1qa6: virtual backbone torsions, dot-bracket notation, sugar puckers, glycosidic bond, suiteness calculated using X3DNA-DSSR
| # | dbn | Residue | PTPoutlier | puckering | sugar class | Glyco | Eta | Theta | Eta' | Theta' | Eta" | Theta" | Suiteness |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | ( | 1..C.G.101. | C3'-endo | ~C3'-endo | anti | 231.45 | 229.474 | 271.95 | 0 | ||||
| 2 | ( | 1..C.C.102. | C3'-endo | ~C3'-endo | anti | 152.146 | 208.945 | 174.717 | 210.412 | 246.048 | 232.839 | 0.427 | |
| 3 | ( | 1..C.C.103. | C3'-endo | ~C3'-endo | anti | 169.967 | 215.231 | 176.188 | 218.794 | 209.423 | 236.944 | 0.563 | |
| 4 | ( | 1..C.A.104. | C3'-endo | ~C3'-endo | anti | 169.441 | 218.545 | 183.714 | 212.173 | 217.295 | 231.702 | 0.01 | |
| 5 | ( | 1..C.G.105. | C2'-exo | ~C3'-endo | anti | 173.114 | 228.031 | 181.002 | 234.524 | 217.624 | 291.28 | 0.064 | |
| 6 | . | 1..C.G.106. | C3'-endo | ~C3'-endo | anti | 158.362 | 61.694 | 187.927 | 66.775 | 264.514 | 90.2 | 0 | |
| 7 | ( | 1..C.A.107. | C4'-exo | ~C3'-endo | anti | 168.647 | 220.77 | 193.205 | 217.258 | 197.453 | 236.025 | 0 | |
| 8 | ( | 1..C.U.108. | C3'-endo | ~C3'-endo | anti | 159.289 | 205.96 | 173.355 | 213.195 | 210.741 | 230.907 | 0.405 | |
| 9 | ( | 1..C.G.109. | C3'-endo | ~C3'-endo | anti | 173.509 | 328.346 | 184.8 | 286.915 | 207.681 | 233.262 | 0.727 | |
| 10 | . | 1..C.U.110. | C3'-exo | ~C2'-endo | anti | 68.766 | 169.658 | 132.665 | 112.803 | 106.484 | 100.835 | 0.496 | |
| 11 | . | 1..C.A.111. | *** | C2'-endo | ~C2'-endo | anti | 23.324 | 341.408 | 27.383 | 269.209 | 19.578 | 196.81 | 0.023 |
| 12 | ( | 1..C.G.112. | C3'-endo | ~C3'-endo | anti | 268.879 | 230.762 | 343.233 | 228.119 | 64.575 | 256.885 | 0.069 | |
| 13 | ( | 1..C.G.113. | C3'-endo | ~C3'-endo | anti | 166.964 | 228.089 | 182.493 | 231.093 | 228.141 | 268.487 | 0 | |
| 14 | ( | 1..C.C.114. | C3'-endo | ~C3'-endo | anti | 167.68 | 220.273 | 189.868 | 225.183 | 246.328 | 272.495 | 0.524 | |
| 15 | . | 1..C.U.115. | C3'-endo | ~C3'-endo | anti | 166.505 | 237.508 | 193.283 | 230.236 | 260.56 | 281.734 | 0.804 | |
| 16 | . | 1..C.U.116. | C3'-endo | ~C3'-endo | anti | 159.5 | 246.702 | 180.694 | 203.152 | 253.351 | 151.162 | 0 | |
| 17 | . | 1..C.A.117. | C4'-exo | ~C3'-endo | anti | 21.545 | 236.999 | 49.398 | 236.277 | 27.196 | 295.166 | 0.179 | |
