.3695 | 0.0000 | 1 |
116 | 1 | 13 | C | C5 | C | 98.1096 | 0.0000 | 1 |
117 | 1 | 13 | C | C6 | C | 141.6913 | 0.0000 | 1 |
118 | 1 | 14 | A | H1' | H | 5.8966 | 0.0000 | 1 |
119 | 1 | 14 | A | H2 | H | 7.9012 | 0.0000 | 1 |
120 | 1 | 14 | A | H2' | H | 4.5848 | 0.0000 | 1 |
121 | 1 | 14 | A | H3' | H | 4.6964 | 0.0000 | 1 |
122 | 1 | 14 | A | H4' | H | 4.3833 | 0.0000 | 1 |
123 | 1 | 14 | A | H8 | H | 8.1727 | 0.0000 | 1 |
124 | 1 | 14 | A | C1' | C | 90.1862 | 0.0000 | 1 |
125 | 1 | 14 | A | C2 | C | 155.0931 | 0.0000 | 1 |
126 | 1 | 14 | A | C8 | C | 141.8130 | 0.0000 | 1 |
127 | 1 | 15 | U | H1' | H | 5.6471 | 0.0000 | 1 |
128 | 1 | 15 | U | H2' | H | 4.1634 | 0.0000 | 1 |
129 | 1 | 15 | U | H3' | H | 3.9484 | 0.0000 | 1 |
130 | 1 | 15 | U | H4' | H | 4.4822 | 0.0000 | 1 |
131 | 1 | 15 | U | H5 | H | 5.5786 | 0.0000 | 1 |
132 | 1 | 15 | U | H6 | H | 7.5754 | 0.0000 | 1 |
133 | 1 | 15 | U | C1' | C | 89.8740 | 0.0000 | 1 |
134 | 1 | 15 | U | C5 | C | 105.0611 | 0.0000 | 1 |
135 | 1 | 15 | U | C6 | C | 143.2590 | 0.0000 | 1 |
136 | 1 | 16 | G | H1' | H | 5.5514 | 0.0000 | 1 |
137 | 1 | 16 | G | H2' | H | 4.3262 | 0.0000 | 1 |
138 | 1 | 16 | G | H3' | H | 4.1547 | 0.0000 | 1 |
139 | 1 | 16 | G | H4' | H | 3.9514 | 0.0000 | 1 |
140 | 1 | 16 | G | H8 | H | 7.7783 | 0.0000 | 1 |
141 | 1 | 16 | G | C1' | C | 89.5343 | 0.0000 | 1 |
142 | 1 | 16 | G | C8 | C | 139.4545 | 0.0000 | 1 |
143 | 1 | 17 | A | H1' | H | 5.8553 | 0.0000 | 1 |
144 | 1 | 17 | A | H2 | H | 7.8324 | 0.0000 | 1 |
145 | 1 | 17 | A | H2' | H | 4.4422 | 0.0000 | 1 |
146 | 1 | 17 | A | H3' | H | 4.1472 | 0.0000 | 1 |
147 | 1 | 17 | A | H8 | H | 8.1757 | 0.0000 | 1 |
148 | 1 | 17 | A | C1' | C | 90.3467 | 0.0000 | 1 |
149 | 1 | 17 | A | C2 | C | 154.7733 | 0.0000 | 1 |
150 | 1 | 17 | A | C8 | C | 141.8130 | 0.0000 | 1 |
151 | 1 | 18 | A | H1' | H | 5.7586 | 0.0000 | 1 |
152 | 1 | 18 | A | H2 | H | 7.7678 | 0.0000 | 1 |
153 | 1 | 18 | A | H2' | H | 4.6255 | 0.0000 | 1 |
154 | 1 | 18 | A | H3' | H | 4.4409 | 0.0000 | 1 |
155 | 1 | 18 | A | H8 | H | 8.0292 | 0.0000 | 1 |
156 | 1 | 18 | A | C1' | C | 90.8088 | 0.0000 | 1 |
157 | 1 | 18 | A | C2 | C | 154.7137 | 0.0000 | 1 |
158 | 1 | 18 | A | C8 | C | 140.7830 | 0.0000 | 1 |
159 | 1 | 19 | A | H1' | H | 5.8096 | 0.0000 | 1 |
160 | 1 | 19 | A | H2 | H | 7.9686 | 0.0000 | 1 |
161 | 1 | 19 | A | H2' | H | 4.5927 | 0.0000 | 1 |
162 | 1 | 19 | A | H3' | H | 4.5328 | 0.0000 | 1 |
163 | 1 | 19 | A | H8 | H | 8.0680 | 0.0000 | 1 |
164 | 1 | 19 | A | C1' | C | 90.5890 | 0.0000 | 1 |
165 | 1 | 19 | A | C2 | C | 155.0651 | 0.0000 | 1 |
