data_1DAC ########### ## ENTRY ## ########### _entry.id 1DAC ############### ## ATOM_SITE ## ############### loop_ _atom_site.id _atom_site.label_atom_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.auth_seq_id _atom_site.cartn_x _atom_site.cartn_y _atom_site.cartn_z _atom_site.label_entity_id _atom_site.label_seq_id 1 H5T C5 A 1 1.480 14.509 -0.584 1 1 2 O5' C5 A 1 2.072 13.770 -0.742 1 1 3 C5' C5 A 1 1.853 13.175 -1.979 1 1 4 H5'1 C5 A 1 0.821 12.824 -1.995 1 1 5 H5'2 C5 A 1 2.040 13.801 -2.851 1 1 6 C4' C5 A 1 2.605 11.874 -2.226 1 1 7 H4' C5 A 1 2.224 11.434 -3.149 1 1 8 O4' C5 A 1 4.041 12.099 -2.268 1 1 9 C1' C5 A 1 4.649 10.807 -2.029 1 1 10 H1' C5 A 1 4.905 10.489 -3.040 1 1 11 N1 C5 A 1 5.925 10.657 -1.175 1 1 12 C6 C5 A 1 6.049 11.334 -0.026 1 1 13 H6 C5 A 1 5.299 12.067 0.231 1 1 14 C5 C5 A 1 7.062 11.133 0.831 1 1 15 H5 C5 A 1 7.247 11.708 1.726 1 1 16 C4 C5 A 1 7.979 10.147 0.444 1 1 17 N4 C5 A 1 8.989 9.862 1.210 1 1 18 H41 C5 A 1 9.586 9.174 0.772 1 1 19 H42 C5 A 1 9.210 10.298 2.094 1 1 20 N3 C5 A 1 7.937 9.522 -0.715 1 1 21 C2 C5 A 1 6.890 9.741 -1.589 1 1 22 O2 C5 A 1 6.822 9.092 -2.670 1 1 23 C3' C5 A 1 2.398 10.842 -1.180 1 1 24 H3' C5 A 1 2.429 11.255 -0.172 1 1 25 C2' C5 A 1 3.566 9.866 -1.517 1 1 26 H2'1 C5 A 1 3.899 9.481 -0.554 1 1 27 O2' C5 A 1 3.187 8.926 -2.476 1 1 28 HO'2 C5 A 1 2.610 8.324 -2.001 1 1 29 O3' C5 A 1 1.091 10.306 -1.259 1 1 30 P CYT A 2 0.626 9.120 -0.189 1 2 31 O1P CYT A 2 1.138 9.567 1.107 1 2 32 O2P CYT A 2 -0.838 9.022 -0.348 1 2 33 O5' CYT A 2 1.430 7.800 -0.674 1 2 34 C5' CYT A 2 0.635 6.661 -1.128 1 2 35 H5'1 CYT A 2 -0.055 6.379 -0.333 1 2 36 H5'2 CYT A 2 0.143 7.072 -2.009 1 2 37 C4' CYT A 2 1.452 5.411 -1.561 1 2 38 H4' CYT A 2 0.871 4.905 -2.331 1 2 39 O4' CYT A 2 2.742 5.730 -2.131 1 2 40 C1' CYT A 2 3.689 4.791 -1.678 1 2 41 H1' CYT A 2 4.299 4.419 -2.501 1 2 42 N1 CYT A 2 4.741 5.312 -0.693 1 2 43 C6 CYT A 2 4.463 6.357 0.140 1 2 44 H6 CYT A 2 3.574 6.945 -0.032 1 2 45 C5 CYT A 2 5.439 6.953 0.864 1 2 46 H5 CYT A 2 5.239 7.866 1.405 1 2 47 C4 CYT A 2 6.696 6.354 0.840 1 2 48 N4 CYT A 2 7.718 6.869 1.478 1 2 49 H41 CYT A 2 8.663 6.527 1.385 1 2 50 H42 CYT A 2 7.654 7.777 1.917 1 2 51 N3 CYT A 2 6.960 5.252 0.178 1 2 52 C2 CYT A 2 6.012 4.698 -0.578 1 2 53 O2 CYT A 2 6.195 3.619 -1.175 1 2 54 C3' CYT A 2 1.651 4.480 -0.399 1 2 55 H3' CYT A 2 2.096 5.011 0.443 1 2 56 C2' CYT A 2 2.843 3.687 -1.007 1 2 57 H2'1 CYT A 2 3.444 3.162 -0.265 1 2 58 O2' CYT A 2 2.400 2.754 -1.901 1 2 59 HO'2 CYT A 2 1.535 2.403 -1.680 1 2 60 O3' CYT A 2 0.577 3.596 -0.113 1 2 61 P ADE A 3 0.394 3.011 1.307 1 3 62 O1P ADE A 3 0.499 4.105 2.312 1 3 63 O2P ADE A 3 -0.890 2.232 1.340 1 3 64 O5' ADE A 3 1.686 2.087 1.543 1 3 65 C5' ADE A 3 1.710 0.828 0.894 1 3 66 H5'1 ADE A 3 0.947 0.219 1.379 1 3 67 H5'2 ADE A 3 1.421 0.924 -0.153 1 3 68 C4' ADE A 3 3.096 0.012 0.977 1 3 69 H4' ADE A 3 3.035 -0.792 0.243 1 3 70 O4' ADE A 3 4.150 0.855 0.535 1 3 71 C1' ADE A 3 5.303 0.624 1.342 1 3 72 H1' ADE A 3 6.137 0.453 0.661 1 3 73 N9 ADE A 3 5.675 1.870 2.029 1 3 74 C8 ADE A 3 4.922 2.925 2.375 1 3 75 H8 ADE A 3 3.897 2.990 2.042 1 3 76 N7 ADE A 3 5.554 3.850 2.905 1 3 77 C5 ADE A 3 6.879 3.318 3.007 1 3 78 C6 ADE A 3 8.089 3.828 3.522 