| 18 | . | 1..C.G.118. | C3'-endo | ~C3'-endo | anti | 163.312 | 243.268 | 183.068 | 250.75 | 257.574 | 211.068 | 0.332 | |
| 19 | . | 1..C.A.119. | C2'-endo | ~C2'-endo | anti | 160.971 | 108.619 | 200.513 | 62.507 | 165.459 | 46.083 | 0 | |
| 20 | . | 1..C.A.120. | *** | C1'-exo | ~C2'-endo | anti | 150.294 | 356.244 | 128.621 | 341.952 | 107.95 | 250.017 | 0 |
| 21 | . | 1..C.G.121. | C3'-endo | ~C3'-endo | anti | 323.962 | 243.037 | 356.602 | 240.035 | 102.919 | 276.055 | 0 | |
| 22 | . | 1..C.C.122. | C3'-endo | ~C3'-endo | anti | 158.944 | 139.553 | 179.006 | 132.88 | 234.85 | 295.325 | 0 | |
| 23 | . | 1..C.A.123. | C3'-endo | ~C3'-endo | anti | 334.01 | 243.614 | 336.177 | 243.772 | 183.309 | 289.842 | 0.017 | |
| 24 | ) | 1..C.G.124. | C3'-endo | ~C3'-endo | anti | 146.355 | 211.103 | 183.348 | 211.08 | 258.573 | 243.121 | 0 | |
| 25 | ) | 1..C.C.125. | C3'-endo | ~C3'-endo | anti | 175.816 | 231.149 | 182.472 | 219.322 | 223.855 | 237.336 | 0 | |
| 26 | ) | 1..C.C.126. | C3'-endo | ~C3'-endo | anti | 166.951 | 228.393 | 176.113 | 224.783 | 214.888 | 248.53 | 0.502 | |
| 27 | . | 1..C.A.127. | C3'-endo | ~C3'-endo | anti | 171.706 | 204.857 | 189.225 | 217.829 | 229.471 | 268.443 | 0 | |
| 28 | . | 1..C.U.128. | C3'-endo | ~C3'-endo | anti | 177.249 | 121.934 | 203.548 | 111.844 | 266.808 | 119.054 | 0.55 | |
| 29 | ) | 1..C.C.129. | C3'-endo | ~C3'-endo | anti | 160.146 | 200.628 | 155.287 | 205.37 | 159.995 | 233.123 | 0.612 | |
| 30 | ) | 1..C.A.130. | C3'-endo | ~C3'-endo | anti | 162.657 | 208.891 | 184.248 | 209.899 | 227.887 | 243.05 | 0.451 | |
| 31 | ) | 1..C.U.131. | C3'-endo | ~C3'-endo | anti | 185.328 | 227.13 | 201.115 | 223.388 | 246.765 | 250 | 0 | |
| 32 | . | 1..C.U.132. | C4'-exo | ~C3'-endo | anti | 146.902 | 244.973 | 166.903 | 232.813 | 211.514 | 274.506 | 0.423 | |
| 33 | . | 1..C.U.133. | C2'-exo | ~C3'-endo | anti | 171.509 | 200.219 | 188.43 | 168.023 | 255.996 | 114.368 | 0.528 | |
| 34 | . | 1..C.A.134. | C3'-endo | ~C3'-endo | anti | 40.144 | 232.34 | 58.458 | 232.972 | 25.516 | 273.837 | 0.15 | |
| 35 | . | 1..C.A.135. | C3'-endo | ~C3'-endo | anti | 171.052 | 211.819 | 188.965 | 210.777 | 242.644 | 271.887 | 0.381 | |
| 36 | . | 1..C.A.136. | C3'-endo | ~C3'-endo | syn | 153.363 | 98.421 | 167.288 | 111.057 | 246.683 | 88.842 | 0.204 | |
| 37 | ( | 1..C.G.137. | C3'-endo | ~C3'-endo | anti | 195.472 | 259.2 | 180.437 | 249.755 | 166.099 | 252.533 | 0.319 | |