166 | 1 | 19 | A | C8 | C | 140.7018 | 0.0000 | 1 |
167 | 1 | 20 | U | H1' | H | 5.5012 | 0.0000 | 1 |
168 | 1 | 20 | U | H2' | H | 4.5262 | 0.0000 | 1 |
169 | 1 | 20 | U | H5 | H | 5.6827 | 0.0000 | 1 |
170 | 1 | 20 | U | H6 | H | 7.7942 | 0.0000 | 1 |
171 | 1 | 20 | U | C1' | C | 92.8059 | 0.0000 | 1 |
172 | 1 | 20 | U | C5 | C | 104.1711 | 0.0000 | 1 |
173 | 1 | 20 | U | C6 | C | 142.3656 | 0.0000 | 1 |
174 | 1 | 21 | A | H1' | H | 5.9575 | 0.0000 | 1 |
175 | 1 | 21 | A | H2 | H | 7.0854 | 0.0000 | 1 |
176 | 1 | 21 | A | H2' | H | 4.4932 | 0.0000 | 1 |
177 | 1 | 21 | A | H3' | H | 4.1483 | 0.0000 | 1 |
178 | 1 | 21 | A | H8 | H | 8.2407 | 0.0000 | 1 |
179 | 1 | 21 | A | H61 | H | 6.5649 | 0.0000 | 2 |
180 | 1 | 21 | A | H62 | H | 7.4534 | 0.0000 | 2 |
181 | 1 | 21 | A | C1' | C | 92.7845 | 0.0000 | 1 |
182 | 1 | 21 | A | C2 | C | 153.0294 | 0.0000 | 1 |
183 | 1 | 21 | A | C8 | C | 140.4086 | 0.0000 | 1 |
184 | 1 | 22 | U | H1' | H | 5.3904 | 0.0000 | 1 |
185 | 1 | 22 | U | H2' | H | 4.4084 | 0.0000 | 1 |
186 | 1 | 22 | U | H3 | H | 13.1930 | 0.0000 | 1 |
187 | 1 | 22 | U | H5 | H | 5.0482 | 0.0000 | 1 |
188 | 1 | 22 | U | H6 | H | 7.5855 | 0.0000 | 1 |
189 | 1 | 22 | U | C1' | C | 93.0345 | 0.0000 | 1 |
190 | 1 | 22 | U | C6 | C | 141.2276 | 0.0000 | 1 |
191 | 1 | 22 | U | N3 | N | 161.5438 | 0.0000 | 1 |
192 | 1 | 23 | A | H1' | H | 5.9575 | 0.0000 | 1 |
193 | 1 | 23 | A | H2 | H | 6.9971 | 0.0000 | 1 |
194 | 1 | 23 | A | H8 | H | 8.0656 | 0.0000 | 1 |
195 | 1 | 23 | A | C1' | C | 92.7845 | 0.0000 | 1 |
196 | 1 | 23 | A | C2 | C | 153.1260 | 0.0000 | 1 |
197 | 1 | 23 | A | C8 | C | 139.7655 | 0.0000 | 1 |
198 | 1 | 24 | U | H1' | H | 5.3962 | 0.0000 | 1 |
199 | 1 | 24 | U | H2' | H | 4.4998 | 0.0000 | 1 |
200 | 1 | 24 | U | H3 | H | 12.9576 | 0.0000 | 1 |
201 | 1 | 24 | U | H3' | H | 4.1279 | 0.0000 | 1 |
202 | 1 | 24 | U | H5 | H | 5.0342 | 0.0000 | 1 |
203 | 1 | 24 | U | H6 | H | 7.5568 | 0.0000 | 1 |
204 | 1 | 24 | U | C1' | C | 93.0345 | 0.0000 | 1 |
205 | 1 | 24 | U | C6 | C | 141.1047 | 0.0000 | 1 |
206 | 1 | 24 | U | N3 | N | 160.8682 | 0.0000 | 1 |
207 | 1 | 25 | A | H1' | H | 5.9151 | 0.0000 | 1 |
208 | 1 | 25 | A | H2 | H | 6.9431 | 0.0000 | 1 |
209 | 1 | 25 | A | H8 | H | 7.9469 | 0.0000 | 1 |
210 | 1 | 25 | A | H61 | H | 6.5209 | 0.0000 | 2 |
211 | 1 | 25 | A | H62 | H | 7.3941 | 0.0000 | 2 |
212 | 1 | 25 | A | C1' | C | 92.7855 | 0.0000 | 1 |
213 | 1 | 25 | A | C2 | C | 152.6974 | 0.0000 | 1 |
214 | 1 | 25 | A | C8 | C | 139.4042 | 0.0000 | 1 |
215 | 1 | 26 | U | H1' | H | 5.1128 | 0.0000 | 1 |