1 3 79 N6 ADE A 3 8.313 5.084 3.881 1 3 80 H61 ADE A 3 9.281 5.297 4.077 1 3 81 H62 ADE A 3 7.565 5.724 3.657 1 3 82 N1 ADE A 3 9.178 3.088 3.412 1 3 83 C2 ADE A 3 9.138 1.920 2.836 1 3 84 H2 ADE A 3 10.086 1.402 2.835 1 3 85 N3 ADE A 3 8.063 1.324 2.346 1 3 86 C4 ADE A 3 6.914 2.054 2.462 1 3 87 C3' ADE A 3 3.514 -0.559 2.328 1 3 88 H3' ADE A 3 3.191 0.098 3.135 1 3 89 C2' ADE A 3 5.023 -0.585 2.216 1 3 90 H2'1 ADE A 3 5.514 -0.550 3.188 1 3 91 O2' ADE A 3 5.554 -1.653 1.513 1 3 92 HO'2 ADE A 3 5.394 -2.284 2.219 1 3 93 O3' ADE A 3 3.017 -1.865 2.513 1 3 94 P ADE A 4 2.663 -2.433 4.033 1 4 95 O1P ADE A 4 1.976 -1.259 4.692 1 4 96 O2P ADE A 4 2.023 -3.757 3.885 1 4 97 O5' ADE A 4 4.185 -2.685 4.719 1 4 98 C5' ADE A 4 5.074 -3.808 4.442 1 4 99 H5'1 ADE A 4 4.552 -4.678 4.842 1 4 100 H5'2 ADE A 4 5.182 -4.045 3.384 1 4 101 C4' ADE A 4 6.371 -3.638 5.255 1 4 102 H4' ADE A 4 6.928 -4.569 5.148 1 4 103 O4' ADE A 4 7.298 -2.708 4.766 1 4 104 C1' ADE A 4 7.944 -2.025 5.898 1 4 105 H1' ADE A 4 9.017 -2.213 5.876 1 4 106 N9 ADE A 4 7.674 -0.593 6.021 1 4 107 C8 ADE A 4 6.556 0.100 5.628 1 4 108 H8 ADE A 4 5.715 -0.510 5.335 1 4 109 N7 ADE A 4 6.763 1.404 5.648 1 4 110 C5 ADE A 4 7.990 1.566 6.332 1 4 111 C6 ADE A 4 8.752 2.638 6.830 1 4 112 N6 ADE A 4 8.397 3.924 6.840 1 4 113 H61 ADE A 4 9.019 4.547 7.336 1 4 114 H62 ADE A 4 7.463 4.211 6.584 1 4 115 N1 ADE A 4 9.884 2.332 7.429 1 4 116 C2 ADE A 4 10.365 1.064 7.549 1 4 117 H2 ADE A 4 11.356 0.902 7.945 1 4 118 N3 ADE A 4 9.717 -0.049 7.120 1 4 119 C4 ADE A 4 8.519 0.280 6.594 1 4 120 C3' ADE A 4 6.167 -3.406 6.732 1 4 121 H3' ADE A 4 5.333 -2.730 6.922 1 4 122 C2' ADE A 4 7.515 -2.739 7.108 1 4 123 H2'1 ADE A 4 7.384 -1.996 7.894 1 4 124 O2' ADE A 4 8.482 -3.703 7.458 1 4 125 HO'2 ADE A 4 9.030 -3.437 8.200 1 4 126 O3' ADE A 4 5.832 -4.630 7.313 1 4 127 P CYT A 5 4.749 -4.733 8.568 1 5 128 O1P CYT A 5 3.583 -3.839 8.295 1 5 129 O2P CYT A 5 4.452 -6.171 8.885 1 5 130 O5' CYT A 5 5.607 -4.023 9.740 1 5 131 C5' CYT A 5 6.717 -4.612 10.387 1 5 132 H5'1 CYT A 5 6.393 -5.417 11.047 1 5 133 H5'2 CYT A 5 7.408 -4.995 9.635 1 5 134 C4' CYT A 5 7.447 -3.592 11.243 1 5 135 H4' CYT A 5 8.207 -4.061 11.868 1 5 136 O4' CYT A 5 7.794 -2.484 10.375 1 5 137 C1' CYT A 5 8.047 -1.335 11.180 1 5 138 H1' CYT A 5 9.127 -1.308 11.326 1 5 139 N1 CYT A 5 7.592 -0.043 10.665 1 5 140 C6 CYT A 5 6.436 0.001 9.959 1 5 141 H6 CYT A 5 5.910 -0.895 9.664 1 5 142 C5 CYT A 5 5.877 1.164 9.698 1 5 143 H5 CYT A 5 4.947 1.103 9.154 1 5 144 C4 CYT A 5 6.539 2.367 9.990 1 5 145 N4 CYT A 5 6.033 3.489 9.590 1 5 146 H41 CYT A 5 6.421 4.284 10.077 1 5 147 H42 CYT A 5 5.153 3.579 9.103 1 5 148 N3 CYT A 5 7.702 2.363 10.642 1 5 149 C2 CYT A 5 8.267 1.190 11.005 1 5 150 O2 CYT A 5 9.265 1.141 11.740 1 5 151 C3' CYT A 5 6.483 -2.863 12.258 1 5 152 H3' CYT A 5 5.599 -2.534 11.712 1 5 153 C2' CYT A 5 7.316 -1.617 12.534 1 5 154 H2'1 CYT A 5 6.710 -0.771 12.860 1 5 155 O2' CYT A 5 8.263 -1.769 13.551 1 5 156 HO'2 CYT A 5 7.760 -2.018 14.330 1 5 157 O3' CYT A 5 6.125 -3.543 13.471 1 5 158 P GUA A 6 5.150 -2.815 14.583 1 6 159 O1P GUA A 6 4.271 -1.894 13.869 1 6 160 O2P GUA A 6 4.518 -3.855 15.502 1 6 161 O5' GUA A 6 6.306 -2.026 15.405 1 6 162 C5' GUA A 6 5.878 -1.122 16.368 1 6 163 H5'1 GUA A 6 5.066 -0.488 16.014 1 6 164 H5'2 GUA A 6 5.608 -1.705 17.249 1 6 165 C4' GUA A 6 7.000 -0.180 16.704 1 6 166 H4' GUA A 6 7.769 -0.785 17.185 1 6 167 O4' GUA A 6 7.448 0.432 15.490 1 6 168 C1' GUA A 6 7.902 1.725 15.717 1 6 169 H1' GUA A 6 8.917 1.884 15.351 1 6 170 N9 GUA A 6 7.100 2.662 14.858 1 6 171 C8 GUA A 6 6.118 2.397 13.902 1 6 172 H8 GUA A 6 5.803 1.392 13.660 1 6 173 N7 GUA A 6 5.487 3.445 13.464 1 6 174 C5 GUA A 6 6.097 4.551 14.088 1 6 175 C6 GUA A 6 6.078 6.002 13.878 1 6 176 O6 GUA A 6 5.393 6.638 13.060 1 6 177 N1 GUA A 6 7.041 6.677 14.579 1 6 178 H1 GUA A 6 7.020 7.643 14.287 1 6 179 C2 GUA A 6 7.955 6.052 15.366 1 6 180 N2 GUA A 6 8.840 6.804 15.966 1 6 181 H21 GUA A 6 8.725 7.779 15.728 1 6 182 H22 GUA A 6 9.501 6.421 16.626 1 6 183 N3 GUA A 6 8.079 4.774 15.553 1 6 184 C4 GUA A 6 7.104 4.054 14.903 1 6 185 C3' GUA A 6 6.599 0.951 17.646 1 6 186 H3' GUA A 6 5.612 1.299 17.342 1 6 187 C2' GUA A 6 7.709 1.899 17.212 1 6 188 H2'1 GUA A 6 7.531 2.964 17.361 1 6 189 O2' GUA A 6 8.970 1.565 17.786 1 6 190 HO'2 GUA A 6 8.835 1.769 18.714 1 6 191 O3' GUA A 6 6.678 0.503 19.021 1 6 192 P URA A 7 5.878 1.291 20.167 1 7 193 O1P URA A 7 4.430 1.379 19.804 1 7 194 O2P URA A 7 6.196 0.626 21.486 1 7 195 O5' URA A 7 6.585 2.742 20.062 1 7 196 C5' URA A 7 7.862 3.043 20.659 1 7 197 H5'1 URA A 7 7.889 2.785 21.718 1 7 198 H5'2 URA A 7 8.635 2.609 20.026 1 7 199 C4' URA A 7 8.119 4.564 20.770 1 7 200 H4' URA A 7 9.110 4.750 21.184 1 7 201 O4' URA A 7 7.991 5.094 19.483 1 7 202 C1' URA A 7 7.471 6.418 19.551 1 7 203 H1' URA A 7 8.261 7.096 19.227 1 7 204 N1 URA A 7 6.189 6.620 18.764 1 7 205 C6 URA A 7 5.485 5.540 18.232 1 7 206 H6 URA A 7 5.705 4.510 18.469 1 7 207 C5 URA A 7 4.435 5.809 17.408 1 7 208 H5 URA A 7 3.790 5.025 17.041 1 7 209 C4 URA A 7 4.065 7.129 17.022 1 7 210 O4 URA A 7 3.130 7.439 16.220 1 7 211 N3 URA A 7 4.875 8.136 17.552 1 7 212 H3 URA A 7 4.664 9.085 17.280 1 7 213 C2 URA A 7 5.928 7.952 18.337 1 7 214 O2 URA A 7 6.688 8.847 18.650 1 7 215 C3' URA A 7 7.111 5.282 21.672 1 7 216 H3' URA A 7 6.143 4.872 21.385 1 7 217 C2' URA A 7 7.194 6.686 21.072 1 7 218 H2'1 URA A 7 6.268 7.226 21.269 1 7 219 O2' URA A 7 8.302 7.464 21.623 1 7 220 HO'2 URA A 7 8.011 7.427 22.537 1 7 221 O3' URA A 7 7.412 5.260 23.107 1 7 222 P URA A 8 6.363 5.505 24.276 1 8 223 O1P URA A 8 5.168 4.681 24.059 1 8 224 O2P URA A 8 7.218 5.254 25.515 1 8 225 O5' URA A 8 5.986 7.109 24.232 1 8 226 C5' URA A 8 6.884 8.105 24.853 1 8 227 H5'1 URA A 8 6.831 8.100 25.942 1 8 228 H5'2 URA A 8 7.887 7.867 24.501 1 8 229 C4' URA A 8 6.600 9.525 24.346 1 8 230 H4' URA A 8 7.424 10.065 24.812 1 8 231 O4' URA A 8 6.720 9.753 22.932 1 8 232 C1' URA A 8 5.840 10.824 22.645 1 8 233 H1' URA A 8 6.406 11.651 22.217 1 8 234 N1 URA A 8 4.713 10.322 21.780 1 8 235 C6 URA A 8 4.164 9.064 21.731 1 8 236 H6 URA A 8 4.585 8.333 22.405 1 8 237 C5 URA A 8 3.218 8.736 20.818 1 8 238 H5 URA A 8 2.919 7.699 20.792 1 8 239 C4 URA A 8 2.585 9.705 19.937 1 8 240 O4 URA A 8 1.675 9.415 19.181 1 8 241 N3 URA A 8 3.010 10.973 20.072 1 8 242 H3 URA A 8 2.570 11.700 19.525 1 8 243 C2 URA A 8 4.102 11.313 20.902 1 8 244 O2 URA A 8 4.472 12.496 20.929 1 8 245 C3' URA A 8 