| 38 | . | 1..C.A.138. | *** | C3'-exo | ~C2'-endo | syn | 317.67 | 25.371 | 331.187 | 55.535 | 330.278 | 68.052 | 0 |
| 39 | . | 1..C.A.139. | C2'-endo | ~C2'-endo | anti | 218.609 | 220.474 | 218.602 | 195.661 | 217.635 | 202.73 | 0.01 | |
| 40 | ( | 1..C.A.140. | C3'-endo | ~C3'-endo | anti | 100.564 | 231.613 | 119.751 | 215.305 | 145.819 | 220.171 | 0 | |
| 41 | ( | 1..C.G.141. | C2'-exo | ~C3'-endo | anti | 160.918 | 199.943 | 171.374 | 201.864 | 200.178 | 215.211 | 0.09 | |
| 42 | ( | 1..C.C.142. | C3'-endo | ~C3'-endo | anti | 168.848 | 228.631 | 181.814 | 232.831 | 207.251 | 278.797 | 0.171 | |
| 43 | . | 1..C.G.143. | C3'-endo | ~C3'-endo | anti | 168.387 | 213.819 | 190.92 | 215.202 | 259.746 | 224.842 | 0.442 | |
| 44 | . | 1..C.U.144. | C3'-endo | ~C3'-endo | anti | 170.099 | 230.66 | 175.297 | 194.731 | 192.977 | 141.344 | 0.591 | |
| 45 | . | 1..C.A.145. | C3'-endo | ~C3'-endo | anti | 38.809 | 226.068 | 55.76 | 223.888 | 23.067 | 278.508 | 0 | |
| 46 | . | 1..C.A.146. | C3'-endo | ~C3'-endo | anti | 148.316 | 257.715 | 168.495 | 241.27 | 243.485 | 234.956 | 0.291 | |
| 47 | . | 1..C.U.147. | C3'-endo | ~C3'-endo | anti | 161.366 | 204.623 | 177.74 | 222.761 | 195.874 | 274.658 | 0.18 | |
| 48 | . | 1..C.A.148. | C3'-endo | ~C3'-endo | anti | 168.689 | 244.172 | 203.678 | 240.468 | 279.834 | 284.977 | 0.401 | |
| 49 | ) | 1..C.G.149. | C3'-endo | ~C3'-endo | anti | 160.947 | 217.803 | 184.812 | 220.088 | 256.726 | 242.753 | 0 | |
| 50 | ) | 1..C.C.150. | C3'-endo | ~C3'-endo | anti | 168.518 | 214.527 | 188.219 | 215.387 | 229.418 | 241.229 | 0.339 | |
| 51 | ) | 1..C.U.151. | C3'-endo | ~C3'-endo | anti | 164.724 | 210.878 | 178.512 | 209.842 | 215.735 | 244.214 | 0.164 | |
| 52 | ) | 1..C.C.152. | C3'-endo | ~C3'-endo | anti | 173.822 | 213.09 | 188.735 | 219.035 | 240.532 | 252.29 | 0.655 | |
| 53 | . | 1..C.A.153. | C3'-endo | ~C3'-endo | anti | 175.351 | 267.278 | 194.251 | 258.303 | 242.779 | 311.87 | 0 | |
| 54 | ) | 1..C.C.154. | C2'-exo | ~C3'-endo | anti | 131.751 | 210.729 | 170.182 | 208.452 | 253.807 | 229.857 | 0 | |
| 55 | ) | 1..C.U.155. | C3'-endo | ~C3'-endo | anti | 174.824 | 210.636 | 180.587 | 210.125 | 213.471 | 216.987 | 0.338 | |
| 56 | ) | 1..C.G.156. | C3'-endo | ~C3'-endo | anti | 171.164 | 214.651 | 180.825 | 217.595 | 200.697 | 252.585 | 0.38 | |