216 | 1 | 26 | U | H2' | H | 3.9047 | 0.0000 | 1 |
217 | 1 | 26 | U | H3 | H | 10.4732 | 0.0000 | 1 |
218 | 1 | 26 | U | H3' | H | 4.3882 | 0.0000 | 1 |
219 | 1 | 26 | U | H4' | H | 4.0476 | 0.0000 | 1 |
220 | 1 | 26 | U | H5 | H | 5.0520 | 0.0000 | 1 |
221 | 1 | 26 | U | H6 | H | 7.2230 | 0.0000 | 1 |
222 | 1 | 26 | U | C1' | C | 93.8576 | 0.0000 | 1 |
223 | 1 | 26 | U | C5 | C | 103.7237 | 0.0000 | 1 |
224 | 1 | 26 | U | C6 | C | 140.3380 | 0.0000 | 1 |
225 | 1 | 26 | U | N3 | N | 157.1693 | 0.0000 | 1 |
226 | 1 | 27 | A | H1' | H | 5.9047 | 0.0000 | 1 |
227 | 1 | 27 | A | H2 | H | 7.8025 | 0.0000 | 1 |
228 | 1 | 27 | A | H2' | H | 4.1669 | 0.0000 | 1 |
229 | 1 | 27 | A | H3' | H | 3.9171 | 0.0000 | 1 |
230 | 1 | 27 | A | H4' | H | 4.0553 | 0.0000 | 1 |
231 | 1 | 27 | A | H8 | H | 8.2057 | 0.0000 | 1 |
232 | 1 | 27 | A | H61 | H | 6.5176 | 0.0000 | 2 |
233 | 1 | 27 | A | C1' | C | 90.0664 | 0.0000 | 1 |
234 | 1 | 27 | A | C2 | C | 153.8788 | 0.0000 | 1 |
235 | 1 | 27 | A | C8 | C | 140.3350 | 0.0000 | 1 |
236 | 1 | 28 | C | H1' | H | 5.4584 | 0.0000 | 1 |
237 | 1 | 28 | C | H2' | H | 4.4080 | 0.0000 | 1 |
238 | 1 | 28 | C | H3' | H | 4.2005 | 0.0000 | 1 |
239 | 1 | 28 | C | H4' | H | 4.6008 | 0.0000 | 1 |
240 | 1 | 28 | C | H5 | H | 5.1257 | 0.0000 | 1 |
241 | 1 | 28 | C | H6 | H | 7.4366 | 0.0000 | 1 |
242 | 1 | 28 | C | H41 | H | 6.7523 | 0.0000 | 2 |
243 | 1 | 28 | C | H42 | H | 8.3030 | 0.0000 | 2 |
244 | 1 | 28 | C | C1' | C | 94.0658 | 0.0000 | 1 |
245 | 1 | 28 | C | C5 | C | 97.8191 | 0.0000 | 1 |
246 | 1 | 28 | C | C6 | C | 141.3363 | 0.0000 | 1 |
247 | 1 | 29 | G | H1 | H | 13.0923 | 0.0000 | 1 |
248 | 1 | 29 | G | H1' | H | 5.7611 | 0.0000 | 1 |
249 | 1 | 29 | G | H2' | H | 3.9724 | 0.0000 | 1 |
250 | 1 | 29 | G | H3' | H | 4.1531 | 0.0000 | 1 |
251 | 1 | 29 | G | H4' | H | 4.4009 | 0.0000 | 1 |
252 | 1 | 29 | G | H8 | H | 7.5812 | 0.0000 | 1 |
253 | 1 | 29 | G | C1' | C | 92.8222 | 0.0000 | 1 |
254 | 1 | 29 | G | C8 | C | 136.1983 | 0.0000 | 1 |
255 | 1 | 29 | G | N1 | N | 147.3699 | 0.0000 | 1 |
256 | 1 | 30 | C | H1' | H | 5.2550 | 0.0000 | 1 |
257 | 1 | 30 | C | H2' | H | 4.1519 | 0.0000 | 1 |
258 | 1 | 30 | C | H3' | H | 4.3979 | 0.0000 | 1 |
259 | 1 | 30 | C | H4' | H | 3.9735 | 0.0000 | 1 |
260 | 1 | 30 | C | H5 | H | 5.2752 | 0.0000 | 1 |
261 | 1 | 30 | C | H6 | H | 7.5173 | 0.0000 | 1 |
262 | 1 | 30 | C | H41 | H | 6.9647 | 0.0000 | 2 |
263 | 1 | 30 | C | H42 | H | 8.3589 | 0.0000 | 2 |
264 | 1 | 30 | C | C5 | C | 97.7097 | 0.0000 | 1 |
265 | 1 | 30 | C | C6 | C | 141.3892 | 0.0000 | 1 |