5.307 10.101 24.835 1 8 246 H3' URA A 8 4.441 9.445 24.743 1 8 247 C2' URA A 8 5.245 11.333 23.961 1 8 248 H2'1 URA A 8 4.198 11.629 23.898 1 8 249 O2' URA A 8 6.094 12.369 24.281 1 8 250 HO'2 URA A 8 5.929 12.747 25.148 1 8 251 O3' URA A 8 5.302 10.586 26.221 1 8 252 P GUA A 9 3.987 10.538 27.131 1 9 253 O1P GUA A 9 3.087 9.391 26.748 1 9 254 O2P GUA A 9 4.462 10.712 28.533 1 9 255 O5' GUA A 9 3.175 11.890 26.674 1 9 256 C5' GUA A 9 3.656 13.183 27.035 1 9 257 H5'1 GUA A 9 3.739 13.373 28.105 1 9 258 H5'2 GUA A 9 4.686 13.315 26.704 1 9 259 C4' GUA A 9 2.899 14.390 26.467 1 9 260 H4' GUA A 9 3.437 15.210 26.943 1 9 261 O4' GUA A 9 3.162 14.442 25.073 1 9 262 C1' GUA A 9 1.917 14.814 24.457 1 9 263 H1' GUA A 9 2.006 15.647 23.760 1 9 264 N9 GUA A 9 1.331 13.773 23.569 1 9 265 C8 GUA A 9 1.394 12.408 23.698 1 9 266 H8 GUA A 9 1.985 11.892 24.439 1 9 267 N7 GUA A 9 0.797 11.712 22.744 1 9 268 C5 GUA A 9 0.028 12.719 22.051 1 9 269 C6 GUA A 9 -0.961 12.626 20.941 1 9 270 O6 GUA A 9 -1.454 11.619 20.393 1 9 271 N1 GUA A 9 -1.431 13.867 20.530 1 9 272 H1 GUA A 9 -2.207 13.908 19.886 1 9 273 C2 GUA A 9 -1.092 14.987 21.203 1 9 274 N2 GUA A 9 -1.858 16.050 20.973 1 9 275 H21 GUA A 9 -2.654 15.985 20.355 1 9 276 H22 GUA A 9 -1.712 16.863 21.555 1 9 277 N3 GUA A 9 -0.224 15.095 22.205 1 9 278 C4 GUA A 9 0.380 13.977 22.569 1 9 279 C3' GUA A 9 1.308 14.377 26.666 1 9 280 H3' GUA A 9 0.861 13.398 26.492 1 9 281 C2' GUA A 9 0.989 15.371 25.486 1 9 282 H2'1 GUA A 9 -0.036 15.459 25.128 1 9 283 O2' GUA A 9 1.371 16.752 25.830 1 9 284 HO'2 GUA A 9 1.918 16.654 26.613 1 9 285 O3' GUA A 9 1.060 14.992 27.926 1 9 286 P G3 A 10 -0.384 14.622 28.684 1 10 287 O1P G3 A 10 -0.564 13.191 28.877 1 10 288 O2P G3 A 10 -0.466 15.457 29.835 1 10 289 O5' G3 A 10 -1.454 15.130 27.645 1 10 290 C5' G3 A 10 -1.722 16.469 27.402 1 10 291 H5'1 G3 A 10 -2.096 16.836 28.358 1 10 292 H5'2 G3 A 10 -0.780 16.984 27.213 1 10 293 C4' G3 A 10 -2.639 16.859 26.284 1 10 294 H4' G3 A 10 -2.784 17.938 26.230 1 10 295 O4' G3 A 10 -2.303 16.334 24.970 1 10 296 C1' G3 A 10 -3.449 16.022 24.220 1 10 297 H1' G3 A 10 -3.535 16.699 23.370 1 10 298 N9 G3 A 10 -3.511 14.558 23.753 1 10 299 C8 G3 A 10 -2.685 13.590 24.260 1 10 300 H8 G3 A 10 -1.897 13.747 24.982 1 10 301 N7 G3 A 10 -2.797 12.468 23.581 1 10 302 C5 G3 A 10 -3.883 12.677 22.682 1 10 303 C6 G3 A 10 -4.567 11.807 21.799 1 10 304 O6 G3 A 10 -4.514 10.630 21.555 1 10 305 N1 G3 A 10 -5.459 12.456 20.963 1 10 306 H1 G3 A 10 -5.815 11.939 20.171 1 10 307 C2 G3 A 10 -5.836 13.765 21.155 1 10 308 N2 G3 A 10 -6.886 14.119 20.524 1 10 309 H21 G3 A 10 -7.443 13.560 19.893 1 10 310 H22 G3 A 10 -7.185 15.060 20.736 1 10 311 N3 G3 A 10 -5.332 14.610 22.038 1 10 312 C4 G3 A 10 -4.307 13.981 22.790 1 10 313 C3' G3 A 10 -4.008 16.228 26.553 1 10 314 H3' G3 A 10 -3.959 15.150 26.710 1 10 315 C2' G3 A 10 -4.650 16.370 25.148 1 10 316 H2'1 G3 A 10 -5.433 15.619 25.039 1 10 317 O2' G3 A 10 -5.114 17.722 24.914 1 10 318 HO'2 G3 A 10 -4.337 18.277 24.814 1 10 319 O3' G3 A 10 -4.719 16.903 27.543 1 10 320 H3T G3 A 10 -5.210 17.553 27.035 1 10 321 H5T C5 B 11 -9.984 8.576 13.477 2 1 322 O5' C5 B 11 -9.742 9.478 13.254 2 1 323 C5' C5 B 11 -10.799 10.294 13.665 2 1 324 H5'1 C5 B 