| 57 | ) | 1..C.G.157. | C3'-endo | ~C3'-endo | anti | 174.855 | 215.955 | 190.143 | 220.286 | 238.3 | 273.012 | 0.551 | |
| 58 | ) | 1..C.U.158. | C3'-endo | ~C3'-endo | anti | 0.322 | |||||||
| 59 | ( | 1..D.G.101. | C3'-endo | ~C3'-endo | anti | 231.447 | 229.477 | 271.957 | 0 | ||||
| 60 | ( | 1..D.C.102. | C3'-endo | ~C3'-endo | anti | 152.142 | 208.951 | 174.717 | 210.422 | 246.051 | 232.83 | 0.426 | |
| 61 | ( | 1..D.C.103. | C3'-endo | ~C3'-endo | anti | 169.974 | 215.231 | 176.195 | 218.787 | 209.41 | 236.938 | 0.562 | |
| 62 | ( | 1..D.A.104. | C3'-endo | ~C3'-endo | anti | 169.446 | 218.545 | 183.711 | 212.185 | 217.295 | 231.71 | 0.01 | |
| 63 | ( | 1..D.G.105. | C2'-exo | ~C3'-endo | anti | 173.091 | 228.025 | 181 | 234.507 | 217.618 | 291.273 | 0.065 | |
| 64 | . | 1..D.G.106. | C3'-endo | ~C3'-endo | anti | 158.377 | 61.692 | 187.926 | 66.777 | 264.514 | 90.198 | 0 | |
| 65 | ( | 1..D.A.107. | C4'-exo | ~C3'-endo | anti | 168.655 | 220.77 | 193.209 | 217.263 | 197.455 | 236.023 | 0 | |
| 66 | ( | 1..D.U.108. | C3'-endo | ~C3'-endo | anti | 159.292 | 205.964 | 173.363 | 213.196 | 210.746 | 230.916 | 0.406 | |
| 67 | ( | 1..D.G.109. | C3'-endo | ~C3'-endo | anti | 173.498 | 328.348 | 184.78 | 286.911 | 207.671 | 233.248 | 0.728 | |
| 68 | . | 1..D.U.110. | C3'-exo | ~C2'-endo | anti | 68.781 | 169.627 | 132.654 | 112.799 | 106.472 | 100.826 | 0.496 | |
| 69 | . | 1..D.A.111. | *** | C2'-endo | ~C2'-endo | anti | 23.324 | 341.398 | 27.385 | 269.209 | 19.579 | 196.805 | 0.023 |
| 70 | ( | 1..D.G.112. | C3'-endo | ~C3'-endo | anti | 268.89 | 230.761 | 343.229 | 228.127 | 64.578 | 256.885 | 0.07 | |
| 71 | ( | 1..D.G.113. | C3'-endo | ~C3'-endo | anti | 166.954 | 228.088 | 182.494 | 231.092 | 228.135 | 268.479 | 0 | |
| 72 | ( | 1..D.C.114. | C3'-endo | ~C3'-endo | anti | 167.689 | 220.272 | 189.882 | 225.177 | 246.329 | 272.499 | 0.524 | |
| 73 | . | 1..D.U.115. | C3'-endo | ~C3'-endo | anti | 166.49 | 237.497 | 193.267 | 230.235 | 260.555 | 281.717 | 0.804 | |
| 74 | . | 1..D.U.116. | C3'-endo | ~C3'-endo | anti | 159.509 | 246.719 | 180.703 | 203.153 | 253.346 | 151.165 | 0 | |
| 75 | . | 1..D.A.117. | C4'-exo | ~C3'-endo | anti | 21.534 | 237 | 49.396 | 236.279 | 27.191 | 295.164 | 0.18 | |
| 76 | . | 1..D.G.118. | C3'-endo | ~C3'-endo | anti | 163.324 | 243.262 | 183.075 | 250.752 | 257.578 | 211.075 | 0.332 | |
| 77 | . | 1..D.A.119. | C2'-endo | ~C2'-endo | anti | 160.971 | 108.635 | 200.507 | 62.514 | 165.459 | 46.081 | 0 | |