11 -11.166 10.926 12.856 2 1 325 H5'2 C5 B 11 -11.676 9.711 13.948 2 1 326 C4' C5 B 11 -10.421 11.185 14.863 2 1 327 H4' C5 B 11 -11.294 11.800 15.079 2 1 328 O4' C5 B 11 -10.273 10.426 16.064 2 1 329 C1' C5 B 11 -9.436 11.250 16.906 2 1 330 H1' C5 B 11 -10.029 11.668 17.720 2 1 331 N1 C5 B 11 -8.331 10.421 17.519 2 1 332 C6 C5 B 11 -7.753 9.370 16.856 2 1 333 H6 C5 B 11 -8.277 8.937 16.017 2 1 334 C5 C5 B 11 -6.688 8.759 17.412 2 1 335 H5 C5 B 11 -6.208 7.910 16.949 2 1 336 C4 C5 B 11 -6.091 9.369 18.532 2 1 337 N4 C5 B 11 -5.047 8.865 19.161 2 1 338 H41 C5 B 11 -4.936 9.431 19.991 2 1 339 H42 C5 B 11 -4.513 8.037 18.943 2 1 340 N3 C5 B 11 -6.623 10.372 19.196 2 1 341 C2 C5 B 11 -7.719 10.873 18.671 2 1 342 O2 C5 B 11 -8.251 11.758 19.366 2 1 343 C3' C5 B 11 -9.236 12.010 14.659 2 1 344 H3' C5 B 11 -8.470 11.384 14.201 2 1 345 C2' C5 B 11 -8.825 12.403 16.081 2 1 346 H2'1 C5 B 11 -7.737 12.381 16.126 2 1 347 O2' C5 B 11 -9.416 13.634 16.462 2 1 348 HO'2 C5 B 11 -9.587 14.137 15.662 2 1 349 O3' C5 B 11 -9.578 13.274 13.914 2 1 350 P CYT B 12 -8.654 13.935 12.807 2 2 351 O1P CYT B 12 -7.862 12.898 12.130 2 2 352 O2P CYT B 12 -9.559 14.784 11.915 2 2 353 O5' CYT B 12 -7.698 14.805 13.744 2 2 354 C5' CYT B 12 -8.061 16.164 14.122 2 2 355 H5'1 CYT B 12 -8.095 16.797 13.235 2 2 356 H5'2 CYT B 12 -9.119 16.246 14.372 2 2 357 C4' CYT B 12 -7.087 16.935 15.066 2 2 358 H4' CYT B 12 -7.457 17.955 15.167 2 2 359 O4' CYT B 12 -7.032 16.205 16.348 2 2 360 C1' CYT B 12 -5.757 16.301 16.921 2 2 361 H1' CYT B 12 -5.860 16.782 17.894 2 2 362 N1 CYT B 12 -5.160 14.997 17.222 2 2 363 C6 CYT B 12 -5.156 14.013 16.287 2 2 364 H6 CYT B 12 -5.683 14.159 15.356 2 2 365 C5 CYT B 12 -4.504 12.793 16.495 2 2 366 H5 CYT B 12 -4.523 12.007 15.754 2 2 367 C4 CYT B 12 -3.833 12.678 17.685 2 2 368 N4 CYT B 12 -3.058 11.622 17.823 2 2 369 H41 CYT B 12 -2.367 11.644 18.558 2 2 370 H42 CYT B 12 -3.406 10.738 17.480 2 2 371 N3 CYT B 12 -3.694 13.674 18.547 2 2 372 C2 CYT B 12 -4.321 14.836 18.320 2 2 373 O2 CYT B 12 -4.072 15.777 19.116 2 2 374 C3' CYT B 12 -5.601 16.925 14.538 2 2 375 H3' CYT B 12 -5.298 15.946 14.169 2 2 376 C2' CYT B 12 -4.980 17.211 15.924 2 2 377 H2'1 CYT B 12 -3.933 16.959 16.092 2 2 378 O2' CYT B 12 -5.238 18.614 16.373 2 2 379 HO'2 CYT B 12 -5.302 19.085 15.539 2 2 380 O3' CYT B 12 -5.379 17.980 13.620 2 2 381 P ADE B 13 -4.251 17.922 12.501 2 3 382 O1P ADE B 13 -4.285 16.530 11.909 2 3 383 O2P ADE B 13 -4.516 19.098 11.619 2 3 384 O5' ADE B 13 -2.960 18.099 13.354 2 3 385 C5' ADE B 13 -2.556 19.288 13.995 2 3 386 H5'1 ADE B 13 -2.251 20.069 13.298 2 3 387 H5'2 ADE B 13 -3.406 19.837 14.401 2 3 388 C4' ADE B 13 -1.530 19.084 15.079 2 3 389 H4' ADE B 13 -1.301 20.057 15.513 2 3 390 O4' ADE B 13 -1.827 18.084 16.058 2 3 391 C1' ADE B 13 -0.655 17.598 16.674 2 3 392 H1' ADE B 13 -0.704 17.762 17.750 2 3 393 N9 ADE B 13 -0.657 16.155 16.456 2 3 394 C8 ADE B 13 -1.124 15.405 15.352 2 3 395 H8 ADE B 13 -1.739 15.802 14.559 2 3 396 N7 ADE B 13 -0.951 14.128 15.419 2 3 397 C5 ADE B 13 -0.191 13.993 16.631 2 3 398 C6 ADE B 13 0.390 12.902 17.341 2 3 399 N6 ADE B 13 0.262 11.636 17.020 2 3 400 H61 ADE B 13 0.720 10.964 17.620 2 3 401 H62 ADE B 13 -0.480 11.463 16.358 2 3 402 N1 ADE B 13 1.196 13.134 18.371 2 3 403 C2 ADE B 13 1.359 14.398 18.754 2 3 404 H2 ADE B 13 2.033 14.501 19.592 2 3 405 N3 ADE B 13 0.894 15.488 18.211 2 3 406 C4 ADE B 13 0.089 15.232 17.143 2 3 407 C3' ADE B 13 -0.102 18.628 14.665 2 3 408 H3' ADE B 13 -0.217 17.655 14.187 2 3 409 C2' ADE B 13 0.569 18.347 16.047 2 3 410 H2'1 ADE B 13 1.370 17.613 15.963 2 3 411 O2' ADE B 13 1.015 19.497 16.817 2 3 412 HO'2 ADE B 13 1.873 19.213 17.141 2 3 413 O3' ADE B 13 0.543 19.582 13.868 2 3 414 P ADE B 14 1.721 19.110 12.766 2 4 415 O1P ADE B 14 1.012 18.148 11.929 2 4 416 O2P ADE B 14 2.327 20.314 12.153 2 4 417 O5' ADE B 14 2.850 18.247 13.597 2 4 418 C5' ADE B 14 3.807 18.993 14.394 2 4 419 H5'1 ADE B 14 4.507 19.587 13.805 2 4 420 H5'2 ADE B 14 3.180 19.576 15.068 2 4 421 C4' ADE B 14 4.677 18.081 15.339 2 4 422 H4' ADE B 14 5.106 18.848 15.983 2 4 423 O4' ADE B 14 3.890 17.320 16.211 2 4 424 C1' ADE B 14 4.695 16.216 16.583 2 4 425 H1' ADE B 14 4.785 16.175 17.669 2 4 426 N9 ADE B 14 3.998 14.977 16.046 2 4 427 C8 ADE B 14 3.009 14.854 15.081 2 4 428 H8 ADE B 14 2.496 15.684 14.618 2 4 429 N7 ADE B 14 2.695 13.580 14.850 2 4 430 C5 ADE B 14 3.524 12.871 15.715 2 4 431 C6 ADE B 14 3.564 11.515 15.985 2 4 432 N6 ADE B 14 2.967 10.476 15.507 2 4 433 H61 ADE B 14 3.322 9.540 15.643 2 4 434 H62 ADE B 14 2.249 10.619 14.812 2 4 435 N1 ADE B 14 4.349 11.143 16.949 2 4 436 C2 ADE B 14 5.159 12.048 17.550 2 4 437 H2 ADE B 14 5.827 11.731 18.337 2 4 438 N3 ADE B 14 5.191 13.396 17.430 2 4 439 C4 ADE B 14 4.229 13.720 16.502 2 4 440 C3' ADE B 14 5.787 17.230 14.722 2 4 441 H3' ADE B 14 5.339 16.599 13.954 2 4 442 C2' ADE B 14 6.063 16.400 15.943 2 4 443 H2'1 ADE B 14 6.490 15.442 15.648 2 4 444 O2' ADE B 14 6.952 16.963 16.853 2 4 445 HO'2 ADE B 14 6.968 17.902 16.652 2 4 446 O3' ADE B 14 6.873 17.990 14.120 2 4 447 P CYT B 15 7.879 17.231 13.138 2 5 448 O1P CYT B 15 7.001 16.794 12.022 2 5 449 O2P CYT B 15 9.018 18.062 12.828 2 5 450 O5' CYT B 15 8.397 15.835 13.805 2 5 451 C5' CYT B 15 9.506 15.793 14.723 2 5 452 H5'1 CYT B 15 10.347 16.302 14.253 2 5 453 H5'2 CYT B 15 9.242 16.373 15.607 2 5 454 C4' CYT B 15 9.823 14.367 15.142 2 5 455 H4' CYT B 15 10.502 14.366 15.995 2 5 456 O4' CYT B 15 8.587 13.674 15.462 2 5 457 C1' CYT B 15 8.777 12.307 15.221 2 5 458 H1' CYT B 15 8.830 11.779 16.173 2 5 459 N1 CYT B 15 7.687 11.668 14.468 2 5 460 C6 CYT B 15 6.769 12.365 13.753 2 5 461 H6 CYT B 15 6.926 13.399 13.484 2 5 462 C5 CYT B 15 5.719 11.763 13.183 2 5 463 H5 CYT B 15 5.055 12.363 12.579 2 5 464 C4 CYT B 15 5.604 10.363 13.441 2 5 465 N4 CYT B 15 4.703 9.581 12.856 2 5 466 H41 CYT B 15 4.774 8.586 13.019 2 5 467 H42 CYT B 15 3.881 9.977 12.425 2 5 468 N3 CYT B 15 6.494 9.684 14.121 2 5 469 C2 CYT B 15 7.609 10.282 14.634 2 5 470 O2 CYT B 15 8.446 9.587 15.123 2 5 471 C3' CYT B 15 10.461 13.569 14.017 2 5 472 H3' CYT B 15 9.834 13.727 13.140 2 5 473 C2' CYT B 15 10.174 12.119 14.518 2 5 474 H2'1 CYT B 15 10.301 11.361 13.745 2 5 475 O2' CYT B 15 10.979 11.746 15.678 2 5 476 HO'2 CYT B 15 10.869 10.867 16.049 2 5 477 O3' CYT B 15 11.842 13.874 13.710 2 5 478 P GUA B 16 12.727 13.100 12.525 2 6 479 O1P GUA B 16 11.964 12.999 11.223 2 6 480 O2P GUA B 16 14.059 13.763 12.471 2 6 