| 78 | . | 1..D.A.120. | *** | C1'-exo | ~C2'-endo | anti | 150.328 | 356.216 | 128.621 | 341.943 | 107.943 | 250.018 | 0 |
| 79 | . | 1..D.G.121. | C3'-endo | ~C3'-endo | anti | 323.96 | 243.05 | 356.608 | 240.033 | 102.911 | 276.051 | 0 | |
| 80 | . | 1..D.C.122. | C3'-endo | ~C3'-endo | anti | 158.955 | 139.579 | 179.009 | 132.895 | 234.848 | 295.32 | 0 | |
| 81 | . | 1..D.A.123. | C3'-endo | ~C3'-endo | anti | 333.963 | 243.635 | 336.161 | 243.778 | 183.314 | 289.84 | 0.017 | |
| 82 | ) | 1..D.G.124. | C3'-endo | ~C3'-endo | anti | 146.361 | 211.097 | 183.345 | 211.078 | 258.563 | 243.126 | 0 | |
| 83 | ) | 1..D.C.125. | C3'-endo | ~C3'-endo | anti | 175.814 | 231.154 | 182.482 | 219.328 | 223.875 | 237.335 | 0 | |
| 84 | ) | 1..D.C.126. | C3'-endo | ~C3'-endo | anti | 166.951 | 228.4 | 176.113 | 224.775 | 214.88 | 248.521 | 0.502 | |
| 85 | . | 1..D.A.127. | C3'-endo | ~C3'-endo | anti | 171.701 | 204.847 | 189.209 | 217.836 | 229.458 | 268.447 | 0 | |
| 86 | . | 1..D.U.128. | C3'-endo | ~C3'-endo | anti | 177.25 | 121.948 | 203.558 | 111.84 | 266.808 | 119.056 | 0.549 | |
| 87 | ) | 1..D.C.129. | C3'-endo | ~C3'-endo | anti | 160.162 | 200.612 | 155.282 | 205.368 | 160.002 | 233.119 | 0.612 | |
| 88 | ) | 1..D.A.130. | C3'-endo | ~C3'-endo | anti | 162.639 | 208.891 | 184.246 | 209.908 | 227.885 | 243.063 | 0.451 | |
| 89 | ) | 1..D.U.131. | C3'-endo | ~C3'-endo | anti | 185.326 | 227.135 | 201.118 | 223.383 | 246.775 | 249.982 | 0 | |
| 90 | . | 1..D.U.132. | C4'-exo | ~C3'-endo | anti | 146.914 | 244.966 | 166.905 | 232.81 | 211.498 | 274.51 | 0.422 | |
| 91 | . | 1..D.U.133. | C2'-exo | ~C3'-endo | anti | 171.494 | 200.22 | 188.421 | 168.027 | 255.994 | 114.367 | 0.527 | |
| 92 | . | 1..D.A.134. | C3'-endo | ~C3'-endo | anti | 40.159 | 232.344 | 58.465 | 232.966 | 25.516 | 273.835 | 0.15 | |
| 93 | . | 1..D.A.135. | C3'-endo | ~C3'-endo | anti | 171.05 | 211.813 | 188.964 | 210.779 | 242.651 | 271.892 | 0.38 | |
| 94 | . | 1..D.A.136. | C3'-endo | ~C3'-endo | syn | 153.349 | 98.417 | 167.279 | 111.052 | 246.679 | 88.834 | 0.204 | |
| 95 | ( | 1..D.G.137. | C3'-endo | ~C3'-endo | anti | 195.481 | 259.19 | 180.446 | 249.748 | 166.102 | 252.529 | 0.318 | |
| 96 | . | 1..D.A.138. | *** | C3'-exo | ~C2'-endo | syn | 317.686 | 25.374 | 331.191 | 55.531 | 330.283 | 68.046 | 0 |
| 97 | . | 1..D.A.139. | C2'-endo | ~C2'-endo | anti | 218.621 | 220.471 | 218.604 | 195.662 | 217.64 | 202.727 | 0.01 | |
| 98 | ( | 1..D.A.140. | C3'-endo | ~C3'-endo | anti | 100.551 | 231.613 | 119.742 | 215.307 | 145.814 | 220.172 | 0 | |
| 99 | ( | 1..D.G.141. | C2'-exo | ~C3'-endo | anti | 160.923 | 199.953 | 171.388 | 201.864 | 200.179 | 215.199 | 0.089 | |
| 100 | ( | 1..D.C.142. | C3'-endo | ~C3'-endo | anti | 168.841 | 228.624 | 181.807 | 232.834 | 207.24 | 278.796 | 0.17 | |
| 101 | . | 1..D.G.143. | C3'-endo | ~C3'-endo | anti | 168.371 | 213.815 | 190.917 | 215.193 | 259.739 | 224.835 | 0.439 | |
| 102 | . | 1..D.U.144. | C3'-endo | ~C3'-endo | anti | 170.112 | 230.666 | 175.305 | 194.736 | 192.979 | 141.349 | 0.59 | |
| 103 | . | 1..D.A.145. | C3'-endo | ~C3'-endo | anti | 38.809 | 226.076 | 55.764 | 223.887 | 23.073 | 278.514 | 0 | |
| 104 | . | 1..D.A.146. | C3'-endo | ~C3'-endo | anti | 148.324 | 257.712 | 168.492 | 241.278 | 243.49 | 234.951 | 0.291 | |
| 105 | . | 1..D.U.147. | C3'-endo | ~C3'-endo | anti | 161.363 | 204.615 | 177.748 | 222.757 | 195.867 | 274.66 | 0.18 | |
| 106 | . | 1..D.A.148. | C3'-endo | ~C3'-endo | anti | 168.687 | 244.159 | 203.672 | 240.469 | 279.832 | 284.97 | 0.4 | |
| 107 | ) | 1..D.G.149. | C3'-endo | ~C3'-endo | anti | 160.95 | 217.813 | 184.827 | 220.089 | 256.724 | 242.756 | 0 | |
| 108 | ) | 1..D.C.150. | C3'-endo | ~C3'-endo | anti | 168.522 | 214.54 | 188.219 | 215.393 | 229.42 | 241.237 | 0.34 | |
| 109 | ) | 1..D.U.151. | C3'-endo | ~C3'-endo | anti | 164.714 | 210.868 | 178.512 | 209.839 | 215.734 | 244.203 | 0.165 | |
| 110 | ) | 1..D.C.152. | C3'-endo | ~C3'-endo | anti | 173.816 | 213.085 | 188.732 | 219.032 | 240.525 | 252.295 | 0.656 | |
| 111 | . | 1..D.A.153. | C3'-endo | ~C3'-endo | anti | 175.361 | 267.289 | 194.26 | 258.309 | 242.788 | 311.873 | 0 | |
| 112 | ) | 1..D.C.154. | C2'-exo | ~C3'-endo | anti | 131.733 | 210.737 | 170.189 | 208.453 | 253.81 | 229.859 | 0 | |
| 113 | ) | 1..D.U.155. | C3'-endo | ~C3'-endo | anti | 174.827 | 210.649 | 180.585 | 210.123 | 213.473 | 216.988 | 0.338 | |
| 114 | ) | 1..D.G.156. | C3'-endo | ~C3'-endo | anti | 171.174 | 214.644 | 180.818 | 217.596 | 200.689 | 252.58 | 0.378 | |
| 115 | ) | 1..D.G.157. | C3'-endo | ~C3'-endo | anti | 174.842 | 215.958 | 190.147 | 220.277 | 238.302 | 273.023 | 0.549 | |
| 116 | ) | 1..D.U.158. | C3'-endo | ~C3'-endo | anti | 0.319 |