481 O5' GUA B 16 12.845 11.592 13.066 2 6 482 C5' GUA B 16 13.694 11.279 14.129 2 6 483 H5'1 GUA B 16 14.669 11.660 13.825 2 6 484 H5'2 GUA B 16 13.453 11.818 15.046 2 6 485 C4' GUA B 16 13.862 9.741 14.373 2 6 486 H4' GUA B 16 14.645 9.629 15.123 2 6 487 O4' GUA B 16 12.610 9.118 14.783 2 6 488 C1' GUA B 16 12.582 7.770 14.311 2 6 489 H1' GUA B 16 12.484 7.037 15.111 2 6 490 N9 GUA B 16 11.514 7.583 13.295 2 6 491 C8 GUA B 16 10.880 8.613 12.638 2 6 492 H8 GUA B 16 11.191 9.636 12.788 2 6 493 N7 GUA B 16 9.882 8.192 11.914 2 6 494 C5 GUA B 16 9.766 6.775 12.146 2 6 495 C6 GUA B 16 9.023 5.651 11.516 2 6 496 O6 GUA B 16 8.143 5.645 10.652 2 6 497 N1 GUA B 16 9.365 4.431 11.986 2 6 498 H1 GUA B 16 8.942 3.640 11.523 2 6 499 C2 GUA B 16 10.334 4.257 12.929 2 6 500 N2 GUA B 16 10.664 3.039 13.306 2 6 501 H21 GUA B 16 10.185 2.302 12.808 2 6 502 H22 GUA B 16 11.425 3.009 13.969 2 6 503 N3 GUA B 16 11.112 5.189 13.423 2 6 504 C4 GUA B 16 10.847 6.460 12.959 2 6 505 C3' GUA B 16 14.451 8.890 13.225 2 6 506 H3' GUA B 16 13.888 9.057 12.307 2 6 507 C2' GUA B 16 13.945 7.525 13.655 2 6 508 H2'1 GUA B 16 13.981 6.845 12.804 2 6 509 O2' GUA B 16 14.813 7.062 14.770 2 6 510 HO'2 GUA B 16 15.704 7.412 14.704 2 6 511 O3' GUA B 16 15.813 9.039 13.056 2 6 512 P URA B 17 16.549 9.227 11.671 2 7 513 O1P URA B 17 15.791 10.147 10.802 2 7 514 O2P URA B 17 17.944 9.533 11.993 2 7 515 O5' URA B 17 16.478 7.750 11.109 2 7 516 C5' URA B 17 17.087 6.650 11.822 2 7 517 H5'1 URA B 17 18.149 6.882 11.748 2 7 518 H5'2 URA B 17 16.769 6.689 12.864 2 7 519 C4' URA B 17 16.687 5.306 11.238 2 7 520 H4' URA B 17 17.161 4.482 11.772 2 7 521 O4' URA B 17 15.294 5.036 11.412 2 7 522 C1' URA B 17 14.743 4.234 10.373 2 7 523 H1' URA B 17 14.502 3.241 10.751 2 7 524 N1 URA B 17 13.472 4.779 9.811 2 7 525 C6 URA B 17 13.349 6.149 9.616 2 7 526 H6 URA B 17 14.180 6.819 9.778 2 7 527 C5 URA B 17 12.192 6.670 9.117 2 7 528 H5 URA B 17 12.096 7.741 9.007 2 7 529 C4 URA B 17 11.075 5.824 8.819 2 7 530 O4 URA B 17 10.053 6.213 8.282 2 7 531 N3 URA B 17 11.328 4.434 9.047 2 7 532 H3 URA B 17 10.786 3.716 8.589 2 7 533 C2 URA B 17 12.524 3.836 9.476 2 7 534 O2 URA B 17 12.742 2.618 9.440 2 7 535 C3' URA B 17 16.881 5.206 9.714 2 7 536 H3' URA B 17 16.461 6.106 9.264 2 7 537 C2' URA B 17 15.878 4.069 9.325 2 7 538 H2'1 URA B 17 15.517 4.206 8.306 2 7 539 O2' URA B 17 16.404 2.788 9.392 2 7 540 HO'2 URA B 17 16.259 2.352 8.549 2 7 541 O3' URA B 17 18.222 5.063 9.237 2 7 542 P URA B 18 18.669 5.422 7.727 2 8 543 O1P URA B 18 18.115 6.729 7.390 2 8 544 O2P URA B 18 20.152 5.236 7.580 2 8 545 O5' URA B 18 17.919 4.230 6.932 2 8 546 C5' URA B 18 18.460 2.875 6.907 2 8 547 H5'1 URA B 18 19.358 2.740 6.304 2 8 548 H5'2 URA B 18 18.619 2.432 7.890 2 8 549 C4' URA B 18 17.476 1.923 6.215 2 8 550 H4' URA B 18 17.897 0.929 6.366 2 8 551 O4' URA B 18 16.160 2.003 6.765 2 8 552 C1' URA B 18 15.158 1.543 5.804 2 8 553 H1' URA B 18 14.695 0.623 6.160 2 8 554 N1 URA B 18 14.150 2.563 5.596 2 8 555 C6 URA B 18 14.481 3.976 5.743 2 8 556 H6 URA B 18 15.509 4.270 5.892 2 8 557 C5 URA B 18 13.543 4.918 5.384 2 8 558 H5 URA B 18 13.850 5.951 5.455 2 8 559 C4 URA B 18 12.186 4.501 5.039 2 8 560 O4 URA B 18 11.186 5.191 4.825 2 8 561 N3 URA B 18 11.982 3.158 5.016 2 8 562 H3 URA B 18 11.103 2.806 4.665 2 8 563 C2 URA B 18 12.913 2.185 5.173 2 8 564 O2 URA B 18 12.650 1.087 4.937 2 8 565 C3' URA B 18 17.288 2.142 4.737 2 8 566 H3' URA B 18 16.988 3.175 4.562 2 8 567 C2' URA B 18 16.007 1.211 4.550 2 8 568 H2'1 URA B 18 15.403 1.340 3.652 2 8 569 O2' URA B 18 16.371 -0.142 4.639 2 8 570 HO'2 URA B 18 16.989 -0.365 3.939 2 8 571 O3' URA B 18 18.349 1.800 3.934 2 8 572 P GUA B 19 18.570 2.584 2.600 2 9 573 O1P GUA B 19 18.374 3.986 2.856 2 9 574 O2P GUA B 19 19.844 2.124 2.038 2 9 575 O5' GUA B 19 17.470 2.217 1.584 2 9 576 C5' GUA B 19 17.420 0.873 1.068 2 9 577 H5'1 GUA B 19 18.323 0.803 0.461 2 9 578 H5'2 GUA B 19 17.390 0.142 1.876 2 9 579 C4' GUA B 19 16.233 0.627 0.187 2 9 580 H4' GUA B 19 16.370 -0.349 -0.279 2 9 581 O4' GUA B 19 15.022 0.507 0.951 2 9 582 C1' GUA B 19 13.970 0.934 0.068 2 9 583 H1' GUA B 19 13.295 0.100 -0.123 2 9 584 N9 GUA B 19 13.250 2.105 0.586 2 9 585 C8 GUA B 19 13.835 3.095 1.308 2 9 586 H8 GUA B 19 14.879 3.188 1.570 2 9 587 N7 GUA B 19 13.036 4.091 1.562 2 9 588 C5 GUA B 19 11.836 3.720 0.907 2 9 589 C6 GUA B 19 10.545 4.431 0.867 2 9 590 O6 GUA B 19 10.211 5.503 1.338 2 9 591 N1 GUA B 19 9.596 3.672 0.221 2 9 592 H1 GUA B 19 8.701 4.113 0.065 2 9 593 C2 GUA B 19 9.830 2.429 -0.376 2 9 594 N2 GUA B 19 8.800 1.975 -1.043 2 9 595 H21 GUA B 19 7.957 2.528 -1.100 2 9 596 H22 GUA B 19 8.973 1.174 -1.633 2 9 597 N3 GUA B 19 11.031 1.759 -0.319 2 9 598 C4 GUA B 19 11.951 2.475 0.355 2 9 599 C3' GUA B 19 15.991 1.704 -0.931 2 9 600 H3' GUA B 19 15.980 2.710 -0.513 2 9 601 C2' GUA B 19 14.541 1.342 -1.307 2 9 602 H2'1 GUA B 19 13.990 2.208 -1.675 2 9 603 O2' GUA B 19 14.457 0.176 -2.117 2 9 604 HO'2 GUA B 19 14.312 0.431 -3.031 2 9 605 O3' GUA B 19 17.010 1.534 -1.917 2 9 606 P G3 B 20 17.340 2.643 -2.999 2 10 607 O1P G3 B 20 17.648 3.918 -2.245 2 10 608 O2P G3 B 20 18.286 2.120 -4.046 2 10 609 O5' G3 B 20 15.933 2.914 -3.687 2 10 610 C5' G3 B 20 15.483 2.176 -4.833 2 10 611 H5'1 G3 B 20 16.176 2.371 -5.652 2 10 612 H5'2 G3 B 20 15.506 1.128 -4.532 2 10 613 C4' G3 B 20 14.077 2.704 -5.243 2 10 614 H4' G3 B 20 13.589 2.062 -5.975 2 10 615 O4' G3 B 20 13.256 2.716 -4.076 2 10 616 C1' G3 B 20 12.332 3.701 -4.241 2 10 617 H1' G3 B 20 11.310 3.335 -4.343 2 10 618 N9 G3 B 20 12.450 4.632 -3.077 2 10 619 C8 G3 B 20 13.510 4.932 -2.317 2 10 620 H8 G3 B 20 14.477 4.466 -2.430 2 10 621 N7 G3 B 20 13.293 5.918 -1.425 2 10 622 C5 G3 B 20 11.979 6.298 -1.587 2 10 623 C6 G3 B 20 11.183 7.294 -1.003 2 10 624 O6 G3 B 20 11.511 8.165 -0.178 2 10 625 N1 G3 B 20 9.889 7.319 -1.501 2 10 626 H1 G3 B 20 9.229 7.933 -1.046 2 10 627 C2 G3 B 20 9.411 6.522 -2.514 2 10 628 N2 G3 B 20 8.239 6.833 -2.983 2 10 629 H21 G3 B 20 7.810 7.674 -2.623 2 10 630 H22 G3 B 20 8.024 6.408 -3.874 2 10 631 N3 G3 B 20 10.226 5.637 -3.174 2 10 632 C4 G3 B 20 11.468 5.495 -2.627 2 10 633 C3' G3 B 20 14.204 4.136 -5.715 2 10 634 H3' G3 B 20 14.811 4.707 -5.012 2 10 635 C2' G3 B 20 12.657 4.451 -5.563 2 10 636 H2'1 G3 B 20 12.575 5.537 -5.532 2 10 637 O2' G3 B 20 11.825 3.922 -6.602 2 10 638 HO'2 G3 B 20 12.316 3.674 -7.389 2 10 639 O3' G3 B 20 14.660 4.143 -7.113 2 10 640 H3T G3 B 20 14.493 5.019 -7.468 2 10